USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 910 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 17 THR OG1 : rot 180:sc= 0.0949 USER MOD Set 1.2: A 101 ASN : amide:sc= -1.56! C(o=-1.5!,f=-1.9!) USER MOD Set 2.1: A 76 SER OG : rot -137:sc= 1.22! USER MOD Set 2.2: A 78 TYR OH : rot 162:sc= 0.763 USER MOD Set 3.1: A 47 SER OG : rot -31:sc= 0.251 USER MOD Set 3.2: A 50 ASN : amide:sc= -0.299 K(o=-0.048,f=-0.9) USER MOD Set 4.1: A 3 GLN : amide:sc= 1.14 K(o=2.3,f=-2.3) USER MOD Set 4.2: A 4 THR OG1 : rot 54:sc= 1.18 USER MOD Single : A 1 SER N :NH3+ 160:sc= -0.843 (180deg=-1.62) USER MOD Single : A 1 SER OG : rot -166:sc= -5.6! USER MOD Single : A 5 TYR OH : rot 141:sc= 0.139 USER MOD Single : A 8 THR OG1 : rot 95:sc= 1.2 USER MOD Single : A 9 ASN : amide:sc= -1.47 K(o=-1.5,f=-8.1!) USER MOD Single : A 13 THR OG1 : rot -68:sc= 0.82 USER MOD Single : A 18 GLN : amide:sc= -0.184 K(o=-0.18,f=-1.5!) USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=-0.081) USER MOD Single : A 28 THR OG1 : rot -35:sc= -0.0399! USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -172:sc= 1.02 USER MOD Single : A 38 THR OG1 : rot 180:sc= 0.0191 USER MOD Single : A 41 GLN : amide:sc= -0.0556 K(o=-0.056,f=-2.2!) USER MOD Single : A 43 GLN : amide:sc= -0.894 K(o=-0.89,f=-0.19) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 ASN : amide:sc= -0.896 K(o=-0.9,f=-2.9!) USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 66 HIS : no HD1:sc= -1.87 X(o=-1.9,f=-2.1) USER MOD Single : A 67 TYR OH : rot 180:sc= -0.281 USER MOD Single : A 69 THR OG1 : rot 131:sc= -1.51! USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 SER OG : rot 89:sc= -0.547! USER MOD Single : A 88 THR OG1 : rot 180:sc= -0.331 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 THR OG1 : rot 120:sc= -0.522 USER MOD Single : A 92 SER OG : rot 121:sc= -0.194! USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 40:sc= -0.699 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= -0.82 K(o=-0.82,f=-3.9!) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0.03) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 GLN : amide:sc= -0.0393 K(o=-0.039,f=-2.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 8.183 0.124 -3.933 1.00 0.00 N ATOM 2 CA SER A 1 7.001 0.362 -3.059 1.00 0.00 C ATOM 3 C SER A 1 7.110 1.747 -2.426 1.00 0.00 C ATOM 4 O SER A 1 6.551 2.005 -1.377 1.00 0.00 O ATOM 5 CB SER A 1 6.959 -0.700 -1.958 1.00 0.00 C ATOM 6 OG SER A 1 7.699 -1.840 -2.380 1.00 0.00 O ATOM 0 H1 SER A 1 8.297 -0.897 -4.092 1.00 0.00 H new ATOM 0 H2 SER A 1 8.042 0.602 -4.846 1.00 0.00 H new ATOM 0 H3 SER A 1 9.036 0.501 -3.473 1.00 0.00 H new ATOM 0 HA SER A 1 6.090 0.304 -3.654 1.00 0.00 H new ATOM 0 HB2 SER A 1 7.378 -0.301 -1.035 1.00 0.00 H new ATOM 0 HB3 SER A 1 5.927 -0.980 -1.745 1.00 0.00 H new ATOM 0 HG SER A 1 7.497 -2.597 -1.791 1.00 0.00 H new ATOM 14 N TRP A 2 7.831 2.639 -3.055 1.00 0.00 N ATOM 15 CA TRP A 2 7.995 4.015 -2.500 1.00 0.00 C ATOM 16 C TRP A 2 8.413 4.964 -3.623 1.00 0.00 C ATOM 17 O TRP A 2 8.051 4.778 -4.767 1.00 0.00 O ATOM 18 CB TRP A 2 9.062 3.989 -1.406 1.00 0.00 C ATOM 19 CG TRP A 2 8.732 2.893 -0.444 1.00 0.00 C ATOM 20 CD1 TRP A 2 9.159 1.612 -0.545 1.00 0.00 C ATOM 21 CD2 TRP A 2 7.890 2.950 0.744 1.00 0.00 C ATOM 22 NE1 TRP A 2 8.641 0.883 0.510 1.00 0.00 N ATOM 23 CE2 TRP A 2 7.854 1.665 1.334 1.00 0.00 C ATOM 24 CE3 TRP A 2 7.168 3.984 1.364 1.00 0.00 C ATOM 25 CZ2 TRP A 2 7.126 1.413 2.495 1.00 0.00 C ATOM 26 CZ3 TRP A 2 6.433 3.735 2.534 1.00 0.00 C ATOM 27 CH2 TRP A 2 6.412 2.452 3.099 1.00 0.00 C ATOM 0 H TRP A 2 8.317 2.471 -3.936 1.00 0.00 H new ATOM 0 HA TRP A 2 7.054 4.362 -2.073 1.00 0.00 H new ATOM 0 HB2 TRP A 2 10.047 3.825 -1.842 1.00 0.00 H new ATOM 0 HB3 TRP A 2 9.097 4.948 -0.889 1.00 0.00 H new ATOM 0 HD1 TRP A 2 9.800 1.223 -1.323 1.00 0.00 H new ATOM 0 HE1 TRP A 2 8.818 -0.110 0.661 1.00 0.00 H new ATOM 0 HE3 TRP A 2 7.179 4.976 0.938 1.00 0.00 H new ATOM 0 HZ2 TRP A 2 7.113 0.422 2.925 1.00 0.00 H new ATOM 0 HZ3 TRP A 2 5.880 4.537 3.002 1.00 0.00 H new ATOM 0 HH2 TRP A 2 5.845 2.267 3.999 1.00 0.00 H new ATOM 38 N GLN A 3 9.166 5.981 -3.319 1.00 0.00 N ATOM 39 CA GLN A 3 9.587 6.927 -4.389 1.00 0.00 C ATOM 40 C GLN A 3 10.763 6.324 -5.166 1.00 0.00 C ATOM 41 O GLN A 3 10.583 5.675 -6.180 1.00 0.00 O ATOM 42 CB GLN A 3 10.001 8.261 -3.761 1.00 0.00 C ATOM 43 CG GLN A 3 10.409 9.241 -4.862 1.00 0.00 C ATOM 44 CD GLN A 3 11.822 9.760 -4.586 1.00 0.00 C ATOM 45 OE1 GLN A 3 12.745 9.461 -5.316 1.00 0.00 O ATOM 46 NE2 GLN A 3 12.029 10.532 -3.554 1.00 0.00 N ATOM 0 H GLN A 3 9.507 6.199 -2.383 1.00 0.00 H new ATOM 0 HA GLN A 3 8.757 7.100 -5.073 1.00 0.00 H new ATOM 0 HB2 GLN A 3 9.175 8.673 -3.181 1.00 0.00 H new ATOM 0 HB3 GLN A 3 10.831 8.108 -3.071 1.00 0.00 H new ATOM 0 HG2 GLN A 3 10.375 8.748 -5.833 1.00 0.00 H new ATOM 0 HG3 GLN A 3 9.706 10.073 -4.902 1.00 0.00 H new ATOM 0 HE21 GLN A 3 11.253 10.783 -2.941 1.00 0.00 H new ATOM 0 HE22 GLN A 3 12.966 10.884 -3.361 1.00 0.00 H new ATOM 55 N THR A 4 11.964 6.519 -4.697 1.00 0.00 N ATOM 56 CA THR A 4 13.139 5.945 -5.408 1.00 0.00 C ATOM 57 C THR A 4 13.042 4.420 -5.378 1.00 0.00 C ATOM 58 O THR A 4 13.379 3.744 -6.331 1.00 0.00 O ATOM 59 CB THR A 4 14.425 6.399 -4.707 1.00 0.00 C ATOM 60 OG1 THR A 4 14.699 7.748 -5.059 1.00 0.00 O ATOM 61 CG2 THR A 4 15.598 5.511 -5.131 1.00 0.00 C ATOM 0 H THR A 4 12.182 7.050 -3.854 1.00 0.00 H new ATOM 0 HA THR A 4 13.154 6.288 -6.443 1.00 0.00 H new ATOM 0 HB THR A 4 14.293 6.318 -3.628 1.00 0.00 H new ATOM 0 HG1 THR A 4 13.913 8.302 -4.868 1.00 0.00 H new ATOM 0 HG21 THR A 4 16.506 5.842 -4.627 1.00 0.00 H new ATOM 0 HG22 THR A 4 15.389 4.477 -4.858 1.00 0.00 H new ATOM 0 HG23 THR A 4 15.736 5.581 -6.210 1.00 0.00 H new ATOM 69 N TYR A 5 12.586 3.874 -4.286 1.00 0.00 N ATOM 70 CA TYR A 5 12.468 2.395 -4.181 1.00 0.00 C ATOM 71 C TYR A 5 11.597 1.862 -5.324 1.00 0.00 C ATOM 72 O TYR A 5 11.887 0.831 -5.899 1.00 0.00 O ATOM 73 CB TYR A 5 11.855 2.029 -2.828 1.00 0.00 C ATOM 74 CG TYR A 5 12.718 2.601 -1.722 1.00 0.00 C ATOM 75 CD1 TYR A 5 14.097 2.760 -1.920 1.00 0.00 C ATOM 76 CD2 TYR A 5 12.143 2.975 -0.498 1.00 0.00 C ATOM 77 CE1 TYR A 5 14.897 3.290 -0.901 1.00 0.00 C ATOM 78 CE2 TYR A 5 12.945 3.505 0.520 1.00 0.00 C ATOM 79 CZ TYR A 5 14.322 3.662 0.320 1.00 0.00 C ATOM 80 OH TYR A 5 15.111 4.182 1.326 1.00 0.00 O ATOM 0 H TYR A 5 12.289 4.391 -3.459 1.00 0.00 H new ATOM 0 HA TYR A 5 13.457 1.942 -4.257 1.00 0.00 H new ATOM 0 HB2 TYR A 5 10.841 2.423 -2.756 1.00 0.00 H new ATOM 0 HB3 TYR A 5 11.784 0.946 -2.728 1.00 0.00 H new ATOM 0 HD1 TYR A 5 14.543 2.473 -2.861 1.00 0.00 H new ATOM 0 HD2 TYR A 5 11.081 2.854 -0.341 1.00 0.00 H new ATOM 0 HE1 TYR A 5 15.959 3.412 -1.057 1.00 0.00 H new ATOM 0 HE2 TYR A 5 12.501 3.793 1.461 1.00 0.00 H new ATOM 0 HH TYR A 5 14.627 4.901 1.783 1.00 0.00 H new ATOM 90 N VAL A 6 10.544 2.553 -5.677 1.00 0.00 N ATOM 91 CA VAL A 6 9.691 2.067 -6.801 1.00 0.00 C ATOM 92 C VAL A 6 10.593 1.857 -8.028 1.00 0.00 C ATOM 93 O VAL A 6 10.503 0.862 -8.718 1.00 0.00 O ATOM 94 CB VAL A 6 8.581 3.111 -7.099 1.00 0.00 C ATOM 95 CG1 VAL A 6 8.540 3.473 -8.590 1.00 0.00 C ATOM 96 CG2 VAL A 6 7.211 2.546 -6.701 1.00 0.00 C ATOM 0 H VAL A 6 10.241 3.424 -5.241 1.00 0.00 H new ATOM 0 HA VAL A 6 9.206 1.126 -6.542 1.00 0.00 H new ATOM 0 HB VAL A 6 8.809 4.006 -6.520 1.00 0.00 H new ATOM 0 HG11 VAL A 6 7.752 4.206 -8.765 1.00 0.00 H new ATOM 0 HG12 VAL A 6 9.500 3.894 -8.889 1.00 0.00 H new ATOM 0 HG13 VAL A 6 8.338 2.577 -9.177 1.00 0.00 H new ATOM 0 HG21 VAL A 6 6.437 3.284 -6.913 1.00 0.00 H new ATOM 0 HG22 VAL A 6 7.012 1.638 -7.271 1.00 0.00 H new ATOM 0 HG23 VAL A 6 7.209 2.314 -5.636 1.00 0.00 H new ATOM 106 N ASP A 7 11.450 2.801 -8.306 1.00 0.00 N ATOM 107 CA ASP A 7 12.349 2.675 -9.490 1.00 0.00 C ATOM 108 C ASP A 7 13.678 2.013 -9.101 1.00 0.00 C ATOM 109 O ASP A 7 14.729 2.423 -9.552 1.00 0.00 O ATOM 110 CB ASP A 7 12.634 4.068 -10.053 1.00 0.00 C ATOM 111 CG ASP A 7 12.369 4.075 -11.559 1.00 0.00 C ATOM 112 OD1 ASP A 7 12.947 3.249 -12.246 1.00 0.00 O ATOM 113 OD2 ASP A 7 11.594 4.908 -12.001 1.00 0.00 O ATOM 0 H ASP A 7 11.567 3.657 -7.763 1.00 0.00 H new ATOM 0 HA ASP A 7 11.854 2.054 -10.237 1.00 0.00 H new ATOM 0 HB2 ASP A 7 12.004 4.807 -9.559 1.00 0.00 H new ATOM 0 HB3 ASP A 7 13.669 4.347 -9.854 1.00 0.00 H new ATOM 118 N THR A 8 13.660 0.998 -8.274 1.00 0.00 N ATOM 119 CA THR A 8 14.945 0.351 -7.893 1.00 0.00 C ATOM 120 C THR A 8 14.730 -1.157 -7.687 1.00 0.00 C ATOM 121 O THR A 8 14.578 -1.902 -8.634 1.00 0.00 O ATOM 122 CB THR A 8 15.472 0.998 -6.607 1.00 0.00 C ATOM 123 OG1 THR A 8 15.636 2.393 -6.817 1.00 0.00 O ATOM 124 CG2 THR A 8 16.819 0.378 -6.232 1.00 0.00 C ATOM 0 H THR A 8 12.822 0.596 -7.853 1.00 0.00 H new ATOM 0 HA THR A 8 15.677 0.489 -8.689 1.00 0.00 H new ATOM 0 HB THR A 8 14.761 0.829 -5.798 1.00 0.00 H new ATOM 0 HG1 THR A 8 14.834 2.866 -6.511 1.00 0.00 H new ATOM 0 HG21 THR A 8 17.190 0.840 -5.317 1.00 0.00 H new ATOM 0 HG22 THR A 8 16.695 -0.693 -6.072 1.00 0.00 H new ATOM 0 HG23 THR A 8 17.533 0.544 -7.038 1.00 0.00 H new ATOM 132 N ASN A 9 14.725 -1.614 -6.462 1.00 0.00 N ATOM 133 CA ASN A 9 14.530 -3.071 -6.202 1.00 0.00 C ATOM 134 C ASN A 9 13.097 -3.335 -5.747 1.00 0.00 C ATOM 135 O ASN A 9 12.323 -3.920 -6.461 1.00 0.00 O ATOM 136 CB ASN A 9 15.498 -3.522 -5.105 1.00 0.00 C ATOM 137 CG ASN A 9 15.970 -4.949 -5.392 1.00 0.00 C ATOM 138 OD1 ASN A 9 15.300 -5.903 -5.050 1.00 0.00 O ATOM 139 ND2 ASN A 9 17.103 -5.137 -6.011 1.00 0.00 N ATOM 0 H ASN A 9 14.848 -1.039 -5.628 1.00 0.00 H new ATOM 0 HA ASN A 9 14.722 -3.626 -7.120 1.00 0.00 H new ATOM 0 HB2 ASN A 9 16.353 -2.847 -5.061 1.00 0.00 H new ATOM 0 HB3 ASN A 9 15.007 -3.479 -4.133 1.00 0.00 H new ATOM 0 HD21 ASN A 9 17.426 -6.084 -6.208 1.00 0.00 H new ATOM 0 HD22 ASN A 9 17.666 -4.337 -6.298 1.00 0.00 H new ATOM 146 N LEU A 10 12.769 -2.915 -4.550 1.00 0.00 N ATOM 147 CA LEU A 10 11.401 -3.130 -3.970 1.00 0.00 C ATOM 148 C LEU A 10 10.346 -3.405 -5.051 1.00 0.00 C ATOM 149 O LEU A 10 9.530 -4.296 -4.913 1.00 0.00 O ATOM 150 CB LEU A 10 10.992 -1.884 -3.183 1.00 0.00 C ATOM 151 CG LEU A 10 10.906 -2.223 -1.694 1.00 0.00 C ATOM 152 CD1 LEU A 10 12.273 -2.012 -1.042 1.00 0.00 C ATOM 153 CD2 LEU A 10 9.878 -1.310 -1.021 1.00 0.00 C ATOM 0 H LEU A 10 13.410 -2.418 -3.931 1.00 0.00 H new ATOM 0 HA LEU A 10 11.450 -4.006 -3.323 1.00 0.00 H new ATOM 0 HB2 LEU A 10 11.717 -1.086 -3.343 1.00 0.00 H new ATOM 0 HB3 LEU A 10 10.030 -1.516 -3.539 1.00 0.00 H new ATOM 0 HG LEU A 10 10.603 -3.263 -1.577 1.00 0.00 H new ATOM 0 HD11 LEU A 10 12.211 -2.254 0.019 1.00 0.00 H new ATOM 0 HD12 LEU A 10 13.008 -2.660 -1.520 1.00 0.00 H new ATOM 0 HD13 LEU A 10 12.576 -0.972 -1.160 1.00 0.00 H new ATOM 0 HD21 LEU A 10 9.817 -1.551 0.040 1.00 0.00 H new ATOM 0 HD22 LEU A 10 10.182 -0.270 -1.140 1.00 0.00 H new ATOM 0 HD23 LEU A 10 8.902 -1.458 -1.484 1.00 0.00 H new ATOM 165 N VAL A 11 10.338 -2.651 -6.112 1.00 0.00 N ATOM 166 CA VAL A 11 9.313 -2.885 -7.173 1.00 0.00 C ATOM 167 C VAL A 11 9.702 -4.102 -8.024 1.00 0.00 C ATOM 168 O VAL A 11 9.037 -5.118 -7.988 1.00 0.00 O ATOM 169 CB VAL A 11 9.184 -1.614 -8.041 1.00 0.00 C ATOM 170 CG1 VAL A 11 9.130 -1.957 -9.537 1.00 0.00 C ATOM 171 CG2 VAL A 11 7.902 -0.873 -7.658 1.00 0.00 C ATOM 0 H VAL A 11 10.990 -1.888 -6.293 1.00 0.00 H new ATOM 0 HA VAL A 11 8.347 -3.096 -6.715 1.00 0.00 H new ATOM 0 HB VAL A 11 10.060 -0.991 -7.862 1.00 0.00 H new ATOM 0 HG11 VAL A 11 9.039 -1.039 -10.118 1.00 0.00 H new ATOM 0 HG12 VAL A 11 10.043 -2.479 -9.824 1.00 0.00 H new ATOM 0 HG13 VAL A 11 8.269 -2.597 -9.733 1.00 0.00 H new ATOM 0 HG21 VAL A 11 7.805 0.026 -8.267 1.00 0.00 H new ATOM 0 HG22 VAL A 11 7.042 -1.521 -7.828 1.00 0.00 H new ATOM 0 HG23 VAL A 11 7.944 -0.594 -6.605 1.00 0.00 H new ATOM 181 N GLY A 12 10.759 -4.004 -8.795 1.00 0.00 N ATOM 182 CA GLY A 12 11.175 -5.162 -9.649 1.00 0.00 C ATOM 183 C GLY A 12 10.970 -6.453 -8.865 1.00 0.00 C ATOM 184 O GLY A 12 10.573 -7.469 -9.398 1.00 0.00 O ATOM 0 H GLY A 12 11.350 -3.176 -8.870 1.00 0.00 H new ATOM 0 HA2 GLY A 12 10.589 -5.182 -10.568 1.00 0.00 H new ATOM 0 HA3 GLY A 12 12.221 -5.060 -9.940 1.00 0.00 H new ATOM 188 N THR A 13 11.220 -6.396 -7.587 1.00 0.00 N ATOM 189 CA THR A 13 11.039 -7.579 -6.706 1.00 0.00 C ATOM 190 C THR A 13 11.915 -7.420 -5.469 1.00 0.00 C ATOM 191 O THR A 13 12.483 -8.370 -4.966 1.00 0.00 O ATOM 192 CB THR A 13 11.429 -8.855 -7.436 1.00 0.00 C ATOM 193 OG1 THR A 13 11.724 -9.879 -6.496 1.00 0.00 O ATOM 194 CG2 THR A 13 12.654 -8.593 -8.317 1.00 0.00 C ATOM 0 H THR A 13 11.550 -5.559 -7.107 1.00 0.00 H new ATOM 0 HA THR A 13 9.990 -7.647 -6.418 1.00 0.00 H new ATOM 0 HB THR A 13 10.597 -9.176 -8.063 1.00 0.00 H new ATOM 0 HG1 THR A 13 12.546 -9.652 -6.012 1.00 0.00 H new ATOM 0 HG21 THR A 13 12.930 -9.510 -8.838 1.00 0.00 H new ATOM 0 HG22 THR A 13 12.419 -7.818 -9.046 1.00 0.00 H new ATOM 0 HG23 THR A 13 13.486 -8.265 -7.694 1.00 0.00 H new ATOM 202 N GLY A 14 12.000 -6.235 -4.944 1.00 0.00 N ATOM 203 CA GLY A 14 12.802 -6.040 -3.711 1.00 0.00 C ATOM 204 C GLY A 14 11.907 -6.390 -2.523 1.00 0.00 C ATOM 205 O GLY A 14 12.170 -6.020 -1.397 1.00 0.00 O ATOM 0 H GLY A 14 11.551 -5.396 -5.313 1.00 0.00 H new ATOM 0 HA2 GLY A 14 13.687 -6.676 -3.725 1.00 0.00 H new ATOM 0 HA3 GLY A 14 13.150 -5.010 -3.639 1.00 0.00 H new ATOM 209 N ALA A 15 10.835 -7.099 -2.785 1.00 0.00 N ATOM 210 CA ALA A 15 9.889 -7.480 -1.705 1.00 0.00 C ATOM 211 C ALA A 15 8.554 -7.790 -2.368 1.00 0.00 C ATOM 212 O ALA A 15 7.802 -8.636 -1.926 1.00 0.00 O ATOM 213 CB ALA A 15 9.716 -6.320 -0.722 1.00 0.00 C ATOM 0 H ALA A 15 10.578 -7.431 -3.715 1.00 0.00 H new ATOM 0 HA ALA A 15 10.264 -8.341 -1.152 1.00 0.00 H new ATOM 0 HB1 ALA A 15 9.020 -6.611 0.065 1.00 0.00 H new ATOM 0 HB2 ALA A 15 10.681 -6.071 -0.280 1.00 0.00 H new ATOM 0 HB3 ALA A 15 9.323 -5.451 -1.250 1.00 0.00 H new ATOM 219 N VAL A 16 8.266 -7.111 -3.448 1.00 0.00 N ATOM 220 CA VAL A 16 6.998 -7.357 -4.173 1.00 0.00 C ATOM 221 C VAL A 16 7.291 -7.335 -5.672 1.00 0.00 C ATOM 222 O VAL A 16 8.183 -6.646 -6.124 1.00 0.00 O ATOM 223 CB VAL A 16 5.993 -6.254 -3.834 1.00 0.00 C ATOM 224 CG1 VAL A 16 5.621 -6.334 -2.354 1.00 0.00 C ATOM 225 CG2 VAL A 16 6.619 -4.887 -4.124 1.00 0.00 C ATOM 0 H VAL A 16 8.864 -6.393 -3.857 1.00 0.00 H new ATOM 0 HA VAL A 16 6.580 -8.321 -3.884 1.00 0.00 H new ATOM 0 HB VAL A 16 5.097 -6.384 -4.441 1.00 0.00 H new ATOM 0 HG11 VAL A 16 4.905 -5.547 -2.116 1.00 0.00 H new ATOM 0 HG12 VAL A 16 5.175 -7.306 -2.143 1.00 0.00 H new ATOM 0 HG13 VAL A 16 6.517 -6.206 -1.746 1.00 0.00 H new ATOM 0 HG21 VAL A 16 5.904 -4.101 -3.883 1.00 0.00 H new ATOM 0 HG22 VAL A 16 7.515 -4.761 -3.517 1.00 0.00 H new ATOM 0 HG23 VAL A 16 6.884 -4.825 -5.179 1.00 0.00 H new ATOM 235 N THR A 17 6.541 -8.064 -6.452 1.00 0.00 N ATOM 236 CA THR A 17 6.781 -8.055 -7.921 1.00 0.00 C ATOM 237 C THR A 17 6.162 -6.788 -8.516 1.00 0.00 C ATOM 238 O THR A 17 6.131 -6.605 -9.715 1.00 0.00 O ATOM 239 CB THR A 17 6.127 -9.287 -8.553 1.00 0.00 C ATOM 240 OG1 THR A 17 5.045 -9.714 -7.739 1.00 0.00 O ATOM 241 CG2 THR A 17 7.155 -10.413 -8.668 1.00 0.00 C ATOM 0 H THR A 17 5.777 -8.662 -6.137 1.00 0.00 H new ATOM 0 HA THR A 17 7.852 -8.074 -8.121 1.00 0.00 H new ATOM 0 HB THR A 17 5.759 -9.033 -9.547 1.00 0.00 H new ATOM 0 HG1 THR A 17 4.623 -10.502 -8.142 1.00 0.00 H new ATOM 0 HG21 THR A 17 6.687 -11.288 -9.118 1.00 0.00 H new ATOM 0 HG22 THR A 17 7.986 -10.085 -9.292 1.00 0.00 H new ATOM 0 HG23 THR A 17 7.526 -10.670 -7.676 1.00 0.00 H new ATOM 249 N GLN A 18 5.674 -5.912 -7.674 1.00 0.00 N ATOM 250 CA GLN A 18 5.050 -4.646 -8.154 1.00 0.00 C ATOM 251 C GLN A 18 4.849 -3.724 -6.950 1.00 0.00 C ATOM 252 O GLN A 18 4.849 -4.165 -5.819 1.00 0.00 O ATOM 253 CB GLN A 18 3.688 -4.947 -8.788 1.00 0.00 C ATOM 254 CG GLN A 18 3.880 -5.549 -10.183 1.00 0.00 C ATOM 255 CD GLN A 18 2.662 -5.233 -11.056 1.00 0.00 C ATOM 256 OE1 GLN A 18 1.630 -4.831 -10.558 1.00 0.00 O ATOM 257 NE2 GLN A 18 2.741 -5.402 -12.349 1.00 0.00 N ATOM 0 H GLN A 18 5.683 -6.024 -6.660 1.00 0.00 H new ATOM 0 HA GLN A 18 5.693 -4.173 -8.897 1.00 0.00 H new ATOM 0 HB2 GLN A 18 3.130 -5.639 -8.158 1.00 0.00 H new ATOM 0 HB3 GLN A 18 3.099 -4.032 -8.856 1.00 0.00 H new ATOM 0 HG2 GLN A 18 4.783 -5.146 -10.642 1.00 0.00 H new ATOM 0 HG3 GLN A 18 4.015 -6.628 -10.108 1.00 0.00 H new ATOM 0 HE21 GLN A 18 3.608 -5.740 -12.767 1.00 0.00 H new ATOM 0 HE22 GLN A 18 1.936 -5.196 -12.940 1.00 0.00 H new ATOM 266 N ALA A 19 4.679 -2.453 -7.172 1.00 0.00 N ATOM 267 CA ALA A 19 4.486 -1.528 -5.999 1.00 0.00 C ATOM 268 C ALA A 19 3.913 -0.160 -6.425 1.00 0.00 C ATOM 269 O ALA A 19 4.568 0.630 -7.075 1.00 0.00 O ATOM 270 CB ALA A 19 5.832 -1.318 -5.305 1.00 0.00 C ATOM 0 H ALA A 19 4.664 -2.011 -8.091 1.00 0.00 H new ATOM 0 HA ALA A 19 3.768 -1.990 -5.322 1.00 0.00 H new ATOM 0 HB1 ALA A 19 5.702 -0.649 -4.454 1.00 0.00 H new ATOM 0 HB2 ALA A 19 6.216 -2.277 -4.958 1.00 0.00 H new ATOM 0 HB3 ALA A 19 6.539 -0.878 -6.008 1.00 0.00 H new ATOM 276 N ALA A 20 2.698 0.146 -6.044 1.00 0.00 N ATOM 277 CA ALA A 20 2.119 1.467 -6.427 1.00 0.00 C ATOM 278 C ALA A 20 2.259 2.453 -5.269 1.00 0.00 C ATOM 279 O ALA A 20 2.152 2.092 -4.115 1.00 0.00 O ATOM 280 CB ALA A 20 0.638 1.300 -6.774 1.00 0.00 C ATOM 0 H ALA A 20 2.088 -0.456 -5.490 1.00 0.00 H new ATOM 0 HA ALA A 20 2.656 1.851 -7.294 1.00 0.00 H new ATOM 0 HB1 ALA A 20 0.218 2.267 -7.053 1.00 0.00 H new ATOM 0 HB2 ALA A 20 0.536 0.606 -7.608 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.103 0.909 -5.908 1.00 0.00 H new ATOM 286 N ILE A 21 2.492 3.702 -5.573 1.00 0.00 N ATOM 287 CA ILE A 21 2.633 4.721 -4.497 1.00 0.00 C ATOM 288 C ILE A 21 1.629 5.842 -4.736 1.00 0.00 C ATOM 289 O ILE A 21 1.729 6.595 -5.687 1.00 0.00 O ATOM 290 CB ILE A 21 4.051 5.289 -4.503 1.00 0.00 C ATOM 291 CG1 ILE A 21 5.058 4.150 -4.352 1.00 0.00 C ATOM 292 CG2 ILE A 21 4.216 6.267 -3.340 1.00 0.00 C ATOM 293 CD1 ILE A 21 4.747 3.348 -3.087 1.00 0.00 C ATOM 0 H ILE A 21 2.591 4.060 -6.523 1.00 0.00 H new ATOM 0 HA ILE A 21 2.442 4.258 -3.529 1.00 0.00 H new ATOM 0 HB ILE A 21 4.227 5.810 -5.444 1.00 0.00 H new ATOM 0 HG12 ILE A 21 5.018 3.499 -5.225 1.00 0.00 H new ATOM 0 HG13 ILE A 21 6.070 4.552 -4.300 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.228 6.671 -3.346 1.00 0.00 H new ATOM 0 HG22 ILE A 21 3.499 7.081 -3.445 1.00 0.00 H new ATOM 0 HG23 ILE A 21 4.038 5.746 -2.399 1.00 0.00 H new ATOM 0 HD11 ILE A 21 5.468 2.537 -2.984 1.00 0.00 H new ATOM 0 HD12 ILE A 21 4.810 4.002 -2.217 1.00 0.00 H new ATOM 0 HD13 ILE A 21 3.742 2.933 -3.157 1.00 0.00 H new ATOM 305 N LEU A 22 0.655 5.939 -3.878 1.00 0.00 N ATOM 306 CA LEU A 22 -0.395 6.985 -4.027 1.00 0.00 C ATOM 307 C LEU A 22 -0.319 7.939 -2.825 1.00 0.00 C ATOM 308 O LEU A 22 -0.393 7.520 -1.686 1.00 0.00 O ATOM 309 CB LEU A 22 -1.781 6.307 -4.085 1.00 0.00 C ATOM 310 CG LEU A 22 -1.639 4.773 -3.966 1.00 0.00 C ATOM 311 CD1 LEU A 22 -3.021 4.116 -3.899 1.00 0.00 C ATOM 312 CD2 LEU A 22 -0.883 4.214 -5.180 1.00 0.00 C ATOM 0 H LEU A 22 0.539 5.330 -3.068 1.00 0.00 H new ATOM 0 HA LEU A 22 -0.239 7.551 -4.946 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -2.410 6.683 -3.279 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -2.277 6.561 -5.022 1.00 0.00 H new ATOM 0 HG LEU A 22 -1.084 4.552 -3.054 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.906 3.035 -3.815 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.561 4.492 -3.030 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.581 4.353 -4.804 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -0.790 3.132 -5.084 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -1.432 4.451 -6.091 1.00 0.00 H new ATOM 0 HD23 LEU A 22 0.110 4.661 -5.228 1.00 0.00 H new ATOM 324 N GLY A 23 -0.150 9.216 -3.065 1.00 0.00 N ATOM 325 CA GLY A 23 -0.045 10.184 -1.929 1.00 0.00 C ATOM 326 C GLY A 23 -1.271 11.105 -1.885 1.00 0.00 C ATOM 327 O GLY A 23 -2.321 10.787 -2.405 1.00 0.00 O ATOM 0 H GLY A 23 -0.080 9.629 -3.995 1.00 0.00 H new ATOM 0 HA2 GLY A 23 0.041 9.640 -0.988 1.00 0.00 H new ATOM 0 HA3 GLY A 23 0.861 10.781 -2.036 1.00 0.00 H new ATOM 331 N LEU A 24 -1.141 12.248 -1.251 1.00 0.00 N ATOM 332 CA LEU A 24 -2.293 13.196 -1.154 1.00 0.00 C ATOM 333 C LEU A 24 -2.063 14.395 -2.078 1.00 0.00 C ATOM 334 O LEU A 24 -2.825 14.637 -2.994 1.00 0.00 O ATOM 335 CB LEU A 24 -2.449 13.687 0.293 1.00 0.00 C ATOM 336 CG LEU A 24 -1.112 13.605 1.039 1.00 0.00 C ATOM 337 CD1 LEU A 24 -1.126 14.573 2.224 1.00 0.00 C ATOM 338 CD2 LEU A 24 -0.905 12.184 1.565 1.00 0.00 C ATOM 0 H LEU A 24 -0.284 12.563 -0.797 1.00 0.00 H new ATOM 0 HA LEU A 24 -3.202 12.676 -1.458 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -2.811 14.715 0.297 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.197 13.084 0.809 1.00 0.00 H new ATOM 0 HG LEU A 24 -0.305 13.868 0.355 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -0.175 14.514 2.753 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -1.277 15.590 1.861 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -1.936 14.306 2.902 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.046 12.127 2.095 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -1.716 11.926 2.246 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -0.897 11.484 0.729 1.00 0.00 H new ATOM 350 N ASP A 25 -1.013 15.144 -1.860 1.00 0.00 N ATOM 351 CA ASP A 25 -0.746 16.315 -2.753 1.00 0.00 C ATOM 352 C ASP A 25 -0.050 15.817 -4.021 1.00 0.00 C ATOM 353 O ASP A 25 0.373 16.590 -4.858 1.00 0.00 O ATOM 354 CB ASP A 25 0.139 17.365 -2.059 1.00 0.00 C ATOM 355 CG ASP A 25 0.825 16.773 -0.825 1.00 0.00 C ATOM 356 OD1 ASP A 25 1.822 16.091 -0.994 1.00 0.00 O ATOM 357 OD2 ASP A 25 0.340 17.014 0.269 1.00 0.00 O ATOM 0 H ASP A 25 -0.335 15.000 -1.112 1.00 0.00 H new ATOM 0 HA ASP A 25 -1.696 16.790 -2.997 1.00 0.00 H new ATOM 0 HB2 ASP A 25 0.891 17.731 -2.758 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -0.468 18.222 -1.766 1.00 0.00 H new ATOM 362 N GLY A 26 0.057 14.524 -4.171 1.00 0.00 N ATOM 363 CA GLY A 26 0.703 13.950 -5.378 1.00 0.00 C ATOM 364 C GLY A 26 -0.055 12.680 -5.761 1.00 0.00 C ATOM 365 O GLY A 26 0.269 11.599 -5.313 1.00 0.00 O ATOM 0 H GLY A 26 -0.281 13.836 -3.498 1.00 0.00 H new ATOM 0 HA2 GLY A 26 0.683 14.667 -6.198 1.00 0.00 H new ATOM 0 HA3 GLY A 26 1.750 13.723 -5.178 1.00 0.00 H new ATOM 369 N ASN A 27 -1.080 12.821 -6.564 1.00 0.00 N ATOM 370 CA ASN A 27 -1.909 11.647 -6.986 1.00 0.00 C ATOM 371 C ASN A 27 -1.061 10.374 -7.043 1.00 0.00 C ATOM 372 O ASN A 27 -1.522 9.299 -6.711 1.00 0.00 O ATOM 373 CB ASN A 27 -2.505 11.919 -8.368 1.00 0.00 C ATOM 374 CG ASN A 27 -3.961 11.451 -8.398 1.00 0.00 C ATOM 375 OD1 ASN A 27 -4.785 11.942 -7.653 1.00 0.00 O ATOM 376 ND2 ASN A 27 -4.314 10.514 -9.236 1.00 0.00 N ATOM 0 H ASN A 27 -1.383 13.714 -6.952 1.00 0.00 H new ATOM 0 HA ASN A 27 -2.705 11.503 -6.255 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -2.449 12.983 -8.596 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -1.929 11.398 -9.133 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -5.282 10.194 -9.265 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -3.622 10.102 -9.862 1.00 0.00 H new ATOM 383 N THR A 28 0.171 10.479 -7.453 1.00 0.00 N ATOM 384 CA THR A 28 1.032 9.265 -7.519 1.00 0.00 C ATOM 385 C THR A 28 2.495 9.675 -7.699 1.00 0.00 C ATOM 386 O THR A 28 2.918 10.051 -8.773 1.00 0.00 O ATOM 387 CB THR A 28 0.595 8.395 -8.700 1.00 0.00 C ATOM 388 OG1 THR A 28 -0.817 8.247 -8.678 1.00 0.00 O ATOM 389 CG2 THR A 28 1.255 7.019 -8.596 1.00 0.00 C ATOM 0 H THR A 28 0.618 11.348 -7.744 1.00 0.00 H new ATOM 0 HA THR A 28 0.930 8.701 -6.592 1.00 0.00 H new ATOM 0 HB THR A 28 0.898 8.870 -9.633 1.00 0.00 H new ATOM 0 HG1 THR A 28 -1.128 8.210 -7.749 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.943 6.401 -9.438 1.00 0.00 H new ATOM 0 HG22 THR A 28 2.339 7.133 -8.612 1.00 0.00 H new ATOM 0 HG23 THR A 28 0.955 6.541 -7.664 1.00 0.00 H new ATOM 397 N TRP A 29 3.275 9.592 -6.654 1.00 0.00 N ATOM 398 CA TRP A 29 4.714 9.962 -6.767 1.00 0.00 C ATOM 399 C TRP A 29 5.463 8.795 -7.406 1.00 0.00 C ATOM 400 O TRP A 29 6.468 8.966 -8.068 1.00 0.00 O ATOM 401 CB TRP A 29 5.284 10.233 -5.374 1.00 0.00 C ATOM 402 CG TRP A 29 4.703 11.499 -4.836 1.00 0.00 C ATOM 403 CD1 TRP A 29 4.430 12.603 -5.567 1.00 0.00 C ATOM 404 CD2 TRP A 29 4.320 11.810 -3.465 1.00 0.00 C ATOM 405 NE1 TRP A 29 3.903 13.572 -4.732 1.00 0.00 N ATOM 406 CE2 TRP A 29 3.817 13.132 -3.426 1.00 0.00 C ATOM 407 CE3 TRP A 29 4.363 11.082 -2.262 1.00 0.00 C ATOM 408 CZ2 TRP A 29 3.368 13.709 -2.237 1.00 0.00 C ATOM 409 CZ3 TRP A 29 3.913 11.658 -1.063 1.00 0.00 C ATOM 410 CH2 TRP A 29 3.417 12.971 -1.051 1.00 0.00 C ATOM 0 H TRP A 29 2.977 9.284 -5.728 1.00 0.00 H new ATOM 0 HA TRP A 29 4.824 10.859 -7.377 1.00 0.00 H new ATOM 0 HB2 TRP A 29 5.053 9.402 -4.707 1.00 0.00 H new ATOM 0 HB3 TRP A 29 6.370 10.311 -5.423 1.00 0.00 H new ATOM 0 HD1 TRP A 29 4.596 12.711 -6.629 1.00 0.00 H new ATOM 0 HE1 TRP A 29 3.613 14.499 -5.043 1.00 0.00 H new ATOM 0 HE3 TRP A 29 4.745 10.072 -2.261 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 2.985 14.719 -2.233 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 3.949 11.088 -0.146 1.00 0.00 H new ATOM 0 HH2 TRP A 29 3.074 13.411 -0.126 1.00 0.00 H new ATOM 421 N ALA A 30 4.963 7.607 -7.217 1.00 0.00 N ATOM 422 CA ALA A 30 5.611 6.408 -7.811 1.00 0.00 C ATOM 423 C ALA A 30 4.514 5.400 -8.141 1.00 0.00 C ATOM 424 O ALA A 30 3.405 5.513 -7.658 1.00 0.00 O ATOM 425 CB ALA A 30 6.589 5.800 -6.803 1.00 0.00 C ATOM 0 H ALA A 30 4.124 7.414 -6.670 1.00 0.00 H new ATOM 0 HA ALA A 30 6.163 6.677 -8.712 1.00 0.00 H new ATOM 0 HB1 ALA A 30 7.063 4.921 -7.240 1.00 0.00 H new ATOM 0 HB2 ALA A 30 7.353 6.535 -6.548 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.049 5.510 -5.902 1.00 0.00 H new ATOM 431 N THR A 31 4.788 4.419 -8.955 1.00 0.00 N ATOM 432 CA THR A 31 3.712 3.445 -9.277 1.00 0.00 C ATOM 433 C THR A 31 4.275 2.034 -9.429 1.00 0.00 C ATOM 434 O THR A 31 5.442 1.832 -9.701 1.00 0.00 O ATOM 435 CB THR A 31 3.001 3.863 -10.566 1.00 0.00 C ATOM 436 OG1 THR A 31 1.859 3.040 -10.761 1.00 0.00 O ATOM 437 CG2 THR A 31 3.950 3.708 -11.753 1.00 0.00 C ATOM 0 H THR A 31 5.690 4.252 -9.402 1.00 0.00 H new ATOM 0 HA THR A 31 2.999 3.440 -8.453 1.00 0.00 H new ATOM 0 HB THR A 31 2.692 4.905 -10.487 1.00 0.00 H new ATOM 0 HG1 THR A 31 1.401 3.307 -11.585 1.00 0.00 H new ATOM 0 HG21 THR A 31 3.439 4.007 -12.668 1.00 0.00 H new ATOM 0 HG22 THR A 31 4.826 4.339 -11.603 1.00 0.00 H new ATOM 0 HG23 THR A 31 4.263 2.667 -11.835 1.00 0.00 H new ATOM 445 N SER A 32 3.435 1.061 -9.225 1.00 0.00 N ATOM 446 CA SER A 32 3.858 -0.358 -9.312 1.00 0.00 C ATOM 447 C SER A 32 4.291 -0.728 -10.719 1.00 0.00 C ATOM 448 O SER A 32 4.834 -1.794 -10.928 1.00 0.00 O ATOM 449 CB SER A 32 2.686 -1.247 -8.901 1.00 0.00 C ATOM 450 OG SER A 32 1.647 -1.123 -9.862 1.00 0.00 O ATOM 0 H SER A 32 2.450 1.195 -8.996 1.00 0.00 H new ATOM 0 HA SER A 32 4.709 -0.503 -8.647 1.00 0.00 H new ATOM 0 HB2 SER A 32 3.009 -2.285 -8.829 1.00 0.00 H new ATOM 0 HB3 SER A 32 2.322 -0.957 -7.915 1.00 0.00 H new ATOM 0 HG SER A 32 0.848 -1.593 -9.543 1.00 0.00 H new ATOM 456 N ALA A 33 4.059 0.127 -11.674 1.00 0.00 N ATOM 457 CA ALA A 33 4.458 -0.187 -13.077 1.00 0.00 C ATOM 458 C ALA A 33 3.668 -1.401 -13.570 1.00 0.00 C ATOM 459 O ALA A 33 4.219 -2.457 -13.812 1.00 0.00 O ATOM 460 CB ALA A 33 5.952 -0.501 -13.128 1.00 0.00 C ATOM 0 H ALA A 33 3.609 1.033 -11.545 1.00 0.00 H new ATOM 0 HA ALA A 33 4.246 0.672 -13.714 1.00 0.00 H new ATOM 0 HB1 ALA A 33 6.241 -0.730 -14.154 1.00 0.00 H new ATOM 0 HB2 ALA A 33 6.517 0.362 -12.776 1.00 0.00 H new ATOM 0 HB3 ALA A 33 6.165 -1.359 -12.491 1.00 0.00 H new ATOM 466 N GLY A 34 2.380 -1.258 -13.722 1.00 0.00 N ATOM 467 CA GLY A 34 1.553 -2.404 -14.199 1.00 0.00 C ATOM 468 C GLY A 34 0.084 -1.985 -14.245 1.00 0.00 C ATOM 469 O GLY A 34 -0.411 -1.530 -15.256 1.00 0.00 O ATOM 0 H GLY A 34 1.864 -0.398 -13.537 1.00 0.00 H new ATOM 0 HA2 GLY A 34 1.884 -2.719 -15.189 1.00 0.00 H new ATOM 0 HA3 GLY A 34 1.678 -3.259 -13.534 1.00 0.00 H new ATOM 473 N PHE A 35 -0.618 -2.130 -13.154 1.00 0.00 N ATOM 474 CA PHE A 35 -2.053 -1.735 -13.135 1.00 0.00 C ATOM 475 C PHE A 35 -2.174 -0.303 -12.611 1.00 0.00 C ATOM 476 O PHE A 35 -1.389 0.136 -11.795 1.00 0.00 O ATOM 477 CB PHE A 35 -2.835 -2.686 -12.224 1.00 0.00 C ATOM 478 CG PHE A 35 -2.498 -2.404 -10.779 1.00 0.00 C ATOM 479 CD1 PHE A 35 -1.312 -2.900 -10.221 1.00 0.00 C ATOM 480 CD2 PHE A 35 -3.376 -1.646 -9.996 1.00 0.00 C ATOM 481 CE1 PHE A 35 -1.006 -2.637 -8.879 1.00 0.00 C ATOM 482 CE2 PHE A 35 -3.071 -1.382 -8.656 1.00 0.00 C ATOM 483 CZ PHE A 35 -1.886 -1.878 -8.098 1.00 0.00 C ATOM 0 H PHE A 35 -0.259 -2.505 -12.276 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.462 -1.789 -14.144 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -3.906 -2.563 -12.388 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -2.592 -3.720 -12.468 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.634 -3.485 -10.825 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -4.290 -1.264 -10.426 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -0.093 -3.019 -8.448 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.749 -0.796 -8.053 1.00 0.00 H new ATOM 0 HZ PHE A 35 -1.651 -1.675 -7.064 1.00 0.00 H new ATOM 493 N ALA A 36 -3.149 0.430 -13.075 1.00 0.00 N ATOM 494 CA ALA A 36 -3.312 1.835 -12.603 1.00 0.00 C ATOM 495 C ALA A 36 -4.628 1.969 -11.836 1.00 0.00 C ATOM 496 O ALA A 36 -5.596 1.291 -12.120 1.00 0.00 O ATOM 497 CB ALA A 36 -3.325 2.781 -13.806 1.00 0.00 C ATOM 0 H ALA A 36 -3.838 0.118 -13.759 1.00 0.00 H new ATOM 0 HA ALA A 36 -2.481 2.094 -11.946 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -3.444 3.808 -13.460 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -2.386 2.689 -14.352 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -4.154 2.521 -14.464 1.00 0.00 H new ATOM 503 N VAL A 37 -4.672 2.839 -10.866 1.00 0.00 N ATOM 504 CA VAL A 37 -5.923 3.018 -10.081 1.00 0.00 C ATOM 505 C VAL A 37 -6.632 4.297 -10.529 1.00 0.00 C ATOM 506 O VAL A 37 -6.024 5.341 -10.659 1.00 0.00 O ATOM 507 CB VAL A 37 -5.574 3.121 -8.596 1.00 0.00 C ATOM 508 CG1 VAL A 37 -6.856 3.091 -7.763 1.00 0.00 C ATOM 509 CG2 VAL A 37 -4.684 1.939 -8.205 1.00 0.00 C ATOM 0 H VAL A 37 -3.894 3.434 -10.583 1.00 0.00 H new ATOM 0 HA VAL A 37 -6.582 2.165 -10.245 1.00 0.00 H new ATOM 0 HB VAL A 37 -5.046 4.056 -8.410 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -6.604 3.165 -6.705 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -7.492 3.930 -8.044 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -7.387 2.157 -7.946 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -4.432 2.008 -7.147 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -5.216 1.006 -8.392 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.769 1.960 -8.798 1.00 0.00 H new ATOM 519 N THR A 38 -7.913 4.226 -10.767 1.00 0.00 N ATOM 520 CA THR A 38 -8.658 5.441 -11.204 1.00 0.00 C ATOM 521 C THR A 38 -8.797 6.405 -10.022 1.00 0.00 C ATOM 522 O THR A 38 -8.867 5.981 -8.885 1.00 0.00 O ATOM 523 CB THR A 38 -10.048 5.037 -11.701 1.00 0.00 C ATOM 524 OG1 THR A 38 -10.602 4.073 -10.817 1.00 0.00 O ATOM 525 CG2 THR A 38 -9.938 4.443 -13.106 1.00 0.00 C ATOM 0 H THR A 38 -8.476 3.380 -10.678 1.00 0.00 H new ATOM 0 HA THR A 38 -8.114 5.931 -12.011 1.00 0.00 H new ATOM 0 HB THR A 38 -10.693 5.915 -11.732 1.00 0.00 H new ATOM 0 HG1 THR A 38 -11.493 3.814 -11.132 1.00 0.00 H new ATOM 0 HG21 THR A 38 -10.929 4.156 -13.458 1.00 0.00 H new ATOM 0 HG22 THR A 38 -9.513 5.185 -13.782 1.00 0.00 H new ATOM 0 HG23 THR A 38 -9.293 3.564 -13.080 1.00 0.00 H new ATOM 533 N PRO A 39 -8.833 7.678 -10.328 1.00 0.00 N ATOM 534 CA PRO A 39 -8.962 8.729 -9.302 1.00 0.00 C ATOM 535 C PRO A 39 -10.267 8.547 -8.519 1.00 0.00 C ATOM 536 O PRO A 39 -11.047 7.660 -8.799 1.00 0.00 O ATOM 537 CB PRO A 39 -8.979 10.047 -10.090 1.00 0.00 C ATOM 538 CG PRO A 39 -8.795 9.701 -11.590 1.00 0.00 C ATOM 539 CD PRO A 39 -8.748 8.170 -11.715 1.00 0.00 C ATOM 0 HA PRO A 39 -8.152 8.701 -8.573 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -9.919 10.575 -9.932 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -8.181 10.707 -9.749 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -9.617 10.108 -12.180 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -7.877 10.144 -11.975 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -9.575 7.797 -12.319 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -7.827 7.840 -12.196 1.00 0.00 H new ATOM 547 N ALA A 40 -10.500 9.381 -7.537 1.00 0.00 N ATOM 548 CA ALA A 40 -11.747 9.270 -6.720 1.00 0.00 C ATOM 549 C ALA A 40 -11.551 8.219 -5.621 1.00 0.00 C ATOM 550 O ALA A 40 -11.948 8.412 -4.489 1.00 0.00 O ATOM 551 CB ALA A 40 -12.926 8.867 -7.611 1.00 0.00 C ATOM 0 H ALA A 40 -9.875 10.140 -7.264 1.00 0.00 H new ATOM 0 HA ALA A 40 -11.960 10.237 -6.265 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -13.829 8.789 -7.006 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -13.072 9.621 -8.385 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -12.717 7.904 -8.077 1.00 0.00 H new ATOM 557 N GLN A 41 -10.942 7.110 -5.941 1.00 0.00 N ATOM 558 CA GLN A 41 -10.724 6.055 -4.912 1.00 0.00 C ATOM 559 C GLN A 41 -9.715 6.552 -3.874 1.00 0.00 C ATOM 560 O GLN A 41 -9.777 6.197 -2.714 1.00 0.00 O ATOM 561 CB GLN A 41 -10.181 4.790 -5.582 1.00 0.00 C ATOM 562 CG GLN A 41 -11.297 3.748 -5.690 1.00 0.00 C ATOM 563 CD GLN A 41 -11.545 3.116 -4.320 1.00 0.00 C ATOM 564 OE1 GLN A 41 -10.795 3.338 -3.390 1.00 0.00 O ATOM 565 NE2 GLN A 41 -12.573 2.331 -4.154 1.00 0.00 N ATOM 0 H GLN A 41 -10.586 6.889 -6.871 1.00 0.00 H new ATOM 0 HA GLN A 41 -11.671 5.830 -4.421 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.795 5.028 -6.573 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -9.349 4.388 -5.004 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -12.211 4.216 -6.056 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -11.021 2.979 -6.412 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -13.203 2.144 -4.934 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -12.747 1.904 -3.244 1.00 0.00 H new ATOM 574 N GLY A 42 -8.783 7.370 -4.280 1.00 0.00 N ATOM 575 CA GLY A 42 -7.773 7.882 -3.310 1.00 0.00 C ATOM 576 C GLY A 42 -8.487 8.545 -2.128 1.00 0.00 C ATOM 577 O GLY A 42 -8.045 8.461 -0.999 1.00 0.00 O ATOM 0 H GLY A 42 -8.677 7.705 -5.238 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.146 7.064 -2.957 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -7.115 8.600 -3.800 1.00 0.00 H new ATOM 581 N GLN A 43 -9.586 9.205 -2.377 1.00 0.00 N ATOM 582 CA GLN A 43 -10.320 9.873 -1.264 1.00 0.00 C ATOM 583 C GLN A 43 -10.941 8.813 -0.352 1.00 0.00 C ATOM 584 O GLN A 43 -11.040 8.993 0.846 1.00 0.00 O ATOM 585 CB GLN A 43 -11.425 10.760 -1.838 1.00 0.00 C ATOM 586 CG GLN A 43 -10.858 12.150 -2.131 1.00 0.00 C ATOM 587 CD GLN A 43 -11.492 12.703 -3.406 1.00 0.00 C ATOM 588 OE1 GLN A 43 -11.918 13.841 -3.444 1.00 0.00 O ATOM 589 NE2 GLN A 43 -11.574 11.941 -4.462 1.00 0.00 N ATOM 0 H GLN A 43 -10.006 9.310 -3.300 1.00 0.00 H new ATOM 0 HA GLN A 43 -9.625 10.485 -0.690 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -11.824 10.318 -2.751 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -12.252 10.834 -1.131 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -11.057 12.819 -1.294 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -9.775 12.096 -2.245 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -11.217 10.986 -4.431 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -11.995 12.300 -5.319 1.00 0.00 H new ATOM 598 N THR A 44 -11.360 7.711 -0.907 1.00 0.00 N ATOM 599 CA THR A 44 -11.973 6.642 -0.070 1.00 0.00 C ATOM 600 C THR A 44 -10.966 6.184 0.988 1.00 0.00 C ATOM 601 O THR A 44 -11.331 5.797 2.080 1.00 0.00 O ATOM 602 CB THR A 44 -12.356 5.459 -0.961 1.00 0.00 C ATOM 603 OG1 THR A 44 -13.201 5.912 -2.009 1.00 0.00 O ATOM 604 CG2 THR A 44 -13.094 4.408 -0.130 1.00 0.00 C ATOM 0 H THR A 44 -11.305 7.504 -1.904 1.00 0.00 H new ATOM 0 HA THR A 44 -12.865 7.028 0.423 1.00 0.00 H new ATOM 0 HB THR A 44 -11.454 5.017 -1.384 1.00 0.00 H new ATOM 0 HG1 THR A 44 -13.446 5.156 -2.582 1.00 0.00 H new ATOM 0 HG21 THR A 44 -13.366 3.566 -0.767 1.00 0.00 H new ATOM 0 HG22 THR A 44 -12.446 4.060 0.675 1.00 0.00 H new ATOM 0 HG23 THR A 44 -13.996 4.848 0.295 1.00 0.00 H new ATOM 612 N LEU A 45 -9.700 6.227 0.673 1.00 0.00 N ATOM 613 CA LEU A 45 -8.671 5.795 1.662 1.00 0.00 C ATOM 614 C LEU A 45 -8.624 6.798 2.818 1.00 0.00 C ATOM 615 O LEU A 45 -8.508 6.428 3.970 1.00 0.00 O ATOM 616 CB LEU A 45 -7.301 5.737 0.979 1.00 0.00 C ATOM 617 CG LEU A 45 -7.016 4.305 0.516 1.00 0.00 C ATOM 618 CD1 LEU A 45 -5.898 4.316 -0.528 1.00 0.00 C ATOM 619 CD2 LEU A 45 -6.583 3.457 1.715 1.00 0.00 C ATOM 0 H LEU A 45 -9.334 6.542 -0.225 1.00 0.00 H new ATOM 0 HA LEU A 45 -8.927 4.808 2.047 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -7.280 6.416 0.127 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -6.525 6.068 1.670 1.00 0.00 H new ATOM 0 HG LEU A 45 -7.919 3.881 0.076 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -5.697 3.296 -0.856 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -6.205 4.919 -1.383 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -4.995 4.741 -0.090 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -6.380 2.438 1.386 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -5.681 3.883 2.155 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -7.379 3.446 2.459 1.00 0.00 H new ATOM 631 N ALA A 46 -8.718 8.065 2.517 1.00 0.00 N ATOM 632 CA ALA A 46 -8.682 9.094 3.593 1.00 0.00 C ATOM 633 C ALA A 46 -9.880 8.899 4.525 1.00 0.00 C ATOM 634 O ALA A 46 -9.763 8.994 5.730 1.00 0.00 O ATOM 635 CB ALA A 46 -8.746 10.487 2.964 1.00 0.00 C ATOM 0 H ALA A 46 -8.818 8.431 1.570 1.00 0.00 H new ATOM 0 HA ALA A 46 -7.759 8.994 4.164 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -8.720 11.242 3.749 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -7.894 10.625 2.299 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -9.670 10.587 2.395 1.00 0.00 H new ATOM 641 N SER A 47 -11.033 8.630 3.976 1.00 0.00 N ATOM 642 CA SER A 47 -12.237 8.431 4.831 1.00 0.00 C ATOM 643 C SER A 47 -12.162 7.062 5.511 1.00 0.00 C ATOM 644 O SER A 47 -12.941 6.751 6.391 1.00 0.00 O ATOM 645 CB SER A 47 -13.495 8.501 3.963 1.00 0.00 C ATOM 646 OG SER A 47 -14.644 8.394 4.792 1.00 0.00 O ATOM 0 H SER A 47 -11.193 8.539 2.973 1.00 0.00 H new ATOM 0 HA SER A 47 -12.275 9.211 5.591 1.00 0.00 H new ATOM 0 HB2 SER A 47 -13.517 9.440 3.410 1.00 0.00 H new ATOM 0 HB3 SER A 47 -13.488 7.698 3.226 1.00 0.00 H new ATOM 0 HG SER A 47 -14.434 7.839 5.572 1.00 0.00 H new ATOM 652 N ALA A 48 -11.231 6.239 5.109 1.00 0.00 N ATOM 653 CA ALA A 48 -11.110 4.889 5.731 1.00 0.00 C ATOM 654 C ALA A 48 -10.240 4.975 6.987 1.00 0.00 C ATOM 655 O ALA A 48 -10.237 4.086 7.814 1.00 0.00 O ATOM 656 CB ALA A 48 -10.462 3.925 4.734 1.00 0.00 C ATOM 0 H ALA A 48 -10.550 6.443 4.378 1.00 0.00 H new ATOM 0 HA ALA A 48 -12.102 4.528 6.001 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -10.373 2.938 5.188 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -11.080 3.858 3.838 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.471 4.291 4.465 1.00 0.00 H new ATOM 662 N PHE A 49 -9.497 6.038 7.133 1.00 0.00 N ATOM 663 CA PHE A 49 -8.624 6.177 8.331 1.00 0.00 C ATOM 664 C PHE A 49 -9.448 6.691 9.512 1.00 0.00 C ATOM 665 O PHE A 49 -9.035 6.609 10.652 1.00 0.00 O ATOM 666 CB PHE A 49 -7.498 7.166 8.026 1.00 0.00 C ATOM 667 CG PHE A 49 -6.770 6.723 6.780 1.00 0.00 C ATOM 668 CD1 PHE A 49 -6.537 5.361 6.555 1.00 0.00 C ATOM 669 CD2 PHE A 49 -6.328 7.672 5.850 1.00 0.00 C ATOM 670 CE1 PHE A 49 -5.862 4.947 5.400 1.00 0.00 C ATOM 671 CE2 PHE A 49 -5.652 7.258 4.695 1.00 0.00 C ATOM 672 CZ PHE A 49 -5.420 5.896 4.471 1.00 0.00 C ATOM 0 H PHE A 49 -9.457 6.816 6.474 1.00 0.00 H new ATOM 0 HA PHE A 49 -8.199 5.206 8.584 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -7.906 8.167 7.887 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -6.806 7.218 8.867 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -6.878 4.629 7.272 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -6.508 8.723 6.023 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -5.683 3.896 5.226 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -5.310 7.989 3.978 1.00 0.00 H new ATOM 0 HZ PHE A 49 -4.899 5.577 3.580 1.00 0.00 H new ATOM 682 N ASN A 50 -10.613 7.216 9.250 1.00 0.00 N ATOM 683 CA ASN A 50 -11.462 7.730 10.359 1.00 0.00 C ATOM 684 C ASN A 50 -12.766 6.922 10.414 1.00 0.00 C ATOM 685 O ASN A 50 -13.655 7.214 11.190 1.00 0.00 O ATOM 686 CB ASN A 50 -11.768 9.215 10.120 1.00 0.00 C ATOM 687 CG ASN A 50 -12.922 9.363 9.124 1.00 0.00 C ATOM 688 OD1 ASN A 50 -12.738 9.201 7.934 1.00 0.00 O ATOM 689 ND2 ASN A 50 -14.112 9.665 9.566 1.00 0.00 N ATOM 0 H ASN A 50 -11.013 7.311 8.316 1.00 0.00 H new ATOM 0 HA ASN A 50 -10.937 7.625 11.308 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -12.027 9.697 11.063 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -10.881 9.720 9.738 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -14.889 9.765 8.912 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -14.266 9.801 10.565 1.00 0.00 H new ATOM 696 N ASN A 51 -12.884 5.911 9.596 1.00 0.00 N ATOM 697 CA ASN A 51 -14.126 5.088 9.600 1.00 0.00 C ATOM 698 C ASN A 51 -13.884 3.795 8.816 1.00 0.00 C ATOM 699 O ASN A 51 -13.788 3.801 7.604 1.00 0.00 O ATOM 700 CB ASN A 51 -15.263 5.875 8.944 1.00 0.00 C ATOM 701 CG ASN A 51 -16.574 5.587 9.676 1.00 0.00 C ATOM 702 OD1 ASN A 51 -17.328 4.720 9.278 1.00 0.00 O ATOM 703 ND2 ASN A 51 -16.881 6.281 10.736 1.00 0.00 N ATOM 0 H ASN A 51 -12.173 5.620 8.925 1.00 0.00 H new ATOM 0 HA ASN A 51 -14.397 4.846 10.628 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -15.045 6.942 8.974 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -15.352 5.597 7.894 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -17.753 6.097 11.231 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -16.249 7.008 11.070 1.00 0.00 H new ATOM 710 N ALA A 52 -13.787 2.689 9.499 1.00 0.00 N ATOM 711 CA ALA A 52 -13.552 1.395 8.798 1.00 0.00 C ATOM 712 C ALA A 52 -14.893 0.697 8.557 1.00 0.00 C ATOM 713 O ALA A 52 -15.053 -0.474 8.835 1.00 0.00 O ATOM 714 CB ALA A 52 -12.661 0.503 9.665 1.00 0.00 C ATOM 0 H ALA A 52 -13.860 2.625 10.514 1.00 0.00 H new ATOM 0 HA ALA A 52 -13.062 1.580 7.842 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -12.488 -0.444 9.154 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -11.707 1.001 9.839 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -13.153 0.316 10.620 1.00 0.00 H new ATOM 720 N ASP A 53 -15.861 1.412 8.051 1.00 0.00 N ATOM 721 CA ASP A 53 -17.195 0.797 7.801 1.00 0.00 C ATOM 722 C ASP A 53 -17.204 0.045 6.464 1.00 0.00 C ATOM 723 O ASP A 53 -17.640 -1.084 6.404 1.00 0.00 O ATOM 724 CB ASP A 53 -18.264 1.892 7.773 1.00 0.00 C ATOM 725 CG ASP A 53 -19.515 1.399 8.501 1.00 0.00 C ATOM 726 OD1 ASP A 53 -19.550 1.504 9.716 1.00 0.00 O ATOM 727 OD2 ASP A 53 -20.417 0.925 7.832 1.00 0.00 O ATOM 0 H ASP A 53 -15.785 2.398 7.800 1.00 0.00 H new ATOM 0 HA ASP A 53 -17.407 0.089 8.602 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -17.886 2.797 8.249 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -18.508 2.151 6.743 1.00 0.00 H new ATOM 732 N PRO A 54 -16.747 0.697 5.424 1.00 0.00 N ATOM 733 CA PRO A 54 -16.721 0.098 4.076 1.00 0.00 C ATOM 734 C PRO A 54 -15.793 -1.124 4.024 1.00 0.00 C ATOM 735 O PRO A 54 -16.242 -2.247 3.919 1.00 0.00 O ATOM 736 CB PRO A 54 -16.196 1.213 3.162 1.00 0.00 C ATOM 737 CG PRO A 54 -15.961 2.470 4.039 1.00 0.00 C ATOM 738 CD PRO A 54 -16.229 2.075 5.500 1.00 0.00 C ATOM 0 HA PRO A 54 -17.706 -0.259 3.775 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -15.269 0.906 2.678 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -16.913 1.428 2.370 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -14.940 2.833 3.922 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -16.624 3.279 3.733 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -15.318 2.124 6.097 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -16.952 2.745 5.966 1.00 0.00 H new ATOM 746 N ILE A 55 -14.505 -0.914 4.077 1.00 0.00 N ATOM 747 CA ILE A 55 -13.561 -2.072 4.004 1.00 0.00 C ATOM 748 C ILE A 55 -14.038 -3.196 4.924 1.00 0.00 C ATOM 749 O ILE A 55 -14.200 -4.324 4.504 1.00 0.00 O ATOM 750 CB ILE A 55 -12.138 -1.656 4.416 1.00 0.00 C ATOM 751 CG1 ILE A 55 -12.155 -0.322 5.172 1.00 0.00 C ATOM 752 CG2 ILE A 55 -11.272 -1.513 3.163 1.00 0.00 C ATOM 753 CD1 ILE A 55 -10.774 -0.064 5.776 1.00 0.00 C ATOM 0 H ILE A 55 -14.066 0.002 4.167 1.00 0.00 H new ATOM 0 HA ILE A 55 -13.540 -2.420 2.971 1.00 0.00 H new ATOM 0 HB ILE A 55 -11.729 -2.423 5.073 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -12.426 0.489 4.496 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -12.909 -0.346 5.958 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -10.263 -1.218 3.450 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -11.236 -2.466 2.635 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -11.700 -0.753 2.510 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -10.784 0.884 6.314 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -10.522 -0.870 6.465 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -10.031 -0.022 4.980 1.00 0.00 H new ATOM 765 N ARG A 56 -14.259 -2.904 6.174 1.00 0.00 N ATOM 766 CA ARG A 56 -14.719 -3.970 7.112 1.00 0.00 C ATOM 767 C ARG A 56 -15.922 -4.697 6.508 1.00 0.00 C ATOM 768 O ARG A 56 -15.935 -5.906 6.392 1.00 0.00 O ATOM 769 CB ARG A 56 -15.118 -3.345 8.452 1.00 0.00 C ATOM 770 CG ARG A 56 -13.866 -3.117 9.306 1.00 0.00 C ATOM 771 CD ARG A 56 -14.267 -2.507 10.652 1.00 0.00 C ATOM 772 NE ARG A 56 -13.950 -3.465 11.751 1.00 0.00 N ATOM 773 CZ ARG A 56 -13.932 -3.059 12.994 1.00 0.00 C ATOM 774 NH1 ARG A 56 -14.185 -1.810 13.281 1.00 0.00 N ATOM 775 NH2 ARG A 56 -13.659 -3.903 13.952 1.00 0.00 N ATOM 0 H ARG A 56 -14.142 -1.979 6.588 1.00 0.00 H new ATOM 0 HA ARG A 56 -13.908 -4.680 7.275 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -15.633 -2.399 8.285 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -15.814 -3.999 8.977 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -13.344 -4.061 9.464 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -13.175 -2.454 8.786 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -13.736 -1.568 10.810 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -15.332 -2.275 10.654 1.00 0.00 H new ATOM 0 HE ARG A 56 -13.747 -4.440 11.532 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -14.397 -1.148 12.535 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -14.170 -1.497 14.252 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -13.460 -4.879 13.731 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -13.645 -3.587 14.922 1.00 0.00 H new ATOM 789 N ALA A 57 -16.931 -3.969 6.121 1.00 0.00 N ATOM 790 CA ALA A 57 -18.133 -4.615 5.524 1.00 0.00 C ATOM 791 C ALA A 57 -17.696 -5.636 4.473 1.00 0.00 C ATOM 792 O ALA A 57 -17.533 -6.806 4.759 1.00 0.00 O ATOM 793 CB ALA A 57 -19.010 -3.548 4.863 1.00 0.00 C ATOM 0 H ALA A 57 -16.976 -2.952 6.192 1.00 0.00 H new ATOM 0 HA ALA A 57 -18.700 -5.119 6.307 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -19.890 -4.020 4.426 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -19.323 -2.820 5.611 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -18.442 -3.044 4.081 1.00 0.00 H new ATOM 799 N SER A 58 -17.504 -5.205 3.257 1.00 0.00 N ATOM 800 CA SER A 58 -17.078 -6.152 2.190 1.00 0.00 C ATOM 801 C SER A 58 -15.610 -6.531 2.402 1.00 0.00 C ATOM 802 O SER A 58 -15.301 -7.556 2.975 1.00 0.00 O ATOM 803 CB SER A 58 -17.247 -5.487 0.824 1.00 0.00 C ATOM 804 OG SER A 58 -18.448 -5.953 0.219 1.00 0.00 O ATOM 0 H SER A 58 -17.624 -4.238 2.957 1.00 0.00 H new ATOM 0 HA SER A 58 -17.692 -7.052 2.232 1.00 0.00 H new ATOM 0 HB2 SER A 58 -17.279 -4.403 0.936 1.00 0.00 H new ATOM 0 HB3 SER A 58 -16.393 -5.716 0.187 1.00 0.00 H new ATOM 0 HG SER A 58 -18.560 -5.527 -0.656 1.00 0.00 H new ATOM 810 N GLY A 59 -14.701 -5.714 1.945 1.00 0.00 N ATOM 811 CA GLY A 59 -13.257 -6.034 2.125 1.00 0.00 C ATOM 812 C GLY A 59 -12.404 -4.926 1.506 1.00 0.00 C ATOM 813 O GLY A 59 -12.200 -3.885 2.097 1.00 0.00 O ATOM 0 H GLY A 59 -14.895 -4.840 1.456 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -13.026 -6.135 3.185 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -13.025 -6.990 1.656 1.00 0.00 H new ATOM 817 N PHE A 60 -11.902 -5.144 0.323 1.00 0.00 N ATOM 818 CA PHE A 60 -11.061 -4.104 -0.332 1.00 0.00 C ATOM 819 C PHE A 60 -11.550 -3.888 -1.764 1.00 0.00 C ATOM 820 O PHE A 60 -11.790 -4.826 -2.497 1.00 0.00 O ATOM 821 CB PHE A 60 -9.605 -4.570 -0.357 1.00 0.00 C ATOM 822 CG PHE A 60 -8.845 -3.913 0.770 1.00 0.00 C ATOM 823 CD1 PHE A 60 -8.848 -2.520 0.896 1.00 0.00 C ATOM 824 CD2 PHE A 60 -8.138 -4.698 1.689 1.00 0.00 C ATOM 825 CE1 PHE A 60 -8.143 -1.910 1.940 1.00 0.00 C ATOM 826 CE2 PHE A 60 -7.433 -4.088 2.733 1.00 0.00 C ATOM 827 CZ PHE A 60 -7.436 -2.694 2.859 1.00 0.00 C ATOM 0 H PHE A 60 -12.038 -5.997 -0.219 1.00 0.00 H new ATOM 0 HA PHE A 60 -11.134 -3.170 0.225 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -9.558 -5.654 -0.258 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -9.148 -4.317 -1.314 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -9.394 -1.915 0.188 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -8.137 -5.774 1.592 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -8.145 -0.834 2.036 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -6.887 -4.693 3.441 1.00 0.00 H new ATOM 0 HZ PHE A 60 -6.893 -2.223 3.665 1.00 0.00 H new ATOM 837 N ASP A 61 -11.703 -2.658 -2.169 1.00 0.00 N ATOM 838 CA ASP A 61 -12.178 -2.387 -3.554 1.00 0.00 C ATOM 839 C ASP A 61 -11.240 -1.384 -4.228 1.00 0.00 C ATOM 840 O ASP A 61 -10.994 -0.310 -3.718 1.00 0.00 O ATOM 841 CB ASP A 61 -13.594 -1.811 -3.506 1.00 0.00 C ATOM 842 CG ASP A 61 -13.969 -1.266 -4.886 1.00 0.00 C ATOM 843 OD1 ASP A 61 -14.127 -2.065 -5.794 1.00 0.00 O ATOM 844 OD2 ASP A 61 -14.091 -0.058 -5.010 1.00 0.00 O ATOM 0 H ASP A 61 -11.520 -1.830 -1.602 1.00 0.00 H new ATOM 0 HA ASP A 61 -12.185 -3.316 -4.123 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -14.302 -2.582 -3.203 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -13.650 -1.017 -2.762 1.00 0.00 H new ATOM 849 N LEU A 62 -10.717 -1.727 -5.374 1.00 0.00 N ATOM 850 CA LEU A 62 -9.797 -0.794 -6.081 1.00 0.00 C ATOM 851 C LEU A 62 -10.249 -0.643 -7.535 1.00 0.00 C ATOM 852 O LEU A 62 -11.419 -0.744 -7.846 1.00 0.00 O ATOM 853 CB LEU A 62 -8.373 -1.353 -6.048 1.00 0.00 C ATOM 854 CG LEU A 62 -8.045 -1.840 -4.637 1.00 0.00 C ATOM 855 CD1 LEU A 62 -7.287 -3.166 -4.719 1.00 0.00 C ATOM 856 CD2 LEU A 62 -7.176 -0.799 -3.927 1.00 0.00 C ATOM 0 H LEU A 62 -10.888 -2.613 -5.850 1.00 0.00 H new ATOM 0 HA LEU A 62 -9.816 0.178 -5.587 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -8.278 -2.174 -6.758 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -7.663 -0.584 -6.352 1.00 0.00 H new ATOM 0 HG LEU A 62 -8.970 -1.984 -4.078 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.053 -3.514 -3.713 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.905 -3.908 -5.225 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -6.362 -3.022 -5.278 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.942 -1.146 -2.921 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -6.251 -0.655 -4.486 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.715 0.146 -3.869 1.00 0.00 H new ATOM 868 N ALA A 63 -9.329 -0.403 -8.429 1.00 0.00 N ATOM 869 CA ALA A 63 -9.706 -0.249 -9.861 1.00 0.00 C ATOM 870 C ALA A 63 -10.584 -1.427 -10.285 1.00 0.00 C ATOM 871 O ALA A 63 -11.784 -1.302 -10.427 1.00 0.00 O ATOM 872 CB ALA A 63 -8.441 -0.223 -10.720 1.00 0.00 C ATOM 0 H ALA A 63 -8.333 -0.307 -8.229 1.00 0.00 H new ATOM 0 HA ALA A 63 -10.256 0.682 -9.995 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -8.716 -0.110 -11.769 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.813 0.615 -10.417 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.892 -1.155 -10.587 1.00 0.00 H new ATOM 878 N GLY A 64 -9.992 -2.572 -10.488 1.00 0.00 N ATOM 879 CA GLY A 64 -10.788 -3.761 -10.901 1.00 0.00 C ATOM 880 C GLY A 64 -10.321 -4.984 -10.108 1.00 0.00 C ATOM 881 O GLY A 64 -10.260 -6.082 -10.623 1.00 0.00 O ATOM 0 H GLY A 64 -8.990 -2.735 -10.385 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -11.849 -3.582 -10.724 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -10.669 -3.939 -11.970 1.00 0.00 H new ATOM 885 N VAL A 65 -9.986 -4.802 -8.860 1.00 0.00 N ATOM 886 CA VAL A 65 -9.519 -5.957 -8.040 1.00 0.00 C ATOM 887 C VAL A 65 -10.124 -5.874 -6.637 1.00 0.00 C ATOM 888 O VAL A 65 -10.532 -4.821 -6.187 1.00 0.00 O ATOM 889 CB VAL A 65 -7.994 -5.920 -7.939 1.00 0.00 C ATOM 890 CG1 VAL A 65 -7.474 -7.306 -7.554 1.00 0.00 C ATOM 891 CG2 VAL A 65 -7.404 -5.510 -9.292 1.00 0.00 C ATOM 0 H VAL A 65 -10.015 -3.906 -8.373 1.00 0.00 H new ATOM 0 HA VAL A 65 -9.834 -6.887 -8.513 1.00 0.00 H new ATOM 0 HB VAL A 65 -7.697 -5.198 -7.179 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -6.387 -7.280 -7.482 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -7.894 -7.598 -6.592 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -7.770 -8.030 -8.314 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -6.317 -5.483 -9.222 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -7.701 -6.233 -10.052 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -7.774 -4.522 -9.566 1.00 0.00 H new ATOM 901 N HIS A 66 -10.182 -6.979 -5.944 1.00 0.00 N ATOM 902 CA HIS A 66 -10.758 -6.971 -4.569 1.00 0.00 C ATOM 903 C HIS A 66 -9.805 -7.692 -3.611 1.00 0.00 C ATOM 904 O HIS A 66 -9.181 -8.673 -3.964 1.00 0.00 O ATOM 905 CB HIS A 66 -12.109 -7.691 -4.578 1.00 0.00 C ATOM 906 CG HIS A 66 -13.017 -7.069 -3.553 1.00 0.00 C ATOM 907 ND1 HIS A 66 -13.867 -6.018 -3.858 1.00 0.00 N ATOM 908 CD2 HIS A 66 -13.224 -7.344 -2.224 1.00 0.00 C ATOM 909 CE1 HIS A 66 -14.540 -5.702 -2.738 1.00 0.00 C ATOM 910 NE2 HIS A 66 -14.186 -6.479 -1.710 1.00 0.00 N ATOM 0 H HIS A 66 -9.855 -7.888 -6.271 1.00 0.00 H new ATOM 0 HA HIS A 66 -10.895 -5.941 -4.240 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -12.561 -7.625 -5.568 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -11.970 -8.750 -4.361 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -12.717 -8.115 -1.662 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -15.277 -4.915 -2.676 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -14.543 -6.446 -0.755 1.00 0.00 H new ATOM 918 N TYR A 67 -9.693 -7.216 -2.402 1.00 0.00 N ATOM 919 CA TYR A 67 -8.785 -7.876 -1.420 1.00 0.00 C ATOM 920 C TYR A 67 -9.506 -8.017 -0.079 1.00 0.00 C ATOM 921 O TYR A 67 -10.697 -7.798 0.021 1.00 0.00 O ATOM 922 CB TYR A 67 -7.525 -7.028 -1.238 1.00 0.00 C ATOM 923 CG TYR A 67 -6.713 -7.062 -2.510 1.00 0.00 C ATOM 924 CD1 TYR A 67 -6.344 -8.290 -3.071 1.00 0.00 C ATOM 925 CD2 TYR A 67 -6.335 -5.866 -3.130 1.00 0.00 C ATOM 926 CE1 TYR A 67 -5.595 -8.323 -4.253 1.00 0.00 C ATOM 927 CE2 TYR A 67 -5.586 -5.898 -4.313 1.00 0.00 C ATOM 928 CZ TYR A 67 -5.216 -7.127 -4.874 1.00 0.00 C ATOM 929 OH TYR A 67 -4.478 -7.159 -6.039 1.00 0.00 O ATOM 0 H TYR A 67 -10.191 -6.398 -2.051 1.00 0.00 H new ATOM 0 HA TYR A 67 -8.505 -8.863 -1.788 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -7.796 -6.001 -0.993 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -6.934 -7.409 -0.405 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -6.637 -9.212 -2.592 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -6.621 -4.919 -2.697 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -5.310 -9.271 -4.686 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -5.294 -4.975 -4.793 1.00 0.00 H new ATOM 0 HH TYR A 67 -4.300 -6.243 -6.339 1.00 0.00 H new ATOM 939 N VAL A 68 -8.797 -8.381 0.955 1.00 0.00 N ATOM 940 CA VAL A 68 -9.449 -8.535 2.285 1.00 0.00 C ATOM 941 C VAL A 68 -8.859 -7.516 3.262 1.00 0.00 C ATOM 942 O VAL A 68 -7.664 -7.305 3.308 1.00 0.00 O ATOM 943 CB VAL A 68 -9.210 -9.950 2.823 1.00 0.00 C ATOM 944 CG1 VAL A 68 -10.412 -10.381 3.665 1.00 0.00 C ATOM 945 CG2 VAL A 68 -9.033 -10.926 1.654 1.00 0.00 C ATOM 0 H VAL A 68 -7.796 -8.578 0.936 1.00 0.00 H new ATOM 0 HA VAL A 68 -10.521 -8.367 2.179 1.00 0.00 H new ATOM 0 HB VAL A 68 -8.309 -9.955 3.437 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -10.245 -11.387 4.049 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -10.538 -9.691 4.499 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -11.310 -10.373 3.048 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -8.863 -11.931 2.041 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -9.932 -10.922 1.037 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -8.178 -10.620 1.051 1.00 0.00 H new ATOM 955 N THR A 69 -9.688 -6.883 4.047 1.00 0.00 N ATOM 956 CA THR A 69 -9.175 -5.881 5.022 1.00 0.00 C ATOM 957 C THR A 69 -8.947 -6.562 6.373 1.00 0.00 C ATOM 958 O THR A 69 -9.877 -6.826 7.109 1.00 0.00 O ATOM 959 CB THR A 69 -10.201 -4.757 5.189 1.00 0.00 C ATOM 960 OG1 THR A 69 -10.827 -4.500 3.940 1.00 0.00 O ATOM 961 CG2 THR A 69 -9.499 -3.490 5.682 1.00 0.00 C ATOM 0 H THR A 69 -10.699 -7.017 4.055 1.00 0.00 H new ATOM 0 HA THR A 69 -8.236 -5.465 4.656 1.00 0.00 H new ATOM 0 HB THR A 69 -10.954 -5.058 5.918 1.00 0.00 H new ATOM 0 HG1 THR A 69 -11.799 -4.475 4.060 1.00 0.00 H new ATOM 0 HG21 THR A 69 -10.231 -2.691 5.800 1.00 0.00 H new ATOM 0 HG22 THR A 69 -9.021 -3.689 6.641 1.00 0.00 H new ATOM 0 HG23 THR A 69 -8.744 -3.186 4.956 1.00 0.00 H new ATOM 969 N LEU A 70 -7.719 -6.852 6.706 1.00 0.00 N ATOM 970 CA LEU A 70 -7.445 -7.518 8.011 1.00 0.00 C ATOM 971 C LEU A 70 -6.450 -6.680 8.820 1.00 0.00 C ATOM 972 O LEU A 70 -5.589 -7.205 9.499 1.00 0.00 O ATOM 973 CB LEU A 70 -6.863 -8.911 7.762 1.00 0.00 C ATOM 974 CG LEU A 70 -7.552 -9.923 8.677 1.00 0.00 C ATOM 975 CD1 LEU A 70 -9.065 -9.867 8.455 1.00 0.00 C ATOM 976 CD2 LEU A 70 -7.042 -11.329 8.356 1.00 0.00 C ATOM 0 H LEU A 70 -6.897 -6.658 6.134 1.00 0.00 H new ATOM 0 HA LEU A 70 -8.375 -7.610 8.572 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.003 -9.194 6.719 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.789 -8.907 7.950 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.329 -9.683 9.717 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -9.556 -10.589 9.108 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -9.429 -8.865 8.683 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -9.289 -10.107 7.416 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -7.533 -12.052 9.008 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.265 -11.568 7.316 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -5.964 -11.370 8.515 1.00 0.00 H new ATOM 988 N ARG A 71 -6.567 -5.382 8.760 1.00 0.00 N ATOM 989 CA ARG A 71 -5.633 -4.513 9.532 1.00 0.00 C ATOM 990 C ARG A 71 -5.861 -3.053 9.147 1.00 0.00 C ATOM 991 O ARG A 71 -4.934 -2.334 8.825 1.00 0.00 O ATOM 992 CB ARG A 71 -4.188 -4.903 9.222 1.00 0.00 C ATOM 993 CG ARG A 71 -3.465 -5.240 10.528 1.00 0.00 C ATOM 994 CD ARG A 71 -2.427 -6.333 10.271 1.00 0.00 C ATOM 995 NE ARG A 71 -2.710 -7.505 11.147 1.00 0.00 N ATOM 996 CZ ARG A 71 -2.166 -8.663 10.887 1.00 0.00 C ATOM 997 NH1 ARG A 71 -1.385 -8.802 9.848 1.00 0.00 N ATOM 998 NH2 ARG A 71 -2.404 -9.685 11.663 1.00 0.00 N ATOM 0 H ARG A 71 -7.268 -4.885 8.210 1.00 0.00 H new ATOM 0 HA ARG A 71 -5.819 -4.643 10.598 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.167 -5.760 8.549 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -3.680 -4.085 8.712 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -2.979 -4.350 10.927 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -4.183 -5.575 11.277 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -2.452 -6.634 9.224 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -1.425 -5.951 10.469 1.00 0.00 H new ATOM 0 HE ARG A 71 -3.330 -7.402 11.951 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -1.200 -8.005 9.239 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -0.961 -9.707 9.646 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -3.015 -9.579 12.473 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -1.979 -10.590 11.460 1.00 0.00 H new ATOM 1012 N ALA A 72 -7.084 -2.606 9.182 1.00 0.00 N ATOM 1013 CA ALA A 72 -7.369 -1.188 8.822 1.00 0.00 C ATOM 1014 C ALA A 72 -7.866 -0.447 10.062 1.00 0.00 C ATOM 1015 O ALA A 72 -8.547 0.554 9.972 1.00 0.00 O ATOM 1016 CB ALA A 72 -8.442 -1.141 7.733 1.00 0.00 C ATOM 0 H ALA A 72 -7.899 -3.160 9.444 1.00 0.00 H new ATOM 0 HA ALA A 72 -6.460 -0.714 8.451 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -8.649 -0.103 7.471 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -8.089 -1.674 6.851 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -9.354 -1.612 8.100 1.00 0.00 H new ATOM 1022 N ASP A 73 -7.530 -0.939 11.223 1.00 0.00 N ATOM 1023 CA ASP A 73 -7.982 -0.271 12.476 1.00 0.00 C ATOM 1024 C ASP A 73 -6.769 0.050 13.356 1.00 0.00 C ATOM 1025 O ASP A 73 -6.812 0.942 14.180 1.00 0.00 O ATOM 1026 CB ASP A 73 -8.930 -1.202 13.235 1.00 0.00 C ATOM 1027 CG ASP A 73 -9.898 -0.369 14.075 1.00 0.00 C ATOM 1028 OD1 ASP A 73 -10.378 0.633 13.572 1.00 0.00 O ATOM 1029 OD2 ASP A 73 -10.142 -0.748 15.209 1.00 0.00 O ATOM 0 H ASP A 73 -6.962 -1.775 11.358 1.00 0.00 H new ATOM 0 HA ASP A 73 -8.501 0.654 12.226 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -9.484 -1.825 12.533 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -8.360 -1.874 13.877 1.00 0.00 H new ATOM 1034 N ASP A 74 -5.687 -0.665 13.190 1.00 0.00 N ATOM 1035 CA ASP A 74 -4.479 -0.390 14.020 1.00 0.00 C ATOM 1036 C ASP A 74 -3.792 0.879 13.507 1.00 0.00 C ATOM 1037 O ASP A 74 -4.138 1.979 13.891 1.00 0.00 O ATOM 1038 CB ASP A 74 -3.512 -1.573 13.930 1.00 0.00 C ATOM 1039 CG ASP A 74 -3.898 -2.631 14.966 1.00 0.00 C ATOM 1040 OD1 ASP A 74 -4.707 -2.322 15.826 1.00 0.00 O ATOM 1041 OD2 ASP A 74 -3.380 -3.732 14.883 1.00 0.00 O ATOM 0 H ASP A 74 -5.588 -1.425 12.517 1.00 0.00 H new ATOM 0 HA ASP A 74 -4.775 -0.249 15.060 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -3.539 -2.003 12.929 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -2.490 -1.235 14.104 1.00 0.00 H new ATOM 1046 N ARG A 75 -2.827 0.739 12.637 1.00 0.00 N ATOM 1047 CA ARG A 75 -2.132 1.944 12.100 1.00 0.00 C ATOM 1048 C ARG A 75 -1.787 1.713 10.626 1.00 0.00 C ATOM 1049 O ARG A 75 -2.028 2.555 9.784 1.00 0.00 O ATOM 1050 CB ARG A 75 -0.844 2.231 12.888 1.00 0.00 C ATOM 1051 CG ARG A 75 -0.438 1.020 13.740 1.00 0.00 C ATOM 1052 CD ARG A 75 0.351 0.032 12.882 1.00 0.00 C ATOM 1053 NE ARG A 75 1.640 -0.281 13.560 1.00 0.00 N ATOM 1054 CZ ARG A 75 2.365 -1.288 13.157 1.00 0.00 C ATOM 1055 NH1 ARG A 75 1.978 -2.011 12.140 1.00 0.00 N ATOM 1056 NH2 ARG A 75 3.481 -1.570 13.772 1.00 0.00 N ATOM 0 H ARG A 75 -2.491 -0.154 12.277 1.00 0.00 H new ATOM 0 HA ARG A 75 -2.796 2.803 12.200 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -0.039 2.480 12.197 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -0.992 3.099 13.531 1.00 0.00 H new ATOM 0 HG2 ARG A 75 0.166 1.345 14.587 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -1.325 0.536 14.148 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -0.226 -0.880 12.732 1.00 0.00 H new ATOM 0 HD3 ARG A 75 0.538 0.456 11.896 1.00 0.00 H new ATOM 0 HE ARG A 75 1.957 0.293 14.341 1.00 0.00 H new ATOM 0 HH11 ARG A 75 1.107 -1.789 11.658 1.00 0.00 H new ATOM 0 HH12 ARG A 75 2.547 -2.798 11.827 1.00 0.00 H new ATOM 0 HH21 ARG A 75 3.784 -1.004 14.565 1.00 0.00 H new ATOM 0 HH22 ARG A 75 4.051 -2.356 13.460 1.00 0.00 H new ATOM 1070 N SER A 76 -1.234 0.574 10.306 1.00 0.00 N ATOM 1071 CA SER A 76 -0.887 0.289 8.885 1.00 0.00 C ATOM 1072 C SER A 76 -2.088 -0.370 8.208 1.00 0.00 C ATOM 1073 O SER A 76 -3.192 -0.328 8.712 1.00 0.00 O ATOM 1074 CB SER A 76 0.313 -0.658 8.824 1.00 0.00 C ATOM 1075 OG SER A 76 1.445 -0.021 9.403 1.00 0.00 O ATOM 0 H SER A 76 -1.008 -0.170 10.966 1.00 0.00 H new ATOM 0 HA SER A 76 -0.633 1.219 8.376 1.00 0.00 H new ATOM 0 HB2 SER A 76 0.089 -1.582 9.357 1.00 0.00 H new ATOM 0 HB3 SER A 76 0.524 -0.930 7.790 1.00 0.00 H new ATOM 0 HG SER A 76 2.235 -0.191 8.849 1.00 0.00 H new ATOM 1081 N ILE A 77 -1.892 -0.977 7.072 1.00 0.00 N ATOM 1082 CA ILE A 77 -3.041 -1.630 6.384 1.00 0.00 C ATOM 1083 C ILE A 77 -2.537 -2.709 5.420 1.00 0.00 C ATOM 1084 O ILE A 77 -2.732 -2.620 4.224 1.00 0.00 O ATOM 1085 CB ILE A 77 -3.832 -0.579 5.601 1.00 0.00 C ATOM 1086 CG1 ILE A 77 -4.479 0.411 6.575 1.00 0.00 C ATOM 1087 CG2 ILE A 77 -4.924 -1.273 4.785 1.00 0.00 C ATOM 1088 CD1 ILE A 77 -5.340 1.405 5.793 1.00 0.00 C ATOM 0 H ILE A 77 -0.995 -1.050 6.593 1.00 0.00 H new ATOM 0 HA ILE A 77 -3.684 -2.094 7.132 1.00 0.00 H new ATOM 0 HB ILE A 77 -3.158 -0.042 4.934 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -5.091 -0.124 7.301 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -3.710 0.942 7.136 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -5.490 -0.528 4.226 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -4.467 -1.978 4.090 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -5.595 -1.809 5.456 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -5.801 2.110 6.485 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -4.715 1.948 5.084 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -6.118 0.866 5.252 1.00 0.00 H new ATOM 1100 N TYR A 78 -1.911 -3.739 5.925 1.00 0.00 N ATOM 1101 CA TYR A 78 -1.426 -4.821 5.021 1.00 0.00 C ATOM 1102 C TYR A 78 -2.527 -5.877 4.896 1.00 0.00 C ATOM 1103 O TYR A 78 -3.256 -6.135 5.833 1.00 0.00 O ATOM 1104 CB TYR A 78 -0.166 -5.471 5.600 1.00 0.00 C ATOM 1105 CG TYR A 78 0.648 -4.450 6.363 1.00 0.00 C ATOM 1106 CD1 TYR A 78 1.419 -3.503 5.674 1.00 0.00 C ATOM 1107 CD2 TYR A 78 0.637 -4.459 7.763 1.00 0.00 C ATOM 1108 CE1 TYR A 78 2.178 -2.567 6.388 1.00 0.00 C ATOM 1109 CE2 TYR A 78 1.396 -3.523 8.475 1.00 0.00 C ATOM 1110 CZ TYR A 78 2.167 -2.578 7.788 1.00 0.00 C ATOM 1111 OH TYR A 78 2.917 -1.657 8.490 1.00 0.00 O ATOM 0 H TYR A 78 -1.716 -3.877 6.917 1.00 0.00 H new ATOM 0 HA TYR A 78 -1.186 -4.401 4.044 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -0.443 -6.292 6.261 1.00 0.00 H new ATOM 0 HB3 TYR A 78 0.434 -5.897 4.796 1.00 0.00 H new ATOM 0 HD1 TYR A 78 1.428 -3.495 4.594 1.00 0.00 H new ATOM 0 HD2 TYR A 78 0.043 -5.188 8.294 1.00 0.00 H new ATOM 0 HE1 TYR A 78 2.772 -1.837 5.858 1.00 0.00 H new ATOM 0 HE2 TYR A 78 1.387 -3.530 9.555 1.00 0.00 H new ATOM 0 HH TYR A 78 2.590 -1.604 9.412 1.00 0.00 H new ATOM 1121 N GLY A 79 -2.667 -6.487 3.750 1.00 0.00 N ATOM 1122 CA GLY A 79 -3.739 -7.512 3.591 1.00 0.00 C ATOM 1123 C GLY A 79 -3.233 -8.691 2.758 1.00 0.00 C ATOM 1124 O GLY A 79 -2.062 -8.795 2.450 1.00 0.00 O ATOM 0 H GLY A 79 -2.092 -6.322 2.924 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.063 -7.864 4.571 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -4.609 -7.065 3.109 1.00 0.00 H new ATOM 1128 N LYS A 80 -4.118 -9.578 2.391 1.00 0.00 N ATOM 1129 CA LYS A 80 -3.718 -10.758 1.575 1.00 0.00 C ATOM 1130 C LYS A 80 -4.894 -11.170 0.688 1.00 0.00 C ATOM 1131 O LYS A 80 -5.924 -10.528 0.673 1.00 0.00 O ATOM 1132 CB LYS A 80 -3.345 -11.918 2.500 1.00 0.00 C ATOM 1133 CG LYS A 80 -4.424 -12.082 3.573 1.00 0.00 C ATOM 1134 CD LYS A 80 -4.769 -13.565 3.729 1.00 0.00 C ATOM 1135 CE LYS A 80 -6.072 -13.868 2.987 1.00 0.00 C ATOM 1136 NZ LYS A 80 -6.309 -15.339 2.981 1.00 0.00 N ATOM 0 H LYS A 80 -5.110 -9.534 2.624 1.00 0.00 H new ATOM 0 HA LYS A 80 -2.859 -10.503 0.955 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -3.246 -12.839 1.925 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -2.378 -11.729 2.967 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -4.072 -11.678 4.522 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -5.315 -11.518 3.297 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -3.961 -14.181 3.333 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -4.873 -13.816 4.785 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -6.905 -13.357 3.469 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -6.017 -13.494 1.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -7.195 -15.546 2.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -5.518 -15.816 2.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -6.379 -15.683 3.960 1.00 0.00 H new ATOM 1150 N LYS A 81 -4.751 -12.234 -0.054 1.00 0.00 N ATOM 1151 CA LYS A 81 -5.868 -12.676 -0.936 1.00 0.00 C ATOM 1152 C LYS A 81 -5.441 -13.916 -1.723 1.00 0.00 C ATOM 1153 O LYS A 81 -5.825 -14.102 -2.861 1.00 0.00 O ATOM 1154 CB LYS A 81 -6.222 -11.550 -1.908 1.00 0.00 C ATOM 1155 CG LYS A 81 -7.679 -11.696 -2.350 1.00 0.00 C ATOM 1156 CD LYS A 81 -7.723 -12.211 -3.790 1.00 0.00 C ATOM 1157 CE LYS A 81 -8.604 -13.460 -3.859 1.00 0.00 C ATOM 1158 NZ LYS A 81 -9.300 -13.499 -5.175 1.00 0.00 N ATOM 0 H LYS A 81 -3.913 -12.814 -0.088 1.00 0.00 H new ATOM 0 HA LYS A 81 -6.738 -12.919 -0.326 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -6.071 -10.582 -1.430 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -5.563 -11.583 -2.775 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -8.204 -12.386 -1.689 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -8.190 -10.736 -2.280 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -8.116 -11.439 -4.452 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -6.716 -12.444 -4.135 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -7.996 -14.355 -3.729 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -9.333 -13.450 -3.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -9.900 -14.347 -5.225 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -9.891 -12.650 -5.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -8.596 -13.527 -5.940 1.00 0.00 H new ATOM 1172 N GLY A 82 -4.652 -14.768 -1.127 1.00 0.00 N ATOM 1173 CA GLY A 82 -4.207 -15.997 -1.842 1.00 0.00 C ATOM 1174 C GLY A 82 -3.388 -15.610 -3.075 1.00 0.00 C ATOM 1175 O GLY A 82 -3.928 -15.334 -4.127 1.00 0.00 O ATOM 0 H GLY A 82 -4.297 -14.666 -0.176 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -3.608 -16.619 -1.177 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -5.072 -16.589 -2.140 1.00 0.00 H new ATOM 1179 N SER A 83 -2.089 -15.592 -2.955 1.00 0.00 N ATOM 1180 CA SER A 83 -1.232 -15.225 -4.120 1.00 0.00 C ATOM 1181 C SER A 83 -1.379 -13.733 -4.421 1.00 0.00 C ATOM 1182 O SER A 83 -0.872 -13.239 -5.408 1.00 0.00 O ATOM 1183 CB SER A 83 -1.665 -16.030 -5.347 1.00 0.00 C ATOM 1184 OG SER A 83 -2.473 -17.124 -4.934 1.00 0.00 O ATOM 0 H SER A 83 -1.582 -15.816 -2.099 1.00 0.00 H new ATOM 0 HA SER A 83 -0.192 -15.447 -3.882 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.220 -15.393 -6.036 1.00 0.00 H new ATOM 0 HB3 SER A 83 -0.789 -16.393 -5.885 1.00 0.00 H new ATOM 0 HG SER A 83 -3.412 -16.844 -4.902 1.00 0.00 H new ATOM 1190 N ALA A 84 -2.073 -13.011 -3.586 1.00 0.00 N ATOM 1191 CA ALA A 84 -2.250 -11.553 -3.835 1.00 0.00 C ATOM 1192 C ALA A 84 -2.403 -10.818 -2.502 1.00 0.00 C ATOM 1193 O ALA A 84 -3.197 -11.192 -1.665 1.00 0.00 O ATOM 1194 CB ALA A 84 -3.502 -11.335 -4.688 1.00 0.00 C ATOM 0 H ALA A 84 -2.525 -13.367 -2.743 1.00 0.00 H new ATOM 0 HA ALA A 84 -1.378 -11.164 -4.360 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -3.635 -10.269 -4.873 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -3.390 -11.857 -5.638 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -4.373 -11.724 -4.161 1.00 0.00 H new ATOM 1200 N GLY A 85 -1.651 -9.771 -2.300 1.00 0.00 N ATOM 1201 CA GLY A 85 -1.757 -9.010 -1.022 1.00 0.00 C ATOM 1202 C GLY A 85 -1.408 -7.543 -1.278 1.00 0.00 C ATOM 1203 O GLY A 85 -1.016 -7.173 -2.368 1.00 0.00 O ATOM 0 H GLY A 85 -0.967 -9.409 -2.965 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -2.767 -9.091 -0.620 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -1.082 -9.432 -0.277 1.00 0.00 H new ATOM 1207 N VAL A 86 -1.548 -6.703 -0.289 1.00 0.00 N ATOM 1208 CA VAL A 86 -1.223 -5.264 -0.494 1.00 0.00 C ATOM 1209 C VAL A 86 -0.693 -4.652 0.808 1.00 0.00 C ATOM 1210 O VAL A 86 -1.402 -4.538 1.789 1.00 0.00 O ATOM 1211 CB VAL A 86 -2.487 -4.521 -0.935 1.00 0.00 C ATOM 1212 CG1 VAL A 86 -3.471 -4.445 0.233 1.00 0.00 C ATOM 1213 CG2 VAL A 86 -2.116 -3.106 -1.387 1.00 0.00 C ATOM 0 H VAL A 86 -1.871 -6.949 0.647 1.00 0.00 H new ATOM 0 HA VAL A 86 -0.455 -5.174 -1.263 1.00 0.00 H new ATOM 0 HB VAL A 86 -2.952 -5.056 -1.763 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.370 -3.916 -0.083 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.736 -5.453 0.552 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.009 -3.912 1.064 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -3.016 -2.577 -1.701 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.650 -2.570 -0.560 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.418 -3.162 -2.222 1.00 0.00 H new ATOM 1223 N ILE A 87 0.551 -4.253 0.824 1.00 0.00 N ATOM 1224 CA ILE A 87 1.128 -3.642 2.059 1.00 0.00 C ATOM 1225 C ILE A 87 0.925 -2.127 2.013 1.00 0.00 C ATOM 1226 O ILE A 87 1.828 -1.382 1.687 1.00 0.00 O ATOM 1227 CB ILE A 87 2.624 -3.958 2.124 1.00 0.00 C ATOM 1228 CG1 ILE A 87 2.810 -5.446 2.419 1.00 0.00 C ATOM 1229 CG2 ILE A 87 3.288 -3.130 3.228 1.00 0.00 C ATOM 1230 CD1 ILE A 87 3.989 -5.984 1.608 1.00 0.00 C ATOM 0 H ILE A 87 1.194 -4.323 0.035 1.00 0.00 H new ATOM 0 HA ILE A 87 0.632 -4.048 2.940 1.00 0.00 H new ATOM 0 HB ILE A 87 3.087 -3.710 1.169 1.00 0.00 H new ATOM 0 HG12 ILE A 87 2.988 -5.597 3.484 1.00 0.00 H new ATOM 0 HG13 ILE A 87 1.902 -5.994 2.167 1.00 0.00 H new ATOM 0 HG21 ILE A 87 4.352 -3.362 3.266 1.00 0.00 H new ATOM 0 HG22 ILE A 87 3.155 -2.069 3.017 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.830 -3.369 4.188 1.00 0.00 H new ATOM 0 HD11 ILE A 87 4.121 -7.045 1.819 1.00 0.00 H new ATOM 0 HD12 ILE A 87 3.792 -5.847 0.545 1.00 0.00 H new ATOM 0 HD13 ILE A 87 4.895 -5.444 1.882 1.00 0.00 H new ATOM 1242 N THR A 88 -0.253 -1.663 2.331 1.00 0.00 N ATOM 1243 CA THR A 88 -0.506 -0.196 2.295 1.00 0.00 C ATOM 1244 C THR A 88 -0.562 0.363 3.717 1.00 0.00 C ATOM 1245 O THR A 88 -1.093 -0.250 4.620 1.00 0.00 O ATOM 1246 CB THR A 88 -1.843 0.080 1.599 1.00 0.00 C ATOM 1247 OG1 THR A 88 -2.883 0.081 2.567 1.00 0.00 O ATOM 1248 CG2 THR A 88 -2.117 -1.000 0.552 1.00 0.00 C ATOM 0 H THR A 88 -1.049 -2.235 2.613 1.00 0.00 H new ATOM 0 HA THR A 88 0.304 0.286 1.747 1.00 0.00 H new ATOM 0 HB THR A 88 -1.801 1.051 1.105 1.00 0.00 H new ATOM 0 HG1 THR A 88 -3.740 0.259 2.126 1.00 0.00 H new ATOM 0 HG21 THR A 88 -3.069 -0.798 0.061 1.00 0.00 H new ATOM 0 HG22 THR A 88 -1.319 -0.998 -0.190 1.00 0.00 H new ATOM 0 HG23 THR A 88 -2.159 -1.975 1.037 1.00 0.00 H new ATOM 1256 N VAL A 89 -0.028 1.537 3.912 1.00 0.00 N ATOM 1257 CA VAL A 89 -0.056 2.162 5.265 1.00 0.00 C ATOM 1258 C VAL A 89 -0.077 3.687 5.095 1.00 0.00 C ATOM 1259 O VAL A 89 -0.104 4.188 3.989 1.00 0.00 O ATOM 1260 CB VAL A 89 1.175 1.711 6.076 1.00 0.00 C ATOM 1261 CG1 VAL A 89 1.622 0.327 5.600 1.00 0.00 C ATOM 1262 CG2 VAL A 89 2.333 2.696 5.894 1.00 0.00 C ATOM 0 H VAL A 89 0.429 2.093 3.189 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.946 1.850 5.811 1.00 0.00 H new ATOM 0 HB VAL A 89 0.899 1.676 7.130 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.492 0.009 6.174 1.00 0.00 H new ATOM 0 HG12 VAL A 89 0.811 -0.387 5.745 1.00 0.00 H new ATOM 0 HG13 VAL A 89 1.881 0.372 4.542 1.00 0.00 H new ATOM 0 HG21 VAL A 89 3.192 2.359 6.475 1.00 0.00 H new ATOM 0 HG22 VAL A 89 2.605 2.747 4.840 1.00 0.00 H new ATOM 0 HG23 VAL A 89 2.028 3.684 6.238 1.00 0.00 H new ATOM 1272 N LYS A 90 -0.065 4.432 6.169 1.00 0.00 N ATOM 1273 CA LYS A 90 -0.084 5.919 6.034 1.00 0.00 C ATOM 1274 C LYS A 90 1.225 6.520 6.551 1.00 0.00 C ATOM 1275 O LYS A 90 1.292 7.028 7.652 1.00 0.00 O ATOM 1276 CB LYS A 90 -1.258 6.502 6.826 1.00 0.00 C ATOM 1277 CG LYS A 90 -2.159 7.299 5.879 1.00 0.00 C ATOM 1278 CD LYS A 90 -2.735 8.513 6.616 1.00 0.00 C ATOM 1279 CE LYS A 90 -3.468 8.048 7.876 1.00 0.00 C ATOM 1280 NZ LYS A 90 -3.052 8.893 9.031 1.00 0.00 N ATOM 0 H LYS A 90 -0.043 4.080 7.126 1.00 0.00 H new ATOM 0 HA LYS A 90 -0.197 6.167 4.979 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -1.826 5.701 7.299 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -0.889 7.146 7.624 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -1.590 7.626 5.009 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -2.967 6.667 5.512 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.934 9.203 6.883 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -3.420 9.056 5.964 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -4.546 8.118 7.730 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -3.241 7.001 8.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -3.549 8.578 9.888 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -2.026 8.805 9.174 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -3.290 9.887 8.838 1.00 0.00 H new ATOM 1294 N THR A 91 2.261 6.490 5.755 1.00 0.00 N ATOM 1295 CA THR A 91 3.553 7.087 6.197 1.00 0.00 C ATOM 1296 C THR A 91 3.675 8.483 5.599 1.00 0.00 C ATOM 1297 O THR A 91 3.189 8.744 4.521 1.00 0.00 O ATOM 1298 CB THR A 91 4.729 6.245 5.711 1.00 0.00 C ATOM 1299 OG1 THR A 91 4.562 5.950 4.330 1.00 0.00 O ATOM 1300 CG2 THR A 91 4.801 4.944 6.507 1.00 0.00 C ATOM 0 H THR A 91 2.268 6.079 4.821 1.00 0.00 H new ATOM 0 HA THR A 91 3.570 7.126 7.286 1.00 0.00 H new ATOM 0 HB THR A 91 5.654 6.803 5.855 1.00 0.00 H new ATOM 0 HG1 THR A 91 5.318 6.314 3.824 1.00 0.00 H new ATOM 0 HG21 THR A 91 5.643 4.348 6.155 1.00 0.00 H new ATOM 0 HG22 THR A 91 4.935 5.171 7.565 1.00 0.00 H new ATOM 0 HG23 THR A 91 3.877 4.383 6.371 1.00 0.00 H new ATOM 1308 N SER A 92 4.326 9.379 6.283 1.00 0.00 N ATOM 1309 CA SER A 92 4.479 10.765 5.748 1.00 0.00 C ATOM 1310 C SER A 92 3.104 11.315 5.327 1.00 0.00 C ATOM 1311 O SER A 92 3.005 12.238 4.544 1.00 0.00 O ATOM 1312 CB SER A 92 5.430 10.736 4.544 1.00 0.00 C ATOM 1313 OG SER A 92 4.971 11.634 3.544 1.00 0.00 O ATOM 0 H SER A 92 4.761 9.215 7.191 1.00 0.00 H new ATOM 0 HA SER A 92 4.893 11.415 6.519 1.00 0.00 H new ATOM 0 HB2 SER A 92 6.437 11.011 4.858 1.00 0.00 H new ATOM 0 HB3 SER A 92 5.488 9.726 4.139 1.00 0.00 H new ATOM 0 HG SER A 92 5.661 12.307 3.367 1.00 0.00 H new ATOM 1319 N LYS A 93 2.043 10.741 5.843 1.00 0.00 N ATOM 1320 CA LYS A 93 0.661 11.201 5.494 1.00 0.00 C ATOM 1321 C LYS A 93 0.219 10.585 4.162 1.00 0.00 C ATOM 1322 O LYS A 93 -0.955 10.530 3.854 1.00 0.00 O ATOM 1323 CB LYS A 93 0.605 12.732 5.412 1.00 0.00 C ATOM 1324 CG LYS A 93 -0.422 13.247 6.422 1.00 0.00 C ATOM 1325 CD LYS A 93 -0.387 14.776 6.462 1.00 0.00 C ATOM 1326 CE LYS A 93 -1.004 15.268 7.774 1.00 0.00 C ATOM 1327 NZ LYS A 93 -2.457 15.529 7.570 1.00 0.00 N ATOM 0 H LYS A 93 2.077 9.962 6.501 1.00 0.00 H new ATOM 0 HA LYS A 93 -0.020 10.872 6.279 1.00 0.00 H new ATOM 0 HB2 LYS A 93 1.586 13.157 5.623 1.00 0.00 H new ATOM 0 HB3 LYS A 93 0.332 13.045 4.404 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.419 12.904 6.147 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -0.207 12.843 7.411 1.00 0.00 H new ATOM 0 HD2 LYS A 93 0.641 15.129 6.376 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -0.936 15.185 5.614 1.00 0.00 H new ATOM 0 HE2 LYS A 93 -0.863 14.523 8.557 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -0.503 16.177 8.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 -2.878 15.863 8.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -2.580 16.255 6.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 -2.929 14.651 7.272 1.00 0.00 H new ATOM 1341 N SER A 94 1.145 10.113 3.378 1.00 0.00 N ATOM 1342 CA SER A 94 0.776 9.488 2.075 1.00 0.00 C ATOM 1343 C SER A 94 0.357 8.035 2.314 1.00 0.00 C ATOM 1344 O SER A 94 0.370 7.553 3.429 1.00 0.00 O ATOM 1345 CB SER A 94 1.976 9.527 1.128 1.00 0.00 C ATOM 1346 OG SER A 94 2.696 8.306 1.228 1.00 0.00 O ATOM 0 H SER A 94 2.144 10.132 3.582 1.00 0.00 H new ATOM 0 HA SER A 94 -0.051 10.038 1.627 1.00 0.00 H new ATOM 0 HB2 SER A 94 1.639 9.680 0.103 1.00 0.00 H new ATOM 0 HB3 SER A 94 2.625 10.366 1.379 1.00 0.00 H new ATOM 0 HG SER A 94 3.465 8.329 0.621 1.00 0.00 H new ATOM 1352 N ILE A 95 -0.022 7.334 1.280 1.00 0.00 N ATOM 1353 CA ILE A 95 -0.448 5.921 1.467 1.00 0.00 C ATOM 1354 C ILE A 95 0.265 5.018 0.457 1.00 0.00 C ATOM 1355 O ILE A 95 -0.105 4.948 -0.699 1.00 0.00 O ATOM 1356 CB ILE A 95 -1.962 5.827 1.268 1.00 0.00 C ATOM 1357 CG1 ILE A 95 -2.655 6.817 2.207 1.00 0.00 C ATOM 1358 CG2 ILE A 95 -2.435 4.407 1.588 1.00 0.00 C ATOM 1359 CD1 ILE A 95 -3.769 7.545 1.454 1.00 0.00 C ATOM 0 H ILE A 95 -0.055 7.677 0.320 1.00 0.00 H new ATOM 0 HA ILE A 95 -0.187 5.593 2.473 1.00 0.00 H new ATOM 0 HB ILE A 95 -2.209 6.065 0.234 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.068 6.290 3.067 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -1.932 7.536 2.591 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -3.514 4.342 1.446 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -1.938 3.700 0.924 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -2.190 4.167 2.623 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -4.261 8.249 2.124 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -3.344 8.086 0.608 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -4.497 6.820 1.092 1.00 0.00 H new ATOM 1371 N LEU A 96 1.282 4.319 0.888 1.00 0.00 N ATOM 1372 CA LEU A 96 2.014 3.413 -0.044 1.00 0.00 C ATOM 1373 C LEU A 96 1.127 2.206 -0.354 1.00 0.00 C ATOM 1374 O LEU A 96 0.220 1.887 0.392 1.00 0.00 O ATOM 1375 CB LEU A 96 3.318 2.945 0.608 1.00 0.00 C ATOM 1376 CG LEU A 96 3.048 2.510 2.049 1.00 0.00 C ATOM 1377 CD1 LEU A 96 3.872 1.260 2.370 1.00 0.00 C ATOM 1378 CD2 LEU A 96 3.444 3.640 3.003 1.00 0.00 C ATOM 0 H LEU A 96 1.637 4.337 1.844 1.00 0.00 H new ATOM 0 HA LEU A 96 2.252 3.943 -0.966 1.00 0.00 H new ATOM 0 HB2 LEU A 96 3.742 2.116 0.041 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.053 3.750 0.593 1.00 0.00 H new ATOM 0 HG LEU A 96 1.988 2.285 2.168 1.00 0.00 H new ATOM 0 HD11 LEU A 96 3.679 0.951 3.397 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.592 0.455 1.690 1.00 0.00 H new ATOM 0 HD13 LEU A 96 4.932 1.483 2.251 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.252 3.332 4.031 1.00 0.00 H new ATOM 0 HD22 LEU A 96 4.504 3.863 2.883 1.00 0.00 H new ATOM 0 HD23 LEU A 96 2.858 4.530 2.776 1.00 0.00 H new ATOM 1390 N VAL A 97 1.368 1.537 -1.453 1.00 0.00 N ATOM 1391 CA VAL A 97 0.517 0.364 -1.804 1.00 0.00 C ATOM 1392 C VAL A 97 1.375 -0.833 -2.201 1.00 0.00 C ATOM 1393 O VAL A 97 1.362 -1.254 -3.341 1.00 0.00 O ATOM 1394 CB VAL A 97 -0.379 0.714 -2.990 1.00 0.00 C ATOM 1395 CG1 VAL A 97 -1.455 -0.363 -3.146 1.00 0.00 C ATOM 1396 CG2 VAL A 97 -1.047 2.065 -2.750 1.00 0.00 C ATOM 0 H VAL A 97 2.112 1.751 -2.117 1.00 0.00 H new ATOM 0 HA VAL A 97 -0.080 0.111 -0.928 1.00 0.00 H new ATOM 0 HB VAL A 97 0.224 0.766 -3.896 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -2.097 -0.116 -3.992 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.981 -1.329 -3.320 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -2.055 -0.412 -2.237 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -1.685 2.311 -3.599 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.651 2.017 -1.844 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -0.283 2.834 -2.636 1.00 0.00 H new ATOM 1406 N GLY A 98 2.099 -1.413 -1.285 1.00 0.00 N ATOM 1407 CA GLY A 98 2.909 -2.604 -1.655 1.00 0.00 C ATOM 1408 C GLY A 98 1.997 -3.554 -2.430 1.00 0.00 C ATOM 1409 O GLY A 98 0.904 -3.852 -2.001 1.00 0.00 O ATOM 0 H GLY A 98 2.164 -1.119 -0.311 1.00 0.00 H new ATOM 0 HA2 GLY A 98 3.765 -2.312 -2.263 1.00 0.00 H new ATOM 0 HA3 GLY A 98 3.303 -3.092 -0.764 1.00 0.00 H new ATOM 1413 N VAL A 99 2.410 -4.015 -3.574 1.00 0.00 N ATOM 1414 CA VAL A 99 1.526 -4.919 -4.356 1.00 0.00 C ATOM 1415 C VAL A 99 2.343 -6.134 -4.811 1.00 0.00 C ATOM 1416 O VAL A 99 3.173 -6.042 -5.697 1.00 0.00 O ATOM 1417 CB VAL A 99 0.935 -4.175 -5.577 1.00 0.00 C ATOM 1418 CG1 VAL A 99 -0.583 -4.364 -5.601 1.00 0.00 C ATOM 1419 CG2 VAL A 99 1.218 -2.662 -5.509 1.00 0.00 C ATOM 0 H VAL A 99 3.314 -3.808 -3.999 1.00 0.00 H new ATOM 0 HA VAL A 99 0.695 -5.249 -3.732 1.00 0.00 H new ATOM 0 HB VAL A 99 1.402 -4.588 -6.471 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -1.001 -3.840 -6.461 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.816 -5.426 -5.674 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -1.014 -3.960 -4.685 1.00 0.00 H new ATOM 0 HG21 VAL A 99 0.788 -2.172 -6.383 1.00 0.00 H new ATOM 0 HG22 VAL A 99 0.771 -2.249 -4.605 1.00 0.00 H new ATOM 0 HG23 VAL A 99 2.295 -2.494 -5.491 1.00 0.00 H new ATOM 1429 N TYR A 100 2.125 -7.270 -4.196 1.00 0.00 N ATOM 1430 CA TYR A 100 2.897 -8.492 -4.572 1.00 0.00 C ATOM 1431 C TYR A 100 1.936 -9.609 -4.984 1.00 0.00 C ATOM 1432 O TYR A 100 0.753 -9.555 -4.715 1.00 0.00 O ATOM 1433 CB TYR A 100 3.723 -8.963 -3.371 1.00 0.00 C ATOM 1434 CG TYR A 100 2.841 -9.013 -2.144 1.00 0.00 C ATOM 1435 CD1 TYR A 100 2.678 -7.872 -1.351 1.00 0.00 C ATOM 1436 CD2 TYR A 100 2.185 -10.201 -1.801 1.00 0.00 C ATOM 1437 CE1 TYR A 100 1.862 -7.918 -0.215 1.00 0.00 C ATOM 1438 CE2 TYR A 100 1.367 -10.248 -0.664 1.00 0.00 C ATOM 1439 CZ TYR A 100 1.207 -9.105 0.128 1.00 0.00 C ATOM 1440 OH TYR A 100 0.401 -9.150 1.249 1.00 0.00 O ATOM 0 H TYR A 100 1.444 -7.403 -3.448 1.00 0.00 H new ATOM 0 HA TYR A 100 3.556 -8.253 -5.406 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.145 -9.948 -3.570 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.560 -8.286 -3.203 1.00 0.00 H new ATOM 0 HD1 TYR A 100 3.183 -6.955 -1.616 1.00 0.00 H new ATOM 0 HD2 TYR A 100 2.309 -11.082 -2.413 1.00 0.00 H new ATOM 0 HE1 TYR A 100 1.738 -7.037 0.397 1.00 0.00 H new ATOM 0 HE2 TYR A 100 0.861 -11.165 -0.399 1.00 0.00 H new ATOM 0 HH TYR A 100 -0.111 -8.317 1.317 1.00 0.00 H new ATOM 1450 N ASN A 101 2.442 -10.625 -5.628 1.00 0.00 N ATOM 1451 CA ASN A 101 1.568 -11.754 -6.053 1.00 0.00 C ATOM 1452 C ASN A 101 2.391 -13.044 -6.093 1.00 0.00 C ATOM 1453 O ASN A 101 3.477 -13.117 -5.550 1.00 0.00 O ATOM 1454 CB ASN A 101 1.002 -11.464 -7.444 1.00 0.00 C ATOM 1455 CG ASN A 101 0.757 -9.961 -7.593 1.00 0.00 C ATOM 1456 OD1 ASN A 101 1.652 -9.219 -7.945 1.00 0.00 O ATOM 1457 ND2 ASN A 101 -0.427 -9.478 -7.336 1.00 0.00 N ATOM 0 H ASN A 101 3.426 -10.722 -5.879 1.00 0.00 H new ATOM 0 HA ASN A 101 0.747 -11.868 -5.345 1.00 0.00 H new ATOM 0 HB2 ASN A 101 1.697 -11.807 -8.210 1.00 0.00 H new ATOM 0 HB3 ASN A 101 0.071 -12.011 -7.591 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -0.601 -8.477 -7.431 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -1.179 -10.101 -7.040 1.00 0.00 H new ATOM 1464 N GLU A 102 1.886 -14.059 -6.738 1.00 0.00 N ATOM 1465 CA GLU A 102 2.641 -15.341 -6.819 1.00 0.00 C ATOM 1466 C GLU A 102 2.850 -15.904 -5.412 1.00 0.00 C ATOM 1467 O GLU A 102 3.713 -16.730 -5.185 1.00 0.00 O ATOM 1468 CB GLU A 102 4.002 -15.090 -7.472 1.00 0.00 C ATOM 1469 CG GLU A 102 3.851 -15.110 -8.994 1.00 0.00 C ATOM 1470 CD GLU A 102 4.598 -13.918 -9.596 1.00 0.00 C ATOM 1471 OE1 GLU A 102 4.473 -12.831 -9.055 1.00 0.00 O ATOM 1472 OE2 GLU A 102 5.282 -14.112 -10.587 1.00 0.00 O ATOM 0 H GLU A 102 0.983 -14.056 -7.213 1.00 0.00 H new ATOM 0 HA GLU A 102 2.075 -16.056 -7.416 1.00 0.00 H new ATOM 0 HB2 GLU A 102 4.400 -14.128 -7.148 1.00 0.00 H new ATOM 0 HB3 GLU A 102 4.714 -15.852 -7.157 1.00 0.00 H new ATOM 0 HG2 GLU A 102 4.247 -16.042 -9.397 1.00 0.00 H new ATOM 0 HG3 GLU A 102 2.796 -15.067 -9.266 1.00 0.00 H new ATOM 1479 N LYS A 103 2.071 -15.464 -4.462 1.00 0.00 N ATOM 1480 CA LYS A 103 2.232 -15.976 -3.072 1.00 0.00 C ATOM 1481 C LYS A 103 3.642 -15.651 -2.571 1.00 0.00 C ATOM 1482 O LYS A 103 4.427 -16.531 -2.282 1.00 0.00 O ATOM 1483 CB LYS A 103 2.023 -17.490 -3.060 1.00 0.00 C ATOM 1484 CG LYS A 103 0.844 -17.834 -2.148 1.00 0.00 C ATOM 1485 CD LYS A 103 0.352 -19.250 -2.459 1.00 0.00 C ATOM 1486 CE LYS A 103 -0.396 -19.807 -1.248 1.00 0.00 C ATOM 1487 NZ LYS A 103 -0.455 -21.292 -1.340 1.00 0.00 N ATOM 0 H LYS A 103 1.331 -14.773 -4.588 1.00 0.00 H new ATOM 0 HA LYS A 103 1.496 -15.503 -2.421 1.00 0.00 H new ATOM 0 HB2 LYS A 103 1.832 -17.850 -4.071 1.00 0.00 H new ATOM 0 HB3 LYS A 103 2.926 -17.990 -2.709 1.00 0.00 H new ATOM 0 HG2 LYS A 103 1.147 -17.764 -1.103 1.00 0.00 H new ATOM 0 HG3 LYS A 103 0.036 -17.117 -2.294 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -0.304 -19.236 -3.330 1.00 0.00 H new ATOM 0 HD3 LYS A 103 1.196 -19.894 -2.706 1.00 0.00 H new ATOM 0 HE2 LYS A 103 0.107 -19.509 -0.328 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -1.404 -19.394 -1.209 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -0.964 -21.671 -0.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -0.953 -21.566 -2.211 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 0.511 -21.677 -1.358 1.00 0.00 H new ATOM 1501 N ILE A 104 3.969 -14.392 -2.467 1.00 0.00 N ATOM 1502 CA ILE A 104 5.326 -14.010 -1.986 1.00 0.00 C ATOM 1503 C ILE A 104 5.417 -14.260 -0.475 1.00 0.00 C ATOM 1504 O ILE A 104 4.635 -13.745 0.300 1.00 0.00 O ATOM 1505 CB ILE A 104 5.574 -12.528 -2.306 1.00 0.00 C ATOM 1506 CG1 ILE A 104 6.048 -12.402 -3.757 1.00 0.00 C ATOM 1507 CG2 ILE A 104 6.645 -11.950 -1.377 1.00 0.00 C ATOM 1508 CD1 ILE A 104 6.402 -10.943 -4.053 1.00 0.00 C ATOM 0 H ILE A 104 3.354 -13.611 -2.695 1.00 0.00 H new ATOM 0 HA ILE A 104 6.086 -14.610 -2.486 1.00 0.00 H new ATOM 0 HB ILE A 104 4.646 -11.975 -2.161 1.00 0.00 H new ATOM 0 HG12 ILE A 104 6.917 -13.039 -3.924 1.00 0.00 H new ATOM 0 HG13 ILE A 104 5.267 -12.743 -4.437 1.00 0.00 H new ATOM 0 HG21 ILE A 104 6.807 -10.900 -1.618 1.00 0.00 H new ATOM 0 HG22 ILE A 104 6.315 -12.038 -0.342 1.00 0.00 H new ATOM 0 HG23 ILE A 104 7.576 -12.501 -1.508 1.00 0.00 H new ATOM 0 HD11 ILE A 104 6.739 -10.853 -5.086 1.00 0.00 H new ATOM 0 HD12 ILE A 104 5.522 -10.317 -3.903 1.00 0.00 H new ATOM 0 HD13 ILE A 104 7.197 -10.618 -3.382 1.00 0.00 H new ATOM 1520 N GLN A 105 6.366 -15.055 -0.058 1.00 0.00 N ATOM 1521 CA GLN A 105 6.515 -15.355 1.395 1.00 0.00 C ATOM 1522 C GLN A 105 6.385 -14.062 2.214 1.00 0.00 C ATOM 1523 O GLN A 105 7.299 -13.263 2.249 1.00 0.00 O ATOM 1524 CB GLN A 105 7.893 -15.971 1.643 1.00 0.00 C ATOM 1525 CG GLN A 105 7.751 -17.482 1.818 1.00 0.00 C ATOM 1526 CD GLN A 105 6.850 -17.774 3.019 1.00 0.00 C ATOM 1527 OE1 GLN A 105 6.564 -16.895 3.807 1.00 0.00 O ATOM 1528 NE2 GLN A 105 6.387 -18.982 3.194 1.00 0.00 N ATOM 0 H GLN A 105 7.047 -15.511 -0.665 1.00 0.00 H new ATOM 0 HA GLN A 105 5.735 -16.053 1.699 1.00 0.00 H new ATOM 0 HB2 GLN A 105 8.557 -15.752 0.807 1.00 0.00 H new ATOM 0 HB3 GLN A 105 8.345 -15.532 2.532 1.00 0.00 H new ATOM 0 HG2 GLN A 105 7.328 -17.925 0.916 1.00 0.00 H new ATOM 0 HG3 GLN A 105 8.731 -17.935 1.966 1.00 0.00 H new ATOM 0 HE21 GLN A 105 6.627 -19.721 2.533 1.00 0.00 H new ATOM 0 HE22 GLN A 105 5.786 -19.187 3.992 1.00 0.00 H new ATOM 1537 N PRO A 106 5.253 -13.898 2.858 1.00 0.00 N ATOM 1538 CA PRO A 106 4.992 -12.710 3.692 1.00 0.00 C ATOM 1539 C PRO A 106 5.995 -12.645 4.847 1.00 0.00 C ATOM 1540 O PRO A 106 6.765 -13.561 5.065 1.00 0.00 O ATOM 1541 CB PRO A 106 3.568 -12.912 4.229 1.00 0.00 C ATOM 1542 CG PRO A 106 3.032 -14.248 3.656 1.00 0.00 C ATOM 1543 CD PRO A 106 4.148 -14.872 2.804 1.00 0.00 C ATOM 0 HA PRO A 106 5.091 -11.780 3.132 1.00 0.00 H new ATOM 0 HB2 PRO A 106 3.570 -12.937 5.319 1.00 0.00 H new ATOM 0 HB3 PRO A 106 2.926 -12.083 3.931 1.00 0.00 H new ATOM 0 HG2 PRO A 106 2.744 -14.922 4.463 1.00 0.00 H new ATOM 0 HG3 PRO A 106 2.141 -14.075 3.052 1.00 0.00 H new ATOM 0 HD2 PRO A 106 4.454 -15.840 3.201 1.00 0.00 H new ATOM 0 HD3 PRO A 106 3.817 -15.038 1.779 1.00 0.00 H new ATOM 1551 N GLY A 107 5.988 -11.574 5.594 1.00 0.00 N ATOM 1552 CA GLY A 107 6.937 -11.455 6.737 1.00 0.00 C ATOM 1553 C GLY A 107 8.254 -10.849 6.251 1.00 0.00 C ATOM 1554 O GLY A 107 9.033 -10.329 7.025 1.00 0.00 O ATOM 0 H GLY A 107 5.366 -10.777 5.462 1.00 0.00 H new ATOM 0 HA2 GLY A 107 6.504 -10.830 7.518 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.117 -12.436 7.177 1.00 0.00 H new ATOM 1558 N THR A 108 8.510 -10.909 4.972 1.00 0.00 N ATOM 1559 CA THR A 108 9.778 -10.334 4.441 1.00 0.00 C ATOM 1560 C THR A 108 9.471 -9.029 3.704 1.00 0.00 C ATOM 1561 O THR A 108 10.143 -8.032 3.882 1.00 0.00 O ATOM 1562 CB THR A 108 10.423 -11.327 3.472 1.00 0.00 C ATOM 1563 OG1 THR A 108 10.943 -12.427 4.205 1.00 0.00 O ATOM 1564 CG2 THR A 108 11.555 -10.638 2.711 1.00 0.00 C ATOM 0 H THR A 108 7.897 -11.330 4.274 1.00 0.00 H new ATOM 0 HA THR A 108 10.463 -10.136 5.266 1.00 0.00 H new ATOM 0 HB THR A 108 9.676 -11.682 2.762 1.00 0.00 H new ATOM 0 HG1 THR A 108 11.356 -13.066 3.587 1.00 0.00 H new ATOM 0 HG21 THR A 108 12.014 -11.346 2.021 1.00 0.00 H new ATOM 0 HG22 THR A 108 11.155 -9.793 2.151 1.00 0.00 H new ATOM 0 HG23 THR A 108 12.305 -10.283 3.418 1.00 0.00 H new ATOM 1572 N ALA A 109 8.459 -9.027 2.880 1.00 0.00 N ATOM 1573 CA ALA A 109 8.109 -7.785 2.136 1.00 0.00 C ATOM 1574 C ALA A 109 7.459 -6.789 3.098 1.00 0.00 C ATOM 1575 O ALA A 109 7.757 -5.611 3.083 1.00 0.00 O ATOM 1576 CB ALA A 109 7.132 -8.123 1.011 1.00 0.00 C ATOM 0 H ALA A 109 7.860 -9.831 2.690 1.00 0.00 H new ATOM 0 HA ALA A 109 9.011 -7.346 1.710 1.00 0.00 H new ATOM 0 HB1 ALA A 109 6.876 -7.214 0.466 1.00 0.00 H new ATOM 0 HB2 ALA A 109 7.595 -8.836 0.329 1.00 0.00 H new ATOM 0 HB3 ALA A 109 6.227 -8.560 1.434 1.00 0.00 H new ATOM 1582 N ALA A 110 6.574 -7.253 3.937 1.00 0.00 N ATOM 1583 CA ALA A 110 5.911 -6.333 4.904 1.00 0.00 C ATOM 1584 C ALA A 110 6.945 -5.841 5.918 1.00 0.00 C ATOM 1585 O ALA A 110 6.856 -4.741 6.427 1.00 0.00 O ATOM 1586 CB ALA A 110 4.793 -7.078 5.635 1.00 0.00 C ATOM 0 H ALA A 110 6.282 -8.228 3.995 1.00 0.00 H new ATOM 0 HA ALA A 110 5.487 -5.483 4.369 1.00 0.00 H new ATOM 0 HB1 ALA A 110 4.309 -6.404 6.342 1.00 0.00 H new ATOM 0 HB2 ALA A 110 4.059 -7.434 4.912 1.00 0.00 H new ATOM 0 HB3 ALA A 110 5.213 -7.928 6.173 1.00 0.00 H new ATOM 1592 N ASN A 111 7.927 -6.648 6.213 1.00 0.00 N ATOM 1593 CA ASN A 111 8.969 -6.231 7.190 1.00 0.00 C ATOM 1594 C ASN A 111 9.834 -5.131 6.574 1.00 0.00 C ATOM 1595 O ASN A 111 10.191 -4.169 7.224 1.00 0.00 O ATOM 1596 CB ASN A 111 9.845 -7.435 7.540 1.00 0.00 C ATOM 1597 CG ASN A 111 9.620 -7.822 9.002 1.00 0.00 C ATOM 1598 OD1 ASN A 111 8.722 -8.581 9.310 1.00 0.00 O ATOM 1599 ND2 ASN A 111 10.401 -7.327 9.921 1.00 0.00 N ATOM 0 H ASN A 111 8.052 -7.580 5.818 1.00 0.00 H new ATOM 0 HA ASN A 111 8.492 -5.852 8.094 1.00 0.00 H new ATOM 0 HB2 ASN A 111 9.603 -8.275 6.889 1.00 0.00 H new ATOM 0 HB3 ASN A 111 10.895 -7.195 7.374 1.00 0.00 H new ATOM 0 HD21 ASN A 111 10.259 -7.577 10.900 1.00 0.00 H new ATOM 0 HD22 ASN A 111 11.154 -6.690 9.661 1.00 0.00 H new ATOM 1606 N VAL A 112 10.172 -5.261 5.320 1.00 0.00 N ATOM 1607 CA VAL A 112 11.010 -4.219 4.664 1.00 0.00 C ATOM 1608 C VAL A 112 10.210 -2.921 4.555 1.00 0.00 C ATOM 1609 O VAL A 112 10.764 -1.841 4.506 1.00 0.00 O ATOM 1610 CB VAL A 112 11.409 -4.689 3.275 1.00 0.00 C ATOM 1611 CG1 VAL A 112 12.429 -3.719 2.674 1.00 0.00 C ATOM 1612 CG2 VAL A 112 12.021 -6.089 3.364 1.00 0.00 C ATOM 0 H VAL A 112 9.904 -6.043 4.722 1.00 0.00 H new ATOM 0 HA VAL A 112 11.907 -4.045 5.258 1.00 0.00 H new ATOM 0 HB VAL A 112 10.525 -4.720 2.638 1.00 0.00 H new ATOM 0 HG11 VAL A 112 12.712 -4.060 1.678 1.00 0.00 H new ATOM 0 HG12 VAL A 112 11.989 -2.724 2.605 1.00 0.00 H new ATOM 0 HG13 VAL A 112 13.314 -3.681 3.310 1.00 0.00 H new ATOM 0 HG21 VAL A 112 12.307 -6.425 2.367 1.00 0.00 H new ATOM 0 HG22 VAL A 112 12.903 -6.061 4.004 1.00 0.00 H new ATOM 0 HG23 VAL A 112 11.290 -6.780 3.784 1.00 0.00 H new ATOM 1622 N VAL A 113 8.910 -3.021 4.516 1.00 0.00 N ATOM 1623 CA VAL A 113 8.070 -1.797 4.410 1.00 0.00 C ATOM 1624 C VAL A 113 8.008 -1.104 5.774 1.00 0.00 C ATOM 1625 O VAL A 113 7.836 0.096 5.862 1.00 0.00 O ATOM 1626 CB VAL A 113 6.656 -2.186 3.964 1.00 0.00 C ATOM 1627 CG1 VAL A 113 5.702 -1.010 4.189 1.00 0.00 C ATOM 1628 CG2 VAL A 113 6.675 -2.548 2.477 1.00 0.00 C ATOM 0 H VAL A 113 8.393 -3.900 4.553 1.00 0.00 H new ATOM 0 HA VAL A 113 8.505 -1.117 3.678 1.00 0.00 H new ATOM 0 HB VAL A 113 6.316 -3.043 4.546 1.00 0.00 H new ATOM 0 HG11 VAL A 113 4.698 -1.290 3.871 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.688 -0.750 5.247 1.00 0.00 H new ATOM 0 HG13 VAL A 113 6.040 -0.151 3.609 1.00 0.00 H new ATOM 0 HG21 VAL A 113 5.671 -2.825 2.157 1.00 0.00 H new ATOM 0 HG22 VAL A 113 7.016 -1.690 1.898 1.00 0.00 H new ATOM 0 HG23 VAL A 113 7.352 -3.387 2.315 1.00 0.00 H new ATOM 1638 N GLU A 114 8.147 -1.848 6.837 1.00 0.00 N ATOM 1639 CA GLU A 114 8.096 -1.227 8.191 1.00 0.00 C ATOM 1640 C GLU A 114 9.317 -0.325 8.384 1.00 0.00 C ATOM 1641 O GLU A 114 9.214 0.775 8.889 1.00 0.00 O ATOM 1642 CB GLU A 114 8.094 -2.324 9.259 1.00 0.00 C ATOM 1643 CG GLU A 114 6.830 -2.198 10.112 1.00 0.00 C ATOM 1644 CD GLU A 114 7.101 -2.740 11.518 1.00 0.00 C ATOM 1645 OE1 GLU A 114 7.970 -3.585 11.648 1.00 0.00 O ATOM 1646 OE2 GLU A 114 6.434 -2.300 12.440 1.00 0.00 O ATOM 0 H GLU A 114 8.293 -2.857 6.827 1.00 0.00 H new ATOM 0 HA GLU A 114 7.187 -0.632 8.284 1.00 0.00 H new ATOM 0 HB2 GLU A 114 8.132 -3.306 8.788 1.00 0.00 H new ATOM 0 HB3 GLU A 114 8.981 -2.237 9.887 1.00 0.00 H new ATOM 0 HG2 GLU A 114 6.519 -1.155 10.167 1.00 0.00 H new ATOM 0 HG3 GLU A 114 6.011 -2.750 9.650 1.00 0.00 H new ATOM 1653 N LYS A 115 10.472 -0.780 7.979 1.00 0.00 N ATOM 1654 CA LYS A 115 11.699 0.054 8.132 1.00 0.00 C ATOM 1655 C LYS A 115 11.638 1.218 7.143 1.00 0.00 C ATOM 1656 O LYS A 115 11.754 2.371 7.511 1.00 0.00 O ATOM 1657 CB LYS A 115 12.934 -0.799 7.838 1.00 0.00 C ATOM 1658 CG LYS A 115 12.852 -2.107 8.627 1.00 0.00 C ATOM 1659 CD LYS A 115 12.942 -1.802 10.122 1.00 0.00 C ATOM 1660 CE LYS A 115 11.715 -2.373 10.832 1.00 0.00 C ATOM 1661 NZ LYS A 115 12.043 -3.720 11.379 1.00 0.00 N ATOM 0 H LYS A 115 10.619 -1.693 7.549 1.00 0.00 H new ATOM 0 HA LYS A 115 11.759 0.438 9.150 1.00 0.00 H new ATOM 0 HB2 LYS A 115 12.998 -1.010 6.770 1.00 0.00 H new ATOM 0 HB3 LYS A 115 13.838 -0.254 8.110 1.00 0.00 H new ATOM 0 HG2 LYS A 115 11.917 -2.621 8.405 1.00 0.00 H new ATOM 0 HG3 LYS A 115 13.661 -2.775 8.331 1.00 0.00 H new ATOM 0 HD2 LYS A 115 13.851 -2.235 10.539 1.00 0.00 H new ATOM 0 HD3 LYS A 115 13.000 -0.725 10.282 1.00 0.00 H new ATOM 0 HE2 LYS A 115 11.404 -1.707 11.637 1.00 0.00 H new ATOM 0 HE3 LYS A 115 10.879 -2.444 10.136 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 11.209 -4.111 11.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 12.320 -4.352 10.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 12.829 -3.638 12.055 1.00 0.00 H new ATOM 1675 N LEU A 116 11.454 0.924 5.886 1.00 0.00 N ATOM 1676 CA LEU A 116 11.380 2.012 4.873 1.00 0.00 C ATOM 1677 C LEU A 116 10.357 3.050 5.329 1.00 0.00 C ATOM 1678 O LEU A 116 10.392 4.193 4.920 1.00 0.00 O ATOM 1679 CB LEU A 116 10.951 1.428 3.526 1.00 0.00 C ATOM 1680 CG LEU A 116 12.189 1.149 2.674 1.00 0.00 C ATOM 1681 CD1 LEU A 116 13.241 0.421 3.513 1.00 0.00 C ATOM 1682 CD2 LEU A 116 11.796 0.275 1.482 1.00 0.00 C ATOM 0 H LEU A 116 11.352 -0.022 5.517 1.00 0.00 H new ATOM 0 HA LEU A 116 12.358 2.482 4.766 1.00 0.00 H new ATOM 0 HB2 LEU A 116 10.387 0.508 3.679 1.00 0.00 H new ATOM 0 HB3 LEU A 116 10.290 2.124 3.010 1.00 0.00 H new ATOM 0 HG LEU A 116 12.603 2.092 2.318 1.00 0.00 H new ATOM 0 HD11 LEU A 116 14.122 0.224 2.902 1.00 0.00 H new ATOM 0 HD12 LEU A 116 13.521 1.042 4.364 1.00 0.00 H new ATOM 0 HD13 LEU A 116 12.831 -0.523 3.872 1.00 0.00 H new ATOM 0 HD21 LEU A 116 12.677 0.074 0.872 1.00 0.00 H new ATOM 0 HD22 LEU A 116 11.382 -0.667 1.842 1.00 0.00 H new ATOM 0 HD23 LEU A 116 11.049 0.794 0.881 1.00 0.00 H new ATOM 1694 N ALA A 117 9.448 2.659 6.178 1.00 0.00 N ATOM 1695 CA ALA A 117 8.423 3.618 6.669 1.00 0.00 C ATOM 1696 C ALA A 117 9.084 4.623 7.612 1.00 0.00 C ATOM 1697 O ALA A 117 8.834 5.810 7.547 1.00 0.00 O ATOM 1698 CB ALA A 117 7.334 2.853 7.424 1.00 0.00 C ATOM 0 H ALA A 117 9.372 1.714 6.553 1.00 0.00 H new ATOM 0 HA ALA A 117 7.979 4.145 5.825 1.00 0.00 H new ATOM 0 HB1 ALA A 117 6.581 3.554 7.785 1.00 0.00 H new ATOM 0 HB2 ALA A 117 6.866 2.131 6.755 1.00 0.00 H new ATOM 0 HB3 ALA A 117 7.778 2.329 8.271 1.00 0.00 H new ATOM 1704 N ASP A 118 9.928 4.156 8.491 1.00 0.00 N ATOM 1705 CA ASP A 118 10.601 5.084 9.442 1.00 0.00 C ATOM 1706 C ASP A 118 11.447 6.097 8.665 1.00 0.00 C ATOM 1707 O ASP A 118 11.872 7.102 9.200 1.00 0.00 O ATOM 1708 CB ASP A 118 11.501 4.284 10.386 1.00 0.00 C ATOM 1709 CG ASP A 118 11.806 5.123 11.627 1.00 0.00 C ATOM 1710 OD1 ASP A 118 10.875 5.430 12.354 1.00 0.00 O ATOM 1711 OD2 ASP A 118 12.966 5.444 11.832 1.00 0.00 O ATOM 0 H ASP A 118 10.180 3.173 8.591 1.00 0.00 H new ATOM 0 HA ASP A 118 9.846 5.615 10.022 1.00 0.00 H new ATOM 0 HB2 ASP A 118 11.010 3.354 10.673 1.00 0.00 H new ATOM 0 HB3 ASP A 118 12.427 4.012 9.880 1.00 0.00 H new ATOM 1716 N TYR A 119 11.695 5.843 7.408 1.00 0.00 N ATOM 1717 CA TYR A 119 12.512 6.799 6.605 1.00 0.00 C ATOM 1718 C TYR A 119 11.643 7.989 6.187 1.00 0.00 C ATOM 1719 O TYR A 119 11.922 9.122 6.524 1.00 0.00 O ATOM 1720 CB TYR A 119 13.043 6.094 5.351 1.00 0.00 C ATOM 1721 CG TYR A 119 13.573 7.122 4.378 1.00 0.00 C ATOM 1722 CD1 TYR A 119 14.091 8.332 4.853 1.00 0.00 C ATOM 1723 CD2 TYR A 119 13.543 6.866 3.002 1.00 0.00 C ATOM 1724 CE1 TYR A 119 14.577 9.287 3.954 1.00 0.00 C ATOM 1725 CE2 TYR A 119 14.029 7.822 2.102 1.00 0.00 C ATOM 1726 CZ TYR A 119 14.546 9.032 2.579 1.00 0.00 C ATOM 1727 OH TYR A 119 15.025 9.976 1.692 1.00 0.00 O ATOM 0 H TYR A 119 11.369 5.018 6.904 1.00 0.00 H new ATOM 0 HA TYR A 119 13.350 7.152 7.207 1.00 0.00 H new ATOM 0 HB2 TYR A 119 13.833 5.394 5.622 1.00 0.00 H new ATOM 0 HB3 TYR A 119 12.248 5.512 4.884 1.00 0.00 H new ATOM 0 HD1 TYR A 119 14.116 8.529 5.915 1.00 0.00 H new ATOM 0 HD2 TYR A 119 13.145 5.931 2.635 1.00 0.00 H new ATOM 0 HE1 TYR A 119 14.976 10.221 4.321 1.00 0.00 H new ATOM 0 HE2 TYR A 119 14.005 7.626 1.040 1.00 0.00 H new ATOM 0 HH TYR A 119 14.931 9.641 0.776 1.00 0.00 H new ATOM 1737 N LEU A 120 10.598 7.741 5.445 1.00 0.00 N ATOM 1738 CA LEU A 120 9.720 8.858 4.995 1.00 0.00 C ATOM 1739 C LEU A 120 9.048 9.512 6.204 1.00 0.00 C ATOM 1740 O LEU A 120 9.071 10.716 6.362 1.00 0.00 O ATOM 1741 CB LEU A 120 8.650 8.317 4.045 1.00 0.00 C ATOM 1742 CG LEU A 120 8.988 8.733 2.614 1.00 0.00 C ATOM 1743 CD1 LEU A 120 8.253 7.820 1.630 1.00 0.00 C ATOM 1744 CD2 LEU A 120 8.549 10.183 2.392 1.00 0.00 C ATOM 0 H LEU A 120 10.314 6.813 5.131 1.00 0.00 H new ATOM 0 HA LEU A 120 10.325 9.602 4.476 1.00 0.00 H new ATOM 0 HB2 LEU A 120 8.599 7.231 4.118 1.00 0.00 H new ATOM 0 HB3 LEU A 120 7.670 8.702 4.326 1.00 0.00 H new ATOM 0 HG LEU A 120 10.063 8.648 2.453 1.00 0.00 H new ATOM 0 HD11 LEU A 120 8.494 8.116 0.609 1.00 0.00 H new ATOM 0 HD12 LEU A 120 8.563 6.787 1.791 1.00 0.00 H new ATOM 0 HD13 LEU A 120 7.178 7.905 1.788 1.00 0.00 H new ATOM 0 HD21 LEU A 120 8.789 10.484 1.372 1.00 0.00 H new ATOM 0 HD22 LEU A 120 7.474 10.266 2.552 1.00 0.00 H new ATOM 0 HD23 LEU A 120 9.072 10.833 3.094 1.00 0.00 H new ATOM 1756 N ILE A 121 8.449 8.732 7.060 1.00 0.00 N ATOM 1757 CA ILE A 121 7.778 9.317 8.254 1.00 0.00 C ATOM 1758 C ILE A 121 8.747 10.253 8.977 1.00 0.00 C ATOM 1759 O ILE A 121 8.354 11.256 9.538 1.00 0.00 O ATOM 1760 CB ILE A 121 7.353 8.195 9.200 1.00 0.00 C ATOM 1761 CG1 ILE A 121 6.350 7.286 8.489 1.00 0.00 C ATOM 1762 CG2 ILE A 121 6.699 8.799 10.444 1.00 0.00 C ATOM 1763 CD1 ILE A 121 6.477 5.863 9.029 1.00 0.00 C ATOM 0 H ILE A 121 8.395 7.716 6.985 1.00 0.00 H new ATOM 0 HA ILE A 121 6.899 9.879 7.937 1.00 0.00 H new ATOM 0 HB ILE A 121 8.227 7.614 9.494 1.00 0.00 H new ATOM 0 HG12 ILE A 121 5.336 7.655 8.643 1.00 0.00 H new ATOM 0 HG13 ILE A 121 6.533 7.296 7.414 1.00 0.00 H new ATOM 0 HG21 ILE A 121 6.395 8.000 11.120 1.00 0.00 H new ATOM 0 HG22 ILE A 121 7.412 9.451 10.950 1.00 0.00 H new ATOM 0 HG23 ILE A 121 5.823 9.378 10.150 1.00 0.00 H new ATOM 0 HD11 ILE A 121 5.762 5.216 8.521 1.00 0.00 H new ATOM 0 HD12 ILE A 121 7.488 5.495 8.852 1.00 0.00 H new ATOM 0 HD13 ILE A 121 6.272 5.861 10.100 1.00 0.00 H new ATOM 1775 N GLY A 122 10.012 9.932 8.970 1.00 0.00 N ATOM 1776 CA GLY A 122 11.003 10.804 9.661 1.00 0.00 C ATOM 1777 C GLY A 122 10.729 12.269 9.316 1.00 0.00 C ATOM 1778 O GLY A 122 10.375 13.061 10.167 1.00 0.00 O ATOM 0 H GLY A 122 10.401 9.105 8.517 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.942 10.657 10.739 1.00 0.00 H new ATOM 0 HA3 GLY A 122 12.014 10.532 9.359 1.00 0.00 H new ATOM 1782 N GLN A 123 10.892 12.636 8.074 1.00 0.00 N ATOM 1783 CA GLN A 123 10.642 14.049 7.676 1.00 0.00 C ATOM 1784 C GLN A 123 9.314 14.522 8.267 1.00 0.00 C ATOM 1785 O GLN A 123 9.263 15.464 9.032 1.00 0.00 O ATOM 1786 CB GLN A 123 10.584 14.145 6.151 1.00 0.00 C ATOM 1787 CG GLN A 123 11.919 14.674 5.624 1.00 0.00 C ATOM 1788 CD GLN A 123 11.924 16.202 5.691 1.00 0.00 C ATOM 1789 OE1 GLN A 123 11.315 16.785 6.567 1.00 0.00 O ATOM 1790 NE2 GLN A 123 12.589 16.881 4.798 1.00 0.00 N ATOM 0 H GLN A 123 11.187 12.018 7.318 1.00 0.00 H new ATOM 0 HA GLN A 123 11.449 14.679 8.051 1.00 0.00 H new ATOM 0 HB2 GLN A 123 10.373 13.165 5.722 1.00 0.00 H new ATOM 0 HB3 GLN A 123 9.773 14.807 5.848 1.00 0.00 H new ATOM 0 HG2 GLN A 123 12.741 14.271 6.215 1.00 0.00 H new ATOM 0 HG3 GLN A 123 12.073 14.344 4.597 1.00 0.00 H new ATOM 0 HE21 GLN A 123 13.100 16.393 4.063 1.00 0.00 H new ATOM 0 HE22 GLN A 123 12.598 17.900 4.835 1.00 0.00 H new ATOM 1799 N GLY A 124 8.235 13.878 7.915 1.00 0.00 N ATOM 1800 CA GLY A 124 6.909 14.292 8.455 1.00 0.00 C ATOM 1801 C GLY A 124 6.214 15.209 7.448 1.00 0.00 C ATOM 1802 O GLY A 124 6.127 16.405 7.640 1.00 0.00 O ATOM 0 H GLY A 124 8.214 13.083 7.277 1.00 0.00 H new ATOM 0 HA2 GLY A 124 6.293 13.414 8.649 1.00 0.00 H new ATOM 0 HA3 GLY A 124 7.037 14.809 9.406 1.00 0.00 H new ATOM 1806 N PHE A 125 5.716 14.657 6.374 1.00 0.00 N ATOM 1807 CA PHE A 125 5.028 15.500 5.356 1.00 0.00 C ATOM 1808 C PHE A 125 3.656 15.919 5.884 1.00 0.00 C ATOM 1809 O PHE A 125 2.803 15.057 6.011 1.00 0.00 O ATOM 1810 CB PHE A 125 4.853 14.698 4.064 1.00 0.00 C ATOM 1811 CG PHE A 125 6.187 14.552 3.374 1.00 0.00 C ATOM 1812 CD1 PHE A 125 7.091 13.573 3.801 1.00 0.00 C ATOM 1813 CD2 PHE A 125 6.521 15.396 2.308 1.00 0.00 C ATOM 1814 CE1 PHE A 125 8.329 13.436 3.161 1.00 0.00 C ATOM 1815 CE2 PHE A 125 7.759 15.259 1.669 1.00 0.00 C ATOM 1816 CZ PHE A 125 8.663 14.279 2.095 1.00 0.00 C ATOM 1817 OXT PHE A 125 3.481 17.096 6.154 1.00 0.00 O ATOM 0 H PHE A 125 5.756 13.661 6.159 1.00 0.00 H new ATOM 0 HA PHE A 125 5.627 16.388 5.155 1.00 0.00 H new ATOM 0 HB2 PHE A 125 4.438 13.715 4.288 1.00 0.00 H new ATOM 0 HB3 PHE A 125 4.145 15.200 3.405 1.00 0.00 H new ATOM 0 HD1 PHE A 125 6.834 12.923 4.624 1.00 0.00 H new ATOM 0 HD2 PHE A 125 5.824 16.152 1.979 1.00 0.00 H new ATOM 0 HE1 PHE A 125 9.026 12.680 3.490 1.00 0.00 H new ATOM 0 HE2 PHE A 125 8.017 15.910 0.847 1.00 0.00 H new ATOM 0 HZ PHE A 125 9.618 14.173 1.601 1.00 0.00 H new TER 1827 PHE A 125