USER MOD reduce.3.24.130724 H: found=0, std=0, add=911, rem=0, adj=29 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 18 GLN : amide:sc= -0.71 K(o=-1.3,f=-2.9!) USER MOD Set 1.2: A 101 ASN : amide:sc= -0.565 K(o=-1.3,f=-2.9) USER MOD Set 2.1: A 76 SER OG : rot 180:sc= 0.0569 USER MOD Set 2.2: A 78 TYR OH : rot 180:sc= -0.306 USER MOD Set 3.1: A 67 TYR OH : rot 150:sc= 0 USER MOD Set 3.2: A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.1: A 4 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 8 THR OG1 : rot -14:sc= 0.935 USER MOD Single : A 1 SER N :NH3+ 180:sc= -0.0875 (180deg=-0.0875) USER MOD Single : A 1 SER OG : rot 8:sc= 0.606! USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 13 THR OG1 : rot -68:sc= 0.913 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0.0538 USER MOD Single : A 27 ASN :FLIP amide:sc= -2.63! C(o=-3.7!,f=-2.6!) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0.00524 USER MOD Single : A 31 THR OG1 : rot 180:sc= -0.479 USER MOD Single : A 32 SER OG : rot -73:sc= -3.26! USER MOD Single : A 38 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -0.786 X(o=-0.79,f=-0.8) USER MOD Single : A 43 GLN : amide:sc= -0.147 K(o=-0.15,f=-2.6!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 SER OG : rot 180:sc= -0.0546 USER MOD Single : A 66 HIS :FLIP no HD1:sc= -1.03 F(o=-2,f=-1) USER MOD Single : A 69 THR OG1 : rot 108:sc= 0.603 USER MOD Single : A 80 LYS NZ :NH3+ 174:sc=-0.00405 (180deg=-0.0416) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 88 THR OG1 : rot -32:sc= -1.73! USER MOD Single : A 90 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.298) USER MOD Single : A 91 THR OG1 : rot 180:sc= -0.324 USER MOD Single : A 92 SER OG : rot -63:sc= 0.344! USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 92:sc= 1.53 USER MOD Single : A 100 TYR OH : rot 180:sc= -0.716 USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 GLN : amide:sc= -0.0309 X(o=-0.031,f=0) USER MOD Single : A 108 THR OG1 : rot -120:sc= -1.56! USER MOD Single : A 111 ASN : amide:sc= -0.612 K(o=-0.61,f=-1.4) 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 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 1 8.713 8.182 0.637 1.00 0.00 N ATOM 2 CA SER A 1 10.073 7.580 0.544 1.00 0.00 C ATOM 3 C SER A 1 10.098 6.539 -0.578 1.00 0.00 C ATOM 4 O SER A 1 11.115 5.929 -0.848 1.00 0.00 O ATOM 5 CB SER A 1 10.424 6.906 1.870 1.00 0.00 C ATOM 6 OG SER A 1 11.437 5.932 1.648 1.00 0.00 O ATOM 0 H1 SER A 1 8.698 8.889 1.400 1.00 0.00 H new ATOM 0 H2 SER A 1 8.474 8.641 -0.265 1.00 0.00 H new ATOM 0 H3 SER A 1 8.017 7.437 0.842 1.00 0.00 H new ATOM 0 HA SER A 1 10.801 8.363 0.329 1.00 0.00 H new ATOM 0 HB2 SER A 1 10.769 7.649 2.589 1.00 0.00 H new ATOM 0 HB3 SER A 1 9.539 6.436 2.298 1.00 0.00 H new ATOM 0 HG SER A 1 11.767 6.007 0.728 1.00 0.00 H new ATOM 14 N TRP A 2 8.991 6.331 -1.236 1.00 0.00 N ATOM 15 CA TRP A 2 8.961 5.331 -2.339 1.00 0.00 C ATOM 16 C TRP A 2 9.489 5.976 -3.624 1.00 0.00 C ATOM 17 O TRP A 2 9.428 5.395 -4.689 1.00 0.00 O ATOM 18 CB TRP A 2 7.526 4.859 -2.565 1.00 0.00 C ATOM 19 CG TRP A 2 7.295 3.562 -1.852 1.00 0.00 C ATOM 20 CD1 TRP A 2 7.037 2.376 -2.452 1.00 0.00 C ATOM 21 CD2 TRP A 2 7.287 3.305 -0.420 1.00 0.00 C ATOM 22 NE1 TRP A 2 6.869 1.408 -1.476 1.00 0.00 N ATOM 23 CE2 TRP A 2 7.015 1.932 -0.207 1.00 0.00 C ATOM 24 CE3 TRP A 2 7.489 4.123 0.702 1.00 0.00 C ATOM 25 CZ2 TRP A 2 6.943 1.392 1.081 1.00 0.00 C ATOM 26 CZ3 TRP A 2 7.420 3.585 1.998 1.00 0.00 C ATOM 27 CH2 TRP A 2 7.148 2.223 2.187 1.00 0.00 C ATOM 0 H TRP A 2 8.108 6.809 -1.058 1.00 0.00 H new ATOM 0 HA TRP A 2 9.586 4.479 -2.071 1.00 0.00 H new ATOM 0 HB2 TRP A 2 6.826 5.612 -2.204 1.00 0.00 H new ATOM 0 HB3 TRP A 2 7.339 4.735 -3.632 1.00 0.00 H new ATOM 0 HD1 TRP A 2 6.973 2.212 -3.517 1.00 0.00 H new ATOM 0 HE1 TRP A 2 6.663 0.428 -1.671 1.00 0.00 H new ATOM 0 HE3 TRP A 2 7.699 5.174 0.568 1.00 0.00 H new ATOM 0 HZ2 TRP A 2 6.731 0.342 1.220 1.00 0.00 H new ATOM 0 HZ3 TRP A 2 7.577 4.225 2.854 1.00 0.00 H new ATOM 0 HH2 TRP A 2 7.097 1.816 3.186 1.00 0.00 H new ATOM 38 N GLN A 3 10.002 7.176 -3.537 1.00 0.00 N ATOM 39 CA GLN A 3 10.529 7.852 -4.758 1.00 0.00 C ATOM 40 C GLN A 3 11.603 6.969 -5.398 1.00 0.00 C ATOM 41 O GLN A 3 11.316 6.141 -6.241 1.00 0.00 O ATOM 42 CB GLN A 3 11.140 9.203 -4.374 1.00 0.00 C ATOM 43 CG GLN A 3 10.185 10.329 -4.776 1.00 0.00 C ATOM 44 CD GLN A 3 10.942 11.371 -5.603 1.00 0.00 C ATOM 45 OE1 GLN A 3 11.161 12.477 -5.152 1.00 0.00 O ATOM 46 NE2 GLN A 3 11.351 11.062 -6.803 1.00 0.00 N ATOM 0 H GLN A 3 10.078 7.715 -2.675 1.00 0.00 H new ATOM 0 HA GLN A 3 9.716 8.013 -5.466 1.00 0.00 H new ATOM 0 HB2 GLN A 3 11.328 9.237 -3.301 1.00 0.00 H new ATOM 0 HB3 GLN A 3 12.102 9.333 -4.870 1.00 0.00 H new ATOM 0 HG2 GLN A 3 9.353 9.926 -5.353 1.00 0.00 H new ATOM 0 HG3 GLN A 3 9.760 10.794 -3.887 1.00 0.00 H new ATOM 0 HE21 GLN A 3 11.167 10.133 -7.181 1.00 0.00 H new ATOM 0 HE22 GLN A 3 11.855 11.750 -7.363 1.00 0.00 H new ATOM 55 N THR A 4 12.836 7.131 -5.002 1.00 0.00 N ATOM 56 CA THR A 4 13.919 6.290 -5.585 1.00 0.00 C ATOM 57 C THR A 4 13.625 4.821 -5.278 1.00 0.00 C ATOM 58 O THR A 4 13.866 3.944 -6.083 1.00 0.00 O ATOM 59 CB THR A 4 15.263 6.687 -4.968 1.00 0.00 C ATOM 60 OG1 THR A 4 16.314 6.046 -5.679 1.00 0.00 O ATOM 61 CG2 THR A 4 15.302 6.261 -3.499 1.00 0.00 C ATOM 0 H THR A 4 13.140 7.808 -4.302 1.00 0.00 H new ATOM 0 HA THR A 4 13.964 6.438 -6.664 1.00 0.00 H new ATOM 0 HB THR A 4 15.387 7.768 -5.030 1.00 0.00 H new ATOM 0 HG1 THR A 4 17.176 6.299 -5.287 1.00 0.00 H new ATOM 0 HG21 THR A 4 16.260 6.545 -3.063 1.00 0.00 H new ATOM 0 HG22 THR A 4 14.496 6.754 -2.956 1.00 0.00 H new ATOM 0 HG23 THR A 4 15.178 5.180 -3.430 1.00 0.00 H new ATOM 69 N TYR A 5 13.095 4.552 -4.116 1.00 0.00 N ATOM 70 CA TYR A 5 12.768 3.148 -3.744 1.00 0.00 C ATOM 71 C TYR A 5 11.900 2.519 -4.841 1.00 0.00 C ATOM 72 O TYR A 5 11.963 1.331 -5.087 1.00 0.00 O ATOM 73 CB TYR A 5 12.006 3.148 -2.414 1.00 0.00 C ATOM 74 CG TYR A 5 12.961 3.326 -1.248 1.00 0.00 C ATOM 75 CD1 TYR A 5 14.346 3.433 -1.459 1.00 0.00 C ATOM 76 CD2 TYR A 5 12.450 3.388 0.055 1.00 0.00 C ATOM 77 CE1 TYR A 5 15.209 3.600 -0.368 1.00 0.00 C ATOM 78 CE2 TYR A 5 13.316 3.555 1.142 1.00 0.00 C ATOM 79 CZ TYR A 5 14.694 3.659 0.931 1.00 0.00 C ATOM 80 OH TYR A 5 15.545 3.824 2.004 1.00 0.00 O ATOM 0 H TYR A 5 12.874 5.249 -3.405 1.00 0.00 H new ATOM 0 HA TYR A 5 13.685 2.568 -3.638 1.00 0.00 H new ATOM 0 HB2 TYR A 5 11.268 3.950 -2.412 1.00 0.00 H new ATOM 0 HB3 TYR A 5 11.459 2.212 -2.303 1.00 0.00 H new ATOM 0 HD1 TYR A 5 14.745 3.387 -2.461 1.00 0.00 H new ATOM 0 HD2 TYR A 5 11.386 3.307 0.221 1.00 0.00 H new ATOM 0 HE1 TYR A 5 16.273 3.683 -0.530 1.00 0.00 H new ATOM 0 HE2 TYR A 5 12.919 3.604 2.145 1.00 0.00 H new ATOM 0 HH TYR A 5 15.024 3.845 2.834 1.00 0.00 H new ATOM 90 N VAL A 6 11.099 3.306 -5.511 1.00 0.00 N ATOM 91 CA VAL A 6 10.241 2.748 -6.598 1.00 0.00 C ATOM 92 C VAL A 6 11.144 2.349 -7.774 1.00 0.00 C ATOM 93 O VAL A 6 11.034 1.271 -8.319 1.00 0.00 O ATOM 94 CB VAL A 6 9.203 3.810 -7.035 1.00 0.00 C ATOM 95 CG1 VAL A 6 9.035 3.825 -8.561 1.00 0.00 C ATOM 96 CG2 VAL A 6 7.845 3.489 -6.399 1.00 0.00 C ATOM 0 H VAL A 6 11.002 4.309 -5.353 1.00 0.00 H new ATOM 0 HA VAL A 6 9.700 1.869 -6.246 1.00 0.00 H new ATOM 0 HB VAL A 6 9.561 4.786 -6.708 1.00 0.00 H new ATOM 0 HG11 VAL A 6 8.300 4.580 -8.839 1.00 0.00 H new ATOM 0 HG12 VAL A 6 9.991 4.059 -9.030 1.00 0.00 H new ATOM 0 HG13 VAL A 6 8.695 2.846 -8.899 1.00 0.00 H new ATOM 0 HG21 VAL A 6 7.114 4.236 -6.706 1.00 0.00 H new ATOM 0 HG22 VAL A 6 7.515 2.503 -6.725 1.00 0.00 H new ATOM 0 HG23 VAL A 6 7.940 3.499 -5.313 1.00 0.00 H new ATOM 106 N ASP A 7 12.032 3.213 -8.173 1.00 0.00 N ATOM 107 CA ASP A 7 12.932 2.878 -9.310 1.00 0.00 C ATOM 108 C ASP A 7 14.213 2.221 -8.786 1.00 0.00 C ATOM 109 O ASP A 7 15.302 2.561 -9.203 1.00 0.00 O ATOM 110 CB ASP A 7 13.289 4.157 -10.069 1.00 0.00 C ATOM 111 CG ASP A 7 12.647 4.130 -11.457 1.00 0.00 C ATOM 112 OD1 ASP A 7 11.640 3.458 -11.608 1.00 0.00 O ATOM 113 OD2 ASP A 7 13.172 4.781 -12.344 1.00 0.00 O ATOM 0 H ASP A 7 12.174 4.136 -7.762 1.00 0.00 H new ATOM 0 HA ASP A 7 12.422 2.184 -9.979 1.00 0.00 H new ATOM 0 HB2 ASP A 7 12.942 5.029 -9.514 1.00 0.00 H new ATOM 0 HB3 ASP A 7 14.371 4.247 -10.160 1.00 0.00 H new ATOM 118 N THR A 8 14.105 1.286 -7.876 1.00 0.00 N ATOM 119 CA THR A 8 15.339 0.636 -7.351 1.00 0.00 C ATOM 120 C THR A 8 15.018 -0.751 -6.771 1.00 0.00 C ATOM 121 O THR A 8 14.907 -1.721 -7.495 1.00 0.00 O ATOM 122 CB THR A 8 15.953 1.522 -6.264 1.00 0.00 C ATOM 123 OG1 THR A 8 16.371 2.752 -6.839 1.00 0.00 O ATOM 124 CG2 THR A 8 17.157 0.811 -5.644 1.00 0.00 C ATOM 0 H THR A 8 13.227 0.950 -7.480 1.00 0.00 H new ATOM 0 HA THR A 8 16.047 0.510 -8.170 1.00 0.00 H new ATOM 0 HB THR A 8 15.211 1.716 -5.490 1.00 0.00 H new ATOM 0 HG1 THR A 8 16.382 2.670 -7.815 1.00 0.00 H new ATOM 0 HG21 THR A 8 17.594 1.442 -4.870 1.00 0.00 H new ATOM 0 HG22 THR A 8 16.835 -0.133 -5.204 1.00 0.00 H new ATOM 0 HG23 THR A 8 17.901 0.616 -6.416 1.00 0.00 H new ATOM 132 N ASN A 9 14.897 -0.859 -5.473 1.00 0.00 N ATOM 133 CA ASN A 9 14.615 -2.189 -4.848 1.00 0.00 C ATOM 134 C ASN A 9 13.133 -2.312 -4.487 1.00 0.00 C ATOM 135 O ASN A 9 12.461 -3.203 -4.952 1.00 0.00 O ATOM 136 CB ASN A 9 15.458 -2.332 -3.577 1.00 0.00 C ATOM 137 CG ASN A 9 16.796 -2.990 -3.924 1.00 0.00 C ATOM 138 OD1 ASN A 9 17.781 -2.312 -4.144 1.00 0.00 O ATOM 139 ND2 ASN A 9 16.875 -4.292 -3.982 1.00 0.00 N ATOM 0 H ASN A 9 14.981 -0.083 -4.817 1.00 0.00 H new ATOM 0 HA ASN A 9 14.867 -2.975 -5.560 1.00 0.00 H new ATOM 0 HB2 ASN A 9 15.627 -1.353 -3.128 1.00 0.00 H new ATOM 0 HB3 ASN A 9 14.925 -2.933 -2.840 1.00 0.00 H new ATOM 0 HD21 ASN A 9 17.762 -4.739 -4.212 1.00 0.00 H new ATOM 0 HD22 ASN A 9 16.049 -4.862 -3.798 1.00 0.00 H new ATOM 146 N LEU A 10 12.633 -1.434 -3.648 1.00 0.00 N ATOM 147 CA LEU A 10 11.194 -1.494 -3.229 1.00 0.00 C ATOM 148 C LEU A 10 10.336 -2.101 -4.342 1.00 0.00 C ATOM 149 O LEU A 10 9.548 -2.998 -4.114 1.00 0.00 O ATOM 150 CB LEU A 10 10.699 -0.080 -2.932 1.00 0.00 C ATOM 151 CG LEU A 10 10.331 0.036 -1.451 1.00 0.00 C ATOM 152 CD1 LEU A 10 9.177 -0.917 -1.138 1.00 0.00 C ATOM 153 CD2 LEU A 10 11.541 -0.331 -0.589 1.00 0.00 C ATOM 0 H LEU A 10 13.166 -0.671 -3.231 1.00 0.00 H new ATOM 0 HA LEU A 10 11.112 -2.118 -2.339 1.00 0.00 H new ATOM 0 HB2 LEU A 10 11.472 0.647 -3.183 1.00 0.00 H new ATOM 0 HB3 LEU A 10 9.832 0.150 -3.551 1.00 0.00 H new ATOM 0 HG LEU A 10 10.029 1.061 -1.233 1.00 0.00 H new ATOM 0 HD11 LEU A 10 8.914 -0.836 -0.083 1.00 0.00 H new ATOM 0 HD12 LEU A 10 8.313 -0.655 -1.749 1.00 0.00 H new ATOM 0 HD13 LEU A 10 9.480 -1.940 -1.358 1.00 0.00 H new ATOM 0 HD21 LEU A 10 11.276 -0.247 0.465 1.00 0.00 H new ATOM 0 HD22 LEU A 10 11.846 -1.355 -0.806 1.00 0.00 H new ATOM 0 HD23 LEU A 10 12.365 0.347 -0.811 1.00 0.00 H new ATOM 165 N VAL A 11 10.496 -1.629 -5.543 1.00 0.00 N ATOM 166 CA VAL A 11 9.705 -2.183 -6.676 1.00 0.00 C ATOM 167 C VAL A 11 10.596 -3.158 -7.438 1.00 0.00 C ATOM 168 O VAL A 11 10.127 -4.049 -8.117 1.00 0.00 O ATOM 169 CB VAL A 11 9.265 -1.021 -7.580 1.00 0.00 C ATOM 170 CG1 VAL A 11 9.332 -1.405 -9.067 1.00 0.00 C ATOM 171 CG2 VAL A 11 7.832 -0.623 -7.230 1.00 0.00 C ATOM 0 H VAL A 11 11.143 -0.880 -5.792 1.00 0.00 H new ATOM 0 HA VAL A 11 8.816 -2.707 -6.325 1.00 0.00 H new ATOM 0 HB VAL A 11 9.946 -0.186 -7.412 1.00 0.00 H new ATOM 0 HG11 VAL A 11 9.014 -0.559 -9.676 1.00 0.00 H new ATOM 0 HG12 VAL A 11 10.355 -1.675 -9.327 1.00 0.00 H new ATOM 0 HG13 VAL A 11 8.674 -2.254 -9.254 1.00 0.00 H new ATOM 0 HG21 VAL A 11 7.517 0.201 -7.870 1.00 0.00 H new ATOM 0 HG22 VAL A 11 7.170 -1.475 -7.384 1.00 0.00 H new ATOM 0 HG23 VAL A 11 7.786 -0.311 -6.187 1.00 0.00 H new ATOM 181 N GLY A 12 11.881 -2.983 -7.313 1.00 0.00 N ATOM 182 CA GLY A 12 12.845 -3.892 -7.990 1.00 0.00 C ATOM 183 C GLY A 12 13.011 -5.117 -7.096 1.00 0.00 C ATOM 184 O GLY A 12 14.093 -5.443 -6.647 1.00 0.00 O ATOM 0 H GLY A 12 12.310 -2.239 -6.763 1.00 0.00 H new ATOM 0 HA2 GLY A 12 12.476 -4.181 -8.974 1.00 0.00 H new ATOM 0 HA3 GLY A 12 13.802 -3.394 -8.142 1.00 0.00 H new ATOM 188 N THR A 13 11.920 -5.771 -6.820 1.00 0.00 N ATOM 189 CA THR A 13 11.919 -6.968 -5.941 1.00 0.00 C ATOM 190 C THR A 13 12.802 -6.729 -4.722 1.00 0.00 C ATOM 191 O THR A 13 13.624 -7.544 -4.353 1.00 0.00 O ATOM 192 CB THR A 13 12.399 -8.199 -6.700 1.00 0.00 C ATOM 193 OG1 THR A 13 12.930 -9.153 -5.791 1.00 0.00 O ATOM 194 CG2 THR A 13 13.473 -7.803 -7.716 1.00 0.00 C ATOM 0 H THR A 13 11.000 -5.516 -7.180 1.00 0.00 H new ATOM 0 HA THR A 13 10.896 -7.145 -5.609 1.00 0.00 H new ATOM 0 HB THR A 13 11.553 -8.639 -7.228 1.00 0.00 H new ATOM 0 HG1 THR A 13 13.757 -8.804 -5.397 1.00 0.00 H new ATOM 0 HG21 THR A 13 13.810 -8.689 -8.253 1.00 0.00 H new ATOM 0 HG22 THR A 13 13.058 -7.086 -8.424 1.00 0.00 H new ATOM 0 HG23 THR A 13 14.318 -7.352 -7.195 1.00 0.00 H new ATOM 202 N GLY A 14 12.588 -5.643 -4.055 1.00 0.00 N ATOM 203 CA GLY A 14 13.350 -5.374 -2.814 1.00 0.00 C ATOM 204 C GLY A 14 12.411 -5.740 -1.675 1.00 0.00 C ATOM 205 O GLY A 14 12.540 -5.273 -0.561 1.00 0.00 O ATOM 0 H GLY A 14 11.914 -4.923 -4.315 1.00 0.00 H new ATOM 0 HA2 GLY A 14 14.263 -5.969 -2.777 1.00 0.00 H new ATOM 0 HA3 GLY A 14 13.649 -4.327 -2.756 1.00 0.00 H new ATOM 209 N ALA A 15 11.441 -6.569 -1.990 1.00 0.00 N ATOM 210 CA ALA A 15 10.423 -6.993 -0.997 1.00 0.00 C ATOM 211 C ALA A 15 9.156 -7.318 -1.778 1.00 0.00 C ATOM 212 O ALA A 15 8.406 -8.211 -1.437 1.00 0.00 O ATOM 213 CB ALA A 15 10.137 -5.857 -0.014 1.00 0.00 C ATOM 0 H ALA A 15 11.318 -6.974 -2.918 1.00 0.00 H new ATOM 0 HA ALA A 15 10.774 -7.854 -0.428 1.00 0.00 H new ATOM 0 HB1 ALA A 15 9.389 -6.181 0.709 1.00 0.00 H new ATOM 0 HB2 ALA A 15 11.055 -5.589 0.509 1.00 0.00 H new ATOM 0 HB3 ALA A 15 9.763 -4.990 -0.559 1.00 0.00 H new ATOM 219 N VAL A 16 8.931 -6.597 -2.848 1.00 0.00 N ATOM 220 CA VAL A 16 7.740 -6.850 -3.688 1.00 0.00 C ATOM 221 C VAL A 16 8.167 -6.744 -5.150 1.00 0.00 C ATOM 222 O VAL A 16 9.034 -5.965 -5.492 1.00 0.00 O ATOM 223 CB VAL A 16 6.672 -5.796 -3.389 1.00 0.00 C ATOM 224 CG1 VAL A 16 5.940 -6.159 -2.096 1.00 0.00 C ATOM 225 CG2 VAL A 16 7.340 -4.430 -3.223 1.00 0.00 C ATOM 0 H VAL A 16 9.532 -5.839 -3.171 1.00 0.00 H new ATOM 0 HA VAL A 16 7.329 -7.838 -3.481 1.00 0.00 H new ATOM 0 HB VAL A 16 5.959 -5.760 -4.213 1.00 0.00 H new ATOM 0 HG11 VAL A 16 5.180 -5.407 -1.885 1.00 0.00 H new ATOM 0 HG12 VAL A 16 5.465 -7.134 -2.208 1.00 0.00 H new ATOM 0 HG13 VAL A 16 6.653 -6.195 -1.272 1.00 0.00 H new ATOM 0 HG21 VAL A 16 6.581 -3.677 -3.010 1.00 0.00 H new ATOM 0 HG22 VAL A 16 8.052 -4.471 -2.399 1.00 0.00 H new ATOM 0 HG23 VAL A 16 7.864 -4.167 -4.142 1.00 0.00 H new ATOM 235 N THR A 17 7.570 -7.504 -6.022 1.00 0.00 N ATOM 236 CA THR A 17 7.957 -7.414 -7.458 1.00 0.00 C ATOM 237 C THR A 17 7.275 -6.196 -8.087 1.00 0.00 C ATOM 238 O THR A 17 7.281 -6.020 -9.289 1.00 0.00 O ATOM 239 CB THR A 17 7.513 -8.683 -8.189 1.00 0.00 C ATOM 240 OG1 THR A 17 6.242 -9.089 -7.699 1.00 0.00 O ATOM 241 CG2 THR A 17 8.533 -9.798 -7.953 1.00 0.00 C ATOM 0 H THR A 17 6.836 -8.179 -5.807 1.00 0.00 H new ATOM 0 HA THR A 17 9.039 -7.312 -7.540 1.00 0.00 H new ATOM 0 HB THR A 17 7.444 -8.480 -9.258 1.00 0.00 H new ATOM 0 HG1 THR A 17 5.955 -9.901 -8.167 1.00 0.00 H new ATOM 0 HG21 THR A 17 8.213 -10.700 -8.475 1.00 0.00 H new ATOM 0 HG22 THR A 17 9.507 -9.486 -8.330 1.00 0.00 H new ATOM 0 HG23 THR A 17 8.607 -10.004 -6.885 1.00 0.00 H new ATOM 249 N GLN A 18 6.679 -5.358 -7.279 1.00 0.00 N ATOM 250 CA GLN A 18 5.984 -4.149 -7.822 1.00 0.00 C ATOM 251 C GLN A 18 5.580 -3.231 -6.664 1.00 0.00 C ATOM 252 O GLN A 18 5.727 -3.571 -5.507 1.00 0.00 O ATOM 253 CB GLN A 18 4.716 -4.556 -8.596 1.00 0.00 C ATOM 254 CG GLN A 18 4.554 -6.081 -8.612 1.00 0.00 C ATOM 255 CD GLN A 18 3.108 -6.446 -8.946 1.00 0.00 C ATOM 256 OE1 GLN A 18 2.200 -5.680 -8.690 1.00 0.00 O ATOM 257 NE2 GLN A 18 2.857 -7.593 -9.514 1.00 0.00 N ATOM 0 H GLN A 18 6.643 -5.458 -6.265 1.00 0.00 H new ATOM 0 HA GLN A 18 6.666 -3.631 -8.497 1.00 0.00 H new ATOM 0 HB2 GLN A 18 3.841 -4.098 -8.136 1.00 0.00 H new ATOM 0 HB3 GLN A 18 4.772 -4.181 -9.618 1.00 0.00 H new ATOM 0 HG2 GLN A 18 5.228 -6.520 -9.348 1.00 0.00 H new ATOM 0 HG3 GLN A 18 4.828 -6.495 -7.642 1.00 0.00 H new ATOM 0 HE21 GLN A 18 3.621 -8.234 -9.728 1.00 0.00 H new ATOM 0 HE22 GLN A 18 1.897 -7.849 -9.744 1.00 0.00 H new ATOM 266 N ALA A 19 5.066 -2.070 -6.972 1.00 0.00 N ATOM 267 CA ALA A 19 4.640 -1.122 -5.900 1.00 0.00 C ATOM 268 C ALA A 19 4.021 0.115 -6.555 1.00 0.00 C ATOM 269 O ALA A 19 4.191 0.344 -7.737 1.00 0.00 O ATOM 270 CB ALA A 19 5.852 -0.712 -5.060 1.00 0.00 C ATOM 0 H ALA A 19 4.922 -1.735 -7.925 1.00 0.00 H new ATOM 0 HA ALA A 19 3.908 -1.602 -5.250 1.00 0.00 H new ATOM 0 HB1 ALA A 19 5.536 -0.020 -4.279 1.00 0.00 H new ATOM 0 HB2 ALA A 19 6.294 -1.597 -4.603 1.00 0.00 H new ATOM 0 HB3 ALA A 19 6.590 -0.226 -5.699 1.00 0.00 H new ATOM 276 N ALA A 20 3.298 0.914 -5.815 1.00 0.00 N ATOM 277 CA ALA A 20 2.677 2.119 -6.437 1.00 0.00 C ATOM 278 C ALA A 20 2.298 3.147 -5.368 1.00 0.00 C ATOM 279 O ALA A 20 1.524 2.876 -4.472 1.00 0.00 O ATOM 280 CB ALA A 20 1.412 1.702 -7.192 1.00 0.00 C ATOM 0 H ALA A 20 3.113 0.787 -4.820 1.00 0.00 H new ATOM 0 HA ALA A 20 3.399 2.568 -7.120 1.00 0.00 H new ATOM 0 HB1 ALA A 20 0.955 2.580 -7.648 1.00 0.00 H new ATOM 0 HB2 ALA A 20 1.672 0.983 -7.969 1.00 0.00 H new ATOM 0 HB3 ALA A 20 0.707 1.246 -6.497 1.00 0.00 H new ATOM 286 N ILE A 21 2.822 4.337 -5.475 1.00 0.00 N ATOM 287 CA ILE A 21 2.472 5.396 -4.489 1.00 0.00 C ATOM 288 C ILE A 21 1.238 6.135 -5.002 1.00 0.00 C ATOM 289 O ILE A 21 1.310 6.919 -5.929 1.00 0.00 O ATOM 290 CB ILE A 21 3.640 6.373 -4.346 1.00 0.00 C ATOM 291 CG1 ILE A 21 4.954 5.609 -4.518 1.00 0.00 C ATOM 292 CG2 ILE A 21 3.600 7.011 -2.957 1.00 0.00 C ATOM 293 CD1 ILE A 21 4.979 4.417 -3.558 1.00 0.00 C ATOM 0 H ILE A 21 3.477 4.621 -6.203 1.00 0.00 H new ATOM 0 HA ILE A 21 2.267 4.953 -3.515 1.00 0.00 H new ATOM 0 HB ILE A 21 3.565 7.152 -5.105 1.00 0.00 H new ATOM 0 HG12 ILE A 21 5.054 5.263 -5.547 1.00 0.00 H new ATOM 0 HG13 ILE A 21 5.799 6.268 -4.319 1.00 0.00 H new ATOM 0 HG21 ILE A 21 4.432 7.708 -2.853 1.00 0.00 H new ATOM 0 HG22 ILE A 21 2.659 7.547 -2.830 1.00 0.00 H new ATOM 0 HG23 ILE A 21 3.680 6.234 -2.197 1.00 0.00 H new ATOM 0 HD11 ILE A 21 5.915 3.872 -3.679 1.00 0.00 H new ATOM 0 HD12 ILE A 21 4.898 4.775 -2.532 1.00 0.00 H new ATOM 0 HD13 ILE A 21 4.142 3.755 -3.778 1.00 0.00 H new ATOM 305 N LEU A 22 0.102 5.872 -4.423 1.00 0.00 N ATOM 306 CA LEU A 22 -1.147 6.536 -4.890 1.00 0.00 C ATOM 307 C LEU A 22 -1.274 7.922 -4.247 1.00 0.00 C ATOM 308 O LEU A 22 -2.315 8.548 -4.302 1.00 0.00 O ATOM 309 CB LEU A 22 -2.353 5.667 -4.515 1.00 0.00 C ATOM 310 CG LEU A 22 -1.932 4.190 -4.471 1.00 0.00 C ATOM 311 CD1 LEU A 22 -3.173 3.295 -4.458 1.00 0.00 C ATOM 312 CD2 LEU A 22 -1.082 3.854 -5.702 1.00 0.00 C ATOM 0 H LEU A 22 -0.017 5.224 -3.644 1.00 0.00 H new ATOM 0 HA LEU A 22 -1.113 6.656 -5.973 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -2.746 5.972 -3.545 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -3.154 5.806 -5.242 1.00 0.00 H new ATOM 0 HG LEU A 22 -1.349 4.017 -3.566 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -2.867 2.249 -4.427 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -3.777 3.523 -3.580 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.760 3.474 -5.358 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -0.787 2.805 -5.665 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -1.663 4.036 -6.606 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -0.191 4.482 -5.711 1.00 0.00 H new ATOM 324 N GLY A 23 -0.220 8.414 -3.653 1.00 0.00 N ATOM 325 CA GLY A 23 -0.271 9.766 -3.025 1.00 0.00 C ATOM 326 C GLY A 23 -1.199 9.754 -1.810 1.00 0.00 C ATOM 327 O GLY A 23 -2.075 8.921 -1.687 1.00 0.00 O ATOM 0 H GLY A 23 0.678 7.936 -3.575 1.00 0.00 H new ATOM 0 HA2 GLY A 23 0.731 10.072 -2.723 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -0.622 10.499 -3.752 1.00 0.00 H new ATOM 331 N LEU A 24 -1.018 10.687 -0.913 1.00 0.00 N ATOM 332 CA LEU A 24 -1.889 10.752 0.292 1.00 0.00 C ATOM 333 C LEU A 24 -3.212 11.419 -0.085 1.00 0.00 C ATOM 334 O LEU A 24 -4.274 10.847 0.064 1.00 0.00 O ATOM 335 CB LEU A 24 -1.197 11.577 1.382 1.00 0.00 C ATOM 336 CG LEU A 24 -0.292 10.670 2.220 1.00 0.00 C ATOM 337 CD1 LEU A 24 0.551 11.523 3.170 1.00 0.00 C ATOM 338 CD2 LEU A 24 -1.155 9.707 3.037 1.00 0.00 C ATOM 0 H LEU A 24 -0.300 11.410 -0.966 1.00 0.00 H new ATOM 0 HA LEU A 24 -2.075 9.745 0.665 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -0.609 12.375 0.929 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -1.942 12.053 2.020 1.00 0.00 H new ATOM 0 HG LEU A 24 0.365 10.104 1.559 1.00 0.00 H new ATOM 0 HD11 LEU A 24 1.195 10.876 3.766 1.00 0.00 H new ATOM 0 HD12 LEU A 24 1.166 12.213 2.591 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.106 12.089 3.831 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -0.513 9.060 3.634 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -1.811 10.276 3.696 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.758 9.098 2.363 1.00 0.00 H new ATOM 350 N ASP A 25 -3.151 12.623 -0.580 1.00 0.00 N ATOM 351 CA ASP A 25 -4.399 13.332 -0.975 1.00 0.00 C ATOM 352 C ASP A 25 -4.177 14.017 -2.324 1.00 0.00 C ATOM 353 O ASP A 25 -4.858 14.961 -2.674 1.00 0.00 O ATOM 354 CB ASP A 25 -4.745 14.383 0.083 1.00 0.00 C ATOM 355 CG ASP A 25 -3.480 15.154 0.465 1.00 0.00 C ATOM 356 OD1 ASP A 25 -3.028 15.949 -0.342 1.00 0.00 O ATOM 357 OD2 ASP A 25 -2.983 14.935 1.558 1.00 0.00 O ATOM 0 H ASP A 25 -2.289 13.148 -0.728 1.00 0.00 H new ATOM 0 HA ASP A 25 -5.220 12.619 -1.055 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -5.500 15.069 -0.303 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -5.171 13.902 0.964 1.00 0.00 H new ATOM 362 N GLY A 26 -3.223 13.549 -3.083 1.00 0.00 N ATOM 363 CA GLY A 26 -2.953 14.172 -4.409 1.00 0.00 C ATOM 364 C GLY A 26 -3.379 13.212 -5.520 1.00 0.00 C ATOM 365 O GLY A 26 -4.550 12.966 -5.728 1.00 0.00 O ATOM 0 H GLY A 26 -2.620 12.763 -2.842 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -3.497 15.112 -4.498 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -1.893 14.407 -4.503 1.00 0.00 H new ATOM 369 N ASN A 27 -2.435 12.666 -6.236 1.00 0.00 N ATOM 370 CA ASN A 27 -2.780 11.721 -7.334 1.00 0.00 C ATOM 371 C ASN A 27 -1.655 10.696 -7.493 1.00 0.00 C ATOM 372 O ASN A 27 -1.024 10.301 -6.532 1.00 0.00 O ATOM 373 CB ASN A 27 -2.954 12.504 -8.639 1.00 0.00 C ATOM 374 CG ASN A 27 -3.835 13.727 -8.384 1.00 0.00 C ATOM 375 OD1 ASN A 27 -5.083 13.556 -8.047 1.00 0.00 O flip ATOM 376 ND2 ASN A 27 -3.382 14.850 -8.490 1.00 0.00 N flip ATOM 0 H ASN A 27 -1.437 12.834 -6.107 1.00 0.00 H new ATOM 0 HA ASN A 27 -3.709 11.203 -7.096 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -1.982 12.816 -9.021 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -3.407 11.868 -9.400 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -2.406 14.983 -8.754 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -3.978 15.659 -8.315 1.00 0.00 H new ATOM 383 N THR A 28 -1.396 10.259 -8.695 1.00 0.00 N ATOM 384 CA THR A 28 -0.311 9.261 -8.904 1.00 0.00 C ATOM 385 C THR A 28 1.048 9.933 -8.700 1.00 0.00 C ATOM 386 O THR A 28 1.359 10.931 -9.320 1.00 0.00 O ATOM 387 CB THR A 28 -0.394 8.701 -10.325 1.00 0.00 C ATOM 388 OG1 THR A 28 -1.758 8.549 -10.694 1.00 0.00 O ATOM 389 CG2 THR A 28 0.307 7.344 -10.385 1.00 0.00 C ATOM 0 H THR A 28 -1.888 10.550 -9.540 1.00 0.00 H new ATOM 0 HA THR A 28 -0.426 8.448 -8.187 1.00 0.00 H new ATOM 0 HB THR A 28 0.095 9.389 -11.015 1.00 0.00 H new ATOM 0 HG1 THR A 28 -1.813 8.192 -11.605 1.00 0.00 H new ATOM 0 HG21 THR A 28 0.246 6.948 -11.399 1.00 0.00 H new ATOM 0 HG22 THR A 28 1.353 7.462 -10.104 1.00 0.00 H new ATOM 0 HG23 THR A 28 -0.178 6.653 -9.695 1.00 0.00 H new ATOM 397 N TRP A 29 1.862 9.392 -7.836 1.00 0.00 N ATOM 398 CA TRP A 29 3.202 9.995 -7.591 1.00 0.00 C ATOM 399 C TRP A 29 4.273 9.116 -8.244 1.00 0.00 C ATOM 400 O TRP A 29 5.215 9.601 -8.838 1.00 0.00 O ATOM 401 CB TRP A 29 3.456 10.072 -6.085 1.00 0.00 C ATOM 402 CG TRP A 29 2.881 11.342 -5.543 1.00 0.00 C ATOM 403 CD1 TRP A 29 1.696 11.881 -5.915 1.00 0.00 C ATOM 404 CD2 TRP A 29 3.442 12.238 -4.540 1.00 0.00 C ATOM 405 NE1 TRP A 29 1.495 13.052 -5.202 1.00 0.00 N ATOM 406 CE2 TRP A 29 2.543 13.312 -4.342 1.00 0.00 C ATOM 407 CE3 TRP A 29 4.629 12.220 -3.789 1.00 0.00 C ATOM 408 CZ2 TRP A 29 2.814 14.335 -3.433 1.00 0.00 C ATOM 409 CZ3 TRP A 29 4.907 13.248 -2.873 1.00 0.00 C ATOM 410 CH2 TRP A 29 4.001 14.302 -2.695 1.00 0.00 C ATOM 0 H TRP A 29 1.656 8.557 -7.288 1.00 0.00 H new ATOM 0 HA TRP A 29 3.239 10.998 -8.017 1.00 0.00 H new ATOM 0 HB2 TRP A 29 3.005 9.215 -5.586 1.00 0.00 H new ATOM 0 HB3 TRP A 29 4.527 10.031 -5.884 1.00 0.00 H new ATOM 0 HD1 TRP A 29 1.019 11.466 -6.647 1.00 0.00 H new ATOM 0 HE1 TRP A 29 0.674 13.649 -5.301 1.00 0.00 H new ATOM 0 HE3 TRP A 29 5.332 11.411 -3.917 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 2.113 15.146 -3.300 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 5.824 13.226 -2.303 1.00 0.00 H new ATOM 0 HH2 TRP A 29 4.220 15.089 -1.988 1.00 0.00 H new ATOM 421 N ALA A 30 4.128 7.825 -8.136 1.00 0.00 N ATOM 422 CA ALA A 30 5.126 6.901 -8.746 1.00 0.00 C ATOM 423 C ALA A 30 4.492 5.517 -8.883 1.00 0.00 C ATOM 424 O ALA A 30 3.568 5.182 -8.172 1.00 0.00 O ATOM 425 CB ALA A 30 6.359 6.813 -7.846 1.00 0.00 C ATOM 0 H ALA A 30 3.357 7.367 -7.649 1.00 0.00 H new ATOM 0 HA ALA A 30 5.426 7.271 -9.726 1.00 0.00 H new ATOM 0 HB1 ALA A 30 7.088 6.137 -8.293 1.00 0.00 H new ATOM 0 HB2 ALA A 30 6.801 7.803 -7.737 1.00 0.00 H new ATOM 0 HB3 ALA A 30 6.068 6.436 -6.866 1.00 0.00 H new ATOM 431 N THR A 31 4.968 4.709 -9.790 1.00 0.00 N ATOM 432 CA THR A 31 4.369 3.353 -9.948 1.00 0.00 C ATOM 433 C THR A 31 5.340 2.432 -10.690 1.00 0.00 C ATOM 434 O THR A 31 6.362 2.859 -11.189 1.00 0.00 O ATOM 435 CB THR A 31 3.061 3.465 -10.737 1.00 0.00 C ATOM 436 OG1 THR A 31 2.678 2.178 -11.202 1.00 0.00 O ATOM 437 CG2 THR A 31 3.257 4.404 -11.927 1.00 0.00 C ATOM 0 H THR A 31 5.738 4.925 -10.423 1.00 0.00 H new ATOM 0 HA THR A 31 4.168 2.933 -8.962 1.00 0.00 H new ATOM 0 HB THR A 31 2.280 3.864 -10.090 1.00 0.00 H new ATOM 0 HG1 THR A 31 1.840 2.248 -11.706 1.00 0.00 H new ATOM 0 HG21 THR A 31 2.325 4.482 -12.487 1.00 0.00 H new ATOM 0 HG22 THR A 31 3.548 5.391 -11.568 1.00 0.00 H new ATOM 0 HG23 THR A 31 4.038 4.010 -12.577 1.00 0.00 H new ATOM 445 N SER A 32 5.024 1.167 -10.767 1.00 0.00 N ATOM 446 CA SER A 32 5.920 0.210 -11.476 1.00 0.00 C ATOM 447 C SER A 32 5.271 -1.175 -11.501 1.00 0.00 C ATOM 448 O SER A 32 5.162 -1.837 -10.489 1.00 0.00 O ATOM 449 CB SER A 32 7.258 0.120 -10.742 1.00 0.00 C ATOM 450 OG SER A 32 7.301 1.100 -9.712 1.00 0.00 O ATOM 0 H SER A 32 4.181 0.755 -10.368 1.00 0.00 H new ATOM 0 HA SER A 32 6.083 0.560 -12.495 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.385 -0.876 -10.317 1.00 0.00 H new ATOM 0 HB3 SER A 32 8.080 0.276 -11.441 1.00 0.00 H new ATOM 0 HG SER A 32 7.419 1.988 -10.110 1.00 0.00 H new ATOM 456 N ALA A 33 4.842 -1.619 -12.650 1.00 0.00 N ATOM 457 CA ALA A 33 4.203 -2.963 -12.734 1.00 0.00 C ATOM 458 C ALA A 33 3.034 -3.032 -11.750 1.00 0.00 C ATOM 459 O ALA A 33 2.837 -4.022 -11.074 1.00 0.00 O ATOM 460 CB ALA A 33 5.235 -4.037 -12.383 1.00 0.00 C ATOM 0 H ALA A 33 4.906 -1.111 -13.532 1.00 0.00 H new ATOM 0 HA ALA A 33 3.834 -3.132 -13.746 1.00 0.00 H new ATOM 0 HB1 ALA A 33 4.771 -5.021 -12.443 1.00 0.00 H new ATOM 0 HB2 ALA A 33 6.068 -3.985 -13.085 1.00 0.00 H new ATOM 0 HB3 ALA A 33 5.603 -3.871 -11.370 1.00 0.00 H new ATOM 466 N GLY A 34 2.255 -1.987 -11.666 1.00 0.00 N ATOM 467 CA GLY A 34 1.099 -1.993 -10.725 1.00 0.00 C ATOM 468 C GLY A 34 -0.186 -1.658 -11.490 1.00 0.00 C ATOM 469 O GLY A 34 -0.207 -0.781 -12.330 1.00 0.00 O ATOM 0 H GLY A 34 2.369 -1.130 -12.208 1.00 0.00 H new ATOM 0 HA2 GLY A 34 1.008 -2.970 -10.251 1.00 0.00 H new ATOM 0 HA3 GLY A 34 1.261 -1.266 -9.929 1.00 0.00 H new ATOM 473 N PHE A 35 -1.259 -2.347 -11.204 1.00 0.00 N ATOM 474 CA PHE A 35 -2.539 -2.064 -11.916 1.00 0.00 C ATOM 475 C PHE A 35 -2.819 -0.559 -11.881 1.00 0.00 C ATOM 476 O PHE A 35 -2.069 0.209 -11.312 1.00 0.00 O ATOM 477 CB PHE A 35 -3.690 -2.811 -11.235 1.00 0.00 C ATOM 478 CG PHE A 35 -3.420 -2.928 -9.753 1.00 0.00 C ATOM 479 CD1 PHE A 35 -2.854 -1.854 -9.055 1.00 0.00 C ATOM 480 CD2 PHE A 35 -3.738 -4.112 -9.078 1.00 0.00 C ATOM 481 CE1 PHE A 35 -2.606 -1.966 -7.682 1.00 0.00 C ATOM 482 CE2 PHE A 35 -3.489 -4.224 -7.704 1.00 0.00 C ATOM 483 CZ PHE A 35 -2.923 -3.152 -7.007 1.00 0.00 C ATOM 0 H PHE A 35 -1.304 -3.092 -10.509 1.00 0.00 H new ATOM 0 HA PHE A 35 -2.456 -2.398 -12.950 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -4.628 -2.282 -11.402 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -3.801 -3.803 -11.673 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -2.609 -0.940 -9.576 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -4.176 -4.940 -9.617 1.00 0.00 H new ATOM 0 HE1 PHE A 35 -2.170 -1.138 -7.143 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.734 -5.138 -7.183 1.00 0.00 H new ATOM 0 HZ PHE A 35 -2.730 -3.238 -5.948 1.00 0.00 H new ATOM 493 N ALA A 36 -3.894 -0.131 -12.486 1.00 0.00 N ATOM 494 CA ALA A 36 -4.219 1.323 -12.486 1.00 0.00 C ATOM 495 C ALA A 36 -5.204 1.622 -11.353 1.00 0.00 C ATOM 496 O ALA A 36 -6.366 1.272 -11.419 1.00 0.00 O ATOM 497 CB ALA A 36 -4.849 1.702 -13.829 1.00 0.00 C ATOM 0 H ALA A 36 -4.560 -0.725 -12.980 1.00 0.00 H new ATOM 0 HA ALA A 36 -3.308 1.903 -12.337 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -5.088 2.766 -13.832 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -4.147 1.486 -14.634 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -5.762 1.125 -13.979 1.00 0.00 H new ATOM 503 N VAL A 37 -4.749 2.264 -10.310 1.00 0.00 N ATOM 504 CA VAL A 37 -5.659 2.580 -9.172 1.00 0.00 C ATOM 505 C VAL A 37 -6.028 4.065 -9.197 1.00 0.00 C ATOM 506 O VAL A 37 -5.387 4.856 -9.855 1.00 0.00 O ATOM 507 CB VAL A 37 -4.957 2.252 -7.851 1.00 0.00 C ATOM 508 CG1 VAL A 37 -5.988 2.191 -6.723 1.00 0.00 C ATOM 509 CG2 VAL A 37 -4.254 0.896 -7.970 1.00 0.00 C ATOM 0 H VAL A 37 -3.787 2.583 -10.197 1.00 0.00 H new ATOM 0 HA VAL A 37 -6.567 1.983 -9.263 1.00 0.00 H new ATOM 0 HB VAL A 37 -4.223 3.027 -7.630 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -5.486 1.957 -5.784 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -6.490 3.155 -6.636 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -6.723 1.417 -6.944 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -3.754 0.662 -7.030 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -4.990 0.123 -8.192 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -3.517 0.937 -8.772 1.00 0.00 H new ATOM 519 N THR A 38 -7.065 4.429 -8.474 1.00 0.00 N ATOM 520 CA THR A 38 -7.532 5.852 -8.407 1.00 0.00 C ATOM 521 C THR A 38 -8.666 6.175 -9.422 1.00 0.00 C ATOM 522 O THR A 38 -8.932 7.340 -9.642 1.00 0.00 O ATOM 523 CB THR A 38 -6.343 6.812 -8.626 1.00 0.00 C ATOM 524 OG1 THR A 38 -6.522 7.969 -7.820 1.00 0.00 O ATOM 525 CG2 THR A 38 -6.246 7.233 -10.098 1.00 0.00 C ATOM 0 H THR A 38 -7.619 3.781 -7.914 1.00 0.00 H new ATOM 0 HA THR A 38 -7.951 5.994 -7.411 1.00 0.00 H new ATOM 0 HB THR A 38 -5.423 6.297 -8.349 1.00 0.00 H new ATOM 0 HG1 THR A 38 -5.769 8.581 -7.954 1.00 0.00 H new ATOM 0 HG21 THR A 38 -5.401 7.909 -10.228 1.00 0.00 H new ATOM 0 HG22 THR A 38 -6.103 6.350 -10.720 1.00 0.00 H new ATOM 0 HG23 THR A 38 -7.165 7.740 -10.393 1.00 0.00 H new ATOM 533 N PRO A 39 -9.328 5.185 -10.008 1.00 0.00 N ATOM 534 CA PRO A 39 -10.421 5.475 -10.957 1.00 0.00 C ATOM 535 C PRO A 39 -11.568 6.171 -10.222 1.00 0.00 C ATOM 536 O PRO A 39 -12.406 6.817 -10.820 1.00 0.00 O ATOM 537 CB PRO A 39 -10.878 4.106 -11.475 1.00 0.00 C ATOM 538 CG PRO A 39 -10.096 3.025 -10.692 1.00 0.00 C ATOM 539 CD PRO A 39 -9.070 3.744 -9.802 1.00 0.00 C ATOM 0 HA PRO A 39 -10.103 6.130 -11.768 1.00 0.00 H new ATOM 0 HB2 PRO A 39 -11.951 3.981 -11.332 1.00 0.00 H new ATOM 0 HB3 PRO A 39 -10.687 4.018 -12.544 1.00 0.00 H new ATOM 0 HG2 PRO A 39 -10.775 2.426 -10.086 1.00 0.00 H new ATOM 0 HG3 PRO A 39 -9.595 2.343 -11.379 1.00 0.00 H new ATOM 0 HD2 PRO A 39 -9.193 3.467 -8.755 1.00 0.00 H new ATOM 0 HD3 PRO A 39 -8.050 3.481 -10.084 1.00 0.00 H new ATOM 547 N ALA A 40 -11.611 6.036 -8.924 1.00 0.00 N ATOM 548 CA ALA A 40 -12.700 6.679 -8.138 1.00 0.00 C ATOM 549 C ALA A 40 -12.629 6.194 -6.687 1.00 0.00 C ATOM 550 O ALA A 40 -12.346 6.955 -5.782 1.00 0.00 O ATOM 551 CB ALA A 40 -14.056 6.301 -8.737 1.00 0.00 C ATOM 0 H ALA A 40 -10.936 5.506 -8.373 1.00 0.00 H new ATOM 0 HA ALA A 40 -12.582 7.762 -8.168 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -14.852 6.772 -8.161 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -14.105 6.643 -9.771 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -14.178 5.218 -8.707 1.00 0.00 H new ATOM 557 N GLN A 41 -12.881 4.933 -6.458 1.00 0.00 N ATOM 558 CA GLN A 41 -12.824 4.401 -5.066 1.00 0.00 C ATOM 559 C GLN A 41 -11.447 4.692 -4.468 1.00 0.00 C ATOM 560 O GLN A 41 -11.287 4.774 -3.267 1.00 0.00 O ATOM 561 CB GLN A 41 -13.063 2.892 -5.084 1.00 0.00 C ATOM 562 CG GLN A 41 -14.563 2.611 -5.002 1.00 0.00 C ATOM 563 CD GLN A 41 -15.295 3.442 -6.058 1.00 0.00 C ATOM 564 OE1 GLN A 41 -15.878 4.462 -5.748 1.00 0.00 O ATOM 565 NE2 GLN A 41 -15.287 3.048 -7.301 1.00 0.00 N ATOM 0 H GLN A 41 -13.124 4.249 -7.174 1.00 0.00 H new ATOM 0 HA GLN A 41 -13.594 4.881 -4.462 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -12.651 2.459 -5.995 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -12.548 2.422 -4.246 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -14.755 1.550 -5.162 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -14.936 2.856 -4.008 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -14.798 2.192 -7.561 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -15.770 3.596 -8.013 1.00 0.00 H new ATOM 574 N GLY A 42 -10.452 4.849 -5.294 1.00 0.00 N ATOM 575 CA GLY A 42 -9.090 5.140 -4.764 1.00 0.00 C ATOM 576 C GLY A 42 -9.172 6.328 -3.804 1.00 0.00 C ATOM 577 O GLY A 42 -8.622 6.306 -2.718 1.00 0.00 O ATOM 0 H GLY A 42 -10.521 4.789 -6.310 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.692 4.266 -4.248 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -8.407 5.365 -5.583 1.00 0.00 H new ATOM 581 N GLN A 43 -9.862 7.365 -4.192 1.00 0.00 N ATOM 582 CA GLN A 43 -9.987 8.550 -3.301 1.00 0.00 C ATOM 583 C GLN A 43 -10.596 8.112 -1.968 1.00 0.00 C ATOM 584 O GLN A 43 -10.254 8.622 -0.919 1.00 0.00 O ATOM 585 CB GLN A 43 -10.887 9.594 -3.962 1.00 0.00 C ATOM 586 CG GLN A 43 -10.152 10.935 -4.025 1.00 0.00 C ATOM 587 CD GLN A 43 -10.330 11.674 -2.698 1.00 0.00 C ATOM 588 OE1 GLN A 43 -11.218 11.361 -1.930 1.00 0.00 O ATOM 589 NE2 GLN A 43 -9.519 12.651 -2.395 1.00 0.00 N ATOM 0 H GLN A 43 -10.344 7.442 -5.088 1.00 0.00 H new ATOM 0 HA GLN A 43 -9.003 8.986 -3.127 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -11.161 9.270 -4.966 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -11.813 9.701 -3.397 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -9.093 10.773 -4.224 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -10.542 11.538 -4.845 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -8.774 12.914 -3.040 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -9.631 13.152 -1.513 1.00 0.00 H new ATOM 598 N THR A 44 -11.493 7.165 -2.000 1.00 0.00 N ATOM 599 CA THR A 44 -12.118 6.685 -0.735 1.00 0.00 C ATOM 600 C THR A 44 -11.019 6.199 0.211 1.00 0.00 C ATOM 601 O THR A 44 -11.100 6.369 1.412 1.00 0.00 O ATOM 602 CB THR A 44 -13.078 5.532 -1.041 1.00 0.00 C ATOM 603 OG1 THR A 44 -14.141 6.005 -1.858 1.00 0.00 O ATOM 604 CG2 THR A 44 -13.642 4.976 0.268 1.00 0.00 C ATOM 0 H THR A 44 -11.820 6.703 -2.848 1.00 0.00 H new ATOM 0 HA THR A 44 -12.673 7.498 -0.268 1.00 0.00 H new ATOM 0 HB THR A 44 -12.543 4.742 -1.567 1.00 0.00 H new ATOM 0 HG1 THR A 44 -14.755 5.267 -2.056 1.00 0.00 H new ATOM 0 HG21 THR A 44 -14.325 4.155 0.050 1.00 0.00 H new ATOM 0 HG22 THR A 44 -12.825 4.612 0.891 1.00 0.00 H new ATOM 0 HG23 THR A 44 -14.178 5.764 0.797 1.00 0.00 H new ATOM 612 N LEU A 45 -9.986 5.606 -0.324 1.00 0.00 N ATOM 613 CA LEU A 45 -8.873 5.118 0.540 1.00 0.00 C ATOM 614 C LEU A 45 -8.341 6.289 1.363 1.00 0.00 C ATOM 615 O LEU A 45 -8.179 6.198 2.564 1.00 0.00 O ATOM 616 CB LEU A 45 -7.753 4.562 -0.343 1.00 0.00 C ATOM 617 CG LEU A 45 -6.568 4.142 0.529 1.00 0.00 C ATOM 618 CD1 LEU A 45 -6.487 2.616 0.578 1.00 0.00 C ATOM 619 CD2 LEU A 45 -5.275 4.700 -0.069 1.00 0.00 C ATOM 0 H LEU A 45 -9.865 5.438 -1.323 1.00 0.00 H new ATOM 0 HA LEU A 45 -9.232 4.332 1.204 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -8.117 3.708 -0.914 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -7.437 5.316 -1.064 1.00 0.00 H new ATOM 0 HG LEU A 45 -6.702 4.532 1.538 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -5.643 2.316 1.199 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -7.409 2.216 1.001 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -6.352 2.226 -0.431 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -4.429 4.402 0.551 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -5.142 4.308 -1.077 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -5.331 5.788 -0.107 1.00 0.00 H new ATOM 631 N ALA A 46 -8.073 7.393 0.723 1.00 0.00 N ATOM 632 CA ALA A 46 -7.558 8.578 1.465 1.00 0.00 C ATOM 633 C ALA A 46 -8.619 9.044 2.465 1.00 0.00 C ATOM 634 O ALA A 46 -8.319 9.688 3.451 1.00 0.00 O ATOM 635 CB ALA A 46 -7.253 9.704 0.475 1.00 0.00 C ATOM 0 H ALA A 46 -8.188 7.526 -0.282 1.00 0.00 H new ATOM 0 HA ALA A 46 -6.646 8.312 1.999 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -6.876 10.572 1.016 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -6.502 9.367 -0.239 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -8.164 9.976 -0.058 1.00 0.00 H new ATOM 641 N SER A 47 -9.860 8.720 2.220 1.00 0.00 N ATOM 642 CA SER A 47 -10.943 9.140 3.155 1.00 0.00 C ATOM 643 C SER A 47 -11.060 8.125 4.294 1.00 0.00 C ATOM 644 O SER A 47 -11.594 8.418 5.346 1.00 0.00 O ATOM 645 CB SER A 47 -12.270 9.206 2.398 1.00 0.00 C ATOM 646 OG SER A 47 -12.982 10.369 2.801 1.00 0.00 O ATOM 0 H SER A 47 -10.171 8.182 1.411 1.00 0.00 H new ATOM 0 HA SER A 47 -10.706 10.121 3.566 1.00 0.00 H new ATOM 0 HB2 SER A 47 -12.088 9.231 1.324 1.00 0.00 H new ATOM 0 HB3 SER A 47 -12.863 8.314 2.601 1.00 0.00 H new ATOM 0 HG SER A 47 -13.833 10.416 2.317 1.00 0.00 H new ATOM 652 N ALA A 48 -10.564 6.934 4.096 1.00 0.00 N ATOM 653 CA ALA A 48 -10.648 5.902 5.168 1.00 0.00 C ATOM 654 C ALA A 48 -9.638 6.229 6.270 1.00 0.00 C ATOM 655 O ALA A 48 -9.793 5.830 7.407 1.00 0.00 O ATOM 656 CB ALA A 48 -10.326 4.527 4.581 1.00 0.00 C ATOM 0 H ALA A 48 -10.104 6.631 3.238 1.00 0.00 H new ATOM 0 HA ALA A 48 -11.655 5.894 5.584 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -10.388 3.773 5.366 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -11.042 4.291 3.794 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -9.319 4.536 4.165 1.00 0.00 H new ATOM 662 N PHE A 49 -8.604 6.955 5.943 1.00 0.00 N ATOM 663 CA PHE A 49 -7.588 7.309 6.972 1.00 0.00 C ATOM 664 C PHE A 49 -8.290 7.910 8.190 1.00 0.00 C ATOM 665 O PHE A 49 -7.761 7.921 9.284 1.00 0.00 O ATOM 666 CB PHE A 49 -6.611 8.336 6.391 1.00 0.00 C ATOM 667 CG PHE A 49 -5.578 7.637 5.535 1.00 0.00 C ATOM 668 CD1 PHE A 49 -5.833 6.358 5.023 1.00 0.00 C ATOM 669 CD2 PHE A 49 -4.363 8.273 5.250 1.00 0.00 C ATOM 670 CE1 PHE A 49 -4.874 5.716 4.231 1.00 0.00 C ATOM 671 CE2 PHE A 49 -3.404 7.631 4.457 1.00 0.00 C ATOM 672 CZ PHE A 49 -3.660 6.353 3.946 1.00 0.00 C ATOM 0 H PHE A 49 -8.420 7.318 5.008 1.00 0.00 H new ATOM 0 HA PHE A 49 -7.042 6.414 7.269 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -7.153 9.070 5.795 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -6.120 8.880 7.198 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -6.770 5.867 5.240 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -4.166 9.260 5.642 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -5.070 4.729 3.839 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -2.467 8.122 4.240 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.922 5.859 3.332 1.00 0.00 H new ATOM 682 N ASN A 50 -9.480 8.412 8.008 1.00 0.00 N ATOM 683 CA ASN A 50 -10.221 9.016 9.149 1.00 0.00 C ATOM 684 C ASN A 50 -10.919 7.917 9.952 1.00 0.00 C ATOM 685 O ASN A 50 -11.002 7.977 11.163 1.00 0.00 O ATOM 686 CB ASN A 50 -11.269 9.992 8.610 1.00 0.00 C ATOM 687 CG ASN A 50 -11.291 11.252 9.479 1.00 0.00 C ATOM 688 OD1 ASN A 50 -10.607 12.214 9.191 1.00 0.00 O ATOM 689 ND2 ASN A 50 -12.053 11.286 10.537 1.00 0.00 N ATOM 0 H ASN A 50 -9.972 8.430 7.115 1.00 0.00 H new ATOM 0 HA ASN A 50 -9.521 9.545 9.795 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -11.040 10.254 7.577 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -12.252 9.522 8.609 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -12.075 12.121 11.123 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -12.627 10.478 10.778 1.00 0.00 H new ATOM 696 N ASN A 51 -11.428 6.914 9.289 1.00 0.00 N ATOM 697 CA ASN A 51 -12.126 5.817 10.017 1.00 0.00 C ATOM 698 C ASN A 51 -11.803 4.474 9.359 1.00 0.00 C ATOM 699 O ASN A 51 -11.696 4.370 8.153 1.00 0.00 O ATOM 700 CB ASN A 51 -13.637 6.059 9.962 1.00 0.00 C ATOM 701 CG ASN A 51 -14.147 6.455 11.349 1.00 0.00 C ATOM 702 OD1 ASN A 51 -14.242 7.625 11.662 1.00 0.00 O ATOM 703 ND2 ASN A 51 -14.483 5.523 12.197 1.00 0.00 N ATOM 0 H ASN A 51 -11.390 6.807 8.275 1.00 0.00 H new ATOM 0 HA ASN A 51 -11.792 5.799 11.054 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -13.863 6.846 9.243 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -14.147 5.158 9.620 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -14.826 5.776 13.124 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -14.403 4.541 11.934 1.00 0.00 H new ATOM 710 N ALA A 52 -11.650 3.440 10.144 1.00 0.00 N ATOM 711 CA ALA A 52 -11.338 2.101 9.567 1.00 0.00 C ATOM 712 C ALA A 52 -12.562 1.195 9.719 1.00 0.00 C ATOM 713 O ALA A 52 -12.453 -0.015 9.750 1.00 0.00 O ATOM 714 CB ALA A 52 -10.152 1.488 10.313 1.00 0.00 C ATOM 0 H ALA A 52 -11.728 3.466 11.161 1.00 0.00 H new ATOM 0 HA ALA A 52 -11.085 2.204 8.512 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -9.924 0.509 9.891 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -9.283 2.138 10.212 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -10.403 1.379 11.368 1.00 0.00 H new ATOM 720 N ASP A 53 -13.725 1.777 9.818 1.00 0.00 N ATOM 721 CA ASP A 53 -14.964 0.965 9.972 1.00 0.00 C ATOM 722 C ASP A 53 -15.252 0.155 8.697 1.00 0.00 C ATOM 723 O ASP A 53 -15.561 -1.017 8.781 1.00 0.00 O ATOM 724 CB ASP A 53 -16.144 1.893 10.267 1.00 0.00 C ATOM 725 CG ASP A 53 -16.214 2.163 11.771 1.00 0.00 C ATOM 726 OD1 ASP A 53 -15.279 1.795 12.464 1.00 0.00 O ATOM 727 OD2 ASP A 53 -17.201 2.734 12.206 1.00 0.00 O ATOM 0 H ASP A 53 -13.871 2.786 9.799 1.00 0.00 H new ATOM 0 HA ASP A 53 -14.823 0.267 10.798 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -16.029 2.830 9.723 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -17.073 1.438 9.924 1.00 0.00 H new ATOM 732 N PRO A 54 -15.156 0.791 7.549 1.00 0.00 N ATOM 733 CA PRO A 54 -15.425 0.112 6.267 1.00 0.00 C ATOM 734 C PRO A 54 -14.527 -1.119 6.110 1.00 0.00 C ATOM 735 O PRO A 54 -14.992 -2.241 6.168 1.00 0.00 O ATOM 736 CB PRO A 54 -15.118 1.163 5.192 1.00 0.00 C ATOM 737 CG PRO A 54 -14.818 2.500 5.917 1.00 0.00 C ATOM 738 CD PRO A 54 -14.778 2.212 7.427 1.00 0.00 C ATOM 0 HA PRO A 54 -16.451 -0.250 6.197 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -14.265 0.855 4.588 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -15.964 1.276 4.514 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -13.867 2.913 5.581 1.00 0.00 H new ATOM 0 HG3 PRO A 54 -15.585 3.240 5.689 1.00 0.00 H new ATOM 0 HD2 PRO A 54 -13.785 2.394 7.838 1.00 0.00 H new ATOM 0 HD3 PRO A 54 -15.471 2.854 7.971 1.00 0.00 H new ATOM 746 N ILE A 55 -13.250 -0.925 5.907 1.00 0.00 N ATOM 747 CA ILE A 55 -12.336 -2.101 5.743 1.00 0.00 C ATOM 748 C ILE A 55 -12.702 -3.179 6.766 1.00 0.00 C ATOM 749 O ILE A 55 -12.486 -4.355 6.546 1.00 0.00 O ATOM 750 CB ILE A 55 -10.867 -1.695 5.952 1.00 0.00 C ATOM 751 CG1 ILE A 55 -10.773 -0.323 6.625 1.00 0.00 C ATOM 752 CG2 ILE A 55 -10.153 -1.643 4.603 1.00 0.00 C ATOM 753 CD1 ILE A 55 -9.325 -0.065 7.044 1.00 0.00 C ATOM 0 H ILE A 55 -12.800 -0.011 5.848 1.00 0.00 H new ATOM 0 HA ILE A 55 -12.453 -2.483 4.729 1.00 0.00 H new ATOM 0 HB ILE A 55 -10.393 -2.436 6.596 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -11.110 0.455 5.940 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -11.428 -0.286 7.496 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -9.112 -1.355 4.753 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -10.194 -2.625 4.132 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -10.643 -0.912 3.960 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -9.253 0.911 7.524 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -9.006 -0.837 7.744 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -8.683 -0.085 6.164 1.00 0.00 H new ATOM 765 N ARG A 56 -13.253 -2.791 7.883 1.00 0.00 N ATOM 766 CA ARG A 56 -13.628 -3.798 8.915 1.00 0.00 C ATOM 767 C ARG A 56 -14.846 -4.593 8.441 1.00 0.00 C ATOM 768 O ARG A 56 -14.734 -5.732 8.034 1.00 0.00 O ATOM 769 CB ARG A 56 -13.964 -3.086 10.226 1.00 0.00 C ATOM 770 CG ARG A 56 -13.302 -3.827 11.391 1.00 0.00 C ATOM 771 CD ARG A 56 -14.201 -3.748 12.624 1.00 0.00 C ATOM 772 NE ARG A 56 -13.761 -4.757 13.628 1.00 0.00 N ATOM 773 CZ ARG A 56 -14.190 -4.690 14.859 1.00 0.00 C ATOM 774 NH1 ARG A 56 -15.018 -3.744 15.215 1.00 0.00 N ATOM 775 NH2 ARG A 56 -13.795 -5.572 15.734 1.00 0.00 N ATOM 0 H ARG A 56 -13.459 -1.822 8.125 1.00 0.00 H new ATOM 0 HA ARG A 56 -12.792 -4.479 9.074 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -13.615 -2.054 10.192 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -15.044 -3.053 10.368 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -13.128 -4.869 11.121 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -12.329 -3.387 11.609 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -14.157 -2.748 13.055 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -15.238 -3.929 12.342 1.00 0.00 H new ATOM 0 HE ARG A 56 -13.122 -5.503 13.352 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -15.331 -3.056 14.530 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -15.352 -3.694 16.178 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -13.152 -6.313 15.456 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -14.129 -5.521 16.696 1.00 0.00 H new ATOM 789 N ALA A 57 -16.012 -4.006 8.488 1.00 0.00 N ATOM 790 CA ALA A 57 -17.231 -4.736 8.040 1.00 0.00 C ATOM 791 C ALA A 57 -17.668 -4.210 6.672 1.00 0.00 C ATOM 792 O ALA A 57 -18.390 -3.238 6.571 1.00 0.00 O ATOM 793 CB ALA A 57 -18.357 -4.522 9.052 1.00 0.00 C ATOM 0 H ALA A 57 -16.172 -3.054 8.817 1.00 0.00 H new ATOM 0 HA ALA A 57 -17.008 -5.800 7.966 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -19.248 -5.056 8.723 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -18.047 -4.899 10.027 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -18.580 -3.458 9.129 1.00 0.00 H new ATOM 799 N SER A 58 -17.235 -4.845 5.617 1.00 0.00 N ATOM 800 CA SER A 58 -17.621 -4.383 4.253 1.00 0.00 C ATOM 801 C SER A 58 -16.671 -4.999 3.225 1.00 0.00 C ATOM 802 O SER A 58 -17.004 -5.955 2.553 1.00 0.00 O ATOM 803 CB SER A 58 -17.528 -2.860 4.179 1.00 0.00 C ATOM 804 OG SER A 58 -17.415 -2.462 2.818 1.00 0.00 O ATOM 0 H SER A 58 -16.629 -5.665 5.641 1.00 0.00 H new ATOM 0 HA SER A 58 -18.645 -4.692 4.042 1.00 0.00 H new ATOM 0 HB2 SER A 58 -18.411 -2.408 4.630 1.00 0.00 H new ATOM 0 HB3 SER A 58 -16.666 -2.509 4.745 1.00 0.00 H new ATOM 0 HG SER A 58 -17.357 -1.485 2.767 1.00 0.00 H new ATOM 810 N GLY A 59 -15.488 -4.460 3.097 1.00 0.00 N ATOM 811 CA GLY A 59 -14.518 -5.019 2.114 1.00 0.00 C ATOM 812 C GLY A 59 -13.465 -3.966 1.762 1.00 0.00 C ATOM 813 O GLY A 59 -13.313 -2.971 2.442 1.00 0.00 O ATOM 0 H GLY A 59 -15.153 -3.658 3.630 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -14.035 -5.903 2.530 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -15.043 -5.336 1.213 1.00 0.00 H new ATOM 817 N PHE A 60 -12.734 -4.186 0.703 1.00 0.00 N ATOM 818 CA PHE A 60 -11.682 -3.210 0.292 1.00 0.00 C ATOM 819 C PHE A 60 -11.948 -2.777 -1.152 1.00 0.00 C ATOM 820 O PHE A 60 -11.829 -3.559 -2.069 1.00 0.00 O ATOM 821 CB PHE A 60 -10.312 -3.888 0.376 1.00 0.00 C ATOM 822 CG PHE A 60 -9.243 -2.864 0.677 1.00 0.00 C ATOM 823 CD1 PHE A 60 -9.287 -1.602 0.071 1.00 0.00 C ATOM 824 CD2 PHE A 60 -8.201 -3.182 1.557 1.00 0.00 C ATOM 825 CE1 PHE A 60 -8.289 -0.660 0.347 1.00 0.00 C ATOM 826 CE2 PHE A 60 -7.202 -2.239 1.830 1.00 0.00 C ATOM 827 CZ PHE A 60 -7.246 -0.978 1.226 1.00 0.00 C ATOM 0 H PHE A 60 -12.820 -5.005 0.101 1.00 0.00 H new ATOM 0 HA PHE A 60 -11.700 -2.339 0.948 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -10.323 -4.653 1.153 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -10.089 -4.392 -0.564 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -10.090 -1.356 -0.608 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -8.168 -4.155 2.025 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -8.323 0.314 -0.119 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -6.397 -2.485 2.507 1.00 0.00 H new ATOM 0 HZ PHE A 60 -6.476 -0.250 1.437 1.00 0.00 H new ATOM 837 N ASP A 61 -12.316 -1.543 -1.362 1.00 0.00 N ATOM 838 CA ASP A 61 -12.599 -1.083 -2.751 1.00 0.00 C ATOM 839 C ASP A 61 -11.293 -0.740 -3.473 1.00 0.00 C ATOM 840 O ASP A 61 -10.370 -0.206 -2.892 1.00 0.00 O ATOM 841 CB ASP A 61 -13.495 0.158 -2.707 1.00 0.00 C ATOM 842 CG ASP A 61 -12.953 1.144 -1.669 1.00 0.00 C ATOM 843 OD1 ASP A 61 -11.767 1.426 -1.712 1.00 0.00 O ATOM 844 OD2 ASP A 61 -13.733 1.600 -0.851 1.00 0.00 O ATOM 0 H ASP A 61 -12.433 -0.836 -0.636 1.00 0.00 H new ATOM 0 HA ASP A 61 -13.104 -1.884 -3.291 1.00 0.00 H new ATOM 0 HB2 ASP A 61 -13.529 0.630 -3.689 1.00 0.00 H new ATOM 0 HB3 ASP A 61 -14.516 -0.127 -2.455 1.00 0.00 H new ATOM 849 N LEU A 62 -11.218 -1.038 -4.743 1.00 0.00 N ATOM 850 CA LEU A 62 -9.983 -0.728 -5.515 1.00 0.00 C ATOM 851 C LEU A 62 -10.359 -0.438 -6.971 1.00 0.00 C ATOM 852 O LEU A 62 -11.512 -0.229 -7.293 1.00 0.00 O ATOM 853 CB LEU A 62 -9.027 -1.921 -5.456 1.00 0.00 C ATOM 854 CG LEU A 62 -8.035 -1.721 -4.310 1.00 0.00 C ATOM 855 CD1 LEU A 62 -7.106 -2.933 -4.218 1.00 0.00 C ATOM 856 CD2 LEU A 62 -7.204 -0.464 -4.573 1.00 0.00 C ATOM 0 H LEU A 62 -11.962 -1.484 -5.279 1.00 0.00 H new ATOM 0 HA LEU A 62 -9.491 0.145 -5.085 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.588 -2.844 -5.309 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -8.493 -2.020 -6.401 1.00 0.00 H new ATOM 0 HG LEU A 62 -8.581 -1.611 -3.373 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -6.400 -2.789 -3.401 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -7.696 -3.831 -4.033 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -6.559 -3.044 -5.154 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.496 -0.319 -3.757 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -6.660 -0.577 -5.510 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -7.864 0.401 -4.639 1.00 0.00 H new ATOM 868 N ALA A 63 -9.395 -0.412 -7.853 1.00 0.00 N ATOM 869 CA ALA A 63 -9.699 -0.125 -9.283 1.00 0.00 C ATOM 870 C ALA A 63 -10.417 -1.319 -9.920 1.00 0.00 C ATOM 871 O ALA A 63 -9.798 -2.215 -10.458 1.00 0.00 O ATOM 872 CB ALA A 63 -8.395 0.141 -10.032 1.00 0.00 C ATOM 0 H ALA A 63 -8.411 -0.577 -7.644 1.00 0.00 H new ATOM 0 HA ALA A 63 -10.346 0.751 -9.342 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -8.613 0.351 -11.079 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -7.888 0.998 -9.588 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -7.751 -0.736 -9.965 1.00 0.00 H new ATOM 878 N GLY A 64 -11.720 -1.326 -9.874 1.00 0.00 N ATOM 879 CA GLY A 64 -12.486 -2.447 -10.488 1.00 0.00 C ATOM 880 C GLY A 64 -12.174 -3.755 -9.759 1.00 0.00 C ATOM 881 O GLY A 64 -12.311 -4.830 -10.309 1.00 0.00 O ATOM 0 H GLY A 64 -12.289 -0.602 -9.436 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -13.555 -2.239 -10.437 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -12.229 -2.539 -11.543 1.00 0.00 H new ATOM 885 N VAL A 65 -11.763 -3.678 -8.524 1.00 0.00 N ATOM 886 CA VAL A 65 -11.450 -4.922 -7.767 1.00 0.00 C ATOM 887 C VAL A 65 -11.981 -4.779 -6.340 1.00 0.00 C ATOM 888 O VAL A 65 -12.507 -3.749 -5.968 1.00 0.00 O ATOM 889 CB VAL A 65 -9.932 -5.153 -7.728 1.00 0.00 C ATOM 890 CG1 VAL A 65 -9.639 -6.635 -7.966 1.00 0.00 C ATOM 891 CG2 VAL A 65 -9.246 -4.324 -8.818 1.00 0.00 C ATOM 0 H VAL A 65 -11.630 -2.809 -8.007 1.00 0.00 H new ATOM 0 HA VAL A 65 -11.921 -5.773 -8.259 1.00 0.00 H new ATOM 0 HB VAL A 65 -9.551 -4.850 -6.753 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -8.562 -6.802 -7.939 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -10.118 -7.230 -7.189 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -10.028 -6.931 -8.940 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -8.170 -4.495 -8.782 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -9.628 -4.620 -9.795 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -9.451 -3.266 -8.654 1.00 0.00 H new ATOM 901 N HIS A 66 -11.850 -5.798 -5.537 1.00 0.00 N ATOM 902 CA HIS A 66 -12.354 -5.699 -4.140 1.00 0.00 C ATOM 903 C HIS A 66 -11.665 -6.750 -3.266 1.00 0.00 C ATOM 904 O HIS A 66 -11.847 -7.938 -3.444 1.00 0.00 O ATOM 905 CB HIS A 66 -13.866 -5.928 -4.121 1.00 0.00 C ATOM 906 CG HIS A 66 -14.169 -7.335 -4.551 1.00 0.00 C ATOM 907 ND1 HIS A 66 -13.673 -8.110 -5.570 1.00 0.00 N flip ATOM 908 CD2 HIS A 66 -15.100 -8.123 -3.895 1.00 0.00 C flip ATOM 909 CE1 HIS A 66 -14.286 -9.359 -5.549 1.00 0.00 C flip ATOM 910 NE2 HIS A 66 -15.136 -9.314 -4.519 1.00 0.00 N flip ATOM 0 H HIS A 66 -11.419 -6.688 -5.785 1.00 0.00 H new ATOM 0 HA HIS A 66 -12.134 -4.706 -3.749 1.00 0.00 H new ATOM 0 HB2 HIS A 66 -14.258 -5.751 -3.119 1.00 0.00 H new ATOM 0 HB3 HIS A 66 -14.359 -5.220 -4.786 1.00 0.00 H new ATOM 0 HD2 HIS A 66 -15.690 -7.834 -3.038 1.00 0.00 H new ATOM 0 HE1 HIS A 66 -14.112 -10.187 -6.221 1.00 0.00 H new ATOM 0 HE2 HIS A 66 -15.739 -10.088 -4.240 1.00 0.00 H new ATOM 918 N TYR A 67 -10.880 -6.320 -2.317 1.00 0.00 N ATOM 919 CA TYR A 67 -10.184 -7.293 -1.427 1.00 0.00 C ATOM 920 C TYR A 67 -10.926 -7.385 -0.095 1.00 0.00 C ATOM 921 O TYR A 67 -12.057 -6.957 0.031 1.00 0.00 O ATOM 922 CB TYR A 67 -8.749 -6.825 -1.165 1.00 0.00 C ATOM 923 CG TYR A 67 -7.992 -6.687 -2.468 1.00 0.00 C ATOM 924 CD1 TYR A 67 -8.545 -7.165 -3.664 1.00 0.00 C ATOM 925 CD2 TYR A 67 -6.728 -6.083 -2.477 1.00 0.00 C ATOM 926 CE1 TYR A 67 -7.837 -7.035 -4.864 1.00 0.00 C ATOM 927 CE2 TYR A 67 -6.020 -5.955 -3.677 1.00 0.00 C ATOM 928 CZ TYR A 67 -6.574 -6.432 -4.870 1.00 0.00 C ATOM 929 OH TYR A 67 -5.876 -6.306 -6.054 1.00 0.00 O ATOM 0 H TYR A 67 -10.690 -5.338 -2.119 1.00 0.00 H new ATOM 0 HA TYR A 67 -10.167 -8.269 -1.912 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -8.762 -5.869 -0.642 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -8.240 -7.537 -0.515 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -9.518 -7.634 -3.659 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -6.299 -5.716 -1.556 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -8.265 -7.400 -5.786 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -5.046 -5.488 -3.682 1.00 0.00 H new ATOM 0 HH TYR A 67 -5.307 -5.509 -6.015 1.00 0.00 H new ATOM 939 N VAL A 68 -10.292 -7.933 0.905 1.00 0.00 N ATOM 940 CA VAL A 68 -10.949 -8.047 2.236 1.00 0.00 C ATOM 941 C VAL A 68 -9.987 -7.538 3.311 1.00 0.00 C ATOM 942 O VAL A 68 -8.803 -7.392 3.077 1.00 0.00 O ATOM 943 CB VAL A 68 -11.301 -9.510 2.516 1.00 0.00 C ATOM 944 CG1 VAL A 68 -12.465 -9.573 3.507 1.00 0.00 C ATOM 945 CG2 VAL A 68 -11.707 -10.198 1.211 1.00 0.00 C ATOM 0 H VAL A 68 -9.344 -8.308 0.857 1.00 0.00 H new ATOM 0 HA VAL A 68 -11.863 -7.453 2.245 1.00 0.00 H new ATOM 0 HB VAL A 68 -10.434 -10.017 2.939 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -12.717 -10.615 3.707 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -12.177 -9.084 4.438 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -13.332 -9.065 3.083 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -11.957 -11.240 1.412 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -12.574 -9.691 0.787 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -10.879 -10.154 0.503 1.00 0.00 H new ATOM 955 N THR A 69 -10.482 -7.260 4.485 1.00 0.00 N ATOM 956 CA THR A 69 -9.589 -6.756 5.564 1.00 0.00 C ATOM 957 C THR A 69 -9.684 -7.671 6.786 1.00 0.00 C ATOM 958 O THR A 69 -10.728 -7.808 7.394 1.00 0.00 O ATOM 959 CB THR A 69 -10.007 -5.338 5.955 1.00 0.00 C ATOM 960 OG1 THR A 69 -10.802 -4.779 4.919 1.00 0.00 O ATOM 961 CG2 THR A 69 -8.761 -4.477 6.164 1.00 0.00 C ATOM 0 H THR A 69 -11.464 -7.360 4.743 1.00 0.00 H new ATOM 0 HA THR A 69 -8.561 -6.746 5.202 1.00 0.00 H new ATOM 0 HB THR A 69 -10.583 -5.370 6.880 1.00 0.00 H new ATOM 0 HG1 THR A 69 -11.735 -4.726 5.215 1.00 0.00 H new ATOM 0 HG21 THR A 69 -9.060 -3.466 6.443 1.00 0.00 H new ATOM 0 HG22 THR A 69 -8.151 -4.907 6.958 1.00 0.00 H new ATOM 0 HG23 THR A 69 -8.183 -4.443 5.240 1.00 0.00 H new ATOM 969 N LEU A 70 -8.598 -8.293 7.150 1.00 0.00 N ATOM 970 CA LEU A 70 -8.610 -9.195 8.334 1.00 0.00 C ATOM 971 C LEU A 70 -7.392 -8.886 9.202 1.00 0.00 C ATOM 972 O LEU A 70 -6.914 -9.720 9.946 1.00 0.00 O ATOM 973 CB LEU A 70 -8.548 -10.651 7.868 1.00 0.00 C ATOM 974 CG LEU A 70 -7.316 -10.848 6.982 1.00 0.00 C ATOM 975 CD1 LEU A 70 -6.321 -11.774 7.685 1.00 0.00 C ATOM 976 CD2 LEU A 70 -7.741 -11.473 5.649 1.00 0.00 C ATOM 0 H LEU A 70 -7.698 -8.215 6.676 1.00 0.00 H new ATOM 0 HA LEU A 70 -9.524 -9.040 8.908 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -8.501 -11.318 8.729 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -9.452 -10.906 7.315 1.00 0.00 H new ATOM 0 HG LEU A 70 -6.844 -9.883 6.798 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -5.444 -11.913 7.053 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -6.018 -11.330 8.633 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -6.791 -12.740 7.871 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -6.864 -11.614 5.017 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -8.214 -12.438 5.834 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -8.448 -10.813 5.147 1.00 0.00 H new ATOM 988 N ARG A 71 -6.881 -7.691 9.106 1.00 0.00 N ATOM 989 CA ARG A 71 -5.689 -7.317 9.914 1.00 0.00 C ATOM 990 C ARG A 71 -5.286 -5.882 9.578 1.00 0.00 C ATOM 991 O ARG A 71 -4.172 -5.620 9.169 1.00 0.00 O ATOM 992 CB ARG A 71 -4.524 -8.264 9.592 1.00 0.00 C ATOM 993 CG ARG A 71 -4.521 -8.598 8.096 1.00 0.00 C ATOM 994 CD ARG A 71 -3.324 -7.924 7.423 1.00 0.00 C ATOM 995 NE ARG A 71 -3.745 -6.601 6.859 1.00 0.00 N ATOM 996 CZ ARG A 71 -4.796 -6.497 6.088 1.00 0.00 C ATOM 997 NH1 ARG A 71 -5.386 -7.563 5.617 1.00 0.00 N ATOM 998 NH2 ARG A 71 -5.225 -5.316 5.738 1.00 0.00 N ATOM 0 H ARG A 71 -7.240 -6.954 8.499 1.00 0.00 H new ATOM 0 HA ARG A 71 -5.930 -7.394 10.974 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -3.578 -7.799 9.872 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -4.615 -9.179 10.178 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -4.471 -9.678 7.954 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -5.449 -8.259 7.635 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -2.519 -7.784 8.145 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -2.933 -8.561 6.630 1.00 0.00 H new ATOM 0 HE ARG A 71 -3.202 -5.767 7.081 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -5.028 -8.489 5.850 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -6.205 -7.469 5.017 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -4.741 -4.480 6.066 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -6.044 -5.229 5.137 1.00 0.00 H new ATOM 1012 N ALA A 72 -6.181 -4.948 9.746 1.00 0.00 N ATOM 1013 CA ALA A 72 -5.839 -3.533 9.434 1.00 0.00 C ATOM 1014 C ALA A 72 -5.289 -2.858 10.691 1.00 0.00 C ATOM 1015 O ALA A 72 -5.285 -1.649 10.805 1.00 0.00 O ATOM 1016 CB ALA A 72 -7.091 -2.794 8.952 1.00 0.00 C ATOM 0 H ALA A 72 -7.131 -5.103 10.085 1.00 0.00 H new ATOM 0 HA ALA A 72 -5.085 -3.504 8.648 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -6.837 -1.759 8.724 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -7.477 -3.279 8.055 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -7.851 -2.818 9.733 1.00 0.00 H new ATOM 1022 N ASP A 73 -4.824 -3.646 11.626 1.00 0.00 N ATOM 1023 CA ASP A 73 -4.259 -3.098 12.898 1.00 0.00 C ATOM 1024 C ASP A 73 -4.979 -1.800 13.299 1.00 0.00 C ATOM 1025 O ASP A 73 -6.108 -1.829 13.747 1.00 0.00 O ATOM 1026 CB ASP A 73 -2.756 -2.846 12.728 1.00 0.00 C ATOM 1027 CG ASP A 73 -2.461 -2.408 11.293 1.00 0.00 C ATOM 1028 OD1 ASP A 73 -2.970 -1.374 10.893 1.00 0.00 O ATOM 1029 OD2 ASP A 73 -1.727 -3.111 10.619 1.00 0.00 O ATOM 0 H ASP A 73 -4.811 -4.664 11.561 1.00 0.00 H new ATOM 0 HA ASP A 73 -4.411 -3.827 13.694 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -2.426 -2.078 13.427 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -2.198 -3.752 12.963 1.00 0.00 H new ATOM 1034 N ASP A 74 -4.342 -0.662 13.159 1.00 0.00 N ATOM 1035 CA ASP A 74 -5.012 0.611 13.553 1.00 0.00 C ATOM 1036 C ASP A 74 -5.107 1.561 12.353 1.00 0.00 C ATOM 1037 O ASP A 74 -6.165 2.070 12.042 1.00 0.00 O ATOM 1038 CB ASP A 74 -4.209 1.282 14.672 1.00 0.00 C ATOM 1039 CG ASP A 74 -4.866 2.610 15.055 1.00 0.00 C ATOM 1040 OD1 ASP A 74 -6.011 2.585 15.475 1.00 0.00 O ATOM 1041 OD2 ASP A 74 -4.212 3.632 14.922 1.00 0.00 O ATOM 0 H ASP A 74 -3.396 -0.563 12.792 1.00 0.00 H new ATOM 0 HA ASP A 74 -6.019 0.385 13.903 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -4.160 0.626 15.541 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -3.184 1.454 14.344 1.00 0.00 H new ATOM 1046 N ARG A 75 -4.011 1.823 11.687 1.00 0.00 N ATOM 1047 CA ARG A 75 -4.062 2.763 10.527 1.00 0.00 C ATOM 1048 C ARG A 75 -3.374 2.152 9.299 1.00 0.00 C ATOM 1049 O ARG A 75 -3.453 2.685 8.210 1.00 0.00 O ATOM 1050 CB ARG A 75 -3.355 4.064 10.905 1.00 0.00 C ATOM 1051 CG ARG A 75 -3.819 5.185 9.973 1.00 0.00 C ATOM 1052 CD ARG A 75 -5.311 5.443 10.190 1.00 0.00 C ATOM 1053 NE ARG A 75 -6.095 4.699 9.162 1.00 0.00 N ATOM 1054 CZ ARG A 75 -7.383 4.545 9.303 1.00 0.00 C ATOM 1055 NH1 ARG A 75 -7.995 5.055 10.339 1.00 0.00 N ATOM 1056 NH2 ARG A 75 -8.061 3.884 8.405 1.00 0.00 N ATOM 0 H ARG A 75 -3.092 1.431 11.893 1.00 0.00 H new ATOM 0 HA ARG A 75 -5.106 2.957 10.280 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -3.575 4.323 11.941 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -2.275 3.938 10.831 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -3.250 6.094 10.168 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -3.634 4.909 8.935 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -5.605 5.124 11.190 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -5.521 6.510 10.122 1.00 0.00 H new ATOM 0 HE ARG A 75 -5.623 4.309 8.346 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -7.466 5.575 11.039 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -9.002 4.933 10.447 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -7.584 3.489 7.595 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -9.068 3.763 8.513 1.00 0.00 H new ATOM 1070 N SER A 76 -2.705 1.045 9.456 1.00 0.00 N ATOM 1071 CA SER A 76 -2.020 0.418 8.286 1.00 0.00 C ATOM 1072 C SER A 76 -3.001 -0.531 7.590 1.00 0.00 C ATOM 1073 O SER A 76 -3.845 -1.129 8.227 1.00 0.00 O ATOM 1074 CB SER A 76 -0.812 -0.375 8.779 1.00 0.00 C ATOM 1075 OG SER A 76 -0.588 -0.085 10.152 1.00 0.00 O ATOM 0 H SER A 76 -2.601 0.546 10.340 1.00 0.00 H new ATOM 0 HA SER A 76 -1.691 1.188 7.588 1.00 0.00 H new ATOM 0 HB2 SER A 76 -0.984 -1.443 8.644 1.00 0.00 H new ATOM 0 HB3 SER A 76 0.070 -0.118 8.193 1.00 0.00 H new ATOM 0 HG SER A 76 0.186 -0.594 10.472 1.00 0.00 H new ATOM 1081 N ILE A 77 -2.919 -0.673 6.289 1.00 0.00 N ATOM 1082 CA ILE A 77 -3.880 -1.582 5.600 1.00 0.00 C ATOM 1083 C ILE A 77 -3.162 -2.461 4.568 1.00 0.00 C ATOM 1084 O ILE A 77 -3.225 -2.210 3.381 1.00 0.00 O ATOM 1085 CB ILE A 77 -4.974 -0.773 4.882 1.00 0.00 C ATOM 1086 CG1 ILE A 77 -5.086 0.646 5.458 1.00 0.00 C ATOM 1087 CG2 ILE A 77 -6.318 -1.481 5.052 1.00 0.00 C ATOM 1088 CD1 ILE A 77 -4.551 1.650 4.434 1.00 0.00 C ATOM 0 H ILE A 77 -2.241 -0.207 5.686 1.00 0.00 H new ATOM 0 HA ILE A 77 -4.332 -2.215 6.363 1.00 0.00 H new ATOM 0 HB ILE A 77 -4.707 -0.701 3.828 1.00 0.00 H new ATOM 0 HG12 ILE A 77 -6.125 0.873 5.698 1.00 0.00 H new ATOM 0 HG13 ILE A 77 -4.520 0.720 6.387 1.00 0.00 H new ATOM 0 HG21 ILE A 77 -7.096 -0.911 4.545 1.00 0.00 H new ATOM 0 HG22 ILE A 77 -6.260 -2.480 4.620 1.00 0.00 H new ATOM 0 HG23 ILE A 77 -6.557 -1.557 6.113 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -4.629 2.659 4.839 1.00 0.00 H new ATOM 0 HD12 ILE A 77 -3.507 1.426 4.216 1.00 0.00 H new ATOM 0 HD13 ILE A 77 -5.136 1.581 3.517 1.00 0.00 H new ATOM 1100 N TYR A 78 -2.517 -3.515 4.999 1.00 0.00 N ATOM 1101 CA TYR A 78 -1.845 -4.422 4.020 1.00 0.00 C ATOM 1102 C TYR A 78 -2.857 -5.497 3.612 1.00 0.00 C ATOM 1103 O TYR A 78 -2.814 -6.617 4.081 1.00 0.00 O ATOM 1104 CB TYR A 78 -0.620 -5.090 4.654 1.00 0.00 C ATOM 1105 CG TYR A 78 0.063 -4.140 5.609 1.00 0.00 C ATOM 1106 CD1 TYR A 78 -0.381 -4.044 6.932 1.00 0.00 C ATOM 1107 CD2 TYR A 78 1.149 -3.365 5.177 1.00 0.00 C ATOM 1108 CE1 TYR A 78 0.257 -3.174 7.824 1.00 0.00 C ATOM 1109 CE2 TYR A 78 1.787 -2.496 6.070 1.00 0.00 C ATOM 1110 CZ TYR A 78 1.341 -2.400 7.392 1.00 0.00 C ATOM 1111 OH TYR A 78 1.971 -1.542 8.271 1.00 0.00 O ATOM 0 H TYR A 78 -2.427 -3.785 5.978 1.00 0.00 H new ATOM 0 HA TYR A 78 -1.510 -3.850 3.155 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -0.924 -5.993 5.184 1.00 0.00 H new ATOM 0 HB3 TYR A 78 0.078 -5.397 3.875 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -1.217 -4.641 7.266 1.00 0.00 H new ATOM 0 HD2 TYR A 78 1.493 -3.439 4.156 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -0.087 -3.100 8.845 1.00 0.00 H new ATOM 0 HE2 TYR A 78 2.624 -1.900 5.738 1.00 0.00 H new ATOM 0 HH TYR A 78 2.703 -1.082 7.810 1.00 0.00 H new ATOM 1121 N GLY A 79 -3.787 -5.150 2.765 1.00 0.00 N ATOM 1122 CA GLY A 79 -4.832 -6.130 2.344 1.00 0.00 C ATOM 1123 C GLY A 79 -4.208 -7.299 1.582 1.00 0.00 C ATOM 1124 O GLY A 79 -3.017 -7.344 1.348 1.00 0.00 O ATOM 0 H GLY A 79 -3.870 -4.225 2.343 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -5.361 -6.503 3.221 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -5.570 -5.633 1.715 1.00 0.00 H new ATOM 1128 N LYS A 80 -5.020 -8.245 1.191 1.00 0.00 N ATOM 1129 CA LYS A 80 -4.507 -9.422 0.438 1.00 0.00 C ATOM 1130 C LYS A 80 -5.442 -9.709 -0.740 1.00 0.00 C ATOM 1131 O LYS A 80 -6.638 -9.507 -0.657 1.00 0.00 O ATOM 1132 CB LYS A 80 -4.462 -10.641 1.364 1.00 0.00 C ATOM 1133 CG LYS A 80 -3.135 -10.654 2.127 1.00 0.00 C ATOM 1134 CD LYS A 80 -3.156 -11.768 3.175 1.00 0.00 C ATOM 1135 CE LYS A 80 -3.132 -13.130 2.476 1.00 0.00 C ATOM 1136 NZ LYS A 80 -1.737 -13.654 2.457 1.00 0.00 N ATOM 0 H LYS A 80 -6.025 -8.251 1.364 1.00 0.00 H new ATOM 0 HA LYS A 80 -3.503 -9.213 0.068 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -5.296 -10.610 2.065 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.568 -11.557 0.783 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -2.307 -10.808 1.435 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -2.972 -9.690 2.609 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -2.297 -11.673 3.839 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -4.048 -11.681 3.795 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -3.787 -13.829 2.996 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -3.510 -13.035 1.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -1.735 -14.621 2.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -1.145 -13.044 1.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -1.356 -13.663 3.425 1.00 0.00 H new ATOM 1150 N LYS A 81 -4.914 -10.175 -1.838 1.00 0.00 N ATOM 1151 CA LYS A 81 -5.782 -10.468 -3.015 1.00 0.00 C ATOM 1152 C LYS A 81 -5.766 -11.970 -3.296 1.00 0.00 C ATOM 1153 O LYS A 81 -5.982 -12.404 -4.410 1.00 0.00 O ATOM 1154 CB LYS A 81 -5.258 -9.720 -4.242 1.00 0.00 C ATOM 1155 CG LYS A 81 -6.281 -9.821 -5.375 1.00 0.00 C ATOM 1156 CD LYS A 81 -5.655 -10.549 -6.567 1.00 0.00 C ATOM 1157 CE LYS A 81 -4.391 -9.810 -7.011 1.00 0.00 C ATOM 1158 NZ LYS A 81 -4.679 -9.029 -8.246 1.00 0.00 N ATOM 0 H LYS A 81 -3.921 -10.366 -1.972 1.00 0.00 H new ATOM 0 HA LYS A 81 -6.800 -10.144 -2.801 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -5.076 -8.674 -3.994 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -4.305 -10.143 -4.559 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -7.166 -10.357 -5.033 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -6.607 -8.825 -5.674 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -5.411 -11.575 -6.293 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -6.367 -10.600 -7.390 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -4.049 -9.144 -6.219 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -3.587 -10.522 -7.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -3.820 -8.527 -8.547 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -4.986 -9.675 -9.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -5.433 -8.339 -8.053 1.00 0.00 H new ATOM 1172 N GLY A 82 -5.506 -12.770 -2.300 1.00 0.00 N ATOM 1173 CA GLY A 82 -5.471 -14.241 -2.519 1.00 0.00 C ATOM 1174 C GLY A 82 -4.034 -14.666 -2.832 1.00 0.00 C ATOM 1175 O GLY A 82 -3.238 -14.893 -1.944 1.00 0.00 O ATOM 0 H GLY A 82 -5.316 -12.468 -1.344 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -5.833 -14.762 -1.633 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -6.132 -14.515 -3.341 1.00 0.00 H new ATOM 1179 N SER A 83 -3.693 -14.765 -4.088 1.00 0.00 N ATOM 1180 CA SER A 83 -2.305 -15.165 -4.450 1.00 0.00 C ATOM 1181 C SER A 83 -1.378 -13.959 -4.295 1.00 0.00 C ATOM 1182 O SER A 83 -0.190 -14.098 -4.084 1.00 0.00 O ATOM 1183 CB SER A 83 -2.271 -15.651 -5.899 1.00 0.00 C ATOM 1184 OG SER A 83 -2.885 -16.929 -5.978 1.00 0.00 O ATOM 0 H SER A 83 -4.314 -14.587 -4.877 1.00 0.00 H new ATOM 0 HA SER A 83 -1.975 -15.970 -3.793 1.00 0.00 H new ATOM 0 HB2 SER A 83 -2.792 -14.944 -6.545 1.00 0.00 H new ATOM 0 HB3 SER A 83 -1.241 -15.707 -6.252 1.00 0.00 H new ATOM 0 HG SER A 83 -2.867 -17.244 -6.906 1.00 0.00 H new ATOM 1190 N ALA A 84 -1.914 -12.774 -4.395 1.00 0.00 N ATOM 1191 CA ALA A 84 -1.067 -11.558 -4.249 1.00 0.00 C ATOM 1192 C ALA A 84 -1.447 -10.831 -2.959 1.00 0.00 C ATOM 1193 O ALA A 84 -2.123 -11.372 -2.106 1.00 0.00 O ATOM 1194 CB ALA A 84 -1.294 -10.629 -5.444 1.00 0.00 C ATOM 0 H ALA A 84 -2.903 -12.596 -4.572 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.017 -11.847 -4.211 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -0.674 -9.739 -5.336 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.027 -11.148 -6.364 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.343 -10.337 -5.484 1.00 0.00 H new ATOM 1200 N GLY A 85 -1.023 -9.607 -2.810 1.00 0.00 N ATOM 1201 CA GLY A 85 -1.365 -8.847 -1.576 1.00 0.00 C ATOM 1202 C GLY A 85 -1.016 -7.371 -1.772 1.00 0.00 C ATOM 1203 O GLY A 85 -0.039 -7.035 -2.411 1.00 0.00 O ATOM 0 H GLY A 85 -0.455 -9.101 -3.489 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -2.427 -8.954 -1.353 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -0.818 -9.251 -0.724 1.00 0.00 H new ATOM 1207 N VAL A 86 -1.810 -6.485 -1.233 1.00 0.00 N ATOM 1208 CA VAL A 86 -1.521 -5.031 -1.396 1.00 0.00 C ATOM 1209 C VAL A 86 -0.992 -4.451 -0.082 1.00 0.00 C ATOM 1210 O VAL A 86 -1.540 -4.684 0.979 1.00 0.00 O ATOM 1211 CB VAL A 86 -2.801 -4.294 -1.795 1.00 0.00 C ATOM 1212 CG1 VAL A 86 -3.751 -4.238 -0.597 1.00 0.00 C ATOM 1213 CG2 VAL A 86 -2.452 -2.870 -2.233 1.00 0.00 C ATOM 0 H VAL A 86 -2.644 -6.704 -0.688 1.00 0.00 H new ATOM 0 HA VAL A 86 -0.768 -4.905 -2.174 1.00 0.00 H new ATOM 0 HB VAL A 86 -3.283 -4.821 -2.618 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.663 -3.713 -0.880 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.999 -5.251 -0.281 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.269 -3.709 0.225 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -3.363 -2.343 -2.518 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.971 -2.343 -1.409 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.773 -2.907 -3.085 1.00 0.00 H new ATOM 1223 N ILE A 87 0.064 -3.688 -0.151 1.00 0.00 N ATOM 1224 CA ILE A 87 0.638 -3.076 1.081 1.00 0.00 C ATOM 1225 C ILE A 87 0.312 -1.580 1.083 1.00 0.00 C ATOM 1226 O ILE A 87 1.114 -0.766 0.673 1.00 0.00 O ATOM 1227 CB ILE A 87 2.157 -3.266 1.071 1.00 0.00 C ATOM 1228 CG1 ILE A 87 2.482 -4.758 0.961 1.00 0.00 C ATOM 1229 CG2 ILE A 87 2.758 -2.704 2.359 1.00 0.00 C ATOM 1230 CD1 ILE A 87 1.723 -5.532 2.039 1.00 0.00 C ATOM 0 H ILE A 87 0.557 -3.461 -1.014 1.00 0.00 H new ATOM 0 HA ILE A 87 0.217 -3.548 1.969 1.00 0.00 H new ATOM 0 HB ILE A 87 2.581 -2.736 0.218 1.00 0.00 H new ATOM 0 HG12 ILE A 87 2.208 -5.128 -0.027 1.00 0.00 H new ATOM 0 HG13 ILE A 87 3.555 -4.916 1.074 1.00 0.00 H new ATOM 0 HG21 ILE A 87 3.839 -2.842 2.346 1.00 0.00 H new ATOM 0 HG22 ILE A 87 2.529 -1.641 2.434 1.00 0.00 H new ATOM 0 HG23 ILE A 87 2.335 -3.228 3.216 1.00 0.00 H new ATOM 0 HD11 ILE A 87 1.957 -6.593 1.957 1.00 0.00 H new ATOM 0 HD12 ILE A 87 2.019 -5.170 3.024 1.00 0.00 H new ATOM 0 HD13 ILE A 87 0.651 -5.385 1.906 1.00 0.00 H new ATOM 1242 N THR A 88 -0.859 -1.207 1.525 1.00 0.00 N ATOM 1243 CA THR A 88 -1.224 0.238 1.520 1.00 0.00 C ATOM 1244 C THR A 88 -0.944 0.869 2.884 1.00 0.00 C ATOM 1245 O THR A 88 -1.529 0.503 3.884 1.00 0.00 O ATOM 1246 CB THR A 88 -2.710 0.386 1.193 1.00 0.00 C ATOM 1247 OG1 THR A 88 -3.481 0.032 2.332 1.00 0.00 O ATOM 1248 CG2 THR A 88 -3.070 -0.531 0.024 1.00 0.00 C ATOM 0 H THR A 88 -1.575 -1.837 1.887 1.00 0.00 H new ATOM 0 HA THR A 88 -0.623 0.746 0.766 1.00 0.00 H new ATOM 0 HB THR A 88 -2.922 1.419 0.919 1.00 0.00 H new ATOM 0 HG1 THR A 88 -3.012 -0.662 2.842 1.00 0.00 H new ATOM 0 HG21 THR A 88 -4.130 -0.425 -0.209 1.00 0.00 H new ATOM 0 HG22 THR A 88 -2.478 -0.257 -0.849 1.00 0.00 H new ATOM 0 HG23 THR A 88 -2.860 -1.566 0.295 1.00 0.00 H new ATOM 1256 N VAL A 89 -0.063 1.829 2.922 1.00 0.00 N ATOM 1257 CA VAL A 89 0.255 2.513 4.204 1.00 0.00 C ATOM 1258 C VAL A 89 0.672 3.952 3.903 1.00 0.00 C ATOM 1259 O VAL A 89 0.939 4.302 2.770 1.00 0.00 O ATOM 1260 CB VAL A 89 1.400 1.782 4.906 1.00 0.00 C ATOM 1261 CG1 VAL A 89 1.532 2.295 6.340 1.00 0.00 C ATOM 1262 CG2 VAL A 89 1.106 0.281 4.931 1.00 0.00 C ATOM 0 H VAL A 89 0.454 2.171 2.112 1.00 0.00 H new ATOM 0 HA VAL A 89 -0.620 2.509 4.854 1.00 0.00 H new ATOM 0 HB VAL A 89 2.330 1.964 4.367 1.00 0.00 H new ATOM 0 HG11 VAL A 89 2.348 1.773 6.839 1.00 0.00 H new ATOM 0 HG12 VAL A 89 1.740 3.365 6.326 1.00 0.00 H new ATOM 0 HG13 VAL A 89 0.602 2.113 6.879 1.00 0.00 H new ATOM 0 HG21 VAL A 89 1.922 -0.241 5.431 1.00 0.00 H new ATOM 0 HG22 VAL A 89 0.176 0.101 5.470 1.00 0.00 H new ATOM 0 HG23 VAL A 89 1.011 -0.088 3.910 1.00 0.00 H new ATOM 1272 N LYS A 90 0.733 4.794 4.896 1.00 0.00 N ATOM 1273 CA LYS A 90 1.138 6.209 4.636 1.00 0.00 C ATOM 1274 C LYS A 90 2.577 6.421 5.106 1.00 0.00 C ATOM 1275 O LYS A 90 3.091 5.676 5.917 1.00 0.00 O ATOM 1276 CB LYS A 90 0.214 7.191 5.376 1.00 0.00 C ATOM 1277 CG LYS A 90 -0.941 6.453 6.062 1.00 0.00 C ATOM 1278 CD LYS A 90 -0.535 6.087 7.491 1.00 0.00 C ATOM 1279 CE LYS A 90 -0.486 7.353 8.347 1.00 0.00 C ATOM 1280 NZ LYS A 90 -0.457 6.979 9.790 1.00 0.00 N ATOM 0 H LYS A 90 0.523 4.570 5.869 1.00 0.00 H new ATOM 0 HA LYS A 90 1.060 6.398 3.565 1.00 0.00 H new ATOM 0 HB2 LYS A 90 0.788 7.745 6.119 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -0.184 7.921 4.672 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -1.831 7.081 6.075 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -1.195 5.553 5.503 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.247 5.378 7.912 1.00 0.00 H new ATOM 0 HD3 LYS A 90 0.439 5.598 7.490 1.00 0.00 H new ATOM 0 HE2 LYS A 90 0.397 7.941 8.095 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -1.355 7.978 8.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -0.760 7.791 10.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -1.100 6.178 9.954 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.510 6.707 10.059 1.00 0.00 H new ATOM 1294 N THR A 91 3.233 7.434 4.607 1.00 0.00 N ATOM 1295 CA THR A 91 4.639 7.691 5.031 1.00 0.00 C ATOM 1296 C THR A 91 4.889 9.200 5.094 1.00 0.00 C ATOM 1297 O THR A 91 5.044 9.767 6.157 1.00 0.00 O ATOM 1298 CB THR A 91 5.606 7.057 4.031 1.00 0.00 C ATOM 1299 OG1 THR A 91 4.928 6.803 2.808 1.00 0.00 O ATOM 1300 CG2 THR A 91 6.144 5.744 4.603 1.00 0.00 C ATOM 0 H THR A 91 2.857 8.093 3.926 1.00 0.00 H new ATOM 0 HA THR A 91 4.801 7.253 6.016 1.00 0.00 H new ATOM 0 HB THR A 91 6.436 7.739 3.847 1.00 0.00 H new ATOM 0 HG1 THR A 91 5.549 6.398 2.167 1.00 0.00 H new ATOM 0 HG21 THR A 91 6.833 5.292 3.890 1.00 0.00 H new ATOM 0 HG22 THR A 91 6.667 5.942 5.538 1.00 0.00 H new ATOM 0 HG23 THR A 91 5.315 5.061 4.789 1.00 0.00 H new ATOM 1308 N SER A 92 4.934 9.856 3.967 1.00 0.00 N ATOM 1309 CA SER A 92 5.180 11.326 3.975 1.00 0.00 C ATOM 1310 C SER A 92 4.704 11.941 2.656 1.00 0.00 C ATOM 1311 O SER A 92 5.397 11.908 1.659 1.00 0.00 O ATOM 1312 CB SER A 92 6.675 11.590 4.147 1.00 0.00 C ATOM 1313 OG SER A 92 7.017 12.799 3.481 1.00 0.00 O ATOM 0 H SER A 92 4.812 9.440 3.044 1.00 0.00 H new ATOM 0 HA SER A 92 4.630 11.777 4.801 1.00 0.00 H new ATOM 0 HB2 SER A 92 6.924 11.661 5.206 1.00 0.00 H new ATOM 0 HB3 SER A 92 7.252 10.760 3.739 1.00 0.00 H new ATOM 0 HG SER A 92 6.846 12.703 2.521 1.00 0.00 H new ATOM 1319 N LYS A 93 3.530 12.512 2.648 1.00 0.00 N ATOM 1320 CA LYS A 93 3.013 13.141 1.399 1.00 0.00 C ATOM 1321 C LYS A 93 2.851 12.080 0.307 1.00 0.00 C ATOM 1322 O LYS A 93 3.051 12.347 -0.862 1.00 0.00 O ATOM 1323 CB LYS A 93 3.996 14.213 0.926 1.00 0.00 C ATOM 1324 CG LYS A 93 3.649 15.549 1.587 1.00 0.00 C ATOM 1325 CD LYS A 93 4.562 16.645 1.036 1.00 0.00 C ATOM 1326 CE LYS A 93 4.644 17.792 2.045 1.00 0.00 C ATOM 1327 NZ LYS A 93 3.505 18.727 1.821 1.00 0.00 N ATOM 0 H LYS A 93 2.906 12.570 3.453 1.00 0.00 H new ATOM 0 HA LYS A 93 2.043 13.595 1.602 1.00 0.00 H new ATOM 0 HB2 LYS A 93 5.016 13.924 1.179 1.00 0.00 H new ATOM 0 HB3 LYS A 93 3.952 14.309 -0.159 1.00 0.00 H new ATOM 0 HG2 LYS A 93 2.606 15.801 1.396 1.00 0.00 H new ATOM 0 HG3 LYS A 93 3.766 15.473 2.668 1.00 0.00 H new ATOM 0 HD2 LYS A 93 5.557 16.243 0.844 1.00 0.00 H new ATOM 0 HD3 LYS A 93 4.177 17.010 0.084 1.00 0.00 H new ATOM 0 HE2 LYS A 93 4.613 17.400 3.062 1.00 0.00 H new ATOM 0 HE3 LYS A 93 5.591 18.321 1.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 3.557 19.508 2.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 3.554 19.109 0.855 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 2.607 18.217 1.946 1.00 0.00 H new ATOM 1341 N SER A 94 2.486 10.880 0.670 1.00 0.00 N ATOM 1342 CA SER A 94 2.310 9.815 -0.356 1.00 0.00 C ATOM 1343 C SER A 94 1.943 8.494 0.325 1.00 0.00 C ATOM 1344 O SER A 94 2.405 8.192 1.407 1.00 0.00 O ATOM 1345 CB SER A 94 3.612 9.643 -1.138 1.00 0.00 C ATOM 1346 OG SER A 94 3.390 9.984 -2.500 1.00 0.00 O ATOM 0 H SER A 94 2.303 10.592 1.631 1.00 0.00 H new ATOM 0 HA SER A 94 1.509 10.100 -1.038 1.00 0.00 H new ATOM 0 HB2 SER A 94 4.391 10.277 -0.715 1.00 0.00 H new ATOM 0 HB3 SER A 94 3.963 8.614 -1.061 1.00 0.00 H new ATOM 0 HG SER A 94 3.600 10.931 -2.639 1.00 0.00 H new ATOM 1352 N ILE A 95 1.118 7.701 -0.306 1.00 0.00 N ATOM 1353 CA ILE A 95 0.723 6.396 0.295 1.00 0.00 C ATOM 1354 C ILE A 95 1.434 5.266 -0.448 1.00 0.00 C ATOM 1355 O ILE A 95 1.194 5.031 -1.615 1.00 0.00 O ATOM 1356 CB ILE A 95 -0.791 6.210 0.170 1.00 0.00 C ATOM 1357 CG1 ILE A 95 -1.503 7.213 1.078 1.00 0.00 C ATOM 1358 CG2 ILE A 95 -1.171 4.786 0.589 1.00 0.00 C ATOM 1359 CD1 ILE A 95 -2.999 7.218 0.761 1.00 0.00 C ATOM 0 H ILE A 95 0.700 7.903 -1.214 1.00 0.00 H new ATOM 0 HA ILE A 95 1.004 6.380 1.348 1.00 0.00 H new ATOM 0 HB ILE A 95 -1.091 6.375 -0.865 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -1.343 6.950 2.124 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -1.087 8.210 0.933 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -2.249 4.656 0.499 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -0.664 4.069 -0.057 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -0.870 4.619 1.623 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -3.506 7.933 1.409 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -3.149 7.502 -0.281 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -3.410 6.222 0.929 1.00 0.00 H new ATOM 1371 N LEU A 96 2.305 4.564 0.219 1.00 0.00 N ATOM 1372 CA LEU A 96 3.032 3.451 -0.449 1.00 0.00 C ATOM 1373 C LEU A 96 2.089 2.262 -0.645 1.00 0.00 C ATOM 1374 O LEU A 96 1.307 1.928 0.222 1.00 0.00 O ATOM 1375 CB LEU A 96 4.209 3.023 0.427 1.00 0.00 C ATOM 1376 CG LEU A 96 3.696 2.648 1.816 1.00 0.00 C ATOM 1377 CD1 LEU A 96 4.118 1.217 2.147 1.00 0.00 C ATOM 1378 CD2 LEU A 96 4.283 3.608 2.854 1.00 0.00 C ATOM 0 H LEU A 96 2.545 4.713 1.199 1.00 0.00 H new ATOM 0 HA LEU A 96 3.396 3.787 -1.420 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.723 2.174 -0.024 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.935 3.833 0.501 1.00 0.00 H new ATOM 0 HG LEU A 96 2.608 2.718 1.832 1.00 0.00 H new ATOM 0 HD11 LEU A 96 3.752 0.950 3.138 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.698 0.534 1.409 1.00 0.00 H new ATOM 0 HD13 LEU A 96 5.206 1.145 2.131 1.00 0.00 H new ATOM 0 HD21 LEU A 96 3.917 3.340 3.845 1.00 0.00 H new ATOM 0 HD22 LEU A 96 5.371 3.540 2.838 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.980 4.628 2.619 1.00 0.00 H new ATOM 1390 N VAL A 97 2.163 1.618 -1.777 1.00 0.00 N ATOM 1391 CA VAL A 97 1.278 0.445 -2.028 1.00 0.00 C ATOM 1392 C VAL A 97 2.122 -0.729 -2.518 1.00 0.00 C ATOM 1393 O VAL A 97 1.923 -1.235 -3.602 1.00 0.00 O ATOM 1394 CB VAL A 97 0.241 0.795 -3.094 1.00 0.00 C ATOM 1395 CG1 VAL A 97 -0.713 -0.387 -3.275 1.00 0.00 C ATOM 1396 CG2 VAL A 97 -0.551 2.026 -2.651 1.00 0.00 C ATOM 0 H VAL A 97 2.798 1.853 -2.540 1.00 0.00 H new ATOM 0 HA VAL A 97 0.769 0.176 -1.102 1.00 0.00 H new ATOM 0 HB VAL A 97 0.743 1.009 -4.037 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -1.455 -0.142 -4.035 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -0.149 -1.265 -3.588 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -1.216 -0.597 -2.331 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -1.291 2.276 -3.412 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -1.056 1.814 -1.709 1.00 0.00 H new ATOM 0 HG23 VAL A 97 0.129 2.867 -2.516 1.00 0.00 H new ATOM 1406 N GLY A 98 3.066 -1.167 -1.732 1.00 0.00 N ATOM 1407 CA GLY A 98 3.918 -2.309 -2.166 1.00 0.00 C ATOM 1408 C GLY A 98 3.026 -3.468 -2.611 1.00 0.00 C ATOM 1409 O GLY A 98 2.343 -4.078 -1.813 1.00 0.00 O ATOM 0 H GLY A 98 3.284 -0.785 -0.812 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.568 -2.001 -2.985 1.00 0.00 H new ATOM 0 HA3 GLY A 98 4.564 -2.626 -1.348 1.00 0.00 H new ATOM 1413 N VAL A 99 3.025 -3.781 -3.878 1.00 0.00 N ATOM 1414 CA VAL A 99 2.174 -4.907 -4.361 1.00 0.00 C ATOM 1415 C VAL A 99 3.075 -6.069 -4.796 1.00 0.00 C ATOM 1416 O VAL A 99 4.064 -5.881 -5.482 1.00 0.00 O ATOM 1417 CB VAL A 99 1.298 -4.465 -5.551 1.00 0.00 C ATOM 1418 CG1 VAL A 99 -0.168 -4.776 -5.242 1.00 0.00 C ATOM 1419 CG2 VAL A 99 1.438 -2.958 -5.806 1.00 0.00 C ATOM 0 H VAL A 99 3.573 -3.309 -4.597 1.00 0.00 H new ATOM 0 HA VAL A 99 1.519 -5.222 -3.549 1.00 0.00 H new ATOM 0 HB VAL A 99 1.627 -5.006 -6.438 1.00 0.00 H new ATOM 0 HG11 VAL A 99 -0.791 -4.465 -6.081 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.286 -5.847 -5.080 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.473 -4.237 -4.345 1.00 0.00 H new ATOM 0 HG21 VAL A 99 0.810 -2.672 -6.650 1.00 0.00 H new ATOM 0 HG22 VAL A 99 1.125 -2.408 -4.918 1.00 0.00 H new ATOM 0 HG23 VAL A 99 2.478 -2.722 -6.031 1.00 0.00 H new ATOM 1429 N TYR A 100 2.739 -7.268 -4.398 1.00 0.00 N ATOM 1430 CA TYR A 100 3.569 -8.447 -4.781 1.00 0.00 C ATOM 1431 C TYR A 100 2.657 -9.559 -5.306 1.00 0.00 C ATOM 1432 O TYR A 100 1.455 -9.400 -5.390 1.00 0.00 O ATOM 1433 CB TYR A 100 4.339 -8.951 -3.558 1.00 0.00 C ATOM 1434 CG TYR A 100 3.391 -9.114 -2.394 1.00 0.00 C ATOM 1435 CD1 TYR A 100 2.568 -10.244 -2.313 1.00 0.00 C ATOM 1436 CD2 TYR A 100 3.337 -8.136 -1.393 1.00 0.00 C ATOM 1437 CE1 TYR A 100 1.691 -10.396 -1.232 1.00 0.00 C ATOM 1438 CE2 TYR A 100 2.459 -8.288 -0.313 1.00 0.00 C ATOM 1439 CZ TYR A 100 1.637 -9.418 -0.233 1.00 0.00 C ATOM 1440 OH TYR A 100 0.772 -9.566 0.833 1.00 0.00 O ATOM 0 H TYR A 100 1.924 -7.481 -3.823 1.00 0.00 H new ATOM 0 HA TYR A 100 4.276 -8.158 -5.558 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.819 -9.903 -3.785 1.00 0.00 H new ATOM 0 HB3 TYR A 100 5.131 -8.248 -3.299 1.00 0.00 H new ATOM 0 HD1 TYR A 100 2.610 -10.999 -3.085 1.00 0.00 H new ATOM 0 HD2 TYR A 100 3.972 -7.265 -1.454 1.00 0.00 H new ATOM 0 HE1 TYR A 100 1.057 -11.268 -1.169 1.00 0.00 H new ATOM 0 HE2 TYR A 100 2.416 -7.533 0.458 1.00 0.00 H new ATOM 0 HH TYR A 100 0.861 -8.798 1.436 1.00 0.00 H new ATOM 1450 N ASN A 101 3.215 -10.686 -5.659 1.00 0.00 N ATOM 1451 CA ASN A 101 2.374 -11.802 -6.178 1.00 0.00 C ATOM 1452 C ASN A 101 2.500 -13.014 -5.251 1.00 0.00 C ATOM 1453 O ASN A 101 2.636 -12.877 -4.052 1.00 0.00 O ATOM 1454 CB ASN A 101 2.841 -12.178 -7.587 1.00 0.00 C ATOM 1455 CG ASN A 101 2.879 -10.925 -8.464 1.00 0.00 C ATOM 1456 OD1 ASN A 101 2.170 -9.971 -8.212 1.00 0.00 O ATOM 1457 ND2 ASN A 101 3.683 -10.887 -9.491 1.00 0.00 N ATOM 0 H ASN A 101 4.215 -10.881 -5.610 1.00 0.00 H new ATOM 0 HA ASN A 101 1.331 -11.486 -6.215 1.00 0.00 H new ATOM 0 HB2 ASN A 101 3.830 -12.635 -7.544 1.00 0.00 H new ATOM 0 HB3 ASN A 101 2.167 -12.917 -8.020 1.00 0.00 H new ATOM 0 HD21 ASN A 101 3.716 -10.056 -10.082 1.00 0.00 H new ATOM 0 HD22 ASN A 101 4.278 -11.688 -9.703 1.00 0.00 H new ATOM 1464 N GLU A 102 2.450 -14.201 -5.794 1.00 0.00 N ATOM 1465 CA GLU A 102 2.560 -15.416 -4.943 1.00 0.00 C ATOM 1466 C GLU A 102 4.033 -15.691 -4.625 1.00 0.00 C ATOM 1467 O GLU A 102 4.374 -16.089 -3.529 1.00 0.00 O ATOM 1468 CB GLU A 102 1.964 -16.610 -5.697 1.00 0.00 C ATOM 1469 CG GLU A 102 2.398 -17.914 -5.027 1.00 0.00 C ATOM 1470 CD GLU A 102 1.879 -17.947 -3.590 1.00 0.00 C ATOM 1471 OE1 GLU A 102 0.735 -18.325 -3.403 1.00 0.00 O ATOM 1472 OE2 GLU A 102 2.634 -17.591 -2.700 1.00 0.00 O ATOM 0 H GLU A 102 2.338 -14.380 -6.792 1.00 0.00 H new ATOM 0 HA GLU A 102 2.017 -15.262 -4.011 1.00 0.00 H new ATOM 0 HB2 GLU A 102 0.876 -16.540 -5.707 1.00 0.00 H new ATOM 0 HB3 GLU A 102 2.293 -16.597 -6.736 1.00 0.00 H new ATOM 0 HG2 GLU A 102 2.011 -18.767 -5.584 1.00 0.00 H new ATOM 0 HG3 GLU A 102 3.485 -17.995 -5.034 1.00 0.00 H new ATOM 1479 N LYS A 103 4.906 -15.488 -5.573 1.00 0.00 N ATOM 1480 CA LYS A 103 6.353 -15.746 -5.319 1.00 0.00 C ATOM 1481 C LYS A 103 6.740 -15.182 -3.950 1.00 0.00 C ATOM 1482 O LYS A 103 7.036 -15.915 -3.027 1.00 0.00 O ATOM 1483 CB LYS A 103 7.192 -15.072 -6.407 1.00 0.00 C ATOM 1484 CG LYS A 103 7.311 -16.008 -7.611 1.00 0.00 C ATOM 1485 CD LYS A 103 8.721 -15.907 -8.199 1.00 0.00 C ATOM 1486 CE LYS A 103 9.392 -17.281 -8.154 1.00 0.00 C ATOM 1487 NZ LYS A 103 10.856 -17.113 -7.940 1.00 0.00 N ATOM 0 H LYS A 103 4.681 -15.155 -6.511 1.00 0.00 H new ATOM 0 HA LYS A 103 6.538 -16.820 -5.334 1.00 0.00 H new ATOM 0 HB2 LYS A 103 6.730 -14.132 -6.708 1.00 0.00 H new ATOM 0 HB3 LYS A 103 8.182 -14.831 -6.021 1.00 0.00 H new ATOM 0 HG2 LYS A 103 7.104 -17.035 -7.309 1.00 0.00 H new ATOM 0 HG3 LYS A 103 6.571 -15.743 -8.366 1.00 0.00 H new ATOM 0 HD2 LYS A 103 8.673 -15.547 -9.227 1.00 0.00 H new ATOM 0 HD3 LYS A 103 9.311 -15.184 -7.636 1.00 0.00 H new ATOM 0 HE2 LYS A 103 8.963 -17.881 -7.351 1.00 0.00 H new ATOM 0 HE3 LYS A 103 9.209 -17.817 -9.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 11.312 -18.047 -7.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 11.259 -16.556 -8.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 11.021 -16.618 -7.040 1.00 0.00 H new ATOM 1501 N ILE A 104 6.738 -13.883 -3.809 1.00 0.00 N ATOM 1502 CA ILE A 104 7.103 -13.278 -2.497 1.00 0.00 C ATOM 1503 C ILE A 104 6.045 -13.652 -1.456 1.00 0.00 C ATOM 1504 O ILE A 104 4.862 -13.633 -1.728 1.00 0.00 O ATOM 1505 CB ILE A 104 7.165 -11.757 -2.639 1.00 0.00 C ATOM 1506 CG1 ILE A 104 8.216 -11.389 -3.689 1.00 0.00 C ATOM 1507 CG2 ILE A 104 7.545 -11.132 -1.297 1.00 0.00 C ATOM 1508 CD1 ILE A 104 7.701 -10.226 -4.538 1.00 0.00 C ATOM 0 H ILE A 104 6.500 -13.217 -4.544 1.00 0.00 H new ATOM 0 HA ILE A 104 8.076 -13.652 -2.178 1.00 0.00 H new ATOM 0 HB ILE A 104 6.190 -11.381 -2.949 1.00 0.00 H new ATOM 0 HG12 ILE A 104 9.151 -11.112 -3.202 1.00 0.00 H new ATOM 0 HG13 ILE A 104 8.430 -12.250 -4.323 1.00 0.00 H new ATOM 0 HG21 ILE A 104 7.589 -10.048 -1.400 1.00 0.00 H new ATOM 0 HG22 ILE A 104 6.798 -11.396 -0.548 1.00 0.00 H new ATOM 0 HG23 ILE A 104 8.520 -11.506 -0.984 1.00 0.00 H new ATOM 0 HD11 ILE A 104 8.449 -9.963 -5.286 1.00 0.00 H new ATOM 0 HD12 ILE A 104 6.777 -10.520 -5.036 1.00 0.00 H new ATOM 0 HD13 ILE A 104 7.510 -9.365 -3.898 1.00 0.00 H new ATOM 1520 N GLN A 105 6.462 -13.998 -0.268 1.00 0.00 N ATOM 1521 CA GLN A 105 5.478 -14.378 0.785 1.00 0.00 C ATOM 1522 C GLN A 105 4.870 -13.115 1.407 1.00 0.00 C ATOM 1523 O GLN A 105 5.492 -12.071 1.420 1.00 0.00 O ATOM 1524 CB GLN A 105 6.188 -15.194 1.869 1.00 0.00 C ATOM 1525 CG GLN A 105 5.898 -16.680 1.654 1.00 0.00 C ATOM 1526 CD GLN A 105 7.182 -17.490 1.846 1.00 0.00 C ATOM 1527 OE1 GLN A 105 7.516 -18.321 1.027 1.00 0.00 O ATOM 1528 NE2 GLN A 105 7.919 -17.283 2.903 1.00 0.00 N ATOM 0 H GLN A 105 7.440 -14.034 0.018 1.00 0.00 H new ATOM 0 HA GLN A 105 4.682 -14.975 0.340 1.00 0.00 H new ATOM 0 HB2 GLN A 105 7.262 -15.012 1.832 1.00 0.00 H new ATOM 0 HB3 GLN A 105 5.846 -14.884 2.856 1.00 0.00 H new ATOM 0 HG2 GLN A 105 5.136 -17.017 2.357 1.00 0.00 H new ATOM 0 HG3 GLN A 105 5.501 -16.842 0.652 1.00 0.00 H new ATOM 0 HE21 GLN A 105 7.639 -16.585 3.591 1.00 0.00 H new ATOM 0 HE22 GLN A 105 8.775 -17.820 3.041 1.00 0.00 H new ATOM 1537 N PRO A 106 3.662 -13.250 1.900 1.00 0.00 N ATOM 1538 CA PRO A 106 2.935 -12.131 2.527 1.00 0.00 C ATOM 1539 C PRO A 106 3.654 -11.669 3.799 1.00 0.00 C ATOM 1540 O PRO A 106 3.420 -10.584 4.295 1.00 0.00 O ATOM 1541 CB PRO A 106 1.553 -12.706 2.875 1.00 0.00 C ATOM 1542 CG PRO A 106 1.546 -14.200 2.460 1.00 0.00 C ATOM 1543 CD PRO A 106 2.924 -14.527 1.865 1.00 0.00 C ATOM 0 HA PRO A 106 2.869 -11.264 1.869 1.00 0.00 H new ATOM 0 HB2 PRO A 106 1.354 -12.604 3.942 1.00 0.00 H new ATOM 0 HB3 PRO A 106 0.769 -12.160 2.351 1.00 0.00 H new ATOM 0 HG2 PRO A 106 1.341 -14.835 3.322 1.00 0.00 H new ATOM 0 HG3 PRO A 106 0.759 -14.390 1.730 1.00 0.00 H new ATOM 0 HD2 PRO A 106 3.434 -15.295 2.447 1.00 0.00 H new ATOM 0 HD3 PRO A 106 2.836 -14.905 0.846 1.00 0.00 H new ATOM 1551 N GLY A 107 4.523 -12.483 4.334 1.00 0.00 N ATOM 1552 CA GLY A 107 5.249 -12.088 5.575 1.00 0.00 C ATOM 1553 C GLY A 107 6.609 -11.492 5.209 1.00 0.00 C ATOM 1554 O GLY A 107 7.273 -10.889 6.027 1.00 0.00 O ATOM 0 H GLY A 107 4.762 -13.404 3.966 1.00 0.00 H new ATOM 0 HA2 GLY A 107 4.662 -11.361 6.136 1.00 0.00 H new ATOM 0 HA3 GLY A 107 5.383 -12.956 6.221 1.00 0.00 H new ATOM 1558 N THR A 108 7.027 -11.655 3.985 1.00 0.00 N ATOM 1559 CA THR A 108 8.343 -11.097 3.569 1.00 0.00 C ATOM 1560 C THR A 108 8.166 -9.639 3.145 1.00 0.00 C ATOM 1561 O THR A 108 8.960 -8.784 3.479 1.00 0.00 O ATOM 1562 CB THR A 108 8.889 -11.902 2.389 1.00 0.00 C ATOM 1563 OG1 THR A 108 8.243 -13.167 2.343 1.00 0.00 O ATOM 1564 CG2 THR A 108 10.396 -12.101 2.558 1.00 0.00 C ATOM 0 H THR A 108 6.514 -12.150 3.255 1.00 0.00 H new ATOM 0 HA THR A 108 9.041 -11.154 4.404 1.00 0.00 H new ATOM 0 HB THR A 108 8.699 -11.363 1.461 1.00 0.00 H new ATOM 0 HG1 THR A 108 8.911 -13.879 2.431 1.00 0.00 H new ATOM 0 HG21 THR A 108 10.784 -12.675 1.716 1.00 0.00 H new ATOM 0 HG22 THR A 108 10.890 -11.130 2.593 1.00 0.00 H new ATOM 0 HG23 THR A 108 10.590 -12.640 3.485 1.00 0.00 H new ATOM 1572 N ALA A 109 7.129 -9.351 2.411 1.00 0.00 N ATOM 1573 CA ALA A 109 6.904 -7.948 1.965 1.00 0.00 C ATOM 1574 C ALA A 109 6.319 -7.132 3.119 1.00 0.00 C ATOM 1575 O ALA A 109 6.419 -5.921 3.148 1.00 0.00 O ATOM 1576 CB ALA A 109 5.930 -7.938 0.785 1.00 0.00 C ATOM 0 H ALA A 109 6.428 -10.024 2.101 1.00 0.00 H new ATOM 0 HA ALA A 109 7.852 -7.509 1.656 1.00 0.00 H new ATOM 0 HB1 ALA A 109 5.765 -6.911 0.458 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.349 -8.518 -0.037 1.00 0.00 H new ATOM 0 HB3 ALA A 109 4.981 -8.378 1.093 1.00 0.00 H new ATOM 1582 N ALA A 110 5.712 -7.783 4.074 1.00 0.00 N ATOM 1583 CA ALA A 110 5.124 -7.042 5.226 1.00 0.00 C ATOM 1584 C ALA A 110 6.209 -6.775 6.271 1.00 0.00 C ATOM 1585 O ALA A 110 6.086 -5.893 7.096 1.00 0.00 O ATOM 1586 CB ALA A 110 4.009 -7.880 5.855 1.00 0.00 C ATOM 0 H ALA A 110 5.598 -8.796 4.106 1.00 0.00 H new ATOM 0 HA ALA A 110 4.716 -6.094 4.876 1.00 0.00 H new ATOM 0 HB1 ALA A 110 3.578 -7.339 6.698 1.00 0.00 H new ATOM 0 HB2 ALA A 110 3.234 -8.071 5.112 1.00 0.00 H new ATOM 0 HB3 ALA A 110 4.419 -8.828 6.204 1.00 0.00 H new ATOM 1592 N ASN A 111 7.270 -7.534 6.243 1.00 0.00 N ATOM 1593 CA ASN A 111 8.362 -7.328 7.236 1.00 0.00 C ATOM 1594 C ASN A 111 9.252 -6.168 6.783 1.00 0.00 C ATOM 1595 O ASN A 111 9.702 -5.371 7.581 1.00 0.00 O ATOM 1596 CB ASN A 111 9.200 -8.604 7.339 1.00 0.00 C ATOM 1597 CG ASN A 111 8.602 -9.524 8.405 1.00 0.00 C ATOM 1598 OD1 ASN A 111 7.431 -9.845 8.358 1.00 0.00 O ATOM 1599 ND2 ASN A 111 9.361 -9.964 9.371 1.00 0.00 N ATOM 0 H ASN A 111 7.428 -8.288 5.575 1.00 0.00 H new ATOM 0 HA ASN A 111 7.931 -7.095 8.210 1.00 0.00 H new ATOM 0 HB2 ASN A 111 9.225 -9.114 6.376 1.00 0.00 H new ATOM 0 HB3 ASN A 111 10.230 -8.355 7.595 1.00 0.00 H new ATOM 0 HD21 ASN A 111 8.971 -10.577 10.087 1.00 0.00 H new ATOM 0 HD22 ASN A 111 10.344 -9.695 9.410 1.00 0.00 H new ATOM 1606 N VAL A 112 9.510 -6.072 5.508 1.00 0.00 N ATOM 1607 CA VAL A 112 10.372 -4.968 5.001 1.00 0.00 C ATOM 1608 C VAL A 112 9.588 -3.654 5.015 1.00 0.00 C ATOM 1609 O VAL A 112 10.152 -2.585 5.134 1.00 0.00 O ATOM 1610 CB VAL A 112 10.806 -5.283 3.570 1.00 0.00 C ATOM 1611 CG1 VAL A 112 9.571 -5.586 2.721 1.00 0.00 C ATOM 1612 CG2 VAL A 112 11.543 -4.077 2.984 1.00 0.00 C ATOM 0 H VAL A 112 9.160 -6.712 4.794 1.00 0.00 H new ATOM 0 HA VAL A 112 11.250 -4.872 5.640 1.00 0.00 H new ATOM 0 HB VAL A 112 11.469 -6.148 3.572 1.00 0.00 H new ATOM 0 HG11 VAL A 112 9.878 -5.811 1.700 1.00 0.00 H new ATOM 0 HG12 VAL A 112 9.044 -6.444 3.139 1.00 0.00 H new ATOM 0 HG13 VAL A 112 8.910 -4.720 2.719 1.00 0.00 H new ATOM 0 HG21 VAL A 112 11.853 -4.301 1.963 1.00 0.00 H new ATOM 0 HG22 VAL A 112 10.880 -3.212 2.980 1.00 0.00 H new ATOM 0 HG23 VAL A 112 12.422 -3.858 3.590 1.00 0.00 H new ATOM 1622 N VAL A 113 8.292 -3.724 4.891 1.00 0.00 N ATOM 1623 CA VAL A 113 7.474 -2.479 4.894 1.00 0.00 C ATOM 1624 C VAL A 113 7.420 -1.910 6.312 1.00 0.00 C ATOM 1625 O VAL A 113 7.404 -0.711 6.510 1.00 0.00 O ATOM 1626 CB VAL A 113 6.057 -2.802 4.417 1.00 0.00 C ATOM 1627 CG1 VAL A 113 5.207 -1.529 4.435 1.00 0.00 C ATOM 1628 CG2 VAL A 113 6.116 -3.354 2.991 1.00 0.00 C ATOM 0 H VAL A 113 7.763 -4.590 4.788 1.00 0.00 H new ATOM 0 HA VAL A 113 7.923 -1.744 4.226 1.00 0.00 H new ATOM 0 HB VAL A 113 5.611 -3.544 5.079 1.00 0.00 H new ATOM 0 HG11 VAL A 113 4.198 -1.761 4.095 1.00 0.00 H new ATOM 0 HG12 VAL A 113 5.166 -1.133 5.450 1.00 0.00 H new ATOM 0 HG13 VAL A 113 5.651 -0.786 3.773 1.00 0.00 H new ATOM 0 HG21 VAL A 113 5.107 -3.585 2.648 1.00 0.00 H new ATOM 0 HG22 VAL A 113 6.562 -2.610 2.331 1.00 0.00 H new ATOM 0 HG23 VAL A 113 6.721 -4.261 2.977 1.00 0.00 H new ATOM 1638 N GLU A 114 7.393 -2.760 7.301 1.00 0.00 N ATOM 1639 CA GLU A 114 7.339 -2.268 8.706 1.00 0.00 C ATOM 1640 C GLU A 114 8.592 -1.439 9.005 1.00 0.00 C ATOM 1641 O GLU A 114 8.524 -0.402 9.635 1.00 0.00 O ATOM 1642 CB GLU A 114 7.273 -3.463 9.659 1.00 0.00 C ATOM 1643 CG GLU A 114 5.901 -4.130 9.543 1.00 0.00 C ATOM 1644 CD GLU A 114 5.942 -5.506 10.212 1.00 0.00 C ATOM 1645 OE1 GLU A 114 6.873 -6.246 9.942 1.00 0.00 O ATOM 1646 OE2 GLU A 114 5.041 -5.794 10.981 1.00 0.00 O ATOM 0 H GLU A 114 7.406 -3.775 7.197 1.00 0.00 H new ATOM 0 HA GLU A 114 6.454 -1.646 8.842 1.00 0.00 H new ATOM 0 HB2 GLU A 114 8.059 -4.179 9.418 1.00 0.00 H new ATOM 0 HB3 GLU A 114 7.445 -3.135 10.684 1.00 0.00 H new ATOM 0 HG2 GLU A 114 5.141 -3.507 10.015 1.00 0.00 H new ATOM 0 HG3 GLU A 114 5.622 -4.232 8.494 1.00 0.00 H new ATOM 1653 N LYS A 115 9.734 -1.886 8.559 1.00 0.00 N ATOM 1654 CA LYS A 115 10.988 -1.123 8.818 1.00 0.00 C ATOM 1655 C LYS A 115 11.030 0.111 7.916 1.00 0.00 C ATOM 1656 O LYS A 115 11.471 1.171 8.312 1.00 0.00 O ATOM 1657 CB LYS A 115 12.195 -2.014 8.517 1.00 0.00 C ATOM 1658 CG LYS A 115 13.457 -1.385 9.110 1.00 0.00 C ATOM 1659 CD LYS A 115 14.677 -2.211 8.702 1.00 0.00 C ATOM 1660 CE LYS A 115 15.586 -1.370 7.803 1.00 0.00 C ATOM 1661 NZ LYS A 115 15.035 -1.349 6.419 1.00 0.00 N ATOM 0 H LYS A 115 9.853 -2.747 8.026 1.00 0.00 H new ATOM 0 HA LYS A 115 11.015 -0.811 9.862 1.00 0.00 H new ATOM 0 HB2 LYS A 115 12.040 -3.008 8.937 1.00 0.00 H new ATOM 0 HB3 LYS A 115 12.309 -2.137 7.440 1.00 0.00 H new ATOM 0 HG2 LYS A 115 13.565 -0.359 8.758 1.00 0.00 H new ATOM 0 HG3 LYS A 115 13.379 -1.343 10.196 1.00 0.00 H new ATOM 0 HD2 LYS A 115 15.223 -2.535 9.588 1.00 0.00 H new ATOM 0 HD3 LYS A 115 14.360 -3.112 8.176 1.00 0.00 H new ATOM 0 HE2 LYS A 115 15.660 -0.354 8.192 1.00 0.00 H new ATOM 0 HE3 LYS A 115 16.594 -1.784 7.798 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 15.653 -0.777 5.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 14.986 -2.320 6.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 14.081 -0.935 6.431 1.00 0.00 H new ATOM 1675 N LEU A 116 10.575 -0.023 6.701 1.00 0.00 N ATOM 1676 CA LEU A 116 10.587 1.135 5.764 1.00 0.00 C ATOM 1677 C LEU A 116 9.894 2.334 6.416 1.00 0.00 C ATOM 1678 O LEU A 116 10.441 3.417 6.489 1.00 0.00 O ATOM 1679 CB LEU A 116 9.845 0.750 4.483 1.00 0.00 C ATOM 1680 CG LEU A 116 10.792 0.853 3.287 1.00 0.00 C ATOM 1681 CD1 LEU A 116 11.293 2.290 3.156 1.00 0.00 C ATOM 1682 CD2 LEU A 116 11.986 -0.082 3.494 1.00 0.00 C ATOM 0 H LEU A 116 10.194 -0.887 6.316 1.00 0.00 H new ATOM 0 HA LEU A 116 11.617 1.403 5.527 1.00 0.00 H new ATOM 0 HB2 LEU A 116 9.459 -0.266 4.567 1.00 0.00 H new ATOM 0 HB3 LEU A 116 8.987 1.406 4.337 1.00 0.00 H new ATOM 0 HG LEU A 116 10.259 0.567 2.380 1.00 0.00 H new ATOM 0 HD11 LEU A 116 11.968 2.364 2.303 1.00 0.00 H new ATOM 0 HD12 LEU A 116 10.445 2.959 3.006 1.00 0.00 H new ATOM 0 HD13 LEU A 116 11.824 2.575 4.065 1.00 0.00 H new ATOM 0 HD21 LEU A 116 12.659 -0.007 2.640 1.00 0.00 H new ATOM 0 HD22 LEU A 116 12.518 0.203 4.402 1.00 0.00 H new ATOM 0 HD23 LEU A 116 11.632 -1.109 3.588 1.00 0.00 H new ATOM 1694 N ALA A 117 8.690 2.153 6.888 1.00 0.00 N ATOM 1695 CA ALA A 117 7.965 3.286 7.529 1.00 0.00 C ATOM 1696 C ALA A 117 8.538 3.541 8.926 1.00 0.00 C ATOM 1697 O ALA A 117 8.529 4.652 9.416 1.00 0.00 O ATOM 1698 CB ALA A 117 6.478 2.941 7.637 1.00 0.00 C ATOM 0 H ALA A 117 8.178 1.271 6.857 1.00 0.00 H new ATOM 0 HA ALA A 117 8.087 4.184 6.923 1.00 0.00 H new ATOM 0 HB1 ALA A 117 5.946 3.769 8.106 1.00 0.00 H new ATOM 0 HB2 ALA A 117 6.072 2.766 6.641 1.00 0.00 H new ATOM 0 HB3 ALA A 117 6.356 2.042 8.242 1.00 0.00 H new ATOM 1704 N ASP A 118 9.038 2.522 9.571 1.00 0.00 N ATOM 1705 CA ASP A 118 9.609 2.711 10.934 1.00 0.00 C ATOM 1706 C ASP A 118 10.665 3.818 10.901 1.00 0.00 C ATOM 1707 O ASP A 118 10.940 4.457 11.897 1.00 0.00 O ATOM 1708 CB ASP A 118 10.255 1.405 11.402 1.00 0.00 C ATOM 1709 CG ASP A 118 9.708 1.031 12.780 1.00 0.00 C ATOM 1710 OD1 ASP A 118 9.087 1.879 13.398 1.00 0.00 O ATOM 1711 OD2 ASP A 118 9.917 -0.097 13.193 1.00 0.00 O ATOM 0 H ASP A 118 9.075 1.568 9.213 1.00 0.00 H new ATOM 0 HA ASP A 118 8.812 2.992 11.623 1.00 0.00 H new ATOM 0 HB2 ASP A 118 10.048 0.608 10.688 1.00 0.00 H new ATOM 0 HB3 ASP A 118 11.338 1.518 11.447 1.00 0.00 H new ATOM 1716 N TYR A 119 11.260 4.049 9.763 1.00 0.00 N ATOM 1717 CA TYR A 119 12.299 5.112 9.668 1.00 0.00 C ATOM 1718 C TYR A 119 11.630 6.465 9.408 1.00 0.00 C ATOM 1719 O TYR A 119 11.928 7.449 10.055 1.00 0.00 O ATOM 1720 CB TYR A 119 13.253 4.786 8.517 1.00 0.00 C ATOM 1721 CG TYR A 119 14.638 5.291 8.847 1.00 0.00 C ATOM 1722 CD1 TYR A 119 15.230 4.963 10.073 1.00 0.00 C ATOM 1723 CD2 TYR A 119 15.329 6.087 7.927 1.00 0.00 C ATOM 1724 CE1 TYR A 119 16.513 5.434 10.379 1.00 0.00 C ATOM 1725 CE2 TYR A 119 16.612 6.557 8.232 1.00 0.00 C ATOM 1726 CZ TYR A 119 17.205 6.230 9.459 1.00 0.00 C ATOM 1727 OH TYR A 119 18.468 6.695 9.761 1.00 0.00 O ATOM 0 H TYR A 119 11.071 3.547 8.895 1.00 0.00 H new ATOM 0 HA TYR A 119 12.856 5.159 10.604 1.00 0.00 H new ATOM 0 HB2 TYR A 119 13.279 3.710 8.347 1.00 0.00 H new ATOM 0 HB3 TYR A 119 12.897 5.246 7.595 1.00 0.00 H new ATOM 0 HD1 TYR A 119 14.697 4.347 10.782 1.00 0.00 H new ATOM 0 HD2 TYR A 119 14.872 6.339 6.981 1.00 0.00 H new ATOM 0 HE1 TYR A 119 16.969 5.183 11.325 1.00 0.00 H new ATOM 0 HE2 TYR A 119 17.145 7.172 7.522 1.00 0.00 H new ATOM 0 HH TYR A 119 18.807 7.231 9.014 1.00 0.00 H new ATOM 1737 N LEU A 120 10.735 6.523 8.458 1.00 0.00 N ATOM 1738 CA LEU A 120 10.054 7.813 8.145 1.00 0.00 C ATOM 1739 C LEU A 120 9.007 8.134 9.216 1.00 0.00 C ATOM 1740 O LEU A 120 8.364 9.163 9.173 1.00 0.00 O ATOM 1741 CB LEU A 120 9.361 7.701 6.786 1.00 0.00 C ATOM 1742 CG LEU A 120 10.157 8.478 5.741 1.00 0.00 C ATOM 1743 CD1 LEU A 120 9.470 8.358 4.378 1.00 0.00 C ATOM 1744 CD2 LEU A 120 10.225 9.951 6.149 1.00 0.00 C ATOM 0 H LEU A 120 10.446 5.731 7.884 1.00 0.00 H new ATOM 0 HA LEU A 120 10.798 8.609 8.123 1.00 0.00 H new ATOM 0 HB2 LEU A 120 9.280 6.654 6.492 1.00 0.00 H new ATOM 0 HB3 LEU A 120 8.346 8.093 6.850 1.00 0.00 H new ATOM 0 HG LEU A 120 11.165 8.069 5.674 1.00 0.00 H new ATOM 0 HD11 LEU A 120 10.040 8.913 3.633 1.00 0.00 H new ATOM 0 HD12 LEU A 120 9.419 7.309 4.087 1.00 0.00 H new ATOM 0 HD13 LEU A 120 8.461 8.766 4.442 1.00 0.00 H new ATOM 0 HD21 LEU A 120 10.793 10.509 5.405 1.00 0.00 H new ATOM 0 HD22 LEU A 120 9.216 10.357 6.215 1.00 0.00 H new ATOM 0 HD23 LEU A 120 10.715 10.038 7.119 1.00 0.00 H new ATOM 1756 N ILE A 121 8.822 7.264 10.171 1.00 0.00 N ATOM 1757 CA ILE A 121 7.807 7.533 11.229 1.00 0.00 C ATOM 1758 C ILE A 121 8.428 8.412 12.324 1.00 0.00 C ATOM 1759 O ILE A 121 7.827 9.362 12.784 1.00 0.00 O ATOM 1760 CB ILE A 121 7.309 6.188 11.806 1.00 0.00 C ATOM 1761 CG1 ILE A 121 5.921 5.884 11.237 1.00 0.00 C ATOM 1762 CG2 ILE A 121 7.214 6.234 13.338 1.00 0.00 C ATOM 1763 CD1 ILE A 121 6.055 4.971 10.017 1.00 0.00 C ATOM 0 H ILE A 121 9.327 6.383 10.265 1.00 0.00 H new ATOM 0 HA ILE A 121 6.955 8.067 10.808 1.00 0.00 H new ATOM 0 HB ILE A 121 8.023 5.413 11.527 1.00 0.00 H new ATOM 0 HG12 ILE A 121 5.303 5.405 11.996 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.421 6.811 10.957 1.00 0.00 H new ATOM 0 HG21 ILE A 121 6.861 5.272 13.710 1.00 0.00 H new ATOM 0 HG22 ILE A 121 8.198 6.446 13.757 1.00 0.00 H new ATOM 0 HG23 ILE A 121 6.516 7.017 13.636 1.00 0.00 H new ATOM 0 HD11 ILE A 121 5.066 4.756 9.613 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.657 5.467 9.256 1.00 0.00 H new ATOM 0 HD13 ILE A 121 6.537 4.039 10.311 1.00 0.00 H new ATOM 1775 N GLY A 122 9.623 8.103 12.745 1.00 0.00 N ATOM 1776 CA GLY A 122 10.270 8.922 13.810 1.00 0.00 C ATOM 1777 C GLY A 122 10.904 10.170 13.191 1.00 0.00 C ATOM 1778 O GLY A 122 11.635 10.891 13.840 1.00 0.00 O ATOM 0 H GLY A 122 10.179 7.321 12.399 1.00 0.00 H new ATOM 0 HA2 GLY A 122 9.532 9.211 14.558 1.00 0.00 H new ATOM 0 HA3 GLY A 122 11.030 8.333 14.323 1.00 0.00 H new ATOM 1782 N GLN A 123 10.635 10.430 11.942 1.00 0.00 N ATOM 1783 CA GLN A 123 11.229 11.629 11.288 1.00 0.00 C ATOM 1784 C GLN A 123 10.114 12.550 10.783 1.00 0.00 C ATOM 1785 O GLN A 123 9.682 13.454 11.471 1.00 0.00 O ATOM 1786 CB GLN A 123 12.096 11.185 10.109 1.00 0.00 C ATOM 1787 CG GLN A 123 13.566 11.167 10.533 1.00 0.00 C ATOM 1788 CD GLN A 123 14.427 10.684 9.363 1.00 0.00 C ATOM 1789 OE1 GLN A 123 14.692 11.429 8.442 1.00 0.00 O ATOM 1790 NE2 GLN A 123 14.878 9.460 9.362 1.00 0.00 N ATOM 0 H GLN A 123 10.030 9.865 11.346 1.00 0.00 H new ATOM 0 HA GLN A 123 11.841 12.169 12.011 1.00 0.00 H new ATOM 0 HB2 GLN A 123 11.791 10.194 9.773 1.00 0.00 H new ATOM 0 HB3 GLN A 123 11.958 11.863 9.267 1.00 0.00 H new ATOM 0 HG2 GLN A 123 13.879 12.164 10.842 1.00 0.00 H new ATOM 0 HG3 GLN A 123 13.700 10.510 11.393 1.00 0.00 H new ATOM 0 HE21 GLN A 123 14.655 8.834 10.136 1.00 0.00 H new ATOM 0 HE22 GLN A 123 15.453 9.129 8.587 1.00 0.00 H new ATOM 1799 N GLY A 124 9.648 12.330 9.583 1.00 0.00 N ATOM 1800 CA GLY A 124 8.567 13.197 9.030 1.00 0.00 C ATOM 1801 C GLY A 124 7.197 12.667 9.464 1.00 0.00 C ATOM 1802 O GLY A 124 6.681 13.033 10.501 1.00 0.00 O ATOM 0 H GLY A 124 9.969 11.588 8.962 1.00 0.00 H new ATOM 0 HA2 GLY A 124 8.697 14.221 9.379 1.00 0.00 H new ATOM 0 HA3 GLY A 124 8.629 13.220 7.942 1.00 0.00 H new ATOM 1806 N PHE A 125 6.604 11.809 8.678 1.00 0.00 N ATOM 1807 CA PHE A 125 5.266 11.260 9.044 1.00 0.00 C ATOM 1808 C PHE A 125 5.272 9.742 8.856 1.00 0.00 C ATOM 1809 O PHE A 125 6.217 9.240 8.269 1.00 0.00 O ATOM 1810 CB PHE A 125 4.189 11.879 8.146 1.00 0.00 C ATOM 1811 CG PHE A 125 4.405 13.371 8.048 1.00 0.00 C ATOM 1812 CD1 PHE A 125 5.479 13.877 7.305 1.00 0.00 C ATOM 1813 CD2 PHE A 125 3.529 14.250 8.698 1.00 0.00 C ATOM 1814 CE1 PHE A 125 5.678 15.261 7.215 1.00 0.00 C ATOM 1815 CE2 PHE A 125 3.729 15.633 8.608 1.00 0.00 C ATOM 1816 CZ PHE A 125 4.803 16.138 7.866 1.00 0.00 C ATOM 1817 OXT PHE A 125 4.330 9.106 9.299 1.00 0.00 O ATOM 0 H PHE A 125 6.988 11.464 7.798 1.00 0.00 H new ATOM 0 HA PHE A 125 5.050 11.501 10.085 1.00 0.00 H new ATOM 0 HB2 PHE A 125 4.227 11.430 7.153 1.00 0.00 H new ATOM 0 HB3 PHE A 125 3.199 11.671 8.552 1.00 0.00 H new ATOM 0 HD1 PHE A 125 6.154 13.200 6.802 1.00 0.00 H new ATOM 0 HD2 PHE A 125 2.699 13.861 9.269 1.00 0.00 H new ATOM 0 HE1 PHE A 125 6.507 15.651 6.643 1.00 0.00 H new ATOM 0 HE2 PHE A 125 3.055 16.310 9.111 1.00 0.00 H new ATOM 0 HZ PHE A 125 4.957 17.205 7.796 1.00 0.00 H new TER 1827 PHE A 125