USER MOD reduce.3.24.130724 H: found=0, std=0, add=809, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 811 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 115 GLN : amide:sc= -0.188 K(o=0.0085,f=-4.1!) USER MOD Set 1.2: A 117 LYS NZ :NH3+ -128:sc= 0.197 (180deg=-0.0208) USER MOD Single : A 27 SER OG : rot 160:sc= 0 USER MOD Single : A 28 HIS : no HD1:sc= 0 X(o=0,f=-0.07) USER MOD Single : A 29 MET CE :methyl 163:sc= -0.241 (180deg=-0.633) USER MOD Single : A 30 GLN : amide:sc= -0.52 K(o=-0.52,f=-5.7!) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= -1.49 USER MOD Single : A 46 ASN : amide:sc= -1.42 K(o=-1.4,f=-2.5!) USER MOD Single : A 48 GLN : amide:sc= 0.618 K(o=0.62,f=-4.8!) USER MOD Single : A 49 SER OG : rot -102:sc= 0.882 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0.393 K(o=0.39,f=-2.3!) USER MOD Single : A 55 TYR OH : rot 180:sc= -0.936 USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 THR OG1 : rot 144:sc= 0.0121 USER MOD Single : A 74 LYS NZ :NH3+ -123:sc= -0.14 (180deg=-3.22!) USER MOD Single : A 77 SER OG : rot 13:sc= -0.476 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.0163 USER MOD Single : A 81 LYS NZ :NH3+ -172:sc= 1.1 (180deg=1.01) USER MOD Single : A 83 THR OG1 : rot 97:sc= -1.05 USER MOD Single : A 89 THR OG1 : rot 67:sc= 0.536 USER MOD Single : A 91 GLN : amide:sc= -0.177 X(o=-0.18,f=0) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 ASN : amide:sc= -0.109 X(o=-0.11,f=-0.11) USER MOD Single : A 105 LYS NZ :NH3+ -120:sc= 0.0187 (180deg=0) USER MOD Single : A 106 GLN : amide:sc= 0.119 K(o=0.12,f=-0.45) USER MOD Single : A 110 THR OG1 : rot 17:sc= 0.149 USER MOD Single : A 112 THR OG1 : rot 59:sc= 0.555 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 ASN : amide:sc= -0.0995 X(o=-0.1,f=-0.0078) USER MOD Single : A 128 GLN : amide:sc= -0.35 X(o=-0.35,f=-0.13) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 26 22.663 8.130 12.064 1.00 0.00 N ATOM 2 CA GLY A 26 23.379 9.320 11.517 1.00 0.00 C ATOM 3 C GLY A 26 23.470 9.211 9.993 1.00 0.00 C ATOM 4 O GLY A 26 24.401 8.637 9.461 1.00 0.00 O ATOM 0 HA2 GLY A 26 22.853 10.233 11.795 1.00 0.00 H new ATOM 0 HA3 GLY A 26 24.378 9.385 11.947 1.00 0.00 H new ATOM 10 N SER A 27 22.508 9.756 9.289 1.00 0.00 N ATOM 11 CA SER A 27 22.531 9.686 7.795 1.00 0.00 C ATOM 12 C SER A 27 22.414 11.092 7.194 1.00 0.00 C ATOM 13 O SER A 27 21.886 11.999 7.810 1.00 0.00 O ATOM 14 CB SER A 27 21.310 8.845 7.418 1.00 0.00 C ATOM 15 OG SER A 27 21.722 7.511 7.150 1.00 0.00 O ATOM 0 H SER A 27 21.707 10.247 9.686 1.00 0.00 H new ATOM 0 HA SER A 27 23.459 9.254 7.419 1.00 0.00 H new ATOM 0 HB2 SER A 27 20.582 8.857 8.229 1.00 0.00 H new ATOM 0 HB3 SER A 27 20.819 9.269 6.542 1.00 0.00 H new ATOM 0 HG SER A 27 20.952 6.910 7.225 1.00 0.00 H new ATOM 21 N HIS A 28 22.901 11.274 5.992 1.00 0.00 N ATOM 22 CA HIS A 28 22.818 12.617 5.338 1.00 0.00 C ATOM 23 C HIS A 28 21.713 12.621 4.275 1.00 0.00 C ATOM 24 O HIS A 28 20.943 13.558 4.176 1.00 0.00 O ATOM 25 CB HIS A 28 24.190 12.836 4.689 1.00 0.00 C ATOM 26 CG HIS A 28 24.861 14.022 5.326 1.00 0.00 C ATOM 27 ND1 HIS A 28 24.357 15.308 5.210 1.00 0.00 N ATOM 28 CD2 HIS A 28 25.996 14.132 6.090 1.00 0.00 C ATOM 29 CE1 HIS A 28 25.179 16.129 5.887 1.00 0.00 C ATOM 30 NE2 HIS A 28 26.195 15.463 6.444 1.00 0.00 N ATOM 0 H HIS A 28 23.353 10.550 5.434 1.00 0.00 H new ATOM 0 HA HIS A 28 22.577 13.406 6.051 1.00 0.00 H new ATOM 0 HB2 HIS A 28 24.808 11.946 4.810 1.00 0.00 H new ATOM 0 HB3 HIS A 28 24.076 13.001 3.618 1.00 0.00 H new ATOM 0 HD2 HIS A 28 26.637 13.310 6.373 1.00 0.00 H new ATOM 0 HE1 HIS A 28 25.036 17.196 5.970 1.00 0.00 H new ATOM 0 HE2 HIS A 28 26.953 15.848 7.007 1.00 0.00 H new ATOM 38 N MET A 29 21.631 11.580 3.482 1.00 0.00 N ATOM 39 CA MET A 29 20.577 11.516 2.424 1.00 0.00 C ATOM 40 C MET A 29 19.502 10.488 2.805 1.00 0.00 C ATOM 41 O MET A 29 18.320 10.766 2.727 1.00 0.00 O ATOM 42 CB MET A 29 21.316 11.083 1.155 1.00 0.00 C ATOM 43 CG MET A 29 20.486 11.451 -0.076 1.00 0.00 C ATOM 44 SD MET A 29 21.110 10.547 -1.514 1.00 0.00 S ATOM 45 CE MET A 29 20.387 8.938 -1.104 1.00 0.00 C ATOM 0 H MET A 29 22.250 10.771 3.523 1.00 0.00 H new ATOM 0 HA MET A 29 20.066 12.469 2.291 1.00 0.00 H new ATOM 0 HB2 MET A 29 22.291 11.568 1.107 1.00 0.00 H new ATOM 0 HB3 MET A 29 21.496 10.008 1.176 1.00 0.00 H new ATOM 0 HG2 MET A 29 19.437 11.208 0.093 1.00 0.00 H new ATOM 0 HG3 MET A 29 20.539 12.525 -0.256 1.00 0.00 H new ATOM 0 HE1 MET A 29 20.385 8.303 -1.990 1.00 0.00 H new ATOM 0 HE2 MET A 29 20.976 8.464 -0.319 1.00 0.00 H new ATOM 0 HE3 MET A 29 19.364 9.077 -0.755 1.00 0.00 H new ATOM 55 N GLN A 30 19.910 9.304 3.215 1.00 0.00 N ATOM 56 CA GLN A 30 18.932 8.235 3.609 1.00 0.00 C ATOM 57 C GLN A 30 18.056 7.822 2.415 1.00 0.00 C ATOM 58 O GLN A 30 18.158 8.371 1.333 1.00 0.00 O ATOM 59 CB GLN A 30 18.076 8.847 4.727 1.00 0.00 C ATOM 60 CG GLN A 30 18.137 7.952 5.969 1.00 0.00 C ATOM 61 CD GLN A 30 17.567 8.707 7.173 1.00 0.00 C ATOM 62 OE1 GLN A 30 18.305 9.252 7.967 1.00 0.00 O ATOM 63 NE2 GLN A 30 16.274 8.761 7.345 1.00 0.00 N ATOM 0 H GLN A 30 20.890 9.032 3.293 1.00 0.00 H new ATOM 0 HA GLN A 30 19.443 7.332 3.943 1.00 0.00 H new ATOM 0 HB2 GLN A 30 18.436 9.847 4.969 1.00 0.00 H new ATOM 0 HB3 GLN A 30 17.044 8.952 4.392 1.00 0.00 H new ATOM 0 HG2 GLN A 30 17.570 7.037 5.799 1.00 0.00 H new ATOM 0 HG3 GLN A 30 19.167 7.656 6.167 1.00 0.00 H new ATOM 0 HE21 GLN A 30 15.651 8.304 6.679 1.00 0.00 H new ATOM 0 HE22 GLN A 30 15.886 9.261 8.145 1.00 0.00 H new ATOM 72 N ALA A 31 17.204 6.848 2.611 1.00 0.00 N ATOM 73 CA ALA A 31 16.315 6.379 1.505 1.00 0.00 C ATOM 74 C ALA A 31 14.850 6.400 1.954 1.00 0.00 C ATOM 75 O ALA A 31 14.535 6.805 3.059 1.00 0.00 O ATOM 76 CB ALA A 31 16.770 4.947 1.213 1.00 0.00 C ATOM 0 H ALA A 31 17.085 6.354 3.496 1.00 0.00 H new ATOM 0 HA ALA A 31 16.382 7.016 0.623 1.00 0.00 H new ATOM 0 HB1 ALA A 31 16.164 4.529 0.409 1.00 0.00 H new ATOM 0 HB2 ALA A 31 17.818 4.952 0.913 1.00 0.00 H new ATOM 0 HB3 ALA A 31 16.653 4.338 2.109 1.00 0.00 H new ATOM 82 N LEU A 32 13.955 5.970 1.100 1.00 0.00 N ATOM 83 CA LEU A 32 12.501 5.960 1.462 1.00 0.00 C ATOM 84 C LEU A 32 12.237 4.984 2.620 1.00 0.00 C ATOM 85 O LEU A 32 13.113 4.251 3.040 1.00 0.00 O ATOM 86 CB LEU A 32 11.771 5.508 0.192 1.00 0.00 C ATOM 87 CG LEU A 32 10.680 6.522 -0.164 1.00 0.00 C ATOM 88 CD1 LEU A 32 11.321 7.799 -0.713 1.00 0.00 C ATOM 89 CD2 LEU A 32 9.755 5.921 -1.224 1.00 0.00 C ATOM 0 H LEU A 32 14.168 5.624 0.164 1.00 0.00 H new ATOM 0 HA LEU A 32 12.159 6.939 1.798 1.00 0.00 H new ATOM 0 HB2 LEU A 32 12.478 5.416 -0.632 1.00 0.00 H new ATOM 0 HB3 LEU A 32 11.330 4.523 0.345 1.00 0.00 H new ATOM 0 HG LEU A 32 10.105 6.763 0.730 1.00 0.00 H new ATOM 0 HD11 LEU A 32 10.542 8.518 -0.965 1.00 0.00 H new ATOM 0 HD12 LEU A 32 11.980 8.228 0.041 1.00 0.00 H new ATOM 0 HD13 LEU A 32 11.898 7.561 -1.607 1.00 0.00 H new ATOM 0 HD21 LEU A 32 8.978 6.641 -1.479 1.00 0.00 H new ATOM 0 HD22 LEU A 32 10.333 5.679 -2.116 1.00 0.00 H new ATOM 0 HD23 LEU A 32 9.295 5.014 -0.833 1.00 0.00 H new ATOM 101 N SER A 33 11.036 4.984 3.141 1.00 0.00 N ATOM 102 CA SER A 33 10.700 4.075 4.285 1.00 0.00 C ATOM 103 C SER A 33 9.949 2.823 3.811 1.00 0.00 C ATOM 104 O SER A 33 9.265 2.186 4.588 1.00 0.00 O ATOM 105 CB SER A 33 9.792 4.913 5.178 1.00 0.00 C ATOM 106 OG SER A 33 10.580 5.635 6.116 1.00 0.00 O ATOM 0 H SER A 33 10.269 5.576 2.823 1.00 0.00 H new ATOM 0 HA SER A 33 11.597 3.720 4.792 1.00 0.00 H new ATOM 0 HB2 SER A 33 9.206 5.604 4.572 1.00 0.00 H new ATOM 0 HB3 SER A 33 9.085 4.269 5.701 1.00 0.00 H new ATOM 0 HG SER A 33 9.995 6.174 6.688 1.00 0.00 H new ATOM 112 N TYR A 34 10.055 2.488 2.544 1.00 0.00 N ATOM 113 CA TYR A 34 9.337 1.293 1.972 1.00 0.00 C ATOM 114 C TYR A 34 7.827 1.552 1.971 1.00 0.00 C ATOM 115 O TYR A 34 7.196 1.524 0.934 1.00 0.00 O ATOM 116 CB TYR A 34 9.709 0.079 2.843 1.00 0.00 C ATOM 117 CG TYR A 34 8.875 -1.115 2.427 1.00 0.00 C ATOM 118 CD1 TYR A 34 9.278 -1.913 1.347 1.00 0.00 C ATOM 119 CD2 TYR A 34 7.696 -1.420 3.119 1.00 0.00 C ATOM 120 CE1 TYR A 34 8.502 -3.013 0.960 1.00 0.00 C ATOM 121 CE2 TYR A 34 6.922 -2.519 2.733 1.00 0.00 C ATOM 122 CZ TYR A 34 7.322 -3.316 1.654 1.00 0.00 C ATOM 123 OH TYR A 34 6.550 -4.397 1.274 1.00 0.00 O ATOM 0 H TYR A 34 10.620 3.001 1.867 1.00 0.00 H new ATOM 0 HA TYR A 34 9.629 1.103 0.939 1.00 0.00 H new ATOM 0 HB2 TYR A 34 10.769 -0.149 2.734 1.00 0.00 H new ATOM 0 HB3 TYR A 34 9.538 0.307 3.895 1.00 0.00 H new ATOM 0 HD1 TYR A 34 10.187 -1.679 0.813 1.00 0.00 H new ATOM 0 HD2 TYR A 34 7.384 -0.806 3.951 1.00 0.00 H new ATOM 0 HE1 TYR A 34 8.812 -3.627 0.128 1.00 0.00 H new ATOM 0 HE2 TYR A 34 6.014 -2.753 3.268 1.00 0.00 H new ATOM 0 HH TYR A 34 5.769 -4.464 1.862 1.00 0.00 H new ATOM 133 N ARG A 35 7.251 1.837 3.114 1.00 0.00 N ATOM 134 CA ARG A 35 5.789 2.138 3.167 1.00 0.00 C ATOM 135 C ARG A 35 5.492 3.318 2.236 1.00 0.00 C ATOM 136 O ARG A 35 4.478 3.349 1.564 1.00 0.00 O ATOM 137 CB ARG A 35 5.502 2.508 4.626 1.00 0.00 C ATOM 138 CG ARG A 35 4.022 2.870 4.788 1.00 0.00 C ATOM 139 CD ARG A 35 3.183 1.590 4.841 1.00 0.00 C ATOM 140 NE ARG A 35 1.900 2.001 5.477 1.00 0.00 N ATOM 141 CZ ARG A 35 1.711 1.797 6.755 1.00 0.00 C ATOM 142 NH1 ARG A 35 2.216 2.629 7.628 1.00 0.00 N ATOM 143 NH2 ARG A 35 1.020 0.764 7.157 1.00 0.00 N ATOM 0 H ARG A 35 7.732 1.874 4.013 1.00 0.00 H new ATOM 0 HA ARG A 35 5.170 1.299 2.847 1.00 0.00 H new ATOM 0 HB2 ARG A 35 5.755 1.673 5.279 1.00 0.00 H new ATOM 0 HB3 ARG A 35 6.127 3.349 4.927 1.00 0.00 H new ATOM 0 HG2 ARG A 35 3.877 3.450 5.699 1.00 0.00 H new ATOM 0 HG3 ARG A 35 3.697 3.496 3.957 1.00 0.00 H new ATOM 0 HD2 ARG A 35 3.017 1.184 3.843 1.00 0.00 H new ATOM 0 HD3 ARG A 35 3.682 0.814 5.422 1.00 0.00 H new ATOM 0 HE ARG A 35 1.170 2.441 4.917 1.00 0.00 H new ATOM 0 HH11 ARG A 35 2.756 3.435 7.312 1.00 0.00 H new ATOM 0 HH12 ARG A 35 2.070 2.472 8.625 1.00 0.00 H new ATOM 0 HH21 ARG A 35 0.628 0.116 6.474 1.00 0.00 H new ATOM 0 HH22 ARG A 35 0.873 0.605 8.154 1.00 0.00 H new ATOM 157 N GLU A 36 6.393 4.272 2.173 1.00 0.00 N ATOM 158 CA GLU A 36 6.199 5.441 1.263 1.00 0.00 C ATOM 159 C GLU A 36 6.221 4.953 -0.188 1.00 0.00 C ATOM 160 O GLU A 36 5.413 5.359 -1.002 1.00 0.00 O ATOM 161 CB GLU A 36 7.382 6.372 1.541 1.00 0.00 C ATOM 162 CG GLU A 36 6.961 7.830 1.317 1.00 0.00 C ATOM 163 CD GLU A 36 7.138 8.624 2.616 1.00 0.00 C ATOM 164 OE1 GLU A 36 8.238 8.615 3.149 1.00 0.00 O ATOM 165 OE2 GLU A 36 6.172 9.227 3.055 1.00 0.00 O ATOM 0 H GLU A 36 7.256 4.288 2.716 1.00 0.00 H new ATOM 0 HA GLU A 36 5.250 5.951 1.426 1.00 0.00 H new ATOM 0 HB2 GLU A 36 7.729 6.238 2.565 1.00 0.00 H new ATOM 0 HB3 GLU A 36 8.216 6.120 0.886 1.00 0.00 H new ATOM 0 HG2 GLU A 36 7.562 8.274 0.523 1.00 0.00 H new ATOM 0 HG3 GLU A 36 5.921 7.873 0.992 1.00 0.00 H new ATOM 172 N ALA A 37 7.128 4.060 -0.507 1.00 0.00 N ATOM 173 CA ALA A 37 7.192 3.513 -1.894 1.00 0.00 C ATOM 174 C ALA A 37 5.925 2.698 -2.170 1.00 0.00 C ATOM 175 O ALA A 37 5.377 2.738 -3.254 1.00 0.00 O ATOM 176 CB ALA A 37 8.432 2.614 -1.925 1.00 0.00 C ATOM 0 H ALA A 37 7.826 3.688 0.136 1.00 0.00 H new ATOM 0 HA ALA A 37 7.255 4.295 -2.651 1.00 0.00 H new ATOM 0 HB1 ALA A 37 8.540 2.178 -2.918 1.00 0.00 H new ATOM 0 HB2 ALA A 37 9.317 3.206 -1.690 1.00 0.00 H new ATOM 0 HB3 ALA A 37 8.323 1.818 -1.189 1.00 0.00 H new ATOM 182 N VAL A 38 5.446 1.977 -1.182 1.00 0.00 N ATOM 183 CA VAL A 38 4.198 1.175 -1.368 1.00 0.00 C ATOM 184 C VAL A 38 3.011 2.124 -1.554 1.00 0.00 C ATOM 185 O VAL A 38 2.135 1.875 -2.356 1.00 0.00 O ATOM 186 CB VAL A 38 4.038 0.344 -0.089 1.00 0.00 C ATOM 187 CG1 VAL A 38 2.778 -0.520 -0.196 1.00 0.00 C ATOM 188 CG2 VAL A 38 5.256 -0.567 0.099 1.00 0.00 C ATOM 0 H VAL A 38 5.867 1.911 -0.255 1.00 0.00 H new ATOM 0 HA VAL A 38 4.245 0.531 -2.246 1.00 0.00 H new ATOM 0 HB VAL A 38 3.955 1.017 0.764 1.00 0.00 H new ATOM 0 HG11 VAL A 38 2.664 -1.111 0.713 1.00 0.00 H new ATOM 0 HG12 VAL A 38 1.906 0.122 -0.323 1.00 0.00 H new ATOM 0 HG13 VAL A 38 2.866 -1.187 -1.054 1.00 0.00 H new ATOM 0 HG21 VAL A 38 5.134 -1.154 1.010 1.00 0.00 H new ATOM 0 HG22 VAL A 38 5.344 -1.238 -0.756 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.157 0.042 0.177 1.00 0.00 H new ATOM 198 N LEU A 39 2.991 3.224 -0.834 1.00 0.00 N ATOM 199 CA LEU A 39 1.878 4.208 -0.989 1.00 0.00 C ATOM 200 C LEU A 39 1.828 4.677 -2.448 1.00 0.00 C ATOM 201 O LEU A 39 0.781 4.710 -3.066 1.00 0.00 O ATOM 202 CB LEU A 39 2.238 5.371 -0.056 1.00 0.00 C ATOM 203 CG LEU A 39 1.029 6.292 0.124 1.00 0.00 C ATOM 204 CD1 LEU A 39 1.116 6.984 1.486 1.00 0.00 C ATOM 205 CD2 LEU A 39 1.018 7.353 -0.981 1.00 0.00 C ATOM 0 H LEU A 39 3.700 3.479 -0.146 1.00 0.00 H new ATOM 0 HA LEU A 39 0.902 3.790 -0.742 1.00 0.00 H new ATOM 0 HB2 LEU A 39 2.559 4.986 0.912 1.00 0.00 H new ATOM 0 HB3 LEU A 39 3.076 5.933 -0.469 1.00 0.00 H new ATOM 0 HG LEU A 39 0.115 5.701 0.068 1.00 0.00 H new ATOM 0 HD11 LEU A 39 0.256 7.641 1.616 1.00 0.00 H new ATOM 0 HD12 LEU A 39 1.122 6.233 2.276 1.00 0.00 H new ATOM 0 HD13 LEU A 39 2.032 7.572 1.537 1.00 0.00 H new ATOM 0 HD21 LEU A 39 0.156 8.007 -0.849 1.00 0.00 H new ATOM 0 HD22 LEU A 39 1.933 7.944 -0.927 1.00 0.00 H new ATOM 0 HD23 LEU A 39 0.958 6.865 -1.954 1.00 0.00 H new ATOM 217 N ARG A 40 2.970 5.013 -3.001 1.00 0.00 N ATOM 218 CA ARG A 40 3.024 5.457 -4.428 1.00 0.00 C ATOM 219 C ARG A 40 2.708 4.267 -5.348 1.00 0.00 C ATOM 220 O ARG A 40 1.997 4.399 -6.327 1.00 0.00 O ATOM 221 CB ARG A 40 4.464 5.947 -4.640 1.00 0.00 C ATOM 222 CG ARG A 40 4.743 6.117 -6.138 1.00 0.00 C ATOM 223 CD ARG A 40 6.149 6.690 -6.339 1.00 0.00 C ATOM 224 NE ARG A 40 6.049 7.533 -7.563 1.00 0.00 N ATOM 225 CZ ARG A 40 5.798 8.812 -7.457 1.00 0.00 C ATOM 226 NH1 ARG A 40 6.771 9.649 -7.204 1.00 0.00 N ATOM 227 NH2 ARG A 40 4.574 9.249 -7.597 1.00 0.00 N ATOM 0 H ARG A 40 3.870 4.998 -2.522 1.00 0.00 H new ATOM 0 HA ARG A 40 2.300 6.240 -4.654 1.00 0.00 H new ATOM 0 HB2 ARG A 40 4.614 6.895 -4.123 1.00 0.00 H new ATOM 0 HB3 ARG A 40 5.167 5.234 -4.209 1.00 0.00 H new ATOM 0 HG2 ARG A 40 4.655 5.156 -6.645 1.00 0.00 H new ATOM 0 HG3 ARG A 40 4.002 6.781 -6.583 1.00 0.00 H new ATOM 0 HD2 ARG A 40 6.462 7.280 -5.478 1.00 0.00 H new ATOM 0 HD3 ARG A 40 6.885 5.896 -6.465 1.00 0.00 H new ATOM 0 HE ARG A 40 6.176 7.113 -8.484 1.00 0.00 H new ATOM 0 HH11 ARG A 40 7.724 9.304 -7.090 1.00 0.00 H new ATOM 0 HH12 ARG A 40 6.577 10.647 -7.121 1.00 0.00 H new ATOM 0 HH21 ARG A 40 3.817 8.593 -7.789 1.00 0.00 H new ATOM 0 HH22 ARG A 40 4.376 10.246 -7.515 1.00 0.00 H new ATOM 241 N ALA A 41 3.232 3.105 -5.029 1.00 0.00 N ATOM 242 CA ALA A 41 2.965 1.896 -5.867 1.00 0.00 C ATOM 243 C ALA A 41 1.477 1.531 -5.794 1.00 0.00 C ATOM 244 O ALA A 41 0.877 1.158 -6.783 1.00 0.00 O ATOM 245 CB ALA A 41 3.822 0.784 -5.260 1.00 0.00 C ATOM 0 H ALA A 41 3.834 2.944 -4.222 1.00 0.00 H new ATOM 0 HA ALA A 41 3.207 2.059 -6.917 1.00 0.00 H new ATOM 0 HB1 ALA A 41 3.677 -0.137 -5.825 1.00 0.00 H new ATOM 0 HB2 ALA A 41 4.873 1.072 -5.299 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.528 0.623 -4.223 1.00 0.00 H new ATOM 251 N VAL A 42 0.876 1.649 -4.632 1.00 0.00 N ATOM 252 CA VAL A 42 -0.575 1.326 -4.501 1.00 0.00 C ATOM 253 C VAL A 42 -1.380 2.289 -5.380 1.00 0.00 C ATOM 254 O VAL A 42 -2.262 1.877 -6.109 1.00 0.00 O ATOM 255 CB VAL A 42 -0.900 1.511 -3.008 1.00 0.00 C ATOM 256 CG1 VAL A 42 -2.377 1.883 -2.824 1.00 0.00 C ATOM 257 CG2 VAL A 42 -0.616 0.204 -2.265 1.00 0.00 C ATOM 0 H VAL A 42 1.331 1.955 -3.772 1.00 0.00 H new ATOM 0 HA VAL A 42 -0.822 0.315 -4.824 1.00 0.00 H new ATOM 0 HB VAL A 42 -0.280 2.313 -2.608 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -2.591 2.010 -1.763 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -2.586 2.814 -3.350 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -3.005 1.089 -3.228 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -0.845 0.330 -1.207 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -1.236 -0.592 -2.678 1.00 0.00 H new ATOM 0 HG23 VAL A 42 0.436 -0.059 -2.380 1.00 0.00 H new ATOM 267 N ASP A 43 -1.061 3.562 -5.333 1.00 0.00 N ATOM 268 CA ASP A 43 -1.787 4.551 -6.186 1.00 0.00 C ATOM 269 C ASP A 43 -1.575 4.198 -7.663 1.00 0.00 C ATOM 270 O ASP A 43 -2.504 4.195 -8.448 1.00 0.00 O ATOM 271 CB ASP A 43 -1.154 5.911 -5.853 1.00 0.00 C ATOM 272 CG ASP A 43 -2.110 7.062 -6.209 1.00 0.00 C ATOM 273 OD1 ASP A 43 -3.136 6.809 -6.823 1.00 0.00 O ATOM 274 OD2 ASP A 43 -1.793 8.187 -5.859 1.00 0.00 O ATOM 0 H ASP A 43 -0.330 3.956 -4.741 1.00 0.00 H new ATOM 0 HA ASP A 43 -2.862 4.558 -6.004 1.00 0.00 H new ATOM 0 HB2 ASP A 43 -0.908 5.952 -4.792 1.00 0.00 H new ATOM 0 HB3 ASP A 43 -0.219 6.026 -6.402 1.00 0.00 H new ATOM 279 N ARG A 44 -0.358 3.876 -8.035 1.00 0.00 N ATOM 280 CA ARG A 44 -0.076 3.495 -9.453 1.00 0.00 C ATOM 281 C ARG A 44 -0.796 2.179 -9.783 1.00 0.00 C ATOM 282 O ARG A 44 -1.317 1.999 -10.868 1.00 0.00 O ATOM 283 CB ARG A 44 1.445 3.317 -9.526 1.00 0.00 C ATOM 284 CG ARG A 44 1.889 3.235 -10.991 1.00 0.00 C ATOM 285 CD ARG A 44 2.812 4.413 -11.316 1.00 0.00 C ATOM 286 NE ARG A 44 2.733 4.569 -12.797 1.00 0.00 N ATOM 287 CZ ARG A 44 1.991 5.507 -13.319 1.00 0.00 C ATOM 288 NH1 ARG A 44 2.427 6.741 -13.356 1.00 0.00 N ATOM 289 NH2 ARG A 44 0.815 5.209 -13.808 1.00 0.00 N ATOM 0 H ARG A 44 0.452 3.861 -7.415 1.00 0.00 H new ATOM 0 HA ARG A 44 -0.424 4.242 -10.166 1.00 0.00 H new ATOM 0 HB2 ARG A 44 1.942 4.152 -9.032 1.00 0.00 H new ATOM 0 HB3 ARG A 44 1.740 2.412 -8.996 1.00 0.00 H new ATOM 0 HG2 ARG A 44 2.407 2.293 -11.172 1.00 0.00 H new ATOM 0 HG3 ARG A 44 1.018 3.251 -11.647 1.00 0.00 H new ATOM 0 HD2 ARG A 44 2.488 5.320 -10.806 1.00 0.00 H new ATOM 0 HD3 ARG A 44 3.834 4.214 -10.994 1.00 0.00 H new ATOM 0 HE ARG A 44 3.260 3.941 -13.404 1.00 0.00 H new ATOM 0 HH11 ARG A 44 3.346 6.969 -12.977 1.00 0.00 H new ATOM 0 HH12 ARG A 44 1.848 7.475 -13.764 1.00 0.00 H new ATOM 0 HH21 ARG A 44 0.480 4.246 -13.781 1.00 0.00 H new ATOM 0 HH22 ARG A 44 0.233 5.940 -14.217 1.00 0.00 H new ATOM 303 N LEU A 45 -0.836 1.267 -8.840 1.00 0.00 N ATOM 304 CA LEU A 45 -1.527 -0.037 -9.066 1.00 0.00 C ATOM 305 C LEU A 45 -3.025 0.194 -9.311 1.00 0.00 C ATOM 306 O LEU A 45 -3.632 -0.466 -10.130 1.00 0.00 O ATOM 307 CB LEU A 45 -1.303 -0.829 -7.771 1.00 0.00 C ATOM 308 CG LEU A 45 -2.091 -2.144 -7.810 1.00 0.00 C ATOM 309 CD1 LEU A 45 -1.222 -3.276 -7.260 1.00 0.00 C ATOM 310 CD2 LEU A 45 -3.353 -2.011 -6.951 1.00 0.00 C ATOM 0 H LEU A 45 -0.415 1.374 -7.917 1.00 0.00 H new ATOM 0 HA LEU A 45 -1.144 -0.567 -9.938 1.00 0.00 H new ATOM 0 HB2 LEU A 45 -0.241 -1.037 -7.643 1.00 0.00 H new ATOM 0 HB3 LEU A 45 -1.617 -0.234 -6.913 1.00 0.00 H new ATOM 0 HG LEU A 45 -2.372 -2.366 -8.839 1.00 0.00 H new ATOM 0 HD11 LEU A 45 -1.782 -4.211 -7.288 1.00 0.00 H new ATOM 0 HD12 LEU A 45 -0.323 -3.373 -7.869 1.00 0.00 H new ATOM 0 HD13 LEU A 45 -0.941 -3.052 -6.231 1.00 0.00 H new ATOM 0 HD21 LEU A 45 -3.913 -2.946 -6.979 1.00 0.00 H new ATOM 0 HD22 LEU A 45 -3.071 -1.788 -5.922 1.00 0.00 H new ATOM 0 HD23 LEU A 45 -3.974 -1.204 -7.340 1.00 0.00 H new ATOM 322 N ASN A 46 -3.617 1.124 -8.601 1.00 0.00 N ATOM 323 CA ASN A 46 -5.079 1.407 -8.779 1.00 0.00 C ATOM 324 C ASN A 46 -5.344 2.126 -10.111 1.00 0.00 C ATOM 325 O ASN A 46 -6.393 1.965 -10.705 1.00 0.00 O ATOM 326 CB ASN A 46 -5.465 2.308 -7.599 1.00 0.00 C ATOM 327 CG ASN A 46 -5.293 1.553 -6.272 1.00 0.00 C ATOM 328 OD1 ASN A 46 -4.805 2.108 -5.308 1.00 0.00 O ATOM 329 ND2 ASN A 46 -5.682 0.309 -6.177 1.00 0.00 N ATOM 0 H ASN A 46 -3.150 1.702 -7.903 1.00 0.00 H new ATOM 0 HA ASN A 46 -5.664 0.487 -8.801 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -4.844 3.204 -7.599 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -6.499 2.637 -7.707 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -5.575 -0.193 -5.295 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -6.092 -0.160 -6.984 1.00 0.00 H new ATOM 336 N GLU A 47 -4.412 2.914 -10.585 1.00 0.00 N ATOM 337 CA GLU A 47 -4.626 3.630 -11.880 1.00 0.00 C ATOM 338 C GLU A 47 -4.446 2.664 -13.061 1.00 0.00 C ATOM 339 O GLU A 47 -5.121 2.772 -14.067 1.00 0.00 O ATOM 340 CB GLU A 47 -3.558 4.727 -11.916 1.00 0.00 C ATOM 341 CG GLU A 47 -3.811 5.652 -13.112 1.00 0.00 C ATOM 342 CD GLU A 47 -4.472 6.947 -12.633 1.00 0.00 C ATOM 343 OE1 GLU A 47 -3.791 7.737 -11.997 1.00 0.00 O ATOM 344 OE2 GLU A 47 -5.646 7.127 -12.910 1.00 0.00 O ATOM 0 H GLU A 47 -3.515 3.092 -10.133 1.00 0.00 H new ATOM 0 HA GLU A 47 -5.632 4.041 -11.958 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -3.580 5.300 -10.989 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -2.566 4.281 -11.992 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.871 5.877 -13.615 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -4.451 5.154 -13.840 1.00 0.00 H new ATOM 351 N GLN A 48 -3.537 1.726 -12.942 1.00 0.00 N ATOM 352 CA GLN A 48 -3.298 0.750 -14.054 1.00 0.00 C ATOM 353 C GLN A 48 -4.433 -0.286 -14.136 1.00 0.00 C ATOM 354 O GLN A 48 -4.768 -0.762 -15.205 1.00 0.00 O ATOM 355 CB GLN A 48 -1.975 0.064 -13.699 1.00 0.00 C ATOM 356 CG GLN A 48 -0.879 0.532 -14.661 1.00 0.00 C ATOM 357 CD GLN A 48 0.276 1.154 -13.868 1.00 0.00 C ATOM 358 OE1 GLN A 48 0.432 2.360 -13.845 1.00 0.00 O ATOM 359 NE2 GLN A 48 1.102 0.377 -13.217 1.00 0.00 N ATOM 0 H GLN A 48 -2.948 1.593 -12.120 1.00 0.00 H new ATOM 0 HA GLN A 48 -3.263 1.245 -15.024 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -1.696 0.299 -12.672 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -2.088 -1.019 -13.759 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -0.516 -0.310 -15.250 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -1.285 1.261 -15.363 1.00 0.00 H new ATOM 0 HE21 GLN A 48 0.972 -0.635 -13.235 1.00 0.00 H new ATOM 0 HE22 GLN A 48 1.876 0.782 -12.691 1.00 0.00 H new ATOM 368 N SER A 49 -5.018 -0.644 -13.019 1.00 0.00 N ATOM 369 CA SER A 49 -6.121 -1.648 -13.026 1.00 0.00 C ATOM 370 C SER A 49 -7.342 -1.105 -13.777 1.00 0.00 C ATOM 371 O SER A 49 -7.447 0.076 -14.047 1.00 0.00 O ATOM 372 CB SER A 49 -6.460 -1.888 -11.548 1.00 0.00 C ATOM 373 OG SER A 49 -6.155 -0.732 -10.780 1.00 0.00 O ATOM 0 H SER A 49 -4.775 -0.280 -12.098 1.00 0.00 H new ATOM 0 HA SER A 49 -5.827 -2.568 -13.531 1.00 0.00 H new ATOM 0 HB2 SER A 49 -7.517 -2.133 -11.445 1.00 0.00 H new ATOM 0 HB3 SER A 49 -5.897 -2.742 -11.172 1.00 0.00 H new ATOM 0 HG SER A 49 -5.308 -0.868 -10.305 1.00 0.00 H new ATOM 379 N SER A 50 -8.263 -1.967 -14.108 1.00 0.00 N ATOM 380 CA SER A 50 -9.492 -1.530 -14.837 1.00 0.00 C ATOM 381 C SER A 50 -10.731 -1.876 -14.006 1.00 0.00 C ATOM 382 O SER A 50 -11.688 -2.447 -14.497 1.00 0.00 O ATOM 383 CB SER A 50 -9.475 -2.315 -16.152 1.00 0.00 C ATOM 384 OG SER A 50 -8.283 -2.010 -16.865 1.00 0.00 O ATOM 0 H SER A 50 -8.218 -2.965 -13.904 1.00 0.00 H new ATOM 0 HA SER A 50 -9.518 -0.455 -15.016 1.00 0.00 H new ATOM 0 HB2 SER A 50 -9.529 -3.385 -15.951 1.00 0.00 H new ATOM 0 HB3 SER A 50 -10.348 -2.059 -16.753 1.00 0.00 H new ATOM 0 HG SER A 50 -8.268 -2.512 -17.707 1.00 0.00 H new ATOM 390 N GLU A 51 -10.706 -1.540 -12.742 1.00 0.00 N ATOM 391 CA GLU A 51 -11.862 -1.848 -11.849 1.00 0.00 C ATOM 392 C GLU A 51 -12.779 -0.624 -11.693 1.00 0.00 C ATOM 393 O GLU A 51 -12.454 0.472 -12.116 1.00 0.00 O ATOM 394 CB GLU A 51 -11.227 -2.218 -10.507 1.00 0.00 C ATOM 395 CG GLU A 51 -11.896 -3.477 -9.945 1.00 0.00 C ATOM 396 CD GLU A 51 -10.843 -4.565 -9.713 1.00 0.00 C ATOM 397 OE1 GLU A 51 -10.470 -5.220 -10.673 1.00 0.00 O ATOM 398 OE2 GLU A 51 -10.428 -4.727 -8.575 1.00 0.00 O ATOM 0 H GLU A 51 -9.928 -1.062 -12.287 1.00 0.00 H new ATOM 0 HA GLU A 51 -12.485 -2.648 -12.249 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -10.158 -2.389 -10.635 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -11.335 -1.393 -9.803 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -12.403 -3.243 -9.009 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -12.656 -3.836 -10.638 1.00 0.00 H new ATOM 405 N ALA A 52 -13.925 -0.813 -11.082 1.00 0.00 N ATOM 406 CA ALA A 52 -14.883 0.318 -10.883 1.00 0.00 C ATOM 407 C ALA A 52 -14.652 0.993 -9.523 1.00 0.00 C ATOM 408 O ALA A 52 -14.894 2.172 -9.367 1.00 0.00 O ATOM 409 CB ALA A 52 -16.274 -0.318 -10.934 1.00 0.00 C ATOM 0 H ALA A 52 -14.239 -1.710 -10.710 1.00 0.00 H new ATOM 0 HA ALA A 52 -14.759 1.091 -11.642 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -17.032 0.453 -10.795 1.00 0.00 H new ATOM 0 HB2 ALA A 52 -16.419 -0.799 -11.901 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -16.363 -1.062 -10.142 1.00 0.00 H new ATOM 415 N ASN A 53 -14.191 0.255 -8.541 1.00 0.00 N ATOM 416 CA ASN A 53 -13.943 0.857 -7.196 1.00 0.00 C ATOM 417 C ASN A 53 -12.446 0.814 -6.875 1.00 0.00 C ATOM 418 O ASN A 53 -11.782 -0.180 -7.104 1.00 0.00 O ATOM 419 CB ASN A 53 -14.740 -0.004 -6.211 1.00 0.00 C ATOM 420 CG ASN A 53 -16.216 0.423 -6.213 1.00 0.00 C ATOM 421 OD1 ASN A 53 -16.589 1.379 -6.867 1.00 0.00 O ATOM 422 ND2 ASN A 53 -17.077 -0.252 -5.502 1.00 0.00 N ATOM 0 H ASN A 53 -13.976 -0.739 -8.615 1.00 0.00 H new ATOM 0 HA ASN A 53 -14.249 1.902 -7.146 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -14.657 -1.056 -6.485 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -14.325 0.098 -5.208 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -18.059 0.022 -5.496 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -16.768 -1.054 -4.953 1.00 0.00 H new ATOM 429 N LEU A 54 -11.911 1.893 -6.361 1.00 0.00 N ATOM 430 CA LEU A 54 -10.448 1.936 -6.032 1.00 0.00 C ATOM 431 C LEU A 54 -10.101 0.947 -4.911 1.00 0.00 C ATOM 432 O LEU A 54 -10.968 0.429 -4.233 1.00 0.00 O ATOM 433 CB LEU A 54 -10.186 3.371 -5.569 1.00 0.00 C ATOM 434 CG LEU A 54 -10.064 4.293 -6.783 1.00 0.00 C ATOM 435 CD1 LEU A 54 -10.255 5.745 -6.342 1.00 0.00 C ATOM 436 CD2 LEU A 54 -8.677 4.131 -7.408 1.00 0.00 C ATOM 0 H LEU A 54 -12.424 2.750 -6.153 1.00 0.00 H new ATOM 0 HA LEU A 54 -9.838 1.657 -6.891 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -10.998 3.709 -4.924 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -9.271 3.411 -4.977 1.00 0.00 H new ATOM 0 HG LEU A 54 -10.827 4.031 -7.516 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -10.168 6.402 -7.207 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -11.242 5.863 -5.895 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -9.491 6.006 -5.610 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -8.589 4.788 -8.273 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -7.915 4.393 -6.674 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -8.538 3.096 -7.722 1.00 0.00 H new ATOM 448 N TYR A 55 -8.831 0.691 -4.709 1.00 0.00 N ATOM 449 CA TYR A 55 -8.415 -0.253 -3.629 1.00 0.00 C ATOM 450 C TYR A 55 -7.267 0.351 -2.819 1.00 0.00 C ATOM 451 O TYR A 55 -6.105 0.163 -3.127 1.00 0.00 O ATOM 452 CB TYR A 55 -7.962 -1.525 -4.350 1.00 0.00 C ATOM 453 CG TYR A 55 -9.151 -2.428 -4.560 1.00 0.00 C ATOM 454 CD1 TYR A 55 -9.521 -3.340 -3.564 1.00 0.00 C ATOM 455 CD2 TYR A 55 -9.887 -2.352 -5.747 1.00 0.00 C ATOM 456 CE1 TYR A 55 -10.626 -4.175 -3.756 1.00 0.00 C ATOM 457 CE2 TYR A 55 -10.992 -3.187 -5.937 1.00 0.00 C ATOM 458 CZ TYR A 55 -11.361 -4.097 -4.944 1.00 0.00 C ATOM 459 OH TYR A 55 -12.450 -4.918 -5.137 1.00 0.00 O ATOM 0 H TYR A 55 -8.065 1.096 -5.247 1.00 0.00 H new ATOM 0 HA TYR A 55 -9.224 -0.460 -2.929 1.00 0.00 H new ATOM 0 HB2 TYR A 55 -7.509 -1.272 -5.309 1.00 0.00 H new ATOM 0 HB3 TYR A 55 -7.200 -2.038 -3.763 1.00 0.00 H new ATOM 0 HD1 TYR A 55 -8.953 -3.398 -2.647 1.00 0.00 H new ATOM 0 HD2 TYR A 55 -9.602 -1.649 -6.516 1.00 0.00 H new ATOM 0 HE1 TYR A 55 -10.912 -4.879 -2.988 1.00 0.00 H new ATOM 0 HE2 TYR A 55 -11.561 -3.128 -6.853 1.00 0.00 H new ATOM 0 HH TYR A 55 -12.847 -4.734 -6.014 1.00 0.00 H new ATOM 469 N ARG A 56 -7.593 1.073 -1.780 1.00 0.00 N ATOM 470 CA ARG A 56 -6.535 1.693 -0.931 1.00 0.00 C ATOM 471 C ARG A 56 -5.849 0.612 -0.090 1.00 0.00 C ATOM 472 O ARG A 56 -6.475 -0.338 0.347 1.00 0.00 O ATOM 473 CB ARG A 56 -7.273 2.693 -0.035 1.00 0.00 C ATOM 474 CG ARG A 56 -6.261 3.527 0.755 1.00 0.00 C ATOM 475 CD ARG A 56 -6.194 3.018 2.198 1.00 0.00 C ATOM 476 NE ARG A 56 -5.052 3.747 2.818 1.00 0.00 N ATOM 477 CZ ARG A 56 -4.962 3.834 4.119 1.00 0.00 C ATOM 478 NH1 ARG A 56 -4.512 2.819 4.810 1.00 0.00 N ATOM 479 NH2 ARG A 56 -5.321 4.936 4.727 1.00 0.00 N ATOM 0 H ARG A 56 -8.550 1.260 -1.482 1.00 0.00 H new ATOM 0 HA ARG A 56 -5.759 2.182 -1.520 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -7.900 3.345 -0.642 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -7.934 2.162 0.650 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -5.278 3.462 0.289 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.551 4.578 0.742 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -7.124 3.219 2.730 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -6.036 1.940 2.228 1.00 0.00 H new ATOM 0 HE ARG A 56 -4.341 4.178 2.227 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -4.232 1.962 4.334 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -4.441 2.885 5.825 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -5.671 5.726 4.186 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -5.251 5.004 5.742 1.00 0.00 H new ATOM 493 N LEU A 57 -4.568 0.749 0.136 1.00 0.00 N ATOM 494 CA LEU A 57 -3.830 -0.267 0.945 1.00 0.00 C ATOM 495 C LEU A 57 -4.359 -0.297 2.381 1.00 0.00 C ATOM 496 O LEU A 57 -4.301 0.686 3.098 1.00 0.00 O ATOM 497 CB LEU A 57 -2.369 0.187 0.919 1.00 0.00 C ATOM 498 CG LEU A 57 -1.497 -0.831 1.658 1.00 0.00 C ATOM 499 CD1 LEU A 57 -0.141 -0.933 0.965 1.00 0.00 C ATOM 500 CD2 LEU A 57 -1.293 -0.377 3.106 1.00 0.00 C ATOM 0 H LEU A 57 -3.999 1.524 -0.206 1.00 0.00 H new ATOM 0 HA LEU A 57 -3.951 -1.274 0.546 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.029 0.291 -0.111 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -2.275 1.167 1.386 1.00 0.00 H new ATOM 0 HG LEU A 57 -1.988 -1.804 1.648 1.00 0.00 H new ATOM 0 HD11 LEU A 57 0.482 -1.657 1.489 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.283 -1.256 -0.066 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.348 0.041 0.976 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.672 -1.103 3.631 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.802 0.596 3.116 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -2.260 -0.300 3.603 1.00 0.00 H new ATOM 512 N LEU A 58 -4.862 -1.424 2.804 1.00 0.00 N ATOM 513 CA LEU A 58 -5.385 -1.544 4.194 1.00 0.00 C ATOM 514 C LEU A 58 -4.257 -1.990 5.132 1.00 0.00 C ATOM 515 O LEU A 58 -4.100 -1.469 6.220 1.00 0.00 O ATOM 516 CB LEU A 58 -6.479 -2.613 4.113 1.00 0.00 C ATOM 517 CG LEU A 58 -7.148 -2.762 5.480 1.00 0.00 C ATOM 518 CD1 LEU A 58 -8.299 -1.760 5.595 1.00 0.00 C ATOM 519 CD2 LEU A 58 -7.691 -4.185 5.631 1.00 0.00 C ATOM 0 H LEU A 58 -4.934 -2.272 2.242 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.771 -0.602 4.582 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -7.219 -2.335 3.362 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -6.050 -3.565 3.801 1.00 0.00 H new ATOM 0 HG LEU A 58 -6.418 -2.568 6.266 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -8.777 -1.865 6.569 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -7.911 -0.747 5.488 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -9.030 -1.953 4.810 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -8.168 -4.291 6.605 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -8.422 -4.381 4.846 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -6.871 -4.898 5.549 1.00 0.00 H new ATOM 531 N GLU A 59 -3.471 -2.949 4.710 1.00 0.00 N ATOM 532 CA GLU A 59 -2.346 -3.434 5.565 1.00 0.00 C ATOM 533 C GLU A 59 -1.095 -3.686 4.710 1.00 0.00 C ATOM 534 O GLU A 59 -1.180 -4.138 3.582 1.00 0.00 O ATOM 535 CB GLU A 59 -2.855 -4.740 6.192 1.00 0.00 C ATOM 536 CG GLU A 59 -2.975 -4.572 7.713 1.00 0.00 C ATOM 537 CD GLU A 59 -4.342 -5.081 8.186 1.00 0.00 C ATOM 538 OE1 GLU A 59 -4.499 -6.286 8.300 1.00 0.00 O ATOM 539 OE2 GLU A 59 -5.209 -4.257 8.430 1.00 0.00 O ATOM 0 H GLU A 59 -3.561 -3.417 3.808 1.00 0.00 H new ATOM 0 HA GLU A 59 -2.061 -2.706 6.325 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -3.824 -5.005 5.768 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -2.172 -5.557 5.960 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -2.179 -5.123 8.213 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -2.854 -3.523 7.983 1.00 0.00 H new ATOM 546 N LEU A 60 0.065 -3.396 5.246 1.00 0.00 N ATOM 547 CA LEU A 60 1.333 -3.612 4.483 1.00 0.00 C ATOM 548 C LEU A 60 2.116 -4.782 5.091 1.00 0.00 C ATOM 549 O LEU A 60 2.095 -5.003 6.287 1.00 0.00 O ATOM 550 CB LEU A 60 2.117 -2.304 4.630 1.00 0.00 C ATOM 551 CG LEU A 60 3.503 -2.448 3.994 1.00 0.00 C ATOM 552 CD1 LEU A 60 3.399 -2.251 2.480 1.00 0.00 C ATOM 553 CD2 LEU A 60 4.445 -1.394 4.583 1.00 0.00 C ATOM 0 H LEU A 60 0.188 -3.017 6.185 1.00 0.00 H new ATOM 0 HA LEU A 60 1.151 -3.857 3.437 1.00 0.00 H new ATOM 0 HB2 LEU A 60 1.572 -1.489 4.154 1.00 0.00 H new ATOM 0 HB3 LEU A 60 2.217 -2.047 5.685 1.00 0.00 H new ATOM 0 HG LEU A 60 3.894 -3.444 4.201 1.00 0.00 H new ATOM 0 HD11 LEU A 60 4.387 -2.354 2.031 1.00 0.00 H new ATOM 0 HD12 LEU A 60 2.730 -3.002 2.061 1.00 0.00 H new ATOM 0 HD13 LEU A 60 3.006 -1.256 2.269 1.00 0.00 H new ATOM 0 HD21 LEU A 60 5.432 -1.495 4.131 1.00 0.00 H new ATOM 0 HD22 LEU A 60 4.052 -0.399 4.377 1.00 0.00 H new ATOM 0 HD23 LEU A 60 4.523 -1.537 5.661 1.00 0.00 H new ATOM 565 N ASP A 61 2.803 -5.527 4.266 1.00 0.00 N ATOM 566 CA ASP A 61 3.592 -6.690 4.770 1.00 0.00 C ATOM 567 C ASP A 61 5.081 -6.331 4.877 1.00 0.00 C ATOM 568 O ASP A 61 5.536 -5.349 4.320 1.00 0.00 O ATOM 569 CB ASP A 61 3.376 -7.787 3.721 1.00 0.00 C ATOM 570 CG ASP A 61 4.107 -9.066 4.140 1.00 0.00 C ATOM 571 OD1 ASP A 61 3.854 -9.542 5.236 1.00 0.00 O ATOM 572 OD2 ASP A 61 4.911 -9.545 3.358 1.00 0.00 O ATOM 0 H ASP A 61 2.852 -5.379 3.258 1.00 0.00 H new ATOM 0 HA ASP A 61 3.278 -7.001 5.766 1.00 0.00 H new ATOM 0 HB2 ASP A 61 2.311 -7.988 3.608 1.00 0.00 H new ATOM 0 HB3 ASP A 61 3.742 -7.451 2.751 1.00 0.00 H new ATOM 577 N GLN A 62 5.839 -7.134 5.582 1.00 0.00 N ATOM 578 CA GLN A 62 7.301 -6.869 5.727 1.00 0.00 C ATOM 579 C GLN A 62 8.096 -7.956 4.981 1.00 0.00 C ATOM 580 O GLN A 62 8.432 -8.980 5.546 1.00 0.00 O ATOM 581 CB GLN A 62 7.573 -6.923 7.232 1.00 0.00 C ATOM 582 CG GLN A 62 8.812 -6.084 7.556 1.00 0.00 C ATOM 583 CD GLN A 62 9.258 -6.368 8.992 1.00 0.00 C ATOM 584 OE1 GLN A 62 10.219 -7.078 9.211 1.00 0.00 O ATOM 585 NE2 GLN A 62 8.596 -5.844 9.988 1.00 0.00 N ATOM 0 H GLN A 62 5.504 -7.967 6.066 1.00 0.00 H new ATOM 0 HA GLN A 62 7.599 -5.908 5.307 1.00 0.00 H new ATOM 0 HB2 GLN A 62 6.711 -6.546 7.782 1.00 0.00 H new ATOM 0 HB3 GLN A 62 7.726 -7.955 7.548 1.00 0.00 H new ATOM 0 HG2 GLN A 62 9.617 -6.321 6.860 1.00 0.00 H new ATOM 0 HG3 GLN A 62 8.588 -5.024 7.436 1.00 0.00 H new ATOM 0 HE21 GLN A 62 7.789 -5.248 9.806 1.00 0.00 H new ATOM 0 HE22 GLN A 62 8.886 -6.031 10.948 1.00 0.00 H new ATOM 594 N PRO A 63 8.351 -7.694 3.723 1.00 0.00 N ATOM 595 CA PRO A 63 9.093 -8.655 2.863 1.00 0.00 C ATOM 596 C PRO A 63 10.595 -8.676 3.201 1.00 0.00 C ATOM 597 O PRO A 63 11.070 -7.872 3.984 1.00 0.00 O ATOM 598 CB PRO A 63 8.862 -8.119 1.454 1.00 0.00 C ATOM 599 CG PRO A 63 8.583 -6.662 1.631 1.00 0.00 C ATOM 600 CD PRO A 63 7.971 -6.484 2.990 1.00 0.00 C ATOM 0 HA PRO A 63 8.753 -9.682 2.995 1.00 0.00 H new ATOM 0 HB2 PRO A 63 9.737 -8.279 0.823 1.00 0.00 H new ATOM 0 HB3 PRO A 63 8.025 -8.625 0.972 1.00 0.00 H new ATOM 0 HG2 PRO A 63 9.502 -6.082 1.545 1.00 0.00 H new ATOM 0 HG3 PRO A 63 7.906 -6.304 0.855 1.00 0.00 H new ATOM 0 HD2 PRO A 63 8.348 -5.587 3.481 1.00 0.00 H new ATOM 0 HD3 PRO A 63 6.888 -6.381 2.927 1.00 0.00 H new ATOM 608 N PRO A 64 11.291 -9.611 2.592 1.00 0.00 N ATOM 609 CA PRO A 64 12.753 -9.761 2.821 1.00 0.00 C ATOM 610 C PRO A 64 13.548 -8.662 2.101 1.00 0.00 C ATOM 611 O PRO A 64 13.267 -8.320 0.969 1.00 0.00 O ATOM 612 CB PRO A 64 13.070 -11.129 2.222 1.00 0.00 C ATOM 613 CG PRO A 64 12.003 -11.373 1.204 1.00 0.00 C ATOM 614 CD PRO A 64 10.780 -10.612 1.643 1.00 0.00 C ATOM 0 HA PRO A 64 13.020 -9.678 3.874 1.00 0.00 H new ATOM 0 HB2 PRO A 64 14.059 -11.138 1.764 1.00 0.00 H new ATOM 0 HB3 PRO A 64 13.066 -11.904 2.988 1.00 0.00 H new ATOM 0 HG2 PRO A 64 12.329 -11.040 0.219 1.00 0.00 H new ATOM 0 HG3 PRO A 64 11.785 -12.438 1.124 1.00 0.00 H new ATOM 0 HD2 PRO A 64 10.282 -10.139 0.797 1.00 0.00 H new ATOM 0 HD3 PRO A 64 10.051 -11.271 2.115 1.00 0.00 H new ATOM 622 N LYS A 65 14.552 -8.128 2.758 1.00 0.00 N ATOM 623 CA LYS A 65 15.409 -7.058 2.145 1.00 0.00 C ATOM 624 C LYS A 65 14.552 -5.926 1.566 1.00 0.00 C ATOM 625 O LYS A 65 14.542 -5.685 0.373 1.00 0.00 O ATOM 626 CB LYS A 65 16.213 -7.757 1.036 1.00 0.00 C ATOM 627 CG LYS A 65 16.916 -9.002 1.593 1.00 0.00 C ATOM 628 CD LYS A 65 17.907 -8.598 2.690 1.00 0.00 C ATOM 629 CE LYS A 65 17.838 -9.605 3.844 1.00 0.00 C ATOM 630 NZ LYS A 65 18.756 -10.714 3.451 1.00 0.00 N ATOM 0 H LYS A 65 14.818 -8.392 3.707 1.00 0.00 H new ATOM 0 HA LYS A 65 16.061 -6.597 2.887 1.00 0.00 H new ATOM 0 HB2 LYS A 65 15.549 -8.041 0.219 1.00 0.00 H new ATOM 0 HB3 LYS A 65 16.950 -7.069 0.623 1.00 0.00 H new ATOM 0 HG2 LYS A 65 16.179 -9.697 1.995 1.00 0.00 H new ATOM 0 HG3 LYS A 65 17.440 -9.523 0.792 1.00 0.00 H new ATOM 0 HD2 LYS A 65 18.918 -8.563 2.285 1.00 0.00 H new ATOM 0 HD3 LYS A 65 17.674 -7.597 3.053 1.00 0.00 H new ATOM 0 HE2 LYS A 65 18.151 -9.149 4.784 1.00 0.00 H new ATOM 0 HE3 LYS A 65 16.821 -9.969 3.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 18.760 -11.441 4.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 18.430 -11.134 2.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 19.719 -10.340 3.327 1.00 0.00 H new ATOM 644 N ALA A 66 13.845 -5.222 2.411 1.00 0.00 N ATOM 645 CA ALA A 66 12.994 -4.093 1.927 1.00 0.00 C ATOM 646 C ALA A 66 13.474 -2.754 2.511 1.00 0.00 C ATOM 647 O ALA A 66 12.881 -1.720 2.264 1.00 0.00 O ATOM 648 CB ALA A 66 11.582 -4.419 2.421 1.00 0.00 C ATOM 0 H ALA A 66 13.820 -5.380 3.418 1.00 0.00 H new ATOM 0 HA ALA A 66 13.037 -3.990 0.843 1.00 0.00 H new ATOM 0 HB1 ALA A 66 10.895 -3.634 2.105 1.00 0.00 H new ATOM 0 HB2 ALA A 66 11.261 -5.372 2.002 1.00 0.00 H new ATOM 0 HB3 ALA A 66 11.583 -4.483 3.509 1.00 0.00 H new ATOM 654 N ASP A 67 14.547 -2.756 3.274 1.00 0.00 N ATOM 655 CA ASP A 67 15.054 -1.477 3.860 1.00 0.00 C ATOM 656 C ASP A 67 16.571 -1.344 3.657 1.00 0.00 C ATOM 657 O ASP A 67 17.247 -0.673 4.414 1.00 0.00 O ATOM 658 CB ASP A 67 14.712 -1.565 5.348 1.00 0.00 C ATOM 659 CG ASP A 67 13.889 -0.342 5.755 1.00 0.00 C ATOM 660 OD1 ASP A 67 12.699 -0.336 5.483 1.00 0.00 O ATOM 661 OD2 ASP A 67 14.464 0.569 6.329 1.00 0.00 O ATOM 0 H ASP A 67 15.089 -3.587 3.513 1.00 0.00 H new ATOM 0 HA ASP A 67 14.605 -0.604 3.386 1.00 0.00 H new ATOM 0 HB2 ASP A 67 14.151 -2.478 5.550 1.00 0.00 H new ATOM 0 HB3 ASP A 67 15.626 -1.615 5.940 1.00 0.00 H new ATOM 666 N GLU A 68 17.106 -1.968 2.638 1.00 0.00 N ATOM 667 CA GLU A 68 18.575 -1.872 2.382 1.00 0.00 C ATOM 668 C GLU A 68 18.896 -2.222 0.919 1.00 0.00 C ATOM 669 O GLU A 68 19.535 -3.218 0.634 1.00 0.00 O ATOM 670 CB GLU A 68 19.213 -2.881 3.345 1.00 0.00 C ATOM 671 CG GLU A 68 20.306 -2.185 4.160 1.00 0.00 C ATOM 672 CD GLU A 68 21.566 -2.033 3.305 1.00 0.00 C ATOM 673 OE1 GLU A 68 21.590 -1.140 2.473 1.00 0.00 O ATOM 674 OE2 GLU A 68 22.485 -2.810 3.499 1.00 0.00 O ATOM 0 H GLU A 68 16.588 -2.541 1.972 1.00 0.00 H new ATOM 0 HA GLU A 68 18.956 -0.863 2.543 1.00 0.00 H new ATOM 0 HB2 GLU A 68 18.455 -3.294 4.011 1.00 0.00 H new ATOM 0 HB3 GLU A 68 19.636 -3.716 2.787 1.00 0.00 H new ATOM 0 HG2 GLU A 68 19.959 -1.206 4.491 1.00 0.00 H new ATOM 0 HG3 GLU A 68 20.530 -2.764 5.056 1.00 0.00 H new ATOM 681 N ASP A 69 18.464 -1.396 -0.008 1.00 0.00 N ATOM 682 CA ASP A 69 18.740 -1.645 -1.463 1.00 0.00 C ATOM 683 C ASP A 69 18.134 -0.513 -2.309 1.00 0.00 C ATOM 684 O ASP A 69 16.957 -0.529 -2.609 1.00 0.00 O ATOM 685 CB ASP A 69 18.065 -2.986 -1.799 1.00 0.00 C ATOM 686 CG ASP A 69 19.109 -4.030 -2.239 1.00 0.00 C ATOM 687 OD1 ASP A 69 20.256 -3.664 -2.450 1.00 0.00 O ATOM 688 OD2 ASP A 69 18.735 -5.185 -2.364 1.00 0.00 O ATOM 0 H ASP A 69 17.926 -0.551 0.184 1.00 0.00 H new ATOM 0 HA ASP A 69 19.809 -1.677 -1.674 1.00 0.00 H new ATOM 0 HB2 ASP A 69 17.522 -3.353 -0.928 1.00 0.00 H new ATOM 0 HB3 ASP A 69 17.333 -2.841 -2.593 1.00 0.00 H new ATOM 693 N PRO A 70 18.960 0.445 -2.653 1.00 0.00 N ATOM 694 CA PRO A 70 18.489 1.605 -3.452 1.00 0.00 C ATOM 695 C PRO A 70 18.248 1.225 -4.926 1.00 0.00 C ATOM 696 O PRO A 70 17.125 0.994 -5.328 1.00 0.00 O ATOM 697 CB PRO A 70 19.622 2.622 -3.304 1.00 0.00 C ATOM 698 CG PRO A 70 20.845 1.814 -2.995 1.00 0.00 C ATOM 699 CD PRO A 70 20.390 0.538 -2.331 1.00 0.00 C ATOM 0 HA PRO A 70 17.529 1.991 -3.109 1.00 0.00 H new ATOM 0 HB2 PRO A 70 19.754 3.199 -4.219 1.00 0.00 H new ATOM 0 HB3 PRO A 70 19.409 3.333 -2.506 1.00 0.00 H new ATOM 0 HG2 PRO A 70 21.400 1.595 -3.907 1.00 0.00 H new ATOM 0 HG3 PRO A 70 21.516 2.369 -2.339 1.00 0.00 H new ATOM 0 HD2 PRO A 70 20.939 -0.324 -2.710 1.00 0.00 H new ATOM 0 HD3 PRO A 70 20.553 0.571 -1.254 1.00 0.00 H new ATOM 707 N GLY A 71 19.284 1.171 -5.733 1.00 0.00 N ATOM 708 CA GLY A 71 19.108 0.826 -7.180 1.00 0.00 C ATOM 709 C GLY A 71 18.525 -0.585 -7.346 1.00 0.00 C ATOM 710 O GLY A 71 17.852 -0.870 -8.318 1.00 0.00 O ATOM 0 H GLY A 71 20.247 1.352 -5.449 1.00 0.00 H new ATOM 0 HA2 GLY A 71 18.448 1.553 -7.653 1.00 0.00 H new ATOM 0 HA3 GLY A 71 20.069 0.888 -7.691 1.00 0.00 H new ATOM 714 N THR A 72 18.781 -1.470 -6.415 1.00 0.00 N ATOM 715 CA THR A 72 18.244 -2.861 -6.532 1.00 0.00 C ATOM 716 C THR A 72 16.731 -2.871 -6.267 1.00 0.00 C ATOM 717 O THR A 72 16.240 -2.105 -5.458 1.00 0.00 O ATOM 718 CB THR A 72 18.993 -3.664 -5.462 1.00 0.00 C ATOM 719 OG1 THR A 72 20.391 -3.440 -5.597 1.00 0.00 O ATOM 720 CG2 THR A 72 18.699 -5.158 -5.621 1.00 0.00 C ATOM 0 H THR A 72 19.338 -1.290 -5.580 1.00 0.00 H new ATOM 0 HA THR A 72 18.388 -3.281 -7.528 1.00 0.00 H new ATOM 0 HB THR A 72 18.660 -3.340 -4.476 1.00 0.00 H new ATOM 0 HG1 THR A 72 20.806 -3.415 -4.709 1.00 0.00 H new ATOM 0 HG21 THR A 72 19.236 -5.718 -4.856 1.00 0.00 H new ATOM 0 HG22 THR A 72 17.628 -5.332 -5.513 1.00 0.00 H new ATOM 0 HG23 THR A 72 19.023 -5.490 -6.608 1.00 0.00 H new ATOM 728 N PRO A 73 16.037 -3.748 -6.959 1.00 0.00 N ATOM 729 CA PRO A 73 14.564 -3.861 -6.794 1.00 0.00 C ATOM 730 C PRO A 73 14.215 -4.355 -5.385 1.00 0.00 C ATOM 731 O PRO A 73 14.988 -5.049 -4.751 1.00 0.00 O ATOM 732 CB PRO A 73 14.159 -4.878 -7.861 1.00 0.00 C ATOM 733 CG PRO A 73 15.399 -5.669 -8.116 1.00 0.00 C ATOM 734 CD PRO A 73 16.548 -4.713 -7.942 1.00 0.00 C ATOM 0 HA PRO A 73 14.044 -2.910 -6.909 1.00 0.00 H new ATOM 0 HB2 PRO A 73 13.346 -5.516 -7.513 1.00 0.00 H new ATOM 0 HB3 PRO A 73 13.810 -4.384 -8.768 1.00 0.00 H new ATOM 0 HG2 PRO A 73 15.478 -6.504 -7.420 1.00 0.00 H new ATOM 0 HG3 PRO A 73 15.392 -6.091 -9.121 1.00 0.00 H new ATOM 0 HD2 PRO A 73 17.443 -5.220 -7.581 1.00 0.00 H new ATOM 0 HD3 PRO A 73 16.814 -4.228 -8.881 1.00 0.00 H new ATOM 742 N LYS A 74 13.061 -3.990 -4.891 1.00 0.00 N ATOM 743 CA LYS A 74 12.655 -4.419 -3.524 1.00 0.00 C ATOM 744 C LYS A 74 11.315 -5.154 -3.575 1.00 0.00 C ATOM 745 O LYS A 74 10.360 -4.654 -4.137 1.00 0.00 O ATOM 746 CB LYS A 74 12.519 -3.122 -2.723 1.00 0.00 C ATOM 747 CG LYS A 74 13.319 -3.237 -1.425 1.00 0.00 C ATOM 748 CD LYS A 74 14.652 -2.505 -1.582 1.00 0.00 C ATOM 749 CE LYS A 74 14.523 -1.086 -1.019 1.00 0.00 C ATOM 750 NZ LYS A 74 15.006 -1.167 0.390 1.00 0.00 N ATOM 0 H LYS A 74 12.380 -3.410 -5.380 1.00 0.00 H new ATOM 0 HA LYS A 74 13.377 -5.102 -3.078 1.00 0.00 H new ATOM 0 HB2 LYS A 74 12.881 -2.279 -3.312 1.00 0.00 H new ATOM 0 HB3 LYS A 74 11.470 -2.928 -2.500 1.00 0.00 H new ATOM 0 HG2 LYS A 74 12.753 -2.810 -0.597 1.00 0.00 H new ATOM 0 HG3 LYS A 74 13.494 -4.286 -1.185 1.00 0.00 H new ATOM 0 HD2 LYS A 74 15.440 -3.046 -1.058 1.00 0.00 H new ATOM 0 HD3 LYS A 74 14.937 -2.466 -2.633 1.00 0.00 H new ATOM 0 HE2 LYS A 74 15.118 -0.379 -1.597 1.00 0.00 H new ATOM 0 HE3 LYS A 74 13.490 -0.741 -1.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 14.259 -0.834 1.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 15.245 -2.153 0.619 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 15.851 -0.571 0.502 1.00 0.00 H new ATOM 764 N PRO A 75 11.284 -6.315 -2.972 1.00 0.00 N ATOM 765 CA PRO A 75 10.038 -7.112 -2.936 1.00 0.00 C ATOM 766 C PRO A 75 9.022 -6.420 -2.026 1.00 0.00 C ATOM 767 O PRO A 75 9.315 -6.091 -0.893 1.00 0.00 O ATOM 768 CB PRO A 75 10.488 -8.458 -2.366 1.00 0.00 C ATOM 769 CG PRO A 75 11.723 -8.149 -1.587 1.00 0.00 C ATOM 770 CD PRO A 75 12.385 -6.985 -2.272 1.00 0.00 C ATOM 0 HA PRO A 75 9.553 -7.226 -3.905 1.00 0.00 H new ATOM 0 HB2 PRO A 75 9.718 -8.895 -1.730 1.00 0.00 H new ATOM 0 HB3 PRO A 75 10.691 -9.176 -3.161 1.00 0.00 H new ATOM 0 HG2 PRO A 75 11.478 -7.902 -0.554 1.00 0.00 H new ATOM 0 HG3 PRO A 75 12.389 -9.011 -1.559 1.00 0.00 H new ATOM 0 HD2 PRO A 75 12.866 -6.320 -1.555 1.00 0.00 H new ATOM 0 HD3 PRO A 75 13.157 -7.316 -2.966 1.00 0.00 H new ATOM 778 N VAL A 76 7.844 -6.171 -2.529 1.00 0.00 N ATOM 779 CA VAL A 76 6.801 -5.472 -1.718 1.00 0.00 C ATOM 780 C VAL A 76 5.506 -6.292 -1.689 1.00 0.00 C ATOM 781 O VAL A 76 5.188 -7.000 -2.628 1.00 0.00 O ATOM 782 CB VAL A 76 6.559 -4.132 -2.424 1.00 0.00 C ATOM 783 CG1 VAL A 76 5.832 -3.176 -1.478 1.00 0.00 C ATOM 784 CG2 VAL A 76 7.894 -3.504 -2.840 1.00 0.00 C ATOM 0 H VAL A 76 7.555 -6.423 -3.474 1.00 0.00 H new ATOM 0 HA VAL A 76 7.121 -5.337 -0.685 1.00 0.00 H new ATOM 0 HB VAL A 76 5.951 -4.309 -3.311 1.00 0.00 H new ATOM 0 HG11 VAL A 76 5.661 -2.225 -1.982 1.00 0.00 H new ATOM 0 HG12 VAL A 76 4.875 -3.609 -1.187 1.00 0.00 H new ATOM 0 HG13 VAL A 76 6.441 -3.011 -0.589 1.00 0.00 H new ATOM 0 HG21 VAL A 76 7.709 -2.553 -3.340 1.00 0.00 H new ATOM 0 HG22 VAL A 76 8.508 -3.335 -1.955 1.00 0.00 H new ATOM 0 HG23 VAL A 76 8.416 -4.176 -3.521 1.00 0.00 H new ATOM 794 N SER A 77 4.757 -6.190 -0.623 1.00 0.00 N ATOM 795 CA SER A 77 3.475 -6.951 -0.522 1.00 0.00 C ATOM 796 C SER A 77 2.505 -6.221 0.415 1.00 0.00 C ATOM 797 O SER A 77 2.894 -5.703 1.445 1.00 0.00 O ATOM 798 CB SER A 77 3.865 -8.315 0.057 1.00 0.00 C ATOM 799 OG SER A 77 4.442 -9.114 -0.970 1.00 0.00 O ATOM 0 H SER A 77 4.978 -5.610 0.186 1.00 0.00 H new ATOM 0 HA SER A 77 2.973 -7.050 -1.485 1.00 0.00 H new ATOM 0 HB2 SER A 77 4.574 -8.187 0.875 1.00 0.00 H new ATOM 0 HB3 SER A 77 2.987 -8.812 0.471 1.00 0.00 H new ATOM 0 HG SER A 77 4.649 -8.551 -1.745 1.00 0.00 H new ATOM 805 N PHE A 78 1.241 -6.172 0.064 1.00 0.00 N ATOM 806 CA PHE A 78 0.244 -5.473 0.936 1.00 0.00 C ATOM 807 C PHE A 78 -1.185 -5.862 0.548 1.00 0.00 C ATOM 808 O PHE A 78 -1.430 -6.403 -0.515 1.00 0.00 O ATOM 809 CB PHE A 78 0.457 -3.968 0.714 1.00 0.00 C ATOM 810 CG PHE A 78 0.527 -3.644 -0.764 1.00 0.00 C ATOM 811 CD1 PHE A 78 -0.650 -3.538 -1.517 1.00 0.00 C ATOM 812 CD2 PHE A 78 1.769 -3.439 -1.376 1.00 0.00 C ATOM 813 CE1 PHE A 78 -0.583 -3.228 -2.879 1.00 0.00 C ATOM 814 CE2 PHE A 78 1.834 -3.130 -2.740 1.00 0.00 C ATOM 815 CZ PHE A 78 0.659 -3.024 -3.492 1.00 0.00 C ATOM 0 H PHE A 78 0.858 -6.585 -0.786 1.00 0.00 H new ATOM 0 HA PHE A 78 0.382 -5.749 1.981 1.00 0.00 H new ATOM 0 HB2 PHE A 78 -0.358 -3.410 1.175 1.00 0.00 H new ATOM 0 HB3 PHE A 78 1.378 -3.651 1.204 1.00 0.00 H new ATOM 0 HD1 PHE A 78 -1.609 -3.696 -1.046 1.00 0.00 H new ATOM 0 HD2 PHE A 78 2.677 -3.519 -0.796 1.00 0.00 H new ATOM 0 HE1 PHE A 78 -1.491 -3.146 -3.459 1.00 0.00 H new ATOM 0 HE2 PHE A 78 2.793 -2.973 -3.212 1.00 0.00 H new ATOM 0 HZ PHE A 78 0.710 -2.785 -4.544 1.00 0.00 H new ATOM 825 N THR A 79 -2.127 -5.572 1.403 1.00 0.00 N ATOM 826 CA THR A 79 -3.549 -5.903 1.099 1.00 0.00 C ATOM 827 C THR A 79 -4.354 -4.612 0.928 1.00 0.00 C ATOM 828 O THR A 79 -4.201 -3.671 1.682 1.00 0.00 O ATOM 829 CB THR A 79 -4.061 -6.709 2.300 1.00 0.00 C ATOM 830 OG1 THR A 79 -3.553 -6.155 3.507 1.00 0.00 O ATOM 831 CG2 THR A 79 -3.606 -8.165 2.173 1.00 0.00 C ATOM 0 H THR A 79 -1.973 -5.118 2.303 1.00 0.00 H new ATOM 0 HA THR A 79 -3.648 -6.473 0.175 1.00 0.00 H new ATOM 0 HB THR A 79 -5.150 -6.669 2.319 1.00 0.00 H new ATOM 0 HG1 THR A 79 -3.885 -6.673 4.270 1.00 0.00 H new ATOM 0 HG21 THR A 79 -3.971 -8.736 3.027 1.00 0.00 H new ATOM 0 HG22 THR A 79 -4.006 -8.592 1.253 1.00 0.00 H new ATOM 0 HG23 THR A 79 -2.517 -8.205 2.148 1.00 0.00 H new ATOM 839 N VAL A 80 -5.205 -4.566 -0.064 1.00 0.00 N ATOM 840 CA VAL A 80 -6.027 -3.339 -0.302 1.00 0.00 C ATOM 841 C VAL A 80 -7.524 -3.676 -0.219 1.00 0.00 C ATOM 842 O VAL A 80 -7.936 -4.786 -0.502 1.00 0.00 O ATOM 843 CB VAL A 80 -5.641 -2.845 -1.707 1.00 0.00 C ATOM 844 CG1 VAL A 80 -4.163 -2.436 -1.722 1.00 0.00 C ATOM 845 CG2 VAL A 80 -5.866 -3.956 -2.740 1.00 0.00 C ATOM 0 H VAL A 80 -5.368 -5.328 -0.723 1.00 0.00 H new ATOM 0 HA VAL A 80 -5.841 -2.570 0.448 1.00 0.00 H new ATOM 0 HB VAL A 80 -6.264 -1.987 -1.960 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -3.892 -2.087 -2.718 1.00 0.00 H new ATOM 0 HG12 VAL A 80 -4.000 -1.636 -1.000 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -3.545 -3.294 -1.458 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -5.589 -3.594 -3.730 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -5.252 -4.820 -2.485 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -6.917 -4.245 -2.740 1.00 0.00 H new ATOM 855 N LYS A 81 -8.336 -2.729 0.178 1.00 0.00 N ATOM 856 CA LYS A 81 -9.807 -2.987 0.299 1.00 0.00 C ATOM 857 C LYS A 81 -10.603 -1.997 -0.569 1.00 0.00 C ATOM 858 O LYS A 81 -10.147 -0.907 -0.861 1.00 0.00 O ATOM 859 CB LYS A 81 -10.111 -2.795 1.796 1.00 0.00 C ATOM 860 CG LYS A 81 -11.594 -2.469 2.011 1.00 0.00 C ATOM 861 CD LYS A 81 -12.108 -3.202 3.253 1.00 0.00 C ATOM 862 CE LYS A 81 -13.061 -4.323 2.824 1.00 0.00 C ATOM 863 NZ LYS A 81 -12.945 -5.366 3.885 1.00 0.00 N ATOM 0 H LYS A 81 -8.044 -1.783 0.425 1.00 0.00 H new ATOM 0 HA LYS A 81 -10.089 -3.981 -0.047 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -9.849 -3.700 2.344 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -9.495 -1.990 2.197 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -11.726 -1.394 2.131 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -12.172 -2.766 1.136 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -11.272 -3.616 3.817 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -12.623 -2.504 3.913 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -14.085 -3.959 2.741 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -12.785 -4.722 1.848 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -13.463 -6.219 3.592 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -11.943 -5.603 4.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -13.348 -5.004 4.773 1.00 0.00 H new ATOM 877 N GLU A 82 -11.791 -2.378 -0.980 1.00 0.00 N ATOM 878 CA GLU A 82 -12.634 -1.472 -1.832 1.00 0.00 C ATOM 879 C GLU A 82 -12.963 -0.170 -1.081 1.00 0.00 C ATOM 880 O GLU A 82 -13.454 -0.191 0.035 1.00 0.00 O ATOM 881 CB GLU A 82 -13.917 -2.263 -2.118 1.00 0.00 C ATOM 882 CG GLU A 82 -14.192 -2.274 -3.628 1.00 0.00 C ATOM 883 CD GLU A 82 -15.427 -3.136 -3.947 1.00 0.00 C ATOM 884 OE1 GLU A 82 -15.772 -3.986 -3.139 1.00 0.00 O ATOM 885 OE2 GLU A 82 -16.006 -2.933 -5.004 1.00 0.00 O ATOM 0 H GLU A 82 -12.215 -3.280 -0.762 1.00 0.00 H new ATOM 0 HA GLU A 82 -12.118 -1.185 -2.748 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -13.816 -3.284 -1.750 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -14.758 -1.815 -1.589 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -14.352 -1.255 -3.982 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -13.323 -2.663 -4.159 1.00 0.00 H new ATOM 892 N THR A 83 -12.700 0.960 -1.691 1.00 0.00 N ATOM 893 CA THR A 83 -12.998 2.275 -1.026 1.00 0.00 C ATOM 894 C THR A 83 -14.385 2.783 -1.438 1.00 0.00 C ATOM 895 O THR A 83 -15.012 2.249 -2.333 1.00 0.00 O ATOM 896 CB THR A 83 -11.919 3.243 -1.528 1.00 0.00 C ATOM 897 OG1 THR A 83 -11.826 3.171 -2.948 1.00 0.00 O ATOM 898 CG2 THR A 83 -10.571 2.880 -0.905 1.00 0.00 C ATOM 0 H THR A 83 -12.291 1.032 -2.623 1.00 0.00 H new ATOM 0 HA THR A 83 -12.995 2.183 0.060 1.00 0.00 H new ATOM 0 HB THR A 83 -12.188 4.259 -1.239 1.00 0.00 H new ATOM 0 HG1 THR A 83 -12.354 3.894 -3.347 1.00 0.00 H new ATOM 0 HG21 THR A 83 -9.807 3.570 -1.264 1.00 0.00 H new ATOM 0 HG22 THR A 83 -10.641 2.949 0.181 1.00 0.00 H new ATOM 0 HG23 THR A 83 -10.302 1.862 -1.187 1.00 0.00 H new ATOM 906 N VAL A 84 -14.862 3.823 -0.796 1.00 0.00 N ATOM 907 CA VAL A 84 -16.206 4.378 -1.157 1.00 0.00 C ATOM 908 C VAL A 84 -16.141 5.126 -2.499 1.00 0.00 C ATOM 909 O VAL A 84 -17.157 5.376 -3.121 1.00 0.00 O ATOM 910 CB VAL A 84 -16.589 5.342 -0.019 1.00 0.00 C ATOM 911 CG1 VAL A 84 -16.601 4.596 1.318 1.00 0.00 C ATOM 912 CG2 VAL A 84 -15.584 6.498 0.052 1.00 0.00 C ATOM 0 H VAL A 84 -14.381 4.310 -0.040 1.00 0.00 H new ATOM 0 HA VAL A 84 -16.944 3.585 -1.272 1.00 0.00 H new ATOM 0 HB VAL A 84 -17.583 5.741 -0.219 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -16.873 5.286 2.117 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -17.328 3.785 1.276 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -15.611 4.185 1.514 1.00 0.00 H new ATOM 0 HG21 VAL A 84 -15.864 7.174 0.860 1.00 0.00 H new ATOM 0 HG22 VAL A 84 -14.586 6.102 0.240 1.00 0.00 H new ATOM 0 HG23 VAL A 84 -15.587 7.041 -0.893 1.00 0.00 H new ATOM 922 N CYS A 85 -14.962 5.491 -2.946 1.00 0.00 N ATOM 923 CA CYS A 85 -14.841 6.228 -4.240 1.00 0.00 C ATOM 924 C CYS A 85 -14.631 5.256 -5.407 1.00 0.00 C ATOM 925 O CYS A 85 -13.877 4.306 -5.294 1.00 0.00 O ATOM 926 CB CYS A 85 -13.615 7.123 -4.082 1.00 0.00 C ATOM 927 SG CYS A 85 -14.084 8.649 -3.235 1.00 0.00 S ATOM 0 H CYS A 85 -14.079 5.309 -2.469 1.00 0.00 H new ATOM 0 HA CYS A 85 -15.745 6.797 -4.459 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -12.843 6.603 -3.515 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -13.192 7.353 -5.060 1.00 0.00 H new ATOM 932 N PRO A 86 -15.299 5.542 -6.499 1.00 0.00 N ATOM 933 CA PRO A 86 -15.176 4.699 -7.709 1.00 0.00 C ATOM 934 C PRO A 86 -13.894 5.051 -8.478 1.00 0.00 C ATOM 935 O PRO A 86 -13.074 5.826 -8.022 1.00 0.00 O ATOM 936 CB PRO A 86 -16.415 5.064 -8.522 1.00 0.00 C ATOM 937 CG PRO A 86 -16.792 6.445 -8.083 1.00 0.00 C ATOM 938 CD PRO A 86 -16.227 6.663 -6.701 1.00 0.00 C ATOM 0 HA PRO A 86 -15.114 3.634 -7.488 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -16.204 5.036 -9.591 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -17.226 4.359 -8.338 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -16.398 7.187 -8.778 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -17.876 6.560 -8.075 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -15.713 7.621 -6.630 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -17.014 6.667 -5.947 1.00 0.00 H new ATOM 946 N ARG A 87 -13.721 4.487 -9.644 1.00 0.00 N ATOM 947 CA ARG A 87 -12.505 4.778 -10.457 1.00 0.00 C ATOM 948 C ARG A 87 -12.921 5.244 -11.863 1.00 0.00 C ATOM 949 O ARG A 87 -13.857 4.709 -12.427 1.00 0.00 O ATOM 950 CB ARG A 87 -11.757 3.440 -10.534 1.00 0.00 C ATOM 951 CG ARG A 87 -10.289 3.634 -10.141 1.00 0.00 C ATOM 952 CD ARG A 87 -9.469 4.029 -11.376 1.00 0.00 C ATOM 953 NE ARG A 87 -8.915 2.749 -11.905 1.00 0.00 N ATOM 954 CZ ARG A 87 -9.057 2.448 -13.168 1.00 0.00 C ATOM 955 NH1 ARG A 87 -10.157 1.875 -13.584 1.00 0.00 N ATOM 956 NH2 ARG A 87 -8.090 2.708 -14.011 1.00 0.00 N ATOM 0 H ARG A 87 -14.376 3.832 -10.071 1.00 0.00 H new ATOM 0 HA ARG A 87 -11.888 5.566 -10.025 1.00 0.00 H new ATOM 0 HB2 ARG A 87 -12.226 2.714 -9.871 1.00 0.00 H new ATOM 0 HB3 ARG A 87 -11.821 3.036 -11.545 1.00 0.00 H new ATOM 0 HG2 ARG A 87 -10.207 4.406 -9.376 1.00 0.00 H new ATOM 0 HG3 ARG A 87 -9.894 2.714 -9.709 1.00 0.00 H new ATOM 0 HD2 ARG A 87 -10.092 4.525 -12.120 1.00 0.00 H new ATOM 0 HD3 ARG A 87 -8.672 4.724 -11.113 1.00 0.00 H new ATOM 0 HE ARG A 87 -8.425 2.109 -11.280 1.00 0.00 H new ATOM 0 HH11 ARG A 87 -10.904 1.663 -12.922 1.00 0.00 H new ATOM 0 HH12 ARG A 87 -10.268 1.640 -14.570 1.00 0.00 H new ATOM 0 HH21 ARG A 87 -7.229 3.144 -13.681 1.00 0.00 H new ATOM 0 HH22 ARG A 87 -8.197 2.474 -14.998 1.00 0.00 H new ATOM 970 N PRO A 88 -12.216 6.221 -12.401 1.00 0.00 N ATOM 971 CA PRO A 88 -11.077 6.868 -11.704 1.00 0.00 C ATOM 972 C PRO A 88 -11.552 8.067 -10.864 1.00 0.00 C ATOM 973 O PRO A 88 -12.397 8.833 -11.290 1.00 0.00 O ATOM 974 CB PRO A 88 -10.200 7.346 -12.857 1.00 0.00 C ATOM 975 CG PRO A 88 -11.122 7.522 -14.031 1.00 0.00 C ATOM 976 CD PRO A 88 -12.417 6.801 -13.731 1.00 0.00 C ATOM 0 HA PRO A 88 -10.566 6.199 -11.011 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -9.703 8.283 -12.607 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -9.418 6.620 -13.080 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -11.310 8.581 -14.211 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -10.665 7.121 -14.936 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -13.264 7.487 -13.741 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -12.623 6.030 -14.473 1.00 0.00 H new ATOM 984 N THR A 89 -11.000 8.250 -9.689 1.00 0.00 N ATOM 985 CA THR A 89 -11.402 9.415 -8.838 1.00 0.00 C ATOM 986 C THR A 89 -10.450 10.592 -9.108 1.00 0.00 C ATOM 987 O THR A 89 -9.341 10.405 -9.574 1.00 0.00 O ATOM 988 CB THR A 89 -11.275 8.922 -7.384 1.00 0.00 C ATOM 989 OG1 THR A 89 -12.417 8.148 -7.048 1.00 0.00 O ATOM 990 CG2 THR A 89 -11.179 10.110 -6.420 1.00 0.00 C ATOM 0 H THR A 89 -10.288 7.643 -9.282 1.00 0.00 H new ATOM 0 HA THR A 89 -12.414 9.762 -9.047 1.00 0.00 H new ATOM 0 HB THR A 89 -10.371 8.319 -7.298 1.00 0.00 H new ATOM 0 HG1 THR A 89 -12.423 7.325 -7.580 1.00 0.00 H new ATOM 0 HG21 THR A 89 -11.090 9.743 -5.398 1.00 0.00 H new ATOM 0 HG22 THR A 89 -10.303 10.710 -6.668 1.00 0.00 H new ATOM 0 HG23 THR A 89 -12.076 10.724 -6.508 1.00 0.00 H new ATOM 998 N ARG A 90 -10.872 11.801 -8.816 1.00 0.00 N ATOM 999 CA ARG A 90 -9.987 12.988 -9.051 1.00 0.00 C ATOM 1000 C ARG A 90 -8.663 12.812 -8.297 1.00 0.00 C ATOM 1001 O ARG A 90 -7.595 12.908 -8.871 1.00 0.00 O ATOM 1002 CB ARG A 90 -10.767 14.191 -8.504 1.00 0.00 C ATOM 1003 CG ARG A 90 -9.962 15.475 -8.731 1.00 0.00 C ATOM 1004 CD ARG A 90 -10.827 16.506 -9.464 1.00 0.00 C ATOM 1005 NE ARG A 90 -11.557 17.244 -8.391 1.00 0.00 N ATOM 1006 CZ ARG A 90 -12.513 18.076 -8.706 1.00 0.00 C ATOM 1007 NH1 ARG A 90 -13.733 17.634 -8.870 1.00 0.00 N ATOM 1008 NH2 ARG A 90 -12.249 19.348 -8.855 1.00 0.00 N ATOM 0 H ARG A 90 -11.789 12.017 -8.426 1.00 0.00 H new ATOM 0 HA ARG A 90 -9.740 13.117 -10.105 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -11.735 14.265 -9.000 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -10.963 14.056 -7.440 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -9.628 15.880 -7.776 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -9.068 15.256 -9.314 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -10.213 17.183 -10.059 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -11.522 16.020 -10.149 1.00 0.00 H new ATOM 0 HE ARG A 90 -11.309 17.098 -7.412 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -13.936 16.641 -8.752 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -14.481 18.282 -9.116 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -11.297 19.690 -8.725 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -12.995 19.998 -9.101 1.00 0.00 H new ATOM 1022 N GLN A 91 -8.731 12.544 -7.018 1.00 0.00 N ATOM 1023 CA GLN A 91 -7.489 12.345 -6.215 1.00 0.00 C ATOM 1024 C GLN A 91 -7.240 10.837 -6.008 1.00 0.00 C ATOM 1025 O GLN A 91 -7.976 10.019 -6.529 1.00 0.00 O ATOM 1026 CB GLN A 91 -7.767 13.057 -4.884 1.00 0.00 C ATOM 1027 CG GLN A 91 -6.877 14.299 -4.769 1.00 0.00 C ATOM 1028 CD GLN A 91 -7.576 15.497 -5.422 1.00 0.00 C ATOM 1029 OE1 GLN A 91 -8.386 16.155 -4.800 1.00 0.00 O ATOM 1030 NE2 GLN A 91 -7.295 15.809 -6.657 1.00 0.00 N ATOM 0 H GLN A 91 -9.601 12.454 -6.493 1.00 0.00 H new ATOM 0 HA GLN A 91 -6.598 12.743 -6.700 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -8.817 13.343 -4.826 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -7.574 12.381 -4.051 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -6.669 14.514 -3.721 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -5.918 14.117 -5.253 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -6.615 15.257 -7.180 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -7.755 16.605 -7.099 1.00 0.00 H new ATOM 1039 N PRO A 92 -6.207 10.513 -5.260 1.00 0.00 N ATOM 1040 CA PRO A 92 -5.870 9.083 -4.997 1.00 0.00 C ATOM 1041 C PRO A 92 -6.950 8.406 -4.134 1.00 0.00 C ATOM 1042 O PRO A 92 -7.801 9.072 -3.571 1.00 0.00 O ATOM 1043 CB PRO A 92 -4.536 9.164 -4.252 1.00 0.00 C ATOM 1044 CG PRO A 92 -4.523 10.526 -3.641 1.00 0.00 C ATOM 1045 CD PRO A 92 -5.264 11.424 -4.593 1.00 0.00 C ATOM 0 HA PRO A 92 -5.812 8.486 -5.907 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -4.460 8.388 -3.490 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -3.695 9.027 -4.931 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -5.002 10.517 -2.662 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -3.501 10.876 -3.493 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -5.784 12.225 -4.067 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -4.589 11.896 -5.307 1.00 0.00 H new ATOM 1053 N PRO A 93 -6.877 7.094 -4.058 1.00 0.00 N ATOM 1054 CA PRO A 93 -7.859 6.315 -3.252 1.00 0.00 C ATOM 1055 C PRO A 93 -7.688 6.600 -1.752 1.00 0.00 C ATOM 1056 O PRO A 93 -8.646 6.581 -1.001 1.00 0.00 O ATOM 1057 CB PRO A 93 -7.523 4.862 -3.582 1.00 0.00 C ATOM 1058 CG PRO A 93 -6.095 4.891 -4.019 1.00 0.00 C ATOM 1059 CD PRO A 93 -5.884 6.217 -4.700 1.00 0.00 C ATOM 0 HA PRO A 93 -8.894 6.569 -3.481 1.00 0.00 H new ATOM 0 HB2 PRO A 93 -7.658 4.218 -2.713 1.00 0.00 H new ATOM 0 HB3 PRO A 93 -8.170 4.475 -4.369 1.00 0.00 H new ATOM 0 HG2 PRO A 93 -5.426 4.782 -3.166 1.00 0.00 H new ATOM 0 HG3 PRO A 93 -5.881 4.067 -4.699 1.00 0.00 H new ATOM 0 HD2 PRO A 93 -4.869 6.586 -4.554 1.00 0.00 H new ATOM 0 HD3 PRO A 93 -6.046 6.146 -5.776 1.00 0.00 H new ATOM 1067 N GLU A 94 -6.478 6.874 -1.315 1.00 0.00 N ATOM 1068 CA GLU A 94 -6.249 7.177 0.133 1.00 0.00 C ATOM 1069 C GLU A 94 -7.040 8.432 0.533 1.00 0.00 C ATOM 1070 O GLU A 94 -7.523 8.542 1.645 1.00 0.00 O ATOM 1071 CB GLU A 94 -4.741 7.421 0.263 1.00 0.00 C ATOM 1072 CG GLU A 94 -4.263 6.973 1.650 1.00 0.00 C ATOM 1073 CD GLU A 94 -2.989 6.134 1.513 1.00 0.00 C ATOM 1074 OE1 GLU A 94 -3.096 4.980 1.130 1.00 0.00 O ATOM 1075 OE2 GLU A 94 -1.926 6.656 1.800 1.00 0.00 O ATOM 0 H GLU A 94 -5.642 6.900 -1.899 1.00 0.00 H new ATOM 0 HA GLU A 94 -6.579 6.368 0.784 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -4.206 6.872 -0.512 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -4.520 8.478 0.115 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -4.071 7.843 2.277 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -5.042 6.391 2.143 1.00 0.00 H new ATOM 1082 N LEU A 95 -7.182 9.368 -0.376 1.00 0.00 N ATOM 1083 CA LEU A 95 -7.948 10.618 -0.078 1.00 0.00 C ATOM 1084 C LEU A 95 -9.417 10.292 0.235 1.00 0.00 C ATOM 1085 O LEU A 95 -10.082 11.027 0.941 1.00 0.00 O ATOM 1086 CB LEU A 95 -7.846 11.454 -1.362 1.00 0.00 C ATOM 1087 CG LEU A 95 -8.788 12.663 -1.284 1.00 0.00 C ATOM 1088 CD1 LEU A 95 -8.017 13.941 -1.622 1.00 0.00 C ATOM 1089 CD2 LEU A 95 -9.934 12.477 -2.285 1.00 0.00 C ATOM 0 H LEU A 95 -6.796 9.318 -1.319 1.00 0.00 H new ATOM 0 HA LEU A 95 -7.554 11.144 0.791 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -6.820 11.792 -1.504 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -8.101 10.840 -2.226 1.00 0.00 H new ATOM 0 HG LEU A 95 -9.192 12.744 -0.275 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -8.689 14.797 -1.566 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -7.201 14.073 -0.911 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -7.611 13.865 -2.630 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -10.606 13.334 -2.233 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -9.527 12.396 -3.293 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -10.485 11.569 -2.042 1.00 0.00 H new ATOM 1101 N CYS A 96 -9.931 9.209 -0.297 1.00 0.00 N ATOM 1102 CA CYS A 96 -11.358 8.849 -0.044 1.00 0.00 C ATOM 1103 C CYS A 96 -11.499 7.939 1.185 1.00 0.00 C ATOM 1104 O CYS A 96 -10.534 7.627 1.859 1.00 0.00 O ATOM 1105 CB CYS A 96 -11.809 8.129 -1.315 1.00 0.00 C ATOM 1106 SG CYS A 96 -12.332 9.362 -2.534 1.00 0.00 S ATOM 0 H CYS A 96 -9.421 8.559 -0.896 1.00 0.00 H new ATOM 0 HA CYS A 96 -11.966 9.728 0.170 1.00 0.00 H new ATOM 0 HB2 CYS A 96 -10.995 7.525 -1.715 1.00 0.00 H new ATOM 0 HB3 CYS A 96 -12.630 7.448 -1.091 1.00 0.00 H new ATOM 1111 N ASP A 97 -12.708 7.533 1.489 1.00 0.00 N ATOM 1112 CA ASP A 97 -12.948 6.665 2.684 1.00 0.00 C ATOM 1113 C ASP A 97 -12.646 5.187 2.384 1.00 0.00 C ATOM 1114 O ASP A 97 -11.975 4.853 1.424 1.00 0.00 O ATOM 1115 CB ASP A 97 -14.434 6.852 3.014 1.00 0.00 C ATOM 1116 CG ASP A 97 -14.630 6.863 4.531 1.00 0.00 C ATOM 1117 OD1 ASP A 97 -14.716 5.791 5.107 1.00 0.00 O ATOM 1118 OD2 ASP A 97 -14.694 7.943 5.091 1.00 0.00 O ATOM 0 H ASP A 97 -13.545 7.768 0.956 1.00 0.00 H new ATOM 0 HA ASP A 97 -12.296 6.941 3.513 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -14.797 7.786 2.584 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -15.019 6.048 2.568 1.00 0.00 H new ATOM 1123 N PHE A 98 -13.145 4.307 3.220 1.00 0.00 N ATOM 1124 CA PHE A 98 -12.919 2.843 3.047 1.00 0.00 C ATOM 1125 C PHE A 98 -14.243 2.093 3.248 1.00 0.00 C ATOM 1126 O PHE A 98 -15.010 2.411 4.138 1.00 0.00 O ATOM 1127 CB PHE A 98 -11.946 2.473 4.173 1.00 0.00 C ATOM 1128 CG PHE A 98 -10.695 1.816 3.630 1.00 0.00 C ATOM 1129 CD1 PHE A 98 -10.742 1.025 2.473 1.00 0.00 C ATOM 1130 CD2 PHE A 98 -9.482 1.992 4.307 1.00 0.00 C ATOM 1131 CE1 PHE A 98 -9.574 0.416 1.999 1.00 0.00 C ATOM 1132 CE2 PHE A 98 -8.319 1.379 3.832 1.00 0.00 C ATOM 1133 CZ PHE A 98 -8.364 0.593 2.679 1.00 0.00 C ATOM 0 H PHE A 98 -13.712 4.552 4.032 1.00 0.00 H new ATOM 0 HA PHE A 98 -12.536 2.589 2.058 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -11.675 3.370 4.731 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -12.438 1.798 4.874 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -11.676 0.886 1.949 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -9.445 2.602 5.197 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -9.607 -0.192 1.107 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -7.385 1.513 4.357 1.00 0.00 H new ATOM 0 HZ PHE A 98 -7.464 0.121 2.312 1.00 0.00 H new ATOM 1143 N LYS A 99 -14.514 1.092 2.451 1.00 0.00 N ATOM 1144 CA LYS A 99 -15.784 0.323 2.631 1.00 0.00 C ATOM 1145 C LYS A 99 -15.485 -1.032 3.268 1.00 0.00 C ATOM 1146 O LYS A 99 -14.882 -1.889 2.651 1.00 0.00 O ATOM 1147 CB LYS A 99 -16.364 0.107 1.232 1.00 0.00 C ATOM 1148 CG LYS A 99 -16.663 1.452 0.576 1.00 0.00 C ATOM 1149 CD LYS A 99 -17.505 1.224 -0.681 1.00 0.00 C ATOM 1150 CE LYS A 99 -18.962 1.601 -0.397 1.00 0.00 C ATOM 1151 NZ LYS A 99 -19.757 0.884 -1.435 1.00 0.00 N ATOM 0 H LYS A 99 -13.916 0.774 1.688 1.00 0.00 H new ATOM 0 HA LYS A 99 -16.479 0.860 3.276 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -15.659 -0.456 0.620 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -17.276 -0.486 1.295 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -17.196 2.099 1.273 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -15.733 1.959 0.318 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -17.117 1.824 -1.505 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -17.442 0.180 -0.989 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -19.259 1.298 0.607 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -19.110 2.679 -0.461 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -20.767 1.094 -1.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -19.457 1.198 -2.380 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -19.602 -0.140 -1.345 1.00 0.00 H new ATOM 1165 N GLU A 100 -15.912 -1.244 4.484 1.00 0.00 N ATOM 1166 CA GLU A 100 -15.657 -2.564 5.134 1.00 0.00 C ATOM 1167 C GLU A 100 -16.430 -3.660 4.389 1.00 0.00 C ATOM 1168 O GLU A 100 -15.988 -4.790 4.294 1.00 0.00 O ATOM 1169 CB GLU A 100 -16.158 -2.422 6.575 1.00 0.00 C ATOM 1170 CG GLU A 100 -15.874 -3.713 7.353 1.00 0.00 C ATOM 1171 CD GLU A 100 -14.379 -4.040 7.291 1.00 0.00 C ATOM 1172 OE1 GLU A 100 -13.636 -3.472 8.072 1.00 0.00 O ATOM 1173 OE2 GLU A 100 -14.002 -4.851 6.459 1.00 0.00 O ATOM 0 H GLU A 100 -16.422 -0.567 5.052 1.00 0.00 H new ATOM 0 HA GLU A 100 -14.603 -2.840 5.113 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -15.666 -1.579 7.059 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -17.228 -2.212 6.579 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -16.188 -3.599 8.391 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -16.453 -4.536 6.933 1.00 0.00 H new ATOM 1180 N ASN A 101 -17.572 -3.324 3.840 1.00 0.00 N ATOM 1181 CA ASN A 101 -18.369 -4.335 3.074 1.00 0.00 C ATOM 1182 C ASN A 101 -17.687 -4.629 1.726 1.00 0.00 C ATOM 1183 O ASN A 101 -18.059 -5.556 1.031 1.00 0.00 O ATOM 1184 CB ASN A 101 -19.752 -3.700 2.849 1.00 0.00 C ATOM 1185 CG ASN A 101 -20.288 -3.124 4.165 1.00 0.00 C ATOM 1186 OD1 ASN A 101 -20.424 -1.925 4.301 1.00 0.00 O ATOM 1187 ND2 ASN A 101 -20.595 -3.930 5.143 1.00 0.00 N ATOM 0 H ASN A 101 -17.987 -2.394 3.889 1.00 0.00 H new ATOM 0 HA ASN A 101 -18.449 -5.280 3.612 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -19.681 -2.911 2.100 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -20.445 -4.447 2.461 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -20.949 -3.553 6.022 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -20.481 -4.937 5.029 1.00 0.00 H new ATOM 1194 N GLY A 102 -16.687 -3.853 1.355 1.00 0.00 N ATOM 1195 CA GLY A 102 -15.980 -4.093 0.066 1.00 0.00 C ATOM 1196 C GLY A 102 -15.099 -5.338 0.185 1.00 0.00 C ATOM 1197 O GLY A 102 -14.844 -5.831 1.269 1.00 0.00 O ATOM 0 H GLY A 102 -16.336 -3.064 1.897 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -16.704 -4.224 -0.738 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -15.370 -3.227 -0.192 1.00 0.00 H new ATOM 1201 N ARG A 103 -14.624 -5.842 -0.921 1.00 0.00 N ATOM 1202 CA ARG A 103 -13.745 -7.049 -0.874 1.00 0.00 C ATOM 1203 C ARG A 103 -12.280 -6.623 -0.723 1.00 0.00 C ATOM 1204 O ARG A 103 -11.941 -5.464 -0.885 1.00 0.00 O ATOM 1205 CB ARG A 103 -13.982 -7.795 -2.197 1.00 0.00 C ATOM 1206 CG ARG A 103 -13.594 -6.914 -3.391 1.00 0.00 C ATOM 1207 CD ARG A 103 -14.842 -6.589 -4.220 1.00 0.00 C ATOM 1208 NE ARG A 103 -15.154 -7.839 -4.971 1.00 0.00 N ATOM 1209 CZ ARG A 103 -16.281 -8.465 -4.753 1.00 0.00 C ATOM 1210 NH1 ARG A 103 -17.369 -8.087 -5.373 1.00 0.00 N ATOM 1211 NH2 ARG A 103 -16.318 -9.465 -3.912 1.00 0.00 N ATOM 0 H ARG A 103 -14.805 -5.472 -1.854 1.00 0.00 H new ATOM 0 HA ARG A 103 -13.973 -7.692 -0.024 1.00 0.00 H new ATOM 0 HB2 ARG A 103 -13.397 -8.715 -2.212 1.00 0.00 H new ATOM 0 HB3 ARG A 103 -15.030 -8.082 -2.276 1.00 0.00 H new ATOM 0 HG2 ARG A 103 -13.129 -5.993 -3.040 1.00 0.00 H new ATOM 0 HG3 ARG A 103 -12.858 -7.427 -4.010 1.00 0.00 H new ATOM 0 HD2 ARG A 103 -15.674 -6.297 -3.579 1.00 0.00 H new ATOM 0 HD3 ARG A 103 -14.657 -5.758 -4.900 1.00 0.00 H new ATOM 0 HE ARG A 103 -14.490 -8.205 -5.653 1.00 0.00 H new ATOM 0 HH11 ARG A 103 -17.338 -7.304 -6.026 1.00 0.00 H new ATOM 0 HH12 ARG A 103 -18.248 -8.575 -5.203 1.00 0.00 H new ATOM 0 HH21 ARG A 103 -15.469 -9.755 -3.427 1.00 0.00 H new ATOM 0 HH22 ARG A 103 -17.196 -9.955 -3.740 1.00 0.00 H new ATOM 1225 N VAL A 104 -11.413 -7.546 -0.399 1.00 0.00 N ATOM 1226 CA VAL A 104 -9.972 -7.196 -0.223 1.00 0.00 C ATOM 1227 C VAL A 104 -9.124 -7.847 -1.324 1.00 0.00 C ATOM 1228 O VAL A 104 -9.599 -8.669 -2.082 1.00 0.00 O ATOM 1229 CB VAL A 104 -9.601 -7.739 1.166 1.00 0.00 C ATOM 1230 CG1 VAL A 104 -8.156 -7.367 1.510 1.00 0.00 C ATOM 1231 CG2 VAL A 104 -10.536 -7.128 2.216 1.00 0.00 C ATOM 0 H VAL A 104 -11.641 -8.529 -0.248 1.00 0.00 H new ATOM 0 HA VAL A 104 -9.791 -6.124 -0.296 1.00 0.00 H new ATOM 0 HB VAL A 104 -9.702 -8.824 1.160 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -7.905 -7.757 2.496 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -7.483 -7.796 0.768 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -8.050 -6.282 1.511 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -10.275 -7.511 3.202 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -10.431 -6.043 2.209 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -11.567 -7.395 1.984 1.00 0.00 H new ATOM 1241 N LYS A 105 -7.877 -7.462 -1.422 1.00 0.00 N ATOM 1242 CA LYS A 105 -6.973 -8.026 -2.469 1.00 0.00 C ATOM 1243 C LYS A 105 -5.516 -7.888 -2.004 1.00 0.00 C ATOM 1244 O LYS A 105 -5.156 -6.914 -1.369 1.00 0.00 O ATOM 1245 CB LYS A 105 -7.237 -7.163 -3.706 1.00 0.00 C ATOM 1246 CG LYS A 105 -6.175 -7.431 -4.775 1.00 0.00 C ATOM 1247 CD LYS A 105 -6.595 -6.765 -6.091 1.00 0.00 C ATOM 1248 CE LYS A 105 -6.521 -5.240 -5.949 1.00 0.00 C ATOM 1249 NZ LYS A 105 -7.366 -4.699 -7.054 1.00 0.00 N ATOM 0 H LYS A 105 -7.441 -6.771 -0.812 1.00 0.00 H new ATOM 0 HA LYS A 105 -7.149 -9.083 -2.670 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -8.228 -7.380 -4.105 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -7.228 -6.108 -3.431 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -5.210 -7.042 -4.450 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -6.053 -8.504 -4.921 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -5.944 -7.096 -6.900 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -7.609 -7.066 -6.354 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -6.892 -4.917 -4.976 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -5.493 -4.887 -6.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -6.784 -4.102 -7.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -7.764 -5.487 -7.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -8.140 -4.131 -6.653 1.00 0.00 H new ATOM 1263 N GLN A 106 -4.677 -8.843 -2.312 1.00 0.00 N ATOM 1264 CA GLN A 106 -3.246 -8.749 -1.881 1.00 0.00 C ATOM 1265 C GLN A 106 -2.332 -8.711 -3.104 1.00 0.00 C ATOM 1266 O GLN A 106 -2.009 -9.729 -3.683 1.00 0.00 O ATOM 1267 CB GLN A 106 -2.982 -10.000 -1.035 1.00 0.00 C ATOM 1268 CG GLN A 106 -1.706 -9.799 -0.211 1.00 0.00 C ATOM 1269 CD GLN A 106 -1.197 -11.149 0.302 1.00 0.00 C ATOM 1270 OE1 GLN A 106 -0.172 -11.630 -0.137 1.00 0.00 O ATOM 1271 NE2 GLN A 106 -1.873 -11.786 1.221 1.00 0.00 N ATOM 0 H GLN A 106 -4.917 -9.681 -2.841 1.00 0.00 H new ATOM 0 HA GLN A 106 -3.049 -7.841 -1.310 1.00 0.00 H new ATOM 0 HB2 GLN A 106 -3.828 -10.191 -0.375 1.00 0.00 H new ATOM 0 HB3 GLN A 106 -2.878 -10.873 -1.680 1.00 0.00 H new ATOM 0 HG2 GLN A 106 -0.940 -9.320 -0.822 1.00 0.00 H new ATOM 0 HG3 GLN A 106 -1.906 -9.133 0.629 1.00 0.00 H new ATOM 0 HE21 GLN A 106 -2.734 -11.384 1.591 1.00 0.00 H new ATOM 0 HE22 GLN A 106 -1.539 -12.685 1.568 1.00 0.00 H new ATOM 1280 N CYS A 107 -1.916 -7.533 -3.499 1.00 0.00 N ATOM 1281 CA CYS A 107 -1.023 -7.408 -4.691 1.00 0.00 C ATOM 1282 C CYS A 107 0.442 -7.348 -4.254 1.00 0.00 C ATOM 1283 O CYS A 107 0.857 -6.440 -3.558 1.00 0.00 O ATOM 1284 CB CYS A 107 -1.443 -6.109 -5.376 1.00 0.00 C ATOM 1285 SG CYS A 107 -3.111 -6.307 -6.058 1.00 0.00 S ATOM 0 H CYS A 107 -2.157 -6.651 -3.046 1.00 0.00 H new ATOM 0 HA CYS A 107 -1.113 -8.261 -5.363 1.00 0.00 H new ATOM 0 HB2 CYS A 107 -1.424 -5.285 -4.663 1.00 0.00 H new ATOM 0 HB3 CYS A 107 -0.740 -5.859 -6.170 1.00 0.00 H new ATOM 1290 N VAL A 108 1.221 -8.320 -4.654 1.00 0.00 N ATOM 1291 CA VAL A 108 2.663 -8.347 -4.266 1.00 0.00 C ATOM 1292 C VAL A 108 3.562 -8.300 -5.512 1.00 0.00 C ATOM 1293 O VAL A 108 3.279 -8.923 -6.518 1.00 0.00 O ATOM 1294 CB VAL A 108 2.855 -9.667 -3.503 1.00 0.00 C ATOM 1295 CG1 VAL A 108 1.891 -9.724 -2.315 1.00 0.00 C ATOM 1296 CG2 VAL A 108 2.585 -10.859 -4.431 1.00 0.00 C ATOM 0 H VAL A 108 0.918 -9.101 -5.236 1.00 0.00 H new ATOM 0 HA VAL A 108 2.935 -7.486 -3.656 1.00 0.00 H new ATOM 0 HB VAL A 108 3.883 -9.717 -3.144 1.00 0.00 H new ATOM 0 HG11 VAL A 108 2.031 -10.662 -1.777 1.00 0.00 H new ATOM 0 HG12 VAL A 108 2.090 -8.888 -1.644 1.00 0.00 H new ATOM 0 HG13 VAL A 108 0.864 -9.663 -2.676 1.00 0.00 H new ATOM 0 HG21 VAL A 108 2.724 -11.789 -3.879 1.00 0.00 H new ATOM 0 HG22 VAL A 108 1.561 -10.807 -4.802 1.00 0.00 H new ATOM 0 HG23 VAL A 108 3.277 -10.829 -5.272 1.00 0.00 H new ATOM 1306 N GLY A 109 4.644 -7.568 -5.447 1.00 0.00 N ATOM 1307 CA GLY A 109 5.570 -7.477 -6.620 1.00 0.00 C ATOM 1308 C GLY A 109 6.914 -6.902 -6.170 1.00 0.00 C ATOM 1309 O GLY A 109 7.130 -6.659 -4.999 1.00 0.00 O ATOM 0 H GLY A 109 4.929 -7.027 -4.630 1.00 0.00 H new ATOM 0 HA2 GLY A 109 5.714 -8.464 -7.060 1.00 0.00 H new ATOM 0 HA3 GLY A 109 5.133 -6.845 -7.393 1.00 0.00 H new ATOM 1313 N THR A 110 7.821 -6.672 -7.088 1.00 0.00 N ATOM 1314 CA THR A 110 9.149 -6.102 -6.695 1.00 0.00 C ATOM 1315 C THR A 110 9.373 -4.747 -7.377 1.00 0.00 C ATOM 1316 O THR A 110 9.217 -4.607 -8.577 1.00 0.00 O ATOM 1317 CB THR A 110 10.209 -7.123 -7.138 1.00 0.00 C ATOM 1318 OG1 THR A 110 10.226 -7.227 -8.558 1.00 0.00 O ATOM 1319 CG2 THR A 110 9.905 -8.493 -6.524 1.00 0.00 C ATOM 0 H THR A 110 7.702 -6.852 -8.085 1.00 0.00 H new ATOM 0 HA THR A 110 9.204 -5.928 -5.620 1.00 0.00 H new ATOM 0 HB THR A 110 11.187 -6.785 -6.794 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.766 -6.455 -8.948 1.00 0.00 H new ATOM 0 HG21 THR A 110 10.661 -9.211 -6.843 1.00 0.00 H new ATOM 0 HG22 THR A 110 9.915 -8.415 -5.437 1.00 0.00 H new ATOM 0 HG23 THR A 110 8.923 -8.830 -6.855 1.00 0.00 H new ATOM 1327 N VAL A 111 9.735 -3.749 -6.611 1.00 0.00 N ATOM 1328 CA VAL A 111 9.972 -2.384 -7.181 1.00 0.00 C ATOM 1329 C VAL A 111 11.096 -1.679 -6.406 1.00 0.00 C ATOM 1330 O VAL A 111 11.199 -1.807 -5.200 1.00 0.00 O ATOM 1331 CB VAL A 111 8.643 -1.628 -7.009 1.00 0.00 C ATOM 1332 CG1 VAL A 111 7.546 -2.310 -7.831 1.00 0.00 C ATOM 1333 CG2 VAL A 111 8.228 -1.619 -5.533 1.00 0.00 C ATOM 0 H VAL A 111 9.878 -3.821 -5.604 1.00 0.00 H new ATOM 0 HA VAL A 111 10.277 -2.425 -8.227 1.00 0.00 H new ATOM 0 HB VAL A 111 8.779 -0.603 -7.355 1.00 0.00 H new ATOM 0 HG11 VAL A 111 6.608 -1.770 -7.705 1.00 0.00 H new ATOM 0 HG12 VAL A 111 7.827 -2.309 -8.884 1.00 0.00 H new ATOM 0 HG13 VAL A 111 7.422 -3.338 -7.490 1.00 0.00 H new ATOM 0 HG21 VAL A 111 7.286 -1.081 -5.423 1.00 0.00 H new ATOM 0 HG22 VAL A 111 8.104 -2.644 -5.184 1.00 0.00 H new ATOM 0 HG23 VAL A 111 8.999 -1.125 -4.941 1.00 0.00 H new ATOM 1343 N THR A 112 11.939 -0.940 -7.085 1.00 0.00 N ATOM 1344 CA THR A 112 13.055 -0.231 -6.373 1.00 0.00 C ATOM 1345 C THR A 112 12.497 0.861 -5.447 1.00 0.00 C ATOM 1346 O THR A 112 11.425 1.394 -5.671 1.00 0.00 O ATOM 1347 CB THR A 112 13.935 0.378 -7.477 1.00 0.00 C ATOM 1348 OG1 THR A 112 15.023 1.071 -6.884 1.00 0.00 O ATOM 1349 CG2 THR A 112 13.118 1.354 -8.331 1.00 0.00 C ATOM 0 H THR A 112 11.906 -0.796 -8.094 1.00 0.00 H new ATOM 0 HA THR A 112 13.627 -0.911 -5.741 1.00 0.00 H new ATOM 0 HB THR A 112 14.308 -0.424 -8.114 1.00 0.00 H new ATOM 0 HG1 THR A 112 15.549 0.449 -6.339 1.00 0.00 H new ATOM 0 HG21 THR A 112 13.754 1.777 -9.108 1.00 0.00 H new ATOM 0 HG22 THR A 112 12.285 0.824 -8.792 1.00 0.00 H new ATOM 0 HG23 THR A 112 12.734 2.156 -7.700 1.00 0.00 H new ATOM 1357 N LEU A 113 13.220 1.187 -4.404 1.00 0.00 N ATOM 1358 CA LEU A 113 12.747 2.237 -3.447 1.00 0.00 C ATOM 1359 C LEU A 113 13.172 3.642 -3.906 1.00 0.00 C ATOM 1360 O LEU A 113 12.661 4.634 -3.418 1.00 0.00 O ATOM 1361 CB LEU A 113 13.420 1.885 -2.118 1.00 0.00 C ATOM 1362 CG LEU A 113 12.591 2.442 -0.961 1.00 0.00 C ATOM 1363 CD1 LEU A 113 11.399 1.520 -0.693 1.00 0.00 C ATOM 1364 CD2 LEU A 113 13.461 2.530 0.294 1.00 0.00 C ATOM 0 H LEU A 113 14.121 0.770 -4.173 1.00 0.00 H new ATOM 0 HA LEU A 113 11.660 2.256 -3.374 1.00 0.00 H new ATOM 0 HB2 LEU A 113 13.516 0.803 -2.022 1.00 0.00 H new ATOM 0 HB3 LEU A 113 14.428 2.298 -2.088 1.00 0.00 H new ATOM 0 HG LEU A 113 12.228 3.436 -1.222 1.00 0.00 H new ATOM 0 HD11 LEU A 113 10.809 1.919 0.132 1.00 0.00 H new ATOM 0 HD12 LEU A 113 10.778 1.459 -1.587 1.00 0.00 H new ATOM 0 HD13 LEU A 113 11.760 0.525 -0.433 1.00 0.00 H new ATOM 0 HD21 LEU A 113 12.870 2.927 1.119 1.00 0.00 H new ATOM 0 HD22 LEU A 113 13.826 1.536 0.554 1.00 0.00 H new ATOM 0 HD23 LEU A 113 14.308 3.189 0.104 1.00 0.00 H new ATOM 1376 N ASP A 114 14.097 3.735 -4.832 1.00 0.00 N ATOM 1377 CA ASP A 114 14.550 5.076 -5.314 1.00 0.00 C ATOM 1378 C ASP A 114 13.400 5.803 -6.023 1.00 0.00 C ATOM 1379 O ASP A 114 13.068 6.927 -5.695 1.00 0.00 O ATOM 1380 CB ASP A 114 15.687 4.782 -6.301 1.00 0.00 C ATOM 1381 CG ASP A 114 17.024 5.182 -5.677 1.00 0.00 C ATOM 1382 OD1 ASP A 114 17.455 4.498 -4.762 1.00 0.00 O ATOM 1383 OD2 ASP A 114 17.594 6.163 -6.123 1.00 0.00 O ATOM 0 H ASP A 114 14.557 2.939 -5.274 1.00 0.00 H new ATOM 0 HA ASP A 114 14.875 5.718 -4.496 1.00 0.00 H new ATOM 0 HB2 ASP A 114 15.696 3.722 -6.556 1.00 0.00 H new ATOM 0 HB3 ASP A 114 15.528 5.332 -7.229 1.00 0.00 H new ATOM 1388 N GLN A 115 12.795 5.164 -6.991 1.00 0.00 N ATOM 1389 CA GLN A 115 11.666 5.795 -7.736 1.00 0.00 C ATOM 1390 C GLN A 115 10.851 4.714 -8.457 1.00 0.00 C ATOM 1391 O GLN A 115 11.398 3.856 -9.124 1.00 0.00 O ATOM 1392 CB GLN A 115 12.324 6.749 -8.747 1.00 0.00 C ATOM 1393 CG GLN A 115 13.360 5.996 -9.595 1.00 0.00 C ATOM 1394 CD GLN A 115 14.574 6.895 -9.852 1.00 0.00 C ATOM 1395 OE1 GLN A 115 14.891 7.193 -10.986 1.00 0.00 O ATOM 1396 NE2 GLN A 115 15.275 7.339 -8.842 1.00 0.00 N ATOM 0 H GLN A 115 13.038 4.223 -7.300 1.00 0.00 H new ATOM 0 HA GLN A 115 10.981 6.327 -7.076 1.00 0.00 H new ATOM 0 HB2 GLN A 115 11.563 7.186 -9.394 1.00 0.00 H new ATOM 0 HB3 GLN A 115 12.805 7.573 -8.220 1.00 0.00 H new ATOM 0 HG2 GLN A 115 13.672 5.087 -9.081 1.00 0.00 H new ATOM 0 HG3 GLN A 115 12.915 5.691 -10.542 1.00 0.00 H new ATOM 0 HE21 GLN A 115 15.010 7.090 -7.889 1.00 0.00 H new ATOM 0 HE22 GLN A 115 16.086 7.935 -9.007 1.00 0.00 H new ATOM 1405 N ILE A 116 9.550 4.745 -8.320 1.00 0.00 N ATOM 1406 CA ILE A 116 8.699 3.715 -8.993 1.00 0.00 C ATOM 1407 C ILE A 116 8.773 3.871 -10.515 1.00 0.00 C ATOM 1408 O ILE A 116 8.863 4.969 -11.037 1.00 0.00 O ATOM 1409 CB ILE A 116 7.274 3.968 -8.481 1.00 0.00 C ATOM 1410 CG1 ILE A 116 7.103 3.298 -7.113 1.00 0.00 C ATOM 1411 CG2 ILE A 116 6.242 3.394 -9.461 1.00 0.00 C ATOM 1412 CD1 ILE A 116 7.262 1.779 -7.248 1.00 0.00 C ATOM 0 H ILE A 116 9.040 5.438 -7.772 1.00 0.00 H new ATOM 0 HA ILE A 116 9.029 2.701 -8.770 1.00 0.00 H new ATOM 0 HB ILE A 116 7.115 5.043 -8.393 1.00 0.00 H new ATOM 0 HG12 ILE A 116 7.842 3.688 -6.413 1.00 0.00 H new ATOM 0 HG13 ILE A 116 6.121 3.534 -6.704 1.00 0.00 H new ATOM 0 HG21 ILE A 116 5.237 3.582 -9.083 1.00 0.00 H new ATOM 0 HG22 ILE A 116 6.359 3.872 -10.434 1.00 0.00 H new ATOM 0 HG23 ILE A 116 6.396 2.320 -9.564 1.00 0.00 H new ATOM 0 HD11 ILE A 116 7.139 1.312 -6.271 1.00 0.00 H new ATOM 0 HD12 ILE A 116 6.506 1.393 -7.932 1.00 0.00 H new ATOM 0 HD13 ILE A 116 8.254 1.550 -7.637 1.00 0.00 H new ATOM 1424 N LYS A 117 8.730 2.772 -11.221 1.00 0.00 N ATOM 1425 CA LYS A 117 8.793 2.822 -12.713 1.00 0.00 C ATOM 1426 C LYS A 117 7.973 1.672 -13.312 1.00 0.00 C ATOM 1427 O LYS A 117 7.812 0.631 -12.702 1.00 0.00 O ATOM 1428 CB LYS A 117 10.278 2.664 -13.062 1.00 0.00 C ATOM 1429 CG LYS A 117 10.974 4.026 -12.966 1.00 0.00 C ATOM 1430 CD LYS A 117 12.182 4.057 -13.906 1.00 0.00 C ATOM 1431 CE LYS A 117 12.742 5.484 -13.976 1.00 0.00 C ATOM 1432 NZ LYS A 117 14.066 5.425 -13.292 1.00 0.00 N ATOM 0 H LYS A 117 8.653 1.835 -10.826 1.00 0.00 H new ATOM 0 HA LYS A 117 8.383 3.750 -13.112 1.00 0.00 H new ATOM 0 HB2 LYS A 117 10.749 1.954 -12.382 1.00 0.00 H new ATOM 0 HB3 LYS A 117 10.385 2.259 -14.068 1.00 0.00 H new ATOM 0 HG2 LYS A 117 10.276 4.821 -13.229 1.00 0.00 H new ATOM 0 HG3 LYS A 117 11.294 4.210 -11.941 1.00 0.00 H new ATOM 0 HD2 LYS A 117 12.950 3.371 -13.550 1.00 0.00 H new ATOM 0 HD3 LYS A 117 11.890 3.721 -14.901 1.00 0.00 H new ATOM 0 HE2 LYS A 117 12.848 5.814 -15.009 1.00 0.00 H new ATOM 0 HE3 LYS A 117 12.076 6.192 -13.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 14.114 6.167 -12.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 14.185 4.493 -12.845 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 14.824 5.574 -13.989 1.00 0.00 H new ATOM 1446 N ASP A 118 7.452 1.857 -14.498 1.00 0.00 N ATOM 1447 CA ASP A 118 6.638 0.779 -15.138 1.00 0.00 C ATOM 1448 C ASP A 118 7.499 -0.037 -16.115 1.00 0.00 C ATOM 1449 O ASP A 118 8.573 0.390 -16.494 1.00 0.00 O ATOM 1450 CB ASP A 118 5.515 1.512 -15.882 1.00 0.00 C ATOM 1451 CG ASP A 118 4.290 1.626 -14.972 1.00 0.00 C ATOM 1452 OD1 ASP A 118 3.615 0.625 -14.793 1.00 0.00 O ATOM 1453 OD2 ASP A 118 4.048 2.710 -14.466 1.00 0.00 O ATOM 0 H ASP A 118 7.555 2.708 -15.051 1.00 0.00 H new ATOM 0 HA ASP A 118 6.245 0.073 -14.406 1.00 0.00 H new ATOM 0 HB2 ASP A 118 5.851 2.504 -16.183 1.00 0.00 H new ATOM 0 HB3 ASP A 118 5.256 0.973 -16.793 1.00 0.00 H new ATOM 1458 N PRO A 119 6.999 -1.195 -16.496 1.00 0.00 N ATOM 1459 CA PRO A 119 5.678 -1.678 -16.006 1.00 0.00 C ATOM 1460 C PRO A 119 5.775 -2.178 -14.557 1.00 0.00 C ATOM 1461 O PRO A 119 6.838 -2.530 -14.082 1.00 0.00 O ATOM 1462 CB PRO A 119 5.344 -2.828 -16.950 1.00 0.00 C ATOM 1463 CG PRO A 119 6.664 -3.316 -17.459 1.00 0.00 C ATOM 1464 CD PRO A 119 7.623 -2.153 -17.418 1.00 0.00 C ATOM 0 HA PRO A 119 4.920 -0.895 -16.001 1.00 0.00 H new ATOM 0 HB2 PRO A 119 4.806 -3.620 -16.430 1.00 0.00 H new ATOM 0 HB3 PRO A 119 4.706 -2.493 -17.768 1.00 0.00 H new ATOM 0 HG2 PRO A 119 7.032 -4.138 -16.845 1.00 0.00 H new ATOM 0 HG3 PRO A 119 6.566 -3.697 -18.476 1.00 0.00 H new ATOM 0 HD2 PRO A 119 8.607 -2.462 -17.064 1.00 0.00 H new ATOM 0 HD3 PRO A 119 7.762 -1.718 -18.408 1.00 0.00 H new ATOM 1472 N LEU A 120 4.667 -2.212 -13.858 1.00 0.00 N ATOM 1473 CA LEU A 120 4.679 -2.689 -12.441 1.00 0.00 C ATOM 1474 C LEU A 120 4.498 -4.212 -12.396 1.00 0.00 C ATOM 1475 O LEU A 120 3.425 -4.727 -12.651 1.00 0.00 O ATOM 1476 CB LEU A 120 3.498 -1.979 -11.771 1.00 0.00 C ATOM 1477 CG LEU A 120 3.742 -1.886 -10.262 1.00 0.00 C ATOM 1478 CD1 LEU A 120 4.627 -0.674 -9.959 1.00 0.00 C ATOM 1479 CD2 LEU A 120 2.403 -1.729 -9.536 1.00 0.00 C ATOM 0 H LEU A 120 3.752 -1.929 -14.209 1.00 0.00 H new ATOM 0 HA LEU A 120 5.620 -2.469 -11.936 1.00 0.00 H new ATOM 0 HB2 LEU A 120 3.375 -0.981 -12.192 1.00 0.00 H new ATOM 0 HB3 LEU A 120 2.575 -2.524 -11.967 1.00 0.00 H new ATOM 0 HG LEU A 120 4.239 -2.794 -9.921 1.00 0.00 H new ATOM 0 HD11 LEU A 120 4.800 -0.609 -8.885 1.00 0.00 H new ATOM 0 HD12 LEU A 120 5.581 -0.783 -10.474 1.00 0.00 H new ATOM 0 HD13 LEU A 120 4.131 0.234 -10.302 1.00 0.00 H new ATOM 0 HD21 LEU A 120 2.577 -1.663 -8.462 1.00 0.00 H new ATOM 0 HD22 LEU A 120 1.907 -0.821 -9.880 1.00 0.00 H new ATOM 0 HD23 LEU A 120 1.771 -2.591 -9.749 1.00 0.00 H new ATOM 1491 N ASP A 121 5.546 -4.930 -12.083 1.00 0.00 N ATOM 1492 CA ASP A 121 5.455 -6.423 -12.029 1.00 0.00 C ATOM 1493 C ASP A 121 4.896 -6.885 -10.676 1.00 0.00 C ATOM 1494 O ASP A 121 5.624 -7.325 -9.804 1.00 0.00 O ATOM 1495 CB ASP A 121 6.892 -6.918 -12.221 1.00 0.00 C ATOM 1496 CG ASP A 121 7.291 -6.787 -13.695 1.00 0.00 C ATOM 1497 OD1 ASP A 121 7.500 -5.669 -14.137 1.00 0.00 O ATOM 1498 OD2 ASP A 121 7.382 -7.809 -14.356 1.00 0.00 O ATOM 0 H ASP A 121 6.465 -4.546 -11.861 1.00 0.00 H new ATOM 0 HA ASP A 121 4.783 -6.818 -12.791 1.00 0.00 H new ATOM 0 HB2 ASP A 121 7.573 -6.339 -11.597 1.00 0.00 H new ATOM 0 HB3 ASP A 121 6.974 -7.957 -11.903 1.00 0.00 H new ATOM 1503 N ILE A 122 3.602 -6.793 -10.504 1.00 0.00 N ATOM 1504 CA ILE A 122 2.976 -7.232 -9.215 1.00 0.00 C ATOM 1505 C ILE A 122 1.836 -8.226 -9.482 1.00 0.00 C ATOM 1506 O ILE A 122 1.139 -8.139 -10.476 1.00 0.00 O ATOM 1507 CB ILE A 122 2.436 -5.956 -8.541 1.00 0.00 C ATOM 1508 CG1 ILE A 122 1.460 -5.222 -9.476 1.00 0.00 C ATOM 1509 CG2 ILE A 122 3.599 -5.026 -8.188 1.00 0.00 C ATOM 1510 CD1 ILE A 122 0.029 -5.697 -9.207 1.00 0.00 C ATOM 0 H ILE A 122 2.949 -6.433 -11.200 1.00 0.00 H new ATOM 0 HA ILE A 122 3.699 -7.739 -8.576 1.00 0.00 H new ATOM 0 HB ILE A 122 1.906 -6.242 -7.633 1.00 0.00 H new ATOM 0 HG12 ILE A 122 1.531 -4.146 -9.319 1.00 0.00 H new ATOM 0 HG13 ILE A 122 1.726 -5.411 -10.516 1.00 0.00 H new ATOM 0 HG21 ILE A 122 3.213 -4.125 -7.712 1.00 0.00 H new ATOM 0 HG22 ILE A 122 4.278 -5.536 -7.504 1.00 0.00 H new ATOM 0 HG23 ILE A 122 4.136 -4.754 -9.097 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -0.659 -5.174 -9.872 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -0.038 -6.770 -9.386 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -0.236 -5.485 -8.171 1.00 0.00 H new ATOM 1522 N THR A 123 1.645 -9.165 -8.593 1.00 0.00 N ATOM 1523 CA THR A 123 0.552 -10.170 -8.769 1.00 0.00 C ATOM 1524 C THR A 123 -0.368 -10.141 -7.544 1.00 0.00 C ATOM 1525 O THR A 123 0.089 -10.030 -6.422 1.00 0.00 O ATOM 1526 CB THR A 123 1.262 -11.527 -8.883 1.00 0.00 C ATOM 1527 OG1 THR A 123 2.231 -11.476 -9.926 1.00 0.00 O ATOM 1528 CG2 THR A 123 0.237 -12.620 -9.196 1.00 0.00 C ATOM 0 H THR A 123 2.202 -9.281 -7.747 1.00 0.00 H new ATOM 0 HA THR A 123 -0.064 -9.970 -9.645 1.00 0.00 H new ATOM 0 HB THR A 123 1.757 -11.752 -7.938 1.00 0.00 H new ATOM 0 HG1 THR A 123 2.683 -12.343 -9.995 1.00 0.00 H new ATOM 0 HG21 THR A 123 0.744 -13.582 -9.276 1.00 0.00 H new ATOM 0 HG22 THR A 123 -0.502 -12.665 -8.396 1.00 0.00 H new ATOM 0 HG23 THR A 123 -0.261 -12.393 -10.138 1.00 0.00 H new ATOM 1536 N CYS A 124 -1.658 -10.227 -7.744 1.00 0.00 N ATOM 1537 CA CYS A 124 -2.598 -10.190 -6.580 1.00 0.00 C ATOM 1538 C CYS A 124 -3.216 -11.571 -6.339 1.00 0.00 C ATOM 1539 O CYS A 124 -3.487 -12.313 -7.267 1.00 0.00 O ATOM 1540 CB CYS A 124 -3.670 -9.160 -6.953 1.00 0.00 C ATOM 1541 SG CYS A 124 -2.881 -7.642 -7.558 1.00 0.00 S ATOM 0 H CYS A 124 -2.101 -10.321 -8.658 1.00 0.00 H new ATOM 0 HA CYS A 124 -2.090 -9.918 -5.655 1.00 0.00 H new ATOM 0 HB2 CYS A 124 -4.329 -9.569 -7.719 1.00 0.00 H new ATOM 0 HB3 CYS A 124 -4.291 -8.937 -6.085 1.00 0.00 H new ATOM 1546 N ASN A 125 -3.432 -11.928 -5.093 1.00 0.00 N ATOM 1547 CA ASN A 125 -4.018 -13.272 -4.793 1.00 0.00 C ATOM 1548 C ASN A 125 -5.070 -13.209 -3.676 1.00 0.00 C ATOM 1549 O ASN A 125 -5.257 -14.160 -2.942 1.00 0.00 O ATOM 1550 CB ASN A 125 -2.825 -14.139 -4.364 1.00 0.00 C ATOM 1551 CG ASN A 125 -2.111 -13.493 -3.169 1.00 0.00 C ATOM 1552 OD1 ASN A 125 -1.109 -12.825 -3.337 1.00 0.00 O ATOM 1553 ND2 ASN A 125 -2.587 -13.663 -1.964 1.00 0.00 N ATOM 0 H ASN A 125 -3.229 -11.350 -4.277 1.00 0.00 H new ATOM 0 HA ASN A 125 -4.539 -13.676 -5.661 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -3.168 -15.138 -4.096 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -2.130 -14.253 -5.196 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -2.118 -13.235 -1.165 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -3.428 -14.223 -1.822 1.00 0.00 H new ATOM 1560 N GLU A 126 -5.772 -12.115 -3.553 1.00 0.00 N ATOM 1561 CA GLU A 126 -6.824 -12.025 -2.490 1.00 0.00 C ATOM 1562 C GLU A 126 -8.109 -11.374 -3.016 1.00 0.00 C ATOM 1563 O GLU A 126 -9.035 -11.134 -2.267 1.00 0.00 O ATOM 1564 CB GLU A 126 -6.203 -11.194 -1.365 1.00 0.00 C ATOM 1565 CG GLU A 126 -6.533 -11.833 -0.015 1.00 0.00 C ATOM 1566 CD GLU A 126 -5.239 -12.082 0.760 1.00 0.00 C ATOM 1567 OE1 GLU A 126 -4.556 -13.044 0.442 1.00 0.00 O ATOM 1568 OE2 GLU A 126 -4.949 -11.306 1.655 1.00 0.00 O ATOM 0 H GLU A 126 -5.667 -11.284 -4.135 1.00 0.00 H new ATOM 0 HA GLU A 126 -7.119 -13.016 -2.144 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -5.123 -11.135 -1.497 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -6.585 -10.174 -1.399 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -7.192 -11.180 0.557 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -7.066 -12.772 -0.165 1.00 0.00 H new ATOM 1575 N VAL A 127 -8.175 -11.104 -4.294 1.00 0.00 N ATOM 1576 CA VAL A 127 -9.403 -10.476 -4.884 1.00 0.00 C ATOM 1577 C VAL A 127 -10.630 -11.369 -4.651 1.00 0.00 C ATOM 1578 O VAL A 127 -10.530 -12.582 -4.623 1.00 0.00 O ATOM 1579 CB VAL A 127 -9.118 -10.344 -6.388 1.00 0.00 C ATOM 1580 CG1 VAL A 127 -10.231 -9.528 -7.052 1.00 0.00 C ATOM 1581 CG2 VAL A 127 -7.778 -9.633 -6.605 1.00 0.00 C ATOM 0 H VAL A 127 -7.427 -11.292 -4.962 1.00 0.00 H new ATOM 0 HA VAL A 127 -9.619 -9.511 -4.426 1.00 0.00 H new ATOM 0 HB VAL A 127 -9.077 -11.340 -6.829 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -10.027 -9.435 -8.119 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -11.187 -10.031 -6.908 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -10.272 -8.536 -6.603 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -7.583 -9.543 -7.674 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -7.817 -8.639 -6.158 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -6.980 -10.210 -6.138 1.00 0.00 H new ATOM 1591 N GLN A 128 -11.786 -10.764 -4.489 1.00 0.00 N ATOM 1592 CA GLN A 128 -13.047 -11.545 -4.258 1.00 0.00 C ATOM 1593 C GLN A 128 -12.883 -12.500 -3.066 1.00 0.00 C ATOM 1594 O GLN A 128 -13.101 -13.693 -3.175 1.00 0.00 O ATOM 1595 CB GLN A 128 -13.291 -12.324 -5.558 1.00 0.00 C ATOM 1596 CG GLN A 128 -13.815 -11.374 -6.641 1.00 0.00 C ATOM 1597 CD GLN A 128 -13.184 -11.733 -7.992 1.00 0.00 C ATOM 1598 OE1 GLN A 128 -13.102 -12.891 -8.350 1.00 0.00 O ATOM 1599 NE2 GLN A 128 -12.733 -10.781 -8.763 1.00 0.00 N ATOM 0 H GLN A 128 -11.910 -9.752 -4.507 1.00 0.00 H new ATOM 0 HA GLN A 128 -13.888 -10.895 -4.018 1.00 0.00 H new ATOM 0 HB2 GLN A 128 -12.365 -12.794 -5.890 1.00 0.00 H new ATOM 0 HB3 GLN A 128 -14.010 -13.124 -5.384 1.00 0.00 H new ATOM 0 HG2 GLN A 128 -14.901 -11.444 -6.706 1.00 0.00 H new ATOM 0 HG3 GLN A 128 -13.577 -10.343 -6.380 1.00 0.00 H new ATOM 0 HE21 GLN A 128 -12.801 -9.808 -8.465 1.00 0.00 H new ATOM 0 HE22 GLN A 128 -12.313 -11.010 -9.664 1.00 0.00 H new ATOM 1608 N GLY A 129 -12.501 -11.976 -1.928 1.00 0.00 N ATOM 1609 CA GLY A 129 -12.317 -12.837 -0.723 1.00 0.00 C ATOM 1610 C GLY A 129 -13.646 -12.972 0.024 1.00 0.00 C ATOM 1611 O GLY A 129 -13.904 -12.266 0.981 1.00 0.00 O ATOM 0 H GLY A 129 -12.308 -10.985 -1.783 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -11.954 -13.821 -1.020 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -11.562 -12.404 -0.067 1.00 0.00 H new ATOM 1615 N VAL A 130 -14.486 -13.878 -0.407 1.00 0.00 N ATOM 1616 CA VAL A 130 -15.808 -14.078 0.273 1.00 0.00 C ATOM 1617 C VAL A 130 -16.176 -15.569 0.307 1.00 0.00 C ATOM 1618 O VAL A 130 -16.804 -15.979 1.271 1.00 0.00 O ATOM 1619 CB VAL A 130 -16.837 -13.286 -0.553 1.00 0.00 C ATOM 1620 CG1 VAL A 130 -16.688 -11.790 -0.263 1.00 0.00 C ATOM 1621 CG2 VAL A 130 -16.625 -13.536 -2.052 1.00 0.00 C ATOM 1622 OXT VAL A 130 -15.828 -16.273 -0.628 1.00 0.00 O ATOM 0 H VAL A 130 -14.315 -14.492 -1.204 1.00 0.00 H new ATOM 0 HA VAL A 130 -15.779 -13.733 1.307 1.00 0.00 H new ATOM 0 HB VAL A 130 -17.838 -13.617 -0.275 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -17.418 -11.231 -0.849 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -16.858 -11.606 0.798 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -15.682 -11.466 -0.531 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -17.360 -12.969 -2.623 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -15.622 -13.218 -2.336 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -16.742 -14.599 -2.264 1.00 0.00 H new TER 1632 VAL A 130