USER MOD reduce.3.24.130724 H: found=0, std=0, add=971, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 0 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 66 THR OG1 : rot 180:sc= -0.123 USER MOD Set 1.2: A 67 MET CE :methyl -143:sc= -3.15 (180deg=-4.4!) USER MOD Set 1.3: A 124 GLN : amide:sc= -7.64! C(o=-11!,f=-12!) USER MOD Set 2.1: A 27 ASN : amide:sc=-0.00462 K(o=-4.5,f=-5.2) USER MOD Set 2.2: A 29 HIS :FLIP no HE2:sc= -4.47 F(o=-7.5!,f=-4.5) USER MOD Single : A 6 GLN : amide:sc= -1.64! C(o=-1.6!,f=-5.4!) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 ASN : amide:sc=-0.000578 X(o=-0.00058,f=-0.14) USER MOD Single : A 21 SER OG : rot -59:sc= -0.538! USER MOD Single : A 22 ASN : amide:sc= -0.331 X(o=-0.33,f=-0.81) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 32 ASN : amide:sc= 0 K(o=0,f=-0.96) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 LYS NZ :NH3+ 160:sc= -0.0152 (180deg=-0.165) USER MOD Single : A 40 GLN : amide:sc= -0.555 K(o=-0.55,f=-3.7!) USER MOD Single : A 41 HIS : no HD1:sc= -3.67 X(o=-3.7,f=-3.5!) USER MOD Single : A 46 LYS NZ :NH3+ 159:sc= 0.0822 (180deg=0.0241) USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0411) USER MOD Single : A 49 THR OG1 : rot 180:sc= -0.118 USER MOD Single : A 51 TYR OH : rot -93:sc= 0.753 USER MOD Single : A 54 ASN : amide:sc= -0.108 X(o=-0.11,f=-0.18) USER MOD Single : A 56 HIS : no HD1:sc= -1.61 X(o=-1.6,f=-1.7) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 SER OG : rot -103:sc= 0.265 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 75 ASN :FLIP amide:sc= -0.664 F(o=-2!,f=-0.66) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 78 THR OG1 : rot 180:sc= 0.0497 USER MOD Single : A 81 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 82 GLN : amide:sc= -0.218 K(o=-0.22,f=-1.8!) USER MOD Single : A 83 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 HIS : no HE2:sc= -29.4! C(o=-29!,f=-32!) USER MOD Single : A 87 HIS :FLIP no HD1:sc= -3.57! C(o=-4.9!,f=-3.6!) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 93 GLN : amide:sc= 0 X(o=0,f=-0.043) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 HIS : no HE2:sc= -12.7! C(o=-13!,f=-17!) USER MOD Single : A 100 ASN : amide:sc= -3.72! C(o=-3.7!,f=-8.7!) USER MOD Single : A 101 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -14.4! C(o=-14!,f=-17!) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 114 TYR OH : rot 30:sc= -0.628 USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 120 LYS NZ :NH3+ -154:sc= -0.599 (180deg=-2.72!) USER MOD Single : A 127 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 129 HIS : no HD1:sc= 0.16 K(o=0.16,f=-1.8!) USER MOD Single : A 135 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 FUC O2 : rot 36:sc= 0.0134 USER MOD Single : A 136 FUC O3 : rot -94:sc= 0.0211 USER MOD Single : A 136 FUC O4 : rot -92:sc= 0.0126 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 6 20.769 0.400 -14.794 1.00 1.00 N ATOM 2 CA GLN A 6 21.513 -0.169 -13.635 1.00 1.00 C ATOM 3 C GLN A 6 23.017 -0.031 -13.877 1.00 1.00 C ATOM 4 O GLN A 6 23.538 -0.477 -14.880 1.00 1.00 O ATOM 5 CB GLN A 6 21.157 -1.648 -13.476 1.00 1.00 C ATOM 6 CG GLN A 6 20.283 -1.834 -12.234 1.00 1.00 C ATOM 7 CD GLN A 6 21.105 -1.532 -10.980 1.00 1.00 C ATOM 8 OE1 GLN A 6 21.542 -0.416 -10.780 1.00 1.00 O ATOM 9 NE2 GLN A 6 21.336 -2.486 -10.121 1.00 1.00 N ATOM 0 HA GLN A 6 21.239 0.370 -12.728 1.00 1.00 H new ATOM 0 HB2 GLN A 6 20.629 -2.003 -14.361 1.00 1.00 H new ATOM 0 HB3 GLN A 6 22.065 -2.244 -13.387 1.00 1.00 H new ATOM 0 HG2 GLN A 6 19.418 -1.172 -12.283 1.00 1.00 H new ATOM 0 HG3 GLN A 6 19.902 -2.854 -12.194 1.00 1.00 H new ATOM 0 HE21 GLN A 6 20.969 -3.423 -10.289 1.00 1.00 H new ATOM 0 HE22 GLN A 6 21.883 -2.295 -9.282 1.00 1.00 H new ATOM 10 N VAL A 7 23.720 0.584 -12.965 1.00 1.00 N ATOM 11 CA VAL A 7 25.190 0.749 -13.145 1.00 1.00 C ATOM 12 C VAL A 7 25.897 0.514 -11.806 1.00 1.00 C ATOM 13 O VAL A 7 26.154 1.447 -11.072 1.00 1.00 O ATOM 14 CB VAL A 7 25.486 2.167 -13.636 1.00 1.00 C ATOM 15 CG1 VAL A 7 26.867 2.201 -14.295 1.00 1.00 C ATOM 16 CG2 VAL A 7 24.425 2.584 -14.657 1.00 1.00 C ATOM 0 H VAL A 7 23.340 0.979 -12.104 1.00 1.00 H new ATOM 0 HA VAL A 7 25.551 0.028 -13.878 1.00 1.00 H new ATOM 0 HB VAL A 7 25.469 2.855 -12.791 1.00 1.00 H new ATOM 0 HG11 VAL A 7 27.078 3.211 -14.645 1.00 1.00 H new ATOM 0 HG12 VAL A 7 27.624 1.903 -13.570 1.00 1.00 H new ATOM 0 HG13 VAL A 7 26.884 1.513 -15.140 1.00 1.00 H new ATOM 0 HG21 VAL A 7 24.635 3.594 -15.008 1.00 1.00 H new ATOM 0 HG22 VAL A 7 24.443 1.896 -15.502 1.00 1.00 H new ATOM 0 HG23 VAL A 7 23.441 2.559 -14.190 1.00 1.00 H new ATOM 17 N PRO A 8 26.192 -0.732 -11.530 1.00 1.00 N ATOM 18 CA PRO A 8 26.865 -1.109 -10.296 1.00 1.00 C ATOM 19 C PRO A 8 28.110 -0.241 -10.087 1.00 1.00 C ATOM 20 O PRO A 8 29.197 -0.588 -10.503 1.00 1.00 O ATOM 21 CB PRO A 8 27.253 -2.569 -10.503 1.00 1.00 C ATOM 22 CG PRO A 8 26.213 -3.077 -11.550 1.00 1.00 C ATOM 23 CD PRO A 8 25.872 -1.846 -12.436 1.00 1.00 C ATOM 0 HA PRO A 8 26.237 -0.972 -9.416 1.00 1.00 H new ATOM 0 HB2 PRO A 8 28.274 -2.665 -10.872 1.00 1.00 H new ATOM 0 HB3 PRO A 8 27.196 -3.135 -9.573 1.00 1.00 H new ATOM 0 HG2 PRO A 8 26.625 -3.889 -12.149 1.00 1.00 H new ATOM 0 HG3 PRO A 8 25.321 -3.465 -11.059 1.00 1.00 H new ATOM 0 HD2 PRO A 8 26.470 -1.818 -13.347 1.00 1.00 H new ATOM 0 HD3 PRO A 8 24.826 -1.838 -12.742 1.00 1.00 H new ATOM 24 N SER A 9 27.957 0.885 -9.446 1.00 1.00 N ATOM 25 CA SER A 9 29.130 1.773 -9.212 1.00 1.00 C ATOM 26 C SER A 9 29.705 1.501 -7.820 1.00 1.00 C ATOM 27 O SER A 9 29.588 2.309 -6.921 1.00 1.00 O ATOM 28 CB SER A 9 28.689 3.234 -9.306 1.00 1.00 C ATOM 29 OG SER A 9 29.330 3.848 -10.416 1.00 1.00 O ATOM 0 H SER A 9 27.071 1.228 -9.075 1.00 1.00 H new ATOM 0 HA SER A 9 29.893 1.575 -9.965 1.00 1.00 H new ATOM 0 HB2 SER A 9 27.606 3.292 -9.419 1.00 1.00 H new ATOM 0 HB3 SER A 9 28.943 3.762 -8.387 1.00 1.00 H new ATOM 0 HG SER A 9 29.048 4.784 -10.480 1.00 1.00 H new ATOM 30 N ASN A 10 30.327 0.368 -7.636 1.00 1.00 N ATOM 31 CA ASN A 10 30.908 0.046 -6.303 1.00 1.00 C ATOM 32 C ASN A 10 29.817 0.138 -5.235 1.00 1.00 C ATOM 33 O ASN A 10 29.471 1.209 -4.778 1.00 1.00 O ATOM 34 CB ASN A 10 32.024 1.042 -5.979 1.00 1.00 C ATOM 35 CG ASN A 10 33.369 0.313 -5.955 1.00 1.00 C ATOM 36 OD1 ASN A 10 33.959 0.137 -4.908 1.00 1.00 O ATOM 37 ND2 ASN A 10 33.881 -0.122 -7.074 1.00 1.00 N ATOM 0 H ASN A 10 30.457 -0.348 -8.351 1.00 1.00 H new ATOM 0 HA ASN A 10 31.316 -0.965 -6.319 1.00 1.00 H new ATOM 0 HB2 ASN A 10 32.043 1.838 -6.724 1.00 1.00 H new ATOM 0 HB3 ASN A 10 31.837 1.513 -5.014 1.00 1.00 H new ATOM 0 HD21 ASN A 10 34.777 -0.610 -7.069 1.00 1.00 H new ATOM 0 HD22 ASN A 10 33.385 0.026 -7.953 1.00 1.00 H new ATOM 38 N CYS A 11 29.271 -0.977 -4.833 1.00 1.00 N ATOM 39 CA CYS A 11 28.202 -0.953 -3.795 1.00 1.00 C ATOM 40 C CYS A 11 26.964 -0.252 -4.357 1.00 1.00 C ATOM 41 O CYS A 11 26.687 -0.314 -5.539 1.00 1.00 O ATOM 42 CB CYS A 11 28.703 -0.197 -2.563 1.00 1.00 C ATOM 43 SG CYS A 11 28.016 -0.957 -1.071 1.00 1.00 S ATOM 0 H CYS A 11 29.519 -1.904 -5.179 1.00 1.00 H new ATOM 0 HA CYS A 11 27.945 -1.974 -3.513 1.00 1.00 H new ATOM 0 HB2 CYS A 11 29.792 -0.219 -2.527 1.00 1.00 H new ATOM 0 HB3 CYS A 11 28.407 0.851 -2.620 1.00 1.00 H new ATOM 44 N ASP A 12 26.214 0.414 -3.521 1.00 1.00 N ATOM 45 CA ASP A 12 24.993 1.115 -4.013 1.00 1.00 C ATOM 46 C ASP A 12 24.735 2.361 -3.161 1.00 1.00 C ATOM 47 O ASP A 12 23.903 2.358 -2.277 1.00 1.00 O ATOM 48 CB ASP A 12 23.792 0.172 -3.915 1.00 1.00 C ATOM 49 CG ASP A 12 23.894 -0.899 -5.003 1.00 1.00 C ATOM 50 OD1 ASP A 12 24.489 -1.930 -4.737 1.00 1.00 O ATOM 51 OD2 ASP A 12 23.376 -0.670 -6.083 1.00 1.00 O ATOM 0 H ASP A 12 26.393 0.503 -2.521 1.00 1.00 H new ATOM 0 HA ASP A 12 25.140 1.413 -5.051 1.00 1.00 H new ATOM 0 HB2 ASP A 12 23.763 -0.296 -2.931 1.00 1.00 H new ATOM 0 HB3 ASP A 12 22.865 0.734 -4.029 1.00 1.00 H new ATOM 52 N CYS A 13 25.441 3.428 -3.424 1.00 1.00 N ATOM 53 CA CYS A 13 25.233 4.675 -2.633 1.00 1.00 C ATOM 54 C CYS A 13 26.422 5.616 -2.848 1.00 1.00 C ATOM 55 O CYS A 13 27.242 5.403 -3.719 1.00 1.00 O ATOM 56 CB CYS A 13 25.125 4.326 -1.148 1.00 1.00 C ATOM 57 SG CYS A 13 26.338 3.046 -0.741 1.00 1.00 S ATOM 0 H CYS A 13 26.153 3.490 -4.152 1.00 1.00 H new ATOM 0 HA CYS A 13 24.315 5.164 -2.959 1.00 1.00 H new ATOM 0 HB2 CYS A 13 25.300 5.214 -0.541 1.00 1.00 H new ATOM 0 HB3 CYS A 13 24.119 3.975 -0.918 1.00 1.00 H new ATOM 58 N LEU A 14 26.524 6.659 -2.066 1.00 1.00 N ATOM 59 CA LEU A 14 27.661 7.605 -2.237 1.00 1.00 C ATOM 60 C LEU A 14 28.177 8.042 -0.864 1.00 1.00 C ATOM 61 O LEU A 14 27.805 7.493 0.154 1.00 1.00 O ATOM 62 CB LEU A 14 27.186 8.834 -3.014 1.00 1.00 C ATOM 63 CG LEU A 14 27.252 8.550 -4.516 1.00 1.00 C ATOM 64 CD1 LEU A 14 25.841 8.581 -5.106 1.00 1.00 C ATOM 65 CD2 LEU A 14 28.111 9.618 -5.197 1.00 1.00 C ATOM 0 H LEU A 14 25.870 6.894 -1.319 1.00 1.00 H new ATOM 0 HA LEU A 14 28.463 7.111 -2.786 1.00 1.00 H new ATOM 0 HB2 LEU A 14 26.165 9.086 -2.726 1.00 1.00 H new ATOM 0 HB3 LEU A 14 27.809 9.695 -2.769 1.00 1.00 H new ATOM 0 HG LEU A 14 27.692 7.566 -4.680 1.00 1.00 H new ATOM 0 HD11 LEU A 14 25.889 8.379 -6.176 1.00 1.00 H new ATOM 0 HD12 LEU A 14 25.227 7.822 -4.621 1.00 1.00 H new ATOM 0 HD13 LEU A 14 25.400 9.564 -4.942 1.00 1.00 H new ATOM 0 HD21 LEU A 14 28.160 9.418 -6.267 1.00 1.00 H new ATOM 0 HD22 LEU A 14 27.669 10.601 -5.031 1.00 1.00 H new ATOM 0 HD23 LEU A 14 29.117 9.597 -4.778 1.00 1.00 H new ATOM 66 N ASN A 15 29.032 9.027 -0.829 1.00 1.00 N ATOM 67 CA ASN A 15 29.572 9.502 0.475 1.00 1.00 C ATOM 68 C ASN A 15 30.278 8.347 1.190 1.00 1.00 C ATOM 69 O ASN A 15 30.341 8.302 2.402 1.00 1.00 O ATOM 70 CB ASN A 15 28.424 10.016 1.347 1.00 1.00 C ATOM 71 CG ASN A 15 28.664 11.487 1.691 1.00 1.00 C ATOM 72 OD1 ASN A 15 28.904 12.296 0.816 1.00 1.00 O ATOM 73 ND2 ASN A 15 28.609 11.870 2.937 1.00 1.00 N ATOM 0 H ASN A 15 29.380 9.524 -1.649 1.00 1.00 H new ATOM 0 HA ASN A 15 30.284 10.308 0.299 1.00 1.00 H new ATOM 0 HB2 ASN A 15 27.476 9.904 0.821 1.00 1.00 H new ATOM 0 HB3 ASN A 15 28.354 9.425 2.260 1.00 1.00 H new ATOM 0 HD21 ASN A 15 28.767 12.849 3.177 1.00 1.00 H new ATOM 0 HD22 ASN A 15 28.408 11.191 3.671 1.00 1.00 H new ATOM 74 N GLY A 16 30.810 7.415 0.449 1.00 1.00 N ATOM 75 CA GLY A 16 31.513 6.266 1.088 1.00 1.00 C ATOM 76 C GLY A 16 30.579 5.587 2.091 1.00 1.00 C ATOM 77 O GLY A 16 30.982 5.218 3.176 1.00 1.00 O ATOM 0 H GLY A 16 30.789 7.399 -0.571 1.00 1.00 H new ATOM 0 HA2 GLY A 16 31.828 5.551 0.328 1.00 1.00 H new ATOM 0 HA3 GLY A 16 32.415 6.613 1.593 1.00 1.00 H new ATOM 78 N GLY A 17 29.334 5.419 1.738 1.00 1.00 N ATOM 79 CA GLY A 17 28.376 4.762 2.673 1.00 1.00 C ATOM 80 C GLY A 17 28.972 3.443 3.167 1.00 1.00 C ATOM 81 O GLY A 17 30.086 3.090 2.833 1.00 1.00 O ATOM 0 H GLY A 17 28.939 5.708 0.843 1.00 1.00 H new ATOM 0 HA2 GLY A 17 28.167 5.418 3.518 1.00 1.00 H new ATOM 0 HA3 GLY A 17 27.427 4.579 2.169 1.00 1.00 H new ATOM 82 N THR A 18 28.241 2.709 3.961 1.00 1.00 N ATOM 83 CA THR A 18 28.771 1.413 4.472 1.00 1.00 C ATOM 84 C THR A 18 28.264 0.271 3.589 1.00 1.00 C ATOM 85 O THR A 18 27.109 -0.101 3.641 1.00 1.00 O ATOM 86 CB THR A 18 28.295 1.199 5.907 1.00 1.00 C ATOM 87 OG1 THR A 18 28.811 2.212 6.745 1.00 1.00 O ATOM 88 CG2 THR A 18 28.791 -0.170 6.369 1.00 1.00 C ATOM 0 H THR A 18 27.302 2.950 4.277 1.00 1.00 H new ATOM 0 HA THR A 18 29.861 1.432 4.450 1.00 1.00 H new ATOM 0 HB THR A 18 27.207 1.241 5.955 1.00 1.00 H new ATOM 0 HG21 THR A 18 28.464 -0.349 7.393 1.00 1.00 H new ATOM 0 HG22 THR A 18 28.383 -0.943 5.718 1.00 1.00 H new ATOM 0 HG23 THR A 18 29.880 -0.196 6.326 1.00 1.00 H new ATOM 89 N CYS A 19 29.120 -0.290 2.778 1.00 1.00 N ATOM 90 CA CYS A 19 28.689 -1.407 1.894 1.00 1.00 C ATOM 91 C CYS A 19 28.123 -2.541 2.750 1.00 1.00 C ATOM 92 O CYS A 19 28.532 -2.743 3.877 1.00 1.00 O ATOM 93 CB CYS A 19 29.892 -1.914 1.099 1.00 1.00 C ATOM 94 SG CYS A 19 29.363 -2.376 -0.569 1.00 1.00 S ATOM 0 H CYS A 19 30.100 -0.021 2.691 1.00 1.00 H new ATOM 0 HA CYS A 19 27.921 -1.056 1.205 1.00 1.00 H new ATOM 0 HB2 CYS A 19 30.659 -1.141 1.048 1.00 1.00 H new ATOM 0 HB3 CYS A 19 30.338 -2.773 1.601 1.00 1.00 H new ATOM 95 N VAL A 20 27.180 -3.279 2.231 1.00 1.00 N ATOM 96 CA VAL A 20 26.587 -4.393 3.025 1.00 1.00 C ATOM 97 C VAL A 20 26.232 -5.560 2.100 1.00 1.00 C ATOM 98 O VAL A 20 26.032 -5.391 0.913 1.00 1.00 O ATOM 99 CB VAL A 20 25.320 -3.907 3.740 1.00 1.00 C ATOM 100 CG1 VAL A 20 25.658 -3.539 5.185 1.00 1.00 C ATOM 101 CG2 VAL A 20 24.756 -2.675 3.024 1.00 1.00 C ATOM 0 H VAL A 20 26.795 -3.159 1.294 1.00 1.00 H new ATOM 0 HA VAL A 20 27.315 -4.726 3.765 1.00 1.00 H new ATOM 0 HB VAL A 20 24.576 -4.704 3.727 1.00 1.00 H new ATOM 0 HG11 VAL A 20 24.757 -3.194 5.693 1.00 1.00 H new ATOM 0 HG12 VAL A 20 26.052 -4.415 5.701 1.00 1.00 H new ATOM 0 HG13 VAL A 20 26.406 -2.746 5.193 1.00 1.00 H new ATOM 0 HG21 VAL A 20 23.856 -2.336 3.538 1.00 1.00 H new ATOM 0 HG22 VAL A 20 25.500 -1.878 3.030 1.00 1.00 H new ATOM 0 HG23 VAL A 20 24.510 -2.934 1.994 1.00 1.00 H new ATOM 102 N SER A 21 26.151 -6.744 2.643 1.00 1.00 N ATOM 103 CA SER A 21 25.807 -7.937 1.817 1.00 1.00 C ATOM 104 C SER A 21 25.586 -9.129 2.752 1.00 1.00 C ATOM 105 O SER A 21 26.238 -9.253 3.769 1.00 1.00 O ATOM 106 CB SER A 21 26.958 -8.248 0.859 1.00 1.00 C ATOM 107 OG SER A 21 27.707 -7.063 0.623 1.00 1.00 O ATOM 0 H SER A 21 26.310 -6.938 3.632 1.00 1.00 H new ATOM 0 HA SER A 21 24.905 -7.741 1.238 1.00 1.00 H new ATOM 0 HB2 SER A 21 27.601 -9.020 1.283 1.00 1.00 H new ATOM 0 HB3 SER A 21 26.568 -8.639 -0.081 1.00 1.00 H new ATOM 0 HG SER A 21 27.121 -6.376 0.244 1.00 1.00 H new ATOM 108 N ASN A 22 24.677 -10.009 2.428 1.00 1.00 N ATOM 109 CA ASN A 22 24.441 -11.177 3.321 1.00 1.00 C ATOM 110 C ASN A 22 25.704 -12.045 3.352 1.00 1.00 C ATOM 111 O ASN A 22 26.782 -11.590 3.023 1.00 1.00 O ATOM 112 CB ASN A 22 23.251 -11.990 2.805 1.00 1.00 C ATOM 113 CG ASN A 22 22.408 -12.467 3.988 1.00 1.00 C ATOM 114 OD1 ASN A 22 22.127 -11.708 4.894 1.00 1.00 O ATOM 115 ND2 ASN A 22 21.989 -13.703 4.019 1.00 1.00 N ATOM 0 H ASN A 22 24.094 -9.970 1.592 1.00 1.00 H new ATOM 0 HA ASN A 22 24.215 -10.832 4.330 1.00 1.00 H new ATOM 0 HB2 ASN A 22 22.644 -11.381 2.135 1.00 1.00 H new ATOM 0 HB3 ASN A 22 23.604 -12.845 2.228 1.00 1.00 H new ATOM 0 HD21 ASN A 22 21.426 -14.031 4.804 1.00 1.00 H new ATOM 0 HD22 ASN A 22 22.225 -14.341 3.259 1.00 1.00 H new ATOM 116 N LYS A 23 25.591 -13.283 3.750 1.00 1.00 N ATOM 117 CA LYS A 23 26.803 -14.154 3.802 1.00 1.00 C ATOM 118 C LYS A 23 26.511 -15.499 3.132 1.00 1.00 C ATOM 119 O LYS A 23 27.183 -15.898 2.202 1.00 1.00 O ATOM 120 CB LYS A 23 27.198 -14.387 5.262 1.00 1.00 C ATOM 121 CG LYS A 23 28.665 -14.817 5.331 1.00 1.00 C ATOM 122 CD LYS A 23 29.164 -14.706 6.773 1.00 1.00 C ATOM 123 CE LYS A 23 30.246 -15.758 7.022 1.00 1.00 C ATOM 124 NZ LYS A 23 31.591 -15.129 6.890 1.00 1.00 N ATOM 0 H LYS A 23 24.720 -13.728 4.040 1.00 1.00 H new ATOM 0 HA LYS A 23 27.620 -13.663 3.273 1.00 1.00 H new ATOM 0 HB2 LYS A 23 27.047 -13.476 5.841 1.00 1.00 H new ATOM 0 HB3 LYS A 23 26.562 -15.154 5.704 1.00 1.00 H new ATOM 0 HG2 LYS A 23 28.771 -15.842 4.976 1.00 1.00 H new ATOM 0 HG3 LYS A 23 29.270 -14.189 4.677 1.00 1.00 H new ATOM 0 HD2 LYS A 23 29.563 -13.708 6.955 1.00 1.00 H new ATOM 0 HD3 LYS A 23 28.336 -14.849 7.467 1.00 1.00 H new ATOM 0 HE2 LYS A 23 30.129 -16.186 8.017 1.00 1.00 H new ATOM 0 HE3 LYS A 23 30.144 -16.576 6.309 1.00 1.00 H new ATOM 0 HZ1 LYS A 23 32.327 -15.844 7.059 1.00 1.00 H new ATOM 0 HZ2 LYS A 23 31.700 -14.740 5.932 1.00 1.00 H new ATOM 0 HZ3 LYS A 23 31.686 -14.363 7.587 1.00 1.00 H new ATOM 125 N TYR A 24 25.515 -16.201 3.597 1.00 1.00 N ATOM 126 CA TYR A 24 25.183 -17.519 2.985 1.00 1.00 C ATOM 127 C TYR A 24 24.100 -17.316 1.934 1.00 1.00 C ATOM 128 O TYR A 24 23.183 -18.101 1.799 1.00 1.00 O ATOM 129 CB TYR A 24 24.673 -18.464 4.068 1.00 1.00 C ATOM 130 CG TYR A 24 23.668 -17.744 4.936 1.00 1.00 C ATOM 131 CD1 TYR A 24 22.342 -17.605 4.506 1.00 1.00 C ATOM 132 CD2 TYR A 24 24.063 -17.215 6.171 1.00 1.00 C ATOM 133 CE1 TYR A 24 21.411 -16.936 5.312 1.00 1.00 C ATOM 134 CE2 TYR A 24 23.132 -16.546 6.977 1.00 1.00 C ATOM 135 CZ TYR A 24 21.806 -16.407 6.547 1.00 1.00 C ATOM 136 OH TYR A 24 20.889 -15.748 7.341 1.00 1.00 O ATOM 0 H TYR A 24 24.917 -15.920 4.374 1.00 1.00 H new ATOM 0 HA TYR A 24 26.071 -17.948 2.521 1.00 1.00 H new ATOM 0 HB2 TYR A 24 24.213 -19.341 3.613 1.00 1.00 H new ATOM 0 HB3 TYR A 24 25.505 -18.820 4.676 1.00 1.00 H new ATOM 0 HD1 TYR A 24 22.037 -18.013 3.554 1.00 1.00 H new ATOM 0 HD2 TYR A 24 25.085 -17.323 6.502 1.00 1.00 H new ATOM 0 HE1 TYR A 24 20.389 -16.828 4.981 1.00 1.00 H new ATOM 0 HE2 TYR A 24 23.437 -16.138 7.929 1.00 1.00 H new ATOM 0 HH TYR A 24 21.327 -15.445 8.164 1.00 1.00 H new ATOM 137 N PHE A 25 24.201 -16.251 1.200 1.00 1.00 N ATOM 138 CA PHE A 25 23.185 -15.953 0.160 1.00 1.00 C ATOM 139 C PHE A 25 23.720 -16.323 -1.228 1.00 1.00 C ATOM 140 O PHE A 25 24.391 -17.321 -1.400 1.00 1.00 O ATOM 141 CB PHE A 25 22.843 -14.462 0.234 1.00 1.00 C ATOM 142 CG PHE A 25 24.072 -13.594 -0.002 1.00 1.00 C ATOM 143 CD1 PHE A 25 25.324 -14.148 -0.330 1.00 1.00 C ATOM 144 CD2 PHE A 25 23.940 -12.203 0.095 1.00 1.00 C ATOM 145 CE1 PHE A 25 26.425 -13.308 -0.552 1.00 1.00 C ATOM 146 CE2 PHE A 25 25.038 -11.369 -0.129 1.00 1.00 C ATOM 147 CZ PHE A 25 26.278 -11.919 -0.452 1.00 1.00 C ATOM 0 H PHE A 25 24.952 -15.565 1.276 1.00 1.00 H new ATOM 0 HA PHE A 25 22.285 -16.543 0.334 1.00 1.00 H new ATOM 0 HB2 PHE A 25 22.081 -14.225 -0.509 1.00 1.00 H new ATOM 0 HB3 PHE A 25 22.417 -14.234 1.211 1.00 1.00 H new ATOM 0 HD1 PHE A 25 25.437 -15.219 -0.411 1.00 1.00 H new ATOM 0 HD2 PHE A 25 22.982 -11.772 0.345 1.00 1.00 H new ATOM 0 HE1 PHE A 25 27.387 -13.733 -0.800 1.00 1.00 H new ATOM 0 HE2 PHE A 25 24.926 -10.298 -0.052 1.00 1.00 H new ATOM 0 HZ PHE A 25 27.126 -11.273 -0.625 1.00 1.00 H new ATOM 148 N SER A 26 23.432 -15.525 -2.216 1.00 1.00 N ATOM 149 CA SER A 26 23.924 -15.823 -3.590 1.00 1.00 C ATOM 150 C SER A 26 24.417 -14.527 -4.238 1.00 1.00 C ATOM 151 O SER A 26 25.408 -14.510 -4.942 1.00 1.00 O ATOM 152 CB SER A 26 22.785 -16.410 -4.423 1.00 1.00 C ATOM 153 OG SER A 26 23.310 -16.924 -5.640 1.00 1.00 O ATOM 0 H SER A 26 22.874 -14.675 -2.132 1.00 1.00 H new ATOM 0 HA SER A 26 24.742 -16.542 -3.540 1.00 1.00 H new ATOM 0 HB2 SER A 26 22.283 -17.202 -3.867 1.00 1.00 H new ATOM 0 HB3 SER A 26 22.038 -15.644 -4.631 1.00 1.00 H new ATOM 0 HG SER A 26 22.582 -17.303 -6.176 1.00 1.00 H new ATOM 154 N ASN A 27 23.734 -13.440 -4.001 1.00 1.00 N ATOM 155 CA ASN A 27 24.160 -12.143 -4.598 1.00 1.00 C ATOM 156 C ASN A 27 23.306 -11.014 -4.017 1.00 1.00 C ATOM 157 O ASN A 27 22.625 -10.307 -4.733 1.00 1.00 O ATOM 158 CB ASN A 27 23.977 -12.194 -6.116 1.00 1.00 C ATOM 159 CG ASN A 27 25.267 -11.742 -6.802 1.00 1.00 C ATOM 160 OD1 ASN A 27 25.592 -10.571 -6.799 1.00 1.00 O ATOM 161 ND2 ASN A 27 26.022 -12.626 -7.394 1.00 1.00 N ATOM 0 H ASN A 27 22.898 -13.395 -3.419 1.00 1.00 H new ATOM 0 HA ASN A 27 25.210 -11.962 -4.367 1.00 1.00 H new ATOM 0 HB2 ASN A 27 23.722 -13.207 -6.428 1.00 1.00 H new ATOM 0 HB3 ASN A 27 23.149 -11.551 -6.415 1.00 1.00 H new ATOM 0 HD21 ASN A 27 26.884 -12.334 -7.854 1.00 1.00 H new ATOM 0 HD22 ASN A 27 25.750 -13.609 -7.397 1.00 1.00 H new ATOM 162 N ILE A 28 23.334 -10.841 -2.723 1.00 1.00 N ATOM 163 CA ILE A 28 22.519 -9.759 -2.100 1.00 1.00 C ATOM 164 C ILE A 28 23.441 -8.695 -1.504 1.00 1.00 C ATOM 165 O ILE A 28 23.339 -8.354 -0.342 1.00 1.00 O ATOM 166 CB ILE A 28 21.651 -10.332 -0.980 1.00 1.00 C ATOM 167 CG1 ILE A 28 21.350 -11.812 -1.246 1.00 1.00 C ATOM 168 CG2 ILE A 28 20.339 -9.549 -0.910 1.00 1.00 C ATOM 169 CD1 ILE A 28 20.333 -11.939 -2.377 1.00 1.00 C ATOM 0 H ILE A 28 23.885 -11.401 -2.072 1.00 1.00 H new ATOM 0 HA ILE A 28 21.885 -9.318 -2.869 1.00 1.00 H new ATOM 0 HB ILE A 28 22.186 -10.246 -0.034 1.00 1.00 H new ATOM 0 HG12 ILE A 28 22.268 -12.337 -1.510 1.00 1.00 H new ATOM 0 HG13 ILE A 28 20.962 -12.282 -0.342 1.00 1.00 H new ATOM 0 HG21 ILE A 28 19.716 -9.954 -0.113 1.00 1.00 H new ATOM 0 HG22 ILE A 28 20.552 -8.499 -0.707 1.00 1.00 H new ATOM 0 HG23 ILE A 28 19.813 -9.635 -1.861 1.00 1.00 H new ATOM 0 HD11 ILE A 28 20.123 -12.993 -2.561 1.00 1.00 H new ATOM 0 HD12 ILE A 28 19.411 -11.429 -2.096 1.00 1.00 H new ATOM 0 HD13 ILE A 28 20.737 -11.486 -3.282 1.00 1.00 H new ATOM 170 N HIS A 29 24.336 -8.163 -2.283 1.00 1.00 N ATOM 171 CA HIS A 29 25.253 -7.117 -1.751 1.00 1.00 C ATOM 172 C HIS A 29 24.621 -5.741 -1.968 1.00 1.00 C ATOM 173 O HIS A 29 24.640 -5.204 -3.058 1.00 1.00 O ATOM 174 CB HIS A 29 26.597 -7.181 -2.483 1.00 1.00 C ATOM 175 CG HIS A 29 26.884 -8.598 -2.898 1.00 1.00 C ATOM 176 ND1 HIS A 29 27.508 -9.635 -2.250 1.00 1.00 N flip ATOM 177 CD2 HIS A 29 26.515 -9.094 -4.138 1.00 1.00 C flip ATOM 178 CE1 HIS A 29 27.527 -10.758 -3.073 1.00 1.00 C flip ATOM 179 NE2 HIS A 29 26.916 -10.377 -4.198 1.00 1.00 N flip ATOM 0 H HIS A 29 24.474 -8.405 -3.264 1.00 1.00 H new ATOM 0 HA HIS A 29 25.418 -7.286 -0.687 1.00 1.00 H new ATOM 0 HB2 HIS A 29 26.576 -6.533 -3.359 1.00 1.00 H new ATOM 0 HB3 HIS A 29 27.393 -6.814 -1.835 1.00 1.00 H new ATOM 0 HD1 HIS A 29 27.898 -9.590 -1.309 1.00 1.00 H new ATOM 0 HD2 HIS A 29 25.999 -8.550 -4.915 1.00 1.00 H new ATOM 0 HE1 HIS A 29 27.946 -11.728 -2.850 1.00 1.00 H new ATOM 180 N TRP A 30 24.056 -5.166 -0.942 1.00 1.00 N ATOM 181 CA TRP A 30 23.421 -3.827 -1.095 1.00 1.00 C ATOM 182 C TRP A 30 24.276 -2.777 -0.383 1.00 1.00 C ATOM 183 O TRP A 30 25.468 -2.943 -0.225 1.00 1.00 O ATOM 184 CB TRP A 30 22.015 -3.857 -0.489 1.00 1.00 C ATOM 185 CG TRP A 30 22.100 -4.132 0.977 1.00 1.00 C ATOM 186 CD1 TRP A 30 22.213 -3.193 1.944 1.00 1.00 C ATOM 187 CD2 TRP A 30 22.072 -5.416 1.655 1.00 1.00 C ATOM 188 NE1 TRP A 30 22.262 -3.824 3.175 1.00 1.00 N ATOM 189 CE2 TRP A 30 22.179 -5.196 3.048 1.00 1.00 C ATOM 190 CE3 TRP A 30 21.968 -6.736 1.194 1.00 1.00 C ATOM 191 CZ2 TRP A 30 22.182 -6.258 3.955 1.00 1.00 C ATOM 192 CZ3 TRP A 30 21.970 -7.811 2.101 1.00 1.00 C ATOM 193 CH2 TRP A 30 22.077 -7.571 3.480 1.00 1.00 C ATOM 0 H TRP A 30 24.007 -5.566 -0.005 1.00 1.00 H new ATOM 0 HA TRP A 30 23.348 -3.572 -2.152 1.00 1.00 H new ATOM 0 HB2 TRP A 30 21.515 -2.904 -0.661 1.00 1.00 H new ATOM 0 HB3 TRP A 30 21.415 -4.625 -0.978 1.00 1.00 H new ATOM 0 HD1 TRP A 30 22.258 -2.126 1.782 1.00 1.00 H new ATOM 0 HE1 TRP A 30 22.349 -3.335 4.066 1.00 1.00 H new ATOM 0 HE3 TRP A 30 21.886 -6.929 0.135 1.00 1.00 H new ATOM 0 HZ2 TRP A 30 22.265 -6.068 5.015 1.00 1.00 H new ATOM 0 HZ3 TRP A 30 21.889 -8.824 1.735 1.00 1.00 H new ATOM 0 HH2 TRP A 30 22.078 -8.398 4.174 1.00 1.00 H new ATOM 194 N CYS A 31 23.683 -1.697 0.046 1.00 1.00 N ATOM 195 CA CYS A 31 24.476 -0.646 0.743 1.00 1.00 C ATOM 196 C CYS A 31 23.636 -0.024 1.860 1.00 1.00 C ATOM 197 O CYS A 31 22.422 -0.036 1.819 1.00 1.00 O ATOM 198 CB CYS A 31 24.877 0.442 -0.254 1.00 1.00 C ATOM 199 SG CYS A 31 25.412 1.915 0.652 1.00 1.00 S ATOM 0 H CYS A 31 22.688 -1.497 -0.055 1.00 1.00 H new ATOM 0 HA CYS A 31 25.372 -1.097 1.169 1.00 1.00 H new ATOM 0 HB2 CYS A 31 25.681 0.084 -0.897 1.00 1.00 H new ATOM 0 HB3 CYS A 31 24.035 0.685 -0.902 1.00 1.00 H new ATOM 200 N ASN A 32 24.275 0.523 2.857 1.00 1.00 N ATOM 201 CA ASN A 32 23.516 1.148 3.975 1.00 1.00 C ATOM 202 C ASN A 32 24.099 2.529 4.280 1.00 1.00 C ATOM 203 O ASN A 32 25.151 2.652 4.876 1.00 1.00 O ATOM 204 CB ASN A 32 23.622 0.264 5.220 1.00 1.00 C ATOM 205 CG ASN A 32 22.220 -0.143 5.680 1.00 1.00 C ATOM 206 OD1 ASN A 32 21.768 -1.235 5.397 1.00 1.00 O ATOM 207 ND2 ASN A 32 21.508 0.695 6.383 1.00 1.00 N ATOM 0 H ASN A 32 25.290 0.564 2.945 1.00 1.00 H new ATOM 0 HA ASN A 32 22.469 1.251 3.689 1.00 1.00 H new ATOM 0 HB2 ASN A 32 24.215 -0.623 4.999 1.00 1.00 H new ATOM 0 HB3 ASN A 32 24.136 0.801 6.017 1.00 1.00 H new ATOM 0 HD21 ASN A 32 20.573 0.433 6.695 1.00 1.00 H new ATOM 0 HD22 ASN A 32 21.887 1.612 6.621 1.00 1.00 H new ATOM 208 N CYS A 33 23.421 3.571 3.881 1.00 1.00 N ATOM 209 CA CYS A 33 23.934 4.942 4.154 1.00 1.00 C ATOM 210 C CYS A 33 23.082 5.584 5.254 1.00 1.00 C ATOM 211 O CYS A 33 21.976 5.151 5.506 1.00 1.00 O ATOM 212 CB CYS A 33 23.853 5.785 2.878 1.00 1.00 C ATOM 213 SG CYS A 33 22.124 5.958 2.369 1.00 1.00 S ATOM 0 H CYS A 33 22.535 3.531 3.378 1.00 1.00 H new ATOM 0 HA CYS A 33 24.973 4.889 4.479 1.00 1.00 H new ATOM 0 HB2 CYS A 33 24.291 6.768 3.052 1.00 1.00 H new ATOM 0 HB3 CYS A 33 24.431 5.314 2.083 1.00 1.00 H new ATOM 214 N PRO A 34 23.625 6.597 5.880 1.00 1.00 N ATOM 215 CA PRO A 34 22.932 7.299 6.949 1.00 1.00 C ATOM 216 C PRO A 34 21.495 7.622 6.528 1.00 1.00 C ATOM 217 O PRO A 34 21.231 7.947 5.388 1.00 1.00 O ATOM 218 CB PRO A 34 23.742 8.574 7.153 1.00 1.00 C ATOM 219 CG PRO A 34 25.174 8.176 6.672 1.00 1.00 C ATOM 220 CD PRO A 34 24.966 7.109 5.557 1.00 1.00 C ATOM 0 HA PRO A 34 22.859 6.710 7.863 1.00 1.00 H new ATOM 0 HB2 PRO A 34 23.339 9.403 6.571 1.00 1.00 H new ATOM 0 HB3 PRO A 34 23.742 8.887 8.197 1.00 1.00 H new ATOM 0 HG2 PRO A 34 25.712 9.043 6.288 1.00 1.00 H new ATOM 0 HG3 PRO A 34 25.765 7.772 7.494 1.00 1.00 H new ATOM 0 HD2 PRO A 34 25.008 7.546 4.559 1.00 1.00 H new ATOM 0 HD3 PRO A 34 25.723 6.326 5.594 1.00 1.00 H new ATOM 221 N LYS A 35 20.566 7.528 7.440 1.00 1.00 N ATOM 222 CA LYS A 35 19.147 7.824 7.094 1.00 1.00 C ATOM 223 C LYS A 35 19.005 9.305 6.738 1.00 1.00 C ATOM 224 O LYS A 35 18.067 9.708 6.080 1.00 1.00 O ATOM 225 CB LYS A 35 18.252 7.498 8.292 1.00 1.00 C ATOM 226 CG LYS A 35 18.279 5.991 8.554 1.00 1.00 C ATOM 227 CD LYS A 35 17.193 5.628 9.569 1.00 1.00 C ATOM 228 CE LYS A 35 17.713 4.534 10.504 1.00 1.00 C ATOM 229 NZ LYS A 35 16.884 4.505 11.743 1.00 1.00 N ATOM 0 H LYS A 35 20.729 7.259 8.410 1.00 1.00 H new ATOM 0 HA LYS A 35 18.847 7.216 6.240 1.00 1.00 H new ATOM 0 HB2 LYS A 35 18.596 8.037 9.174 1.00 1.00 H new ATOM 0 HB3 LYS A 35 17.231 7.826 8.097 1.00 1.00 H new ATOM 0 HG2 LYS A 35 18.118 5.447 7.623 1.00 1.00 H new ATOM 0 HG3 LYS A 35 19.258 5.695 8.931 1.00 1.00 H new ATOM 0 HD2 LYS A 35 16.910 6.509 10.145 1.00 1.00 H new ATOM 0 HD3 LYS A 35 16.297 5.284 9.052 1.00 1.00 H new ATOM 0 HE2 LYS A 35 17.675 3.566 10.005 1.00 1.00 H new ATOM 0 HE3 LYS A 35 18.757 4.722 10.756 1.00 1.00 H new ATOM 0 HZ1 LYS A 35 17.237 3.762 12.379 1.00 1.00 H new ATOM 0 HZ2 LYS A 35 16.942 5.427 12.221 1.00 1.00 H new ATOM 0 HZ3 LYS A 35 15.894 4.306 11.494 1.00 1.00 H new ATOM 230 N LYS A 36 19.930 10.120 7.166 1.00 1.00 N ATOM 231 CA LYS A 36 19.846 11.573 6.848 1.00 1.00 C ATOM 232 C LYS A 36 20.479 11.830 5.479 1.00 1.00 C ATOM 233 O LYS A 36 20.731 12.957 5.101 1.00 1.00 O ATOM 234 CB LYS A 36 20.595 12.374 7.915 1.00 1.00 C ATOM 235 CG LYS A 36 21.948 11.715 8.192 1.00 1.00 C ATOM 236 CD LYS A 36 23.054 12.769 8.114 1.00 1.00 C ATOM 237 CE LYS A 36 23.241 13.416 9.487 1.00 1.00 C ATOM 238 NZ LYS A 36 23.984 12.482 10.379 1.00 1.00 N ATOM 0 H LYS A 36 20.739 9.843 7.721 1.00 1.00 H new ATOM 0 HA LYS A 36 18.801 11.882 6.831 1.00 1.00 H new ATOM 0 HB2 LYS A 36 20.741 13.401 7.579 1.00 1.00 H new ATOM 0 HB3 LYS A 36 20.006 12.419 8.831 1.00 1.00 H new ATOM 0 HG2 LYS A 36 21.943 11.250 9.178 1.00 1.00 H new ATOM 0 HG3 LYS A 36 22.134 10.923 7.467 1.00 1.00 H new ATOM 0 HD2 LYS A 36 23.987 12.309 7.787 1.00 1.00 H new ATOM 0 HD3 LYS A 36 22.796 13.528 7.375 1.00 1.00 H new ATOM 0 HE2 LYS A 36 23.788 14.353 9.388 1.00 1.00 H new ATOM 0 HE3 LYS A 36 22.271 13.657 9.922 1.00 1.00 H new ATOM 0 HZ1 LYS A 36 24.404 13.015 11.167 1.00 1.00 H new ATOM 0 HZ2 LYS A 36 23.329 11.767 10.755 1.00 1.00 H new ATOM 0 HZ3 LYS A 36 24.738 12.011 9.838 1.00 1.00 H new ATOM 239 N PHE A 37 20.737 10.792 4.733 1.00 1.00 N ATOM 240 CA PHE A 37 21.354 10.971 3.388 1.00 1.00 C ATOM 241 C PHE A 37 20.276 10.828 2.312 1.00 1.00 C ATOM 242 O PHE A 37 19.187 10.355 2.569 1.00 1.00 O ATOM 243 CB PHE A 37 22.430 9.902 3.176 1.00 1.00 C ATOM 244 CG PHE A 37 23.732 10.355 3.797 1.00 1.00 C ATOM 245 CD1 PHE A 37 23.729 11.304 4.830 1.00 1.00 C ATOM 246 CD2 PHE A 37 24.946 9.824 3.340 1.00 1.00 C ATOM 247 CE1 PHE A 37 24.938 11.721 5.404 1.00 1.00 C ATOM 248 CE2 PHE A 37 26.155 10.241 3.914 1.00 1.00 C ATOM 249 CZ PHE A 37 26.150 11.189 4.946 1.00 1.00 C ATOM 0 H PHE A 37 20.547 9.825 4.997 1.00 1.00 H new ATOM 0 HA PHE A 37 21.806 11.961 3.322 1.00 1.00 H new ATOM 0 HB2 PHE A 37 22.112 8.960 3.622 1.00 1.00 H new ATOM 0 HB3 PHE A 37 22.569 9.719 2.110 1.00 1.00 H new ATOM 0 HD1 PHE A 37 22.794 11.714 5.183 1.00 1.00 H new ATOM 0 HD2 PHE A 37 24.950 9.093 2.545 1.00 1.00 H new ATOM 0 HE1 PHE A 37 24.935 12.452 6.199 1.00 1.00 H new ATOM 0 HE2 PHE A 37 27.090 9.832 3.561 1.00 1.00 H new ATOM 0 HZ PHE A 37 27.082 11.510 5.389 1.00 1.00 H new ATOM 250 N GLY A 38 20.570 11.234 1.107 1.00 1.00 N ATOM 251 CA GLY A 38 19.560 11.119 0.017 1.00 1.00 C ATOM 252 C GLY A 38 20.101 11.773 -1.255 1.00 1.00 C ATOM 253 O GLY A 38 20.846 12.728 -1.201 1.00 1.00 O ATOM 0 H GLY A 38 21.464 11.640 0.831 1.00 1.00 H new ATOM 0 HA2 GLY A 38 19.331 10.070 -0.171 1.00 1.00 H new ATOM 0 HA3 GLY A 38 18.629 11.600 0.318 1.00 1.00 H new ATOM 254 N GLY A 39 19.729 11.263 -2.398 1.00 1.00 N ATOM 255 CA GLY A 39 20.214 11.849 -3.678 1.00 1.00 C ATOM 256 C GLY A 39 20.806 10.750 -4.554 1.00 1.00 C ATOM 257 O GLY A 39 21.793 10.135 -4.204 1.00 1.00 O ATOM 0 H GLY A 39 19.107 10.461 -2.499 1.00 1.00 H new ATOM 0 HA2 GLY A 39 19.392 12.340 -4.199 1.00 1.00 H new ATOM 0 HA3 GLY A 39 20.966 12.613 -3.478 1.00 1.00 H new ATOM 258 N GLN A 40 20.203 10.507 -5.692 1.00 1.00 N ATOM 259 CA GLN A 40 20.712 9.452 -6.617 1.00 1.00 C ATOM 260 C GLN A 40 21.084 8.202 -5.822 1.00 1.00 C ATOM 261 O GLN A 40 20.278 7.315 -5.620 1.00 1.00 O ATOM 262 CB GLN A 40 21.949 9.974 -7.351 1.00 1.00 C ATOM 263 CG GLN A 40 21.536 11.071 -8.334 1.00 1.00 C ATOM 264 CD GLN A 40 22.073 10.738 -9.727 1.00 1.00 C ATOM 265 OE1 GLN A 40 22.795 9.776 -9.898 1.00 1.00 O ATOM 266 NE2 GLN A 40 21.748 11.498 -10.736 1.00 1.00 N ATOM 0 H GLN A 40 19.373 11.000 -6.021 1.00 1.00 H new ATOM 0 HA GLN A 40 19.935 9.201 -7.339 1.00 1.00 H new ATOM 0 HB2 GLN A 40 22.671 10.366 -6.635 1.00 1.00 H new ATOM 0 HB3 GLN A 40 22.439 9.159 -7.884 1.00 1.00 H new ATOM 0 HG2 GLN A 40 20.450 11.158 -8.363 1.00 1.00 H new ATOM 0 HG3 GLN A 40 21.924 12.035 -8.004 1.00 1.00 H new ATOM 0 HE21 GLN A 40 21.142 12.306 -10.592 1.00 1.00 H new ATOM 0 HE22 GLN A 40 22.100 11.285 -11.669 1.00 1.00 H new ATOM 267 N HIS A 41 22.298 8.133 -5.363 1.00 1.00 N ATOM 268 CA HIS A 41 22.737 6.955 -4.570 1.00 1.00 C ATOM 269 C HIS A 41 23.184 7.431 -3.192 1.00 1.00 C ATOM 270 O HIS A 41 24.306 7.218 -2.786 1.00 1.00 O ATOM 271 CB HIS A 41 23.904 6.264 -5.278 1.00 1.00 C ATOM 272 CG HIS A 41 23.544 4.831 -5.557 1.00 1.00 C ATOM 273 ND1 HIS A 41 22.648 4.128 -4.767 1.00 1.00 N ATOM 274 CD2 HIS A 41 23.948 3.957 -6.535 1.00 1.00 C ATOM 275 CE1 HIS A 41 22.543 2.888 -5.279 1.00 1.00 C ATOM 276 NE2 HIS A 41 23.316 2.730 -6.357 1.00 1.00 N ATOM 0 H HIS A 41 23.012 8.848 -5.504 1.00 1.00 H new ATOM 0 HA HIS A 41 21.914 6.248 -4.470 1.00 1.00 H new ATOM 0 HB2 HIS A 41 24.135 6.780 -6.210 1.00 1.00 H new ATOM 0 HB3 HIS A 41 24.799 6.311 -4.657 1.00 1.00 H new ATOM 0 HD2 HIS A 41 24.650 4.187 -7.323 1.00 1.00 H new ATOM 0 HE1 HIS A 41 21.911 2.115 -4.868 1.00 1.00 H new ATOM 0 HE2 HIS A 41 23.421 1.891 -6.927 1.00 1.00 H new ATOM 277 N CYS A 42 22.322 8.090 -2.471 1.00 1.00 N ATOM 278 CA CYS A 42 22.718 8.584 -1.126 1.00 1.00 C ATOM 279 C CYS A 42 24.030 9.358 -1.255 1.00 1.00 C ATOM 280 O CYS A 42 25.052 8.963 -0.727 1.00 1.00 O ATOM 281 CB CYS A 42 22.913 7.395 -0.180 1.00 1.00 C ATOM 282 SG CYS A 42 22.069 7.725 1.389 1.00 1.00 S ATOM 0 H CYS A 42 21.366 8.307 -2.753 1.00 1.00 H new ATOM 0 HA CYS A 42 21.941 9.235 -0.725 1.00 1.00 H new ATOM 0 HB2 CYS A 42 22.517 6.487 -0.634 1.00 1.00 H new ATOM 0 HB3 CYS A 42 23.976 7.227 -0.005 1.00 1.00 H new ATOM 283 N GLU A 43 24.008 10.454 -1.967 1.00 1.00 N ATOM 284 CA GLU A 43 25.250 11.260 -2.143 1.00 1.00 C ATOM 285 C GLU A 43 25.072 12.627 -1.480 1.00 1.00 C ATOM 286 O GLU A 43 26.011 13.384 -1.335 1.00 1.00 O ATOM 287 CB GLU A 43 25.524 11.459 -3.636 1.00 1.00 C ATOM 288 CG GLU A 43 24.197 11.539 -4.394 1.00 1.00 C ATOM 289 CD GLU A 43 24.387 12.357 -5.673 1.00 1.00 C ATOM 290 OE1 GLU A 43 24.465 13.570 -5.570 1.00 1.00 O ATOM 291 OE2 GLU A 43 24.450 11.756 -6.732 1.00 1.00 O ATOM 0 H GLU A 43 23.181 10.826 -2.435 1.00 1.00 H new ATOM 0 HA GLU A 43 26.087 10.735 -1.683 1.00 1.00 H new ATOM 0 HB2 GLU A 43 26.099 12.371 -3.792 1.00 1.00 H new ATOM 0 HB3 GLU A 43 26.124 10.634 -4.019 1.00 1.00 H new ATOM 0 HG2 GLU A 43 23.846 10.537 -4.640 1.00 1.00 H new ATOM 0 HG3 GLU A 43 23.434 11.999 -3.766 1.00 1.00 H new ATOM 292 N ILE A 44 23.872 12.954 -1.086 1.00 1.00 N ATOM 293 CA ILE A 44 23.635 14.278 -0.443 1.00 1.00 C ATOM 294 C ILE A 44 23.467 14.094 1.067 1.00 1.00 C ATOM 295 O ILE A 44 22.881 13.133 1.524 1.00 1.00 O ATOM 296 CB ILE A 44 22.366 14.908 -1.022 1.00 1.00 C ATOM 297 CG1 ILE A 44 22.194 14.471 -2.480 1.00 1.00 C ATOM 298 CG2 ILE A 44 22.478 16.432 -0.959 1.00 1.00 C ATOM 299 CD1 ILE A 44 20.802 14.871 -2.973 1.00 1.00 C ATOM 0 H ILE A 44 23.046 12.363 -1.181 1.00 1.00 H new ATOM 0 HA ILE A 44 24.487 14.930 -0.636 1.00 1.00 H new ATOM 0 HB ILE A 44 21.504 14.581 -0.441 1.00 1.00 H new ATOM 0 HG12 ILE A 44 22.959 14.935 -3.102 1.00 1.00 H new ATOM 0 HG13 ILE A 44 22.325 13.392 -2.565 1.00 1.00 H new ATOM 0 HG21 ILE A 44 21.574 16.881 -1.371 1.00 1.00 H new ATOM 0 HG22 ILE A 44 22.598 16.745 0.078 1.00 1.00 H new ATOM 0 HG23 ILE A 44 23.342 16.758 -1.539 1.00 1.00 H new ATOM 0 HD11 ILE A 44 20.680 14.560 -4.011 1.00 1.00 H new ATOM 0 HD12 ILE A 44 20.045 14.386 -2.357 1.00 1.00 H new ATOM 0 HD13 ILE A 44 20.688 15.953 -2.903 1.00 1.00 H new ATOM 300 N ASP A 45 23.974 15.012 1.843 1.00 1.00 N ATOM 301 CA ASP A 45 23.841 14.895 3.322 1.00 1.00 C ATOM 302 C ASP A 45 22.892 15.983 3.830 1.00 1.00 C ATOM 303 O ASP A 45 23.311 17.061 4.201 1.00 1.00 O ATOM 304 CB ASP A 45 25.214 15.071 3.975 1.00 1.00 C ATOM 305 CG ASP A 45 25.048 15.195 5.491 1.00 1.00 C ATOM 306 OD1 ASP A 45 24.006 14.800 5.987 1.00 1.00 O ATOM 307 OD2 ASP A 45 25.965 15.684 6.129 1.00 1.00 O ATOM 0 H ASP A 45 24.475 15.838 1.516 1.00 1.00 H new ATOM 0 HA ASP A 45 23.443 13.913 3.577 1.00 1.00 H new ATOM 0 HB2 ASP A 45 25.853 14.221 3.737 1.00 1.00 H new ATOM 0 HB3 ASP A 45 25.705 15.960 3.579 1.00 1.00 H new ATOM 308 N LYS A 46 21.616 15.708 3.845 1.00 1.00 N ATOM 309 CA LYS A 46 20.638 16.726 4.325 1.00 1.00 C ATOM 310 C LYS A 46 21.177 17.399 5.589 1.00 1.00 C ATOM 311 O LYS A 46 22.113 16.929 6.204 1.00 1.00 O ATOM 312 CB LYS A 46 19.306 16.042 4.638 1.00 1.00 C ATOM 313 CG LYS A 46 18.698 15.495 3.345 1.00 1.00 C ATOM 314 CD LYS A 46 17.345 14.849 3.650 1.00 1.00 C ATOM 315 CE LYS A 46 16.954 13.917 2.502 1.00 1.00 C ATOM 316 NZ LYS A 46 17.209 12.504 2.900 1.00 1.00 N ATOM 0 H LYS A 46 21.208 14.822 3.546 1.00 1.00 H new ATOM 0 HA LYS A 46 20.488 17.479 3.551 1.00 1.00 H new ATOM 0 HB2 LYS A 46 19.459 15.232 5.351 1.00 1.00 H new ATOM 0 HB3 LYS A 46 18.621 16.751 5.103 1.00 1.00 H new ATOM 0 HG2 LYS A 46 18.574 16.300 2.620 1.00 1.00 H new ATOM 0 HG3 LYS A 46 19.369 14.763 2.896 1.00 1.00 H new ATOM 0 HD2 LYS A 46 17.399 14.290 4.584 1.00 1.00 H new ATOM 0 HD3 LYS A 46 16.584 15.618 3.783 1.00 1.00 H new ATOM 0 HE2 LYS A 46 15.901 14.051 2.253 1.00 1.00 H new ATOM 0 HE3 LYS A 46 17.527 14.163 1.608 1.00 1.00 H new ATOM 0 HZ1 LYS A 46 16.639 11.868 2.307 1.00 1.00 H new ATOM 0 HZ2 LYS A 46 18.218 12.284 2.773 1.00 1.00 H new ATOM 0 HZ3 LYS A 46 16.949 12.372 3.898 1.00 1.00 H new ATOM 317 N SER A 47 20.593 18.499 5.982 1.00 1.00 N ATOM 318 CA SER A 47 21.074 19.201 7.205 1.00 1.00 C ATOM 319 C SER A 47 20.203 20.431 7.467 1.00 1.00 C ATOM 320 O SER A 47 19.587 20.556 8.507 1.00 1.00 O ATOM 321 CB SER A 47 22.525 19.639 7.004 1.00 1.00 C ATOM 322 OG SER A 47 22.981 20.305 8.175 1.00 1.00 O ATOM 0 H SER A 47 19.805 18.941 5.509 1.00 1.00 H new ATOM 0 HA SER A 47 21.012 18.525 8.058 1.00 1.00 H new ATOM 0 HB2 SER A 47 23.153 18.773 6.796 1.00 1.00 H new ATOM 0 HB3 SER A 47 22.601 20.302 6.142 1.00 1.00 H new ATOM 0 HG SER A 47 23.912 20.586 8.050 1.00 1.00 H new ATOM 323 N LYS A 48 20.147 21.342 6.534 1.00 1.00 N ATOM 324 CA LYS A 48 19.318 22.563 6.736 1.00 1.00 C ATOM 325 C LYS A 48 17.903 22.320 6.188 1.00 1.00 C ATOM 326 O LYS A 48 17.156 21.527 6.726 1.00 1.00 O ATOM 327 CB LYS A 48 19.972 23.745 6.016 1.00 1.00 C ATOM 328 CG LYS A 48 20.468 23.298 4.641 1.00 1.00 C ATOM 329 CD LYS A 48 21.977 23.061 4.698 1.00 1.00 C ATOM 330 CE LYS A 48 22.497 22.732 3.297 1.00 1.00 C ATOM 331 NZ LYS A 48 22.100 21.343 2.934 1.00 1.00 N ATOM 0 H LYS A 48 20.639 21.293 5.642 1.00 1.00 H new ATOM 0 HA LYS A 48 19.248 22.790 7.800 1.00 1.00 H new ATOM 0 HB2 LYS A 48 19.256 24.559 5.908 1.00 1.00 H new ATOM 0 HB3 LYS A 48 20.804 24.128 6.607 1.00 1.00 H new ATOM 0 HG2 LYS A 48 19.957 22.385 4.337 1.00 1.00 H new ATOM 0 HG3 LYS A 48 20.236 24.057 3.894 1.00 1.00 H new ATOM 0 HD2 LYS A 48 22.480 23.947 5.085 1.00 1.00 H new ATOM 0 HD3 LYS A 48 22.201 22.242 5.382 1.00 1.00 H new ATOM 0 HE2 LYS A 48 22.093 23.438 2.572 1.00 1.00 H new ATOM 0 HE3 LYS A 48 23.582 22.831 3.268 1.00 1.00 H new ATOM 0 HZ1 LYS A 48 22.551 21.076 2.036 1.00 1.00 H new ATOM 0 HZ2 LYS A 48 22.405 20.688 3.682 1.00 1.00 H new ATOM 0 HZ3 LYS A 48 21.066 21.293 2.830 1.00 1.00 H new ATOM 332 N THR A 49 17.522 22.988 5.128 1.00 1.00 N ATOM 333 CA THR A 49 16.155 22.780 4.569 1.00 1.00 C ATOM 334 C THR A 49 15.111 23.150 5.625 1.00 1.00 C ATOM 335 O THR A 49 15.302 22.930 6.805 1.00 1.00 O ATOM 336 CB THR A 49 15.981 21.312 4.172 1.00 1.00 C ATOM 337 OG1 THR A 49 17.240 20.774 3.794 1.00 1.00 O ATOM 338 CG2 THR A 49 15.006 21.213 2.998 1.00 1.00 C ATOM 0 H THR A 49 18.098 23.666 4.628 1.00 1.00 H new ATOM 0 HA THR A 49 16.023 23.411 3.690 1.00 1.00 H new ATOM 0 HB THR A 49 15.585 20.749 5.017 1.00 1.00 H new ATOM 0 HG1 THR A 49 17.131 19.833 3.541 1.00 1.00 H new ATOM 0 HG21 THR A 49 14.882 20.168 2.715 1.00 1.00 H new ATOM 0 HG22 THR A 49 14.041 21.627 3.291 1.00 1.00 H new ATOM 0 HG23 THR A 49 15.399 21.774 2.150 1.00 1.00 H new ATOM 339 N CYS A 50 14.006 23.710 5.212 1.00 1.00 N ATOM 340 CA CYS A 50 12.952 24.090 6.195 1.00 1.00 C ATOM 341 C CYS A 50 11.974 25.072 5.547 1.00 1.00 C ATOM 342 O CYS A 50 12.215 25.588 4.474 1.00 1.00 O ATOM 343 CB CYS A 50 13.602 24.754 7.411 1.00 1.00 C ATOM 344 SG CYS A 50 12.634 26.205 7.895 1.00 1.00 S ATOM 0 H CYS A 50 13.788 23.920 4.238 1.00 1.00 H new ATOM 0 HA CYS A 50 12.415 23.195 6.510 1.00 1.00 H new ATOM 0 HB2 CYS A 50 13.657 24.047 8.239 1.00 1.00 H new ATOM 0 HB3 CYS A 50 14.625 25.048 7.175 1.00 1.00 H new ATOM 345 N TYR A 51 10.873 25.337 6.196 1.00 1.00 N ATOM 346 CA TYR A 51 9.879 26.289 5.624 1.00 1.00 C ATOM 347 C TYR A 51 9.383 27.223 6.730 1.00 1.00 C ATOM 348 O TYR A 51 9.920 27.247 7.820 1.00 1.00 O ATOM 349 CB TYR A 51 8.697 25.508 5.046 1.00 1.00 C ATOM 350 CG TYR A 51 8.303 24.407 6.001 1.00 1.00 C ATOM 351 CD1 TYR A 51 7.573 24.710 7.157 1.00 1.00 C ATOM 352 CD2 TYR A 51 8.668 23.081 5.730 1.00 1.00 C ATOM 353 CE1 TYR A 51 7.207 23.688 8.043 1.00 1.00 C ATOM 354 CE2 TYR A 51 8.302 22.059 6.616 1.00 1.00 C ATOM 355 CZ TYR A 51 7.571 22.362 7.773 1.00 1.00 C ATOM 356 OH TYR A 51 7.211 21.356 8.645 1.00 1.00 O ATOM 0 H TYR A 51 10.619 24.935 7.098 1.00 1.00 H new ATOM 0 HA TYR A 51 10.346 26.874 4.832 1.00 1.00 H new ATOM 0 HB2 TYR A 51 7.853 26.177 4.878 1.00 1.00 H new ATOM 0 HB3 TYR A 51 8.966 25.085 4.078 1.00 1.00 H new ATOM 0 HD1 TYR A 51 7.292 25.732 7.366 1.00 1.00 H new ATOM 0 HD2 TYR A 51 9.231 22.847 4.839 1.00 1.00 H new ATOM 0 HE1 TYR A 51 6.644 23.922 8.934 1.00 1.00 H new ATOM 0 HE2 TYR A 51 8.583 21.037 6.407 1.00 1.00 H new ATOM 0 HH TYR A 51 7.936 21.205 9.287 1.00 1.00 H new ATOM 357 N GLU A 52 8.364 27.991 6.462 1.00 1.00 N ATOM 358 CA GLU A 52 7.839 28.919 7.503 1.00 1.00 C ATOM 359 C GLU A 52 6.419 28.502 7.889 1.00 1.00 C ATOM 360 O GLU A 52 6.175 28.033 8.982 1.00 1.00 O ATOM 361 CB GLU A 52 7.822 30.347 6.954 1.00 1.00 C ATOM 362 CG GLU A 52 8.284 31.318 8.042 1.00 1.00 C ATOM 363 CD GLU A 52 7.967 32.752 7.617 1.00 1.00 C ATOM 364 OE1 GLU A 52 7.574 32.938 6.477 1.00 1.00 O ATOM 365 OE2 GLU A 52 8.122 33.641 8.439 1.00 1.00 O ATOM 0 H GLU A 52 7.872 28.017 5.569 1.00 1.00 H new ATOM 0 HA GLU A 52 8.481 28.878 8.383 1.00 1.00 H new ATOM 0 HB2 GLU A 52 8.475 30.421 6.084 1.00 1.00 H new ATOM 0 HB3 GLU A 52 6.817 30.608 6.622 1.00 1.00 H new ATOM 0 HG2 GLU A 52 7.786 31.088 8.984 1.00 1.00 H new ATOM 0 HG3 GLU A 52 9.355 31.207 8.212 1.00 1.00 H new ATOM 366 N GLY A 53 5.479 28.671 6.999 1.00 1.00 N ATOM 367 CA GLY A 53 4.075 28.285 7.316 1.00 1.00 C ATOM 368 C GLY A 53 4.041 26.840 7.817 1.00 1.00 C ATOM 369 O GLY A 53 5.052 26.169 7.875 1.00 1.00 O ATOM 0 H GLY A 53 5.623 29.059 6.067 1.00 1.00 H new ATOM 0 HA2 GLY A 53 3.666 28.953 8.074 1.00 1.00 H new ATOM 0 HA3 GLY A 53 3.450 28.388 6.429 1.00 1.00 H new ATOM 370 N ASN A 54 2.884 26.354 8.179 1.00 1.00 N ATOM 371 CA ASN A 54 2.787 24.952 8.675 1.00 1.00 C ATOM 372 C ASN A 54 3.107 23.985 7.534 1.00 1.00 C ATOM 373 O ASN A 54 3.695 22.941 7.739 1.00 1.00 O ATOM 374 CB ASN A 54 1.369 24.689 9.187 1.00 1.00 C ATOM 375 CG ASN A 54 0.921 25.853 10.072 1.00 1.00 C ATOM 376 OD1 ASN A 54 0.173 26.708 9.639 1.00 1.00 O ATOM 377 ND2 ASN A 54 1.349 25.924 11.302 1.00 1.00 N ATOM 0 H ASN A 54 2.003 26.867 8.153 1.00 1.00 H new ATOM 0 HA ASN A 54 3.499 24.803 9.487 1.00 1.00 H new ATOM 0 HB2 ASN A 54 0.684 24.572 8.347 1.00 1.00 H new ATOM 0 HB3 ASN A 54 1.342 23.757 9.752 1.00 1.00 H new ATOM 0 HD21 ASN A 54 1.056 26.697 11.900 1.00 1.00 H new ATOM 0 HD22 ASN A 54 1.977 25.207 11.666 1.00 1.00 H new ATOM 378 N GLY A 55 2.728 24.323 6.333 1.00 1.00 N ATOM 379 CA GLY A 55 3.013 23.422 5.180 1.00 1.00 C ATOM 380 C GLY A 55 1.714 22.767 4.707 1.00 1.00 C ATOM 381 O GLY A 55 1.384 21.666 5.100 1.00 1.00 O ATOM 0 H GLY A 55 2.233 25.184 6.099 1.00 1.00 H new ATOM 0 HA2 GLY A 55 3.464 23.989 4.365 1.00 1.00 H new ATOM 0 HA3 GLY A 55 3.732 22.657 5.472 1.00 1.00 H new ATOM 382 N HIS A 56 0.975 23.434 3.863 1.00 1.00 N ATOM 383 CA HIS A 56 -0.300 22.846 3.365 1.00 1.00 C ATOM 384 C HIS A 56 -0.248 22.740 1.839 1.00 1.00 C ATOM 385 O HIS A 56 -0.731 21.789 1.257 1.00 1.00 O ATOM 386 CB HIS A 56 -1.470 23.742 3.775 1.00 1.00 C ATOM 387 CG HIS A 56 -2.764 23.007 3.555 1.00 1.00 C ATOM 388 ND1 HIS A 56 -2.802 21.659 3.237 1.00 1.00 N ATOM 389 CD2 HIS A 56 -4.073 23.418 3.605 1.00 1.00 C ATOM 390 CE1 HIS A 56 -4.095 21.309 3.108 1.00 1.00 C ATOM 391 NE2 HIS A 56 -4.912 22.344 3.322 1.00 1.00 N ATOM 0 H HIS A 56 1.199 24.360 3.497 1.00 1.00 H new ATOM 0 HA HIS A 56 -0.436 21.854 3.795 1.00 1.00 H new ATOM 0 HB2 HIS A 56 -1.374 24.027 4.823 1.00 1.00 H new ATOM 0 HB3 HIS A 56 -1.459 24.663 3.192 1.00 1.00 H new ATOM 0 HD2 HIS A 56 -4.402 24.422 3.830 1.00 1.00 H new ATOM 0 HE1 HIS A 56 -4.431 20.313 2.861 1.00 1.00 H new ATOM 0 HE2 HIS A 56 -5.931 22.347 3.286 1.00 1.00 H new ATOM 392 N PHE A 57 0.336 23.708 1.188 1.00 1.00 N ATOM 393 CA PHE A 57 0.420 23.661 -0.299 1.00 1.00 C ATOM 394 C PHE A 57 1.844 24.008 -0.739 1.00 1.00 C ATOM 395 O PHE A 57 2.205 25.162 -0.855 1.00 1.00 O ATOM 396 CB PHE A 57 -0.560 24.672 -0.898 1.00 1.00 C ATOM 397 CG PHE A 57 -1.852 23.974 -1.251 1.00 1.00 C ATOM 398 CD1 PHE A 57 -2.712 23.535 -0.236 1.00 1.00 C ATOM 399 CD2 PHE A 57 -2.190 23.764 -2.595 1.00 1.00 C ATOM 400 CE1 PHE A 57 -3.910 22.887 -0.564 1.00 1.00 C ATOM 401 CE2 PHE A 57 -3.388 23.116 -2.923 1.00 1.00 C ATOM 402 CZ PHE A 57 -4.248 22.677 -1.907 1.00 1.00 C ATOM 0 H PHE A 57 0.758 24.529 1.621 1.00 1.00 H new ATOM 0 HA PHE A 57 0.165 22.660 -0.646 1.00 1.00 H new ATOM 0 HB2 PHE A 57 -0.751 25.475 -0.186 1.00 1.00 H new ATOM 0 HB3 PHE A 57 -0.127 25.131 -1.787 1.00 1.00 H new ATOM 0 HD1 PHE A 57 -2.451 23.696 0.800 1.00 1.00 H new ATOM 0 HD2 PHE A 57 -1.527 24.102 -3.378 1.00 1.00 H new ATOM 0 HE1 PHE A 57 -4.573 22.549 0.219 1.00 1.00 H new ATOM 0 HE2 PHE A 57 -3.649 22.955 -3.959 1.00 1.00 H new ATOM 0 HZ PHE A 57 -5.171 22.177 -2.160 1.00 1.00 H new ATOM 403 N TYR A 58 2.656 23.016 -0.986 1.00 1.00 N ATOM 404 CA TYR A 58 4.056 23.290 -1.417 1.00 1.00 C ATOM 405 C TYR A 58 4.799 21.967 -1.612 1.00 1.00 C ATOM 406 O TYR A 58 4.198 20.932 -1.826 1.00 1.00 O ATOM 407 CB TYR A 58 4.767 24.122 -0.347 1.00 1.00 C ATOM 408 CG TYR A 58 4.981 23.278 0.886 1.00 1.00 C ATOM 409 CD1 TYR A 58 3.880 22.749 1.573 1.00 1.00 C ATOM 410 CD2 TYR A 58 6.281 23.024 1.344 1.00 1.00 C ATOM 411 CE1 TYR A 58 4.079 21.966 2.718 1.00 1.00 C ATOM 412 CE2 TYR A 58 6.479 22.240 2.489 1.00 1.00 C ATOM 413 CZ TYR A 58 5.378 21.711 3.176 1.00 1.00 C ATOM 414 OH TYR A 58 5.574 20.940 4.303 1.00 1.00 O ATOM 0 H TYR A 58 2.411 22.029 -0.908 1.00 1.00 H new ATOM 0 HA TYR A 58 4.044 23.842 -2.357 1.00 1.00 H new ATOM 0 HB2 TYR A 58 5.724 24.480 -0.726 1.00 1.00 H new ATOM 0 HB3 TYR A 58 4.172 25.002 -0.100 1.00 1.00 H new ATOM 0 HD1 TYR A 58 2.878 22.945 1.220 1.00 1.00 H new ATOM 0 HD2 TYR A 58 7.130 23.432 0.815 1.00 1.00 H new ATOM 0 HE1 TYR A 58 3.230 21.559 3.248 1.00 1.00 H new ATOM 0 HE2 TYR A 58 7.481 22.044 2.842 1.00 1.00 H new ATOM 0 HH TYR A 58 6.534 20.861 4.482 1.00 1.00 H new ATOM 415 N ARG A 59 6.102 21.991 -1.538 1.00 1.00 N ATOM 416 CA ARG A 59 6.882 20.734 -1.718 1.00 1.00 C ATOM 417 C ARG A 59 8.157 20.801 -0.874 1.00 1.00 C ATOM 418 O ARG A 59 8.425 19.933 -0.068 1.00 1.00 O ATOM 419 CB ARG A 59 7.255 20.573 -3.194 1.00 1.00 C ATOM 420 CG ARG A 59 6.601 19.307 -3.750 1.00 1.00 C ATOM 421 CD ARG A 59 5.135 19.592 -4.084 1.00 1.00 C ATOM 422 NE ARG A 59 4.711 18.738 -5.228 1.00 1.00 N ATOM 423 CZ ARG A 59 3.543 18.922 -5.782 1.00 1.00 C ATOM 424 NH1 ARG A 59 3.338 19.962 -6.543 1.00 1.00 N ATOM 425 NH2 ARG A 59 2.580 18.065 -5.574 1.00 1.00 N ATOM 0 H ARG A 59 6.660 22.826 -1.361 1.00 1.00 H new ATOM 0 HA ARG A 59 6.280 19.883 -1.400 1.00 1.00 H new ATOM 0 HB2 ARG A 59 6.926 21.444 -3.760 1.00 1.00 H new ATOM 0 HB3 ARG A 59 8.338 20.513 -3.302 1.00 1.00 H new ATOM 0 HG2 ARG A 59 7.130 18.974 -4.643 1.00 1.00 H new ATOM 0 HG3 ARG A 59 6.668 18.500 -3.020 1.00 1.00 H new ATOM 0 HD2 ARG A 59 4.508 19.392 -3.215 1.00 1.00 H new ATOM 0 HD3 ARG A 59 5.006 20.645 -4.335 1.00 1.00 H new ATOM 0 HE ARG A 59 5.333 18.010 -5.579 1.00 1.00 H new ATOM 0 HH11 ARG A 59 4.090 20.631 -6.705 1.00 1.00 H new ATOM 0 HH12 ARG A 59 2.426 20.105 -6.976 1.00 1.00 H new ATOM 0 HH21 ARG A 59 2.740 17.252 -4.979 1.00 1.00 H new ATOM 0 HH22 ARG A 59 1.667 18.208 -6.007 1.00 1.00 H new ATOM 426 N GLY A 60 8.944 21.826 -1.052 1.00 1.00 N ATOM 427 CA GLY A 60 10.200 21.948 -0.259 1.00 1.00 C ATOM 428 C GLY A 60 10.969 20.627 -0.311 1.00 1.00 C ATOM 429 O GLY A 60 11.322 20.144 -1.368 1.00 1.00 O ATOM 0 H GLY A 60 8.772 22.584 -1.712 1.00 1.00 H new ATOM 0 HA2 GLY A 60 10.816 22.755 -0.656 1.00 1.00 H new ATOM 0 HA3 GLY A 60 9.966 22.204 0.774 1.00 1.00 H new ATOM 430 N LYS A 61 11.231 20.038 0.824 1.00 1.00 N ATOM 431 CA LYS A 61 11.977 18.748 0.838 1.00 1.00 C ATOM 432 C LYS A 61 11.528 17.914 2.041 1.00 1.00 C ATOM 433 O LYS A 61 10.385 17.963 2.450 1.00 1.00 O ATOM 434 CB LYS A 61 13.478 19.029 0.939 1.00 1.00 C ATOM 435 CG LYS A 61 14.255 17.900 0.259 1.00 1.00 C ATOM 436 CD LYS A 61 14.963 18.443 -0.984 1.00 1.00 C ATOM 437 CE LYS A 61 16.333 17.776 -1.123 1.00 1.00 C ATOM 438 NZ LYS A 61 16.406 17.059 -2.427 1.00 1.00 N ATOM 0 H LYS A 61 10.961 20.394 1.741 1.00 1.00 H new ATOM 0 HA LYS A 61 11.773 18.198 -0.081 1.00 1.00 H new ATOM 0 HB2 LYS A 61 13.713 19.983 0.466 1.00 1.00 H new ATOM 0 HB3 LYS A 61 13.774 19.110 1.985 1.00 1.00 H new ATOM 0 HG2 LYS A 61 14.984 17.478 0.951 1.00 1.00 H new ATOM 0 HG3 LYS A 61 13.576 17.094 -0.019 1.00 1.00 H new ATOM 0 HD2 LYS A 61 14.361 18.250 -1.872 1.00 1.00 H new ATOM 0 HD3 LYS A 61 15.079 19.524 -0.906 1.00 1.00 H new ATOM 0 HE2 LYS A 61 17.122 18.526 -1.063 1.00 1.00 H new ATOM 0 HE3 LYS A 61 16.494 17.077 -0.302 1.00 1.00 H new ATOM 0 HZ1 LYS A 61 17.337 16.605 -2.522 1.00 1.00 H new ATOM 0 HZ2 LYS A 61 15.662 16.334 -2.466 1.00 1.00 H new ATOM 0 HZ3 LYS A 61 16.270 17.737 -3.204 1.00 1.00 H new ATOM 439 N ALA A 62 12.417 17.145 2.610 1.00 1.00 N ATOM 440 CA ALA A 62 12.037 16.310 3.784 1.00 1.00 C ATOM 441 C ALA A 62 11.038 15.239 3.342 1.00 1.00 C ATOM 442 O ALA A 62 9.884 15.521 3.086 1.00 1.00 O ATOM 443 CB ALA A 62 11.398 17.194 4.856 1.00 1.00 C ATOM 0 H ALA A 62 13.389 17.059 2.312 1.00 1.00 H new ATOM 0 HA ALA A 62 12.927 15.832 4.194 1.00 1.00 H new ATOM 0 HB1 ALA A 62 11.120 16.582 5.714 1.00 1.00 H new ATOM 0 HB2 ALA A 62 12.110 17.958 5.170 1.00 1.00 H new ATOM 0 HB3 ALA A 62 10.508 17.673 4.449 1.00 1.00 H new ATOM 444 N SER A 63 11.472 14.011 3.249 1.00 1.00 N ATOM 445 CA SER A 63 10.546 12.926 2.821 1.00 1.00 C ATOM 446 C SER A 63 10.372 11.918 3.960 1.00 1.00 C ATOM 447 O SER A 63 9.636 10.958 3.843 1.00 1.00 O ATOM 448 CB SER A 63 11.125 12.214 1.598 1.00 1.00 C ATOM 449 OG SER A 63 11.245 13.143 0.528 1.00 1.00 O ATOM 0 H SER A 63 12.427 13.714 3.451 1.00 1.00 H new ATOM 0 HA SER A 63 9.578 13.358 2.568 1.00 1.00 H new ATOM 0 HB2 SER A 63 12.100 11.789 1.837 1.00 1.00 H new ATOM 0 HB3 SER A 63 10.480 11.386 1.305 1.00 1.00 H new ATOM 0 HG SER A 63 10.522 12.995 -0.117 1.00 1.00 H new ATOM 450 N THR A 64 11.040 12.125 5.063 1.00 1.00 N ATOM 451 CA THR A 64 10.903 11.171 6.200 1.00 1.00 C ATOM 452 C THR A 64 9.889 11.715 7.207 1.00 1.00 C ATOM 453 O THR A 64 9.550 12.882 7.193 1.00 1.00 O ATOM 454 CB THR A 64 12.255 10.991 6.896 1.00 1.00 C ATOM 455 OG1 THR A 64 12.687 12.240 7.417 1.00 1.00 O ATOM 456 CG2 THR A 64 13.289 10.467 5.900 1.00 1.00 C ATOM 0 H THR A 64 11.671 12.909 5.225 1.00 1.00 H new ATOM 0 HA THR A 64 10.562 10.209 5.817 1.00 1.00 H new ATOM 0 HB THR A 64 12.148 10.272 7.709 1.00 1.00 H new ATOM 0 HG1 THR A 64 13.551 12.126 7.864 1.00 1.00 H new ATOM 0 HG21 THR A 64 14.248 10.342 6.403 1.00 1.00 H new ATOM 0 HG22 THR A 64 12.959 9.507 5.504 1.00 1.00 H new ATOM 0 HG23 THR A 64 13.399 11.178 5.082 1.00 1.00 H new ATOM 457 N ASP A 65 9.404 10.879 8.085 1.00 1.00 N ATOM 458 CA ASP A 65 8.413 11.356 9.093 1.00 1.00 C ATOM 459 C ASP A 65 9.145 11.792 10.370 1.00 1.00 C ATOM 460 O ASP A 65 10.247 12.302 10.317 1.00 1.00 O ATOM 461 CB ASP A 65 7.425 10.233 9.409 1.00 1.00 C ATOM 462 CG ASP A 65 8.179 9.023 9.961 1.00 1.00 C ATOM 463 OD1 ASP A 65 8.815 8.339 9.177 1.00 1.00 O ATOM 464 OD2 ASP A 65 8.106 8.800 11.158 1.00 1.00 O ATOM 0 H ASP A 65 9.649 9.891 8.148 1.00 1.00 H new ATOM 0 HA ASP A 65 7.865 12.209 8.691 1.00 1.00 H new ATOM 0 HB2 ASP A 65 6.689 10.577 10.135 1.00 1.00 H new ATOM 0 HB3 ASP A 65 6.878 9.953 8.509 1.00 1.00 H new ATOM 465 N THR A 66 8.546 11.601 11.518 1.00 1.00 N ATOM 466 CA THR A 66 9.209 12.008 12.788 1.00 1.00 C ATOM 467 C THR A 66 10.101 10.873 13.286 1.00 1.00 C ATOM 468 O THR A 66 10.318 10.720 14.472 1.00 1.00 O ATOM 469 CB THR A 66 8.144 12.318 13.843 1.00 1.00 C ATOM 470 OG1 THR A 66 7.069 11.398 13.712 1.00 1.00 O ATOM 471 CG2 THR A 66 7.626 13.743 13.644 1.00 1.00 C ATOM 0 H THR A 66 7.624 11.179 11.628 1.00 1.00 H new ATOM 0 HA THR A 66 9.816 12.896 12.611 1.00 1.00 H new ATOM 0 HB THR A 66 8.580 12.229 14.838 1.00 1.00 H new ATOM 0 HG1 THR A 66 6.387 11.594 14.388 1.00 1.00 H new ATOM 0 HG21 THR A 66 6.868 13.963 14.396 1.00 1.00 H new ATOM 0 HG22 THR A 66 8.452 14.448 13.745 1.00 1.00 H new ATOM 0 HG23 THR A 66 7.189 13.836 12.650 1.00 1.00 H new ATOM 472 N MET A 67 10.620 10.073 12.399 1.00 1.00 N ATOM 473 CA MET A 67 11.491 8.956 12.839 1.00 1.00 C ATOM 474 C MET A 67 12.771 8.969 12.007 1.00 1.00 C ATOM 475 O MET A 67 13.860 8.777 12.511 1.00 1.00 O ATOM 476 CB MET A 67 10.761 7.627 12.638 1.00 1.00 C ATOM 477 CG MET A 67 10.247 7.120 13.987 1.00 1.00 C ATOM 478 SD MET A 67 8.495 6.690 13.843 1.00 1.00 S ATOM 479 CE MET A 67 7.829 8.333 14.202 1.00 1.00 C ATOM 0 H MET A 67 10.478 10.146 11.392 1.00 1.00 H new ATOM 0 HA MET A 67 11.736 9.072 13.895 1.00 1.00 H new ATOM 0 HB2 MET A 67 9.930 7.757 11.945 1.00 1.00 H new ATOM 0 HB3 MET A 67 11.434 6.893 12.194 1.00 1.00 H new ATOM 0 HG2 MET A 67 10.821 6.249 14.303 1.00 1.00 H new ATOM 0 HG3 MET A 67 10.383 7.886 14.751 1.00 1.00 H new ATOM 0 HE1 MET A 67 6.917 8.235 14.791 1.00 1.00 H new ATOM 0 HE2 MET A 67 8.564 8.909 14.765 1.00 1.00 H new ATOM 0 HE3 MET A 67 7.604 8.847 13.267 1.00 1.00 H new ATOM 480 N GLY A 68 12.640 9.197 10.732 1.00 1.00 N ATOM 481 CA GLY A 68 13.834 9.230 9.846 1.00 1.00 C ATOM 482 C GLY A 68 13.542 8.409 8.596 1.00 1.00 C ATOM 483 O GLY A 68 14.077 8.659 7.535 1.00 1.00 O ATOM 0 H GLY A 68 11.750 9.363 10.262 1.00 1.00 H new ATOM 0 HA2 GLY A 68 14.074 10.258 9.575 1.00 1.00 H new ATOM 0 HA3 GLY A 68 14.702 8.827 10.368 1.00 1.00 H new ATOM 484 N ARG A 69 12.685 7.433 8.711 1.00 1.00 N ATOM 485 CA ARG A 69 12.345 6.604 7.526 1.00 1.00 C ATOM 486 C ARG A 69 11.667 7.499 6.487 1.00 1.00 C ATOM 487 O ARG A 69 11.054 8.488 6.838 1.00 1.00 O ATOM 488 CB ARG A 69 11.390 5.483 7.941 1.00 1.00 C ATOM 489 CG ARG A 69 10.205 6.081 8.701 1.00 1.00 C ATOM 490 CD ARG A 69 9.842 5.177 9.880 1.00 1.00 C ATOM 491 NE ARG A 69 11.081 4.797 10.617 1.00 1.00 N ATOM 492 CZ ARG A 69 11.109 3.700 11.324 1.00 1.00 C ATOM 493 NH1 ARG A 69 10.129 3.425 12.141 1.00 1.00 N ATOM 494 NH2 ARG A 69 12.117 2.879 11.214 1.00 1.00 N ATOM 0 H ARG A 69 12.207 7.175 9.574 1.00 1.00 H new ATOM 0 HA ARG A 69 13.248 6.162 7.106 1.00 1.00 H new ATOM 0 HB2 ARG A 69 11.038 4.946 7.060 1.00 1.00 H new ATOM 0 HB3 ARG A 69 11.911 4.760 8.568 1.00 1.00 H new ATOM 0 HG2 ARG A 69 10.456 7.079 9.059 1.00 1.00 H new ATOM 0 HG3 ARG A 69 9.349 6.188 8.035 1.00 1.00 H new ATOM 0 HD2 ARG A 69 9.153 5.693 10.548 1.00 1.00 H new ATOM 0 HD3 ARG A 69 9.331 4.283 9.522 1.00 1.00 H new ATOM 0 HE ARG A 69 11.907 5.394 10.569 1.00 1.00 H new ATOM 0 HH11 ARG A 69 9.341 4.067 12.227 1.00 1.00 H new ATOM 0 HH12 ARG A 69 10.151 2.568 12.693 1.00 1.00 H new ATOM 0 HH21 ARG A 69 12.883 3.094 10.576 1.00 1.00 H new ATOM 0 HH22 ARG A 69 12.139 2.022 11.766 1.00 1.00 H new ATOM 495 N PRO A 70 11.800 7.128 5.239 1.00 1.00 N ATOM 496 CA PRO A 70 11.216 7.887 4.141 1.00 1.00 C ATOM 497 C PRO A 70 9.690 7.729 4.115 1.00 1.00 C ATOM 498 O PRO A 70 9.024 8.241 3.237 1.00 1.00 O ATOM 499 CB PRO A 70 11.840 7.281 2.889 1.00 1.00 C ATOM 500 CG PRO A 70 12.206 5.829 3.330 1.00 1.00 C ATOM 501 CD PRO A 70 12.546 5.923 4.844 1.00 1.00 C ATOM 0 HA PRO A 70 11.409 8.956 4.230 1.00 1.00 H new ATOM 0 HB2 PRO A 70 11.142 7.282 2.052 1.00 1.00 H new ATOM 0 HB3 PRO A 70 12.721 7.838 2.570 1.00 1.00 H new ATOM 0 HG2 PRO A 70 11.374 5.146 3.157 1.00 1.00 H new ATOM 0 HG3 PRO A 70 13.054 5.449 2.761 1.00 1.00 H new ATOM 0 HD2 PRO A 70 12.219 5.040 5.393 1.00 1.00 H new ATOM 0 HD3 PRO A 70 13.617 6.028 5.018 1.00 1.00 H new ATOM 502 N CYS A 71 9.128 7.031 5.065 1.00 1.00 N ATOM 503 CA CYS A 71 7.650 6.857 5.079 1.00 1.00 C ATOM 504 C CYS A 71 7.240 5.864 3.990 1.00 1.00 C ATOM 505 O CYS A 71 8.011 5.539 3.109 1.00 1.00 O ATOM 506 CB CYS A 71 6.978 8.205 4.814 1.00 1.00 C ATOM 507 SG CYS A 71 5.418 8.291 5.726 1.00 1.00 S ATOM 0 H CYS A 71 9.628 6.576 5.829 1.00 1.00 H new ATOM 0 HA CYS A 71 7.339 6.477 6.052 1.00 1.00 H new ATOM 0 HB2 CYS A 71 7.636 9.018 5.121 1.00 1.00 H new ATOM 0 HB3 CYS A 71 6.795 8.329 3.747 1.00 1.00 H new ATOM 508 N LEU A 72 6.029 5.383 4.043 1.00 1.00 N ATOM 509 CA LEU A 72 5.563 4.416 3.012 1.00 1.00 C ATOM 510 C LEU A 72 5.102 5.186 1.770 1.00 1.00 C ATOM 511 O LEU A 72 4.188 5.982 1.852 1.00 1.00 O ATOM 512 CB LEU A 72 4.380 3.616 3.561 1.00 1.00 C ATOM 513 CG LEU A 72 4.832 2.772 4.752 1.00 1.00 C ATOM 514 CD1 LEU A 72 3.747 2.797 5.830 1.00 1.00 C ATOM 515 CD2 LEU A 72 5.059 1.331 4.294 1.00 1.00 C ATOM 0 H LEU A 72 5.341 5.619 4.758 1.00 1.00 H new ATOM 0 HA LEU A 72 6.379 3.741 2.754 1.00 1.00 H new ATOM 0 HB2 LEU A 72 3.582 4.293 3.866 1.00 1.00 H new ATOM 0 HB3 LEU A 72 3.972 2.972 2.782 1.00 1.00 H new ATOM 0 HG LEU A 72 5.759 3.177 5.157 1.00 1.00 H new ATOM 0 HD11 LEU A 72 4.066 2.196 6.681 1.00 1.00 H new ATOM 0 HD12 LEU A 72 3.579 3.824 6.154 1.00 1.00 H new ATOM 0 HD13 LEU A 72 2.821 2.389 5.424 1.00 1.00 H new ATOM 0 HD21 LEU A 72 5.382 0.726 5.142 1.00 1.00 H new ATOM 0 HD22 LEU A 72 4.130 0.926 3.892 1.00 1.00 H new ATOM 0 HD23 LEU A 72 5.827 1.312 3.521 1.00 1.00 H new ATOM 516 N PRO A 73 5.732 4.926 0.651 1.00 1.00 N ATOM 517 CA PRO A 73 5.369 5.588 -0.589 1.00 1.00 C ATOM 518 C PRO A 73 3.856 5.491 -0.785 1.00 1.00 C ATOM 519 O PRO A 73 3.242 4.514 -0.414 1.00 1.00 O ATOM 520 CB PRO A 73 6.111 4.809 -1.669 1.00 1.00 C ATOM 521 CG PRO A 73 7.327 4.197 -0.906 1.00 1.00 C ATOM 522 CD PRO A 73 6.836 3.961 0.552 1.00 1.00 C ATOM 0 HA PRO A 73 5.629 6.646 -0.607 1.00 1.00 H new ATOM 0 HB2 PRO A 73 5.482 4.035 -2.109 1.00 1.00 H new ATOM 0 HB3 PRO A 73 6.433 5.459 -2.483 1.00 1.00 H new ATOM 0 HG2 PRO A 73 7.648 3.263 -1.367 1.00 1.00 H new ATOM 0 HG3 PRO A 73 8.182 4.873 -0.926 1.00 1.00 H new ATOM 0 HD2 PRO A 73 6.500 2.936 0.711 1.00 1.00 H new ATOM 0 HD3 PRO A 73 7.619 4.157 1.285 1.00 1.00 H new ATOM 523 N TRP A 74 3.247 6.495 -1.351 1.00 1.00 N ATOM 524 CA TRP A 74 1.770 6.450 -1.553 1.00 1.00 C ATOM 525 C TRP A 74 1.399 5.235 -2.409 1.00 1.00 C ATOM 526 O TRP A 74 0.251 4.843 -2.478 1.00 1.00 O ATOM 527 CB TRP A 74 1.316 7.743 -2.233 1.00 1.00 C ATOM 528 CG TRP A 74 1.969 8.898 -1.544 1.00 1.00 C ATOM 529 CD1 TRP A 74 2.964 9.654 -2.060 1.00 1.00 C ATOM 530 CD2 TRP A 74 1.700 9.429 -0.217 1.00 1.00 C ATOM 531 NE1 TRP A 74 3.323 10.616 -1.133 1.00 1.00 N ATOM 532 CE2 TRP A 74 2.572 10.518 0.021 1.00 1.00 C ATOM 533 CE3 TRP A 74 0.790 9.073 0.795 1.00 1.00 C ATOM 534 CZ2 TRP A 74 2.543 11.226 1.224 1.00 1.00 C ATOM 535 CZ3 TRP A 74 0.758 9.781 2.004 1.00 1.00 C ATOM 536 CH2 TRP A 74 1.634 10.855 2.219 1.00 1.00 C ATOM 0 H TRP A 74 3.706 7.344 -1.682 1.00 1.00 H new ATOM 0 HA TRP A 74 1.269 6.359 -0.589 1.00 1.00 H new ATOM 0 HB2 TRP A 74 1.586 7.730 -3.289 1.00 1.00 H new ATOM 0 HB3 TRP A 74 0.231 7.836 -2.183 1.00 1.00 H new ATOM 0 HD1 TRP A 74 3.407 9.527 -3.037 1.00 1.00 H new ATOM 0 HE1 TRP A 74 4.053 11.312 -1.284 1.00 1.00 H new ATOM 0 HE3 TRP A 74 0.111 8.248 0.639 1.00 1.00 H new ATOM 0 HZ2 TRP A 74 3.218 12.054 1.385 1.00 1.00 H new ATOM 0 HZ3 TRP A 74 0.055 9.498 2.774 1.00 1.00 H new ATOM 0 HH2 TRP A 74 1.606 11.396 3.154 1.00 1.00 H new ATOM 537 N ASN A 75 2.361 4.625 -3.046 1.00 1.00 N ATOM 538 CA ASN A 75 2.060 3.425 -3.877 1.00 1.00 C ATOM 539 C ASN A 75 2.080 2.185 -2.974 1.00 1.00 C ATOM 540 O ASN A 75 1.363 1.230 -3.197 1.00 1.00 O ATOM 541 CB ASN A 75 3.116 3.291 -4.979 1.00 1.00 C ATOM 542 CG ASN A 75 3.086 1.875 -5.560 1.00 1.00 C ATOM 543 OD1 ASN A 75 3.598 0.890 -4.874 1.00 1.00 O flip ATOM 544 ND2 ASN A 75 2.591 1.663 -6.649 1.00 1.00 N flip ATOM 0 H ASN A 75 3.342 4.905 -3.027 1.00 1.00 H new ATOM 0 HA ASN A 75 1.078 3.523 -4.341 1.00 1.00 H new ATOM 0 HB2 ASN A 75 2.927 4.021 -5.766 1.00 1.00 H new ATOM 0 HB3 ASN A 75 4.105 3.507 -4.575 1.00 1.00 H new ATOM 0 HD21 ASN A 75 2.191 2.432 -7.186 1.00 1.00 H new ATOM 0 HD22 ASN A 75 2.576 0.716 -7.027 1.00 1.00 H new ATOM 545 N SER A 76 2.899 2.206 -1.954 1.00 1.00 N ATOM 546 CA SER A 76 2.984 1.057 -1.018 1.00 1.00 C ATOM 547 C SER A 76 1.585 0.518 -0.759 1.00 1.00 C ATOM 548 O SER A 76 0.800 1.108 -0.050 1.00 1.00 O ATOM 549 CB SER A 76 3.608 1.514 0.302 1.00 1.00 C ATOM 550 OG SER A 76 4.808 0.787 0.531 1.00 1.00 O ATOM 0 H SER A 76 3.519 2.984 -1.731 1.00 1.00 H new ATOM 0 HA SER A 76 3.604 0.275 -1.456 1.00 1.00 H new ATOM 0 HB2 SER A 76 3.818 2.583 0.267 1.00 1.00 H new ATOM 0 HB3 SER A 76 2.909 1.353 1.123 1.00 1.00 H new ATOM 0 HG SER A 76 5.211 1.079 1.375 1.00 1.00 H new ATOM 551 N ALA A 77 1.282 -0.593 -1.354 1.00 1.00 N ATOM 552 CA ALA A 77 -0.068 -1.218 -1.195 1.00 1.00 C ATOM 553 C ALA A 77 -0.624 -0.970 0.214 1.00 1.00 C ATOM 554 O ALA A 77 -1.819 -0.873 0.404 1.00 1.00 O ATOM 555 CB ALA A 77 0.044 -2.725 -1.434 1.00 1.00 C ATOM 0 H ALA A 77 1.920 -1.111 -1.958 1.00 1.00 H new ATOM 0 HA ALA A 77 -0.747 -0.769 -1.920 1.00 1.00 H new ATOM 0 HB1 ALA A 77 -0.937 -3.186 -1.319 1.00 1.00 H new ATOM 0 HB2 ALA A 77 0.415 -2.907 -2.443 1.00 1.00 H new ATOM 0 HB3 ALA A 77 0.735 -3.158 -0.710 1.00 1.00 H new ATOM 556 N THR A 78 0.223 -0.859 1.202 1.00 1.00 N ATOM 557 CA THR A 78 -0.278 -0.609 2.586 1.00 1.00 C ATOM 558 C THR A 78 -0.973 0.752 2.636 1.00 1.00 C ATOM 559 O THR A 78 -2.156 0.848 2.900 1.00 1.00 O ATOM 560 CB THR A 78 0.899 -0.601 3.563 1.00 1.00 C ATOM 561 OG1 THR A 78 1.888 -1.519 3.119 1.00 1.00 O ATOM 562 CG2 THR A 78 0.412 -1.002 4.956 1.00 1.00 C ATOM 0 H THR A 78 1.237 -0.930 1.112 1.00 1.00 H new ATOM 0 HA THR A 78 -0.981 -1.395 2.862 1.00 1.00 H new ATOM 0 HB THR A 78 1.328 0.400 3.607 1.00 1.00 H new ATOM 0 HG1 THR A 78 2.643 -1.513 3.743 1.00 1.00 H new ATOM 0 HG21 THR A 78 1.252 -0.996 5.651 1.00 1.00 H new ATOM 0 HG22 THR A 78 -0.344 -0.294 5.295 1.00 1.00 H new ATOM 0 HG23 THR A 78 -0.019 -2.002 4.917 1.00 1.00 H new ATOM 563 N VAL A 79 -0.251 1.807 2.379 1.00 1.00 N ATOM 564 CA VAL A 79 -0.865 3.145 2.403 1.00 1.00 C ATOM 565 C VAL A 79 -2.024 3.163 1.411 1.00 1.00 C ATOM 566 O VAL A 79 -3.027 3.816 1.621 1.00 1.00 O ATOM 567 CB VAL A 79 0.197 4.160 2.008 1.00 1.00 C ATOM 568 CG1 VAL A 79 0.936 3.680 0.763 1.00 1.00 C ATOM 569 CG2 VAL A 79 -0.468 5.482 1.707 1.00 1.00 C ATOM 0 H VAL A 79 0.743 1.790 2.153 1.00 1.00 H new ATOM 0 HA VAL A 79 -1.246 3.391 3.394 1.00 1.00 H new ATOM 0 HB VAL A 79 0.906 4.275 2.828 1.00 1.00 H new ATOM 0 HG11 VAL A 79 1.695 4.412 0.486 1.00 1.00 H new ATOM 0 HG12 VAL A 79 1.414 2.722 0.970 1.00 1.00 H new ATOM 0 HG13 VAL A 79 0.228 3.563 -0.058 1.00 1.00 H new ATOM 0 HG21 VAL A 79 0.289 6.214 1.423 1.00 1.00 H new ATOM 0 HG22 VAL A 79 -1.175 5.355 0.888 1.00 1.00 H new ATOM 0 HG23 VAL A 79 -0.998 5.833 2.593 1.00 1.00 H new ATOM 570 N LEU A 80 -1.908 2.420 0.344 1.00 1.00 N ATOM 571 CA LEU A 80 -3.020 2.365 -0.640 1.00 1.00 C ATOM 572 C LEU A 80 -4.256 1.878 0.109 1.00 1.00 C ATOM 573 O LEU A 80 -5.351 2.374 -0.069 1.00 1.00 O ATOM 574 CB LEU A 80 -2.684 1.374 -1.760 1.00 1.00 C ATOM 575 CG LEU A 80 -1.468 1.866 -2.548 1.00 1.00 C ATOM 576 CD1 LEU A 80 -1.230 0.942 -3.744 1.00 1.00 C ATOM 577 CD2 LEU A 80 -1.725 3.285 -3.052 1.00 1.00 C ATOM 0 H LEU A 80 -1.093 1.851 0.114 1.00 1.00 H new ATOM 0 HA LEU A 80 -3.186 3.346 -1.086 1.00 1.00 H new ATOM 0 HB2 LEU A 80 -2.480 0.390 -1.337 1.00 1.00 H new ATOM 0 HB3 LEU A 80 -3.539 1.263 -2.427 1.00 1.00 H new ATOM 0 HG LEU A 80 -0.591 1.862 -1.900 1.00 1.00 H new ATOM 0 HD11 LEU A 80 -0.364 1.291 -4.307 1.00 1.00 H new ATOM 0 HD12 LEU A 80 -1.048 -0.072 -3.389 1.00 1.00 H new ATOM 0 HD13 LEU A 80 -2.109 0.948 -4.389 1.00 1.00 H new ATOM 0 HD21 LEU A 80 -0.858 3.634 -3.613 1.00 1.00 H new ATOM 0 HD22 LEU A 80 -2.602 3.288 -3.700 1.00 1.00 H new ATOM 0 HD23 LEU A 80 -1.899 3.947 -2.203 1.00 1.00 H new ATOM 578 N GLN A 81 -4.065 0.917 0.969 1.00 1.00 N ATOM 579 CA GLN A 81 -5.193 0.385 1.775 1.00 1.00 C ATOM 580 C GLN A 81 -5.748 1.526 2.626 1.00 1.00 C ATOM 581 O GLN A 81 -6.930 1.602 2.897 1.00 1.00 O ATOM 582 CB GLN A 81 -4.669 -0.735 2.679 1.00 1.00 C ATOM 583 CG GLN A 81 -5.378 -2.045 2.340 1.00 1.00 C ATOM 584 CD GLN A 81 -4.640 -3.211 3.000 1.00 1.00 C ATOM 585 OE1 GLN A 81 -4.007 -4.002 2.330 1.00 1.00 O ATOM 586 NE2 GLN A 81 -4.694 -3.351 4.296 1.00 1.00 N ATOM 0 H GLN A 81 -3.164 0.474 1.148 1.00 1.00 H new ATOM 0 HA GLN A 81 -5.978 -0.013 1.132 1.00 1.00 H new ATOM 0 HB2 GLN A 81 -3.593 -0.848 2.547 1.00 1.00 H new ATOM 0 HB3 GLN A 81 -4.837 -0.480 3.725 1.00 1.00 H new ATOM 0 HG2 GLN A 81 -6.411 -2.012 2.686 1.00 1.00 H new ATOM 0 HG3 GLN A 81 -5.409 -2.185 1.259 1.00 1.00 H new ATOM 0 HE21 GLN A 81 -5.225 -2.687 4.859 1.00 1.00 H new ATOM 0 HE22 GLN A 81 -4.205 -4.124 4.746 1.00 1.00 H new ATOM 587 N GLN A 82 -4.891 2.422 3.035 1.00 1.00 N ATOM 588 CA GLN A 82 -5.342 3.579 3.856 1.00 1.00 C ATOM 589 C GLN A 82 -5.929 4.647 2.926 1.00 1.00 C ATOM 590 O GLN A 82 -6.484 4.339 1.891 1.00 1.00 O ATOM 591 CB GLN A 82 -4.141 4.156 4.610 1.00 1.00 C ATOM 592 CG GLN A 82 -3.504 3.064 5.471 1.00 1.00 C ATOM 593 CD GLN A 82 -3.130 3.645 6.836 1.00 1.00 C ATOM 594 OE1 GLN A 82 -3.008 4.845 6.985 1.00 1.00 O ATOM 595 NE2 GLN A 82 -2.941 2.840 7.845 1.00 1.00 N ATOM 0 H GLN A 82 -3.891 2.401 2.834 1.00 1.00 H new ATOM 0 HA GLN A 82 -6.100 3.260 4.572 1.00 1.00 H new ATOM 0 HB2 GLN A 82 -3.410 4.549 3.904 1.00 1.00 H new ATOM 0 HB3 GLN A 82 -4.458 4.989 5.237 1.00 1.00 H new ATOM 0 HG2 GLN A 82 -4.198 2.233 5.595 1.00 1.00 H new ATOM 0 HG3 GLN A 82 -2.617 2.668 4.977 1.00 1.00 H new ATOM 0 HE21 GLN A 82 -3.043 1.833 7.720 1.00 1.00 H new ATOM 0 HE22 GLN A 82 -2.691 3.218 8.759 1.00 1.00 H new ATOM 596 N THR A 83 -5.804 5.899 3.276 1.00 1.00 N ATOM 597 CA THR A 83 -6.344 6.970 2.403 1.00 1.00 C ATOM 598 C THR A 83 -5.182 7.828 1.905 1.00 1.00 C ATOM 599 O THR A 83 -4.077 7.346 1.764 1.00 1.00 O ATOM 600 CB THR A 83 -7.322 7.837 3.201 1.00 1.00 C ATOM 601 OG1 THR A 83 -7.740 7.132 4.361 1.00 1.00 O ATOM 602 CG2 THR A 83 -8.539 8.166 2.335 1.00 1.00 C ATOM 0 H THR A 83 -5.350 6.222 4.130 1.00 1.00 H new ATOM 0 HA THR A 83 -6.870 6.531 1.555 1.00 1.00 H new ATOM 0 HB THR A 83 -6.829 8.763 3.497 1.00 1.00 H new ATOM 0 HG1 THR A 83 -8.365 7.687 4.873 1.00 1.00 H new ATOM 0 HG21 THR A 83 -9.234 8.783 2.904 1.00 1.00 H new ATOM 0 HG22 THR A 83 -8.217 8.708 1.446 1.00 1.00 H new ATOM 0 HG23 THR A 83 -9.034 7.242 2.037 1.00 1.00 H new ATOM 603 N TYR A 84 -5.440 9.091 1.653 1.00 1.00 N ATOM 604 CA TYR A 84 -4.381 10.044 1.163 1.00 1.00 C ATOM 605 C TYR A 84 -3.160 9.292 0.635 1.00 1.00 C ATOM 606 O TYR A 84 -2.043 9.506 1.063 1.00 1.00 O ATOM 607 CB TYR A 84 -3.975 10.973 2.305 1.00 1.00 C ATOM 608 CG TYR A 84 -5.194 11.727 2.783 1.00 1.00 C ATOM 609 CD1 TYR A 84 -5.679 12.819 2.052 1.00 1.00 C ATOM 610 CD2 TYR A 84 -5.841 11.330 3.961 1.00 1.00 C ATOM 611 CE1 TYR A 84 -6.812 13.513 2.499 1.00 1.00 C ATOM 612 CE2 TYR A 84 -6.973 12.023 4.407 1.00 1.00 C ATOM 613 CZ TYR A 84 -7.459 13.115 3.676 1.00 1.00 C ATOM 614 OH TYR A 84 -8.575 13.798 4.115 1.00 1.00 O ATOM 0 H TYR A 84 -6.361 9.514 1.768 1.00 1.00 H new ATOM 0 HA TYR A 84 -4.791 10.629 0.339 1.00 1.00 H new ATOM 0 HB2 TYR A 84 -3.544 10.397 3.124 1.00 1.00 H new ATOM 0 HB3 TYR A 84 -3.209 11.671 1.968 1.00 1.00 H new ATOM 0 HD1 TYR A 84 -5.180 13.126 1.145 1.00 1.00 H new ATOM 0 HD2 TYR A 84 -5.466 10.489 4.525 1.00 1.00 H new ATOM 0 HE1 TYR A 84 -7.186 14.355 1.936 1.00 1.00 H new ATOM 0 HE2 TYR A 84 -7.471 11.716 5.314 1.00 1.00 H new ATOM 0 HH TYR A 84 -8.901 13.392 4.945 1.00 1.00 H new ATOM 615 N HIS A 85 -3.377 8.407 -0.297 1.00 1.00 N ATOM 616 CA HIS A 85 -2.254 7.622 -0.873 1.00 1.00 C ATOM 617 C HIS A 85 -2.276 7.777 -2.395 1.00 1.00 C ATOM 618 O HIS A 85 -2.563 8.838 -2.910 1.00 1.00 O ATOM 619 CB HIS A 85 -2.430 6.150 -0.492 1.00 1.00 C ATOM 620 CG HIS A 85 -3.712 5.632 -1.081 1.00 1.00 C ATOM 621 ND1 HIS A 85 -4.905 5.616 -0.372 1.00 1.00 N ATOM 622 CD2 HIS A 85 -4.007 5.110 -2.313 1.00 1.00 C ATOM 623 CE1 HIS A 85 -5.848 5.099 -1.182 1.00 1.00 C ATOM 624 NE2 HIS A 85 -5.352 4.775 -2.371 1.00 1.00 N ATOM 0 H HIS A 85 -4.295 8.193 -0.687 1.00 1.00 H new ATOM 0 HA HIS A 85 -1.300 7.980 -0.487 1.00 1.00 H new ATOM 0 HB2 HIS A 85 -1.586 5.565 -0.858 1.00 1.00 H new ATOM 0 HB3 HIS A 85 -2.446 6.043 0.593 1.00 1.00 H new ATOM 0 HD1 HIS A 85 -5.042 5.937 0.586 1.00 1.00 H new ATOM 0 HD2 HIS A 85 -3.299 4.979 -3.118 1.00 1.00 H new ATOM 0 HE1 HIS A 85 -6.882 4.964 -0.900 1.00 1.00 H new ATOM 625 N ALA A 86 -1.978 6.738 -3.121 1.00 1.00 N ATOM 626 CA ALA A 86 -1.991 6.849 -4.604 1.00 1.00 C ATOM 627 C ALA A 86 -3.229 6.137 -5.161 1.00 1.00 C ATOM 628 O ALA A 86 -3.128 5.374 -6.094 1.00 1.00 O ATOM 629 CB ALA A 86 -0.741 6.183 -5.174 1.00 1.00 C ATOM 0 H ALA A 86 -1.727 5.820 -2.754 1.00 1.00 H new ATOM 0 HA ALA A 86 -2.012 7.902 -4.885 1.00 1.00 H new ATOM 0 HB1 ALA A 86 -0.749 6.264 -6.261 1.00 1.00 H new ATOM 0 HB2 ALA A 86 0.147 6.678 -4.780 1.00 1.00 H new ATOM 0 HB3 ALA A 86 -0.727 5.131 -4.888 1.00 1.00 H new ATOM 630 N HIS A 87 -4.388 6.365 -4.591 1.00 1.00 N ATOM 631 CA HIS A 87 -5.622 5.678 -5.091 1.00 1.00 C ATOM 632 C HIS A 87 -6.828 6.091 -4.232 1.00 1.00 C ATOM 633 O HIS A 87 -7.395 5.282 -3.524 1.00 1.00 O ATOM 634 CB HIS A 87 -5.442 4.160 -4.974 1.00 1.00 C ATOM 635 CG HIS A 87 -5.000 3.579 -6.290 1.00 1.00 C ATOM 636 ND1 HIS A 87 -4.767 4.145 -7.520 1.00 1.00 N flip ATOM 637 CD2 HIS A 87 -4.732 2.228 -6.439 1.00 1.00 C flip ATOM 638 CE1 HIS A 87 -4.364 3.161 -8.418 1.00 1.00 C flip ATOM 639 NE2 HIS A 87 -4.358 2.026 -7.714 1.00 1.00 N flip ATOM 0 H HIS A 87 -4.533 6.996 -3.803 1.00 1.00 H new ATOM 0 HA HIS A 87 -5.790 5.960 -6.130 1.00 1.00 H new ATOM 0 HB2 HIS A 87 -4.705 3.934 -4.204 1.00 1.00 H new ATOM 0 HB3 HIS A 87 -6.380 3.699 -4.663 1.00 1.00 H new ATOM 0 HD2 HIS A 87 -4.810 1.474 -5.670 1.00 1.00 H new ATOM 0 HE1 HIS A 87 -4.111 3.288 -9.460 1.00 1.00 H new ATOM 0 HE2 HIS A 87 -4.101 1.116 -8.097 1.00 1.00 H new ATOM 640 N ARG A 88 -7.229 7.332 -4.276 1.00 1.00 N ATOM 641 CA ARG A 88 -8.389 7.762 -3.446 1.00 1.00 C ATOM 642 C ARG A 88 -8.897 9.116 -3.948 1.00 1.00 C ATOM 643 O ARG A 88 -8.562 9.548 -5.032 1.00 1.00 O ATOM 644 CB ARG A 88 -7.955 7.885 -1.983 1.00 1.00 C ATOM 645 CG ARG A 88 -6.468 8.221 -1.902 1.00 1.00 C ATOM 646 CD ARG A 88 -6.267 9.695 -2.247 1.00 1.00 C ATOM 647 NE ARG A 88 -5.114 9.844 -3.180 1.00 1.00 N ATOM 648 CZ ARG A 88 -5.277 9.654 -4.462 1.00 1.00 C ATOM 649 NH1 ARG A 88 -6.254 10.239 -5.095 1.00 1.00 N ATOM 650 NH2 ARG A 88 -4.452 8.888 -5.115 1.00 1.00 N ATOM 0 H ARG A 88 -6.806 8.063 -4.848 1.00 1.00 H new ATOM 0 HA ARG A 88 -9.187 7.023 -3.523 1.00 1.00 H new ATOM 0 HB2 ARG A 88 -8.538 8.661 -1.487 1.00 1.00 H new ATOM 0 HB3 ARG A 88 -8.154 6.951 -1.457 1.00 1.00 H new ATOM 0 HG2 ARG A 88 -6.090 8.015 -0.901 1.00 1.00 H new ATOM 0 HG3 ARG A 88 -5.903 7.593 -2.591 1.00 1.00 H new ATOM 0 HD2 ARG A 88 -7.171 10.097 -2.705 1.00 1.00 H new ATOM 0 HD3 ARG A 88 -6.087 10.269 -1.338 1.00 1.00 H new ATOM 0 HE ARG A 88 -4.195 10.095 -2.816 1.00 1.00 H new ATOM 0 HH11 ARG A 88 -6.896 10.849 -4.589 1.00 1.00 H new ATOM 0 HH12 ARG A 88 -6.376 10.087 -6.096 1.00 1.00 H new ATOM 0 HH21 ARG A 88 -3.679 8.437 -4.626 1.00 1.00 H new ATOM 0 HH22 ARG A 88 -4.578 8.739 -6.116 1.00 1.00 H new ATOM 651 N SER A 89 -9.698 9.796 -3.173 1.00 1.00 N ATOM 652 CA SER A 89 -10.203 11.123 -3.619 1.00 1.00 C ATOM 653 C SER A 89 -9.602 12.210 -2.732 1.00 1.00 C ATOM 654 O SER A 89 -10.300 12.963 -2.083 1.00 1.00 O ATOM 655 CB SER A 89 -11.728 11.159 -3.520 1.00 1.00 C ATOM 656 OG SER A 89 -12.278 10.161 -4.370 1.00 1.00 O ATOM 0 H SER A 89 -10.022 9.491 -2.255 1.00 1.00 H new ATOM 0 HA SER A 89 -9.913 11.294 -4.656 1.00 1.00 H new ATOM 0 HB2 SER A 89 -12.041 10.988 -2.490 1.00 1.00 H new ATOM 0 HB3 SER A 89 -12.099 12.143 -3.807 1.00 1.00 H new ATOM 0 HG SER A 89 -13.256 10.181 -4.307 1.00 1.00 H new ATOM 657 N ASP A 90 -8.304 12.289 -2.708 1.00 1.00 N ATOM 658 CA ASP A 90 -7.625 13.322 -1.872 1.00 1.00 C ATOM 659 C ASP A 90 -6.297 13.721 -2.518 1.00 1.00 C ATOM 660 O ASP A 90 -5.851 14.844 -2.386 1.00 1.00 O ATOM 661 CB ASP A 90 -7.359 12.765 -0.473 1.00 1.00 C ATOM 662 CG ASP A 90 -8.455 11.764 -0.100 1.00 1.00 C ATOM 663 OD1 ASP A 90 -8.376 10.633 -0.550 1.00 1.00 O ATOM 664 OD2 ASP A 90 -9.356 12.147 0.629 1.00 1.00 O ATOM 0 H ASP A 90 -7.677 11.680 -3.234 1.00 1.00 H new ATOM 0 HA ASP A 90 -8.271 14.197 -1.798 1.00 1.00 H new ATOM 0 HB2 ASP A 90 -6.384 12.279 -0.444 1.00 1.00 H new ATOM 0 HB3 ASP A 90 -7.332 13.577 0.253 1.00 1.00 H new ATOM 665 N ALA A 91 -5.659 12.823 -3.224 1.00 1.00 N ATOM 666 CA ALA A 91 -4.367 13.186 -3.874 1.00 1.00 C ATOM 667 C ALA A 91 -4.573 14.449 -4.702 1.00 1.00 C ATOM 668 O ALA A 91 -3.644 15.143 -5.038 1.00 1.00 O ATOM 669 CB ALA A 91 -3.906 12.056 -4.791 1.00 1.00 C ATOM 0 H ALA A 91 -5.973 11.865 -3.377 1.00 1.00 H new ATOM 0 HA ALA A 91 -3.610 13.354 -3.108 1.00 1.00 H new ATOM 0 HB1 ALA A 91 -2.962 12.331 -5.261 1.00 1.00 H new ATOM 0 HB2 ALA A 91 -3.769 11.146 -4.207 1.00 1.00 H new ATOM 0 HB3 ALA A 91 -4.658 11.883 -5.561 1.00 1.00 H new ATOM 670 N LEU A 92 -5.791 14.739 -5.044 1.00 1.00 N ATOM 671 CA LEU A 92 -6.074 15.952 -5.861 1.00 1.00 C ATOM 672 C LEU A 92 -5.645 17.218 -5.108 1.00 1.00 C ATOM 673 O LEU A 92 -4.731 17.912 -5.506 1.00 1.00 O ATOM 674 CB LEU A 92 -7.576 16.038 -6.145 1.00 1.00 C ATOM 675 CG LEU A 92 -8.372 15.475 -4.957 1.00 1.00 C ATOM 676 CD1 LEU A 92 -9.478 16.454 -4.564 1.00 1.00 C ATOM 677 CD2 LEU A 92 -8.994 14.131 -5.346 1.00 1.00 C ATOM 0 H LEU A 92 -6.611 14.187 -4.793 1.00 1.00 H new ATOM 0 HA LEU A 92 -5.515 15.879 -6.794 1.00 1.00 H new ATOM 0 HB2 LEU A 92 -7.861 17.075 -6.325 1.00 1.00 H new ATOM 0 HB3 LEU A 92 -7.815 15.480 -7.050 1.00 1.00 H new ATOM 0 HG LEU A 92 -7.700 15.333 -4.111 1.00 1.00 H new ATOM 0 HD11 LEU A 92 -10.039 16.050 -3.721 1.00 1.00 H new ATOM 0 HD12 LEU A 92 -9.035 17.409 -4.281 1.00 1.00 H new ATOM 0 HD13 LEU A 92 -10.150 16.603 -5.409 1.00 1.00 H new ATOM 0 HD21 LEU A 92 -9.558 13.733 -4.502 1.00 1.00 H new ATOM 0 HD22 LEU A 92 -9.662 14.272 -6.195 1.00 1.00 H new ATOM 0 HD23 LEU A 92 -8.205 13.430 -5.618 1.00 1.00 H new ATOM 678 N GLN A 93 -6.324 17.533 -4.040 1.00 1.00 N ATOM 679 CA GLN A 93 -6.003 18.762 -3.263 1.00 1.00 C ATOM 680 C GLN A 93 -4.551 18.745 -2.776 1.00 1.00 C ATOM 681 O GLN A 93 -3.885 19.761 -2.764 1.00 1.00 O ATOM 682 CB GLN A 93 -6.941 18.837 -2.057 1.00 1.00 C ATOM 683 CG GLN A 93 -7.747 20.136 -2.117 1.00 1.00 C ATOM 684 CD GLN A 93 -7.922 20.697 -0.704 1.00 1.00 C ATOM 685 OE1 GLN A 93 -7.295 21.673 -0.344 1.00 1.00 O ATOM 686 NE2 GLN A 93 -8.755 20.117 0.116 1.00 1.00 N ATOM 0 H GLN A 93 -7.098 16.983 -3.668 1.00 1.00 H new ATOM 0 HA GLN A 93 -6.135 19.631 -3.908 1.00 1.00 H new ATOM 0 HB2 GLN A 93 -7.614 17.979 -2.052 1.00 1.00 H new ATOM 0 HB3 GLN A 93 -6.366 18.796 -1.132 1.00 1.00 H new ATOM 0 HG2 GLN A 93 -7.236 20.864 -2.748 1.00 1.00 H new ATOM 0 HG3 GLN A 93 -8.721 19.951 -2.569 1.00 1.00 H new ATOM 0 HE21 GLN A 93 -9.281 19.297 -0.187 1.00 1.00 H new ATOM 0 HE22 GLN A 93 -8.880 20.483 1.060 1.00 1.00 H new ATOM 687 N LEU A 94 -4.057 17.617 -2.352 1.00 1.00 N ATOM 688 CA LEU A 94 -2.657 17.572 -1.844 1.00 1.00 C ATOM 689 C LEU A 94 -1.724 16.982 -2.901 1.00 1.00 C ATOM 690 O LEU A 94 -0.572 16.704 -2.633 1.00 1.00 O ATOM 691 CB LEU A 94 -2.608 16.717 -0.576 1.00 1.00 C ATOM 692 CG LEU A 94 -3.605 17.256 0.461 1.00 1.00 C ATOM 693 CD1 LEU A 94 -3.624 18.786 0.434 1.00 1.00 C ATOM 694 CD2 LEU A 94 -5.008 16.727 0.151 1.00 1.00 C ATOM 0 H LEU A 94 -4.558 16.728 -2.335 1.00 1.00 H new ATOM 0 HA LEU A 94 -2.328 18.586 -1.618 1.00 1.00 H new ATOM 0 HB2 LEU A 94 -2.846 15.681 -0.817 1.00 1.00 H new ATOM 0 HB3 LEU A 94 -1.600 16.724 -0.161 1.00 1.00 H new ATOM 0 HG LEU A 94 -3.296 16.920 1.451 1.00 1.00 H new ATOM 0 HD11 LEU A 94 -4.335 19.154 1.174 1.00 1.00 H new ATOM 0 HD12 LEU A 94 -2.629 19.166 0.666 1.00 1.00 H new ATOM 0 HD13 LEU A 94 -3.922 19.129 -0.557 1.00 1.00 H new ATOM 0 HD21 LEU A 94 -5.713 17.111 0.888 1.00 1.00 H new ATOM 0 HD22 LEU A 94 -5.309 17.055 -0.844 1.00 1.00 H new ATOM 0 HD23 LEU A 94 -5.002 15.638 0.188 1.00 1.00 H new ATOM 695 N GLY A 95 -2.203 16.797 -4.099 1.00 1.00 N ATOM 696 CA GLY A 95 -1.330 16.233 -5.171 1.00 1.00 C ATOM 697 C GLY A 95 -0.471 15.090 -4.614 1.00 1.00 C ATOM 698 O GLY A 95 0.707 15.258 -4.367 1.00 1.00 O ATOM 0 H GLY A 95 -3.159 17.011 -4.384 1.00 1.00 H new ATOM 0 HA2 GLY A 95 -1.944 15.867 -5.994 1.00 1.00 H new ATOM 0 HA3 GLY A 95 -0.688 17.015 -5.575 1.00 1.00 H new ATOM 699 N LEU A 96 -1.038 13.925 -4.434 1.00 1.00 N ATOM 700 CA LEU A 96 -0.229 12.780 -3.917 1.00 1.00 C ATOM 701 C LEU A 96 0.284 11.974 -5.120 1.00 1.00 C ATOM 702 O LEU A 96 1.174 12.406 -5.824 1.00 1.00 O ATOM 703 CB LEU A 96 -1.090 11.884 -3.012 1.00 1.00 C ATOM 704 CG LEU A 96 -1.513 12.650 -1.750 1.00 1.00 C ATOM 705 CD1 LEU A 96 -2.779 12.018 -1.168 1.00 1.00 C ATOM 706 CD2 LEU A 96 -0.408 12.581 -0.695 1.00 1.00 C ATOM 0 H LEU A 96 -2.019 13.717 -4.621 1.00 1.00 H new ATOM 0 HA LEU A 96 0.609 13.152 -3.327 1.00 1.00 H new ATOM 0 HB2 LEU A 96 -1.973 11.549 -3.555 1.00 1.00 H new ATOM 0 HB3 LEU A 96 -0.530 10.992 -2.733 1.00 1.00 H new ATOM 0 HG LEU A 96 -1.698 13.690 -2.020 1.00 1.00 H new ATOM 0 HD11 LEU A 96 -3.079 12.562 -0.272 1.00 1.00 H new ATOM 0 HD12 LEU A 96 -3.580 12.064 -1.905 1.00 1.00 H new ATOM 0 HD13 LEU A 96 -2.581 10.977 -0.911 1.00 1.00 H new ATOM 0 HD21 LEU A 96 -0.720 13.128 0.195 1.00 1.00 H new ATOM 0 HD22 LEU A 96 -0.219 11.540 -0.434 1.00 1.00 H new ATOM 0 HD23 LEU A 96 0.504 13.026 -1.093 1.00 1.00 H new ATOM 707 N GLY A 97 -0.275 10.820 -5.381 1.00 1.00 N ATOM 708 CA GLY A 97 0.189 10.022 -6.553 1.00 1.00 C ATOM 709 C GLY A 97 1.146 8.922 -6.091 1.00 1.00 C ATOM 710 O GLY A 97 0.866 8.190 -5.164 1.00 1.00 O ATOM 0 H GLY A 97 -1.028 10.399 -4.837 1.00 1.00 H new ATOM 0 HA2 GLY A 97 -0.666 9.580 -7.064 1.00 1.00 H new ATOM 0 HA3 GLY A 97 0.689 10.672 -7.271 1.00 1.00 H new ATOM 711 N LYS A 98 2.275 8.797 -6.737 1.00 1.00 N ATOM 712 CA LYS A 98 3.252 7.743 -6.343 1.00 1.00 C ATOM 713 C LYS A 98 4.597 8.394 -6.017 1.00 1.00 C ATOM 714 O LYS A 98 5.356 8.748 -6.896 1.00 1.00 O ATOM 715 CB LYS A 98 3.432 6.757 -7.498 1.00 1.00 C ATOM 716 CG LYS A 98 3.432 7.520 -8.824 1.00 1.00 C ATOM 717 CD LYS A 98 3.728 6.553 -9.971 1.00 1.00 C ATOM 718 CE LYS A 98 4.093 7.347 -11.226 1.00 1.00 C ATOM 719 NZ LYS A 98 3.256 6.883 -12.369 1.00 1.00 N ATOM 0 H LYS A 98 2.562 9.381 -7.522 1.00 1.00 H new ATOM 0 HA LYS A 98 2.881 7.212 -5.466 1.00 1.00 H new ATOM 0 HB2 LYS A 98 4.367 6.210 -7.381 1.00 1.00 H new ATOM 0 HB3 LYS A 98 2.629 6.020 -7.490 1.00 1.00 H new ATOM 0 HG2 LYS A 98 2.466 8.000 -8.979 1.00 1.00 H new ATOM 0 HG3 LYS A 98 4.181 8.312 -8.800 1.00 1.00 H new ATOM 0 HD2 LYS A 98 4.547 5.888 -9.698 1.00 1.00 H new ATOM 0 HD3 LYS A 98 2.858 5.925 -10.165 1.00 1.00 H new ATOM 0 HE2 LYS A 98 3.935 8.412 -11.054 1.00 1.00 H new ATOM 0 HE3 LYS A 98 5.150 7.215 -11.458 1.00 1.00 H new ATOM 0 HZ1 LYS A 98 3.504 7.423 -13.223 1.00 1.00 H new ATOM 0 HZ2 LYS A 98 3.428 5.871 -12.537 1.00 1.00 H new ATOM 0 HZ3 LYS A 98 2.251 7.031 -12.146 1.00 1.00 H new ATOM 720 N HIS A 99 4.896 8.551 -4.759 1.00 1.00 N ATOM 721 CA HIS A 99 6.191 9.176 -4.371 1.00 1.00 C ATOM 722 C HIS A 99 6.344 9.125 -2.850 1.00 1.00 C ATOM 723 O HIS A 99 5.601 8.452 -2.164 1.00 1.00 O ATOM 724 CB HIS A 99 6.217 10.634 -4.834 1.00 1.00 C ATOM 725 CG HIS A 99 4.936 11.302 -4.429 1.00 1.00 C ATOM 726 ND1 HIS A 99 4.902 12.374 -3.552 1.00 1.00 N ATOM 727 CD2 HIS A 99 3.634 11.048 -4.763 1.00 1.00 C ATOM 728 CE1 HIS A 99 3.612 12.721 -3.387 1.00 1.00 C ATOM 729 NE2 HIS A 99 2.797 11.944 -4.105 1.00 1.00 N ATOM 0 H HIS A 99 4.298 8.273 -3.980 1.00 1.00 H new ATOM 0 HA HIS A 99 7.010 8.632 -4.841 1.00 1.00 H new ATOM 0 HB2 HIS A 99 7.068 11.153 -4.392 1.00 1.00 H new ATOM 0 HB3 HIS A 99 6.340 10.683 -5.916 1.00 1.00 H new ATOM 0 HD1 HIS A 99 5.707 12.819 -3.112 1.00 1.00 H new ATOM 0 HD2 HIS A 99 3.305 10.270 -5.436 1.00 1.00 H new ATOM 0 HE1 HIS A 99 3.277 13.528 -2.752 1.00 1.00 H new ATOM 730 N ASN A 100 7.300 9.834 -2.317 1.00 1.00 N ATOM 731 CA ASN A 100 7.498 9.831 -0.841 1.00 1.00 C ATOM 732 C ASN A 100 7.779 11.258 -0.369 1.00 1.00 C ATOM 733 O ASN A 100 8.906 11.622 -0.098 1.00 1.00 O ATOM 734 CB ASN A 100 8.682 8.929 -0.486 1.00 1.00 C ATOM 735 CG ASN A 100 9.961 9.496 -1.104 1.00 1.00 C ATOM 736 OD1 ASN A 100 10.714 10.186 -0.446 1.00 1.00 O ATOM 737 ND2 ASN A 100 10.241 9.233 -2.352 1.00 1.00 N ATOM 0 H ASN A 100 7.954 10.416 -2.841 1.00 1.00 H new ATOM 0 HA ASN A 100 6.600 9.455 -0.351 1.00 1.00 H new ATOM 0 HB2 ASN A 100 8.788 8.860 0.597 1.00 1.00 H new ATOM 0 HB3 ASN A 100 8.505 7.918 -0.854 1.00 1.00 H new ATOM 0 HD21 ASN A 100 11.091 9.607 -2.774 1.00 1.00 H new ATOM 0 HD22 ASN A 100 9.609 8.654 -2.905 1.00 1.00 H new ATOM 738 N TYR A 101 6.763 12.072 -0.274 1.00 1.00 N ATOM 739 CA TYR A 101 6.972 13.477 0.173 1.00 1.00 C ATOM 740 C TYR A 101 6.035 13.791 1.341 1.00 1.00 C ATOM 741 O TYR A 101 5.279 12.950 1.787 1.00 1.00 O ATOM 742 CB TYR A 101 6.673 14.426 -0.989 1.00 1.00 C ATOM 743 CG TYR A 101 7.965 14.806 -1.672 1.00 1.00 C ATOM 744 CD1 TYR A 101 8.730 13.825 -2.316 1.00 1.00 C ATOM 745 CD2 TYR A 101 8.399 16.138 -1.661 1.00 1.00 C ATOM 746 CE1 TYR A 101 9.930 14.176 -2.950 1.00 1.00 C ATOM 747 CE2 TYR A 101 9.598 16.489 -2.295 1.00 1.00 C ATOM 748 CZ TYR A 101 10.364 15.508 -2.939 1.00 1.00 C ATOM 749 OH TYR A 101 11.545 15.854 -3.563 1.00 1.00 O ATOM 0 H TYR A 101 5.797 11.824 -0.487 1.00 1.00 H new ATOM 0 HA TYR A 101 8.005 13.605 0.496 1.00 1.00 H new ATOM 0 HB2 TYR A 101 6.000 13.947 -1.700 1.00 1.00 H new ATOM 0 HB3 TYR A 101 6.166 15.319 -0.623 1.00 1.00 H new ATOM 0 HD1 TYR A 101 8.395 12.798 -2.324 1.00 1.00 H new ATOM 0 HD2 TYR A 101 7.809 16.894 -1.164 1.00 1.00 H new ATOM 0 HE1 TYR A 101 10.520 13.420 -3.447 1.00 1.00 H new ATOM 0 HE2 TYR A 101 9.932 17.516 -2.287 1.00 1.00 H new ATOM 0 HH TYR A 101 11.698 16.817 -3.462 1.00 1.00 H new ATOM 750 N CYS A 102 6.076 14.997 1.839 1.00 1.00 N ATOM 751 CA CYS A 102 5.185 15.364 2.975 1.00 1.00 C ATOM 752 C CYS A 102 3.956 16.099 2.436 1.00 1.00 C ATOM 753 O CYS A 102 3.834 16.336 1.251 1.00 1.00 O ATOM 754 CB CYS A 102 5.941 16.269 3.950 1.00 1.00 C ATOM 755 SG CYS A 102 7.258 15.321 4.754 1.00 1.00 S ATOM 0 H CYS A 102 6.688 15.743 1.508 1.00 1.00 H new ATOM 0 HA CYS A 102 4.869 14.461 3.497 1.00 1.00 H new ATOM 0 HB2 CYS A 102 6.364 17.121 3.418 1.00 1.00 H new ATOM 0 HB3 CYS A 102 5.256 16.668 4.698 1.00 1.00 H new ATOM 756 N ARG A 103 3.039 16.452 3.294 1.00 1.00 N ATOM 757 CA ARG A 103 1.812 17.160 2.827 1.00 1.00 C ATOM 758 C ARG A 103 0.877 17.383 4.020 1.00 1.00 C ATOM 759 O ARG A 103 1.281 17.261 5.159 1.00 1.00 O ATOM 760 CB ARG A 103 1.113 16.298 1.771 1.00 1.00 C ATOM 761 CG ARG A 103 1.282 14.819 2.128 1.00 1.00 C ATOM 762 CD ARG A 103 0.898 14.606 3.594 1.00 1.00 C ATOM 763 NE ARG A 103 0.522 13.184 3.812 1.00 1.00 N ATOM 764 CZ ARG A 103 -0.502 12.675 3.182 1.00 1.00 C ATOM 765 NH1 ARG A 103 -1.223 13.420 2.390 1.00 1.00 N ATOM 766 NH2 ARG A 103 -0.815 11.423 3.359 1.00 1.00 N ATOM 0 H ARG A 103 3.086 16.281 4.299 1.00 1.00 H new ATOM 0 HA ARG A 103 2.076 18.124 2.392 1.00 1.00 H new ATOM 0 HB2 ARG A 103 0.054 16.553 1.721 1.00 1.00 H new ATOM 0 HB3 ARG A 103 1.536 16.496 0.786 1.00 1.00 H new ATOM 0 HG2 ARG A 103 0.655 14.203 1.483 1.00 1.00 H new ATOM 0 HG3 ARG A 103 2.313 14.508 1.961 1.00 1.00 H new ATOM 0 HD2 ARG A 103 1.733 14.875 4.241 1.00 1.00 H new ATOM 0 HD3 ARG A 103 0.066 15.257 3.860 1.00 1.00 H new ATOM 0 HE ARG A 103 1.064 12.606 4.454 1.00 1.00 H new ATOM 0 HH11 ARG A 103 -0.987 14.404 2.261 1.00 1.00 H new ATOM 0 HH12 ARG A 103 -2.022 13.018 1.900 1.00 1.00 H new ATOM 0 HH21 ARG A 103 -0.261 10.843 3.989 1.00 1.00 H new ATOM 0 HH22 ARG A 103 -1.615 11.023 2.868 1.00 1.00 H new ATOM 767 N ASN A 104 -0.370 17.702 3.780 1.00 1.00 N ATOM 768 CA ASN A 104 -1.305 17.919 4.922 1.00 1.00 C ATOM 769 C ASN A 104 -2.754 18.021 4.421 1.00 1.00 C ATOM 770 O ASN A 104 -3.378 19.053 4.556 1.00 1.00 O ATOM 771 CB ASN A 104 -0.928 19.215 5.642 1.00 1.00 C ATOM 772 CG ASN A 104 -0.771 18.935 7.135 1.00 1.00 C ATOM 773 OD1 ASN A 104 0.044 19.545 7.799 1.00 1.00 O ATOM 774 ND2 ASN A 104 -1.524 18.029 7.696 1.00 1.00 N ATOM 0 H ASN A 104 -0.777 17.820 2.852 1.00 1.00 H new ATOM 0 HA ASN A 104 -1.228 17.073 5.606 1.00 1.00 H new ATOM 0 HB2 ASN A 104 0.001 19.613 5.235 1.00 1.00 H new ATOM 0 HB3 ASN A 104 -1.696 19.971 5.481 1.00 1.00 H new ATOM 0 HD21 ASN A 104 -1.429 17.832 8.692 1.00 1.00 H new ATOM 0 HD22 ASN A 104 -2.208 17.517 7.138 1.00 1.00 H new ATOM 775 N PRO A 105 -3.250 16.944 3.863 1.00 1.00 N ATOM 776 CA PRO A 105 -4.618 16.893 3.357 1.00 1.00 C ATOM 777 C PRO A 105 -5.634 17.268 4.448 1.00 1.00 C ATOM 778 O PRO A 105 -6.792 17.501 4.164 1.00 1.00 O ATOM 779 CB PRO A 105 -4.820 15.437 2.942 1.00 1.00 C ATOM 780 CG PRO A 105 -3.374 14.916 2.696 1.00 1.00 C ATOM 781 CD PRO A 105 -2.468 15.712 3.675 1.00 1.00 C ATOM 0 HA PRO A 105 -4.768 17.597 2.538 1.00 1.00 H new ATOM 0 HB2 PRO A 105 -5.324 14.865 3.721 1.00 1.00 H new ATOM 0 HB3 PRO A 105 -5.432 15.359 2.043 1.00 1.00 H new ATOM 0 HG2 PRO A 105 -3.307 13.844 2.884 1.00 1.00 H new ATOM 0 HG3 PRO A 105 -3.070 15.078 1.662 1.00 1.00 H new ATOM 0 HD2 PRO A 105 -2.310 15.179 4.613 1.00 1.00 H new ATOM 0 HD3 PRO A 105 -1.483 15.912 3.252 1.00 1.00 H new ATOM 782 N ASP A 106 -5.230 17.311 5.693 1.00 1.00 N ATOM 783 CA ASP A 106 -6.211 17.651 6.769 1.00 1.00 C ATOM 784 C ASP A 106 -5.656 18.742 7.692 1.00 1.00 C ATOM 785 O ASP A 106 -6.148 18.945 8.784 1.00 1.00 O ATOM 786 CB ASP A 106 -6.508 16.398 7.594 1.00 1.00 C ATOM 787 CG ASP A 106 -7.869 16.547 8.277 1.00 1.00 C ATOM 788 OD1 ASP A 106 -8.868 16.509 7.578 1.00 1.00 O ATOM 789 OD2 ASP A 106 -7.889 16.697 9.488 1.00 1.00 O ATOM 0 H ASP A 106 -4.277 17.128 6.008 1.00 1.00 H new ATOM 0 HA ASP A 106 -7.123 18.022 6.302 1.00 1.00 H new ATOM 0 HB2 ASP A 106 -6.506 15.518 6.951 1.00 1.00 H new ATOM 0 HB3 ASP A 106 -5.729 16.249 8.341 1.00 1.00 H new ATOM 790 N ASN A 107 -4.646 19.449 7.268 1.00 1.00 N ATOM 791 CA ASN A 107 -4.076 20.528 8.127 1.00 1.00 C ATOM 792 C ASN A 107 -3.228 19.908 9.242 1.00 1.00 C ATOM 793 O ASN A 107 -2.017 19.878 9.169 1.00 1.00 O ATOM 794 CB ASN A 107 -5.214 21.343 8.746 1.00 1.00 C ATOM 795 CG ASN A 107 -5.027 22.823 8.405 1.00 1.00 C ATOM 796 OD1 ASN A 107 -4.148 23.474 8.934 1.00 1.00 O ATOM 797 ND2 ASN A 107 -5.822 23.386 7.538 1.00 1.00 N ATOM 0 H ASN A 107 -4.189 19.327 6.364 1.00 1.00 H new ATOM 0 HA ASN A 107 -3.450 21.180 7.518 1.00 1.00 H new ATOM 0 HB2 ASN A 107 -6.174 20.991 8.369 1.00 1.00 H new ATOM 0 HB3 ASN A 107 -5.226 21.207 9.827 1.00 1.00 H new ATOM 0 HD21 ASN A 107 -5.706 24.372 7.304 1.00 1.00 H new ATOM 0 HD22 ASN A 107 -6.560 22.840 7.093 1.00 1.00 H new ATOM 798 N ARG A 108 -3.855 19.418 10.277 1.00 1.00 N ATOM 799 CA ARG A 108 -3.084 18.802 11.395 1.00 1.00 C ATOM 800 C ARG A 108 -2.032 19.787 11.913 1.00 1.00 C ATOM 801 O ARG A 108 -1.108 19.405 12.603 1.00 1.00 O ATOM 802 CB ARG A 108 -2.385 17.539 10.894 1.00 1.00 C ATOM 803 CG ARG A 108 -2.437 16.463 11.978 1.00 1.00 C ATOM 804 CD ARG A 108 -2.721 15.108 11.333 1.00 1.00 C ATOM 805 NE ARG A 108 -1.772 14.092 11.869 1.00 1.00 N ATOM 806 CZ ARG A 108 -2.166 13.254 12.790 1.00 1.00 C ATOM 807 NH1 ARG A 108 -3.051 12.340 12.503 1.00 1.00 N ATOM 808 NH2 ARG A 108 -1.675 13.332 13.996 1.00 1.00 N ATOM 0 H ARG A 108 -4.868 19.418 10.397 1.00 1.00 H new ATOM 0 HA ARG A 108 -3.770 18.551 12.204 1.00 1.00 H new ATOM 0 HB2 ARG A 108 -2.869 17.179 9.986 1.00 1.00 H new ATOM 0 HB3 ARG A 108 -1.349 17.761 10.637 1.00 1.00 H new ATOM 0 HG2 ARG A 108 -1.491 16.430 12.519 1.00 1.00 H new ATOM 0 HG3 ARG A 108 -3.212 16.701 12.706 1.00 1.00 H new ATOM 0 HD2 ARG A 108 -3.748 14.805 11.537 1.00 1.00 H new ATOM 0 HD3 ARG A 108 -2.619 15.181 10.250 1.00 1.00 H new ATOM 0 HE ARG A 108 -0.816 14.051 11.517 1.00 1.00 H new ATOM 0 HH11 ARG A 108 -3.435 12.280 11.560 1.00 1.00 H new ATOM 0 HH12 ARG A 108 -3.359 11.685 13.222 1.00 1.00 H new ATOM 0 HH21 ARG A 108 -0.983 14.048 14.220 1.00 1.00 H new ATOM 0 HH22 ARG A 108 -1.983 12.678 14.715 1.00 1.00 H new ATOM 809 N ARG A 109 -2.159 21.047 11.585 1.00 1.00 N ATOM 810 CA ARG A 109 -1.157 22.046 12.059 1.00 1.00 C ATOM 811 C ARG A 109 0.249 21.454 11.936 1.00 1.00 C ATOM 812 O ARG A 109 1.148 21.805 12.674 1.00 1.00 O ATOM 813 CB ARG A 109 -1.438 22.399 13.521 1.00 1.00 C ATOM 814 CG ARG A 109 -1.006 23.842 13.790 1.00 1.00 C ATOM 815 CD ARG A 109 -1.741 24.376 15.022 1.00 1.00 C ATOM 816 NE ARG A 109 -3.121 24.787 14.638 1.00 1.00 N ATOM 817 CZ ARG A 109 -3.326 25.405 13.507 1.00 1.00 C ATOM 818 NH1 ARG A 109 -3.477 24.719 12.407 1.00 1.00 N ATOM 819 NH2 ARG A 109 -3.381 26.708 13.475 1.00 1.00 N ATOM 0 H ARG A 109 -2.912 21.426 11.011 1.00 1.00 H new ATOM 0 HA ARG A 109 -1.226 22.947 11.450 1.00 1.00 H new ATOM 0 HB2 ARG A 109 -2.500 22.280 13.737 1.00 1.00 H new ATOM 0 HB3 ARG A 109 -0.900 21.718 14.180 1.00 1.00 H new ATOM 0 HG2 ARG A 109 0.071 23.886 13.949 1.00 1.00 H new ATOM 0 HG3 ARG A 109 -1.226 24.466 12.924 1.00 1.00 H new ATOM 0 HD2 ARG A 109 -1.780 23.609 15.796 1.00 1.00 H new ATOM 0 HD3 ARG A 109 -1.201 25.225 15.441 1.00 1.00 H new ATOM 0 HE ARG A 109 -3.905 24.585 15.259 1.00 1.00 H new ATOM 0 HH11 ARG A 109 -3.435 23.700 12.431 1.00 1.00 H new ATOM 0 HH12 ARG A 109 -3.637 25.202 11.523 1.00 1.00 H new ATOM 0 HH21 ARG A 109 -3.264 27.245 14.334 1.00 1.00 H new ATOM 0 HH22 ARG A 109 -3.541 27.190 12.591 1.00 1.00 H new ATOM 820 N ARG A 110 0.442 20.552 11.012 1.00 1.00 N ATOM 821 CA ARG A 110 1.785 19.931 10.844 1.00 1.00 C ATOM 822 C ARG A 110 1.695 18.802 9.807 1.00 1.00 C ATOM 823 O ARG A 110 1.062 17.795 10.054 1.00 1.00 O ATOM 824 CB ARG A 110 2.243 19.350 12.183 1.00 1.00 C ATOM 825 CG ARG A 110 3.511 20.069 12.645 1.00 1.00 C ATOM 826 CD ARG A 110 4.191 19.249 13.742 1.00 1.00 C ATOM 827 NE ARG A 110 4.529 20.139 14.888 1.00 1.00 N ATOM 828 CZ ARG A 110 5.267 19.691 15.866 1.00 1.00 C ATOM 829 NH1 ARG A 110 5.052 18.499 16.352 1.00 1.00 N ATOM 830 NH2 ARG A 110 6.219 20.434 16.359 1.00 1.00 N ATOM 0 H ARG A 110 -0.274 20.219 10.366 1.00 1.00 H new ATOM 0 HA ARG A 110 2.498 20.684 10.507 1.00 1.00 H new ATOM 0 HB2 ARG A 110 1.456 19.463 12.929 1.00 1.00 H new ATOM 0 HB3 ARG A 110 2.435 18.282 12.081 1.00 1.00 H new ATOM 0 HG2 ARG A 110 4.191 20.206 11.804 1.00 1.00 H new ATOM 0 HG3 ARG A 110 3.263 21.062 13.019 1.00 1.00 H new ATOM 0 HD2 ARG A 110 3.532 18.446 14.073 1.00 1.00 H new ATOM 0 HD3 ARG A 110 5.095 18.780 13.353 1.00 1.00 H new ATOM 0 HE ARG A 110 4.183 21.098 14.908 1.00 1.00 H new ATOM 0 HH11 ARG A 110 4.307 17.918 15.967 1.00 1.00 H new ATOM 0 HH12 ARG A 110 5.629 18.148 17.117 1.00 1.00 H new ATOM 0 HH21 ARG A 110 6.387 21.366 15.980 1.00 1.00 H new ATOM 0 HH22 ARG A 110 6.796 20.083 17.124 1.00 1.00 H new ATOM 831 N PRO A 111 2.329 18.998 8.675 1.00 1.00 N ATOM 832 CA PRO A 111 2.319 18.005 7.610 1.00 1.00 C ATOM 833 C PRO A 111 2.681 16.624 8.165 1.00 1.00 C ATOM 834 O PRO A 111 3.556 16.491 8.994 1.00 1.00 O ATOM 835 CB PRO A 111 3.381 18.486 6.628 1.00 1.00 C ATOM 836 CG PRO A 111 3.441 20.025 6.881 1.00 1.00 C ATOM 837 CD PRO A 111 3.095 20.220 8.385 1.00 1.00 C ATOM 0 HA PRO A 111 1.340 17.905 7.142 1.00 1.00 H new ATOM 0 HB2 PRO A 111 4.344 18.011 6.814 1.00 1.00 H new ATOM 0 HB3 PRO A 111 3.107 18.259 5.598 1.00 1.00 H new ATOM 0 HG2 PRO A 111 4.431 20.421 6.653 1.00 1.00 H new ATOM 0 HG3 PRO A 111 2.732 20.554 6.245 1.00 1.00 H new ATOM 0 HD2 PRO A 111 3.989 20.299 9.004 1.00 1.00 H new ATOM 0 HD3 PRO A 111 2.507 21.122 8.556 1.00 1.00 H new ATOM 838 N TRP A 112 2.014 15.599 7.706 1.00 1.00 N ATOM 839 CA TRP A 112 2.313 14.221 8.195 1.00 1.00 C ATOM 840 C TRP A 112 2.447 13.284 6.994 1.00 1.00 C ATOM 841 O TRP A 112 2.169 13.659 5.874 1.00 1.00 O ATOM 842 CB TRP A 112 1.172 13.737 9.087 1.00 1.00 C ATOM 843 CG TRP A 112 -0.131 14.117 8.467 1.00 1.00 C ATOM 844 CD1 TRP A 112 -0.820 15.245 8.747 1.00 1.00 C ATOM 845 CD2 TRP A 112 -0.910 13.396 7.469 1.00 1.00 C ATOM 846 NE1 TRP A 112 -1.977 15.261 7.990 1.00 1.00 N ATOM 847 CE2 TRP A 112 -2.077 14.145 7.185 1.00 1.00 C ATOM 848 CE3 TRP A 112 -0.721 12.177 6.791 1.00 1.00 C ATOM 849 CZ2 TRP A 112 -3.023 13.699 6.260 1.00 1.00 C ATOM 850 CZ3 TRP A 112 -1.671 11.725 5.860 1.00 1.00 C ATOM 851 CH2 TRP A 112 -2.820 12.486 5.595 1.00 1.00 C ATOM 0 H TRP A 112 1.271 15.657 7.010 1.00 1.00 H new ATOM 0 HA TRP A 112 3.241 14.228 8.766 1.00 1.00 H new ATOM 0 HB2 TRP A 112 1.227 12.656 9.213 1.00 1.00 H new ATOM 0 HB3 TRP A 112 1.258 14.178 10.080 1.00 1.00 H new ATOM 0 HD1 TRP A 112 -0.517 16.009 9.447 1.00 1.00 H new ATOM 0 HE1 TRP A 112 -2.672 16.007 8.023 1.00 1.00 H new ATOM 0 HE3 TRP A 112 0.161 11.585 6.988 1.00 1.00 H new ATOM 0 HZ2 TRP A 112 -3.906 14.287 6.059 1.00 1.00 H new ATOM 0 HZ3 TRP A 112 -1.516 10.788 5.346 1.00 1.00 H new ATOM 0 HH2 TRP A 112 -3.547 12.135 4.878 1.00 1.00 H new ATOM 852 N CYS A 113 2.869 12.070 7.211 1.00 1.00 N ATOM 853 CA CYS A 113 3.013 11.126 6.066 1.00 1.00 C ATOM 854 C CYS A 113 2.655 9.706 6.514 1.00 1.00 C ATOM 855 O CYS A 113 2.884 9.328 7.643 1.00 1.00 O ATOM 856 CB CYS A 113 4.457 11.151 5.569 1.00 1.00 C ATOM 857 SG CYS A 113 5.476 10.097 6.628 1.00 1.00 S ATOM 0 H CYS A 113 3.119 11.691 8.125 1.00 1.00 H new ATOM 0 HA CYS A 113 2.341 11.429 5.263 1.00 1.00 H new ATOM 0 HB2 CYS A 113 4.504 10.802 4.537 1.00 1.00 H new ATOM 0 HB3 CYS A 113 4.839 12.172 5.578 1.00 1.00 H new ATOM 858 N TYR A 114 2.101 8.918 5.630 1.00 1.00 N ATOM 859 CA TYR A 114 1.731 7.517 5.991 1.00 1.00 C ATOM 860 C TYR A 114 3.003 6.684 6.173 1.00 1.00 C ATOM 861 O TYR A 114 3.418 5.970 5.283 1.00 1.00 O ATOM 862 CB TYR A 114 0.883 6.912 4.868 1.00 1.00 C ATOM 863 CG TYR A 114 -0.540 7.409 4.982 1.00 1.00 C ATOM 864 CD1 TYR A 114 -1.174 7.440 6.233 1.00 1.00 C ATOM 865 CD2 TYR A 114 -1.226 7.836 3.839 1.00 1.00 C ATOM 866 CE1 TYR A 114 -2.494 7.899 6.338 1.00 1.00 C ATOM 867 CE2 TYR A 114 -2.545 8.295 3.944 1.00 1.00 C ATOM 868 CZ TYR A 114 -3.179 8.327 5.193 1.00 1.00 C ATOM 869 OH TYR A 114 -4.479 8.779 5.296 1.00 1.00 O ATOM 0 H TYR A 114 1.888 9.186 4.669 1.00 1.00 H new ATOM 0 HA TYR A 114 1.161 7.518 6.920 1.00 1.00 H new ATOM 0 HB2 TYR A 114 1.298 7.186 3.898 1.00 1.00 H new ATOM 0 HB3 TYR A 114 0.905 5.824 4.928 1.00 1.00 H new ATOM 0 HD1 TYR A 114 -0.645 7.110 7.115 1.00 1.00 H new ATOM 0 HD2 TYR A 114 -0.738 7.811 2.876 1.00 1.00 H new ATOM 0 HE1 TYR A 114 -2.983 7.923 7.301 1.00 1.00 H new ATOM 0 HE2 TYR A 114 -3.074 8.624 3.062 1.00 1.00 H new ATOM 0 HH TYR A 114 -4.616 9.184 6.178 1.00 1.00 H new ATOM 870 N VAL A 115 3.621 6.762 7.322 1.00 1.00 N ATOM 871 CA VAL A 115 4.858 5.966 7.557 1.00 1.00 C ATOM 872 C VAL A 115 4.511 4.772 8.449 1.00 1.00 C ATOM 873 O VAL A 115 3.854 4.907 9.461 1.00 1.00 O ATOM 874 CB VAL A 115 5.923 6.848 8.227 1.00 1.00 C ATOM 875 CG1 VAL A 115 5.255 7.805 9.213 1.00 1.00 C ATOM 876 CG2 VAL A 115 6.938 5.974 8.974 1.00 1.00 C ATOM 0 H VAL A 115 3.322 7.342 8.106 1.00 1.00 H new ATOM 0 HA VAL A 115 5.258 5.605 6.610 1.00 1.00 H new ATOM 0 HB VAL A 115 6.441 7.420 7.457 1.00 1.00 H new ATOM 0 HG11 VAL A 115 6.014 8.428 9.686 1.00 1.00 H new ATOM 0 HG12 VAL A 115 4.545 8.438 8.681 1.00 1.00 H new ATOM 0 HG13 VAL A 115 4.729 7.232 9.977 1.00 1.00 H new ATOM 0 HG21 VAL A 115 7.688 6.609 9.445 1.00 1.00 H new ATOM 0 HG22 VAL A 115 6.424 5.392 9.739 1.00 1.00 H new ATOM 0 HG23 VAL A 115 7.425 5.299 8.270 1.00 1.00 H new ATOM 877 N GLN A 116 4.941 3.604 8.069 1.00 1.00 N ATOM 878 CA GLN A 116 4.632 2.390 8.875 1.00 1.00 C ATOM 879 C GLN A 116 4.991 2.628 10.344 1.00 1.00 C ATOM 880 O GLN A 116 6.101 2.998 10.673 1.00 1.00 O ATOM 881 CB GLN A 116 5.436 1.206 8.332 1.00 1.00 C ATOM 882 CG GLN A 116 4.477 0.144 7.791 1.00 1.00 C ATOM 883 CD GLN A 116 5.054 -1.248 8.054 1.00 1.00 C ATOM 884 OE1 GLN A 116 5.793 -1.775 7.246 1.00 1.00 O ATOM 885 NE2 GLN A 116 4.746 -1.871 9.159 1.00 1.00 N ATOM 0 H GLN A 116 5.496 3.436 7.230 1.00 1.00 H new ATOM 0 HA GLN A 116 3.566 2.173 8.805 1.00 1.00 H new ATOM 0 HB2 GLN A 116 6.108 1.541 7.542 1.00 1.00 H new ATOM 0 HB3 GLN A 116 6.057 0.782 9.121 1.00 1.00 H new ATOM 0 HG2 GLN A 116 3.503 0.241 8.270 1.00 1.00 H new ATOM 0 HG3 GLN A 116 4.323 0.289 6.722 1.00 1.00 H new ATOM 0 HE21 GLN A 116 4.126 -1.429 9.838 1.00 1.00 H new ATOM 0 HE22 GLN A 116 5.126 -2.800 9.344 1.00 1.00 H new ATOM 886 N VAL A 117 4.057 2.404 11.229 1.00 1.00 N ATOM 887 CA VAL A 117 4.333 2.599 12.680 1.00 1.00 C ATOM 888 C VAL A 117 4.733 1.256 13.283 1.00 1.00 C ATOM 889 O VAL A 117 4.637 1.039 14.475 1.00 1.00 O ATOM 890 CB VAL A 117 3.073 3.119 13.381 1.00 1.00 C ATOM 891 CG1 VAL A 117 2.050 1.988 13.512 1.00 1.00 C ATOM 892 CG2 VAL A 117 3.442 3.632 14.775 1.00 1.00 C ATOM 0 H VAL A 117 3.111 2.093 11.007 1.00 1.00 H new ATOM 0 HA VAL A 117 5.137 3.324 12.811 1.00 1.00 H new ATOM 0 HB VAL A 117 2.642 3.929 12.793 1.00 1.00 H new ATOM 0 HG11 VAL A 117 1.156 2.362 14.011 1.00 1.00 H new ATOM 0 HG12 VAL A 117 1.785 1.620 12.521 1.00 1.00 H new ATOM 0 HG13 VAL A 117 2.479 1.175 14.098 1.00 1.00 H new ATOM 0 HG21 VAL A 117 2.547 4.002 15.275 1.00 1.00 H new ATOM 0 HG22 VAL A 117 3.874 2.820 15.359 1.00 1.00 H new ATOM 0 HG23 VAL A 117 4.168 4.440 14.685 1.00 1.00 H new ATOM 893 N GLY A 118 5.172 0.351 12.459 1.00 1.00 N ATOM 894 CA GLY A 118 5.572 -0.990 12.962 1.00 1.00 C ATOM 895 C GLY A 118 4.592 -2.036 12.434 1.00 1.00 C ATOM 896 O GLY A 118 4.954 -3.167 12.177 1.00 1.00 O ATOM 0 H GLY A 118 5.272 0.482 11.452 1.00 1.00 H new ATOM 0 HA2 GLY A 118 6.585 -1.226 12.637 1.00 1.00 H new ATOM 0 HA3 GLY A 118 5.577 -0.996 14.052 1.00 1.00 H new ATOM 897 N LEU A 119 3.352 -1.667 12.270 1.00 1.00 N ATOM 898 CA LEU A 119 2.351 -2.646 11.758 1.00 1.00 C ATOM 899 C LEU A 119 1.301 -1.957 10.866 1.00 1.00 C ATOM 900 O LEU A 119 0.623 -2.607 10.095 1.00 1.00 O ATOM 901 CB LEU A 119 1.691 -3.380 12.941 1.00 1.00 C ATOM 902 CG LEU A 119 0.776 -2.453 13.753 1.00 1.00 C ATOM 903 CD1 LEU A 119 1.496 -1.149 14.108 1.00 1.00 C ATOM 904 CD2 LEU A 119 -0.477 -2.146 12.942 1.00 1.00 C ATOM 0 H LEU A 119 2.989 -0.734 12.467 1.00 1.00 H new ATOM 0 HA LEU A 119 2.864 -3.380 11.136 1.00 1.00 H new ATOM 0 HB2 LEU A 119 1.112 -4.224 12.567 1.00 1.00 H new ATOM 0 HB3 LEU A 119 2.464 -3.788 13.592 1.00 1.00 H new ATOM 0 HG LEU A 119 0.503 -2.955 14.681 1.00 1.00 H new ATOM 0 HD11 LEU A 119 0.827 -0.509 14.683 1.00 1.00 H new ATOM 0 HD12 LEU A 119 2.383 -1.373 14.701 1.00 1.00 H new ATOM 0 HD13 LEU A 119 1.791 -0.636 13.193 1.00 1.00 H new ATOM 0 HD21 LEU A 119 -1.129 -1.488 13.516 1.00 1.00 H new ATOM 0 HD22 LEU A 119 -0.196 -1.656 12.010 1.00 1.00 H new ATOM 0 HD23 LEU A 119 -1.003 -3.074 12.720 1.00 1.00 H new ATOM 905 N LYS A 120 1.161 -0.658 10.943 1.00 1.00 N ATOM 906 CA LYS A 120 0.159 0.033 10.074 1.00 1.00 C ATOM 907 C LYS A 120 0.681 1.428 9.711 1.00 1.00 C ATOM 908 O LYS A 120 1.139 2.150 10.572 1.00 1.00 O ATOM 909 CB LYS A 120 -1.174 0.168 10.816 1.00 1.00 C ATOM 910 CG LYS A 120 -0.996 1.071 12.038 1.00 1.00 C ATOM 911 CD LYS A 120 -1.803 2.356 11.845 1.00 1.00 C ATOM 912 CE LYS A 120 -2.856 2.469 12.950 1.00 1.00 C ATOM 913 NZ LYS A 120 -3.452 1.128 13.207 1.00 1.00 N ATOM 0 H LYS A 120 1.693 -0.049 11.565 1.00 1.00 H new ATOM 0 HA LYS A 120 0.006 -0.553 9.168 1.00 1.00 H new ATOM 0 HB2 LYS A 120 -1.930 0.585 10.151 1.00 1.00 H new ATOM 0 HB3 LYS A 120 -1.529 -0.815 11.127 1.00 1.00 H new ATOM 0 HG2 LYS A 120 -1.327 0.553 12.938 1.00 1.00 H new ATOM 0 HG3 LYS A 120 0.059 1.309 12.177 1.00 1.00 H new ATOM 0 HD2 LYS A 120 -1.140 3.221 11.870 1.00 1.00 H new ATOM 0 HD3 LYS A 120 -2.285 2.352 10.868 1.00 1.00 H new ATOM 0 HE2 LYS A 120 -2.402 2.858 13.861 1.00 1.00 H new ATOM 0 HE3 LYS A 120 -3.633 3.174 12.656 1.00 1.00 H new ATOM 0 HZ1 LYS A 120 -4.411 1.242 13.592 1.00 1.00 H new ATOM 0 HZ2 LYS A 120 -3.498 0.592 12.317 1.00 1.00 H new ATOM 0 HZ3 LYS A 120 -2.863 0.612 13.892 1.00 1.00 H new ATOM 914 N PRO A 121 0.595 1.777 8.451 1.00 1.00 N ATOM 915 CA PRO A 121 1.056 3.077 7.994 1.00 1.00 C ATOM 916 C PRO A 121 0.408 4.176 8.837 1.00 1.00 C ATOM 917 O PRO A 121 -0.691 4.616 8.564 1.00 1.00 O ATOM 918 CB PRO A 121 0.596 3.174 6.545 1.00 1.00 C ATOM 919 CG PRO A 121 0.410 1.683 6.114 1.00 1.00 C ATOM 920 CD PRO A 121 0.035 0.905 7.410 1.00 1.00 C ATOM 0 HA PRO A 121 2.136 3.193 8.082 1.00 1.00 H new ATOM 0 HB2 PRO A 121 -0.334 3.735 6.457 1.00 1.00 H new ATOM 0 HB3 PRO A 121 1.334 3.681 5.924 1.00 1.00 H new ATOM 0 HG2 PRO A 121 -0.374 1.589 5.362 1.00 1.00 H new ATOM 0 HG3 PRO A 121 1.325 1.288 5.672 1.00 1.00 H new ATOM 0 HD2 PRO A 121 -1.043 0.781 7.516 1.00 1.00 H new ATOM 0 HD3 PRO A 121 0.474 -0.092 7.431 1.00 1.00 H new ATOM 921 N LEU A 122 1.079 4.621 9.860 1.00 1.00 N ATOM 922 CA LEU A 122 0.501 5.688 10.721 1.00 1.00 C ATOM 923 C LEU A 122 0.997 7.044 10.221 1.00 1.00 C ATOM 924 O LEU A 122 2.131 7.184 9.808 1.00 1.00 O ATOM 925 CB LEU A 122 0.957 5.469 12.167 1.00 1.00 C ATOM 926 CG LEU A 122 0.284 6.491 13.083 1.00 1.00 C ATOM 927 CD1 LEU A 122 -1.220 6.517 12.810 1.00 1.00 C ATOM 928 CD2 LEU A 122 0.527 6.102 14.543 1.00 1.00 C ATOM 0 H LEU A 122 2.004 4.292 10.138 1.00 1.00 H new ATOM 0 HA LEU A 122 -0.588 5.659 10.680 1.00 1.00 H new ATOM 0 HB2 LEU A 122 0.705 4.458 12.488 1.00 1.00 H new ATOM 0 HB3 LEU A 122 2.041 5.565 12.235 1.00 1.00 H new ATOM 0 HG LEU A 122 0.703 7.479 12.891 1.00 1.00 H new ATOM 0 HD11 LEU A 122 -1.696 7.247 13.465 1.00 1.00 H new ATOM 0 HD12 LEU A 122 -1.396 6.793 11.770 1.00 1.00 H new ATOM 0 HD13 LEU A 122 -1.641 5.530 13.000 1.00 1.00 H new ATOM 0 HD21 LEU A 122 0.048 6.830 15.198 1.00 1.00 H new ATOM 0 HD22 LEU A 122 0.108 5.113 14.731 1.00 1.00 H new ATOM 0 HD23 LEU A 122 1.599 6.085 14.742 1.00 1.00 H new ATOM 929 N VAL A 123 0.158 8.042 10.237 1.00 1.00 N ATOM 930 CA VAL A 123 0.595 9.376 9.744 1.00 1.00 C ATOM 931 C VAL A 123 1.466 10.055 10.803 1.00 1.00 C ATOM 932 O VAL A 123 1.020 10.359 11.891 1.00 1.00 O ATOM 933 CB VAL A 123 -0.627 10.251 9.434 1.00 1.00 C ATOM 934 CG1 VAL A 123 -1.698 9.414 8.729 1.00 1.00 C ATOM 935 CG2 VAL A 123 -1.203 10.826 10.732 1.00 1.00 C ATOM 0 H VAL A 123 -0.805 7.992 10.568 1.00 1.00 H new ATOM 0 HA VAL A 123 1.174 9.245 8.830 1.00 1.00 H new ATOM 0 HB VAL A 123 -0.319 11.070 8.784 1.00 1.00 H new ATOM 0 HG11 VAL A 123 -2.564 10.040 8.511 1.00 1.00 H new ATOM 0 HG12 VAL A 123 -1.294 9.016 7.798 1.00 1.00 H new ATOM 0 HG13 VAL A 123 -2.000 8.590 9.375 1.00 1.00 H new ATOM 0 HG21 VAL A 123 -2.070 11.446 10.502 1.00 1.00 H new ATOM 0 HG22 VAL A 123 -1.504 10.010 11.389 1.00 1.00 H new ATOM 0 HG23 VAL A 123 -0.445 11.432 11.229 1.00 1.00 H new ATOM 936 N GLN A 124 2.705 10.300 10.490 1.00 1.00 N ATOM 937 CA GLN A 124 3.597 10.966 11.472 1.00 1.00 C ATOM 938 C GLN A 124 3.935 12.364 10.962 1.00 1.00 C ATOM 939 O GLN A 124 4.458 12.529 9.876 1.00 1.00 O ATOM 940 CB GLN A 124 4.884 10.156 11.634 1.00 1.00 C ATOM 941 CG GLN A 124 4.766 9.249 12.859 1.00 1.00 C ATOM 942 CD GLN A 124 4.630 7.796 12.406 1.00 1.00 C ATOM 943 OE1 GLN A 124 5.502 6.986 12.652 1.00 1.00 O ATOM 944 NE2 GLN A 124 3.565 7.429 11.750 1.00 1.00 N ATOM 0 H GLN A 124 3.138 10.067 9.596 1.00 1.00 H new ATOM 0 HA GLN A 124 3.096 11.033 12.437 1.00 1.00 H new ATOM 0 HB2 GLN A 124 5.064 9.557 10.741 1.00 1.00 H new ATOM 0 HB3 GLN A 124 5.736 10.826 11.745 1.00 1.00 H new ATOM 0 HG2 GLN A 124 5.644 9.362 13.495 1.00 1.00 H new ATOM 0 HG3 GLN A 124 3.901 9.537 13.456 1.00 1.00 H new ATOM 0 HE21 GLN A 124 2.833 8.109 11.544 1.00 1.00 H new ATOM 0 HE22 GLN A 124 3.463 6.462 11.443 1.00 1.00 H new ATOM 945 N GLU A 125 3.639 13.373 11.731 1.00 1.00 N ATOM 946 CA GLU A 125 3.947 14.757 11.284 1.00 1.00 C ATOM 947 C GLU A 125 5.418 14.822 10.865 1.00 1.00 C ATOM 948 O GLU A 125 6.301 14.767 11.696 1.00 1.00 O ATOM 949 CB GLU A 125 3.700 15.732 12.437 1.00 1.00 C ATOM 950 CG GLU A 125 2.412 15.342 13.165 1.00 1.00 C ATOM 951 CD GLU A 125 1.887 16.543 13.954 1.00 1.00 C ATOM 952 OE1 GLU A 125 2.393 16.783 15.037 1.00 1.00 O ATOM 953 OE2 GLU A 125 0.987 17.203 13.461 1.00 1.00 O ATOM 0 H GLU A 125 3.198 13.299 12.648 1.00 1.00 H new ATOM 0 HA GLU A 125 3.309 15.028 10.443 1.00 1.00 H new ATOM 0 HB2 GLU A 125 4.542 15.714 13.129 1.00 1.00 H new ATOM 0 HB3 GLU A 125 3.622 16.750 12.056 1.00 1.00 H new ATOM 0 HG2 GLU A 125 1.662 15.010 12.447 1.00 1.00 H new ATOM 0 HG3 GLU A 125 2.601 14.506 13.838 1.00 1.00 H new ATOM 954 N CYS A 126 5.683 14.924 9.585 1.00 1.00 N ATOM 955 CA CYS A 126 7.098 14.983 9.100 1.00 1.00 C ATOM 956 C CYS A 126 7.965 15.744 10.108 1.00 1.00 C ATOM 957 O CYS A 126 7.554 16.743 10.663 1.00 1.00 O ATOM 958 CB CYS A 126 7.142 15.707 7.752 1.00 1.00 C ATOM 959 SG CYS A 126 6.421 14.654 6.468 1.00 1.00 S ATOM 0 H CYS A 126 4.976 14.969 8.851 1.00 1.00 H new ATOM 0 HA CYS A 126 7.480 13.968 8.989 1.00 1.00 H new ATOM 0 HB2 CYS A 126 6.593 16.647 7.815 1.00 1.00 H new ATOM 0 HB3 CYS A 126 8.172 15.956 7.496 1.00 1.00 H new ATOM 960 N MET A 127 9.157 15.274 10.357 1.00 1.00 N ATOM 961 CA MET A 127 10.040 15.968 11.338 1.00 1.00 C ATOM 962 C MET A 127 10.836 17.070 10.635 1.00 1.00 C ATOM 963 O MET A 127 11.940 16.856 10.176 1.00 1.00 O ATOM 964 CB MET A 127 11.007 14.956 11.957 1.00 1.00 C ATOM 965 CG MET A 127 10.763 14.871 13.465 1.00 1.00 C ATOM 966 SD MET A 127 11.456 16.335 14.272 1.00 1.00 S ATOM 967 CE MET A 127 10.426 16.283 15.759 1.00 1.00 C ATOM 0 H MET A 127 9.557 14.441 9.925 1.00 1.00 H new ATOM 0 HA MET A 127 9.426 16.414 12.120 1.00 1.00 H new ATOM 0 HB2 MET A 127 10.867 13.977 11.500 1.00 1.00 H new ATOM 0 HB3 MET A 127 12.037 15.255 11.761 1.00 1.00 H new ATOM 0 HG2 MET A 127 9.694 14.802 13.668 1.00 1.00 H new ATOM 0 HG3 MET A 127 11.223 13.969 13.868 1.00 1.00 H new ATOM 0 HE1 MET A 127 10.689 17.114 16.413 1.00 1.00 H new ATOM 0 HE2 MET A 127 9.376 16.362 15.477 1.00 1.00 H new ATOM 0 HE3 MET A 127 10.591 15.342 16.283 1.00 1.00 H new ATOM 968 N VAL A 128 10.285 18.251 10.554 1.00 1.00 N ATOM 969 CA VAL A 128 11.008 19.373 9.890 1.00 1.00 C ATOM 970 C VAL A 128 10.616 20.691 10.563 1.00 1.00 C ATOM 971 O VAL A 128 9.553 21.230 10.322 1.00 1.00 O ATOM 972 CB VAL A 128 10.638 19.413 8.401 1.00 1.00 C ATOM 973 CG1 VAL A 128 10.985 20.784 7.812 1.00 1.00 C ATOM 974 CG2 VAL A 128 11.424 18.333 7.657 1.00 1.00 C ATOM 0 H VAL A 128 9.363 18.487 10.920 1.00 1.00 H new ATOM 0 HA VAL A 128 12.084 19.226 9.983 1.00 1.00 H new ATOM 0 HB VAL A 128 9.568 19.236 8.293 1.00 1.00 H new ATOM 0 HG11 VAL A 128 10.719 20.804 6.755 1.00 1.00 H new ATOM 0 HG12 VAL A 128 10.429 21.558 8.341 1.00 1.00 H new ATOM 0 HG13 VAL A 128 12.054 20.967 7.921 1.00 1.00 H new ATOM 0 HG21 VAL A 128 11.164 18.358 6.599 1.00 1.00 H new ATOM 0 HG22 VAL A 128 12.492 18.516 7.773 1.00 1.00 H new ATOM 0 HG23 VAL A 128 11.177 17.354 8.068 1.00 1.00 H new ATOM 975 N HIS A 129 11.465 21.213 11.406 1.00 1.00 N ATOM 976 CA HIS A 129 11.141 22.493 12.095 1.00 1.00 C ATOM 977 C HIS A 129 11.474 23.670 11.175 1.00 1.00 C ATOM 978 O HIS A 129 11.536 23.529 9.970 1.00 1.00 O ATOM 979 CB HIS A 129 11.964 22.602 13.380 1.00 1.00 C ATOM 980 CG HIS A 129 11.134 23.248 14.455 1.00 1.00 C ATOM 981 ND1 HIS A 129 11.375 24.539 14.899 1.00 1.00 N ATOM 982 CD2 HIS A 129 10.063 22.794 15.185 1.00 1.00 C ATOM 983 CE1 HIS A 129 10.468 24.815 15.854 1.00 1.00 C ATOM 984 NE2 HIS A 129 9.644 23.786 16.068 1.00 1.00 N ATOM 0 H HIS A 129 12.369 20.807 11.647 1.00 1.00 H new ATOM 0 HA HIS A 129 10.079 22.514 12.339 1.00 1.00 H new ATOM 0 HB2 HIS A 129 12.288 21.612 13.702 1.00 1.00 H new ATOM 0 HB3 HIS A 129 12.864 23.189 13.199 1.00 1.00 H new ATOM 0 HD2 HIS A 129 9.614 21.816 15.089 1.00 1.00 H new ATOM 0 HE1 HIS A 129 10.413 25.755 16.383 1.00 1.00 H new ATOM 0 HE2 HIS A 129 8.874 23.737 16.735 1.00 1.00 H new ATOM 985 N ASP A 130 11.688 24.829 11.734 1.00 1.00 N ATOM 986 CA ASP A 130 12.016 26.014 10.892 1.00 1.00 C ATOM 987 C ASP A 130 13.467 25.915 10.415 1.00 1.00 C ATOM 988 O ASP A 130 14.100 24.885 10.530 1.00 1.00 O ATOM 989 CB ASP A 130 11.837 27.291 11.717 1.00 1.00 C ATOM 990 CG ASP A 130 12.733 27.228 12.955 1.00 1.00 C ATOM 991 OD1 ASP A 130 13.573 26.345 13.011 1.00 1.00 O ATOM 992 OD2 ASP A 130 12.565 28.065 13.827 1.00 1.00 O ATOM 0 H ASP A 130 11.650 25.007 12.738 1.00 1.00 H new ATOM 0 HA ASP A 130 11.351 26.042 10.029 1.00 1.00 H new ATOM 0 HB2 ASP A 130 12.091 28.164 11.115 1.00 1.00 H new ATOM 0 HB3 ASP A 130 10.794 27.401 12.015 1.00 1.00 H new ATOM 993 N CYS A 131 13.998 26.980 9.878 1.00 1.00 N ATOM 994 CA CYS A 131 15.407 26.946 9.394 1.00 1.00 C ATOM 995 C CYS A 131 16.246 27.941 10.197 1.00 1.00 C ATOM 996 O CYS A 131 16.010 29.133 10.167 1.00 1.00 O ATOM 997 CB CYS A 131 15.447 27.325 7.911 1.00 1.00 C ATOM 998 SG CYS A 131 13.785 27.775 7.355 1.00 1.00 S ATOM 0 H CYS A 131 13.517 27.871 9.754 1.00 1.00 H new ATOM 0 HA CYS A 131 15.811 25.942 9.523 1.00 1.00 H new ATOM 0 HB2 CYS A 131 16.131 28.159 7.757 1.00 1.00 H new ATOM 0 HB3 CYS A 131 15.825 26.489 7.322 1.00 1.00 H new ATOM 999 N ALA A 132 17.225 27.463 10.915 1.00 1.00 N ATOM 1000 CA ALA A 132 18.077 28.383 11.719 1.00 1.00 C ATOM 1001 C ALA A 132 19.073 27.566 12.544 1.00 1.00 C ATOM 1002 O ALA A 132 18.696 26.739 13.350 1.00 1.00 O ATOM 1003 CB ALA A 132 17.193 29.208 12.657 1.00 1.00 C ATOM 0 H ALA A 132 17.471 26.475 10.979 1.00 1.00 H new ATOM 0 HA ALA A 132 18.621 29.051 11.051 1.00 1.00 H new ATOM 0 HB1 ALA A 132 17.816 29.881 13.246 1.00 1.00 H new ATOM 0 HB2 ALA A 132 16.483 29.791 12.069 1.00 1.00 H new ATOM 0 HB3 ALA A 132 16.649 28.540 13.325 1.00 1.00 H new ATOM 1004 N ASP A 133 20.344 27.791 12.349 1.00 1.00 N ATOM 1005 CA ASP A 133 21.363 27.026 13.122 1.00 1.00 C ATOM 1006 C ASP A 133 22.622 27.879 13.290 1.00 1.00 C ATOM 1007 O ASP A 133 23.564 27.769 12.531 1.00 1.00 O ATOM 1008 CB ASP A 133 21.715 25.741 12.371 1.00 1.00 C ATOM 1009 CG ASP A 133 21.038 24.550 13.052 1.00 1.00 C ATOM 1010 OD1 ASP A 133 19.838 24.404 12.891 1.00 1.00 O ATOM 1011 OD2 ASP A 133 21.733 23.803 13.723 1.00 1.00 O ATOM 0 H ASP A 133 20.720 28.471 11.688 1.00 1.00 H new ATOM 0 HA ASP A 133 20.960 26.775 14.103 1.00 1.00 H new ATOM 0 HB2 ASP A 133 21.390 25.813 11.333 1.00 1.00 H new ATOM 0 HB3 ASP A 133 22.796 25.600 12.357 1.00 1.00 H new ATOM 1012 N GLY A 134 22.647 28.729 14.281 1.00 1.00 N ATOM 1013 CA GLY A 134 23.846 29.587 14.497 1.00 1.00 C ATOM 1014 C GLY A 134 24.067 30.479 13.274 1.00 1.00 C ATOM 1015 O GLY A 134 25.158 30.956 13.032 1.00 1.00 O ATOM 0 H GLY A 134 21.889 28.866 14.950 1.00 1.00 H new ATOM 0 HA2 GLY A 134 23.711 30.201 15.387 1.00 1.00 H new ATOM 0 HA3 GLY A 134 24.724 28.965 14.669 1.00 1.00 H new ATOM 1016 N LYS A 135 23.041 30.708 12.501 1.00 1.00 N ATOM 1017 CA LYS A 135 23.196 31.570 11.296 1.00 1.00 C ATOM 1018 C LYS A 135 21.852 31.683 10.572 1.00 1.00 C ATOM 1019 O LYS A 135 20.839 31.735 11.250 1.00 1.00 O ATOM 1020 CB LYS A 135 24.231 30.950 10.355 1.00 1.00 C ATOM 1021 CG LYS A 135 25.509 31.791 10.375 1.00 1.00 C ATOM 1022 CD LYS A 135 25.682 32.491 9.026 1.00 1.00 C ATOM 1023 CE LYS A 135 27.172 32.615 8.702 1.00 1.00 C ATOM 1024 NZ LYS A 135 27.626 34.008 8.975 1.00 1.00 N ATOM 1025 OXT LYS A 135 21.859 31.715 9.353 1.00 1.00 O ATOM 0 H LYS A 135 22.103 30.336 12.652 1.00 1.00 H new ATOM 0 HA LYS A 135 23.529 32.562 11.600 1.00 1.00 H new ATOM 0 HB2 LYS A 135 24.451 29.928 10.662 1.00 1.00 H new ATOM 0 HB3 LYS A 135 23.832 30.899 9.342 1.00 1.00 H new ATOM 0 HG2 LYS A 135 25.459 32.529 11.176 1.00 1.00 H new ATOM 0 HG3 LYS A 135 26.371 31.156 10.580 1.00 1.00 H new ATOM 0 HD2 LYS A 135 25.175 31.926 8.244 1.00 1.00 H new ATOM 0 HD3 LYS A 135 25.222 33.479 9.055 1.00 1.00 H new ATOM 0 HE2 LYS A 135 27.746 31.910 9.303 1.00 1.00 H new ATOM 0 HE3 LYS A 135 27.350 32.361 7.657 1.00 1.00 H new ATOM 0 HZ1 LYS A 135 28.639 34.092 8.755 1.00 1.00 H new ATOM 0 HZ2 LYS A 135 27.086 34.671 8.383 1.00 1.00 H new ATOM 0 HZ3 LYS A 135 27.470 34.234 9.978 1.00 1.00 H new TER 1026 LYS A 135 HETATM 1027 C1 FUC A 136 28.403 2.032 8.102 1.00 1.00 C HETATM 1028 C2 FUC A 136 29.110 3.045 9.001 1.00 1.00 C HETATM 1029 C3 FUC A 136 28.702 4.454 8.593 1.00 1.00 C HETATM 1030 C4 FUC A 136 27.187 4.564 8.677 1.00 1.00 C HETATM 1031 C5 FUC A 136 26.560 3.504 7.779 1.00 1.00 C HETATM 1032 C6 FUC A 136 25.045 3.525 7.812 1.00 1.00 C HETATM 1033 O2 FUC A 136 30.518 2.893 8.890 1.00 1.00 O HETATM 1034 O3 FUC A 136 29.308 5.403 9.460 1.00 1.00 O HETATM 1035 O4 FUC A 136 26.771 4.354 10.019 1.00 1.00 O HETATM 1036 O5 FUC A 136 26.985 2.193 8.199 1.00 1.00 O HETATM 0 HO4 FUC A 136 26.562 3.406 10.152 1.00 1.00 H new HETATM 0 HO3 FUC A 136 28.688 5.625 10.186 1.00 1.00 H new HETATM 0 HO2 FUC A 136 30.750 2.660 7.967 1.00 1.00 H new HETATM 0 H63 FUC A 136 24.701 3.343 8.830 1.00 1.00 H new HETATM 0 H62 FUC A 136 24.687 4.498 7.476 1.00 1.00 H new HETATM 0 H61 FUC A 136 24.656 2.748 7.153 1.00 1.00 H new HETATM 0 H5 FUC A 136 26.890 3.729 6.765 1.00 1.00 H new HETATM 0 H4 FUC A 136 26.871 5.555 8.352 1.00 1.00 H new HETATM 0 H3 FUC A 136 29.031 4.656 7.574 1.00 1.00 H new HETATM 0 H2 FUC A 136 28.821 2.873 10.038 1.00 1.00 H new