USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1124 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 129 ASN : amide:sc= -6.31! C(o=-15!,f=-15!) USER MOD Set 1.2: A 132 GLN : amide:sc= -8.85! C(o=-15!,f=-15!) USER MOD Set 2.1: A 65 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 108 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 27 THR OG1 : rot 180:sc= -0.954! USER MOD Set 3.2: A 59 ASN : amide:sc= -1.26! C(o=-2.2!,f=0.15!) USER MOD Set 4.1: A 36 CYS SG : rot -143:sc= 0.463 USER MOD Set 4.2: A 39 CYS SG : rot 180:sc= 0.713 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 HIS : no HD1:sc= -0.0218 X(o=-0.022,f=-0.075) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 74:sc= 1.2 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 153:sc= 0.0257 USER MOD Single : A 14 ASN : amide:sc= -0.15 X(o=-0.15,f=-0.015) USER MOD Single : A 18 SER OG : rot 180:sc= -0.433 USER MOD Single : A 20 TYR OH : rot 18:sc= -5.29! USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 114:sc= 0.996 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 THR OG1 : rot 103:sc= 1.2 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -0.259 K(o=-0.26,f=-2.2!) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -107:sc= -0.191 USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0768) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 GLN : amide:sc= -1.16 K(o=-1.2,f=-5!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 101:sc= 0.577 USER MOD Single : A 85 ASN : amide:sc= -0.0651 X(o=-0.065,f=0) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 47:sc= 0.105 USER MOD Single : A 95 ASN : amide:sc= -0.0537 X(o=-0.054,f=-0.53) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= -0.0621 X(o=-0.062,f=-0.062) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.828 K(o=-0.83,f=-0.3) USER MOD Single : A 106 SER OG : rot -76:sc= 1.2 USER MOD Single : A 110 SER OG : rot -150:sc= -0.616 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 GLN : amide:sc= -0.748 K(o=-0.75,f=-5.4!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 180:sc= -0.69 USER MOD Single : A 141 ASN : amide:sc= 1.07 K(o=1.1,f=-0.52) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 11.415 -9.497 8.943 1.00 0.00 N ATOM 2 CA MET A 1 10.400 -9.960 9.872 1.00 0.00 C ATOM 3 C MET A 1 9.962 -8.835 10.812 1.00 0.00 C ATOM 4 O MET A 1 10.584 -8.610 11.848 1.00 0.00 O ATOM 5 CB MET A 1 10.952 -11.126 10.695 1.00 0.00 C ATOM 6 CG MET A 1 10.039 -12.349 10.596 1.00 0.00 C ATOM 7 SD MET A 1 10.913 -13.808 11.136 1.00 0.00 S ATOM 8 CE MET A 1 11.243 -14.575 9.558 1.00 0.00 C ATOM 0 H1 MET A 1 11.695 -10.279 8.317 1.00 0.00 H new ATOM 0 H2 MET A 1 11.033 -8.716 8.372 1.00 0.00 H new ATOM 0 H3 MET A 1 12.245 -9.164 9.474 1.00 0.00 H new ATOM 0 HA MET A 1 9.533 -10.287 9.298 1.00 0.00 H new ATOM 0 HB2 MET A 1 11.951 -11.384 10.342 1.00 0.00 H new ATOM 0 HB3 MET A 1 11.050 -10.825 11.738 1.00 0.00 H new ATOM 0 HG2 MET A 1 9.150 -12.200 11.209 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.700 -12.478 9.568 1.00 0.00 H new ATOM 0 HE1 MET A 1 11.788 -15.506 9.713 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.301 -14.786 9.052 1.00 0.00 H new ATOM 0 HE3 MET A 1 11.842 -13.902 8.945 1.00 0.00 H new ATOM 18 N VAL A 2 8.894 -8.157 10.415 1.00 0.00 N ATOM 19 CA VAL A 2 8.368 -7.060 11.208 1.00 0.00 C ATOM 20 C VAL A 2 6.838 -7.094 11.165 1.00 0.00 C ATOM 21 O VAL A 2 6.207 -6.188 10.622 1.00 0.00 O ATOM 22 CB VAL A 2 8.949 -5.733 10.718 1.00 0.00 C ATOM 23 CG1 VAL A 2 10.378 -5.540 11.228 1.00 0.00 C ATOM 24 CG2 VAL A 2 8.893 -5.639 9.191 1.00 0.00 C ATOM 0 H VAL A 2 8.380 -8.347 9.555 1.00 0.00 H new ATOM 0 HA VAL A 2 8.668 -7.165 12.251 1.00 0.00 H new ATOM 0 HB VAL A 2 8.336 -4.928 11.125 1.00 0.00 H new ATOM 0 HG11 VAL A 2 10.768 -4.589 10.866 1.00 0.00 H new ATOM 0 HG12 VAL A 2 10.379 -5.541 12.318 1.00 0.00 H new ATOM 0 HG13 VAL A 2 11.007 -6.353 10.864 1.00 0.00 H new ATOM 0 HG21 VAL A 2 9.312 -4.686 8.870 1.00 0.00 H new ATOM 0 HG22 VAL A 2 9.470 -6.455 8.755 1.00 0.00 H new ATOM 0 HG23 VAL A 2 7.857 -5.710 8.860 1.00 0.00 H new ATOM 34 N PRO A 3 6.271 -8.178 11.758 1.00 0.00 N ATOM 35 CA PRO A 3 4.827 -8.344 11.792 1.00 0.00 C ATOM 36 C PRO A 3 4.193 -7.403 12.821 1.00 0.00 C ATOM 37 O PRO A 3 3.258 -6.670 12.502 1.00 0.00 O ATOM 38 CB PRO A 3 4.606 -9.812 12.114 1.00 0.00 C ATOM 39 CG PRO A 3 5.914 -10.311 12.704 1.00 0.00 C ATOM 40 CD PRO A 3 6.985 -9.272 12.411 1.00 0.00 C ATOM 0 HA PRO A 3 4.351 -8.083 10.847 1.00 0.00 H new ATOM 0 HB2 PRO A 3 3.786 -9.938 12.821 1.00 0.00 H new ATOM 0 HB3 PRO A 3 4.343 -10.373 11.217 1.00 0.00 H new ATOM 0 HG2 PRO A 3 5.814 -10.464 13.779 1.00 0.00 H new ATOM 0 HG3 PRO A 3 6.186 -11.273 12.269 1.00 0.00 H new ATOM 0 HD2 PRO A 3 7.472 -8.936 13.326 1.00 0.00 H new ATOM 0 HD3 PRO A 3 7.764 -9.677 11.766 1.00 0.00 H new ATOM 48 N HIS A 4 4.727 -7.456 14.032 1.00 0.00 N ATOM 49 CA HIS A 4 4.223 -6.620 15.109 1.00 0.00 C ATOM 50 C HIS A 4 4.122 -5.172 14.628 1.00 0.00 C ATOM 51 O HIS A 4 3.108 -4.510 14.846 1.00 0.00 O ATOM 52 CB HIS A 4 5.087 -6.771 16.362 1.00 0.00 C ATOM 53 CG HIS A 4 5.184 -8.188 16.875 1.00 0.00 C ATOM 54 ND1 HIS A 4 4.107 -9.055 16.891 1.00 0.00 N ATOM 55 CD2 HIS A 4 6.243 -8.880 17.386 1.00 0.00 C ATOM 56 CE1 HIS A 4 4.508 -10.212 17.394 1.00 0.00 C ATOM 57 NE2 HIS A 4 5.833 -10.103 17.701 1.00 0.00 N ATOM 0 H HIS A 4 5.503 -8.064 14.292 1.00 0.00 H new ATOM 0 HA HIS A 4 3.221 -6.944 15.389 1.00 0.00 H new ATOM 0 HB2 HIS A 4 6.090 -6.405 16.145 1.00 0.00 H new ATOM 0 HB3 HIS A 4 4.680 -6.137 17.150 1.00 0.00 H new ATOM 0 HD2 HIS A 4 7.245 -8.498 17.513 1.00 0.00 H new ATOM 0 HE1 HIS A 4 3.894 -11.089 17.536 1.00 0.00 H new ATOM 0 HE2 HIS A 4 6.412 -10.839 18.105 1.00 0.00 H new ATOM 66 N THR A 5 5.189 -4.720 13.984 1.00 0.00 N ATOM 67 CA THR A 5 5.233 -3.362 13.470 1.00 0.00 C ATOM 68 C THR A 5 4.092 -3.128 12.478 1.00 0.00 C ATOM 69 O THR A 5 3.349 -2.155 12.599 1.00 0.00 O ATOM 70 CB THR A 5 6.620 -3.129 12.866 1.00 0.00 C ATOM 71 OG1 THR A 5 7.492 -3.111 13.994 1.00 0.00 O ATOM 72 CG2 THR A 5 6.767 -1.734 12.257 1.00 0.00 C ATOM 0 H THR A 5 6.029 -5.271 13.807 1.00 0.00 H new ATOM 0 HA THR A 5 5.083 -2.634 14.267 1.00 0.00 H new ATOM 0 HB THR A 5 6.813 -3.880 12.100 1.00 0.00 H new ATOM 0 HG1 THR A 5 8.413 -2.967 13.693 1.00 0.00 H new ATOM 0 HG21 THR A 5 7.769 -1.622 11.843 1.00 0.00 H new ATOM 0 HG22 THR A 5 6.030 -1.603 11.465 1.00 0.00 H new ATOM 0 HG23 THR A 5 6.607 -0.981 13.029 1.00 0.00 H new ATOM 80 N LEU A 6 3.988 -4.038 11.520 1.00 0.00 N ATOM 81 CA LEU A 6 2.950 -3.943 10.509 1.00 0.00 C ATOM 82 C LEU A 6 1.580 -3.912 11.191 1.00 0.00 C ATOM 83 O LEU A 6 0.742 -3.068 10.873 1.00 0.00 O ATOM 84 CB LEU A 6 3.099 -5.066 9.480 1.00 0.00 C ATOM 85 CG LEU A 6 2.353 -4.870 8.159 1.00 0.00 C ATOM 86 CD1 LEU A 6 3.284 -5.092 6.965 1.00 0.00 C ATOM 87 CD2 LEU A 6 1.112 -5.761 8.092 1.00 0.00 C ATOM 0 H LEU A 6 4.606 -4.844 11.423 1.00 0.00 H new ATOM 0 HA LEU A 6 3.049 -3.013 9.949 1.00 0.00 H new ATOM 0 HB2 LEU A 6 4.159 -5.192 9.260 1.00 0.00 H new ATOM 0 HB3 LEU A 6 2.755 -5.995 9.934 1.00 0.00 H new ATOM 0 HG LEU A 6 2.009 -3.837 8.111 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.729 -4.947 6.039 1.00 0.00 H new ATOM 0 HD12 LEU A 6 4.109 -4.380 7.009 1.00 0.00 H new ATOM 0 HD13 LEU A 6 3.679 -6.107 6.996 1.00 0.00 H new ATOM 0 HD21 LEU A 6 0.601 -5.602 7.143 1.00 0.00 H new ATOM 0 HD22 LEU A 6 1.410 -6.806 8.173 1.00 0.00 H new ATOM 0 HD23 LEU A 6 0.440 -5.511 8.913 1.00 0.00 H new ATOM 99 N SER A 7 1.394 -4.843 12.116 1.00 0.00 N ATOM 100 CA SER A 7 0.141 -4.932 12.847 1.00 0.00 C ATOM 101 C SER A 7 -0.009 -3.728 13.778 1.00 0.00 C ATOM 102 O SER A 7 -1.124 -3.359 14.147 1.00 0.00 O ATOM 103 CB SER A 7 0.061 -6.234 13.645 1.00 0.00 C ATOM 104 OG SER A 7 -0.976 -7.089 13.170 1.00 0.00 O ATOM 0 H SER A 7 2.090 -5.542 12.376 1.00 0.00 H new ATOM 0 HA SER A 7 -0.677 -4.929 12.126 1.00 0.00 H new ATOM 0 HB2 SER A 7 1.016 -6.755 13.585 1.00 0.00 H new ATOM 0 HB3 SER A 7 -0.111 -6.005 14.697 1.00 0.00 H new ATOM 0 HG SER A 7 -0.993 -7.910 13.704 1.00 0.00 H new ATOM 110 N THR A 8 1.129 -3.149 14.132 1.00 0.00 N ATOM 111 CA THR A 8 1.137 -1.993 15.014 1.00 0.00 C ATOM 112 C THR A 8 0.819 -0.719 14.229 1.00 0.00 C ATOM 113 O THR A 8 0.438 0.294 14.811 1.00 0.00 O ATOM 114 CB THR A 8 2.493 -1.949 15.721 1.00 0.00 C ATOM 115 OG1 THR A 8 2.412 -2.987 16.695 1.00 0.00 O ATOM 116 CG2 THR A 8 2.681 -0.675 16.549 1.00 0.00 C ATOM 0 H THR A 8 2.051 -3.458 13.825 1.00 0.00 H new ATOM 0 HA THR A 8 0.359 -2.070 15.774 1.00 0.00 H new ATOM 0 HB THR A 8 3.290 -2.022 14.981 1.00 0.00 H new ATOM 0 HG1 THR A 8 2.488 -3.858 16.252 1.00 0.00 H new ATOM 0 HG21 THR A 8 3.659 -0.694 17.030 1.00 0.00 H new ATOM 0 HG22 THR A 8 2.614 0.196 15.897 1.00 0.00 H new ATOM 0 HG23 THR A 8 1.904 -0.618 17.311 1.00 0.00 H new ATOM 124 N LEU A 9 0.987 -0.815 12.918 1.00 0.00 N ATOM 125 CA LEU A 9 0.722 0.318 12.046 1.00 0.00 C ATOM 126 C LEU A 9 -0.784 0.578 11.998 1.00 0.00 C ATOM 127 O LEU A 9 -1.582 -0.352 12.102 1.00 0.00 O ATOM 128 CB LEU A 9 1.353 0.094 10.670 1.00 0.00 C ATOM 129 CG LEU A 9 2.842 0.421 10.553 1.00 0.00 C ATOM 130 CD1 LEU A 9 3.322 0.286 9.105 1.00 0.00 C ATOM 131 CD2 LEU A 9 3.147 1.805 11.130 1.00 0.00 C ATOM 0 H LEU A 9 1.303 -1.658 12.439 1.00 0.00 H new ATOM 0 HA LEU A 9 1.188 1.220 12.441 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.208 -0.950 10.392 1.00 0.00 H new ATOM 0 HB3 LEU A 9 0.811 0.697 9.941 1.00 0.00 H new ATOM 0 HG LEU A 9 3.398 -0.305 11.146 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.384 0.524 9.050 1.00 0.00 H new ATOM 0 HD12 LEU A 9 3.161 -0.736 8.762 1.00 0.00 H new ATOM 0 HD13 LEU A 9 2.763 0.974 8.471 1.00 0.00 H new ATOM 0 HD21 LEU A 9 4.213 2.012 11.034 1.00 0.00 H new ATOM 0 HD22 LEU A 9 2.580 2.560 10.585 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.866 1.830 12.183 1.00 0.00 H new ATOM 143 N LYS A 10 -1.128 1.848 11.840 1.00 0.00 N ATOM 144 CA LYS A 10 -2.525 2.243 11.776 1.00 0.00 C ATOM 145 C LYS A 10 -2.766 3.044 10.495 1.00 0.00 C ATOM 146 O LYS A 10 -1.863 3.716 9.999 1.00 0.00 O ATOM 147 CB LYS A 10 -2.931 2.984 13.051 1.00 0.00 C ATOM 148 CG LYS A 10 -3.184 2.004 14.199 1.00 0.00 C ATOM 149 CD LYS A 10 -4.270 2.531 15.138 1.00 0.00 C ATOM 150 CE LYS A 10 -4.070 2.000 16.560 1.00 0.00 C ATOM 151 NZ LYS A 10 -5.012 0.893 16.837 1.00 0.00 N ATOM 0 H LYS A 10 -0.463 2.617 11.754 1.00 0.00 H new ATOM 0 HA LYS A 10 -3.168 1.364 11.728 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -2.146 3.686 13.334 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -3.831 3.570 12.864 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -3.484 1.036 13.797 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -2.261 1.845 14.757 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -4.251 3.621 15.147 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -5.251 2.232 14.769 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -3.044 1.652 16.684 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -4.223 2.804 17.280 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -4.863 0.544 17.805 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -5.989 1.236 16.739 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -4.847 0.120 16.162 1.00 0.00 H new ATOM 164 N THR A 11 -3.989 2.944 9.996 1.00 0.00 N ATOM 165 CA THR A 11 -4.362 3.652 8.783 1.00 0.00 C ATOM 166 C THR A 11 -4.614 5.131 9.083 1.00 0.00 C ATOM 167 O THR A 11 -4.492 5.565 10.226 1.00 0.00 O ATOM 168 CB THR A 11 -5.571 2.940 8.173 1.00 0.00 C ATOM 169 OG1 THR A 11 -6.450 2.741 9.277 1.00 0.00 O ATOM 170 CG2 THR A 11 -5.240 1.523 7.700 1.00 0.00 C ATOM 0 H THR A 11 -4.734 2.384 10.409 1.00 0.00 H new ATOM 0 HA THR A 11 -3.554 3.636 8.052 1.00 0.00 H new ATOM 0 HB THR A 11 -5.950 3.523 7.334 1.00 0.00 H new ATOM 0 HG1 THR A 11 -7.374 2.696 8.955 1.00 0.00 H new ATOM 0 HG21 THR A 11 -6.133 1.063 7.276 1.00 0.00 H new ATOM 0 HG22 THR A 11 -4.458 1.566 6.941 1.00 0.00 H new ATOM 0 HG23 THR A 11 -4.893 0.929 8.545 1.00 0.00 H new ATOM 178 N ALA A 12 -4.961 5.864 8.034 1.00 0.00 N ATOM 179 CA ALA A 12 -5.232 7.284 8.172 1.00 0.00 C ATOM 180 C ALA A 12 -6.577 7.478 8.872 1.00 0.00 C ATOM 181 O ALA A 12 -6.966 8.603 9.179 1.00 0.00 O ATOM 182 CB ALA A 12 -5.191 7.948 6.793 1.00 0.00 C ATOM 0 H ALA A 12 -5.060 5.501 7.086 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.469 7.761 8.787 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -5.394 9.014 6.896 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -4.205 7.808 6.351 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -5.945 7.496 6.149 1.00 0.00 H new ATOM 188 N ASP A 13 -7.253 6.362 9.105 1.00 0.00 N ATOM 189 CA ASP A 13 -8.548 6.395 9.762 1.00 0.00 C ATOM 190 C ASP A 13 -8.391 5.925 11.210 1.00 0.00 C ATOM 191 O ASP A 13 -9.348 5.449 11.820 1.00 0.00 O ATOM 192 CB ASP A 13 -9.543 5.461 9.068 1.00 0.00 C ATOM 193 CG ASP A 13 -8.916 4.438 8.119 1.00 0.00 C ATOM 194 OD1 ASP A 13 -8.880 3.233 8.413 1.00 0.00 O ATOM 195 OD2 ASP A 13 -8.443 4.929 7.024 1.00 0.00 O ATOM 0 H ASP A 13 -6.928 5.429 8.850 1.00 0.00 H new ATOM 0 HA ASP A 13 -8.923 7.418 9.718 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -10.110 4.927 9.831 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -10.255 6.066 8.507 1.00 0.00 H new ATOM 201 N ASN A 14 -7.177 6.076 11.719 1.00 0.00 N ATOM 202 CA ASN A 14 -6.883 5.673 13.083 1.00 0.00 C ATOM 203 C ASN A 14 -7.407 4.254 13.317 1.00 0.00 C ATOM 204 O ASN A 14 -7.973 3.964 14.369 1.00 0.00 O ATOM 205 CB ASN A 14 -7.566 6.601 14.091 1.00 0.00 C ATOM 206 CG ASN A 14 -6.537 7.459 14.830 1.00 0.00 C ATOM 207 OD1 ASN A 14 -6.600 8.678 14.841 1.00 0.00 O ATOM 208 ND2 ASN A 14 -5.589 6.758 15.446 1.00 0.00 N ATOM 0 H ASN A 14 -6.386 6.472 11.211 1.00 0.00 H new ATOM 0 HA ASN A 14 -5.803 5.720 13.222 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -8.278 7.245 13.574 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -8.134 6.009 14.809 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -4.856 7.239 15.967 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -5.595 5.739 15.397 1.00 0.00 H new ATOM 215 N ARG A 15 -7.199 3.410 12.318 1.00 0.00 N ATOM 216 CA ARG A 15 -7.643 2.028 12.401 1.00 0.00 C ATOM 217 C ARG A 15 -6.445 1.081 12.324 1.00 0.00 C ATOM 218 O ARG A 15 -5.401 1.436 11.780 1.00 0.00 O ATOM 219 CB ARG A 15 -8.622 1.696 11.272 1.00 0.00 C ATOM 220 CG ARG A 15 -10.069 1.924 11.716 1.00 0.00 C ATOM 221 CD ARG A 15 -10.968 0.769 11.269 1.00 0.00 C ATOM 222 NE ARG A 15 -12.365 1.236 11.146 1.00 0.00 N ATOM 223 CZ ARG A 15 -12.799 2.086 10.190 1.00 0.00 C ATOM 224 NH1 ARG A 15 -11.944 2.569 9.265 1.00 0.00 N ATOM 225 NH2 ARG A 15 -14.072 2.436 10.174 1.00 0.00 N ATOM 0 H ARG A 15 -6.729 3.656 11.447 1.00 0.00 H new ATOM 0 HA ARG A 15 -8.151 1.899 13.357 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -8.403 2.315 10.402 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -8.491 0.658 10.966 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -10.109 2.022 12.801 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -10.438 2.860 11.297 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -10.621 0.376 10.313 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -10.911 -0.047 11.989 1.00 0.00 H new ATOM 0 HE ARG A 15 -13.044 0.895 11.826 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -10.962 2.293 9.284 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -12.279 3.210 8.546 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -14.712 2.065 10.877 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -14.416 3.077 9.459 1.00 0.00 H new ATOM 238 N PRO A 16 -6.641 -0.140 12.891 1.00 0.00 N ATOM 239 CA PRO A 16 -5.589 -1.142 12.892 1.00 0.00 C ATOM 240 C PRO A 16 -5.431 -1.774 11.508 1.00 0.00 C ATOM 241 O PRO A 16 -6.422 -2.110 10.859 1.00 0.00 O ATOM 242 CB PRO A 16 -6.001 -2.145 13.959 1.00 0.00 C ATOM 243 CG PRO A 16 -7.487 -1.921 14.188 1.00 0.00 C ATOM 244 CD PRO A 16 -7.865 -0.596 13.545 1.00 0.00 C ATOM 0 HA PRO A 16 -4.609 -0.721 13.116 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -5.806 -3.166 13.632 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -5.436 -1.991 14.879 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -8.067 -2.735 13.753 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -7.710 -1.905 15.255 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -8.675 -0.721 12.827 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -8.208 0.122 14.290 1.00 0.00 H new ATOM 252 N ALA A 17 -4.180 -1.915 11.096 1.00 0.00 N ATOM 253 CA ALA A 17 -3.881 -2.501 9.800 1.00 0.00 C ATOM 254 C ALA A 17 -4.449 -3.919 9.742 1.00 0.00 C ATOM 255 O ALA A 17 -4.765 -4.421 8.664 1.00 0.00 O ATOM 256 CB ALA A 17 -2.370 -2.466 9.561 1.00 0.00 C ATOM 0 H ALA A 17 -3.362 -1.634 11.636 1.00 0.00 H new ATOM 0 HA ALA A 17 -4.351 -1.927 9.001 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -2.145 -2.905 8.589 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -2.022 -1.433 9.582 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -1.865 -3.035 10.342 1.00 0.00 H new ATOM 262 N SER A 18 -4.562 -4.526 10.915 1.00 0.00 N ATOM 263 CA SER A 18 -5.086 -5.877 11.010 1.00 0.00 C ATOM 264 C SER A 18 -6.461 -5.953 10.342 1.00 0.00 C ATOM 265 O SER A 18 -6.883 -7.022 9.901 1.00 0.00 O ATOM 266 CB SER A 18 -5.177 -6.330 12.468 1.00 0.00 C ATOM 267 OG SER A 18 -6.013 -5.473 13.241 1.00 0.00 O ATOM 0 H SER A 18 -4.299 -4.106 11.807 1.00 0.00 H new ATOM 0 HA SER A 18 -4.401 -6.548 10.492 1.00 0.00 H new ATOM 0 HB2 SER A 18 -5.565 -7.348 12.508 1.00 0.00 H new ATOM 0 HB3 SER A 18 -4.178 -6.352 12.904 1.00 0.00 H new ATOM 0 HG SER A 18 -6.047 -5.796 14.166 1.00 0.00 H new ATOM 273 N VAL A 19 -7.123 -4.807 10.290 1.00 0.00 N ATOM 274 CA VAL A 19 -8.441 -4.729 9.685 1.00 0.00 C ATOM 275 C VAL A 19 -8.433 -5.497 8.361 1.00 0.00 C ATOM 276 O VAL A 19 -9.382 -6.217 8.052 1.00 0.00 O ATOM 277 CB VAL A 19 -8.860 -3.267 9.528 1.00 0.00 C ATOM 278 CG1 VAL A 19 -9.874 -3.107 8.393 1.00 0.00 C ATOM 279 CG2 VAL A 19 -9.414 -2.710 10.840 1.00 0.00 C ATOM 0 H VAL A 19 -6.770 -3.923 10.658 1.00 0.00 H new ATOM 0 HA VAL A 19 -9.186 -5.197 10.328 1.00 0.00 H new ATOM 0 HB VAL A 19 -7.972 -2.690 9.269 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -10.156 -2.058 8.302 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -9.429 -3.446 7.457 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -10.760 -3.703 8.610 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -9.704 -1.669 10.700 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -10.285 -3.292 11.143 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -8.649 -2.772 11.614 1.00 0.00 H new ATOM 289 N TYR A 20 -7.356 -5.314 7.614 1.00 0.00 N ATOM 290 CA TYR A 20 -7.212 -5.979 6.330 1.00 0.00 C ATOM 291 C TYR A 20 -6.079 -7.007 6.368 1.00 0.00 C ATOM 292 O TYR A 20 -5.946 -7.823 5.457 1.00 0.00 O ATOM 293 CB TYR A 20 -6.857 -4.883 5.324 1.00 0.00 C ATOM 294 CG TYR A 20 -5.772 -3.920 5.810 1.00 0.00 C ATOM 295 CD1 TYR A 20 -4.490 -4.380 6.031 1.00 0.00 C ATOM 296 CD2 TYR A 20 -6.076 -2.592 6.028 1.00 0.00 C ATOM 297 CE1 TYR A 20 -3.469 -3.474 6.489 1.00 0.00 C ATOM 298 CE2 TYR A 20 -5.055 -1.685 6.486 1.00 0.00 C ATOM 299 CZ TYR A 20 -3.802 -2.170 6.693 1.00 0.00 C ATOM 300 OH TYR A 20 -2.838 -1.315 7.127 1.00 0.00 O ATOM 0 H TYR A 20 -6.573 -4.714 7.873 1.00 0.00 H new ATOM 0 HA TYR A 20 -8.129 -6.506 6.067 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -6.526 -5.349 4.396 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -7.756 -4.313 5.091 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -4.252 -5.420 5.860 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -7.080 -2.232 5.855 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -2.462 -3.821 6.667 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -5.280 -0.643 6.661 1.00 0.00 H new ATOM 0 HH TYR A 20 -1.955 -1.708 6.964 1.00 0.00 H new ATOM 310 N LEU A 21 -5.293 -6.934 7.431 1.00 0.00 N ATOM 311 CA LEU A 21 -4.175 -7.847 7.599 1.00 0.00 C ATOM 312 C LEU A 21 -4.701 -9.214 8.039 1.00 0.00 C ATOM 313 O LEU A 21 -5.311 -9.336 9.100 1.00 0.00 O ATOM 314 CB LEU A 21 -3.136 -7.253 8.551 1.00 0.00 C ATOM 315 CG LEU A 21 -1.685 -7.286 8.066 1.00 0.00 C ATOM 316 CD1 LEU A 21 -1.163 -8.722 7.994 1.00 0.00 C ATOM 317 CD2 LEU A 21 -1.537 -6.553 6.730 1.00 0.00 C ATOM 0 H LEU A 21 -5.408 -6.257 8.185 1.00 0.00 H new ATOM 0 HA LEU A 21 -3.657 -7.994 6.651 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.407 -6.217 8.752 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -3.194 -7.788 9.499 1.00 0.00 H new ATOM 0 HG LEU A 21 -1.069 -6.757 8.793 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -0.130 -8.717 7.647 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -1.211 -9.177 8.984 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -1.776 -9.298 7.300 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -0.497 -6.591 6.407 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -2.167 -7.032 5.980 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -1.842 -5.513 6.850 1.00 0.00 H new ATOM 329 N LYS A 22 -4.446 -10.210 7.202 1.00 0.00 N ATOM 330 CA LYS A 22 -4.887 -11.563 7.491 1.00 0.00 C ATOM 331 C LYS A 22 -3.665 -12.455 7.720 1.00 0.00 C ATOM 332 O LYS A 22 -2.915 -12.738 6.787 1.00 0.00 O ATOM 333 CB LYS A 22 -5.820 -12.069 6.390 1.00 0.00 C ATOM 334 CG LYS A 22 -7.276 -11.718 6.700 1.00 0.00 C ATOM 335 CD LYS A 22 -8.203 -12.162 5.566 1.00 0.00 C ATOM 336 CE LYS A 22 -9.670 -12.070 5.988 1.00 0.00 C ATOM 337 NZ LYS A 22 -10.187 -13.406 6.358 1.00 0.00 N ATOM 0 H LYS A 22 -3.939 -10.106 6.323 1.00 0.00 H new ATOM 0 HA LYS A 22 -5.474 -11.584 8.409 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -5.532 -11.630 5.435 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -5.716 -13.149 6.289 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -7.579 -12.198 7.631 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -7.370 -10.643 6.851 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -8.034 -11.538 4.688 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -7.967 -13.187 5.279 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -9.770 -11.388 6.833 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -10.264 -11.657 5.173 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -11.184 -13.326 6.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -10.110 -14.046 5.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -9.631 -13.786 7.150 1.00 0.00 H new ATOM 350 N LYS A 23 -3.503 -12.874 8.966 1.00 0.00 N ATOM 351 CA LYS A 23 -2.384 -13.728 9.330 1.00 0.00 C ATOM 352 C LYS A 23 -2.583 -15.112 8.710 1.00 0.00 C ATOM 353 O LYS A 23 -2.619 -16.114 9.421 1.00 0.00 O ATOM 354 CB LYS A 23 -2.201 -13.755 10.849 1.00 0.00 C ATOM 355 CG LYS A 23 -0.747 -13.467 11.230 1.00 0.00 C ATOM 356 CD LYS A 23 -0.600 -13.310 12.745 1.00 0.00 C ATOM 357 CE LYS A 23 0.748 -13.852 13.223 1.00 0.00 C ATOM 358 NZ LYS A 23 0.561 -14.770 14.370 1.00 0.00 N ATOM 0 H LYS A 23 -4.128 -12.638 9.737 1.00 0.00 H new ATOM 0 HA LYS A 23 -1.453 -13.328 8.928 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -2.855 -13.016 11.311 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -2.497 -14.730 11.238 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -0.108 -14.278 10.881 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -0.410 -12.558 10.732 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -0.690 -12.258 13.016 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -1.409 -13.839 13.249 1.00 0.00 H new ATOM 0 HE2 LYS A 23 1.246 -14.377 12.407 1.00 0.00 H new ATOM 0 HE3 LYS A 23 1.397 -13.025 13.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 1.486 -15.129 14.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 0.106 -14.259 15.153 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -0.040 -15.568 14.082 1.00 0.00 H new ATOM 371 N ASP A 24 -2.707 -15.122 7.391 1.00 0.00 N ATOM 372 CA ASP A 24 -2.901 -16.367 6.668 1.00 0.00 C ATOM 373 C ASP A 24 -3.317 -16.056 5.228 1.00 0.00 C ATOM 374 O ASP A 24 -4.156 -16.750 4.655 1.00 0.00 O ATOM 375 CB ASP A 24 -4.008 -17.210 7.307 1.00 0.00 C ATOM 376 CG ASP A 24 -5.278 -16.440 7.669 1.00 0.00 C ATOM 377 OD1 ASP A 24 -5.586 -16.236 8.853 1.00 0.00 O ATOM 378 OD2 ASP A 24 -5.977 -16.036 6.661 1.00 0.00 O ATOM 0 H ASP A 24 -2.677 -14.288 6.804 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.963 -16.922 6.696 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -4.272 -18.015 6.622 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -3.614 -17.676 8.210 1.00 0.00 H new ATOM 384 N LYS A 25 -2.709 -15.014 4.683 1.00 0.00 N ATOM 385 CA LYS A 25 -3.006 -14.601 3.321 1.00 0.00 C ATOM 386 C LYS A 25 -1.936 -13.615 2.847 1.00 0.00 C ATOM 387 O LYS A 25 -1.223 -13.029 3.659 1.00 0.00 O ATOM 388 CB LYS A 25 -4.432 -14.056 3.225 1.00 0.00 C ATOM 389 CG LYS A 25 -5.377 -15.098 2.624 1.00 0.00 C ATOM 390 CD LYS A 25 -6.736 -15.076 3.331 1.00 0.00 C ATOM 391 CE LYS A 25 -7.845 -14.646 2.370 1.00 0.00 C ATOM 392 NZ LYS A 25 -9.157 -15.151 2.835 1.00 0.00 N ATOM 0 H LYS A 25 -2.011 -14.442 5.159 1.00 0.00 H new ATOM 0 HA LYS A 25 -2.972 -15.457 2.647 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -4.783 -13.770 4.216 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -4.440 -13.155 2.611 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -5.513 -14.901 1.561 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -4.934 -16.090 2.711 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -6.959 -16.066 3.730 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -6.698 -14.392 4.179 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -7.871 -13.559 2.299 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -7.636 -15.026 1.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.900 -14.851 2.172 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.133 -16.190 2.880 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.361 -14.768 3.780 1.00 0.00 H new ATOM 405 N PRO A 26 -1.856 -13.458 1.498 1.00 0.00 N ATOM 406 CA PRO A 26 -0.886 -12.553 0.906 1.00 0.00 C ATOM 407 C PRO A 26 -1.315 -11.096 1.084 1.00 0.00 C ATOM 408 O PRO A 26 -2.504 -10.785 1.034 1.00 0.00 O ATOM 409 CB PRO A 26 -0.797 -12.972 -0.553 1.00 0.00 C ATOM 410 CG PRO A 26 -2.051 -13.783 -0.831 1.00 0.00 C ATOM 411 CD PRO A 26 -2.684 -14.137 0.505 1.00 0.00 C ATOM 0 HA PRO A 26 0.092 -12.613 1.385 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.742 -12.101 -1.207 1.00 0.00 H new ATOM 0 HB3 PRO A 26 0.100 -13.564 -0.735 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -2.748 -13.211 -1.444 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -1.805 -14.687 -1.388 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -3.719 -13.799 0.555 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -2.692 -15.215 0.666 1.00 0.00 H new ATOM 419 N THR A 27 -0.324 -10.241 1.290 1.00 0.00 N ATOM 420 CA THR A 27 -0.585 -8.824 1.476 1.00 0.00 C ATOM 421 C THR A 27 0.241 -7.996 0.490 1.00 0.00 C ATOM 422 O THR A 27 1.435 -8.237 0.318 1.00 0.00 O ATOM 423 CB THR A 27 -0.306 -8.480 2.941 1.00 0.00 C ATOM 424 OG1 THR A 27 -1.173 -9.342 3.672 1.00 0.00 O ATOM 425 CG2 THR A 27 -0.776 -7.073 3.313 1.00 0.00 C ATOM 0 H THR A 27 0.661 -10.502 1.332 1.00 0.00 H new ATOM 0 HA THR A 27 -1.626 -8.582 1.263 1.00 0.00 H new ATOM 0 HB THR A 27 0.763 -8.568 3.136 1.00 0.00 H new ATOM 0 HG1 THR A 27 -1.056 -9.186 4.632 1.00 0.00 H new ATOM 0 HG21 THR A 27 -0.554 -6.881 4.363 1.00 0.00 H new ATOM 0 HG22 THR A 27 -0.259 -6.341 2.693 1.00 0.00 H new ATOM 0 HG23 THR A 27 -1.851 -6.993 3.149 1.00 0.00 H new ATOM 433 N LEU A 28 -0.428 -7.036 -0.133 1.00 0.00 N ATOM 434 CA LEU A 28 0.229 -6.172 -1.098 1.00 0.00 C ATOM 435 C LEU A 28 0.229 -4.734 -0.572 1.00 0.00 C ATOM 436 O LEU A 28 -0.789 -4.250 -0.081 1.00 0.00 O ATOM 437 CB LEU A 28 -0.415 -6.321 -2.477 1.00 0.00 C ATOM 438 CG LEU A 28 0.144 -5.420 -3.581 1.00 0.00 C ATOM 439 CD1 LEU A 28 1.138 -6.181 -4.459 1.00 0.00 C ATOM 440 CD2 LEU A 28 -0.985 -4.794 -4.402 1.00 0.00 C ATOM 0 H LEU A 28 -1.418 -6.838 0.012 1.00 0.00 H new ATOM 0 HA LEU A 28 1.271 -6.466 -1.225 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -0.310 -7.358 -2.795 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.483 -6.124 -2.380 1.00 0.00 H new ATOM 0 HG LEU A 28 0.691 -4.603 -3.111 1.00 0.00 H new ATOM 0 HD11 LEU A 28 1.520 -5.518 -5.235 1.00 0.00 H new ATOM 0 HD12 LEU A 28 1.966 -6.537 -3.846 1.00 0.00 H new ATOM 0 HD13 LEU A 28 0.638 -7.031 -4.922 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.560 -4.159 -5.179 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.580 -5.582 -4.863 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -1.620 -4.194 -3.750 1.00 0.00 H new ATOM 452 N ILE A 29 1.383 -4.095 -0.691 1.00 0.00 N ATOM 453 CA ILE A 29 1.529 -2.724 -0.233 1.00 0.00 C ATOM 454 C ILE A 29 1.821 -1.819 -1.431 1.00 0.00 C ATOM 455 O ILE A 29 2.492 -2.230 -2.376 1.00 0.00 O ATOM 456 CB ILE A 29 2.582 -2.637 0.873 1.00 0.00 C ATOM 457 CG1 ILE A 29 2.330 -3.690 1.955 1.00 0.00 C ATOM 458 CG2 ILE A 29 2.654 -1.224 1.454 1.00 0.00 C ATOM 459 CD1 ILE A 29 3.647 -4.246 2.499 1.00 0.00 C ATOM 0 H ILE A 29 2.226 -4.501 -1.098 1.00 0.00 H new ATOM 0 HA ILE A 29 0.600 -2.372 0.215 1.00 0.00 H new ATOM 0 HB ILE A 29 3.556 -2.853 0.434 1.00 0.00 H new ATOM 0 HG12 ILE A 29 1.754 -3.249 2.769 1.00 0.00 H new ATOM 0 HG13 ILE A 29 1.731 -4.502 1.544 1.00 0.00 H new ATOM 0 HG21 ILE A 29 3.411 -1.191 2.238 1.00 0.00 H new ATOM 0 HG22 ILE A 29 2.918 -0.519 0.665 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.685 -0.953 1.873 1.00 0.00 H new ATOM 0 HD11 ILE A 29 3.438 -4.992 3.266 1.00 0.00 H new ATOM 0 HD12 ILE A 29 4.210 -4.708 1.688 1.00 0.00 H new ATOM 0 HD13 ILE A 29 4.233 -3.435 2.932 1.00 0.00 H new ATOM 471 N LYS A 30 1.301 -0.603 -1.353 1.00 0.00 N ATOM 472 CA LYS A 30 1.496 0.364 -2.420 1.00 0.00 C ATOM 473 C LYS A 30 1.825 1.729 -1.812 1.00 0.00 C ATOM 474 O LYS A 30 0.969 2.357 -1.191 1.00 0.00 O ATOM 475 CB LYS A 30 0.286 0.384 -3.355 1.00 0.00 C ATOM 476 CG LYS A 30 0.194 1.712 -4.108 1.00 0.00 C ATOM 477 CD LYS A 30 -0.296 1.498 -5.542 1.00 0.00 C ATOM 478 CE LYS A 30 -1.521 2.365 -5.838 1.00 0.00 C ATOM 479 NZ LYS A 30 -1.114 3.634 -6.483 1.00 0.00 N ATOM 0 H LYS A 30 0.745 -0.265 -0.568 1.00 0.00 H new ATOM 0 HA LYS A 30 2.345 0.078 -3.041 1.00 0.00 H new ATOM 0 HB2 LYS A 30 0.360 -0.437 -4.068 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -0.625 0.225 -2.779 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -0.486 2.384 -3.584 1.00 0.00 H new ATOM 0 HG3 LYS A 30 1.171 2.194 -4.122 1.00 0.00 H new ATOM 0 HD2 LYS A 30 0.503 1.740 -6.243 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -0.545 0.447 -5.692 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -2.208 1.824 -6.488 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -2.057 2.576 -4.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -1.957 4.211 -6.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -0.476 4.156 -5.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -0.623 3.428 -7.376 1.00 0.00 H new ATOM 492 N PHE A 31 3.065 2.147 -2.012 1.00 0.00 N ATOM 493 CA PHE A 31 3.518 3.426 -1.491 1.00 0.00 C ATOM 494 C PHE A 31 3.200 4.559 -2.469 1.00 0.00 C ATOM 495 O PHE A 31 3.474 4.449 -3.663 1.00 0.00 O ATOM 496 CB PHE A 31 5.035 3.327 -1.316 1.00 0.00 C ATOM 497 CG PHE A 31 5.488 2.135 -0.474 1.00 0.00 C ATOM 498 CD1 PHE A 31 5.653 0.915 -1.052 1.00 0.00 C ATOM 499 CD2 PHE A 31 5.726 2.294 0.857 1.00 0.00 C ATOM 500 CE1 PHE A 31 6.075 -0.192 -0.270 1.00 0.00 C ATOM 501 CE2 PHE A 31 6.147 1.185 1.639 1.00 0.00 C ATOM 502 CZ PHE A 31 6.313 -0.034 1.060 1.00 0.00 C ATOM 0 H PHE A 31 3.771 1.623 -2.528 1.00 0.00 H new ATOM 0 HA PHE A 31 3.015 3.644 -0.549 1.00 0.00 H new ATOM 0 HB2 PHE A 31 5.500 3.261 -2.300 1.00 0.00 H new ATOM 0 HB3 PHE A 31 5.397 4.245 -0.853 1.00 0.00 H new ATOM 0 HD1 PHE A 31 5.463 0.788 -2.108 1.00 0.00 H new ATOM 0 HD2 PHE A 31 5.595 3.262 1.318 1.00 0.00 H new ATOM 0 HE1 PHE A 31 6.207 -1.160 -0.731 1.00 0.00 H new ATOM 0 HE2 PHE A 31 6.335 1.310 2.695 1.00 0.00 H new ATOM 0 HZ PHE A 31 6.634 -0.876 1.655 1.00 0.00 H new ATOM 512 N TRP A 32 2.629 5.624 -1.925 1.00 0.00 N ATOM 513 CA TRP A 32 2.272 6.777 -2.734 1.00 0.00 C ATOM 514 C TRP A 32 2.679 8.037 -1.967 1.00 0.00 C ATOM 515 O TRP A 32 3.042 7.965 -0.794 1.00 0.00 O ATOM 516 CB TRP A 32 0.787 6.752 -3.098 1.00 0.00 C ATOM 517 CG TRP A 32 -0.151 6.733 -1.890 1.00 0.00 C ATOM 518 CD1 TRP A 32 -0.322 5.751 -0.994 1.00 0.00 C ATOM 519 CD2 TRP A 32 -1.044 7.789 -1.477 1.00 0.00 C ATOM 520 NE1 TRP A 32 -1.257 6.096 -0.038 1.00 0.00 N ATOM 521 CE2 TRP A 32 -1.709 7.375 -0.341 1.00 0.00 C ATOM 522 CE3 TRP A 32 -1.282 9.053 -2.045 1.00 0.00 C ATOM 523 CZ2 TRP A 32 -2.655 8.163 0.323 1.00 0.00 C ATOM 524 CZ3 TRP A 32 -2.231 9.830 -1.369 1.00 0.00 C ATOM 525 CH2 TRP A 32 -2.908 9.427 -0.225 1.00 0.00 C ATOM 0 H TRP A 32 2.405 5.712 -0.934 1.00 0.00 H new ATOM 0 HA TRP A 32 2.805 6.761 -3.685 1.00 0.00 H new ATOM 0 HB2 TRP A 32 0.559 7.626 -3.708 1.00 0.00 H new ATOM 0 HB3 TRP A 32 0.589 5.874 -3.712 1.00 0.00 H new ATOM 0 HD1 TRP A 32 0.205 4.809 -1.017 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -1.560 5.518 0.746 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -0.773 9.398 -2.933 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -3.163 7.815 1.210 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -2.452 10.810 -1.765 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -3.627 10.086 0.240 1.00 0.00 H new ATOM 536 N ALA A 33 2.604 9.164 -2.661 1.00 0.00 N ATOM 537 CA ALA A 33 2.959 10.438 -2.060 1.00 0.00 C ATOM 538 C ALA A 33 1.795 11.416 -2.225 1.00 0.00 C ATOM 539 O ALA A 33 1.052 11.344 -3.203 1.00 0.00 O ATOM 540 CB ALA A 33 4.252 10.957 -2.693 1.00 0.00 C ATOM 0 H ALA A 33 2.303 9.221 -3.634 1.00 0.00 H new ATOM 0 HA ALA A 33 3.142 10.322 -0.992 1.00 0.00 H new ATOM 0 HB1 ALA A 33 4.519 11.913 -2.243 1.00 0.00 H new ATOM 0 HB2 ALA A 33 5.054 10.239 -2.523 1.00 0.00 H new ATOM 0 HB3 ALA A 33 4.105 11.089 -3.765 1.00 0.00 H new ATOM 546 N SER A 34 1.674 12.311 -1.256 1.00 0.00 N ATOM 547 CA SER A 34 0.614 13.303 -1.280 1.00 0.00 C ATOM 548 C SER A 34 0.976 14.431 -2.247 1.00 0.00 C ATOM 549 O SER A 34 0.100 15.012 -2.885 1.00 0.00 O ATOM 550 CB SER A 34 0.351 13.866 0.118 1.00 0.00 C ATOM 551 OG SER A 34 -1.030 13.811 0.466 1.00 0.00 O ATOM 0 H SER A 34 2.294 12.370 -0.448 1.00 0.00 H new ATOM 0 HA SER A 34 -0.300 12.817 -1.623 1.00 0.00 H new ATOM 0 HB2 SER A 34 0.932 13.304 0.850 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.695 14.899 0.163 1.00 0.00 H new ATOM 0 HG SER A 34 -1.155 13.187 1.211 1.00 0.00 H new ATOM 557 N TRP A 35 2.269 14.709 -2.323 1.00 0.00 N ATOM 558 CA TRP A 35 2.759 15.758 -3.201 1.00 0.00 C ATOM 559 C TRP A 35 2.673 15.249 -4.642 1.00 0.00 C ATOM 560 O TRP A 35 2.919 15.998 -5.585 1.00 0.00 O ATOM 561 CB TRP A 35 4.172 16.191 -2.805 1.00 0.00 C ATOM 562 CG TRP A 35 5.151 15.030 -2.626 1.00 0.00 C ATOM 563 CD1 TRP A 35 5.654 14.543 -1.483 1.00 0.00 C ATOM 564 CD2 TRP A 35 5.729 14.224 -3.674 1.00 0.00 C ATOM 565 NE1 TRP A 35 6.511 13.487 -1.717 1.00 0.00 N ATOM 566 CE2 TRP A 35 6.558 13.286 -3.091 1.00 0.00 C ATOM 567 CE3 TRP A 35 5.558 14.283 -5.068 1.00 0.00 C ATOM 568 CZ2 TRP A 35 7.280 12.338 -3.828 1.00 0.00 C ATOM 569 CZ3 TRP A 35 6.286 13.330 -5.789 1.00 0.00 C ATOM 570 CH2 TRP A 35 7.124 12.380 -5.218 1.00 0.00 C ATOM 0 H TRP A 35 2.993 14.226 -1.791 1.00 0.00 H new ATOM 0 HA TRP A 35 2.144 16.653 -3.110 1.00 0.00 H new ATOM 0 HB2 TRP A 35 4.561 16.867 -3.567 1.00 0.00 H new ATOM 0 HB3 TRP A 35 4.120 16.756 -1.874 1.00 0.00 H new ATOM 0 HD1 TRP A 35 5.418 14.929 -0.502 1.00 0.00 H new ATOM 0 HE1 TRP A 35 7.017 12.952 -1.011 1.00 0.00 H new ATOM 0 HE3 TRP A 35 4.915 15.007 -5.545 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 7.922 11.614 -3.349 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 6.190 13.333 -6.865 1.00 0.00 H new ATOM 0 HH2 TRP A 35 7.653 11.677 -5.844 1.00 0.00 H new ATOM 581 N CYS A 36 2.323 13.976 -4.765 1.00 0.00 N ATOM 582 CA CYS A 36 2.201 13.357 -6.074 1.00 0.00 C ATOM 583 C CYS A 36 0.727 13.378 -6.479 1.00 0.00 C ATOM 584 O CYS A 36 -0.092 12.671 -5.892 1.00 0.00 O ATOM 585 CB CYS A 36 2.778 11.940 -6.086 1.00 0.00 C ATOM 586 SG CYS A 36 2.754 11.269 -7.787 1.00 0.00 S ATOM 0 H CYS A 36 2.120 13.357 -3.980 1.00 0.00 H new ATOM 0 HA CYS A 36 2.784 13.921 -6.802 1.00 0.00 H new ATOM 0 HB2 CYS A 36 3.799 11.951 -5.705 1.00 0.00 H new ATOM 0 HB3 CYS A 36 2.198 11.297 -5.424 1.00 0.00 H new ATOM 0 HG CYS A 36 2.480 9.999 -7.749 1.00 0.00 H new ATOM 592 N PRO A 37 0.425 14.215 -7.507 1.00 0.00 N ATOM 593 CA PRO A 37 -0.937 14.336 -7.999 1.00 0.00 C ATOM 594 C PRO A 37 -1.330 13.115 -8.833 1.00 0.00 C ATOM 595 O PRO A 37 -2.445 12.609 -8.713 1.00 0.00 O ATOM 596 CB PRO A 37 -0.955 15.629 -8.796 1.00 0.00 C ATOM 597 CG PRO A 37 0.497 15.945 -9.110 1.00 0.00 C ATOM 598 CD PRO A 37 1.367 15.065 -8.226 1.00 0.00 C ATOM 0 HA PRO A 37 -1.672 14.369 -7.195 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -1.537 15.516 -9.711 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -1.415 16.434 -8.223 1.00 0.00 H new ATOM 0 HG2 PRO A 37 0.710 15.758 -10.163 1.00 0.00 H new ATOM 0 HG3 PRO A 37 0.707 16.998 -8.925 1.00 0.00 H new ATOM 0 HD2 PRO A 37 2.062 14.471 -8.820 1.00 0.00 H new ATOM 0 HD3 PRO A 37 1.965 15.663 -7.538 1.00 0.00 H new ATOM 606 N LEU A 38 -0.392 12.675 -9.659 1.00 0.00 N ATOM 607 CA LEU A 38 -0.626 11.523 -10.513 1.00 0.00 C ATOM 608 C LEU A 38 -0.993 10.317 -9.645 1.00 0.00 C ATOM 609 O LEU A 38 -1.780 9.467 -10.058 1.00 0.00 O ATOM 610 CB LEU A 38 0.577 11.280 -11.426 1.00 0.00 C ATOM 611 CG LEU A 38 0.400 10.199 -12.494 1.00 0.00 C ATOM 612 CD1 LEU A 38 0.843 8.832 -11.970 1.00 0.00 C ATOM 613 CD2 LEU A 38 -1.038 10.176 -13.018 1.00 0.00 C ATOM 0 H LEU A 38 0.532 13.096 -9.755 1.00 0.00 H new ATOM 0 HA LEU A 38 -1.470 11.707 -11.178 1.00 0.00 H new ATOM 0 HB2 LEU A 38 0.826 12.217 -11.924 1.00 0.00 H new ATOM 0 HB3 LEU A 38 1.432 11.013 -10.805 1.00 0.00 H new ATOM 0 HG LEU A 38 1.045 10.443 -13.338 1.00 0.00 H new ATOM 0 HD11 LEU A 38 0.707 8.082 -12.749 1.00 0.00 H new ATOM 0 HD12 LEU A 38 1.895 8.874 -11.687 1.00 0.00 H new ATOM 0 HD13 LEU A 38 0.244 8.564 -11.100 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -1.137 9.399 -13.776 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -1.722 9.969 -12.195 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -1.281 11.144 -13.457 1.00 0.00 H new ATOM 625 N CYS A 39 -0.405 10.281 -8.458 1.00 0.00 N ATOM 626 CA CYS A 39 -0.660 9.194 -7.529 1.00 0.00 C ATOM 627 C CYS A 39 -2.069 9.370 -6.958 1.00 0.00 C ATOM 628 O CYS A 39 -2.872 8.439 -6.980 1.00 0.00 O ATOM 629 CB CYS A 39 0.398 9.133 -6.426 1.00 0.00 C ATOM 630 SG CYS A 39 1.730 7.969 -6.901 1.00 0.00 S ATOM 0 H CYS A 39 0.247 10.988 -8.119 1.00 0.00 H new ATOM 0 HA CYS A 39 -0.598 8.241 -8.055 1.00 0.00 H new ATOM 0 HB2 CYS A 39 0.815 10.126 -6.255 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -0.059 8.813 -5.489 1.00 0.00 H new ATOM 0 HG CYS A 39 2.625 7.926 -5.959 1.00 0.00 H new ATOM 636 N LEU A 40 -2.325 10.571 -6.460 1.00 0.00 N ATOM 637 CA LEU A 40 -3.623 10.881 -5.884 1.00 0.00 C ATOM 638 C LEU A 40 -4.720 10.512 -6.885 1.00 0.00 C ATOM 639 O LEU A 40 -5.799 10.071 -6.492 1.00 0.00 O ATOM 640 CB LEU A 40 -3.671 12.340 -5.427 1.00 0.00 C ATOM 641 CG LEU A 40 -3.288 12.600 -3.970 1.00 0.00 C ATOM 642 CD1 LEU A 40 -1.844 13.093 -3.862 1.00 0.00 C ATOM 643 CD2 LEU A 40 -4.273 13.565 -3.307 1.00 0.00 C ATOM 0 H LEU A 40 -1.656 11.341 -6.443 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.796 10.285 -4.988 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -3.007 12.922 -6.066 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -4.681 12.718 -5.589 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.348 11.656 -3.428 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -1.597 13.270 -2.815 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.171 12.340 -4.271 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -1.733 14.021 -4.423 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -3.977 13.732 -2.271 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.270 14.514 -3.843 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -5.275 13.137 -3.333 1.00 0.00 H new ATOM 655 N SER A 41 -4.407 10.706 -8.157 1.00 0.00 N ATOM 656 CA SER A 41 -5.353 10.400 -9.216 1.00 0.00 C ATOM 657 C SER A 41 -5.470 8.884 -9.390 1.00 0.00 C ATOM 658 O SER A 41 -6.494 8.387 -9.858 1.00 0.00 O ATOM 659 CB SER A 41 -4.937 11.056 -10.534 1.00 0.00 C ATOM 660 OG SER A 41 -5.500 12.357 -10.684 1.00 0.00 O ATOM 0 H SER A 41 -3.511 11.072 -8.479 1.00 0.00 H new ATOM 0 HA SER A 41 -6.325 10.803 -8.933 1.00 0.00 H new ATOM 0 HB2 SER A 41 -3.850 11.124 -10.578 1.00 0.00 H new ATOM 0 HB3 SER A 41 -5.251 10.427 -11.367 1.00 0.00 H new ATOM 0 HG SER A 41 -5.209 12.743 -11.537 1.00 0.00 H new ATOM 666 N GLU A 42 -4.407 8.193 -9.007 1.00 0.00 N ATOM 667 CA GLU A 42 -4.377 6.744 -9.116 1.00 0.00 C ATOM 668 C GLU A 42 -5.049 6.106 -7.898 1.00 0.00 C ATOM 669 O GLU A 42 -5.381 4.923 -7.917 1.00 0.00 O ATOM 670 CB GLU A 42 -2.943 6.236 -9.279 1.00 0.00 C ATOM 671 CG GLU A 42 -2.837 5.264 -10.457 1.00 0.00 C ATOM 672 CD GLU A 42 -2.812 6.017 -11.788 1.00 0.00 C ATOM 673 OE1 GLU A 42 -3.743 6.780 -12.087 1.00 0.00 O ATOM 674 OE2 GLU A 42 -1.779 5.788 -12.526 1.00 0.00 O ATOM 0 H GLU A 42 -3.560 8.609 -8.621 1.00 0.00 H new ATOM 0 HA GLU A 42 -4.934 6.455 -10.007 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -2.270 7.079 -9.437 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -2.623 5.740 -8.363 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -1.933 4.664 -10.358 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -3.681 4.574 -10.441 1.00 0.00 H new ATOM 682 N LEU A 43 -5.229 6.921 -6.868 1.00 0.00 N ATOM 683 CA LEU A 43 -5.856 6.450 -5.644 1.00 0.00 C ATOM 684 C LEU A 43 -7.238 5.881 -5.970 1.00 0.00 C ATOM 685 O LEU A 43 -7.536 4.736 -5.636 1.00 0.00 O ATOM 686 CB LEU A 43 -5.880 7.563 -4.593 1.00 0.00 C ATOM 687 CG LEU A 43 -4.539 7.893 -3.934 1.00 0.00 C ATOM 688 CD1 LEU A 43 -4.681 9.064 -2.961 1.00 0.00 C ATOM 689 CD2 LEU A 43 -3.942 6.655 -3.259 1.00 0.00 C ATOM 0 H LEU A 43 -4.952 7.903 -6.856 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.274 5.640 -5.204 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.265 8.469 -5.061 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -6.587 7.283 -3.812 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.842 8.204 -4.712 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.714 9.278 -2.506 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -5.032 9.944 -3.500 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.399 8.805 -2.183 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.989 6.916 -2.798 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.628 6.291 -2.494 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.783 5.875 -4.004 1.00 0.00 H new ATOM 701 N GLY A 44 -8.046 6.708 -6.617 1.00 0.00 N ATOM 702 CA GLY A 44 -9.389 6.303 -6.991 1.00 0.00 C ATOM 703 C GLY A 44 -9.374 4.949 -7.705 1.00 0.00 C ATOM 704 O GLY A 44 -10.128 4.045 -7.345 1.00 0.00 O ATOM 0 H GLY A 44 -7.795 7.658 -6.892 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -10.016 6.242 -6.101 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -9.832 7.057 -7.642 1.00 0.00 H new ATOM 708 N GLN A 45 -8.509 4.852 -8.703 1.00 0.00 N ATOM 709 CA GLN A 45 -8.386 3.624 -9.470 1.00 0.00 C ATOM 710 C GLN A 45 -7.904 2.483 -8.573 1.00 0.00 C ATOM 711 O GLN A 45 -8.225 1.320 -8.814 1.00 0.00 O ATOM 712 CB GLN A 45 -7.449 3.815 -10.664 1.00 0.00 C ATOM 713 CG GLN A 45 -7.543 2.633 -11.632 1.00 0.00 C ATOM 714 CD GLN A 45 -7.737 3.116 -13.070 1.00 0.00 C ATOM 715 OE1 GLN A 45 -8.845 3.257 -13.562 1.00 0.00 O ATOM 716 NE2 GLN A 45 -6.601 3.362 -13.716 1.00 0.00 N ATOM 0 H GLN A 45 -7.886 5.604 -8.999 1.00 0.00 H new ATOM 0 HA GLN A 45 -9.370 3.363 -9.860 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -7.703 4.738 -11.186 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -6.423 3.920 -10.312 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -6.637 2.031 -11.566 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -8.375 1.989 -11.346 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -5.707 3.223 -13.246 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -6.624 3.689 -14.682 1.00 0.00 H new ATOM 725 N THR A 46 -7.142 2.855 -7.555 1.00 0.00 N ATOM 726 CA THR A 46 -6.613 1.877 -6.619 1.00 0.00 C ATOM 727 C THR A 46 -7.726 1.354 -5.709 1.00 0.00 C ATOM 728 O THR A 46 -7.747 0.173 -5.365 1.00 0.00 O ATOM 729 CB THR A 46 -5.459 2.529 -5.854 1.00 0.00 C ATOM 730 OG1 THR A 46 -4.477 2.780 -6.856 1.00 0.00 O ATOM 731 CG2 THR A 46 -4.772 1.559 -4.893 1.00 0.00 C ATOM 0 H THR A 46 -6.878 3.820 -7.358 1.00 0.00 H new ATOM 0 HA THR A 46 -6.223 1.002 -7.140 1.00 0.00 H new ATOM 0 HB THR A 46 -5.832 3.388 -5.296 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.486 3.731 -7.092 1.00 0.00 H new ATOM 0 HG21 THR A 46 -3.961 2.072 -4.376 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.496 1.196 -4.163 1.00 0.00 H new ATOM 0 HG23 THR A 46 -4.369 0.716 -5.454 1.00 0.00 H new ATOM 739 N GLU A 47 -8.623 2.257 -5.345 1.00 0.00 N ATOM 740 CA GLU A 47 -9.736 1.901 -4.482 1.00 0.00 C ATOM 741 C GLU A 47 -10.687 0.948 -5.209 1.00 0.00 C ATOM 742 O GLU A 47 -11.357 0.132 -4.576 1.00 0.00 O ATOM 743 CB GLU A 47 -10.476 3.150 -3.999 1.00 0.00 C ATOM 744 CG GLU A 47 -11.429 2.813 -2.849 1.00 0.00 C ATOM 745 CD GLU A 47 -12.380 3.976 -2.566 1.00 0.00 C ATOM 746 OE1 GLU A 47 -12.902 4.595 -3.507 1.00 0.00 O ATOM 747 OE2 GLU A 47 -12.573 4.233 -1.316 1.00 0.00 O ATOM 0 H GLU A 47 -8.602 3.236 -5.632 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.341 1.390 -3.604 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -9.756 3.900 -3.671 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -11.037 3.587 -4.825 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -12.004 1.921 -3.098 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.855 2.582 -1.952 1.00 0.00 H new ATOM 755 N LYS A 48 -10.716 1.081 -6.526 1.00 0.00 N ATOM 756 CA LYS A 48 -11.574 0.242 -7.345 1.00 0.00 C ATOM 757 C LYS A 48 -10.927 -1.135 -7.507 1.00 0.00 C ATOM 758 O LYS A 48 -11.623 -2.137 -7.668 1.00 0.00 O ATOM 759 CB LYS A 48 -11.893 0.933 -8.672 1.00 0.00 C ATOM 760 CG LYS A 48 -12.583 -0.030 -9.640 1.00 0.00 C ATOM 761 CD LYS A 48 -13.323 0.736 -10.738 1.00 0.00 C ATOM 762 CE LYS A 48 -12.832 0.316 -12.125 1.00 0.00 C ATOM 763 NZ LYS A 48 -13.177 1.345 -13.132 1.00 0.00 N ATOM 0 H LYS A 48 -10.159 1.758 -7.047 1.00 0.00 H new ATOM 0 HA LYS A 48 -12.536 0.088 -6.856 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -12.535 1.795 -8.492 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -10.973 1.309 -9.121 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -11.843 -0.693 -10.089 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -13.285 -0.660 -9.094 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -14.394 0.552 -10.656 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -13.173 1.807 -10.604 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -11.753 0.166 -12.105 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -13.281 -0.638 -12.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -12.836 1.043 -14.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.209 1.468 -13.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -12.728 2.247 -12.874 1.00 0.00 H new ATOM 776 N TRP A 49 -9.603 -1.141 -7.461 1.00 0.00 N ATOM 777 CA TRP A 49 -8.855 -2.377 -7.602 1.00 0.00 C ATOM 778 C TRP A 49 -8.971 -3.153 -6.289 1.00 0.00 C ATOM 779 O TRP A 49 -8.898 -4.381 -6.280 1.00 0.00 O ATOM 780 CB TRP A 49 -7.406 -2.099 -8.006 1.00 0.00 C ATOM 781 CG TRP A 49 -7.246 -1.592 -9.440 1.00 0.00 C ATOM 782 CD1 TRP A 49 -8.209 -1.298 -10.324 1.00 0.00 C ATOM 783 CD2 TRP A 49 -6.002 -1.328 -10.126 1.00 0.00 C ATOM 784 NE1 TRP A 49 -7.679 -0.867 -11.524 1.00 0.00 N ATOM 785 CE2 TRP A 49 -6.296 -0.886 -11.399 1.00 0.00 C ATOM 786 CE3 TRP A 49 -4.674 -1.461 -9.683 1.00 0.00 C ATOM 787 CZ2 TRP A 49 -5.314 -0.539 -12.335 1.00 0.00 C ATOM 788 CZ3 TRP A 49 -3.705 -1.109 -10.631 1.00 0.00 C ATOM 789 CH2 TRP A 49 -3.984 -0.663 -11.917 1.00 0.00 C ATOM 0 H TRP A 49 -9.029 -0.308 -7.328 1.00 0.00 H new ATOM 0 HA TRP A 49 -9.268 -2.988 -8.405 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -6.984 -1.363 -7.322 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -6.825 -3.014 -7.888 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -9.266 -1.387 -10.123 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -8.206 -0.586 -12.351 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -4.422 -1.807 -8.691 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -5.569 -0.194 -13.326 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -2.668 -1.190 -10.342 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -3.178 -0.413 -12.591 1.00 0.00 H new ATOM 800 N ALA A 50 -9.150 -2.404 -5.211 1.00 0.00 N ATOM 801 CA ALA A 50 -9.276 -3.006 -3.894 1.00 0.00 C ATOM 802 C ALA A 50 -10.656 -3.654 -3.765 1.00 0.00 C ATOM 803 O ALA A 50 -10.923 -4.370 -2.801 1.00 0.00 O ATOM 804 CB ALA A 50 -9.029 -1.944 -2.821 1.00 0.00 C ATOM 0 H ALA A 50 -9.211 -1.386 -5.222 1.00 0.00 H new ATOM 0 HA ALA A 50 -8.529 -3.788 -3.757 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -9.124 -2.396 -1.833 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -8.026 -1.535 -2.938 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -9.762 -1.144 -2.926 1.00 0.00 H new ATOM 810 N GLN A 51 -11.497 -3.381 -4.752 1.00 0.00 N ATOM 811 CA GLN A 51 -12.844 -3.928 -4.760 1.00 0.00 C ATOM 812 C GLN A 51 -12.948 -5.063 -5.781 1.00 0.00 C ATOM 813 O GLN A 51 -13.922 -5.812 -5.784 1.00 0.00 O ATOM 814 CB GLN A 51 -13.877 -2.837 -5.047 1.00 0.00 C ATOM 815 CG GLN A 51 -14.099 -1.956 -3.816 1.00 0.00 C ATOM 816 CD GLN A 51 -15.377 -2.359 -3.076 1.00 0.00 C ATOM 817 OE1 GLN A 51 -16.045 -3.320 -3.418 1.00 0.00 O ATOM 818 NE2 GLN A 51 -15.677 -1.572 -2.047 1.00 0.00 N ATOM 0 H GLN A 51 -11.272 -2.789 -5.551 1.00 0.00 H new ATOM 0 HA GLN A 51 -13.057 -4.333 -3.771 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -13.540 -2.223 -5.882 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -14.820 -3.294 -5.347 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -13.244 -2.040 -3.145 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -14.164 -0.911 -4.119 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -15.073 -0.783 -1.815 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -16.511 -1.757 -1.489 1.00 0.00 H new ATOM 827 N ASP A 52 -11.929 -5.154 -6.623 1.00 0.00 N ATOM 828 CA ASP A 52 -11.893 -6.185 -7.647 1.00 0.00 C ATOM 829 C ASP A 52 -11.698 -7.550 -6.983 1.00 0.00 C ATOM 830 O ASP A 52 -10.785 -7.729 -6.180 1.00 0.00 O ATOM 831 CB ASP A 52 -10.731 -5.961 -8.615 1.00 0.00 C ATOM 832 CG ASP A 52 -10.316 -7.192 -9.424 1.00 0.00 C ATOM 833 OD1 ASP A 52 -9.170 -7.658 -9.334 1.00 0.00 O ATOM 834 OD2 ASP A 52 -11.237 -7.681 -10.181 1.00 0.00 O ATOM 0 H ASP A 52 -11.122 -4.531 -6.617 1.00 0.00 H new ATOM 0 HA ASP A 52 -12.833 -6.146 -8.197 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -11.003 -5.165 -9.308 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -9.869 -5.610 -8.049 1.00 0.00 H new ATOM 840 N ALA A 53 -12.573 -8.478 -7.343 1.00 0.00 N ATOM 841 CA ALA A 53 -12.508 -9.821 -6.793 1.00 0.00 C ATOM 842 C ALA A 53 -11.106 -10.391 -7.012 1.00 0.00 C ATOM 843 O ALA A 53 -10.497 -10.924 -6.086 1.00 0.00 O ATOM 844 CB ALA A 53 -13.597 -10.687 -7.432 1.00 0.00 C ATOM 0 H ALA A 53 -13.331 -8.326 -8.009 1.00 0.00 H new ATOM 0 HA ALA A 53 -12.692 -9.805 -5.719 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -13.549 -11.695 -7.020 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -14.575 -10.255 -7.221 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -13.443 -10.728 -8.510 1.00 0.00 H new ATOM 850 N LYS A 54 -10.633 -10.259 -8.243 1.00 0.00 N ATOM 851 CA LYS A 54 -9.314 -10.754 -8.596 1.00 0.00 C ATOM 852 C LYS A 54 -8.297 -10.264 -7.563 1.00 0.00 C ATOM 853 O LYS A 54 -7.405 -11.010 -7.161 1.00 0.00 O ATOM 854 CB LYS A 54 -8.964 -10.369 -10.034 1.00 0.00 C ATOM 855 CG LYS A 54 -8.463 -11.581 -10.821 1.00 0.00 C ATOM 856 CD LYS A 54 -8.888 -11.495 -12.289 1.00 0.00 C ATOM 857 CE LYS A 54 -9.785 -12.675 -12.671 1.00 0.00 C ATOM 858 NZ LYS A 54 -11.182 -12.418 -12.255 1.00 0.00 N ATOM 0 H LYS A 54 -11.141 -9.816 -9.009 1.00 0.00 H new ATOM 0 HA LYS A 54 -9.296 -11.844 -8.569 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -9.842 -9.950 -10.526 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -8.199 -9.592 -10.030 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -7.376 -11.638 -10.756 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -8.857 -12.495 -10.377 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -9.419 -10.559 -12.463 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -8.004 -11.484 -12.927 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -9.744 -12.837 -13.748 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -9.420 -13.586 -12.197 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -11.778 -13.228 -12.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -11.218 -12.285 -11.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -11.533 -11.560 -12.727 1.00 0.00 H new ATOM 871 N PHE A 55 -8.465 -9.011 -7.164 1.00 0.00 N ATOM 872 CA PHE A 55 -7.573 -8.413 -6.185 1.00 0.00 C ATOM 873 C PHE A 55 -7.895 -8.907 -4.774 1.00 0.00 C ATOM 874 O PHE A 55 -7.014 -8.965 -3.916 1.00 0.00 O ATOM 875 CB PHE A 55 -7.795 -6.900 -6.244 1.00 0.00 C ATOM 876 CG PHE A 55 -6.737 -6.147 -7.054 1.00 0.00 C ATOM 877 CD1 PHE A 55 -5.506 -5.923 -6.524 1.00 0.00 C ATOM 878 CD2 PHE A 55 -7.029 -5.702 -8.308 1.00 0.00 C ATOM 879 CE1 PHE A 55 -4.525 -5.223 -7.275 1.00 0.00 C ATOM 880 CE2 PHE A 55 -6.048 -5.004 -9.059 1.00 0.00 C ATOM 881 CZ PHE A 55 -4.817 -4.779 -8.527 1.00 0.00 C ATOM 0 H PHE A 55 -9.205 -8.395 -7.501 1.00 0.00 H new ATOM 0 HA PHE A 55 -6.541 -8.683 -6.409 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -8.776 -6.704 -6.676 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -7.809 -6.505 -5.228 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -5.274 -6.278 -5.531 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -8.007 -5.880 -8.730 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -3.548 -5.043 -6.852 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -6.279 -4.651 -10.053 1.00 0.00 H new ATOM 0 HZ PHE A 55 -4.071 -4.247 -9.099 1.00 0.00 H new ATOM 891 N SER A 56 -9.159 -9.253 -4.576 1.00 0.00 N ATOM 892 CA SER A 56 -9.607 -9.742 -3.283 1.00 0.00 C ATOM 893 C SER A 56 -8.733 -10.915 -2.835 1.00 0.00 C ATOM 894 O SER A 56 -8.385 -11.020 -1.659 1.00 0.00 O ATOM 895 CB SER A 56 -11.077 -10.166 -3.335 1.00 0.00 C ATOM 896 OG SER A 56 -11.664 -10.216 -2.037 1.00 0.00 O ATOM 0 H SER A 56 -9.887 -9.204 -5.289 1.00 0.00 H new ATOM 0 HA SER A 56 -9.515 -8.932 -2.560 1.00 0.00 H new ATOM 0 HB2 SER A 56 -11.634 -9.467 -3.958 1.00 0.00 H new ATOM 0 HB3 SER A 56 -11.155 -11.146 -3.806 1.00 0.00 H new ATOM 0 HG SER A 56 -12.602 -10.489 -2.113 1.00 0.00 H new ATOM 902 N SER A 57 -8.402 -11.766 -3.794 1.00 0.00 N ATOM 903 CA SER A 57 -7.574 -12.926 -3.512 1.00 0.00 C ATOM 904 C SER A 57 -6.476 -12.556 -2.513 1.00 0.00 C ATOM 905 O SER A 57 -6.122 -13.356 -1.649 1.00 0.00 O ATOM 906 CB SER A 57 -6.957 -13.488 -4.795 1.00 0.00 C ATOM 907 OG SER A 57 -6.910 -14.911 -4.786 1.00 0.00 O ATOM 0 H SER A 57 -8.692 -11.676 -4.768 1.00 0.00 H new ATOM 0 HA SER A 57 -8.207 -13.699 -3.076 1.00 0.00 H new ATOM 0 HB2 SER A 57 -7.536 -13.150 -5.654 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.948 -13.093 -4.915 1.00 0.00 H new ATOM 0 HG SER A 57 -6.511 -15.230 -5.622 1.00 0.00 H new ATOM 913 N ALA A 58 -5.966 -11.341 -2.666 1.00 0.00 N ATOM 914 CA ALA A 58 -4.915 -10.856 -1.788 1.00 0.00 C ATOM 915 C ALA A 58 -5.354 -9.530 -1.161 1.00 0.00 C ATOM 916 O ALA A 58 -6.314 -8.912 -1.616 1.00 0.00 O ATOM 917 CB ALA A 58 -3.611 -10.724 -2.577 1.00 0.00 C ATOM 0 H ALA A 58 -6.261 -10.680 -3.384 1.00 0.00 H new ATOM 0 HA ALA A 58 -4.735 -11.562 -0.977 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -2.822 -10.360 -1.918 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -3.328 -11.697 -2.978 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -3.752 -10.020 -3.397 1.00 0.00 H new ATOM 923 N ASN A 59 -4.628 -9.135 -0.126 1.00 0.00 N ATOM 924 CA ASN A 59 -4.930 -7.894 0.569 1.00 0.00 C ATOM 925 C ASN A 59 -4.169 -6.745 -0.097 1.00 0.00 C ATOM 926 O ASN A 59 -2.946 -6.793 -0.218 1.00 0.00 O ATOM 927 CB ASN A 59 -4.494 -7.963 2.034 1.00 0.00 C ATOM 928 CG ASN A 59 -4.556 -9.400 2.557 1.00 0.00 C ATOM 929 OD1 ASN A 59 -5.380 -10.202 2.148 1.00 0.00 O ATOM 930 ND2 ASN A 59 -3.642 -9.679 3.482 1.00 0.00 N ATOM 0 H ASN A 59 -3.832 -9.651 0.248 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.007 -7.733 0.521 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.479 -7.579 2.133 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -5.137 -7.324 2.639 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -3.601 -10.611 3.894 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -2.982 -8.961 3.779 1.00 0.00 H new ATOM 937 N LEU A 60 -4.926 -5.738 -0.508 1.00 0.00 N ATOM 938 CA LEU A 60 -4.338 -4.578 -1.158 1.00 0.00 C ATOM 939 C LEU A 60 -4.475 -3.362 -0.240 1.00 0.00 C ATOM 940 O LEU A 60 -5.570 -3.049 0.225 1.00 0.00 O ATOM 941 CB LEU A 60 -4.951 -4.374 -2.544 1.00 0.00 C ATOM 942 CG LEU A 60 -4.483 -3.134 -3.309 1.00 0.00 C ATOM 943 CD1 LEU A 60 -5.013 -3.140 -4.742 1.00 0.00 C ATOM 944 CD2 LEU A 60 -4.864 -1.853 -2.561 1.00 0.00 C ATOM 0 H LEU A 60 -5.940 -5.701 -0.404 1.00 0.00 H new ATOM 0 HA LEU A 60 -3.272 -4.733 -1.326 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -4.732 -5.254 -3.149 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.034 -4.323 -2.436 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.395 -3.161 -3.370 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -4.665 -2.248 -5.262 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -4.650 -4.027 -5.261 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -6.103 -3.149 -4.727 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.520 -0.986 -3.125 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -5.947 -1.806 -2.448 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.396 -1.854 -1.576 1.00 0.00 H new ATOM 956 N ILE A 61 -3.346 -2.708 -0.006 1.00 0.00 N ATOM 957 CA ILE A 61 -3.326 -1.532 0.848 1.00 0.00 C ATOM 958 C ILE A 61 -2.174 -0.619 0.424 1.00 0.00 C ATOM 959 O ILE A 61 -1.245 -1.058 -0.252 1.00 0.00 O ATOM 960 CB ILE A 61 -3.275 -1.942 2.322 1.00 0.00 C ATOM 961 CG1 ILE A 61 -1.891 -2.478 2.694 1.00 0.00 C ATOM 962 CG2 ILE A 61 -4.385 -2.941 2.652 1.00 0.00 C ATOM 963 CD1 ILE A 61 -1.608 -2.274 4.184 1.00 0.00 C ATOM 0 H ILE A 61 -2.439 -2.970 -0.393 1.00 0.00 H new ATOM 0 HA ILE A 61 -4.246 -0.960 0.731 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.450 -1.054 2.930 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.830 -3.539 2.450 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -1.129 -1.971 2.102 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.326 -3.216 3.705 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -5.355 -2.487 2.449 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.266 -3.833 2.037 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -0.618 -2.663 4.423 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -1.646 -1.210 4.419 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -2.358 -2.803 4.772 1.00 0.00 H new ATOM 975 N THR A 62 -2.274 0.635 0.837 1.00 0.00 N ATOM 976 CA THR A 62 -1.252 1.616 0.508 1.00 0.00 C ATOM 977 C THR A 62 -0.514 2.061 1.771 1.00 0.00 C ATOM 978 O THR A 62 -1.055 1.976 2.873 1.00 0.00 O ATOM 979 CB THR A 62 -1.924 2.767 -0.241 1.00 0.00 C ATOM 980 OG1 THR A 62 -2.728 3.403 0.748 1.00 0.00 O ATOM 981 CG2 THR A 62 -2.934 2.278 -1.282 1.00 0.00 C ATOM 0 H THR A 62 -3.047 0.996 1.397 1.00 0.00 H new ATOM 0 HA THR A 62 -0.489 1.189 -0.143 1.00 0.00 H new ATOM 0 HB THR A 62 -1.162 3.374 -0.730 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.672 3.200 0.582 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.382 3.135 -1.785 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.426 1.652 -2.015 1.00 0.00 H new ATOM 0 HG23 THR A 62 -3.714 1.699 -0.788 1.00 0.00 H new ATOM 989 N VAL A 63 0.709 2.527 1.570 1.00 0.00 N ATOM 990 CA VAL A 63 1.527 2.988 2.681 1.00 0.00 C ATOM 991 C VAL A 63 1.996 4.418 2.405 1.00 0.00 C ATOM 992 O VAL A 63 2.288 4.770 1.264 1.00 0.00 O ATOM 993 CB VAL A 63 2.685 2.015 2.917 1.00 0.00 C ATOM 994 CG1 VAL A 63 3.859 2.717 3.601 1.00 0.00 C ATOM 995 CG2 VAL A 63 2.224 0.801 3.726 1.00 0.00 C ATOM 0 H VAL A 63 1.154 2.596 0.655 1.00 0.00 H new ATOM 0 HA VAL A 63 0.944 3.009 3.602 1.00 0.00 H new ATOM 0 HB VAL A 63 3.028 1.659 1.946 1.00 0.00 H new ATOM 0 HG11 VAL A 63 4.668 2.004 3.757 1.00 0.00 H new ATOM 0 HG12 VAL A 63 4.212 3.534 2.971 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.535 3.114 4.563 1.00 0.00 H new ATOM 0 HG21 VAL A 63 3.065 0.125 3.880 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.842 1.131 4.692 1.00 0.00 H new ATOM 0 HG23 VAL A 63 1.435 0.280 3.183 1.00 0.00 H new ATOM 1005 N ALA A 64 2.050 5.204 3.471 1.00 0.00 N ATOM 1006 CA ALA A 64 2.479 6.589 3.358 1.00 0.00 C ATOM 1007 C ALA A 64 3.476 6.902 4.474 1.00 0.00 C ATOM 1008 O ALA A 64 3.408 6.317 5.554 1.00 0.00 O ATOM 1009 CB ALA A 64 1.254 7.506 3.396 1.00 0.00 C ATOM 0 H ALA A 64 1.804 4.909 4.416 1.00 0.00 H new ATOM 0 HA ALA A 64 2.985 6.759 2.408 1.00 0.00 H new ATOM 0 HB1 ALA A 64 1.574 8.544 3.311 1.00 0.00 H new ATOM 0 HB2 ALA A 64 0.591 7.262 2.566 1.00 0.00 H new ATOM 0 HB3 ALA A 64 0.723 7.365 4.338 1.00 0.00 H new ATOM 1015 N SER A 65 4.379 7.824 4.175 1.00 0.00 N ATOM 1016 CA SER A 65 5.390 8.221 5.140 1.00 0.00 C ATOM 1017 C SER A 65 5.291 9.724 5.413 1.00 0.00 C ATOM 1018 O SER A 65 5.633 10.537 4.555 1.00 0.00 O ATOM 1019 CB SER A 65 6.794 7.862 4.647 1.00 0.00 C ATOM 1020 OG SER A 65 6.834 6.572 4.044 1.00 0.00 O ATOM 0 H SER A 65 4.432 8.307 3.278 1.00 0.00 H new ATOM 0 HA SER A 65 5.210 7.677 6.067 1.00 0.00 H new ATOM 0 HB2 SER A 65 7.128 8.609 3.927 1.00 0.00 H new ATOM 0 HB3 SER A 65 7.491 7.893 5.484 1.00 0.00 H new ATOM 0 HG SER A 65 7.746 6.381 3.741 1.00 0.00 H new ATOM 1026 N PRO A 66 4.809 10.055 6.640 1.00 0.00 N ATOM 1027 CA PRO A 66 4.661 11.445 7.036 1.00 0.00 C ATOM 1028 C PRO A 66 6.020 12.070 7.362 1.00 0.00 C ATOM 1029 O PRO A 66 6.836 11.465 8.054 1.00 0.00 O ATOM 1030 CB PRO A 66 3.720 11.416 8.228 1.00 0.00 C ATOM 1031 CG PRO A 66 3.744 9.987 8.745 1.00 0.00 C ATOM 1032 CD PRO A 66 4.396 9.118 7.681 1.00 0.00 C ATOM 0 HA PRO A 66 4.255 12.068 6.240 1.00 0.00 H new ATOM 0 HB2 PRO A 66 4.045 12.115 8.999 1.00 0.00 H new ATOM 0 HB3 PRO A 66 2.711 11.709 7.936 1.00 0.00 H new ATOM 0 HG2 PRO A 66 4.301 9.928 9.680 1.00 0.00 H new ATOM 0 HG3 PRO A 66 2.732 9.640 8.955 1.00 0.00 H new ATOM 0 HD2 PRO A 66 5.249 8.572 8.084 1.00 0.00 H new ATOM 0 HD3 PRO A 66 3.698 8.377 7.292 1.00 0.00 H new ATOM 1040 N GLY A 67 6.219 13.274 6.847 1.00 0.00 N ATOM 1041 CA GLY A 67 7.463 13.989 7.074 1.00 0.00 C ATOM 1042 C GLY A 67 8.648 13.232 6.471 1.00 0.00 C ATOM 1043 O GLY A 67 9.800 13.514 6.796 1.00 0.00 O ATOM 0 H GLY A 67 5.539 13.773 6.273 1.00 0.00 H new ATOM 0 HA2 GLY A 67 7.400 14.984 6.634 1.00 0.00 H new ATOM 0 HA3 GLY A 67 7.619 14.123 8.144 1.00 0.00 H new ATOM 1047 N PHE A 68 8.324 12.286 5.601 1.00 0.00 N ATOM 1048 CA PHE A 68 9.346 11.487 4.948 1.00 0.00 C ATOM 1049 C PHE A 68 9.227 11.581 3.426 1.00 0.00 C ATOM 1050 O PHE A 68 8.138 11.427 2.874 1.00 0.00 O ATOM 1051 CB PHE A 68 9.122 10.036 5.377 1.00 0.00 C ATOM 1052 CG PHE A 68 9.952 9.019 4.591 1.00 0.00 C ATOM 1053 CD1 PHE A 68 9.655 8.758 3.290 1.00 0.00 C ATOM 1054 CD2 PHE A 68 10.988 8.375 5.194 1.00 0.00 C ATOM 1055 CE1 PHE A 68 10.426 7.814 2.561 1.00 0.00 C ATOM 1056 CE2 PHE A 68 11.758 7.431 4.465 1.00 0.00 C ATOM 1057 CZ PHE A 68 11.461 7.171 3.163 1.00 0.00 C ATOM 0 H PHE A 68 7.367 12.055 5.333 1.00 0.00 H new ATOM 0 HA PHE A 68 10.335 11.846 5.231 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.358 9.941 6.437 1.00 0.00 H new ATOM 0 HB3 PHE A 68 8.066 9.793 5.263 1.00 0.00 H new ATOM 0 HD1 PHE A 68 8.833 9.269 2.811 1.00 0.00 H new ATOM 0 HD2 PHE A 68 11.225 8.582 6.227 1.00 0.00 H new ATOM 0 HE1 PHE A 68 10.190 7.607 1.528 1.00 0.00 H new ATOM 0 HE2 PHE A 68 12.580 6.919 4.944 1.00 0.00 H new ATOM 0 HZ PHE A 68 12.048 6.454 2.608 1.00 0.00 H new ATOM 1067 N LEU A 69 10.362 11.833 2.789 1.00 0.00 N ATOM 1068 CA LEU A 69 10.397 11.948 1.341 1.00 0.00 C ATOM 1069 C LEU A 69 9.636 13.205 0.916 1.00 0.00 C ATOM 1070 O LEU A 69 8.792 13.151 0.024 1.00 0.00 O ATOM 1071 CB LEU A 69 9.881 10.665 0.687 1.00 0.00 C ATOM 1072 CG LEU A 69 10.176 10.508 -0.804 1.00 0.00 C ATOM 1073 CD1 LEU A 69 11.584 11.002 -1.142 1.00 0.00 C ATOM 1074 CD2 LEU A 69 9.953 9.063 -1.259 1.00 0.00 C ATOM 0 H LEU A 69 11.263 11.961 3.249 1.00 0.00 H new ATOM 0 HA LEU A 69 11.424 12.063 0.993 1.00 0.00 H new ATOM 0 HB2 LEU A 69 10.312 9.814 1.214 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.802 10.616 0.831 1.00 0.00 H new ATOM 0 HG LEU A 69 9.474 11.133 -1.356 1.00 0.00 H new ATOM 0 HD11 LEU A 69 11.767 10.878 -2.209 1.00 0.00 H new ATOM 0 HD12 LEU A 69 11.673 12.056 -0.878 1.00 0.00 H new ATOM 0 HD13 LEU A 69 12.317 10.424 -0.579 1.00 0.00 H new ATOM 0 HD21 LEU A 69 10.170 8.979 -2.324 1.00 0.00 H new ATOM 0 HD22 LEU A 69 10.614 8.400 -0.701 1.00 0.00 H new ATOM 0 HD23 LEU A 69 8.916 8.780 -1.077 1.00 0.00 H new ATOM 1086 N HIS A 70 9.963 14.308 1.575 1.00 0.00 N ATOM 1087 CA HIS A 70 9.319 15.576 1.276 1.00 0.00 C ATOM 1088 C HIS A 70 7.803 15.427 1.411 1.00 0.00 C ATOM 1089 O HIS A 70 7.044 16.191 0.816 1.00 0.00 O ATOM 1090 CB HIS A 70 9.744 16.089 -0.102 1.00 0.00 C ATOM 1091 CG HIS A 70 11.222 16.371 -0.223 1.00 0.00 C ATOM 1092 ND1 HIS A 70 11.854 17.375 0.489 1.00 0.00 N ATOM 1093 CD2 HIS A 70 12.185 15.772 -0.981 1.00 0.00 C ATOM 1094 CE1 HIS A 70 13.139 17.371 0.168 1.00 0.00 C ATOM 1095 NE2 HIS A 70 13.342 16.377 -0.744 1.00 0.00 N ATOM 0 H HIS A 70 10.665 14.349 2.314 1.00 0.00 H new ATOM 0 HA HIS A 70 9.640 16.329 1.995 1.00 0.00 H new ATOM 0 HB2 HIS A 70 9.462 15.353 -0.855 1.00 0.00 H new ATOM 0 HB3 HIS A 70 9.191 17.001 -0.325 1.00 0.00 H new ATOM 0 HD2 HIS A 70 12.032 14.945 -1.659 1.00 0.00 H new ATOM 0 HE1 HIS A 70 13.893 18.037 0.559 1.00 0.00 H new ATOM 0 HE2 HIS A 70 14.236 16.138 -1.173 1.00 0.00 H new ATOM 1104 N GLU A 71 7.405 14.439 2.199 1.00 0.00 N ATOM 1105 CA GLU A 71 5.993 14.180 2.421 1.00 0.00 C ATOM 1106 C GLU A 71 5.482 15.004 3.603 1.00 0.00 C ATOM 1107 O GLU A 71 6.255 15.375 4.487 1.00 0.00 O ATOM 1108 CB GLU A 71 5.736 12.688 2.640 1.00 0.00 C ATOM 1109 CG GLU A 71 4.241 12.405 2.800 1.00 0.00 C ATOM 1110 CD GLU A 71 3.486 12.704 1.503 1.00 0.00 C ATOM 1111 OE1 GLU A 71 3.460 13.859 1.052 1.00 0.00 O ATOM 1112 OE2 GLU A 71 2.911 11.685 0.960 1.00 0.00 O ATOM 0 H GLU A 71 8.037 13.808 2.692 1.00 0.00 H new ATOM 0 HA GLU A 71 5.444 14.482 1.529 1.00 0.00 H new ATOM 0 HB2 GLU A 71 6.129 12.120 1.796 1.00 0.00 H new ATOM 0 HB3 GLU A 71 6.270 12.350 3.528 1.00 0.00 H new ATOM 0 HG2 GLU A 71 4.092 11.362 3.080 1.00 0.00 H new ATOM 0 HG3 GLU A 71 3.836 13.013 3.609 1.00 0.00 H new ATOM 1120 N LYS A 72 4.183 15.267 3.584 1.00 0.00 N ATOM 1121 CA LYS A 72 3.560 16.040 4.644 1.00 0.00 C ATOM 1122 C LYS A 72 3.777 15.330 5.983 1.00 0.00 C ATOM 1123 O LYS A 72 3.722 14.104 6.055 1.00 0.00 O ATOM 1124 CB LYS A 72 2.088 16.304 4.320 1.00 0.00 C ATOM 1125 CG LYS A 72 1.726 17.770 4.571 1.00 0.00 C ATOM 1126 CD LYS A 72 1.114 18.404 3.321 1.00 0.00 C ATOM 1127 CE LYS A 72 1.052 19.927 3.454 1.00 0.00 C ATOM 1128 NZ LYS A 72 2.395 20.520 3.261 1.00 0.00 N ATOM 0 H LYS A 72 3.545 14.958 2.850 1.00 0.00 H new ATOM 0 HA LYS A 72 4.027 17.022 4.724 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.890 16.050 3.279 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.456 15.660 4.931 1.00 0.00 H new ATOM 0 HG2 LYS A 72 1.021 17.838 5.400 1.00 0.00 H new ATOM 0 HG3 LYS A 72 2.618 18.324 4.865 1.00 0.00 H new ATOM 0 HD2 LYS A 72 1.706 18.135 2.446 1.00 0.00 H new ATOM 0 HD3 LYS A 72 0.111 18.008 3.162 1.00 0.00 H new ATOM 0 HE2 LYS A 72 0.359 20.334 2.718 1.00 0.00 H new ATOM 0 HE3 LYS A 72 0.667 20.197 4.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 2.307 21.550 3.152 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 2.990 20.309 4.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 2.833 20.117 2.408 1.00 0.00 H new ATOM 1141 N LYS A 73 4.018 16.133 7.009 1.00 0.00 N ATOM 1142 CA LYS A 73 4.245 15.597 8.340 1.00 0.00 C ATOM 1143 C LYS A 73 2.965 14.922 8.837 1.00 0.00 C ATOM 1144 O LYS A 73 1.884 15.163 8.303 1.00 0.00 O ATOM 1145 CB LYS A 73 4.766 16.691 9.276 1.00 0.00 C ATOM 1146 CG LYS A 73 6.204 16.400 9.712 1.00 0.00 C ATOM 1147 CD LYS A 73 6.242 15.831 11.132 1.00 0.00 C ATOM 1148 CE LYS A 73 7.061 14.540 11.182 1.00 0.00 C ATOM 1149 NZ LYS A 73 8.501 14.846 11.340 1.00 0.00 N ATOM 0 H LYS A 73 4.061 17.150 6.945 1.00 0.00 H new ATOM 0 HA LYS A 73 5.022 14.833 8.316 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.723 17.657 8.772 1.00 0.00 H new ATOM 0 HB3 LYS A 73 4.123 16.761 10.153 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.661 15.692 9.020 1.00 0.00 H new ATOM 0 HG3 LYS A 73 6.794 17.316 9.667 1.00 0.00 H new ATOM 0 HD2 LYS A 73 6.673 16.566 11.811 1.00 0.00 H new ATOM 0 HD3 LYS A 73 5.227 15.636 11.477 1.00 0.00 H new ATOM 0 HE2 LYS A 73 6.722 13.919 12.011 1.00 0.00 H new ATOM 0 HE3 LYS A 73 6.903 13.966 10.269 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 9.043 13.959 11.372 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 8.824 15.420 10.535 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 8.649 15.374 12.224 1.00 0.00 H new ATOM 1162 N ASP A 74 3.131 14.088 9.853 1.00 0.00 N ATOM 1163 CA ASP A 74 2.003 13.375 10.429 1.00 0.00 C ATOM 1164 C ASP A 74 0.940 14.383 10.869 1.00 0.00 C ATOM 1165 O ASP A 74 1.230 15.568 11.028 1.00 0.00 O ATOM 1166 CB ASP A 74 2.429 12.569 11.656 1.00 0.00 C ATOM 1167 CG ASP A 74 1.612 11.302 11.914 1.00 0.00 C ATOM 1168 OD1 ASP A 74 0.767 11.259 12.820 1.00 0.00 O ATOM 1169 OD2 ASP A 74 1.874 10.314 11.127 1.00 0.00 O ATOM 0 H ASP A 74 4.030 13.890 10.292 1.00 0.00 H new ATOM 0 HA ASP A 74 1.610 12.696 9.672 1.00 0.00 H new ATOM 0 HB2 ASP A 74 3.477 12.291 11.543 1.00 0.00 H new ATOM 0 HB3 ASP A 74 2.363 13.211 12.534 1.00 0.00 H new ATOM 1175 N GLY A 75 -0.269 13.874 11.056 1.00 0.00 N ATOM 1176 CA GLY A 75 -1.378 14.715 11.476 1.00 0.00 C ATOM 1177 C GLY A 75 -1.932 15.520 10.298 1.00 0.00 C ATOM 1178 O GLY A 75 -3.135 15.501 10.040 1.00 0.00 O ATOM 0 H GLY A 75 -0.505 12.890 10.925 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -2.168 14.096 11.902 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.047 15.394 12.262 1.00 0.00 H new ATOM 1182 N ASP A 76 -1.029 16.208 9.617 1.00 0.00 N ATOM 1183 CA ASP A 76 -1.413 17.019 8.473 1.00 0.00 C ATOM 1184 C ASP A 76 -1.974 16.113 7.377 1.00 0.00 C ATOM 1185 O ASP A 76 -3.071 16.349 6.870 1.00 0.00 O ATOM 1186 CB ASP A 76 -0.207 17.765 7.897 1.00 0.00 C ATOM 1187 CG ASP A 76 0.084 19.121 8.545 1.00 0.00 C ATOM 1188 OD1 ASP A 76 -0.656 20.095 8.348 1.00 0.00 O ATOM 1189 OD2 ASP A 76 1.136 19.154 9.291 1.00 0.00 O ATOM 0 H ASP A 76 -0.033 16.221 9.834 1.00 0.00 H new ATOM 0 HA ASP A 76 -2.159 17.741 8.807 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.675 17.133 8.000 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.368 17.916 6.830 1.00 0.00 H new ATOM 1195 N PHE A 77 -1.198 15.091 7.040 1.00 0.00 N ATOM 1196 CA PHE A 77 -1.605 14.148 6.013 1.00 0.00 C ATOM 1197 C PHE A 77 -2.924 13.468 6.385 1.00 0.00 C ATOM 1198 O PHE A 77 -3.676 13.044 5.508 1.00 0.00 O ATOM 1199 CB PHE A 77 -0.506 13.087 5.921 1.00 0.00 C ATOM 1200 CG PHE A 77 -0.700 12.088 4.778 1.00 0.00 C ATOM 1201 CD1 PHE A 77 -0.302 12.411 3.518 1.00 0.00 C ATOM 1202 CD2 PHE A 77 -1.270 10.879 5.022 1.00 0.00 C ATOM 1203 CE1 PHE A 77 -0.483 11.484 2.457 1.00 0.00 C ATOM 1204 CE2 PHE A 77 -1.452 9.952 3.962 1.00 0.00 C ATOM 1205 CZ PHE A 77 -1.054 10.274 2.702 1.00 0.00 C ATOM 0 H PHE A 77 -0.290 14.897 7.461 1.00 0.00 H new ATOM 0 HA PHE A 77 -1.750 14.668 5.066 1.00 0.00 H new ATOM 0 HB2 PHE A 77 0.456 13.585 5.796 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -0.462 12.541 6.863 1.00 0.00 H new ATOM 0 HD1 PHE A 77 0.151 13.372 3.324 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -1.585 10.623 6.023 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -0.167 11.740 1.456 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -1.906 8.992 4.156 1.00 0.00 H new ATOM 0 HZ PHE A 77 -1.191 9.569 1.896 1.00 0.00 H new ATOM 1215 N GLN A 78 -3.165 13.385 7.685 1.00 0.00 N ATOM 1216 CA GLN A 78 -4.380 12.764 8.183 1.00 0.00 C ATOM 1217 C GLN A 78 -5.598 13.615 7.821 1.00 0.00 C ATOM 1218 O GLN A 78 -6.672 13.082 7.543 1.00 0.00 O ATOM 1219 CB GLN A 78 -4.300 12.536 9.694 1.00 0.00 C ATOM 1220 CG GLN A 78 -2.925 12.001 10.097 1.00 0.00 C ATOM 1221 CD GLN A 78 -2.942 11.463 11.528 1.00 0.00 C ATOM 1222 OE1 GLN A 78 -2.162 11.859 12.379 1.00 0.00 O ATOM 1223 NE2 GLN A 78 -3.874 10.539 11.747 1.00 0.00 N ATOM 0 H GLN A 78 -2.539 13.738 8.409 1.00 0.00 H new ATOM 0 HA GLN A 78 -4.488 11.789 7.707 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -4.497 13.472 10.217 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -5.072 11.830 10.000 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -2.624 11.209 9.411 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -2.183 12.795 10.012 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -4.495 10.252 10.991 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -3.967 10.118 12.671 1.00 0.00 H new ATOM 1232 N LYS A 79 -5.391 14.924 7.832 1.00 0.00 N ATOM 1233 CA LYS A 79 -6.459 15.853 7.509 1.00 0.00 C ATOM 1234 C LYS A 79 -6.731 15.806 6.003 1.00 0.00 C ATOM 1235 O LYS A 79 -7.883 15.851 5.575 1.00 0.00 O ATOM 1236 CB LYS A 79 -6.128 17.253 8.030 1.00 0.00 C ATOM 1237 CG LYS A 79 -6.760 17.489 9.404 1.00 0.00 C ATOM 1238 CD LYS A 79 -6.053 18.627 10.144 1.00 0.00 C ATOM 1239 CE LYS A 79 -5.430 18.128 11.449 1.00 0.00 C ATOM 1240 NZ LYS A 79 -5.710 19.075 12.552 1.00 0.00 N ATOM 0 H LYS A 79 -4.499 15.363 8.060 1.00 0.00 H new ATOM 0 HA LYS A 79 -7.382 15.562 8.010 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -5.047 17.374 8.097 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -6.489 18.002 7.326 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -7.817 17.728 9.286 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -6.704 16.575 9.996 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -5.278 19.054 9.507 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -6.765 19.424 10.358 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -5.829 17.144 11.696 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -4.353 18.014 11.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -5.280 18.721 13.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -5.309 20.006 12.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -6.738 19.164 12.681 1.00 0.00 H new ATOM 1253 N TRP A 80 -5.650 15.719 5.243 1.00 0.00 N ATOM 1254 CA TRP A 80 -5.756 15.665 3.794 1.00 0.00 C ATOM 1255 C TRP A 80 -6.686 14.505 3.431 1.00 0.00 C ATOM 1256 O TRP A 80 -7.634 14.681 2.667 1.00 0.00 O ATOM 1257 CB TRP A 80 -4.376 15.551 3.146 1.00 0.00 C ATOM 1258 CG TRP A 80 -4.412 15.427 1.621 1.00 0.00 C ATOM 1259 CD1 TRP A 80 -5.186 14.626 0.877 1.00 0.00 C ATOM 1260 CD2 TRP A 80 -3.603 16.165 0.679 1.00 0.00 C ATOM 1261 NE1 TRP A 80 -4.937 14.793 -0.471 1.00 0.00 N ATOM 1262 CE2 TRP A 80 -3.944 15.758 -0.594 1.00 0.00 C ATOM 1263 CE3 TRP A 80 -2.617 17.143 0.898 1.00 0.00 C ATOM 1264 CZ2 TRP A 80 -3.347 16.276 -1.750 1.00 0.00 C ATOM 1265 CZ3 TRP A 80 -2.031 17.652 -0.268 1.00 0.00 C ATOM 1266 CH2 TRP A 80 -2.362 17.252 -1.558 1.00 0.00 C ATOM 0 H TRP A 80 -4.696 15.685 5.603 1.00 0.00 H new ATOM 0 HA TRP A 80 -6.183 16.589 3.404 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -3.786 16.427 3.415 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -3.863 14.682 3.559 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -5.913 13.937 1.280 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -5.397 14.299 -1.236 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -2.334 17.475 1.886 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -3.631 15.941 -2.736 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -1.268 18.409 -0.157 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -1.862 17.692 -2.408 1.00 0.00 H new ATOM 1277 N TYR A 81 -6.382 13.346 3.996 1.00 0.00 N ATOM 1278 CA TYR A 81 -7.178 12.158 3.741 1.00 0.00 C ATOM 1279 C TYR A 81 -8.656 12.413 4.045 1.00 0.00 C ATOM 1280 O TYR A 81 -9.532 11.959 3.310 1.00 0.00 O ATOM 1281 CB TYR A 81 -6.650 11.084 4.694 1.00 0.00 C ATOM 1282 CG TYR A 81 -7.527 9.833 4.769 1.00 0.00 C ATOM 1283 CD1 TYR A 81 -7.406 8.847 3.812 1.00 0.00 C ATOM 1284 CD2 TYR A 81 -8.441 9.692 5.794 1.00 0.00 C ATOM 1285 CE1 TYR A 81 -8.232 7.669 3.883 1.00 0.00 C ATOM 1286 CE2 TYR A 81 -9.267 8.514 5.865 1.00 0.00 C ATOM 1287 CZ TYR A 81 -9.121 7.561 4.905 1.00 0.00 C ATOM 1288 OH TYR A 81 -9.901 6.448 4.972 1.00 0.00 O ATOM 0 H TYR A 81 -5.595 13.204 4.630 1.00 0.00 H new ATOM 0 HA TYR A 81 -7.102 11.862 2.695 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -5.648 10.794 4.379 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -6.559 11.512 5.692 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -6.692 8.958 3.009 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -8.537 10.465 6.542 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -8.147 6.889 3.141 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -9.985 8.390 6.662 1.00 0.00 H new ATOM 0 HH TYR A 81 -9.530 5.828 5.634 1.00 0.00 H new ATOM 1298 N ALA A 82 -8.887 13.135 5.131 1.00 0.00 N ATOM 1299 CA ALA A 82 -10.243 13.454 5.542 1.00 0.00 C ATOM 1300 C ALA A 82 -10.800 14.557 4.639 1.00 0.00 C ATOM 1301 O ALA A 82 -11.950 14.968 4.789 1.00 0.00 O ATOM 1302 CB ALA A 82 -10.248 13.854 7.020 1.00 0.00 C ATOM 0 H ALA A 82 -8.158 13.508 5.739 1.00 0.00 H new ATOM 0 HA ALA A 82 -10.890 12.583 5.437 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -11.266 14.093 7.329 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -9.871 13.027 7.622 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -9.611 14.727 7.163 1.00 0.00 H new ATOM 1308 N GLY A 83 -9.958 15.004 3.719 1.00 0.00 N ATOM 1309 CA GLY A 83 -10.350 16.050 2.791 1.00 0.00 C ATOM 1310 C GLY A 83 -10.875 15.455 1.482 1.00 0.00 C ATOM 1311 O GLY A 83 -11.682 16.076 0.793 1.00 0.00 O ATOM 0 H GLY A 83 -9.005 14.660 3.597 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -11.120 16.674 3.245 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -9.497 16.696 2.584 1.00 0.00 H new ATOM 1315 N LEU A 84 -10.393 14.258 1.180 1.00 0.00 N ATOM 1316 CA LEU A 84 -10.804 13.571 -0.033 1.00 0.00 C ATOM 1317 C LEU A 84 -11.768 12.441 0.327 1.00 0.00 C ATOM 1318 O LEU A 84 -11.714 11.901 1.432 1.00 0.00 O ATOM 1319 CB LEU A 84 -9.580 13.106 -0.826 1.00 0.00 C ATOM 1320 CG LEU A 84 -8.620 12.171 -0.089 1.00 0.00 C ATOM 1321 CD1 LEU A 84 -8.838 10.717 -0.514 1.00 0.00 C ATOM 1322 CD2 LEU A 84 -7.168 12.613 -0.282 1.00 0.00 C ATOM 0 H LEU A 84 -9.722 13.747 1.754 1.00 0.00 H new ATOM 0 HA LEU A 84 -11.343 14.252 -0.692 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -9.926 12.602 -1.728 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -9.024 13.987 -1.147 1.00 0.00 H new ATOM 0 HG LEU A 84 -8.835 12.231 0.978 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -8.143 10.072 0.024 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -9.861 10.420 -0.284 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -8.665 10.621 -1.586 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -6.506 11.931 0.252 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -6.922 12.600 -1.344 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -7.040 13.623 0.108 1.00 0.00 H new ATOM 1334 N ASN A 85 -12.630 12.114 -0.624 1.00 0.00 N ATOM 1335 CA ASN A 85 -13.605 11.055 -0.421 1.00 0.00 C ATOM 1336 C ASN A 85 -12.933 9.699 -0.646 1.00 0.00 C ATOM 1337 O ASN A 85 -11.709 9.611 -0.707 1.00 0.00 O ATOM 1338 CB ASN A 85 -14.765 11.179 -1.410 1.00 0.00 C ATOM 1339 CG ASN A 85 -16.073 11.501 -0.684 1.00 0.00 C ATOM 1340 OD1 ASN A 85 -16.370 12.639 -0.361 1.00 0.00 O ATOM 1341 ND2 ASN A 85 -16.835 10.439 -0.445 1.00 0.00 N ATOM 0 H ASN A 85 -12.674 12.564 -1.538 1.00 0.00 H new ATOM 0 HA ASN A 85 -13.988 11.139 0.596 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -14.546 11.962 -2.136 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -14.874 10.248 -1.967 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -17.728 10.550 0.036 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -16.527 9.513 -0.742 1.00 0.00 H new ATOM 1348 N TYR A 86 -13.767 8.675 -0.764 1.00 0.00 N ATOM 1349 CA TYR A 86 -13.270 7.327 -0.982 1.00 0.00 C ATOM 1350 C TYR A 86 -12.542 6.805 0.258 1.00 0.00 C ATOM 1351 O TYR A 86 -11.353 6.493 0.199 1.00 0.00 O ATOM 1352 CB TYR A 86 -12.274 7.426 -2.139 1.00 0.00 C ATOM 1353 CG TYR A 86 -12.691 8.407 -3.237 1.00 0.00 C ATOM 1354 CD1 TYR A 86 -13.795 8.138 -4.020 1.00 0.00 C ATOM 1355 CD2 TYR A 86 -11.964 9.561 -3.444 1.00 0.00 C ATOM 1356 CE1 TYR A 86 -14.188 9.060 -5.052 1.00 0.00 C ATOM 1357 CE2 TYR A 86 -12.356 10.485 -4.477 1.00 0.00 C ATOM 1358 CZ TYR A 86 -13.450 10.189 -5.231 1.00 0.00 C ATOM 1359 OH TYR A 86 -13.821 11.060 -6.205 1.00 0.00 O ATOM 0 H TYR A 86 -14.783 8.752 -0.713 1.00 0.00 H new ATOM 0 HA TYR A 86 -14.093 6.645 -1.196 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -11.304 7.729 -1.745 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -12.145 6.437 -2.579 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -14.364 7.235 -3.858 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -11.100 9.772 -2.831 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -15.050 8.860 -5.671 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -11.795 11.392 -4.649 1.00 0.00 H new ATOM 0 HH TYR A 86 -13.203 11.821 -6.216 1.00 0.00 H new ATOM 1369 N PRO A 87 -13.304 6.723 1.382 1.00 0.00 N ATOM 1370 CA PRO A 87 -12.745 6.245 2.633 1.00 0.00 C ATOM 1371 C PRO A 87 -12.561 4.725 2.607 1.00 0.00 C ATOM 1372 O PRO A 87 -11.939 4.155 3.502 1.00 0.00 O ATOM 1373 CB PRO A 87 -13.721 6.705 3.703 1.00 0.00 C ATOM 1374 CG PRO A 87 -15.019 7.017 2.975 1.00 0.00 C ATOM 1375 CD PRO A 87 -14.715 7.084 1.488 1.00 0.00 C ATOM 0 HA PRO A 87 -11.748 6.641 2.825 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -13.871 5.930 4.454 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -13.344 7.585 4.224 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -15.765 6.248 3.178 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -15.434 7.963 3.323 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -15.344 6.395 0.924 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -14.899 8.082 1.091 1.00 0.00 H new ATOM 1383 N LYS A 88 -13.113 4.113 1.569 1.00 0.00 N ATOM 1384 CA LYS A 88 -13.019 2.671 1.413 1.00 0.00 C ATOM 1385 C LYS A 88 -11.622 2.309 0.903 1.00 0.00 C ATOM 1386 O LYS A 88 -11.303 1.132 0.743 1.00 0.00 O ATOM 1387 CB LYS A 88 -14.152 2.152 0.526 1.00 0.00 C ATOM 1388 CG LYS A 88 -15.052 1.184 1.296 1.00 0.00 C ATOM 1389 CD LYS A 88 -14.570 -0.259 1.132 1.00 0.00 C ATOM 1390 CE LYS A 88 -15.667 -1.251 1.529 1.00 0.00 C ATOM 1391 NZ LYS A 88 -15.071 -2.493 2.070 1.00 0.00 N ATOM 0 H LYS A 88 -13.627 4.589 0.828 1.00 0.00 H new ATOM 0 HA LYS A 88 -13.147 2.174 2.375 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -14.744 2.990 0.159 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -13.734 1.650 -0.347 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -15.060 1.451 2.353 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -16.078 1.272 0.938 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -14.275 -0.432 0.097 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -13.686 -0.423 1.748 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -16.321 -0.800 2.275 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -16.285 -1.485 0.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -15.828 -3.155 2.334 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -14.465 -2.931 1.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -14.500 -2.267 2.909 1.00 0.00 H new ATOM 1404 N LEU A 89 -10.829 3.341 0.661 1.00 0.00 N ATOM 1405 CA LEU A 89 -9.475 3.146 0.173 1.00 0.00 C ATOM 1406 C LEU A 89 -8.539 2.900 1.358 1.00 0.00 C ATOM 1407 O LEU A 89 -8.547 3.655 2.328 1.00 0.00 O ATOM 1408 CB LEU A 89 -9.049 4.321 -0.711 1.00 0.00 C ATOM 1409 CG LEU A 89 -7.545 4.576 -0.811 1.00 0.00 C ATOM 1410 CD1 LEU A 89 -6.880 3.578 -1.761 1.00 0.00 C ATOM 1411 CD2 LEU A 89 -7.258 6.025 -1.210 1.00 0.00 C ATOM 0 H LEU A 89 -11.098 4.316 0.794 1.00 0.00 H new ATOM 0 HA LEU A 89 -9.425 2.262 -0.463 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -9.436 4.152 -1.716 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -9.526 5.225 -0.333 1.00 0.00 H new ATOM 0 HG LEU A 89 -7.108 4.421 0.176 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -5.811 3.782 -1.813 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -7.038 2.564 -1.393 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.317 3.675 -2.755 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -6.181 6.178 -1.274 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -7.712 6.232 -2.179 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -7.677 6.698 -0.462 1.00 0.00 H new ATOM 1423 N PRO A 90 -7.735 1.809 1.238 1.00 0.00 N ATOM 1424 CA PRO A 90 -6.796 1.453 2.288 1.00 0.00 C ATOM 1425 C PRO A 90 -5.587 2.389 2.283 1.00 0.00 C ATOM 1426 O PRO A 90 -4.934 2.561 1.254 1.00 0.00 O ATOM 1427 CB PRO A 90 -6.428 0.005 2.012 1.00 0.00 C ATOM 1428 CG PRO A 90 -6.808 -0.252 0.561 1.00 0.00 C ATOM 1429 CD PRO A 90 -7.699 0.890 0.104 1.00 0.00 C ATOM 0 HA PRO A 90 -7.221 1.558 3.286 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -5.363 -0.165 2.173 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -6.963 -0.669 2.681 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -5.916 -0.313 -0.062 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -7.329 -1.205 0.466 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -7.297 1.374 -0.786 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -8.698 0.536 -0.150 1.00 0.00 H new ATOM 1437 N VAL A 91 -5.323 2.969 3.445 1.00 0.00 N ATOM 1438 CA VAL A 91 -4.202 3.883 3.587 1.00 0.00 C ATOM 1439 C VAL A 91 -3.486 3.605 4.909 1.00 0.00 C ATOM 1440 O VAL A 91 -4.110 3.607 5.970 1.00 0.00 O ATOM 1441 CB VAL A 91 -4.687 5.330 3.462 1.00 0.00 C ATOM 1442 CG1 VAL A 91 -3.576 6.314 3.829 1.00 0.00 C ATOM 1443 CG2 VAL A 91 -5.226 5.608 2.058 1.00 0.00 C ATOM 0 H VAL A 91 -5.866 2.824 4.296 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.478 3.726 2.787 1.00 0.00 H new ATOM 0 HB VAL A 91 -5.505 5.472 4.168 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -3.947 7.334 3.732 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.260 6.139 4.857 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.728 6.171 3.160 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.564 6.642 1.996 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -4.437 5.440 1.325 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -6.062 4.940 1.850 1.00 0.00 H new ATOM 1453 N VAL A 92 -2.187 3.370 4.805 1.00 0.00 N ATOM 1454 CA VAL A 92 -1.379 3.091 5.980 1.00 0.00 C ATOM 1455 C VAL A 92 -0.305 4.170 6.125 1.00 0.00 C ATOM 1456 O VAL A 92 0.444 4.435 5.185 1.00 0.00 O ATOM 1457 CB VAL A 92 -0.799 1.677 5.892 1.00 0.00 C ATOM 1458 CG1 VAL A 92 -0.005 1.332 7.153 1.00 0.00 C ATOM 1459 CG2 VAL A 92 -1.902 0.647 5.638 1.00 0.00 C ATOM 0 H VAL A 92 -1.673 3.367 3.924 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.992 3.121 6.881 1.00 0.00 H new ATOM 0 HB VAL A 92 -0.113 1.647 5.046 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.396 0.322 7.065 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.815 2.040 7.271 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.660 1.388 8.022 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.463 -0.349 5.580 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.624 0.678 6.454 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.405 0.877 4.699 1.00 0.00 H new ATOM 1469 N THR A 93 -0.262 4.762 7.308 1.00 0.00 N ATOM 1470 CA THR A 93 0.708 5.808 7.589 1.00 0.00 C ATOM 1471 C THR A 93 1.807 5.280 8.513 1.00 0.00 C ATOM 1472 O THR A 93 1.536 4.893 9.647 1.00 0.00 O ATOM 1473 CB THR A 93 -0.043 7.010 8.162 1.00 0.00 C ATOM 1474 OG1 THR A 93 -1.007 6.433 9.036 1.00 0.00 O ATOM 1475 CG2 THR A 93 -0.884 7.732 7.106 1.00 0.00 C ATOM 0 H THR A 93 -0.884 4.538 8.085 1.00 0.00 H new ATOM 0 HA THR A 93 1.217 6.130 6.680 1.00 0.00 H new ATOM 0 HB THR A 93 0.670 7.709 8.599 1.00 0.00 H new ATOM 0 HG1 THR A 93 -0.575 5.758 9.600 1.00 0.00 H new ATOM 0 HG21 THR A 93 -1.397 8.577 7.565 1.00 0.00 H new ATOM 0 HG22 THR A 93 -0.235 8.091 6.307 1.00 0.00 H new ATOM 0 HG23 THR A 93 -1.620 7.042 6.693 1.00 0.00 H new ATOM 1483 N ASP A 94 3.026 5.284 7.992 1.00 0.00 N ATOM 1484 CA ASP A 94 4.167 4.811 8.756 1.00 0.00 C ATOM 1485 C ASP A 94 5.122 5.977 9.014 1.00 0.00 C ATOM 1486 O ASP A 94 5.770 6.469 8.093 1.00 0.00 O ATOM 1487 CB ASP A 94 4.935 3.732 7.991 1.00 0.00 C ATOM 1488 CG ASP A 94 6.100 3.100 8.756 1.00 0.00 C ATOM 1489 OD1 ASP A 94 6.531 3.613 9.799 1.00 0.00 O ATOM 1490 OD2 ASP A 94 6.576 2.023 8.230 1.00 0.00 O ATOM 0 H ASP A 94 3.247 5.607 7.050 1.00 0.00 H new ATOM 0 HA ASP A 94 3.795 4.393 9.692 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.238 2.944 7.706 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.319 4.166 7.068 1.00 0.00 H new ATOM 1496 N ASN A 95 5.178 6.388 10.273 1.00 0.00 N ATOM 1497 CA ASN A 95 6.044 7.489 10.663 1.00 0.00 C ATOM 1498 C ASN A 95 7.502 7.092 10.430 1.00 0.00 C ATOM 1499 O ASN A 95 7.996 6.143 11.037 1.00 0.00 O ATOM 1500 CB ASN A 95 5.875 7.821 12.147 1.00 0.00 C ATOM 1501 CG ASN A 95 6.883 8.885 12.588 1.00 0.00 C ATOM 1502 OD1 ASN A 95 8.027 8.602 12.900 1.00 0.00 O ATOM 1503 ND2 ASN A 95 6.393 10.122 12.598 1.00 0.00 N ATOM 0 H ASN A 95 4.638 5.979 11.036 1.00 0.00 H new ATOM 0 HA ASN A 95 5.775 8.360 10.065 1.00 0.00 H new ATOM 0 HB2 ASN A 95 4.861 8.177 12.331 1.00 0.00 H new ATOM 0 HB3 ASN A 95 6.009 6.918 12.743 1.00 0.00 H new ATOM 0 HD21 ASN A 95 6.986 10.903 12.879 1.00 0.00 H new ATOM 0 HD22 ASN A 95 5.425 10.289 12.325 1.00 0.00 H new ATOM 1510 N GLY A 96 8.151 7.839 9.550 1.00 0.00 N ATOM 1511 CA GLY A 96 9.544 7.578 9.227 1.00 0.00 C ATOM 1512 C GLY A 96 9.662 6.573 8.080 1.00 0.00 C ATOM 1513 O GLY A 96 10.605 6.633 7.294 1.00 0.00 O ATOM 0 H GLY A 96 7.738 8.626 9.050 1.00 0.00 H new ATOM 0 HA2 GLY A 96 10.038 8.510 8.951 1.00 0.00 H new ATOM 0 HA3 GLY A 96 10.059 7.193 10.107 1.00 0.00 H new ATOM 1517 N GLY A 97 8.692 5.673 8.023 1.00 0.00 N ATOM 1518 CA GLY A 97 8.676 4.656 6.984 1.00 0.00 C ATOM 1519 C GLY A 97 9.679 3.542 7.293 1.00 0.00 C ATOM 1520 O GLY A 97 10.788 3.535 6.763 1.00 0.00 O ATOM 0 H GLY A 97 7.912 5.626 8.678 1.00 0.00 H new ATOM 0 HA2 GLY A 97 7.674 4.235 6.897 1.00 0.00 H new ATOM 0 HA3 GLY A 97 8.915 5.110 6.022 1.00 0.00 H new ATOM 1524 N THR A 98 9.251 2.626 8.151 1.00 0.00 N ATOM 1525 CA THR A 98 10.098 1.510 8.536 1.00 0.00 C ATOM 1526 C THR A 98 10.153 0.470 7.415 1.00 0.00 C ATOM 1527 O THR A 98 11.206 -0.110 7.153 1.00 0.00 O ATOM 1528 CB THR A 98 9.569 0.949 9.858 1.00 0.00 C ATOM 1529 OG1 THR A 98 10.114 1.818 10.846 1.00 0.00 O ATOM 1530 CG2 THR A 98 10.164 -0.418 10.195 1.00 0.00 C ATOM 0 H THR A 98 8.330 2.634 8.589 1.00 0.00 H new ATOM 0 HA THR A 98 11.128 1.831 8.690 1.00 0.00 H new ATOM 0 HB THR A 98 8.483 0.869 9.809 1.00 0.00 H new ATOM 0 HG1 THR A 98 9.820 1.528 11.735 1.00 0.00 H new ATOM 0 HG21 THR A 98 9.755 -0.769 11.142 1.00 0.00 H new ATOM 0 HG22 THR A 98 9.915 -1.128 9.406 1.00 0.00 H new ATOM 0 HG23 THR A 98 11.248 -0.333 10.277 1.00 0.00 H new ATOM 1538 N ILE A 99 9.007 0.267 6.783 1.00 0.00 N ATOM 1539 CA ILE A 99 8.911 -0.693 5.696 1.00 0.00 C ATOM 1540 C ILE A 99 9.510 -0.081 4.428 1.00 0.00 C ATOM 1541 O ILE A 99 10.143 -0.778 3.637 1.00 0.00 O ATOM 1542 CB ILE A 99 7.467 -1.168 5.526 1.00 0.00 C ATOM 1543 CG1 ILE A 99 6.983 -1.906 6.776 1.00 0.00 C ATOM 1544 CG2 ILE A 99 7.315 -2.018 4.263 1.00 0.00 C ATOM 1545 CD1 ILE A 99 5.916 -1.095 7.512 1.00 0.00 C ATOM 0 H ILE A 99 8.136 0.751 7.003 1.00 0.00 H new ATOM 0 HA ILE A 99 9.491 -1.587 5.925 1.00 0.00 H new ATOM 0 HB ILE A 99 6.830 -0.292 5.402 1.00 0.00 H new ATOM 0 HG12 ILE A 99 6.577 -2.878 6.495 1.00 0.00 H new ATOM 0 HG13 ILE A 99 7.826 -2.093 7.441 1.00 0.00 H new ATOM 0 HG21 ILE A 99 6.279 -2.343 4.166 1.00 0.00 H new ATOM 0 HG22 ILE A 99 7.593 -1.427 3.391 1.00 0.00 H new ATOM 0 HG23 ILE A 99 7.964 -2.891 4.332 1.00 0.00 H new ATOM 0 HD11 ILE A 99 5.589 -1.642 8.396 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.333 -0.134 7.813 1.00 0.00 H new ATOM 0 HD13 ILE A 99 5.064 -0.930 6.852 1.00 0.00 H new ATOM 1557 N ALA A 100 9.289 1.216 4.274 1.00 0.00 N ATOM 1558 CA ALA A 100 9.800 1.930 3.115 1.00 0.00 C ATOM 1559 C ALA A 100 11.329 1.889 3.129 1.00 0.00 C ATOM 1560 O ALA A 100 11.959 1.750 2.082 1.00 0.00 O ATOM 1561 CB ALA A 100 9.255 3.360 3.116 1.00 0.00 C ATOM 0 H ALA A 100 8.763 1.791 4.932 1.00 0.00 H new ATOM 0 HA ALA A 100 9.466 1.454 2.193 1.00 0.00 H new ATOM 0 HB1 ALA A 100 9.638 3.896 2.247 1.00 0.00 H new ATOM 0 HB2 ALA A 100 8.166 3.334 3.076 1.00 0.00 H new ATOM 0 HB3 ALA A 100 9.573 3.870 4.026 1.00 0.00 H new ATOM 1567 N GLN A 101 11.882 2.010 4.326 1.00 0.00 N ATOM 1568 CA GLN A 101 13.326 1.989 4.490 1.00 0.00 C ATOM 1569 C GLN A 101 13.840 0.548 4.472 1.00 0.00 C ATOM 1570 O GLN A 101 14.901 0.271 3.916 1.00 0.00 O ATOM 1571 CB GLN A 101 13.742 2.704 5.776 1.00 0.00 C ATOM 1572 CG GLN A 101 13.284 1.924 7.010 1.00 0.00 C ATOM 1573 CD GLN A 101 13.788 2.585 8.295 1.00 0.00 C ATOM 1574 OE1 GLN A 101 13.431 3.702 8.631 1.00 0.00 O ATOM 1575 NE2 GLN A 101 14.636 1.835 8.992 1.00 0.00 N ATOM 0 H GLN A 101 11.356 2.123 5.193 1.00 0.00 H new ATOM 0 HA GLN A 101 13.776 2.525 3.654 1.00 0.00 H new ATOM 0 HB2 GLN A 101 14.825 2.821 5.797 1.00 0.00 H new ATOM 0 HB3 GLN A 101 13.313 3.706 5.795 1.00 0.00 H new ATOM 0 HG2 GLN A 101 12.195 1.870 7.027 1.00 0.00 H new ATOM 0 HG3 GLN A 101 13.653 0.900 6.955 1.00 0.00 H new ATOM 0 HE21 GLN A 101 14.893 0.908 8.654 1.00 0.00 H new ATOM 0 HE22 GLN A 101 15.029 2.187 9.865 1.00 0.00 H new ATOM 1584 N SER A 102 13.064 -0.332 5.088 1.00 0.00 N ATOM 1585 CA SER A 102 13.428 -1.736 5.150 1.00 0.00 C ATOM 1586 C SER A 102 13.635 -2.286 3.737 1.00 0.00 C ATOM 1587 O SER A 102 14.572 -3.045 3.494 1.00 0.00 O ATOM 1588 CB SER A 102 12.359 -2.551 5.884 1.00 0.00 C ATOM 1589 OG SER A 102 12.788 -3.885 6.139 1.00 0.00 O ATOM 0 H SER A 102 12.184 -0.099 5.549 1.00 0.00 H new ATOM 0 HA SER A 102 14.360 -1.823 5.708 1.00 0.00 H new ATOM 0 HB2 SER A 102 12.114 -2.062 6.827 1.00 0.00 H new ATOM 0 HB3 SER A 102 11.446 -2.571 5.289 1.00 0.00 H new ATOM 0 HG SER A 102 12.080 -4.372 6.610 1.00 0.00 H new ATOM 1595 N LEU A 103 12.746 -1.880 2.842 1.00 0.00 N ATOM 1596 CA LEU A 103 12.821 -2.322 1.461 1.00 0.00 C ATOM 1597 C LEU A 103 13.743 -1.385 0.677 1.00 0.00 C ATOM 1598 O LEU A 103 14.238 -1.742 -0.389 1.00 0.00 O ATOM 1599 CB LEU A 103 11.419 -2.447 0.862 1.00 0.00 C ATOM 1600 CG LEU A 103 10.379 -3.155 1.731 1.00 0.00 C ATOM 1601 CD1 LEU A 103 8.963 -2.696 1.377 1.00 0.00 C ATOM 1602 CD2 LEU A 103 10.527 -4.675 1.636 1.00 0.00 C ATOM 0 H LEU A 103 11.971 -1.250 3.047 1.00 0.00 H new ATOM 0 HA LEU A 103 13.258 -3.319 1.404 1.00 0.00 H new ATOM 0 HB2 LEU A 103 11.052 -1.446 0.634 1.00 0.00 H new ATOM 0 HB3 LEU A 103 11.496 -2.981 -0.085 1.00 0.00 H new ATOM 0 HG LEU A 103 10.558 -2.877 2.770 1.00 0.00 H new ATOM 0 HD11 LEU A 103 8.243 -3.215 2.010 1.00 0.00 H new ATOM 0 HD12 LEU A 103 8.878 -1.621 1.537 1.00 0.00 H new ATOM 0 HD13 LEU A 103 8.757 -2.924 0.331 1.00 0.00 H new ATOM 0 HD21 LEU A 103 9.775 -5.154 2.264 1.00 0.00 H new ATOM 0 HD22 LEU A 103 10.390 -4.990 0.602 1.00 0.00 H new ATOM 0 HD23 LEU A 103 11.521 -4.966 1.975 1.00 0.00 H new ATOM 1614 N ASN A 104 13.945 -0.202 1.239 1.00 0.00 N ATOM 1615 CA ASN A 104 14.798 0.791 0.608 1.00 0.00 C ATOM 1616 C ASN A 104 14.128 1.293 -0.673 1.00 0.00 C ATOM 1617 O ASN A 104 14.732 1.269 -1.745 1.00 0.00 O ATOM 1618 CB ASN A 104 16.152 0.190 0.228 1.00 0.00 C ATOM 1619 CG ASN A 104 17.150 1.286 -0.155 1.00 0.00 C ATOM 1620 OD1 ASN A 104 17.665 2.012 0.679 1.00 0.00 O ATOM 1621 ND2 ASN A 104 17.393 1.364 -1.460 1.00 0.00 N ATOM 0 H ASN A 104 13.532 0.091 2.125 1.00 0.00 H new ATOM 0 HA ASN A 104 14.950 1.605 1.317 1.00 0.00 H new ATOM 0 HB2 ASN A 104 16.545 -0.389 1.064 1.00 0.00 H new ATOM 0 HB3 ASN A 104 16.026 -0.500 -0.606 1.00 0.00 H new ATOM 0 HD21 ASN A 104 18.045 2.063 -1.817 1.00 0.00 H new ATOM 0 HD22 ASN A 104 16.928 0.725 -2.105 1.00 0.00 H new ATOM 1628 N ILE A 105 12.888 1.737 -0.519 1.00 0.00 N ATOM 1629 CA ILE A 105 12.129 2.243 -1.651 1.00 0.00 C ATOM 1630 C ILE A 105 12.676 3.615 -2.051 1.00 0.00 C ATOM 1631 O ILE A 105 13.699 3.706 -2.729 1.00 0.00 O ATOM 1632 CB ILE A 105 10.632 2.245 -1.334 1.00 0.00 C ATOM 1633 CG1 ILE A 105 10.143 0.837 -0.987 1.00 0.00 C ATOM 1634 CG2 ILE A 105 9.831 2.865 -2.480 1.00 0.00 C ATOM 1635 CD1 ILE A 105 8.660 0.850 -0.614 1.00 0.00 C ATOM 0 H ILE A 105 12.391 1.757 0.371 1.00 0.00 H new ATOM 0 HA ILE A 105 12.247 1.588 -2.514 1.00 0.00 H new ATOM 0 HB ILE A 105 10.469 2.867 -0.454 1.00 0.00 H new ATOM 0 HG12 ILE A 105 10.302 0.173 -1.836 1.00 0.00 H new ATOM 0 HG13 ILE A 105 10.727 0.439 -0.157 1.00 0.00 H new ATOM 0 HG21 ILE A 105 8.770 2.854 -2.230 1.00 0.00 H new ATOM 0 HG22 ILE A 105 10.157 3.893 -2.637 1.00 0.00 H new ATOM 0 HG23 ILE A 105 9.995 2.290 -3.391 1.00 0.00 H new ATOM 0 HD11 ILE A 105 8.337 -0.162 -0.372 1.00 0.00 H new ATOM 0 HD12 ILE A 105 8.508 1.496 0.251 1.00 0.00 H new ATOM 0 HD13 ILE A 105 8.077 1.226 -1.455 1.00 0.00 H new ATOM 1647 N SER A 106 11.970 4.647 -1.616 1.00 0.00 N ATOM 1648 CA SER A 106 12.369 6.011 -1.921 1.00 0.00 C ATOM 1649 C SER A 106 11.770 6.445 -3.260 1.00 0.00 C ATOM 1650 O SER A 106 11.683 7.638 -3.548 1.00 0.00 O ATOM 1651 CB SER A 106 13.894 6.142 -1.954 1.00 0.00 C ATOM 1652 OG SER A 106 14.412 6.014 -3.275 1.00 0.00 O ATOM 0 H SER A 106 11.123 4.567 -1.054 1.00 0.00 H new ATOM 0 HA SER A 106 11.991 6.663 -1.134 1.00 0.00 H new ATOM 0 HB2 SER A 106 14.184 7.109 -1.543 1.00 0.00 H new ATOM 0 HB3 SER A 106 14.337 5.378 -1.315 1.00 0.00 H new ATOM 0 HG SER A 106 14.410 5.070 -3.537 1.00 0.00 H new ATOM 1658 N VAL A 107 11.372 5.453 -4.043 1.00 0.00 N ATOM 1659 CA VAL A 107 10.784 5.719 -5.346 1.00 0.00 C ATOM 1660 C VAL A 107 9.296 5.365 -5.309 1.00 0.00 C ATOM 1661 O VAL A 107 8.921 4.289 -4.845 1.00 0.00 O ATOM 1662 CB VAL A 107 11.551 4.961 -6.431 1.00 0.00 C ATOM 1663 CG1 VAL A 107 12.894 5.634 -6.724 1.00 0.00 C ATOM 1664 CG2 VAL A 107 11.748 3.494 -6.041 1.00 0.00 C ATOM 0 H VAL A 107 11.445 4.465 -3.801 1.00 0.00 H new ATOM 0 HA VAL A 107 10.862 6.778 -5.592 1.00 0.00 H new ATOM 0 HB VAL A 107 10.955 4.988 -7.343 1.00 0.00 H new ATOM 0 HG11 VAL A 107 13.419 5.076 -7.499 1.00 0.00 H new ATOM 0 HG12 VAL A 107 12.723 6.655 -7.066 1.00 0.00 H new ATOM 0 HG13 VAL A 107 13.498 5.652 -5.817 1.00 0.00 H new ATOM 0 HG21 VAL A 107 12.296 2.978 -6.830 1.00 0.00 H new ATOM 0 HG22 VAL A 107 12.313 3.438 -5.110 1.00 0.00 H new ATOM 0 HG23 VAL A 107 10.776 3.020 -5.905 1.00 0.00 H new ATOM 1674 N TYR A 108 8.489 6.291 -5.804 1.00 0.00 N ATOM 1675 CA TYR A 108 7.050 6.091 -5.834 1.00 0.00 C ATOM 1676 C TYR A 108 6.477 6.427 -7.214 1.00 0.00 C ATOM 1677 O TYR A 108 7.035 7.250 -7.936 1.00 0.00 O ATOM 1678 CB TYR A 108 6.467 7.061 -4.804 1.00 0.00 C ATOM 1679 CG TYR A 108 6.874 6.754 -3.361 1.00 0.00 C ATOM 1680 CD1 TYR A 108 7.043 5.446 -2.955 1.00 0.00 C ATOM 1681 CD2 TYR A 108 7.072 7.786 -2.466 1.00 0.00 C ATOM 1682 CE1 TYR A 108 7.426 5.158 -1.597 1.00 0.00 C ATOM 1683 CE2 TYR A 108 7.455 7.497 -1.109 1.00 0.00 C ATOM 1684 CZ TYR A 108 7.614 6.197 -0.741 1.00 0.00 C ATOM 1685 OH TYR A 108 7.974 5.925 0.542 1.00 0.00 O ATOM 0 H TYR A 108 8.804 7.182 -6.188 1.00 0.00 H new ATOM 0 HA TYR A 108 6.803 5.052 -5.617 1.00 0.00 H new ATOM 0 HB2 TYR A 108 6.785 8.074 -5.053 1.00 0.00 H new ATOM 0 HB3 TYR A 108 5.380 7.041 -4.876 1.00 0.00 H new ATOM 0 HD1 TYR A 108 6.888 4.639 -3.655 1.00 0.00 H new ATOM 0 HD2 TYR A 108 6.940 8.810 -2.784 1.00 0.00 H new ATOM 0 HE1 TYR A 108 7.561 4.139 -1.266 1.00 0.00 H new ATOM 0 HE2 TYR A 108 7.613 8.295 -0.398 1.00 0.00 H new ATOM 0 HH TYR A 108 8.074 6.764 1.039 1.00 0.00 H new ATOM 1695 N PRO A 109 5.342 5.755 -7.544 1.00 0.00 N ATOM 1696 CA PRO A 109 4.746 4.796 -6.628 1.00 0.00 C ATOM 1697 C PRO A 109 5.549 3.494 -6.598 1.00 0.00 C ATOM 1698 O PRO A 109 6.441 3.291 -7.422 1.00 0.00 O ATOM 1699 CB PRO A 109 3.324 4.606 -7.130 1.00 0.00 C ATOM 1700 CG PRO A 109 3.319 5.100 -8.567 1.00 0.00 C ATOM 1701 CD PRO A 109 4.599 5.889 -8.792 1.00 0.00 C ATOM 0 HA PRO A 109 4.747 5.143 -5.595 1.00 0.00 H new ATOM 0 HB2 PRO A 109 3.028 3.558 -7.076 1.00 0.00 H new ATOM 0 HB3 PRO A 109 2.617 5.169 -6.521 1.00 0.00 H new ATOM 0 HG2 PRO A 109 3.261 4.260 -9.259 1.00 0.00 H new ATOM 0 HG3 PRO A 109 2.447 5.727 -8.752 1.00 0.00 H new ATOM 0 HD2 PRO A 109 5.166 5.492 -9.634 1.00 0.00 H new ATOM 0 HD3 PRO A 109 4.386 6.934 -9.015 1.00 0.00 H new ATOM 1709 N SER A 110 5.205 2.646 -5.640 1.00 0.00 N ATOM 1710 CA SER A 110 5.884 1.370 -5.491 1.00 0.00 C ATOM 1711 C SER A 110 4.891 0.301 -5.027 1.00 0.00 C ATOM 1712 O SER A 110 3.809 0.624 -4.540 1.00 0.00 O ATOM 1713 CB SER A 110 7.050 1.477 -4.506 1.00 0.00 C ATOM 1714 OG SER A 110 8.259 0.957 -5.052 1.00 0.00 O ATOM 0 H SER A 110 4.465 2.817 -4.959 1.00 0.00 H new ATOM 0 HA SER A 110 6.290 1.083 -6.461 1.00 0.00 H new ATOM 0 HB2 SER A 110 7.197 2.521 -4.230 1.00 0.00 H new ATOM 0 HB3 SER A 110 6.803 0.937 -3.592 1.00 0.00 H new ATOM 0 HG SER A 110 8.817 0.600 -4.330 1.00 0.00 H new ATOM 1720 N TRP A 111 5.297 -0.949 -5.192 1.00 0.00 N ATOM 1721 CA TRP A 111 4.457 -2.067 -4.796 1.00 0.00 C ATOM 1722 C TRP A 111 5.333 -3.072 -4.046 1.00 0.00 C ATOM 1723 O TRP A 111 6.465 -3.337 -4.448 1.00 0.00 O ATOM 1724 CB TRP A 111 3.749 -2.676 -6.008 1.00 0.00 C ATOM 1725 CG TRP A 111 2.820 -1.706 -6.739 1.00 0.00 C ATOM 1726 CD1 TRP A 111 3.153 -0.600 -7.419 1.00 0.00 C ATOM 1727 CD2 TRP A 111 1.383 -1.801 -6.839 1.00 0.00 C ATOM 1728 NE1 TRP A 111 2.040 0.023 -7.946 1.00 0.00 N ATOM 1729 CE2 TRP A 111 0.930 -0.730 -7.582 1.00 0.00 C ATOM 1730 CE3 TRP A 111 0.496 -2.759 -6.317 1.00 0.00 C ATOM 1731 CZ2 TRP A 111 -0.423 -0.516 -7.872 1.00 0.00 C ATOM 1732 CZ3 TRP A 111 -0.853 -2.531 -6.615 1.00 0.00 C ATOM 1733 CH2 TRP A 111 -1.325 -1.458 -7.363 1.00 0.00 C ATOM 0 H TRP A 111 6.196 -1.213 -5.594 1.00 0.00 H new ATOM 0 HA TRP A 111 3.660 -1.736 -4.130 1.00 0.00 H new ATOM 0 HB2 TRP A 111 4.500 -3.041 -6.709 1.00 0.00 H new ATOM 0 HB3 TRP A 111 3.171 -3.540 -5.681 1.00 0.00 H new ATOM 0 HD1 TRP A 111 4.165 -0.242 -7.539 1.00 0.00 H new ATOM 0 HE1 TRP A 111 2.033 0.879 -8.501 1.00 0.00 H new ATOM 0 HE3 TRP A 111 0.829 -3.604 -5.732 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 -0.753 0.330 -8.457 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 -1.577 -3.238 -6.238 1.00 0.00 H new ATOM 0 HH2 TRP A 111 -2.383 -1.352 -7.551 1.00 0.00 H new ATOM 1744 N ALA A 112 4.775 -3.606 -2.969 1.00 0.00 N ATOM 1745 CA ALA A 112 5.491 -4.577 -2.159 1.00 0.00 C ATOM 1746 C ALA A 112 4.605 -5.805 -1.941 1.00 0.00 C ATOM 1747 O ALA A 112 3.418 -5.674 -1.650 1.00 0.00 O ATOM 1748 CB ALA A 112 5.921 -3.926 -0.843 1.00 0.00 C ATOM 0 H ALA A 112 3.836 -3.385 -2.639 1.00 0.00 H new ATOM 0 HA ALA A 112 6.395 -4.910 -2.668 1.00 0.00 H new ATOM 0 HB1 ALA A 112 6.458 -4.654 -0.235 1.00 0.00 H new ATOM 0 HB2 ALA A 112 6.572 -3.077 -1.053 1.00 0.00 H new ATOM 0 HB3 ALA A 112 5.039 -3.582 -0.302 1.00 0.00 H new ATOM 1754 N LEU A 113 5.217 -6.971 -2.089 1.00 0.00 N ATOM 1755 CA LEU A 113 4.499 -8.221 -1.912 1.00 0.00 C ATOM 1756 C LEU A 113 4.968 -8.896 -0.622 1.00 0.00 C ATOM 1757 O LEU A 113 6.169 -9.009 -0.378 1.00 0.00 O ATOM 1758 CB LEU A 113 4.641 -9.103 -3.154 1.00 0.00 C ATOM 1759 CG LEU A 113 3.939 -10.460 -3.097 1.00 0.00 C ATOM 1760 CD1 LEU A 113 2.418 -10.292 -3.094 1.00 0.00 C ATOM 1761 CD2 LEU A 113 4.410 -11.369 -4.235 1.00 0.00 C ATOM 0 H LEU A 113 6.203 -7.076 -2.330 1.00 0.00 H new ATOM 0 HA LEU A 113 3.431 -8.033 -1.804 1.00 0.00 H new ATOM 0 HB2 LEU A 113 4.255 -8.553 -4.012 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.702 -9.273 -3.335 1.00 0.00 H new ATOM 0 HG LEU A 113 4.212 -10.945 -2.160 1.00 0.00 H new ATOM 0 HD11 LEU A 113 1.944 -11.273 -3.053 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.118 -9.707 -2.224 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.107 -9.776 -4.003 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.895 -12.328 -4.172 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.185 -10.899 -5.193 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.485 -11.528 -4.152 1.00 0.00 H new ATOM 1773 N ILE A 114 3.998 -9.327 0.170 1.00 0.00 N ATOM 1774 CA ILE A 114 4.297 -9.988 1.430 1.00 0.00 C ATOM 1775 C ILE A 114 3.680 -11.388 1.425 1.00 0.00 C ATOM 1776 O ILE A 114 2.483 -11.542 1.191 1.00 0.00 O ATOM 1777 CB ILE A 114 3.848 -9.121 2.609 1.00 0.00 C ATOM 1778 CG1 ILE A 114 4.456 -7.721 2.523 1.00 0.00 C ATOM 1779 CG2 ILE A 114 4.166 -9.804 3.941 1.00 0.00 C ATOM 1780 CD1 ILE A 114 5.978 -7.773 2.671 1.00 0.00 C ATOM 0 H ILE A 114 3.004 -9.232 -0.036 1.00 0.00 H new ATOM 0 HA ILE A 114 5.373 -10.114 1.549 1.00 0.00 H new ATOM 0 HB ILE A 114 2.766 -9.004 2.556 1.00 0.00 H new ATOM 0 HG12 ILE A 114 4.196 -7.266 1.567 1.00 0.00 H new ATOM 0 HG13 ILE A 114 4.033 -7.088 3.303 1.00 0.00 H new ATOM 0 HG21 ILE A 114 3.838 -9.168 4.763 1.00 0.00 H new ATOM 0 HG22 ILE A 114 3.647 -10.761 3.992 1.00 0.00 H new ATOM 0 HG23 ILE A 114 5.241 -9.970 4.017 1.00 0.00 H new ATOM 0 HD11 ILE A 114 6.385 -6.764 2.606 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.235 -8.206 3.638 1.00 0.00 H new ATOM 0 HD13 ILE A 114 6.400 -8.386 1.875 1.00 0.00 H new ATOM 1792 N GLY A 115 4.526 -12.372 1.686 1.00 0.00 N ATOM 1793 CA GLY A 115 4.080 -13.755 1.715 1.00 0.00 C ATOM 1794 C GLY A 115 2.903 -13.930 2.676 1.00 0.00 C ATOM 1795 O GLY A 115 2.621 -13.048 3.486 1.00 0.00 O ATOM 0 H GLY A 115 5.519 -12.240 1.880 1.00 0.00 H new ATOM 0 HA2 GLY A 115 3.786 -14.067 0.713 1.00 0.00 H new ATOM 0 HA3 GLY A 115 4.903 -14.400 2.021 1.00 0.00 H new ATOM 1799 N LYS A 116 2.247 -15.076 2.555 1.00 0.00 N ATOM 1800 CA LYS A 116 1.107 -15.379 3.404 1.00 0.00 C ATOM 1801 C LYS A 116 1.582 -15.549 4.848 1.00 0.00 C ATOM 1802 O LYS A 116 0.774 -15.549 5.775 1.00 0.00 O ATOM 1803 CB LYS A 116 0.342 -16.587 2.862 1.00 0.00 C ATOM 1804 CG LYS A 116 1.210 -17.846 2.896 1.00 0.00 C ATOM 1805 CD LYS A 116 0.346 -19.107 2.987 1.00 0.00 C ATOM 1806 CE LYS A 116 1.004 -20.158 3.882 1.00 0.00 C ATOM 1807 NZ LYS A 116 0.041 -20.661 4.887 1.00 0.00 N ATOM 0 H LYS A 116 2.483 -15.805 1.882 1.00 0.00 H new ATOM 0 HA LYS A 116 0.397 -14.552 3.398 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.559 -16.746 3.454 1.00 0.00 H new ATOM 0 HB3 LYS A 116 0.021 -16.390 1.839 1.00 0.00 H new ATOM 0 HG2 LYS A 116 1.829 -17.889 2.000 1.00 0.00 H new ATOM 0 HG3 LYS A 116 1.887 -17.802 3.749 1.00 0.00 H new ATOM 0 HD2 LYS A 116 -0.637 -18.851 3.383 1.00 0.00 H new ATOM 0 HD3 LYS A 116 0.191 -19.519 1.990 1.00 0.00 H new ATOM 0 HE2 LYS A 116 1.369 -20.985 3.273 1.00 0.00 H new ATOM 0 HE3 LYS A 116 1.870 -19.726 4.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 0.505 -21.374 5.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 -0.287 -19.871 5.479 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 -0.772 -21.092 4.403 1.00 0.00 H new ATOM 1820 N ASP A 117 2.891 -15.691 4.994 1.00 0.00 N ATOM 1821 CA ASP A 117 3.483 -15.861 6.310 1.00 0.00 C ATOM 1822 C ASP A 117 3.677 -14.490 6.959 1.00 0.00 C ATOM 1823 O ASP A 117 3.747 -14.383 8.182 1.00 0.00 O ATOM 1824 CB ASP A 117 4.853 -16.536 6.213 1.00 0.00 C ATOM 1825 CG ASP A 117 4.978 -17.591 5.113 1.00 0.00 C ATOM 1826 OD1 ASP A 117 5.133 -17.264 3.928 1.00 0.00 O ATOM 1827 OD2 ASP A 117 4.912 -18.814 5.520 1.00 0.00 O ATOM 0 H ASP A 117 3.558 -15.692 4.223 1.00 0.00 H new ATOM 0 HA ASP A 117 2.814 -16.484 6.903 1.00 0.00 H new ATOM 0 HB2 ASP A 117 5.608 -15.768 6.046 1.00 0.00 H new ATOM 0 HB3 ASP A 117 5.079 -17.004 7.171 1.00 0.00 H new ATOM 1833 N GLY A 118 3.757 -13.475 6.112 1.00 0.00 N ATOM 1834 CA GLY A 118 3.941 -12.115 6.588 1.00 0.00 C ATOM 1835 C GLY A 118 5.392 -11.662 6.411 1.00 0.00 C ATOM 1836 O GLY A 118 5.881 -10.825 7.167 1.00 0.00 O ATOM 0 H GLY A 118 3.698 -13.567 5.098 1.00 0.00 H new ATOM 0 HA2 GLY A 118 3.278 -11.443 6.044 1.00 0.00 H new ATOM 0 HA3 GLY A 118 3.663 -12.054 7.640 1.00 0.00 H new ATOM 1840 N ASP A 119 6.039 -12.239 5.409 1.00 0.00 N ATOM 1841 CA ASP A 119 7.425 -11.905 5.124 1.00 0.00 C ATOM 1842 C ASP A 119 7.521 -11.298 3.723 1.00 0.00 C ATOM 1843 O ASP A 119 6.678 -11.563 2.867 1.00 0.00 O ATOM 1844 CB ASP A 119 8.310 -13.154 5.159 1.00 0.00 C ATOM 1845 CG ASP A 119 8.086 -14.137 4.008 1.00 0.00 C ATOM 1846 OD1 ASP A 119 8.860 -14.175 3.040 1.00 0.00 O ATOM 1847 OD2 ASP A 119 7.052 -14.898 4.135 1.00 0.00 O ATOM 0 H ASP A 119 5.630 -12.935 4.785 1.00 0.00 H new ATOM 0 HA ASP A 119 7.765 -11.199 5.882 1.00 0.00 H new ATOM 0 HB2 ASP A 119 9.354 -12.841 5.152 1.00 0.00 H new ATOM 0 HB3 ASP A 119 8.140 -13.676 6.101 1.00 0.00 H new ATOM 1853 N VAL A 120 8.555 -10.492 3.532 1.00 0.00 N ATOM 1854 CA VAL A 120 8.771 -9.843 2.250 1.00 0.00 C ATOM 1855 C VAL A 120 8.964 -10.910 1.169 1.00 0.00 C ATOM 1856 O VAL A 120 9.930 -11.670 1.207 1.00 0.00 O ATOM 1857 CB VAL A 120 9.951 -8.872 2.347 1.00 0.00 C ATOM 1858 CG1 VAL A 120 10.284 -8.275 0.978 1.00 0.00 C ATOM 1859 CG2 VAL A 120 9.671 -7.772 3.372 1.00 0.00 C ATOM 0 H VAL A 120 9.252 -10.274 4.244 1.00 0.00 H new ATOM 0 HA VAL A 120 7.900 -9.250 1.971 1.00 0.00 H new ATOM 0 HB VAL A 120 10.821 -9.434 2.687 1.00 0.00 H new ATOM 0 HG11 VAL A 120 11.125 -7.589 1.075 1.00 0.00 H new ATOM 0 HG12 VAL A 120 10.546 -9.075 0.286 1.00 0.00 H new ATOM 0 HG13 VAL A 120 9.418 -7.735 0.596 1.00 0.00 H new ATOM 0 HG21 VAL A 120 10.524 -7.096 3.422 1.00 0.00 H new ATOM 0 HG22 VAL A 120 8.783 -7.215 3.074 1.00 0.00 H new ATOM 0 HG23 VAL A 120 9.506 -8.221 4.351 1.00 0.00 H new ATOM 1869 N GLN A 121 8.028 -10.933 0.233 1.00 0.00 N ATOM 1870 CA GLN A 121 8.082 -11.894 -0.857 1.00 0.00 C ATOM 1871 C GLN A 121 8.863 -11.316 -2.037 1.00 0.00 C ATOM 1872 O GLN A 121 9.883 -11.870 -2.443 1.00 0.00 O ATOM 1873 CB GLN A 121 6.675 -12.318 -1.284 1.00 0.00 C ATOM 1874 CG GLN A 121 6.338 -13.712 -0.754 1.00 0.00 C ATOM 1875 CD GLN A 121 5.260 -14.378 -1.613 1.00 0.00 C ATOM 1876 OE1 GLN A 121 4.814 -13.849 -2.616 1.00 0.00 O ATOM 1877 NE2 GLN A 121 4.868 -15.567 -1.163 1.00 0.00 N ATOM 0 H GLN A 121 7.227 -10.302 0.206 1.00 0.00 H new ATOM 0 HA GLN A 121 8.603 -12.784 -0.505 1.00 0.00 H new ATOM 0 HB2 GLN A 121 5.946 -11.598 -0.913 1.00 0.00 H new ATOM 0 HB3 GLN A 121 6.604 -12.312 -2.372 1.00 0.00 H new ATOM 0 HG2 GLN A 121 7.236 -14.330 -0.747 1.00 0.00 H new ATOM 0 HG3 GLN A 121 5.993 -13.640 0.277 1.00 0.00 H new ATOM 0 HE21 GLN A 121 5.283 -15.953 -0.315 1.00 0.00 H new ATOM 0 HE22 GLN A 121 4.153 -16.092 -1.666 1.00 0.00 H new ATOM 1886 N ARG A 122 8.355 -10.207 -2.555 1.00 0.00 N ATOM 1887 CA ARG A 122 8.993 -9.547 -3.682 1.00 0.00 C ATOM 1888 C ARG A 122 8.760 -8.036 -3.613 1.00 0.00 C ATOM 1889 O ARG A 122 7.806 -7.580 -2.985 1.00 0.00 O ATOM 1890 CB ARG A 122 8.453 -10.080 -5.011 1.00 0.00 C ATOM 1891 CG ARG A 122 9.412 -11.103 -5.622 1.00 0.00 C ATOM 1892 CD ARG A 122 10.359 -10.437 -6.623 1.00 0.00 C ATOM 1893 NE ARG A 122 11.764 -10.722 -6.257 1.00 0.00 N ATOM 1894 CZ ARG A 122 12.826 -10.049 -6.748 1.00 0.00 C ATOM 1895 NH1 ARG A 122 12.650 -9.044 -7.632 1.00 0.00 N ATOM 1896 NH2 ARG A 122 14.039 -10.389 -6.352 1.00 0.00 N ATOM 0 H ARG A 122 7.509 -9.749 -2.215 1.00 0.00 H new ATOM 0 HA ARG A 122 10.061 -9.756 -3.628 1.00 0.00 H new ATOM 0 HB2 ARG A 122 7.478 -10.540 -4.853 1.00 0.00 H new ATOM 0 HB3 ARG A 122 8.307 -9.253 -5.706 1.00 0.00 H new ATOM 0 HG2 ARG A 122 9.990 -11.582 -4.832 1.00 0.00 H new ATOM 0 HG3 ARG A 122 8.843 -11.888 -6.121 1.00 0.00 H new ATOM 0 HD2 ARG A 122 10.155 -10.804 -7.629 1.00 0.00 H new ATOM 0 HD3 ARG A 122 10.189 -9.360 -6.636 1.00 0.00 H new ATOM 0 HE ARG A 122 11.941 -11.475 -5.592 1.00 0.00 H new ATOM 0 HH11 ARG A 122 11.710 -8.789 -7.933 1.00 0.00 H new ATOM 0 HH12 ARG A 122 13.457 -8.540 -7.999 1.00 0.00 H new ATOM 0 HH21 ARG A 122 14.163 -11.150 -5.685 1.00 0.00 H new ATOM 0 HH22 ARG A 122 14.852 -9.890 -6.714 1.00 0.00 H new ATOM 1909 N ILE A 123 9.648 -7.302 -4.266 1.00 0.00 N ATOM 1910 CA ILE A 123 9.551 -5.853 -4.287 1.00 0.00 C ATOM 1911 C ILE A 123 9.449 -5.374 -5.738 1.00 0.00 C ATOM 1912 O ILE A 123 10.194 -5.834 -6.601 1.00 0.00 O ATOM 1913 CB ILE A 123 10.712 -5.226 -3.513 1.00 0.00 C ATOM 1914 CG1 ILE A 123 10.511 -5.380 -2.003 1.00 0.00 C ATOM 1915 CG2 ILE A 123 10.918 -3.766 -3.920 1.00 0.00 C ATOM 1916 CD1 ILE A 123 9.470 -4.383 -1.486 1.00 0.00 C ATOM 0 H ILE A 123 10.439 -7.684 -4.785 1.00 0.00 H new ATOM 0 HA ILE A 123 8.645 -5.525 -3.777 1.00 0.00 H new ATOM 0 HB ILE A 123 11.625 -5.762 -3.772 1.00 0.00 H new ATOM 0 HG12 ILE A 123 10.190 -6.397 -1.777 1.00 0.00 H new ATOM 0 HG13 ILE A 123 11.459 -5.222 -1.488 1.00 0.00 H new ATOM 0 HG21 ILE A 123 11.749 -3.345 -3.355 1.00 0.00 H new ATOM 0 HG22 ILE A 123 11.140 -3.713 -4.986 1.00 0.00 H new ATOM 0 HG23 ILE A 123 10.012 -3.198 -3.710 1.00 0.00 H new ATOM 0 HD11 ILE A 123 9.345 -4.512 -0.411 1.00 0.00 H new ATOM 0 HD12 ILE A 123 9.805 -3.367 -1.693 1.00 0.00 H new ATOM 0 HD13 ILE A 123 8.518 -4.559 -1.986 1.00 0.00 H new ATOM 1928 N VAL A 124 8.521 -4.454 -5.959 1.00 0.00 N ATOM 1929 CA VAL A 124 8.313 -3.907 -7.290 1.00 0.00 C ATOM 1930 C VAL A 124 8.353 -2.379 -7.220 1.00 0.00 C ATOM 1931 O VAL A 124 7.497 -1.760 -6.590 1.00 0.00 O ATOM 1932 CB VAL A 124 7.007 -4.446 -7.877 1.00 0.00 C ATOM 1933 CG1 VAL A 124 6.662 -3.736 -9.188 1.00 0.00 C ATOM 1934 CG2 VAL A 124 7.078 -5.961 -8.076 1.00 0.00 C ATOM 0 H VAL A 124 7.905 -4.074 -5.240 1.00 0.00 H new ATOM 0 HA VAL A 124 9.111 -4.222 -7.963 1.00 0.00 H new ATOM 0 HB VAL A 124 6.209 -4.240 -7.164 1.00 0.00 H new ATOM 0 HG11 VAL A 124 5.729 -4.137 -9.585 1.00 0.00 H new ATOM 0 HG12 VAL A 124 6.548 -2.668 -9.004 1.00 0.00 H new ATOM 0 HG13 VAL A 124 7.462 -3.896 -9.910 1.00 0.00 H new ATOM 0 HG21 VAL A 124 6.137 -6.318 -8.494 1.00 0.00 H new ATOM 0 HG22 VAL A 124 7.893 -6.200 -8.760 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.255 -6.446 -7.116 1.00 0.00 H new ATOM 1944 N LYS A 125 9.356 -1.815 -7.877 1.00 0.00 N ATOM 1945 CA LYS A 125 9.518 -0.372 -7.898 1.00 0.00 C ATOM 1946 C LYS A 125 8.868 0.191 -9.163 1.00 0.00 C ATOM 1947 O LYS A 125 9.021 -0.369 -10.247 1.00 0.00 O ATOM 1948 CB LYS A 125 10.993 0.004 -7.745 1.00 0.00 C ATOM 1949 CG LYS A 125 11.802 -0.445 -8.964 1.00 0.00 C ATOM 1950 CD LYS A 125 13.190 -0.941 -8.549 1.00 0.00 C ATOM 1951 CE LYS A 125 14.287 -0.225 -9.340 1.00 0.00 C ATOM 1952 NZ LYS A 125 15.394 0.175 -8.445 1.00 0.00 N ATOM 0 H LYS A 125 10.064 -2.332 -8.399 1.00 0.00 H new ATOM 0 HA LYS A 125 9.008 0.081 -7.048 1.00 0.00 H new ATOM 0 HB2 LYS A 125 11.086 1.083 -7.619 1.00 0.00 H new ATOM 0 HB3 LYS A 125 11.398 -0.458 -6.845 1.00 0.00 H new ATOM 0 HG2 LYS A 125 11.269 -1.240 -9.486 1.00 0.00 H new ATOM 0 HG3 LYS A 125 11.903 0.385 -9.664 1.00 0.00 H new ATOM 0 HD2 LYS A 125 13.337 -0.772 -7.482 1.00 0.00 H new ATOM 0 HD3 LYS A 125 13.260 -2.016 -8.714 1.00 0.00 H new ATOM 0 HE2 LYS A 125 14.665 -0.881 -10.125 1.00 0.00 H new ATOM 0 HE3 LYS A 125 13.873 0.655 -9.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 16.130 0.659 -8.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 15.033 0.818 -7.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 15.799 -0.670 -7.995 1.00 0.00 H new ATOM 1965 N GLY A 126 8.156 1.295 -8.983 1.00 0.00 N ATOM 1966 CA GLY A 126 7.482 1.941 -10.096 1.00 0.00 C ATOM 1967 C GLY A 126 5.965 1.767 -9.995 1.00 0.00 C ATOM 1968 O GLY A 126 5.424 1.630 -8.899 1.00 0.00 O ATOM 0 H GLY A 126 8.032 1.758 -8.083 1.00 0.00 H new ATOM 0 HA2 GLY A 126 7.730 3.002 -10.109 1.00 0.00 H new ATOM 0 HA3 GLY A 126 7.838 1.519 -11.036 1.00 0.00 H new ATOM 1972 N SER A 127 5.322 1.778 -11.153 1.00 0.00 N ATOM 1973 CA SER A 127 3.877 1.623 -11.207 1.00 0.00 C ATOM 1974 C SER A 127 3.516 0.368 -12.006 1.00 0.00 C ATOM 1975 O SER A 127 4.319 -0.118 -12.800 1.00 0.00 O ATOM 1976 CB SER A 127 3.214 2.855 -11.826 1.00 0.00 C ATOM 1977 OG SER A 127 3.879 4.061 -11.457 1.00 0.00 O ATOM 0 H SER A 127 5.774 1.892 -12.061 1.00 0.00 H new ATOM 0 HA SER A 127 3.505 1.517 -10.188 1.00 0.00 H new ATOM 0 HB2 SER A 127 3.213 2.759 -12.912 1.00 0.00 H new ATOM 0 HB3 SER A 127 2.172 2.904 -11.509 1.00 0.00 H new ATOM 0 HG SER A 127 3.427 4.824 -11.873 1.00 0.00 H new ATOM 1983 N ILE A 128 2.307 -0.117 -11.769 1.00 0.00 N ATOM 1984 CA ILE A 128 1.829 -1.304 -12.456 1.00 0.00 C ATOM 1985 C ILE A 128 0.377 -1.090 -12.888 1.00 0.00 C ATOM 1986 O ILE A 128 -0.276 -0.151 -12.435 1.00 0.00 O ATOM 1987 CB ILE A 128 2.035 -2.547 -11.587 1.00 0.00 C ATOM 1988 CG1 ILE A 128 1.637 -2.272 -10.134 1.00 0.00 C ATOM 1989 CG2 ILE A 128 3.472 -3.062 -11.699 1.00 0.00 C ATOM 1990 CD1 ILE A 128 1.203 -3.560 -9.432 1.00 0.00 C ATOM 0 H ILE A 128 1.643 0.291 -11.110 1.00 0.00 H new ATOM 0 HA ILE A 128 2.409 -1.477 -13.362 1.00 0.00 H new ATOM 0 HB ILE A 128 1.380 -3.335 -11.957 1.00 0.00 H new ATOM 0 HG12 ILE A 128 2.478 -1.828 -9.601 1.00 0.00 H new ATOM 0 HG13 ILE A 128 0.824 -1.547 -10.107 1.00 0.00 H new ATOM 0 HG21 ILE A 128 3.592 -3.946 -11.072 1.00 0.00 H new ATOM 0 HG22 ILE A 128 3.686 -3.321 -12.736 1.00 0.00 H new ATOM 0 HG23 ILE A 128 4.163 -2.286 -11.369 1.00 0.00 H new ATOM 0 HD11 ILE A 128 0.926 -3.337 -8.402 1.00 0.00 H new ATOM 0 HD12 ILE A 128 0.347 -3.988 -9.954 1.00 0.00 H new ATOM 0 HD13 ILE A 128 2.027 -4.274 -9.440 1.00 0.00 H new ATOM 2002 N ASN A 129 -0.087 -1.977 -13.755 1.00 0.00 N ATOM 2003 CA ASN A 129 -1.449 -1.897 -14.252 1.00 0.00 C ATOM 2004 C ASN A 129 -2.283 -3.017 -13.627 1.00 0.00 C ATOM 2005 O ASN A 129 -1.738 -3.935 -13.017 1.00 0.00 O ATOM 2006 CB ASN A 129 -1.493 -2.066 -15.773 1.00 0.00 C ATOM 2007 CG ASN A 129 -0.458 -3.093 -16.238 1.00 0.00 C ATOM 2008 OD1 ASN A 129 0.738 -2.860 -16.217 1.00 0.00 O ATOM 2009 ND2 ASN A 129 -0.986 -4.238 -16.661 1.00 0.00 N ATOM 0 H ASN A 129 0.457 -2.756 -14.126 1.00 0.00 H new ATOM 0 HA ASN A 129 -1.846 -0.917 -13.987 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -2.490 -2.384 -16.079 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -1.302 -1.107 -16.255 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -0.379 -4.987 -16.995 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -1.998 -4.367 -16.652 1.00 0.00 H new ATOM 2016 N GLU A 130 -3.592 -2.905 -13.801 1.00 0.00 N ATOM 2017 CA GLU A 130 -4.505 -3.899 -13.262 1.00 0.00 C ATOM 2018 C GLU A 130 -4.073 -5.304 -13.684 1.00 0.00 C ATOM 2019 O GLU A 130 -4.058 -6.223 -12.869 1.00 0.00 O ATOM 2020 CB GLU A 130 -5.944 -3.613 -13.698 1.00 0.00 C ATOM 2021 CG GLU A 130 -6.926 -4.548 -12.989 1.00 0.00 C ATOM 2022 CD GLU A 130 -8.308 -4.490 -13.645 1.00 0.00 C ATOM 2023 OE1 GLU A 130 -8.534 -5.145 -14.674 1.00 0.00 O ATOM 2024 OE2 GLU A 130 -9.163 -3.730 -13.048 1.00 0.00 O ATOM 0 H GLU A 130 -4.042 -2.142 -14.307 1.00 0.00 H new ATOM 0 HA GLU A 130 -4.471 -3.843 -12.174 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -6.197 -2.577 -13.474 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -6.033 -3.737 -14.777 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.548 -5.570 -13.019 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.006 -4.269 -11.938 1.00 0.00 H new ATOM 2032 N ALA A 131 -3.732 -5.423 -14.959 1.00 0.00 N ATOM 2033 CA ALA A 131 -3.301 -6.701 -15.500 1.00 0.00 C ATOM 2034 C ALA A 131 -2.127 -7.231 -14.673 1.00 0.00 C ATOM 2035 O ALA A 131 -2.140 -8.382 -14.237 1.00 0.00 O ATOM 2036 CB ALA A 131 -2.942 -6.535 -16.979 1.00 0.00 C ATOM 0 H ALA A 131 -3.745 -4.657 -15.632 1.00 0.00 H new ATOM 0 HA ALA A 131 -4.106 -7.434 -15.439 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -2.619 -7.494 -17.385 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -3.816 -6.185 -17.528 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -2.136 -5.808 -17.078 1.00 0.00 H new ATOM 2042 N GLN A 132 -1.142 -6.367 -14.481 1.00 0.00 N ATOM 2043 CA GLN A 132 0.036 -6.734 -13.714 1.00 0.00 C ATOM 2044 C GLN A 132 -0.373 -7.324 -12.363 1.00 0.00 C ATOM 2045 O GLN A 132 0.176 -8.338 -11.933 1.00 0.00 O ATOM 2046 CB GLN A 132 0.964 -5.531 -13.527 1.00 0.00 C ATOM 2047 CG GLN A 132 2.067 -5.520 -14.588 1.00 0.00 C ATOM 2048 CD GLN A 132 3.039 -4.360 -14.357 1.00 0.00 C ATOM 2049 OE1 GLN A 132 2.739 -3.206 -14.608 1.00 0.00 O ATOM 2050 NE2 GLN A 132 4.216 -4.732 -13.862 1.00 0.00 N ATOM 0 H GLN A 132 -1.135 -5.414 -14.843 1.00 0.00 H new ATOM 0 HA GLN A 132 0.585 -7.494 -14.270 1.00 0.00 H new ATOM 0 HB2 GLN A 132 0.386 -4.609 -13.588 1.00 0.00 H new ATOM 0 HB3 GLN A 132 1.411 -5.562 -12.533 1.00 0.00 H new ATOM 0 HG2 GLN A 132 2.610 -6.465 -14.563 1.00 0.00 H new ATOM 0 HG3 GLN A 132 1.622 -5.434 -15.579 1.00 0.00 H new ATOM 0 HE21 GLN A 132 4.402 -5.717 -13.675 1.00 0.00 H new ATOM 0 HE22 GLN A 132 4.933 -4.032 -13.670 1.00 0.00 H new ATOM 2059 N ALA A 133 -1.333 -6.667 -11.732 1.00 0.00 N ATOM 2060 CA ALA A 133 -1.823 -7.115 -10.439 1.00 0.00 C ATOM 2061 C ALA A 133 -2.295 -8.565 -10.552 1.00 0.00 C ATOM 2062 O ALA A 133 -1.971 -9.397 -9.705 1.00 0.00 O ATOM 2063 CB ALA A 133 -2.931 -6.177 -9.958 1.00 0.00 C ATOM 0 H ALA A 133 -1.786 -5.827 -12.092 1.00 0.00 H new ATOM 0 HA ALA A 133 -1.026 -7.084 -9.696 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -3.298 -6.514 -8.988 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -2.536 -5.165 -9.865 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -3.750 -6.182 -10.677 1.00 0.00 H new ATOM 2069 N LEU A 134 -3.055 -8.826 -11.605 1.00 0.00 N ATOM 2070 CA LEU A 134 -3.575 -10.162 -11.841 1.00 0.00 C ATOM 2071 C LEU A 134 -2.409 -11.140 -11.993 1.00 0.00 C ATOM 2072 O LEU A 134 -2.370 -12.175 -11.331 1.00 0.00 O ATOM 2073 CB LEU A 134 -4.536 -10.161 -13.033 1.00 0.00 C ATOM 2074 CG LEU A 134 -5.632 -9.093 -13.008 1.00 0.00 C ATOM 2075 CD1 LEU A 134 -6.568 -9.241 -14.209 1.00 0.00 C ATOM 2076 CD2 LEU A 134 -6.395 -9.119 -11.682 1.00 0.00 C ATOM 0 H LEU A 134 -3.323 -8.134 -12.305 1.00 0.00 H new ATOM 0 HA LEU A 134 -4.163 -10.497 -10.987 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -3.953 -10.034 -13.945 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -5.011 -11.140 -13.092 1.00 0.00 H new ATOM 0 HG LEU A 134 -5.157 -8.115 -13.087 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -7.338 -8.470 -14.168 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -5.997 -9.134 -15.131 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -7.038 -10.224 -14.185 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -7.168 -8.350 -11.692 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -6.858 -10.097 -11.548 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -5.704 -8.929 -10.861 1.00 0.00 H new ATOM 2088 N ALA A 135 -1.486 -10.778 -12.873 1.00 0.00 N ATOM 2089 CA ALA A 135 -0.322 -11.610 -13.121 1.00 0.00 C ATOM 2090 C ALA A 135 0.474 -11.767 -11.824 1.00 0.00 C ATOM 2091 O ALA A 135 1.160 -12.768 -11.629 1.00 0.00 O ATOM 2092 CB ALA A 135 0.514 -10.997 -14.247 1.00 0.00 C ATOM 0 H ALA A 135 -1.522 -9.919 -13.423 1.00 0.00 H new ATOM 0 HA ALA A 135 -0.625 -12.606 -13.444 1.00 0.00 H new ATOM 0 HB1 ALA A 135 1.388 -11.622 -14.433 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -0.087 -10.935 -15.154 1.00 0.00 H new ATOM 0 HB3 ALA A 135 0.838 -9.997 -13.957 1.00 0.00 H new ATOM 2098 N LEU A 136 0.355 -10.761 -10.969 1.00 0.00 N ATOM 2099 CA LEU A 136 1.056 -10.774 -9.697 1.00 0.00 C ATOM 2100 C LEU A 136 0.399 -11.799 -8.769 1.00 0.00 C ATOM 2101 O LEU A 136 1.087 -12.585 -8.120 1.00 0.00 O ATOM 2102 CB LEU A 136 1.121 -9.364 -9.106 1.00 0.00 C ATOM 2103 CG LEU A 136 1.609 -9.266 -7.659 1.00 0.00 C ATOM 2104 CD1 LEU A 136 2.953 -8.537 -7.583 1.00 0.00 C ATOM 2105 CD2 LEU A 136 0.552 -8.612 -6.768 1.00 0.00 C ATOM 0 H LEU A 136 -0.216 -9.932 -11.133 1.00 0.00 H new ATOM 0 HA LEU A 136 2.092 -11.085 -9.836 1.00 0.00 H new ATOM 0 HB2 LEU A 136 1.777 -8.759 -9.732 1.00 0.00 H new ATOM 0 HB3 LEU A 136 0.127 -8.921 -9.164 1.00 0.00 H new ATOM 0 HG LEU A 136 1.768 -10.276 -7.282 1.00 0.00 H new ATOM 0 HD11 LEU A 136 3.278 -8.481 -6.544 1.00 0.00 H new ATOM 0 HD12 LEU A 136 3.696 -9.081 -8.166 1.00 0.00 H new ATOM 0 HD13 LEU A 136 2.844 -7.529 -7.984 1.00 0.00 H new ATOM 0 HD21 LEU A 136 0.924 -8.554 -5.745 1.00 0.00 H new ATOM 0 HD22 LEU A 136 0.339 -7.608 -7.134 1.00 0.00 H new ATOM 0 HD23 LEU A 136 -0.361 -9.207 -6.789 1.00 0.00 H new ATOM 2117 N ILE A 137 -0.925 -11.756 -8.736 1.00 0.00 N ATOM 2118 CA ILE A 137 -1.684 -12.672 -7.900 1.00 0.00 C ATOM 2119 C ILE A 137 -1.634 -14.074 -8.510 1.00 0.00 C ATOM 2120 O ILE A 137 -1.852 -15.065 -7.815 1.00 0.00 O ATOM 2121 CB ILE A 137 -3.103 -12.146 -7.679 1.00 0.00 C ATOM 2122 CG1 ILE A 137 -3.080 -10.755 -7.043 1.00 0.00 C ATOM 2123 CG2 ILE A 137 -3.934 -13.138 -6.863 1.00 0.00 C ATOM 2124 CD1 ILE A 137 -4.144 -9.849 -7.666 1.00 0.00 C ATOM 0 H ILE A 137 -1.492 -11.101 -9.275 1.00 0.00 H new ATOM 0 HA ILE A 137 -1.238 -12.741 -6.908 1.00 0.00 H new ATOM 0 HB ILE A 137 -3.586 -12.046 -8.651 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -3.252 -10.839 -5.970 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -2.095 -10.308 -7.174 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -4.939 -12.740 -6.720 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -3.992 -14.088 -7.395 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -3.464 -13.294 -5.892 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -4.106 -8.866 -7.196 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -3.955 -9.747 -8.735 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -5.130 -10.287 -7.512 1.00 0.00 H new ATOM 2136 N ARG A 138 -1.346 -14.112 -9.803 1.00 0.00 N ATOM 2137 CA ARG A 138 -1.266 -15.376 -10.515 1.00 0.00 C ATOM 2138 C ARG A 138 0.112 -16.011 -10.316 1.00 0.00 C ATOM 2139 O ARG A 138 0.214 -17.197 -10.008 1.00 0.00 O ATOM 2140 CB ARG A 138 -1.519 -15.182 -12.012 1.00 0.00 C ATOM 2141 CG ARG A 138 -2.715 -16.017 -12.478 1.00 0.00 C ATOM 2142 CD ARG A 138 -3.847 -15.121 -12.980 1.00 0.00 C ATOM 2143 NE ARG A 138 -5.061 -15.929 -13.228 1.00 0.00 N ATOM 2144 CZ ARG A 138 -6.283 -15.407 -13.468 1.00 0.00 C ATOM 2145 NH1 ARG A 138 -6.463 -14.070 -13.496 1.00 0.00 N ATOM 2146 NH2 ARG A 138 -7.299 -16.224 -13.676 1.00 0.00 N ATOM 0 H ARG A 138 -1.165 -13.288 -10.376 1.00 0.00 H new ATOM 0 HA ARG A 138 -2.035 -16.034 -10.110 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -1.703 -14.128 -12.220 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -0.630 -15.467 -12.575 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -2.403 -16.694 -13.273 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -3.074 -16.636 -11.655 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -4.061 -14.345 -12.245 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -3.543 -14.616 -13.897 1.00 0.00 H new ATOM 0 HE ARG A 138 -4.969 -16.945 -13.217 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -5.673 -13.446 -13.335 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -7.389 -13.684 -13.678 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -7.154 -17.233 -13.654 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -8.228 -15.846 -13.859 1.00 0.00 H new ATOM 2159 N ASP A 139 1.137 -15.192 -10.500 1.00 0.00 N ATOM 2160 CA ASP A 139 2.504 -15.659 -10.343 1.00 0.00 C ATOM 2161 C ASP A 139 3.445 -14.454 -10.277 1.00 0.00 C ATOM 2162 O ASP A 139 3.367 -13.553 -11.113 1.00 0.00 O ATOM 2163 CB ASP A 139 2.929 -16.525 -11.531 1.00 0.00 C ATOM 2164 CG ASP A 139 3.900 -17.658 -11.190 1.00 0.00 C ATOM 2165 OD1 ASP A 139 5.056 -17.416 -10.815 1.00 0.00 O ATOM 2166 OD2 ASP A 139 3.418 -18.848 -11.326 1.00 0.00 O ATOM 0 H ASP A 139 1.048 -14.209 -10.756 1.00 0.00 H new ATOM 0 HA ASP A 139 2.556 -16.249 -9.428 1.00 0.00 H new ATOM 0 HB2 ASP A 139 2.037 -16.956 -11.985 1.00 0.00 H new ATOM 0 HB3 ASP A 139 3.391 -15.884 -12.282 1.00 0.00 H new ATOM 2172 N PRO A 140 4.335 -14.476 -9.250 1.00 0.00 N ATOM 2173 CA PRO A 140 5.291 -13.397 -9.063 1.00 0.00 C ATOM 2174 C PRO A 140 6.422 -13.482 -10.090 1.00 0.00 C ATOM 2175 O PRO A 140 7.190 -12.537 -10.251 1.00 0.00 O ATOM 2176 CB PRO A 140 5.777 -13.544 -7.630 1.00 0.00 C ATOM 2177 CG PRO A 140 5.432 -14.967 -7.219 1.00 0.00 C ATOM 2178 CD PRO A 140 4.457 -15.526 -8.242 1.00 0.00 C ATOM 0 HA PRO A 140 4.850 -12.413 -9.220 1.00 0.00 H new ATOM 0 HB2 PRO A 140 6.850 -13.366 -7.561 1.00 0.00 H new ATOM 0 HB3 PRO A 140 5.291 -12.820 -6.976 1.00 0.00 H new ATOM 0 HG2 PRO A 140 6.332 -15.580 -7.175 1.00 0.00 H new ATOM 0 HG3 PRO A 140 4.989 -14.980 -6.223 1.00 0.00 H new ATOM 0 HD2 PRO A 140 4.829 -16.453 -8.679 1.00 0.00 H new ATOM 0 HD3 PRO A 140 3.493 -15.753 -7.787 1.00 0.00 H new ATOM 2186 N ASN A 141 6.486 -14.623 -10.758 1.00 0.00 N ATOM 2187 CA ASN A 141 7.510 -14.844 -11.766 1.00 0.00 C ATOM 2188 C ASN A 141 7.080 -14.183 -13.076 1.00 0.00 C ATOM 2189 O ASN A 141 7.915 -13.900 -13.936 1.00 0.00 O ATOM 2190 CB ASN A 141 7.707 -16.337 -12.033 1.00 0.00 C ATOM 2191 CG ASN A 141 8.317 -17.037 -10.816 1.00 0.00 C ATOM 2192 OD1 ASN A 141 9.446 -16.787 -10.425 1.00 0.00 O ATOM 2193 ND2 ASN A 141 7.511 -17.924 -10.241 1.00 0.00 N ATOM 0 H ASN A 141 5.846 -15.405 -10.622 1.00 0.00 H new ATOM 0 HA ASN A 141 8.443 -14.417 -11.398 1.00 0.00 H new ATOM 0 HB2 ASN A 141 6.749 -16.796 -12.278 1.00 0.00 H new ATOM 0 HB3 ASN A 141 8.356 -16.473 -12.898 1.00 0.00 H new ATOM 0 HD21 ASN A 141 7.826 -18.443 -9.422 1.00 0.00 H new ATOM 0 HD22 ASN A 141 6.577 -18.085 -10.619 1.00 0.00 H new ATOM 2200 N ALA A 142 5.781 -13.953 -13.188 1.00 0.00 N ATOM 2201 CA ALA A 142 5.231 -13.330 -14.381 1.00 0.00 C ATOM 2202 C ALA A 142 5.911 -11.978 -14.603 1.00 0.00 C ATOM 2203 O ALA A 142 6.563 -11.451 -13.703 1.00 0.00 O ATOM 2204 CB ALA A 142 3.713 -13.202 -14.236 1.00 0.00 C ATOM 0 H ALA A 142 5.092 -14.187 -12.473 1.00 0.00 H new ATOM 0 HA ALA A 142 5.424 -13.945 -15.260 1.00 0.00 H new ATOM 0 HB1 ALA A 142 3.300 -12.735 -15.130 1.00 0.00 H new ATOM 0 HB2 ALA A 142 3.275 -14.192 -14.108 1.00 0.00 H new ATOM 0 HB3 ALA A 142 3.481 -12.588 -13.366 1.00 0.00 H new ATOM 2210 N ASP A 143 5.737 -11.455 -15.809 1.00 0.00 N ATOM 2211 CA ASP A 143 6.325 -10.175 -16.162 1.00 0.00 C ATOM 2212 C ASP A 143 7.849 -10.276 -16.068 1.00 0.00 C ATOM 2213 O ASP A 143 8.392 -10.534 -14.994 1.00 0.00 O ATOM 2214 CB ASP A 143 5.864 -9.073 -15.205 1.00 0.00 C ATOM 2215 CG ASP A 143 5.435 -7.769 -15.878 1.00 0.00 C ATOM 2216 OD1 ASP A 143 4.321 -7.660 -16.410 1.00 0.00 O ATOM 2217 OD2 ASP A 143 6.314 -6.824 -15.843 1.00 0.00 O ATOM 0 H ASP A 143 5.197 -11.896 -16.554 1.00 0.00 H new ATOM 0 HA ASP A 143 6.009 -9.927 -17.175 1.00 0.00 H new ATOM 0 HB2 ASP A 143 5.029 -9.451 -14.615 1.00 0.00 H new ATOM 0 HB3 ASP A 143 6.674 -8.855 -14.509 1.00 0.00 H new ATOM 2223 N LEU A 144 8.495 -10.067 -17.205 1.00 0.00 N ATOM 2224 CA LEU A 144 9.946 -10.132 -17.263 1.00 0.00 C ATOM 2225 C LEU A 144 10.466 -9.001 -18.152 1.00 0.00 C ATOM 2226 O LEU A 144 10.614 -7.868 -17.699 1.00 0.00 O ATOM 2227 CB LEU A 144 10.402 -11.523 -17.707 1.00 0.00 C ATOM 2228 CG LEU A 144 10.314 -11.812 -19.207 1.00 0.00 C ATOM 2229 CD1 LEU A 144 11.621 -12.416 -19.726 1.00 0.00 C ATOM 2230 CD2 LEU A 144 9.107 -12.697 -19.525 1.00 0.00 C ATOM 0 H LEU A 144 8.041 -9.853 -18.093 1.00 0.00 H new ATOM 0 HA LEU A 144 10.375 -9.983 -16.272 1.00 0.00 H new ATOM 0 HB2 LEU A 144 11.436 -11.663 -17.391 1.00 0.00 H new ATOM 0 HB3 LEU A 144 9.804 -12.265 -17.179 1.00 0.00 H new ATOM 0 HG LEU A 144 10.166 -10.867 -19.729 1.00 0.00 H new ATOM 0 HD11 LEU A 144 11.532 -12.612 -20.795 1.00 0.00 H new ATOM 0 HD12 LEU A 144 12.439 -11.717 -19.552 1.00 0.00 H new ATOM 0 HD13 LEU A 144 11.824 -13.350 -19.201 1.00 0.00 H new ATOM 0 HD21 LEU A 144 9.068 -12.887 -20.598 1.00 0.00 H new ATOM 0 HD22 LEU A 144 9.199 -13.643 -18.992 1.00 0.00 H new ATOM 0 HD23 LEU A 144 8.193 -12.192 -19.212 1.00 0.00 H new TER 2242 LEU A 144