USER MOD reduce.3.24.130724 H: found=0, std=0, add=1346, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1340 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 43 ASN : amide:sc= 1.11 K(o=2.2,f=0.38) USER MOD Set 1.2: A 47 GLN : amide:sc= 1.05 K(o=2.2,f=0.38) 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 THR OG1 : rot 180:sc= -0.0452 USER MOD Single : A 5 SER OG : rot 74:sc= 1.11 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot 30:sc= -0.0286 USER MOD Single : A 8 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN :FLIP amide:sc= -0.0682 F(o=-1.1,f=-0.068) USER MOD Single : A 14 LYS NZ :NH3+ 143:sc= 1.12 (180deg=0.135!) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 HIS : no HD1:sc= 0.843 K(o=0.84,f=-4.4!) USER MOD Single : A 29 SER OG : rot -170:sc= 0.0088 USER MOD Single : A 33 THR OG1 : rot 66:sc= 1.21 USER MOD Single : A 35 MET CE :methyl -145:sc= -3.17! (180deg=-5.54!) USER MOD Single : A 39 ASN :FLIP amide:sc= -0.797 F(o=-2.5!,f=-0.8) USER MOD Single : A 42 THR OG1 : rot 76:sc= 1.1 USER MOD Single : A 46 ASN : amide:sc= -0.141 X(o=-0.14,f=-0.52) USER MOD Single : A 52 SER OG : rot -26:sc= 0.245 USER MOD Single : A 53 GLN :FLIP amide:sc= -0.0364 F(o=-1.3,f=-0.036) USER MOD Single : A 55 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.084) USER MOD Single : A 60 LYS NZ :NH3+ -166:sc= 1.22 (180deg=1.01) USER MOD Single : A 63 GLN : amide:sc= -0.41 X(o=-0.41,f=-0.14) USER MOD Single : A 66 MET CE :methyl 167:sc= -1.73! (180deg=-1.95!) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 78:sc= 1.22 USER MOD Single : A 71 THR OG1 : rot 140:sc= -0.0333 USER MOD Single : A 73 LYS NZ :NH3+ -133:sc= -0.356 (180deg=-2.88!) USER MOD Single : A 74 THR OG1 : rot 180:sc= -0.0318 USER MOD Single : A 75 HIS : no HD1:sc= 0 X(o=0,f=-0.00071) USER MOD Single : A 78 HIS : no HD1:sc= -0.149 X(o=-0.15,f=-0.092) USER MOD Single : A 79 HIS : no HD1:sc= -0.886 X(o=-0.89,f=-0.93) USER MOD Single : A 80 HIS : no HD1:sc= -0.316 X(o=-0.32,f=-0.32) USER MOD Single : A 81 HIS : no HD1:sc= -0.122 X(o=-0.12,f=-0.0036) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=-0.0071) USER MOD Single : A 83 HIS :FLIP no HE2:sc= -0.0264 F(o=-1.5,f=-0.026) USER MOD Single : B 1 MET CE :methyl 165:sc= -0.0854 (180deg=-0.481) USER MOD Single : B 1 MET N :NH3+ -165:sc= -0.0226 (180deg=-0.272) USER MOD Single : B 4 THR OG1 : rot -130:sc= -0.775 USER MOD Single : B 5 SER OG : rot 180:sc= 0 USER MOD Single : B 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 7 TYR OH : rot -140:sc= -0.55 USER MOD Single : B 8 THR OG1 : rot 180:sc= 0 USER MOD Single : B 11 GLN : amide:sc= 0.0632 K(o=0.063,f=-0.45) USER MOD Single : B 14 LYS NZ :NH3+ -150:sc= 1.21 (180deg=0.998) USER MOD Single : B 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 HIS : no HD1:sc= 0.285 K(o=0.28,f=-6.2!) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 33 THR OG1 : rot 64:sc= 0.57 USER MOD Single : B 35 MET CE :methyl -143:sc= -3.88! (180deg=-5.87!) USER MOD Single : B 39 ASN : amide:sc= 0.868 K(o=0.87,f=-0.035) USER MOD Single : B 42 THR OG1 : rot 85:sc= 1.32 USER MOD Single : B 43 ASN :FLIP amide:sc= -0.0044 F(o=-1.5,f=-0.0044) USER MOD Single : B 46 ASN : amide:sc= 0.816 K(o=0.82,f=-0.25) USER MOD Single : B 47 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : B 52 SER OG : rot 180:sc=9.52e-05 USER MOD Single : B 53 GLN : amide:sc=-0.00278 K(o=-0.0028,f=-0.74) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 60 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0403) USER MOD Single : B 63 GLN :FLIP amide:sc= 0 F(o=-0.62,f=0) USER MOD Single : B 66 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 67 SER OG : rot 58:sc= 1.24 USER MOD Single : B 68 SER OG : rot -30:sc= 0.108 USER MOD Single : B 71 THR OG1 : rot 180:sc= -0.107 USER MOD Single : B 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 74 THR OG1 : rot 180:sc= 0 USER MOD Single : B 75 HIS : no HD1:sc= -0.139 X(o=-0.14,f=0) USER MOD Single : B 78 HIS : no HE2:sc= 1.15 K(o=1.2,f=-3.7!) USER MOD Single : B 79 HIS : no HD1:sc= 0.512 K(o=0.51,f=-3.2!) USER MOD Single : B 80 HIS : no HD1:sc= -0.0314 X(o=-0.031,f=-0.0076) USER MOD Single : B 81 HIS : no HD1:sc= -0.0434 X(o=-0.043,f=-0.006) USER MOD Single : B 82 HIS : no HD1:sc=-0.00152 X(o=-0.0015,f=-0.0091) USER MOD Single : B 83 HIS : no HD1:sc= -0.333 K(o=-0.33,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.826 -6.054 18.326 1.00 0.00 N ATOM 2 CA MET A 1 -4.383 -5.849 16.927 1.00 0.00 C ATOM 3 C MET A 1 -5.502 -6.168 15.943 1.00 0.00 C ATOM 4 O MET A 1 -5.777 -7.334 15.663 1.00 0.00 O ATOM 5 CB MET A 1 -3.167 -6.728 16.605 1.00 0.00 C ATOM 6 CG MET A 1 -1.871 -6.266 17.254 1.00 0.00 C ATOM 7 SD MET A 1 -1.349 -4.638 16.670 1.00 0.00 S ATOM 8 CE MET A 1 0.194 -4.439 17.560 1.00 0.00 C ATOM 0 H1 MET A 1 -4.044 -5.829 18.974 1.00 0.00 H new ATOM 0 H2 MET A 1 -5.634 -5.431 18.529 1.00 0.00 H new ATOM 0 H3 MET A 1 -5.111 -7.045 18.458 1.00 0.00 H new ATOM 0 HA MET A 1 -4.108 -4.799 16.826 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.376 -7.749 16.925 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.029 -6.755 15.524 1.00 0.00 H new ATOM 0 HG2 MET A 1 -2.000 -6.236 18.336 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.085 -6.992 17.047 1.00 0.00 H new ATOM 0 HE1 MET A 1 0.640 -3.478 17.305 1.00 0.00 H new ATOM 0 HE2 MET A 1 0.003 -4.477 18.632 1.00 0.00 H new ATOM 0 HE3 MET A 1 0.879 -5.241 17.285 1.00 0.00 H new ATOM 17 N PRO A 2 -6.184 -5.136 15.429 1.00 0.00 N ATOM 18 CA PRO A 2 -7.153 -5.295 14.347 1.00 0.00 C ATOM 19 C PRO A 2 -6.440 -5.490 13.012 1.00 0.00 C ATOM 20 O PRO A 2 -6.505 -6.558 12.405 1.00 0.00 O ATOM 21 CB PRO A 2 -7.943 -3.975 14.354 1.00 0.00 C ATOM 22 CG PRO A 2 -7.460 -3.211 15.549 1.00 0.00 C ATOM 23 CD PRO A 2 -6.090 -3.741 15.868 1.00 0.00 C ATOM 0 HA PRO A 2 -7.794 -6.166 14.482 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -7.772 -3.413 13.436 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -9.015 -4.162 14.418 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -7.423 -2.142 15.338 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -8.135 -3.346 16.394 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -5.310 -3.199 15.334 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -5.862 -3.664 16.931 1.00 0.00 H new ATOM 31 N ILE A 3 -5.750 -4.442 12.573 1.00 0.00 N ATOM 32 CA ILE A 3 -4.900 -4.495 11.385 1.00 0.00 C ATOM 33 C ILE A 3 -3.668 -3.616 11.587 1.00 0.00 C ATOM 34 O ILE A 3 -2.586 -3.911 11.082 1.00 0.00 O ATOM 35 CB ILE A 3 -5.638 -4.043 10.099 1.00 0.00 C ATOM 36 CG1 ILE A 3 -6.381 -2.723 10.334 1.00 0.00 C ATOM 37 CG2 ILE A 3 -6.595 -5.124 9.612 1.00 0.00 C ATOM 38 CD1 ILE A 3 -7.037 -2.165 9.090 1.00 0.00 C ATOM 0 H ILE A 3 -5.763 -3.530 13.030 1.00 0.00 H new ATOM 0 HA ILE A 3 -4.611 -5.537 11.252 1.00 0.00 H new ATOM 0 HB ILE A 3 -4.892 -3.879 9.322 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -7.143 -2.876 11.098 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -5.680 -1.986 10.726 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -7.100 -4.782 8.709 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -6.036 -6.033 9.393 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -7.335 -5.331 10.386 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -7.543 -1.231 9.333 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -6.278 -1.979 8.330 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -7.763 -2.883 8.709 1.00 0.00 H new ATOM 50 N THR A 4 -3.847 -2.529 12.328 1.00 0.00 N ATOM 51 CA THR A 4 -2.765 -1.603 12.629 1.00 0.00 C ATOM 52 C THR A 4 -3.003 -0.994 14.013 1.00 0.00 C ATOM 53 O THR A 4 -3.888 -1.453 14.736 1.00 0.00 O ATOM 54 CB THR A 4 -2.697 -0.484 11.567 1.00 0.00 C ATOM 55 OG1 THR A 4 -3.410 -0.881 10.388 1.00 0.00 O ATOM 56 CG2 THR A 4 -1.258 -0.178 11.192 1.00 0.00 C ATOM 0 H THR A 4 -4.744 -2.266 12.736 1.00 0.00 H new ATOM 0 HA THR A 4 -1.818 -2.142 12.618 1.00 0.00 H new ATOM 0 HB THR A 4 -3.151 0.410 11.993 1.00 0.00 H new ATOM 0 HG1 THR A 4 -3.363 -0.165 9.721 1.00 0.00 H new ATOM 0 HG21 THR A 4 -1.238 0.613 10.443 1.00 0.00 H new ATOM 0 HG22 THR A 4 -0.712 0.147 12.078 1.00 0.00 H new ATOM 0 HG23 THR A 4 -0.789 -1.074 10.786 1.00 0.00 H new ATOM 64 N SER A 5 -2.229 0.029 14.382 1.00 0.00 N ATOM 65 CA SER A 5 -2.423 0.708 15.667 1.00 0.00 C ATOM 66 C SER A 5 -3.707 1.546 15.679 1.00 0.00 C ATOM 67 O SER A 5 -4.061 2.124 16.709 1.00 0.00 O ATOM 68 CB SER A 5 -1.222 1.597 15.988 1.00 0.00 C ATOM 69 OG SER A 5 -0.036 0.830 16.101 1.00 0.00 O ATOM 0 H SER A 5 -1.468 0.404 13.815 1.00 0.00 H new ATOM 0 HA SER A 5 -2.517 -0.064 16.431 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.101 2.347 15.206 1.00 0.00 H new ATOM 0 HB3 SER A 5 -1.402 2.134 16.919 1.00 0.00 H new ATOM 0 HG SER A 5 0.256 0.545 15.210 1.00 0.00 H new ATOM 75 N LYS A 6 -4.378 1.616 14.524 1.00 0.00 N ATOM 76 CA LYS A 6 -5.673 2.296 14.380 1.00 0.00 C ATOM 77 C LYS A 6 -5.539 3.822 14.381 1.00 0.00 C ATOM 78 O LYS A 6 -5.903 4.472 13.402 1.00 0.00 O ATOM 79 CB LYS A 6 -6.654 1.860 15.478 1.00 0.00 C ATOM 80 CG LYS A 6 -7.983 2.599 15.433 1.00 0.00 C ATOM 81 CD LYS A 6 -8.827 2.331 16.669 1.00 0.00 C ATOM 82 CE LYS A 6 -10.062 3.219 16.695 1.00 0.00 C ATOM 83 NZ LYS A 6 -10.882 3.005 17.915 1.00 0.00 N ATOM 0 H LYS A 6 -4.037 1.201 13.657 1.00 0.00 H new ATOM 0 HA LYS A 6 -6.067 1.998 13.408 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -6.839 0.790 15.385 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -6.191 2.020 16.452 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -7.799 3.670 15.345 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -8.536 2.296 14.544 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -9.128 1.284 16.687 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -8.231 2.506 17.565 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -9.757 4.264 16.643 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -10.669 3.020 15.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -11.712 3.631 17.889 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -11.196 2.014 17.953 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -10.312 3.220 18.758 1.00 0.00 H new ATOM 97 N TYR A 7 -5.018 4.378 15.475 1.00 0.00 N ATOM 98 CA TYR A 7 -4.973 5.830 15.676 1.00 0.00 C ATOM 99 C TYR A 7 -6.396 6.387 15.763 1.00 0.00 C ATOM 100 O TYR A 7 -7.334 5.661 16.088 1.00 0.00 O ATOM 101 CB TYR A 7 -4.199 6.535 14.551 1.00 0.00 C ATOM 102 CG TYR A 7 -2.734 6.172 14.483 1.00 0.00 C ATOM 103 CD1 TYR A 7 -1.807 6.777 15.323 1.00 0.00 C ATOM 104 CD2 TYR A 7 -2.276 5.235 13.569 1.00 0.00 C ATOM 105 CE1 TYR A 7 -0.465 6.458 15.250 1.00 0.00 C ATOM 106 CE2 TYR A 7 -0.938 4.908 13.492 1.00 0.00 C ATOM 107 CZ TYR A 7 -0.037 5.521 14.333 1.00 0.00 C ATOM 108 OH TYR A 7 1.298 5.204 14.255 1.00 0.00 O ATOM 0 H TYR A 7 -4.617 3.840 16.243 1.00 0.00 H new ATOM 0 HA TYR A 7 -4.447 6.023 16.611 1.00 0.00 H new ATOM 0 HB2 TYR A 7 -4.666 6.292 13.597 1.00 0.00 H new ATOM 0 HB3 TYR A 7 -4.288 7.613 14.684 1.00 0.00 H new ATOM 0 HD1 TYR A 7 -2.141 7.508 16.044 1.00 0.00 H new ATOM 0 HD2 TYR A 7 -2.979 4.753 12.906 1.00 0.00 H new ATOM 0 HE1 TYR A 7 0.245 6.939 15.907 1.00 0.00 H new ATOM 0 HE2 TYR A 7 -0.599 4.175 12.775 1.00 0.00 H new ATOM 0 HH TYR A 7 1.713 5.316 15.136 1.00 0.00 H new ATOM 118 N THR A 8 -6.555 7.671 15.490 1.00 0.00 N ATOM 119 CA THR A 8 -7.870 8.288 15.520 1.00 0.00 C ATOM 120 C THR A 8 -8.537 8.195 14.150 1.00 0.00 C ATOM 121 O THR A 8 -7.982 8.655 13.150 1.00 0.00 O ATOM 122 CB THR A 8 -7.774 9.759 15.956 1.00 0.00 C ATOM 123 OG1 THR A 8 -7.049 9.841 17.189 1.00 0.00 O ATOM 124 CG2 THR A 8 -9.158 10.369 16.135 1.00 0.00 C ATOM 0 H THR A 8 -5.793 8.304 15.246 1.00 0.00 H new ATOM 0 HA THR A 8 -8.478 7.748 16.246 1.00 0.00 H new ATOM 0 HB THR A 8 -7.253 10.318 15.178 1.00 0.00 H new ATOM 0 HG1 THR A 8 -6.985 10.778 17.469 1.00 0.00 H new ATOM 0 HG21 THR A 8 -9.060 11.410 16.444 1.00 0.00 H new ATOM 0 HG22 THR A 8 -9.702 10.320 15.192 1.00 0.00 H new ATOM 0 HG23 THR A 8 -9.704 9.814 16.898 1.00 0.00 H new ATOM 132 N ASP A 9 -9.730 7.609 14.120 1.00 0.00 N ATOM 133 CA ASP A 9 -10.466 7.386 12.877 1.00 0.00 C ATOM 134 C ASP A 9 -10.736 8.701 12.148 1.00 0.00 C ATOM 135 O ASP A 9 -10.624 8.767 10.925 1.00 0.00 O ATOM 136 CB ASP A 9 -11.786 6.647 13.154 1.00 0.00 C ATOM 137 CG ASP A 9 -12.770 7.452 13.987 1.00 0.00 C ATOM 138 OD1 ASP A 9 -12.339 8.155 14.928 1.00 0.00 O ATOM 139 OD2 ASP A 9 -13.984 7.384 13.706 1.00 0.00 O ATOM 0 H ASP A 9 -10.214 7.276 14.954 1.00 0.00 H new ATOM 0 HA ASP A 9 -9.846 6.764 12.231 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -12.254 6.387 12.204 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -11.568 5.711 13.668 1.00 0.00 H new ATOM 144 N GLU A 10 -11.081 9.741 12.903 1.00 0.00 N ATOM 145 CA GLU A 10 -11.291 11.071 12.335 1.00 0.00 C ATOM 146 C GLU A 10 -10.062 11.541 11.569 1.00 0.00 C ATOM 147 O GLU A 10 -10.174 12.100 10.478 1.00 0.00 O ATOM 148 CB GLU A 10 -11.623 12.075 13.439 1.00 0.00 C ATOM 149 CG GLU A 10 -13.088 12.094 13.821 1.00 0.00 C ATOM 150 CD GLU A 10 -13.939 12.762 12.762 1.00 0.00 C ATOM 151 OE1 GLU A 10 -14.225 12.127 11.729 1.00 0.00 O ATOM 152 OE2 GLU A 10 -14.303 13.942 12.943 1.00 0.00 O ATOM 0 H GLU A 10 -11.221 9.689 13.912 1.00 0.00 H new ATOM 0 HA GLU A 10 -12.129 11.008 11.641 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -11.029 11.841 14.322 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -11.328 13.072 13.112 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -13.436 11.073 13.975 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -13.209 12.619 14.769 1.00 0.00 H new ATOM 159 N GLN A 11 -8.893 11.301 12.137 1.00 0.00 N ATOM 160 CA GLN A 11 -7.651 11.715 11.511 1.00 0.00 C ATOM 161 C GLN A 11 -7.391 10.886 10.258 1.00 0.00 C ATOM 162 O GLN A 11 -7.242 11.433 9.169 1.00 0.00 O ATOM 163 CB GLN A 11 -6.485 11.578 12.492 1.00 0.00 C ATOM 164 CG GLN A 11 -5.158 12.060 11.933 1.00 0.00 C ATOM 165 CD GLN A 11 -4.032 12.004 12.950 1.00 0.00 C ATOM 166 OE1 GLN A 11 -4.362 12.201 14.218 1.00 0.00 O flip ATOM 167 NE2 GLN A 11 -2.874 11.798 12.597 1.00 0.00 N flip ATOM 0 H GLN A 11 -8.779 10.822 13.030 1.00 0.00 H new ATOM 0 HA GLN A 11 -7.739 12.763 11.225 1.00 0.00 H new ATOM 0 HB2 GLN A 11 -6.714 12.141 13.396 1.00 0.00 H new ATOM 0 HB3 GLN A 11 -6.388 10.532 12.784 1.00 0.00 H new ATOM 0 HG2 GLN A 11 -4.891 11.451 11.069 1.00 0.00 H new ATOM 0 HG3 GLN A 11 -5.270 13.085 11.578 1.00 0.00 H new ATOM 0 HE21 GLN A 11 -2.660 11.651 11.611 1.00 0.00 H new ATOM 0 HE22 GLN A 11 -2.126 11.774 13.290 1.00 0.00 H new ATOM 176 N VAL A 12 -7.379 9.567 10.423 1.00 0.00 N ATOM 177 CA VAL A 12 -7.082 8.647 9.327 1.00 0.00 C ATOM 178 C VAL A 12 -8.023 8.871 8.142 1.00 0.00 C ATOM 179 O VAL A 12 -7.575 9.050 7.008 1.00 0.00 O ATOM 180 CB VAL A 12 -7.190 7.174 9.787 1.00 0.00 C ATOM 181 CG1 VAL A 12 -6.851 6.226 8.644 1.00 0.00 C ATOM 182 CG2 VAL A 12 -6.292 6.914 10.990 1.00 0.00 C ATOM 0 H VAL A 12 -7.573 9.107 11.312 1.00 0.00 H new ATOM 0 HA VAL A 12 -6.058 8.850 9.013 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.221 6.988 10.089 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -6.933 5.195 8.989 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -7.544 6.388 7.819 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -5.832 6.415 8.305 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -6.385 5.872 11.295 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -5.256 7.123 10.723 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -6.591 7.561 11.814 1.00 0.00 H new ATOM 192 N GLU A 13 -9.321 8.886 8.420 1.00 0.00 N ATOM 193 CA GLU A 13 -10.331 9.026 7.378 1.00 0.00 C ATOM 194 C GLU A 13 -10.174 10.345 6.630 1.00 0.00 C ATOM 195 O GLU A 13 -10.237 10.386 5.401 1.00 0.00 O ATOM 196 CB GLU A 13 -11.731 8.937 7.988 1.00 0.00 C ATOM 197 CG GLU A 13 -12.854 9.131 6.983 1.00 0.00 C ATOM 198 CD GLU A 13 -14.221 9.067 7.623 1.00 0.00 C ATOM 199 OE1 GLU A 13 -14.722 10.112 8.085 1.00 0.00 O ATOM 200 OE2 GLU A 13 -14.813 7.970 7.658 1.00 0.00 O ATOM 0 H GLU A 13 -9.700 8.802 9.363 1.00 0.00 H new ATOM 0 HA GLU A 13 -10.194 8.213 6.665 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -11.848 7.964 8.465 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -11.824 9.689 8.771 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -12.733 10.095 6.489 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -12.782 8.366 6.210 1.00 0.00 H new ATOM 207 N LYS A 14 -9.953 11.418 7.373 1.00 0.00 N ATOM 208 CA LYS A 14 -9.870 12.746 6.775 1.00 0.00 C ATOM 209 C LYS A 14 -8.568 12.924 6.001 1.00 0.00 C ATOM 210 O LYS A 14 -8.524 13.663 5.018 1.00 0.00 O ATOM 211 CB LYS A 14 -10.046 13.833 7.842 1.00 0.00 C ATOM 212 CG LYS A 14 -11.508 14.189 8.115 1.00 0.00 C ATOM 213 CD LYS A 14 -12.365 12.953 8.369 1.00 0.00 C ATOM 214 CE LYS A 14 -13.844 13.292 8.476 1.00 0.00 C ATOM 215 NZ LYS A 14 -14.189 13.958 9.758 1.00 0.00 N ATOM 0 H LYS A 14 -9.828 11.399 8.385 1.00 0.00 H new ATOM 0 HA LYS A 14 -10.686 12.847 6.059 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -9.582 13.498 8.770 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -9.515 14.731 7.526 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -11.564 14.851 8.979 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -11.911 14.740 7.265 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -12.216 12.237 7.561 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -12.037 12.469 9.289 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -14.124 13.942 7.647 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -14.430 12.378 8.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -14.916 14.682 9.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -14.554 13.252 10.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -13.339 14.407 10.156 1.00 0.00 H new ATOM 229 N ILE A 15 -7.516 12.229 6.427 1.00 0.00 N ATOM 230 CA ILE A 15 -6.276 12.201 5.660 1.00 0.00 C ATOM 231 C ILE A 15 -6.517 11.503 4.326 1.00 0.00 C ATOM 232 O ILE A 15 -6.147 12.014 3.269 1.00 0.00 O ATOM 233 CB ILE A 15 -5.131 11.483 6.416 1.00 0.00 C ATOM 234 CG1 ILE A 15 -4.766 12.251 7.690 1.00 0.00 C ATOM 235 CG2 ILE A 15 -3.910 11.335 5.517 1.00 0.00 C ATOM 236 CD1 ILE A 15 -3.700 11.577 8.526 1.00 0.00 C ATOM 0 H ILE A 15 -7.497 11.684 7.289 1.00 0.00 H new ATOM 0 HA ILE A 15 -5.968 13.234 5.501 1.00 0.00 H new ATOM 0 HB ILE A 15 -5.475 10.488 6.699 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.423 13.248 7.416 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -5.663 12.378 8.296 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.115 10.828 6.064 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.175 10.749 4.637 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -3.565 12.321 5.206 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -3.496 12.180 9.411 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -4.047 10.590 8.832 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.788 11.474 7.938 1.00 0.00 H new ATOM 248 N LEU A 16 -7.168 10.344 4.389 1.00 0.00 N ATOM 249 CA LEU A 16 -7.510 9.584 3.192 1.00 0.00 C ATOM 250 C LEU A 16 -8.364 10.421 2.247 1.00 0.00 C ATOM 251 O LEU A 16 -8.166 10.401 1.031 1.00 0.00 O ATOM 252 CB LEU A 16 -8.262 8.305 3.566 1.00 0.00 C ATOM 253 CG LEU A 16 -7.432 7.236 4.273 1.00 0.00 C ATOM 254 CD1 LEU A 16 -8.326 6.112 4.772 1.00 0.00 C ATOM 255 CD2 LEU A 16 -6.367 6.689 3.338 1.00 0.00 C ATOM 0 H LEU A 16 -7.470 9.910 5.261 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.582 9.318 2.686 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -9.101 8.572 4.209 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -8.682 7.872 2.658 1.00 0.00 H new ATOM 0 HG LEU A 16 -6.939 7.693 5.131 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -7.718 5.359 5.273 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -9.058 6.513 5.473 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.844 5.657 3.928 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.784 5.928 3.856 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.843 6.247 2.463 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.709 7.499 3.023 1.00 0.00 H new ATOM 267 N ALA A 17 -9.313 11.158 2.820 1.00 0.00 N ATOM 268 CA ALA A 17 -10.200 12.021 2.048 1.00 0.00 C ATOM 269 C ALA A 17 -9.410 13.043 1.238 1.00 0.00 C ATOM 270 O ALA A 17 -9.687 13.256 0.056 1.00 0.00 O ATOM 271 CB ALA A 17 -11.190 12.725 2.967 1.00 0.00 C ATOM 0 H ALA A 17 -9.487 11.173 3.825 1.00 0.00 H new ATOM 0 HA ALA A 17 -10.753 11.393 1.350 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -11.844 13.365 2.375 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -11.789 11.982 3.494 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -10.646 13.332 3.691 1.00 0.00 H new ATOM 277 N GLU A 18 -8.419 13.664 1.870 1.00 0.00 N ATOM 278 CA GLU A 18 -7.592 14.658 1.196 1.00 0.00 C ATOM 279 C GLU A 18 -6.731 14.015 0.111 1.00 0.00 C ATOM 280 O GLU A 18 -6.542 14.590 -0.960 1.00 0.00 O ATOM 281 CB GLU A 18 -6.710 15.402 2.198 1.00 0.00 C ATOM 282 CG GLU A 18 -7.488 16.303 3.139 1.00 0.00 C ATOM 283 CD GLU A 18 -6.585 17.128 4.029 1.00 0.00 C ATOM 284 OE1 GLU A 18 -5.860 17.997 3.503 1.00 0.00 O ATOM 285 OE2 GLU A 18 -6.605 16.922 5.260 1.00 0.00 O ATOM 0 H GLU A 18 -8.170 13.497 2.845 1.00 0.00 H new ATOM 0 HA GLU A 18 -8.261 15.376 0.721 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -6.149 14.675 2.785 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -5.982 16.002 1.653 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -8.125 16.968 2.556 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -8.146 15.694 3.759 1.00 0.00 H new ATOM 292 N VAL A 19 -6.219 12.820 0.390 1.00 0.00 N ATOM 293 CA VAL A 19 -5.438 12.075 -0.592 1.00 0.00 C ATOM 294 C VAL A 19 -6.313 11.705 -1.787 1.00 0.00 C ATOM 295 O VAL A 19 -5.918 11.881 -2.940 1.00 0.00 O ATOM 296 CB VAL A 19 -4.827 10.791 0.016 1.00 0.00 C ATOM 297 CG1 VAL A 19 -4.048 10.011 -1.033 1.00 0.00 C ATOM 298 CG2 VAL A 19 -3.933 11.126 1.203 1.00 0.00 C ATOM 0 H VAL A 19 -6.331 12.347 1.287 1.00 0.00 H new ATOM 0 HA VAL A 19 -4.621 12.719 -0.917 1.00 0.00 H new ATOM 0 HB VAL A 19 -5.646 10.165 0.369 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -3.628 9.112 -0.581 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -4.716 9.729 -1.847 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -3.241 10.632 -1.423 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -3.515 10.207 1.614 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -3.124 11.779 0.876 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -4.520 11.632 1.969 1.00 0.00 H new ATOM 308 N ALA A 20 -7.517 11.216 -1.499 1.00 0.00 N ATOM 309 CA ALA A 20 -8.471 10.848 -2.539 1.00 0.00 C ATOM 310 C ALA A 20 -8.857 12.058 -3.383 1.00 0.00 C ATOM 311 O ALA A 20 -9.138 11.931 -4.574 1.00 0.00 O ATOM 312 CB ALA A 20 -9.712 10.216 -1.925 1.00 0.00 C ATOM 0 H ALA A 20 -7.855 11.065 -0.549 1.00 0.00 H new ATOM 0 HA ALA A 20 -7.991 10.118 -3.191 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -10.413 9.948 -2.716 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -9.429 9.320 -1.372 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -10.185 10.927 -1.247 1.00 0.00 H new ATOM 318 N LEU A 21 -8.868 13.232 -2.763 1.00 0.00 N ATOM 319 CA LEU A 21 -9.172 14.467 -3.472 1.00 0.00 C ATOM 320 C LEU A 21 -8.048 14.780 -4.453 1.00 0.00 C ATOM 321 O LEU A 21 -8.295 15.180 -5.592 1.00 0.00 O ATOM 322 CB LEU A 21 -9.375 15.615 -2.471 1.00 0.00 C ATOM 323 CG LEU A 21 -10.000 16.899 -3.036 1.00 0.00 C ATOM 324 CD1 LEU A 21 -10.661 17.696 -1.925 1.00 0.00 C ATOM 325 CD2 LEU A 21 -8.951 17.759 -3.729 1.00 0.00 C ATOM 0 H LEU A 21 -8.670 13.354 -1.770 1.00 0.00 H new ATOM 0 HA LEU A 21 -10.098 14.348 -4.035 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -10.006 15.255 -1.658 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -8.408 15.866 -2.036 1.00 0.00 H new ATOM 0 HG LEU A 21 -10.752 16.610 -3.770 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -11.100 18.603 -2.340 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -11.442 17.094 -1.461 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -9.916 17.963 -1.176 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -9.421 18.662 -4.120 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -8.176 18.034 -3.014 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -8.505 17.198 -4.550 1.00 0.00 H new ATOM 337 N VAL A 22 -6.814 14.562 -4.015 1.00 0.00 N ATOM 338 CA VAL A 22 -5.652 14.766 -4.869 1.00 0.00 C ATOM 339 C VAL A 22 -5.708 13.826 -6.067 1.00 0.00 C ATOM 340 O VAL A 22 -5.525 14.242 -7.214 1.00 0.00 O ATOM 341 CB VAL A 22 -4.337 14.525 -4.097 1.00 0.00 C ATOM 342 CG1 VAL A 22 -3.144 14.554 -5.038 1.00 0.00 C ATOM 343 CG2 VAL A 22 -4.167 15.558 -2.994 1.00 0.00 C ATOM 0 H VAL A 22 -6.593 14.243 -3.072 1.00 0.00 H new ATOM 0 HA VAL A 22 -5.672 15.801 -5.209 1.00 0.00 H new ATOM 0 HB VAL A 22 -4.389 13.536 -3.641 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -2.229 14.382 -4.471 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -3.256 13.774 -5.792 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -3.090 15.527 -5.527 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -3.235 15.371 -2.461 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -4.142 16.556 -3.431 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -5.003 15.488 -2.298 1.00 0.00 H new ATOM 353 N LEU A 23 -5.982 12.560 -5.782 1.00 0.00 N ATOM 354 CA LEU A 23 -6.102 11.534 -6.810 1.00 0.00 C ATOM 355 C LEU A 23 -7.199 11.895 -7.806 1.00 0.00 C ATOM 356 O LEU A 23 -7.059 11.673 -9.009 1.00 0.00 O ATOM 357 CB LEU A 23 -6.413 10.183 -6.157 1.00 0.00 C ATOM 358 CG LEU A 23 -5.205 9.381 -5.642 1.00 0.00 C ATOM 359 CD1 LEU A 23 -4.109 10.285 -5.092 1.00 0.00 C ATOM 360 CD2 LEU A 23 -5.657 8.414 -4.565 1.00 0.00 C ATOM 0 H LEU A 23 -6.127 12.215 -4.833 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.157 11.467 -7.348 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.091 10.355 -5.321 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.948 9.568 -6.881 1.00 0.00 H new ATOM 0 HG LEU A 23 -4.788 8.834 -6.487 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -3.277 9.675 -4.740 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -3.761 10.955 -5.878 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -4.504 10.873 -4.263 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -4.800 7.847 -4.202 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -6.100 8.970 -3.739 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.396 7.728 -4.979 1.00 0.00 H new ATOM 372 N GLU A 24 -8.279 12.468 -7.299 1.00 0.00 N ATOM 373 CA GLU A 24 -9.407 12.850 -8.134 1.00 0.00 C ATOM 374 C GLU A 24 -9.051 14.051 -9.009 1.00 0.00 C ATOM 375 O GLU A 24 -9.226 14.020 -10.227 1.00 0.00 O ATOM 376 CB GLU A 24 -10.614 13.193 -7.264 1.00 0.00 C ATOM 377 CG GLU A 24 -11.929 13.135 -8.016 1.00 0.00 C ATOM 378 CD GLU A 24 -12.404 11.715 -8.233 1.00 0.00 C ATOM 379 OE1 GLU A 24 -12.857 11.078 -7.255 1.00 0.00 O ATOM 380 OE2 GLU A 24 -12.326 11.225 -9.379 1.00 0.00 O ATOM 0 H GLU A 24 -8.398 12.680 -6.308 1.00 0.00 H new ATOM 0 HA GLU A 24 -9.653 12.006 -8.778 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -10.654 12.503 -6.421 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -10.483 14.193 -6.851 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -12.687 13.689 -7.462 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -11.815 13.629 -8.981 1.00 0.00 H new ATOM 387 N LYS A 25 -8.540 15.103 -8.374 1.00 0.00 N ATOM 388 CA LYS A 25 -8.225 16.352 -9.063 1.00 0.00 C ATOM 389 C LYS A 25 -7.134 16.153 -10.112 1.00 0.00 C ATOM 390 O LYS A 25 -7.200 16.710 -11.209 1.00 0.00 O ATOM 391 CB LYS A 25 -7.779 17.416 -8.053 1.00 0.00 C ATOM 392 CG LYS A 25 -7.468 18.760 -8.690 1.00 0.00 C ATOM 393 CD LYS A 25 -6.819 19.719 -7.707 1.00 0.00 C ATOM 394 CE LYS A 25 -6.485 21.039 -8.375 1.00 0.00 C ATOM 395 NZ LYS A 25 -5.730 21.946 -7.474 1.00 0.00 N ATOM 0 H LYS A 25 -8.334 15.115 -7.375 1.00 0.00 H new ATOM 0 HA LYS A 25 -9.130 16.686 -9.571 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -8.562 17.549 -7.307 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -6.894 17.058 -7.527 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -6.806 18.612 -9.543 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -8.388 19.201 -9.073 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -7.490 19.893 -6.866 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -5.911 19.272 -7.303 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -5.898 20.851 -9.274 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -7.406 21.528 -8.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -5.523 22.836 -7.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -6.299 22.147 -6.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -4.838 21.492 -7.192 1.00 0.00 H new ATOM 409 N HIS A 26 -6.126 15.359 -9.773 1.00 0.00 N ATOM 410 CA HIS A 26 -5.002 15.132 -10.677 1.00 0.00 C ATOM 411 C HIS A 26 -5.297 13.986 -11.640 1.00 0.00 C ATOM 412 O HIS A 26 -4.453 13.630 -12.463 1.00 0.00 O ATOM 413 CB HIS A 26 -3.713 14.843 -9.896 1.00 0.00 C ATOM 414 CG HIS A 26 -3.176 16.022 -9.132 1.00 0.00 C ATOM 415 ND1 HIS A 26 -2.057 16.728 -9.521 1.00 0.00 N ATOM 416 CD2 HIS A 26 -3.599 16.603 -7.982 1.00 0.00 C ATOM 417 CE1 HIS A 26 -1.819 17.688 -8.647 1.00 0.00 C ATOM 418 NE2 HIS A 26 -2.738 17.636 -7.703 1.00 0.00 N ATOM 0 H HIS A 26 -6.062 14.863 -8.884 1.00 0.00 H new ATOM 0 HA HIS A 26 -4.859 16.045 -11.255 1.00 0.00 H new ATOM 0 HB2 HIS A 26 -3.900 14.027 -9.198 1.00 0.00 H new ATOM 0 HB3 HIS A 26 -2.949 14.498 -10.593 1.00 0.00 H new ATOM 0 HD2 HIS A 26 -4.455 16.308 -7.394 1.00 0.00 H new ATOM 0 HE1 HIS A 26 -1.007 18.398 -8.697 1.00 0.00 H new ATOM 0 HE2 HIS A 26 -2.799 18.260 -6.898 1.00 0.00 H new ATOM 427 N ALA A 27 -6.500 13.420 -11.522 1.00 0.00 N ATOM 428 CA ALA A 27 -6.966 12.348 -12.401 1.00 0.00 C ATOM 429 C ALA A 27 -6.019 11.145 -12.377 1.00 0.00 C ATOM 430 O ALA A 27 -5.685 10.578 -13.420 1.00 0.00 O ATOM 431 CB ALA A 27 -7.135 12.867 -13.822 1.00 0.00 C ATOM 0 H ALA A 27 -7.179 13.694 -10.812 1.00 0.00 H new ATOM 0 HA ALA A 27 -7.934 12.010 -12.030 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -7.482 12.059 -14.466 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -7.865 13.676 -13.829 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -6.179 13.238 -14.190 1.00 0.00 H new ATOM 437 N ALA A 28 -5.602 10.752 -11.183 1.00 0.00 N ATOM 438 CA ALA A 28 -4.694 9.623 -11.021 1.00 0.00 C ATOM 439 C ALA A 28 -5.383 8.313 -11.383 1.00 0.00 C ATOM 440 O ALA A 28 -6.435 7.983 -10.834 1.00 0.00 O ATOM 441 CB ALA A 28 -4.166 9.570 -9.597 1.00 0.00 C ATOM 0 H ALA A 28 -5.878 11.199 -10.309 1.00 0.00 H new ATOM 0 HA ALA A 28 -3.853 9.762 -11.701 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -3.489 8.722 -9.491 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -3.630 10.492 -9.373 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -5.000 9.458 -8.904 1.00 0.00 H new ATOM 447 N SER A 29 -4.796 7.586 -12.323 1.00 0.00 N ATOM 448 CA SER A 29 -5.321 6.296 -12.746 1.00 0.00 C ATOM 449 C SER A 29 -5.236 5.284 -11.601 1.00 0.00 C ATOM 450 O SER A 29 -4.412 5.442 -10.696 1.00 0.00 O ATOM 451 CB SER A 29 -4.519 5.800 -13.953 1.00 0.00 C ATOM 452 OG SER A 29 -4.270 6.862 -14.861 1.00 0.00 O ATOM 0 H SER A 29 -3.947 7.872 -12.811 1.00 0.00 H new ATOM 0 HA SER A 29 -6.369 6.406 -13.026 1.00 0.00 H new ATOM 0 HB2 SER A 29 -3.574 5.373 -13.617 1.00 0.00 H new ATOM 0 HB3 SER A 29 -5.067 5.004 -14.458 1.00 0.00 H new ATOM 0 HG SER A 29 -3.899 6.501 -15.693 1.00 0.00 H new ATOM 458 N PRO A 30 -6.090 4.242 -11.615 1.00 0.00 N ATOM 459 CA PRO A 30 -6.084 3.196 -10.582 1.00 0.00 C ATOM 460 C PRO A 30 -4.700 2.581 -10.382 1.00 0.00 C ATOM 461 O PRO A 30 -4.238 2.427 -9.249 1.00 0.00 O ATOM 462 CB PRO A 30 -7.060 2.150 -11.125 1.00 0.00 C ATOM 463 CG PRO A 30 -7.970 2.913 -12.022 1.00 0.00 C ATOM 464 CD PRO A 30 -7.136 4.007 -12.629 1.00 0.00 C ATOM 0 HA PRO A 30 -6.362 3.591 -9.605 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -6.536 1.364 -11.668 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -7.612 1.667 -10.319 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -8.388 2.267 -12.794 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -8.810 3.327 -11.464 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -6.708 3.703 -13.584 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -7.725 4.905 -12.815 1.00 0.00 H new ATOM 472 N GLU A 31 -4.043 2.240 -11.483 1.00 0.00 N ATOM 473 CA GLU A 31 -2.702 1.666 -11.438 1.00 0.00 C ATOM 474 C GLU A 31 -1.727 2.644 -10.789 1.00 0.00 C ATOM 475 O GLU A 31 -0.934 2.269 -9.926 1.00 0.00 O ATOM 476 CB GLU A 31 -2.205 1.309 -12.847 1.00 0.00 C ATOM 477 CG GLU A 31 -3.216 0.559 -13.702 1.00 0.00 C ATOM 478 CD GLU A 31 -4.156 1.489 -14.447 1.00 0.00 C ATOM 479 OE1 GLU A 31 -5.158 1.928 -13.853 1.00 0.00 O ATOM 480 OE2 GLU A 31 -3.881 1.789 -15.626 1.00 0.00 O ATOM 0 H GLU A 31 -4.419 2.352 -12.425 1.00 0.00 H new ATOM 0 HA GLU A 31 -2.752 0.754 -10.843 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -1.923 2.227 -13.362 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -1.303 0.703 -12.758 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -2.686 -0.067 -14.420 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -3.799 -0.108 -13.067 1.00 0.00 H new ATOM 487 N LEU A 32 -1.806 3.903 -11.209 1.00 0.00 N ATOM 488 CA LEU A 32 -0.965 4.960 -10.657 1.00 0.00 C ATOM 489 C LEU A 32 -1.228 5.126 -9.162 1.00 0.00 C ATOM 490 O LEU A 32 -0.307 5.336 -8.376 1.00 0.00 O ATOM 491 CB LEU A 32 -1.227 6.281 -11.394 1.00 0.00 C ATOM 492 CG LEU A 32 -0.416 7.487 -10.903 1.00 0.00 C ATOM 493 CD1 LEU A 32 1.073 7.252 -11.096 1.00 0.00 C ATOM 494 CD2 LEU A 32 -0.852 8.749 -11.630 1.00 0.00 C ATOM 0 H LEU A 32 -2.449 4.218 -11.935 1.00 0.00 H new ATOM 0 HA LEU A 32 0.080 4.682 -10.794 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -1.018 6.133 -12.453 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.287 6.520 -11.308 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.605 7.615 -9.837 1.00 0.00 H new ATOM 0 HD11 LEU A 32 1.627 8.121 -10.741 1.00 0.00 H new ATOM 0 HD12 LEU A 32 1.378 6.371 -10.532 1.00 0.00 H new ATOM 0 HD13 LEU A 32 1.283 7.096 -12.154 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -0.268 9.596 -11.271 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.692 8.626 -12.701 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -1.910 8.931 -11.440 1.00 0.00 H new ATOM 506 N THR A 33 -2.493 5.009 -8.785 1.00 0.00 N ATOM 507 CA THR A 33 -2.901 5.116 -7.393 1.00 0.00 C ATOM 508 C THR A 33 -2.201 4.062 -6.528 1.00 0.00 C ATOM 509 O THR A 33 -1.563 4.388 -5.523 1.00 0.00 O ATOM 510 CB THR A 33 -4.426 4.955 -7.268 1.00 0.00 C ATOM 511 OG1 THR A 33 -5.091 5.942 -8.071 1.00 0.00 O ATOM 512 CG2 THR A 33 -4.875 5.083 -5.823 1.00 0.00 C ATOM 0 H THR A 33 -3.262 4.838 -9.433 1.00 0.00 H new ATOM 0 HA THR A 33 -2.611 6.105 -7.037 1.00 0.00 H new ATOM 0 HB THR A 33 -4.690 3.958 -7.622 1.00 0.00 H new ATOM 0 HG1 THR A 33 -4.910 5.769 -9.018 1.00 0.00 H new ATOM 0 HG21 THR A 33 -5.957 4.965 -5.766 1.00 0.00 H new ATOM 0 HG22 THR A 33 -4.394 4.311 -5.223 1.00 0.00 H new ATOM 0 HG23 THR A 33 -4.597 6.065 -5.441 1.00 0.00 H new ATOM 520 N LEU A 34 -2.305 2.802 -6.938 1.00 0.00 N ATOM 521 CA LEU A 34 -1.709 1.706 -6.187 1.00 0.00 C ATOM 522 C LEU A 34 -0.182 1.790 -6.262 1.00 0.00 C ATOM 523 O LEU A 34 0.519 1.417 -5.319 1.00 0.00 O ATOM 524 CB LEU A 34 -2.231 0.361 -6.712 1.00 0.00 C ATOM 525 CG LEU A 34 -2.058 -0.822 -5.755 1.00 0.00 C ATOM 526 CD1 LEU A 34 -3.153 -1.850 -5.983 1.00 0.00 C ATOM 527 CD2 LEU A 34 -0.695 -1.469 -5.937 1.00 0.00 C ATOM 0 H LEU A 34 -2.796 2.516 -7.785 1.00 0.00 H new ATOM 0 HA LEU A 34 -1.996 1.785 -5.138 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -3.290 0.467 -6.946 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -1.719 0.130 -7.646 1.00 0.00 H new ATOM 0 HG LEU A 34 -2.130 -0.446 -4.735 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -3.017 -2.685 -5.296 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -4.126 -1.390 -5.808 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -3.103 -2.213 -7.009 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -0.595 -2.307 -5.247 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -0.597 -1.829 -6.961 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.086 -0.736 -5.734 1.00 0.00 H new ATOM 539 N MET A 35 0.319 2.305 -7.382 1.00 0.00 N ATOM 540 CA MET A 35 1.746 2.577 -7.548 1.00 0.00 C ATOM 541 C MET A 35 2.239 3.487 -6.435 1.00 0.00 C ATOM 542 O MET A 35 3.246 3.212 -5.778 1.00 0.00 O ATOM 543 CB MET A 35 1.999 3.252 -8.897 1.00 0.00 C ATOM 544 CG MET A 35 3.455 3.615 -9.146 1.00 0.00 C ATOM 545 SD MET A 35 3.667 4.677 -10.589 1.00 0.00 S ATOM 546 CE MET A 35 2.593 3.860 -11.760 1.00 0.00 C ATOM 0 H MET A 35 -0.248 2.545 -8.196 1.00 0.00 H new ATOM 0 HA MET A 35 2.285 1.630 -7.508 1.00 0.00 H new ATOM 0 HB2 MET A 35 1.660 2.588 -9.693 1.00 0.00 H new ATOM 0 HB3 MET A 35 1.395 4.157 -8.957 1.00 0.00 H new ATOM 0 HG2 MET A 35 3.856 4.119 -8.266 1.00 0.00 H new ATOM 0 HG3 MET A 35 4.035 2.702 -9.283 1.00 0.00 H new ATOM 0 HE1 MET A 35 3.021 3.935 -12.760 1.00 0.00 H new ATOM 0 HE2 MET A 35 2.490 2.810 -11.488 1.00 0.00 H new ATOM 0 HE3 MET A 35 1.612 4.336 -11.748 1.00 0.00 H new ATOM 556 N ILE A 36 1.506 4.572 -6.232 1.00 0.00 N ATOM 557 CA ILE A 36 1.842 5.566 -5.228 1.00 0.00 C ATOM 558 C ILE A 36 1.832 4.961 -3.829 1.00 0.00 C ATOM 559 O ILE A 36 2.690 5.281 -3.006 1.00 0.00 O ATOM 560 CB ILE A 36 0.875 6.767 -5.317 1.00 0.00 C ATOM 561 CG1 ILE A 36 1.127 7.509 -6.632 1.00 0.00 C ATOM 562 CG2 ILE A 36 1.029 7.702 -4.119 1.00 0.00 C ATOM 563 CD1 ILE A 36 0.047 8.494 -7.003 1.00 0.00 C ATOM 0 H ILE A 36 0.660 4.787 -6.761 1.00 0.00 H new ATOM 0 HA ILE A 36 2.853 5.922 -5.426 1.00 0.00 H new ATOM 0 HB ILE A 36 -0.151 6.400 -5.297 1.00 0.00 H new ATOM 0 HG12 ILE A 36 2.077 8.038 -6.561 1.00 0.00 H new ATOM 0 HG13 ILE A 36 1.228 6.779 -7.435 1.00 0.00 H new ATOM 0 HG21 ILE A 36 0.333 8.535 -4.216 1.00 0.00 H new ATOM 0 HG22 ILE A 36 0.815 7.155 -3.201 1.00 0.00 H new ATOM 0 HG23 ILE A 36 2.049 8.084 -4.084 1.00 0.00 H new ATOM 0 HD11 ILE A 36 0.303 8.976 -7.947 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -0.903 7.970 -7.109 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -0.041 9.249 -6.222 1.00 0.00 H new ATOM 575 N ALA A 37 0.884 4.065 -3.575 1.00 0.00 N ATOM 576 CA ALA A 37 0.829 3.350 -2.302 1.00 0.00 C ATOM 577 C ALA A 37 2.133 2.594 -2.050 1.00 0.00 C ATOM 578 O ALA A 37 2.664 2.597 -0.938 1.00 0.00 O ATOM 579 CB ALA A 37 -0.352 2.392 -2.281 1.00 0.00 C ATOM 0 H ALA A 37 0.144 3.816 -4.231 1.00 0.00 H new ATOM 0 HA ALA A 37 0.697 4.081 -1.505 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -0.378 1.868 -1.326 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -1.278 2.952 -2.413 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -0.248 1.668 -3.089 1.00 0.00 H new ATOM 585 N GLY A 38 2.647 1.957 -3.098 1.00 0.00 N ATOM 586 CA GLY A 38 3.905 1.242 -2.999 1.00 0.00 C ATOM 587 C GLY A 38 5.079 2.174 -2.776 1.00 0.00 C ATOM 588 O GLY A 38 6.017 1.843 -2.047 1.00 0.00 O ATOM 0 H GLY A 38 2.211 1.924 -4.019 1.00 0.00 H new ATOM 0 HA2 GLY A 38 3.850 0.527 -2.178 1.00 0.00 H new ATOM 0 HA3 GLY A 38 4.067 0.668 -3.911 1.00 0.00 H new ATOM 592 N ASN A 39 5.022 3.344 -3.399 1.00 0.00 N ATOM 593 CA ASN A 39 6.065 4.352 -3.235 1.00 0.00 C ATOM 594 C ASN A 39 6.113 4.821 -1.787 1.00 0.00 C ATOM 595 O ASN A 39 7.188 4.996 -1.213 1.00 0.00 O ATOM 596 CB ASN A 39 5.822 5.552 -4.156 1.00 0.00 C ATOM 597 CG ASN A 39 5.808 5.179 -5.630 1.00 0.00 C ATOM 598 OD1 ASN A 39 5.083 5.950 -6.431 1.00 0.00 O flip ATOM 599 ND2 ASN A 39 6.446 4.215 -6.048 1.00 0.00 N flip ATOM 0 H ASN A 39 4.264 3.620 -4.024 1.00 0.00 H new ATOM 0 HA ASN A 39 7.019 3.898 -3.504 1.00 0.00 H new ATOM 0 HB2 ASN A 39 4.870 6.016 -3.896 1.00 0.00 H new ATOM 0 HB3 ASN A 39 6.598 6.298 -3.983 1.00 0.00 H new ATOM 0 HD21 ASN A 39 6.992 3.646 -5.401 1.00 0.00 H new ATOM 0 HD22 ASN A 39 6.430 3.985 -7.041 1.00 0.00 H new ATOM 606 N ILE A 40 4.932 5.009 -1.203 1.00 0.00 N ATOM 607 CA ILE A 40 4.813 5.399 0.197 1.00 0.00 C ATOM 608 C ILE A 40 5.440 4.345 1.104 1.00 0.00 C ATOM 609 O ILE A 40 6.289 4.662 1.941 1.00 0.00 O ATOM 610 CB ILE A 40 3.334 5.607 0.605 1.00 0.00 C ATOM 611 CG1 ILE A 40 2.713 6.759 -0.189 1.00 0.00 C ATOM 612 CG2 ILE A 40 3.224 5.873 2.100 1.00 0.00 C ATOM 613 CD1 ILE A 40 1.252 7.001 0.129 1.00 0.00 C ATOM 0 H ILE A 40 4.039 4.896 -1.683 1.00 0.00 H new ATOM 0 HA ILE A 40 5.343 6.344 0.314 1.00 0.00 H new ATOM 0 HB ILE A 40 2.785 4.694 0.375 1.00 0.00 H new ATOM 0 HG12 ILE A 40 3.275 7.671 0.012 1.00 0.00 H new ATOM 0 HG13 ILE A 40 2.814 6.550 -1.254 1.00 0.00 H new ATOM 0 HG21 ILE A 40 2.177 6.017 2.368 1.00 0.00 H new ATOM 0 HG22 ILE A 40 3.626 5.023 2.651 1.00 0.00 H new ATOM 0 HG23 ILE A 40 3.790 6.770 2.353 1.00 0.00 H new ATOM 0 HD11 ILE A 40 0.882 7.832 -0.472 1.00 0.00 H new ATOM 0 HD12 ILE A 40 0.677 6.104 -0.099 1.00 0.00 H new ATOM 0 HD13 ILE A 40 1.145 7.242 1.187 1.00 0.00 H new ATOM 625 N ALA A 41 5.024 3.092 0.920 1.00 0.00 N ATOM 626 CA ALA A 41 5.534 1.985 1.714 1.00 0.00 C ATOM 627 C ALA A 41 7.055 1.904 1.643 1.00 0.00 C ATOM 628 O ALA A 41 7.728 1.859 2.672 1.00 0.00 O ATOM 629 CB ALA A 41 4.910 0.677 1.255 1.00 0.00 C ATOM 0 H ALA A 41 4.331 2.822 0.222 1.00 0.00 H new ATOM 0 HA ALA A 41 5.259 2.162 2.754 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.300 -0.143 1.857 1.00 0.00 H new ATOM 0 HB2 ALA A 41 3.828 0.730 1.371 1.00 0.00 H new ATOM 0 HB3 ALA A 41 5.154 0.505 0.207 1.00 0.00 H new ATOM 635 N THR A 42 7.587 1.909 0.425 1.00 0.00 N ATOM 636 CA THR A 42 9.025 1.806 0.208 1.00 0.00 C ATOM 637 C THR A 42 9.778 2.928 0.926 1.00 0.00 C ATOM 638 O THR A 42 10.739 2.673 1.649 1.00 0.00 O ATOM 639 CB THR A 42 9.356 1.852 -1.295 1.00 0.00 C ATOM 640 OG1 THR A 42 8.621 0.833 -1.986 1.00 0.00 O ATOM 641 CG2 THR A 42 10.847 1.654 -1.531 1.00 0.00 C ATOM 0 H THR A 42 7.039 1.984 -0.432 1.00 0.00 H new ATOM 0 HA THR A 42 9.346 0.849 0.619 1.00 0.00 H new ATOM 0 HB THR A 42 9.072 2.833 -1.677 1.00 0.00 H new ATOM 0 HG1 THR A 42 7.687 1.113 -2.085 1.00 0.00 H new ATOM 0 HG21 THR A 42 11.054 1.691 -2.601 1.00 0.00 H new ATOM 0 HG22 THR A 42 11.403 2.444 -1.026 1.00 0.00 H new ATOM 0 HG23 THR A 42 11.153 0.685 -1.135 1.00 0.00 H new ATOM 649 N ASN A 43 9.313 4.160 0.743 1.00 0.00 N ATOM 650 CA ASN A 43 9.966 5.330 1.324 1.00 0.00 C ATOM 651 C ASN A 43 10.014 5.236 2.849 1.00 0.00 C ATOM 652 O ASN A 43 11.020 5.571 3.477 1.00 0.00 O ATOM 653 CB ASN A 43 9.226 6.601 0.892 1.00 0.00 C ATOM 654 CG ASN A 43 9.860 7.870 1.428 1.00 0.00 C ATOM 655 OD1 ASN A 43 11.071 7.948 1.612 1.00 0.00 O ATOM 656 ND2 ASN A 43 9.038 8.878 1.677 1.00 0.00 N ATOM 0 H ASN A 43 8.481 4.375 0.193 1.00 0.00 H new ATOM 0 HA ASN A 43 10.993 5.368 0.961 1.00 0.00 H new ATOM 0 HB2 ASN A 43 9.200 6.647 -0.197 1.00 0.00 H new ATOM 0 HB3 ASN A 43 8.192 6.546 1.233 1.00 0.00 H new ATOM 0 HD21 ASN A 43 9.406 9.759 2.035 1.00 0.00 H new ATOM 0 HD22 ASN A 43 8.037 8.773 1.511 1.00 0.00 H new ATOM 663 N VAL A 44 8.925 4.772 3.442 1.00 0.00 N ATOM 664 CA VAL A 44 8.873 4.566 4.883 1.00 0.00 C ATOM 665 C VAL A 44 9.842 3.468 5.294 1.00 0.00 C ATOM 666 O VAL A 44 10.564 3.610 6.277 1.00 0.00 O ATOM 667 CB VAL A 44 7.442 4.196 5.339 1.00 0.00 C ATOM 668 CG1 VAL A 44 7.410 3.739 6.794 1.00 0.00 C ATOM 669 CG2 VAL A 44 6.506 5.372 5.131 1.00 0.00 C ATOM 0 H VAL A 44 8.065 4.531 2.949 1.00 0.00 H new ATOM 0 HA VAL A 44 9.160 5.500 5.366 1.00 0.00 H new ATOM 0 HB VAL A 44 7.105 3.359 4.728 1.00 0.00 H new ATOM 0 HG11 VAL A 44 6.387 3.489 7.074 1.00 0.00 H new ATOM 0 HG12 VAL A 44 8.044 2.861 6.914 1.00 0.00 H new ATOM 0 HG13 VAL A 44 7.776 4.541 7.435 1.00 0.00 H new ATOM 0 HG21 VAL A 44 5.502 5.100 5.456 1.00 0.00 H new ATOM 0 HG22 VAL A 44 6.857 6.224 5.713 1.00 0.00 H new ATOM 0 HG23 VAL A 44 6.486 5.639 4.074 1.00 0.00 H new ATOM 679 N LEU A 45 9.875 2.391 4.515 1.00 0.00 N ATOM 680 CA LEU A 45 10.778 1.273 4.779 1.00 0.00 C ATOM 681 C LEU A 45 12.236 1.710 4.654 1.00 0.00 C ATOM 682 O LEU A 45 13.142 1.021 5.126 1.00 0.00 O ATOM 683 CB LEU A 45 10.488 0.114 3.822 1.00 0.00 C ATOM 684 CG LEU A 45 9.100 -0.514 3.970 1.00 0.00 C ATOM 685 CD1 LEU A 45 8.873 -1.562 2.893 1.00 0.00 C ATOM 686 CD2 LEU A 45 8.937 -1.127 5.350 1.00 0.00 C ATOM 0 H LEU A 45 9.285 2.268 3.692 1.00 0.00 H new ATOM 0 HA LEU A 45 10.608 0.934 5.801 1.00 0.00 H new ATOM 0 HB2 LEU A 45 10.602 0.471 2.798 1.00 0.00 H new ATOM 0 HB3 LEU A 45 11.239 -0.661 3.975 1.00 0.00 H new ATOM 0 HG LEU A 45 8.353 0.271 3.851 1.00 0.00 H new ATOM 0 HD11 LEU A 45 7.881 -1.998 3.013 1.00 0.00 H new ATOM 0 HD12 LEU A 45 8.948 -1.096 1.910 1.00 0.00 H new ATOM 0 HD13 LEU A 45 9.627 -2.344 2.982 1.00 0.00 H new ATOM 0 HD21 LEU A 45 7.944 -1.569 5.437 1.00 0.00 H new ATOM 0 HD22 LEU A 45 9.692 -1.899 5.496 1.00 0.00 H new ATOM 0 HD23 LEU A 45 9.058 -0.353 6.108 1.00 0.00 H new ATOM 698 N ASN A 46 12.450 2.852 4.008 1.00 0.00 N ATOM 699 CA ASN A 46 13.781 3.437 3.887 1.00 0.00 C ATOM 700 C ASN A 46 14.123 4.276 5.115 1.00 0.00 C ATOM 701 O ASN A 46 15.065 3.970 5.851 1.00 0.00 O ATOM 702 CB ASN A 46 13.882 4.327 2.639 1.00 0.00 C ATOM 703 CG ASN A 46 13.656 3.584 1.335 1.00 0.00 C ATOM 704 OD1 ASN A 46 13.161 4.157 0.362 1.00 0.00 O ATOM 705 ND2 ASN A 46 14.028 2.316 1.297 1.00 0.00 N ATOM 0 H ASN A 46 11.713 3.394 3.557 1.00 0.00 H new ATOM 0 HA ASN A 46 14.487 2.611 3.802 1.00 0.00 H new ATOM 0 HB2 ASN A 46 13.151 5.132 2.719 1.00 0.00 H new ATOM 0 HB3 ASN A 46 14.868 4.792 2.615 1.00 0.00 H new ATOM 0 HD21 ASN A 46 13.909 1.775 0.440 1.00 0.00 H new ATOM 0 HD22 ASN A 46 14.434 1.879 2.124 1.00 0.00 H new ATOM 712 N GLN A 47 13.341 5.330 5.337 1.00 0.00 N ATOM 713 CA GLN A 47 13.666 6.322 6.357 1.00 0.00 C ATOM 714 C GLN A 47 12.734 6.286 7.566 1.00 0.00 C ATOM 715 O GLN A 47 13.185 6.403 8.704 1.00 0.00 O ATOM 716 CB GLN A 47 13.642 7.732 5.765 1.00 0.00 C ATOM 717 CG GLN A 47 12.450 8.032 4.870 1.00 0.00 C ATOM 718 CD GLN A 47 12.302 9.520 4.594 1.00 0.00 C ATOM 719 OE1 GLN A 47 12.623 10.353 5.438 1.00 0.00 O ATOM 720 NE2 GLN A 47 11.829 9.868 3.409 1.00 0.00 N ATOM 0 H GLN A 47 12.479 5.518 4.825 1.00 0.00 H new ATOM 0 HA GLN A 47 14.667 6.064 6.704 1.00 0.00 H new ATOM 0 HB2 GLN A 47 13.655 8.453 6.582 1.00 0.00 H new ATOM 0 HB3 GLN A 47 14.556 7.885 5.191 1.00 0.00 H new ATOM 0 HG2 GLN A 47 12.562 7.498 3.926 1.00 0.00 H new ATOM 0 HG3 GLN A 47 11.541 7.659 5.341 1.00 0.00 H new ATOM 0 HE21 GLN A 47 11.572 9.150 2.732 1.00 0.00 H new ATOM 0 HE22 GLN A 47 11.721 10.854 3.173 1.00 0.00 H new ATOM 729 N ARG A 48 11.444 6.120 7.323 1.00 0.00 N ATOM 730 CA ARG A 48 10.439 6.309 8.369 1.00 0.00 C ATOM 731 C ARG A 48 10.278 5.069 9.252 1.00 0.00 C ATOM 732 O ARG A 48 9.349 4.991 10.053 1.00 0.00 O ATOM 733 CB ARG A 48 9.094 6.674 7.736 1.00 0.00 C ATOM 734 CG ARG A 48 9.071 8.022 7.031 1.00 0.00 C ATOM 735 CD ARG A 48 9.084 9.179 8.016 1.00 0.00 C ATOM 736 NE ARG A 48 8.863 10.462 7.347 1.00 0.00 N ATOM 737 CZ ARG A 48 7.792 11.235 7.548 1.00 0.00 C ATOM 738 NH1 ARG A 48 6.844 10.864 8.398 1.00 0.00 N ATOM 739 NH2 ARG A 48 7.667 12.379 6.889 1.00 0.00 N ATOM 0 H ARG A 48 11.064 5.855 6.414 1.00 0.00 H new ATOM 0 HA ARG A 48 10.783 7.122 9.009 1.00 0.00 H new ATOM 0 HB2 ARG A 48 8.822 5.899 7.019 1.00 0.00 H new ATOM 0 HB3 ARG A 48 8.329 6.672 8.513 1.00 0.00 H new ATOM 0 HG2 ARG A 48 9.933 8.100 6.369 1.00 0.00 H new ATOM 0 HG3 ARG A 48 8.181 8.089 6.405 1.00 0.00 H new ATOM 0 HD2 ARG A 48 8.312 9.024 8.770 1.00 0.00 H new ATOM 0 HD3 ARG A 48 10.040 9.201 8.539 1.00 0.00 H new ATOM 0 HE ARG A 48 9.570 10.786 6.687 1.00 0.00 H new ATOM 0 HH11 ARG A 48 6.929 9.983 8.904 1.00 0.00 H new ATOM 0 HH12 ARG A 48 6.030 11.460 8.546 1.00 0.00 H new ATOM 0 HH21 ARG A 48 8.388 12.669 6.229 1.00 0.00 H new ATOM 0 HH22 ARG A 48 6.849 12.969 7.042 1.00 0.00 H new ATOM 753 N VAL A 49 11.183 4.110 9.114 1.00 0.00 N ATOM 754 CA VAL A 49 11.136 2.903 9.926 1.00 0.00 C ATOM 755 C VAL A 49 12.536 2.545 10.417 1.00 0.00 C ATOM 756 O VAL A 49 13.535 2.909 9.790 1.00 0.00 O ATOM 757 CB VAL A 49 10.532 1.711 9.142 1.00 0.00 C ATOM 758 CG1 VAL A 49 11.510 1.186 8.105 1.00 0.00 C ATOM 759 CG2 VAL A 49 10.100 0.601 10.087 1.00 0.00 C ATOM 0 H VAL A 49 11.956 4.144 8.450 1.00 0.00 H new ATOM 0 HA VAL A 49 10.491 3.104 10.781 1.00 0.00 H new ATOM 0 HB VAL A 49 9.648 2.072 8.617 1.00 0.00 H new ATOM 0 HG11 VAL A 49 11.059 0.350 7.570 1.00 0.00 H new ATOM 0 HG12 VAL A 49 11.753 1.980 7.399 1.00 0.00 H new ATOM 0 HG13 VAL A 49 12.421 0.851 8.601 1.00 0.00 H new ATOM 0 HG21 VAL A 49 9.680 -0.224 9.512 1.00 0.00 H new ATOM 0 HG22 VAL A 49 10.963 0.247 10.651 1.00 0.00 H new ATOM 0 HG23 VAL A 49 9.347 0.983 10.777 1.00 0.00 H new ATOM 769 N ALA A 50 12.606 1.862 11.551 1.00 0.00 N ATOM 770 CA ALA A 50 13.873 1.384 12.081 1.00 0.00 C ATOM 771 C ALA A 50 14.365 0.176 11.290 1.00 0.00 C ATOM 772 O ALA A 50 13.565 -0.634 10.817 1.00 0.00 O ATOM 773 CB ALA A 50 13.726 1.035 13.554 1.00 0.00 C ATOM 0 H ALA A 50 11.795 1.626 12.123 1.00 0.00 H new ATOM 0 HA ALA A 50 14.613 2.178 11.983 1.00 0.00 H new ATOM 0 HB1 ALA A 50 14.681 0.678 13.940 1.00 0.00 H new ATOM 0 HB2 ALA A 50 13.418 1.921 14.109 1.00 0.00 H new ATOM 0 HB3 ALA A 50 12.973 0.255 13.670 1.00 0.00 H new ATOM 779 N ALA A 51 15.682 0.065 11.147 1.00 0.00 N ATOM 780 CA ALA A 51 16.298 -1.033 10.410 1.00 0.00 C ATOM 781 C ALA A 51 15.836 -2.396 10.922 1.00 0.00 C ATOM 782 O ALA A 51 15.539 -3.294 10.133 1.00 0.00 O ATOM 783 CB ALA A 51 17.815 -0.931 10.485 1.00 0.00 C ATOM 0 H ALA A 51 16.350 0.730 11.537 1.00 0.00 H new ATOM 0 HA ALA A 51 15.980 -0.948 9.371 1.00 0.00 H new ATOM 0 HB1 ALA A 51 18.263 -1.756 9.931 1.00 0.00 H new ATOM 0 HB2 ALA A 51 18.138 0.015 10.051 1.00 0.00 H new ATOM 0 HB3 ALA A 51 18.132 -0.979 11.527 1.00 0.00 H new ATOM 789 N SER A 52 15.753 -2.538 12.240 1.00 0.00 N ATOM 790 CA SER A 52 15.358 -3.802 12.853 1.00 0.00 C ATOM 791 C SER A 52 13.848 -4.027 12.748 1.00 0.00 C ATOM 792 O SER A 52 13.344 -5.083 13.134 1.00 0.00 O ATOM 793 CB SER A 52 15.791 -3.829 14.323 1.00 0.00 C ATOM 794 OG SER A 52 15.618 -5.119 14.895 1.00 0.00 O ATOM 0 H SER A 52 15.954 -1.792 12.906 1.00 0.00 H new ATOM 0 HA SER A 52 15.856 -4.607 12.313 1.00 0.00 H new ATOM 0 HB2 SER A 52 16.837 -3.533 14.400 1.00 0.00 H new ATOM 0 HB3 SER A 52 15.211 -3.099 14.887 1.00 0.00 H new ATOM 0 HG SER A 52 14.909 -5.597 14.416 1.00 0.00 H new ATOM 800 N GLN A 53 13.130 -3.045 12.214 1.00 0.00 N ATOM 801 CA GLN A 53 11.681 -3.136 12.124 1.00 0.00 C ATOM 802 C GLN A 53 11.223 -3.269 10.672 1.00 0.00 C ATOM 803 O GLN A 53 10.060 -3.566 10.421 1.00 0.00 O ATOM 804 CB GLN A 53 11.025 -1.898 12.746 1.00 0.00 C ATOM 805 CG GLN A 53 9.630 -2.159 13.289 1.00 0.00 C ATOM 806 CD GLN A 53 9.652 -2.926 14.597 1.00 0.00 C ATOM 807 OE1 GLN A 53 9.655 -4.246 14.515 1.00 0.00 O flip ATOM 808 NE2 GLN A 53 9.674 -2.333 15.676 1.00 0.00 N flip ATOM 0 H GLN A 53 13.526 -2.183 11.840 1.00 0.00 H new ATOM 0 HA GLN A 53 11.376 -4.027 12.673 1.00 0.00 H new ATOM 0 HB2 GLN A 53 11.657 -1.529 13.553 1.00 0.00 H new ATOM 0 HB3 GLN A 53 10.972 -1.109 11.996 1.00 0.00 H new ATOM 0 HG2 GLN A 53 9.117 -1.209 13.437 1.00 0.00 H new ATOM 0 HG3 GLN A 53 9.055 -2.720 12.552 1.00 0.00 H new ATOM 0 HE21 GLN A 53 9.671 -1.313 15.698 1.00 0.00 H new ATOM 0 HE22 GLN A 53 9.695 -2.862 16.548 1.00 0.00 H new ATOM 817 N ARG A 54 12.148 -3.065 9.729 1.00 0.00 N ATOM 818 CA ARG A 54 11.805 -2.972 8.302 1.00 0.00 C ATOM 819 C ARG A 54 10.936 -4.139 7.832 1.00 0.00 C ATOM 820 O ARG A 54 9.782 -3.952 7.456 1.00 0.00 O ATOM 821 CB ARG A 54 13.061 -2.912 7.424 1.00 0.00 C ATOM 822 CG ARG A 54 14.012 -1.772 7.751 1.00 0.00 C ATOM 823 CD ARG A 54 15.068 -1.612 6.665 1.00 0.00 C ATOM 824 NE ARG A 54 16.249 -0.880 7.127 1.00 0.00 N ATOM 825 CZ ARG A 54 16.458 0.425 6.922 1.00 0.00 C ATOM 826 NH1 ARG A 54 15.526 1.173 6.352 1.00 0.00 N ATOM 827 NH2 ARG A 54 17.597 0.981 7.304 1.00 0.00 N ATOM 0 H ARG A 54 13.143 -2.961 9.927 1.00 0.00 H new ATOM 0 HA ARG A 54 11.237 -2.048 8.196 1.00 0.00 H new ATOM 0 HB2 ARG A 54 13.600 -3.855 7.519 1.00 0.00 H new ATOM 0 HB3 ARG A 54 12.755 -2.824 6.382 1.00 0.00 H new ATOM 0 HG2 ARG A 54 13.450 -0.844 7.856 1.00 0.00 H new ATOM 0 HG3 ARG A 54 14.496 -1.961 8.709 1.00 0.00 H new ATOM 0 HD2 ARG A 54 15.372 -2.597 6.312 1.00 0.00 H new ATOM 0 HD3 ARG A 54 14.632 -1.089 5.814 1.00 0.00 H new ATOM 0 HE ARG A 54 16.961 -1.401 7.640 1.00 0.00 H new ATOM 0 HH11 ARG A 54 14.641 0.755 6.066 1.00 0.00 H new ATOM 0 HH12 ARG A 54 15.693 2.168 6.199 1.00 0.00 H new ATOM 0 HH21 ARG A 54 18.315 0.414 7.755 1.00 0.00 H new ATOM 0 HH22 ARG A 54 17.756 1.976 7.148 1.00 0.00 H new ATOM 841 N LYS A 55 11.494 -5.343 7.861 1.00 0.00 N ATOM 842 CA LYS A 55 10.804 -6.515 7.334 1.00 0.00 C ATOM 843 C LYS A 55 9.636 -6.918 8.238 1.00 0.00 C ATOM 844 O LYS A 55 8.662 -7.510 7.779 1.00 0.00 O ATOM 845 CB LYS A 55 11.791 -7.679 7.174 1.00 0.00 C ATOM 846 CG LYS A 55 11.716 -8.377 5.820 1.00 0.00 C ATOM 847 CD LYS A 55 10.411 -9.138 5.645 1.00 0.00 C ATOM 848 CE LYS A 55 10.263 -9.691 4.235 1.00 0.00 C ATOM 849 NZ LYS A 55 11.380 -10.598 3.862 1.00 0.00 N ATOM 0 H LYS A 55 12.420 -5.534 8.243 1.00 0.00 H new ATOM 0 HA LYS A 55 10.396 -6.263 6.355 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.804 -7.305 7.323 1.00 0.00 H new ATOM 0 HB3 LYS A 55 11.603 -8.411 7.959 1.00 0.00 H new ATOM 0 HG2 LYS A 55 11.815 -7.638 5.025 1.00 0.00 H new ATOM 0 HG3 LYS A 55 12.554 -9.066 5.720 1.00 0.00 H new ATOM 0 HD2 LYS A 55 10.369 -9.957 6.363 1.00 0.00 H new ATOM 0 HD3 LYS A 55 9.573 -8.477 5.866 1.00 0.00 H new ATOM 0 HE2 LYS A 55 9.319 -10.230 4.156 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.218 -8.864 3.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 11.192 -11.015 2.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 12.269 -10.059 3.828 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 11.462 -11.356 4.569 1.00 0.00 H new ATOM 863 N LEU A 56 9.730 -6.574 9.516 1.00 0.00 N ATOM 864 CA LEU A 56 8.690 -6.917 10.479 1.00 0.00 C ATOM 865 C LEU A 56 7.446 -6.067 10.227 1.00 0.00 C ATOM 866 O LEU A 56 6.328 -6.580 10.170 1.00 0.00 O ATOM 867 CB LEU A 56 9.222 -6.710 11.908 1.00 0.00 C ATOM 868 CG LEU A 56 8.392 -7.321 13.053 1.00 0.00 C ATOM 869 CD1 LEU A 56 7.139 -6.503 13.338 1.00 0.00 C ATOM 870 CD2 LEU A 56 8.026 -8.764 12.734 1.00 0.00 C ATOM 0 H LEU A 56 10.516 -6.057 9.911 1.00 0.00 H new ATOM 0 HA LEU A 56 8.413 -7.965 10.362 1.00 0.00 H new ATOM 0 HB2 LEU A 56 10.229 -7.125 11.959 1.00 0.00 H new ATOM 0 HB3 LEU A 56 9.309 -5.638 12.086 1.00 0.00 H new ATOM 0 HG LEU A 56 9.008 -7.304 13.952 1.00 0.00 H new ATOM 0 HD11 LEU A 56 6.580 -6.965 14.151 1.00 0.00 H new ATOM 0 HD12 LEU A 56 7.423 -5.490 13.623 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.516 -6.468 12.444 1.00 0.00 H new ATOM 0 HD21 LEU A 56 7.440 -9.180 13.553 1.00 0.00 H new ATOM 0 HD22 LEU A 56 7.440 -8.796 11.816 1.00 0.00 H new ATOM 0 HD23 LEU A 56 8.936 -9.350 12.604 1.00 0.00 H new ATOM 882 N ILE A 57 7.650 -4.768 10.050 1.00 0.00 N ATOM 883 CA ILE A 57 6.544 -3.847 9.831 1.00 0.00 C ATOM 884 C ILE A 57 5.959 -4.049 8.433 1.00 0.00 C ATOM 885 O ILE A 57 4.774 -3.799 8.198 1.00 0.00 O ATOM 886 CB ILE A 57 6.990 -2.376 10.039 1.00 0.00 C ATOM 887 CG1 ILE A 57 5.785 -1.474 10.313 1.00 0.00 C ATOM 888 CG2 ILE A 57 7.769 -1.864 8.834 1.00 0.00 C ATOM 889 CD1 ILE A 57 6.172 -0.085 10.778 1.00 0.00 C ATOM 0 H ILE A 57 8.571 -4.329 10.054 1.00 0.00 H new ATOM 0 HA ILE A 57 5.768 -4.061 10.566 1.00 0.00 H new ATOM 0 HB ILE A 57 7.647 -2.350 10.908 1.00 0.00 H new ATOM 0 HG12 ILE A 57 5.187 -1.393 9.406 1.00 0.00 H new ATOM 0 HG13 ILE A 57 5.155 -1.941 11.070 1.00 0.00 H new ATOM 0 HG21 ILE A 57 8.069 -0.831 9.007 1.00 0.00 H new ATOM 0 HG22 ILE A 57 8.656 -2.480 8.686 1.00 0.00 H new ATOM 0 HG23 ILE A 57 7.140 -1.915 7.945 1.00 0.00 H new ATOM 0 HD11 ILE A 57 5.272 0.504 10.955 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.745 -0.157 11.702 1.00 0.00 H new ATOM 0 HD13 ILE A 57 6.778 0.399 10.012 1.00 0.00 H new ATOM 901 N ALA A 58 6.794 -4.532 7.512 1.00 0.00 N ATOM 902 CA ALA A 58 6.345 -4.868 6.169 1.00 0.00 C ATOM 903 C ALA A 58 5.462 -6.110 6.203 1.00 0.00 C ATOM 904 O ALA A 58 4.528 -6.246 5.412 1.00 0.00 O ATOM 905 CB ALA A 58 7.535 -5.085 5.246 1.00 0.00 C ATOM 0 H ALA A 58 7.787 -4.698 7.677 1.00 0.00 H new ATOM 0 HA ALA A 58 5.759 -4.035 5.781 1.00 0.00 H new ATOM 0 HB1 ALA A 58 7.179 -5.335 4.247 1.00 0.00 H new ATOM 0 HB2 ALA A 58 8.132 -4.174 5.201 1.00 0.00 H new ATOM 0 HB3 ALA A 58 8.148 -5.902 5.628 1.00 0.00 H new ATOM 911 N GLU A 59 5.760 -7.012 7.136 1.00 0.00 N ATOM 912 CA GLU A 59 4.956 -8.209 7.332 1.00 0.00 C ATOM 913 C GLU A 59 3.566 -7.803 7.808 1.00 0.00 C ATOM 914 O GLU A 59 2.562 -8.312 7.321 1.00 0.00 O ATOM 915 CB GLU A 59 5.621 -9.136 8.354 1.00 0.00 C ATOM 916 CG GLU A 59 5.342 -10.621 8.141 1.00 0.00 C ATOM 917 CD GLU A 59 3.900 -11.021 8.401 1.00 0.00 C ATOM 918 OE1 GLU A 59 3.489 -11.050 9.582 1.00 0.00 O ATOM 919 OE2 GLU A 59 3.185 -11.345 7.428 1.00 0.00 O ATOM 0 H GLU A 59 6.556 -6.933 7.769 1.00 0.00 H new ATOM 0 HA GLU A 59 4.873 -8.749 6.389 1.00 0.00 H new ATOM 0 HB2 GLU A 59 6.699 -8.974 8.324 1.00 0.00 H new ATOM 0 HB3 GLU A 59 5.284 -8.856 9.352 1.00 0.00 H new ATOM 0 HG2 GLU A 59 5.603 -10.886 7.116 1.00 0.00 H new ATOM 0 HG3 GLU A 59 5.993 -11.200 8.796 1.00 0.00 H new ATOM 926 N LYS A 60 3.528 -6.856 8.747 1.00 0.00 N ATOM 927 CA LYS A 60 2.267 -6.306 9.241 1.00 0.00 C ATOM 928 C LYS A 60 1.435 -5.785 8.079 1.00 0.00 C ATOM 929 O LYS A 60 0.263 -6.127 7.937 1.00 0.00 O ATOM 930 CB LYS A 60 2.517 -5.162 10.230 1.00 0.00 C ATOM 931 CG LYS A 60 3.343 -5.552 11.444 1.00 0.00 C ATOM 932 CD LYS A 60 3.543 -4.368 12.383 1.00 0.00 C ATOM 933 CE LYS A 60 2.225 -3.886 12.971 1.00 0.00 C ATOM 934 NZ LYS A 60 2.416 -2.762 13.926 1.00 0.00 N ATOM 0 H LYS A 60 4.359 -6.454 9.181 1.00 0.00 H new ATOM 0 HA LYS A 60 1.730 -7.105 9.753 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.022 -4.350 9.707 1.00 0.00 H new ATOM 0 HB3 LYS A 60 1.556 -4.774 10.569 1.00 0.00 H new ATOM 0 HG2 LYS A 60 2.847 -6.363 11.978 1.00 0.00 H new ATOM 0 HG3 LYS A 60 4.313 -5.930 11.120 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.218 -4.653 13.190 1.00 0.00 H new ATOM 0 HD3 LYS A 60 4.020 -3.551 11.842 1.00 0.00 H new ATOM 0 HE2 LYS A 60 1.564 -3.568 12.165 1.00 0.00 H new ATOM 0 HE3 LYS A 60 1.731 -4.714 13.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 1.544 -2.622 14.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 3.200 -2.985 14.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 2.637 -1.893 13.399 1.00 0.00 H new ATOM 948 N PHE A 61 2.071 -4.965 7.248 1.00 0.00 N ATOM 949 CA PHE A 61 1.429 -4.381 6.079 1.00 0.00 C ATOM 950 C PHE A 61 0.890 -5.464 5.152 1.00 0.00 C ATOM 951 O PHE A 61 -0.292 -5.473 4.808 1.00 0.00 O ATOM 952 CB PHE A 61 2.438 -3.504 5.328 1.00 0.00 C ATOM 953 CG PHE A 61 1.897 -2.860 4.081 1.00 0.00 C ATOM 954 CD1 PHE A 61 1.176 -1.680 4.152 1.00 0.00 C ATOM 955 CD2 PHE A 61 2.114 -3.434 2.837 1.00 0.00 C ATOM 956 CE1 PHE A 61 0.685 -1.083 3.008 1.00 0.00 C ATOM 957 CE2 PHE A 61 1.626 -2.841 1.690 1.00 0.00 C ATOM 958 CZ PHE A 61 0.908 -1.664 1.777 1.00 0.00 C ATOM 0 H PHE A 61 3.045 -4.688 7.367 1.00 0.00 H new ATOM 0 HA PHE A 61 0.588 -3.772 6.412 1.00 0.00 H new ATOM 0 HB2 PHE A 61 2.793 -2.723 6.001 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.302 -4.113 5.062 1.00 0.00 H new ATOM 0 HD1 PHE A 61 0.996 -1.221 5.113 1.00 0.00 H new ATOM 0 HD2 PHE A 61 2.672 -4.356 2.765 1.00 0.00 H new ATOM 0 HE1 PHE A 61 0.126 -0.161 3.077 1.00 0.00 H new ATOM 0 HE2 PHE A 61 1.805 -3.296 0.727 1.00 0.00 H new ATOM 0 HZ PHE A 61 0.522 -1.199 0.882 1.00 0.00 H new ATOM 968 N ALA A 62 1.765 -6.378 4.763 1.00 0.00 N ATOM 969 CA ALA A 62 1.415 -7.430 3.823 1.00 0.00 C ATOM 970 C ALA A 62 0.338 -8.349 4.385 1.00 0.00 C ATOM 971 O ALA A 62 -0.626 -8.675 3.695 1.00 0.00 O ATOM 972 CB ALA A 62 2.653 -8.230 3.451 1.00 0.00 C ATOM 0 H ALA A 62 2.731 -6.412 5.088 1.00 0.00 H new ATOM 0 HA ALA A 62 1.011 -6.959 2.927 1.00 0.00 H new ATOM 0 HB1 ALA A 62 2.380 -9.016 2.746 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.388 -7.570 2.991 1.00 0.00 H new ATOM 0 HB3 ALA A 62 3.079 -8.679 4.348 1.00 0.00 H new ATOM 978 N GLN A 63 0.495 -8.754 5.640 1.00 0.00 N ATOM 979 CA GLN A 63 -0.449 -9.666 6.271 1.00 0.00 C ATOM 980 C GLN A 63 -1.829 -9.023 6.362 1.00 0.00 C ATOM 981 O GLN A 63 -2.845 -9.651 6.048 1.00 0.00 O ATOM 982 CB GLN A 63 0.034 -10.065 7.667 1.00 0.00 C ATOM 983 CG GLN A 63 -0.725 -11.245 8.246 1.00 0.00 C ATOM 984 CD GLN A 63 -0.507 -12.520 7.454 1.00 0.00 C ATOM 985 OE1 GLN A 63 -1.403 -13.352 7.339 1.00 0.00 O ATOM 986 NE2 GLN A 63 0.696 -12.693 6.923 1.00 0.00 N ATOM 0 H GLN A 63 1.267 -8.465 6.240 1.00 0.00 H new ATOM 0 HA GLN A 63 -0.516 -10.564 5.656 1.00 0.00 H new ATOM 0 HB2 GLN A 63 1.095 -10.310 7.621 1.00 0.00 H new ATOM 0 HB3 GLN A 63 -0.067 -9.212 8.337 1.00 0.00 H new ATOM 0 HG2 GLN A 63 -0.411 -11.404 9.278 1.00 0.00 H new ATOM 0 HG3 GLN A 63 -1.790 -11.012 8.269 1.00 0.00 H new ATOM 0 HE21 GLN A 63 1.413 -11.978 7.041 1.00 0.00 H new ATOM 0 HE22 GLN A 63 0.904 -13.541 6.396 1.00 0.00 H new ATOM 995 N ALA A 64 -1.857 -7.763 6.779 1.00 0.00 N ATOM 996 CA ALA A 64 -3.103 -7.021 6.877 1.00 0.00 C ATOM 997 C ALA A 64 -3.738 -6.866 5.505 1.00 0.00 C ATOM 998 O ALA A 64 -4.956 -6.941 5.363 1.00 0.00 O ATOM 999 CB ALA A 64 -2.869 -5.658 7.509 1.00 0.00 C ATOM 0 H ALA A 64 -1.029 -7.235 7.054 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.786 -7.582 7.515 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -3.814 -5.119 7.573 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -2.457 -5.787 8.510 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -2.168 -5.089 6.898 1.00 0.00 H new ATOM 1005 N LEU A 65 -2.902 -6.677 4.493 1.00 0.00 N ATOM 1006 CA LEU A 65 -3.377 -6.520 3.128 1.00 0.00 C ATOM 1007 C LEU A 65 -3.949 -7.835 2.605 1.00 0.00 C ATOM 1008 O LEU A 65 -4.955 -7.845 1.901 1.00 0.00 O ATOM 1009 CB LEU A 65 -2.245 -6.030 2.221 1.00 0.00 C ATOM 1010 CG LEU A 65 -2.695 -5.486 0.863 1.00 0.00 C ATOM 1011 CD1 LEU A 65 -3.696 -4.361 1.057 1.00 0.00 C ATOM 1012 CD2 LEU A 65 -1.504 -4.989 0.060 1.00 0.00 C ATOM 0 H LEU A 65 -1.888 -6.629 4.594 1.00 0.00 H new ATOM 0 HA LEU A 65 -4.171 -5.774 3.124 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.693 -5.249 2.744 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.551 -6.854 2.054 1.00 0.00 H new ATOM 0 HG LEU A 65 -3.170 -6.296 0.310 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -4.010 -3.981 0.085 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -4.565 -4.736 1.597 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -3.233 -3.557 1.629 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -1.847 -4.607 -0.901 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.002 -4.192 0.609 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -0.807 -5.811 -0.104 1.00 0.00 H new ATOM 1024 N MET A 66 -3.308 -8.944 2.966 1.00 0.00 N ATOM 1025 CA MET A 66 -3.792 -10.269 2.584 1.00 0.00 C ATOM 1026 C MET A 66 -5.150 -10.540 3.223 1.00 0.00 C ATOM 1027 O MET A 66 -6.036 -11.125 2.602 1.00 0.00 O ATOM 1028 CB MET A 66 -2.809 -11.366 3.013 1.00 0.00 C ATOM 1029 CG MET A 66 -1.424 -11.290 2.377 1.00 0.00 C ATOM 1030 SD MET A 66 -1.431 -11.563 0.590 1.00 0.00 S ATOM 1031 CE MET A 66 -1.693 -9.899 -0.024 1.00 0.00 C ATOM 0 H MET A 66 -2.453 -8.952 3.522 1.00 0.00 H new ATOM 0 HA MET A 66 -3.884 -10.285 1.498 1.00 0.00 H new ATOM 0 HB2 MET A 66 -2.695 -11.325 4.096 1.00 0.00 H new ATOM 0 HB3 MET A 66 -3.247 -12.336 2.775 1.00 0.00 H new ATOM 0 HG2 MET A 66 -0.991 -10.311 2.585 1.00 0.00 H new ATOM 0 HG3 MET A 66 -0.777 -12.031 2.847 1.00 0.00 H new ATOM 0 HE1 MET A 66 -1.492 -9.870 -1.095 1.00 0.00 H new ATOM 0 HE2 MET A 66 -2.726 -9.602 0.159 1.00 0.00 H new ATOM 0 HE3 MET A 66 -1.021 -9.212 0.490 1.00 0.00 H new ATOM 1041 N SER A 67 -5.304 -10.107 4.469 1.00 0.00 N ATOM 1042 CA SER A 67 -6.548 -10.299 5.199 1.00 0.00 C ATOM 1043 C SER A 67 -7.623 -9.333 4.694 1.00 0.00 C ATOM 1044 O SER A 67 -8.816 -9.634 4.751 1.00 0.00 O ATOM 1045 CB SER A 67 -6.318 -10.102 6.701 1.00 0.00 C ATOM 1046 OG SER A 67 -7.462 -10.477 7.446 1.00 0.00 O ATOM 0 H SER A 67 -4.579 -9.619 4.995 1.00 0.00 H new ATOM 0 HA SER A 67 -6.894 -11.318 5.029 1.00 0.00 H new ATOM 0 HB2 SER A 67 -5.461 -10.695 7.022 1.00 0.00 H new ATOM 0 HB3 SER A 67 -6.076 -9.058 6.901 1.00 0.00 H new ATOM 0 HG SER A 67 -7.289 -10.343 8.401 1.00 0.00 H new ATOM 1052 N SER A 68 -7.193 -8.183 4.194 1.00 0.00 N ATOM 1053 CA SER A 68 -8.114 -7.188 3.657 1.00 0.00 C ATOM 1054 C SER A 68 -8.386 -7.452 2.180 1.00 0.00 C ATOM 1055 O SER A 68 -9.104 -6.701 1.517 1.00 0.00 O ATOM 1056 CB SER A 68 -7.546 -5.782 3.858 1.00 0.00 C ATOM 1057 OG SER A 68 -7.276 -5.542 5.231 1.00 0.00 O ATOM 0 H SER A 68 -6.210 -7.914 4.149 1.00 0.00 H new ATOM 0 HA SER A 68 -9.059 -7.261 4.195 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.631 -5.667 3.277 1.00 0.00 H new ATOM 0 HB3 SER A 68 -8.254 -5.042 3.487 1.00 0.00 H new ATOM 0 HG SER A 68 -6.440 -5.987 5.483 1.00 0.00 H new ATOM 1063 N LEU A 69 -7.803 -8.530 1.669 1.00 0.00 N ATOM 1064 CA LEU A 69 -8.060 -8.965 0.309 1.00 0.00 C ATOM 1065 C LEU A 69 -9.439 -9.602 0.214 1.00 0.00 C ATOM 1066 O LEU A 69 -9.592 -10.816 0.352 1.00 0.00 O ATOM 1067 CB LEU A 69 -6.988 -9.952 -0.164 1.00 0.00 C ATOM 1068 CG LEU A 69 -5.857 -9.346 -0.994 1.00 0.00 C ATOM 1069 CD1 LEU A 69 -4.864 -10.425 -1.392 1.00 0.00 C ATOM 1070 CD2 LEU A 69 -6.413 -8.658 -2.231 1.00 0.00 C ATOM 0 H LEU A 69 -7.147 -9.119 2.182 1.00 0.00 H new ATOM 0 HA LEU A 69 -8.027 -8.090 -0.340 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -6.554 -10.437 0.710 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -7.471 -10.731 -0.754 1.00 0.00 H new ATOM 0 HG LEU A 69 -5.342 -8.601 -0.388 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -4.063 -9.982 -1.983 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -4.444 -10.882 -0.496 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -5.372 -11.187 -1.983 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -5.593 -8.232 -2.810 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -6.949 -9.385 -2.841 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -7.095 -7.863 -1.930 1.00 0.00 H new ATOM 1082 N GLU A 70 -10.445 -8.767 0.030 1.00 0.00 N ATOM 1083 CA GLU A 70 -11.809 -9.238 -0.111 1.00 0.00 C ATOM 1084 C GLU A 70 -12.044 -9.733 -1.532 1.00 0.00 C ATOM 1085 O GLU A 70 -12.412 -8.966 -2.419 1.00 0.00 O ATOM 1086 CB GLU A 70 -12.788 -8.120 0.255 1.00 0.00 C ATOM 1087 CG GLU A 70 -12.670 -7.673 1.705 1.00 0.00 C ATOM 1088 CD GLU A 70 -13.517 -6.461 2.024 1.00 0.00 C ATOM 1089 OE1 GLU A 70 -14.738 -6.622 2.246 1.00 0.00 O ATOM 1090 OE2 GLU A 70 -12.967 -5.340 2.075 1.00 0.00 O ATOM 0 H GLU A 70 -10.341 -7.754 -0.025 1.00 0.00 H new ATOM 0 HA GLU A 70 -11.977 -10.072 0.570 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.614 -7.265 -0.398 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.806 -8.461 0.068 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -12.963 -8.495 2.357 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -11.627 -7.448 1.926 1.00 0.00 H new ATOM 1097 N THR A 71 -11.778 -11.010 -1.754 1.00 0.00 N ATOM 1098 CA THR A 71 -11.918 -11.598 -3.074 1.00 0.00 C ATOM 1099 C THR A 71 -12.751 -12.880 -3.019 1.00 0.00 C ATOM 1100 O THR A 71 -12.406 -13.838 -2.323 1.00 0.00 O ATOM 1101 CB THR A 71 -10.535 -11.875 -3.719 1.00 0.00 C ATOM 1102 OG1 THR A 71 -10.693 -12.526 -4.986 1.00 0.00 O ATOM 1103 CG2 THR A 71 -9.649 -12.721 -2.813 1.00 0.00 C ATOM 0 H THR A 71 -11.463 -11.660 -1.034 1.00 0.00 H new ATOM 0 HA THR A 71 -12.442 -10.875 -3.699 1.00 0.00 H new ATOM 0 HB THR A 71 -10.047 -10.911 -3.866 1.00 0.00 H new ATOM 0 HG1 THR A 71 -10.047 -12.159 -5.625 1.00 0.00 H new ATOM 0 HG21 THR A 71 -8.689 -12.893 -3.300 1.00 0.00 H new ATOM 0 HG22 THR A 71 -9.489 -12.198 -1.870 1.00 0.00 H new ATOM 0 HG23 THR A 71 -10.134 -13.678 -2.620 1.00 0.00 H new ATOM 1111 N PRO A 72 -13.882 -12.902 -3.735 1.00 0.00 N ATOM 1112 CA PRO A 72 -14.754 -14.075 -3.805 1.00 0.00 C ATOM 1113 C PRO A 72 -14.108 -15.233 -4.565 1.00 0.00 C ATOM 1114 O PRO A 72 -14.148 -15.287 -5.797 1.00 0.00 O ATOM 1115 CB PRO A 72 -16.000 -13.571 -4.551 1.00 0.00 C ATOM 1116 CG PRO A 72 -15.892 -12.083 -4.535 1.00 0.00 C ATOM 1117 CD PRO A 72 -14.424 -11.780 -4.509 1.00 0.00 C ATOM 0 HA PRO A 72 -14.975 -14.470 -2.813 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -16.029 -13.953 -5.572 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -16.914 -13.905 -4.060 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -16.366 -11.647 -5.415 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -16.393 -11.664 -3.662 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -14.001 -11.737 -5.513 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -14.216 -10.821 -4.034 1.00 0.00 H new ATOM 1125 N LYS A 73 -13.469 -16.125 -3.820 1.00 0.00 N ATOM 1126 CA LYS A 73 -12.878 -17.331 -4.389 1.00 0.00 C ATOM 1127 C LYS A 73 -13.171 -18.519 -3.485 1.00 0.00 C ATOM 1128 O LYS A 73 -13.554 -19.591 -3.948 1.00 0.00 O ATOM 1129 CB LYS A 73 -11.365 -17.169 -4.577 1.00 0.00 C ATOM 1130 CG LYS A 73 -10.991 -16.113 -5.605 1.00 0.00 C ATOM 1131 CD LYS A 73 -9.490 -16.056 -5.843 1.00 0.00 C ATOM 1132 CE LYS A 73 -9.134 -15.014 -6.893 1.00 0.00 C ATOM 1133 NZ LYS A 73 -9.824 -15.268 -8.186 1.00 0.00 N ATOM 0 H LYS A 73 -13.346 -16.035 -2.811 1.00 0.00 H new ATOM 0 HA LYS A 73 -13.321 -17.504 -5.370 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -10.914 -16.908 -3.620 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -10.940 -18.126 -4.880 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -11.499 -16.326 -6.545 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -11.342 -15.138 -5.267 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -8.980 -15.822 -4.908 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -9.133 -17.035 -6.164 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -9.403 -14.023 -6.527 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -8.056 -15.013 -7.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -9.140 -15.192 -8.965 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -10.236 -16.223 -8.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -10.580 -14.566 -8.320 1.00 0.00 H new ATOM 1147 N THR A 74 -12.992 -18.313 -2.190 1.00 0.00 N ATOM 1148 CA THR A 74 -13.324 -19.315 -1.197 1.00 0.00 C ATOM 1149 C THR A 74 -13.837 -18.623 0.059 1.00 0.00 C ATOM 1150 O THR A 74 -13.636 -17.419 0.232 1.00 0.00 O ATOM 1151 CB THR A 74 -12.109 -20.209 -0.849 1.00 0.00 C ATOM 1152 OG1 THR A 74 -12.494 -21.229 0.084 1.00 0.00 O ATOM 1153 CG2 THR A 74 -10.971 -19.389 -0.259 1.00 0.00 C ATOM 0 H THR A 74 -12.614 -17.449 -1.801 1.00 0.00 H new ATOM 0 HA THR A 74 -14.096 -19.963 -1.612 1.00 0.00 H new ATOM 0 HB THR A 74 -11.762 -20.670 -1.774 1.00 0.00 H new ATOM 0 HG1 THR A 74 -11.718 -21.789 0.295 1.00 0.00 H new ATOM 0 HG21 THR A 74 -10.133 -20.045 -0.025 1.00 0.00 H new ATOM 0 HG22 THR A 74 -10.653 -18.637 -0.981 1.00 0.00 H new ATOM 0 HG23 THR A 74 -11.311 -18.897 0.652 1.00 0.00 H new ATOM 1161 N HIS A 75 -14.515 -19.367 0.918 1.00 0.00 N ATOM 1162 CA HIS A 75 -15.043 -18.809 2.157 1.00 0.00 C ATOM 1163 C HIS A 75 -14.687 -19.708 3.333 1.00 0.00 C ATOM 1164 O HIS A 75 -15.144 -19.492 4.456 1.00 0.00 O ATOM 1165 CB HIS A 75 -16.564 -18.642 2.068 1.00 0.00 C ATOM 1166 CG HIS A 75 -17.010 -17.656 1.032 1.00 0.00 C ATOM 1167 ND1 HIS A 75 -17.388 -18.022 -0.239 1.00 0.00 N ATOM 1168 CD2 HIS A 75 -17.146 -16.311 1.086 1.00 0.00 C ATOM 1169 CE1 HIS A 75 -17.738 -16.949 -0.921 1.00 0.00 C ATOM 1170 NE2 HIS A 75 -17.602 -15.895 -0.140 1.00 0.00 N ATOM 0 H HIS A 75 -14.714 -20.358 0.782 1.00 0.00 H new ATOM 0 HA HIS A 75 -14.593 -17.828 2.311 1.00 0.00 H new ATOM 0 HB2 HIS A 75 -17.013 -19.611 1.850 1.00 0.00 H new ATOM 0 HB3 HIS A 75 -16.942 -18.327 3.041 1.00 0.00 H new ATOM 0 HD2 HIS A 75 -16.935 -15.681 1.937 1.00 0.00 H new ATOM 0 HE1 HIS A 75 -18.078 -16.936 -1.946 1.00 0.00 H new ATOM 0 HE2 HIS A 75 -17.803 -14.930 -0.403 1.00 0.00 H new ATOM 1179 N LEU A 76 -13.858 -20.707 3.070 1.00 0.00 N ATOM 1180 CA LEU A 76 -13.507 -21.690 4.082 1.00 0.00 C ATOM 1181 C LEU A 76 -12.200 -21.291 4.761 1.00 0.00 C ATOM 1182 O LEU A 76 -11.182 -21.080 4.096 1.00 0.00 O ATOM 1183 CB LEU A 76 -13.393 -23.081 3.441 1.00 0.00 C ATOM 1184 CG LEU A 76 -13.768 -24.265 4.344 1.00 0.00 C ATOM 1185 CD1 LEU A 76 -13.914 -25.534 3.517 1.00 0.00 C ATOM 1186 CD2 LEU A 76 -12.731 -24.469 5.440 1.00 0.00 C ATOM 0 H LEU A 76 -13.416 -20.858 2.163 1.00 0.00 H new ATOM 0 HA LEU A 76 -14.289 -21.726 4.840 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -14.030 -23.106 2.557 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -12.367 -23.220 3.099 1.00 0.00 H new ATOM 0 HG LEU A 76 -14.723 -24.038 4.818 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -14.180 -26.365 4.170 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -14.696 -25.394 2.771 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -12.971 -25.753 3.017 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -13.022 -25.314 6.064 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -11.759 -24.669 4.989 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -12.668 -23.570 6.053 1.00 0.00 H new ATOM 1198 N GLU A 77 -12.245 -21.192 6.083 1.00 0.00 N ATOM 1199 CA GLU A 77 -11.106 -20.743 6.876 1.00 0.00 C ATOM 1200 C GLU A 77 -9.925 -21.703 6.782 1.00 0.00 C ATOM 1201 O GLU A 77 -9.949 -22.785 7.371 1.00 0.00 O ATOM 1202 CB GLU A 77 -11.516 -20.588 8.343 1.00 0.00 C ATOM 1203 CG GLU A 77 -12.419 -19.395 8.609 1.00 0.00 C ATOM 1204 CD GLU A 77 -11.713 -18.078 8.370 1.00 0.00 C ATOM 1205 OE1 GLU A 77 -10.609 -17.883 8.919 1.00 0.00 O ATOM 1206 OE2 GLU A 77 -12.255 -17.230 7.633 1.00 0.00 O ATOM 0 H GLU A 77 -13.071 -21.420 6.636 1.00 0.00 H new ATOM 0 HA GLU A 77 -10.791 -19.782 6.470 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -12.026 -21.496 8.665 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -10.617 -20.494 8.953 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -13.297 -19.456 7.966 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -12.774 -19.433 9.639 1.00 0.00 H new ATOM 1213 N HIS A 78 -8.906 -21.299 6.023 1.00 0.00 N ATOM 1214 CA HIS A 78 -7.633 -22.021 5.960 1.00 0.00 C ATOM 1215 C HIS A 78 -7.851 -23.493 5.599 1.00 0.00 C ATOM 1216 O HIS A 78 -7.439 -24.394 6.327 1.00 0.00 O ATOM 1217 CB HIS A 78 -6.904 -21.889 7.307 1.00 0.00 C ATOM 1218 CG HIS A 78 -5.480 -22.365 7.306 1.00 0.00 C ATOM 1219 ND1 HIS A 78 -4.437 -21.614 6.813 1.00 0.00 N ATOM 1220 CD2 HIS A 78 -4.928 -23.513 7.767 1.00 0.00 C ATOM 1221 CE1 HIS A 78 -3.308 -22.278 6.967 1.00 0.00 C ATOM 1222 NE2 HIS A 78 -3.574 -23.434 7.547 1.00 0.00 N ATOM 0 H HIS A 78 -8.938 -20.465 5.436 1.00 0.00 H new ATOM 0 HA HIS A 78 -7.016 -21.582 5.176 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -6.921 -20.843 7.612 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -7.458 -22.450 8.060 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -5.455 -24.338 8.223 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -2.329 -21.934 6.668 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -2.889 -24.149 7.791 1.00 0.00 H new ATOM 1231 N HIS A 79 -8.495 -23.739 4.465 1.00 0.00 N ATOM 1232 CA HIS A 79 -8.818 -25.103 4.059 1.00 0.00 C ATOM 1233 C HIS A 79 -7.619 -25.791 3.406 1.00 0.00 C ATOM 1234 O HIS A 79 -7.664 -26.164 2.233 1.00 0.00 O ATOM 1235 CB HIS A 79 -10.033 -25.125 3.125 1.00 0.00 C ATOM 1236 CG HIS A 79 -10.501 -26.509 2.785 1.00 0.00 C ATOM 1237 ND1 HIS A 79 -10.822 -27.452 3.737 1.00 0.00 N ATOM 1238 CD2 HIS A 79 -10.684 -27.111 1.587 1.00 0.00 C ATOM 1239 CE1 HIS A 79 -11.183 -28.571 3.140 1.00 0.00 C ATOM 1240 NE2 HIS A 79 -11.110 -28.392 1.835 1.00 0.00 N ATOM 0 H HIS A 79 -8.803 -23.018 3.813 1.00 0.00 H new ATOM 0 HA HIS A 79 -9.071 -25.662 4.960 1.00 0.00 H new ATOM 0 HB2 HIS A 79 -10.851 -24.578 3.593 1.00 0.00 H new ATOM 0 HB3 HIS A 79 -9.783 -24.598 2.204 1.00 0.00 H new ATOM 0 HD2 HIS A 79 -10.524 -26.666 0.616 1.00 0.00 H new ATOM 0 HE1 HIS A 79 -11.487 -29.481 3.636 1.00 0.00 H new ATOM 0 HE2 HIS A 79 -11.333 -29.091 1.127 1.00 0.00 H new ATOM 1249 N HIS A 80 -6.545 -25.917 4.182 1.00 0.00 N ATOM 1250 CA HIS A 80 -5.353 -26.674 3.799 1.00 0.00 C ATOM 1251 C HIS A 80 -4.238 -26.417 4.807 1.00 0.00 C ATOM 1252 O HIS A 80 -3.729 -25.300 4.922 1.00 0.00 O ATOM 1253 CB HIS A 80 -4.870 -26.350 2.366 1.00 0.00 C ATOM 1254 CG HIS A 80 -4.305 -24.972 2.166 1.00 0.00 C ATOM 1255 ND1 HIS A 80 -3.024 -24.752 1.710 1.00 0.00 N ATOM 1256 CD2 HIS A 80 -4.852 -23.746 2.349 1.00 0.00 C ATOM 1257 CE1 HIS A 80 -2.807 -23.455 1.622 1.00 0.00 C ATOM 1258 NE2 HIS A 80 -3.898 -22.820 2.003 1.00 0.00 N ATOM 0 H HIS A 80 -6.476 -25.491 5.106 1.00 0.00 H new ATOM 0 HA HIS A 80 -5.623 -27.730 3.803 1.00 0.00 H new ATOM 0 HB2 HIS A 80 -4.110 -27.079 2.085 1.00 0.00 H new ATOM 0 HB3 HIS A 80 -5.708 -26.482 1.681 1.00 0.00 H new ATOM 0 HD2 HIS A 80 -5.851 -23.536 2.701 1.00 0.00 H new ATOM 0 HE1 HIS A 80 -1.889 -22.990 1.293 1.00 0.00 H new ATOM 0 HE2 HIS A 80 -4.015 -21.807 2.036 1.00 0.00 H new ATOM 1267 N HIS A 81 -3.891 -27.440 5.570 1.00 0.00 N ATOM 1268 CA HIS A 81 -2.792 -27.327 6.517 1.00 0.00 C ATOM 1269 C HIS A 81 -1.460 -27.441 5.783 1.00 0.00 C ATOM 1270 O HIS A 81 -1.341 -28.194 4.816 1.00 0.00 O ATOM 1271 CB HIS A 81 -2.898 -28.386 7.629 1.00 0.00 C ATOM 1272 CG HIS A 81 -2.643 -29.800 7.193 1.00 0.00 C ATOM 1273 ND1 HIS A 81 -1.648 -30.580 7.737 1.00 0.00 N ATOM 1274 CD2 HIS A 81 -3.274 -30.584 6.289 1.00 0.00 C ATOM 1275 CE1 HIS A 81 -1.674 -31.776 7.185 1.00 0.00 C ATOM 1276 NE2 HIS A 81 -2.657 -31.814 6.304 1.00 0.00 N ATOM 0 H HIS A 81 -4.349 -28.351 5.554 1.00 0.00 H new ATOM 0 HA HIS A 81 -2.849 -26.349 6.994 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -2.190 -28.133 8.418 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -3.895 -28.332 8.066 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -4.110 -30.297 5.668 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -1.003 -32.590 7.415 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -2.915 -32.618 5.732 1.00 0.00 H new ATOM 1285 N HIS A 82 -0.474 -26.681 6.234 1.00 0.00 N ATOM 1286 CA HIS A 82 0.845 -26.688 5.611 1.00 0.00 C ATOM 1287 C HIS A 82 1.562 -27.995 5.905 1.00 0.00 C ATOM 1288 O HIS A 82 1.464 -28.530 7.010 1.00 0.00 O ATOM 1289 CB HIS A 82 1.694 -25.512 6.103 1.00 0.00 C ATOM 1290 CG HIS A 82 1.416 -24.213 5.406 1.00 0.00 C ATOM 1291 ND1 HIS A 82 0.760 -23.158 6.004 1.00 0.00 N ATOM 1292 CD2 HIS A 82 1.742 -23.788 4.161 1.00 0.00 C ATOM 1293 CE1 HIS A 82 0.693 -22.145 5.158 1.00 0.00 C ATOM 1294 NE2 HIS A 82 1.281 -22.500 4.033 1.00 0.00 N ATOM 0 H HIS A 82 -0.560 -26.050 7.030 1.00 0.00 H new ATOM 0 HA HIS A 82 0.706 -26.588 4.535 1.00 0.00 H new ATOM 0 HB2 HIS A 82 1.526 -25.380 7.172 1.00 0.00 H new ATOM 0 HB3 HIS A 82 2.747 -25.761 5.975 1.00 0.00 H new ATOM 0 HD2 HIS A 82 2.267 -24.357 3.408 1.00 0.00 H new ATOM 0 HE1 HIS A 82 0.234 -21.188 5.355 1.00 0.00 H new ATOM 0 HE2 HIS A 82 1.378 -21.915 3.203 1.00 0.00 H new ATOM 1303 N HIS A 83 2.268 -28.511 4.912 1.00 0.00 N ATOM 1304 CA HIS A 83 3.018 -29.744 5.069 1.00 0.00 C ATOM 1305 C HIS A 83 4.179 -29.779 4.080 1.00 0.00 C ATOM 1306 O HIS A 83 4.000 -30.280 2.953 1.00 0.00 O ATOM 1307 CB HIS A 83 2.110 -30.981 4.911 1.00 0.00 C ATOM 1308 CG HIS A 83 1.309 -31.032 3.636 1.00 0.00 C ATOM 1309 ND1 HIS A 83 0.280 -30.264 3.202 1.00 0.00 N flip ATOM 1310 CD2 HIS A 83 1.515 -31.979 2.654 1.00 0.00 C flip ATOM 1311 CE1 HIS A 83 -0.108 -30.755 1.981 1.00 0.00 C flip ATOM 1312 NE2 HIS A 83 0.653 -31.788 1.672 1.00 0.00 N flip ATOM 1313 OXT HIS A 83 5.266 -29.276 4.427 1.00 0.00 O ATOM 0 H HIS A 83 2.337 -28.092 3.985 1.00 0.00 H new ATOM 0 HA HIS A 83 3.423 -29.773 6.080 1.00 0.00 H new ATOM 0 HB2 HIS A 83 2.730 -31.876 4.968 1.00 0.00 H new ATOM 0 HB3 HIS A 83 1.421 -31.016 5.755 1.00 0.00 H new ATOM 0 HD1 HIS A 83 -0.130 -29.469 3.692 1.00 0.00 H new ATOM 0 HD2 HIS A 83 2.265 -32.756 2.684 1.00 0.00 H new ATOM 0 HE1 HIS A 83 -0.907 -30.360 1.371 1.00 0.00 H new TER 1322 HIS A 83 ATOM 1323 N MET B 1 12.127 9.689 -11.333 1.00 0.00 N ATOM 1324 CA MET B 1 12.470 8.393 -11.968 1.00 0.00 C ATOM 1325 C MET B 1 11.221 7.539 -12.156 1.00 0.00 C ATOM 1326 O MET B 1 10.512 7.257 -11.195 1.00 0.00 O ATOM 1327 CB MET B 1 13.480 7.630 -11.104 1.00 0.00 C ATOM 1328 CG MET B 1 14.825 8.323 -10.963 1.00 0.00 C ATOM 1329 SD MET B 1 15.906 7.503 -9.774 1.00 0.00 S ATOM 1330 CE MET B 1 16.034 5.864 -10.488 1.00 0.00 C ATOM 0 H1 MET B 1 12.922 10.350 -11.442 1.00 0.00 H new ATOM 0 H2 MET B 1 11.282 10.086 -11.790 1.00 0.00 H new ATOM 0 H3 MET B 1 11.936 9.540 -10.322 1.00 0.00 H new ATOM 0 HA MET B 1 12.910 8.600 -12.944 1.00 0.00 H new ATOM 0 HB2 MET B 1 13.054 7.482 -10.112 1.00 0.00 H new ATOM 0 HB3 MET B 1 13.636 6.641 -11.535 1.00 0.00 H new ATOM 0 HG2 MET B 1 15.317 8.354 -11.935 1.00 0.00 H new ATOM 0 HG3 MET B 1 14.667 9.356 -10.653 1.00 0.00 H new ATOM 0 HE1 MET B 1 16.865 5.330 -10.027 1.00 0.00 H new ATOM 0 HE2 MET B 1 15.108 5.317 -10.311 1.00 0.00 H new ATOM 0 HE3 MET B 1 16.207 5.947 -11.561 1.00 0.00 H new ATOM 1339 N PRO B 2 10.922 7.136 -13.400 1.00 0.00 N ATOM 1340 CA PRO B 2 9.800 6.241 -13.690 1.00 0.00 C ATOM 1341 C PRO B 2 10.153 4.779 -13.413 1.00 0.00 C ATOM 1342 O PRO B 2 10.935 4.167 -14.139 1.00 0.00 O ATOM 1343 CB PRO B 2 9.545 6.474 -15.181 1.00 0.00 C ATOM 1344 CG PRO B 2 10.871 6.870 -15.743 1.00 0.00 C ATOM 1345 CD PRO B 2 11.644 7.533 -14.626 1.00 0.00 C ATOM 0 HA PRO B 2 8.929 6.443 -13.066 1.00 0.00 H new ATOM 0 HB2 PRO B 2 9.166 5.572 -15.662 1.00 0.00 H new ATOM 0 HB3 PRO B 2 8.801 7.255 -15.337 1.00 0.00 H new ATOM 0 HG2 PRO B 2 11.407 5.998 -16.118 1.00 0.00 H new ATOM 0 HG3 PRO B 2 10.745 7.553 -16.583 1.00 0.00 H new ATOM 0 HD2 PRO B 2 12.680 7.196 -14.604 1.00 0.00 H new ATOM 0 HD3 PRO B 2 11.663 8.616 -14.744 1.00 0.00 H new ATOM 1353 N ILE B 3 9.588 4.228 -12.346 1.00 0.00 N ATOM 1354 CA ILE B 3 9.905 2.863 -11.936 1.00 0.00 C ATOM 1355 C ILE B 3 8.844 1.886 -12.427 1.00 0.00 C ATOM 1356 O ILE B 3 9.095 1.059 -13.305 1.00 0.00 O ATOM 1357 CB ILE B 3 10.010 2.710 -10.395 1.00 0.00 C ATOM 1358 CG1 ILE B 3 10.418 4.020 -9.717 1.00 0.00 C ATOM 1359 CG2 ILE B 3 10.995 1.606 -10.045 1.00 0.00 C ATOM 1360 CD1 ILE B 3 9.241 4.914 -9.377 1.00 0.00 C ATOM 0 H ILE B 3 8.910 4.702 -11.750 1.00 0.00 H new ATOM 0 HA ILE B 3 10.874 2.640 -12.382 1.00 0.00 H new ATOM 0 HB ILE B 3 9.021 2.443 -10.022 1.00 0.00 H new ATOM 0 HG12 ILE B 3 10.967 3.792 -8.804 1.00 0.00 H new ATOM 0 HG13 ILE B 3 11.100 4.563 -10.372 1.00 0.00 H new ATOM 0 HG21 ILE B 3 11.061 1.507 -8.961 1.00 0.00 H new ATOM 0 HG22 ILE B 3 10.654 0.664 -10.475 1.00 0.00 H new ATOM 0 HG23 ILE B 3 11.977 1.854 -10.447 1.00 0.00 H new ATOM 0 HD11 ILE B 3 9.602 5.825 -8.899 1.00 0.00 H new ATOM 0 HD12 ILE B 3 8.704 5.172 -10.290 1.00 0.00 H new ATOM 0 HD13 ILE B 3 8.570 4.389 -8.697 1.00 0.00 H new ATOM 1372 N THR B 4 7.660 2.002 -11.845 1.00 0.00 N ATOM 1373 CA THR B 4 6.560 1.090 -12.110 1.00 0.00 C ATOM 1374 C THR B 4 6.103 1.149 -13.569 1.00 0.00 C ATOM 1375 O THR B 4 6.353 0.228 -14.348 1.00 0.00 O ATOM 1376 CB THR B 4 5.384 1.422 -11.178 1.00 0.00 C ATOM 1377 OG1 THR B 4 5.853 1.471 -9.822 1.00 0.00 O ATOM 1378 CG2 THR B 4 4.270 0.397 -11.305 1.00 0.00 C ATOM 0 H THR B 4 7.435 2.735 -11.173 1.00 0.00 H new ATOM 0 HA THR B 4 6.913 0.076 -11.921 1.00 0.00 H new ATOM 0 HB THR B 4 4.978 2.392 -11.466 1.00 0.00 H new ATOM 0 HG1 THR B 4 5.272 0.922 -9.255 1.00 0.00 H new ATOM 0 HG21 THR B 4 3.454 0.661 -10.633 1.00 0.00 H new ATOM 0 HG22 THR B 4 3.904 0.383 -12.332 1.00 0.00 H new ATOM 0 HG23 THR B 4 4.652 -0.590 -11.042 1.00 0.00 H new ATOM 1386 N SER B 5 5.448 2.237 -13.937 1.00 0.00 N ATOM 1387 CA SER B 5 4.930 2.391 -15.285 1.00 0.00 C ATOM 1388 C SER B 5 5.347 3.737 -15.849 1.00 0.00 C ATOM 1389 O SER B 5 5.754 4.629 -15.101 1.00 0.00 O ATOM 1390 CB SER B 5 3.406 2.256 -15.283 1.00 0.00 C ATOM 1391 OG SER B 5 3.008 0.998 -14.762 1.00 0.00 O ATOM 0 H SER B 5 5.262 3.028 -13.320 1.00 0.00 H new ATOM 0 HA SER B 5 5.344 1.606 -15.918 1.00 0.00 H new ATOM 0 HB2 SER B 5 2.967 3.056 -14.687 1.00 0.00 H new ATOM 0 HB3 SER B 5 3.026 2.370 -16.298 1.00 0.00 H new ATOM 0 HG SER B 5 2.030 0.936 -14.769 1.00 0.00 H new ATOM 1397 N LYS B 6 5.248 3.887 -17.158 1.00 0.00 N ATOM 1398 CA LYS B 6 5.682 5.109 -17.800 1.00 0.00 C ATOM 1399 C LYS B 6 4.524 6.089 -17.917 1.00 0.00 C ATOM 1400 O LYS B 6 3.859 6.175 -18.950 1.00 0.00 O ATOM 1401 CB LYS B 6 6.281 4.825 -19.179 1.00 0.00 C ATOM 1402 CG LYS B 6 6.972 6.033 -19.794 1.00 0.00 C ATOM 1403 CD LYS B 6 7.513 5.723 -21.175 1.00 0.00 C ATOM 1404 CE LYS B 6 8.284 6.901 -21.745 1.00 0.00 C ATOM 1405 NZ LYS B 6 8.759 6.640 -23.129 1.00 0.00 N ATOM 0 H LYS B 6 4.873 3.181 -17.792 1.00 0.00 H new ATOM 0 HA LYS B 6 6.459 5.557 -17.180 1.00 0.00 H new ATOM 0 HB2 LYS B 6 6.998 4.008 -19.095 1.00 0.00 H new ATOM 0 HB3 LYS B 6 5.490 4.487 -19.849 1.00 0.00 H new ATOM 0 HG2 LYS B 6 6.268 6.863 -19.856 1.00 0.00 H new ATOM 0 HG3 LYS B 6 7.788 6.355 -19.147 1.00 0.00 H new ATOM 0 HD2 LYS B 6 8.164 4.850 -21.125 1.00 0.00 H new ATOM 0 HD3 LYS B 6 6.689 5.469 -21.842 1.00 0.00 H new ATOM 0 HE2 LYS B 6 7.648 7.786 -21.741 1.00 0.00 H new ATOM 0 HE3 LYS B 6 9.138 7.119 -21.104 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 9.280 7.469 -23.479 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 9.387 5.811 -23.130 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 7.943 6.457 -23.747 1.00 0.00 H new ATOM 1419 N TYR B 7 4.257 6.784 -16.827 1.00 0.00 N ATOM 1420 CA TYR B 7 3.278 7.856 -16.821 1.00 0.00 C ATOM 1421 C TYR B 7 3.976 9.177 -17.106 1.00 0.00 C ATOM 1422 O TYR B 7 5.205 9.223 -17.220 1.00 0.00 O ATOM 1423 CB TYR B 7 2.563 7.938 -15.469 1.00 0.00 C ATOM 1424 CG TYR B 7 1.473 6.905 -15.265 1.00 0.00 C ATOM 1425 CD1 TYR B 7 1.746 5.660 -14.706 1.00 0.00 C ATOM 1426 CD2 TYR B 7 0.159 7.187 -15.618 1.00 0.00 C ATOM 1427 CE1 TYR B 7 0.738 4.734 -14.506 1.00 0.00 C ATOM 1428 CE2 TYR B 7 -0.849 6.264 -15.424 1.00 0.00 C ATOM 1429 CZ TYR B 7 -0.555 5.040 -14.866 1.00 0.00 C ATOM 1430 OH TYR B 7 -1.559 4.122 -14.654 1.00 0.00 O ATOM 0 H TYR B 7 4.709 6.623 -15.927 1.00 0.00 H new ATOM 0 HA TYR B 7 2.535 7.651 -17.592 1.00 0.00 H new ATOM 0 HB2 TYR B 7 3.302 7.828 -14.675 1.00 0.00 H new ATOM 0 HB3 TYR B 7 2.127 8.932 -15.363 1.00 0.00 H new ATOM 0 HD1 TYR B 7 2.759 5.413 -14.424 1.00 0.00 H new ATOM 0 HD2 TYR B 7 -0.078 8.147 -16.053 1.00 0.00 H new ATOM 0 HE1 TYR B 7 0.965 3.773 -14.068 1.00 0.00 H new ATOM 0 HE2 TYR B 7 -1.864 6.501 -15.709 1.00 0.00 H new ATOM 0 HH TYR B 7 -2.173 4.126 -15.418 1.00 0.00 H new ATOM 1440 N THR B 8 3.200 10.242 -17.235 1.00 0.00 N ATOM 1441 CA THR B 8 3.765 11.573 -17.353 1.00 0.00 C ATOM 1442 C THR B 8 4.588 11.898 -16.107 1.00 0.00 C ATOM 1443 O THR B 8 4.072 11.844 -14.986 1.00 0.00 O ATOM 1444 CB THR B 8 2.660 12.631 -17.539 1.00 0.00 C ATOM 1445 OG1 THR B 8 1.869 12.308 -18.692 1.00 0.00 O ATOM 1446 CG2 THR B 8 3.254 14.024 -17.699 1.00 0.00 C ATOM 0 H THR B 8 2.181 10.209 -17.260 1.00 0.00 H new ATOM 0 HA THR B 8 4.409 11.594 -18.232 1.00 0.00 H new ATOM 0 HB THR B 8 2.032 12.627 -16.648 1.00 0.00 H new ATOM 0 HG1 THR B 8 1.167 12.982 -18.806 1.00 0.00 H new ATOM 0 HG21 THR B 8 2.451 14.749 -17.828 1.00 0.00 H new ATOM 0 HG22 THR B 8 3.832 14.277 -16.810 1.00 0.00 H new ATOM 0 HG23 THR B 8 3.905 14.044 -18.573 1.00 0.00 H new ATOM 1454 N ASP B 9 5.865 12.215 -16.312 1.00 0.00 N ATOM 1455 CA ASP B 9 6.796 12.480 -15.215 1.00 0.00 C ATOM 1456 C ASP B 9 6.245 13.555 -14.288 1.00 0.00 C ATOM 1457 O ASP B 9 6.329 13.438 -13.065 1.00 0.00 O ATOM 1458 CB ASP B 9 8.155 12.931 -15.759 1.00 0.00 C ATOM 1459 CG ASP B 9 8.700 12.000 -16.824 1.00 0.00 C ATOM 1460 OD1 ASP B 9 8.263 12.112 -17.991 1.00 0.00 O ATOM 1461 OD2 ASP B 9 9.568 11.161 -16.510 1.00 0.00 O ATOM 0 H ASP B 9 6.283 12.295 -17.239 1.00 0.00 H new ATOM 0 HA ASP B 9 6.921 11.554 -14.654 1.00 0.00 H new ATOM 0 HB2 ASP B 9 8.060 13.934 -16.174 1.00 0.00 H new ATOM 0 HB3 ASP B 9 8.868 12.992 -14.937 1.00 0.00 H new ATOM 1466 N GLU B 10 5.686 14.599 -14.890 1.00 0.00 N ATOM 1467 CA GLU B 10 5.065 15.686 -14.148 1.00 0.00 C ATOM 1468 C GLU B 10 3.990 15.149 -13.209 1.00 0.00 C ATOM 1469 O GLU B 10 4.030 15.400 -12.008 1.00 0.00 O ATOM 1470 CB GLU B 10 4.439 16.685 -15.118 1.00 0.00 C ATOM 1471 CG GLU B 10 4.826 18.126 -14.848 1.00 0.00 C ATOM 1472 CD GLU B 10 6.314 18.362 -14.992 1.00 0.00 C ATOM 1473 OE1 GLU B 10 6.879 18.006 -16.051 1.00 0.00 O ATOM 1474 OE2 GLU B 10 6.918 18.933 -14.065 1.00 0.00 O ATOM 0 H GLU B 10 5.651 14.714 -15.903 1.00 0.00 H new ATOM 0 HA GLU B 10 5.834 16.183 -13.556 1.00 0.00 H new ATOM 0 HB2 GLU B 10 4.734 16.424 -16.134 1.00 0.00 H new ATOM 0 HB3 GLU B 10 3.354 16.595 -15.068 1.00 0.00 H new ATOM 0 HG2 GLU B 10 4.289 18.778 -15.537 1.00 0.00 H new ATOM 0 HG3 GLU B 10 4.513 18.400 -13.840 1.00 0.00 H new ATOM 1481 N GLN B 11 3.048 14.394 -13.771 1.00 0.00 N ATOM 1482 CA GLN B 11 1.926 13.850 -13.013 1.00 0.00 C ATOM 1483 C GLN B 11 2.397 13.107 -11.770 1.00 0.00 C ATOM 1484 O GLN B 11 1.991 13.435 -10.658 1.00 0.00 O ATOM 1485 CB GLN B 11 1.094 12.917 -13.898 1.00 0.00 C ATOM 1486 CG GLN B 11 0.253 13.653 -14.924 1.00 0.00 C ATOM 1487 CD GLN B 11 -0.888 14.418 -14.281 1.00 0.00 C ATOM 1488 OE1 GLN B 11 -0.726 15.565 -13.869 1.00 0.00 O ATOM 1489 NE2 GLN B 11 -2.051 13.788 -14.196 1.00 0.00 N ATOM 0 H GLN B 11 3.042 14.144 -14.760 1.00 0.00 H new ATOM 0 HA GLN B 11 1.308 14.687 -12.688 1.00 0.00 H new ATOM 0 HB2 GLN B 11 1.761 12.226 -14.414 1.00 0.00 H new ATOM 0 HB3 GLN B 11 0.440 12.316 -13.266 1.00 0.00 H new ATOM 0 HG2 GLN B 11 0.885 14.345 -15.481 1.00 0.00 H new ATOM 0 HG3 GLN B 11 -0.149 12.939 -15.643 1.00 0.00 H new ATOM 0 HE21 GLN B 11 -2.142 12.836 -14.550 1.00 0.00 H new ATOM 0 HE22 GLN B 11 -2.855 14.255 -13.776 1.00 0.00 H new ATOM 1498 N VAL B 12 3.268 12.125 -11.964 1.00 0.00 N ATOM 1499 CA VAL B 12 3.756 11.310 -10.858 1.00 0.00 C ATOM 1500 C VAL B 12 4.431 12.173 -9.793 1.00 0.00 C ATOM 1501 O VAL B 12 4.119 12.062 -8.606 1.00 0.00 O ATOM 1502 CB VAL B 12 4.750 10.235 -11.339 1.00 0.00 C ATOM 1503 CG1 VAL B 12 5.243 9.404 -10.165 1.00 0.00 C ATOM 1504 CG2 VAL B 12 4.113 9.348 -12.401 1.00 0.00 C ATOM 0 H VAL B 12 3.651 11.873 -12.875 1.00 0.00 H new ATOM 0 HA VAL B 12 2.886 10.817 -10.425 1.00 0.00 H new ATOM 0 HB VAL B 12 5.608 10.736 -11.788 1.00 0.00 H new ATOM 0 HG11 VAL B 12 5.944 8.650 -10.522 1.00 0.00 H new ATOM 0 HG12 VAL B 12 5.743 10.052 -9.445 1.00 0.00 H new ATOM 0 HG13 VAL B 12 4.396 8.914 -9.685 1.00 0.00 H new ATOM 0 HG21 VAL B 12 4.832 8.596 -12.726 1.00 0.00 H new ATOM 0 HG22 VAL B 12 3.235 8.854 -11.984 1.00 0.00 H new ATOM 0 HG23 VAL B 12 3.815 9.958 -13.254 1.00 0.00 H new ATOM 1514 N GLU B 13 5.334 13.044 -10.231 1.00 0.00 N ATOM 1515 CA GLU B 13 6.096 13.891 -9.321 1.00 0.00 C ATOM 1516 C GLU B 13 5.172 14.761 -8.473 1.00 0.00 C ATOM 1517 O GLU B 13 5.323 14.840 -7.252 1.00 0.00 O ATOM 1518 CB GLU B 13 7.055 14.784 -10.109 1.00 0.00 C ATOM 1519 CG GLU B 13 7.935 15.657 -9.225 1.00 0.00 C ATOM 1520 CD GLU B 13 8.731 16.670 -10.017 1.00 0.00 C ATOM 1521 OE1 GLU B 13 9.679 16.266 -10.720 1.00 0.00 O ATOM 1522 OE2 GLU B 13 8.417 17.876 -9.933 1.00 0.00 O ATOM 0 H GLU B 13 5.557 13.182 -11.217 1.00 0.00 H new ATOM 0 HA GLU B 13 6.665 13.240 -8.658 1.00 0.00 H new ATOM 0 HB2 GLU B 13 7.690 14.158 -10.736 1.00 0.00 H new ATOM 0 HB3 GLU B 13 6.478 15.423 -10.778 1.00 0.00 H new ATOM 0 HG2 GLU B 13 7.311 16.178 -8.499 1.00 0.00 H new ATOM 0 HG3 GLU B 13 8.619 15.023 -8.661 1.00 0.00 H new ATOM 1529 N LYS B 14 4.203 15.399 -9.124 1.00 0.00 N ATOM 1530 CA LYS B 14 3.339 16.353 -8.440 1.00 0.00 C ATOM 1531 C LYS B 14 2.422 15.642 -7.457 1.00 0.00 C ATOM 1532 O LYS B 14 2.265 16.084 -6.322 1.00 0.00 O ATOM 1533 CB LYS B 14 2.502 17.176 -9.433 1.00 0.00 C ATOM 1534 CG LYS B 14 3.312 17.843 -10.536 1.00 0.00 C ATOM 1535 CD LYS B 14 4.529 18.576 -9.995 1.00 0.00 C ATOM 1536 CE LYS B 14 5.348 19.177 -11.126 1.00 0.00 C ATOM 1537 NZ LYS B 14 6.672 19.672 -10.665 1.00 0.00 N ATOM 0 H LYS B 14 3.998 15.274 -10.115 1.00 0.00 H new ATOM 0 HA LYS B 14 3.987 17.038 -7.893 1.00 0.00 H new ATOM 0 HB2 LYS B 14 1.757 16.524 -9.889 1.00 0.00 H new ATOM 0 HB3 LYS B 14 1.959 17.944 -8.882 1.00 0.00 H new ATOM 0 HG2 LYS B 14 3.634 17.089 -11.254 1.00 0.00 H new ATOM 0 HG3 LYS B 14 2.677 18.546 -11.076 1.00 0.00 H new ATOM 0 HD2 LYS B 14 4.210 19.364 -9.313 1.00 0.00 H new ATOM 0 HD3 LYS B 14 5.147 17.887 -9.419 1.00 0.00 H new ATOM 0 HE2 LYS B 14 5.494 18.427 -11.904 1.00 0.00 H new ATOM 0 HE3 LYS B 14 4.792 19.999 -11.576 1.00 0.00 H new ATOM 0 HZ1 LYS B 14 6.968 20.474 -11.257 1.00 0.00 H new ATOM 0 HZ2 LYS B 14 6.602 19.981 -9.674 1.00 0.00 H new ATOM 0 HZ3 LYS B 14 7.374 18.908 -10.741 1.00 0.00 H new ATOM 1551 N ILE B 15 1.840 14.528 -7.885 1.00 0.00 N ATOM 1552 CA ILE B 15 0.901 13.787 -7.048 1.00 0.00 C ATOM 1553 C ILE B 15 1.597 13.232 -5.807 1.00 0.00 C ATOM 1554 O ILE B 15 1.034 13.261 -4.712 1.00 0.00 O ATOM 1555 CB ILE B 15 0.219 12.642 -7.830 1.00 0.00 C ATOM 1556 CG1 ILE B 15 -0.552 13.207 -9.025 1.00 0.00 C ATOM 1557 CG2 ILE B 15 -0.721 11.866 -6.923 1.00 0.00 C ATOM 1558 CD1 ILE B 15 -1.164 12.146 -9.914 1.00 0.00 C ATOM 0 H ILE B 15 2.001 14.118 -8.805 1.00 0.00 H new ATOM 0 HA ILE B 15 0.128 14.489 -6.734 1.00 0.00 H new ATOM 0 HB ILE B 15 0.990 11.963 -8.195 1.00 0.00 H new ATOM 0 HG12 ILE B 15 -1.343 13.861 -8.659 1.00 0.00 H new ATOM 0 HG13 ILE B 15 0.121 13.823 -9.621 1.00 0.00 H new ATOM 0 HG21 ILE B 15 -1.193 11.063 -7.490 1.00 0.00 H new ATOM 0 HG22 ILE B 15 -0.157 11.441 -6.093 1.00 0.00 H new ATOM 0 HG23 ILE B 15 -1.488 12.536 -6.535 1.00 0.00 H new ATOM 0 HD11 ILE B 15 -1.694 12.623 -10.738 1.00 0.00 H new ATOM 0 HD12 ILE B 15 -0.377 11.505 -10.311 1.00 0.00 H new ATOM 0 HD13 ILE B 15 -1.863 11.544 -9.334 1.00 0.00 H new ATOM 1570 N LEU B 16 2.828 12.753 -5.974 1.00 0.00 N ATOM 1571 CA LEU B 16 3.607 12.260 -4.843 1.00 0.00 C ATOM 1572 C LEU B 16 3.840 13.373 -3.827 1.00 0.00 C ATOM 1573 O LEU B 16 3.686 13.167 -2.623 1.00 0.00 O ATOM 1574 CB LEU B 16 4.947 11.687 -5.310 1.00 0.00 C ATOM 1575 CG LEU B 16 4.855 10.366 -6.074 1.00 0.00 C ATOM 1576 CD1 LEU B 16 6.231 9.934 -6.554 1.00 0.00 C ATOM 1577 CD2 LEU B 16 4.233 9.288 -5.197 1.00 0.00 C ATOM 0 H LEU B 16 3.304 12.696 -6.875 1.00 0.00 H new ATOM 0 HA LEU B 16 3.038 11.462 -4.366 1.00 0.00 H new ATOM 0 HB2 LEU B 16 5.438 12.424 -5.946 1.00 0.00 H new ATOM 0 HB3 LEU B 16 5.586 11.542 -4.439 1.00 0.00 H new ATOM 0 HG LEU B 16 4.217 10.513 -6.945 1.00 0.00 H new ATOM 0 HD11 LEU B 16 6.148 8.992 -7.096 1.00 0.00 H new ATOM 0 HD12 LEU B 16 6.642 10.698 -7.214 1.00 0.00 H new ATOM 0 HD13 LEU B 16 6.891 9.802 -5.696 1.00 0.00 H new ATOM 0 HD21 LEU B 16 4.174 8.354 -5.755 1.00 0.00 H new ATOM 0 HD22 LEU B 16 4.848 9.142 -4.309 1.00 0.00 H new ATOM 0 HD23 LEU B 16 3.231 9.595 -4.898 1.00 0.00 H new ATOM 1589 N ALA B 17 4.191 14.558 -4.323 1.00 0.00 N ATOM 1590 CA ALA B 17 4.399 15.716 -3.463 1.00 0.00 C ATOM 1591 C ALA B 17 3.097 16.111 -2.771 1.00 0.00 C ATOM 1592 O ALA B 17 3.089 16.451 -1.590 1.00 0.00 O ATOM 1593 CB ALA B 17 4.950 16.883 -4.271 1.00 0.00 C ATOM 0 H ALA B 17 4.337 14.739 -5.316 1.00 0.00 H new ATOM 0 HA ALA B 17 5.127 15.451 -2.696 1.00 0.00 H new ATOM 0 HB1 ALA B 17 5.100 17.741 -3.615 1.00 0.00 H new ATOM 0 HB2 ALA B 17 5.902 16.598 -4.719 1.00 0.00 H new ATOM 0 HB3 ALA B 17 4.243 17.147 -5.057 1.00 0.00 H new ATOM 1599 N GLU B 18 2.001 16.052 -3.521 1.00 0.00 N ATOM 1600 CA GLU B 18 0.676 16.352 -2.992 1.00 0.00 C ATOM 1601 C GLU B 18 0.339 15.448 -1.810 1.00 0.00 C ATOM 1602 O GLU B 18 -0.016 15.932 -0.735 1.00 0.00 O ATOM 1603 CB GLU B 18 -0.378 16.176 -4.086 1.00 0.00 C ATOM 1604 CG GLU B 18 -0.291 17.207 -5.197 1.00 0.00 C ATOM 1605 CD GLU B 18 -0.965 18.514 -4.845 1.00 0.00 C ATOM 1606 OE1 GLU B 18 -0.462 19.236 -3.960 1.00 0.00 O ATOM 1607 OE2 GLU B 18 -2.011 18.821 -5.455 1.00 0.00 O ATOM 0 H GLU B 18 2.006 15.796 -4.508 1.00 0.00 H new ATOM 0 HA GLU B 18 0.677 17.386 -2.648 1.00 0.00 H new ATOM 0 HB2 GLU B 18 -0.275 15.181 -4.519 1.00 0.00 H new ATOM 0 HB3 GLU B 18 -1.368 16.226 -3.634 1.00 0.00 H new ATOM 0 HG2 GLU B 18 0.757 17.396 -5.428 1.00 0.00 H new ATOM 0 HG3 GLU B 18 -0.748 16.800 -6.099 1.00 0.00 H new ATOM 1614 N VAL B 19 0.459 14.139 -2.014 1.00 0.00 N ATOM 1615 CA VAL B 19 0.143 13.161 -0.972 1.00 0.00 C ATOM 1616 C VAL B 19 1.041 13.352 0.247 1.00 0.00 C ATOM 1617 O VAL B 19 0.563 13.363 1.386 1.00 0.00 O ATOM 1618 CB VAL B 19 0.284 11.713 -1.492 1.00 0.00 C ATOM 1619 CG1 VAL B 19 -0.012 10.707 -0.389 1.00 0.00 C ATOM 1620 CG2 VAL B 19 -0.634 11.480 -2.680 1.00 0.00 C ATOM 0 H VAL B 19 0.773 13.728 -2.893 1.00 0.00 H new ATOM 0 HA VAL B 19 -0.895 13.328 -0.683 1.00 0.00 H new ATOM 0 HB VAL B 19 1.315 11.571 -1.816 1.00 0.00 H new ATOM 0 HG11 VAL B 19 0.094 9.695 -0.781 1.00 0.00 H new ATOM 0 HG12 VAL B 19 0.688 10.853 0.434 1.00 0.00 H new ATOM 0 HG13 VAL B 19 -1.031 10.851 -0.029 1.00 0.00 H new ATOM 0 HG21 VAL B 19 -0.520 10.455 -3.032 1.00 0.00 H new ATOM 0 HG22 VAL B 19 -1.668 11.648 -2.379 1.00 0.00 H new ATOM 0 HG23 VAL B 19 -0.373 12.170 -3.482 1.00 0.00 H new ATOM 1630 N ALA B 20 2.337 13.517 0.002 1.00 0.00 N ATOM 1631 CA ALA B 20 3.296 13.746 1.075 1.00 0.00 C ATOM 1632 C ALA B 20 2.941 15.005 1.861 1.00 0.00 C ATOM 1633 O ALA B 20 3.007 15.022 3.088 1.00 0.00 O ATOM 1634 CB ALA B 20 4.708 13.850 0.518 1.00 0.00 C ATOM 0 H ALA B 20 2.747 13.496 -0.932 1.00 0.00 H new ATOM 0 HA ALA B 20 3.253 12.895 1.754 1.00 0.00 H new ATOM 0 HB1 ALA B 20 5.410 14.021 1.335 1.00 0.00 H new ATOM 0 HB2 ALA B 20 4.966 12.923 0.006 1.00 0.00 H new ATOM 0 HB3 ALA B 20 4.761 14.681 -0.186 1.00 0.00 H new ATOM 1640 N LEU B 21 2.554 16.052 1.139 1.00 0.00 N ATOM 1641 CA LEU B 21 2.166 17.312 1.758 1.00 0.00 C ATOM 1642 C LEU B 21 0.949 17.111 2.657 1.00 0.00 C ATOM 1643 O LEU B 21 0.896 17.645 3.763 1.00 0.00 O ATOM 1644 CB LEU B 21 1.884 18.361 0.671 1.00 0.00 C ATOM 1645 CG LEU B 21 1.706 19.806 1.156 1.00 0.00 C ATOM 1646 CD1 LEU B 21 2.124 20.779 0.065 1.00 0.00 C ATOM 1647 CD2 LEU B 21 0.262 20.070 1.554 1.00 0.00 C ATOM 0 H LEU B 21 2.501 16.051 0.120 1.00 0.00 H new ATOM 0 HA LEU B 21 2.985 17.672 2.381 1.00 0.00 H new ATOM 0 HB2 LEU B 21 2.703 18.339 -0.048 1.00 0.00 H new ATOM 0 HB3 LEU B 21 0.982 18.066 0.135 1.00 0.00 H new ATOM 0 HG LEU B 21 2.339 19.951 2.031 1.00 0.00 H new ATOM 0 HD11 LEU B 21 1.994 21.801 0.420 1.00 0.00 H new ATOM 0 HD12 LEU B 21 3.171 20.614 -0.188 1.00 0.00 H new ATOM 0 HD13 LEU B 21 1.507 20.621 -0.820 1.00 0.00 H new ATOM 0 HD21 LEU B 21 0.161 21.101 1.894 1.00 0.00 H new ATOM 0 HD22 LEU B 21 -0.388 19.906 0.695 1.00 0.00 H new ATOM 0 HD23 LEU B 21 -0.023 19.393 2.359 1.00 0.00 H new ATOM 1659 N VAL B 22 -0.013 16.318 2.191 1.00 0.00 N ATOM 1660 CA VAL B 22 -1.207 16.020 2.975 1.00 0.00 C ATOM 1661 C VAL B 22 -0.827 15.348 4.291 1.00 0.00 C ATOM 1662 O VAL B 22 -1.383 15.661 5.347 1.00 0.00 O ATOM 1663 CB VAL B 22 -2.189 15.112 2.200 1.00 0.00 C ATOM 1664 CG1 VAL B 22 -3.370 14.713 3.073 1.00 0.00 C ATOM 1665 CG2 VAL B 22 -2.675 15.802 0.935 1.00 0.00 C ATOM 0 H VAL B 22 0.012 15.871 1.275 1.00 0.00 H new ATOM 0 HA VAL B 22 -1.705 16.968 3.178 1.00 0.00 H new ATOM 0 HB VAL B 22 -1.653 14.206 1.917 1.00 0.00 H new ATOM 0 HG11 VAL B 22 -4.045 14.075 2.503 1.00 0.00 H new ATOM 0 HG12 VAL B 22 -3.010 14.171 3.947 1.00 0.00 H new ATOM 0 HG13 VAL B 22 -3.903 15.608 3.395 1.00 0.00 H new ATOM 0 HG21 VAL B 22 -3.365 15.146 0.405 1.00 0.00 H new ATOM 0 HG22 VAL B 22 -3.186 16.728 1.199 1.00 0.00 H new ATOM 0 HG23 VAL B 22 -1.823 16.028 0.293 1.00 0.00 H new ATOM 1675 N LEU B 23 0.138 14.441 4.224 1.00 0.00 N ATOM 1676 CA LEU B 23 0.603 13.736 5.409 1.00 0.00 C ATOM 1677 C LEU B 23 1.286 14.698 6.375 1.00 0.00 C ATOM 1678 O LEU B 23 1.115 14.596 7.587 1.00 0.00 O ATOM 1679 CB LEU B 23 1.557 12.605 5.019 1.00 0.00 C ATOM 1680 CG LEU B 23 0.966 11.555 4.073 1.00 0.00 C ATOM 1681 CD1 LEU B 23 1.953 10.424 3.845 1.00 0.00 C ATOM 1682 CD2 LEU B 23 -0.347 11.018 4.624 1.00 0.00 C ATOM 0 H LEU B 23 0.614 14.177 3.361 1.00 0.00 H new ATOM 0 HA LEU B 23 -0.262 13.303 5.911 1.00 0.00 H new ATOM 0 HB2 LEU B 23 2.439 13.040 4.549 1.00 0.00 H new ATOM 0 HB3 LEU B 23 1.894 12.105 5.927 1.00 0.00 H new ATOM 0 HG LEU B 23 0.766 12.032 3.114 1.00 0.00 H new ATOM 0 HD11 LEU B 23 1.514 9.689 3.170 1.00 0.00 H new ATOM 0 HD12 LEU B 23 2.867 10.822 3.403 1.00 0.00 H new ATOM 0 HD13 LEU B 23 2.188 9.948 4.797 1.00 0.00 H new ATOM 0 HD21 LEU B 23 -0.752 10.273 3.939 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -0.173 10.559 5.597 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -1.058 11.837 4.732 1.00 0.00 H new ATOM 1694 N GLU B 24 2.035 15.646 5.824 1.00 0.00 N ATOM 1695 CA GLU B 24 2.740 16.637 6.630 1.00 0.00 C ATOM 1696 C GLU B 24 1.771 17.662 7.216 1.00 0.00 C ATOM 1697 O GLU B 24 2.031 18.238 8.272 1.00 0.00 O ATOM 1698 CB GLU B 24 3.811 17.328 5.784 1.00 0.00 C ATOM 1699 CG GLU B 24 4.895 16.375 5.305 1.00 0.00 C ATOM 1700 CD GLU B 24 5.857 15.961 6.401 1.00 0.00 C ATOM 1701 OE1 GLU B 24 5.408 15.682 7.530 1.00 0.00 O ATOM 1702 OE2 GLU B 24 7.075 15.895 6.128 1.00 0.00 O ATOM 0 H GLU B 24 2.170 15.750 4.818 1.00 0.00 H new ATOM 0 HA GLU B 24 3.222 16.125 7.463 1.00 0.00 H new ATOM 0 HB2 GLU B 24 3.338 17.796 4.920 1.00 0.00 H new ATOM 0 HB3 GLU B 24 4.269 18.126 6.368 1.00 0.00 H new ATOM 0 HG2 GLU B 24 4.427 15.484 4.887 1.00 0.00 H new ATOM 0 HG3 GLU B 24 5.455 16.849 4.499 1.00 0.00 H new ATOM 1709 N LYS B 25 0.649 17.876 6.537 1.00 0.00 N ATOM 1710 CA LYS B 25 -0.397 18.769 7.032 1.00 0.00 C ATOM 1711 C LYS B 25 -1.002 18.232 8.323 1.00 0.00 C ATOM 1712 O LYS B 25 -1.538 18.984 9.135 1.00 0.00 O ATOM 1713 CB LYS B 25 -1.492 18.939 5.975 1.00 0.00 C ATOM 1714 CG LYS B 25 -1.079 19.813 4.803 1.00 0.00 C ATOM 1715 CD LYS B 25 -1.128 21.287 5.164 1.00 0.00 C ATOM 1716 CE LYS B 25 -2.562 21.781 5.276 1.00 0.00 C ATOM 1717 NZ LYS B 25 -2.629 23.204 5.693 1.00 0.00 N ATOM 0 H LYS B 25 0.439 17.442 5.638 1.00 0.00 H new ATOM 0 HA LYS B 25 0.054 19.739 7.239 1.00 0.00 H new ATOM 0 HB2 LYS B 25 -1.779 17.956 5.601 1.00 0.00 H new ATOM 0 HB3 LYS B 25 -2.375 19.371 6.446 1.00 0.00 H new ATOM 0 HG2 LYS B 25 -0.070 19.548 4.488 1.00 0.00 H new ATOM 0 HG3 LYS B 25 -1.738 19.623 3.956 1.00 0.00 H new ATOM 0 HD2 LYS B 25 -0.610 21.449 6.109 1.00 0.00 H new ATOM 0 HD3 LYS B 25 -0.599 21.867 4.407 1.00 0.00 H new ATOM 0 HE2 LYS B 25 -3.063 21.661 4.315 1.00 0.00 H new ATOM 0 HE3 LYS B 25 -3.102 21.166 5.996 1.00 0.00 H new ATOM 0 HZ1 LYS B 25 -3.624 23.500 5.757 1.00 0.00 H new ATOM 0 HZ2 LYS B 25 -2.174 23.315 6.622 1.00 0.00 H new ATOM 0 HZ3 LYS B 25 -2.136 23.794 4.993 1.00 0.00 H new ATOM 1731 N HIS B 26 -0.912 16.924 8.505 1.00 0.00 N ATOM 1732 CA HIS B 26 -1.426 16.286 9.708 1.00 0.00 C ATOM 1733 C HIS B 26 -0.281 15.780 10.573 1.00 0.00 C ATOM 1734 O HIS B 26 -0.506 15.274 11.671 1.00 0.00 O ATOM 1735 CB HIS B 26 -2.354 15.121 9.350 1.00 0.00 C ATOM 1736 CG HIS B 26 -3.638 15.531 8.692 1.00 0.00 C ATOM 1737 ND1 HIS B 26 -4.839 15.607 9.365 1.00 0.00 N ATOM 1738 CD2 HIS B 26 -3.909 15.864 7.406 1.00 0.00 C ATOM 1739 CE1 HIS B 26 -5.792 15.958 8.521 1.00 0.00 C ATOM 1740 NE2 HIS B 26 -5.253 16.122 7.331 1.00 0.00 N ATOM 0 H HIS B 26 -0.488 16.283 7.835 1.00 0.00 H new ATOM 0 HA HIS B 26 -1.994 17.030 10.267 1.00 0.00 H new ATOM 0 HB2 HIS B 26 -1.822 14.439 8.687 1.00 0.00 H new ATOM 0 HB3 HIS B 26 -2.587 14.565 10.258 1.00 0.00 H new ATOM 0 HD2 HIS B 26 -3.199 15.916 6.594 1.00 0.00 H new ATOM 0 HE1 HIS B 26 -6.836 16.088 8.765 1.00 0.00 H new ATOM 0 HE2 HIS B 26 -5.756 16.397 6.487 1.00 0.00 H new ATOM 1749 N ALA B 27 0.945 15.934 10.065 1.00 0.00 N ATOM 1750 CA ALA B 27 2.143 15.401 10.710 1.00 0.00 C ATOM 1751 C ALA B 27 1.960 13.916 11.025 1.00 0.00 C ATOM 1752 O ALA B 27 2.184 13.469 12.149 1.00 0.00 O ATOM 1753 CB ALA B 27 2.471 16.195 11.969 1.00 0.00 C ATOM 0 H ALA B 27 1.132 16.432 9.195 1.00 0.00 H new ATOM 0 HA ALA B 27 2.984 15.500 10.024 1.00 0.00 H new ATOM 0 HB1 ALA B 27 3.366 15.784 12.436 1.00 0.00 H new ATOM 0 HB2 ALA B 27 2.646 17.238 11.706 1.00 0.00 H new ATOM 0 HB3 ALA B 27 1.636 16.132 12.667 1.00 0.00 H new ATOM 1759 N ALA B 28 1.549 13.165 10.008 1.00 0.00 N ATOM 1760 CA ALA B 28 1.223 11.748 10.155 1.00 0.00 C ATOM 1761 C ALA B 28 2.394 10.933 10.694 1.00 0.00 C ATOM 1762 O ALA B 28 3.542 11.121 10.290 1.00 0.00 O ATOM 1763 CB ALA B 28 0.767 11.175 8.823 1.00 0.00 C ATOM 0 H ALA B 28 1.432 13.520 9.059 1.00 0.00 H new ATOM 0 HA ALA B 28 0.415 11.680 10.884 1.00 0.00 H new ATOM 0 HB1 ALA B 28 0.527 10.119 8.944 1.00 0.00 H new ATOM 0 HB2 ALA B 28 -0.118 11.711 8.480 1.00 0.00 H new ATOM 0 HB3 ALA B 28 1.565 11.284 8.088 1.00 0.00 H new ATOM 1769 N SER B 29 2.092 10.023 11.606 1.00 0.00 N ATOM 1770 CA SER B 29 3.094 9.130 12.162 1.00 0.00 C ATOM 1771 C SER B 29 3.478 8.056 11.136 1.00 0.00 C ATOM 1772 O SER B 29 2.709 7.781 10.213 1.00 0.00 O ATOM 1773 CB SER B 29 2.551 8.497 13.441 1.00 0.00 C ATOM 1774 OG SER B 29 2.121 9.499 14.345 1.00 0.00 O ATOM 0 H SER B 29 1.153 9.883 11.979 1.00 0.00 H new ATOM 0 HA SER B 29 3.994 9.696 12.404 1.00 0.00 H new ATOM 0 HB2 SER B 29 1.720 7.834 13.201 1.00 0.00 H new ATOM 0 HB3 SER B 29 3.323 7.885 13.907 1.00 0.00 H new ATOM 0 HG SER B 29 1.774 9.078 15.159 1.00 0.00 H new ATOM 1780 N PRO B 30 4.668 7.441 11.280 1.00 0.00 N ATOM 1781 CA PRO B 30 5.197 6.473 10.305 1.00 0.00 C ATOM 1782 C PRO B 30 4.237 5.329 9.982 1.00 0.00 C ATOM 1783 O PRO B 30 3.974 5.051 8.811 1.00 0.00 O ATOM 1784 CB PRO B 30 6.456 5.934 10.980 1.00 0.00 C ATOM 1785 CG PRO B 30 6.874 7.011 11.920 1.00 0.00 C ATOM 1786 CD PRO B 30 5.605 7.653 12.401 1.00 0.00 C ATOM 0 HA PRO B 30 5.373 6.952 9.342 1.00 0.00 H new ATOM 0 HB2 PRO B 30 6.253 5.003 11.510 1.00 0.00 H new ATOM 0 HB3 PRO B 30 7.237 5.722 10.249 1.00 0.00 H new ATOM 0 HG2 PRO B 30 7.445 6.602 12.754 1.00 0.00 H new ATOM 0 HG3 PRO B 30 7.515 7.738 11.421 1.00 0.00 H new ATOM 0 HD2 PRO B 30 5.244 7.190 13.320 1.00 0.00 H new ATOM 0 HD3 PRO B 30 5.746 8.713 12.612 1.00 0.00 H new ATOM 1794 N GLU B 31 3.707 4.665 11.006 1.00 0.00 N ATOM 1795 CA GLU B 31 2.813 3.534 10.772 1.00 0.00 C ATOM 1796 C GLU B 31 1.483 4.016 10.197 1.00 0.00 C ATOM 1797 O GLU B 31 0.859 3.325 9.395 1.00 0.00 O ATOM 1798 CB GLU B 31 2.584 2.720 12.049 1.00 0.00 C ATOM 1799 CG GLU B 31 1.875 1.399 11.787 1.00 0.00 C ATOM 1800 CD GLU B 31 1.724 0.540 13.024 1.00 0.00 C ATOM 1801 OE1 GLU B 31 2.686 -0.176 13.376 1.00 0.00 O ATOM 1802 OE2 GLU B 31 0.637 0.556 13.636 1.00 0.00 O ATOM 0 H GLU B 31 3.876 4.884 11.988 1.00 0.00 H new ATOM 0 HA GLU B 31 3.293 2.877 10.046 1.00 0.00 H new ATOM 0 HB2 GLU B 31 3.544 2.523 12.526 1.00 0.00 H new ATOM 0 HB3 GLU B 31 1.995 3.311 12.750 1.00 0.00 H new ATOM 0 HG2 GLU B 31 0.888 1.602 11.372 1.00 0.00 H new ATOM 0 HG3 GLU B 31 2.430 0.841 11.032 1.00 0.00 H new ATOM 1809 N LEU B 32 1.064 5.211 10.599 1.00 0.00 N ATOM 1810 CA LEU B 32 -0.129 5.831 10.031 1.00 0.00 C ATOM 1811 C LEU B 32 0.078 6.094 8.544 1.00 0.00 C ATOM 1812 O LEU B 32 -0.829 5.909 7.735 1.00 0.00 O ATOM 1813 CB LEU B 32 -0.446 7.142 10.758 1.00 0.00 C ATOM 1814 CG LEU B 32 -1.591 7.965 10.162 1.00 0.00 C ATOM 1815 CD1 LEU B 32 -2.875 7.152 10.118 1.00 0.00 C ATOM 1816 CD2 LEU B 32 -1.796 9.240 10.961 1.00 0.00 C ATOM 0 H LEU B 32 1.531 5.769 11.314 1.00 0.00 H new ATOM 0 HA LEU B 32 -0.971 5.150 10.157 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -0.688 6.912 11.796 1.00 0.00 H new ATOM 0 HB3 LEU B 32 0.453 7.758 10.769 1.00 0.00 H new ATOM 0 HG LEU B 32 -1.324 8.233 9.140 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -3.674 7.757 9.691 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -2.723 6.265 9.503 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -3.149 6.850 11.129 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -2.613 9.815 10.525 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -2.040 8.987 11.993 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -0.882 9.834 10.939 1.00 0.00 H new ATOM 1828 N THR B 33 1.286 6.514 8.201 1.00 0.00 N ATOM 1829 CA THR B 33 1.672 6.724 6.817 1.00 0.00 C ATOM 1830 C THR B 33 1.474 5.447 6.000 1.00 0.00 C ATOM 1831 O THR B 33 0.859 5.461 4.932 1.00 0.00 O ATOM 1832 CB THR B 33 3.148 7.163 6.738 1.00 0.00 C ATOM 1833 OG1 THR B 33 3.328 8.424 7.397 1.00 0.00 O ATOM 1834 CG2 THR B 33 3.620 7.258 5.300 1.00 0.00 C ATOM 0 H THR B 33 2.024 6.718 8.874 1.00 0.00 H new ATOM 0 HA THR B 33 1.038 7.508 6.403 1.00 0.00 H new ATOM 0 HB THR B 33 3.748 6.405 7.242 1.00 0.00 H new ATOM 0 HG1 THR B 33 3.127 8.326 8.351 1.00 0.00 H new ATOM 0 HG21 THR B 33 4.664 7.570 5.280 1.00 0.00 H new ATOM 0 HG22 THR B 33 3.523 6.284 4.820 1.00 0.00 H new ATOM 0 HG23 THR B 33 3.013 7.988 4.765 1.00 0.00 H new ATOM 1842 N LEU B 34 1.978 4.341 6.529 1.00 0.00 N ATOM 1843 CA LEU B 34 1.866 3.064 5.850 1.00 0.00 C ATOM 1844 C LEU B 34 0.419 2.584 5.862 1.00 0.00 C ATOM 1845 O LEU B 34 -0.023 1.890 4.948 1.00 0.00 O ATOM 1846 CB LEU B 34 2.767 2.022 6.507 1.00 0.00 C ATOM 1847 CG LEU B 34 3.534 1.139 5.526 1.00 0.00 C ATOM 1848 CD1 LEU B 34 4.820 1.818 5.093 1.00 0.00 C ATOM 1849 CD2 LEU B 34 3.815 -0.228 6.130 1.00 0.00 C ATOM 0 H LEU B 34 2.466 4.305 7.424 1.00 0.00 H new ATOM 0 HA LEU B 34 2.187 3.198 4.817 1.00 0.00 H new ATOM 0 HB2 LEU B 34 3.482 2.533 7.152 1.00 0.00 H new ATOM 0 HB3 LEU B 34 2.157 1.386 7.149 1.00 0.00 H new ATOM 0 HG LEU B 34 2.913 0.990 4.642 1.00 0.00 H new ATOM 0 HD11 LEU B 34 5.354 1.174 4.394 1.00 0.00 H new ATOM 0 HD12 LEU B 34 4.586 2.765 4.607 1.00 0.00 H new ATOM 0 HD13 LEU B 34 5.446 2.003 5.966 1.00 0.00 H new ATOM 0 HD21 LEU B 34 4.362 -0.838 5.411 1.00 0.00 H new ATOM 0 HD22 LEU B 34 4.411 -0.110 7.035 1.00 0.00 H new ATOM 0 HD23 LEU B 34 2.873 -0.717 6.378 1.00 0.00 H new ATOM 1861 N MET B 35 -0.313 2.958 6.909 1.00 0.00 N ATOM 1862 CA MET B 35 -1.732 2.643 7.007 1.00 0.00 C ATOM 1863 C MET B 35 -2.495 3.296 5.862 1.00 0.00 C ATOM 1864 O MET B 35 -3.383 2.685 5.268 1.00 0.00 O ATOM 1865 CB MET B 35 -2.300 3.119 8.344 1.00 0.00 C ATOM 1866 CG MET B 35 -3.773 2.791 8.531 1.00 0.00 C ATOM 1867 SD MET B 35 -4.477 3.557 10.003 1.00 0.00 S ATOM 1868 CE MET B 35 -3.426 2.876 11.278 1.00 0.00 C ATOM 0 H MET B 35 0.057 3.481 7.703 1.00 0.00 H new ATOM 0 HA MET B 35 -1.847 1.561 6.944 1.00 0.00 H new ATOM 0 HB2 MET B 35 -1.730 2.665 9.154 1.00 0.00 H new ATOM 0 HB3 MET B 35 -2.164 4.197 8.424 1.00 0.00 H new ATOM 0 HG2 MET B 35 -4.329 3.122 7.654 1.00 0.00 H new ATOM 0 HG3 MET B 35 -3.894 1.710 8.596 1.00 0.00 H new ATOM 0 HE1 MET B 35 -4.019 2.675 12.170 1.00 0.00 H new ATOM 0 HE2 MET B 35 -2.979 1.947 10.923 1.00 0.00 H new ATOM 0 HE3 MET B 35 -2.638 3.589 11.519 1.00 0.00 H new ATOM 1878 N ILE B 36 -2.142 4.544 5.559 1.00 0.00 N ATOM 1879 CA ILE B 36 -2.727 5.247 4.424 1.00 0.00 C ATOM 1880 C ILE B 36 -2.460 4.469 3.142 1.00 0.00 C ATOM 1881 O ILE B 36 -3.374 4.217 2.357 1.00 0.00 O ATOM 1882 CB ILE B 36 -2.170 6.686 4.283 1.00 0.00 C ATOM 1883 CG1 ILE B 36 -2.462 7.509 5.541 1.00 0.00 C ATOM 1884 CG2 ILE B 36 -2.751 7.379 3.054 1.00 0.00 C ATOM 1885 CD1 ILE B 36 -3.925 7.539 5.932 1.00 0.00 C ATOM 0 H ILE B 36 -1.455 5.086 6.083 1.00 0.00 H new ATOM 0 HA ILE B 36 -3.800 5.321 4.601 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.090 6.613 4.159 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -1.883 7.103 6.371 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -2.118 8.531 5.382 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -2.344 8.387 2.978 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -2.489 6.814 2.160 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -3.836 7.432 3.145 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -4.049 8.142 6.832 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -4.510 7.973 5.121 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -4.271 6.524 6.125 1.00 0.00 H new ATOM 1897 N ALA B 37 -1.207 4.061 2.958 1.00 0.00 N ATOM 1898 CA ALA B 37 -0.815 3.272 1.794 1.00 0.00 C ATOM 1899 C ALA B 37 -1.606 1.966 1.723 1.00 0.00 C ATOM 1900 O ALA B 37 -2.100 1.585 0.659 1.00 0.00 O ATOM 1901 CB ALA B 37 0.678 2.986 1.829 1.00 0.00 C ATOM 0 H ALA B 37 -0.443 4.265 3.603 1.00 0.00 H new ATOM 0 HA ALA B 37 -1.041 3.852 0.899 1.00 0.00 H new ATOM 0 HB1 ALA B 37 0.956 2.397 0.955 1.00 0.00 H new ATOM 0 HB2 ALA B 37 1.229 3.927 1.823 1.00 0.00 H new ATOM 0 HB3 ALA B 37 0.921 2.429 2.734 1.00 0.00 H new ATOM 1907 N GLY B 38 -1.718 1.287 2.861 1.00 0.00 N ATOM 1908 CA GLY B 38 -2.491 0.059 2.931 1.00 0.00 C ATOM 1909 C GLY B 38 -3.940 0.261 2.545 1.00 0.00 C ATOM 1910 O GLY B 38 -4.505 -0.540 1.799 1.00 0.00 O ATOM 0 H GLY B 38 -1.285 1.567 3.741 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -2.044 -0.686 2.272 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -2.441 -0.340 3.944 1.00 0.00 H new ATOM 1914 N ASN B 39 -4.542 1.334 3.048 1.00 0.00 N ATOM 1915 CA ASN B 39 -5.925 1.664 2.714 1.00 0.00 C ATOM 1916 C ASN B 39 -6.079 1.901 1.219 1.00 0.00 C ATOM 1917 O ASN B 39 -7.047 1.441 0.613 1.00 0.00 O ATOM 1918 CB ASN B 39 -6.404 2.896 3.486 1.00 0.00 C ATOM 1919 CG ASN B 39 -6.929 2.559 4.870 1.00 0.00 C ATOM 1920 OD1 ASN B 39 -8.112 2.275 5.042 1.00 0.00 O ATOM 1921 ND2 ASN B 39 -6.059 2.588 5.868 1.00 0.00 N ATOM 0 H ASN B 39 -4.095 1.990 3.688 1.00 0.00 H new ATOM 0 HA ASN B 39 -6.542 0.813 3.003 1.00 0.00 H new ATOM 0 HB2 ASN B 39 -5.580 3.604 3.578 1.00 0.00 H new ATOM 0 HB3 ASN B 39 -7.189 3.393 2.916 1.00 0.00 H new ATOM 0 HD21 ASN B 39 -6.364 2.370 6.817 1.00 0.00 H new ATOM 0 HD22 ASN B 39 -5.084 2.828 5.688 1.00 0.00 H new ATOM 1928 N ILE B 40 -5.112 2.603 0.629 1.00 0.00 N ATOM 1929 CA ILE B 40 -5.105 2.841 -0.808 1.00 0.00 C ATOM 1930 C ILE B 40 -5.204 1.518 -1.565 1.00 0.00 C ATOM 1931 O ILE B 40 -6.124 1.317 -2.360 1.00 0.00 O ATOM 1932 CB ILE B 40 -3.831 3.592 -1.262 1.00 0.00 C ATOM 1933 CG1 ILE B 40 -3.774 4.989 -0.636 1.00 0.00 C ATOM 1934 CG2 ILE B 40 -3.784 3.689 -2.779 1.00 0.00 C ATOM 1935 CD1 ILE B 40 -2.492 5.736 -0.935 1.00 0.00 C ATOM 0 H ILE B 40 -4.324 3.016 1.128 1.00 0.00 H new ATOM 0 HA ILE B 40 -5.970 3.465 -1.034 1.00 0.00 H new ATOM 0 HB ILE B 40 -2.962 3.028 -0.922 1.00 0.00 H new ATOM 0 HG12 ILE B 40 -4.619 5.575 -0.998 1.00 0.00 H new ATOM 0 HG13 ILE B 40 -3.888 4.899 0.444 1.00 0.00 H new ATOM 0 HG21 ILE B 40 -2.882 4.220 -3.082 1.00 0.00 H new ATOM 0 HG22 ILE B 40 -3.776 2.687 -3.208 1.00 0.00 H new ATOM 0 HG23 ILE B 40 -4.660 4.230 -3.136 1.00 0.00 H new ATOM 0 HD11 ILE B 40 -2.523 6.716 -0.460 1.00 0.00 H new ATOM 0 HD12 ILE B 40 -1.643 5.172 -0.548 1.00 0.00 H new ATOM 0 HD13 ILE B 40 -2.385 5.858 -2.013 1.00 0.00 H new ATOM 1947 N ALA B 41 -4.270 0.612 -1.289 1.00 0.00 N ATOM 1948 CA ALA B 41 -4.261 -0.694 -1.928 1.00 0.00 C ATOM 1949 C ALA B 41 -5.576 -1.425 -1.683 1.00 0.00 C ATOM 1950 O ALA B 41 -6.202 -1.915 -2.618 1.00 0.00 O ATOM 1951 CB ALA B 41 -3.086 -1.518 -1.422 1.00 0.00 C ATOM 0 H ALA B 41 -3.510 0.762 -0.626 1.00 0.00 H new ATOM 0 HA ALA B 41 -4.150 -0.552 -3.003 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -3.090 -2.494 -1.908 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -2.154 -1.002 -1.652 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -3.171 -1.649 -0.343 1.00 0.00 H new ATOM 1957 N THR B 42 -6.005 -1.452 -0.428 1.00 0.00 N ATOM 1958 CA THR B 42 -7.224 -2.151 -0.033 1.00 0.00 C ATOM 1959 C THR B 42 -8.449 -1.647 -0.805 1.00 0.00 C ATOM 1960 O THR B 42 -9.293 -2.440 -1.230 1.00 0.00 O ATOM 1961 CB THR B 42 -7.475 -2.000 1.481 1.00 0.00 C ATOM 1962 OG1 THR B 42 -6.330 -2.457 2.212 1.00 0.00 O ATOM 1963 CG2 THR B 42 -8.703 -2.787 1.918 1.00 0.00 C ATOM 0 H THR B 42 -5.521 -0.992 0.343 1.00 0.00 H new ATOM 0 HA THR B 42 -7.077 -3.204 -0.274 1.00 0.00 H new ATOM 0 HB THR B 42 -7.650 -0.945 1.690 1.00 0.00 H new ATOM 0 HG1 THR B 42 -5.673 -1.733 2.277 1.00 0.00 H new ATOM 0 HG21 THR B 42 -8.854 -2.661 2.990 1.00 0.00 H new ATOM 0 HG22 THR B 42 -9.579 -2.421 1.383 1.00 0.00 H new ATOM 0 HG23 THR B 42 -8.557 -3.844 1.694 1.00 0.00 H new ATOM 1971 N ASN B 43 -8.544 -0.335 -0.994 1.00 0.00 N ATOM 1972 CA ASN B 43 -9.690 0.245 -1.691 1.00 0.00 C ATOM 1973 C ASN B 43 -9.613 -0.025 -3.190 1.00 0.00 C ATOM 1974 O ASN B 43 -10.621 -0.341 -3.821 1.00 0.00 O ATOM 1975 CB ASN B 43 -9.801 1.755 -1.444 1.00 0.00 C ATOM 1976 CG ASN B 43 -10.336 2.109 -0.063 1.00 0.00 C ATOM 1977 OD1 ASN B 43 -10.044 1.284 0.932 1.00 0.00 O flip ATOM 1978 ND2 ASN B 43 -11.007 3.123 0.108 1.00 0.00 N flip ATOM 0 H ASN B 43 -7.850 0.342 -0.679 1.00 0.00 H new ATOM 0 HA ASN B 43 -10.582 -0.235 -1.288 1.00 0.00 H new ATOM 0 HB2 ASN B 43 -8.818 2.209 -1.571 1.00 0.00 H new ATOM 0 HB3 ASN B 43 -10.454 2.191 -2.200 1.00 0.00 H new ATOM 0 HD21 ASN B 43 -11.214 3.737 -0.680 1.00 0.00 H new ATOM 0 HD22 ASN B 43 -11.358 3.352 1.038 1.00 0.00 H new ATOM 1985 N VAL B 44 -8.416 0.091 -3.758 1.00 0.00 N ATOM 1986 CA VAL B 44 -8.217 -0.182 -5.181 1.00 0.00 C ATOM 1987 C VAL B 44 -8.482 -1.655 -5.482 1.00 0.00 C ATOM 1988 O VAL B 44 -9.092 -1.995 -6.499 1.00 0.00 O ATOM 1989 CB VAL B 44 -6.788 0.192 -5.639 1.00 0.00 C ATOM 1990 CG1 VAL B 44 -6.561 -0.183 -7.099 1.00 0.00 C ATOM 1991 CG2 VAL B 44 -6.535 1.678 -5.429 1.00 0.00 C ATOM 0 H VAL B 44 -7.572 0.371 -3.259 1.00 0.00 H new ATOM 0 HA VAL B 44 -8.925 0.436 -5.734 1.00 0.00 H new ATOM 0 HB VAL B 44 -6.082 -0.375 -5.032 1.00 0.00 H new ATOM 0 HG11 VAL B 44 -5.548 0.092 -7.392 1.00 0.00 H new ATOM 0 HG12 VAL B 44 -6.696 -1.257 -7.224 1.00 0.00 H new ATOM 0 HG13 VAL B 44 -7.277 0.348 -7.727 1.00 0.00 H new ATOM 0 HG21 VAL B 44 -5.525 1.925 -5.756 1.00 0.00 H new ATOM 0 HG22 VAL B 44 -7.256 2.255 -6.008 1.00 0.00 H new ATOM 0 HG23 VAL B 44 -6.643 1.920 -4.372 1.00 0.00 H new ATOM 2001 N LEU B 45 -8.033 -2.523 -4.583 1.00 0.00 N ATOM 2002 CA LEU B 45 -8.265 -3.952 -4.725 1.00 0.00 C ATOM 2003 C LEU B 45 -9.750 -4.265 -4.603 1.00 0.00 C ATOM 2004 O LEU B 45 -10.271 -5.119 -5.311 1.00 0.00 O ATOM 2005 CB LEU B 45 -7.473 -4.740 -3.680 1.00 0.00 C ATOM 2006 CG LEU B 45 -5.951 -4.619 -3.790 1.00 0.00 C ATOM 2007 CD1 LEU B 45 -5.273 -5.264 -2.591 1.00 0.00 C ATOM 2008 CD2 LEU B 45 -5.458 -5.251 -5.081 1.00 0.00 C ATOM 0 H LEU B 45 -7.507 -2.261 -3.749 1.00 0.00 H new ATOM 0 HA LEU B 45 -7.922 -4.253 -5.715 1.00 0.00 H new ATOM 0 HB2 LEU B 45 -7.778 -4.406 -2.688 1.00 0.00 H new ATOM 0 HB3 LEU B 45 -7.745 -5.793 -3.759 1.00 0.00 H new ATOM 0 HG LEU B 45 -5.693 -3.560 -3.802 1.00 0.00 H new ATOM 0 HD11 LEU B 45 -4.192 -5.167 -2.689 1.00 0.00 H new ATOM 0 HD12 LEU B 45 -5.601 -4.768 -1.677 1.00 0.00 H new ATOM 0 HD13 LEU B 45 -5.540 -6.320 -2.546 1.00 0.00 H new ATOM 0 HD21 LEU B 45 -4.374 -5.156 -5.142 1.00 0.00 H new ATOM 0 HD22 LEU B 45 -5.731 -6.306 -5.097 1.00 0.00 H new ATOM 0 HD23 LEU B 45 -5.915 -4.745 -5.931 1.00 0.00 H new ATOM 2020 N ASN B 46 -10.429 -3.562 -3.708 1.00 0.00 N ATOM 2021 CA ASN B 46 -11.857 -3.769 -3.504 1.00 0.00 C ATOM 2022 C ASN B 46 -12.667 -3.280 -4.697 1.00 0.00 C ATOM 2023 O ASN B 46 -13.405 -4.048 -5.313 1.00 0.00 O ATOM 2024 CB ASN B 46 -12.341 -3.050 -2.243 1.00 0.00 C ATOM 2025 CG ASN B 46 -12.571 -3.996 -1.082 1.00 0.00 C ATOM 2026 OD1 ASN B 46 -13.648 -4.575 -0.948 1.00 0.00 O ATOM 2027 ND2 ASN B 46 -11.571 -4.148 -0.229 1.00 0.00 N ATOM 0 H ASN B 46 -10.016 -2.845 -3.112 1.00 0.00 H new ATOM 0 HA ASN B 46 -12.008 -4.842 -3.390 1.00 0.00 H new ATOM 0 HB2 ASN B 46 -11.606 -2.298 -1.954 1.00 0.00 H new ATOM 0 HB3 ASN B 46 -13.268 -2.521 -2.464 1.00 0.00 H new ATOM 0 HD21 ASN B 46 -11.677 -4.764 0.577 1.00 0.00 H new ATOM 0 HD22 ASN B 46 -10.694 -3.649 -0.377 1.00 0.00 H new ATOM 2034 N GLN B 47 -12.519 -2.005 -5.028 1.00 0.00 N ATOM 2035 CA GLN B 47 -13.366 -1.376 -6.028 1.00 0.00 C ATOM 2036 C GLN B 47 -12.536 -0.742 -7.134 1.00 0.00 C ATOM 2037 O GLN B 47 -12.349 0.474 -7.133 1.00 0.00 O ATOM 2038 CB GLN B 47 -14.239 -0.304 -5.373 1.00 0.00 C ATOM 2039 CG GLN B 47 -15.009 -0.792 -4.157 1.00 0.00 C ATOM 2040 CD GLN B 47 -15.653 0.343 -3.390 1.00 0.00 C ATOM 2041 OE1 GLN B 47 -16.024 1.367 -3.966 1.00 0.00 O ATOM 2042 NE2 GLN B 47 -15.783 0.174 -2.085 1.00 0.00 N ATOM 0 H GLN B 47 -11.819 -1.387 -4.618 1.00 0.00 H new ATOM 0 HA GLN B 47 -13.996 -2.149 -6.467 1.00 0.00 H new ATOM 0 HB2 GLN B 47 -13.607 0.534 -5.078 1.00 0.00 H new ATOM 0 HB3 GLN B 47 -14.947 0.074 -6.111 1.00 0.00 H new ATOM 0 HG2 GLN B 47 -15.779 -1.495 -4.475 1.00 0.00 H new ATOM 0 HG3 GLN B 47 -14.334 -1.336 -3.497 1.00 0.00 H new ATOM 0 HE21 GLN B 47 -15.462 -0.690 -1.648 1.00 0.00 H new ATOM 0 HE22 GLN B 47 -16.204 0.908 -1.515 1.00 0.00 H new ATOM 2051 N ARG B 48 -12.010 -1.584 -8.034 1.00 0.00 N ATOM 2052 CA ARG B 48 -11.296 -1.135 -9.239 1.00 0.00 C ATOM 2053 C ARG B 48 -10.687 -2.318 -9.981 1.00 0.00 C ATOM 2054 O ARG B 48 -10.911 -2.489 -11.178 1.00 0.00 O ATOM 2055 CB ARG B 48 -10.199 -0.110 -8.924 1.00 0.00 C ATOM 2056 CG ARG B 48 -10.623 1.319 -9.223 1.00 0.00 C ATOM 2057 CD ARG B 48 -9.743 2.334 -8.518 1.00 0.00 C ATOM 2058 NE ARG B 48 -10.299 3.682 -8.607 1.00 0.00 N ATOM 2059 CZ ARG B 48 -11.126 4.208 -7.702 1.00 0.00 C ATOM 2060 NH1 ARG B 48 -11.525 3.484 -6.659 1.00 0.00 N ATOM 2061 NH2 ARG B 48 -11.577 5.447 -7.858 1.00 0.00 N ATOM 0 H ARG B 48 -12.067 -2.599 -7.947 1.00 0.00 H new ATOM 0 HA ARG B 48 -12.037 -0.648 -9.872 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -9.925 -0.190 -7.872 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -9.308 -0.349 -9.505 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -10.584 1.491 -10.299 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -11.659 1.462 -8.915 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -9.631 2.054 -7.470 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -8.746 2.321 -8.959 1.00 0.00 H new ATOM 0 HE ARG B 48 -10.039 4.256 -9.409 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -11.198 2.524 -6.550 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -12.157 3.889 -5.969 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -11.291 5.995 -8.669 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -12.209 5.850 -7.167 1.00 0.00 H new ATOM 2075 N VAL B 49 -9.914 -3.130 -9.275 1.00 0.00 N ATOM 2076 CA VAL B 49 -9.262 -4.275 -9.897 1.00 0.00 C ATOM 2077 C VAL B 49 -10.239 -5.445 -10.027 1.00 0.00 C ATOM 2078 O VAL B 49 -11.233 -5.527 -9.295 1.00 0.00 O ATOM 2079 CB VAL B 49 -8.012 -4.717 -9.097 1.00 0.00 C ATOM 2080 CG1 VAL B 49 -8.402 -5.434 -7.816 1.00 0.00 C ATOM 2081 CG2 VAL B 49 -7.099 -5.590 -9.943 1.00 0.00 C ATOM 0 H VAL B 49 -9.723 -3.020 -8.279 1.00 0.00 H new ATOM 0 HA VAL B 49 -8.939 -3.969 -10.892 1.00 0.00 H new ATOM 0 HB VAL B 49 -7.463 -3.816 -8.825 1.00 0.00 H new ATOM 0 HG11 VAL B 49 -7.502 -5.731 -7.277 1.00 0.00 H new ATOM 0 HG12 VAL B 49 -8.995 -4.766 -7.191 1.00 0.00 H new ATOM 0 HG13 VAL B 49 -8.989 -6.320 -8.059 1.00 0.00 H new ATOM 0 HG21 VAL B 49 -6.230 -5.885 -9.355 1.00 0.00 H new ATOM 0 HG22 VAL B 49 -7.640 -6.481 -10.262 1.00 0.00 H new ATOM 0 HG23 VAL B 49 -6.771 -5.031 -10.820 1.00 0.00 H new ATOM 2091 N ALA B 50 -9.960 -6.339 -10.966 1.00 0.00 N ATOM 2092 CA ALA B 50 -10.784 -7.521 -11.170 1.00 0.00 C ATOM 2093 C ALA B 50 -10.607 -8.493 -10.013 1.00 0.00 C ATOM 2094 O ALA B 50 -9.525 -8.580 -9.441 1.00 0.00 O ATOM 2095 CB ALA B 50 -10.427 -8.192 -12.487 1.00 0.00 C ATOM 0 H ALA B 50 -9.165 -6.267 -11.601 1.00 0.00 H new ATOM 0 HA ALA B 50 -11.830 -7.216 -11.209 1.00 0.00 H new ATOM 0 HB1 ALA B 50 -11.051 -9.075 -12.627 1.00 0.00 H new ATOM 0 HB2 ALA B 50 -10.596 -7.495 -13.308 1.00 0.00 H new ATOM 0 HB3 ALA B 50 -9.378 -8.488 -12.472 1.00 0.00 H new ATOM 2101 N ALA B 51 -11.668 -9.208 -9.660 1.00 0.00 N ATOM 2102 CA ALA B 51 -11.598 -10.217 -8.603 1.00 0.00 C ATOM 2103 C ALA B 51 -10.560 -11.282 -8.939 1.00 0.00 C ATOM 2104 O ALA B 51 -9.827 -11.754 -8.068 1.00 0.00 O ATOM 2105 CB ALA B 51 -12.962 -10.856 -8.390 1.00 0.00 C ATOM 0 H ALA B 51 -12.588 -9.110 -10.088 1.00 0.00 H new ATOM 0 HA ALA B 51 -11.295 -9.724 -7.680 1.00 0.00 H new ATOM 0 HB1 ALA B 51 -12.894 -11.605 -7.601 1.00 0.00 H new ATOM 0 HB2 ALA B 51 -13.682 -10.090 -8.102 1.00 0.00 H new ATOM 0 HB3 ALA B 51 -13.289 -11.332 -9.314 1.00 0.00 H new ATOM 2111 N SER B 52 -10.487 -11.639 -10.210 1.00 0.00 N ATOM 2112 CA SER B 52 -9.517 -12.613 -10.685 1.00 0.00 C ATOM 2113 C SER B 52 -8.099 -12.061 -10.582 1.00 0.00 C ATOM 2114 O SER B 52 -7.139 -12.805 -10.391 1.00 0.00 O ATOM 2115 CB SER B 52 -9.835 -12.959 -12.132 1.00 0.00 C ATOM 2116 OG SER B 52 -11.222 -13.207 -12.281 1.00 0.00 O ATOM 0 H SER B 52 -11.095 -11.265 -10.939 1.00 0.00 H new ATOM 0 HA SER B 52 -9.577 -13.508 -10.065 1.00 0.00 H new ATOM 0 HB2 SER B 52 -9.532 -12.140 -12.785 1.00 0.00 H new ATOM 0 HB3 SER B 52 -9.266 -13.837 -12.437 1.00 0.00 H new ATOM 0 HG SER B 52 -11.416 -13.427 -13.216 1.00 0.00 H new ATOM 2122 N GLN B 53 -7.985 -10.745 -10.680 1.00 0.00 N ATOM 2123 CA GLN B 53 -6.691 -10.082 -10.698 1.00 0.00 C ATOM 2124 C GLN B 53 -6.333 -9.590 -9.303 1.00 0.00 C ATOM 2125 O GLN B 53 -5.226 -9.127 -9.066 1.00 0.00 O ATOM 2126 CB GLN B 53 -6.744 -8.896 -11.663 1.00 0.00 C ATOM 2127 CG GLN B 53 -5.387 -8.463 -12.191 1.00 0.00 C ATOM 2128 CD GLN B 53 -5.508 -7.420 -13.280 1.00 0.00 C ATOM 2129 OE1 GLN B 53 -5.516 -6.221 -13.011 1.00 0.00 O ATOM 2130 NE2 GLN B 53 -5.610 -7.871 -14.518 1.00 0.00 N ATOM 0 H GLN B 53 -8.781 -10.111 -10.749 1.00 0.00 H new ATOM 0 HA GLN B 53 -5.931 -10.791 -11.027 1.00 0.00 H new ATOM 0 HB2 GLN B 53 -7.384 -9.156 -12.506 1.00 0.00 H new ATOM 0 HB3 GLN B 53 -7.211 -8.051 -11.157 1.00 0.00 H new ATOM 0 HG2 GLN B 53 -4.790 -8.063 -11.371 1.00 0.00 H new ATOM 0 HG3 GLN B 53 -4.855 -9.332 -12.579 1.00 0.00 H new ATOM 0 HE21 GLN B 53 -5.599 -8.875 -14.698 1.00 0.00 H new ATOM 0 HE22 GLN B 53 -5.700 -7.215 -15.294 1.00 0.00 H new ATOM 2139 N ARG B 54 -7.277 -9.729 -8.386 1.00 0.00 N ATOM 2140 CA ARG B 54 -7.185 -9.112 -7.070 1.00 0.00 C ATOM 2141 C ARG B 54 -5.962 -9.600 -6.297 1.00 0.00 C ATOM 2142 O ARG B 54 -5.084 -8.810 -5.951 1.00 0.00 O ATOM 2143 CB ARG B 54 -8.473 -9.391 -6.295 1.00 0.00 C ATOM 2144 CG ARG B 54 -8.673 -8.514 -5.072 1.00 0.00 C ATOM 2145 CD ARG B 54 -10.151 -8.388 -4.743 1.00 0.00 C ATOM 2146 NE ARG B 54 -10.891 -7.790 -5.857 1.00 0.00 N ATOM 2147 CZ ARG B 54 -12.219 -7.738 -5.942 1.00 0.00 C ATOM 2148 NH1 ARG B 54 -12.976 -8.211 -4.960 1.00 0.00 N ATOM 2149 NH2 ARG B 54 -12.787 -7.179 -7.002 1.00 0.00 N ATOM 0 H ARG B 54 -8.128 -10.272 -8.531 1.00 0.00 H new ATOM 0 HA ARG B 54 -7.063 -8.036 -7.197 1.00 0.00 H new ATOM 0 HB2 ARG B 54 -9.322 -9.257 -6.965 1.00 0.00 H new ATOM 0 HB3 ARG B 54 -8.475 -10.435 -5.982 1.00 0.00 H new ATOM 0 HG2 ARG B 54 -8.140 -8.939 -4.221 1.00 0.00 H new ATOM 0 HG3 ARG B 54 -8.249 -7.526 -5.252 1.00 0.00 H new ATOM 0 HD2 ARG B 54 -10.561 -9.372 -4.517 1.00 0.00 H new ATOM 0 HD3 ARG B 54 -10.277 -7.777 -3.849 1.00 0.00 H new ATOM 0 HE ARG B 54 -10.351 -7.385 -6.622 1.00 0.00 H new ATOM 0 HH11 ARG B 54 -12.541 -8.618 -4.132 1.00 0.00 H new ATOM 0 HH12 ARG B 54 -13.992 -8.167 -5.033 1.00 0.00 H new ATOM 0 HH21 ARG B 54 -12.207 -6.792 -7.747 1.00 0.00 H new ATOM 0 HH22 ARG B 54 -13.804 -7.136 -7.073 1.00 0.00 H new ATOM 2163 N LYS B 55 -5.886 -10.899 -6.043 1.00 0.00 N ATOM 2164 CA LYS B 55 -4.767 -11.445 -5.284 1.00 0.00 C ATOM 2165 C LYS B 55 -3.509 -11.503 -6.148 1.00 0.00 C ATOM 2166 O LYS B 55 -2.396 -11.421 -5.637 1.00 0.00 O ATOM 2167 CB LYS B 55 -5.099 -12.835 -4.730 1.00 0.00 C ATOM 2168 CG LYS B 55 -4.030 -13.375 -3.790 1.00 0.00 C ATOM 2169 CD LYS B 55 -4.437 -14.697 -3.160 1.00 0.00 C ATOM 2170 CE LYS B 55 -3.374 -15.186 -2.188 1.00 0.00 C ATOM 2171 NZ LYS B 55 -3.785 -16.426 -1.481 1.00 0.00 N ATOM 0 H LYS B 55 -6.575 -11.587 -6.346 1.00 0.00 H new ATOM 0 HA LYS B 55 -4.580 -10.781 -4.440 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -6.051 -12.791 -4.201 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -5.228 -13.529 -5.560 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -3.098 -13.508 -4.340 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -3.836 -12.644 -3.005 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -5.386 -14.578 -2.637 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -4.593 -15.443 -3.939 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -2.446 -15.370 -2.730 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -3.167 -14.405 -1.457 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -3.030 -16.721 -0.830 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -4.656 -16.246 -0.942 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -3.958 -17.181 -2.176 1.00 0.00 H new ATOM 2185 N LEU B 56 -3.693 -11.618 -7.459 1.00 0.00 N ATOM 2186 CA LEU B 56 -2.566 -11.699 -8.381 1.00 0.00 C ATOM 2187 C LEU B 56 -1.825 -10.372 -8.464 1.00 0.00 C ATOM 2188 O LEU B 56 -0.596 -10.334 -8.403 1.00 0.00 O ATOM 2189 CB LEU B 56 -3.035 -12.129 -9.771 1.00 0.00 C ATOM 2190 CG LEU B 56 -3.461 -13.590 -9.879 1.00 0.00 C ATOM 2191 CD1 LEU B 56 -3.893 -13.916 -11.299 1.00 0.00 C ATOM 2192 CD2 LEU B 56 -2.324 -14.502 -9.441 1.00 0.00 C ATOM 0 H LEU B 56 -4.609 -11.657 -7.906 1.00 0.00 H new ATOM 0 HA LEU B 56 -1.877 -12.450 -7.995 1.00 0.00 H new ATOM 0 HB2 LEU B 56 -3.873 -11.498 -10.068 1.00 0.00 H new ATOM 0 HB3 LEU B 56 -2.230 -11.946 -10.483 1.00 0.00 H new ATOM 0 HG LEU B 56 -4.312 -13.755 -9.218 1.00 0.00 H new ATOM 0 HD11 LEU B 56 -4.193 -14.962 -11.357 1.00 0.00 H new ATOM 0 HD12 LEU B 56 -4.734 -13.281 -11.578 1.00 0.00 H new ATOM 0 HD13 LEU B 56 -3.062 -13.739 -11.982 1.00 0.00 H new ATOM 0 HD21 LEU B 56 -2.640 -15.542 -9.522 1.00 0.00 H new ATOM 0 HD22 LEU B 56 -1.457 -14.335 -10.080 1.00 0.00 H new ATOM 0 HD23 LEU B 56 -2.060 -14.283 -8.406 1.00 0.00 H new ATOM 2204 N ILE B 57 -2.572 -9.285 -8.592 1.00 0.00 N ATOM 2205 CA ILE B 57 -1.974 -7.963 -8.688 1.00 0.00 C ATOM 2206 C ILE B 57 -1.426 -7.543 -7.324 1.00 0.00 C ATOM 2207 O ILE B 57 -0.460 -6.786 -7.237 1.00 0.00 O ATOM 2208 CB ILE B 57 -2.990 -6.922 -9.231 1.00 0.00 C ATOM 2209 CG1 ILE B 57 -2.269 -5.737 -9.871 1.00 0.00 C ATOM 2210 CG2 ILE B 57 -3.925 -6.429 -8.133 1.00 0.00 C ATOM 2211 CD1 ILE B 57 -3.205 -4.812 -10.621 1.00 0.00 C ATOM 0 H ILE B 57 -3.591 -9.293 -8.632 1.00 0.00 H new ATOM 0 HA ILE B 57 -1.148 -8.005 -9.398 1.00 0.00 H new ATOM 0 HB ILE B 57 -3.589 -7.423 -9.992 1.00 0.00 H new ATOM 0 HG12 ILE B 57 -1.752 -5.172 -9.096 1.00 0.00 H new ATOM 0 HG13 ILE B 57 -1.507 -6.109 -10.557 1.00 0.00 H new ATOM 0 HG21 ILE B 57 -4.623 -5.702 -8.549 1.00 0.00 H new ATOM 0 HG22 ILE B 57 -4.481 -7.272 -7.723 1.00 0.00 H new ATOM 0 HG23 ILE B 57 -3.341 -5.960 -7.341 1.00 0.00 H new ATOM 0 HD11 ILE B 57 -2.635 -3.990 -11.053 1.00 0.00 H new ATOM 0 HD12 ILE B 57 -3.703 -5.366 -11.417 1.00 0.00 H new ATOM 0 HD13 ILE B 57 -3.951 -4.414 -9.933 1.00 0.00 H new ATOM 2223 N ALA B 58 -2.031 -8.077 -6.262 1.00 0.00 N ATOM 2224 CA ALA B 58 -1.550 -7.853 -4.907 1.00 0.00 C ATOM 2225 C ALA B 58 -0.245 -8.608 -4.676 1.00 0.00 C ATOM 2226 O ALA B 58 0.677 -8.088 -4.053 1.00 0.00 O ATOM 2227 CB ALA B 58 -2.598 -8.278 -3.888 1.00 0.00 C ATOM 0 H ALA B 58 -2.859 -8.670 -6.320 1.00 0.00 H new ATOM 0 HA ALA B 58 -1.362 -6.787 -4.780 1.00 0.00 H new ATOM 0 HB1 ALA B 58 -2.219 -8.102 -2.881 1.00 0.00 H new ATOM 0 HB2 ALA B 58 -3.509 -7.698 -4.039 1.00 0.00 H new ATOM 0 HB3 ALA B 58 -2.818 -9.338 -4.013 1.00 0.00 H new ATOM 2233 N GLU B 59 -0.177 -9.835 -5.191 1.00 0.00 N ATOM 2234 CA GLU B 59 1.040 -10.640 -5.121 1.00 0.00 C ATOM 2235 C GLU B 59 2.177 -9.919 -5.837 1.00 0.00 C ATOM 2236 O GLU B 59 3.271 -9.762 -5.293 1.00 0.00 O ATOM 2237 CB GLU B 59 0.811 -12.014 -5.758 1.00 0.00 C ATOM 2238 CG GLU B 59 1.995 -12.962 -5.631 1.00 0.00 C ATOM 2239 CD GLU B 59 2.238 -13.409 -4.204 1.00 0.00 C ATOM 2240 OE1 GLU B 59 1.641 -14.428 -3.792 1.00 0.00 O ATOM 2241 OE2 GLU B 59 3.034 -12.762 -3.497 1.00 0.00 O ATOM 0 H GLU B 59 -0.955 -10.295 -5.664 1.00 0.00 H new ATOM 0 HA GLU B 59 1.306 -10.782 -4.074 1.00 0.00 H new ATOM 0 HB2 GLU B 59 -0.062 -12.476 -5.296 1.00 0.00 H new ATOM 0 HB3 GLU B 59 0.579 -11.879 -6.814 1.00 0.00 H new ATOM 0 HG2 GLU B 59 1.822 -13.838 -6.257 1.00 0.00 H new ATOM 0 HG3 GLU B 59 2.891 -12.470 -6.011 1.00 0.00 H new ATOM 2248 N LYS B 60 1.901 -9.481 -7.064 1.00 0.00 N ATOM 2249 CA LYS B 60 2.857 -8.694 -7.840 1.00 0.00 C ATOM 2250 C LYS B 60 3.332 -7.486 -7.038 1.00 0.00 C ATOM 2251 O LYS B 60 4.531 -7.231 -6.932 1.00 0.00 O ATOM 2252 CB LYS B 60 2.216 -8.225 -9.147 1.00 0.00 C ATOM 2253 CG LYS B 60 1.892 -9.351 -10.115 1.00 0.00 C ATOM 2254 CD LYS B 60 1.071 -8.854 -11.297 1.00 0.00 C ATOM 2255 CE LYS B 60 1.806 -7.783 -12.094 1.00 0.00 C ATOM 2256 NZ LYS B 60 3.039 -8.307 -12.740 1.00 0.00 N ATOM 0 H LYS B 60 1.019 -9.659 -7.544 1.00 0.00 H new ATOM 0 HA LYS B 60 3.716 -9.325 -8.068 1.00 0.00 H new ATOM 0 HB2 LYS B 60 1.299 -7.683 -8.916 1.00 0.00 H new ATOM 0 HB3 LYS B 60 2.888 -7.520 -9.637 1.00 0.00 H new ATOM 0 HG2 LYS B 60 2.818 -9.799 -10.477 1.00 0.00 H new ATOM 0 HG3 LYS B 60 1.342 -10.134 -9.593 1.00 0.00 H new ATOM 0 HD2 LYS B 60 0.833 -9.693 -11.951 1.00 0.00 H new ATOM 0 HD3 LYS B 60 0.124 -8.452 -10.937 1.00 0.00 H new ATOM 0 HE2 LYS B 60 1.141 -7.381 -12.858 1.00 0.00 H new ATOM 0 HE3 LYS B 60 2.068 -6.957 -11.433 1.00 0.00 H new ATOM 0 HZ1 LYS B 60 3.440 -7.579 -13.365 1.00 0.00 H new ATOM 0 HZ2 LYS B 60 3.735 -8.557 -12.009 1.00 0.00 H new ATOM 0 HZ3 LYS B 60 2.806 -9.152 -13.299 1.00 0.00 H new ATOM 2270 N PHE B 61 2.378 -6.758 -6.466 1.00 0.00 N ATOM 2271 CA PHE B 61 2.675 -5.587 -5.653 1.00 0.00 C ATOM 2272 C PHE B 61 3.546 -5.951 -4.453 1.00 0.00 C ATOM 2273 O PHE B 61 4.571 -5.317 -4.206 1.00 0.00 O ATOM 2274 CB PHE B 61 1.372 -4.933 -5.181 1.00 0.00 C ATOM 2275 CG PHE B 61 1.564 -3.852 -4.153 1.00 0.00 C ATOM 2276 CD1 PHE B 61 2.196 -2.665 -4.483 1.00 0.00 C ATOM 2277 CD2 PHE B 61 1.105 -4.025 -2.857 1.00 0.00 C ATOM 2278 CE1 PHE B 61 2.366 -1.671 -3.541 1.00 0.00 C ATOM 2279 CE2 PHE B 61 1.274 -3.035 -1.909 1.00 0.00 C ATOM 2280 CZ PHE B 61 1.905 -1.857 -2.251 1.00 0.00 C ATOM 0 H PHE B 61 1.383 -6.963 -6.553 1.00 0.00 H new ATOM 0 HA PHE B 61 3.231 -4.880 -6.268 1.00 0.00 H new ATOM 0 HB2 PHE B 61 0.857 -4.511 -6.044 1.00 0.00 H new ATOM 0 HB3 PHE B 61 0.721 -5.703 -4.766 1.00 0.00 H new ATOM 0 HD1 PHE B 61 2.560 -2.515 -5.489 1.00 0.00 H new ATOM 0 HD2 PHE B 61 0.609 -4.945 -2.585 1.00 0.00 H new ATOM 0 HE1 PHE B 61 2.859 -0.749 -3.811 1.00 0.00 H new ATOM 0 HE2 PHE B 61 0.913 -3.183 -0.902 1.00 0.00 H new ATOM 0 HZ PHE B 61 2.039 -1.081 -1.512 1.00 0.00 H new ATOM 2290 N ALA B 62 3.136 -6.976 -3.718 1.00 0.00 N ATOM 2291 CA ALA B 62 3.849 -7.395 -2.520 1.00 0.00 C ATOM 2292 C ALA B 62 5.273 -7.822 -2.845 1.00 0.00 C ATOM 2293 O ALA B 62 6.216 -7.402 -2.179 1.00 0.00 O ATOM 2294 CB ALA B 62 3.102 -8.525 -1.830 1.00 0.00 C ATOM 0 H ALA B 62 2.310 -7.534 -3.932 1.00 0.00 H new ATOM 0 HA ALA B 62 3.902 -6.541 -1.844 1.00 0.00 H new ATOM 0 HB1 ALA B 62 3.646 -8.828 -0.936 1.00 0.00 H new ATOM 0 HB2 ALA B 62 2.105 -8.184 -1.550 1.00 0.00 H new ATOM 0 HB3 ALA B 62 3.018 -9.374 -2.509 1.00 0.00 H new ATOM 2300 N GLN B 63 5.433 -8.645 -3.874 1.00 0.00 N ATOM 2301 CA GLN B 63 6.757 -9.111 -4.262 1.00 0.00 C ATOM 2302 C GLN B 63 7.613 -7.957 -4.760 1.00 0.00 C ATOM 2303 O GLN B 63 8.803 -7.891 -4.462 1.00 0.00 O ATOM 2304 CB GLN B 63 6.669 -10.207 -5.324 1.00 0.00 C ATOM 2305 CG GLN B 63 6.036 -11.490 -4.812 1.00 0.00 C ATOM 2306 CD GLN B 63 6.135 -12.639 -5.800 1.00 0.00 C ATOM 2307 OE1 GLN B 63 6.143 -12.325 -7.088 1.00 0.00 O flip ATOM 2308 NE2 GLN B 63 6.211 -13.803 -5.406 1.00 0.00 N flip ATOM 0 H GLN B 63 4.670 -9.000 -4.450 1.00 0.00 H new ATOM 0 HA GLN B 63 7.230 -9.535 -3.376 1.00 0.00 H new ATOM 0 HB2 GLN B 63 6.091 -9.837 -6.171 1.00 0.00 H new ATOM 0 HB3 GLN B 63 7.671 -10.426 -5.694 1.00 0.00 H new ATOM 0 HG2 GLN B 63 6.519 -11.779 -3.878 1.00 0.00 H new ATOM 0 HG3 GLN B 63 4.986 -11.304 -4.584 1.00 0.00 H new ATOM 0 HE21 GLN B 63 6.202 -14.005 -4.406 1.00 0.00 H new ATOM 0 HE22 GLN B 63 6.283 -14.566 -6.079 1.00 0.00 H new ATOM 2317 N ALA B 64 7.005 -7.037 -5.504 1.00 0.00 N ATOM 2318 CA ALA B 64 7.710 -5.849 -5.970 1.00 0.00 C ATOM 2319 C ALA B 64 8.147 -4.995 -4.787 1.00 0.00 C ATOM 2320 O ALA B 64 9.264 -4.475 -4.758 1.00 0.00 O ATOM 2321 CB ALA B 64 6.834 -5.043 -6.916 1.00 0.00 C ATOM 0 H ALA B 64 6.029 -7.092 -5.796 1.00 0.00 H new ATOM 0 HA ALA B 64 8.599 -6.166 -6.515 1.00 0.00 H new ATOM 0 HB1 ALA B 64 7.378 -4.161 -7.253 1.00 0.00 H new ATOM 0 HB2 ALA B 64 6.568 -5.656 -7.777 1.00 0.00 H new ATOM 0 HB3 ALA B 64 5.927 -4.734 -6.397 1.00 0.00 H new ATOM 2327 N LEU B 65 7.264 -4.872 -3.803 1.00 0.00 N ATOM 2328 CA LEU B 65 7.573 -4.147 -2.580 1.00 0.00 C ATOM 2329 C LEU B 65 8.728 -4.822 -1.844 1.00 0.00 C ATOM 2330 O LEU B 65 9.647 -4.157 -1.375 1.00 0.00 O ATOM 2331 CB LEU B 65 6.335 -4.074 -1.677 1.00 0.00 C ATOM 2332 CG LEU B 65 6.491 -3.203 -0.429 1.00 0.00 C ATOM 2333 CD1 LEU B 65 6.837 -1.780 -0.826 1.00 0.00 C ATOM 2334 CD2 LEU B 65 5.217 -3.226 0.403 1.00 0.00 C ATOM 0 H LEU B 65 6.324 -5.268 -3.830 1.00 0.00 H new ATOM 0 HA LEU B 65 7.872 -3.132 -2.842 1.00 0.00 H new ATOM 0 HB2 LEU B 65 5.499 -3.694 -2.264 1.00 0.00 H new ATOM 0 HB3 LEU B 65 6.072 -5.085 -1.365 1.00 0.00 H new ATOM 0 HG LEU B 65 7.303 -3.606 0.177 1.00 0.00 H new ATOM 0 HD11 LEU B 65 6.946 -1.169 0.070 1.00 0.00 H new ATOM 0 HD12 LEU B 65 7.773 -1.775 -1.384 1.00 0.00 H new ATOM 0 HD13 LEU B 65 6.041 -1.372 -1.449 1.00 0.00 H new ATOM 0 HD21 LEU B 65 5.348 -2.601 1.286 1.00 0.00 H new ATOM 0 HD22 LEU B 65 4.387 -2.845 -0.192 1.00 0.00 H new ATOM 0 HD23 LEU B 65 5.002 -4.249 0.711 1.00 0.00 H new ATOM 2346 N MET B 66 8.688 -6.148 -1.779 1.00 0.00 N ATOM 2347 CA MET B 66 9.737 -6.918 -1.115 1.00 0.00 C ATOM 2348 C MET B 66 11.035 -6.887 -1.917 1.00 0.00 C ATOM 2349 O MET B 66 12.109 -7.169 -1.386 1.00 0.00 O ATOM 2350 CB MET B 66 9.293 -8.366 -0.898 1.00 0.00 C ATOM 2351 CG MET B 66 8.077 -8.497 0.002 1.00 0.00 C ATOM 2352 SD MET B 66 8.370 -7.860 1.664 1.00 0.00 S ATOM 2353 CE MET B 66 6.714 -7.932 2.339 1.00 0.00 C ATOM 0 H MET B 66 7.940 -6.714 -2.178 1.00 0.00 H new ATOM 0 HA MET B 66 9.920 -6.456 -0.145 1.00 0.00 H new ATOM 0 HB2 MET B 66 9.071 -8.818 -1.864 1.00 0.00 H new ATOM 0 HB3 MET B 66 10.119 -8.930 -0.464 1.00 0.00 H new ATOM 0 HG2 MET B 66 7.239 -7.962 -0.445 1.00 0.00 H new ATOM 0 HG3 MET B 66 7.788 -9.546 0.065 1.00 0.00 H new ATOM 0 HE1 MET B 66 6.724 -7.570 3.367 1.00 0.00 H new ATOM 0 HE2 MET B 66 6.050 -7.308 1.741 1.00 0.00 H new ATOM 0 HE3 MET B 66 6.358 -8.962 2.321 1.00 0.00 H new ATOM 2363 N SER B 67 10.929 -6.552 -3.197 1.00 0.00 N ATOM 2364 CA SER B 67 12.099 -6.421 -4.052 1.00 0.00 C ATOM 2365 C SER B 67 12.785 -5.080 -3.804 1.00 0.00 C ATOM 2366 O SER B 67 14.015 -4.991 -3.786 1.00 0.00 O ATOM 2367 CB SER B 67 11.699 -6.539 -5.527 1.00 0.00 C ATOM 2368 OG SER B 67 11.086 -7.790 -5.797 1.00 0.00 O ATOM 0 H SER B 67 10.042 -6.366 -3.665 1.00 0.00 H new ATOM 0 HA SER B 67 12.795 -7.225 -3.812 1.00 0.00 H new ATOM 0 HB2 SER B 67 11.013 -5.732 -5.786 1.00 0.00 H new ATOM 0 HB3 SER B 67 12.581 -6.421 -6.156 1.00 0.00 H new ATOM 0 HG SER B 67 10.296 -7.897 -5.226 1.00 0.00 H new ATOM 2374 N SER B 68 11.981 -4.042 -3.602 1.00 0.00 N ATOM 2375 CA SER B 68 12.507 -2.711 -3.351 1.00 0.00 C ATOM 2376 C SER B 68 12.842 -2.540 -1.873 1.00 0.00 C ATOM 2377 O SER B 68 13.529 -1.593 -1.484 1.00 0.00 O ATOM 2378 CB SER B 68 11.499 -1.650 -3.800 1.00 0.00 C ATOM 2379 OG SER B 68 12.083 -0.359 -3.804 1.00 0.00 O ATOM 0 H SER B 68 10.963 -4.100 -3.608 1.00 0.00 H new ATOM 0 HA SER B 68 13.424 -2.584 -3.927 1.00 0.00 H new ATOM 0 HB2 SER B 68 11.134 -1.890 -4.799 1.00 0.00 H new ATOM 0 HB3 SER B 68 10.636 -1.660 -3.135 1.00 0.00 H new ATOM 0 HG SER B 68 12.783 -0.315 -3.120 1.00 0.00 H new ATOM 2385 N LEU B 69 12.340 -3.453 -1.054 1.00 0.00 N ATOM 2386 CA LEU B 69 12.656 -3.471 0.362 1.00 0.00 C ATOM 2387 C LEU B 69 14.132 -3.781 0.559 1.00 0.00 C ATOM 2388 O LEU B 69 14.644 -4.770 0.031 1.00 0.00 O ATOM 2389 CB LEU B 69 11.790 -4.506 1.088 1.00 0.00 C ATOM 2390 CG LEU B 69 12.093 -4.699 2.577 1.00 0.00 C ATOM 2391 CD1 LEU B 69 11.933 -3.391 3.335 1.00 0.00 C ATOM 2392 CD2 LEU B 69 11.189 -5.770 3.170 1.00 0.00 C ATOM 0 H LEU B 69 11.707 -4.196 -1.352 1.00 0.00 H new ATOM 0 HA LEU B 69 12.444 -2.489 0.784 1.00 0.00 H new ATOM 0 HB2 LEU B 69 10.745 -4.215 0.984 1.00 0.00 H new ATOM 0 HB3 LEU B 69 11.906 -5.466 0.585 1.00 0.00 H new ATOM 0 HG LEU B 69 13.129 -5.025 2.674 1.00 0.00 H new ATOM 0 HD11 LEU B 69 12.153 -3.553 4.390 1.00 0.00 H new ATOM 0 HD12 LEU B 69 12.621 -2.649 2.930 1.00 0.00 H new ATOM 0 HD13 LEU B 69 10.909 -3.032 3.229 1.00 0.00 H new ATOM 0 HD21 LEU B 69 11.418 -5.894 4.228 1.00 0.00 H new ATOM 0 HD22 LEU B 69 10.147 -5.470 3.057 1.00 0.00 H new ATOM 0 HD23 LEU B 69 11.354 -6.714 2.650 1.00 0.00 H new ATOM 2404 N GLU B 70 14.807 -2.921 1.304 1.00 0.00 N ATOM 2405 CA GLU B 70 16.235 -3.064 1.540 1.00 0.00 C ATOM 2406 C GLU B 70 16.535 -4.328 2.345 1.00 0.00 C ATOM 2407 O GLU B 70 16.789 -5.386 1.774 1.00 0.00 O ATOM 2408 CB GLU B 70 16.775 -1.833 2.271 1.00 0.00 C ATOM 2409 CG GLU B 70 16.506 -0.527 1.541 1.00 0.00 C ATOM 2410 CD GLU B 70 16.941 0.686 2.337 1.00 0.00 C ATOM 2411 OE1 GLU B 70 18.155 0.981 2.364 1.00 0.00 O ATOM 2412 OE2 GLU B 70 16.070 1.354 2.932 1.00 0.00 O ATOM 0 H GLU B 70 14.386 -2.111 1.759 1.00 0.00 H new ATOM 0 HA GLU B 70 16.731 -3.151 0.574 1.00 0.00 H new ATOM 0 HB2 GLU B 70 16.327 -1.784 3.263 1.00 0.00 H new ATOM 0 HB3 GLU B 70 17.850 -1.946 2.412 1.00 0.00 H new ATOM 0 HG2 GLU B 70 17.028 -0.536 0.584 1.00 0.00 H new ATOM 0 HG3 GLU B 70 15.441 -0.450 1.322 1.00 0.00 H new ATOM 2419 N THR B 71 16.465 -4.209 3.668 1.00 0.00 N ATOM 2420 CA THR B 71 16.795 -5.310 4.568 1.00 0.00 C ATOM 2421 C THR B 71 18.197 -5.855 4.272 1.00 0.00 C ATOM 2422 O THR B 71 18.357 -6.860 3.575 1.00 0.00 O ATOM 2423 CB THR B 71 15.756 -6.445 4.479 1.00 0.00 C ATOM 2424 OG1 THR B 71 14.435 -5.897 4.565 1.00 0.00 O ATOM 2425 CG2 THR B 71 15.953 -7.464 5.594 1.00 0.00 C ATOM 0 H THR B 71 16.180 -3.353 4.144 1.00 0.00 H new ATOM 0 HA THR B 71 16.778 -4.915 5.584 1.00 0.00 H new ATOM 0 HB THR B 71 15.889 -6.951 3.523 1.00 0.00 H new ATOM 0 HG1 THR B 71 13.776 -6.620 4.506 1.00 0.00 H new ATOM 0 HG21 THR B 71 15.205 -8.252 5.504 1.00 0.00 H new ATOM 0 HG22 THR B 71 16.949 -7.899 5.517 1.00 0.00 H new ATOM 0 HG23 THR B 71 15.846 -6.971 6.560 1.00 0.00 H new ATOM 2433 N PRO B 72 19.231 -5.179 4.787 1.00 0.00 N ATOM 2434 CA PRO B 72 20.619 -5.527 4.526 1.00 0.00 C ATOM 2435 C PRO B 72 21.108 -6.656 5.422 1.00 0.00 C ATOM 2436 O PRO B 72 20.874 -6.654 6.634 1.00 0.00 O ATOM 2437 CB PRO B 72 21.386 -4.229 4.834 1.00 0.00 C ATOM 2438 CG PRO B 72 20.361 -3.235 5.297 1.00 0.00 C ATOM 2439 CD PRO B 72 19.140 -4.024 5.672 1.00 0.00 C ATOM 0 HA PRO B 72 20.761 -5.886 3.507 1.00 0.00 H new ATOM 0 HB2 PRO B 72 22.141 -4.396 5.603 1.00 0.00 H new ATOM 0 HB3 PRO B 72 21.908 -3.866 3.948 1.00 0.00 H new ATOM 0 HG2 PRO B 72 20.731 -2.665 6.149 1.00 0.00 H new ATOM 0 HG3 PRO B 72 20.132 -2.518 4.509 1.00 0.00 H new ATOM 0 HD2 PRO B 72 19.151 -4.315 6.722 1.00 0.00 H new ATOM 0 HD3 PRO B 72 18.224 -3.457 5.508 1.00 0.00 H new ATOM 2447 N LYS B 73 21.783 -7.618 4.826 1.00 0.00 N ATOM 2448 CA LYS B 73 22.341 -8.728 5.570 1.00 0.00 C ATOM 2449 C LYS B 73 23.858 -8.635 5.559 1.00 0.00 C ATOM 2450 O LYS B 73 24.546 -9.432 4.922 1.00 0.00 O ATOM 2451 CB LYS B 73 21.864 -10.056 4.982 1.00 0.00 C ATOM 2452 CG LYS B 73 20.351 -10.210 5.010 1.00 0.00 C ATOM 2453 CD LYS B 73 19.832 -10.252 6.437 1.00 0.00 C ATOM 2454 CE LYS B 73 18.316 -10.347 6.480 1.00 0.00 C ATOM 2455 NZ LYS B 73 17.800 -10.237 7.869 1.00 0.00 N ATOM 0 H LYS B 73 21.959 -7.653 3.822 1.00 0.00 H new ATOM 0 HA LYS B 73 21.998 -8.681 6.604 1.00 0.00 H new ATOM 0 HB2 LYS B 73 22.213 -10.137 3.953 1.00 0.00 H new ATOM 0 HB3 LYS B 73 22.317 -10.877 5.538 1.00 0.00 H new ATOM 0 HG2 LYS B 73 19.888 -9.380 4.476 1.00 0.00 H new ATOM 0 HG3 LYS B 73 20.066 -11.124 4.489 1.00 0.00 H new ATOM 0 HD2 LYS B 73 20.265 -11.106 6.957 1.00 0.00 H new ATOM 0 HD3 LYS B 73 20.156 -9.357 6.969 1.00 0.00 H new ATOM 0 HE2 LYS B 73 17.884 -9.556 5.867 1.00 0.00 H new ATOM 0 HE3 LYS B 73 17.998 -11.295 6.047 1.00 0.00 H new ATOM 0 HZ1 LYS B 73 16.762 -10.306 7.860 1.00 0.00 H new ATOM 0 HZ2 LYS B 73 18.193 -11.007 8.447 1.00 0.00 H new ATOM 0 HZ3 LYS B 73 18.083 -9.321 8.273 1.00 0.00 H new ATOM 2469 N THR B 74 24.364 -7.627 6.257 1.00 0.00 N ATOM 2470 CA THR B 74 25.791 -7.356 6.306 1.00 0.00 C ATOM 2471 C THR B 74 26.510 -8.338 7.233 1.00 0.00 C ATOM 2472 O THR B 74 27.715 -8.554 7.098 1.00 0.00 O ATOM 2473 CB THR B 74 26.050 -5.894 6.747 1.00 0.00 C ATOM 2474 OG1 THR B 74 27.445 -5.669 6.979 1.00 0.00 O ATOM 2475 CG2 THR B 74 25.254 -5.548 8.000 1.00 0.00 C ATOM 0 H THR B 74 23.798 -6.977 6.803 1.00 0.00 H new ATOM 0 HA THR B 74 26.195 -7.491 5.303 1.00 0.00 H new ATOM 0 HB THR B 74 25.720 -5.245 5.936 1.00 0.00 H new ATOM 0 HG1 THR B 74 27.585 -4.739 7.255 1.00 0.00 H new ATOM 0 HG21 THR B 74 25.456 -4.516 8.286 1.00 0.00 H new ATOM 0 HG22 THR B 74 24.189 -5.667 7.799 1.00 0.00 H new ATOM 0 HG23 THR B 74 25.547 -6.213 8.812 1.00 0.00 H new ATOM 2483 N HIS B 75 25.749 -8.940 8.155 1.00 0.00 N ATOM 2484 CA HIS B 75 26.263 -9.965 9.075 1.00 0.00 C ATOM 2485 C HIS B 75 27.293 -9.383 10.045 1.00 0.00 C ATOM 2486 O HIS B 75 28.400 -9.016 9.655 1.00 0.00 O ATOM 2487 CB HIS B 75 26.872 -11.138 8.291 1.00 0.00 C ATOM 2488 CG HIS B 75 27.153 -12.359 9.117 1.00 0.00 C ATOM 2489 ND1 HIS B 75 26.490 -13.552 8.934 1.00 0.00 N ATOM 2490 CD2 HIS B 75 28.042 -12.577 10.117 1.00 0.00 C ATOM 2491 CE1 HIS B 75 26.954 -14.448 9.786 1.00 0.00 C ATOM 2492 NE2 HIS B 75 27.897 -13.882 10.515 1.00 0.00 N ATOM 0 H HIS B 75 24.759 -8.731 8.285 1.00 0.00 H new ATOM 0 HA HIS B 75 25.421 -10.333 9.662 1.00 0.00 H new ATOM 0 HB2 HIS B 75 26.193 -11.410 7.483 1.00 0.00 H new ATOM 0 HB3 HIS B 75 27.801 -10.806 7.828 1.00 0.00 H new ATOM 0 HD2 HIS B 75 28.736 -11.857 10.525 1.00 0.00 H new ATOM 0 HE1 HIS B 75 26.618 -15.471 9.872 1.00 0.00 H new ATOM 0 HE2 HIS B 75 28.431 -14.340 11.254 1.00 0.00 H new ATOM 2501 N LEU B 76 26.927 -9.312 11.314 1.00 0.00 N ATOM 2502 CA LEU B 76 27.824 -8.781 12.331 1.00 0.00 C ATOM 2503 C LEU B 76 28.281 -9.877 13.282 1.00 0.00 C ATOM 2504 O LEU B 76 27.507 -10.350 14.122 1.00 0.00 O ATOM 2505 CB LEU B 76 27.161 -7.651 13.132 1.00 0.00 C ATOM 2506 CG LEU B 76 27.110 -6.280 12.445 1.00 0.00 C ATOM 2507 CD1 LEU B 76 28.486 -5.887 11.923 1.00 0.00 C ATOM 2508 CD2 LEU B 76 26.082 -6.265 11.324 1.00 0.00 C ATOM 0 H LEU B 76 26.018 -9.614 11.665 1.00 0.00 H new ATOM 0 HA LEU B 76 28.692 -8.376 11.810 1.00 0.00 H new ATOM 0 HB2 LEU B 76 26.142 -7.953 13.373 1.00 0.00 H new ATOM 0 HB3 LEU B 76 27.693 -7.542 14.077 1.00 0.00 H new ATOM 0 HG LEU B 76 26.803 -5.544 13.188 1.00 0.00 H new ATOM 0 HD11 LEU B 76 28.427 -4.912 11.440 1.00 0.00 H new ATOM 0 HD12 LEU B 76 29.190 -5.838 12.754 1.00 0.00 H new ATOM 0 HD13 LEU B 76 28.827 -6.629 11.202 1.00 0.00 H new ATOM 0 HD21 LEU B 76 26.068 -5.281 10.856 1.00 0.00 H new ATOM 0 HD22 LEU B 76 26.344 -7.017 10.580 1.00 0.00 H new ATOM 0 HD23 LEU B 76 25.096 -6.486 11.732 1.00 0.00 H new ATOM 2520 N GLU B 77 29.532 -10.292 13.132 1.00 0.00 N ATOM 2521 CA GLU B 77 30.141 -11.221 14.070 1.00 0.00 C ATOM 2522 C GLU B 77 30.379 -10.504 15.389 1.00 0.00 C ATOM 2523 O GLU B 77 31.344 -9.755 15.530 1.00 0.00 O ATOM 2524 CB GLU B 77 31.470 -11.758 13.531 1.00 0.00 C ATOM 2525 CG GLU B 77 31.349 -12.559 12.245 1.00 0.00 C ATOM 2526 CD GLU B 77 32.648 -13.253 11.888 1.00 0.00 C ATOM 2527 OE1 GLU B 77 32.971 -14.273 12.531 1.00 0.00 O ATOM 2528 OE2 GLU B 77 33.366 -12.768 10.985 1.00 0.00 O ATOM 0 H GLU B 77 30.143 -9.999 12.370 1.00 0.00 H new ATOM 0 HA GLU B 77 29.468 -12.066 14.214 1.00 0.00 H new ATOM 0 HB2 GLU B 77 32.144 -10.919 13.360 1.00 0.00 H new ATOM 0 HB3 GLU B 77 31.930 -12.386 14.294 1.00 0.00 H new ATOM 0 HG2 GLU B 77 30.558 -13.301 12.353 1.00 0.00 H new ATOM 0 HG3 GLU B 77 31.055 -11.896 11.431 1.00 0.00 H new ATOM 2535 N HIS B 78 29.493 -10.708 16.350 1.00 0.00 N ATOM 2536 CA HIS B 78 29.543 -9.929 17.576 1.00 0.00 C ATOM 2537 C HIS B 78 29.682 -10.814 18.805 1.00 0.00 C ATOM 2538 O HIS B 78 29.265 -10.435 19.894 1.00 0.00 O ATOM 2539 CB HIS B 78 28.309 -9.013 17.693 1.00 0.00 C ATOM 2540 CG HIS B 78 26.981 -9.722 17.767 1.00 0.00 C ATOM 2541 ND1 HIS B 78 26.352 -10.273 16.670 1.00 0.00 N ATOM 2542 CD2 HIS B 78 26.149 -9.935 18.817 1.00 0.00 C ATOM 2543 CE1 HIS B 78 25.195 -10.790 17.041 1.00 0.00 C ATOM 2544 NE2 HIS B 78 25.044 -10.599 18.339 1.00 0.00 N ATOM 0 H HIS B 78 28.741 -11.396 16.307 1.00 0.00 H new ATOM 0 HA HIS B 78 30.433 -9.302 17.528 1.00 0.00 H new ATOM 0 HB2 HIS B 78 28.421 -8.394 18.583 1.00 0.00 H new ATOM 0 HB3 HIS B 78 28.295 -8.340 16.836 1.00 0.00 H new ATOM 0 HD1 HIS B 78 26.723 -10.280 15.720 1.00 0.00 H new ATOM 0 HD2 HIS B 78 26.323 -9.638 19.841 1.00 0.00 H new ATOM 0 HE1 HIS B 78 24.490 -11.286 16.391 1.00 0.00 H new ATOM 2553 N HIS B 79 30.308 -11.978 18.641 1.00 0.00 N ATOM 2554 CA HIS B 79 30.557 -12.859 19.777 1.00 0.00 C ATOM 2555 C HIS B 79 31.876 -12.477 20.456 1.00 0.00 C ATOM 2556 O HIS B 79 32.318 -13.118 21.404 1.00 0.00 O ATOM 2557 CB HIS B 79 30.561 -14.332 19.345 1.00 0.00 C ATOM 2558 CG HIS B 79 30.635 -15.294 20.498 1.00 0.00 C ATOM 2559 ND1 HIS B 79 31.352 -16.469 20.454 1.00 0.00 N ATOM 2560 CD2 HIS B 79 30.093 -15.236 21.738 1.00 0.00 C ATOM 2561 CE1 HIS B 79 31.252 -17.087 21.617 1.00 0.00 C ATOM 2562 NE2 HIS B 79 30.495 -16.359 22.417 1.00 0.00 N ATOM 0 H HIS B 79 30.647 -12.328 17.745 1.00 0.00 H new ATOM 0 HA HIS B 79 29.748 -12.735 20.497 1.00 0.00 H new ATOM 0 HB2 HIS B 79 29.658 -14.536 18.769 1.00 0.00 H new ATOM 0 HB3 HIS B 79 31.408 -14.506 18.682 1.00 0.00 H new ATOM 0 HD2 HIS B 79 29.460 -14.450 22.122 1.00 0.00 H new ATOM 0 HE1 HIS B 79 31.713 -18.030 21.871 1.00 0.00 H new ATOM 0 HE2 HIS B 79 30.250 -16.592 23.379 1.00 0.00 H new ATOM 2571 N HIS B 80 32.505 -11.424 19.950 1.00 0.00 N ATOM 2572 CA HIS B 80 33.653 -10.830 20.627 1.00 0.00 C ATOM 2573 C HIS B 80 33.137 -9.917 21.728 1.00 0.00 C ATOM 2574 O HIS B 80 33.855 -9.552 22.656 1.00 0.00 O ATOM 2575 CB HIS B 80 34.533 -10.042 19.649 1.00 0.00 C ATOM 2576 CG HIS B 80 35.170 -10.887 18.587 1.00 0.00 C ATOM 2577 ND1 HIS B 80 36.532 -11.077 18.489 1.00 0.00 N ATOM 2578 CD2 HIS B 80 34.624 -11.595 17.569 1.00 0.00 C ATOM 2579 CE1 HIS B 80 36.793 -11.859 17.459 1.00 0.00 C ATOM 2580 NE2 HIS B 80 35.653 -12.188 16.887 1.00 0.00 N ATOM 0 H HIS B 80 32.242 -10.965 19.078 1.00 0.00 H new ATOM 0 HA HIS B 80 34.271 -11.622 21.050 1.00 0.00 H new ATOM 0 HB2 HIS B 80 33.928 -9.271 19.172 1.00 0.00 H new ATOM 0 HB3 HIS B 80 35.315 -9.531 20.210 1.00 0.00 H new ATOM 0 HD2 HIS B 80 33.572 -11.677 17.338 1.00 0.00 H new ATOM 0 HE1 HIS B 80 37.775 -12.176 17.139 1.00 0.00 H new ATOM 0 HE2 HIS B 80 35.553 -12.788 16.068 1.00 0.00 H new ATOM 2589 N HIS B 81 31.868 -9.562 21.594 1.00 0.00 N ATOM 2590 CA HIS B 81 31.149 -8.797 22.594 1.00 0.00 C ATOM 2591 C HIS B 81 30.298 -9.773 23.397 1.00 0.00 C ATOM 2592 O HIS B 81 29.280 -10.249 22.900 1.00 0.00 O ATOM 2593 CB HIS B 81 30.274 -7.748 21.898 1.00 0.00 C ATOM 2594 CG HIS B 81 29.594 -6.782 22.820 1.00 0.00 C ATOM 2595 ND1 HIS B 81 29.931 -5.450 22.884 1.00 0.00 N ATOM 2596 CD2 HIS B 81 28.563 -6.948 23.679 1.00 0.00 C ATOM 2597 CE1 HIS B 81 29.136 -4.838 23.742 1.00 0.00 C ATOM 2598 NE2 HIS B 81 28.296 -5.724 24.240 1.00 0.00 N ATOM 0 H HIS B 81 31.305 -9.801 20.778 1.00 0.00 H new ATOM 0 HA HIS B 81 31.834 -8.274 23.261 1.00 0.00 H new ATOM 0 HB2 HIS B 81 30.893 -7.186 21.199 1.00 0.00 H new ATOM 0 HB3 HIS B 81 29.514 -8.262 21.309 1.00 0.00 H new ATOM 0 HD2 HIS B 81 28.045 -7.873 23.886 1.00 0.00 H new ATOM 0 HE1 HIS B 81 29.168 -3.788 23.994 1.00 0.00 H new ATOM 0 HE2 HIS B 81 27.568 -5.532 24.928 1.00 0.00 H new ATOM 2607 N HIS B 82 30.727 -10.061 24.626 1.00 0.00 N ATOM 2608 CA HIS B 82 30.178 -11.168 25.420 1.00 0.00 C ATOM 2609 C HIS B 82 30.645 -12.502 24.850 1.00 0.00 C ATOM 2610 O HIS B 82 30.056 -13.031 23.906 1.00 0.00 O ATOM 2611 CB HIS B 82 28.644 -11.143 25.497 1.00 0.00 C ATOM 2612 CG HIS B 82 28.094 -10.163 26.485 1.00 0.00 C ATOM 2613 ND1 HIS B 82 27.209 -9.167 26.144 1.00 0.00 N ATOM 2614 CD2 HIS B 82 28.289 -10.049 27.818 1.00 0.00 C ATOM 2615 CE1 HIS B 82 26.884 -8.483 27.224 1.00 0.00 C ATOM 2616 NE2 HIS B 82 27.523 -8.997 28.257 1.00 0.00 N ATOM 0 H HIS B 82 31.462 -9.537 25.101 1.00 0.00 H new ATOM 0 HA HIS B 82 30.552 -11.044 26.436 1.00 0.00 H new ATOM 0 HB2 HIS B 82 28.246 -10.908 24.510 1.00 0.00 H new ATOM 0 HB3 HIS B 82 28.288 -12.140 25.755 1.00 0.00 H new ATOM 0 HD2 HIS B 82 28.929 -10.671 28.426 1.00 0.00 H new ATOM 0 HE1 HIS B 82 26.207 -7.642 27.257 1.00 0.00 H new ATOM 0 HE2 HIS B 82 27.459 -8.668 29.220 1.00 0.00 H new ATOM 2625 N HIS B 83 31.720 -13.033 25.414 1.00 0.00 N ATOM 2626 CA HIS B 83 32.275 -14.299 24.948 1.00 0.00 C ATOM 2627 C HIS B 83 31.670 -15.474 25.707 1.00 0.00 C ATOM 2628 O HIS B 83 31.047 -16.338 25.056 1.00 0.00 O ATOM 2629 CB HIS B 83 33.815 -14.317 25.039 1.00 0.00 C ATOM 2630 CG HIS B 83 34.387 -13.979 26.388 1.00 0.00 C ATOM 2631 ND1 HIS B 83 34.472 -14.884 27.423 1.00 0.00 N ATOM 2632 CD2 HIS B 83 34.925 -12.832 26.858 1.00 0.00 C ATOM 2633 CE1 HIS B 83 35.033 -14.308 28.467 1.00 0.00 C ATOM 2634 NE2 HIS B 83 35.321 -13.062 28.152 1.00 0.00 N ATOM 2635 OXT HIS B 83 31.796 -15.520 26.945 1.00 0.00 O ATOM 0 H HIS B 83 32.225 -12.610 26.193 1.00 0.00 H new ATOM 0 HA HIS B 83 32.010 -14.401 23.896 1.00 0.00 H new ATOM 0 HB2 HIS B 83 34.167 -15.308 24.752 1.00 0.00 H new ATOM 0 HB3 HIS B 83 34.213 -13.613 24.308 1.00 0.00 H new ATOM 0 HD2 HIS B 83 35.025 -11.904 26.315 1.00 0.00 H new ATOM 0 HE1 HIS B 83 35.224 -14.778 29.420 1.00 0.00 H new ATOM 0 HE2 HIS B 83 35.765 -12.381 28.768 1.00 0.00 H new TER 2644 HIS B 83