USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1124 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 65 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 108 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 27 THR OG1 : rot 110:sc= -0.286 USER MOD Set 2.2: A 59 ASN : amide:sc= 0.138 X(o=-0.15,f=0.02) USER MOD Set 3.1: A 30 LYS NZ :NH3+ -174:sc= 0.166 (180deg=-0.145) USER MOD Set 3.2: A 46 THR OG1 : rot 77:sc= 0.977 USER MOD Set 4.1: A 36 CYS SG : rot -138:sc= 0.338 USER MOD Set 4.2: A 39 CYS SG : rot 160:sc= -0.0278 USER MOD Set 5.1: A 4 HIS : no HD1:sc= -0.0156 X(o=-0.016,f=-0.016) USER MOD Set 5.2: A 5 THR OG1 : rot 180:sc= 0 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 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 THR OG1 : rot 66:sc= 1.19 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot 165:sc= -0.96 USER MOD Single : A 14 ASN : amide:sc= -0.141 X(o=-0.14,f=-0.028) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot -105:sc= 1.78 USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= -0.0134 X(o=-0.013,f=-0.24) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 GLN : amide:sc= -0.0123 K(o=-0.012,f=-0.86) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 170:sc= 0 USER MOD Single : A 62 THR OG1 : rot -85:sc= -0.264 USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0292) USER MOD Single : A 78 GLN : amide:sc= -0.692 K(o=-0.69,f=-4.1!) USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 39:sc= 0.134 USER MOD Single : A 95 ASN : amide:sc= 0.664 K(o=0.66,f=-4.5!) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 104 ASN : amide:sc= -0.617 X(o=-0.62,f=-0.9) USER MOD Single : A 106 SER OG : rot 22:sc= 0.402 USER MOD Single : A 110 SER OG : rot 89:sc= 1.12 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 GLN : amide:sc= -5.39! C(o=-5.4!,f=-7.2!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 SER OG : rot 179:sc= 0.0195 USER MOD Single : A 129 ASN : amide:sc= 0.126 K(o=0.13,f=-9!) USER MOD Single : A 132 GLN : amide:sc= -2.43! C(o=-2.4!,f=-12!) USER MOD Single : A 141 ASN : amide:sc= 1.01 K(o=1,f=-0.69) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 10.330 -11.515 10.915 1.00 0.00 N ATOM 2 CA MET A 1 9.879 -10.991 12.192 1.00 0.00 C ATOM 3 C MET A 1 9.434 -9.532 12.059 1.00 0.00 C ATOM 4 O MET A 1 10.265 -8.626 12.032 1.00 0.00 O ATOM 5 CB MET A 1 11.012 -11.088 13.214 1.00 0.00 C ATOM 6 CG MET A 1 11.198 -12.530 13.692 1.00 0.00 C ATOM 7 SD MET A 1 12.086 -12.551 15.240 1.00 0.00 S ATOM 8 CE MET A 1 11.608 -14.160 15.849 1.00 0.00 C ATOM 0 H1 MET A 1 10.626 -12.505 11.031 1.00 0.00 H new ATOM 0 H2 MET A 1 9.553 -11.465 10.225 1.00 0.00 H new ATOM 0 H3 MET A 1 11.134 -10.951 10.573 1.00 0.00 H new ATOM 0 HA MET A 1 9.027 -11.583 12.526 1.00 0.00 H new ATOM 0 HB2 MET A 1 11.939 -10.726 12.770 1.00 0.00 H new ATOM 0 HB3 MET A 1 10.794 -10.444 14.066 1.00 0.00 H new ATOM 0 HG2 MET A 1 10.227 -13.009 13.814 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.744 -13.103 12.942 1.00 0.00 H new ATOM 0 HE1 MET A 1 12.078 -14.337 16.816 1.00 0.00 H new ATOM 0 HE2 MET A 1 10.524 -14.200 15.959 1.00 0.00 H new ATOM 0 HE3 MET A 1 11.929 -14.926 15.144 1.00 0.00 H new ATOM 18 N VAL A 2 8.124 -9.351 11.980 1.00 0.00 N ATOM 19 CA VAL A 2 7.559 -8.018 11.851 1.00 0.00 C ATOM 20 C VAL A 2 6.129 -8.021 12.394 1.00 0.00 C ATOM 21 O VAL A 2 5.184 -7.722 11.664 1.00 0.00 O ATOM 22 CB VAL A 2 7.648 -7.551 10.398 1.00 0.00 C ATOM 23 CG1 VAL A 2 6.942 -6.206 10.210 1.00 0.00 C ATOM 24 CG2 VAL A 2 9.103 -7.477 9.934 1.00 0.00 C ATOM 0 H VAL A 2 7.437 -10.105 12.003 1.00 0.00 H new ATOM 0 HA VAL A 2 8.129 -7.302 12.443 1.00 0.00 H new ATOM 0 HB VAL A 2 7.136 -8.287 9.778 1.00 0.00 H new ATOM 0 HG11 VAL A 2 7.020 -5.897 9.168 1.00 0.00 H new ATOM 0 HG12 VAL A 2 5.891 -6.306 10.481 1.00 0.00 H new ATOM 0 HG13 VAL A 2 7.411 -5.456 10.847 1.00 0.00 H new ATOM 0 HG21 VAL A 2 9.138 -7.142 8.897 1.00 0.00 H new ATOM 0 HG22 VAL A 2 9.650 -6.773 10.561 1.00 0.00 H new ATOM 0 HG23 VAL A 2 9.560 -8.463 10.012 1.00 0.00 H new ATOM 34 N PRO A 3 6.010 -8.370 13.703 1.00 0.00 N ATOM 35 CA PRO A 3 4.710 -8.415 14.350 1.00 0.00 C ATOM 36 C PRO A 3 4.195 -7.006 14.644 1.00 0.00 C ATOM 37 O PRO A 3 3.513 -6.404 13.814 1.00 0.00 O ATOM 38 CB PRO A 3 4.925 -9.243 15.607 1.00 0.00 C ATOM 39 CG PRO A 3 6.425 -9.238 15.857 1.00 0.00 C ATOM 40 CD PRO A 3 7.105 -8.730 14.597 1.00 0.00 C ATOM 0 HA PRO A 3 3.942 -8.863 13.720 1.00 0.00 H new ATOM 0 HB2 PRO A 3 4.386 -8.816 16.453 1.00 0.00 H new ATOM 0 HB3 PRO A 3 4.555 -10.259 15.474 1.00 0.00 H new ATOM 0 HG2 PRO A 3 6.668 -8.599 16.706 1.00 0.00 H new ATOM 0 HG3 PRO A 3 6.775 -10.241 16.102 1.00 0.00 H new ATOM 0 HD2 PRO A 3 7.741 -7.871 14.810 1.00 0.00 H new ATOM 0 HD3 PRO A 3 7.742 -9.496 14.154 1.00 0.00 H new ATOM 48 N HIS A 4 4.538 -6.519 15.827 1.00 0.00 N ATOM 49 CA HIS A 4 4.119 -5.191 16.240 1.00 0.00 C ATOM 50 C HIS A 4 4.499 -4.173 15.162 1.00 0.00 C ATOM 51 O HIS A 4 3.813 -3.168 14.983 1.00 0.00 O ATOM 52 CB HIS A 4 4.696 -4.842 17.613 1.00 0.00 C ATOM 53 CG HIS A 4 6.091 -4.265 17.566 1.00 0.00 C ATOM 54 ND1 HIS A 4 7.203 -5.021 17.240 1.00 0.00 N ATOM 55 CD2 HIS A 4 6.542 -3.000 17.805 1.00 0.00 C ATOM 56 CE1 HIS A 4 8.270 -4.238 17.285 1.00 0.00 C ATOM 57 NE2 HIS A 4 7.858 -2.985 17.636 1.00 0.00 N ATOM 0 H HIS A 4 5.102 -7.021 16.513 1.00 0.00 H new ATOM 0 HA HIS A 4 3.035 -5.166 16.348 1.00 0.00 H new ATOM 0 HB2 HIS A 4 4.035 -4.127 18.102 1.00 0.00 H new ATOM 0 HB3 HIS A 4 4.706 -5.740 18.230 1.00 0.00 H new ATOM 0 HD2 HIS A 4 5.931 -2.154 18.084 1.00 0.00 H new ATOM 0 HE1 HIS A 4 9.287 -4.538 17.080 1.00 0.00 H new ATOM 0 HE2 HIS A 4 8.462 -2.171 17.750 1.00 0.00 H new ATOM 66 N THR A 5 5.589 -4.469 14.473 1.00 0.00 N ATOM 67 CA THR A 5 6.069 -3.594 13.416 1.00 0.00 C ATOM 68 C THR A 5 4.985 -3.396 12.356 1.00 0.00 C ATOM 69 O THR A 5 4.615 -2.264 12.045 1.00 0.00 O ATOM 70 CB THR A 5 7.363 -4.189 12.859 1.00 0.00 C ATOM 71 OG1 THR A 5 8.374 -3.712 13.742 1.00 0.00 O ATOM 72 CG2 THR A 5 7.744 -3.595 11.501 1.00 0.00 C ATOM 0 H THR A 5 6.155 -5.304 14.625 1.00 0.00 H new ATOM 0 HA THR A 5 6.292 -2.598 13.798 1.00 0.00 H new ATOM 0 HB THR A 5 7.254 -5.269 12.765 1.00 0.00 H new ATOM 0 HG1 THR A 5 9.247 -4.053 13.454 1.00 0.00 H new ATOM 0 HG21 THR A 5 8.670 -4.052 11.151 1.00 0.00 H new ATOM 0 HG22 THR A 5 6.948 -3.791 10.782 1.00 0.00 H new ATOM 0 HG23 THR A 5 7.886 -2.519 11.601 1.00 0.00 H new ATOM 80 N LEU A 6 4.506 -4.512 11.828 1.00 0.00 N ATOM 81 CA LEU A 6 3.472 -4.476 10.809 1.00 0.00 C ATOM 82 C LEU A 6 2.151 -4.039 11.443 1.00 0.00 C ATOM 83 O LEU A 6 1.402 -3.259 10.857 1.00 0.00 O ATOM 84 CB LEU A 6 3.390 -5.819 10.079 1.00 0.00 C ATOM 85 CG LEU A 6 2.116 -6.065 9.270 1.00 0.00 C ATOM 86 CD1 LEU A 6 2.435 -6.242 7.785 1.00 0.00 C ATOM 87 CD2 LEU A 6 1.329 -7.252 9.831 1.00 0.00 C ATOM 0 H LEU A 6 4.816 -5.449 12.087 1.00 0.00 H new ATOM 0 HA LEU A 6 3.718 -3.739 10.044 1.00 0.00 H new ATOM 0 HB2 LEU A 6 4.244 -5.897 9.407 1.00 0.00 H new ATOM 0 HB3 LEU A 6 3.489 -6.617 10.815 1.00 0.00 H new ATOM 0 HG LEU A 6 1.480 -5.185 9.361 1.00 0.00 H new ATOM 0 HD11 LEU A 6 1.511 -6.416 7.233 1.00 0.00 H new ATOM 0 HD12 LEU A 6 2.920 -5.342 7.407 1.00 0.00 H new ATOM 0 HD13 LEU A 6 3.101 -7.095 7.655 1.00 0.00 H new ATOM 0 HD21 LEU A 6 0.428 -7.405 9.237 1.00 0.00 H new ATOM 0 HD22 LEU A 6 1.946 -8.149 9.791 1.00 0.00 H new ATOM 0 HD23 LEU A 6 1.052 -7.048 10.865 1.00 0.00 H new ATOM 99 N SER A 7 1.903 -4.560 12.637 1.00 0.00 N ATOM 100 CA SER A 7 0.685 -4.234 13.358 1.00 0.00 C ATOM 101 C SER A 7 0.672 -2.746 13.716 1.00 0.00 C ATOM 102 O SER A 7 -0.390 -2.171 13.952 1.00 0.00 O ATOM 103 CB SER A 7 0.548 -5.085 14.621 1.00 0.00 C ATOM 104 OG SER A 7 -0.089 -6.332 14.360 1.00 0.00 O ATOM 0 H SER A 7 2.526 -5.206 13.122 1.00 0.00 H new ATOM 0 HA SER A 7 -0.165 -4.453 12.711 1.00 0.00 H new ATOM 0 HB2 SER A 7 1.536 -5.265 15.045 1.00 0.00 H new ATOM 0 HB3 SER A 7 -0.025 -4.535 15.368 1.00 0.00 H new ATOM 0 HG SER A 7 -0.155 -6.846 15.192 1.00 0.00 H new ATOM 110 N THR A 8 1.862 -2.166 13.744 1.00 0.00 N ATOM 111 CA THR A 8 2.001 -0.757 14.068 1.00 0.00 C ATOM 112 C THR A 8 1.526 0.109 12.900 1.00 0.00 C ATOM 113 O THR A 8 1.078 1.237 13.100 1.00 0.00 O ATOM 114 CB THR A 8 3.457 -0.503 14.460 1.00 0.00 C ATOM 115 OG1 THR A 8 3.512 -0.850 15.841 1.00 0.00 O ATOM 116 CG2 THR A 8 3.820 0.983 14.436 1.00 0.00 C ATOM 0 H THR A 8 2.740 -2.647 13.547 1.00 0.00 H new ATOM 0 HA THR A 8 1.369 -0.482 14.913 1.00 0.00 H new ATOM 0 HB THR A 8 4.114 -1.049 13.783 1.00 0.00 H new ATOM 0 HG1 THR A 8 3.350 -1.811 15.943 1.00 0.00 H new ATOM 0 HG21 THR A 8 4.864 1.107 14.722 1.00 0.00 H new ATOM 0 HG22 THR A 8 3.670 1.378 13.431 1.00 0.00 H new ATOM 0 HG23 THR A 8 3.185 1.524 15.137 1.00 0.00 H new ATOM 124 N LEU A 9 1.641 -0.452 11.706 1.00 0.00 N ATOM 125 CA LEU A 9 1.228 0.254 10.504 1.00 0.00 C ATOM 126 C LEU A 9 -0.278 0.520 10.566 1.00 0.00 C ATOM 127 O LEU A 9 -1.064 -0.197 9.949 1.00 0.00 O ATOM 128 CB LEU A 9 1.667 -0.512 9.255 1.00 0.00 C ATOM 129 CG LEU A 9 3.092 -0.238 8.767 1.00 0.00 C ATOM 130 CD1 LEU A 9 3.261 1.228 8.362 1.00 0.00 C ATOM 131 CD2 LEU A 9 4.121 -0.667 9.814 1.00 0.00 C ATOM 0 H LEU A 9 2.014 -1.387 11.544 1.00 0.00 H new ATOM 0 HA LEU A 9 1.721 1.224 10.444 1.00 0.00 H new ATOM 0 HB2 LEU A 9 1.571 -1.579 9.455 1.00 0.00 H new ATOM 0 HB3 LEU A 9 0.975 -0.276 8.446 1.00 0.00 H new ATOM 0 HG LEU A 9 3.270 -0.840 7.876 1.00 0.00 H new ATOM 0 HD11 LEU A 9 4.282 1.395 8.019 1.00 0.00 H new ATOM 0 HD12 LEU A 9 2.565 1.466 7.558 1.00 0.00 H new ATOM 0 HD13 LEU A 9 3.057 1.868 9.220 1.00 0.00 H new ATOM 0 HD21 LEU A 9 5.125 -0.462 9.443 1.00 0.00 H new ATOM 0 HD22 LEU A 9 3.955 -0.111 10.737 1.00 0.00 H new ATOM 0 HD23 LEU A 9 4.018 -1.734 10.010 1.00 0.00 H new ATOM 143 N LYS A 10 -0.634 1.553 11.316 1.00 0.00 N ATOM 144 CA LYS A 10 -2.031 1.921 11.464 1.00 0.00 C ATOM 145 C LYS A 10 -2.469 2.747 10.254 1.00 0.00 C ATOM 146 O LYS A 10 -1.683 3.519 9.706 1.00 0.00 O ATOM 147 CB LYS A 10 -2.259 2.627 12.804 1.00 0.00 C ATOM 148 CG LYS A 10 -2.215 1.630 13.963 1.00 0.00 C ATOM 149 CD LYS A 10 -3.126 2.077 15.108 1.00 0.00 C ATOM 150 CE LYS A 10 -4.159 0.999 15.442 1.00 0.00 C ATOM 151 NZ LYS A 10 -3.736 0.230 16.634 1.00 0.00 N ATOM 0 H LYS A 10 0.020 2.146 11.827 1.00 0.00 H new ATOM 0 HA LYS A 10 -2.659 1.030 11.486 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -1.498 3.393 12.950 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -3.224 3.134 12.792 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -2.523 0.645 13.612 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -1.191 1.533 14.325 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -2.525 2.296 15.991 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -3.635 3.000 14.832 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -5.129 1.461 15.625 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -4.281 0.327 14.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -4.447 -0.498 16.848 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -2.820 -0.226 16.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -3.643 0.872 17.447 1.00 0.00 H new ATOM 164 N THR A 11 -3.723 2.554 9.869 1.00 0.00 N ATOM 165 CA THR A 11 -4.274 3.273 8.731 1.00 0.00 C ATOM 166 C THR A 11 -4.663 4.695 9.135 1.00 0.00 C ATOM 167 O THR A 11 -4.649 5.033 10.319 1.00 0.00 O ATOM 168 CB THR A 11 -5.444 2.456 8.180 1.00 0.00 C ATOM 169 OG1 THR A 11 -6.244 2.177 9.327 1.00 0.00 O ATOM 170 CG2 THR A 11 -5.014 1.075 7.683 1.00 0.00 C ATOM 0 H THR A 11 -4.372 1.912 10.324 1.00 0.00 H new ATOM 0 HA THR A 11 -3.534 3.386 7.938 1.00 0.00 H new ATOM 0 HB THR A 11 -5.915 3.004 7.364 1.00 0.00 H new ATOM 0 HG1 THR A 11 -7.129 1.868 9.041 1.00 0.00 H new ATOM 0 HG21 THR A 11 -5.883 0.538 7.303 1.00 0.00 H new ATOM 0 HG22 THR A 11 -4.280 1.188 6.885 1.00 0.00 H new ATOM 0 HG23 THR A 11 -4.572 0.513 8.506 1.00 0.00 H new ATOM 178 N ALA A 12 -5.000 5.491 8.131 1.00 0.00 N ATOM 179 CA ALA A 12 -5.393 6.869 8.367 1.00 0.00 C ATOM 180 C ALA A 12 -6.675 6.895 9.202 1.00 0.00 C ATOM 181 O ALA A 12 -7.066 7.943 9.712 1.00 0.00 O ATOM 182 CB ALA A 12 -5.555 7.591 7.028 1.00 0.00 C ATOM 0 H ALA A 12 -5.009 5.207 7.151 1.00 0.00 H new ATOM 0 HA ALA A 12 -4.623 7.395 8.930 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -5.850 8.625 7.206 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -4.609 7.571 6.487 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -6.322 7.092 6.436 1.00 0.00 H new ATOM 188 N ASP A 13 -7.292 5.728 9.316 1.00 0.00 N ATOM 189 CA ASP A 13 -8.521 5.603 10.080 1.00 0.00 C ATOM 190 C ASP A 13 -8.197 5.061 11.474 1.00 0.00 C ATOM 191 O ASP A 13 -9.041 4.431 12.109 1.00 0.00 O ATOM 192 CB ASP A 13 -9.492 4.630 9.408 1.00 0.00 C ATOM 193 CG ASP A 13 -8.856 3.686 8.385 1.00 0.00 C ATOM 194 OD1 ASP A 13 -8.022 4.100 7.567 1.00 0.00 O ATOM 195 OD2 ASP A 13 -9.257 2.462 8.451 1.00 0.00 O ATOM 0 H ASP A 13 -6.963 4.861 8.892 1.00 0.00 H new ATOM 0 HA ASP A 13 -8.982 6.589 10.139 1.00 0.00 H new ATOM 0 HB2 ASP A 13 -9.976 4.032 10.180 1.00 0.00 H new ATOM 0 HB3 ASP A 13 -10.274 5.205 8.912 1.00 0.00 H new ATOM 201 N ASN A 14 -6.974 5.325 11.907 1.00 0.00 N ATOM 202 CA ASN A 14 -6.528 4.872 13.214 1.00 0.00 C ATOM 203 C ASN A 14 -6.855 3.386 13.371 1.00 0.00 C ATOM 204 O ASN A 14 -7.191 2.934 14.465 1.00 0.00 O ATOM 205 CB ASN A 14 -7.241 5.634 14.334 1.00 0.00 C ATOM 206 CG ASN A 14 -6.246 6.454 15.159 1.00 0.00 C ATOM 207 OD1 ASN A 14 -6.390 7.651 15.342 1.00 0.00 O ATOM 208 ND2 ASN A 14 -5.231 5.744 15.642 1.00 0.00 N ATOM 0 H ASN A 14 -6.277 5.847 11.376 1.00 0.00 H new ATOM 0 HA ASN A 14 -5.455 5.048 13.285 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -7.996 6.294 13.906 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -7.763 4.930 14.982 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -4.512 6.199 16.204 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -5.171 4.744 15.450 1.00 0.00 H new ATOM 215 N ARG A 15 -6.744 2.668 12.264 1.00 0.00 N ATOM 216 CA ARG A 15 -7.023 1.242 12.264 1.00 0.00 C ATOM 217 C ARG A 15 -5.727 0.448 12.085 1.00 0.00 C ATOM 218 O ARG A 15 -4.803 0.903 11.412 1.00 0.00 O ATOM 219 CB ARG A 15 -7.999 0.871 11.147 1.00 0.00 C ATOM 220 CG ARG A 15 -9.129 -0.014 11.679 1.00 0.00 C ATOM 221 CD ARG A 15 -10.481 0.424 11.110 1.00 0.00 C ATOM 222 NE ARG A 15 -11.176 1.302 12.078 1.00 0.00 N ATOM 223 CZ ARG A 15 -11.707 0.874 13.243 1.00 0.00 C ATOM 224 NH1 ARG A 15 -11.627 -0.425 13.596 1.00 0.00 N ATOM 225 NH2 ARG A 15 -12.306 1.746 14.032 1.00 0.00 N ATOM 0 H ARG A 15 -6.464 3.047 11.359 1.00 0.00 H new ATOM 0 HA ARG A 15 -7.476 0.993 13.223 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -8.417 1.777 10.709 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -7.466 0.349 10.352 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -8.938 -1.054 11.413 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -9.154 0.037 12.768 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -10.335 0.952 10.168 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -11.095 -0.451 10.894 1.00 0.00 H new ATOM 0 HE ARG A 15 -11.259 2.293 11.850 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -11.162 -1.093 12.981 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -12.031 -0.740 14.478 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -12.363 2.727 13.758 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -12.712 1.439 14.916 1.00 0.00 H new ATOM 238 N PRO A 16 -5.701 -0.758 12.715 1.00 0.00 N ATOM 239 CA PRO A 16 -4.534 -1.620 12.631 1.00 0.00 C ATOM 240 C PRO A 16 -4.448 -2.295 11.260 1.00 0.00 C ATOM 241 O PRO A 16 -5.429 -2.862 10.781 1.00 0.00 O ATOM 242 CB PRO A 16 -4.694 -2.611 13.772 1.00 0.00 C ATOM 243 CG PRO A 16 -6.163 -2.564 14.162 1.00 0.00 C ATOM 244 CD PRO A 16 -6.776 -1.330 13.519 1.00 0.00 C ATOM 0 HA PRO A 16 -3.598 -1.071 12.727 1.00 0.00 H new ATOM 0 HB2 PRO A 16 -4.404 -3.615 13.461 1.00 0.00 H new ATOM 0 HB3 PRO A 16 -4.057 -2.342 14.615 1.00 0.00 H new ATOM 0 HG2 PRO A 16 -6.676 -3.465 13.826 1.00 0.00 H new ATOM 0 HG3 PRO A 16 -6.269 -2.522 15.246 1.00 0.00 H new ATOM 0 HD2 PRO A 16 -7.636 -1.591 12.902 1.00 0.00 H new ATOM 0 HD3 PRO A 16 -7.126 -0.624 14.272 1.00 0.00 H new ATOM 252 N ALA A 17 -3.266 -2.212 10.668 1.00 0.00 N ATOM 253 CA ALA A 17 -3.039 -2.807 9.363 1.00 0.00 C ATOM 254 C ALA A 17 -3.346 -4.304 9.428 1.00 0.00 C ATOM 255 O ALA A 17 -3.777 -4.897 8.441 1.00 0.00 O ATOM 256 CB ALA A 17 -1.603 -2.526 8.916 1.00 0.00 C ATOM 0 H ALA A 17 -2.455 -1.741 11.069 1.00 0.00 H new ATOM 0 HA ALA A 17 -3.704 -2.366 8.621 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -1.433 -2.973 7.936 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -1.445 -1.449 8.856 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -0.907 -2.956 9.637 1.00 0.00 H new ATOM 262 N SER A 18 -3.115 -4.872 10.603 1.00 0.00 N ATOM 263 CA SER A 18 -3.362 -6.289 10.811 1.00 0.00 C ATOM 264 C SER A 18 -4.761 -6.653 10.313 1.00 0.00 C ATOM 265 O SER A 18 -4.988 -7.772 9.854 1.00 0.00 O ATOM 266 CB SER A 18 -3.209 -6.663 12.286 1.00 0.00 C ATOM 267 OG SER A 18 -3.135 -8.073 12.474 1.00 0.00 O ATOM 0 H SER A 18 -2.759 -4.377 11.421 1.00 0.00 H new ATOM 0 HA SER A 18 -2.623 -6.853 10.243 1.00 0.00 H new ATOM 0 HB2 SER A 18 -2.309 -6.196 12.687 1.00 0.00 H new ATOM 0 HB3 SER A 18 -4.053 -6.266 12.850 1.00 0.00 H new ATOM 0 HG SER A 18 -3.036 -8.271 13.429 1.00 0.00 H new ATOM 273 N VAL A 19 -5.664 -5.690 10.421 1.00 0.00 N ATOM 274 CA VAL A 19 -7.034 -5.896 9.986 1.00 0.00 C ATOM 275 C VAL A 19 -7.043 -6.287 8.507 1.00 0.00 C ATOM 276 O VAL A 19 -7.955 -6.974 8.048 1.00 0.00 O ATOM 277 CB VAL A 19 -7.871 -4.649 10.279 1.00 0.00 C ATOM 278 CG1 VAL A 19 -9.300 -4.811 9.760 1.00 0.00 C ATOM 279 CG2 VAL A 19 -7.864 -4.324 11.775 1.00 0.00 C ATOM 0 H VAL A 19 -5.473 -4.764 10.804 1.00 0.00 H new ATOM 0 HA VAL A 19 -7.490 -6.715 10.542 1.00 0.00 H new ATOM 0 HB VAL A 19 -7.418 -3.810 9.751 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -9.872 -3.910 9.982 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -9.280 -4.972 8.682 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -9.769 -5.667 10.246 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -8.466 -3.434 11.957 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -8.281 -5.163 12.332 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -6.840 -4.143 12.103 1.00 0.00 H new ATOM 289 N TYR A 20 -6.018 -5.832 7.801 1.00 0.00 N ATOM 290 CA TYR A 20 -5.896 -6.126 6.383 1.00 0.00 C ATOM 291 C TYR A 20 -4.841 -7.205 6.136 1.00 0.00 C ATOM 292 O TYR A 20 -4.303 -7.311 5.035 1.00 0.00 O ATOM 293 CB TYR A 20 -5.441 -4.824 5.721 1.00 0.00 C ATOM 294 CG TYR A 20 -6.590 -3.907 5.297 1.00 0.00 C ATOM 295 CD1 TYR A 20 -7.386 -4.250 4.221 1.00 0.00 C ATOM 296 CD2 TYR A 20 -6.832 -2.737 5.989 1.00 0.00 C ATOM 297 CE1 TYR A 20 -8.467 -3.386 3.823 1.00 0.00 C ATOM 298 CE2 TYR A 20 -7.913 -1.875 5.590 1.00 0.00 C ATOM 299 CZ TYR A 20 -8.677 -2.241 4.526 1.00 0.00 C ATOM 300 OH TYR A 20 -9.699 -1.427 4.149 1.00 0.00 O ATOM 0 H TYR A 20 -5.264 -5.262 8.185 1.00 0.00 H new ATOM 0 HA TYR A 20 -6.842 -6.490 5.983 1.00 0.00 H new ATOM 0 HB2 TYR A 20 -4.795 -4.283 6.412 1.00 0.00 H new ATOM 0 HB3 TYR A 20 -4.840 -5.065 4.844 1.00 0.00 H new ATOM 0 HD1 TYR A 20 -7.198 -5.165 3.679 1.00 0.00 H new ATOM 0 HD2 TYR A 20 -6.210 -2.469 6.830 1.00 0.00 H new ATOM 0 HE1 TYR A 20 -9.097 -3.642 2.984 1.00 0.00 H new ATOM 0 HE2 TYR A 20 -8.113 -0.958 6.124 1.00 0.00 H new ATOM 0 HH TYR A 20 -9.731 -0.647 4.741 1.00 0.00 H new ATOM 310 N LEU A 21 -4.578 -7.981 7.178 1.00 0.00 N ATOM 311 CA LEU A 21 -3.598 -9.049 7.087 1.00 0.00 C ATOM 312 C LEU A 21 -4.039 -10.218 7.971 1.00 0.00 C ATOM 313 O LEU A 21 -3.896 -10.167 9.191 1.00 0.00 O ATOM 314 CB LEU A 21 -2.200 -8.523 7.417 1.00 0.00 C ATOM 315 CG LEU A 21 -1.488 -7.761 6.297 1.00 0.00 C ATOM 316 CD1 LEU A 21 -1.621 -6.249 6.490 1.00 0.00 C ATOM 317 CD2 LEU A 21 -0.026 -8.197 6.180 1.00 0.00 C ATOM 0 H LEU A 21 -5.027 -7.891 8.089 1.00 0.00 H new ATOM 0 HA LEU A 21 -3.540 -9.425 6.066 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -2.276 -7.867 8.284 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -1.575 -9.367 7.709 1.00 0.00 H new ATOM 0 HG LEU A 21 -1.975 -8.009 5.354 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -1.106 -5.732 5.680 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -2.675 -5.973 6.484 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -1.176 -5.963 7.443 1.00 0.00 H new ATOM 0 HD21 LEU A 21 0.457 -7.640 5.377 1.00 0.00 H new ATOM 0 HD22 LEU A 21 0.489 -7.998 7.120 1.00 0.00 H new ATOM 0 HD23 LEU A 21 0.019 -9.264 5.960 1.00 0.00 H new ATOM 329 N LYS A 22 -4.568 -11.243 7.320 1.00 0.00 N ATOM 330 CA LYS A 22 -5.032 -12.422 8.032 1.00 0.00 C ATOM 331 C LYS A 22 -5.504 -13.470 7.021 1.00 0.00 C ATOM 332 O LYS A 22 -5.488 -13.226 5.816 1.00 0.00 O ATOM 333 CB LYS A 22 -6.094 -12.042 9.064 1.00 0.00 C ATOM 334 CG LYS A 22 -7.345 -11.480 8.383 1.00 0.00 C ATOM 335 CD LYS A 22 -8.433 -11.165 9.410 1.00 0.00 C ATOM 336 CE LYS A 22 -9.523 -12.238 9.402 1.00 0.00 C ATOM 337 NZ LYS A 22 -10.785 -11.702 9.958 1.00 0.00 N ATOM 0 H LYS A 22 -4.686 -11.282 6.308 1.00 0.00 H new ATOM 0 HA LYS A 22 -4.216 -12.870 8.599 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -6.360 -12.917 9.656 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -5.688 -11.302 9.754 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -7.088 -10.576 7.831 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -7.723 -12.200 7.657 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -7.991 -11.098 10.404 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -8.874 -10.192 9.191 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -9.688 -12.589 8.383 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -9.198 -13.099 9.987 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -11.513 -12.444 9.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -10.628 -11.389 10.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -11.102 -10.895 9.384 1.00 0.00 H new ATOM 350 N LYS A 23 -5.912 -14.615 7.550 1.00 0.00 N ATOM 351 CA LYS A 23 -6.388 -15.701 6.709 1.00 0.00 C ATOM 352 C LYS A 23 -5.212 -16.278 5.917 1.00 0.00 C ATOM 353 O LYS A 23 -5.405 -16.864 4.854 1.00 0.00 O ATOM 354 CB LYS A 23 -7.548 -15.229 5.832 1.00 0.00 C ATOM 355 CG LYS A 23 -8.356 -16.418 5.306 1.00 0.00 C ATOM 356 CD LYS A 23 -9.499 -16.767 6.261 1.00 0.00 C ATOM 357 CE LYS A 23 -9.462 -18.249 6.639 1.00 0.00 C ATOM 358 NZ LYS A 23 -10.389 -19.025 5.786 1.00 0.00 N ATOM 0 H LYS A 23 -5.923 -14.814 8.550 1.00 0.00 H new ATOM 0 HA LYS A 23 -6.789 -16.510 7.320 1.00 0.00 H new ATOM 0 HB2 LYS A 23 -8.198 -14.569 6.406 1.00 0.00 H new ATOM 0 HB3 LYS A 23 -7.162 -14.648 4.995 1.00 0.00 H new ATOM 0 HG2 LYS A 23 -8.759 -16.182 4.321 1.00 0.00 H new ATOM 0 HG3 LYS A 23 -7.702 -17.282 5.184 1.00 0.00 H new ATOM 0 HD2 LYS A 23 -9.426 -16.156 7.161 1.00 0.00 H new ATOM 0 HD3 LYS A 23 -10.454 -16.531 5.793 1.00 0.00 H new ATOM 0 HE2 LYS A 23 -8.448 -18.633 6.528 1.00 0.00 H new ATOM 0 HE3 LYS A 23 -9.736 -18.370 7.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 -10.351 -20.029 6.056 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 -11.358 -18.669 5.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 -10.110 -18.924 4.789 1.00 0.00 H new ATOM 371 N ASP A 24 -4.022 -16.094 6.469 1.00 0.00 N ATOM 372 CA ASP A 24 -2.816 -16.590 5.827 1.00 0.00 C ATOM 373 C ASP A 24 -2.838 -16.208 4.345 1.00 0.00 C ATOM 374 O ASP A 24 -2.384 -16.975 3.497 1.00 0.00 O ATOM 375 CB ASP A 24 -2.728 -18.114 5.922 1.00 0.00 C ATOM 376 CG ASP A 24 -2.304 -18.653 7.289 1.00 0.00 C ATOM 377 OD1 ASP A 24 -2.121 -17.888 8.249 1.00 0.00 O ATOM 378 OD2 ASP A 24 -2.157 -19.932 7.350 1.00 0.00 O ATOM 0 H ASP A 24 -3.867 -15.609 7.353 1.00 0.00 H new ATOM 0 HA ASP A 24 -1.958 -16.148 6.334 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -3.700 -18.536 5.668 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -2.021 -18.469 5.173 1.00 0.00 H new ATOM 384 N LYS A 25 -3.370 -15.026 4.079 1.00 0.00 N ATOM 385 CA LYS A 25 -3.459 -14.534 2.715 1.00 0.00 C ATOM 386 C LYS A 25 -2.324 -13.539 2.460 1.00 0.00 C ATOM 387 O LYS A 25 -1.760 -12.984 3.402 1.00 0.00 O ATOM 388 CB LYS A 25 -4.851 -13.962 2.438 1.00 0.00 C ATOM 389 CG LYS A 25 -5.858 -15.080 2.162 1.00 0.00 C ATOM 390 CD LYS A 25 -5.540 -15.792 0.846 1.00 0.00 C ATOM 391 CE LYS A 25 -6.733 -15.736 -0.110 1.00 0.00 C ATOM 392 NZ LYS A 25 -7.827 -16.608 0.376 1.00 0.00 N ATOM 0 H LYS A 25 -3.745 -14.393 4.786 1.00 0.00 H new ATOM 0 HA LYS A 25 -3.331 -15.353 2.008 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -5.182 -13.372 3.293 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -4.807 -13.288 1.583 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -5.842 -15.799 2.981 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -6.865 -14.665 2.121 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -4.672 -15.328 0.378 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -5.277 -16.831 1.045 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -7.089 -14.710 -0.197 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -6.424 -16.052 -1.106 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -8.629 -16.559 -0.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -7.488 -17.589 0.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -8.133 -16.289 1.317 1.00 0.00 H new ATOM 405 N PRO A 26 -2.015 -13.340 1.151 1.00 0.00 N ATOM 406 CA PRO A 26 -0.959 -12.423 0.762 1.00 0.00 C ATOM 407 C PRO A 26 -1.413 -10.969 0.913 1.00 0.00 C ATOM 408 O PRO A 26 -2.606 -10.678 0.851 1.00 0.00 O ATOM 409 CB PRO A 26 -0.623 -12.794 -0.673 1.00 0.00 C ATOM 410 CG PRO A 26 -1.812 -13.589 -1.187 1.00 0.00 C ATOM 411 CD PRO A 26 -2.663 -13.981 0.010 1.00 0.00 C ATOM 0 HA PRO A 26 -0.077 -12.504 1.397 1.00 0.00 H new ATOM 0 HB2 PRO A 26 -0.458 -11.903 -1.278 1.00 0.00 H new ATOM 0 HB3 PRO A 26 0.292 -13.385 -0.720 1.00 0.00 H new ATOM 0 HG2 PRO A 26 -2.394 -12.994 -1.891 1.00 0.00 H new ATOM 0 HG3 PRO A 26 -1.475 -14.476 -1.723 1.00 0.00 H new ATOM 0 HD2 PRO A 26 -3.691 -13.638 -0.106 1.00 0.00 H new ATOM 0 HD3 PRO A 26 -2.700 -15.063 0.132 1.00 0.00 H new ATOM 419 N THR A 27 -0.436 -10.094 1.106 1.00 0.00 N ATOM 420 CA THR A 27 -0.719 -8.678 1.265 1.00 0.00 C ATOM 421 C THR A 27 0.141 -7.851 0.309 1.00 0.00 C ATOM 422 O THR A 27 1.340 -8.096 0.176 1.00 0.00 O ATOM 423 CB THR A 27 -0.511 -8.317 2.737 1.00 0.00 C ATOM 424 OG1 THR A 27 -1.396 -9.187 3.437 1.00 0.00 O ATOM 425 CG2 THR A 27 -1.023 -6.916 3.074 1.00 0.00 C ATOM 0 H THR A 27 0.553 -10.339 1.156 1.00 0.00 H new ATOM 0 HA THR A 27 -1.752 -8.449 1.002 1.00 0.00 H new ATOM 0 HB THR A 27 0.549 -8.385 2.980 1.00 0.00 H new ATOM 0 HG1 THR A 27 -0.876 -9.857 3.928 1.00 0.00 H new ATOM 0 HG21 THR A 27 -0.851 -6.710 4.131 1.00 0.00 H new ATOM 0 HG22 THR A 27 -0.493 -6.180 2.470 1.00 0.00 H new ATOM 0 HG23 THR A 27 -2.091 -6.858 2.862 1.00 0.00 H new ATOM 433 N LEU A 28 -0.503 -6.888 -0.334 1.00 0.00 N ATOM 434 CA LEU A 28 0.190 -6.022 -1.273 1.00 0.00 C ATOM 435 C LEU A 28 0.214 -4.595 -0.723 1.00 0.00 C ATOM 436 O LEU A 28 -0.799 -4.095 -0.237 1.00 0.00 O ATOM 437 CB LEU A 28 -0.437 -6.134 -2.665 1.00 0.00 C ATOM 438 CG LEU A 28 0.119 -5.186 -3.728 1.00 0.00 C ATOM 439 CD1 LEU A 28 1.270 -5.839 -4.497 1.00 0.00 C ATOM 440 CD2 LEU A 28 -0.990 -4.699 -4.663 1.00 0.00 C ATOM 0 H LEU A 28 -1.497 -6.688 -0.223 1.00 0.00 H new ATOM 0 HA LEU A 28 1.227 -6.336 -1.388 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -0.311 -7.158 -3.017 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.509 -5.958 -2.574 1.00 0.00 H new ATOM 0 HG LEU A 28 0.524 -4.309 -3.224 1.00 0.00 H new ATOM 0 HD11 LEU A 28 1.647 -5.144 -5.247 1.00 0.00 H new ATOM 0 HD12 LEU A 28 2.071 -6.095 -3.804 1.00 0.00 H new ATOM 0 HD13 LEU A 28 0.912 -6.744 -4.989 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -0.567 -4.026 -5.409 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.447 -5.554 -5.162 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -1.747 -4.169 -4.085 1.00 0.00 H new ATOM 452 N ILE A 29 1.383 -3.980 -0.818 1.00 0.00 N ATOM 453 CA ILE A 29 1.553 -2.619 -0.337 1.00 0.00 C ATOM 454 C ILE A 29 1.864 -1.699 -1.519 1.00 0.00 C ATOM 455 O ILE A 29 2.510 -2.113 -2.480 1.00 0.00 O ATOM 456 CB ILE A 29 2.607 -2.572 0.772 1.00 0.00 C ATOM 457 CG1 ILE A 29 2.461 -3.765 1.719 1.00 0.00 C ATOM 458 CG2 ILE A 29 2.557 -1.238 1.520 1.00 0.00 C ATOM 459 CD1 ILE A 29 1.226 -3.612 2.608 1.00 0.00 C ATOM 0 H ILE A 29 2.222 -4.398 -1.221 1.00 0.00 H new ATOM 0 HA ILE A 29 0.630 -2.256 0.115 1.00 0.00 H new ATOM 0 HB ILE A 29 3.591 -2.646 0.310 1.00 0.00 H new ATOM 0 HG12 ILE A 29 2.385 -4.686 1.141 1.00 0.00 H new ATOM 0 HG13 ILE A 29 3.352 -3.852 2.341 1.00 0.00 H new ATOM 0 HG21 ILE A 29 3.316 -1.231 2.302 1.00 0.00 H new ATOM 0 HG22 ILE A 29 2.747 -0.422 0.822 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.572 -1.109 1.969 1.00 0.00 H new ATOM 0 HD11 ILE A 29 1.146 -4.473 3.271 1.00 0.00 H new ATOM 0 HD12 ILE A 29 1.316 -2.703 3.203 1.00 0.00 H new ATOM 0 HD13 ILE A 29 0.334 -3.550 1.984 1.00 0.00 H new ATOM 471 N LYS A 30 1.386 -0.467 -1.410 1.00 0.00 N ATOM 472 CA LYS A 30 1.605 0.515 -2.457 1.00 0.00 C ATOM 473 C LYS A 30 1.931 1.868 -1.822 1.00 0.00 C ATOM 474 O LYS A 30 1.142 2.398 -1.041 1.00 0.00 O ATOM 475 CB LYS A 30 0.409 0.556 -3.411 1.00 0.00 C ATOM 476 CG LYS A 30 0.588 1.647 -4.469 1.00 0.00 C ATOM 477 CD LYS A 30 -0.739 2.353 -4.760 1.00 0.00 C ATOM 478 CE LYS A 30 -0.514 3.629 -5.570 1.00 0.00 C ATOM 479 NZ LYS A 30 -1.802 4.307 -5.837 1.00 0.00 N ATOM 0 H LYS A 30 0.848 -0.128 -0.612 1.00 0.00 H new ATOM 0 HA LYS A 30 2.463 0.235 -3.069 1.00 0.00 H new ATOM 0 HB2 LYS A 30 0.294 -0.412 -3.898 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -0.505 0.739 -2.846 1.00 0.00 H new ATOM 0 HG2 LYS A 30 1.323 2.375 -4.125 1.00 0.00 H new ATOM 0 HG3 LYS A 30 0.979 1.208 -5.387 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -1.400 1.682 -5.308 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -1.239 2.596 -3.822 1.00 0.00 H new ATOM 0 HE2 LYS A 30 0.151 4.300 -5.026 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -0.022 3.387 -6.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -1.644 5.115 -6.473 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -2.460 3.638 -6.285 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -2.208 4.645 -4.941 1.00 0.00 H new ATOM 492 N PHE A 31 3.095 2.390 -2.181 1.00 0.00 N ATOM 493 CA PHE A 31 3.536 3.671 -1.656 1.00 0.00 C ATOM 494 C PHE A 31 3.149 4.812 -2.599 1.00 0.00 C ATOM 495 O PHE A 31 3.387 4.735 -3.804 1.00 0.00 O ATOM 496 CB PHE A 31 5.060 3.610 -1.547 1.00 0.00 C ATOM 497 CG PHE A 31 5.576 2.487 -0.645 1.00 0.00 C ATOM 498 CD1 PHE A 31 5.600 1.206 -1.101 1.00 0.00 C ATOM 499 CD2 PHE A 31 6.008 2.771 0.613 1.00 0.00 C ATOM 500 CE1 PHE A 31 6.079 0.164 -0.262 1.00 0.00 C ATOM 501 CE2 PHE A 31 6.487 1.729 1.450 1.00 0.00 C ATOM 502 CZ PHE A 31 6.512 0.448 0.996 1.00 0.00 C ATOM 0 H PHE A 31 3.747 1.948 -2.830 1.00 0.00 H new ATOM 0 HA PHE A 31 3.067 3.858 -0.690 1.00 0.00 H new ATOM 0 HB2 PHE A 31 5.480 3.483 -2.545 1.00 0.00 H new ATOM 0 HB3 PHE A 31 5.425 4.564 -1.167 1.00 0.00 H new ATOM 0 HD1 PHE A 31 5.255 0.981 -2.100 1.00 0.00 H new ATOM 0 HD2 PHE A 31 5.987 3.788 0.975 1.00 0.00 H new ATOM 0 HE1 PHE A 31 6.099 -0.854 -0.623 1.00 0.00 H new ATOM 0 HE2 PHE A 31 6.832 1.954 2.448 1.00 0.00 H new ATOM 0 HZ PHE A 31 6.876 -0.344 1.634 1.00 0.00 H new ATOM 512 N TRP A 32 2.558 5.844 -2.015 1.00 0.00 N ATOM 513 CA TRP A 32 2.135 7.000 -2.789 1.00 0.00 C ATOM 514 C TRP A 32 2.484 8.257 -1.990 1.00 0.00 C ATOM 515 O TRP A 32 2.873 8.169 -0.826 1.00 0.00 O ATOM 516 CB TRP A 32 0.649 6.910 -3.142 1.00 0.00 C ATOM 517 CG TRP A 32 -0.278 6.853 -1.925 1.00 0.00 C ATOM 518 CD1 TRP A 32 -0.416 5.857 -1.041 1.00 0.00 C ATOM 519 CD2 TRP A 32 -1.194 7.881 -1.494 1.00 0.00 C ATOM 520 NE1 TRP A 32 -1.352 6.166 -0.074 1.00 0.00 N ATOM 521 CE2 TRP A 32 -1.839 7.436 -0.357 1.00 0.00 C ATOM 522 CE3 TRP A 32 -1.469 9.145 -2.045 1.00 0.00 C ATOM 523 CZ2 TRP A 32 -2.801 8.193 0.324 1.00 0.00 C ATOM 524 CZ3 TRP A 32 -2.432 9.889 -1.351 1.00 0.00 C ATOM 525 CH2 TRP A 32 -3.089 9.455 -0.207 1.00 0.00 C ATOM 0 H TRP A 32 2.362 5.904 -1.016 1.00 0.00 H new ATOM 0 HA TRP A 32 2.659 7.037 -3.744 1.00 0.00 H new ATOM 0 HB2 TRP A 32 0.378 7.772 -3.752 1.00 0.00 H new ATOM 0 HB3 TRP A 32 0.484 6.023 -3.753 1.00 0.00 H new ATOM 0 HD1 TRP A 32 0.135 4.929 -1.079 1.00 0.00 H new ATOM 0 HE1 TRP A 32 -1.634 5.571 0.705 1.00 0.00 H new ATOM 0 HE3 TRP A 32 -0.977 9.513 -2.933 1.00 0.00 H new ATOM 0 HZ2 TRP A 32 -3.294 7.823 1.211 1.00 0.00 H new ATOM 0 HZ3 TRP A 32 -2.681 10.868 -1.732 1.00 0.00 H new ATOM 0 HH2 TRP A 32 -3.820 10.090 0.271 1.00 0.00 H new ATOM 536 N ALA A 33 2.332 9.399 -2.645 1.00 0.00 N ATOM 537 CA ALA A 33 2.627 10.671 -2.009 1.00 0.00 C ATOM 538 C ALA A 33 1.491 11.655 -2.298 1.00 0.00 C ATOM 539 O ALA A 33 0.799 11.532 -3.309 1.00 0.00 O ATOM 540 CB ALA A 33 3.981 11.186 -2.501 1.00 0.00 C ATOM 0 H ALA A 33 2.008 9.469 -3.610 1.00 0.00 H new ATOM 0 HA ALA A 33 2.696 10.553 -0.928 1.00 0.00 H new ATOM 0 HB1 ALA A 33 4.202 12.141 -2.024 1.00 0.00 H new ATOM 0 HB2 ALA A 33 4.758 10.465 -2.248 1.00 0.00 H new ATOM 0 HB3 ALA A 33 3.948 11.320 -3.582 1.00 0.00 H new ATOM 546 N SER A 34 1.333 12.609 -1.393 1.00 0.00 N ATOM 547 CA SER A 34 0.293 13.613 -1.537 1.00 0.00 C ATOM 548 C SER A 34 0.725 14.673 -2.552 1.00 0.00 C ATOM 549 O SER A 34 -0.108 15.236 -3.261 1.00 0.00 O ATOM 550 CB SER A 34 -0.032 14.267 -0.192 1.00 0.00 C ATOM 551 OG SER A 34 -1.336 13.925 0.267 1.00 0.00 O ATOM 0 H SER A 34 1.908 12.708 -0.557 1.00 0.00 H new ATOM 0 HA SER A 34 -0.610 13.120 -1.898 1.00 0.00 H new ATOM 0 HB2 SER A 34 0.706 13.958 0.549 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.046 15.350 -0.287 1.00 0.00 H new ATOM 0 HG SER A 34 -1.938 14.687 0.138 1.00 0.00 H new ATOM 557 N TRP A 35 2.027 14.914 -2.590 1.00 0.00 N ATOM 558 CA TRP A 35 2.580 15.896 -3.507 1.00 0.00 C ATOM 559 C TRP A 35 2.652 15.258 -4.896 1.00 0.00 C ATOM 560 O TRP A 35 3.021 15.917 -5.866 1.00 0.00 O ATOM 561 CB TRP A 35 3.936 16.405 -3.011 1.00 0.00 C ATOM 562 CG TRP A 35 4.926 15.295 -2.657 1.00 0.00 C ATOM 563 CD1 TRP A 35 5.221 14.808 -1.444 1.00 0.00 C ATOM 564 CD2 TRP A 35 5.746 14.545 -3.580 1.00 0.00 C ATOM 565 NE1 TRP A 35 6.166 13.807 -1.516 1.00 0.00 N ATOM 566 CE2 TRP A 35 6.496 13.641 -2.857 1.00 0.00 C ATOM 567 CE3 TRP A 35 5.849 14.632 -4.980 1.00 0.00 C ATOM 568 CZ2 TRP A 35 7.403 12.752 -3.447 1.00 0.00 C ATOM 569 CZ3 TRP A 35 6.760 13.736 -5.554 1.00 0.00 C ATOM 570 CH2 TRP A 35 7.523 12.819 -4.840 1.00 0.00 C ATOM 0 H TRP A 35 2.715 14.446 -2.000 1.00 0.00 H new ATOM 0 HA TRP A 35 1.940 16.777 -3.562 1.00 0.00 H new ATOM 0 HB2 TRP A 35 4.377 17.040 -3.779 1.00 0.00 H new ATOM 0 HB3 TRP A 35 3.778 17.031 -2.133 1.00 0.00 H new ATOM 0 HD1 TRP A 35 4.774 15.156 -0.525 1.00 0.00 H new ATOM 0 HE1 TRP A 35 6.552 13.284 -0.730 1.00 0.00 H new ATOM 0 HE3 TRP A 35 5.272 15.333 -5.565 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 7.979 12.053 -2.859 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 6.878 13.759 -6.627 1.00 0.00 H new ATOM 0 HH2 TRP A 35 8.205 12.161 -5.358 1.00 0.00 H new ATOM 581 N CYS A 36 2.292 13.985 -4.946 1.00 0.00 N ATOM 582 CA CYS A 36 2.311 13.250 -6.200 1.00 0.00 C ATOM 583 C CYS A 36 0.888 13.223 -6.762 1.00 0.00 C ATOM 584 O CYS A 36 -0.020 12.681 -6.135 1.00 0.00 O ATOM 585 CB CYS A 36 2.883 11.843 -6.023 1.00 0.00 C ATOM 586 SG CYS A 36 2.981 11.000 -7.645 1.00 0.00 S ATOM 0 H CYS A 36 1.985 13.443 -4.138 1.00 0.00 H new ATOM 0 HA CYS A 36 2.971 13.751 -6.909 1.00 0.00 H new ATOM 0 HB2 CYS A 36 3.874 11.898 -5.572 1.00 0.00 H new ATOM 0 HB3 CYS A 36 2.254 11.269 -5.343 1.00 0.00 H new ATOM 0 HG CYS A 36 2.591 9.766 -7.517 1.00 0.00 H new ATOM 592 N PRO A 37 0.734 13.831 -7.969 1.00 0.00 N ATOM 593 CA PRO A 37 -0.563 13.881 -8.622 1.00 0.00 C ATOM 594 C PRO A 37 -0.928 12.522 -9.221 1.00 0.00 C ATOM 595 O PRO A 37 -1.992 11.977 -8.931 1.00 0.00 O ATOM 596 CB PRO A 37 -0.433 14.977 -9.668 1.00 0.00 C ATOM 597 CG PRO A 37 1.058 15.178 -9.880 1.00 0.00 C ATOM 598 CD PRO A 37 1.788 14.483 -8.741 1.00 0.00 C ATOM 0 HA PRO A 37 -1.375 14.103 -7.930 1.00 0.00 H new ATOM 0 HB2 PRO A 37 -0.924 14.689 -10.598 1.00 0.00 H new ATOM 0 HB3 PRO A 37 -0.907 15.898 -9.329 1.00 0.00 H new ATOM 0 HG2 PRO A 37 1.366 14.764 -10.840 1.00 0.00 H new ATOM 0 HG3 PRO A 37 1.301 16.240 -9.898 1.00 0.00 H new ATOM 0 HD2 PRO A 37 2.510 13.758 -9.117 1.00 0.00 H new ATOM 0 HD3 PRO A 37 2.342 15.197 -8.131 1.00 0.00 H new ATOM 606 N LEU A 38 -0.024 12.012 -10.046 1.00 0.00 N ATOM 607 CA LEU A 38 -0.239 10.726 -10.688 1.00 0.00 C ATOM 608 C LEU A 38 -0.699 9.709 -9.642 1.00 0.00 C ATOM 609 O LEU A 38 -1.448 8.784 -9.957 1.00 0.00 O ATOM 610 CB LEU A 38 1.013 10.296 -11.455 1.00 0.00 C ATOM 611 CG LEU A 38 0.823 10.021 -12.948 1.00 0.00 C ATOM 612 CD1 LEU A 38 -0.214 8.920 -13.175 1.00 0.00 C ATOM 613 CD2 LEU A 38 0.472 11.305 -13.702 1.00 0.00 C ATOM 0 H LEU A 38 0.858 12.466 -10.284 1.00 0.00 H new ATOM 0 HA LEU A 38 -1.032 10.799 -11.432 1.00 0.00 H new ATOM 0 HB2 LEU A 38 1.769 11.073 -11.342 1.00 0.00 H new ATOM 0 HB3 LEU A 38 1.410 9.395 -10.987 1.00 0.00 H new ATOM 0 HG LEU A 38 1.769 9.660 -13.352 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -0.330 8.744 -14.244 1.00 0.00 H new ATOM 0 HD12 LEU A 38 0.118 8.002 -12.690 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -1.170 9.228 -12.752 1.00 0.00 H new ATOM 0 HD21 LEU A 38 0.342 11.081 -14.761 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -0.454 11.720 -13.303 1.00 0.00 H new ATOM 0 HD23 LEU A 38 1.277 12.030 -13.580 1.00 0.00 H new ATOM 625 N CYS A 39 -0.233 9.914 -8.419 1.00 0.00 N ATOM 626 CA CYS A 39 -0.590 9.027 -7.324 1.00 0.00 C ATOM 627 C CYS A 39 -2.033 9.324 -6.913 1.00 0.00 C ATOM 628 O CYS A 39 -2.881 8.432 -6.919 1.00 0.00 O ATOM 629 CB CYS A 39 0.378 9.163 -6.147 1.00 0.00 C ATOM 630 SG CYS A 39 1.714 7.919 -6.287 1.00 0.00 S ATOM 0 H CYS A 39 0.388 10.681 -8.162 1.00 0.00 H new ATOM 0 HA CYS A 39 -0.514 7.991 -7.654 1.00 0.00 H new ATOM 0 HB2 CYS A 39 0.804 10.166 -6.130 1.00 0.00 H new ATOM 0 HB3 CYS A 39 -0.158 9.029 -5.207 1.00 0.00 H new ATOM 0 HG CYS A 39 2.731 8.291 -5.568 1.00 0.00 H new ATOM 636 N LEU A 40 -2.268 10.581 -6.567 1.00 0.00 N ATOM 637 CA LEU A 40 -3.595 11.008 -6.155 1.00 0.00 C ATOM 638 C LEU A 40 -4.619 10.559 -7.199 1.00 0.00 C ATOM 639 O LEU A 40 -5.709 10.107 -6.852 1.00 0.00 O ATOM 640 CB LEU A 40 -3.613 12.512 -5.882 1.00 0.00 C ATOM 641 CG LEU A 40 -3.247 12.941 -4.459 1.00 0.00 C ATOM 642 CD1 LEU A 40 -2.165 14.022 -4.475 1.00 0.00 C ATOM 643 CD2 LEU A 40 -4.490 13.384 -3.684 1.00 0.00 C ATOM 0 H LEU A 40 -1.562 11.318 -6.563 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.872 10.534 -5.214 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -2.923 12.995 -6.574 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -4.610 12.890 -6.109 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.833 12.079 -3.937 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -1.923 14.310 -3.452 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -1.271 13.635 -4.964 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.529 14.893 -5.020 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.203 13.684 -2.676 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.956 14.227 -4.194 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -5.198 12.557 -3.629 1.00 0.00 H new ATOM 655 N SER A 41 -4.231 10.699 -8.459 1.00 0.00 N ATOM 656 CA SER A 41 -5.101 10.315 -9.557 1.00 0.00 C ATOM 657 C SER A 41 -5.191 8.790 -9.645 1.00 0.00 C ATOM 658 O SER A 41 -6.177 8.250 -10.143 1.00 0.00 O ATOM 659 CB SER A 41 -4.603 10.895 -10.883 1.00 0.00 C ATOM 660 OG SER A 41 -5.064 12.227 -11.089 1.00 0.00 O ATOM 0 H SER A 41 -3.326 11.073 -8.743 1.00 0.00 H new ATOM 0 HA SER A 41 -6.094 10.720 -9.364 1.00 0.00 H new ATOM 0 HB2 SER A 41 -3.513 10.882 -10.898 1.00 0.00 H new ATOM 0 HB3 SER A 41 -4.941 10.263 -11.705 1.00 0.00 H new ATOM 0 HG SER A 41 -4.724 12.562 -11.945 1.00 0.00 H new ATOM 666 N GLU A 42 -4.147 8.139 -9.153 1.00 0.00 N ATOM 667 CA GLU A 42 -4.096 6.687 -9.168 1.00 0.00 C ATOM 668 C GLU A 42 -4.864 6.115 -7.976 1.00 0.00 C ATOM 669 O GLU A 42 -5.246 4.945 -7.980 1.00 0.00 O ATOM 670 CB GLU A 42 -2.648 6.189 -9.177 1.00 0.00 C ATOM 671 CG GLU A 42 -2.591 4.671 -9.347 1.00 0.00 C ATOM 672 CD GLU A 42 -1.291 4.244 -10.032 1.00 0.00 C ATOM 673 OE1 GLU A 42 -0.635 3.295 -9.578 1.00 0.00 O ATOM 674 OE2 GLU A 42 -0.969 4.935 -11.072 1.00 0.00 O ATOM 0 H GLU A 42 -3.330 8.590 -8.742 1.00 0.00 H new ATOM 0 HA GLU A 42 -4.573 6.337 -10.084 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -2.099 6.670 -9.987 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -2.156 6.473 -8.246 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -2.668 4.189 -8.372 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -3.444 4.335 -9.937 1.00 0.00 H new ATOM 682 N LEU A 43 -5.069 6.966 -6.981 1.00 0.00 N ATOM 683 CA LEU A 43 -5.786 6.561 -5.784 1.00 0.00 C ATOM 684 C LEU A 43 -7.169 6.040 -6.175 1.00 0.00 C ATOM 685 O LEU A 43 -7.537 4.919 -5.825 1.00 0.00 O ATOM 686 CB LEU A 43 -5.823 7.705 -4.769 1.00 0.00 C ATOM 687 CG LEU A 43 -4.507 8.007 -4.049 1.00 0.00 C ATOM 688 CD1 LEU A 43 -4.744 8.885 -2.819 1.00 0.00 C ATOM 689 CD2 LEU A 43 -3.766 6.715 -3.696 1.00 0.00 C ATOM 0 H LEU A 43 -4.751 7.935 -6.980 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.266 5.742 -5.287 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -6.149 8.609 -5.283 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -6.580 7.474 -4.019 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.867 8.570 -4.729 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -3.793 9.085 -2.326 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -5.198 9.827 -3.126 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -5.410 8.370 -2.127 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -2.834 6.958 -3.185 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.390 6.105 -3.043 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -3.546 6.161 -4.608 1.00 0.00 H new ATOM 701 N GLY A 44 -7.900 6.877 -6.896 1.00 0.00 N ATOM 702 CA GLY A 44 -9.236 6.515 -7.338 1.00 0.00 C ATOM 703 C GLY A 44 -9.245 5.122 -7.970 1.00 0.00 C ATOM 704 O GLY A 44 -10.061 4.276 -7.606 1.00 0.00 O ATOM 0 H GLY A 44 -7.592 7.805 -7.185 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -9.922 6.539 -6.491 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -9.595 7.248 -8.060 1.00 0.00 H new ATOM 708 N GLN A 45 -8.328 4.926 -8.907 1.00 0.00 N ATOM 709 CA GLN A 45 -8.219 3.648 -9.592 1.00 0.00 C ATOM 710 C GLN A 45 -7.776 2.556 -8.616 1.00 0.00 C ATOM 711 O GLN A 45 -8.163 1.398 -8.758 1.00 0.00 O ATOM 712 CB GLN A 45 -7.260 3.744 -10.780 1.00 0.00 C ATOM 713 CG GLN A 45 -7.289 2.461 -11.614 1.00 0.00 C ATOM 714 CD GLN A 45 -8.223 2.609 -12.816 1.00 0.00 C ATOM 715 OE1 GLN A 45 -9.430 2.732 -12.686 1.00 0.00 O ATOM 716 NE2 GLN A 45 -7.600 2.592 -13.990 1.00 0.00 N ATOM 0 H GLN A 45 -7.654 5.630 -9.208 1.00 0.00 H new ATOM 0 HA GLN A 45 -9.202 3.382 -9.980 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -7.533 4.594 -11.405 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -6.247 3.925 -10.420 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -6.282 2.224 -11.958 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -7.618 1.627 -10.994 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -6.586 2.486 -14.028 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -8.136 2.685 -14.853 1.00 0.00 H new ATOM 725 N THR A 46 -6.972 2.966 -7.646 1.00 0.00 N ATOM 726 CA THR A 46 -6.472 2.037 -6.647 1.00 0.00 C ATOM 727 C THR A 46 -7.603 1.593 -5.719 1.00 0.00 C ATOM 728 O THR A 46 -7.574 0.485 -5.183 1.00 0.00 O ATOM 729 CB THR A 46 -5.312 2.713 -5.911 1.00 0.00 C ATOM 730 OG1 THR A 46 -4.228 2.639 -6.832 1.00 0.00 O ATOM 731 CG2 THR A 46 -4.833 1.903 -4.705 1.00 0.00 C ATOM 0 H THR A 46 -6.655 3.928 -7.531 1.00 0.00 H new ATOM 0 HA THR A 46 -6.095 1.124 -7.109 1.00 0.00 H new ATOM 0 HB THR A 46 -5.619 3.706 -5.582 1.00 0.00 H new ATOM 0 HG1 THR A 46 -4.342 3.320 -7.527 1.00 0.00 H new ATOM 0 HG21 THR A 46 -4.010 2.426 -4.219 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.654 1.782 -3.998 1.00 0.00 H new ATOM 0 HG23 THR A 46 -4.493 0.922 -5.037 1.00 0.00 H new ATOM 739 N GLU A 47 -8.576 2.478 -5.557 1.00 0.00 N ATOM 740 CA GLU A 47 -9.716 2.191 -4.703 1.00 0.00 C ATOM 741 C GLU A 47 -10.651 1.190 -5.385 1.00 0.00 C ATOM 742 O GLU A 47 -11.262 0.355 -4.719 1.00 0.00 O ATOM 743 CB GLU A 47 -10.462 3.475 -4.335 1.00 0.00 C ATOM 744 CG GLU A 47 -11.585 3.191 -3.335 1.00 0.00 C ATOM 745 CD GLU A 47 -11.933 4.443 -2.529 1.00 0.00 C ATOM 746 OE1 GLU A 47 -11.665 5.565 -2.982 1.00 0.00 O ATOM 747 OE2 GLU A 47 -12.502 4.219 -1.393 1.00 0.00 O ATOM 0 H GLU A 47 -8.598 3.395 -6.003 1.00 0.00 H new ATOM 0 HA GLU A 47 -9.350 1.745 -3.778 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -9.764 4.195 -3.908 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -10.878 3.929 -5.235 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -12.469 2.839 -3.866 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -11.281 2.392 -2.659 1.00 0.00 H new ATOM 755 N LYS A 48 -10.731 1.306 -6.701 1.00 0.00 N ATOM 756 CA LYS A 48 -11.581 0.420 -7.479 1.00 0.00 C ATOM 757 C LYS A 48 -10.884 -0.931 -7.647 1.00 0.00 C ATOM 758 O LYS A 48 -11.533 -1.976 -7.621 1.00 0.00 O ATOM 759 CB LYS A 48 -11.971 1.079 -8.804 1.00 0.00 C ATOM 760 CG LYS A 48 -12.743 0.105 -9.695 1.00 0.00 C ATOM 761 CD LYS A 48 -13.226 0.794 -10.973 1.00 0.00 C ATOM 762 CE LYS A 48 -12.995 -0.094 -12.196 1.00 0.00 C ATOM 763 NZ LYS A 48 -13.473 0.579 -13.425 1.00 0.00 N ATOM 0 H LYS A 48 -10.222 1.999 -7.249 1.00 0.00 H new ATOM 0 HA LYS A 48 -12.518 0.233 -6.954 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -12.581 1.961 -8.610 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -11.075 1.419 -9.323 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -12.106 -0.741 -9.953 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -13.597 -0.294 -9.148 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -14.287 1.029 -10.885 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.700 1.740 -11.101 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -11.934 -0.324 -12.290 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -13.517 -1.042 -12.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -13.308 -0.038 -14.245 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.490 0.777 -13.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -12.957 1.472 -13.555 1.00 0.00 H new ATOM 776 N TRP A 49 -9.571 -0.868 -7.816 1.00 0.00 N ATOM 777 CA TRP A 49 -8.779 -2.074 -7.988 1.00 0.00 C ATOM 778 C TRP A 49 -8.845 -2.871 -6.684 1.00 0.00 C ATOM 779 O TRP A 49 -8.838 -4.101 -6.704 1.00 0.00 O ATOM 780 CB TRP A 49 -7.349 -1.735 -8.411 1.00 0.00 C ATOM 781 CG TRP A 49 -7.231 -1.213 -9.845 1.00 0.00 C ATOM 782 CD1 TRP A 49 -8.208 -1.051 -10.746 1.00 0.00 C ATOM 783 CD2 TRP A 49 -6.020 -0.791 -10.509 1.00 0.00 C ATOM 784 NE1 TRP A 49 -7.718 -0.556 -11.939 1.00 0.00 N ATOM 785 CE2 TRP A 49 -6.347 -0.394 -11.789 1.00 0.00 C ATOM 786 CE3 TRP A 49 -4.695 -0.748 -10.043 1.00 0.00 C ATOM 787 CZ2 TRP A 49 -5.402 0.076 -12.710 1.00 0.00 C ATOM 788 CZ3 TRP A 49 -3.762 -0.276 -10.975 1.00 0.00 C ATOM 789 CH2 TRP A 49 -4.075 0.128 -12.268 1.00 0.00 C ATOM 0 H TRP A 49 -9.036 0.000 -7.837 1.00 0.00 H new ATOM 0 HA TRP A 49 -9.181 -2.689 -8.793 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -6.947 -0.986 -7.728 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -6.730 -2.626 -8.307 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -9.248 -1.279 -10.563 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -8.263 -0.348 -12.776 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -4.418 -1.055 -9.045 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -5.682 0.382 -13.707 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -2.728 -0.222 -10.668 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -3.297 0.481 -12.929 1.00 0.00 H new ATOM 800 N ALA A 50 -8.904 -2.139 -5.581 1.00 0.00 N ATOM 801 CA ALA A 50 -8.970 -2.763 -4.272 1.00 0.00 C ATOM 802 C ALA A 50 -10.371 -3.339 -4.055 1.00 0.00 C ATOM 803 O ALA A 50 -10.608 -4.056 -3.084 1.00 0.00 O ATOM 804 CB ALA A 50 -8.588 -1.741 -3.199 1.00 0.00 C ATOM 0 H ALA A 50 -8.907 -1.119 -5.568 1.00 0.00 H new ATOM 0 HA ALA A 50 -8.261 -3.588 -4.205 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -8.638 -2.210 -2.216 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -7.574 -1.385 -3.380 1.00 0.00 H new ATOM 0 HB3 ALA A 50 -9.280 -0.900 -3.235 1.00 0.00 H new ATOM 810 N GLN A 51 -11.263 -3.003 -4.975 1.00 0.00 N ATOM 811 CA GLN A 51 -12.633 -3.477 -4.897 1.00 0.00 C ATOM 812 C GLN A 51 -12.865 -4.603 -5.908 1.00 0.00 C ATOM 813 O GLN A 51 -13.858 -5.322 -5.826 1.00 0.00 O ATOM 814 CB GLN A 51 -13.624 -2.332 -5.118 1.00 0.00 C ATOM 815 CG GLN A 51 -13.728 -1.449 -3.872 1.00 0.00 C ATOM 816 CD GLN A 51 -14.871 -1.914 -2.966 1.00 0.00 C ATOM 817 OE1 GLN A 51 -14.889 -3.026 -2.467 1.00 0.00 O ATOM 818 NE2 GLN A 51 -15.820 -1.001 -2.782 1.00 0.00 N ATOM 0 H GLN A 51 -11.063 -2.408 -5.779 1.00 0.00 H new ATOM 0 HA GLN A 51 -12.802 -3.873 -3.895 1.00 0.00 H new ATOM 0 HB2 GLN A 51 -13.306 -1.730 -5.969 1.00 0.00 H new ATOM 0 HB3 GLN A 51 -14.605 -2.738 -5.364 1.00 0.00 H new ATOM 0 HG2 GLN A 51 -12.788 -1.478 -3.322 1.00 0.00 H new ATOM 0 HG3 GLN A 51 -13.892 -0.413 -4.168 1.00 0.00 H new ATOM 0 HE21 GLN A 51 -15.743 -0.088 -3.230 1.00 0.00 H new ATOM 0 HE22 GLN A 51 -16.625 -1.214 -2.193 1.00 0.00 H new ATOM 827 N ASP A 52 -11.928 -4.721 -6.838 1.00 0.00 N ATOM 828 CA ASP A 52 -12.016 -5.747 -7.862 1.00 0.00 C ATOM 829 C ASP A 52 -11.946 -7.127 -7.204 1.00 0.00 C ATOM 830 O ASP A 52 -11.137 -7.349 -6.304 1.00 0.00 O ATOM 831 CB ASP A 52 -10.856 -5.636 -8.855 1.00 0.00 C ATOM 832 CG ASP A 52 -10.552 -6.913 -9.639 1.00 0.00 C ATOM 833 OD1 ASP A 52 -11.463 -7.663 -10.017 1.00 0.00 O ATOM 834 OD2 ASP A 52 -9.300 -7.131 -9.861 1.00 0.00 O ATOM 0 H ASP A 52 -11.104 -4.123 -6.903 1.00 0.00 H new ATOM 0 HA ASP A 52 -12.959 -5.613 -8.393 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -11.079 -4.837 -9.563 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -9.959 -5.339 -8.311 1.00 0.00 H new ATOM 840 N ALA A 53 -12.803 -8.018 -7.679 1.00 0.00 N ATOM 841 CA ALA A 53 -12.848 -9.370 -7.148 1.00 0.00 C ATOM 842 C ALA A 53 -11.488 -10.040 -7.356 1.00 0.00 C ATOM 843 O ALA A 53 -10.950 -10.657 -6.439 1.00 0.00 O ATOM 844 CB ALA A 53 -13.988 -10.142 -7.816 1.00 0.00 C ATOM 0 H ALA A 53 -13.472 -7.831 -8.426 1.00 0.00 H new ATOM 0 HA ALA A 53 -13.048 -9.356 -6.077 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -14.023 -11.156 -7.418 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -14.934 -9.641 -7.614 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -13.820 -10.180 -8.892 1.00 0.00 H new ATOM 850 N LYS A 54 -10.973 -9.898 -8.569 1.00 0.00 N ATOM 851 CA LYS A 54 -9.687 -10.482 -8.910 1.00 0.00 C ATOM 852 C LYS A 54 -8.647 -10.051 -7.876 1.00 0.00 C ATOM 853 O LYS A 54 -7.800 -10.847 -7.472 1.00 0.00 O ATOM 854 CB LYS A 54 -9.305 -10.132 -10.349 1.00 0.00 C ATOM 855 CG LYS A 54 -9.594 -11.301 -11.293 1.00 0.00 C ATOM 856 CD LYS A 54 -10.761 -10.977 -12.227 1.00 0.00 C ATOM 857 CE LYS A 54 -12.040 -11.685 -11.774 1.00 0.00 C ATOM 858 NZ LYS A 54 -12.217 -12.957 -12.507 1.00 0.00 N ATOM 0 H LYS A 54 -11.424 -9.387 -9.328 1.00 0.00 H new ATOM 0 HA LYS A 54 -9.741 -11.570 -8.875 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -9.861 -9.252 -10.673 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -8.247 -9.875 -10.396 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -8.705 -11.526 -11.881 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -9.826 -12.193 -10.712 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -10.926 -9.900 -12.249 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -10.513 -11.282 -13.244 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -11.995 -11.880 -10.702 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -12.900 -11.038 -11.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -13.090 -13.424 -12.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -12.282 -12.764 -13.527 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -11.404 -13.579 -12.324 1.00 0.00 H new ATOM 871 N PHE A 55 -8.744 -8.792 -7.474 1.00 0.00 N ATOM 872 CA PHE A 55 -7.821 -8.246 -6.493 1.00 0.00 C ATOM 873 C PHE A 55 -8.179 -8.715 -5.082 1.00 0.00 C ATOM 874 O PHE A 55 -7.308 -8.824 -4.221 1.00 0.00 O ATOM 875 CB PHE A 55 -7.947 -6.723 -6.560 1.00 0.00 C ATOM 876 CG PHE A 55 -6.806 -6.034 -7.310 1.00 0.00 C ATOM 877 CD1 PHE A 55 -5.548 -6.050 -6.795 1.00 0.00 C ATOM 878 CD2 PHE A 55 -7.049 -5.409 -8.493 1.00 0.00 C ATOM 879 CE1 PHE A 55 -4.487 -5.411 -7.493 1.00 0.00 C ATOM 880 CE2 PHE A 55 -5.990 -4.770 -9.189 1.00 0.00 C ATOM 881 CZ PHE A 55 -4.731 -4.784 -8.675 1.00 0.00 C ATOM 0 H PHE A 55 -9.448 -8.134 -7.810 1.00 0.00 H new ATOM 0 HA PHE A 55 -6.806 -8.580 -6.710 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -8.891 -6.468 -7.043 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -7.991 -6.328 -5.545 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -5.355 -6.548 -5.856 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -8.048 -5.399 -8.903 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -3.487 -5.423 -7.085 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -6.184 -4.272 -10.128 1.00 0.00 H new ATOM 0 HZ PHE A 55 -3.925 -4.298 -9.205 1.00 0.00 H new ATOM 891 N SER A 56 -9.463 -8.979 -4.888 1.00 0.00 N ATOM 892 CA SER A 56 -9.947 -9.433 -3.597 1.00 0.00 C ATOM 893 C SER A 56 -9.085 -10.593 -3.093 1.00 0.00 C ATOM 894 O SER A 56 -8.770 -10.666 -1.906 1.00 0.00 O ATOM 895 CB SER A 56 -11.415 -9.861 -3.678 1.00 0.00 C ATOM 896 OG SER A 56 -12.057 -9.806 -2.407 1.00 0.00 O ATOM 0 H SER A 56 -10.183 -8.887 -5.605 1.00 0.00 H new ATOM 0 HA SER A 56 -9.876 -8.603 -2.895 1.00 0.00 H new ATOM 0 HB2 SER A 56 -11.943 -9.215 -4.379 1.00 0.00 H new ATOM 0 HB3 SER A 56 -11.476 -10.876 -4.072 1.00 0.00 H new ATOM 0 HG SER A 56 -12.992 -10.084 -2.500 1.00 0.00 H new ATOM 902 N SER A 57 -8.728 -11.469 -4.019 1.00 0.00 N ATOM 903 CA SER A 57 -7.908 -12.620 -3.684 1.00 0.00 C ATOM 904 C SER A 57 -6.846 -12.226 -2.656 1.00 0.00 C ATOM 905 O SER A 57 -6.789 -12.794 -1.567 1.00 0.00 O ATOM 906 CB SER A 57 -7.245 -13.207 -4.933 1.00 0.00 C ATOM 907 OG SER A 57 -6.512 -14.394 -4.640 1.00 0.00 O ATOM 0 H SER A 57 -8.992 -11.405 -5.002 1.00 0.00 H new ATOM 0 HA SER A 57 -8.554 -13.385 -3.254 1.00 0.00 H new ATOM 0 HB2 SER A 57 -8.008 -13.427 -5.679 1.00 0.00 H new ATOM 0 HB3 SER A 57 -6.576 -12.466 -5.370 1.00 0.00 H new ATOM 0 HG SER A 57 -6.240 -14.826 -5.477 1.00 0.00 H new ATOM 913 N ALA A 58 -6.030 -11.253 -3.038 1.00 0.00 N ATOM 914 CA ALA A 58 -4.975 -10.775 -2.163 1.00 0.00 C ATOM 915 C ALA A 58 -5.408 -9.456 -1.521 1.00 0.00 C ATOM 916 O ALA A 58 -6.372 -8.834 -1.963 1.00 0.00 O ATOM 917 CB ALA A 58 -3.674 -10.637 -2.959 1.00 0.00 C ATOM 0 H ALA A 58 -6.079 -10.784 -3.942 1.00 0.00 H new ATOM 0 HA ALA A 58 -4.792 -11.488 -1.359 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -2.882 -10.278 -2.302 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -3.394 -11.607 -3.369 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -3.819 -9.927 -3.773 1.00 0.00 H new ATOM 923 N ASN A 59 -4.674 -9.068 -0.488 1.00 0.00 N ATOM 924 CA ASN A 59 -4.971 -7.834 0.220 1.00 0.00 C ATOM 925 C ASN A 59 -4.219 -6.677 -0.443 1.00 0.00 C ATOM 926 O ASN A 59 -2.997 -6.729 -0.590 1.00 0.00 O ATOM 927 CB ASN A 59 -4.522 -7.915 1.681 1.00 0.00 C ATOM 928 CG ASN A 59 -4.857 -9.281 2.282 1.00 0.00 C ATOM 929 OD1 ASN A 59 -5.759 -9.976 1.845 1.00 0.00 O ATOM 930 ND2 ASN A 59 -4.082 -9.626 3.306 1.00 0.00 N ATOM 0 H ASN A 59 -3.874 -9.586 -0.124 1.00 0.00 H new ATOM 0 HA ASN A 59 -6.049 -7.675 0.183 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.448 -7.739 1.746 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -5.009 -7.130 2.259 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -4.226 -10.520 3.776 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -3.344 -8.997 3.622 1.00 0.00 H new ATOM 937 N LEU A 60 -4.977 -5.662 -0.826 1.00 0.00 N ATOM 938 CA LEU A 60 -4.399 -4.495 -1.470 1.00 0.00 C ATOM 939 C LEU A 60 -4.542 -3.285 -0.545 1.00 0.00 C ATOM 940 O LEU A 60 -5.642 -2.966 -0.098 1.00 0.00 O ATOM 941 CB LEU A 60 -5.014 -4.287 -2.855 1.00 0.00 C ATOM 942 CG LEU A 60 -4.486 -3.092 -3.650 1.00 0.00 C ATOM 943 CD1 LEU A 60 -4.766 -3.261 -5.145 1.00 0.00 C ATOM 944 CD2 LEU A 60 -5.053 -1.778 -3.107 1.00 0.00 C ATOM 0 H LEU A 60 -5.989 -5.623 -0.703 1.00 0.00 H new ATOM 0 HA LEU A 60 -3.333 -4.643 -1.640 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -4.850 -5.190 -3.443 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -6.092 -4.173 -2.739 1.00 0.00 H new ATOM 0 HG LEU A 60 -3.404 -3.052 -3.527 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -4.380 -2.398 -5.687 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -4.276 -4.165 -5.507 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -5.841 -3.341 -5.307 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -4.662 -0.944 -3.690 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -6.140 -1.793 -3.180 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -4.761 -1.660 -2.063 1.00 0.00 H new ATOM 956 N ILE A 61 -3.412 -2.644 -0.285 1.00 0.00 N ATOM 957 CA ILE A 61 -3.398 -1.474 0.579 1.00 0.00 C ATOM 958 C ILE A 61 -2.237 -0.562 0.175 1.00 0.00 C ATOM 959 O ILE A 61 -1.300 -1.001 -0.491 1.00 0.00 O ATOM 960 CB ILE A 61 -3.365 -1.896 2.049 1.00 0.00 C ATOM 961 CG1 ILE A 61 -1.983 -2.422 2.438 1.00 0.00 C ATOM 962 CG2 ILE A 61 -4.471 -2.907 2.354 1.00 0.00 C ATOM 963 CD1 ILE A 61 -1.915 -2.733 3.936 1.00 0.00 C ATOM 0 H ILE A 61 -2.500 -2.912 -0.656 1.00 0.00 H new ATOM 0 HA ILE A 61 -4.315 -0.897 0.456 1.00 0.00 H new ATOM 0 HB ILE A 61 -3.557 -1.015 2.662 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -1.758 -3.322 1.866 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -1.224 -1.683 2.182 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -4.425 -3.190 3.406 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -5.442 -2.460 2.141 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -4.336 -3.793 1.733 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -0.921 -3.105 4.186 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -2.116 -1.826 4.505 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -2.659 -3.490 4.185 1.00 0.00 H new ATOM 975 N THR A 62 -2.338 0.691 0.593 1.00 0.00 N ATOM 976 CA THR A 62 -1.309 1.669 0.282 1.00 0.00 C ATOM 977 C THR A 62 -0.609 2.130 1.562 1.00 0.00 C ATOM 978 O THR A 62 -1.186 2.071 2.648 1.00 0.00 O ATOM 979 CB THR A 62 -1.963 2.813 -0.496 1.00 0.00 C ATOM 980 OG1 THR A 62 -2.809 3.446 0.460 1.00 0.00 O ATOM 981 CG2 THR A 62 -2.928 2.310 -1.572 1.00 0.00 C ATOM 0 H THR A 62 -3.117 1.052 1.144 1.00 0.00 H new ATOM 0 HA THR A 62 -0.528 1.236 -0.343 1.00 0.00 H new ATOM 0 HB THR A 62 -1.190 3.426 -0.958 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.672 2.982 0.491 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.365 3.161 -2.095 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.387 1.686 -2.283 1.00 0.00 H new ATOM 0 HG23 THR A 62 -3.720 1.725 -1.105 1.00 0.00 H new ATOM 989 N VAL A 63 0.627 2.578 1.394 1.00 0.00 N ATOM 990 CA VAL A 63 1.413 3.048 2.522 1.00 0.00 C ATOM 991 C VAL A 63 1.878 4.481 2.252 1.00 0.00 C ATOM 992 O VAL A 63 2.157 4.841 1.109 1.00 0.00 O ATOM 993 CB VAL A 63 2.570 2.085 2.791 1.00 0.00 C ATOM 994 CG1 VAL A 63 3.750 2.812 3.437 1.00 0.00 C ATOM 995 CG2 VAL A 63 2.113 0.907 3.655 1.00 0.00 C ATOM 0 H VAL A 63 1.103 2.625 0.493 1.00 0.00 H new ATOM 0 HA VAL A 63 0.807 3.068 3.428 1.00 0.00 H new ATOM 0 HB VAL A 63 2.905 1.688 1.833 1.00 0.00 H new ATOM 0 HG11 VAL A 63 4.559 2.104 3.618 1.00 0.00 H new ATOM 0 HG12 VAL A 63 4.100 3.601 2.771 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.433 3.250 4.384 1.00 0.00 H new ATOM 0 HG21 VAL A 63 2.955 0.237 3.832 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.739 1.279 4.609 1.00 0.00 H new ATOM 0 HG23 VAL A 63 1.320 0.365 3.141 1.00 0.00 H new ATOM 1005 N ALA A 64 1.949 5.258 3.322 1.00 0.00 N ATOM 1006 CA ALA A 64 2.376 6.642 3.215 1.00 0.00 C ATOM 1007 C ALA A 64 3.390 6.946 4.319 1.00 0.00 C ATOM 1008 O ALA A 64 3.333 6.358 5.399 1.00 0.00 O ATOM 1009 CB ALA A 64 1.153 7.561 3.280 1.00 0.00 C ATOM 0 H ALA A 64 1.718 4.955 4.268 1.00 0.00 H new ATOM 0 HA ALA A 64 2.867 6.818 2.258 1.00 0.00 H new ATOM 0 HB1 ALA A 64 1.474 8.600 3.200 1.00 0.00 H new ATOM 0 HB2 ALA A 64 0.477 7.325 2.458 1.00 0.00 H new ATOM 0 HB3 ALA A 64 0.637 7.413 4.228 1.00 0.00 H new ATOM 1015 N SER A 65 4.297 7.862 4.011 1.00 0.00 N ATOM 1016 CA SER A 65 5.323 8.249 4.964 1.00 0.00 C ATOM 1017 C SER A 65 5.240 9.753 5.238 1.00 0.00 C ATOM 1018 O SER A 65 5.578 10.564 4.377 1.00 0.00 O ATOM 1019 CB SER A 65 6.717 7.878 4.455 1.00 0.00 C ATOM 1020 OG SER A 65 6.772 6.535 3.982 1.00 0.00 O ATOM 0 H SER A 65 4.342 8.347 3.115 1.00 0.00 H new ATOM 0 HA SER A 65 5.150 7.706 5.893 1.00 0.00 H new ATOM 0 HB2 SER A 65 7.002 8.557 3.652 1.00 0.00 H new ATOM 0 HB3 SER A 65 7.443 8.010 5.257 1.00 0.00 H new ATOM 0 HG SER A 65 7.678 6.337 3.664 1.00 0.00 H new ATOM 1026 N PRO A 66 4.778 10.087 6.472 1.00 0.00 N ATOM 1027 CA PRO A 66 4.647 11.478 6.870 1.00 0.00 C ATOM 1028 C PRO A 66 6.015 12.091 7.179 1.00 0.00 C ATOM 1029 O PRO A 66 6.858 11.451 7.804 1.00 0.00 O ATOM 1030 CB PRO A 66 3.720 11.458 8.075 1.00 0.00 C ATOM 1031 CG PRO A 66 3.738 10.027 8.590 1.00 0.00 C ATOM 1032 CD PRO A 66 4.368 9.154 7.517 1.00 0.00 C ATOM 0 HA PRO A 66 4.236 12.104 6.078 1.00 0.00 H new ATOM 0 HB2 PRO A 66 4.061 12.154 8.842 1.00 0.00 H new ATOM 0 HB3 PRO A 66 2.711 11.760 7.796 1.00 0.00 H new ATOM 0 HG2 PRO A 66 4.307 9.962 9.518 1.00 0.00 H new ATOM 0 HG3 PRO A 66 2.726 9.688 8.812 1.00 0.00 H new ATOM 0 HD2 PRO A 66 5.220 8.599 7.909 1.00 0.00 H new ATOM 0 HD3 PRO A 66 3.658 8.420 7.136 1.00 0.00 H new ATOM 1040 N GLY A 67 6.191 13.325 6.729 1.00 0.00 N ATOM 1041 CA GLY A 67 7.440 14.030 6.949 1.00 0.00 C ATOM 1042 C GLY A 67 8.604 13.315 6.257 1.00 0.00 C ATOM 1043 O GLY A 67 9.767 13.624 6.512 1.00 0.00 O ATOM 0 H GLY A 67 5.488 13.854 6.213 1.00 0.00 H new ATOM 0 HA2 GLY A 67 7.358 15.049 6.571 1.00 0.00 H new ATOM 0 HA3 GLY A 67 7.637 14.102 8.019 1.00 0.00 H new ATOM 1047 N PHE A 68 8.250 12.373 5.396 1.00 0.00 N ATOM 1048 CA PHE A 68 9.249 11.610 4.668 1.00 0.00 C ATOM 1049 C PHE A 68 9.068 11.771 3.157 1.00 0.00 C ATOM 1050 O PHE A 68 7.961 11.617 2.642 1.00 0.00 O ATOM 1051 CB PHE A 68 9.049 10.140 5.040 1.00 0.00 C ATOM 1052 CG PHE A 68 10.050 9.189 4.378 1.00 0.00 C ATOM 1053 CD1 PHE A 68 11.246 8.940 4.974 1.00 0.00 C ATOM 1054 CD2 PHE A 68 9.741 8.593 3.195 1.00 0.00 C ATOM 1055 CE1 PHE A 68 12.175 8.057 4.360 1.00 0.00 C ATOM 1056 CE2 PHE A 68 10.669 7.711 2.581 1.00 0.00 C ATOM 1057 CZ PHE A 68 11.866 7.462 3.177 1.00 0.00 C ATOM 0 H PHE A 68 7.284 12.121 5.186 1.00 0.00 H new ATOM 0 HA PHE A 68 10.247 11.962 4.927 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.126 10.036 6.122 1.00 0.00 H new ATOM 0 HB3 PHE A 68 8.039 9.839 4.762 1.00 0.00 H new ATOM 0 HD1 PHE A 68 11.490 9.413 5.914 1.00 0.00 H new ATOM 0 HD2 PHE A 68 8.790 8.791 2.723 1.00 0.00 H new ATOM 0 HE1 PHE A 68 13.126 7.859 4.833 1.00 0.00 H new ATOM 0 HE2 PHE A 68 10.425 7.238 1.641 1.00 0.00 H new ATOM 0 HZ PHE A 68 12.572 6.791 2.710 1.00 0.00 H new ATOM 1067 N LEU A 69 10.170 12.079 2.490 1.00 0.00 N ATOM 1068 CA LEU A 69 10.146 12.263 1.049 1.00 0.00 C ATOM 1069 C LEU A 69 9.419 13.568 0.718 1.00 0.00 C ATOM 1070 O LEU A 69 8.605 13.611 -0.203 1.00 0.00 O ATOM 1071 CB LEU A 69 9.549 11.034 0.362 1.00 0.00 C ATOM 1072 CG LEU A 69 10.537 10.142 -0.393 1.00 0.00 C ATOM 1073 CD1 LEU A 69 11.081 10.853 -1.632 1.00 0.00 C ATOM 1074 CD2 LEU A 69 11.657 9.659 0.531 1.00 0.00 C ATOM 0 H LEU A 69 11.086 12.206 2.921 1.00 0.00 H new ATOM 0 HA LEU A 69 11.160 12.355 0.659 1.00 0.00 H new ATOM 0 HB2 LEU A 69 9.047 10.429 1.117 1.00 0.00 H new ATOM 0 HB3 LEU A 69 8.784 11.369 -0.338 1.00 0.00 H new ATOM 0 HG LEU A 69 10.003 9.257 -0.739 1.00 0.00 H new ATOM 0 HD11 LEU A 69 11.781 10.197 -2.150 1.00 0.00 H new ATOM 0 HD12 LEU A 69 10.256 11.103 -2.299 1.00 0.00 H new ATOM 0 HD13 LEU A 69 11.595 11.766 -1.331 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.345 9.027 -0.031 1.00 0.00 H new ATOM 0 HD22 LEU A 69 12.196 10.518 0.929 1.00 0.00 H new ATOM 0 HD23 LEU A 69 11.228 9.087 1.354 1.00 0.00 H new ATOM 1086 N HIS A 70 9.739 14.599 1.486 1.00 0.00 N ATOM 1087 CA HIS A 70 9.127 15.900 1.285 1.00 0.00 C ATOM 1088 C HIS A 70 7.609 15.783 1.446 1.00 0.00 C ATOM 1089 O HIS A 70 6.866 16.656 1.000 1.00 0.00 O ATOM 1090 CB HIS A 70 9.536 16.492 -0.063 1.00 0.00 C ATOM 1091 CG HIS A 70 9.858 17.967 -0.016 1.00 0.00 C ATOM 1092 ND1 HIS A 70 11.067 18.456 0.445 1.00 0.00 N ATOM 1093 CD2 HIS A 70 9.115 19.053 -0.378 1.00 0.00 C ATOM 1094 CE1 HIS A 70 11.042 19.778 0.361 1.00 0.00 C ATOM 1095 NE2 HIS A 70 9.831 20.146 -0.148 1.00 0.00 N ATOM 0 H HIS A 70 10.415 14.559 2.249 1.00 0.00 H new ATOM 0 HA HIS A 70 9.486 16.595 2.044 1.00 0.00 H new ATOM 0 HB2 HIS A 70 10.407 15.953 -0.436 1.00 0.00 H new ATOM 0 HB3 HIS A 70 8.730 16.329 -0.779 1.00 0.00 H new ATOM 0 HD2 HIS A 70 8.114 19.027 -0.783 1.00 0.00 H new ATOM 0 HE1 HIS A 70 11.841 20.447 0.646 1.00 0.00 H new ATOM 0 HE2 HIS A 70 9.526 21.104 -0.323 1.00 0.00 H new ATOM 1104 N GLU A 71 7.195 14.698 2.083 1.00 0.00 N ATOM 1105 CA GLU A 71 5.780 14.456 2.308 1.00 0.00 C ATOM 1106 C GLU A 71 5.309 15.191 3.564 1.00 0.00 C ATOM 1107 O GLU A 71 6.083 15.394 4.497 1.00 0.00 O ATOM 1108 CB GLU A 71 5.490 12.957 2.408 1.00 0.00 C ATOM 1109 CG GLU A 71 3.997 12.701 2.622 1.00 0.00 C ATOM 1110 CD GLU A 71 3.202 13.002 1.349 1.00 0.00 C ATOM 1111 OE1 GLU A 71 3.335 14.095 0.780 1.00 0.00 O ATOM 1112 OE2 GLU A 71 2.424 12.050 0.955 1.00 0.00 O ATOM 0 H GLU A 71 7.815 13.976 2.451 1.00 0.00 H new ATOM 0 HA GLU A 71 5.224 14.844 1.454 1.00 0.00 H new ATOM 0 HB2 GLU A 71 5.822 12.457 1.498 1.00 0.00 H new ATOM 0 HB3 GLU A 71 6.058 12.527 3.233 1.00 0.00 H new ATOM 0 HG2 GLU A 71 3.841 11.663 2.916 1.00 0.00 H new ATOM 0 HG3 GLU A 71 3.631 13.322 3.439 1.00 0.00 H new ATOM 1120 N LYS A 72 4.040 15.572 3.547 1.00 0.00 N ATOM 1121 CA LYS A 72 3.455 16.280 4.672 1.00 0.00 C ATOM 1122 C LYS A 72 3.786 15.534 5.966 1.00 0.00 C ATOM 1123 O LYS A 72 3.732 14.306 6.010 1.00 0.00 O ATOM 1124 CB LYS A 72 1.956 16.492 4.452 1.00 0.00 C ATOM 1125 CG LYS A 72 1.671 17.904 3.936 1.00 0.00 C ATOM 1126 CD LYS A 72 0.230 18.028 3.442 1.00 0.00 C ATOM 1127 CE LYS A 72 -0.517 19.129 4.199 1.00 0.00 C ATOM 1128 NZ LYS A 72 -1.294 19.968 3.261 1.00 0.00 N ATOM 0 H LYS A 72 3.400 15.403 2.771 1.00 0.00 H new ATOM 0 HA LYS A 72 3.885 17.278 4.759 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.582 15.758 3.738 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.421 16.328 5.387 1.00 0.00 H new ATOM 0 HG2 LYS A 72 1.850 18.628 4.731 1.00 0.00 H new ATOM 0 HG3 LYS A 72 2.359 18.144 3.125 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.226 18.248 2.375 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -0.286 17.077 3.573 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.185 18.683 4.936 1.00 0.00 H new ATOM 0 HE3 LYS A 72 0.194 19.748 4.747 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -1.794 20.710 3.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -0.650 20.409 2.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -1.985 19.376 2.757 1.00 0.00 H new ATOM 1141 N LYS A 73 4.124 16.307 6.988 1.00 0.00 N ATOM 1142 CA LYS A 73 4.464 15.736 8.279 1.00 0.00 C ATOM 1143 C LYS A 73 3.234 15.038 8.865 1.00 0.00 C ATOM 1144 O LYS A 73 2.117 15.241 8.388 1.00 0.00 O ATOM 1145 CB LYS A 73 5.060 16.804 9.199 1.00 0.00 C ATOM 1146 CG LYS A 73 6.584 16.683 9.263 1.00 0.00 C ATOM 1147 CD LYS A 73 7.183 17.774 10.153 1.00 0.00 C ATOM 1148 CE LYS A 73 8.431 17.266 10.877 1.00 0.00 C ATOM 1149 NZ LYS A 73 9.499 16.942 9.904 1.00 0.00 N ATOM 0 H LYS A 73 4.169 17.325 6.947 1.00 0.00 H new ATOM 0 HA LYS A 73 5.238 14.977 8.166 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.785 17.795 8.838 1.00 0.00 H new ATOM 0 HB3 LYS A 73 4.641 16.702 10.200 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.859 15.702 9.650 1.00 0.00 H new ATOM 0 HG3 LYS A 73 7.001 16.758 8.259 1.00 0.00 H new ATOM 0 HD2 LYS A 73 7.438 18.643 9.547 1.00 0.00 H new ATOM 0 HD3 LYS A 73 6.442 18.101 10.883 1.00 0.00 H new ATOM 0 HE2 LYS A 73 8.786 18.023 11.577 1.00 0.00 H new ATOM 0 HE3 LYS A 73 8.184 16.381 11.463 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 10.380 16.729 10.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 9.216 16.115 9.341 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 9.652 17.754 9.273 1.00 0.00 H new ATOM 1162 N ASP A 74 3.479 14.232 9.886 1.00 0.00 N ATOM 1163 CA ASP A 74 2.406 13.504 10.540 1.00 0.00 C ATOM 1164 C ASP A 74 1.302 14.483 10.942 1.00 0.00 C ATOM 1165 O ASP A 74 1.554 15.677 11.104 1.00 0.00 O ATOM 1166 CB ASP A 74 2.905 12.808 11.809 1.00 0.00 C ATOM 1167 CG ASP A 74 1.818 12.477 12.834 1.00 0.00 C ATOM 1168 OD1 ASP A 74 1.075 11.497 12.683 1.00 0.00 O ATOM 1169 OD2 ASP A 74 1.750 13.286 13.837 1.00 0.00 O ATOM 0 H ASP A 74 4.406 14.067 10.277 1.00 0.00 H new ATOM 0 HA ASP A 74 2.032 12.756 9.841 1.00 0.00 H new ATOM 0 HB2 ASP A 74 3.409 11.884 11.525 1.00 0.00 H new ATOM 0 HB3 ASP A 74 3.651 13.444 12.285 1.00 0.00 H new ATOM 1175 N GLY A 75 0.100 13.945 11.090 1.00 0.00 N ATOM 1176 CA GLY A 75 -1.044 14.756 11.469 1.00 0.00 C ATOM 1177 C GLY A 75 -1.565 15.558 10.275 1.00 0.00 C ATOM 1178 O GLY A 75 -2.755 15.507 9.962 1.00 0.00 O ATOM 0 H GLY A 75 -0.106 12.955 10.954 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -1.837 14.115 11.856 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -0.762 15.435 12.273 1.00 0.00 H new ATOM 1182 N ASP A 76 -0.653 16.279 9.641 1.00 0.00 N ATOM 1183 CA ASP A 76 -1.007 17.091 8.491 1.00 0.00 C ATOM 1184 C ASP A 76 -1.639 16.200 7.418 1.00 0.00 C ATOM 1185 O ASP A 76 -2.744 16.470 6.954 1.00 0.00 O ATOM 1186 CB ASP A 76 0.230 17.756 7.883 1.00 0.00 C ATOM 1187 CG ASP A 76 0.959 18.731 8.810 1.00 0.00 C ATOM 1188 OD1 ASP A 76 1.002 18.539 10.034 1.00 0.00 O ATOM 1189 OD2 ASP A 76 1.506 19.739 8.218 1.00 0.00 O ATOM 0 H ASP A 76 0.332 16.317 9.903 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.703 17.861 8.824 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.929 16.978 7.576 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -0.069 18.290 6.981 1.00 0.00 H new ATOM 1195 N PHE A 77 -0.908 15.155 7.058 1.00 0.00 N ATOM 1196 CA PHE A 77 -1.382 14.222 6.049 1.00 0.00 C ATOM 1197 C PHE A 77 -2.707 13.585 6.473 1.00 0.00 C ATOM 1198 O PHE A 77 -3.520 13.213 5.629 1.00 0.00 O ATOM 1199 CB PHE A 77 -0.322 13.128 5.919 1.00 0.00 C ATOM 1200 CG PHE A 77 -0.629 12.090 4.838 1.00 0.00 C ATOM 1201 CD1 PHE A 77 -0.340 12.357 3.536 1.00 0.00 C ATOM 1202 CD2 PHE A 77 -1.191 10.900 5.178 1.00 0.00 C ATOM 1203 CE1 PHE A 77 -0.625 11.394 2.533 1.00 0.00 C ATOM 1204 CE2 PHE A 77 -1.477 9.936 4.175 1.00 0.00 C ATOM 1205 CZ PHE A 77 -1.187 10.204 2.872 1.00 0.00 C ATOM 0 H PHE A 77 0.009 14.934 7.447 1.00 0.00 H new ATOM 0 HA PHE A 77 -1.545 14.744 5.106 1.00 0.00 H new ATOM 0 HB2 PHE A 77 0.640 13.592 5.700 1.00 0.00 H new ATOM 0 HB3 PHE A 77 -0.220 12.620 6.878 1.00 0.00 H new ATOM 0 HD1 PHE A 77 0.107 13.302 3.265 1.00 0.00 H new ATOM 0 HD2 PHE A 77 -1.420 10.687 6.212 1.00 0.00 H new ATOM 0 HE1 PHE A 77 -0.395 11.607 1.500 1.00 0.00 H new ATOM 0 HE2 PHE A 77 -1.924 8.991 4.446 1.00 0.00 H new ATOM 0 HZ PHE A 77 -1.403 9.471 2.108 1.00 0.00 H new ATOM 1215 N GLN A 78 -2.885 13.478 7.781 1.00 0.00 N ATOM 1216 CA GLN A 78 -4.096 12.891 8.328 1.00 0.00 C ATOM 1217 C GLN A 78 -5.291 13.812 8.076 1.00 0.00 C ATOM 1218 O GLN A 78 -6.423 13.345 7.948 1.00 0.00 O ATOM 1219 CB GLN A 78 -3.938 12.595 9.821 1.00 0.00 C ATOM 1220 CG GLN A 78 -2.535 12.069 10.129 1.00 0.00 C ATOM 1221 CD GLN A 78 -2.485 11.416 11.512 1.00 0.00 C ATOM 1222 OE1 GLN A 78 -1.678 11.759 12.360 1.00 0.00 O ATOM 1223 NE2 GLN A 78 -3.391 10.458 11.691 1.00 0.00 N ATOM 0 H GLN A 78 -2.209 13.789 8.479 1.00 0.00 H new ATOM 0 HA GLN A 78 -4.278 11.943 7.821 1.00 0.00 H new ATOM 0 HB2 GLN A 78 -4.125 13.501 10.397 1.00 0.00 H new ATOM 0 HB3 GLN A 78 -4.682 11.861 10.131 1.00 0.00 H new ATOM 0 HG2 GLN A 78 -2.240 11.344 9.370 1.00 0.00 H new ATOM 0 HG3 GLN A 78 -1.818 12.888 10.084 1.00 0.00 H new ATOM 0 HE21 GLN A 78 -4.037 10.220 10.939 1.00 0.00 H new ATOM 0 HE22 GLN A 78 -3.439 9.961 12.581 1.00 0.00 H new ATOM 1232 N LYS A 79 -5.000 15.103 8.011 1.00 0.00 N ATOM 1233 CA LYS A 79 -6.037 16.095 7.778 1.00 0.00 C ATOM 1234 C LYS A 79 -6.512 15.993 6.327 1.00 0.00 C ATOM 1235 O LYS A 79 -7.708 16.087 6.054 1.00 0.00 O ATOM 1236 CB LYS A 79 -5.544 17.488 8.169 1.00 0.00 C ATOM 1237 CG LYS A 79 -6.330 18.032 9.364 1.00 0.00 C ATOM 1238 CD LYS A 79 -7.520 18.874 8.899 1.00 0.00 C ATOM 1239 CE LYS A 79 -7.734 20.076 9.822 1.00 0.00 C ATOM 1240 NZ LYS A 79 -9.143 20.138 10.272 1.00 0.00 N ATOM 0 H LYS A 79 -4.060 15.486 8.116 1.00 0.00 H new ATOM 0 HA LYS A 79 -6.902 15.901 8.413 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -4.483 17.446 8.415 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -5.648 18.166 7.322 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -6.684 17.204 9.979 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -5.674 18.637 9.990 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -7.350 19.219 7.879 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -8.420 18.260 8.881 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -7.073 20.002 10.685 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -7.472 20.996 9.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -9.272 20.959 10.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -9.768 20.231 9.446 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -9.381 19.268 10.790 1.00 0.00 H new ATOM 1253 N TRP A 80 -5.552 15.808 5.434 1.00 0.00 N ATOM 1254 CA TRP A 80 -5.857 15.695 4.018 1.00 0.00 C ATOM 1255 C TRP A 80 -6.874 14.566 3.843 1.00 0.00 C ATOM 1256 O TRP A 80 -7.933 14.766 3.251 1.00 0.00 O ATOM 1257 CB TRP A 80 -4.583 15.484 3.198 1.00 0.00 C ATOM 1258 CG TRP A 80 -4.786 15.621 1.687 1.00 0.00 C ATOM 1259 CD1 TRP A 80 -5.880 15.324 0.972 1.00 0.00 C ATOM 1260 CD2 TRP A 80 -3.819 16.102 0.730 1.00 0.00 C ATOM 1261 NE1 TRP A 80 -5.690 15.579 -0.372 1.00 0.00 N ATOM 1262 CE2 TRP A 80 -4.397 16.068 -0.523 1.00 0.00 C ATOM 1263 CE3 TRP A 80 -2.500 16.553 0.916 1.00 0.00 C ATOM 1264 CZ2 TRP A 80 -3.730 16.471 -1.686 1.00 0.00 C ATOM 1265 CZ3 TRP A 80 -1.848 16.953 -0.256 1.00 0.00 C ATOM 1266 CH2 TRP A 80 -2.415 16.923 -1.525 1.00 0.00 C ATOM 0 H TRP A 80 -4.561 15.733 5.664 1.00 0.00 H new ATOM 0 HA TRP A 80 -6.295 16.620 3.642 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -3.832 16.205 3.520 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -4.185 14.492 3.412 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -6.795 14.934 1.394 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -6.372 15.435 -1.116 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -2.028 16.588 1.887 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -4.205 16.435 -2.655 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -0.833 17.310 -0.168 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -1.844 17.247 -2.382 1.00 0.00 H new ATOM 1277 N TYR A 81 -6.518 13.404 4.369 1.00 0.00 N ATOM 1278 CA TYR A 81 -7.387 12.242 4.278 1.00 0.00 C ATOM 1279 C TYR A 81 -8.762 12.538 4.881 1.00 0.00 C ATOM 1280 O TYR A 81 -9.774 12.022 4.409 1.00 0.00 O ATOM 1281 CB TYR A 81 -6.710 11.143 5.097 1.00 0.00 C ATOM 1282 CG TYR A 81 -7.668 10.060 5.599 1.00 0.00 C ATOM 1283 CD1 TYR A 81 -8.036 9.023 4.767 1.00 0.00 C ATOM 1284 CD2 TYR A 81 -8.165 10.122 6.886 1.00 0.00 C ATOM 1285 CE1 TYR A 81 -8.937 8.006 5.239 1.00 0.00 C ATOM 1286 CE2 TYR A 81 -9.066 9.104 7.358 1.00 0.00 C ATOM 1287 CZ TYR A 81 -9.407 8.096 6.512 1.00 0.00 C ATOM 1288 OH TYR A 81 -10.261 7.134 6.958 1.00 0.00 O ATOM 0 H TYR A 81 -5.639 13.241 4.860 1.00 0.00 H new ATOM 0 HA TYR A 81 -7.536 11.955 3.237 1.00 0.00 H new ATOM 0 HB2 TYR A 81 -5.936 10.675 4.488 1.00 0.00 H new ATOM 0 HB3 TYR A 81 -6.211 11.597 5.953 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -7.647 8.975 3.761 1.00 0.00 H new ATOM 0 HD2 TYR A 81 -7.878 10.934 7.538 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -9.233 7.190 4.597 1.00 0.00 H new ATOM 0 HE2 TYR A 81 -9.462 9.140 8.362 1.00 0.00 H new ATOM 0 HH TYR A 81 -10.514 7.326 7.885 1.00 0.00 H new ATOM 1298 N ALA A 82 -8.753 13.368 5.913 1.00 0.00 N ATOM 1299 CA ALA A 82 -9.988 13.738 6.586 1.00 0.00 C ATOM 1300 C ALA A 82 -10.905 14.460 5.598 1.00 0.00 C ATOM 1301 O ALA A 82 -12.098 14.616 5.852 1.00 0.00 O ATOM 1302 CB ALA A 82 -9.664 14.595 7.812 1.00 0.00 C ATOM 0 H ALA A 82 -7.911 13.795 6.300 1.00 0.00 H new ATOM 0 HA ALA A 82 -10.514 12.851 6.937 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -10.589 14.873 8.317 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -9.034 14.027 8.496 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -9.138 15.496 7.497 1.00 0.00 H new ATOM 1308 N GLY A 83 -10.314 14.881 4.488 1.00 0.00 N ATOM 1309 CA GLY A 83 -11.063 15.582 3.460 1.00 0.00 C ATOM 1310 C GLY A 83 -11.361 14.661 2.275 1.00 0.00 C ATOM 1311 O GLY A 83 -12.269 14.929 1.489 1.00 0.00 O ATOM 0 H GLY A 83 -9.324 14.749 4.279 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -11.997 15.957 3.878 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -10.496 16.448 3.119 1.00 0.00 H new ATOM 1315 N LEU A 84 -10.577 13.596 2.183 1.00 0.00 N ATOM 1316 CA LEU A 84 -10.746 12.634 1.107 1.00 0.00 C ATOM 1317 C LEU A 84 -11.926 11.715 1.429 1.00 0.00 C ATOM 1318 O LEU A 84 -11.877 10.951 2.391 1.00 0.00 O ATOM 1319 CB LEU A 84 -9.436 11.886 0.847 1.00 0.00 C ATOM 1320 CG LEU A 84 -8.192 12.757 0.660 1.00 0.00 C ATOM 1321 CD1 LEU A 84 -6.924 11.902 0.639 1.00 0.00 C ATOM 1322 CD2 LEU A 84 -8.317 13.630 -0.590 1.00 0.00 C ATOM 0 H LEU A 84 -9.824 13.379 2.836 1.00 0.00 H new ATOM 0 HA LEU A 84 -10.986 13.144 0.174 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -9.257 11.206 1.680 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -9.562 11.271 -0.044 1.00 0.00 H new ATOM 0 HG LEU A 84 -8.113 13.429 1.514 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -6.054 12.545 0.505 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -6.834 11.361 1.581 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.979 11.190 -0.184 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -7.420 14.239 -0.700 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -8.433 12.994 -1.468 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -9.187 14.280 -0.495 1.00 0.00 H new ATOM 1334 N ASN A 85 -12.958 11.821 0.605 1.00 0.00 N ATOM 1335 CA ASN A 85 -14.149 11.008 0.790 1.00 0.00 C ATOM 1336 C ASN A 85 -13.944 9.649 0.120 1.00 0.00 C ATOM 1337 O ASN A 85 -14.556 9.362 -0.908 1.00 0.00 O ATOM 1338 CB ASN A 85 -15.373 11.670 0.153 1.00 0.00 C ATOM 1339 CG ASN A 85 -16.022 12.666 1.116 1.00 0.00 C ATOM 1340 OD1 ASN A 85 -15.642 13.822 1.204 1.00 0.00 O ATOM 1341 ND2 ASN A 85 -17.019 12.154 1.832 1.00 0.00 N ATOM 0 H ASN A 85 -12.995 12.457 -0.192 1.00 0.00 H new ATOM 0 HA ASN A 85 -14.316 10.896 1.861 1.00 0.00 H new ATOM 0 HB2 ASN A 85 -15.078 12.183 -0.762 1.00 0.00 H new ATOM 0 HB3 ASN A 85 -16.098 10.907 -0.129 1.00 0.00 H new ATOM 0 HD21 ASN A 85 -17.516 12.738 2.504 1.00 0.00 H new ATOM 0 HD22 ASN A 85 -17.286 11.177 1.709 1.00 0.00 H new ATOM 1348 N TYR A 86 -13.081 8.849 0.728 1.00 0.00 N ATOM 1349 CA TYR A 86 -12.787 7.526 0.202 1.00 0.00 C ATOM 1350 C TYR A 86 -12.475 6.543 1.332 1.00 0.00 C ATOM 1351 O TYR A 86 -11.342 6.085 1.466 1.00 0.00 O ATOM 1352 CB TYR A 86 -11.542 7.689 -0.675 1.00 0.00 C ATOM 1353 CG TYR A 86 -11.751 8.596 -1.889 1.00 0.00 C ATOM 1354 CD1 TYR A 86 -12.845 8.412 -2.710 1.00 0.00 C ATOM 1355 CD2 TYR A 86 -10.844 9.600 -2.162 1.00 0.00 C ATOM 1356 CE1 TYR A 86 -13.040 9.266 -3.852 1.00 0.00 C ATOM 1357 CE2 TYR A 86 -11.040 10.455 -3.305 1.00 0.00 C ATOM 1358 CZ TYR A 86 -12.129 10.246 -4.093 1.00 0.00 C ATOM 1359 OH TYR A 86 -12.313 11.053 -5.173 1.00 0.00 O ATOM 0 H TYR A 86 -12.575 9.091 1.580 1.00 0.00 H new ATOM 0 HA TYR A 86 -13.641 7.134 -0.351 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -10.732 8.093 -0.067 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -11.222 6.706 -1.020 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -13.555 7.627 -2.495 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -9.988 9.745 -1.519 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -13.891 9.131 -4.503 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.338 11.244 -3.531 1.00 0.00 H new ATOM 0 HH TYR A 86 -11.585 11.708 -5.220 1.00 0.00 H new ATOM 1369 N PRO A 87 -13.529 6.241 2.136 1.00 0.00 N ATOM 1370 CA PRO A 87 -13.379 5.320 3.251 1.00 0.00 C ATOM 1371 C PRO A 87 -13.293 3.873 2.759 1.00 0.00 C ATOM 1372 O PRO A 87 -13.166 2.949 3.561 1.00 0.00 O ATOM 1373 CB PRO A 87 -14.587 5.576 4.138 1.00 0.00 C ATOM 1374 CG PRO A 87 -15.602 6.292 3.261 1.00 0.00 C ATOM 1375 CD PRO A 87 -14.885 6.763 2.007 1.00 0.00 C ATOM 0 HA PRO A 87 -12.454 5.478 3.806 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -14.994 4.641 4.523 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -14.317 6.185 5.000 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -16.423 5.623 3.003 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -16.036 7.138 3.793 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -15.371 6.385 1.108 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -14.885 7.851 1.936 1.00 0.00 H new ATOM 1383 N LYS A 88 -13.367 3.723 1.445 1.00 0.00 N ATOM 1384 CA LYS A 88 -13.300 2.405 0.838 1.00 0.00 C ATOM 1385 C LYS A 88 -11.915 2.204 0.218 1.00 0.00 C ATOM 1386 O LYS A 88 -11.699 1.254 -0.532 1.00 0.00 O ATOM 1387 CB LYS A 88 -14.450 2.212 -0.152 1.00 0.00 C ATOM 1388 CG LYS A 88 -15.738 1.822 0.575 1.00 0.00 C ATOM 1389 CD LYS A 88 -15.764 0.324 0.881 1.00 0.00 C ATOM 1390 CE LYS A 88 -16.971 -0.038 1.748 1.00 0.00 C ATOM 1391 NZ LYS A 88 -16.539 -0.393 3.117 1.00 0.00 N ATOM 0 H LYS A 88 -13.473 4.492 0.784 1.00 0.00 H new ATOM 0 HA LYS A 88 -13.427 1.630 1.594 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -14.609 3.132 -0.714 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -14.187 1.439 -0.874 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -15.821 2.388 1.503 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -16.600 2.086 -0.038 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -15.799 -0.240 -0.051 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -14.845 0.038 1.393 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -17.664 0.803 1.786 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -17.509 -0.875 1.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -17.371 -0.636 3.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -15.895 -1.209 3.077 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -16.046 0.416 3.546 1.00 0.00 H new ATOM 1404 N LEU A 89 -11.013 3.113 0.557 1.00 0.00 N ATOM 1405 CA LEU A 89 -9.655 3.047 0.045 1.00 0.00 C ATOM 1406 C LEU A 89 -8.685 2.834 1.207 1.00 0.00 C ATOM 1407 O LEU A 89 -8.665 3.616 2.156 1.00 0.00 O ATOM 1408 CB LEU A 89 -9.341 4.284 -0.800 1.00 0.00 C ATOM 1409 CG LEU A 89 -7.873 4.713 -0.842 1.00 0.00 C ATOM 1410 CD1 LEU A 89 -7.030 3.710 -1.635 1.00 0.00 C ATOM 1411 CD2 LEU A 89 -7.732 6.136 -1.385 1.00 0.00 C ATOM 0 H LEU A 89 -11.196 3.899 1.180 1.00 0.00 H new ATOM 0 HA LEU A 89 -9.542 2.194 -0.624 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -9.673 4.096 -1.821 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -9.932 5.118 -0.421 1.00 0.00 H new ATOM 0 HG LEU A 89 -7.490 4.719 0.179 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -5.991 4.039 -1.649 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -7.094 2.729 -1.164 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -7.405 3.647 -2.657 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -6.679 6.415 -1.404 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -8.138 6.182 -2.396 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -8.279 6.826 -0.743 1.00 0.00 H new ATOM 1423 N PRO A 90 -7.880 1.743 1.092 1.00 0.00 N ATOM 1424 CA PRO A 90 -6.909 1.418 2.123 1.00 0.00 C ATOM 1425 C PRO A 90 -5.703 2.357 2.057 1.00 0.00 C ATOM 1426 O PRO A 90 -5.087 2.510 1.003 1.00 0.00 O ATOM 1427 CB PRO A 90 -6.544 -0.037 1.873 1.00 0.00 C ATOM 1428 CG PRO A 90 -6.965 -0.333 0.444 1.00 0.00 C ATOM 1429 CD PRO A 90 -7.873 0.795 -0.018 1.00 0.00 C ATOM 0 HA PRO A 90 -7.304 1.549 3.130 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -5.475 -0.200 2.007 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -7.057 -0.694 2.575 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -6.091 -0.409 -0.203 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -7.486 -1.289 0.390 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -7.497 1.257 -0.931 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -8.877 0.431 -0.235 1.00 0.00 H new ATOM 1437 N VAL A 91 -5.401 2.961 3.198 1.00 0.00 N ATOM 1438 CA VAL A 91 -4.279 3.882 3.282 1.00 0.00 C ATOM 1439 C VAL A 91 -3.555 3.674 4.612 1.00 0.00 C ATOM 1440 O VAL A 91 -4.142 3.853 5.678 1.00 0.00 O ATOM 1441 CB VAL A 91 -4.766 5.319 3.085 1.00 0.00 C ATOM 1442 CG1 VAL A 91 -3.735 6.323 3.602 1.00 0.00 C ATOM 1443 CG2 VAL A 91 -5.104 5.587 1.616 1.00 0.00 C ATOM 0 H VAL A 91 -5.913 2.831 4.071 1.00 0.00 H new ATOM 0 HA VAL A 91 -3.561 3.684 2.486 1.00 0.00 H new ATOM 0 HB VAL A 91 -5.678 5.446 3.667 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -4.106 7.337 3.450 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -3.565 6.155 4.665 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.798 6.194 3.060 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -5.448 6.615 1.503 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -4.215 5.432 1.004 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -5.890 4.904 1.293 1.00 0.00 H new ATOM 1453 N VAL A 92 -2.289 3.298 4.507 1.00 0.00 N ATOM 1454 CA VAL A 92 -1.477 3.063 5.689 1.00 0.00 C ATOM 1455 C VAL A 92 -0.457 4.195 5.836 1.00 0.00 C ATOM 1456 O VAL A 92 0.069 4.694 4.842 1.00 0.00 O ATOM 1457 CB VAL A 92 -0.827 1.680 5.611 1.00 0.00 C ATOM 1458 CG1 VAL A 92 -0.045 1.369 6.890 1.00 0.00 C ATOM 1459 CG2 VAL A 92 -1.873 0.599 5.332 1.00 0.00 C ATOM 0 H VAL A 92 -1.805 3.150 3.621 1.00 0.00 H new ATOM 0 HA VAL A 92 -2.098 3.066 6.585 1.00 0.00 H new ATOM 0 HB VAL A 92 -0.122 1.687 4.780 1.00 0.00 H new ATOM 0 HG11 VAL A 92 0.407 0.380 6.809 1.00 0.00 H new ATOM 0 HG12 VAL A 92 0.737 2.115 7.029 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.722 1.389 7.744 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.385 -0.375 5.281 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.613 0.593 6.133 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.367 0.807 4.383 1.00 0.00 H new ATOM 1469 N THR A 93 -0.208 4.567 7.082 1.00 0.00 N ATOM 1470 CA THR A 93 0.738 5.631 7.371 1.00 0.00 C ATOM 1471 C THR A 93 1.858 5.115 8.277 1.00 0.00 C ATOM 1472 O THR A 93 1.601 4.657 9.389 1.00 0.00 O ATOM 1473 CB THR A 93 -0.038 6.804 7.973 1.00 0.00 C ATOM 1474 OG1 THR A 93 -0.914 6.193 8.917 1.00 0.00 O ATOM 1475 CG2 THR A 93 -0.981 7.462 6.962 1.00 0.00 C ATOM 0 H THR A 93 -0.645 4.150 7.904 1.00 0.00 H new ATOM 0 HA THR A 93 1.230 5.980 6.463 1.00 0.00 H new ATOM 0 HB THR A 93 0.664 7.547 8.353 1.00 0.00 H new ATOM 0 HG1 THR A 93 -0.443 5.468 9.379 1.00 0.00 H new ATOM 0 HG21 THR A 93 -1.507 8.288 7.440 1.00 0.00 H new ATOM 0 HG22 THR A 93 -0.404 7.839 6.118 1.00 0.00 H new ATOM 0 HG23 THR A 93 -1.704 6.728 6.608 1.00 0.00 H new ATOM 1483 N ASP A 94 3.078 5.207 7.766 1.00 0.00 N ATOM 1484 CA ASP A 94 4.238 4.756 8.516 1.00 0.00 C ATOM 1485 C ASP A 94 5.134 5.956 8.831 1.00 0.00 C ATOM 1486 O ASP A 94 5.762 6.518 7.936 1.00 0.00 O ATOM 1487 CB ASP A 94 5.060 3.753 7.705 1.00 0.00 C ATOM 1488 CG ASP A 94 6.123 2.993 8.502 1.00 0.00 C ATOM 1489 OD1 ASP A 94 6.394 3.311 9.670 1.00 0.00 O ATOM 1490 OD2 ASP A 94 6.692 2.025 7.867 1.00 0.00 O ATOM 0 H ASP A 94 3.288 5.587 6.843 1.00 0.00 H new ATOM 0 HA ASP A 94 3.885 4.279 9.430 1.00 0.00 H new ATOM 0 HB2 ASP A 94 4.381 3.030 7.253 1.00 0.00 H new ATOM 0 HB3 ASP A 94 5.550 4.284 6.889 1.00 0.00 H new ATOM 1496 N ASN A 95 5.164 6.312 10.107 1.00 0.00 N ATOM 1497 CA ASN A 95 5.971 7.434 10.552 1.00 0.00 C ATOM 1498 C ASN A 95 7.443 7.151 10.244 1.00 0.00 C ATOM 1499 O ASN A 95 8.061 6.300 10.880 1.00 0.00 O ATOM 1500 CB ASN A 95 5.837 7.647 12.061 1.00 0.00 C ATOM 1501 CG ASN A 95 4.384 7.481 12.510 1.00 0.00 C ATOM 1502 OD1 ASN A 95 3.758 6.453 12.311 1.00 0.00 O ATOM 1503 ND2 ASN A 95 3.883 8.550 13.126 1.00 0.00 N ATOM 0 H ASN A 95 4.642 5.842 10.847 1.00 0.00 H new ATOM 0 HA ASN A 95 5.624 8.326 10.030 1.00 0.00 H new ATOM 0 HB2 ASN A 95 6.469 6.934 12.590 1.00 0.00 H new ATOM 0 HB3 ASN A 95 6.191 8.644 12.324 1.00 0.00 H new ATOM 0 HD21 ASN A 95 2.921 8.540 13.464 1.00 0.00 H new ATOM 0 HD22 ASN A 95 4.462 9.379 13.260 1.00 0.00 H new ATOM 1510 N GLY A 96 7.962 7.882 9.268 1.00 0.00 N ATOM 1511 CA GLY A 96 9.349 7.720 8.868 1.00 0.00 C ATOM 1512 C GLY A 96 9.487 6.648 7.785 1.00 0.00 C ATOM 1513 O GLY A 96 10.441 6.663 7.009 1.00 0.00 O ATOM 0 H GLY A 96 7.446 8.588 8.743 1.00 0.00 H new ATOM 0 HA2 GLY A 96 9.737 8.669 8.497 1.00 0.00 H new ATOM 0 HA3 GLY A 96 9.951 7.446 9.734 1.00 0.00 H new ATOM 1517 N GLY A 97 8.518 5.743 7.766 1.00 0.00 N ATOM 1518 CA GLY A 97 8.520 4.667 6.791 1.00 0.00 C ATOM 1519 C GLY A 97 9.601 3.635 7.115 1.00 0.00 C ATOM 1520 O GLY A 97 10.656 3.617 6.483 1.00 0.00 O ATOM 0 H GLY A 97 7.727 5.734 8.410 1.00 0.00 H new ATOM 0 HA2 GLY A 97 7.543 4.183 6.776 1.00 0.00 H new ATOM 0 HA3 GLY A 97 8.689 5.075 5.794 1.00 0.00 H new ATOM 1524 N THR A 98 9.302 2.799 8.099 1.00 0.00 N ATOM 1525 CA THR A 98 10.236 1.767 8.515 1.00 0.00 C ATOM 1526 C THR A 98 10.448 0.755 7.387 1.00 0.00 C ATOM 1527 O THR A 98 11.578 0.352 7.115 1.00 0.00 O ATOM 1528 CB THR A 98 9.701 1.138 9.803 1.00 0.00 C ATOM 1529 OG1 THR A 98 10.009 2.096 10.811 1.00 0.00 O ATOM 1530 CG2 THR A 98 10.492 -0.107 10.218 1.00 0.00 C ATOM 0 H THR A 98 8.425 2.816 8.620 1.00 0.00 H new ATOM 0 HA THR A 98 11.221 2.185 8.724 1.00 0.00 H new ATOM 0 HB THR A 98 8.652 0.875 9.670 1.00 0.00 H new ATOM 0 HG1 THR A 98 9.695 1.769 11.680 1.00 0.00 H new ATOM 0 HG21 THR A 98 10.072 -0.515 11.137 1.00 0.00 H new ATOM 0 HG22 THR A 98 10.432 -0.856 9.428 1.00 0.00 H new ATOM 0 HG23 THR A 98 11.535 0.163 10.384 1.00 0.00 H new ATOM 1538 N ILE A 99 9.345 0.374 6.761 1.00 0.00 N ATOM 1539 CA ILE A 99 9.396 -0.582 5.669 1.00 0.00 C ATOM 1540 C ILE A 99 9.901 0.119 4.406 1.00 0.00 C ATOM 1541 O ILE A 99 10.627 -0.476 3.610 1.00 0.00 O ATOM 1542 CB ILE A 99 8.039 -1.266 5.491 1.00 0.00 C ATOM 1543 CG1 ILE A 99 7.565 -1.893 6.803 1.00 0.00 C ATOM 1544 CG2 ILE A 99 8.084 -2.287 4.352 1.00 0.00 C ATOM 1545 CD1 ILE A 99 6.136 -1.461 7.134 1.00 0.00 C ATOM 0 H ILE A 99 8.410 0.711 6.990 1.00 0.00 H new ATOM 0 HA ILE A 99 10.102 -1.381 5.895 1.00 0.00 H new ATOM 0 HB ILE A 99 7.308 -0.506 5.214 1.00 0.00 H new ATOM 0 HG12 ILE A 99 7.612 -2.979 6.728 1.00 0.00 H new ATOM 0 HG13 ILE A 99 8.234 -1.600 7.612 1.00 0.00 H new ATOM 0 HG21 ILE A 99 7.107 -2.758 4.247 1.00 0.00 H new ATOM 0 HG22 ILE A 99 8.345 -1.783 3.422 1.00 0.00 H new ATOM 0 HG23 ILE A 99 8.832 -3.048 4.575 1.00 0.00 H new ATOM 0 HD11 ILE A 99 5.825 -1.921 8.072 1.00 0.00 H new ATOM 0 HD12 ILE A 99 6.097 -0.376 7.232 1.00 0.00 H new ATOM 0 HD13 ILE A 99 5.466 -1.777 6.335 1.00 0.00 H new ATOM 1557 N ALA A 100 9.498 1.372 4.261 1.00 0.00 N ATOM 1558 CA ALA A 100 9.900 2.160 3.110 1.00 0.00 C ATOM 1559 C ALA A 100 11.423 2.315 3.109 1.00 0.00 C ATOM 1560 O ALA A 100 12.061 2.197 2.064 1.00 0.00 O ATOM 1561 CB ALA A 100 9.179 3.509 3.135 1.00 0.00 C ATOM 0 H ALA A 100 8.896 1.862 4.923 1.00 0.00 H new ATOM 0 HA ALA A 100 9.618 1.657 2.185 1.00 0.00 H new ATOM 0 HB1 ALA A 100 9.482 4.099 2.270 1.00 0.00 H new ATOM 0 HB2 ALA A 100 8.102 3.346 3.104 1.00 0.00 H new ATOM 0 HB3 ALA A 100 9.439 4.044 4.049 1.00 0.00 H new ATOM 1567 N GLN A 101 11.959 2.576 4.292 1.00 0.00 N ATOM 1568 CA GLN A 101 13.394 2.748 4.440 1.00 0.00 C ATOM 1569 C GLN A 101 14.088 1.384 4.505 1.00 0.00 C ATOM 1570 O GLN A 101 15.189 1.220 3.981 1.00 0.00 O ATOM 1571 CB GLN A 101 13.721 3.587 5.678 1.00 0.00 C ATOM 1572 CG GLN A 101 14.618 4.773 5.315 1.00 0.00 C ATOM 1573 CD GLN A 101 15.573 5.109 6.460 1.00 0.00 C ATOM 1574 OE1 GLN A 101 16.748 4.778 6.441 1.00 0.00 O ATOM 1575 NE2 GLN A 101 15.006 5.783 7.458 1.00 0.00 N ATOM 0 H GLN A 101 11.426 2.672 5.156 1.00 0.00 H new ATOM 0 HA GLN A 101 13.768 3.284 3.568 1.00 0.00 H new ATOM 0 HB2 GLN A 101 12.798 3.950 6.130 1.00 0.00 H new ATOM 0 HB3 GLN A 101 14.218 2.965 6.423 1.00 0.00 H new ATOM 0 HG2 GLN A 101 15.190 4.539 4.417 1.00 0.00 H new ATOM 0 HG3 GLN A 101 14.002 5.642 5.084 1.00 0.00 H new ATOM 0 HE21 GLN A 101 14.017 6.029 7.411 1.00 0.00 H new ATOM 0 HE22 GLN A 101 15.560 6.054 8.270 1.00 0.00 H new ATOM 1584 N SER A 102 13.415 0.444 5.150 1.00 0.00 N ATOM 1585 CA SER A 102 13.953 -0.899 5.289 1.00 0.00 C ATOM 1586 C SER A 102 14.038 -1.573 3.918 1.00 0.00 C ATOM 1587 O SER A 102 14.900 -2.421 3.692 1.00 0.00 O ATOM 1588 CB SER A 102 13.098 -1.738 6.241 1.00 0.00 C ATOM 1589 OG SER A 102 13.600 -3.065 6.379 1.00 0.00 O ATOM 0 H SER A 102 12.502 0.585 5.582 1.00 0.00 H new ATOM 0 HA SER A 102 14.955 -0.825 5.713 1.00 0.00 H new ATOM 0 HB2 SER A 102 13.067 -1.258 7.219 1.00 0.00 H new ATOM 0 HB3 SER A 102 12.073 -1.774 5.872 1.00 0.00 H new ATOM 0 HG SER A 102 13.028 -3.569 6.996 1.00 0.00 H new ATOM 1595 N LEU A 103 13.134 -1.170 3.039 1.00 0.00 N ATOM 1596 CA LEU A 103 13.096 -1.723 1.697 1.00 0.00 C ATOM 1597 C LEU A 103 13.941 -0.851 0.765 1.00 0.00 C ATOM 1598 O LEU A 103 14.251 -1.253 -0.356 1.00 0.00 O ATOM 1599 CB LEU A 103 11.651 -1.900 1.229 1.00 0.00 C ATOM 1600 CG LEU A 103 10.921 -3.136 1.757 1.00 0.00 C ATOM 1601 CD1 LEU A 103 9.474 -3.174 1.263 1.00 0.00 C ATOM 1602 CD2 LEU A 103 11.681 -4.415 1.401 1.00 0.00 C ATOM 0 H LEU A 103 12.421 -0.466 3.230 1.00 0.00 H new ATOM 0 HA LEU A 103 13.534 -2.721 1.686 1.00 0.00 H new ATOM 0 HB2 LEU A 103 11.085 -1.016 1.521 1.00 0.00 H new ATOM 0 HB3 LEU A 103 11.645 -1.937 0.140 1.00 0.00 H new ATOM 0 HG LEU A 103 10.887 -3.072 2.845 1.00 0.00 H new ATOM 0 HD11 LEU A 103 8.979 -4.063 1.654 1.00 0.00 H new ATOM 0 HD12 LEU A 103 8.948 -2.284 1.609 1.00 0.00 H new ATOM 0 HD13 LEU A 103 9.462 -3.202 0.173 1.00 0.00 H new ATOM 0 HD21 LEU A 103 11.141 -5.279 1.788 1.00 0.00 H new ATOM 0 HD22 LEU A 103 11.768 -4.497 0.318 1.00 0.00 H new ATOM 0 HD23 LEU A 103 12.677 -4.382 1.843 1.00 0.00 H new ATOM 1614 N ASN A 104 14.290 0.325 1.264 1.00 0.00 N ATOM 1615 CA ASN A 104 15.093 1.257 0.492 1.00 0.00 C ATOM 1616 C ASN A 104 14.264 1.788 -0.680 1.00 0.00 C ATOM 1617 O ASN A 104 14.774 1.934 -1.790 1.00 0.00 O ATOM 1618 CB ASN A 104 16.335 0.572 -0.081 1.00 0.00 C ATOM 1619 CG ASN A 104 17.328 1.601 -0.625 1.00 0.00 C ATOM 1620 OD1 ASN A 104 17.367 1.900 -1.806 1.00 0.00 O ATOM 1621 ND2 ASN A 104 18.125 2.124 0.302 1.00 0.00 N ATOM 0 H ASN A 104 14.031 0.654 2.194 1.00 0.00 H new ATOM 0 HA ASN A 104 15.401 2.066 1.155 1.00 0.00 H new ATOM 0 HB2 ASN A 104 16.814 -0.027 0.694 1.00 0.00 H new ATOM 0 HB3 ASN A 104 16.042 -0.112 -0.877 1.00 0.00 H new ATOM 0 HD21 ASN A 104 18.822 2.821 0.041 1.00 0.00 H new ATOM 0 HD22 ASN A 104 18.039 1.828 1.274 1.00 0.00 H new ATOM 1628 N ILE A 105 13.001 2.064 -0.393 1.00 0.00 N ATOM 1629 CA ILE A 105 12.096 2.575 -1.409 1.00 0.00 C ATOM 1630 C ILE A 105 12.422 4.044 -1.684 1.00 0.00 C ATOM 1631 O ILE A 105 13.184 4.353 -2.598 1.00 0.00 O ATOM 1632 CB ILE A 105 10.641 2.335 -1.000 1.00 0.00 C ATOM 1633 CG1 ILE A 105 10.389 0.853 -0.715 1.00 0.00 C ATOM 1634 CG2 ILE A 105 9.679 2.889 -2.051 1.00 0.00 C ATOM 1635 CD1 ILE A 105 8.926 0.609 -0.338 1.00 0.00 C ATOM 0 H ILE A 105 12.582 1.943 0.529 1.00 0.00 H new ATOM 0 HA ILE A 105 12.233 2.036 -2.347 1.00 0.00 H new ATOM 0 HB ILE A 105 10.452 2.877 -0.073 1.00 0.00 H new ATOM 0 HG12 ILE A 105 10.646 0.261 -1.594 1.00 0.00 H new ATOM 0 HG13 ILE A 105 11.038 0.519 0.095 1.00 0.00 H new ATOM 0 HG21 ILE A 105 8.652 2.706 -1.736 1.00 0.00 H new ATOM 0 HG22 ILE A 105 9.839 3.962 -2.161 1.00 0.00 H new ATOM 0 HG23 ILE A 105 9.860 2.395 -3.006 1.00 0.00 H new ATOM 0 HD11 ILE A 105 8.773 -0.452 -0.140 1.00 0.00 H new ATOM 0 HD12 ILE A 105 8.680 1.184 0.555 1.00 0.00 H new ATOM 0 HD13 ILE A 105 8.282 0.921 -1.160 1.00 0.00 H new ATOM 1647 N SER A 106 11.831 4.910 -0.875 1.00 0.00 N ATOM 1648 CA SER A 106 12.051 6.340 -1.019 1.00 0.00 C ATOM 1649 C SER A 106 11.749 6.773 -2.455 1.00 0.00 C ATOM 1650 O SER A 106 12.254 7.795 -2.918 1.00 0.00 O ATOM 1651 CB SER A 106 13.484 6.718 -0.641 1.00 0.00 C ATOM 1652 OG SER A 106 14.447 6.006 -1.415 1.00 0.00 O ATOM 0 H SER A 106 11.200 4.650 -0.117 1.00 0.00 H new ATOM 0 HA SER A 106 11.376 6.860 -0.339 1.00 0.00 H new ATOM 0 HB2 SER A 106 13.626 7.789 -0.783 1.00 0.00 H new ATOM 0 HB3 SER A 106 13.646 6.512 0.417 1.00 0.00 H new ATOM 0 HG SER A 106 14.030 5.686 -2.242 1.00 0.00 H new ATOM 1658 N VAL A 107 10.926 5.973 -3.119 1.00 0.00 N ATOM 1659 CA VAL A 107 10.551 6.261 -4.493 1.00 0.00 C ATOM 1660 C VAL A 107 9.097 5.843 -4.718 1.00 0.00 C ATOM 1661 O VAL A 107 8.702 4.735 -4.356 1.00 0.00 O ATOM 1662 CB VAL A 107 11.525 5.579 -5.455 1.00 0.00 C ATOM 1663 CG1 VAL A 107 11.697 4.100 -5.105 1.00 0.00 C ATOM 1664 CG2 VAL A 107 11.071 5.750 -6.907 1.00 0.00 C ATOM 0 H VAL A 107 10.509 5.127 -2.731 1.00 0.00 H new ATOM 0 HA VAL A 107 10.616 7.331 -4.691 1.00 0.00 H new ATOM 0 HB VAL A 107 12.496 6.063 -5.348 1.00 0.00 H new ATOM 0 HG11 VAL A 107 12.394 3.639 -5.805 1.00 0.00 H new ATOM 0 HG12 VAL A 107 12.087 4.009 -4.091 1.00 0.00 H new ATOM 0 HG13 VAL A 107 10.733 3.596 -5.170 1.00 0.00 H new ATOM 0 HG21 VAL A 107 11.781 5.256 -7.571 1.00 0.00 H new ATOM 0 HG22 VAL A 107 10.084 5.305 -7.035 1.00 0.00 H new ATOM 0 HG23 VAL A 107 11.024 6.811 -7.151 1.00 0.00 H new ATOM 1674 N TYR A 108 8.338 6.751 -5.315 1.00 0.00 N ATOM 1675 CA TYR A 108 6.937 6.490 -5.592 1.00 0.00 C ATOM 1676 C TYR A 108 6.587 6.852 -7.038 1.00 0.00 C ATOM 1677 O TYR A 108 7.221 7.719 -7.635 1.00 0.00 O ATOM 1678 CB TYR A 108 6.143 7.395 -4.647 1.00 0.00 C ATOM 1679 CG TYR A 108 6.570 7.290 -3.182 1.00 0.00 C ATOM 1680 CD1 TYR A 108 6.893 6.061 -2.644 1.00 0.00 C ATOM 1681 CD2 TYR A 108 6.630 8.423 -2.398 1.00 0.00 C ATOM 1682 CE1 TYR A 108 7.296 5.960 -1.265 1.00 0.00 C ATOM 1683 CE2 TYR A 108 7.032 8.324 -1.018 1.00 0.00 C ATOM 1684 CZ TYR A 108 7.344 7.098 -0.520 1.00 0.00 C ATOM 1685 OH TYR A 108 7.724 7.004 0.783 1.00 0.00 O ATOM 0 H TYR A 108 8.668 7.669 -5.614 1.00 0.00 H new ATOM 0 HA TYR A 108 6.709 5.434 -5.449 1.00 0.00 H new ATOM 0 HB2 TYR A 108 6.252 8.429 -4.974 1.00 0.00 H new ATOM 0 HB3 TYR A 108 5.085 7.146 -4.725 1.00 0.00 H new ATOM 0 HD1 TYR A 108 6.844 5.174 -3.258 1.00 0.00 H new ATOM 0 HD2 TYR A 108 6.376 9.385 -2.819 1.00 0.00 H new ATOM 0 HE1 TYR A 108 7.554 5.005 -0.833 1.00 0.00 H new ATOM 0 HE2 TYR A 108 7.084 9.204 -0.393 1.00 0.00 H new ATOM 0 HH TYR A 108 7.714 7.895 1.192 1.00 0.00 H new ATOM 1695 N PRO A 109 5.552 6.149 -7.571 1.00 0.00 N ATOM 1696 CA PRO A 109 4.854 5.139 -6.795 1.00 0.00 C ATOM 1697 C PRO A 109 5.696 3.868 -6.668 1.00 0.00 C ATOM 1698 O PRO A 109 6.721 3.728 -7.334 1.00 0.00 O ATOM 1699 CB PRO A 109 3.543 4.912 -7.532 1.00 0.00 C ATOM 1700 CG PRO A 109 3.756 5.457 -8.935 1.00 0.00 C ATOM 1701 CD PRO A 109 5.021 6.299 -8.924 1.00 0.00 C ATOM 0 HA PRO A 109 4.668 5.452 -5.767 1.00 0.00 H new ATOM 0 HB2 PRO A 109 3.288 3.853 -7.559 1.00 0.00 H new ATOM 0 HB3 PRO A 109 2.721 5.425 -7.034 1.00 0.00 H new ATOM 0 HG2 PRO A 109 3.848 4.640 -9.651 1.00 0.00 H new ATOM 0 HG3 PRO A 109 2.901 6.058 -9.244 1.00 0.00 H new ATOM 0 HD2 PRO A 109 5.735 5.952 -9.671 1.00 0.00 H new ATOM 0 HD3 PRO A 109 4.804 7.343 -9.151 1.00 0.00 H new ATOM 1709 N SER A 110 5.231 2.972 -5.808 1.00 0.00 N ATOM 1710 CA SER A 110 5.928 1.718 -5.584 1.00 0.00 C ATOM 1711 C SER A 110 4.948 0.658 -5.076 1.00 0.00 C ATOM 1712 O SER A 110 3.974 0.983 -4.399 1.00 0.00 O ATOM 1713 CB SER A 110 7.079 1.895 -4.593 1.00 0.00 C ATOM 1714 OG SER A 110 8.228 2.473 -5.207 1.00 0.00 O ATOM 0 H SER A 110 4.380 3.091 -5.259 1.00 0.00 H new ATOM 0 HA SER A 110 6.351 1.388 -6.533 1.00 0.00 H new ATOM 0 HB2 SER A 110 6.752 2.527 -3.767 1.00 0.00 H new ATOM 0 HB3 SER A 110 7.344 0.927 -4.168 1.00 0.00 H new ATOM 0 HG SER A 110 8.170 3.450 -5.155 1.00 0.00 H new ATOM 1720 N TRP A 111 5.241 -0.587 -5.421 1.00 0.00 N ATOM 1721 CA TRP A 111 4.399 -1.695 -5.009 1.00 0.00 C ATOM 1722 C TRP A 111 5.292 -2.752 -4.355 1.00 0.00 C ATOM 1723 O TRP A 111 6.379 -3.042 -4.852 1.00 0.00 O ATOM 1724 CB TRP A 111 3.592 -2.242 -6.188 1.00 0.00 C ATOM 1725 CG TRP A 111 2.705 -1.199 -6.871 1.00 0.00 C ATOM 1726 CD1 TRP A 111 3.064 -0.270 -7.768 1.00 0.00 C ATOM 1727 CD2 TRP A 111 1.287 -1.014 -6.674 1.00 0.00 C ATOM 1728 NE1 TRP A 111 1.986 0.496 -8.162 1.00 0.00 N ATOM 1729 CE2 TRP A 111 0.871 0.029 -7.475 1.00 0.00 C ATOM 1730 CE3 TRP A 111 0.386 -1.706 -5.846 1.00 0.00 C ATOM 1731 CZ2 TRP A 111 -0.456 0.474 -7.528 1.00 0.00 C ATOM 1732 CZ3 TRP A 111 -0.936 -1.249 -5.909 1.00 0.00 C ATOM 1733 CH2 TRP A 111 -1.371 -0.201 -6.712 1.00 0.00 C ATOM 0 H TRP A 111 6.051 -0.852 -5.982 1.00 0.00 H new ATOM 0 HA TRP A 111 3.659 -1.364 -4.280 1.00 0.00 H new ATOM 0 HB2 TRP A 111 4.280 -2.658 -6.924 1.00 0.00 H new ATOM 0 HB3 TRP A 111 2.966 -3.063 -5.837 1.00 0.00 H new ATOM 0 HD1 TRP A 111 4.071 -0.138 -8.136 1.00 0.00 H new ATOM 0 HE1 TRP A 111 2.004 1.264 -8.834 1.00 0.00 H new ATOM 0 HE3 TRP A 111 0.690 -2.525 -5.211 1.00 0.00 H new ATOM 0 HZ2 TRP A 111 -0.757 1.293 -8.164 1.00 0.00 H new ATOM 0 HZ3 TRP A 111 -1.669 -1.745 -5.290 1.00 0.00 H new ATOM 0 HH2 TRP A 111 -2.411 0.091 -6.706 1.00 0.00 H new ATOM 1744 N ALA A 112 4.802 -3.298 -3.253 1.00 0.00 N ATOM 1745 CA ALA A 112 5.542 -4.316 -2.527 1.00 0.00 C ATOM 1746 C ALA A 112 4.634 -5.520 -2.275 1.00 0.00 C ATOM 1747 O ALA A 112 3.441 -5.359 -2.020 1.00 0.00 O ATOM 1748 CB ALA A 112 6.094 -3.719 -1.231 1.00 0.00 C ATOM 0 H ALA A 112 3.900 -3.054 -2.844 1.00 0.00 H new ATOM 0 HA ALA A 112 6.392 -4.663 -3.114 1.00 0.00 H new ATOM 0 HB1 ALA A 112 6.649 -4.483 -0.686 1.00 0.00 H new ATOM 0 HB2 ALA A 112 6.758 -2.887 -1.467 1.00 0.00 H new ATOM 0 HB3 ALA A 112 5.269 -3.361 -0.615 1.00 0.00 H new ATOM 1754 N LEU A 113 5.231 -6.700 -2.352 1.00 0.00 N ATOM 1755 CA LEU A 113 4.490 -7.931 -2.135 1.00 0.00 C ATOM 1756 C LEU A 113 4.911 -8.544 -0.799 1.00 0.00 C ATOM 1757 O LEU A 113 6.100 -8.632 -0.498 1.00 0.00 O ATOM 1758 CB LEU A 113 4.659 -8.874 -3.327 1.00 0.00 C ATOM 1759 CG LEU A 113 3.696 -10.063 -3.383 1.00 0.00 C ATOM 1760 CD1 LEU A 113 2.254 -9.590 -3.577 1.00 0.00 C ATOM 1761 CD2 LEU A 113 4.122 -11.061 -4.461 1.00 0.00 C ATOM 0 H LEU A 113 6.221 -6.830 -2.562 1.00 0.00 H new ATOM 0 HA LEU A 113 3.421 -7.728 -2.069 1.00 0.00 H new ATOM 0 HB2 LEU A 113 4.543 -8.294 -4.243 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.679 -9.258 -3.320 1.00 0.00 H new ATOM 0 HG LEU A 113 3.738 -10.584 -2.427 1.00 0.00 H new ATOM 0 HD11 LEU A 113 1.590 -10.453 -3.614 1.00 0.00 H new ATOM 0 HD12 LEU A 113 1.967 -8.946 -2.745 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.176 -9.033 -4.511 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.422 -11.896 -4.481 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.125 -10.567 -5.433 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.123 -11.432 -4.239 1.00 0.00 H new ATOM 1773 N ILE A 114 3.911 -8.955 -0.031 1.00 0.00 N ATOM 1774 CA ILE A 114 4.162 -9.558 1.266 1.00 0.00 C ATOM 1775 C ILE A 114 3.530 -10.950 1.308 1.00 0.00 C ATOM 1776 O ILE A 114 2.307 -11.081 1.349 1.00 0.00 O ATOM 1777 CB ILE A 114 3.684 -8.633 2.389 1.00 0.00 C ATOM 1778 CG1 ILE A 114 3.941 -7.166 2.037 1.00 0.00 C ATOM 1779 CG2 ILE A 114 4.320 -9.021 3.725 1.00 0.00 C ATOM 1780 CD1 ILE A 114 5.442 -6.879 1.940 1.00 0.00 C ATOM 0 H ILE A 114 2.925 -8.882 -0.283 1.00 0.00 H new ATOM 0 HA ILE A 114 5.233 -9.688 1.424 1.00 0.00 H new ATOM 0 HB ILE A 114 2.606 -8.754 2.497 1.00 0.00 H new ATOM 0 HG12 ILE A 114 3.459 -6.926 1.089 1.00 0.00 H new ATOM 0 HG13 ILE A 114 3.492 -6.523 2.794 1.00 0.00 H new ATOM 0 HG21 ILE A 114 3.964 -8.349 4.506 1.00 0.00 H new ATOM 0 HG22 ILE A 114 4.045 -10.046 3.975 1.00 0.00 H new ATOM 0 HG23 ILE A 114 5.405 -8.945 3.647 1.00 0.00 H new ATOM 0 HD11 ILE A 114 5.596 -5.830 1.689 1.00 0.00 H new ATOM 0 HD12 ILE A 114 5.917 -7.097 2.897 1.00 0.00 H new ATOM 0 HD13 ILE A 114 5.883 -7.506 1.165 1.00 0.00 H new ATOM 1792 N GLY A 115 4.392 -11.957 1.292 1.00 0.00 N ATOM 1793 CA GLY A 115 3.933 -13.335 1.327 1.00 0.00 C ATOM 1794 C GLY A 115 2.887 -13.537 2.425 1.00 0.00 C ATOM 1795 O GLY A 115 2.627 -12.630 3.216 1.00 0.00 O ATOM 0 H GLY A 115 5.405 -11.846 1.255 1.00 0.00 H new ATOM 0 HA2 GLY A 115 3.508 -13.605 0.360 1.00 0.00 H new ATOM 0 HA3 GLY A 115 4.779 -14.000 1.499 1.00 0.00 H new ATOM 1799 N LYS A 116 2.315 -14.733 2.441 1.00 0.00 N ATOM 1800 CA LYS A 116 1.303 -15.066 3.429 1.00 0.00 C ATOM 1801 C LYS A 116 1.942 -15.087 4.819 1.00 0.00 C ATOM 1802 O LYS A 116 1.242 -15.017 5.829 1.00 0.00 O ATOM 1803 CB LYS A 116 0.600 -16.373 3.055 1.00 0.00 C ATOM 1804 CG LYS A 116 1.603 -17.522 2.943 1.00 0.00 C ATOM 1805 CD LYS A 116 1.778 -17.956 1.487 1.00 0.00 C ATOM 1806 CE LYS A 116 2.946 -18.933 1.343 1.00 0.00 C ATOM 1807 NZ LYS A 116 3.247 -19.174 -0.086 1.00 0.00 N ATOM 0 H LYS A 116 2.534 -15.483 1.785 1.00 0.00 H new ATOM 0 HA LYS A 116 0.523 -14.305 3.448 1.00 0.00 H new ATOM 0 HB2 LYS A 116 -0.152 -16.614 3.807 1.00 0.00 H new ATOM 0 HB3 LYS A 116 0.075 -16.250 2.108 1.00 0.00 H new ATOM 0 HG2 LYS A 116 2.565 -17.211 3.352 1.00 0.00 H new ATOM 0 HG3 LYS A 116 1.261 -18.368 3.540 1.00 0.00 H new ATOM 0 HD2 LYS A 116 0.861 -18.425 1.131 1.00 0.00 H new ATOM 0 HD3 LYS A 116 1.952 -17.081 0.861 1.00 0.00 H new ATOM 0 HE2 LYS A 116 3.827 -18.532 1.844 1.00 0.00 H new ATOM 0 HE3 LYS A 116 2.702 -19.875 1.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 4.042 -19.839 -0.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 2.410 -19.577 -0.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 3.500 -18.275 -0.544 1.00 0.00 H new ATOM 1820 N ASP A 117 3.263 -15.180 4.827 1.00 0.00 N ATOM 1821 CA ASP A 117 4.004 -15.211 6.077 1.00 0.00 C ATOM 1822 C ASP A 117 4.047 -13.803 6.673 1.00 0.00 C ATOM 1823 O ASP A 117 4.217 -13.641 7.881 1.00 0.00 O ATOM 1824 CB ASP A 117 5.445 -15.674 5.852 1.00 0.00 C ATOM 1825 CG ASP A 117 5.617 -16.753 4.781 1.00 0.00 C ATOM 1826 OD1 ASP A 117 5.967 -16.458 3.628 1.00 0.00 O ATOM 1827 OD2 ASP A 117 5.374 -17.957 5.176 1.00 0.00 O ATOM 0 H ASP A 117 3.840 -15.235 3.988 1.00 0.00 H new ATOM 0 HA ASP A 117 3.503 -15.907 6.749 1.00 0.00 H new ATOM 0 HB2 ASP A 117 6.050 -14.810 5.576 1.00 0.00 H new ATOM 0 HB3 ASP A 117 5.841 -16.052 6.795 1.00 0.00 H new ATOM 1833 N GLY A 118 3.891 -12.819 5.799 1.00 0.00 N ATOM 1834 CA GLY A 118 3.910 -11.430 6.224 1.00 0.00 C ATOM 1835 C GLY A 118 5.291 -10.808 6.000 1.00 0.00 C ATOM 1836 O GLY A 118 5.642 -9.820 6.645 1.00 0.00 O ATOM 0 H GLY A 118 3.751 -12.957 4.798 1.00 0.00 H new ATOM 0 HA2 GLY A 118 3.159 -10.866 5.671 1.00 0.00 H new ATOM 0 HA3 GLY A 118 3.644 -11.365 7.279 1.00 0.00 H new ATOM 1840 N ASP A 119 6.035 -11.411 5.085 1.00 0.00 N ATOM 1841 CA ASP A 119 7.368 -10.927 4.769 1.00 0.00 C ATOM 1842 C ASP A 119 7.432 -10.556 3.287 1.00 0.00 C ATOM 1843 O ASP A 119 6.796 -11.199 2.453 1.00 0.00 O ATOM 1844 CB ASP A 119 8.421 -12.006 5.033 1.00 0.00 C ATOM 1845 CG ASP A 119 8.491 -13.111 3.979 1.00 0.00 C ATOM 1846 OD1 ASP A 119 9.234 -13.007 2.991 1.00 0.00 O ATOM 1847 OD2 ASP A 119 7.732 -14.130 4.206 1.00 0.00 O ATOM 0 H ASP A 119 5.741 -12.230 4.553 1.00 0.00 H new ATOM 0 HA ASP A 119 7.572 -10.061 5.399 1.00 0.00 H new ATOM 0 HB2 ASP A 119 9.399 -11.529 5.103 1.00 0.00 H new ATOM 0 HB3 ASP A 119 8.218 -12.461 6.002 1.00 0.00 H new ATOM 1853 N VAL A 120 8.208 -9.519 3.001 1.00 0.00 N ATOM 1854 CA VAL A 120 8.365 -9.055 1.634 1.00 0.00 C ATOM 1855 C VAL A 120 8.837 -10.215 0.756 1.00 0.00 C ATOM 1856 O VAL A 120 9.929 -10.744 0.956 1.00 0.00 O ATOM 1857 CB VAL A 120 9.310 -7.852 1.595 1.00 0.00 C ATOM 1858 CG1 VAL A 120 9.574 -7.409 0.154 1.00 0.00 C ATOM 1859 CG2 VAL A 120 8.760 -6.695 2.432 1.00 0.00 C ATOM 0 H VAL A 120 8.735 -8.988 3.694 1.00 0.00 H new ATOM 0 HA VAL A 120 7.410 -8.714 1.235 1.00 0.00 H new ATOM 0 HB VAL A 120 10.261 -8.159 2.031 1.00 0.00 H new ATOM 0 HG11 VAL A 120 10.248 -6.553 0.154 1.00 0.00 H new ATOM 0 HG12 VAL A 120 10.029 -8.229 -0.401 1.00 0.00 H new ATOM 0 HG13 VAL A 120 8.633 -7.129 -0.319 1.00 0.00 H new ATOM 0 HG21 VAL A 120 9.451 -5.853 2.387 1.00 0.00 H new ATOM 0 HG22 VAL A 120 7.790 -6.390 2.039 1.00 0.00 H new ATOM 0 HG23 VAL A 120 8.647 -7.017 3.467 1.00 0.00 H new ATOM 1869 N GLN A 121 7.989 -10.578 -0.196 1.00 0.00 N ATOM 1870 CA GLN A 121 8.307 -11.666 -1.105 1.00 0.00 C ATOM 1871 C GLN A 121 8.764 -11.114 -2.457 1.00 0.00 C ATOM 1872 O GLN A 121 9.597 -11.719 -3.129 1.00 0.00 O ATOM 1873 CB GLN A 121 7.111 -12.606 -1.273 1.00 0.00 C ATOM 1874 CG GLN A 121 5.902 -11.860 -1.840 1.00 0.00 C ATOM 1875 CD GLN A 121 4.764 -12.827 -2.170 1.00 0.00 C ATOM 1876 OE1 GLN A 121 3.640 -12.680 -1.720 1.00 0.00 O ATOM 1877 NE2 GLN A 121 5.118 -13.823 -2.978 1.00 0.00 N ATOM 0 H GLN A 121 7.083 -10.138 -0.357 1.00 0.00 H new ATOM 0 HA GLN A 121 9.126 -12.244 -0.676 1.00 0.00 H new ATOM 0 HB2 GLN A 121 7.380 -13.427 -1.937 1.00 0.00 H new ATOM 0 HB3 GLN A 121 6.852 -13.046 -0.310 1.00 0.00 H new ATOM 0 HG2 GLN A 121 5.557 -11.119 -1.119 1.00 0.00 H new ATOM 0 HG3 GLN A 121 6.194 -11.317 -2.739 1.00 0.00 H new ATOM 0 HE21 GLN A 121 6.077 -13.887 -3.319 1.00 0.00 H new ATOM 0 HE22 GLN A 121 4.430 -14.523 -3.257 1.00 0.00 H new ATOM 1886 N ARG A 122 8.199 -9.969 -2.813 1.00 0.00 N ATOM 1887 CA ARG A 122 8.538 -9.327 -4.072 1.00 0.00 C ATOM 1888 C ARG A 122 8.416 -7.808 -3.943 1.00 0.00 C ATOM 1889 O ARG A 122 7.507 -7.308 -3.283 1.00 0.00 O ATOM 1890 CB ARG A 122 7.625 -9.812 -5.200 1.00 0.00 C ATOM 1891 CG ARG A 122 8.336 -9.733 -6.553 1.00 0.00 C ATOM 1892 CD ARG A 122 7.393 -10.128 -7.692 1.00 0.00 C ATOM 1893 NE ARG A 122 7.928 -9.642 -8.983 1.00 0.00 N ATOM 1894 CZ ARG A 122 7.166 -9.380 -10.067 1.00 0.00 C ATOM 1895 NH1 ARG A 122 5.828 -9.554 -10.023 1.00 0.00 N ATOM 1896 NH2 ARG A 122 7.750 -8.949 -11.170 1.00 0.00 N ATOM 0 H ARG A 122 7.509 -9.470 -2.252 1.00 0.00 H new ATOM 0 HA ARG A 122 9.567 -9.592 -4.313 1.00 0.00 H new ATOM 0 HB2 ARG A 122 7.316 -10.839 -5.007 1.00 0.00 H new ATOM 0 HB3 ARG A 122 6.719 -9.206 -5.225 1.00 0.00 H new ATOM 0 HG2 ARG A 122 8.704 -8.720 -6.716 1.00 0.00 H new ATOM 0 HG3 ARG A 122 9.205 -10.391 -6.550 1.00 0.00 H new ATOM 0 HD2 ARG A 122 7.278 -11.212 -7.721 1.00 0.00 H new ATOM 0 HD3 ARG A 122 6.403 -9.707 -7.518 1.00 0.00 H new ATOM 0 HE ARG A 122 8.935 -9.496 -9.059 1.00 0.00 H new ATOM 0 HH11 ARG A 122 5.385 -9.886 -9.166 1.00 0.00 H new ATOM 0 HH12 ARG A 122 5.260 -9.354 -10.846 1.00 0.00 H new ATOM 0 HH21 ARG A 122 8.761 -8.819 -11.194 1.00 0.00 H new ATOM 0 HH22 ARG A 122 7.190 -8.746 -11.998 1.00 0.00 H new ATOM 1909 N ILE A 123 9.346 -7.115 -4.584 1.00 0.00 N ATOM 1910 CA ILE A 123 9.355 -5.663 -4.550 1.00 0.00 C ATOM 1911 C ILE A 123 9.285 -5.123 -5.981 1.00 0.00 C ATOM 1912 O ILE A 123 9.987 -5.608 -6.866 1.00 0.00 O ATOM 1913 CB ILE A 123 10.560 -5.153 -3.758 1.00 0.00 C ATOM 1914 CG1 ILE A 123 10.389 -3.678 -3.389 1.00 0.00 C ATOM 1915 CG2 ILE A 123 11.863 -5.407 -4.520 1.00 0.00 C ATOM 1916 CD1 ILE A 123 10.968 -3.388 -2.003 1.00 0.00 C ATOM 0 H ILE A 123 10.099 -7.533 -5.130 1.00 0.00 H new ATOM 0 HA ILE A 123 8.476 -5.289 -4.024 1.00 0.00 H new ATOM 0 HB ILE A 123 10.618 -5.713 -2.825 1.00 0.00 H new ATOM 0 HG12 ILE A 123 10.885 -3.054 -4.132 1.00 0.00 H new ATOM 0 HG13 ILE A 123 9.331 -3.415 -3.407 1.00 0.00 H new ATOM 0 HG21 ILE A 123 12.705 -5.035 -3.936 1.00 0.00 H new ATOM 0 HG22 ILE A 123 11.983 -6.477 -4.689 1.00 0.00 H new ATOM 0 HG23 ILE A 123 11.830 -4.890 -5.479 1.00 0.00 H new ATOM 0 HD11 ILE A 123 10.833 -2.333 -1.766 1.00 0.00 H new ATOM 0 HD12 ILE A 123 10.453 -3.996 -1.259 1.00 0.00 H new ATOM 0 HD13 ILE A 123 12.031 -3.629 -1.995 1.00 0.00 H new ATOM 1928 N VAL A 124 8.431 -4.126 -6.161 1.00 0.00 N ATOM 1929 CA VAL A 124 8.261 -3.514 -7.467 1.00 0.00 C ATOM 1930 C VAL A 124 8.406 -1.997 -7.339 1.00 0.00 C ATOM 1931 O VAL A 124 7.903 -1.400 -6.389 1.00 0.00 O ATOM 1932 CB VAL A 124 6.921 -3.937 -8.073 1.00 0.00 C ATOM 1933 CG1 VAL A 124 6.550 -3.048 -9.262 1.00 0.00 C ATOM 1934 CG2 VAL A 124 6.941 -5.412 -8.477 1.00 0.00 C ATOM 0 H VAL A 124 7.850 -3.727 -5.424 1.00 0.00 H new ATOM 0 HA VAL A 124 9.036 -3.857 -8.152 1.00 0.00 H new ATOM 0 HB VAL A 124 6.155 -3.810 -7.308 1.00 0.00 H new ATOM 0 HG11 VAL A 124 5.594 -3.371 -9.673 1.00 0.00 H new ATOM 0 HG12 VAL A 124 6.472 -2.012 -8.931 1.00 0.00 H new ATOM 0 HG13 VAL A 124 7.320 -3.127 -10.029 1.00 0.00 H new ATOM 0 HG21 VAL A 124 5.976 -5.685 -8.905 1.00 0.00 H new ATOM 0 HG22 VAL A 124 7.725 -5.576 -9.216 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.136 -6.027 -7.599 1.00 0.00 H new ATOM 1944 N LYS A 125 9.099 -1.415 -8.308 1.00 0.00 N ATOM 1945 CA LYS A 125 9.318 0.021 -8.316 1.00 0.00 C ATOM 1946 C LYS A 125 8.678 0.624 -9.569 1.00 0.00 C ATOM 1947 O LYS A 125 9.082 0.310 -10.687 1.00 0.00 O ATOM 1948 CB LYS A 125 10.807 0.336 -8.172 1.00 0.00 C ATOM 1949 CG LYS A 125 11.294 0.053 -6.750 1.00 0.00 C ATOM 1950 CD LYS A 125 12.673 0.670 -6.508 1.00 0.00 C ATOM 1951 CE LYS A 125 13.718 -0.413 -6.235 1.00 0.00 C ATOM 1952 NZ LYS A 125 14.402 -0.802 -7.489 1.00 0.00 N ATOM 0 H LYS A 125 9.516 -1.914 -9.094 1.00 0.00 H new ATOM 0 HA LYS A 125 8.834 0.485 -7.457 1.00 0.00 H new ATOM 0 HB2 LYS A 125 11.379 -0.262 -8.881 1.00 0.00 H new ATOM 0 HB3 LYS A 125 10.986 1.382 -8.420 1.00 0.00 H new ATOM 0 HG2 LYS A 125 10.581 0.456 -6.031 1.00 0.00 H new ATOM 0 HG3 LYS A 125 11.340 -1.024 -6.585 1.00 0.00 H new ATOM 0 HD2 LYS A 125 12.971 1.256 -7.377 1.00 0.00 H new ATOM 0 HD3 LYS A 125 12.625 1.356 -5.662 1.00 0.00 H new ATOM 0 HE2 LYS A 125 14.449 -0.048 -5.514 1.00 0.00 H new ATOM 0 HE3 LYS A 125 13.239 -1.285 -5.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 15.108 -1.538 -7.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 13.703 -1.170 -8.166 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 14.876 0.029 -7.898 1.00 0.00 H new ATOM 1965 N GLY A 126 7.692 1.477 -9.339 1.00 0.00 N ATOM 1966 CA GLY A 126 6.993 2.126 -10.434 1.00 0.00 C ATOM 1967 C GLY A 126 5.482 1.916 -10.323 1.00 0.00 C ATOM 1968 O GLY A 126 4.963 1.680 -9.232 1.00 0.00 O ATOM 0 H GLY A 126 7.360 1.734 -8.409 1.00 0.00 H new ATOM 0 HA2 GLY A 126 7.216 3.193 -10.431 1.00 0.00 H new ATOM 0 HA3 GLY A 126 7.350 1.728 -11.384 1.00 0.00 H new ATOM 1972 N SER A 127 4.817 2.008 -11.466 1.00 0.00 N ATOM 1973 CA SER A 127 3.376 1.831 -11.510 1.00 0.00 C ATOM 1974 C SER A 127 3.027 0.566 -12.297 1.00 0.00 C ATOM 1975 O SER A 127 3.864 0.035 -13.026 1.00 0.00 O ATOM 1976 CB SER A 127 2.690 3.050 -12.131 1.00 0.00 C ATOM 1977 OG SER A 127 1.461 3.361 -11.480 1.00 0.00 O ATOM 0 H SER A 127 5.250 2.203 -12.369 1.00 0.00 H new ATOM 0 HA SER A 127 3.013 1.726 -10.488 1.00 0.00 H new ATOM 0 HB2 SER A 127 3.358 3.910 -12.074 1.00 0.00 H new ATOM 0 HB3 SER A 127 2.503 2.861 -13.188 1.00 0.00 H new ATOM 0 HG SER A 127 1.061 4.152 -11.898 1.00 0.00 H new ATOM 1983 N ILE A 128 1.793 0.121 -12.123 1.00 0.00 N ATOM 1984 CA ILE A 128 1.323 -1.072 -12.809 1.00 0.00 C ATOM 1985 C ILE A 128 -0.145 -0.888 -13.195 1.00 0.00 C ATOM 1986 O ILE A 128 -0.804 0.036 -12.722 1.00 0.00 O ATOM 1987 CB ILE A 128 1.585 -2.317 -11.959 1.00 0.00 C ATOM 1988 CG1 ILE A 128 1.079 -2.120 -10.528 1.00 0.00 C ATOM 1989 CG2 ILE A 128 3.065 -2.704 -11.994 1.00 0.00 C ATOM 1990 CD1 ILE A 128 0.938 -3.461 -9.806 1.00 0.00 C ATOM 0 H ILE A 128 1.103 0.564 -11.517 1.00 0.00 H new ATOM 0 HA ILE A 128 1.879 -1.224 -13.734 1.00 0.00 H new ATOM 0 HB ILE A 128 1.025 -3.147 -12.388 1.00 0.00 H new ATOM 0 HG12 ILE A 128 1.769 -1.479 -9.980 1.00 0.00 H new ATOM 0 HG13 ILE A 128 0.116 -1.610 -10.546 1.00 0.00 H new ATOM 0 HG21 ILE A 128 3.224 -3.592 -11.382 1.00 0.00 H new ATOM 0 HG22 ILE A 128 3.362 -2.914 -13.022 1.00 0.00 H new ATOM 0 HG23 ILE A 128 3.665 -1.882 -11.604 1.00 0.00 H new ATOM 0 HD11 ILE A 128 0.577 -3.292 -8.792 1.00 0.00 H new ATOM 0 HD12 ILE A 128 0.229 -4.091 -10.343 1.00 0.00 H new ATOM 0 HD13 ILE A 128 1.908 -3.957 -9.768 1.00 0.00 H new ATOM 2002 N ASN A 129 -0.615 -1.784 -14.051 1.00 0.00 N ATOM 2003 CA ASN A 129 -1.994 -1.731 -14.506 1.00 0.00 C ATOM 2004 C ASN A 129 -2.778 -2.885 -13.877 1.00 0.00 C ATOM 2005 O ASN A 129 -2.191 -3.795 -13.293 1.00 0.00 O ATOM 2006 CB ASN A 129 -2.078 -1.878 -16.027 1.00 0.00 C ATOM 2007 CG ASN A 129 -1.047 -2.886 -16.538 1.00 0.00 C ATOM 2008 OD1 ASN A 129 -0.888 -3.974 -16.008 1.00 0.00 O ATOM 2009 ND2 ASN A 129 -0.358 -2.467 -17.596 1.00 0.00 N ATOM 0 H ASN A 129 -0.066 -2.550 -14.441 1.00 0.00 H new ATOM 0 HA ASN A 129 -2.409 -0.767 -14.213 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -3.080 -2.202 -16.310 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -1.911 -0.910 -16.499 1.00 0.00 H new ATOM 0 HD21 ASN A 129 0.353 -3.068 -18.012 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -0.541 -1.544 -17.991 1.00 0.00 H new ATOM 2016 N GLU A 130 -4.094 -2.809 -14.015 1.00 0.00 N ATOM 2017 CA GLU A 130 -4.965 -3.835 -13.466 1.00 0.00 C ATOM 2018 C GLU A 130 -4.589 -5.208 -14.030 1.00 0.00 C ATOM 2019 O GLU A 130 -4.814 -6.230 -13.386 1.00 0.00 O ATOM 2020 CB GLU A 130 -6.435 -3.513 -13.743 1.00 0.00 C ATOM 2021 CG GLU A 130 -7.338 -4.675 -13.328 1.00 0.00 C ATOM 2022 CD GLU A 130 -8.786 -4.422 -13.750 1.00 0.00 C ATOM 2023 OE1 GLU A 130 -9.053 -4.181 -14.937 1.00 0.00 O ATOM 2024 OE2 GLU A 130 -9.652 -4.482 -12.795 1.00 0.00 O ATOM 0 H GLU A 130 -4.578 -2.053 -14.499 1.00 0.00 H new ATOM 0 HA GLU A 130 -4.830 -3.858 -12.385 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -6.722 -2.613 -13.200 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -6.571 -3.303 -14.804 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.979 -5.599 -13.782 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.289 -4.811 -12.248 1.00 0.00 H new ATOM 2032 N ALA A 131 -4.022 -5.184 -15.228 1.00 0.00 N ATOM 2033 CA ALA A 131 -3.614 -6.414 -15.886 1.00 0.00 C ATOM 2034 C ALA A 131 -2.436 -7.028 -15.125 1.00 0.00 C ATOM 2035 O ALA A 131 -2.468 -8.204 -14.771 1.00 0.00 O ATOM 2036 CB ALA A 131 -3.273 -6.120 -17.349 1.00 0.00 C ATOM 0 H ALA A 131 -3.836 -4.333 -15.759 1.00 0.00 H new ATOM 0 HA ALA A 131 -4.426 -7.141 -15.879 1.00 0.00 H new ATOM 0 HB1 ALA A 131 -2.967 -7.042 -17.844 1.00 0.00 H new ATOM 0 HB2 ALA A 131 -4.150 -5.712 -17.852 1.00 0.00 H new ATOM 0 HB3 ALA A 131 -2.459 -5.396 -17.395 1.00 0.00 H new ATOM 2042 N GLN A 132 -1.426 -6.202 -14.898 1.00 0.00 N ATOM 2043 CA GLN A 132 -0.240 -6.648 -14.186 1.00 0.00 C ATOM 2044 C GLN A 132 -0.635 -7.331 -12.873 1.00 0.00 C ATOM 2045 O GLN A 132 -0.118 -8.398 -12.545 1.00 0.00 O ATOM 2046 CB GLN A 132 0.718 -5.484 -13.931 1.00 0.00 C ATOM 2047 CG GLN A 132 1.894 -5.517 -14.909 1.00 0.00 C ATOM 2048 CD GLN A 132 2.292 -4.104 -15.337 1.00 0.00 C ATOM 2049 OE1 GLN A 132 1.874 -3.112 -14.763 1.00 0.00 O ATOM 2050 NE2 GLN A 132 3.121 -4.066 -16.376 1.00 0.00 N ATOM 0 H GLN A 132 -1.404 -5.226 -15.194 1.00 0.00 H new ATOM 0 HA GLN A 132 0.282 -7.374 -14.809 1.00 0.00 H new ATOM 0 HB2 GLN A 132 0.183 -4.540 -14.032 1.00 0.00 H new ATOM 0 HB3 GLN A 132 1.090 -5.532 -12.908 1.00 0.00 H new ATOM 0 HG2 GLN A 132 2.745 -6.013 -14.443 1.00 0.00 H new ATOM 0 HG3 GLN A 132 1.625 -6.104 -15.787 1.00 0.00 H new ATOM 0 HE21 GLN A 132 3.433 -4.934 -16.811 1.00 0.00 H new ATOM 0 HE22 GLN A 132 3.445 -3.169 -16.738 1.00 0.00 H new ATOM 2059 N ALA A 133 -1.549 -6.687 -12.160 1.00 0.00 N ATOM 2060 CA ALA A 133 -2.017 -7.218 -10.893 1.00 0.00 C ATOM 2061 C ALA A 133 -2.548 -8.638 -11.104 1.00 0.00 C ATOM 2062 O ALA A 133 -2.170 -9.560 -10.383 1.00 0.00 O ATOM 2063 CB ALA A 133 -3.076 -6.283 -10.306 1.00 0.00 C ATOM 0 H ALA A 133 -1.977 -5.803 -12.437 1.00 0.00 H new ATOM 0 HA ALA A 133 -1.198 -7.274 -10.176 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -3.427 -6.683 -9.355 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -2.642 -5.296 -10.147 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -3.915 -6.203 -10.998 1.00 0.00 H new ATOM 2069 N LEU A 134 -3.416 -8.770 -12.097 1.00 0.00 N ATOM 2070 CA LEU A 134 -4.001 -10.061 -12.412 1.00 0.00 C ATOM 2071 C LEU A 134 -2.892 -11.111 -12.506 1.00 0.00 C ATOM 2072 O LEU A 134 -3.051 -12.231 -12.024 1.00 0.00 O ATOM 2073 CB LEU A 134 -4.864 -9.965 -13.673 1.00 0.00 C ATOM 2074 CG LEU A 134 -6.086 -9.049 -13.581 1.00 0.00 C ATOM 2075 CD1 LEU A 134 -7.250 -9.605 -14.404 1.00 0.00 C ATOM 2076 CD2 LEU A 134 -6.480 -8.807 -12.123 1.00 0.00 C ATOM 0 H LEU A 134 -3.728 -8.003 -12.693 1.00 0.00 H new ATOM 0 HA LEU A 134 -4.674 -10.378 -11.615 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -4.236 -9.619 -14.494 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -5.205 -10.967 -13.933 1.00 0.00 H new ATOM 0 HG LEU A 134 -5.822 -8.082 -14.008 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -8.106 -8.935 -14.322 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -6.951 -9.685 -15.449 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -7.523 -10.591 -14.028 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -7.351 -8.153 -12.085 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -6.720 -9.758 -11.648 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -5.650 -8.337 -11.595 1.00 0.00 H new ATOM 2088 N ALA A 135 -1.793 -10.711 -13.127 1.00 0.00 N ATOM 2089 CA ALA A 135 -0.657 -11.602 -13.289 1.00 0.00 C ATOM 2090 C ALA A 135 -0.125 -11.999 -11.911 1.00 0.00 C ATOM 2091 O ALA A 135 0.200 -13.161 -11.678 1.00 0.00 O ATOM 2092 CB ALA A 135 0.409 -10.922 -14.150 1.00 0.00 C ATOM 0 H ALA A 135 -1.665 -9.781 -13.525 1.00 0.00 H new ATOM 0 HA ALA A 135 -0.957 -12.515 -13.803 1.00 0.00 H new ATOM 0 HB1 ALA A 135 1.261 -11.591 -14.271 1.00 0.00 H new ATOM 0 HB2 ALA A 135 -0.009 -10.687 -15.129 1.00 0.00 H new ATOM 0 HB3 ALA A 135 0.736 -10.002 -13.665 1.00 0.00 H new ATOM 2098 N LEU A 136 -0.052 -11.010 -11.032 1.00 0.00 N ATOM 2099 CA LEU A 136 0.434 -11.241 -9.683 1.00 0.00 C ATOM 2100 C LEU A 136 -0.430 -12.310 -9.010 1.00 0.00 C ATOM 2101 O LEU A 136 0.087 -13.320 -8.532 1.00 0.00 O ATOM 2102 CB LEU A 136 0.502 -9.925 -8.904 1.00 0.00 C ATOM 2103 CG LEU A 136 1.195 -8.761 -9.614 1.00 0.00 C ATOM 2104 CD1 LEU A 136 1.291 -7.541 -8.697 1.00 0.00 C ATOM 2105 CD2 LEU A 136 2.564 -9.185 -10.152 1.00 0.00 C ATOM 0 H LEU A 136 -0.322 -10.046 -11.229 1.00 0.00 H new ATOM 0 HA LEU A 136 1.454 -11.623 -9.707 1.00 0.00 H new ATOM 0 HB2 LEU A 136 -0.514 -9.620 -8.656 1.00 0.00 H new ATOM 0 HB3 LEU A 136 1.019 -10.110 -7.962 1.00 0.00 H new ATOM 0 HG LEU A 136 0.588 -8.472 -10.472 1.00 0.00 H new ATOM 0 HD11 LEU A 136 1.788 -6.727 -9.225 1.00 0.00 H new ATOM 0 HD12 LEU A 136 0.289 -7.226 -8.404 1.00 0.00 H new ATOM 0 HD13 LEU A 136 1.865 -7.799 -7.807 1.00 0.00 H new ATOM 0 HD21 LEU A 136 3.036 -8.339 -10.652 1.00 0.00 H new ATOM 0 HD22 LEU A 136 3.193 -9.515 -9.326 1.00 0.00 H new ATOM 0 HD23 LEU A 136 2.439 -10.003 -10.862 1.00 0.00 H new ATOM 2117 N ILE A 137 -1.730 -12.052 -8.994 1.00 0.00 N ATOM 2118 CA ILE A 137 -2.669 -12.980 -8.388 1.00 0.00 C ATOM 2119 C ILE A 137 -2.622 -14.311 -9.139 1.00 0.00 C ATOM 2120 O ILE A 137 -3.060 -15.336 -8.621 1.00 0.00 O ATOM 2121 CB ILE A 137 -4.067 -12.360 -8.322 1.00 0.00 C ATOM 2122 CG1 ILE A 137 -4.077 -11.126 -7.416 1.00 0.00 C ATOM 2123 CG2 ILE A 137 -5.106 -13.397 -7.890 1.00 0.00 C ATOM 2124 CD1 ILE A 137 -4.608 -9.902 -8.164 1.00 0.00 C ATOM 0 H ILE A 137 -2.154 -11.214 -9.391 1.00 0.00 H new ATOM 0 HA ILE A 137 -2.387 -13.187 -7.356 1.00 0.00 H new ATOM 0 HB ILE A 137 -4.341 -12.027 -9.323 1.00 0.00 H new ATOM 0 HG12 ILE A 137 -4.696 -11.318 -6.540 1.00 0.00 H new ATOM 0 HG13 ILE A 137 -3.068 -10.927 -7.055 1.00 0.00 H new ATOM 0 HG21 ILE A 137 -6.091 -12.931 -7.851 1.00 0.00 H new ATOM 0 HG22 ILE A 137 -5.121 -14.218 -8.607 1.00 0.00 H new ATOM 0 HG23 ILE A 137 -4.847 -13.782 -6.904 1.00 0.00 H new ATOM 0 HD11 ILE A 137 -4.605 -9.039 -7.498 1.00 0.00 H new ATOM 0 HD12 ILE A 137 -3.972 -9.698 -9.026 1.00 0.00 H new ATOM 0 HD13 ILE A 137 -5.626 -10.096 -8.502 1.00 0.00 H new ATOM 2136 N ARG A 138 -2.086 -14.253 -10.350 1.00 0.00 N ATOM 2137 CA ARG A 138 -1.975 -15.440 -11.178 1.00 0.00 C ATOM 2138 C ARG A 138 -0.723 -16.236 -10.803 1.00 0.00 C ATOM 2139 O ARG A 138 -0.785 -17.450 -10.625 1.00 0.00 O ATOM 2140 CB ARG A 138 -1.912 -15.073 -12.662 1.00 0.00 C ATOM 2141 CG ARG A 138 -3.067 -15.712 -13.436 1.00 0.00 C ATOM 2142 CD ARG A 138 -2.836 -15.618 -14.945 1.00 0.00 C ATOM 2143 NE ARG A 138 -3.166 -14.258 -15.424 1.00 0.00 N ATOM 2144 CZ ARG A 138 -3.553 -13.973 -16.686 1.00 0.00 C ATOM 2145 NH1 ARG A 138 -3.663 -14.955 -17.606 1.00 0.00 N ATOM 2146 NH2 ARG A 138 -3.823 -12.722 -17.006 1.00 0.00 N ATOM 0 H ARG A 138 -1.724 -13.400 -10.777 1.00 0.00 H new ATOM 0 HA ARG A 138 -2.862 -16.049 -11.003 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -1.950 -13.989 -12.774 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -0.962 -15.403 -13.082 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -3.170 -16.757 -13.145 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -4.002 -15.215 -13.176 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -1.797 -15.852 -15.177 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -3.452 -16.354 -15.462 1.00 0.00 H new ATOM 0 HE ARG A 138 -3.097 -13.487 -14.760 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -3.453 -15.920 -17.350 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -3.956 -14.732 -18.557 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -3.738 -11.986 -16.304 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -4.117 -12.490 -17.955 1.00 0.00 H new ATOM 2159 N ASP A 139 0.385 -15.516 -10.694 1.00 0.00 N ATOM 2160 CA ASP A 139 1.649 -16.140 -10.342 1.00 0.00 C ATOM 2161 C ASP A 139 2.666 -15.053 -9.986 1.00 0.00 C ATOM 2162 O ASP A 139 2.907 -14.140 -10.776 1.00 0.00 O ATOM 2163 CB ASP A 139 2.210 -16.947 -11.515 1.00 0.00 C ATOM 2164 CG ASP A 139 3.425 -17.815 -11.179 1.00 0.00 C ATOM 2165 OD1 ASP A 139 4.190 -17.512 -10.252 1.00 0.00 O ATOM 2166 OD2 ASP A 139 3.574 -18.856 -11.927 1.00 0.00 O ATOM 0 H ASP A 139 0.433 -14.508 -10.843 1.00 0.00 H new ATOM 0 HA ASP A 139 1.474 -16.806 -9.497 1.00 0.00 H new ATOM 0 HB2 ASP A 139 1.420 -17.589 -11.906 1.00 0.00 H new ATOM 0 HB3 ASP A 139 2.484 -16.257 -12.313 1.00 0.00 H new ATOM 2172 N PRO A 140 3.252 -15.191 -8.767 1.00 0.00 N ATOM 2173 CA PRO A 140 4.239 -14.232 -8.298 1.00 0.00 C ATOM 2174 C PRO A 140 5.580 -14.436 -9.004 1.00 0.00 C ATOM 2175 O PRO A 140 6.397 -13.520 -9.067 1.00 0.00 O ATOM 2176 CB PRO A 140 4.319 -14.453 -6.796 1.00 0.00 C ATOM 2177 CG PRO A 140 3.724 -15.830 -6.545 1.00 0.00 C ATOM 2178 CD PRO A 140 2.993 -16.259 -7.806 1.00 0.00 C ATOM 0 HA PRO A 140 3.964 -13.201 -8.522 1.00 0.00 H new ATOM 0 HB2 PRO A 140 5.351 -14.404 -6.448 1.00 0.00 H new ATOM 0 HB3 PRO A 140 3.765 -13.684 -6.258 1.00 0.00 H new ATOM 0 HG2 PRO A 140 4.508 -16.545 -6.296 1.00 0.00 H new ATOM 0 HG3 PRO A 140 3.039 -15.801 -5.698 1.00 0.00 H new ATOM 0 HD2 PRO A 140 3.362 -17.218 -8.171 1.00 0.00 H new ATOM 0 HD3 PRO A 140 1.925 -16.377 -7.624 1.00 0.00 H new ATOM 2186 N ASN A 141 5.766 -15.643 -9.517 1.00 0.00 N ATOM 2187 CA ASN A 141 6.994 -15.980 -10.216 1.00 0.00 C ATOM 2188 C ASN A 141 7.030 -15.247 -11.558 1.00 0.00 C ATOM 2189 O ASN A 141 8.078 -15.161 -12.196 1.00 0.00 O ATOM 2190 CB ASN A 141 7.077 -17.481 -10.494 1.00 0.00 C ATOM 2191 CG ASN A 141 7.095 -18.282 -9.191 1.00 0.00 C ATOM 2192 OD1 ASN A 141 8.130 -18.509 -8.585 1.00 0.00 O ATOM 2193 ND2 ASN A 141 5.895 -18.695 -8.791 1.00 0.00 N ATOM 0 H ASN A 141 5.085 -16.401 -9.462 1.00 0.00 H new ATOM 0 HA ASN A 141 7.832 -15.685 -9.585 1.00 0.00 H new ATOM 0 HB2 ASN A 141 6.226 -17.789 -11.102 1.00 0.00 H new ATOM 0 HB3 ASN A 141 7.976 -17.698 -11.070 1.00 0.00 H new ATOM 0 HD21 ASN A 141 5.802 -19.235 -7.931 1.00 0.00 H new ATOM 0 HD22 ASN A 141 5.068 -18.471 -9.344 1.00 0.00 H new ATOM 2200 N ALA A 142 5.870 -14.737 -11.948 1.00 0.00 N ATOM 2201 CA ALA A 142 5.754 -14.014 -13.202 1.00 0.00 C ATOM 2202 C ALA A 142 6.758 -12.859 -13.216 1.00 0.00 C ATOM 2203 O ALA A 142 6.581 -11.869 -12.506 1.00 0.00 O ATOM 2204 CB ALA A 142 4.313 -13.535 -13.385 1.00 0.00 C ATOM 0 H ALA A 142 5.002 -14.811 -11.417 1.00 0.00 H new ATOM 0 HA ALA A 142 5.990 -14.666 -14.043 1.00 0.00 H new ATOM 0 HB1 ALA A 142 4.227 -12.992 -14.326 1.00 0.00 H new ATOM 0 HB2 ALA A 142 3.643 -14.395 -13.399 1.00 0.00 H new ATOM 0 HB3 ALA A 142 4.041 -12.876 -12.560 1.00 0.00 H new ATOM 2210 N ASP A 143 7.790 -13.023 -14.030 1.00 0.00 N ATOM 2211 CA ASP A 143 8.822 -12.006 -14.144 1.00 0.00 C ATOM 2212 C ASP A 143 9.517 -11.836 -12.792 1.00 0.00 C ATOM 2213 O ASP A 143 8.983 -11.192 -11.891 1.00 0.00 O ATOM 2214 CB ASP A 143 8.224 -10.656 -14.541 1.00 0.00 C ATOM 2215 CG ASP A 143 8.533 -10.205 -15.970 1.00 0.00 C ATOM 2216 OD1 ASP A 143 9.099 -9.124 -16.190 1.00 0.00 O ATOM 2217 OD2 ASP A 143 8.165 -11.029 -16.893 1.00 0.00 O ATOM 0 H ASP A 143 7.934 -13.845 -14.617 1.00 0.00 H new ATOM 0 HA ASP A 143 9.527 -12.327 -14.910 1.00 0.00 H new ATOM 0 HB2 ASP A 143 7.142 -10.705 -14.418 1.00 0.00 H new ATOM 0 HB3 ASP A 143 8.590 -9.897 -13.850 1.00 0.00 H new ATOM 2223 N LEU A 144 10.700 -12.427 -12.691 1.00 0.00 N ATOM 2224 CA LEU A 144 11.472 -12.349 -11.464 1.00 0.00 C ATOM 2225 C LEU A 144 12.440 -11.166 -11.550 1.00 0.00 C ATOM 2226 O LEU A 144 13.488 -11.170 -10.908 1.00 0.00 O ATOM 2227 CB LEU A 144 12.161 -13.686 -11.179 1.00 0.00 C ATOM 2228 CG LEU A 144 11.238 -14.851 -10.816 1.00 0.00 C ATOM 2229 CD1 LEU A 144 11.892 -16.194 -11.152 1.00 0.00 C ATOM 2230 CD2 LEU A 144 10.809 -14.775 -9.349 1.00 0.00 C ATOM 0 H LEU A 144 11.141 -12.961 -13.439 1.00 0.00 H new ATOM 0 HA LEU A 144 10.817 -12.165 -10.613 1.00 0.00 H new ATOM 0 HB2 LEU A 144 12.741 -13.968 -12.058 1.00 0.00 H new ATOM 0 HB3 LEU A 144 12.869 -13.541 -10.363 1.00 0.00 H new ATOM 0 HG LEU A 144 10.335 -14.771 -11.421 1.00 0.00 H new ATOM 0 HD11 LEU A 144 11.215 -17.005 -10.884 1.00 0.00 H new ATOM 0 HD12 LEU A 144 12.106 -16.237 -12.220 1.00 0.00 H new ATOM 0 HD13 LEU A 144 12.821 -16.297 -10.591 1.00 0.00 H new ATOM 0 HD21 LEU A 144 10.154 -15.615 -9.118 1.00 0.00 H new ATOM 0 HD22 LEU A 144 11.691 -14.816 -8.709 1.00 0.00 H new ATOM 0 HD23 LEU A 144 10.277 -13.840 -9.174 1.00 0.00 H new TER 2242 LEU A 144