USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1081 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 77 HIS : no HD1:sc= -0.217 K(o=0.86,f=-5.1!) USER MOD Set 1.2: B 159 THR OG1 : rot -93:sc= 1.08 USER MOD Set 2.1: A 112 THR OG1 : rot 180:sc= 0.317 USER MOD Set 2.2: A 113 SER OG : rot -159:sc= 0.274 USER MOD Set 3.1: A 79 GLN : amide:sc= 0.675 K(o=1.9,f=-7.3) USER MOD Set 3.2: A 82 LYS NZ :NH3+ -137:sc= 1.24 (180deg=0) USER MOD Set 4.1: A 18 THR OG1 : rot -140:sc= 0.0905 USER MOD Set 4.2: A 57 LYS NZ :NH3+ -178:sc= 2.35 (180deg=0.962) USER MOD Set 5.1: A 30 THR OG1 : rot 15:sc= -1.64 USER MOD Set 5.2: A 44 LYS NZ :NH3+ -134:sc= 1.34 (180deg=-0.199) USER MOD Set 5.3: A 45 SER OG : rot -18:sc= 1.69 USER MOD Set 6.1: A 19 LYS NZ :NH3+ 158:sc= -0.184 (180deg=-0.71) USER MOD Set 6.2: A 92 SER OG : rot 160:sc= -1.25! USER MOD Single : A 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 THR OG1 : rot -55:sc= 0.233 USER MOD Single : A 7 ASN : amide:sc= 0.213 K(o=0.21,f=-3.7!) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 MET CE :methyl -165:sc= -1.83 (180deg=-2.03!) USER MOD Single : A -3 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 HIS : no HD1:sc= -3.27! C(o=-3.3!,f=-6.6!) USER MOD Single : A 22 LYS NZ :NH3+ 177:sc= -1.16! (180deg=-1.17!) USER MOD Single : A 23 SER OG : rot 45:sc= 0.826 USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0.0592 K(o=0.059,f=-4.5!) USER MOD Single : A 58 MET CE :methyl 154:sc= -0.997 (180deg=-3.17!) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0.259 USER MOD Single : A 66 SER OG : rot 180:sc= -0.127 USER MOD Single : A 68 ASN : amide:sc= -1.82 K(o=-1.8,f=-7!) USER MOD Single : A 70 THR OG1 : rot 72:sc= 0.889 USER MOD Single : A 71 CYS SG : rot 180:sc= -1.67! USER MOD Single : A 75 HIS : no HE2:sc= -2.47 K(o=-2.5,f=-4.9!) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= 1.01 K(o=1,f=-0.44) USER MOD Single : A 86 SER OG : rot -98:sc= 1.24 USER MOD Single : A 98 CYS SG : rot -19:sc= -1 USER MOD Single : A 101 TYR OH : rot 113:sc= 0.0132 USER MOD Single : A 111 ASN :FLIP amide:sc= -0.0162 F(o=-1.1,f=-0.016) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 152 SER OG : rot 3:sc= 0.795 USER MOD Single : B 153 SER OG : rot -54:sc= 1.26 USER MOD Single : B 155 THR OG1 : rot -39:sc= -0.813 USER MOD Single : B 160 GLN : amide:sc= 1.01 K(o=1,f=-0.094) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 115.619 11.345 -23.973 1.00 0.00 N ATOM 2 CA GLY A -3 115.683 10.246 -23.031 1.00 0.00 C ATOM 3 C GLY A -3 114.737 10.479 -21.893 1.00 0.00 C ATOM 4 O GLY A -3 114.910 11.426 -21.125 1.00 0.00 O ATOM 0 H1 GLY A -3 116.280 11.170 -24.756 1.00 0.00 H new ATOM 0 H2 GLY A -3 114.652 11.426 -24.347 1.00 0.00 H new ATOM 0 H3 GLY A -3 115.879 12.230 -23.492 1.00 0.00 H new ATOM 0 HA2 GLY A -3 115.434 9.312 -23.534 1.00 0.00 H new ATOM 0 HA3 GLY A -3 116.700 10.142 -22.652 1.00 0.00 H new ATOM 10 N ALA A -2 113.717 9.654 -21.796 1.00 0.00 N ATOM 11 CA ALA A -2 112.734 9.768 -20.747 1.00 0.00 C ATOM 12 C ALA A -2 113.324 9.350 -19.406 1.00 0.00 C ATOM 13 O ALA A -2 113.436 8.164 -19.109 1.00 0.00 O ATOM 14 CB ALA A -2 111.506 8.932 -21.076 1.00 0.00 C ATOM 0 H ALA A -2 113.548 8.885 -22.445 1.00 0.00 H new ATOM 0 HA ALA A -2 112.431 10.812 -20.674 1.00 0.00 H new ATOM 0 HB1 ALA A -2 110.774 9.029 -20.274 1.00 0.00 H new ATOM 0 HB2 ALA A -2 111.068 9.281 -22.011 1.00 0.00 H new ATOM 0 HB3 ALA A -2 111.795 7.886 -21.179 1.00 0.00 H new ATOM 20 N MET A -1 113.753 10.340 -18.644 1.00 0.00 N ATOM 21 CA MET A -1 114.280 10.171 -17.295 1.00 0.00 C ATOM 22 C MET A -1 115.589 9.411 -17.270 1.00 0.00 C ATOM 23 O MET A -1 115.651 8.247 -16.847 1.00 0.00 O ATOM 24 CB MET A -1 113.256 9.560 -16.319 1.00 0.00 C ATOM 25 CG MET A -1 112.001 10.394 -16.147 1.00 0.00 C ATOM 26 SD MET A -1 112.339 12.096 -15.619 1.00 0.00 S ATOM 27 CE MET A -1 113.092 11.826 -14.020 1.00 0.00 C ATOM 0 H MET A -1 113.746 11.312 -18.952 1.00 0.00 H new ATOM 0 HA MET A -1 114.488 11.180 -16.940 1.00 0.00 H new ATOM 0 HB2 MET A -1 112.976 8.568 -16.675 1.00 0.00 H new ATOM 0 HB3 MET A -1 113.729 9.428 -15.346 1.00 0.00 H new ATOM 0 HG2 MET A -1 111.455 10.415 -17.090 1.00 0.00 H new ATOM 0 HG3 MET A -1 111.352 9.915 -15.413 1.00 0.00 H new ATOM 0 HE1 MET A -1 113.110 12.763 -13.464 1.00 0.00 H new ATOM 0 HE2 MET A -1 112.514 11.086 -13.466 1.00 0.00 H new ATOM 0 HE3 MET A -1 114.111 11.464 -14.154 1.00 0.00 H new ATOM 37 N GLY A 0 116.631 10.067 -17.739 1.00 0.00 N ATOM 38 CA GLY A 0 117.971 9.509 -17.672 1.00 0.00 C ATOM 39 C GLY A 0 118.645 9.887 -16.370 1.00 0.00 C ATOM 40 O GLY A 0 119.817 9.612 -16.143 1.00 0.00 O ATOM 0 H GLY A 0 116.578 10.989 -18.172 1.00 0.00 H new ATOM 0 HA2 GLY A 0 117.923 8.424 -17.760 1.00 0.00 H new ATOM 0 HA3 GLY A 0 118.563 9.871 -18.512 1.00 0.00 H new ATOM 44 N LYS A 1 117.889 10.538 -15.532 1.00 0.00 N ATOM 45 CA LYS A 1 118.313 10.941 -14.218 1.00 0.00 C ATOM 46 C LYS A 1 117.400 10.253 -13.239 1.00 0.00 C ATOM 47 O LYS A 1 116.245 9.966 -13.590 1.00 0.00 O ATOM 48 CB LYS A 1 118.203 12.473 -14.028 1.00 0.00 C ATOM 49 CG LYS A 1 119.217 13.319 -14.807 1.00 0.00 C ATOM 50 CD LYS A 1 118.925 13.438 -16.308 1.00 0.00 C ATOM 51 CE LYS A 1 117.644 14.214 -16.573 1.00 0.00 C ATOM 52 NZ LYS A 1 117.509 14.590 -17.995 1.00 0.00 N ATOM 0 H LYS A 1 116.931 10.812 -15.750 1.00 0.00 H new ATOM 0 HA LYS A 1 119.358 10.670 -14.067 1.00 0.00 H new ATOM 0 HB2 LYS A 1 117.200 12.785 -14.319 1.00 0.00 H new ATOM 0 HB3 LYS A 1 118.311 12.697 -12.967 1.00 0.00 H new ATOM 0 HG2 LYS A 1 119.245 14.319 -14.375 1.00 0.00 H new ATOM 0 HG3 LYS A 1 120.209 12.887 -14.676 1.00 0.00 H new ATOM 0 HD2 LYS A 1 119.760 13.934 -16.803 1.00 0.00 H new ATOM 0 HD3 LYS A 1 118.843 12.442 -16.743 1.00 0.00 H new ATOM 0 HE2 LYS A 1 116.786 13.611 -16.274 1.00 0.00 H new ATOM 0 HE3 LYS A 1 117.631 15.113 -15.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 116.623 15.117 -18.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 118.314 15.187 -18.274 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 117.495 13.731 -18.581 1.00 0.00 H new ATOM 66 N PRO A 2 117.892 9.904 -12.042 1.00 0.00 N ATOM 67 CA PRO A 2 117.062 9.282 -11.034 1.00 0.00 C ATOM 68 C PRO A 2 116.092 10.290 -10.473 1.00 0.00 C ATOM 69 O PRO A 2 116.424 11.467 -10.305 1.00 0.00 O ATOM 70 CB PRO A 2 118.042 8.806 -9.963 1.00 0.00 C ATOM 71 CG PRO A 2 119.266 9.643 -10.143 1.00 0.00 C ATOM 72 CD PRO A 2 119.283 10.101 -11.579 1.00 0.00 C ATOM 0 HA PRO A 2 116.465 8.459 -11.427 1.00 0.00 H new ATOM 0 HB2 PRO A 2 117.624 8.932 -8.964 1.00 0.00 H new ATOM 0 HB3 PRO A 2 118.270 7.747 -10.082 1.00 0.00 H new ATOM 0 HG2 PRO A 2 119.251 10.497 -9.466 1.00 0.00 H new ATOM 0 HG3 PRO A 2 120.163 9.069 -9.911 1.00 0.00 H new ATOM 0 HD2 PRO A 2 119.585 11.145 -11.660 1.00 0.00 H new ATOM 0 HD3 PRO A 2 119.987 9.519 -12.174 1.00 0.00 H new ATOM 80 N PHE A 3 114.918 9.855 -10.213 1.00 0.00 N ATOM 81 CA PHE A 3 113.901 10.715 -9.753 1.00 0.00 C ATOM 82 C PHE A 3 113.638 10.550 -8.285 1.00 0.00 C ATOM 83 O PHE A 3 113.756 9.447 -7.730 1.00 0.00 O ATOM 84 CB PHE A 3 112.634 10.567 -10.591 1.00 0.00 C ATOM 85 CG PHE A 3 112.217 9.164 -10.878 1.00 0.00 C ATOM 86 CD1 PHE A 3 111.649 8.400 -9.901 1.00 0.00 C ATOM 87 CD2 PHE A 3 112.377 8.625 -12.143 1.00 0.00 C ATOM 88 CE1 PHE A 3 111.244 7.123 -10.151 1.00 0.00 C ATOM 89 CE2 PHE A 3 111.974 7.336 -12.413 1.00 0.00 C ATOM 90 CZ PHE A 3 111.403 6.581 -11.412 1.00 0.00 C ATOM 0 H PHE A 3 114.634 8.881 -10.315 1.00 0.00 H new ATOM 0 HA PHE A 3 114.256 11.738 -9.882 1.00 0.00 H new ATOM 0 HB2 PHE A 3 111.817 11.073 -10.076 1.00 0.00 H new ATOM 0 HB3 PHE A 3 112.783 11.085 -11.538 1.00 0.00 H new ATOM 0 HD1 PHE A 3 111.518 8.814 -8.912 1.00 0.00 H new ATOM 0 HD2 PHE A 3 112.822 9.221 -12.926 1.00 0.00 H new ATOM 0 HE1 PHE A 3 110.798 6.534 -9.363 1.00 0.00 H new ATOM 0 HE2 PHE A 3 112.105 6.920 -13.401 1.00 0.00 H new ATOM 0 HZ PHE A 3 111.081 5.570 -11.612 1.00 0.00 H new ATOM 100 N PHE A 4 113.360 11.647 -7.673 1.00 0.00 N ATOM 101 CA PHE A 4 113.013 11.722 -6.296 1.00 0.00 C ATOM 102 C PHE A 4 112.028 12.845 -6.097 1.00 0.00 C ATOM 103 O PHE A 4 112.214 13.948 -6.629 1.00 0.00 O ATOM 104 CB PHE A 4 114.242 11.992 -5.375 1.00 0.00 C ATOM 105 CG PHE A 4 113.834 12.400 -3.957 1.00 0.00 C ATOM 106 CD1 PHE A 4 113.553 13.736 -3.665 1.00 0.00 C ATOM 107 CD2 PHE A 4 113.649 11.464 -2.965 1.00 0.00 C ATOM 108 CE1 PHE A 4 113.099 14.119 -2.441 1.00 0.00 C ATOM 109 CE2 PHE A 4 113.205 11.847 -1.709 1.00 0.00 C ATOM 110 CZ PHE A 4 112.921 13.177 -1.450 1.00 0.00 C ATOM 0 H PHE A 4 113.368 12.555 -8.137 1.00 0.00 H new ATOM 0 HA PHE A 4 112.590 10.755 -6.022 1.00 0.00 H new ATOM 0 HB2 PHE A 4 114.860 11.096 -5.328 1.00 0.00 H new ATOM 0 HB3 PHE A 4 114.855 12.779 -5.814 1.00 0.00 H new ATOM 0 HD1 PHE A 4 113.700 14.484 -4.430 1.00 0.00 H new ATOM 0 HD2 PHE A 4 113.851 10.423 -3.167 1.00 0.00 H new ATOM 0 HE1 PHE A 4 112.879 15.158 -2.246 1.00 0.00 H new ATOM 0 HE2 PHE A 4 113.081 11.107 -0.932 1.00 0.00 H new ATOM 0 HZ PHE A 4 112.562 13.475 -0.476 1.00 0.00 H new ATOM 120 N THR A 5 111.006 12.549 -5.375 1.00 0.00 N ATOM 121 CA THR A 5 110.101 13.512 -4.833 1.00 0.00 C ATOM 122 C THR A 5 109.201 12.809 -3.819 1.00 0.00 C ATOM 123 O THR A 5 107.998 13.084 -3.699 1.00 0.00 O ATOM 124 CB THR A 5 109.315 14.277 -5.935 1.00 0.00 C ATOM 125 OG1 THR A 5 108.526 15.340 -5.369 1.00 0.00 O ATOM 126 CG2 THR A 5 108.437 13.352 -6.763 1.00 0.00 C ATOM 0 H THR A 5 110.763 11.588 -5.133 1.00 0.00 H new ATOM 0 HA THR A 5 110.661 14.292 -4.318 1.00 0.00 H new ATOM 0 HB THR A 5 110.058 14.711 -6.603 1.00 0.00 H new ATOM 0 HG1 THR A 5 107.942 14.978 -4.671 1.00 0.00 H new ATOM 0 HG21 THR A 5 107.908 13.932 -7.519 1.00 0.00 H new ATOM 0 HG22 THR A 5 109.058 12.601 -7.251 1.00 0.00 H new ATOM 0 HG23 THR A 5 107.714 12.859 -6.113 1.00 0.00 H new ATOM 134 N ARG A 6 109.842 11.850 -3.081 1.00 0.00 N ATOM 135 CA ARG A 6 109.243 11.030 -1.995 1.00 0.00 C ATOM 136 C ARG A 6 107.903 10.460 -2.362 1.00 0.00 C ATOM 137 O ARG A 6 106.963 10.373 -1.580 1.00 0.00 O ATOM 138 CB ARG A 6 109.194 11.783 -0.712 1.00 0.00 C ATOM 139 CG ARG A 6 108.339 13.013 -0.723 1.00 0.00 C ATOM 140 CD ARG A 6 108.356 13.581 0.603 1.00 0.00 C ATOM 141 NE ARG A 6 107.533 14.788 0.723 1.00 0.00 N ATOM 142 CZ ARG A 6 107.173 15.365 1.882 1.00 0.00 C ATOM 143 NH1 ARG A 6 107.620 14.887 3.038 1.00 0.00 N ATOM 144 NH2 ARG A 6 106.388 16.434 1.874 1.00 0.00 N ATOM 0 H ARG A 6 110.824 11.624 -3.237 1.00 0.00 H new ATOM 0 HA ARG A 6 109.903 10.174 -1.853 1.00 0.00 H new ATOM 0 HB2 ARG A 6 108.830 11.115 0.069 1.00 0.00 H new ATOM 0 HB3 ARG A 6 110.210 12.069 -0.439 1.00 0.00 H new ATOM 0 HG2 ARG A 6 108.716 13.732 -1.450 1.00 0.00 H new ATOM 0 HG3 ARG A 6 107.319 12.765 -1.018 1.00 0.00 H new ATOM 0 HD2 ARG A 6 108.003 12.836 1.315 1.00 0.00 H new ATOM 0 HD3 ARG A 6 109.384 13.821 0.876 1.00 0.00 H new ATOM 0 HE ARG A 6 107.208 15.224 -0.140 1.00 0.00 H new ATOM 0 HH11 ARG A 6 108.240 14.077 3.049 1.00 0.00 H new ATOM 0 HH12 ARG A 6 107.343 15.330 3.914 1.00 0.00 H new ATOM 0 HH21 ARG A 6 106.058 16.818 0.988 1.00 0.00 H new ATOM 0 HH22 ARG A 6 106.114 16.872 2.753 1.00 0.00 H new ATOM 158 N ASN A 7 107.842 10.142 -3.537 1.00 0.00 N ATOM 159 CA ASN A 7 106.677 9.546 -4.144 1.00 0.00 C ATOM 160 C ASN A 7 106.850 8.074 -4.479 1.00 0.00 C ATOM 161 O ASN A 7 107.585 7.694 -5.385 1.00 0.00 O ATOM 162 CB ASN A 7 106.272 10.309 -5.395 1.00 0.00 C ATOM 163 CG ASN A 7 105.036 11.134 -5.188 1.00 0.00 C ATOM 164 OD1 ASN A 7 103.928 10.670 -5.435 1.00 0.00 O ATOM 165 ND2 ASN A 7 105.205 12.338 -4.732 1.00 0.00 N ATOM 0 H ASN A 7 108.616 10.274 -4.188 1.00 0.00 H new ATOM 0 HA ASN A 7 105.888 9.611 -3.394 1.00 0.00 H new ATOM 0 HB2 ASN A 7 107.092 10.959 -5.702 1.00 0.00 H new ATOM 0 HB3 ASN A 7 106.102 9.604 -6.208 1.00 0.00 H new ATOM 0 HD21 ASN A 7 104.397 12.938 -4.566 1.00 0.00 H new ATOM 0 HD22 ASN A 7 106.145 12.683 -4.540 1.00 0.00 H new ATOM 172 N PRO A 8 106.130 7.197 -3.770 1.00 0.00 N ATOM 173 CA PRO A 8 106.094 5.772 -4.113 1.00 0.00 C ATOM 174 C PRO A 8 105.606 5.614 -5.499 1.00 0.00 C ATOM 175 O PRO A 8 105.982 4.726 -6.242 1.00 0.00 O ATOM 176 CB PRO A 8 104.964 5.252 -3.310 1.00 0.00 C ATOM 177 CG PRO A 8 104.595 6.241 -2.287 1.00 0.00 C ATOM 178 CD PRO A 8 105.341 7.495 -2.553 1.00 0.00 C ATOM 0 HA PRO A 8 107.067 5.304 -3.966 1.00 0.00 H new ATOM 0 HB2 PRO A 8 104.110 5.044 -3.955 1.00 0.00 H new ATOM 0 HB3 PRO A 8 105.243 4.310 -2.837 1.00 0.00 H new ATOM 0 HG2 PRO A 8 103.521 6.427 -2.310 1.00 0.00 H new ATOM 0 HG3 PRO A 8 104.832 5.863 -1.292 1.00 0.00 H new ATOM 0 HD2 PRO A 8 104.664 8.335 -2.713 1.00 0.00 H new ATOM 0 HD3 PRO A 8 105.986 7.760 -1.715 1.00 0.00 H new ATOM 186 N SER A 9 104.707 6.470 -5.772 1.00 0.00 N ATOM 187 CA SER A 9 104.027 6.554 -6.947 1.00 0.00 C ATOM 188 C SER A 9 104.948 6.947 -8.146 1.00 0.00 C ATOM 189 O SER A 9 104.657 6.598 -9.290 1.00 0.00 O ATOM 190 CB SER A 9 102.937 7.537 -6.709 1.00 0.00 C ATOM 191 OG SER A 9 101.943 7.001 -5.852 1.00 0.00 O ATOM 0 H SER A 9 104.420 7.184 -5.102 1.00 0.00 H new ATOM 0 HA SER A 9 103.621 5.585 -7.239 1.00 0.00 H new ATOM 0 HB2 SER A 9 103.351 8.444 -6.268 1.00 0.00 H new ATOM 0 HB3 SER A 9 102.486 7.822 -7.660 1.00 0.00 H new ATOM 0 HG SER A 9 101.239 7.668 -5.710 1.00 0.00 H new ATOM 197 N GLU A 10 106.067 7.668 -7.877 1.00 0.00 N ATOM 198 CA GLU A 10 106.998 8.020 -8.948 1.00 0.00 C ATOM 199 C GLU A 10 107.792 6.774 -9.272 1.00 0.00 C ATOM 200 O GLU A 10 108.144 6.517 -10.431 1.00 0.00 O ATOM 201 CB GLU A 10 107.937 9.201 -8.555 1.00 0.00 C ATOM 202 CG GLU A 10 109.030 8.862 -7.546 1.00 0.00 C ATOM 203 CD GLU A 10 109.718 10.070 -7.007 1.00 0.00 C ATOM 204 OE1 GLU A 10 110.212 10.885 -7.812 1.00 0.00 O ATOM 205 OE2 GLU A 10 109.723 10.259 -5.754 1.00 0.00 O ATOM 0 H GLU A 10 106.330 8.003 -6.950 1.00 0.00 H new ATOM 0 HA GLU A 10 106.443 8.367 -9.820 1.00 0.00 H new ATOM 0 HB2 GLU A 10 108.408 9.584 -9.460 1.00 0.00 H new ATOM 0 HB3 GLU A 10 107.327 10.007 -8.147 1.00 0.00 H new ATOM 0 HG2 GLU A 10 108.593 8.300 -6.720 1.00 0.00 H new ATOM 0 HG3 GLU A 10 109.766 8.212 -8.020 1.00 0.00 H new ATOM 212 N LEU A 11 108.042 5.978 -8.225 1.00 0.00 N ATOM 213 CA LEU A 11 108.694 4.707 -8.370 1.00 0.00 C ATOM 214 C LEU A 11 107.828 3.790 -9.202 1.00 0.00 C ATOM 215 O LEU A 11 106.616 3.667 -8.992 1.00 0.00 O ATOM 216 CB LEU A 11 109.000 4.083 -7.013 1.00 0.00 C ATOM 217 CG LEU A 11 109.992 4.840 -6.126 1.00 0.00 C ATOM 218 CD1 LEU A 11 110.139 4.131 -4.804 1.00 0.00 C ATOM 219 CD2 LEU A 11 111.349 4.953 -6.807 1.00 0.00 C ATOM 0 H LEU A 11 107.792 6.212 -7.264 1.00 0.00 H new ATOM 0 HA LEU A 11 109.647 4.858 -8.878 1.00 0.00 H new ATOM 0 HB2 LEU A 11 108.063 3.978 -6.466 1.00 0.00 H new ATOM 0 HB3 LEU A 11 109.387 3.078 -7.178 1.00 0.00 H new ATOM 0 HG LEU A 11 109.607 5.846 -5.957 1.00 0.00 H new ATOM 0 HD11 LEU A 11 110.846 4.674 -4.177 1.00 0.00 H new ATOM 0 HD12 LEU A 11 109.171 4.087 -4.305 1.00 0.00 H new ATOM 0 HD13 LEU A 11 110.507 3.119 -4.973 1.00 0.00 H new ATOM 0 HD21 LEU A 11 112.038 5.495 -6.158 1.00 0.00 H new ATOM 0 HD22 LEU A 11 111.743 3.955 -7.002 1.00 0.00 H new ATOM 0 HD23 LEU A 11 111.240 5.490 -7.749 1.00 0.00 H new ATOM 231 N LYS A 12 108.457 3.193 -10.153 1.00 0.00 N ATOM 232 CA LYS A 12 107.798 2.356 -11.128 1.00 0.00 C ATOM 233 C LYS A 12 107.518 0.945 -10.623 1.00 0.00 C ATOM 234 O LYS A 12 107.815 0.603 -9.478 1.00 0.00 O ATOM 235 CB LYS A 12 108.624 2.277 -12.391 1.00 0.00 C ATOM 236 CG LYS A 12 110.025 1.808 -12.133 1.00 0.00 C ATOM 237 CD LYS A 12 110.634 1.178 -13.360 1.00 0.00 C ATOM 238 CE LYS A 12 110.063 -0.202 -13.634 1.00 0.00 C ATOM 239 NZ LYS A 12 110.631 -0.804 -14.855 1.00 0.00 N ATOM 0 H LYS A 12 109.465 3.266 -10.289 1.00 0.00 H new ATOM 0 HA LYS A 12 106.834 2.824 -11.329 1.00 0.00 H new ATOM 0 HB2 LYS A 12 108.141 1.599 -13.095 1.00 0.00 H new ATOM 0 HB3 LYS A 12 108.654 3.259 -12.863 1.00 0.00 H new ATOM 0 HG2 LYS A 12 110.638 2.650 -11.813 1.00 0.00 H new ATOM 0 HG3 LYS A 12 110.023 1.087 -11.316 1.00 0.00 H new ATOM 0 HD2 LYS A 12 110.458 1.821 -14.223 1.00 0.00 H new ATOM 0 HD3 LYS A 12 111.714 1.105 -13.232 1.00 0.00 H new ATOM 0 HE2 LYS A 12 110.263 -0.852 -12.783 1.00 0.00 H new ATOM 0 HE3 LYS A 12 108.980 -0.133 -13.734 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 110.214 -1.745 -15.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 110.418 -0.197 -15.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 111.662 -0.895 -14.750 1.00 0.00 H new ATOM 253 N GLY A 13 107.006 0.126 -11.527 1.00 0.00 N ATOM 254 CA GLY A 13 106.641 -1.224 -11.212 1.00 0.00 C ATOM 255 C GLY A 13 105.287 -1.316 -10.546 1.00 0.00 C ATOM 256 O GLY A 13 104.271 -0.910 -11.115 1.00 0.00 O ATOM 0 H GLY A 13 106.836 0.389 -12.498 1.00 0.00 H new ATOM 0 HA2 GLY A 13 106.634 -1.818 -12.126 1.00 0.00 H new ATOM 0 HA3 GLY A 13 107.396 -1.658 -10.556 1.00 0.00 H new ATOM 260 N LYS A 14 105.281 -1.834 -9.358 1.00 0.00 N ATOM 261 CA LYS A 14 104.090 -1.998 -8.559 1.00 0.00 C ATOM 262 C LYS A 14 104.368 -1.531 -7.159 1.00 0.00 C ATOM 263 O LYS A 14 105.503 -1.520 -6.726 1.00 0.00 O ATOM 264 CB LYS A 14 103.587 -3.453 -8.525 1.00 0.00 C ATOM 265 CG LYS A 14 104.620 -4.471 -8.102 1.00 0.00 C ATOM 266 CD LYS A 14 105.355 -5.089 -9.289 1.00 0.00 C ATOM 267 CE LYS A 14 104.447 -6.025 -10.067 1.00 0.00 C ATOM 268 NZ LYS A 14 105.134 -6.666 -11.209 1.00 0.00 N ATOM 0 H LYS A 14 106.127 -2.167 -8.896 1.00 0.00 H new ATOM 0 HA LYS A 14 103.304 -1.400 -9.020 1.00 0.00 H new ATOM 0 HB2 LYS A 14 102.738 -3.513 -7.844 1.00 0.00 H new ATOM 0 HB3 LYS A 14 103.220 -3.719 -9.516 1.00 0.00 H new ATOM 0 HG2 LYS A 14 105.343 -3.996 -7.439 1.00 0.00 H new ATOM 0 HG3 LYS A 14 104.133 -5.261 -7.529 1.00 0.00 H new ATOM 0 HD2 LYS A 14 105.718 -4.299 -9.947 1.00 0.00 H new ATOM 0 HD3 LYS A 14 106.229 -5.636 -8.935 1.00 0.00 H new ATOM 0 HE2 LYS A 14 104.067 -6.796 -9.397 1.00 0.00 H new ATOM 0 HE3 LYS A 14 103.585 -5.468 -10.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 104.470 -7.294 -11.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 105.474 -5.934 -11.865 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 105.941 -7.221 -10.861 1.00 0.00 H new ATOM 282 N PHE A 15 103.348 -1.201 -6.467 1.00 0.00 N ATOM 283 CA PHE A 15 103.422 -0.648 -5.171 1.00 0.00 C ATOM 284 C PHE A 15 102.645 -1.566 -4.257 1.00 0.00 C ATOM 285 O PHE A 15 101.418 -1.667 -4.363 1.00 0.00 O ATOM 286 CB PHE A 15 102.772 0.725 -5.260 1.00 0.00 C ATOM 287 CG PHE A 15 102.778 1.590 -4.040 1.00 0.00 C ATOM 288 CD1 PHE A 15 103.563 1.304 -2.939 1.00 0.00 C ATOM 289 CD2 PHE A 15 102.000 2.722 -4.030 1.00 0.00 C ATOM 290 CE1 PHE A 15 103.569 2.148 -1.846 1.00 0.00 C ATOM 291 CE2 PHE A 15 101.989 3.564 -2.950 1.00 0.00 C ATOM 292 CZ PHE A 15 102.774 3.285 -1.853 1.00 0.00 C ATOM 0 H PHE A 15 102.392 -1.314 -6.804 1.00 0.00 H new ATOM 0 HA PHE A 15 104.439 -0.548 -4.791 1.00 0.00 H new ATOM 0 HB2 PHE A 15 103.265 1.276 -6.061 1.00 0.00 H new ATOM 0 HB3 PHE A 15 101.734 0.583 -5.563 1.00 0.00 H new ATOM 0 HD1 PHE A 15 104.176 0.415 -2.933 1.00 0.00 H new ATOM 0 HD2 PHE A 15 101.386 2.952 -4.889 1.00 0.00 H new ATOM 0 HE1 PHE A 15 104.189 1.924 -0.991 1.00 0.00 H new ATOM 0 HE2 PHE A 15 101.366 4.446 -2.958 1.00 0.00 H new ATOM 0 HZ PHE A 15 102.771 3.949 -1.001 1.00 0.00 H new ATOM 302 N ILE A 16 103.327 -2.236 -3.396 1.00 0.00 N ATOM 303 CA ILE A 16 102.699 -3.176 -2.516 1.00 0.00 C ATOM 304 C ILE A 16 102.896 -2.794 -1.075 1.00 0.00 C ATOM 305 O ILE A 16 103.982 -2.389 -0.665 1.00 0.00 O ATOM 306 CB ILE A 16 103.111 -4.676 -2.738 1.00 0.00 C ATOM 307 CG1 ILE A 16 104.645 -4.889 -2.815 1.00 0.00 C ATOM 308 CG2 ILE A 16 102.411 -5.278 -3.950 1.00 0.00 C ATOM 309 CD1 ILE A 16 105.291 -4.519 -4.163 1.00 0.00 C ATOM 0 H ILE A 16 104.337 -2.153 -3.276 1.00 0.00 H new ATOM 0 HA ILE A 16 101.641 -3.119 -2.774 1.00 0.00 H new ATOM 0 HB ILE A 16 102.773 -5.209 -1.849 1.00 0.00 H new ATOM 0 HG12 ILE A 16 105.118 -4.299 -2.030 1.00 0.00 H new ATOM 0 HG13 ILE A 16 104.862 -5.936 -2.602 1.00 0.00 H new ATOM 0 HG21 ILE A 16 102.721 -6.316 -4.071 1.00 0.00 H new ATOM 0 HG22 ILE A 16 101.332 -5.236 -3.805 1.00 0.00 H new ATOM 0 HG23 ILE A 16 102.679 -4.713 -4.843 1.00 0.00 H new ATOM 0 HD11 ILE A 16 106.364 -4.704 -4.115 1.00 0.00 H new ATOM 0 HD12 ILE A 16 104.853 -5.127 -4.955 1.00 0.00 H new ATOM 0 HD13 ILE A 16 105.113 -3.465 -4.374 1.00 0.00 H new ATOM 321 N HIS A 17 101.843 -2.894 -0.335 1.00 0.00 N ATOM 322 CA HIS A 17 101.839 -2.594 1.066 1.00 0.00 C ATOM 323 C HIS A 17 101.607 -3.903 1.800 1.00 0.00 C ATOM 324 O HIS A 17 100.484 -4.398 1.890 1.00 0.00 O ATOM 325 CB HIS A 17 100.733 -1.557 1.322 1.00 0.00 C ATOM 326 CG HIS A 17 100.531 -1.088 2.743 1.00 0.00 C ATOM 327 ND1 HIS A 17 100.965 0.134 3.230 1.00 0.00 N ATOM 328 CD2 HIS A 17 99.843 -1.661 3.758 1.00 0.00 C ATOM 329 CE1 HIS A 17 100.538 0.253 4.477 1.00 0.00 C ATOM 330 NE2 HIS A 17 99.847 -0.807 4.850 1.00 0.00 N ATOM 0 H HIS A 17 100.936 -3.194 -0.693 1.00 0.00 H new ATOM 0 HA HIS A 17 102.777 -2.166 1.420 1.00 0.00 H new ATOM 0 HB2 HIS A 17 100.943 -0.683 0.706 1.00 0.00 H new ATOM 0 HB3 HIS A 17 99.791 -1.976 0.969 1.00 0.00 H new ATOM 0 HD2 HIS A 17 99.367 -2.630 3.723 1.00 0.00 H new ATOM 0 HE1 HIS A 17 100.731 1.108 5.108 1.00 0.00 H new ATOM 0 HE2 HIS A 17 99.406 -0.966 5.756 1.00 0.00 H new ATOM 338 N THR A 18 102.670 -4.458 2.277 1.00 0.00 N ATOM 339 CA THR A 18 102.655 -5.761 2.912 1.00 0.00 C ATOM 340 C THR A 18 103.104 -5.672 4.381 1.00 0.00 C ATOM 341 O THR A 18 104.004 -4.948 4.713 1.00 0.00 O ATOM 342 CB THR A 18 103.572 -6.750 2.114 1.00 0.00 C ATOM 343 OG1 THR A 18 103.508 -8.082 2.653 1.00 0.00 O ATOM 344 CG2 THR A 18 105.039 -6.285 2.067 1.00 0.00 C ATOM 0 H THR A 18 103.593 -4.025 2.243 1.00 0.00 H new ATOM 0 HA THR A 18 101.632 -6.137 2.903 1.00 0.00 H new ATOM 0 HB THR A 18 103.186 -6.758 1.095 1.00 0.00 H new ATOM 0 HG1 THR A 18 104.403 -8.481 2.646 1.00 0.00 H new ATOM 0 HG21 THR A 18 105.631 -7.005 1.503 1.00 0.00 H new ATOM 0 HG22 THR A 18 105.096 -5.310 1.583 1.00 0.00 H new ATOM 0 HG23 THR A 18 105.430 -6.210 3.082 1.00 0.00 H new ATOM 352 N LYS A 19 102.459 -6.409 5.243 1.00 0.00 N ATOM 353 CA LYS A 19 102.824 -6.424 6.645 1.00 0.00 C ATOM 354 C LYS A 19 104.009 -7.358 6.848 1.00 0.00 C ATOM 355 O LYS A 19 103.991 -8.495 6.376 1.00 0.00 O ATOM 356 CB LYS A 19 101.583 -6.844 7.498 1.00 0.00 C ATOM 357 CG LYS A 19 101.759 -7.043 9.034 1.00 0.00 C ATOM 358 CD LYS A 19 102.472 -8.370 9.385 1.00 0.00 C ATOM 359 CE LYS A 19 102.143 -8.854 10.781 1.00 0.00 C ATOM 360 NZ LYS A 19 100.694 -9.099 10.966 1.00 0.00 N ATOM 0 H LYS A 19 101.672 -7.013 5.004 1.00 0.00 H new ATOM 0 HA LYS A 19 103.129 -5.431 6.974 1.00 0.00 H new ATOM 0 HB2 LYS A 19 100.810 -6.090 7.350 1.00 0.00 H new ATOM 0 HB3 LYS A 19 101.200 -7.778 7.086 1.00 0.00 H new ATOM 0 HG2 LYS A 19 102.331 -6.209 9.441 1.00 0.00 H new ATOM 0 HG3 LYS A 19 100.780 -7.023 9.514 1.00 0.00 H new ATOM 0 HD2 LYS A 19 102.186 -9.134 8.662 1.00 0.00 H new ATOM 0 HD3 LYS A 19 103.550 -8.234 9.296 1.00 0.00 H new ATOM 0 HE2 LYS A 19 102.693 -9.773 10.983 1.00 0.00 H new ATOM 0 HE3 LYS A 19 102.480 -8.115 11.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 100.552 -9.756 11.759 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 100.213 -8.200 11.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 100.298 -9.513 10.098 1.00 0.00 H new ATOM 374 N LEU A 20 105.033 -6.892 7.533 1.00 0.00 N ATOM 375 CA LEU A 20 106.140 -7.740 7.842 1.00 0.00 C ATOM 376 C LEU A 20 106.200 -7.892 9.307 1.00 0.00 C ATOM 377 O LEU A 20 106.055 -6.920 10.064 1.00 0.00 O ATOM 378 CB LEU A 20 107.474 -7.251 7.275 1.00 0.00 C ATOM 379 CG LEU A 20 108.153 -8.219 6.303 1.00 0.00 C ATOM 380 CD1 LEU A 20 107.264 -8.580 5.133 1.00 0.00 C ATOM 381 CD2 LEU A 20 109.440 -7.638 5.815 1.00 0.00 C ATOM 0 H LEU A 20 105.112 -5.936 7.879 1.00 0.00 H new ATOM 0 HA LEU A 20 105.976 -8.703 7.358 1.00 0.00 H new ATOM 0 HB2 LEU A 20 107.310 -6.302 6.765 1.00 0.00 H new ATOM 0 HB3 LEU A 20 108.154 -7.054 8.104 1.00 0.00 H new ATOM 0 HG LEU A 20 108.353 -9.140 6.850 1.00 0.00 H new ATOM 0 HD11 LEU A 20 107.792 -9.269 4.474 1.00 0.00 H new ATOM 0 HD12 LEU A 20 106.354 -9.055 5.500 1.00 0.00 H new ATOM 0 HD13 LEU A 20 107.004 -7.677 4.581 1.00 0.00 H new ATOM 0 HD21 LEU A 20 109.915 -8.335 5.124 1.00 0.00 H new ATOM 0 HD22 LEU A 20 109.243 -6.696 5.303 1.00 0.00 H new ATOM 0 HD23 LEU A 20 110.102 -7.458 6.662 1.00 0.00 H new ATOM 393 N ARG A 21 106.339 -9.078 9.719 1.00 0.00 N ATOM 394 CA ARG A 21 106.352 -9.382 11.072 1.00 0.00 C ATOM 395 C ARG A 21 107.789 -9.363 11.555 1.00 0.00 C ATOM 396 O ARG A 21 108.610 -10.061 10.990 1.00 0.00 O ATOM 397 CB ARG A 21 105.816 -10.784 11.220 1.00 0.00 C ATOM 398 CG ARG A 21 105.598 -11.259 12.630 1.00 0.00 C ATOM 399 CD ARG A 21 105.552 -12.773 12.655 1.00 0.00 C ATOM 400 NE ARG A 21 104.538 -13.338 11.745 1.00 0.00 N ATOM 401 CZ ARG A 21 104.351 -14.652 11.520 1.00 0.00 C ATOM 402 NH1 ARG A 21 105.038 -15.556 12.214 1.00 0.00 N ATOM 403 NH2 ARG A 21 103.467 -15.052 10.607 1.00 0.00 N ATOM 0 H ARG A 21 106.450 -9.885 9.105 1.00 0.00 H new ATOM 0 HA ARG A 21 105.757 -8.669 11.643 1.00 0.00 H new ATOM 0 HB2 ARG A 21 104.868 -10.848 10.685 1.00 0.00 H new ATOM 0 HB3 ARG A 21 106.506 -11.470 10.729 1.00 0.00 H new ATOM 0 HG2 ARG A 21 106.400 -10.899 13.274 1.00 0.00 H new ATOM 0 HG3 ARG A 21 104.667 -10.850 13.022 1.00 0.00 H new ATOM 0 HD2 ARG A 21 106.533 -13.164 12.384 1.00 0.00 H new ATOM 0 HD3 ARG A 21 105.345 -13.107 13.672 1.00 0.00 H new ATOM 0 HE ARG A 21 103.933 -12.684 11.249 1.00 0.00 H new ATOM 0 HH11 ARG A 21 105.710 -15.254 12.920 1.00 0.00 H new ATOM 0 HH12 ARG A 21 104.893 -16.551 12.040 1.00 0.00 H new ATOM 0 HH21 ARG A 21 102.932 -14.363 10.079 1.00 0.00 H new ATOM 0 HH22 ARG A 21 103.325 -16.048 10.436 1.00 0.00 H new ATOM 417 N LYS A 22 108.108 -8.502 12.507 1.00 0.00 N ATOM 418 CA LYS A 22 109.354 -8.586 13.246 1.00 0.00 C ATOM 419 C LYS A 22 109.444 -9.967 13.789 1.00 0.00 C ATOM 420 O LYS A 22 108.828 -10.268 14.817 1.00 0.00 O ATOM 421 CB LYS A 22 109.330 -7.626 14.408 1.00 0.00 C ATOM 422 CG LYS A 22 109.891 -6.270 14.125 1.00 0.00 C ATOM 423 CD LYS A 22 109.240 -5.542 12.937 1.00 0.00 C ATOM 424 CE LYS A 22 107.816 -5.077 13.202 1.00 0.00 C ATOM 425 NZ LYS A 22 107.718 -3.889 14.105 1.00 0.00 N ATOM 0 H LYS A 22 107.510 -7.725 12.788 1.00 0.00 H new ATOM 0 HA LYS A 22 110.196 -8.344 12.598 1.00 0.00 H new ATOM 0 HB2 LYS A 22 108.299 -7.512 14.743 1.00 0.00 H new ATOM 0 HB3 LYS A 22 109.887 -8.067 15.234 1.00 0.00 H new ATOM 0 HG2 LYS A 22 109.781 -5.653 15.017 1.00 0.00 H new ATOM 0 HG3 LYS A 22 110.960 -6.366 13.934 1.00 0.00 H new ATOM 0 HD2 LYS A 22 109.851 -4.678 12.675 1.00 0.00 H new ATOM 0 HD3 LYS A 22 109.240 -6.206 12.073 1.00 0.00 H new ATOM 0 HE2 LYS A 22 107.341 -4.837 12.251 1.00 0.00 H new ATOM 0 HE3 LYS A 22 107.252 -5.900 13.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 106.722 -3.603 14.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 108.095 -4.134 15.043 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 108.269 -3.103 13.705 1.00 0.00 H new ATOM 439 N SER A 23 110.195 -10.775 13.126 1.00 0.00 N ATOM 440 CA SER A 23 110.165 -12.179 13.373 1.00 0.00 C ATOM 441 C SER A 23 111.110 -12.617 14.483 1.00 0.00 C ATOM 442 O SER A 23 110.668 -13.195 15.469 1.00 0.00 O ATOM 443 CB SER A 23 110.308 -12.948 12.043 1.00 0.00 C ATOM 444 OG SER A 23 109.161 -12.725 11.235 1.00 0.00 O ATOM 0 H SER A 23 110.847 -10.485 12.398 1.00 0.00 H new ATOM 0 HA SER A 23 109.189 -12.443 13.780 1.00 0.00 H new ATOM 0 HB2 SER A 23 111.205 -12.620 11.517 1.00 0.00 H new ATOM 0 HB3 SER A 23 110.425 -14.014 12.239 1.00 0.00 H new ATOM 0 HG SER A 23 108.933 -11.772 11.246 1.00 0.00 H new ATOM 450 N SER A 24 112.357 -12.287 14.368 1.00 0.00 N ATOM 451 CA SER A 24 113.346 -12.625 15.356 1.00 0.00 C ATOM 452 C SER A 24 114.359 -11.487 15.439 1.00 0.00 C ATOM 453 O SER A 24 115.499 -11.616 14.991 1.00 0.00 O ATOM 454 CB SER A 24 114.030 -13.957 15.000 1.00 0.00 C ATOM 455 OG SER A 24 113.076 -15.022 14.888 1.00 0.00 O ATOM 0 H SER A 24 112.728 -11.766 13.574 1.00 0.00 H new ATOM 0 HA SER A 24 112.872 -12.755 16.329 1.00 0.00 H new ATOM 0 HB2 SER A 24 114.570 -13.850 14.059 1.00 0.00 H new ATOM 0 HB3 SER A 24 114.766 -14.205 15.764 1.00 0.00 H new ATOM 0 HG SER A 24 113.540 -15.854 14.660 1.00 0.00 H new ATOM 461 N ARG A 25 113.901 -10.354 15.998 1.00 0.00 N ATOM 462 CA ARG A 25 114.697 -9.129 16.125 1.00 0.00 C ATOM 463 C ARG A 25 114.976 -8.514 14.780 1.00 0.00 C ATOM 464 O ARG A 25 116.059 -8.680 14.195 1.00 0.00 O ATOM 465 CB ARG A 25 115.979 -9.309 16.965 1.00 0.00 C ATOM 466 CG ARG A 25 115.748 -9.262 18.469 1.00 0.00 C ATOM 467 CD ARG A 25 115.387 -7.861 18.925 1.00 0.00 C ATOM 468 NE ARG A 25 115.164 -7.791 20.367 1.00 0.00 N ATOM 469 CZ ARG A 25 114.880 -6.668 21.056 1.00 0.00 C ATOM 470 NH1 ARG A 25 114.700 -5.506 20.418 1.00 0.00 N ATOM 471 NH2 ARG A 25 114.747 -6.726 22.373 1.00 0.00 N ATOM 0 H ARG A 25 112.958 -10.266 16.377 1.00 0.00 H new ATOM 0 HA ARG A 25 114.084 -8.426 16.689 1.00 0.00 H new ATOM 0 HB2 ARG A 25 116.438 -10.264 16.708 1.00 0.00 H new ATOM 0 HB3 ARG A 25 116.691 -8.530 16.693 1.00 0.00 H new ATOM 0 HG2 ARG A 25 114.949 -9.952 18.739 1.00 0.00 H new ATOM 0 HG3 ARG A 25 116.646 -9.596 18.988 1.00 0.00 H new ATOM 0 HD2 ARG A 25 116.186 -7.173 18.649 1.00 0.00 H new ATOM 0 HD3 ARG A 25 114.488 -7.531 18.404 1.00 0.00 H new ATOM 0 HE ARG A 25 115.228 -8.662 20.895 1.00 0.00 H new ATOM 0 HH11 ARG A 25 114.777 -5.465 19.402 1.00 0.00 H new ATOM 0 HH12 ARG A 25 114.485 -4.661 20.948 1.00 0.00 H new ATOM 0 HH21 ARG A 25 114.860 -7.616 22.858 1.00 0.00 H new ATOM 0 HH22 ARG A 25 114.532 -5.881 22.902 1.00 0.00 H new ATOM 485 N GLY A 26 113.983 -7.838 14.280 1.00 0.00 N ATOM 486 CA GLY A 26 114.107 -7.192 13.032 1.00 0.00 C ATOM 487 C GLY A 26 113.388 -7.921 11.951 1.00 0.00 C ATOM 488 O GLY A 26 112.280 -8.490 12.169 1.00 0.00 O ATOM 0 H GLY A 26 113.075 -7.727 14.732 1.00 0.00 H new ATOM 0 HA2 GLY A 26 113.714 -6.178 13.108 1.00 0.00 H new ATOM 0 HA3 GLY A 26 115.162 -7.106 12.772 1.00 0.00 H new ATOM 492 N PHE A 27 114.004 -7.935 10.820 1.00 0.00 N ATOM 493 CA PHE A 27 113.444 -8.453 9.639 1.00 0.00 C ATOM 494 C PHE A 27 114.271 -9.619 9.088 1.00 0.00 C ATOM 495 O PHE A 27 113.982 -10.768 9.388 1.00 0.00 O ATOM 496 CB PHE A 27 113.365 -7.315 8.647 1.00 0.00 C ATOM 497 CG PHE A 27 112.374 -6.277 9.054 1.00 0.00 C ATOM 498 CD1 PHE A 27 111.019 -6.503 8.941 1.00 0.00 C ATOM 499 CD2 PHE A 27 112.799 -5.094 9.593 1.00 0.00 C ATOM 500 CE1 PHE A 27 110.112 -5.551 9.351 1.00 0.00 C ATOM 501 CE2 PHE A 27 111.903 -4.150 10.005 1.00 0.00 C ATOM 502 CZ PHE A 27 110.562 -4.369 9.887 1.00 0.00 C ATOM 0 H PHE A 27 114.948 -7.570 10.697 1.00 0.00 H new ATOM 0 HA PHE A 27 112.451 -8.857 9.836 1.00 0.00 H new ATOM 0 HB2 PHE A 27 114.348 -6.855 8.546 1.00 0.00 H new ATOM 0 HB3 PHE A 27 113.094 -7.708 7.667 1.00 0.00 H new ATOM 0 HD1 PHE A 27 110.665 -7.436 8.527 1.00 0.00 H new ATOM 0 HD2 PHE A 27 113.857 -4.904 9.694 1.00 0.00 H new ATOM 0 HE1 PHE A 27 109.052 -5.733 9.252 1.00 0.00 H new ATOM 0 HE2 PHE A 27 112.259 -3.222 10.428 1.00 0.00 H new ATOM 0 HZ PHE A 27 109.858 -3.618 10.213 1.00 0.00 H new ATOM 512 N GLY A 28 115.313 -9.350 8.375 1.00 0.00 N ATOM 513 CA GLY A 28 116.006 -10.425 7.701 1.00 0.00 C ATOM 514 C GLY A 28 116.121 -10.179 6.207 1.00 0.00 C ATOM 515 O GLY A 28 115.729 -11.008 5.380 1.00 0.00 O ATOM 0 H GLY A 28 115.707 -8.419 8.238 1.00 0.00 H new ATOM 0 HA2 GLY A 28 117.003 -10.538 8.128 1.00 0.00 H new ATOM 0 HA3 GLY A 28 115.477 -11.362 7.874 1.00 0.00 H new ATOM 519 N PHE A 29 116.579 -9.030 5.868 1.00 0.00 N ATOM 520 CA PHE A 29 116.900 -8.670 4.519 1.00 0.00 C ATOM 521 C PHE A 29 117.796 -7.482 4.578 1.00 0.00 C ATOM 522 O PHE A 29 117.659 -6.656 5.452 1.00 0.00 O ATOM 523 CB PHE A 29 115.656 -8.440 3.622 1.00 0.00 C ATOM 524 CG PHE A 29 114.679 -7.427 4.112 1.00 0.00 C ATOM 525 CD1 PHE A 29 113.641 -7.801 4.921 1.00 0.00 C ATOM 526 CD2 PHE A 29 114.790 -6.115 3.742 1.00 0.00 C ATOM 527 CE1 PHE A 29 112.725 -6.877 5.361 1.00 0.00 C ATOM 528 CE2 PHE A 29 113.872 -5.175 4.174 1.00 0.00 C ATOM 529 CZ PHE A 29 112.838 -5.560 4.986 1.00 0.00 C ATOM 0 H PHE A 29 116.750 -8.281 6.539 1.00 0.00 H new ATOM 0 HA PHE A 29 117.409 -9.504 4.036 1.00 0.00 H new ATOM 0 HB2 PHE A 29 115.997 -8.138 2.632 1.00 0.00 H new ATOM 0 HB3 PHE A 29 115.136 -9.391 3.504 1.00 0.00 H new ATOM 0 HD1 PHE A 29 113.541 -8.835 5.217 1.00 0.00 H new ATOM 0 HD2 PHE A 29 115.606 -5.809 3.104 1.00 0.00 H new ATOM 0 HE1 PHE A 29 111.914 -7.186 6.003 1.00 0.00 H new ATOM 0 HE2 PHE A 29 113.970 -4.143 3.873 1.00 0.00 H new ATOM 0 HZ PHE A 29 112.117 -4.833 5.329 1.00 0.00 H new ATOM 539 N THR A 30 118.721 -7.397 3.732 1.00 0.00 N ATOM 540 CA THR A 30 119.593 -6.298 3.795 1.00 0.00 C ATOM 541 C THR A 30 119.242 -5.341 2.693 1.00 0.00 C ATOM 542 O THR A 30 118.772 -5.765 1.632 1.00 0.00 O ATOM 543 CB THR A 30 121.056 -6.753 3.773 1.00 0.00 C ATOM 544 OG1 THR A 30 121.304 -7.524 2.596 1.00 0.00 O ATOM 545 CG2 THR A 30 121.335 -7.626 4.996 1.00 0.00 C ATOM 0 H THR A 30 118.904 -8.067 2.985 1.00 0.00 H new ATOM 0 HA THR A 30 119.474 -5.771 4.741 1.00 0.00 H new ATOM 0 HB THR A 30 121.702 -5.875 3.783 1.00 0.00 H new ATOM 0 HG1 THR A 30 120.572 -7.391 1.958 1.00 0.00 H new ATOM 0 HG21 THR A 30 122.375 -7.950 4.982 1.00 0.00 H new ATOM 0 HG22 THR A 30 121.146 -7.052 5.903 1.00 0.00 H new ATOM 0 HG23 THR A 30 120.682 -8.499 4.976 1.00 0.00 H new ATOM 553 N VAL A 31 119.401 -4.075 2.938 1.00 0.00 N ATOM 554 CA VAL A 31 118.975 -3.061 2.004 1.00 0.00 C ATOM 555 C VAL A 31 120.093 -2.052 1.681 1.00 0.00 C ATOM 556 O VAL A 31 121.054 -1.908 2.441 1.00 0.00 O ATOM 557 CB VAL A 31 117.718 -2.301 2.549 1.00 0.00 C ATOM 558 CG1 VAL A 31 116.518 -3.202 2.661 1.00 0.00 C ATOM 559 CG2 VAL A 31 117.998 -1.729 3.877 1.00 0.00 C ATOM 0 H VAL A 31 119.829 -3.710 3.789 1.00 0.00 H new ATOM 0 HA VAL A 31 118.717 -3.576 1.079 1.00 0.00 H new ATOM 0 HB VAL A 31 117.496 -1.509 1.834 1.00 0.00 H new ATOM 0 HG11 VAL A 31 115.670 -2.633 3.043 1.00 0.00 H new ATOM 0 HG12 VAL A 31 116.272 -3.604 1.678 1.00 0.00 H new ATOM 0 HG13 VAL A 31 116.741 -4.022 3.343 1.00 0.00 H new ATOM 0 HG21 VAL A 31 117.114 -1.205 4.241 1.00 0.00 H new ATOM 0 HG22 VAL A 31 118.256 -2.529 4.571 1.00 0.00 H new ATOM 0 HG23 VAL A 31 118.831 -1.029 3.804 1.00 0.00 H new ATOM 569 N VAL A 32 119.962 -1.407 0.534 1.00 0.00 N ATOM 570 CA VAL A 32 120.830 -0.355 0.076 1.00 0.00 C ATOM 571 C VAL A 32 120.048 0.912 -0.126 1.00 0.00 C ATOM 572 O VAL A 32 118.993 0.902 -0.713 1.00 0.00 O ATOM 573 CB VAL A 32 121.591 -0.703 -1.243 1.00 0.00 C ATOM 574 CG1 VAL A 32 122.661 -1.715 -0.973 1.00 0.00 C ATOM 575 CG2 VAL A 32 120.638 -1.215 -2.352 1.00 0.00 C ATOM 0 H VAL A 32 119.213 -1.617 -0.126 1.00 0.00 H new ATOM 0 HA VAL A 32 121.581 -0.224 0.855 1.00 0.00 H new ATOM 0 HB VAL A 32 122.047 0.218 -1.606 1.00 0.00 H new ATOM 0 HG11 VAL A 32 123.183 -1.948 -1.901 1.00 0.00 H new ATOM 0 HG12 VAL A 32 123.369 -1.311 -0.249 1.00 0.00 H new ATOM 0 HG13 VAL A 32 122.210 -2.623 -0.572 1.00 0.00 H new ATOM 0 HG21 VAL A 32 121.213 -1.444 -3.249 1.00 0.00 H new ATOM 0 HG22 VAL A 32 120.130 -2.116 -2.008 1.00 0.00 H new ATOM 0 HG23 VAL A 32 119.900 -0.446 -2.581 1.00 0.00 H new ATOM 585 N GLY A 33 120.551 1.974 0.371 1.00 0.00 N ATOM 586 CA GLY A 33 119.918 3.226 0.194 1.00 0.00 C ATOM 587 C GLY A 33 119.664 3.874 1.497 1.00 0.00 C ATOM 588 O GLY A 33 120.479 3.736 2.408 1.00 0.00 O ATOM 0 H GLY A 33 121.414 2.004 0.913 1.00 0.00 H new ATOM 0 HA2 GLY A 33 120.544 3.871 -0.422 1.00 0.00 H new ATOM 0 HA3 GLY A 33 118.977 3.091 -0.340 1.00 0.00 H new ATOM 592 N GLY A 34 118.538 4.565 1.561 1.00 0.00 N ATOM 593 CA GLY A 34 118.069 5.295 2.732 1.00 0.00 C ATOM 594 C GLY A 34 119.141 6.072 3.362 1.00 0.00 C ATOM 595 O GLY A 34 119.519 5.849 4.494 1.00 0.00 O ATOM 0 H GLY A 34 117.899 4.637 0.769 1.00 0.00 H new ATOM 0 HA2 GLY A 34 117.259 5.964 2.441 1.00 0.00 H new ATOM 0 HA3 GLY A 34 117.657 4.592 3.456 1.00 0.00 H new ATOM 599 N ASP A 35 119.648 6.962 2.627 1.00 0.00 N ATOM 600 CA ASP A 35 120.740 7.720 3.085 1.00 0.00 C ATOM 601 C ASP A 35 120.312 9.120 3.297 1.00 0.00 C ATOM 602 O ASP A 35 120.761 9.784 4.237 1.00 0.00 O ATOM 603 CB ASP A 35 121.878 7.616 2.078 1.00 0.00 C ATOM 604 CG ASP A 35 123.230 8.059 2.649 1.00 0.00 C ATOM 605 OD1 ASP A 35 123.437 9.268 2.876 1.00 0.00 O ATOM 606 OD2 ASP A 35 124.130 7.198 2.885 1.00 0.00 O ATOM 0 H ASP A 35 119.324 7.193 1.688 1.00 0.00 H new ATOM 0 HA ASP A 35 121.101 7.336 4.039 1.00 0.00 H new ATOM 0 HB2 ASP A 35 121.957 6.585 1.733 1.00 0.00 H new ATOM 0 HB3 ASP A 35 121.641 8.227 1.207 1.00 0.00 H new ATOM 611 N GLU A 36 119.386 9.569 2.489 1.00 0.00 N ATOM 612 CA GLU A 36 119.035 10.950 2.498 1.00 0.00 C ATOM 613 C GLU A 36 117.688 11.124 1.914 1.00 0.00 C ATOM 614 O GLU A 36 117.120 10.180 1.387 1.00 0.00 O ATOM 615 CB GLU A 36 120.141 11.740 1.760 1.00 0.00 C ATOM 616 CG GLU A 36 120.655 11.072 0.522 1.00 0.00 C ATOM 617 CD GLU A 36 121.669 11.955 -0.195 1.00 0.00 C ATOM 618 OE1 GLU A 36 121.297 13.054 -0.660 1.00 0.00 O ATOM 619 OE2 GLU A 36 122.861 11.605 -0.260 1.00 0.00 O ATOM 0 H GLU A 36 118.869 8.995 1.823 1.00 0.00 H new ATOM 0 HA GLU A 36 118.977 11.344 3.513 1.00 0.00 H new ATOM 0 HB2 GLU A 36 119.753 12.723 1.494 1.00 0.00 H new ATOM 0 HB3 GLU A 36 120.974 11.901 2.444 1.00 0.00 H new ATOM 0 HG2 GLU A 36 121.117 10.120 0.783 1.00 0.00 H new ATOM 0 HG3 GLU A 36 119.824 10.850 -0.147 1.00 0.00 H new ATOM 626 N PRO A 37 117.122 12.314 2.018 1.00 0.00 N ATOM 627 CA PRO A 37 115.845 12.654 1.435 1.00 0.00 C ATOM 628 C PRO A 37 116.061 12.894 -0.037 1.00 0.00 C ATOM 629 O PRO A 37 115.885 13.998 -0.571 1.00 0.00 O ATOM 630 CB PRO A 37 115.495 13.947 2.142 1.00 0.00 C ATOM 631 CG PRO A 37 116.430 14.032 3.276 1.00 0.00 C ATOM 632 CD PRO A 37 117.662 13.464 2.703 1.00 0.00 C ATOM 0 HA PRO A 37 115.069 11.896 1.539 1.00 0.00 H new ATOM 0 HB2 PRO A 37 115.605 14.803 1.476 1.00 0.00 H new ATOM 0 HB3 PRO A 37 114.460 13.941 2.484 1.00 0.00 H new ATOM 0 HG2 PRO A 37 116.572 15.059 3.611 1.00 0.00 H new ATOM 0 HG3 PRO A 37 116.080 13.462 4.137 1.00 0.00 H new ATOM 0 HD2 PRO A 37 118.161 14.155 2.024 1.00 0.00 H new ATOM 0 HD3 PRO A 37 118.388 13.189 3.468 1.00 0.00 H new ATOM 640 N ASP A 38 116.465 11.838 -0.637 1.00 0.00 N ATOM 641 CA ASP A 38 116.906 11.746 -1.994 1.00 0.00 C ATOM 642 C ASP A 38 117.131 10.276 -2.284 1.00 0.00 C ATOM 643 O ASP A 38 116.659 9.734 -3.277 1.00 0.00 O ATOM 644 CB ASP A 38 118.228 12.516 -2.141 1.00 0.00 C ATOM 645 CG ASP A 38 118.856 12.412 -3.528 1.00 0.00 C ATOM 646 OD1 ASP A 38 119.646 11.479 -3.807 1.00 0.00 O ATOM 647 OD2 ASP A 38 118.577 13.303 -4.369 1.00 0.00 O ATOM 0 H ASP A 38 116.502 10.937 -0.160 1.00 0.00 H new ATOM 0 HA ASP A 38 116.176 12.168 -2.684 1.00 0.00 H new ATOM 0 HB2 ASP A 38 118.052 13.567 -1.911 1.00 0.00 H new ATOM 0 HB3 ASP A 38 118.938 12.143 -1.403 1.00 0.00 H new ATOM 652 N GLU A 39 117.793 9.621 -1.352 1.00 0.00 N ATOM 653 CA GLU A 39 118.098 8.233 -1.481 1.00 0.00 C ATOM 654 C GLU A 39 117.188 7.398 -0.565 1.00 0.00 C ATOM 655 O GLU A 39 117.261 7.542 0.694 1.00 0.00 O ATOM 656 CB GLU A 39 119.574 8.007 -1.144 1.00 0.00 C ATOM 657 CG GLU A 39 120.061 6.601 -1.378 1.00 0.00 C ATOM 658 CD GLU A 39 119.934 6.194 -2.821 1.00 0.00 C ATOM 659 OE1 GLU A 39 118.813 5.811 -3.239 1.00 0.00 O ATOM 660 OE2 GLU A 39 120.939 6.224 -3.550 1.00 0.00 O ATOM 0 H GLU A 39 118.129 10.047 -0.488 1.00 0.00 H new ATOM 0 HA GLU A 39 117.918 7.914 -2.508 1.00 0.00 H new ATOM 0 HB2 GLU A 39 120.178 8.691 -1.740 1.00 0.00 H new ATOM 0 HB3 GLU A 39 119.738 8.265 -0.098 1.00 0.00 H new ATOM 0 HG2 GLU A 39 121.103 6.522 -1.069 1.00 0.00 H new ATOM 0 HG3 GLU A 39 119.491 5.911 -0.755 1.00 0.00 H new ATOM 667 N PHE A 40 116.406 6.497 -1.226 1.00 0.00 N ATOM 668 CA PHE A 40 115.367 5.572 -0.645 1.00 0.00 C ATOM 669 C PHE A 40 116.015 4.224 -0.389 1.00 0.00 C ATOM 670 O PHE A 40 117.116 3.975 -0.891 1.00 0.00 O ATOM 671 CB PHE A 40 114.216 5.300 -1.640 1.00 0.00 C ATOM 672 CG PHE A 40 113.518 6.479 -2.274 1.00 0.00 C ATOM 673 CD1 PHE A 40 112.849 7.413 -1.512 1.00 0.00 C ATOM 674 CD2 PHE A 40 113.508 6.617 -3.659 1.00 0.00 C ATOM 675 CE1 PHE A 40 112.181 8.467 -2.115 1.00 0.00 C ATOM 676 CE2 PHE A 40 112.837 7.663 -4.267 1.00 0.00 C ATOM 677 CZ PHE A 40 112.171 8.591 -3.497 1.00 0.00 C ATOM 0 H PHE A 40 116.482 6.384 -2.237 1.00 0.00 H new ATOM 0 HA PHE A 40 114.978 6.044 0.257 1.00 0.00 H new ATOM 0 HB2 PHE A 40 114.612 4.678 -2.443 1.00 0.00 H new ATOM 0 HB3 PHE A 40 113.462 4.708 -1.121 1.00 0.00 H new ATOM 0 HD1 PHE A 40 112.845 7.323 -0.436 1.00 0.00 H new ATOM 0 HD2 PHE A 40 114.032 5.896 -4.269 1.00 0.00 H new ATOM 0 HE1 PHE A 40 111.666 9.195 -1.506 1.00 0.00 H new ATOM 0 HE2 PHE A 40 112.835 7.752 -5.343 1.00 0.00 H new ATOM 0 HZ PHE A 40 111.645 9.409 -3.966 1.00 0.00 H new ATOM 687 N LEU A 41 115.377 3.341 0.403 1.00 0.00 N ATOM 688 CA LEU A 41 116.044 2.075 0.686 1.00 0.00 C ATOM 689 C LEU A 41 115.549 1.029 -0.251 1.00 0.00 C ATOM 690 O LEU A 41 114.440 1.058 -0.620 1.00 0.00 O ATOM 691 CB LEU A 41 115.898 1.562 2.111 1.00 0.00 C ATOM 692 CG LEU A 41 116.363 2.437 3.252 1.00 0.00 C ATOM 693 CD1 LEU A 41 115.324 3.494 3.631 1.00 0.00 C ATOM 694 CD2 LEU A 41 116.739 1.575 4.429 1.00 0.00 C ATOM 0 H LEU A 41 114.460 3.473 0.830 1.00 0.00 H new ATOM 0 HA LEU A 41 117.106 2.281 0.550 1.00 0.00 H new ATOM 0 HB2 LEU A 41 114.844 1.339 2.275 1.00 0.00 H new ATOM 0 HB3 LEU A 41 116.438 0.617 2.178 1.00 0.00 H new ATOM 0 HG LEU A 41 117.245 2.988 2.924 1.00 0.00 H new ATOM 0 HD11 LEU A 41 115.703 4.098 4.455 1.00 0.00 H new ATOM 0 HD12 LEU A 41 115.127 4.135 2.772 1.00 0.00 H new ATOM 0 HD13 LEU A 41 114.400 3.003 3.936 1.00 0.00 H new ATOM 0 HD21 LEU A 41 117.074 2.208 5.251 1.00 0.00 H new ATOM 0 HD22 LEU A 41 115.872 0.995 4.747 1.00 0.00 H new ATOM 0 HD23 LEU A 41 117.543 0.897 4.142 1.00 0.00 H new ATOM 706 N GLN A 42 116.386 0.145 -0.648 1.00 0.00 N ATOM 707 CA GLN A 42 116.042 -0.902 -1.576 1.00 0.00 C ATOM 708 C GLN A 42 116.600 -2.201 -1.052 1.00 0.00 C ATOM 709 O GLN A 42 117.579 -2.187 -0.416 1.00 0.00 O ATOM 710 CB GLN A 42 116.714 -0.594 -2.874 1.00 0.00 C ATOM 711 CG GLN A 42 116.430 -1.579 -3.976 1.00 0.00 C ATOM 712 CD GLN A 42 117.499 -1.577 -5.020 1.00 0.00 C ATOM 713 OE1 GLN A 42 118.647 -1.256 -4.756 1.00 0.00 O ATOM 714 NE2 GLN A 42 117.178 -1.986 -6.171 1.00 0.00 N ATOM 0 H GLN A 42 117.357 0.116 -0.338 1.00 0.00 H new ATOM 0 HA GLN A 42 114.962 -0.975 -1.701 1.00 0.00 H new ATOM 0 HB2 GLN A 42 116.404 0.398 -3.202 1.00 0.00 H new ATOM 0 HB3 GLN A 42 117.791 -0.553 -2.710 1.00 0.00 H new ATOM 0 HG2 GLN A 42 116.339 -2.579 -3.553 1.00 0.00 H new ATOM 0 HG3 GLN A 42 115.472 -1.340 -4.438 1.00 0.00 H new ATOM 0 HE21 GLN A 42 116.212 -2.249 -6.368 1.00 0.00 H new ATOM 0 HE22 GLN A 42 117.885 -2.054 -6.904 1.00 0.00 H new ATOM 723 N ILE A 43 115.997 -3.299 -1.353 1.00 0.00 N ATOM 724 CA ILE A 43 116.488 -4.592 -0.850 1.00 0.00 C ATOM 725 C ILE A 43 117.693 -5.020 -1.701 1.00 0.00 C ATOM 726 O ILE A 43 117.588 -5.089 -2.916 1.00 0.00 O ATOM 727 CB ILE A 43 115.435 -5.742 -0.980 1.00 0.00 C ATOM 728 CG1 ILE A 43 114.005 -5.311 -0.599 1.00 0.00 C ATOM 729 CG2 ILE A 43 115.860 -6.967 -0.169 1.00 0.00 C ATOM 730 CD1 ILE A 43 113.847 -4.749 0.771 1.00 0.00 C ATOM 0 H ILE A 43 115.165 -3.357 -1.940 1.00 0.00 H new ATOM 0 HA ILE A 43 116.727 -4.447 0.203 1.00 0.00 H new ATOM 0 HB ILE A 43 115.407 -6.005 -2.038 1.00 0.00 H new ATOM 0 HG12 ILE A 43 113.665 -4.567 -1.319 1.00 0.00 H new ATOM 0 HG13 ILE A 43 113.346 -6.174 -0.697 1.00 0.00 H new ATOM 0 HG21 ILE A 43 115.111 -7.752 -0.276 1.00 0.00 H new ATOM 0 HG22 ILE A 43 116.821 -7.330 -0.534 1.00 0.00 H new ATOM 0 HG23 ILE A 43 115.951 -6.694 0.882 1.00 0.00 H new ATOM 0 HD11 ILE A 43 112.804 -4.479 0.935 1.00 0.00 H new ATOM 0 HD12 ILE A 43 114.149 -5.494 1.507 1.00 0.00 H new ATOM 0 HD13 ILE A 43 114.472 -3.862 0.875 1.00 0.00 H new ATOM 742 N LYS A 44 118.806 -5.321 -1.063 1.00 0.00 N ATOM 743 CA LYS A 44 120.022 -5.764 -1.766 1.00 0.00 C ATOM 744 C LYS A 44 120.240 -7.241 -1.596 1.00 0.00 C ATOM 745 O LYS A 44 120.984 -7.847 -2.367 1.00 0.00 O ATOM 746 CB LYS A 44 121.280 -5.038 -1.288 1.00 0.00 C ATOM 747 CG LYS A 44 121.573 -5.248 0.214 1.00 0.00 C ATOM 748 CD LYS A 44 122.993 -4.864 0.654 1.00 0.00 C ATOM 749 CE LYS A 44 124.041 -5.882 0.211 1.00 0.00 C ATOM 750 NZ LYS A 44 123.869 -7.210 0.858 1.00 0.00 N ATOM 0 H LYS A 44 118.907 -5.270 -0.049 1.00 0.00 H new ATOM 0 HA LYS A 44 119.857 -5.523 -2.816 1.00 0.00 H new ATOM 0 HB2 LYS A 44 122.134 -5.385 -1.870 1.00 0.00 H new ATOM 0 HB3 LYS A 44 121.172 -3.971 -1.484 1.00 0.00 H new ATOM 0 HG2 LYS A 44 120.858 -4.665 0.794 1.00 0.00 H new ATOM 0 HG3 LYS A 44 121.403 -6.296 0.460 1.00 0.00 H new ATOM 0 HD2 LYS A 44 123.245 -3.887 0.243 1.00 0.00 H new ATOM 0 HD3 LYS A 44 123.020 -4.770 1.740 1.00 0.00 H new ATOM 0 HE2 LYS A 44 123.989 -6.001 -0.871 1.00 0.00 H new ATOM 0 HE3 LYS A 44 125.034 -5.497 0.442 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 124.790 -7.553 1.198 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 123.215 -7.123 1.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 123.482 -7.885 0.168 1.00 0.00 H new ATOM 764 N SER A 45 119.672 -7.818 -0.568 1.00 0.00 N ATOM 765 CA SER A 45 119.756 -9.241 -0.374 1.00 0.00 C ATOM 766 C SER A 45 118.592 -9.683 0.473 1.00 0.00 C ATOM 767 O SER A 45 118.340 -9.116 1.537 1.00 0.00 O ATOM 768 CB SER A 45 121.075 -9.624 0.338 1.00 0.00 C ATOM 769 OG SER A 45 122.214 -9.066 -0.320 1.00 0.00 O ATOM 0 H SER A 45 119.145 -7.321 0.150 1.00 0.00 H new ATOM 0 HA SER A 45 119.733 -9.732 -1.347 1.00 0.00 H new ATOM 0 HB2 SER A 45 121.045 -9.276 1.371 1.00 0.00 H new ATOM 0 HB3 SER A 45 121.169 -10.709 0.370 1.00 0.00 H new ATOM 0 HG SER A 45 121.968 -8.799 -1.230 1.00 0.00 H new ATOM 775 N LEU A 46 117.872 -10.642 -0.006 1.00 0.00 N ATOM 776 CA LEU A 46 116.843 -11.243 0.723 1.00 0.00 C ATOM 777 C LEU A 46 117.452 -12.301 1.621 1.00 0.00 C ATOM 778 O LEU A 46 118.030 -13.282 1.135 1.00 0.00 O ATOM 779 CB LEU A 46 115.845 -11.867 -0.238 1.00 0.00 C ATOM 780 CG LEU A 46 114.767 -12.733 0.380 1.00 0.00 C ATOM 781 CD1 LEU A 46 114.011 -11.957 1.412 1.00 0.00 C ATOM 782 CD2 LEU A 46 113.834 -13.243 -0.687 1.00 0.00 C ATOM 0 H LEU A 46 117.999 -11.028 -0.941 1.00 0.00 H new ATOM 0 HA LEU A 46 116.320 -10.506 1.333 1.00 0.00 H new ATOM 0 HB2 LEU A 46 115.361 -11.066 -0.796 1.00 0.00 H new ATOM 0 HB3 LEU A 46 116.396 -12.470 -0.959 1.00 0.00 H new ATOM 0 HG LEU A 46 115.237 -13.588 0.865 1.00 0.00 H new ATOM 0 HD11 LEU A 46 113.239 -12.590 1.849 1.00 0.00 H new ATOM 0 HD12 LEU A 46 114.696 -11.627 2.193 1.00 0.00 H new ATOM 0 HD13 LEU A 46 113.547 -11.088 0.946 1.00 0.00 H new ATOM 0 HD21 LEU A 46 113.064 -13.864 -0.230 1.00 0.00 H new ATOM 0 HD22 LEU A 46 113.366 -12.400 -1.195 1.00 0.00 H new ATOM 0 HD23 LEU A 46 114.396 -13.835 -1.409 1.00 0.00 H new ATOM 794 N VAL A 47 117.367 -12.101 2.901 1.00 0.00 N ATOM 795 CA VAL A 47 117.904 -13.033 3.821 1.00 0.00 C ATOM 796 C VAL A 47 116.820 -14.036 4.161 1.00 0.00 C ATOM 797 O VAL A 47 115.728 -13.673 4.617 1.00 0.00 O ATOM 798 CB VAL A 47 118.427 -12.331 5.095 1.00 0.00 C ATOM 799 CG1 VAL A 47 119.007 -13.331 6.059 1.00 0.00 C ATOM 800 CG2 VAL A 47 119.460 -11.266 4.740 1.00 0.00 C ATOM 0 H VAL A 47 116.923 -11.287 3.327 1.00 0.00 H new ATOM 0 HA VAL A 47 118.757 -13.541 3.372 1.00 0.00 H new ATOM 0 HB VAL A 47 117.583 -11.841 5.580 1.00 0.00 H new ATOM 0 HG11 VAL A 47 119.368 -12.813 6.947 1.00 0.00 H new ATOM 0 HG12 VAL A 47 118.238 -14.049 6.345 1.00 0.00 H new ATOM 0 HG13 VAL A 47 119.835 -13.857 5.584 1.00 0.00 H new ATOM 0 HG21 VAL A 47 119.814 -10.785 5.652 1.00 0.00 H new ATOM 0 HG22 VAL A 47 120.300 -11.732 4.225 1.00 0.00 H new ATOM 0 HG23 VAL A 47 119.004 -10.520 4.089 1.00 0.00 H new ATOM 810 N LEU A 48 117.079 -15.276 3.876 1.00 0.00 N ATOM 811 CA LEU A 48 116.129 -16.305 4.145 1.00 0.00 C ATOM 812 C LEU A 48 115.958 -16.480 5.615 1.00 0.00 C ATOM 813 O LEU A 48 116.924 -16.319 6.380 1.00 0.00 O ATOM 814 CB LEU A 48 116.507 -17.571 3.432 1.00 0.00 C ATOM 815 CG LEU A 48 116.611 -17.405 1.905 1.00 0.00 C ATOM 816 CD1 LEU A 48 116.934 -18.713 1.231 1.00 0.00 C ATOM 817 CD2 LEU A 48 115.331 -16.784 1.317 1.00 0.00 C ATOM 0 H LEU A 48 117.949 -15.599 3.453 1.00 0.00 H new ATOM 0 HA LEU A 48 115.154 -16.015 3.753 1.00 0.00 H new ATOM 0 HB2 LEU A 48 117.463 -17.925 3.818 1.00 0.00 H new ATOM 0 HB3 LEU A 48 115.768 -18.340 3.657 1.00 0.00 H new ATOM 0 HG LEU A 48 117.434 -16.717 1.710 1.00 0.00 H new ATOM 0 HD11 LEU A 48 117.000 -18.561 0.154 1.00 0.00 H new ATOM 0 HD12 LEU A 48 117.887 -19.089 1.604 1.00 0.00 H new ATOM 0 HD13 LEU A 48 116.149 -19.437 1.447 1.00 0.00 H new ATOM 0 HD21 LEU A 48 115.439 -16.681 0.237 1.00 0.00 H new ATOM 0 HD22 LEU A 48 114.480 -17.428 1.537 1.00 0.00 H new ATOM 0 HD23 LEU A 48 115.166 -15.802 1.760 1.00 0.00 H new ATOM 829 N ASP A 49 114.714 -16.774 5.993 1.00 0.00 N ATOM 830 CA ASP A 49 114.234 -16.828 7.380 1.00 0.00 C ATOM 831 C ASP A 49 113.865 -15.414 7.856 1.00 0.00 C ATOM 832 O ASP A 49 113.564 -15.162 9.016 1.00 0.00 O ATOM 833 CB ASP A 49 115.206 -17.568 8.309 1.00 0.00 C ATOM 834 CG ASP A 49 114.682 -17.797 9.723 1.00 0.00 C ATOM 835 OD1 ASP A 49 113.826 -18.694 9.919 1.00 0.00 O ATOM 836 OD2 ASP A 49 115.154 -17.127 10.671 1.00 0.00 O ATOM 0 H ASP A 49 113.982 -16.990 5.317 1.00 0.00 H new ATOM 0 HA ASP A 49 113.324 -17.428 7.417 1.00 0.00 H new ATOM 0 HB2 ASP A 49 115.449 -18.533 7.865 1.00 0.00 H new ATOM 0 HB3 ASP A 49 116.135 -17.001 8.367 1.00 0.00 H new ATOM 841 N GLY A 50 113.888 -14.497 6.909 1.00 0.00 N ATOM 842 CA GLY A 50 113.415 -13.153 7.111 1.00 0.00 C ATOM 843 C GLY A 50 111.956 -13.099 6.786 1.00 0.00 C ATOM 844 O GLY A 50 111.533 -13.874 5.969 1.00 0.00 O ATOM 0 H GLY A 50 114.241 -14.672 5.968 1.00 0.00 H new ATOM 0 HA2 GLY A 50 113.583 -12.845 8.143 1.00 0.00 H new ATOM 0 HA3 GLY A 50 113.968 -12.459 6.478 1.00 0.00 H new ATOM 848 N PRO A 51 111.160 -12.139 7.270 1.00 0.00 N ATOM 849 CA PRO A 51 109.738 -12.224 7.105 1.00 0.00 C ATOM 850 C PRO A 51 109.357 -11.932 5.645 1.00 0.00 C ATOM 851 O PRO A 51 108.362 -12.411 5.136 1.00 0.00 O ATOM 852 CB PRO A 51 109.205 -11.253 8.157 1.00 0.00 C ATOM 853 CG PRO A 51 110.286 -10.243 8.369 1.00 0.00 C ATOM 854 CD PRO A 51 111.547 -10.805 7.771 1.00 0.00 C ATOM 0 HA PRO A 51 109.299 -13.208 7.268 1.00 0.00 H new ATOM 0 HB2 PRO A 51 108.286 -10.776 7.817 1.00 0.00 H new ATOM 0 HB3 PRO A 51 108.970 -11.774 9.085 1.00 0.00 H new ATOM 0 HG2 PRO A 51 110.025 -9.296 7.896 1.00 0.00 H new ATOM 0 HG3 PRO A 51 110.421 -10.042 9.432 1.00 0.00 H new ATOM 0 HD2 PRO A 51 111.920 -10.172 6.966 1.00 0.00 H new ATOM 0 HD3 PRO A 51 112.341 -10.876 8.515 1.00 0.00 H new ATOM 862 N ALA A 52 110.237 -11.173 4.981 1.00 0.00 N ATOM 863 CA ALA A 52 110.155 -10.868 3.565 1.00 0.00 C ATOM 864 C ALA A 52 110.308 -12.157 2.765 1.00 0.00 C ATOM 865 O ALA A 52 109.604 -12.377 1.790 1.00 0.00 O ATOM 866 CB ALA A 52 111.285 -9.913 3.198 1.00 0.00 C ATOM 0 H ALA A 52 111.045 -10.747 5.435 1.00 0.00 H new ATOM 0 HA ALA A 52 109.193 -10.408 3.339 1.00 0.00 H new ATOM 0 HB1 ALA A 52 111.232 -9.678 2.135 1.00 0.00 H new ATOM 0 HB2 ALA A 52 111.189 -8.995 3.778 1.00 0.00 H new ATOM 0 HB3 ALA A 52 112.244 -10.382 3.418 1.00 0.00 H new ATOM 872 N ALA A 53 111.217 -13.010 3.233 1.00 0.00 N ATOM 873 CA ALA A 53 111.536 -14.296 2.614 1.00 0.00 C ATOM 874 C ALA A 53 110.400 -15.240 2.784 1.00 0.00 C ATOM 875 O ALA A 53 109.950 -15.902 1.861 1.00 0.00 O ATOM 876 CB ALA A 53 112.749 -14.905 3.312 1.00 0.00 C ATOM 0 H ALA A 53 111.765 -12.822 4.072 1.00 0.00 H new ATOM 0 HA ALA A 53 111.735 -14.131 1.555 1.00 0.00 H new ATOM 0 HB1 ALA A 53 112.990 -15.864 2.853 1.00 0.00 H new ATOM 0 HB2 ALA A 53 113.601 -14.232 3.214 1.00 0.00 H new ATOM 0 HB3 ALA A 53 112.524 -15.055 4.368 1.00 0.00 H new ATOM 882 N LEU A 54 109.940 -15.254 3.971 1.00 0.00 N ATOM 883 CA LEU A 54 108.976 -16.149 4.436 1.00 0.00 C ATOM 884 C LEU A 54 107.618 -15.902 3.896 1.00 0.00 C ATOM 885 O LEU A 54 106.968 -16.815 3.390 1.00 0.00 O ATOM 886 CB LEU A 54 109.040 -16.071 5.861 1.00 0.00 C ATOM 887 CG LEU A 54 110.425 -16.453 6.338 1.00 0.00 C ATOM 888 CD1 LEU A 54 110.429 -16.328 7.715 1.00 0.00 C ATOM 889 CD2 LEU A 54 110.807 -17.869 5.926 1.00 0.00 C ATOM 0 H LEU A 54 110.250 -14.596 4.686 1.00 0.00 H new ATOM 0 HA LEU A 54 109.187 -17.159 4.085 1.00 0.00 H new ATOM 0 HB2 LEU A 54 108.799 -15.060 6.189 1.00 0.00 H new ATOM 0 HB3 LEU A 54 108.298 -16.735 6.304 1.00 0.00 H new ATOM 0 HG LEU A 54 111.165 -15.797 5.879 1.00 0.00 H new ATOM 0 HD11 LEU A 54 111.413 -16.595 8.102 1.00 0.00 H new ATOM 0 HD12 LEU A 54 110.199 -15.298 7.988 1.00 0.00 H new ATOM 0 HD13 LEU A 54 109.678 -16.993 8.143 1.00 0.00 H new ATOM 0 HD21 LEU A 54 111.809 -18.096 6.291 1.00 0.00 H new ATOM 0 HD22 LEU A 54 110.096 -18.576 6.353 1.00 0.00 H new ATOM 0 HD23 LEU A 54 110.790 -17.949 4.839 1.00 0.00 H new ATOM 901 N ASP A 55 107.192 -14.655 3.946 1.00 0.00 N ATOM 902 CA ASP A 55 105.918 -14.273 3.353 1.00 0.00 C ATOM 903 C ASP A 55 106.078 -14.348 1.857 1.00 0.00 C ATOM 904 O ASP A 55 105.162 -14.664 1.110 1.00 0.00 O ATOM 905 CB ASP A 55 105.534 -12.843 3.747 1.00 0.00 C ATOM 906 CG ASP A 55 104.088 -12.501 3.429 1.00 0.00 C ATOM 907 OD1 ASP A 55 103.752 -12.239 2.255 1.00 0.00 O ATOM 908 OD2 ASP A 55 103.253 -12.478 4.367 1.00 0.00 O ATOM 0 H ASP A 55 107.703 -13.891 4.387 1.00 0.00 H new ATOM 0 HA ASP A 55 105.133 -14.941 3.706 1.00 0.00 H new ATOM 0 HB2 ASP A 55 105.706 -12.709 4.815 1.00 0.00 H new ATOM 0 HB3 ASP A 55 106.189 -12.142 3.229 1.00 0.00 H new ATOM 913 N GLY A 56 107.324 -14.133 1.459 1.00 0.00 N ATOM 914 CA GLY A 56 107.742 -14.180 0.080 1.00 0.00 C ATOM 915 C GLY A 56 107.117 -13.135 -0.773 1.00 0.00 C ATOM 916 O GLY A 56 106.983 -13.295 -1.990 1.00 0.00 O ATOM 0 H GLY A 56 108.083 -13.917 2.106 1.00 0.00 H new ATOM 0 HA2 GLY A 56 108.826 -14.072 0.035 1.00 0.00 H new ATOM 0 HA3 GLY A 56 107.502 -15.161 -0.329 1.00 0.00 H new ATOM 920 N LYS A 57 106.769 -12.067 -0.140 1.00 0.00 N ATOM 921 CA LYS A 57 106.108 -10.967 -0.765 1.00 0.00 C ATOM 922 C LYS A 57 107.149 -9.968 -1.279 1.00 0.00 C ATOM 923 O LYS A 57 106.881 -9.160 -2.181 1.00 0.00 O ATOM 924 CB LYS A 57 105.271 -10.289 0.292 1.00 0.00 C ATOM 925 CG LYS A 57 104.326 -9.216 -0.226 1.00 0.00 C ATOM 926 CD LYS A 57 103.061 -9.833 -0.812 1.00 0.00 C ATOM 927 CE LYS A 57 101.861 -9.769 0.162 1.00 0.00 C ATOM 928 NZ LYS A 57 102.167 -10.217 1.546 1.00 0.00 N ATOM 0 H LYS A 57 106.941 -11.929 0.856 1.00 0.00 H new ATOM 0 HA LYS A 57 105.497 -11.311 -1.599 1.00 0.00 H new ATOM 0 HB2 LYS A 57 104.685 -11.047 0.812 1.00 0.00 H new ATOM 0 HB3 LYS A 57 105.937 -9.840 1.029 1.00 0.00 H new ATOM 0 HG2 LYS A 57 104.061 -8.538 0.585 1.00 0.00 H new ATOM 0 HG3 LYS A 57 104.830 -8.620 -0.987 1.00 0.00 H new ATOM 0 HD2 LYS A 57 102.803 -9.315 -1.735 1.00 0.00 H new ATOM 0 HD3 LYS A 57 103.256 -10.873 -1.074 1.00 0.00 H new ATOM 0 HE2 LYS A 57 101.493 -8.744 0.198 1.00 0.00 H new ATOM 0 HE3 LYS A 57 101.053 -10.384 -0.235 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 101.303 -10.175 2.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 102.522 -11.194 1.524 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 102.891 -9.595 1.960 1.00 0.00 H new ATOM 942 N MET A 58 108.330 -10.051 -0.722 1.00 0.00 N ATOM 943 CA MET A 58 109.406 -9.112 -0.991 1.00 0.00 C ATOM 944 C MET A 58 110.626 -9.881 -1.429 1.00 0.00 C ATOM 945 O MET A 58 110.792 -11.051 -1.034 1.00 0.00 O ATOM 946 CB MET A 58 109.722 -8.344 0.277 1.00 0.00 C ATOM 947 CG MET A 58 108.609 -7.461 0.784 1.00 0.00 C ATOM 948 SD MET A 58 108.948 -6.835 2.436 1.00 0.00 S ATOM 949 CE MET A 58 110.588 -6.156 2.210 1.00 0.00 C ATOM 0 H MET A 58 108.582 -10.782 -0.057 1.00 0.00 H new ATOM 0 HA MET A 58 109.108 -8.415 -1.775 1.00 0.00 H new ATOM 0 HB2 MET A 58 109.985 -9.056 1.059 1.00 0.00 H new ATOM 0 HB3 MET A 58 110.603 -7.727 0.100 1.00 0.00 H new ATOM 0 HG2 MET A 58 108.470 -6.624 0.100 1.00 0.00 H new ATOM 0 HG3 MET A 58 107.675 -8.023 0.794 1.00 0.00 H new ATOM 0 HE1 MET A 58 110.756 -5.361 2.937 1.00 0.00 H new ATOM 0 HE2 MET A 58 111.330 -6.942 2.353 1.00 0.00 H new ATOM 0 HE3 MET A 58 110.678 -5.751 1.202 1.00 0.00 H new ATOM 959 N GLU A 59 111.471 -9.252 -2.222 1.00 0.00 N ATOM 960 CA GLU A 59 112.642 -9.890 -2.797 1.00 0.00 C ATOM 961 C GLU A 59 113.782 -8.900 -3.009 1.00 0.00 C ATOM 962 O GLU A 59 113.619 -7.694 -2.870 1.00 0.00 O ATOM 963 CB GLU A 59 112.294 -10.588 -4.121 1.00 0.00 C ATOM 964 CG GLU A 59 111.515 -11.884 -3.958 1.00 0.00 C ATOM 965 CD GLU A 59 111.203 -12.543 -5.259 1.00 0.00 C ATOM 966 OE1 GLU A 59 112.072 -13.266 -5.800 1.00 0.00 O ATOM 967 OE2 GLU A 59 110.077 -12.355 -5.780 1.00 0.00 O ATOM 0 H GLU A 59 111.364 -8.273 -2.489 1.00 0.00 H new ATOM 0 HA GLU A 59 112.979 -10.640 -2.082 1.00 0.00 H new ATOM 0 HB2 GLU A 59 111.712 -9.903 -4.738 1.00 0.00 H new ATOM 0 HB3 GLU A 59 113.217 -10.798 -4.661 1.00 0.00 H new ATOM 0 HG2 GLU A 59 112.090 -12.571 -3.337 1.00 0.00 H new ATOM 0 HG3 GLU A 59 110.585 -11.678 -3.429 1.00 0.00 H new ATOM 974 N THR A 60 114.953 -9.423 -3.278 1.00 0.00 N ATOM 975 CA THR A 60 116.084 -8.619 -3.591 1.00 0.00 C ATOM 976 C THR A 60 115.768 -7.801 -4.850 1.00 0.00 C ATOM 977 O THR A 60 115.505 -8.375 -5.923 1.00 0.00 O ATOM 978 CB THR A 60 117.251 -9.532 -3.892 1.00 0.00 C ATOM 979 OG1 THR A 60 117.329 -10.576 -2.905 1.00 0.00 O ATOM 980 CG2 THR A 60 118.517 -8.768 -3.888 1.00 0.00 C ATOM 0 H THR A 60 115.138 -10.426 -3.283 1.00 0.00 H new ATOM 0 HA THR A 60 116.323 -7.957 -2.759 1.00 0.00 H new ATOM 0 HB THR A 60 117.097 -9.971 -4.878 1.00 0.00 H new ATOM 0 HG1 THR A 60 118.087 -11.163 -3.109 1.00 0.00 H new ATOM 0 HG21 THR A 60 119.348 -9.439 -4.106 1.00 0.00 H new ATOM 0 HG22 THR A 60 118.473 -7.987 -4.647 1.00 0.00 H new ATOM 0 HG23 THR A 60 118.665 -8.314 -2.908 1.00 0.00 H new ATOM 988 N GLY A 61 115.739 -6.507 -4.713 1.00 0.00 N ATOM 989 CA GLY A 61 115.454 -5.665 -5.826 1.00 0.00 C ATOM 990 C GLY A 61 114.421 -4.608 -5.500 1.00 0.00 C ATOM 991 O GLY A 61 114.578 -3.443 -5.892 1.00 0.00 O ATOM 0 H GLY A 61 115.911 -6.015 -3.836 1.00 0.00 H new ATOM 0 HA2 GLY A 61 116.373 -5.181 -6.157 1.00 0.00 H new ATOM 0 HA3 GLY A 61 115.097 -6.274 -6.657 1.00 0.00 H new ATOM 995 N ASP A 62 113.373 -4.996 -4.772 1.00 0.00 N ATOM 996 CA ASP A 62 112.276 -4.067 -4.454 1.00 0.00 C ATOM 997 C ASP A 62 112.692 -2.964 -3.510 1.00 0.00 C ATOM 998 O ASP A 62 113.580 -3.131 -2.690 1.00 0.00 O ATOM 999 CB ASP A 62 110.943 -4.762 -4.040 1.00 0.00 C ATOM 1000 CG ASP A 62 111.085 -6.171 -3.505 1.00 0.00 C ATOM 1001 OD1 ASP A 62 111.420 -7.058 -4.302 1.00 0.00 O ATOM 1002 OD2 ASP A 62 110.790 -6.430 -2.339 1.00 0.00 O ATOM 0 H ASP A 62 113.256 -5.936 -4.393 1.00 0.00 H new ATOM 0 HA ASP A 62 112.043 -3.581 -5.401 1.00 0.00 H new ATOM 0 HB2 ASP A 62 110.455 -4.151 -3.281 1.00 0.00 H new ATOM 0 HB3 ASP A 62 110.281 -4.785 -4.905 1.00 0.00 H new ATOM 1007 N VAL A 63 112.075 -1.822 -3.654 1.00 0.00 N ATOM 1008 CA VAL A 63 112.492 -0.646 -2.926 1.00 0.00 C ATOM 1009 C VAL A 63 111.529 -0.172 -1.847 1.00 0.00 C ATOM 1010 O VAL A 63 110.377 0.169 -2.116 1.00 0.00 O ATOM 1011 CB VAL A 63 113.034 0.505 -3.865 1.00 0.00 C ATOM 1012 CG1 VAL A 63 112.287 0.535 -5.164 1.00 0.00 C ATOM 1013 CG2 VAL A 63 112.978 1.887 -3.210 1.00 0.00 C ATOM 0 H VAL A 63 111.277 -1.677 -4.272 1.00 0.00 H new ATOM 0 HA VAL A 63 113.353 -0.981 -2.348 1.00 0.00 H new ATOM 0 HB VAL A 63 114.083 0.272 -4.050 1.00 0.00 H new ATOM 0 HG11 VAL A 63 112.680 1.336 -5.791 1.00 0.00 H new ATOM 0 HG12 VAL A 63 112.409 -0.420 -5.676 1.00 0.00 H new ATOM 0 HG13 VAL A 63 111.229 0.711 -4.971 1.00 0.00 H new ATOM 0 HG21 VAL A 63 113.363 2.634 -3.904 1.00 0.00 H new ATOM 0 HG22 VAL A 63 111.946 2.127 -2.954 1.00 0.00 H new ATOM 0 HG23 VAL A 63 113.585 1.885 -2.305 1.00 0.00 H new ATOM 1023 N ILE A 64 112.058 -0.177 -0.627 1.00 0.00 N ATOM 1024 CA ILE A 64 111.411 0.253 0.592 1.00 0.00 C ATOM 1025 C ILE A 64 111.112 1.745 0.547 1.00 0.00 C ATOM 1026 O ILE A 64 112.063 2.634 0.525 1.00 0.00 O ATOM 1027 CB ILE A 64 112.282 -0.056 1.853 1.00 0.00 C ATOM 1028 CG1 ILE A 64 112.528 -1.563 2.011 1.00 0.00 C ATOM 1029 CG2 ILE A 64 111.662 0.525 3.133 1.00 0.00 C ATOM 1030 CD1 ILE A 64 111.271 -2.382 2.237 1.00 0.00 C ATOM 0 H ILE A 64 113.010 -0.503 -0.461 1.00 0.00 H new ATOM 0 HA ILE A 64 110.479 -0.306 0.668 1.00 0.00 H new ATOM 0 HB ILE A 64 113.244 0.432 1.697 1.00 0.00 H new ATOM 0 HG12 ILE A 64 113.032 -1.932 1.118 1.00 0.00 H new ATOM 0 HG13 ILE A 64 113.207 -1.722 2.849 1.00 0.00 H new ATOM 0 HG21 ILE A 64 112.298 0.288 3.986 1.00 0.00 H new ATOM 0 HG22 ILE A 64 111.574 1.607 3.036 1.00 0.00 H new ATOM 0 HG23 ILE A 64 110.673 0.093 3.287 1.00 0.00 H new ATOM 0 HD11 ILE A 64 111.536 -3.435 2.338 1.00 0.00 H new ATOM 0 HD12 ILE A 64 110.775 -2.044 3.147 1.00 0.00 H new ATOM 0 HD13 ILE A 64 110.598 -2.257 1.389 1.00 0.00 H new ATOM 1042 N VAL A 65 109.811 1.999 0.554 1.00 0.00 N ATOM 1043 CA VAL A 65 109.225 3.299 0.492 1.00 0.00 C ATOM 1044 C VAL A 65 108.837 3.772 1.898 1.00 0.00 C ATOM 1045 O VAL A 65 109.295 4.794 2.344 1.00 0.00 O ATOM 1046 CB VAL A 65 107.962 3.271 -0.434 1.00 0.00 C ATOM 1047 CG1 VAL A 65 107.264 4.616 -0.505 1.00 0.00 C ATOM 1048 CG2 VAL A 65 108.345 2.824 -1.826 1.00 0.00 C ATOM 0 H VAL A 65 109.114 1.256 0.606 1.00 0.00 H new ATOM 0 HA VAL A 65 109.954 3.996 0.077 1.00 0.00 H new ATOM 0 HB VAL A 65 107.262 2.560 0.006 1.00 0.00 H new ATOM 0 HG11 VAL A 65 106.396 4.541 -1.160 1.00 0.00 H new ATOM 0 HG12 VAL A 65 106.941 4.912 0.493 1.00 0.00 H new ATOM 0 HG13 VAL A 65 107.953 5.363 -0.900 1.00 0.00 H new ATOM 0 HG21 VAL A 65 107.459 2.809 -2.460 1.00 0.00 H new ATOM 0 HG22 VAL A 65 109.077 3.516 -2.242 1.00 0.00 H new ATOM 0 HG23 VAL A 65 108.776 1.824 -1.781 1.00 0.00 H new ATOM 1058 N SER A 66 107.999 3.031 2.601 1.00 0.00 N ATOM 1059 CA SER A 66 107.537 3.478 3.926 1.00 0.00 C ATOM 1060 C SER A 66 107.113 2.306 4.815 1.00 0.00 C ATOM 1061 O SER A 66 107.062 1.157 4.367 1.00 0.00 O ATOM 1062 CB SER A 66 106.364 4.470 3.779 1.00 0.00 C ATOM 1063 OG SER A 66 106.736 5.598 2.992 1.00 0.00 O ATOM 0 H SER A 66 107.624 2.133 2.295 1.00 0.00 H new ATOM 0 HA SER A 66 108.379 3.974 4.408 1.00 0.00 H new ATOM 0 HB2 SER A 66 105.514 3.966 3.318 1.00 0.00 H new ATOM 0 HB3 SER A 66 106.040 4.803 4.765 1.00 0.00 H new ATOM 0 HG SER A 66 105.973 6.209 2.914 1.00 0.00 H new ATOM 1069 N VAL A 67 106.816 2.616 6.066 1.00 0.00 N ATOM 1070 CA VAL A 67 106.365 1.652 7.031 1.00 0.00 C ATOM 1071 C VAL A 67 105.280 2.333 7.869 1.00 0.00 C ATOM 1072 O VAL A 67 105.202 3.567 7.845 1.00 0.00 O ATOM 1073 CB VAL A 67 107.547 1.143 7.925 1.00 0.00 C ATOM 1074 CG1 VAL A 67 108.024 2.170 8.906 1.00 0.00 C ATOM 1075 CG2 VAL A 67 107.198 -0.132 8.626 1.00 0.00 C ATOM 0 H VAL A 67 106.886 3.564 6.437 1.00 0.00 H new ATOM 0 HA VAL A 67 105.964 0.769 6.533 1.00 0.00 H new ATOM 0 HB VAL A 67 108.374 0.948 7.242 1.00 0.00 H new ATOM 0 HG11 VAL A 67 108.843 1.757 9.495 1.00 0.00 H new ATOM 0 HG12 VAL A 67 108.372 3.052 8.369 1.00 0.00 H new ATOM 0 HG13 VAL A 67 107.205 2.448 9.569 1.00 0.00 H new ATOM 0 HG21 VAL A 67 108.042 -0.454 9.236 1.00 0.00 H new ATOM 0 HG22 VAL A 67 106.329 0.030 9.264 1.00 0.00 H new ATOM 0 HG23 VAL A 67 106.969 -0.901 7.889 1.00 0.00 H new ATOM 1085 N ASN A 68 104.436 1.546 8.524 1.00 0.00 N ATOM 1086 CA ASN A 68 103.319 2.010 9.383 1.00 0.00 C ATOM 1087 C ASN A 68 103.577 3.345 10.114 1.00 0.00 C ATOM 1088 O ASN A 68 104.372 3.444 11.065 1.00 0.00 O ATOM 1089 CB ASN A 68 102.876 0.930 10.388 1.00 0.00 C ATOM 1090 CG ASN A 68 103.915 0.577 11.437 1.00 0.00 C ATOM 1091 OD1 ASN A 68 105.118 0.606 11.193 1.00 0.00 O ATOM 1092 ND2 ASN A 68 103.458 0.274 12.603 1.00 0.00 N ATOM 0 H ASN A 68 104.500 0.529 8.480 1.00 0.00 H new ATOM 0 HA ASN A 68 102.507 2.201 8.681 1.00 0.00 H new ATOM 0 HB2 ASN A 68 101.972 1.271 10.892 1.00 0.00 H new ATOM 0 HB3 ASN A 68 102.613 0.027 9.838 1.00 0.00 H new ATOM 0 HD21 ASN A 68 104.103 0.048 13.360 1.00 0.00 H new ATOM 0 HD22 ASN A 68 102.452 0.260 12.769 1.00 0.00 H new ATOM 1099 N ASP A 69 102.927 4.367 9.594 1.00 0.00 N ATOM 1100 CA ASP A 69 102.939 5.753 10.111 1.00 0.00 C ATOM 1101 C ASP A 69 104.373 6.279 10.339 1.00 0.00 C ATOM 1102 O ASP A 69 104.657 7.015 11.279 1.00 0.00 O ATOM 1103 CB ASP A 69 102.077 5.855 11.389 1.00 0.00 C ATOM 1104 CG ASP A 69 101.816 7.280 11.843 1.00 0.00 C ATOM 1105 OD1 ASP A 69 101.118 8.026 11.129 1.00 0.00 O ATOM 1106 OD2 ASP A 69 102.255 7.667 12.943 1.00 0.00 O ATOM 0 H ASP A 69 102.345 4.267 8.762 1.00 0.00 H new ATOM 0 HA ASP A 69 102.498 6.398 9.351 1.00 0.00 H new ATOM 0 HB2 ASP A 69 101.122 5.360 11.212 1.00 0.00 H new ATOM 0 HB3 ASP A 69 102.573 5.313 12.194 1.00 0.00 H new ATOM 1111 N THR A 70 105.285 5.855 9.507 1.00 0.00 N ATOM 1112 CA THR A 70 106.636 6.282 9.615 1.00 0.00 C ATOM 1113 C THR A 70 107.202 6.511 8.231 1.00 0.00 C ATOM 1114 O THR A 70 107.252 5.591 7.382 1.00 0.00 O ATOM 1115 CB THR A 70 107.476 5.245 10.359 1.00 0.00 C ATOM 1116 OG1 THR A 70 106.800 4.850 11.562 1.00 0.00 O ATOM 1117 CG2 THR A 70 108.828 5.820 10.718 1.00 0.00 C ATOM 0 H THR A 70 105.104 5.206 8.741 1.00 0.00 H new ATOM 0 HA THR A 70 106.666 7.213 10.182 1.00 0.00 H new ATOM 0 HB THR A 70 107.616 4.381 9.710 1.00 0.00 H new ATOM 0 HG1 THR A 70 106.027 4.293 11.335 1.00 0.00 H new ATOM 0 HG21 THR A 70 109.414 5.069 11.247 1.00 0.00 H new ATOM 0 HG22 THR A 70 109.352 6.114 9.808 1.00 0.00 H new ATOM 0 HG23 THR A 70 108.694 6.693 11.357 1.00 0.00 H new ATOM 1125 N CYS A 71 107.627 7.712 8.000 1.00 0.00 N ATOM 1126 CA CYS A 71 108.134 8.103 6.735 1.00 0.00 C ATOM 1127 C CYS A 71 109.594 7.674 6.587 1.00 0.00 C ATOM 1128 O CYS A 71 110.516 8.475 6.720 1.00 0.00 O ATOM 1129 CB CYS A 71 107.969 9.607 6.560 1.00 0.00 C ATOM 1130 SG CYS A 71 108.288 10.204 4.884 1.00 0.00 S ATOM 0 H CYS A 71 107.629 8.455 8.699 1.00 0.00 H new ATOM 0 HA CYS A 71 107.568 7.604 5.948 1.00 0.00 H new ATOM 0 HB2 CYS A 71 106.954 9.884 6.844 1.00 0.00 H new ATOM 0 HB3 CYS A 71 108.643 10.117 7.248 1.00 0.00 H new ATOM 0 HG CYS A 71 108.119 11.492 4.843 1.00 0.00 H new ATOM 1136 N VAL A 72 109.783 6.382 6.323 1.00 0.00 N ATOM 1137 CA VAL A 72 111.108 5.797 6.052 1.00 0.00 C ATOM 1138 C VAL A 72 111.551 6.217 4.639 1.00 0.00 C ATOM 1139 O VAL A 72 112.689 6.020 4.201 1.00 0.00 O ATOM 1140 CB VAL A 72 111.058 4.242 6.219 1.00 0.00 C ATOM 1141 CG1 VAL A 72 112.380 3.573 5.882 1.00 0.00 C ATOM 1142 CG2 VAL A 72 110.687 3.913 7.643 1.00 0.00 C ATOM 0 H VAL A 72 109.022 5.703 6.289 1.00 0.00 H new ATOM 0 HA VAL A 72 111.842 6.167 6.768 1.00 0.00 H new ATOM 0 HB VAL A 72 110.313 3.861 5.520 1.00 0.00 H new ATOM 0 HG11 VAL A 72 112.287 2.495 6.016 1.00 0.00 H new ATOM 0 HG12 VAL A 72 112.644 3.789 4.847 1.00 0.00 H new ATOM 0 HG13 VAL A 72 113.159 3.954 6.542 1.00 0.00 H new ATOM 0 HG21 VAL A 72 110.650 2.831 7.769 1.00 0.00 H new ATOM 0 HG22 VAL A 72 111.433 4.331 8.319 1.00 0.00 H new ATOM 0 HG23 VAL A 72 109.710 4.339 7.872 1.00 0.00 H new ATOM 1152 N LEU A 73 110.627 6.823 3.968 1.00 0.00 N ATOM 1153 CA LEU A 73 110.810 7.402 2.696 1.00 0.00 C ATOM 1154 C LEU A 73 111.794 8.548 2.863 1.00 0.00 C ATOM 1155 O LEU A 73 111.477 9.565 3.485 1.00 0.00 O ATOM 1156 CB LEU A 73 109.434 7.924 2.320 1.00 0.00 C ATOM 1157 CG LEU A 73 109.189 8.419 0.931 1.00 0.00 C ATOM 1158 CD1 LEU A 73 109.551 7.350 -0.073 1.00 0.00 C ATOM 1159 CD2 LEU A 73 107.726 8.765 0.821 1.00 0.00 C ATOM 0 H LEU A 73 109.676 6.928 4.320 1.00 0.00 H new ATOM 0 HA LEU A 73 111.195 6.721 1.937 1.00 0.00 H new ATOM 0 HB2 LEU A 73 108.718 7.125 2.513 1.00 0.00 H new ATOM 0 HB3 LEU A 73 109.196 8.739 3.004 1.00 0.00 H new ATOM 0 HG LEU A 73 109.803 9.295 0.724 1.00 0.00 H new ATOM 0 HD11 LEU A 73 109.369 7.721 -1.081 1.00 0.00 H new ATOM 0 HD12 LEU A 73 110.605 7.092 0.034 1.00 0.00 H new ATOM 0 HD13 LEU A 73 108.941 6.464 0.103 1.00 0.00 H new ATOM 0 HD21 LEU A 73 107.513 9.131 -0.184 1.00 0.00 H new ATOM 0 HD22 LEU A 73 107.126 7.877 1.019 1.00 0.00 H new ATOM 0 HD23 LEU A 73 107.479 9.538 1.548 1.00 0.00 H new ATOM 1171 N GLY A 74 112.975 8.373 2.315 1.00 0.00 N ATOM 1172 CA GLY A 74 114.011 9.356 2.466 1.00 0.00 C ATOM 1173 C GLY A 74 114.551 9.418 3.886 1.00 0.00 C ATOM 1174 O GLY A 74 115.022 10.472 4.335 1.00 0.00 O ATOM 0 H GLY A 74 113.237 7.557 1.762 1.00 0.00 H new ATOM 0 HA2 GLY A 74 114.827 9.128 1.780 1.00 0.00 H new ATOM 0 HA3 GLY A 74 113.623 10.335 2.185 1.00 0.00 H new ATOM 1178 N HIS A 75 114.457 8.308 4.607 1.00 0.00 N ATOM 1179 CA HIS A 75 114.949 8.236 5.952 1.00 0.00 C ATOM 1180 C HIS A 75 116.448 8.165 5.878 1.00 0.00 C ATOM 1181 O HIS A 75 116.992 7.532 4.989 1.00 0.00 O ATOM 1182 CB HIS A 75 114.417 6.979 6.637 1.00 0.00 C ATOM 1183 CG HIS A 75 113.817 7.196 7.994 1.00 0.00 C ATOM 1184 ND1 HIS A 75 112.727 7.995 8.251 1.00 0.00 N ATOM 1185 CD2 HIS A 75 114.172 6.679 9.168 1.00 0.00 C ATOM 1186 CE1 HIS A 75 112.469 7.937 9.557 1.00 0.00 C ATOM 1187 NE2 HIS A 75 113.322 7.146 10.168 1.00 0.00 N ATOM 0 H HIS A 75 114.037 7.443 4.266 1.00 0.00 H new ATOM 0 HA HIS A 75 114.624 9.106 6.523 1.00 0.00 H new ATOM 0 HB2 HIS A 75 113.664 6.525 5.993 1.00 0.00 H new ATOM 0 HB3 HIS A 75 115.233 6.262 6.729 1.00 0.00 H new ATOM 0 HD1 HIS A 75 112.207 8.538 7.562 1.00 0.00 H new ATOM 0 HD2 HIS A 75 114.996 5.999 9.322 1.00 0.00 H new ATOM 0 HE1 HIS A 75 111.667 8.469 10.047 1.00 0.00 H new ATOM 1195 N THR A 76 117.096 8.851 6.759 1.00 0.00 N ATOM 1196 CA THR A 76 118.528 8.842 6.819 1.00 0.00 C ATOM 1197 C THR A 76 118.979 7.491 7.378 1.00 0.00 C ATOM 1198 O THR A 76 118.255 6.954 8.228 1.00 0.00 O ATOM 1199 CB THR A 76 118.972 9.952 7.776 1.00 0.00 C ATOM 1200 OG1 THR A 76 118.374 11.188 7.387 1.00 0.00 O ATOM 1201 CG2 THR A 76 120.474 10.110 7.827 1.00 0.00 C ATOM 0 H THR A 76 116.649 9.438 7.463 1.00 0.00 H new ATOM 0 HA THR A 76 118.960 9.000 5.831 1.00 0.00 H new ATOM 0 HB THR A 76 118.642 9.668 8.775 1.00 0.00 H new ATOM 0 HG1 THR A 76 118.658 11.897 8.002 1.00 0.00 H new ATOM 0 HG21 THR A 76 120.732 10.910 8.521 1.00 0.00 H new ATOM 0 HG22 THR A 76 120.927 9.177 8.164 1.00 0.00 H new ATOM 0 HG23 THR A 76 120.848 10.356 6.833 1.00 0.00 H new ATOM 1209 N HIS A 77 120.111 6.939 6.923 1.00 0.00 N ATOM 1210 CA HIS A 77 120.584 5.617 7.386 1.00 0.00 C ATOM 1211 C HIS A 77 120.537 5.489 8.881 1.00 0.00 C ATOM 1212 O HIS A 77 119.962 4.548 9.392 1.00 0.00 O ATOM 1213 CB HIS A 77 122.014 5.313 6.886 1.00 0.00 C ATOM 1214 CG HIS A 77 122.633 4.067 7.503 1.00 0.00 C ATOM 1215 ND1 HIS A 77 122.189 2.777 7.289 1.00 0.00 N ATOM 1216 CD2 HIS A 77 123.647 3.959 8.396 1.00 0.00 C ATOM 1217 CE1 HIS A 77 122.921 1.960 8.039 1.00 0.00 C ATOM 1218 NE2 HIS A 77 123.825 2.623 8.733 1.00 0.00 N ATOM 0 H HIS A 77 120.720 7.383 6.235 1.00 0.00 H new ATOM 0 HA HIS A 77 119.898 4.886 6.957 1.00 0.00 H new ATOM 0 HB2 HIS A 77 121.992 5.197 5.802 1.00 0.00 H new ATOM 0 HB3 HIS A 77 122.653 6.169 7.102 1.00 0.00 H new ATOM 0 HD2 HIS A 77 124.226 4.783 8.785 1.00 0.00 H new ATOM 0 HE1 HIS A 77 122.792 0.888 8.075 1.00 0.00 H new ATOM 0 HE2 HIS A 77 124.511 2.236 9.381 1.00 0.00 H new ATOM 1226 N ALA A 78 121.057 6.472 9.555 1.00 0.00 N ATOM 1227 CA ALA A 78 121.145 6.472 11.006 1.00 0.00 C ATOM 1228 C ALA A 78 119.767 6.340 11.631 1.00 0.00 C ATOM 1229 O ALA A 78 119.589 5.679 12.658 1.00 0.00 O ATOM 1230 CB ALA A 78 121.832 7.736 11.486 1.00 0.00 C ATOM 0 H ALA A 78 121.439 7.311 9.118 1.00 0.00 H new ATOM 0 HA ALA A 78 121.738 5.612 11.317 1.00 0.00 H new ATOM 0 HB1 ALA A 78 121.893 7.726 12.574 1.00 0.00 H new ATOM 0 HB2 ALA A 78 122.837 7.786 11.067 1.00 0.00 H new ATOM 0 HB3 ALA A 78 121.261 8.606 11.162 1.00 0.00 H new ATOM 1236 N GLN A 79 118.794 6.905 10.970 1.00 0.00 N ATOM 1237 CA GLN A 79 117.452 6.894 11.457 1.00 0.00 C ATOM 1238 C GLN A 79 116.778 5.561 11.158 1.00 0.00 C ATOM 1239 O GLN A 79 116.178 4.935 12.037 1.00 0.00 O ATOM 1240 CB GLN A 79 116.641 8.021 10.842 1.00 0.00 C ATOM 1241 CG GLN A 79 117.173 9.414 11.089 1.00 0.00 C ATOM 1242 CD GLN A 79 117.478 9.698 12.532 1.00 0.00 C ATOM 1243 OE1 GLN A 79 116.875 9.134 13.437 1.00 0.00 O ATOM 1244 NE2 GLN A 79 118.398 10.589 12.752 1.00 0.00 N ATOM 0 H GLN A 79 118.915 7.385 10.078 1.00 0.00 H new ATOM 0 HA GLN A 79 117.494 7.037 12.537 1.00 0.00 H new ATOM 0 HB2 GLN A 79 116.583 7.858 9.766 1.00 0.00 H new ATOM 0 HB3 GLN A 79 115.623 7.966 11.228 1.00 0.00 H new ATOM 0 HG2 GLN A 79 118.079 9.557 10.501 1.00 0.00 H new ATOM 0 HG3 GLN A 79 116.443 10.141 10.731 1.00 0.00 H new ATOM 0 HE21 GLN A 79 118.875 11.034 11.968 1.00 0.00 H new ATOM 0 HE22 GLN A 79 118.643 10.843 13.709 1.00 0.00 H new ATOM 1253 N VAL A 80 116.883 5.134 9.916 1.00 0.00 N ATOM 1254 CA VAL A 80 116.267 3.898 9.487 1.00 0.00 C ATOM 1255 C VAL A 80 116.870 2.688 10.215 1.00 0.00 C ATOM 1256 O VAL A 80 116.139 1.832 10.713 1.00 0.00 O ATOM 1257 CB VAL A 80 116.263 3.731 7.929 1.00 0.00 C ATOM 1258 CG1 VAL A 80 117.661 3.740 7.354 1.00 0.00 C ATOM 1259 CG2 VAL A 80 115.517 2.469 7.540 1.00 0.00 C ATOM 0 H VAL A 80 117.392 5.629 9.184 1.00 0.00 H new ATOM 0 HA VAL A 80 115.217 3.949 9.775 1.00 0.00 H new ATOM 0 HB VAL A 80 115.744 4.589 7.503 1.00 0.00 H new ATOM 0 HG11 VAL A 80 117.610 3.622 6.272 1.00 0.00 H new ATOM 0 HG12 VAL A 80 118.147 4.686 7.593 1.00 0.00 H new ATOM 0 HG13 VAL A 80 118.236 2.919 7.782 1.00 0.00 H new ATOM 0 HG21 VAL A 80 115.521 2.364 6.455 1.00 0.00 H new ATOM 0 HG22 VAL A 80 116.005 1.605 7.990 1.00 0.00 H new ATOM 0 HG23 VAL A 80 114.488 2.531 7.895 1.00 0.00 H new ATOM 1269 N VAL A 81 118.189 2.675 10.358 1.00 0.00 N ATOM 1270 CA VAL A 81 118.863 1.594 11.060 1.00 0.00 C ATOM 1271 C VAL A 81 118.457 1.607 12.525 1.00 0.00 C ATOM 1272 O VAL A 81 118.267 0.584 13.111 1.00 0.00 O ATOM 1273 CB VAL A 81 120.434 1.610 10.897 1.00 0.00 C ATOM 1274 CG1 VAL A 81 121.098 2.776 11.613 1.00 0.00 C ATOM 1275 CG2 VAL A 81 121.056 0.293 11.335 1.00 0.00 C ATOM 0 H VAL A 81 118.811 3.399 9.998 1.00 0.00 H new ATOM 0 HA VAL A 81 118.540 0.661 10.598 1.00 0.00 H new ATOM 0 HB VAL A 81 120.618 1.745 9.831 1.00 0.00 H new ATOM 0 HG11 VAL A 81 122.176 2.729 11.462 1.00 0.00 H new ATOM 0 HG12 VAL A 81 120.716 3.715 11.212 1.00 0.00 H new ATOM 0 HG13 VAL A 81 120.878 2.721 12.679 1.00 0.00 H new ATOM 0 HG21 VAL A 81 122.138 0.342 11.209 1.00 0.00 H new ATOM 0 HG22 VAL A 81 120.821 0.111 12.384 1.00 0.00 H new ATOM 0 HG23 VAL A 81 120.656 -0.518 10.727 1.00 0.00 H new ATOM 1285 N LYS A 82 118.269 2.794 13.080 1.00 0.00 N ATOM 1286 CA LYS A 82 117.837 2.950 14.457 1.00 0.00 C ATOM 1287 C LYS A 82 116.529 2.185 14.726 1.00 0.00 C ATOM 1288 O LYS A 82 116.445 1.404 15.673 1.00 0.00 O ATOM 1289 CB LYS A 82 117.612 4.422 14.718 1.00 0.00 C ATOM 1290 CG LYS A 82 117.184 4.777 16.129 1.00 0.00 C ATOM 1291 CD LYS A 82 116.911 6.265 16.247 1.00 0.00 C ATOM 1292 CE LYS A 82 115.679 6.686 15.434 1.00 0.00 C ATOM 1293 NZ LYS A 82 115.430 8.144 15.486 1.00 0.00 N ATOM 0 H LYS A 82 118.412 3.676 12.587 1.00 0.00 H new ATOM 0 HA LYS A 82 118.605 2.545 15.116 1.00 0.00 H new ATOM 0 HB2 LYS A 82 118.533 4.958 14.491 1.00 0.00 H new ATOM 0 HB3 LYS A 82 116.853 4.784 14.025 1.00 0.00 H new ATOM 0 HG2 LYS A 82 116.288 4.215 16.395 1.00 0.00 H new ATOM 0 HG3 LYS A 82 117.963 4.488 16.835 1.00 0.00 H new ATOM 0 HD2 LYS A 82 116.761 6.525 17.295 1.00 0.00 H new ATOM 0 HD3 LYS A 82 117.782 6.823 15.902 1.00 0.00 H new ATOM 0 HE2 LYS A 82 115.813 6.381 14.396 1.00 0.00 H new ATOM 0 HE3 LYS A 82 114.803 6.158 15.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 114.413 8.318 15.616 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 115.956 8.558 16.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 115.746 8.582 14.597 1.00 0.00 H new ATOM 1307 N ILE A 83 115.543 2.360 13.849 1.00 0.00 N ATOM 1308 CA ILE A 83 114.211 1.784 14.062 1.00 0.00 C ATOM 1309 C ILE A 83 114.269 0.289 13.856 1.00 0.00 C ATOM 1310 O ILE A 83 113.867 -0.522 14.707 1.00 0.00 O ATOM 1311 CB ILE A 83 113.180 2.381 13.071 1.00 0.00 C ATOM 1312 CG1 ILE A 83 113.115 3.901 13.214 1.00 0.00 C ATOM 1313 CG2 ILE A 83 111.793 1.759 13.275 1.00 0.00 C ATOM 1314 CD1 ILE A 83 112.203 4.554 12.205 1.00 0.00 C ATOM 0 H ILE A 83 115.638 2.894 12.985 1.00 0.00 H new ATOM 0 HA ILE A 83 113.900 2.018 15.080 1.00 0.00 H new ATOM 0 HB ILE A 83 113.509 2.143 12.059 1.00 0.00 H new ATOM 0 HG12 ILE A 83 112.773 4.151 14.218 1.00 0.00 H new ATOM 0 HG13 ILE A 83 114.119 4.313 13.107 1.00 0.00 H new ATOM 0 HG21 ILE A 83 111.090 2.197 12.566 1.00 0.00 H new ATOM 0 HG22 ILE A 83 111.849 0.683 13.112 1.00 0.00 H new ATOM 0 HG23 ILE A 83 111.452 1.955 14.292 1.00 0.00 H new ATOM 0 HD11 ILE A 83 112.201 5.633 12.361 1.00 0.00 H new ATOM 0 HD12 ILE A 83 112.557 4.333 11.198 1.00 0.00 H new ATOM 0 HD13 ILE A 83 111.191 4.169 12.326 1.00 0.00 H new ATOM 1326 N PHE A 84 114.839 -0.046 12.748 1.00 0.00 N ATOM 1327 CA PHE A 84 114.945 -1.382 12.266 1.00 0.00 C ATOM 1328 C PHE A 84 115.850 -2.269 13.153 1.00 0.00 C ATOM 1329 O PHE A 84 115.679 -3.487 13.211 1.00 0.00 O ATOM 1330 CB PHE A 84 115.382 -1.331 10.802 1.00 0.00 C ATOM 1331 CG PHE A 84 114.274 -0.921 9.818 1.00 0.00 C ATOM 1332 CD1 PHE A 84 113.683 0.330 9.875 1.00 0.00 C ATOM 1333 CD2 PHE A 84 113.825 -1.801 8.854 1.00 0.00 C ATOM 1334 CE1 PHE A 84 112.679 0.693 8.998 1.00 0.00 C ATOM 1335 CE2 PHE A 84 112.821 -1.448 7.970 1.00 0.00 C ATOM 1336 CZ PHE A 84 112.247 -0.200 8.044 1.00 0.00 C ATOM 0 H PHE A 84 115.265 0.638 12.123 1.00 0.00 H new ATOM 0 HA PHE A 84 113.971 -1.869 12.322 1.00 0.00 H new ATOM 0 HB2 PHE A 84 116.211 -0.630 10.708 1.00 0.00 H new ATOM 0 HB3 PHE A 84 115.760 -2.312 10.515 1.00 0.00 H new ATOM 0 HD1 PHE A 84 114.014 1.037 10.621 1.00 0.00 H new ATOM 0 HD2 PHE A 84 114.266 -2.785 8.789 1.00 0.00 H new ATOM 0 HE1 PHE A 84 112.234 1.675 9.061 1.00 0.00 H new ATOM 0 HE2 PHE A 84 112.488 -2.152 7.222 1.00 0.00 H new ATOM 0 HZ PHE A 84 111.461 0.078 7.357 1.00 0.00 H new ATOM 1346 N GLN A 85 116.804 -1.665 13.813 1.00 0.00 N ATOM 1347 CA GLN A 85 117.665 -2.367 14.755 1.00 0.00 C ATOM 1348 C GLN A 85 117.076 -2.438 16.172 1.00 0.00 C ATOM 1349 O GLN A 85 117.448 -3.310 16.949 1.00 0.00 O ATOM 1350 CB GLN A 85 119.052 -1.737 14.787 1.00 0.00 C ATOM 1351 CG GLN A 85 120.145 -2.552 14.121 1.00 0.00 C ATOM 1352 CD GLN A 85 119.838 -2.955 12.686 1.00 0.00 C ATOM 1353 OE1 GLN A 85 119.127 -2.275 11.962 1.00 0.00 O ATOM 1354 NE2 GLN A 85 120.392 -4.053 12.267 1.00 0.00 N ATOM 0 H GLN A 85 117.013 -0.671 13.719 1.00 0.00 H new ATOM 0 HA GLN A 85 117.743 -3.393 14.396 1.00 0.00 H new ATOM 0 HB2 GLN A 85 119.002 -0.761 14.304 1.00 0.00 H new ATOM 0 HB3 GLN A 85 119.331 -1.564 15.826 1.00 0.00 H new ATOM 0 HG2 GLN A 85 121.071 -1.977 14.135 1.00 0.00 H new ATOM 0 HG3 GLN A 85 120.321 -3.453 14.710 1.00 0.00 H new ATOM 0 HE21 GLN A 85 120.981 -4.599 12.896 1.00 0.00 H new ATOM 0 HE22 GLN A 85 120.238 -4.369 11.309 1.00 0.00 H new ATOM 1363 N SER A 86 116.175 -1.532 16.519 1.00 0.00 N ATOM 1364 CA SER A 86 115.646 -1.518 17.883 1.00 0.00 C ATOM 1365 C SER A 86 114.396 -2.383 18.073 1.00 0.00 C ATOM 1366 O SER A 86 114.048 -2.726 19.213 1.00 0.00 O ATOM 1367 CB SER A 86 115.423 -0.087 18.378 1.00 0.00 C ATOM 1368 OG SER A 86 114.668 0.662 17.447 1.00 0.00 O ATOM 0 H SER A 86 115.800 -0.814 15.899 1.00 0.00 H new ATOM 0 HA SER A 86 116.414 -1.980 18.504 1.00 0.00 H new ATOM 0 HB2 SER A 86 114.906 -0.107 19.337 1.00 0.00 H new ATOM 0 HB3 SER A 86 116.385 0.398 18.544 1.00 0.00 H new ATOM 0 HG SER A 86 115.271 1.206 16.899 1.00 0.00 H new ATOM 1374 N ILE A 87 113.720 -2.726 16.978 1.00 0.00 N ATOM 1375 CA ILE A 87 112.527 -3.552 17.025 1.00 0.00 C ATOM 1376 C ILE A 87 112.711 -4.889 17.748 1.00 0.00 C ATOM 1377 O ILE A 87 113.794 -5.471 17.753 1.00 0.00 O ATOM 1378 CB ILE A 87 111.916 -3.834 15.653 1.00 0.00 C ATOM 1379 CG1 ILE A 87 112.919 -3.764 14.530 1.00 0.00 C ATOM 1380 CG2 ILE A 87 110.648 -3.051 15.389 1.00 0.00 C ATOM 1381 CD1 ILE A 87 112.306 -4.036 13.208 1.00 0.00 C ATOM 0 H ILE A 87 113.988 -2.437 16.037 1.00 0.00 H new ATOM 0 HA ILE A 87 111.841 -2.934 17.604 1.00 0.00 H new ATOM 0 HB ILE A 87 111.599 -4.876 15.683 1.00 0.00 H new ATOM 0 HG12 ILE A 87 113.379 -2.776 14.518 1.00 0.00 H new ATOM 0 HG13 ILE A 87 113.716 -4.484 14.713 1.00 0.00 H new ATOM 0 HG21 ILE A 87 110.267 -3.299 14.398 1.00 0.00 H new ATOM 0 HG22 ILE A 87 109.900 -3.306 16.140 1.00 0.00 H new ATOM 0 HG23 ILE A 87 110.863 -1.983 15.439 1.00 0.00 H new ATOM 0 HD11 ILE A 87 113.070 -3.974 12.433 1.00 0.00 H new ATOM 0 HD12 ILE A 87 111.870 -5.035 13.208 1.00 0.00 H new ATOM 0 HD13 ILE A 87 111.527 -3.300 13.010 1.00 0.00 H new ATOM 1393 N PRO A 88 111.620 -5.392 18.331 1.00 0.00 N ATOM 1394 CA PRO A 88 111.586 -6.609 19.111 1.00 0.00 C ATOM 1395 C PRO A 88 110.987 -7.783 18.330 1.00 0.00 C ATOM 1396 O PRO A 88 110.359 -7.623 17.278 1.00 0.00 O ATOM 1397 CB PRO A 88 110.617 -6.202 20.234 1.00 0.00 C ATOM 1398 CG PRO A 88 109.748 -5.107 19.649 1.00 0.00 C ATOM 1399 CD PRO A 88 110.288 -4.815 18.276 1.00 0.00 C ATOM 0 HA PRO A 88 112.573 -6.946 19.427 1.00 0.00 H new ATOM 0 HB2 PRO A 88 110.013 -7.050 20.557 1.00 0.00 H new ATOM 0 HB3 PRO A 88 111.160 -5.845 21.109 1.00 0.00 H new ATOM 0 HG2 PRO A 88 108.707 -5.426 19.596 1.00 0.00 H new ATOM 0 HG3 PRO A 88 109.777 -4.215 20.274 1.00 0.00 H new ATOM 0 HD2 PRO A 88 109.680 -5.272 17.495 1.00 0.00 H new ATOM 0 HD3 PRO A 88 110.318 -3.745 18.071 1.00 0.00 H new ATOM 1407 N ILE A 89 111.235 -8.947 18.823 1.00 0.00 N ATOM 1408 CA ILE A 89 110.677 -10.168 18.293 1.00 0.00 C ATOM 1409 C ILE A 89 109.170 -10.202 18.540 1.00 0.00 C ATOM 1410 O ILE A 89 108.712 -9.914 19.651 1.00 0.00 O ATOM 1411 CB ILE A 89 111.315 -11.369 19.012 1.00 0.00 C ATOM 1412 CG1 ILE A 89 112.819 -11.304 18.876 1.00 0.00 C ATOM 1413 CG2 ILE A 89 110.766 -12.694 18.509 1.00 0.00 C ATOM 1414 CD1 ILE A 89 113.551 -12.366 19.621 1.00 0.00 C ATOM 0 H ILE A 89 111.846 -9.092 19.627 1.00 0.00 H new ATOM 0 HA ILE A 89 110.876 -10.214 17.222 1.00 0.00 H new ATOM 0 HB ILE A 89 111.054 -11.312 20.069 1.00 0.00 H new ATOM 0 HG12 ILE A 89 113.079 -11.373 17.820 1.00 0.00 H new ATOM 0 HG13 ILE A 89 113.161 -10.330 19.226 1.00 0.00 H new ATOM 0 HG21 ILE A 89 111.245 -13.513 19.045 1.00 0.00 H new ATOM 0 HG22 ILE A 89 109.690 -12.730 18.678 1.00 0.00 H new ATOM 0 HG23 ILE A 89 110.969 -12.790 17.442 1.00 0.00 H new ATOM 0 HD11 ILE A 89 114.623 -12.244 19.468 1.00 0.00 H new ATOM 0 HD12 ILE A 89 113.325 -12.286 20.684 1.00 0.00 H new ATOM 0 HD13 ILE A 89 113.241 -13.345 19.256 1.00 0.00 H new ATOM 1426 N GLY A 90 108.419 -10.519 17.516 1.00 0.00 N ATOM 1427 CA GLY A 90 107.009 -10.694 17.665 1.00 0.00 C ATOM 1428 C GLY A 90 106.200 -9.495 17.244 1.00 0.00 C ATOM 1429 O GLY A 90 104.998 -9.459 17.489 1.00 0.00 O ATOM 0 H GLY A 90 108.769 -10.660 16.568 1.00 0.00 H new ATOM 0 HA2 GLY A 90 106.695 -11.557 17.078 1.00 0.00 H new ATOM 0 HA3 GLY A 90 106.789 -10.921 18.708 1.00 0.00 H new ATOM 1433 N ALA A 91 106.811 -8.520 16.591 1.00 0.00 N ATOM 1434 CA ALA A 91 106.071 -7.308 16.274 1.00 0.00 C ATOM 1435 C ALA A 91 105.576 -7.305 14.819 1.00 0.00 C ATOM 1436 O ALA A 91 105.825 -8.234 14.073 1.00 0.00 O ATOM 1437 CB ALA A 91 106.914 -6.092 16.593 1.00 0.00 C ATOM 0 H ALA A 91 107.782 -8.538 16.279 1.00 0.00 H new ATOM 0 HA ALA A 91 105.177 -7.275 16.897 1.00 0.00 H new ATOM 0 HB1 ALA A 91 106.354 -5.188 16.353 1.00 0.00 H new ATOM 0 HB2 ALA A 91 107.166 -6.092 17.653 1.00 0.00 H new ATOM 0 HB3 ALA A 91 107.830 -6.119 16.002 1.00 0.00 H new ATOM 1443 N SER A 92 104.909 -6.246 14.425 1.00 0.00 N ATOM 1444 CA SER A 92 104.296 -6.124 13.112 1.00 0.00 C ATOM 1445 C SER A 92 104.520 -4.723 12.563 1.00 0.00 C ATOM 1446 O SER A 92 104.802 -3.798 13.328 1.00 0.00 O ATOM 1447 CB SER A 92 102.797 -6.427 13.272 1.00 0.00 C ATOM 1448 OG SER A 92 102.049 -6.104 12.120 1.00 0.00 O ATOM 0 H SER A 92 104.771 -5.426 15.016 1.00 0.00 H new ATOM 0 HA SER A 92 104.740 -6.824 12.405 1.00 0.00 H new ATOM 0 HB2 SER A 92 102.667 -7.485 13.500 1.00 0.00 H new ATOM 0 HB3 SER A 92 102.406 -5.868 14.122 1.00 0.00 H new ATOM 0 HG SER A 92 101.199 -6.591 12.135 1.00 0.00 H new ATOM 1454 N VAL A 93 104.520 -4.617 11.245 1.00 0.00 N ATOM 1455 CA VAL A 93 104.604 -3.355 10.522 1.00 0.00 C ATOM 1456 C VAL A 93 103.976 -3.482 9.189 1.00 0.00 C ATOM 1457 O VAL A 93 103.960 -4.550 8.610 1.00 0.00 O ATOM 1458 CB VAL A 93 106.033 -2.798 10.272 1.00 0.00 C ATOM 1459 CG1 VAL A 93 106.648 -2.147 11.471 1.00 0.00 C ATOM 1460 CG2 VAL A 93 106.964 -3.840 9.666 1.00 0.00 C ATOM 0 H VAL A 93 104.460 -5.428 10.629 1.00 0.00 H new ATOM 0 HA VAL A 93 104.091 -2.659 11.186 1.00 0.00 H new ATOM 0 HB VAL A 93 105.899 -2.005 9.536 1.00 0.00 H new ATOM 0 HG11 VAL A 93 107.644 -1.784 11.217 1.00 0.00 H new ATOM 0 HG12 VAL A 93 106.027 -1.310 11.789 1.00 0.00 H new ATOM 0 HG13 VAL A 93 106.722 -2.872 12.281 1.00 0.00 H new ATOM 0 HG21 VAL A 93 107.950 -3.401 9.511 1.00 0.00 H new ATOM 0 HG22 VAL A 93 107.048 -4.690 10.343 1.00 0.00 H new ATOM 0 HG23 VAL A 93 106.562 -4.175 8.710 1.00 0.00 H new ATOM 1470 N ASP A 94 103.479 -2.396 8.725 1.00 0.00 N ATOM 1471 CA ASP A 94 102.950 -2.272 7.411 1.00 0.00 C ATOM 1472 C ASP A 94 104.062 -1.718 6.579 1.00 0.00 C ATOM 1473 O ASP A 94 104.416 -0.569 6.728 1.00 0.00 O ATOM 1474 CB ASP A 94 101.814 -1.265 7.418 1.00 0.00 C ATOM 1475 CG ASP A 94 100.636 -1.671 8.257 1.00 0.00 C ATOM 1476 OD1 ASP A 94 99.753 -2.406 7.770 1.00 0.00 O ATOM 1477 OD2 ASP A 94 100.548 -1.235 9.420 1.00 0.00 O ATOM 0 H ASP A 94 103.426 -1.534 9.268 1.00 0.00 H new ATOM 0 HA ASP A 94 102.580 -3.226 7.036 1.00 0.00 H new ATOM 0 HB2 ASP A 94 102.193 -0.310 7.781 1.00 0.00 H new ATOM 0 HB3 ASP A 94 101.478 -1.106 6.393 1.00 0.00 H new ATOM 1482 N LEU A 95 104.619 -2.508 5.755 1.00 0.00 N ATOM 1483 CA LEU A 95 105.748 -2.118 4.987 1.00 0.00 C ATOM 1484 C LEU A 95 105.325 -1.935 3.538 1.00 0.00 C ATOM 1485 O LEU A 95 104.888 -2.876 2.880 1.00 0.00 O ATOM 1486 CB LEU A 95 106.782 -3.218 5.103 1.00 0.00 C ATOM 1487 CG LEU A 95 108.218 -2.835 4.845 1.00 0.00 C ATOM 1488 CD1 LEU A 95 108.693 -1.880 5.923 1.00 0.00 C ATOM 1489 CD2 LEU A 95 109.061 -4.070 4.846 1.00 0.00 C ATOM 0 H LEU A 95 104.306 -3.464 5.584 1.00 0.00 H new ATOM 0 HA LEU A 95 106.165 -1.177 5.345 1.00 0.00 H new ATOM 0 HB2 LEU A 95 106.718 -3.639 6.106 1.00 0.00 H new ATOM 0 HB3 LEU A 95 106.512 -4.012 4.407 1.00 0.00 H new ATOM 0 HG LEU A 95 108.300 -2.341 3.877 1.00 0.00 H new ATOM 0 HD11 LEU A 95 109.731 -1.605 5.734 1.00 0.00 H new ATOM 0 HD12 LEU A 95 108.073 -0.984 5.914 1.00 0.00 H new ATOM 0 HD13 LEU A 95 108.617 -2.364 6.897 1.00 0.00 H new ATOM 0 HD21 LEU A 95 110.101 -3.801 4.660 1.00 0.00 H new ATOM 0 HD22 LEU A 95 108.982 -4.564 5.814 1.00 0.00 H new ATOM 0 HD23 LEU A 95 108.716 -4.747 4.064 1.00 0.00 H new ATOM 1501 N GLU A 96 105.429 -0.745 3.048 1.00 0.00 N ATOM 1502 CA GLU A 96 105.042 -0.477 1.697 1.00 0.00 C ATOM 1503 C GLU A 96 106.250 -0.182 0.843 1.00 0.00 C ATOM 1504 O GLU A 96 107.092 0.677 1.181 1.00 0.00 O ATOM 1505 CB GLU A 96 103.961 0.604 1.622 1.00 0.00 C ATOM 1506 CG GLU A 96 104.303 1.908 2.311 1.00 0.00 C ATOM 1507 CD GLU A 96 103.151 2.871 2.303 1.00 0.00 C ATOM 1508 OE1 GLU A 96 102.254 2.746 3.163 1.00 0.00 O ATOM 1509 OE2 GLU A 96 103.108 3.760 1.444 1.00 0.00 O ATOM 0 H GLU A 96 105.780 0.063 3.563 1.00 0.00 H new ATOM 0 HA GLU A 96 104.583 -1.375 1.283 1.00 0.00 H new ATOM 0 HB2 GLU A 96 103.749 0.811 0.573 1.00 0.00 H new ATOM 0 HB3 GLU A 96 103.044 0.209 2.061 1.00 0.00 H new ATOM 0 HG2 GLU A 96 104.599 1.707 3.340 1.00 0.00 H new ATOM 0 HG3 GLU A 96 105.160 2.365 1.816 1.00 0.00 H new ATOM 1516 N LEU A 97 106.374 -0.926 -0.218 1.00 0.00 N ATOM 1517 CA LEU A 97 107.509 -0.825 -1.082 1.00 0.00 C ATOM 1518 C LEU A 97 107.094 -0.981 -2.529 1.00 0.00 C ATOM 1519 O LEU A 97 105.990 -1.463 -2.824 1.00 0.00 O ATOM 1520 CB LEU A 97 108.589 -1.865 -0.709 1.00 0.00 C ATOM 1521 CG LEU A 97 108.350 -3.360 -1.021 1.00 0.00 C ATOM 1522 CD1 LEU A 97 109.598 -4.111 -0.665 1.00 0.00 C ATOM 1523 CD2 LEU A 97 107.180 -3.932 -0.228 1.00 0.00 C ATOM 0 H LEU A 97 105.687 -1.622 -0.507 1.00 0.00 H new ATOM 0 HA LEU A 97 107.941 0.167 -0.953 1.00 0.00 H new ATOM 0 HB2 LEU A 97 109.512 -1.571 -1.210 1.00 0.00 H new ATOM 0 HB3 LEU A 97 108.767 -1.780 0.363 1.00 0.00 H new ATOM 0 HG LEU A 97 108.108 -3.461 -2.079 1.00 0.00 H new ATOM 0 HD11 LEU A 97 109.457 -5.171 -0.875 1.00 0.00 H new ATOM 0 HD12 LEU A 97 110.432 -3.731 -1.255 1.00 0.00 H new ATOM 0 HD13 LEU A 97 109.813 -3.977 0.395 1.00 0.00 H new ATOM 0 HD21 LEU A 97 107.050 -4.984 -0.480 1.00 0.00 H new ATOM 0 HD22 LEU A 97 107.382 -3.836 0.839 1.00 0.00 H new ATOM 0 HD23 LEU A 97 106.271 -3.385 -0.475 1.00 0.00 H new ATOM 1535 N CYS A 98 107.956 -0.578 -3.414 1.00 0.00 N ATOM 1536 CA CYS A 98 107.699 -0.672 -4.817 1.00 0.00 C ATOM 1537 C CYS A 98 108.583 -1.739 -5.456 1.00 0.00 C ATOM 1538 O CYS A 98 109.812 -1.715 -5.330 1.00 0.00 O ATOM 1539 CB CYS A 98 107.879 0.690 -5.499 1.00 0.00 C ATOM 1540 SG CYS A 98 106.762 1.979 -4.874 1.00 0.00 S ATOM 0 H CYS A 98 108.862 -0.173 -3.180 1.00 0.00 H new ATOM 0 HA CYS A 98 106.661 -0.973 -4.957 1.00 0.00 H new ATOM 0 HB2 CYS A 98 108.909 1.019 -5.365 1.00 0.00 H new ATOM 0 HB3 CYS A 98 107.719 0.573 -6.571 1.00 0.00 H new ATOM 0 HG CYS A 98 105.760 1.424 -4.259 1.00 0.00 H new ATOM 1546 N ARG A 99 107.949 -2.670 -6.113 1.00 0.00 N ATOM 1547 CA ARG A 99 108.607 -3.753 -6.807 1.00 0.00 C ATOM 1548 C ARG A 99 108.669 -3.369 -8.276 1.00 0.00 C ATOM 1549 O ARG A 99 107.786 -2.693 -8.759 1.00 0.00 O ATOM 1550 CB ARG A 99 107.794 -5.051 -6.614 1.00 0.00 C ATOM 1551 CG ARG A 99 108.263 -6.246 -7.418 1.00 0.00 C ATOM 1552 CD ARG A 99 109.410 -6.962 -6.762 1.00 0.00 C ATOM 1553 NE ARG A 99 108.965 -7.712 -5.592 1.00 0.00 N ATOM 1554 CZ ARG A 99 109.046 -9.028 -5.452 1.00 0.00 C ATOM 1555 NH1 ARG A 99 109.667 -9.773 -6.365 1.00 0.00 N ATOM 1556 NH2 ARG A 99 108.535 -9.600 -4.375 1.00 0.00 N ATOM 0 H ARG A 99 106.932 -2.701 -6.185 1.00 0.00 H new ATOM 0 HA ARG A 99 109.612 -3.925 -6.421 1.00 0.00 H new ATOM 0 HB2 ARG A 99 107.814 -5.317 -5.557 1.00 0.00 H new ATOM 0 HB3 ARG A 99 106.754 -4.848 -6.872 1.00 0.00 H new ATOM 0 HG2 ARG A 99 107.433 -6.940 -7.551 1.00 0.00 H new ATOM 0 HG3 ARG A 99 108.565 -5.916 -8.412 1.00 0.00 H new ATOM 0 HD2 ARG A 99 109.875 -7.641 -7.477 1.00 0.00 H new ATOM 0 HD3 ARG A 99 110.171 -6.240 -6.466 1.00 0.00 H new ATOM 0 HE ARG A 99 108.559 -7.182 -4.821 1.00 0.00 H new ATOM 0 HH11 ARG A 99 110.087 -9.332 -7.183 1.00 0.00 H new ATOM 0 HH12 ARG A 99 109.723 -10.784 -6.246 1.00 0.00 H new ATOM 0 HH21 ARG A 99 108.083 -9.030 -3.660 1.00 0.00 H new ATOM 0 HH22 ARG A 99 108.593 -10.612 -4.259 1.00 0.00 H new ATOM 1570 N GLY A 100 109.696 -3.780 -8.962 1.00 0.00 N ATOM 1571 CA GLY A 100 109.845 -3.432 -10.356 1.00 0.00 C ATOM 1572 C GLY A 100 111.271 -3.128 -10.641 1.00 0.00 C ATOM 1573 O GLY A 100 111.757 -3.300 -11.756 1.00 0.00 O ATOM 0 H GLY A 100 110.447 -4.358 -8.583 1.00 0.00 H new ATOM 0 HA2 GLY A 100 109.505 -4.254 -10.985 1.00 0.00 H new ATOM 0 HA3 GLY A 100 109.223 -2.569 -10.595 1.00 0.00 H new ATOM 1577 N TYR A 101 111.938 -2.657 -9.626 1.00 0.00 N ATOM 1578 CA TYR A 101 113.341 -2.394 -9.692 1.00 0.00 C ATOM 1579 C TYR A 101 114.101 -3.649 -9.359 1.00 0.00 C ATOM 1580 O TYR A 101 113.705 -4.392 -8.470 1.00 0.00 O ATOM 1581 CB TYR A 101 113.754 -1.310 -8.693 1.00 0.00 C ATOM 1582 CG TYR A 101 113.442 0.108 -9.094 1.00 0.00 C ATOM 1583 CD1 TYR A 101 114.364 0.845 -9.822 1.00 0.00 C ATOM 1584 CD2 TYR A 101 112.257 0.724 -8.720 1.00 0.00 C ATOM 1585 CE1 TYR A 101 114.122 2.153 -10.166 1.00 0.00 C ATOM 1586 CE2 TYR A 101 112.002 2.035 -9.069 1.00 0.00 C ATOM 1587 CZ TYR A 101 112.941 2.744 -9.790 1.00 0.00 C ATOM 1588 OH TYR A 101 112.703 4.055 -10.123 1.00 0.00 O ATOM 0 H TYR A 101 111.516 -2.444 -8.722 1.00 0.00 H new ATOM 0 HA TYR A 101 113.568 -2.053 -10.702 1.00 0.00 H new ATOM 0 HB2 TYR A 101 113.263 -1.514 -7.741 1.00 0.00 H new ATOM 0 HB3 TYR A 101 114.827 -1.391 -8.522 1.00 0.00 H new ATOM 0 HD1 TYR A 101 115.291 0.381 -10.125 1.00 0.00 H new ATOM 0 HD2 TYR A 101 111.525 0.172 -8.149 1.00 0.00 H new ATOM 0 HE1 TYR A 101 114.855 2.712 -10.728 1.00 0.00 H new ATOM 0 HE2 TYR A 101 111.073 2.503 -8.779 1.00 0.00 H new ATOM 0 HH TYR A 101 111.972 4.100 -10.774 1.00 0.00 H new ATOM 1598 N PRO A 102 115.122 -3.960 -10.127 1.00 0.00 N ATOM 1599 CA PRO A 102 116.074 -4.980 -9.776 1.00 0.00 C ATOM 1600 C PRO A 102 117.287 -4.276 -9.162 1.00 0.00 C ATOM 1601 O PRO A 102 117.187 -3.121 -8.752 1.00 0.00 O ATOM 1602 CB PRO A 102 116.426 -5.557 -11.147 1.00 0.00 C ATOM 1603 CG PRO A 102 116.348 -4.392 -12.086 1.00 0.00 C ATOM 1604 CD PRO A 102 115.419 -3.378 -11.454 1.00 0.00 C ATOM 0 HA PRO A 102 115.730 -5.735 -9.070 1.00 0.00 H new ATOM 0 HB2 PRO A 102 117.423 -5.998 -11.146 1.00 0.00 H new ATOM 0 HB3 PRO A 102 115.729 -6.344 -11.435 1.00 0.00 H new ATOM 0 HG2 PRO A 102 117.336 -3.961 -12.249 1.00 0.00 H new ATOM 0 HG3 PRO A 102 115.972 -4.706 -13.060 1.00 0.00 H new ATOM 0 HD2 PRO A 102 115.892 -2.400 -11.366 1.00 0.00 H new ATOM 0 HD3 PRO A 102 114.513 -3.242 -12.044 1.00 0.00 H new ATOM 1612 N LEU A 103 118.398 -4.942 -9.084 1.00 0.00 N ATOM 1613 CA LEU A 103 119.619 -4.302 -8.656 1.00 0.00 C ATOM 1614 C LEU A 103 120.367 -3.838 -9.912 1.00 0.00 C ATOM 1615 O LEU A 103 121.024 -4.637 -10.567 1.00 0.00 O ATOM 1616 CB LEU A 103 120.475 -5.274 -7.796 1.00 0.00 C ATOM 1617 CG LEU A 103 120.378 -5.165 -6.263 1.00 0.00 C ATOM 1618 CD1 LEU A 103 120.900 -3.829 -5.756 1.00 0.00 C ATOM 1619 CD2 LEU A 103 118.960 -5.373 -5.807 1.00 0.00 C ATOM 0 H LEU A 103 118.492 -5.932 -9.310 1.00 0.00 H new ATOM 0 HA LEU A 103 119.403 -3.441 -8.024 1.00 0.00 H new ATOM 0 HB2 LEU A 103 120.205 -6.292 -8.075 1.00 0.00 H new ATOM 0 HB3 LEU A 103 121.519 -5.134 -8.075 1.00 0.00 H new ATOM 0 HG LEU A 103 121.007 -5.949 -5.842 1.00 0.00 H new ATOM 0 HD11 LEU A 103 120.814 -3.793 -4.670 1.00 0.00 H new ATOM 0 HD12 LEU A 103 121.946 -3.715 -6.041 1.00 0.00 H new ATOM 0 HD13 LEU A 103 120.315 -3.020 -6.193 1.00 0.00 H new ATOM 0 HD21 LEU A 103 118.911 -5.292 -4.721 1.00 0.00 H new ATOM 0 HD22 LEU A 103 118.318 -4.615 -6.256 1.00 0.00 H new ATOM 0 HD23 LEU A 103 118.621 -6.363 -6.113 1.00 0.00 H new ATOM 1631 N PRO A 104 120.256 -2.525 -10.288 1.00 0.00 N ATOM 1632 CA PRO A 104 120.855 -1.982 -11.534 1.00 0.00 C ATOM 1633 C PRO A 104 122.366 -1.836 -11.424 1.00 0.00 C ATOM 1634 O PRO A 104 123.066 -1.531 -12.397 1.00 0.00 O ATOM 1635 CB PRO A 104 120.204 -0.593 -11.678 1.00 0.00 C ATOM 1636 CG PRO A 104 119.135 -0.532 -10.635 1.00 0.00 C ATOM 1637 CD PRO A 104 119.560 -1.466 -9.546 1.00 0.00 C ATOM 0 HA PRO A 104 120.681 -2.640 -12.385 1.00 0.00 H new ATOM 0 HB2 PRO A 104 120.938 0.199 -11.532 1.00 0.00 H new ATOM 0 HB3 PRO A 104 119.785 -0.459 -12.675 1.00 0.00 H new ATOM 0 HG2 PRO A 104 119.020 0.483 -10.254 1.00 0.00 H new ATOM 0 HG3 PRO A 104 118.171 -0.829 -11.048 1.00 0.00 H new ATOM 0 HD2 PRO A 104 120.216 -0.977 -8.825 1.00 0.00 H new ATOM 0 HD3 PRO A 104 118.707 -1.854 -8.989 1.00 0.00 H new ATOM 1645 N PHE A 105 122.830 -2.034 -10.243 1.00 0.00 N ATOM 1646 CA PHE A 105 124.199 -1.986 -9.880 1.00 0.00 C ATOM 1647 C PHE A 105 124.300 -2.921 -8.713 1.00 0.00 C ATOM 1648 O PHE A 105 123.382 -2.944 -7.871 1.00 0.00 O ATOM 1649 CB PHE A 105 124.560 -0.548 -9.476 1.00 0.00 C ATOM 1650 CG PHE A 105 125.996 -0.333 -9.098 1.00 0.00 C ATOM 1651 CD1 PHE A 105 126.982 -0.303 -10.061 1.00 0.00 C ATOM 1652 CD2 PHE A 105 126.354 -0.154 -7.776 1.00 0.00 C ATOM 1653 CE1 PHE A 105 128.297 -0.101 -9.709 1.00 0.00 C ATOM 1654 CE2 PHE A 105 127.662 0.048 -7.420 1.00 0.00 C ATOM 1655 CZ PHE A 105 128.634 0.073 -8.386 1.00 0.00 C ATOM 0 H PHE A 105 122.222 -2.248 -9.452 1.00 0.00 H new ATOM 0 HA PHE A 105 124.878 -2.271 -10.684 1.00 0.00 H new ATOM 0 HB2 PHE A 105 124.315 0.117 -10.304 1.00 0.00 H new ATOM 0 HB3 PHE A 105 123.932 -0.255 -8.635 1.00 0.00 H new ATOM 0 HD1 PHE A 105 126.720 -0.439 -11.100 1.00 0.00 H new ATOM 0 HD2 PHE A 105 125.592 -0.174 -7.011 1.00 0.00 H new ATOM 0 HE1 PHE A 105 129.063 -0.079 -10.470 1.00 0.00 H new ATOM 0 HE2 PHE A 105 127.926 0.187 -6.382 1.00 0.00 H new ATOM 0 HZ PHE A 105 129.666 0.229 -8.109 1.00 0.00 H new ATOM 1665 N ASP A 106 125.349 -3.695 -8.643 1.00 0.00 N ATOM 1666 CA ASP A 106 125.464 -4.695 -7.590 1.00 0.00 C ATOM 1667 C ASP A 106 125.905 -4.027 -6.339 1.00 0.00 C ATOM 1668 O ASP A 106 126.639 -3.056 -6.374 1.00 0.00 O ATOM 1669 CB ASP A 106 126.461 -5.809 -7.926 1.00 0.00 C ATOM 1670 CG ASP A 106 126.157 -6.545 -9.211 1.00 0.00 C ATOM 1671 OD1 ASP A 106 126.564 -6.081 -10.286 1.00 0.00 O ATOM 1672 OD2 ASP A 106 125.499 -7.609 -9.169 1.00 0.00 O ATOM 0 H ASP A 106 126.136 -3.662 -9.292 1.00 0.00 H new ATOM 0 HA ASP A 106 124.483 -5.157 -7.477 1.00 0.00 H new ATOM 0 HB2 ASP A 106 127.460 -5.379 -7.994 1.00 0.00 H new ATOM 0 HB3 ASP A 106 126.478 -6.526 -7.105 1.00 0.00 H new ATOM 1677 N PRO A 107 125.496 -4.538 -5.200 1.00 0.00 N ATOM 1678 CA PRO A 107 125.803 -3.965 -3.922 1.00 0.00 C ATOM 1679 C PRO A 107 127.007 -4.669 -3.362 1.00 0.00 C ATOM 1680 O PRO A 107 127.368 -4.526 -2.200 1.00 0.00 O ATOM 1681 CB PRO A 107 124.546 -4.316 -3.112 1.00 0.00 C ATOM 1682 CG PRO A 107 123.821 -5.372 -3.924 1.00 0.00 C ATOM 1683 CD PRO A 107 124.738 -5.764 -5.010 1.00 0.00 C ATOM 0 HA PRO A 107 126.028 -2.899 -3.930 1.00 0.00 H new ATOM 0 HB2 PRO A 107 124.809 -4.693 -2.124 1.00 0.00 H new ATOM 0 HB3 PRO A 107 123.918 -3.438 -2.961 1.00 0.00 H new ATOM 0 HG2 PRO A 107 123.564 -6.231 -3.304 1.00 0.00 H new ATOM 0 HG3 PRO A 107 122.887 -4.979 -4.327 1.00 0.00 H new ATOM 0 HD2 PRO A 107 125.376 -6.602 -4.727 1.00 0.00 H new ATOM 0 HD3 PRO A 107 124.203 -6.061 -5.912 1.00 0.00 H new ATOM 1691 N ASP A 108 127.601 -5.449 -4.228 1.00 0.00 N ATOM 1692 CA ASP A 108 128.719 -6.240 -3.925 1.00 0.00 C ATOM 1693 C ASP A 108 129.952 -5.376 -3.993 1.00 0.00 C ATOM 1694 O ASP A 108 130.906 -5.550 -3.235 1.00 0.00 O ATOM 1695 CB ASP A 108 128.816 -7.396 -4.914 1.00 0.00 C ATOM 1696 CG ASP A 108 130.044 -8.250 -4.711 1.00 0.00 C ATOM 1697 OD1 ASP A 108 130.023 -9.136 -3.827 1.00 0.00 O ATOM 1698 OD2 ASP A 108 131.046 -8.072 -5.445 1.00 0.00 O ATOM 0 H ASP A 108 127.291 -5.539 -5.196 1.00 0.00 H new ATOM 0 HA ASP A 108 128.626 -6.657 -2.922 1.00 0.00 H new ATOM 0 HB2 ASP A 108 127.928 -8.021 -4.821 1.00 0.00 H new ATOM 0 HB3 ASP A 108 128.822 -6.998 -5.929 1.00 0.00 H new ATOM 1703 N ASP A 109 129.885 -4.413 -4.895 1.00 0.00 N ATOM 1704 CA ASP A 109 130.952 -3.466 -5.137 1.00 0.00 C ATOM 1705 C ASP A 109 131.044 -2.500 -3.952 1.00 0.00 C ATOM 1706 O ASP A 109 130.036 -1.904 -3.549 1.00 0.00 O ATOM 1707 CB ASP A 109 130.677 -2.707 -6.445 1.00 0.00 C ATOM 1708 CG ASP A 109 131.819 -1.795 -6.841 1.00 0.00 C ATOM 1709 OD1 ASP A 109 132.937 -2.308 -7.102 1.00 0.00 O ATOM 1710 OD2 ASP A 109 131.623 -0.571 -6.954 1.00 0.00 O ATOM 0 H ASP A 109 129.070 -4.267 -5.490 1.00 0.00 H new ATOM 0 HA ASP A 109 131.903 -3.988 -5.237 1.00 0.00 H new ATOM 0 HB2 ASP A 109 130.496 -3.424 -7.245 1.00 0.00 H new ATOM 0 HB3 ASP A 109 129.767 -2.117 -6.334 1.00 0.00 H new ATOM 1715 N PRO A 110 132.227 -2.445 -3.304 1.00 0.00 N ATOM 1716 CA PRO A 110 132.508 -1.569 -2.137 1.00 0.00 C ATOM 1717 C PRO A 110 132.328 -0.062 -2.366 1.00 0.00 C ATOM 1718 O PRO A 110 131.717 0.386 -3.334 1.00 0.00 O ATOM 1719 CB PRO A 110 133.988 -1.837 -1.860 1.00 0.00 C ATOM 1720 CG PRO A 110 134.215 -3.205 -2.353 1.00 0.00 C ATOM 1721 CD PRO A 110 133.397 -3.305 -3.602 1.00 0.00 C ATOM 0 HA PRO A 110 131.805 -1.800 -1.336 1.00 0.00 H new ATOM 0 HB2 PRO A 110 134.625 -1.119 -2.376 1.00 0.00 H new ATOM 0 HB3 PRO A 110 134.214 -1.756 -0.797 1.00 0.00 H new ATOM 0 HG2 PRO A 110 135.271 -3.381 -2.557 1.00 0.00 H new ATOM 0 HG3 PRO A 110 133.905 -3.947 -1.617 1.00 0.00 H new ATOM 0 HD2 PRO A 110 133.947 -2.951 -4.474 1.00 0.00 H new ATOM 0 HD3 PRO A 110 133.100 -4.333 -3.809 1.00 0.00 H new ATOM 1729 N ASN A 111 132.891 0.688 -1.416 1.00 0.00 N ATOM 1730 CA ASN A 111 132.928 2.132 -1.346 1.00 0.00 C ATOM 1731 C ASN A 111 131.691 2.734 -0.723 1.00 0.00 C ATOM 1732 O ASN A 111 131.511 3.956 -0.770 1.00 0.00 O ATOM 1733 CB ASN A 111 133.294 2.829 -2.649 1.00 0.00 C ATOM 1734 CG ASN A 111 134.663 2.465 -3.211 1.00 0.00 C ATOM 1735 OD1 ASN A 111 135.592 2.068 -2.364 1.00 0.00 O flip ATOM 1736 ND2 ASN A 111 134.870 2.519 -4.424 1.00 0.00 N flip ATOM 0 H ASN A 111 133.366 0.260 -0.621 1.00 0.00 H new ATOM 0 HA ASN A 111 133.760 2.327 -0.669 1.00 0.00 H new ATOM 0 HB2 ASN A 111 132.536 2.592 -3.396 1.00 0.00 H new ATOM 0 HB3 ASN A 111 133.258 3.907 -2.490 1.00 0.00 H new ATOM 0 HD21 ASN A 111 134.131 2.830 -5.054 1.00 0.00 H new ATOM 0 HD22 ASN A 111 135.781 2.252 -4.798 1.00 0.00 H new ATOM 1743 N THR A 112 130.881 1.871 -0.089 1.00 0.00 N ATOM 1744 CA THR A 112 129.633 2.233 0.616 1.00 0.00 C ATOM 1745 C THR A 112 128.792 3.257 -0.199 1.00 0.00 C ATOM 1746 O THR A 112 128.674 3.109 -1.425 1.00 0.00 O ATOM 1747 CB THR A 112 129.926 2.676 2.126 1.00 0.00 C ATOM 1748 OG1 THR A 112 128.713 2.824 2.874 1.00 0.00 O ATOM 1749 CG2 THR A 112 130.741 3.969 2.245 1.00 0.00 C ATOM 0 H THR A 112 131.079 0.871 -0.050 1.00 0.00 H new ATOM 0 HA THR A 112 129.006 1.344 0.690 1.00 0.00 H new ATOM 0 HB THR A 112 130.527 1.867 2.541 1.00 0.00 H new ATOM 0 HG1 THR A 112 128.926 3.093 3.792 1.00 0.00 H new ATOM 0 HG21 THR A 112 130.899 4.204 3.298 1.00 0.00 H new ATOM 0 HG22 THR A 112 131.705 3.838 1.754 1.00 0.00 H new ATOM 0 HG23 THR A 112 130.199 4.786 1.768 1.00 0.00 H new ATOM 1757 N SER A 113 128.153 4.196 0.469 1.00 0.00 N ATOM 1758 CA SER A 113 127.452 5.275 -0.175 1.00 0.00 C ATOM 1759 C SER A 113 128.449 6.095 -1.010 1.00 0.00 C ATOM 1760 O SER A 113 129.236 6.894 -0.475 1.00 0.00 O ATOM 1761 CB SER A 113 126.864 6.163 0.903 1.00 0.00 C ATOM 1762 OG SER A 113 126.207 5.418 1.928 1.00 0.00 O ATOM 0 H SER A 113 128.109 4.227 1.488 1.00 0.00 H new ATOM 0 HA SER A 113 126.666 4.887 -0.822 1.00 0.00 H new ATOM 0 HB2 SER A 113 127.658 6.764 1.347 1.00 0.00 H new ATOM 0 HB3 SER A 113 126.155 6.856 0.451 1.00 0.00 H new ATOM 0 HG SER A 113 125.581 6.001 2.406 1.00 0.00 H new ATOM 1768 N LEU A 114 128.440 5.877 -2.293 1.00 0.00 N ATOM 1769 CA LEU A 114 129.315 6.536 -3.152 1.00 0.00 C ATOM 1770 C LEU A 114 128.679 7.740 -3.833 1.00 0.00 C ATOM 1771 O LEU A 114 127.503 7.719 -4.229 1.00 0.00 O ATOM 1772 CB LEU A 114 129.968 5.545 -4.157 1.00 0.00 C ATOM 1773 CG LEU A 114 129.082 4.677 -5.134 1.00 0.00 C ATOM 1774 CD1 LEU A 114 128.090 3.742 -4.461 1.00 0.00 C ATOM 1775 CD2 LEU A 114 128.412 5.492 -6.204 1.00 0.00 C ATOM 0 H LEU A 114 127.808 5.224 -2.755 1.00 0.00 H new ATOM 0 HA LEU A 114 130.119 6.946 -2.541 1.00 0.00 H new ATOM 0 HB2 LEU A 114 130.653 6.124 -4.776 1.00 0.00 H new ATOM 0 HB3 LEU A 114 130.574 4.851 -3.574 1.00 0.00 H new ATOM 0 HG LEU A 114 129.815 4.026 -5.611 1.00 0.00 H new ATOM 0 HD11 LEU A 114 127.533 3.194 -5.221 1.00 0.00 H new ATOM 0 HD12 LEU A 114 128.627 3.038 -3.826 1.00 0.00 H new ATOM 0 HD13 LEU A 114 127.397 4.323 -3.853 1.00 0.00 H new ATOM 0 HD21 LEU A 114 127.818 4.837 -6.842 1.00 0.00 H new ATOM 0 HD22 LEU A 114 127.762 6.235 -5.742 1.00 0.00 H new ATOM 0 HD23 LEU A 114 129.169 5.996 -6.805 1.00 0.00 H new ATOM 1787 N VAL A 115 129.417 8.793 -3.884 1.00 0.00 N ATOM 1788 CA VAL A 115 129.050 9.944 -4.646 1.00 0.00 C ATOM 1789 C VAL A 115 130.114 10.112 -5.702 1.00 0.00 C ATOM 1790 O VAL A 115 131.311 9.961 -5.419 1.00 0.00 O ATOM 1791 CB VAL A 115 128.900 11.277 -3.803 1.00 0.00 C ATOM 1792 CG1 VAL A 115 128.043 11.077 -2.575 1.00 0.00 C ATOM 1793 CG2 VAL A 115 130.239 11.939 -3.445 1.00 0.00 C ATOM 0 H VAL A 115 130.306 8.885 -3.392 1.00 0.00 H new ATOM 0 HA VAL A 115 128.058 9.776 -5.064 1.00 0.00 H new ATOM 0 HB VAL A 115 128.387 11.975 -4.464 1.00 0.00 H new ATOM 0 HG11 VAL A 115 127.967 12.016 -2.027 1.00 0.00 H new ATOM 0 HG12 VAL A 115 127.047 10.751 -2.875 1.00 0.00 H new ATOM 0 HG13 VAL A 115 128.495 10.319 -1.935 1.00 0.00 H new ATOM 0 HG21 VAL A 115 130.054 12.845 -2.868 1.00 0.00 H new ATOM 0 HG22 VAL A 115 130.840 11.248 -2.853 1.00 0.00 H new ATOM 0 HG23 VAL A 115 130.775 12.194 -4.359 1.00 0.00 H new ATOM 1803 N THR A 116 129.719 10.301 -6.902 1.00 0.00 N ATOM 1804 CA THR A 116 130.668 10.551 -7.914 1.00 0.00 C ATOM 1805 C THR A 116 130.768 12.064 -8.034 1.00 0.00 C ATOM 1806 O THR A 116 129.754 12.777 -7.892 1.00 0.00 O ATOM 1807 CB THR A 116 130.276 9.876 -9.265 1.00 0.00 C ATOM 1808 OG1 THR A 116 131.347 9.979 -10.205 1.00 0.00 O ATOM 1809 CG2 THR A 116 129.044 10.519 -9.859 1.00 0.00 C ATOM 0 H THR A 116 128.746 10.287 -7.208 1.00 0.00 H new ATOM 0 HA THR A 116 131.635 10.118 -7.659 1.00 0.00 H new ATOM 0 HB THR A 116 130.067 8.827 -9.056 1.00 0.00 H new ATOM 0 HG1 THR A 116 131.086 9.550 -11.046 1.00 0.00 H new ATOM 0 HG21 THR A 116 128.795 10.028 -10.800 1.00 0.00 H new ATOM 0 HG22 THR A 116 128.210 10.418 -9.165 1.00 0.00 H new ATOM 0 HG23 THR A 116 129.237 11.576 -10.042 1.00 0.00 H new ATOM 1817 N SER A 117 131.934 12.560 -8.230 1.00 0.00 N ATOM 1818 CA SER A 117 132.096 13.971 -8.291 1.00 0.00 C ATOM 1819 C SER A 117 132.304 14.373 -9.725 1.00 0.00 C ATOM 1820 O SER A 117 133.430 14.435 -10.242 1.00 0.00 O ATOM 1821 CB SER A 117 133.243 14.422 -7.396 1.00 0.00 C ATOM 1822 OG SER A 117 133.029 13.988 -6.051 1.00 0.00 O ATOM 0 H SER A 117 132.788 12.016 -8.351 1.00 0.00 H new ATOM 0 HA SER A 117 131.199 14.466 -7.918 1.00 0.00 H new ATOM 0 HB2 SER A 117 134.184 14.018 -7.769 1.00 0.00 H new ATOM 0 HB3 SER A 117 133.329 15.508 -7.425 1.00 0.00 H new ATOM 0 HG SER A 117 133.775 14.284 -5.489 1.00 0.00 H new ATOM 1828 N VAL A 118 131.219 14.631 -10.356 1.00 0.00 N ATOM 1829 CA VAL A 118 131.201 14.974 -11.728 1.00 0.00 C ATOM 1830 C VAL A 118 131.166 16.500 -11.863 1.00 0.00 C ATOM 1831 O VAL A 118 130.395 17.189 -11.164 1.00 0.00 O ATOM 1832 CB VAL A 118 130.003 14.277 -12.427 1.00 0.00 C ATOM 1833 CG1 VAL A 118 128.681 14.663 -11.787 1.00 0.00 C ATOM 1834 CG2 VAL A 118 130.005 14.514 -13.929 1.00 0.00 C ATOM 0 H VAL A 118 130.296 14.609 -9.922 1.00 0.00 H new ATOM 0 HA VAL A 118 132.104 14.622 -12.227 1.00 0.00 H new ATOM 0 HB VAL A 118 130.125 13.204 -12.282 1.00 0.00 H new ATOM 0 HG11 VAL A 118 127.865 14.156 -12.303 1.00 0.00 H new ATOM 0 HG12 VAL A 118 128.685 14.369 -10.737 1.00 0.00 H new ATOM 0 HG13 VAL A 118 128.542 15.742 -11.861 1.00 0.00 H new ATOM 0 HG21 VAL A 118 129.150 14.009 -14.378 1.00 0.00 H new ATOM 0 HG22 VAL A 118 129.940 15.584 -14.129 1.00 0.00 H new ATOM 0 HG23 VAL A 118 130.926 14.120 -14.358 1.00 0.00 H new ATOM 1844 N ALA A 119 132.012 17.026 -12.713 1.00 0.00 N ATOM 1845 CA ALA A 119 132.156 18.456 -12.863 1.00 0.00 C ATOM 1846 C ALA A 119 131.058 19.071 -13.707 1.00 0.00 C ATOM 1847 O ALA A 119 131.263 19.440 -14.857 1.00 0.00 O ATOM 1848 CB ALA A 119 133.538 18.811 -13.383 1.00 0.00 C ATOM 0 H ALA A 119 132.620 16.477 -13.321 1.00 0.00 H new ATOM 0 HA ALA A 119 132.049 18.893 -11.870 1.00 0.00 H new ATOM 0 HB1 ALA A 119 133.621 19.893 -13.487 1.00 0.00 H new ATOM 0 HB2 ALA A 119 134.293 18.455 -12.682 1.00 0.00 H new ATOM 0 HB3 ALA A 119 133.694 18.340 -14.354 1.00 0.00 H new ATOM 1854 N ILE A 120 129.901 19.163 -13.106 1.00 0.00 N ATOM 1855 CA ILE A 120 128.721 19.793 -13.684 1.00 0.00 C ATOM 1856 C ILE A 120 128.168 20.725 -12.582 1.00 0.00 C ATOM 1857 O ILE A 120 127.068 21.254 -12.654 1.00 0.00 O ATOM 1858 CB ILE A 120 127.642 18.695 -14.033 1.00 0.00 C ATOM 1859 CG1 ILE A 120 128.226 17.565 -14.905 1.00 0.00 C ATOM 1860 CG2 ILE A 120 126.408 19.289 -14.733 1.00 0.00 C ATOM 1861 CD1 ILE A 120 128.683 17.980 -16.290 1.00 0.00 C ATOM 0 H ILE A 120 129.738 18.792 -12.170 1.00 0.00 H new ATOM 0 HA ILE A 120 128.960 20.334 -14.600 1.00 0.00 H new ATOM 0 HB ILE A 120 127.331 18.277 -13.076 1.00 0.00 H new ATOM 0 HG12 ILE A 120 129.073 17.124 -14.379 1.00 0.00 H new ATOM 0 HG13 ILE A 120 127.473 16.784 -15.009 1.00 0.00 H new ATOM 0 HG21 ILE A 120 125.696 18.493 -14.952 1.00 0.00 H new ATOM 0 HG22 ILE A 120 125.940 20.026 -14.081 1.00 0.00 H new ATOM 0 HG23 ILE A 120 126.713 19.769 -15.663 1.00 0.00 H new ATOM 0 HD11 ILE A 120 129.076 17.112 -16.819 1.00 0.00 H new ATOM 0 HD12 ILE A 120 127.839 18.391 -16.844 1.00 0.00 H new ATOM 0 HD13 ILE A 120 129.463 18.736 -16.204 1.00 0.00 H new ATOM 1873 N LEU A 121 128.998 20.946 -11.580 1.00 0.00 N ATOM 1874 CA LEU A 121 128.565 21.664 -10.375 1.00 0.00 C ATOM 1875 C LEU A 121 128.612 23.175 -10.543 1.00 0.00 C ATOM 1876 O LEU A 121 127.587 23.851 -10.647 1.00 0.00 O ATOM 1877 CB LEU A 121 129.289 21.157 -9.064 1.00 0.00 C ATOM 1878 CG LEU A 121 130.838 21.336 -8.893 1.00 0.00 C ATOM 1879 CD1 LEU A 121 131.272 20.831 -7.534 1.00 0.00 C ATOM 1880 CD2 LEU A 121 131.638 20.618 -9.972 1.00 0.00 C ATOM 0 H LEU A 121 129.972 20.644 -11.567 1.00 0.00 H new ATOM 0 HA LEU A 121 127.512 21.417 -10.238 1.00 0.00 H new ATOM 0 HB2 LEU A 121 128.812 21.654 -8.220 1.00 0.00 H new ATOM 0 HB3 LEU A 121 129.075 20.092 -8.969 1.00 0.00 H new ATOM 0 HG LEU A 121 131.042 22.403 -8.986 1.00 0.00 H new ATOM 0 HD11 LEU A 121 132.349 20.960 -7.425 1.00 0.00 H new ATOM 0 HD12 LEU A 121 130.759 21.395 -6.755 1.00 0.00 H new ATOM 0 HD13 LEU A 121 131.022 19.774 -7.442 1.00 0.00 H new ATOM 0 HD21 LEU A 121 132.703 20.777 -9.802 1.00 0.00 H new ATOM 0 HD22 LEU A 121 131.421 19.550 -9.936 1.00 0.00 H new ATOM 0 HD23 LEU A 121 131.364 21.012 -10.951 1.00 0.00 H new ATOM 1892 N ASP A 122 129.774 23.656 -10.586 1.00 0.00 N ATOM 1893 CA ASP A 122 130.100 25.052 -10.778 1.00 0.00 C ATOM 1894 C ASP A 122 131.511 25.071 -11.245 1.00 0.00 C ATOM 1895 O ASP A 122 132.407 24.619 -10.536 1.00 0.00 O ATOM 1896 CB ASP A 122 129.947 25.860 -9.485 1.00 0.00 C ATOM 1897 CG ASP A 122 130.347 27.305 -9.664 1.00 0.00 C ATOM 1898 OD1 ASP A 122 129.651 28.043 -10.381 1.00 0.00 O ATOM 1899 OD2 ASP A 122 131.350 27.734 -9.073 1.00 0.00 O ATOM 0 H ASP A 122 130.604 23.071 -10.484 1.00 0.00 H new ATOM 0 HA ASP A 122 129.423 25.513 -11.497 1.00 0.00 H new ATOM 0 HB2 ASP A 122 128.912 25.811 -9.148 1.00 0.00 H new ATOM 0 HB3 ASP A 122 130.558 25.410 -8.703 1.00 0.00 H new ATOM 1904 N LYS A 123 131.718 25.521 -12.435 1.00 0.00 N ATOM 1905 CA LYS A 123 132.984 25.381 -13.056 1.00 0.00 C ATOM 1906 C LYS A 123 133.528 26.724 -13.420 1.00 0.00 C ATOM 1907 O LYS A 123 132.784 27.619 -13.834 1.00 0.00 O ATOM 1908 CB LYS A 123 132.827 24.564 -14.323 1.00 0.00 C ATOM 1909 CG LYS A 123 131.965 23.314 -14.177 1.00 0.00 C ATOM 1910 CD LYS A 123 131.945 22.516 -15.458 1.00 0.00 C ATOM 1911 CE LYS A 123 133.262 21.824 -15.670 1.00 0.00 C ATOM 1912 NZ LYS A 123 133.340 21.148 -16.972 1.00 0.00 N ATOM 0 H LYS A 123 131.014 25.995 -13.001 1.00 0.00 H new ATOM 0 HA LYS A 123 133.666 24.886 -12.365 1.00 0.00 H new ATOM 0 HB2 LYS A 123 132.394 25.199 -15.096 1.00 0.00 H new ATOM 0 HB3 LYS A 123 133.816 24.267 -14.672 1.00 0.00 H new ATOM 0 HG2 LYS A 123 132.349 22.696 -13.366 1.00 0.00 H new ATOM 0 HG3 LYS A 123 130.948 23.599 -13.906 1.00 0.00 H new ATOM 0 HD2 LYS A 123 131.143 21.779 -15.421 1.00 0.00 H new ATOM 0 HD3 LYS A 123 131.734 23.175 -16.300 1.00 0.00 H new ATOM 0 HE2 LYS A 123 134.068 22.554 -15.594 1.00 0.00 H new ATOM 0 HE3 LYS A 123 133.417 21.094 -14.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 134.267 20.687 -17.069 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 132.589 20.432 -17.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 133.220 21.846 -17.733 1.00 0.00 H new ATOM 1926 N GLU A 124 134.801 26.853 -13.289 1.00 0.00 N ATOM 1927 CA GLU A 124 135.486 28.066 -13.630 1.00 0.00 C ATOM 1928 C GLU A 124 135.714 28.075 -15.126 1.00 0.00 C ATOM 1929 O GLU A 124 136.117 27.048 -15.688 1.00 0.00 O ATOM 1930 CB GLU A 124 136.833 28.130 -12.925 1.00 0.00 C ATOM 1931 CG GLU A 124 136.761 27.964 -11.424 1.00 0.00 C ATOM 1932 CD GLU A 124 138.113 28.060 -10.792 1.00 0.00 C ATOM 1933 OE1 GLU A 124 138.858 27.070 -10.811 1.00 0.00 O ATOM 1934 OE2 GLU A 124 138.468 29.125 -10.286 1.00 0.00 O ATOM 0 H GLU A 124 135.411 26.114 -12.938 1.00 0.00 H new ATOM 0 HA GLU A 124 134.887 28.923 -13.321 1.00 0.00 H new ATOM 0 HB2 GLU A 124 137.480 27.354 -13.333 1.00 0.00 H new ATOM 0 HB3 GLU A 124 137.302 29.088 -13.150 1.00 0.00 H new ATOM 0 HG2 GLU A 124 136.108 28.729 -11.004 1.00 0.00 H new ATOM 0 HG3 GLU A 124 136.315 26.998 -11.186 1.00 0.00 H new ATOM 1941 N PRO A 125 135.422 29.187 -15.800 1.00 0.00 N ATOM 1942 CA PRO A 125 135.663 29.311 -17.218 1.00 0.00 C ATOM 1943 C PRO A 125 137.143 29.605 -17.506 1.00 0.00 C ATOM 1944 O PRO A 125 137.614 30.691 -17.162 1.00 0.00 O ATOM 1945 CB PRO A 125 134.768 30.483 -17.642 1.00 0.00 C ATOM 1946 CG PRO A 125 134.578 31.308 -16.410 1.00 0.00 C ATOM 1947 CD PRO A 125 134.801 30.402 -15.224 1.00 0.00 C ATOM 1948 OXT PRO A 125 137.828 28.739 -18.055 1.00 0.00 O ATOM 0 HA PRO A 125 135.438 28.395 -17.764 1.00 0.00 H new ATOM 0 HB2 PRO A 125 135.235 31.066 -18.436 1.00 0.00 H new ATOM 0 HB3 PRO A 125 133.812 30.127 -18.027 1.00 0.00 H new ATOM 0 HG2 PRO A 125 135.280 32.142 -16.394 1.00 0.00 H new ATOM 0 HG3 PRO A 125 133.575 31.735 -16.384 1.00 0.00 H new ATOM 0 HD2 PRO A 125 135.452 30.868 -14.485 1.00 0.00 H new ATOM 0 HD3 PRO A 125 133.863 30.168 -14.721 1.00 0.00 H new TER 1956 PRO A 125 ATOM 1957 N ARG B 151 124.136 9.511 -12.286 1.00 0.00 N ATOM 1958 CA ARG B 151 124.849 10.227 -11.214 1.00 0.00 C ATOM 1959 C ARG B 151 123.875 10.527 -10.068 1.00 0.00 C ATOM 1960 O ARG B 151 122.743 10.068 -10.099 1.00 0.00 O ATOM 1961 CB ARG B 151 125.463 11.526 -11.758 1.00 0.00 C ATOM 1962 CG ARG B 151 124.451 12.557 -12.246 1.00 0.00 C ATOM 1963 CD ARG B 151 125.161 13.756 -12.833 1.00 0.00 C ATOM 1964 NE ARG B 151 124.242 14.824 -13.215 1.00 0.00 N ATOM 1965 CZ ARG B 151 124.458 15.705 -14.192 1.00 0.00 C ATOM 1966 NH1 ARG B 151 125.457 15.523 -15.040 1.00 0.00 N ATOM 1967 NH2 ARG B 151 123.642 16.737 -14.347 1.00 0.00 N ATOM 0 HA ARG B 151 125.659 9.602 -10.837 1.00 0.00 H new ATOM 0 HB2 ARG B 151 126.073 11.978 -10.976 1.00 0.00 H new ATOM 0 HB3 ARG B 151 126.133 11.278 -12.581 1.00 0.00 H new ATOM 0 HG2 ARG B 151 123.799 12.109 -12.996 1.00 0.00 H new ATOM 0 HG3 ARG B 151 123.815 12.872 -11.418 1.00 0.00 H new ATOM 0 HD2 ARG B 151 125.877 14.141 -12.107 1.00 0.00 H new ATOM 0 HD3 ARG B 151 125.731 13.443 -13.708 1.00 0.00 H new ATOM 0 HE ARG B 151 123.368 14.902 -12.695 1.00 0.00 H new ATOM 0 HH11 ARG B 151 126.063 14.708 -14.947 1.00 0.00 H new ATOM 0 HH12 ARG B 151 125.621 16.198 -15.787 1.00 0.00 H new ATOM 0 HH21 ARG B 151 122.848 16.858 -13.719 1.00 0.00 H new ATOM 0 HH22 ARG B 151 123.808 17.411 -15.095 1.00 0.00 H new ATOM 1983 N SER B 152 124.318 11.310 -9.081 1.00 0.00 N ATOM 1984 CA SER B 152 123.539 11.723 -7.898 1.00 0.00 C ATOM 1985 C SER B 152 123.119 10.574 -6.960 1.00 0.00 C ATOM 1986 O SER B 152 123.933 10.115 -6.151 1.00 0.00 O ATOM 1987 CB SER B 152 122.375 12.709 -8.225 1.00 0.00 C ATOM 1988 OG SER B 152 121.478 12.189 -9.206 1.00 0.00 O ATOM 0 H SER B 152 125.264 11.691 -9.078 1.00 0.00 H new ATOM 0 HA SER B 152 124.255 12.297 -7.310 1.00 0.00 H new ATOM 0 HB2 SER B 152 121.822 12.929 -7.312 1.00 0.00 H new ATOM 0 HB3 SER B 152 122.791 13.652 -8.581 1.00 0.00 H new ATOM 0 HG SER B 152 121.748 11.278 -9.446 1.00 0.00 H new ATOM 1994 N SER B 153 121.891 10.079 -7.108 1.00 0.00 N ATOM 1995 CA SER B 153 121.327 9.062 -6.224 1.00 0.00 C ATOM 1996 C SER B 153 121.944 7.659 -6.438 1.00 0.00 C ATOM 1997 O SER B 153 121.331 6.750 -7.010 1.00 0.00 O ATOM 1998 CB SER B 153 119.808 9.042 -6.384 1.00 0.00 C ATOM 1999 OG SER B 153 119.283 10.365 -6.245 1.00 0.00 O ATOM 0 H SER B 153 121.256 10.375 -7.850 1.00 0.00 H new ATOM 0 HA SER B 153 121.580 9.332 -5.199 1.00 0.00 H new ATOM 0 HB2 SER B 153 119.542 8.638 -7.361 1.00 0.00 H new ATOM 0 HB3 SER B 153 119.364 8.385 -5.636 1.00 0.00 H new ATOM 0 HG SER B 153 119.591 10.752 -5.399 1.00 0.00 H new ATOM 2005 N ARG B 154 123.185 7.545 -6.036 1.00 0.00 N ATOM 2006 CA ARG B 154 123.915 6.295 -6.002 1.00 0.00 C ATOM 2007 C ARG B 154 124.581 6.169 -4.651 1.00 0.00 C ATOM 2008 O ARG B 154 125.280 5.202 -4.363 1.00 0.00 O ATOM 2009 CB ARG B 154 124.970 6.232 -7.116 1.00 0.00 C ATOM 2010 CG ARG B 154 124.404 6.069 -8.516 1.00 0.00 C ATOM 2011 CD ARG B 154 125.498 6.092 -9.576 1.00 0.00 C ATOM 2012 NE ARG B 154 126.567 5.092 -9.336 1.00 0.00 N ATOM 2013 CZ ARG B 154 127.180 4.367 -10.301 1.00 0.00 C ATOM 2014 NH1 ARG B 154 126.775 4.459 -11.563 1.00 0.00 N ATOM 2015 NH2 ARG B 154 128.197 3.557 -9.994 1.00 0.00 N ATOM 0 H ARG B 154 123.735 8.341 -5.713 1.00 0.00 H new ATOM 0 HA ARG B 154 123.220 5.471 -6.164 1.00 0.00 H new ATOM 0 HB2 ARG B 154 125.568 7.143 -7.084 1.00 0.00 H new ATOM 0 HB3 ARG B 154 125.645 5.401 -6.912 1.00 0.00 H new ATOM 0 HG2 ARG B 154 123.857 5.129 -8.579 1.00 0.00 H new ATOM 0 HG3 ARG B 154 123.689 6.868 -8.714 1.00 0.00 H new ATOM 0 HD2 ARG B 154 125.051 5.909 -10.553 1.00 0.00 H new ATOM 0 HD3 ARG B 154 125.941 7.087 -9.609 1.00 0.00 H new ATOM 0 HE ARG B 154 126.862 4.939 -8.372 1.00 0.00 H new ATOM 0 HH11 ARG B 154 126.001 5.077 -11.806 1.00 0.00 H new ATOM 0 HH12 ARG B 154 127.238 3.912 -12.288 1.00 0.00 H new ATOM 0 HH21 ARG B 154 128.516 3.482 -9.028 1.00 0.00 H new ATOM 0 HH22 ARG B 154 128.655 3.013 -10.726 1.00 0.00 H new ATOM 2029 N THR B 155 124.307 7.134 -3.807 1.00 0.00 N ATOM 2030 CA THR B 155 124.884 7.246 -2.493 1.00 0.00 C ATOM 2031 C THR B 155 124.070 6.369 -1.514 1.00 0.00 C ATOM 2032 O THR B 155 123.571 6.818 -0.494 1.00 0.00 O ATOM 2033 CB THR B 155 124.804 8.724 -2.096 1.00 0.00 C ATOM 2034 OG1 THR B 155 125.282 9.493 -3.212 1.00 0.00 O ATOM 2035 CG2 THR B 155 125.678 9.031 -0.891 1.00 0.00 C ATOM 0 H THR B 155 123.654 7.887 -4.025 1.00 0.00 H new ATOM 0 HA THR B 155 125.920 6.908 -2.471 1.00 0.00 H new ATOM 0 HB THR B 155 123.774 8.968 -1.835 1.00 0.00 H new ATOM 0 HG1 THR B 155 126.045 9.035 -3.623 1.00 0.00 H new ATOM 0 HG21 THR B 155 125.594 10.089 -0.641 1.00 0.00 H new ATOM 0 HG22 THR B 155 125.352 8.430 -0.042 1.00 0.00 H new ATOM 0 HG23 THR B 155 126.716 8.795 -1.125 1.00 0.00 H new ATOM 2043 N ARG B 156 123.957 5.120 -1.859 1.00 0.00 N ATOM 2044 CA ARG B 156 123.148 4.194 -1.131 1.00 0.00 C ATOM 2045 C ARG B 156 123.937 3.497 -0.025 1.00 0.00 C ATOM 2046 O ARG B 156 125.019 2.952 -0.260 1.00 0.00 O ATOM 2047 CB ARG B 156 122.512 3.195 -2.102 1.00 0.00 C ATOM 2048 CG ARG B 156 123.500 2.355 -2.891 1.00 0.00 C ATOM 2049 CD ARG B 156 122.792 1.505 -3.915 1.00 0.00 C ATOM 2050 NE ARG B 156 123.688 0.519 -4.515 1.00 0.00 N ATOM 2051 CZ ARG B 156 123.320 -0.412 -5.383 1.00 0.00 C ATOM 2052 NH1 ARG B 156 122.085 -0.432 -5.864 1.00 0.00 N ATOM 2053 NH2 ARG B 156 124.195 -1.307 -5.790 1.00 0.00 N ATOM 0 H ARG B 156 124.431 4.713 -2.665 1.00 0.00 H new ATOM 0 HA ARG B 156 122.351 4.744 -0.631 1.00 0.00 H new ATOM 0 HB2 ARG B 156 121.859 2.528 -1.539 1.00 0.00 H new ATOM 0 HB3 ARG B 156 121.881 3.742 -2.803 1.00 0.00 H new ATOM 0 HG2 ARG B 156 124.220 3.005 -3.388 1.00 0.00 H new ATOM 0 HG3 ARG B 156 124.064 1.717 -2.211 1.00 0.00 H new ATOM 0 HD2 ARG B 156 121.952 0.994 -3.445 1.00 0.00 H new ATOM 0 HD3 ARG B 156 122.380 2.144 -4.696 1.00 0.00 H new ATOM 0 HE ARG B 156 124.671 0.550 -4.245 1.00 0.00 H new ATOM 0 HH11 ARG B 156 121.410 0.273 -5.566 1.00 0.00 H new ATOM 0 HH12 ARG B 156 121.809 -1.152 -6.532 1.00 0.00 H new ATOM 0 HH21 ARG B 156 125.152 -1.282 -5.437 1.00 0.00 H new ATOM 0 HH22 ARG B 156 123.916 -2.026 -6.458 1.00 0.00 H new ATOM 2067 N ARG B 157 123.399 3.524 1.174 1.00 0.00 N ATOM 2068 CA ARG B 157 124.054 2.924 2.312 1.00 0.00 C ATOM 2069 C ARG B 157 123.456 1.556 2.602 1.00 0.00 C ATOM 2070 O ARG B 157 122.260 1.349 2.451 1.00 0.00 O ATOM 2071 CB ARG B 157 123.899 3.827 3.540 1.00 0.00 C ATOM 2072 CG ARG B 157 124.559 3.280 4.794 1.00 0.00 C ATOM 2073 CD ARG B 157 126.060 3.152 4.638 1.00 0.00 C ATOM 2074 NE ARG B 157 126.674 2.520 5.805 1.00 0.00 N ATOM 2075 CZ ARG B 157 127.440 3.152 6.707 1.00 0.00 C ATOM 2076 NH1 ARG B 157 127.739 4.442 6.553 1.00 0.00 N ATOM 2077 NH2 ARG B 157 127.930 2.487 7.741 1.00 0.00 N ATOM 0 H ARG B 157 122.501 3.960 1.386 1.00 0.00 H new ATOM 0 HA ARG B 157 125.113 2.806 2.084 1.00 0.00 H new ATOM 0 HB2 ARG B 157 124.324 4.805 3.315 1.00 0.00 H new ATOM 0 HB3 ARG B 157 122.837 3.978 3.736 1.00 0.00 H new ATOM 0 HG2 ARG B 157 124.337 3.936 5.636 1.00 0.00 H new ATOM 0 HG3 ARG B 157 124.135 2.304 5.030 1.00 0.00 H new ATOM 0 HD2 ARG B 157 126.284 2.566 3.747 1.00 0.00 H new ATOM 0 HD3 ARG B 157 126.496 4.140 4.488 1.00 0.00 H new ATOM 0 HE ARG B 157 126.507 1.523 5.944 1.00 0.00 H new ATOM 0 HH11 ARG B 157 127.385 4.955 5.746 1.00 0.00 H new ATOM 0 HH12 ARG B 157 128.322 4.916 7.243 1.00 0.00 H new ATOM 0 HH21 ARG B 157 127.725 1.494 7.852 1.00 0.00 H new ATOM 0 HH22 ARG B 157 128.512 2.968 8.427 1.00 0.00 H new ATOM 2091 N GLU B 158 124.287 0.629 2.989 1.00 0.00 N ATOM 2092 CA GLU B 158 123.826 -0.672 3.360 1.00 0.00 C ATOM 2093 C GLU B 158 123.256 -0.681 4.788 1.00 0.00 C ATOM 2094 O GLU B 158 123.817 -0.089 5.700 1.00 0.00 O ATOM 2095 CB GLU B 158 124.915 -1.755 3.113 1.00 0.00 C ATOM 2096 CG GLU B 158 126.347 -1.433 3.606 1.00 0.00 C ATOM 2097 CD GLU B 158 126.488 -1.327 5.107 1.00 0.00 C ATOM 2098 OE1 GLU B 158 126.325 -2.350 5.801 1.00 0.00 O ATOM 2099 OE2 GLU B 158 126.752 -0.211 5.624 1.00 0.00 O ATOM 0 H GLU B 158 125.297 0.756 3.055 1.00 0.00 H new ATOM 0 HA GLU B 158 122.994 -0.938 2.708 1.00 0.00 H new ATOM 0 HB2 GLU B 158 124.590 -2.678 3.593 1.00 0.00 H new ATOM 0 HB3 GLU B 158 124.961 -1.952 2.042 1.00 0.00 H new ATOM 0 HG2 GLU B 158 127.024 -2.207 3.245 1.00 0.00 H new ATOM 0 HG3 GLU B 158 126.669 -0.493 3.157 1.00 0.00 H new ATOM 2106 N THR B 159 122.114 -1.272 4.941 1.00 0.00 N ATOM 2107 CA THR B 159 121.481 -1.409 6.230 1.00 0.00 C ATOM 2108 C THR B 159 121.027 -2.864 6.356 1.00 0.00 C ATOM 2109 O THR B 159 120.339 -3.377 5.472 1.00 0.00 O ATOM 2110 CB THR B 159 120.252 -0.444 6.337 1.00 0.00 C ATOM 2111 OG1 THR B 159 120.642 0.877 5.899 1.00 0.00 O ATOM 2112 CG2 THR B 159 119.717 -0.352 7.784 1.00 0.00 C ATOM 0 H THR B 159 121.583 -1.680 4.172 1.00 0.00 H new ATOM 0 HA THR B 159 122.174 -1.150 7.031 1.00 0.00 H new ATOM 0 HB THR B 159 119.459 -0.844 5.705 1.00 0.00 H new ATOM 0 HG1 THR B 159 120.934 1.405 6.671 1.00 0.00 H new ATOM 0 HG21 THR B 159 118.865 0.327 7.814 1.00 0.00 H new ATOM 0 HG22 THR B 159 119.405 -1.341 8.120 1.00 0.00 H new ATOM 0 HG23 THR B 159 120.503 0.023 8.439 1.00 0.00 H new ATOM 2120 N GLN B 160 121.477 -3.551 7.377 1.00 0.00 N ATOM 2121 CA GLN B 160 121.073 -4.932 7.573 1.00 0.00 C ATOM 2122 C GLN B 160 119.865 -4.963 8.479 1.00 0.00 C ATOM 2123 O GLN B 160 119.983 -4.662 9.658 1.00 0.00 O ATOM 2124 CB GLN B 160 122.184 -5.805 8.204 1.00 0.00 C ATOM 2125 CG GLN B 160 123.469 -6.054 7.390 1.00 0.00 C ATOM 2126 CD GLN B 160 124.373 -4.849 7.236 1.00 0.00 C ATOM 2127 OE1 GLN B 160 125.199 -4.586 8.105 1.00 0.00 O ATOM 2128 NE2 GLN B 160 124.306 -4.177 6.121 1.00 0.00 N ATOM 0 H GLN B 160 122.117 -3.186 8.082 1.00 0.00 H new ATOM 0 HA GLN B 160 120.852 -5.345 6.589 1.00 0.00 H new ATOM 0 HB2 GLN B 160 122.473 -5.344 9.148 1.00 0.00 H new ATOM 0 HB3 GLN B 160 121.749 -6.775 8.443 1.00 0.00 H new ATOM 0 HG2 GLN B 160 124.034 -6.855 7.867 1.00 0.00 H new ATOM 0 HG3 GLN B 160 123.190 -6.409 6.398 1.00 0.00 H new ATOM 0 HE21 GLN B 160 123.607 -4.422 5.419 1.00 0.00 H new ATOM 0 HE22 GLN B 160 124.952 -3.407 5.950 1.00 0.00 H new ATOM 2137 N VAL B 161 118.721 -5.316 7.962 1.00 0.00 N ATOM 2138 CA VAL B 161 117.541 -5.312 8.777 1.00 0.00 C ATOM 2139 C VAL B 161 117.062 -6.721 8.988 1.00 0.00 C ATOM 2140 O VAL B 161 116.536 -7.042 10.069 1.00 0.00 O ATOM 2141 CB VAL B 161 116.396 -4.405 8.235 1.00 0.00 C ATOM 2142 CG1 VAL B 161 116.880 -3.018 7.988 1.00 0.00 C ATOM 2143 CG2 VAL B 161 115.768 -4.928 6.979 1.00 0.00 C ATOM 2144 OXT VAL B 161 117.284 -7.545 8.102 1.00 0.00 O ATOM 0 H VAL B 161 118.582 -5.606 6.994 1.00 0.00 H new ATOM 0 HA VAL B 161 117.825 -4.871 9.732 1.00 0.00 H new ATOM 0 HB VAL B 161 115.634 -4.405 9.015 1.00 0.00 H new ATOM 0 HG11 VAL B 161 116.059 -2.408 7.610 1.00 0.00 H new ATOM 0 HG12 VAL B 161 117.251 -2.591 8.920 1.00 0.00 H new ATOM 0 HG13 VAL B 161 117.685 -3.039 7.253 1.00 0.00 H new ATOM 0 HG21 VAL B 161 114.979 -4.249 6.657 1.00 0.00 H new ATOM 0 HG22 VAL B 161 116.524 -5.002 6.198 1.00 0.00 H new ATOM 0 HG23 VAL B 161 115.343 -5.914 7.168 1.00 0.00 H new TER 2154 VAL B 161