USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 972 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 102 MET CE :methyl -168:sc= -0.0577 (180deg=-0.0884) USER MOD Set 1.2: A 105 TYR OH : rot 6:sc= -0.809 USER MOD Set 2.1: A 57 GLN : amide:sc= 0.72 K(o=1.9,f=-2.9) USER MOD Set 2.2: A 93 THR OG1 : rot -143:sc= 1.16 USER MOD Set 3.1: A 84 SER OG : rot 95:sc= 0.911 USER MOD Set 3.2: A 123 TYR OH : rot -140:sc= 0.799 USER MOD Set 4.1: A 17 THR OG1 : rot 179:sc= 0.293 USER MOD Set 4.2: A 114 THR OG1 : rot 140:sc= 0 USER MOD Single : A 1 GLY N :NH3+ 136:sc= 0.493 (180deg=0.000769) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 LYS NZ :NH3+ -97:sc= 1.28 (180deg=-0.21) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 TYR OH : rot 174:sc= -0.0663 USER MOD Single : A 11 TYR OH : rot 142:sc= 0.142 USER MOD Single : A 12 SER OG : rot 180:sc= 0.118 USER MOD Single : A 14 SER OG : rot 29:sc= 0.298 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl -125:sc= -7.33! (180deg=-8.72!) USER MOD Single : A 23 LYS NZ :NH3+ -165:sc= -0.0101 (180deg=-0.177) USER MOD Single : A 25 ASN : amide:sc= -0.323 X(o=-0.32,f=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot -70:sc= -0.324 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0.0166 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 MET CE :methyl -137:sc= 0 (180deg=-0.00502) USER MOD Single : A 48 TYR OH : rot -85:sc= 1.23 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 135:sc= 0.238 USER MOD Single : A 51 SER OG : rot 114:sc= 0.452 USER MOD Single : A 59 GLN :FLIP amide:sc=-0.00332 F(o=-1.2,f=-0.0033) USER MOD Single : A 61 ASN : amide:sc= 0.5 K(o=0.5,f=-1.8!) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 GLN : amide:sc= 0.776 K(o=0.78,f=-0.77) USER MOD Single : A 71 ASN : amide:sc= -0.22 K(o=-0.22,f=-0.97) USER MOD Single : A 74 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 ASN : amide:sc= -0.387 X(o=-0.39,f=-0.058) USER MOD Single : A 76 ASN :FLIP amide:sc= -0.0175 F(o=-0.65,f=-0.017) USER MOD Single : A 77 TYR OH : rot -15:sc= 1.24 USER MOD Single : A 88 SER OG : rot 180:sc= 0.0467 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 177:sc= 1.3 USER MOD Single : A 101 GLN :FLIP amide:sc= -0.285 F(o=-1.2,f=-0.28) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 SER OG : rot 148:sc= 0.611 USER MOD Single : A 115 SER OG : rot -158:sc= -0.246 USER MOD Single : A 118 THR OG1 : rot -75:sc= 1.1 USER MOD Single : A 119 ASN : amide:sc= -0.384 K(o=-0.38,f=-1.2) USER MOD Single : A 120 HIS : no HE2:sc= 0.729 K(o=0.73,f=-3!) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 125 SER OG : rot 87:sc= 0.451 USER MOD Single : A 126 HIS :FLIP no HE2:sc= -0.367 F(o=-1,f=-0.37) USER MOD Single : A 128 ASN : amide:sc= 1.19 K(o=1.2,f=-0.0024) USER MOD Single : A 135 ASN : amide:sc= -0.0162 X(o=-0.016,f=0) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -137:sc= 0.338 (180deg=-1.27!) USER MOD Single : A 150 SER OG : rot -52:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -9.867 -23.341 -6.960 1.00 24.12 N ATOM 2 CA GLY A 1 -9.515 -23.901 -5.646 1.00 73.14 C ATOM 3 C GLY A 1 -8.157 -23.403 -5.178 1.00 3.15 C ATOM 4 O GLY A 1 -7.306 -24.197 -4.777 1.00 14.34 O ATOM 0 H1 GLY A 1 -10.261 -24.091 -7.563 1.00 24.12 H new ATOM 0 H2 GLY A 1 -10.574 -22.588 -6.838 1.00 24.12 H new ATOM 0 H3 GLY A 1 -9.016 -22.947 -7.409 1.00 24.12 H new ATOM 0 HA2 GLY A 1 -10.276 -23.627 -4.916 1.00 73.14 H new ATOM 0 HA3 GLY A 1 -9.505 -24.989 -5.703 1.00 73.14 H new ATOM 8 N MET A 2 -7.936 -22.091 -5.200 1.00 41.04 N ATOM 9 CA MET A 2 -6.748 -21.411 -4.716 1.00 35.43 C ATOM 10 C MET A 2 -7.190 -19.997 -4.345 1.00 12.12 C ATOM 11 O MET A 2 -7.878 -19.356 -5.144 1.00 12.12 O ATOM 12 CB MET A 2 -5.609 -21.425 -5.758 1.00 55.31 C ATOM 13 CG MET A 2 -5.934 -20.947 -7.184 1.00 35.35 C ATOM 14 SD MET A 2 -6.877 -22.108 -8.220 1.00 44.24 S ATOM 15 CE MET A 2 -6.604 -21.341 -9.838 1.00 44.20 C ATOM 0 H MET A 2 -8.624 -21.441 -5.579 1.00 41.04 H new ATOM 0 HA MET A 2 -6.329 -21.920 -3.848 1.00 35.43 H new ATOM 0 HB2 MET A 2 -4.797 -20.807 -5.375 1.00 55.31 H new ATOM 0 HB3 MET A 2 -5.229 -22.444 -5.825 1.00 55.31 H new ATOM 0 HG2 MET A 2 -6.495 -20.015 -7.114 1.00 35.35 H new ATOM 0 HG3 MET A 2 -4.997 -20.717 -7.691 1.00 35.35 H new ATOM 0 HE1 MET A 2 -7.114 -21.922 -10.607 1.00 44.20 H new ATOM 0 HE2 MET A 2 -6.998 -20.325 -9.830 1.00 44.20 H new ATOM 0 HE3 MET A 2 -5.536 -21.314 -10.052 1.00 44.20 H new ATOM 23 N ALA A 3 -6.883 -19.547 -3.127 1.00 62.10 N ATOM 24 CA ALA A 3 -7.211 -18.201 -2.667 1.00 12.43 C ATOM 25 C ALA A 3 -6.247 -17.773 -1.555 1.00 63.30 C ATOM 26 O ALA A 3 -6.649 -17.673 -0.394 1.00 60.40 O ATOM 27 CB ALA A 3 -8.674 -18.167 -2.194 1.00 3.35 C ATOM 0 H ALA A 3 -6.397 -20.111 -2.430 1.00 62.10 H new ATOM 0 HA ALA A 3 -7.099 -17.492 -3.487 1.00 12.43 H new ATOM 0 HB1 ALA A 3 -8.922 -17.163 -1.850 1.00 3.35 H new ATOM 0 HB2 ALA A 3 -9.330 -18.440 -3.021 1.00 3.35 H new ATOM 0 HB3 ALA A 3 -8.808 -18.874 -1.376 1.00 3.35 H new ATOM 33 N LYS A 4 -4.970 -17.534 -1.887 1.00 14.05 N ATOM 34 CA LYS A 4 -3.966 -17.115 -0.890 1.00 13.13 C ATOM 35 C LYS A 4 -2.968 -16.058 -1.387 1.00 20.33 C ATOM 36 O LYS A 4 -1.874 -15.926 -0.850 1.00 44.22 O ATOM 37 CB LYS A 4 -3.354 -18.333 -0.158 1.00 72.54 C ATOM 38 CG LYS A 4 -2.296 -19.230 -0.830 1.00 22.55 C ATOM 39 CD LYS A 4 -2.759 -20.087 -2.019 1.00 72.11 C ATOM 40 CE LYS A 4 -2.712 -19.451 -3.411 1.00 51.24 C ATOM 41 NZ LYS A 4 -1.383 -19.476 -4.058 1.00 14.03 N ATOM 0 H LYS A 4 -4.606 -17.623 -2.836 1.00 14.05 H new ATOM 0 HA LYS A 4 -4.499 -16.555 -0.121 1.00 13.13 H new ATOM 0 HB2 LYS A 4 -2.911 -17.958 0.765 1.00 72.54 H new ATOM 0 HB3 LYS A 4 -4.183 -18.981 0.127 1.00 72.54 H new ATOM 0 HG2 LYS A 4 -1.479 -18.593 -1.170 1.00 22.55 H new ATOM 0 HG3 LYS A 4 -1.886 -19.897 -0.071 1.00 22.55 H new ATOM 0 HD2 LYS A 4 -2.148 -20.989 -2.041 1.00 72.11 H new ATOM 0 HD3 LYS A 4 -3.785 -20.401 -1.827 1.00 72.11 H new ATOM 0 HE2 LYS A 4 -3.424 -19.967 -4.055 1.00 51.24 H new ATOM 0 HE3 LYS A 4 -3.044 -18.416 -3.334 1.00 51.24 H new ATOM 0 HZ1 LYS A 4 -1.444 -19.026 -4.994 1.00 14.03 H new ATOM 0 HZ2 LYS A 4 -0.700 -18.958 -3.469 1.00 14.03 H new ATOM 0 HZ3 LYS A 4 -1.069 -20.461 -4.168 1.00 14.03 H new ATOM 51 N LYS A 5 -3.314 -15.343 -2.458 1.00 22.23 N ATOM 52 CA LYS A 5 -2.393 -14.507 -3.240 1.00 42.20 C ATOM 53 C LYS A 5 -1.925 -13.259 -2.514 1.00 71.21 C ATOM 54 O LYS A 5 -2.596 -12.777 -1.607 1.00 51.13 O ATOM 55 CB LYS A 5 -3.076 -14.166 -4.572 1.00 41.32 C ATOM 56 CG LYS A 5 -2.849 -15.313 -5.555 1.00 32.25 C ATOM 57 CD LYS A 5 -1.654 -15.059 -6.484 1.00 2.35 C ATOM 58 CE LYS A 5 -2.166 -14.284 -7.706 1.00 4.34 C ATOM 59 NZ LYS A 5 -1.076 -13.808 -8.577 1.00 63.21 N ATOM 0 H LYS A 5 -4.268 -15.327 -2.818 1.00 22.23 H new ATOM 0 HA LYS A 5 -1.479 -15.076 -3.411 1.00 42.20 H new ATOM 0 HB2 LYS A 5 -4.143 -14.008 -4.418 1.00 41.32 H new ATOM 0 HB3 LYS A 5 -2.671 -13.238 -4.976 1.00 41.32 H new ATOM 0 HG2 LYS A 5 -2.684 -16.237 -5.000 1.00 32.25 H new ATOM 0 HG3 LYS A 5 -3.748 -15.457 -6.155 1.00 32.25 H new ATOM 0 HD2 LYS A 5 -0.882 -14.489 -5.966 1.00 2.35 H new ATOM 0 HD3 LYS A 5 -1.202 -16.002 -6.792 1.00 2.35 H new ATOM 0 HE2 LYS A 5 -2.833 -14.924 -8.283 1.00 4.34 H new ATOM 0 HE3 LYS A 5 -2.755 -13.431 -7.369 1.00 4.34 H new ATOM 0 HZ1 LYS A 5 -0.856 -12.818 -8.348 1.00 63.21 H new ATOM 0 HZ2 LYS A 5 -0.230 -14.394 -8.427 1.00 63.21 H new ATOM 0 HZ3 LYS A 5 -1.372 -13.876 -9.572 1.00 63.21 H new ATOM 69 N THR A 6 -0.837 -12.673 -3.009 1.00 73.34 N ATOM 70 CA THR A 6 -0.241 -11.473 -2.445 1.00 61.21 C ATOM 71 C THR A 6 0.030 -10.454 -3.561 1.00 52.23 C ATOM 72 O THR A 6 0.618 -10.796 -4.589 1.00 51.30 O ATOM 73 CB THR A 6 1.036 -11.849 -1.675 1.00 75.52 C ATOM 74 OG1 THR A 6 0.879 -13.000 -0.861 1.00 64.13 O ATOM 75 CG2 THR A 6 1.512 -10.685 -0.802 1.00 34.13 C ATOM 0 H THR A 6 -0.340 -13.027 -3.826 1.00 73.34 H new ATOM 0 HA THR A 6 -0.927 -11.006 -1.739 1.00 61.21 H new ATOM 0 HB THR A 6 1.782 -12.078 -2.436 1.00 75.52 H new ATOM 0 HG1 THR A 6 1.722 -13.191 -0.399 1.00 64.13 H new ATOM 0 HG21 THR A 6 2.416 -10.977 -0.268 1.00 34.13 H new ATOM 0 HG22 THR A 6 1.725 -9.821 -1.432 1.00 34.13 H new ATOM 0 HG23 THR A 6 0.734 -10.427 -0.084 1.00 34.13 H new ATOM 83 N LEU A 7 -0.413 -9.206 -3.385 1.00 74.21 N ATOM 84 CA LEU A 7 -0.054 -8.063 -4.238 1.00 24.33 C ATOM 85 C LEU A 7 0.796 -7.077 -3.434 1.00 13.33 C ATOM 86 O LEU A 7 0.658 -6.986 -2.214 1.00 60.32 O ATOM 87 CB LEU A 7 -1.344 -7.410 -4.761 1.00 22.25 C ATOM 88 CG LEU A 7 -1.182 -6.176 -5.664 1.00 14.43 C ATOM 89 CD1 LEU A 7 -0.350 -6.464 -6.916 1.00 62.23 C ATOM 90 CD2 LEU A 7 -2.567 -5.706 -6.118 1.00 44.33 C ATOM 0 H LEU A 7 -1.047 -8.953 -2.627 1.00 74.21 H new ATOM 0 HA LEU A 7 0.536 -8.390 -5.094 1.00 24.33 H new ATOM 0 HB2 LEU A 7 -1.906 -8.163 -5.313 1.00 22.25 H new ATOM 0 HB3 LEU A 7 -1.952 -7.125 -3.903 1.00 22.25 H new ATOM 0 HG LEU A 7 -0.664 -5.416 -5.078 1.00 14.43 H new ATOM 0 HD11 LEU A 7 -0.269 -5.557 -7.516 1.00 62.23 H new ATOM 0 HD12 LEU A 7 0.646 -6.795 -6.623 1.00 62.23 H new ATOM 0 HD13 LEU A 7 -0.834 -7.245 -7.503 1.00 62.23 H new ATOM 0 HD21 LEU A 7 -2.462 -4.831 -6.759 1.00 44.33 H new ATOM 0 HD22 LEU A 7 -3.059 -6.505 -6.673 1.00 44.33 H new ATOM 0 HD23 LEU A 7 -3.167 -5.447 -5.246 1.00 44.33 H new ATOM 101 N ILE A 8 1.655 -6.323 -4.120 1.00 60.10 N ATOM 102 CA ILE A 8 2.515 -5.309 -3.536 1.00 33.03 C ATOM 103 C ILE A 8 2.403 -4.073 -4.432 1.00 24.02 C ATOM 104 O ILE A 8 2.586 -4.181 -5.650 1.00 15.15 O ATOM 105 CB ILE A 8 3.983 -5.804 -3.455 1.00 31.02 C ATOM 106 CG1 ILE A 8 4.192 -7.265 -2.985 1.00 14.15 C ATOM 107 CG2 ILE A 8 4.708 -4.864 -2.473 1.00 31.25 C ATOM 108 CD1 ILE A 8 5.639 -7.741 -3.195 1.00 41.12 C ATOM 0 H ILE A 8 1.771 -6.409 -5.130 1.00 60.10 H new ATOM 0 HA ILE A 8 2.208 -5.080 -2.515 1.00 33.03 H new ATOM 0 HB ILE A 8 4.373 -5.788 -4.473 1.00 31.02 H new ATOM 0 HG12 ILE A 8 3.934 -7.346 -1.929 1.00 14.15 H new ATOM 0 HG13 ILE A 8 3.513 -7.921 -3.530 1.00 14.15 H new ATOM 0 HG21 ILE A 8 5.750 -5.170 -2.379 1.00 31.25 H new ATOM 0 HG22 ILE A 8 4.662 -3.841 -2.847 1.00 31.25 H new ATOM 0 HG23 ILE A 8 4.225 -4.915 -1.497 1.00 31.25 H new ATOM 0 HD11 ILE A 8 5.737 -8.771 -2.851 1.00 41.12 H new ATOM 0 HD12 ILE A 8 5.890 -7.687 -4.254 1.00 41.12 H new ATOM 0 HD13 ILE A 8 6.318 -7.103 -2.629 1.00 41.12 H new ATOM 119 N LEU A 9 2.103 -2.907 -3.853 1.00 43.31 N ATOM 120 CA LEU A 9 2.093 -1.617 -4.534 1.00 40.32 C ATOM 121 C LEU A 9 2.868 -0.600 -3.694 1.00 41.33 C ATOM 122 O LEU A 9 3.177 -0.844 -2.528 1.00 11.11 O ATOM 123 CB LEU A 9 0.658 -1.102 -4.763 1.00 35.43 C ATOM 124 CG LEU A 9 -0.317 -2.084 -5.441 1.00 55.33 C ATOM 125 CD1 LEU A 9 -1.256 -2.707 -4.403 1.00 20.01 C ATOM 126 CD2 LEU A 9 -1.146 -1.383 -6.523 1.00 3.52 C ATOM 0 H LEU A 9 1.853 -2.837 -2.867 1.00 43.31 H new ATOM 0 HA LEU A 9 2.562 -1.746 -5.509 1.00 40.32 H new ATOM 0 HB2 LEU A 9 0.239 -0.814 -3.799 1.00 35.43 H new ATOM 0 HB3 LEU A 9 0.711 -0.198 -5.370 1.00 35.43 H new ATOM 0 HG LEU A 9 0.277 -2.868 -5.910 1.00 55.33 H new ATOM 0 HD11 LEU A 9 -1.938 -3.398 -4.898 1.00 20.01 H new ATOM 0 HD12 LEU A 9 -0.670 -3.246 -3.659 1.00 20.01 H new ATOM 0 HD13 LEU A 9 -1.829 -1.920 -3.912 1.00 20.01 H new ATOM 0 HD21 LEU A 9 -1.825 -2.101 -6.984 1.00 3.52 H new ATOM 0 HD22 LEU A 9 -1.723 -0.575 -6.073 1.00 3.52 H new ATOM 0 HD23 LEU A 9 -0.481 -0.974 -7.283 1.00 3.52 H new ATOM 137 N TYR A 10 3.163 0.560 -4.284 1.00 0.54 N ATOM 138 CA TYR A 10 3.868 1.696 -3.691 1.00 63.10 C ATOM 139 C TYR A 10 3.996 2.853 -4.673 1.00 22.21 C ATOM 140 O TYR A 10 4.031 2.652 -5.889 1.00 71.40 O ATOM 141 CB TYR A 10 5.234 1.343 -3.040 1.00 71.44 C ATOM 142 CG TYR A 10 5.967 0.093 -3.488 1.00 10.13 C ATOM 143 CD1 TYR A 10 5.868 -0.386 -4.804 1.00 74.03 C ATOM 144 CD2 TYR A 10 6.583 -0.701 -2.501 1.00 13.13 C ATOM 145 CE1 TYR A 10 6.217 -1.711 -5.081 1.00 74.14 C ATOM 146 CE2 TYR A 10 6.903 -2.037 -2.765 1.00 61.13 C ATOM 147 CZ TYR A 10 6.696 -2.559 -4.058 1.00 73.13 C ATOM 148 OH TYR A 10 7.039 -3.846 -4.337 1.00 72.04 O ATOM 0 H TYR A 10 2.898 0.742 -5.252 1.00 0.54 H new ATOM 0 HA TYR A 10 3.236 2.016 -2.862 1.00 63.10 H new ATOM 0 HB2 TYR A 10 5.902 2.190 -3.199 1.00 71.44 H new ATOM 0 HB3 TYR A 10 5.074 1.262 -1.965 1.00 71.44 H new ATOM 0 HD1 TYR A 10 5.525 0.264 -5.596 1.00 74.03 H new ATOM 0 HD2 TYR A 10 6.810 -0.276 -1.534 1.00 13.13 H new ATOM 0 HE1 TYR A 10 6.119 -2.090 -6.088 1.00 74.14 H new ATOM 0 HE2 TYR A 10 7.306 -2.664 -1.984 1.00 61.13 H new ATOM 0 HH TYR A 10 7.442 -4.257 -3.544 1.00 72.04 H new ATOM 157 N TYR A 11 4.123 4.070 -4.143 1.00 51.42 N ATOM 158 CA TYR A 11 4.435 5.259 -4.921 1.00 54.20 C ATOM 159 C TYR A 11 5.916 5.541 -4.746 1.00 50.33 C ATOM 160 O TYR A 11 6.351 5.940 -3.666 1.00 12.21 O ATOM 161 CB TYR A 11 3.595 6.469 -4.497 1.00 2.34 C ATOM 162 CG TYR A 11 4.075 7.772 -5.136 1.00 71.13 C ATOM 163 CD1 TYR A 11 4.369 7.826 -6.513 1.00 53.32 C ATOM 164 CD2 TYR A 11 4.313 8.912 -4.347 1.00 72.33 C ATOM 165 CE1 TYR A 11 4.850 9.006 -7.100 1.00 23.13 C ATOM 166 CE2 TYR A 11 4.821 10.098 -4.918 1.00 60.11 C ATOM 167 CZ TYR A 11 5.080 10.147 -6.307 1.00 23.02 C ATOM 168 OH TYR A 11 5.494 11.292 -6.907 1.00 74.12 O ATOM 0 H TYR A 11 4.009 4.255 -3.146 1.00 51.42 H new ATOM 0 HA TYR A 11 4.194 5.080 -5.969 1.00 54.20 H new ATOM 0 HB2 TYR A 11 2.554 6.297 -4.770 1.00 2.34 H new ATOM 0 HB3 TYR A 11 3.628 6.567 -3.412 1.00 2.34 H new ATOM 0 HD1 TYR A 11 4.222 6.948 -7.124 1.00 53.32 H new ATOM 0 HD2 TYR A 11 4.104 8.879 -3.288 1.00 72.33 H new ATOM 0 HE1 TYR A 11 5.044 9.039 -8.162 1.00 23.13 H new ATOM 0 HE2 TYR A 11 5.011 10.962 -4.299 1.00 60.11 H new ATOM 0 HH TYR A 11 5.059 12.060 -6.481 1.00 74.12 H new ATOM 177 N SER A 12 6.685 5.276 -5.796 1.00 10.51 N ATOM 178 CA SER A 12 8.093 5.600 -5.878 1.00 23.32 C ATOM 179 C SER A 12 8.280 7.120 -5.888 1.00 30.03 C ATOM 180 O SER A 12 7.854 7.778 -6.837 1.00 14.55 O ATOM 181 CB SER A 12 8.719 4.864 -7.073 1.00 23.23 C ATOM 182 OG SER A 12 7.784 4.523 -8.095 1.00 12.52 O ATOM 0 H SER A 12 6.330 4.817 -6.635 1.00 10.51 H new ATOM 0 HA SER A 12 8.630 5.249 -4.997 1.00 23.32 H new ATOM 0 HB2 SER A 12 9.501 5.489 -7.503 1.00 23.23 H new ATOM 0 HB3 SER A 12 9.200 3.954 -6.715 1.00 23.23 H new ATOM 0 HG SER A 12 8.249 4.060 -8.823 1.00 12.52 H new ATOM 187 N TRP A 13 8.873 7.680 -4.826 1.00 74.40 N ATOM 188 CA TRP A 13 9.072 9.123 -4.673 1.00 23.24 C ATOM 189 C TRP A 13 10.113 9.654 -5.673 1.00 65.31 C ATOM 190 O TRP A 13 9.761 10.137 -6.745 1.00 12.21 O ATOM 191 CB TRP A 13 9.435 9.458 -3.221 1.00 34.12 C ATOM 192 CG TRP A 13 9.422 10.927 -2.915 1.00 53.13 C ATOM 193 CD1 TRP A 13 8.314 11.697 -2.829 1.00 44.14 C ATOM 194 CD2 TRP A 13 10.543 11.848 -2.740 1.00 31.12 C ATOM 195 NE1 TRP A 13 8.662 12.996 -2.539 1.00 10.24 N ATOM 196 CE2 TRP A 13 10.023 13.163 -2.546 1.00 50.54 C ATOM 197 CE3 TRP A 13 11.948 11.719 -2.759 1.00 30.34 C ATOM 198 CZ2 TRP A 13 10.845 14.290 -2.421 1.00 44.21 C ATOM 199 CZ3 TRP A 13 12.785 12.845 -2.655 1.00 45.52 C ATOM 200 CH2 TRP A 13 12.237 14.128 -2.496 1.00 1.32 C ATOM 0 H TRP A 13 9.231 7.136 -4.041 1.00 74.40 H new ATOM 0 HA TRP A 13 8.136 9.631 -4.904 1.00 23.24 H new ATOM 0 HB2 TRP A 13 8.735 8.952 -2.556 1.00 34.12 H new ATOM 0 HB3 TRP A 13 10.426 9.060 -3.003 1.00 34.12 H new ATOM 0 HD1 TRP A 13 7.303 11.344 -2.968 1.00 44.14 H new ATOM 0 HE1 TRP A 13 7.993 13.740 -2.344 1.00 10.24 H new ATOM 0 HE3 TRP A 13 12.389 10.738 -2.855 1.00 30.34 H new ATOM 0 HZ2 TRP A 13 10.414 15.269 -2.269 1.00 44.21 H new ATOM 0 HZ3 TRP A 13 13.857 12.722 -2.698 1.00 45.52 H new ATOM 0 HH2 TRP A 13 12.886 14.989 -2.432 1.00 1.32 H new ATOM 210 N SER A 14 11.401 9.536 -5.337 1.00 1.25 N ATOM 211 CA SER A 14 12.536 9.787 -6.213 1.00 25.05 C ATOM 212 C SER A 14 13.686 8.877 -5.783 1.00 33.25 C ATOM 213 O SER A 14 14.689 9.323 -5.236 1.00 24.24 O ATOM 214 CB SER A 14 12.931 11.270 -6.201 1.00 64.32 C ATOM 215 OG SER A 14 12.116 12.006 -7.087 1.00 11.14 O ATOM 0 H SER A 14 11.688 9.249 -4.401 1.00 1.25 H new ATOM 0 HA SER A 14 12.270 9.557 -7.245 1.00 25.05 H new ATOM 0 HB2 SER A 14 12.834 11.670 -5.192 1.00 64.32 H new ATOM 0 HB3 SER A 14 13.977 11.376 -6.487 1.00 64.32 H new ATOM 0 HG SER A 14 11.238 11.577 -7.156 1.00 11.14 H new ATOM 220 N GLY A 15 13.544 7.578 -6.037 1.00 51.51 N ATOM 221 CA GLY A 15 14.612 6.595 -5.875 1.00 54.22 C ATOM 222 C GLY A 15 14.725 6.031 -4.457 1.00 61.22 C ATOM 223 O GLY A 15 15.712 5.356 -4.166 1.00 22.01 O ATOM 0 H GLY A 15 12.668 7.172 -6.367 1.00 51.51 H new ATOM 0 HA2 GLY A 15 14.444 5.773 -6.570 1.00 54.22 H new ATOM 0 HA3 GLY A 15 15.561 7.056 -6.149 1.00 54.22 H new ATOM 227 N GLU A 16 13.754 6.280 -3.577 1.00 42.20 N ATOM 228 CA GLU A 16 13.787 5.807 -2.191 1.00 52.12 C ATOM 229 C GLU A 16 12.950 4.532 -2.057 1.00 13.53 C ATOM 230 O GLU A 16 13.444 3.480 -1.644 1.00 44.54 O ATOM 231 CB GLU A 16 13.257 6.907 -1.247 1.00 21.44 C ATOM 232 CG GLU A 16 14.032 8.235 -1.289 1.00 62.40 C ATOM 233 CD GLU A 16 15.494 8.086 -0.869 1.00 31.14 C ATOM 234 OE1 GLU A 16 15.746 7.583 0.251 1.00 21.32 O ATOM 235 OE2 GLU A 16 16.396 8.471 -1.645 1.00 34.12 O ATOM 0 H GLU A 16 12.918 6.818 -3.806 1.00 42.20 H new ATOM 0 HA GLU A 16 14.816 5.578 -1.913 1.00 52.12 H new ATOM 0 HB2 GLU A 16 12.214 7.105 -1.495 1.00 21.44 H new ATOM 0 HB3 GLU A 16 13.275 6.527 -0.226 1.00 21.44 H new ATOM 0 HG2 GLU A 16 13.989 8.642 -2.299 1.00 62.40 H new ATOM 0 HG3 GLU A 16 13.543 8.956 -0.634 1.00 62.40 H new ATOM 240 N THR A 17 11.671 4.617 -2.425 1.00 25.13 N ATOM 241 CA THR A 17 10.674 3.569 -2.254 1.00 70.42 C ATOM 242 C THR A 17 11.054 2.345 -3.093 1.00 31.23 C ATOM 243 O THR A 17 10.868 1.210 -2.655 1.00 13.35 O ATOM 244 CB THR A 17 9.308 4.133 -2.669 1.00 50.52 C ATOM 245 OG1 THR A 17 9.247 5.542 -2.470 1.00 22.25 O ATOM 246 CG2 THR A 17 8.131 3.495 -1.942 1.00 22.01 C ATOM 0 H THR A 17 11.290 5.453 -2.868 1.00 25.13 H new ATOM 0 HA THR A 17 10.627 3.249 -1.213 1.00 70.42 H new ATOM 0 HB THR A 17 9.219 3.891 -3.728 1.00 50.52 H new ATOM 0 HG1 THR A 17 8.374 5.876 -2.763 1.00 22.25 H new ATOM 0 HG21 THR A 17 7.201 3.946 -2.289 1.00 22.01 H new ATOM 0 HG22 THR A 17 8.114 2.425 -2.147 1.00 22.01 H new ATOM 0 HG23 THR A 17 8.235 3.657 -0.869 1.00 22.01 H new ATOM 254 N LYS A 18 11.643 2.578 -4.277 1.00 1.32 N ATOM 255 CA LYS A 18 12.132 1.532 -5.172 1.00 1.33 C ATOM 256 C LYS A 18 12.961 0.472 -4.440 1.00 62.02 C ATOM 257 O LYS A 18 12.742 -0.706 -4.715 1.00 65.13 O ATOM 258 CB LYS A 18 12.867 2.179 -6.366 1.00 4.21 C ATOM 259 CG LYS A 18 13.474 1.192 -7.380 1.00 51.30 C ATOM 260 CD LYS A 18 14.870 0.658 -7.001 1.00 43.24 C ATOM 261 CE LYS A 18 16.036 1.290 -7.770 1.00 2.34 C ATOM 262 NZ LYS A 18 16.145 0.780 -9.156 1.00 43.34 N ATOM 0 H LYS A 18 11.793 3.519 -4.640 1.00 1.32 H new ATOM 0 HA LYS A 18 11.280 0.979 -5.568 1.00 1.33 H new ATOM 0 HB2 LYS A 18 12.168 2.830 -6.892 1.00 4.21 H new ATOM 0 HB3 LYS A 18 13.665 2.813 -5.980 1.00 4.21 H new ATOM 0 HG2 LYS A 18 12.795 0.347 -7.495 1.00 51.30 H new ATOM 0 HG3 LYS A 18 13.539 1.683 -8.351 1.00 51.30 H new ATOM 0 HD2 LYS A 18 15.027 0.820 -5.935 1.00 43.24 H new ATOM 0 HD3 LYS A 18 14.887 -0.419 -7.166 1.00 43.24 H new ATOM 0 HE2 LYS A 18 15.907 2.372 -7.794 1.00 2.34 H new ATOM 0 HE3 LYS A 18 16.967 1.091 -7.239 1.00 2.34 H new ATOM 0 HZ1 LYS A 18 16.948 1.238 -9.632 1.00 43.34 H new ATOM 0 HZ2 LYS A 18 16.295 -0.249 -9.136 1.00 43.34 H new ATOM 0 HZ3 LYS A 18 15.268 0.992 -9.674 1.00 43.34 H new ATOM 272 N LYS A 19 13.884 0.821 -3.531 1.00 64.10 N ATOM 273 CA LYS A 19 14.799 -0.191 -2.987 1.00 72.41 C ATOM 274 C LYS A 19 14.037 -1.328 -2.327 1.00 5.44 C ATOM 275 O LYS A 19 14.248 -2.495 -2.655 1.00 65.34 O ATOM 276 CB LYS A 19 15.770 0.424 -1.967 1.00 52.23 C ATOM 277 CG LYS A 19 17.109 -0.334 -1.875 1.00 10.44 C ATOM 278 CD LYS A 19 17.801 -0.139 -0.511 1.00 72.32 C ATOM 279 CE LYS A 19 17.866 1.327 -0.059 1.00 14.23 C ATOM 280 NZ LYS A 19 18.539 1.494 1.246 1.00 44.55 N ATOM 0 H LYS A 19 14.015 1.765 -3.167 1.00 64.10 H new ATOM 0 HA LYS A 19 15.369 -0.585 -3.829 1.00 72.41 H new ATOM 0 HB2 LYS A 19 15.964 1.461 -2.239 1.00 52.23 H new ATOM 0 HB3 LYS A 19 15.297 0.435 -0.985 1.00 52.23 H new ATOM 0 HG2 LYS A 19 16.934 -1.397 -2.042 1.00 10.44 H new ATOM 0 HG3 LYS A 19 17.773 0.009 -2.669 1.00 10.44 H new ATOM 0 HD2 LYS A 19 17.270 -0.720 0.243 1.00 72.32 H new ATOM 0 HD3 LYS A 19 18.814 -0.539 -0.566 1.00 72.32 H new ATOM 0 HE2 LYS A 19 18.394 1.912 -0.812 1.00 14.23 H new ATOM 0 HE3 LYS A 19 16.854 1.728 0.005 1.00 14.23 H new ATOM 0 HZ1 LYS A 19 18.555 2.502 1.502 1.00 44.55 H new ATOM 0 HZ2 LYS A 19 18.023 0.960 1.974 1.00 44.55 H new ATOM 0 HZ3 LYS A 19 19.514 1.138 1.182 1.00 44.55 H new ATOM 290 N MET A 20 13.141 -0.973 -1.399 1.00 4.44 N ATOM 291 CA MET A 20 12.351 -1.895 -0.637 1.00 23.05 C ATOM 292 C MET A 20 11.295 -2.582 -1.523 1.00 23.45 C ATOM 293 O MET A 20 10.757 -3.601 -1.114 1.00 65.12 O ATOM 294 CB MET A 20 11.834 -1.131 0.577 1.00 43.12 C ATOM 295 CG MET A 20 10.712 -0.123 0.244 1.00 3.33 C ATOM 296 SD MET A 20 9.466 0.190 1.505 1.00 61.12 S ATOM 297 CE MET A 20 9.275 -1.551 1.756 1.00 65.24 C ATOM 0 H MET A 20 12.954 0.002 -1.164 1.00 4.44 H new ATOM 0 HA MET A 20 12.925 -2.742 -0.260 1.00 23.05 H new ATOM 0 HB2 MET A 20 11.463 -1.844 1.313 1.00 43.12 H new ATOM 0 HB3 MET A 20 12.664 -0.597 1.040 1.00 43.12 H new ATOM 0 HG2 MET A 20 11.180 0.828 -0.008 1.00 3.33 H new ATOM 0 HG3 MET A 20 10.201 -0.474 -0.652 1.00 3.33 H new ATOM 0 HE1 MET A 20 8.227 -1.824 1.631 1.00 65.24 H new ATOM 0 HE2 MET A 20 9.880 -2.092 1.028 1.00 65.24 H new ATOM 0 HE3 MET A 20 9.600 -1.811 2.763 1.00 65.24 H new ATOM 305 N ALA A 21 11.027 -2.111 -2.748 1.00 12.52 N ATOM 306 CA ALA A 21 10.067 -2.713 -3.644 1.00 23.43 C ATOM 307 C ALA A 21 10.695 -3.970 -4.232 1.00 12.35 C ATOM 308 O ALA A 21 10.193 -5.077 -4.032 1.00 52.34 O ATOM 309 CB ALA A 21 9.652 -1.709 -4.732 1.00 33.03 C ATOM 0 H ALA A 21 11.485 -1.287 -3.138 1.00 12.52 H new ATOM 0 HA ALA A 21 9.157 -2.989 -3.110 1.00 23.43 H new ATOM 0 HB1 ALA A 21 8.928 -2.175 -5.401 1.00 33.03 H new ATOM 0 HB2 ALA A 21 9.203 -0.832 -4.266 1.00 33.03 H new ATOM 0 HB3 ALA A 21 10.530 -1.407 -5.302 1.00 33.03 H new ATOM 315 N GLU A 22 11.817 -3.784 -4.932 1.00 12.15 N ATOM 316 CA GLU A 22 12.586 -4.853 -5.555 1.00 34.23 C ATOM 317 C GLU A 22 13.089 -5.866 -4.511 1.00 44.33 C ATOM 318 O GLU A 22 13.296 -7.034 -4.835 1.00 45.11 O ATOM 319 CB GLU A 22 13.773 -4.300 -6.391 1.00 30.45 C ATOM 320 CG GLU A 22 13.422 -3.036 -7.199 1.00 53.12 C ATOM 321 CD GLU A 22 14.384 -2.661 -8.340 1.00 74.10 C ATOM 322 OE1 GLU A 22 15.622 -2.771 -8.170 1.00 50.52 O ATOM 323 OE2 GLU A 22 13.898 -2.104 -9.357 1.00 12.22 O ATOM 0 H GLU A 22 12.222 -2.860 -5.082 1.00 12.15 H new ATOM 0 HA GLU A 22 11.911 -5.371 -6.236 1.00 34.23 H new ATOM 0 HB2 GLU A 22 14.604 -4.075 -5.722 1.00 30.45 H new ATOM 0 HB3 GLU A 22 14.117 -5.075 -7.076 1.00 30.45 H new ATOM 0 HG2 GLU A 22 12.426 -3.167 -7.622 1.00 53.12 H new ATOM 0 HG3 GLU A 22 13.367 -2.194 -6.509 1.00 53.12 H new ATOM 328 N LYS A 23 13.280 -5.450 -3.252 1.00 72.20 N ATOM 329 CA LYS A 23 13.557 -6.345 -2.137 1.00 13.35 C ATOM 330 C LYS A 23 12.378 -7.292 -1.935 1.00 10.21 C ATOM 331 O LYS A 23 12.497 -8.487 -2.192 1.00 71.32 O ATOM 332 CB LYS A 23 13.850 -5.528 -0.864 1.00 64.21 C ATOM 333 CG LYS A 23 15.259 -5.711 -0.296 1.00 45.43 C ATOM 334 CD LYS A 23 16.290 -4.766 -0.934 1.00 72.04 C ATOM 335 CE LYS A 23 16.742 -5.215 -2.327 1.00 24.02 C ATOM 336 NZ LYS A 23 17.550 -6.447 -2.249 1.00 22.01 N ATOM 0 H LYS A 23 13.244 -4.467 -2.983 1.00 72.20 H new ATOM 0 HA LYS A 23 14.440 -6.944 -2.358 1.00 13.35 H new ATOM 0 HB2 LYS A 23 13.696 -4.471 -1.083 1.00 64.21 H new ATOM 0 HB3 LYS A 23 13.126 -5.803 -0.097 1.00 64.21 H new ATOM 0 HG2 LYS A 23 15.236 -5.541 0.780 1.00 45.43 H new ATOM 0 HG3 LYS A 23 15.576 -6.743 -0.449 1.00 45.43 H new ATOM 0 HD2 LYS A 23 15.862 -3.766 -1.003 1.00 72.04 H new ATOM 0 HD3 LYS A 23 17.161 -4.696 -0.282 1.00 72.04 H new ATOM 0 HE2 LYS A 23 15.870 -5.387 -2.958 1.00 24.02 H new ATOM 0 HE3 LYS A 23 17.325 -4.423 -2.797 1.00 24.02 H new ATOM 0 HZ1 LYS A 23 18.051 -6.591 -3.149 1.00 22.01 H new ATOM 0 HZ2 LYS A 23 18.242 -6.360 -1.477 1.00 22.01 H new ATOM 0 HZ3 LYS A 23 16.927 -7.260 -2.066 1.00 22.01 H new ATOM 346 N ILE A 24 11.246 -6.747 -1.486 1.00 25.13 N ATOM 347 CA ILE A 24 10.128 -7.516 -0.962 1.00 13.25 C ATOM 348 C ILE A 24 9.571 -8.422 -2.057 1.00 42.50 C ATOM 349 O ILE A 24 9.228 -9.568 -1.771 1.00 2.22 O ATOM 350 CB ILE A 24 9.079 -6.537 -0.380 1.00 33.14 C ATOM 351 CG1 ILE A 24 9.674 -5.796 0.838 1.00 74.00 C ATOM 352 CG2 ILE A 24 7.787 -7.244 0.064 1.00 43.31 C ATOM 353 CD1 ILE A 24 8.859 -4.574 1.255 1.00 73.44 C ATOM 0 H ILE A 24 11.083 -5.740 -1.478 1.00 25.13 H new ATOM 0 HA ILE A 24 10.444 -8.172 -0.151 1.00 13.25 H new ATOM 0 HB ILE A 24 8.825 -5.840 -1.179 1.00 33.14 H new ATOM 0 HG12 ILE A 24 9.738 -6.486 1.679 1.00 74.00 H new ATOM 0 HG13 ILE A 24 10.692 -5.483 0.604 1.00 74.00 H new ATOM 0 HG21 ILE A 24 7.089 -6.509 0.463 1.00 43.31 H new ATOM 0 HG22 ILE A 24 7.335 -7.747 -0.791 1.00 43.31 H new ATOM 0 HG23 ILE A 24 8.021 -7.978 0.835 1.00 43.31 H new ATOM 0 HD11 ILE A 24 9.330 -4.099 2.115 1.00 73.44 H new ATOM 0 HD12 ILE A 24 8.816 -3.866 0.428 1.00 73.44 H new ATOM 0 HD13 ILE A 24 7.848 -4.884 1.520 1.00 73.44 H new ATOM 364 N ASN A 25 9.524 -7.957 -3.311 1.00 74.13 N ATOM 365 CA ASN A 25 9.031 -8.794 -4.403 1.00 13.45 C ATOM 366 C ASN A 25 9.839 -10.090 -4.554 1.00 34.15 C ATOM 367 O ASN A 25 9.284 -11.120 -4.927 1.00 32.24 O ATOM 368 CB ASN A 25 9.027 -8.025 -5.732 1.00 21.05 C ATOM 369 CG ASN A 25 8.373 -8.848 -6.841 1.00 74.31 C ATOM 370 OD1 ASN A 25 8.893 -8.909 -7.954 1.00 5.43 O ATOM 371 ND2 ASN A 25 7.233 -9.476 -6.576 1.00 70.32 N ATOM 0 H ASN A 25 9.817 -7.020 -3.589 1.00 74.13 H new ATOM 0 HA ASN A 25 8.007 -9.066 -4.145 1.00 13.45 H new ATOM 0 HB2 ASN A 25 8.492 -7.084 -5.609 1.00 21.05 H new ATOM 0 HB3 ASN A 25 10.050 -7.776 -6.015 1.00 21.05 H new ATOM 0 HD21 ASN A 25 6.771 -10.023 -7.303 1.00 70.32 H new ATOM 0 HD22 ASN A 25 6.820 -9.412 -5.646 1.00 70.32 H new ATOM 377 N SER A 26 11.127 -10.042 -4.224 1.00 24.14 N ATOM 378 CA SER A 26 12.049 -11.160 -4.252 1.00 3.11 C ATOM 379 C SER A 26 12.208 -11.843 -2.884 1.00 22.03 C ATOM 380 O SER A 26 13.091 -12.692 -2.773 1.00 24.21 O ATOM 381 CB SER A 26 13.396 -10.644 -4.768 1.00 12.43 C ATOM 382 OG SER A 26 13.366 -10.399 -6.162 1.00 61.33 O ATOM 0 H SER A 26 11.572 -9.177 -3.916 1.00 24.14 H new ATOM 0 HA SER A 26 11.648 -11.928 -4.914 1.00 3.11 H new ATOM 0 HB2 SER A 26 13.659 -9.726 -4.243 1.00 12.43 H new ATOM 0 HB3 SER A 26 14.175 -11.373 -4.544 1.00 12.43 H new ATOM 0 HG SER A 26 14.241 -10.070 -6.455 1.00 61.33 H new ATOM 387 N GLU A 27 11.428 -11.515 -1.848 1.00 63.43 N ATOM 388 CA GLU A 27 11.415 -12.262 -0.588 1.00 14.53 C ATOM 389 C GLU A 27 10.037 -12.880 -0.293 1.00 71.13 C ATOM 390 O GLU A 27 9.951 -13.823 0.501 1.00 65.44 O ATOM 391 CB GLU A 27 11.826 -11.351 0.574 1.00 51.54 C ATOM 392 CG GLU A 27 13.274 -10.830 0.551 1.00 54.43 C ATOM 393 CD GLU A 27 14.399 -11.872 0.729 1.00 62.24 C ATOM 394 OE1 GLU A 27 14.226 -12.971 1.308 1.00 2.21 O ATOM 395 OE2 GLU A 27 15.535 -11.578 0.282 1.00 23.44 O ATOM 0 H GLU A 27 10.787 -10.722 -1.861 1.00 63.43 H new ATOM 0 HA GLU A 27 12.132 -13.076 -0.692 1.00 14.53 H new ATOM 0 HB2 GLU A 27 11.154 -10.493 0.591 1.00 51.54 H new ATOM 0 HB3 GLU A 27 11.672 -11.895 1.506 1.00 51.54 H new ATOM 0 HG2 GLU A 27 13.434 -10.318 -0.398 1.00 54.43 H new ATOM 0 HG3 GLU A 27 13.377 -10.083 1.338 1.00 54.43 H new ATOM 400 N ILE A 28 8.959 -12.378 -0.906 1.00 2.35 N ATOM 401 CA ILE A 28 7.626 -12.953 -0.787 1.00 2.04 C ATOM 402 C ILE A 28 7.496 -14.061 -1.834 1.00 63.11 C ATOM 403 O ILE A 28 8.066 -13.980 -2.929 1.00 51.14 O ATOM 404 CB ILE A 28 6.541 -11.852 -0.921 1.00 31.24 C ATOM 405 CG1 ILE A 28 6.666 -10.866 0.267 1.00 22.24 C ATOM 406 CG2 ILE A 28 5.150 -12.507 -0.936 1.00 11.03 C ATOM 407 CD1 ILE A 28 5.554 -9.808 0.357 1.00 51.04 C ATOM 0 H ILE A 28 8.994 -11.552 -1.504 1.00 2.35 H new ATOM 0 HA ILE A 28 7.475 -13.393 0.199 1.00 2.04 H new ATOM 0 HB ILE A 28 6.679 -11.301 -1.852 1.00 31.24 H new ATOM 0 HG12 ILE A 28 6.677 -11.439 1.194 1.00 22.24 H new ATOM 0 HG13 ILE A 28 7.627 -10.356 0.196 1.00 22.24 H new ATOM 0 HG21 ILE A 28 4.386 -11.736 -1.030 1.00 11.03 H new ATOM 0 HG22 ILE A 28 5.080 -13.192 -1.781 1.00 11.03 H new ATOM 0 HG23 ILE A 28 4.997 -13.058 -0.008 1.00 11.03 H new ATOM 0 HD11 ILE A 28 5.731 -9.167 1.221 1.00 51.04 H new ATOM 0 HD12 ILE A 28 5.553 -9.203 -0.550 1.00 51.04 H new ATOM 0 HD13 ILE A 28 4.589 -10.303 0.464 1.00 51.04 H new ATOM 418 N LYS A 29 6.711 -15.086 -1.510 1.00 25.25 N ATOM 419 CA LYS A 29 6.303 -16.152 -2.413 1.00 3.02 C ATOM 420 C LYS A 29 5.072 -15.723 -3.205 1.00 72.13 C ATOM 421 O LYS A 29 4.173 -15.088 -2.674 1.00 64.53 O ATOM 422 CB LYS A 29 6.047 -17.401 -1.564 1.00 51.23 C ATOM 423 CG LYS A 29 5.325 -18.571 -2.236 1.00 4.23 C ATOM 424 CD LYS A 29 6.188 -19.266 -3.290 1.00 62.11 C ATOM 425 CE LYS A 29 5.414 -19.409 -4.594 1.00 22.51 C ATOM 426 NZ LYS A 29 6.061 -20.383 -5.494 1.00 63.34 N ATOM 0 H LYS A 29 6.328 -15.198 -0.571 1.00 25.25 H new ATOM 0 HA LYS A 29 7.079 -16.374 -3.146 1.00 3.02 H new ATOM 0 HB2 LYS A 29 7.008 -17.763 -1.198 1.00 51.23 H new ATOM 0 HB3 LYS A 29 5.466 -17.102 -0.692 1.00 51.23 H new ATOM 0 HG2 LYS A 29 5.031 -19.296 -1.477 1.00 4.23 H new ATOM 0 HG3 LYS A 29 4.409 -18.208 -2.703 1.00 4.23 H new ATOM 0 HD2 LYS A 29 7.099 -18.692 -3.461 1.00 62.11 H new ATOM 0 HD3 LYS A 29 6.493 -20.249 -2.930 1.00 62.11 H new ATOM 0 HE2 LYS A 29 4.394 -19.728 -4.381 1.00 22.51 H new ATOM 0 HE3 LYS A 29 5.348 -18.440 -5.089 1.00 22.51 H new ATOM 0 HZ1 LYS A 29 5.512 -20.460 -6.374 1.00 63.34 H new ATOM 0 HZ2 LYS A 29 7.026 -20.064 -5.714 1.00 63.34 H new ATOM 0 HZ3 LYS A 29 6.101 -21.312 -5.029 1.00 63.34 H new ATOM 436 N ASP A 30 5.072 -16.087 -4.486 1.00 44.31 N ATOM 437 CA ASP A 30 3.992 -15.893 -5.478 1.00 22.11 C ATOM 438 C ASP A 30 3.341 -14.495 -5.492 1.00 41.41 C ATOM 439 O ASP A 30 2.192 -14.335 -5.923 1.00 23.14 O ATOM 440 CB ASP A 30 2.984 -17.052 -5.535 1.00 11.34 C ATOM 441 CG ASP A 30 2.113 -17.242 -4.297 1.00 15.15 C ATOM 442 OD1 ASP A 30 1.464 -16.276 -3.848 1.00 44.43 O ATOM 443 OD2 ASP A 30 2.010 -18.398 -3.815 1.00 5.21 O ATOM 0 H ASP A 30 5.878 -16.559 -4.896 1.00 44.31 H new ATOM 0 HA ASP A 30 4.522 -15.925 -6.430 1.00 22.11 H new ATOM 0 HB2 ASP A 30 2.331 -16.898 -6.394 1.00 11.34 H new ATOM 0 HB3 ASP A 30 3.533 -17.976 -5.714 1.00 11.34 H new ATOM 447 N SER A 31 4.089 -13.455 -5.140 1.00 11.42 N ATOM 448 CA SER A 31 3.629 -12.070 -5.166 1.00 43.34 C ATOM 449 C SER A 31 3.426 -11.512 -6.587 1.00 64.22 C ATOM 450 O SER A 31 3.744 -12.155 -7.595 1.00 44.30 O ATOM 451 CB SER A 31 4.616 -11.205 -4.370 1.00 14.12 C ATOM 452 OG SER A 31 3.999 -10.781 -3.177 1.00 54.33 O ATOM 0 H SER A 31 5.053 -13.553 -4.822 1.00 11.42 H new ATOM 0 HA SER A 31 2.642 -12.043 -4.705 1.00 43.34 H new ATOM 0 HB2 SER A 31 5.518 -11.774 -4.145 1.00 14.12 H new ATOM 0 HB3 SER A 31 4.922 -10.343 -4.962 1.00 14.12 H new ATOM 0 HG SER A 31 3.299 -10.128 -3.385 1.00 54.33 H new ATOM 457 N GLU A 32 2.964 -10.262 -6.653 1.00 75.03 N ATOM 458 CA GLU A 32 3.026 -9.355 -7.796 1.00 12.22 C ATOM 459 C GLU A 32 3.753 -8.069 -7.360 1.00 21.43 C ATOM 460 O GLU A 32 4.143 -7.949 -6.198 1.00 65.12 O ATOM 461 CB GLU A 32 1.603 -9.057 -8.314 1.00 62.00 C ATOM 462 CG GLU A 32 1.309 -9.691 -9.684 1.00 44.30 C ATOM 463 CD GLU A 32 0.693 -11.086 -9.593 1.00 33.24 C ATOM 464 OE1 GLU A 32 -0.223 -11.300 -8.771 1.00 34.13 O ATOM 465 OE2 GLU A 32 0.999 -11.963 -10.441 1.00 1.55 O ATOM 0 H GLU A 32 2.505 -9.828 -5.852 1.00 75.03 H new ATOM 0 HA GLU A 32 3.579 -9.812 -8.616 1.00 12.22 H new ATOM 0 HB2 GLU A 32 0.876 -9.422 -7.589 1.00 62.00 H new ATOM 0 HB3 GLU A 32 1.468 -7.978 -8.384 1.00 62.00 H new ATOM 0 HG2 GLU A 32 0.633 -9.040 -10.239 1.00 44.30 H new ATOM 0 HG3 GLU A 32 2.236 -9.749 -10.255 1.00 44.30 H new ATOM 470 N LEU A 33 3.945 -7.120 -8.282 1.00 12.32 N ATOM 471 CA LEU A 33 4.676 -5.870 -8.102 1.00 31.42 C ATOM 472 C LEU A 33 4.007 -4.804 -8.980 1.00 31.15 C ATOM 473 O LEU A 33 3.951 -4.997 -10.193 1.00 22.02 O ATOM 474 CB LEU A 33 6.150 -6.111 -8.520 1.00 22.41 C ATOM 475 CG LEU A 33 7.000 -4.835 -8.682 1.00 3.54 C ATOM 476 CD1 LEU A 33 7.152 -4.113 -7.349 1.00 45.43 C ATOM 477 CD2 LEU A 33 8.414 -5.135 -9.192 1.00 23.04 C ATOM 0 H LEU A 33 3.571 -7.213 -9.227 1.00 12.32 H new ATOM 0 HA LEU A 33 4.662 -5.530 -7.067 1.00 31.42 H new ATOM 0 HB2 LEU A 33 6.623 -6.752 -7.776 1.00 22.41 H new ATOM 0 HB3 LEU A 33 6.159 -6.658 -9.463 1.00 22.41 H new ATOM 0 HG LEU A 33 6.471 -4.218 -9.409 1.00 3.54 H new ATOM 0 HD11 LEU A 33 7.755 -3.216 -7.488 1.00 45.43 H new ATOM 0 HD12 LEU A 33 6.168 -3.834 -6.972 1.00 45.43 H new ATOM 0 HD13 LEU A 33 7.641 -4.772 -6.632 1.00 45.43 H new ATOM 0 HD21 LEU A 33 8.971 -4.203 -9.289 1.00 23.04 H new ATOM 0 HD22 LEU A 33 8.924 -5.791 -8.486 1.00 23.04 H new ATOM 0 HD23 LEU A 33 8.354 -5.624 -10.164 1.00 23.04 H new ATOM 488 N LYS A 34 3.494 -3.704 -8.413 1.00 15.55 N ATOM 489 CA LYS A 34 2.933 -2.566 -9.161 1.00 43.11 C ATOM 490 C LYS A 34 3.469 -1.251 -8.590 1.00 22.15 C ATOM 491 O LYS A 34 4.088 -1.251 -7.524 1.00 15.53 O ATOM 492 CB LYS A 34 1.396 -2.576 -9.065 1.00 13.54 C ATOM 493 CG LYS A 34 0.682 -3.808 -9.641 1.00 42.52 C ATOM 494 CD LYS A 34 0.855 -3.947 -11.156 1.00 62.13 C ATOM 495 CE LYS A 34 -0.022 -5.091 -11.673 1.00 0.23 C ATOM 496 NZ LYS A 34 0.535 -5.685 -12.902 1.00 20.35 N ATOM 0 H LYS A 34 3.456 -3.576 -7.402 1.00 15.55 H new ATOM 0 HA LYS A 34 3.229 -2.655 -10.206 1.00 43.11 H new ATOM 0 HB2 LYS A 34 1.119 -2.481 -8.015 1.00 13.54 H new ATOM 0 HB3 LYS A 34 1.016 -1.691 -9.576 1.00 13.54 H new ATOM 0 HG2 LYS A 34 1.066 -4.704 -9.153 1.00 42.52 H new ATOM 0 HG3 LYS A 34 -0.381 -3.748 -9.406 1.00 42.52 H new ATOM 0 HD2 LYS A 34 0.582 -3.015 -11.650 1.00 62.13 H new ATOM 0 HD3 LYS A 34 1.900 -4.140 -11.396 1.00 62.13 H new ATOM 0 HE2 LYS A 34 -0.111 -5.859 -10.904 1.00 0.23 H new ATOM 0 HE3 LYS A 34 -1.028 -4.720 -11.870 1.00 0.23 H new ATOM 0 HZ1 LYS A 34 -0.083 -6.456 -13.226 1.00 20.35 H new ATOM 0 HZ2 LYS A 34 0.597 -4.957 -13.642 1.00 20.35 H new ATOM 0 HZ3 LYS A 34 1.485 -6.061 -12.706 1.00 20.35 H new ATOM 506 N GLU A 35 3.195 -0.117 -9.237 1.00 74.01 N ATOM 507 CA GLU A 35 3.539 1.212 -8.741 1.00 23.04 C ATOM 508 C GLU A 35 2.429 2.218 -9.055 1.00 74.23 C ATOM 509 O GLU A 35 1.662 2.020 -9.996 1.00 51.12 O ATOM 510 CB GLU A 35 4.882 1.679 -9.323 1.00 32.11 C ATOM 511 CG GLU A 35 4.885 1.873 -10.845 1.00 51.23 C ATOM 512 CD GLU A 35 4.950 0.549 -11.619 1.00 21.44 C ATOM 513 OE1 GLU A 35 6.068 0.002 -11.757 1.00 71.14 O ATOM 514 OE2 GLU A 35 3.930 0.109 -12.195 1.00 71.32 O ATOM 0 H GLU A 35 2.718 -0.099 -10.138 1.00 74.01 H new ATOM 0 HA GLU A 35 3.641 1.152 -7.657 1.00 23.04 H new ATOM 0 HB2 GLU A 35 5.161 2.620 -8.849 1.00 32.11 H new ATOM 0 HB3 GLU A 35 5.650 0.951 -9.061 1.00 32.11 H new ATOM 0 HG2 GLU A 35 3.986 2.415 -11.138 1.00 51.23 H new ATOM 0 HG3 GLU A 35 5.737 2.493 -11.125 1.00 51.23 H new ATOM 519 N VAL A 36 2.356 3.318 -8.298 1.00 55.12 N ATOM 520 CA VAL A 36 1.206 4.223 -8.327 1.00 22.13 C ATOM 521 C VAL A 36 1.661 5.683 -8.355 1.00 21.23 C ATOM 522 O VAL A 36 1.893 6.272 -7.296 1.00 63.24 O ATOM 523 CB VAL A 36 0.281 3.938 -7.126 1.00 12.51 C ATOM 524 CG1 VAL A 36 -1.077 4.610 -7.387 1.00 15.24 C ATOM 525 CG2 VAL A 36 0.059 2.442 -6.877 1.00 72.13 C ATOM 0 H VAL A 36 3.091 3.604 -7.651 1.00 55.12 H new ATOM 0 HA VAL A 36 0.639 4.045 -9.241 1.00 22.13 H new ATOM 0 HB VAL A 36 0.766 4.339 -6.236 1.00 12.51 H new ATOM 0 HG11 VAL A 36 -1.745 4.419 -6.547 1.00 15.24 H new ATOM 0 HG12 VAL A 36 -0.935 5.685 -7.501 1.00 15.24 H new ATOM 0 HG13 VAL A 36 -1.515 4.203 -8.299 1.00 15.24 H new ATOM 0 HG21 VAL A 36 -0.600 2.310 -6.019 1.00 72.13 H new ATOM 0 HG22 VAL A 36 -0.397 1.990 -7.758 1.00 72.13 H new ATOM 0 HG23 VAL A 36 1.016 1.961 -6.677 1.00 72.13 H new ATOM 535 N LYS A 37 1.826 6.270 -9.544 1.00 73.10 N ATOM 536 CA LYS A 37 2.230 7.675 -9.685 1.00 71.10 C ATOM 537 C LYS A 37 1.016 8.606 -9.728 1.00 62.03 C ATOM 538 O LYS A 37 -0.121 8.136 -9.762 1.00 75.01 O ATOM 539 CB LYS A 37 3.139 7.864 -10.909 1.00 53.54 C ATOM 540 CG LYS A 37 4.389 6.965 -10.880 1.00 63.23 C ATOM 541 CD LYS A 37 4.363 5.825 -11.912 1.00 55.14 C ATOM 542 CE LYS A 37 5.153 6.175 -13.181 1.00 51.21 C ATOM 543 NZ LYS A 37 4.530 7.254 -13.974 1.00 22.05 N ATOM 0 H LYS A 37 1.685 5.789 -10.432 1.00 73.10 H new ATOM 0 HA LYS A 37 2.808 7.948 -8.802 1.00 71.10 H new ATOM 0 HB2 LYS A 37 2.568 7.653 -11.813 1.00 53.54 H new ATOM 0 HB3 LYS A 37 3.451 8.907 -10.965 1.00 53.54 H new ATOM 0 HG2 LYS A 37 5.271 7.581 -11.056 1.00 63.23 H new ATOM 0 HG3 LYS A 37 4.493 6.537 -9.883 1.00 63.23 H new ATOM 0 HD2 LYS A 37 4.779 4.922 -11.464 1.00 55.14 H new ATOM 0 HD3 LYS A 37 3.330 5.602 -12.179 1.00 55.14 H new ATOM 0 HE2 LYS A 37 6.163 6.475 -12.902 1.00 51.21 H new ATOM 0 HE3 LYS A 37 5.245 5.284 -13.801 1.00 51.21 H new ATOM 0 HZ1 LYS A 37 5.109 7.444 -14.817 1.00 22.05 H new ATOM 0 HZ2 LYS A 37 3.576 6.962 -14.268 1.00 22.05 H new ATOM 0 HZ3 LYS A 37 4.465 8.116 -13.396 1.00 22.05 H new ATOM 553 N VAL A 38 1.276 9.917 -9.728 1.00 11.31 N ATOM 554 CA VAL A 38 0.293 11.000 -9.695 1.00 60.23 C ATOM 555 C VAL A 38 0.365 11.783 -11.017 1.00 4.24 C ATOM 556 O VAL A 38 0.924 11.280 -11.992 1.00 62.44 O ATOM 557 CB VAL A 38 0.501 11.869 -8.428 1.00 43.31 C ATOM 558 CG1 VAL A 38 0.274 11.057 -7.146 1.00 21.02 C ATOM 559 CG2 VAL A 38 1.882 12.529 -8.335 1.00 72.32 C ATOM 0 H VAL A 38 2.233 10.269 -9.752 1.00 11.31 H new ATOM 0 HA VAL A 38 -0.721 10.608 -9.618 1.00 60.23 H new ATOM 0 HB VAL A 38 -0.242 12.661 -8.523 1.00 43.31 H new ATOM 0 HG11 VAL A 38 0.428 11.697 -6.278 1.00 21.02 H new ATOM 0 HG12 VAL A 38 -0.745 10.671 -7.136 1.00 21.02 H new ATOM 0 HG13 VAL A 38 0.978 10.225 -7.113 1.00 21.02 H new ATOM 0 HG21 VAL A 38 1.943 13.118 -7.420 1.00 72.32 H new ATOM 0 HG22 VAL A 38 2.653 11.759 -8.323 1.00 72.32 H new ATOM 0 HG23 VAL A 38 2.033 13.180 -9.196 1.00 72.32 H new ATOM 569 N SER A 39 -0.218 12.984 -11.093 1.00 73.10 N ATOM 570 CA SER A 39 -0.015 13.904 -12.208 1.00 44.13 C ATOM 571 C SER A 39 1.437 14.411 -12.250 1.00 14.55 C ATOM 572 O SER A 39 2.333 13.858 -11.606 1.00 42.40 O ATOM 573 CB SER A 39 -1.029 15.037 -12.128 1.00 42.32 C ATOM 574 OG SER A 39 -1.291 15.553 -13.418 1.00 12.14 O ATOM 0 H SER A 39 -0.848 13.344 -10.376 1.00 73.10 H new ATOM 0 HA SER A 39 -0.180 13.376 -13.147 1.00 44.13 H new ATOM 0 HB2 SER A 39 -1.954 14.675 -11.679 1.00 42.32 H new ATOM 0 HB3 SER A 39 -0.649 15.829 -11.482 1.00 42.32 H new ATOM 0 HG SER A 39 -1.946 16.279 -13.353 1.00 12.14 H new ATOM 579 N GLU A 40 1.677 15.464 -13.022 1.00 24.01 N ATOM 580 CA GLU A 40 2.910 16.230 -12.973 1.00 52.34 C ATOM 581 C GLU A 40 2.608 17.615 -12.408 1.00 24.22 C ATOM 582 O GLU A 40 1.495 18.137 -12.560 1.00 75.30 O ATOM 583 CB GLU A 40 3.568 16.237 -14.356 1.00 55.51 C ATOM 584 CG GLU A 40 2.859 17.114 -15.394 1.00 4.51 C ATOM 585 CD GLU A 40 3.544 16.966 -16.754 1.00 15.53 C ATOM 586 OE1 GLU A 40 3.179 16.036 -17.519 1.00 33.23 O ATOM 587 OE2 GLU A 40 4.499 17.723 -17.036 1.00 14.21 O ATOM 0 H GLU A 40 1.008 15.813 -13.709 1.00 24.01 H new ATOM 0 HA GLU A 40 3.640 15.775 -12.303 1.00 52.34 H new ATOM 0 HB2 GLU A 40 4.598 16.579 -14.253 1.00 55.51 H new ATOM 0 HB3 GLU A 40 3.608 15.214 -14.730 1.00 55.51 H new ATOM 0 HG2 GLU A 40 1.811 16.826 -15.472 1.00 4.51 H new ATOM 0 HG3 GLU A 40 2.880 18.157 -15.078 1.00 4.51 H new ATOM 592 N GLY A 41 3.600 18.215 -11.749 1.00 51.51 N ATOM 593 CA GLY A 41 3.442 19.503 -11.092 1.00 72.30 C ATOM 594 C GLY A 41 2.582 19.425 -9.827 1.00 61.32 C ATOM 595 O GLY A 41 2.023 20.448 -9.426 1.00 11.51 O ATOM 0 H GLY A 41 4.535 17.817 -11.658 1.00 51.51 H new ATOM 0 HA2 GLY A 41 4.425 19.896 -10.833 1.00 72.30 H new ATOM 0 HA3 GLY A 41 2.990 20.208 -11.790 1.00 72.30 H new ATOM 599 N THR A 42 2.433 18.253 -9.198 1.00 52.32 N ATOM 600 CA THR A 42 1.645 18.118 -7.986 1.00 43.30 C ATOM 601 C THR A 42 2.450 18.726 -6.835 1.00 63.24 C ATOM 602 O THR A 42 1.904 19.483 -6.043 1.00 24.35 O ATOM 603 CB THR A 42 1.293 16.636 -7.742 1.00 52.53 C ATOM 604 OG1 THR A 42 0.792 16.017 -8.918 1.00 21.13 O ATOM 605 CG2 THR A 42 0.236 16.462 -6.646 1.00 14.31 C ATOM 0 H THR A 42 2.856 17.382 -9.519 1.00 52.32 H new ATOM 0 HA THR A 42 0.697 18.649 -8.071 1.00 43.30 H new ATOM 0 HB THR A 42 2.226 16.165 -7.432 1.00 52.53 H new ATOM 0 HG1 THR A 42 0.581 15.079 -8.729 1.00 21.13 H new ATOM 0 HG21 THR A 42 0.022 15.402 -6.512 1.00 14.31 H new ATOM 0 HG22 THR A 42 0.610 16.878 -5.711 1.00 14.31 H new ATOM 0 HG23 THR A 42 -0.677 16.982 -6.935 1.00 14.31 H new ATOM 613 N PHE A 43 3.747 18.413 -6.731 1.00 73.24 N ATOM 614 CA PHE A 43 4.577 18.821 -5.607 1.00 35.24 C ATOM 615 C PHE A 43 6.052 18.907 -5.938 1.00 50.13 C ATOM 616 O PHE A 43 6.518 18.313 -6.912 1.00 34.23 O ATOM 617 CB PHE A 43 4.343 17.911 -4.408 1.00 34.24 C ATOM 618 CG PHE A 43 4.031 16.481 -4.742 1.00 54.44 C ATOM 619 CD1 PHE A 43 4.897 15.745 -5.559 1.00 4.35 C ATOM 620 CD2 PHE A 43 2.816 15.939 -4.312 1.00 52.34 C ATOM 621 CE1 PHE A 43 4.571 14.431 -5.926 1.00 1.12 C ATOM 622 CE2 PHE A 43 2.484 14.620 -4.676 1.00 14.53 C ATOM 623 CZ PHE A 43 3.378 13.857 -5.451 1.00 34.44 C ATOM 0 H PHE A 43 4.247 17.866 -7.432 1.00 73.24 H new ATOM 0 HA PHE A 43 4.268 19.835 -5.355 1.00 35.24 H new ATOM 0 HB2 PHE A 43 5.231 17.934 -3.776 1.00 34.24 H new ATOM 0 HB3 PHE A 43 3.521 18.317 -3.819 1.00 34.24 H new ATOM 0 HD1 PHE A 43 5.818 16.189 -5.907 1.00 4.35 H new ATOM 0 HD2 PHE A 43 2.140 16.525 -3.708 1.00 52.34 H new ATOM 0 HE1 PHE A 43 5.230 13.865 -6.568 1.00 1.12 H new ATOM 0 HE2 PHE A 43 1.543 14.193 -4.361 1.00 14.53 H new ATOM 0 HZ PHE A 43 3.147 12.827 -5.682 1.00 34.44 H new ATOM 632 N ASP A 44 6.794 19.575 -5.059 1.00 1.42 N ATOM 633 CA ASP A 44 8.223 19.814 -5.190 1.00 24.03 C ATOM 634 C ASP A 44 8.954 18.892 -4.210 1.00 54.23 C ATOM 635 O ASP A 44 8.379 17.886 -3.778 1.00 2.41 O ATOM 636 CB ASP A 44 8.506 21.312 -4.994 1.00 13.15 C ATOM 637 CG ASP A 44 9.596 21.740 -5.977 1.00 31.31 C ATOM 638 OD1 ASP A 44 10.789 21.597 -5.624 1.00 30.31 O ATOM 639 OD2 ASP A 44 9.252 22.149 -7.116 1.00 32.35 O ATOM 0 H ASP A 44 6.401 19.977 -4.208 1.00 1.42 H new ATOM 0 HA ASP A 44 8.595 19.572 -6.185 1.00 24.03 H new ATOM 0 HB2 ASP A 44 7.599 21.892 -5.160 1.00 13.15 H new ATOM 0 HB3 ASP A 44 8.825 21.505 -3.970 1.00 13.15 H new ATOM 643 N ALA A 45 10.201 19.189 -3.850 1.00 54.22 N ATOM 644 CA ALA A 45 10.964 18.432 -2.856 1.00 5.34 C ATOM 645 C ALA A 45 11.317 19.297 -1.638 1.00 64.21 C ATOM 646 O ALA A 45 12.239 18.967 -0.889 1.00 41.32 O ATOM 647 CB ALA A 45 12.176 17.799 -3.539 1.00 11.25 C ATOM 0 H ALA A 45 10.719 19.974 -4.246 1.00 54.22 H new ATOM 0 HA ALA A 45 10.355 17.623 -2.453 1.00 5.34 H new ATOM 0 HB1 ALA A 45 12.752 17.232 -2.807 1.00 11.25 H new ATOM 0 HB2 ALA A 45 11.839 17.131 -4.332 1.00 11.25 H new ATOM 0 HB3 ALA A 45 12.803 18.582 -3.966 1.00 11.25 H new ATOM 653 N ASP A 46 10.579 20.391 -1.443 1.00 62.20 N ATOM 654 CA ASP A 46 10.850 21.432 -0.462 1.00 2.45 C ATOM 655 C ASP A 46 10.491 20.960 0.963 1.00 43.34 C ATOM 656 O ASP A 46 10.421 19.759 1.239 1.00 14.51 O ATOM 657 CB ASP A 46 10.102 22.710 -0.897 1.00 2.45 C ATOM 658 CG ASP A 46 10.884 23.965 -0.516 1.00 41.43 C ATOM 659 OD1 ASP A 46 11.142 24.128 0.688 1.00 5.11 O ATOM 660 OD2 ASP A 46 11.212 24.789 -1.404 1.00 41.44 O ATOM 0 H ASP A 46 9.740 20.580 -1.991 1.00 62.20 H new ATOM 0 HA ASP A 46 11.915 21.659 -0.424 1.00 2.45 H new ATOM 0 HB2 ASP A 46 9.942 22.692 -1.975 1.00 2.45 H new ATOM 0 HB3 ASP A 46 9.118 22.736 -0.429 1.00 2.45 H new ATOM 664 N MET A 47 10.302 21.887 1.902 1.00 41.54 N ATOM 665 CA MET A 47 9.816 21.631 3.246 1.00 43.10 C ATOM 666 C MET A 47 8.694 22.590 3.656 1.00 61.32 C ATOM 667 O MET A 47 7.918 22.237 4.541 1.00 32.23 O ATOM 668 CB MET A 47 10.993 21.686 4.233 1.00 63.04 C ATOM 669 CG MET A 47 11.507 23.107 4.512 1.00 13.53 C ATOM 670 SD MET A 47 12.977 23.182 5.571 1.00 30.45 S ATOM 671 CE MET A 47 14.232 22.775 4.331 1.00 72.02 C ATOM 0 H MET A 47 10.493 22.875 1.734 1.00 41.54 H new ATOM 0 HA MET A 47 9.378 20.633 3.265 1.00 43.10 H new ATOM 0 HB2 MET A 47 10.686 21.230 5.174 1.00 63.04 H new ATOM 0 HB3 MET A 47 11.813 21.085 3.840 1.00 63.04 H new ATOM 0 HG2 MET A 47 11.735 23.590 3.562 1.00 13.53 H new ATOM 0 HG3 MET A 47 10.708 23.683 4.979 1.00 13.53 H new ATOM 0 HE1 MET A 47 14.947 22.070 4.755 1.00 72.02 H new ATOM 0 HE2 MET A 47 13.752 22.326 3.461 1.00 72.02 H new ATOM 0 HE3 MET A 47 14.753 23.683 4.029 1.00 72.02 H new ATOM 679 N TYR A 48 8.579 23.780 3.051 1.00 62.23 N ATOM 680 CA TYR A 48 7.467 24.699 3.289 1.00 72.41 C ATOM 681 C TYR A 48 6.479 24.633 2.125 1.00 73.30 C ATOM 682 O TYR A 48 5.287 24.484 2.371 1.00 25.41 O ATOM 683 CB TYR A 48 7.967 26.129 3.559 1.00 45.13 C ATOM 684 CG TYR A 48 9.005 26.638 2.581 1.00 61.33 C ATOM 685 CD1 TYR A 48 8.610 27.182 1.345 1.00 62.03 C ATOM 686 CD2 TYR A 48 10.371 26.476 2.874 1.00 21.43 C ATOM 687 CE1 TYR A 48 9.571 27.422 0.349 1.00 10.31 C ATOM 688 CE2 TYR A 48 11.341 26.751 1.900 1.00 74.22 C ATOM 689 CZ TYR A 48 10.932 27.149 0.609 1.00 23.33 C ATOM 690 OH TYR A 48 11.841 27.220 -0.391 1.00 14.53 O ATOM 0 H TYR A 48 9.261 24.131 2.379 1.00 62.23 H new ATOM 0 HA TYR A 48 6.939 24.389 4.191 1.00 72.41 H new ATOM 0 HB2 TYR A 48 7.113 26.806 3.544 1.00 45.13 H new ATOM 0 HB3 TYR A 48 8.387 26.168 4.564 1.00 45.13 H new ATOM 0 HD1 TYR A 48 7.571 27.414 1.163 1.00 62.03 H new ATOM 0 HD2 TYR A 48 10.674 26.138 3.854 1.00 21.43 H new ATOM 0 HE1 TYR A 48 9.270 27.814 -0.612 1.00 10.31 H new ATOM 0 HE2 TYR A 48 12.391 26.659 2.135 1.00 74.22 H new ATOM 0 HH TYR A 48 11.856 26.371 -0.880 1.00 14.53 H new ATOM 699 N LYS A 49 6.941 24.664 0.864 1.00 54.53 N ATOM 700 CA LYS A 49 6.052 24.718 -0.305 1.00 11.41 C ATOM 701 C LYS A 49 5.083 23.539 -0.283 1.00 44.14 C ATOM 702 O LYS A 49 3.875 23.697 -0.457 1.00 40.40 O ATOM 703 CB LYS A 49 6.899 24.730 -1.595 1.00 4.42 C ATOM 704 CG LYS A 49 6.075 24.988 -2.869 1.00 53.53 C ATOM 705 CD LYS A 49 6.004 26.474 -3.250 1.00 22.22 C ATOM 706 CE LYS A 49 4.843 26.697 -4.230 1.00 40.13 C ATOM 707 NZ LYS A 49 4.499 28.123 -4.409 1.00 43.54 N ATOM 0 H LYS A 49 7.933 24.652 0.629 1.00 54.53 H new ATOM 0 HA LYS A 49 5.460 25.633 -0.275 1.00 11.41 H new ATOM 0 HB2 LYS A 49 7.668 25.497 -1.508 1.00 4.42 H new ATOM 0 HB3 LYS A 49 7.413 23.773 -1.692 1.00 4.42 H new ATOM 0 HG2 LYS A 49 6.511 24.427 -3.696 1.00 53.53 H new ATOM 0 HG3 LYS A 49 5.064 24.608 -2.724 1.00 53.53 H new ATOM 0 HD2 LYS A 49 5.862 27.083 -2.357 1.00 22.22 H new ATOM 0 HD3 LYS A 49 6.943 26.789 -3.705 1.00 22.22 H new ATOM 0 HE2 LYS A 49 5.105 26.269 -5.197 1.00 40.13 H new ATOM 0 HE3 LYS A 49 3.965 26.160 -3.871 1.00 40.13 H new ATOM 0 HZ1 LYS A 49 3.710 28.208 -5.081 1.00 43.54 H new ATOM 0 HZ2 LYS A 49 4.220 28.530 -3.494 1.00 43.54 H new ATOM 0 HZ3 LYS A 49 5.325 28.636 -4.779 1.00 43.54 H new ATOM 717 N THR A 50 5.607 22.342 -0.055 1.00 73.41 N ATOM 718 CA THR A 50 4.819 21.127 -0.051 1.00 22.35 C ATOM 719 C THR A 50 3.946 21.003 1.207 1.00 75.42 C ATOM 720 O THR A 50 2.941 20.297 1.166 1.00 14.12 O ATOM 721 CB THR A 50 5.778 19.954 -0.288 1.00 5.25 C ATOM 722 OG1 THR A 50 6.972 20.080 0.458 1.00 24.15 O ATOM 723 CG2 THR A 50 6.269 19.958 -1.739 1.00 42.53 C ATOM 0 H THR A 50 6.598 22.191 0.133 1.00 73.41 H new ATOM 0 HA THR A 50 4.086 21.135 -0.858 1.00 22.35 H new ATOM 0 HB THR A 50 5.216 19.062 -0.012 1.00 5.25 H new ATOM 0 HG1 THR A 50 7.192 19.219 0.871 1.00 24.15 H new ATOM 0 HG21 THR A 50 6.949 19.121 -1.895 1.00 42.53 H new ATOM 0 HG22 THR A 50 5.417 19.864 -2.412 1.00 42.53 H new ATOM 0 HG23 THR A 50 6.791 20.893 -1.944 1.00 42.53 H new ATOM 731 N SER A 51 4.248 21.743 2.278 1.00 33.13 N ATOM 732 CA SER A 51 3.389 21.877 3.444 1.00 25.24 C ATOM 733 C SER A 51 2.261 22.885 3.211 1.00 2.22 C ATOM 734 O SER A 51 1.435 23.054 4.107 1.00 61.40 O ATOM 735 CB SER A 51 4.225 22.273 4.665 1.00 25.34 C ATOM 736 OG SER A 51 5.121 21.226 5.003 1.00 1.25 O ATOM 0 H SER A 51 5.116 22.274 2.354 1.00 33.13 H new ATOM 0 HA SER A 51 2.921 20.910 3.628 1.00 25.24 H new ATOM 0 HB2 SER A 51 4.783 23.185 4.453 1.00 25.34 H new ATOM 0 HB3 SER A 51 3.570 22.489 5.509 1.00 25.34 H new ATOM 0 HG SER A 51 6.043 21.526 4.861 1.00 1.25 H new ATOM 741 N ASP A 52 2.190 23.536 2.044 1.00 15.41 N ATOM 742 CA ASP A 52 0.951 24.145 1.581 1.00 1.13 C ATOM 743 C ASP A 52 0.160 23.128 0.768 1.00 13.35 C ATOM 744 O ASP A 52 -1.009 22.897 1.054 1.00 33.44 O ATOM 745 CB ASP A 52 1.210 25.395 0.742 1.00 42.30 C ATOM 746 CG ASP A 52 -0.112 26.128 0.525 1.00 74.10 C ATOM 747 OD1 ASP A 52 -0.776 26.475 1.526 1.00 63.01 O ATOM 748 OD2 ASP A 52 -0.488 26.354 -0.644 1.00 42.12 O ATOM 0 H ASP A 52 2.979 23.651 1.408 1.00 15.41 H new ATOM 0 HA ASP A 52 0.378 24.451 2.456 1.00 1.13 H new ATOM 0 HB2 ASP A 52 1.924 26.046 1.246 1.00 42.30 H new ATOM 0 HB3 ASP A 52 1.651 25.121 -0.216 1.00 42.30 H new ATOM 752 N ILE A 53 0.807 22.475 -0.207 1.00 3.43 N ATOM 753 CA ILE A 53 0.161 21.547 -1.138 1.00 12.34 C ATOM 754 C ILE A 53 -0.557 20.445 -0.348 1.00 52.41 C ATOM 755 O ILE A 53 -1.748 20.203 -0.545 1.00 34.25 O ATOM 756 CB ILE A 53 1.184 20.980 -2.165 1.00 51.31 C ATOM 757 CG1 ILE A 53 1.863 22.113 -2.989 1.00 41.44 C ATOM 758 CG2 ILE A 53 0.483 20.005 -3.127 1.00 13.34 C ATOM 759 CD1 ILE A 53 3.250 21.760 -3.549 1.00 3.44 C ATOM 0 H ILE A 53 1.808 22.580 -0.371 1.00 3.43 H new ATOM 0 HA ILE A 53 -0.589 22.081 -1.722 1.00 12.34 H new ATOM 0 HB ILE A 53 1.956 20.457 -1.601 1.00 51.31 H new ATOM 0 HG12 ILE A 53 1.209 22.381 -3.819 1.00 41.44 H new ATOM 0 HG13 ILE A 53 1.956 22.997 -2.358 1.00 41.44 H new ATOM 0 HG21 ILE A 53 1.208 19.614 -3.841 1.00 13.34 H new ATOM 0 HG22 ILE A 53 0.052 19.180 -2.559 1.00 13.34 H new ATOM 0 HG23 ILE A 53 -0.308 20.529 -3.663 1.00 13.34 H new ATOM 0 HD11 ILE A 53 3.644 22.609 -4.108 1.00 3.44 H new ATOM 0 HD12 ILE A 53 3.925 21.522 -2.727 1.00 3.44 H new ATOM 0 HD13 ILE A 53 3.167 20.898 -4.210 1.00 3.44 H new ATOM 770 N ALA A 54 0.154 19.786 0.569 1.00 63.31 N ATOM 771 CA ALA A 54 -0.414 18.703 1.352 1.00 14.44 C ATOM 772 C ALA A 54 -1.448 19.195 2.371 1.00 55.44 C ATOM 773 O ALA A 54 -2.240 18.379 2.843 1.00 40.40 O ATOM 774 CB ALA A 54 0.719 17.928 2.039 1.00 51.33 C ATOM 0 H ALA A 54 1.130 19.990 0.784 1.00 63.31 H new ATOM 0 HA ALA A 54 -0.951 18.039 0.675 1.00 14.44 H new ATOM 0 HB1 ALA A 54 0.298 17.114 2.628 1.00 51.33 H new ATOM 0 HB2 ALA A 54 1.391 17.520 1.284 1.00 51.33 H new ATOM 0 HB3 ALA A 54 1.275 18.600 2.693 1.00 51.33 H new ATOM 780 N LEU A 55 -1.455 20.482 2.727 1.00 43.12 N ATOM 781 CA LEU A 55 -2.372 21.044 3.714 1.00 11.13 C ATOM 782 C LEU A 55 -3.674 21.508 3.071 1.00 62.32 C ATOM 783 O LEU A 55 -4.735 21.407 3.687 1.00 75.34 O ATOM 784 CB LEU A 55 -1.683 22.219 4.414 1.00 60.41 C ATOM 785 CG LEU A 55 -2.496 22.802 5.582 1.00 12.41 C ATOM 786 CD1 LEU A 55 -2.892 21.728 6.604 1.00 71.12 C ATOM 787 CD2 LEU A 55 -1.671 23.883 6.289 1.00 11.33 C ATOM 0 H LEU A 55 -0.814 21.170 2.331 1.00 43.12 H new ATOM 0 HA LEU A 55 -2.625 20.269 4.437 1.00 11.13 H new ATOM 0 HB2 LEU A 55 -0.712 21.891 4.786 1.00 60.41 H new ATOM 0 HB3 LEU A 55 -1.495 23.006 3.684 1.00 60.41 H new ATOM 0 HG LEU A 55 -3.411 23.225 5.166 1.00 12.41 H new ATOM 0 HD11 LEU A 55 -3.464 22.187 7.410 1.00 71.12 H new ATOM 0 HD12 LEU A 55 -3.500 20.967 6.115 1.00 71.12 H new ATOM 0 HD13 LEU A 55 -1.993 21.267 7.014 1.00 71.12 H new ATOM 0 HD21 LEU A 55 -2.247 24.297 7.117 1.00 11.33 H new ATOM 0 HD22 LEU A 55 -0.749 23.445 6.671 1.00 11.33 H new ATOM 0 HD23 LEU A 55 -1.430 24.677 5.582 1.00 11.33 H new ATOM 798 N ASP A 56 -3.593 21.985 1.830 1.00 52.51 N ATOM 799 CA ASP A 56 -4.709 22.431 1.001 1.00 24.35 C ATOM 800 C ASP A 56 -5.749 21.315 0.966 1.00 14.45 C ATOM 801 O ASP A 56 -6.933 21.502 1.259 1.00 22.34 O ATOM 802 CB ASP A 56 -4.194 22.691 -0.435 1.00 22.01 C ATOM 803 CG ASP A 56 -4.066 24.146 -0.865 1.00 72.34 C ATOM 804 OD1 ASP A 56 -4.173 25.066 -0.024 1.00 74.33 O ATOM 805 OD2 ASP A 56 -3.805 24.357 -2.070 1.00 13.55 O ATOM 0 H ASP A 56 -2.697 22.075 1.351 1.00 52.51 H new ATOM 0 HA ASP A 56 -5.146 23.345 1.404 1.00 24.35 H new ATOM 0 HB2 ASP A 56 -3.216 22.220 -0.536 1.00 22.01 H new ATOM 0 HB3 ASP A 56 -4.864 22.188 -1.133 1.00 22.01 H new ATOM 809 N GLN A 57 -5.262 20.122 0.633 1.00 12.43 N ATOM 810 CA GLN A 57 -6.020 18.899 0.426 1.00 51.13 C ATOM 811 C GLN A 57 -6.513 18.290 1.754 1.00 75.04 C ATOM 812 O GLN A 57 -7.214 17.277 1.724 1.00 24.42 O ATOM 813 CB GLN A 57 -5.118 17.925 -0.356 1.00 33.04 C ATOM 814 CG GLN A 57 -4.587 18.513 -1.685 1.00 44.44 C ATOM 815 CD GLN A 57 -3.502 17.649 -2.321 1.00 14.35 C ATOM 816 OE1 GLN A 57 -2.872 16.828 -1.659 1.00 55.12 O ATOM 817 NE2 GLN A 57 -3.222 17.815 -3.601 1.00 44.20 N ATOM 0 H GLN A 57 -4.262 19.979 0.492 1.00 12.43 H new ATOM 0 HA GLN A 57 -6.924 19.112 -0.144 1.00 51.13 H new ATOM 0 HB2 GLN A 57 -4.273 17.641 0.271 1.00 33.04 H new ATOM 0 HB3 GLN A 57 -5.677 17.014 -0.568 1.00 33.04 H new ATOM 0 HG2 GLN A 57 -5.415 18.623 -2.385 1.00 44.44 H new ATOM 0 HG3 GLN A 57 -4.190 19.511 -1.502 1.00 44.44 H new ATOM 0 HE21 GLN A 57 -3.744 18.496 -4.153 1.00 44.20 H new ATOM 0 HE22 GLN A 57 -2.484 17.262 -4.038 1.00 44.20 H new ATOM 824 N ILE A 58 -6.172 18.881 2.906 1.00 13.11 N ATOM 825 CA ILE A 58 -6.707 18.524 4.219 1.00 14.54 C ATOM 826 C ILE A 58 -7.764 19.554 4.597 1.00 55.11 C ATOM 827 O ILE A 58 -8.899 19.180 4.888 1.00 14.43 O ATOM 828 CB ILE A 58 -5.590 18.439 5.288 1.00 22.12 C ATOM 829 CG1 ILE A 58 -4.575 17.325 4.961 1.00 31.32 C ATOM 830 CG2 ILE A 58 -6.175 18.199 6.696 1.00 21.44 C ATOM 831 CD1 ILE A 58 -3.265 17.497 5.741 1.00 42.52 C ATOM 0 H ILE A 58 -5.496 19.643 2.948 1.00 13.11 H new ATOM 0 HA ILE A 58 -7.158 17.533 4.173 1.00 14.54 H new ATOM 0 HB ILE A 58 -5.074 19.399 5.277 1.00 22.12 H new ATOM 0 HG12 ILE A 58 -5.013 16.355 5.196 1.00 31.32 H new ATOM 0 HG13 ILE A 58 -4.364 17.329 3.892 1.00 31.32 H new ATOM 0 HG21 ILE A 58 -5.364 18.144 7.422 1.00 21.44 H new ATOM 0 HG22 ILE A 58 -6.842 19.020 6.958 1.00 21.44 H new ATOM 0 HG23 ILE A 58 -6.733 17.262 6.704 1.00 21.44 H new ATOM 0 HD11 ILE A 58 -2.578 16.691 5.481 1.00 42.52 H new ATOM 0 HD12 ILE A 58 -2.813 18.456 5.486 1.00 42.52 H new ATOM 0 HD13 ILE A 58 -3.472 17.466 6.811 1.00 42.52 H new ATOM 842 N GLN A 59 -7.412 20.845 4.637 1.00 54.14 N ATOM 843 CA GLN A 59 -8.318 21.856 5.172 1.00 40.52 C ATOM 844 C GLN A 59 -9.572 22.028 4.311 1.00 73.12 C ATOM 845 O GLN A 59 -10.600 22.456 4.843 1.00 14.41 O ATOM 846 CB GLN A 59 -7.602 23.188 5.413 1.00 75.24 C ATOM 847 CG GLN A 59 -6.563 23.082 6.539 1.00 31.03 C ATOM 848 CD GLN A 59 -6.172 24.472 7.042 1.00 72.00 C ATOM 849 OE1 GLN A 59 -4.938 24.905 6.831 1.00 43.23 O flip ATOM 850 NE2 GLN A 59 -6.984 25.180 7.622 1.00 72.00 N flip ATOM 0 H GLN A 59 -6.517 21.206 4.308 1.00 54.14 H new ATOM 0 HA GLN A 59 -8.657 21.492 6.142 1.00 40.52 H new ATOM 0 HB2 GLN A 59 -7.111 23.508 4.494 1.00 75.24 H new ATOM 0 HB3 GLN A 59 -8.335 23.954 5.666 1.00 75.24 H new ATOM 0 HG2 GLN A 59 -6.969 22.492 7.361 1.00 31.03 H new ATOM 0 HG3 GLN A 59 -5.678 22.558 6.177 1.00 31.03 H new ATOM 0 HE21 GLN A 59 -7.933 24.842 7.782 1.00 72.00 H new ATOM 0 HE22 GLN A 59 -6.712 26.108 7.945 1.00 72.00 H new ATOM 857 N GLY A 60 -9.549 21.578 3.055 1.00 55.33 N ATOM 858 CA GLY A 60 -10.717 21.515 2.185 1.00 73.04 C ATOM 859 C GLY A 60 -10.611 22.481 1.013 1.00 24.01 C ATOM 860 O GLY A 60 -11.633 22.893 0.463 1.00 74.22 O ATOM 0 H GLY A 60 -8.697 21.240 2.608 1.00 55.33 H new ATOM 0 HA2 GLY A 60 -10.833 20.499 1.807 1.00 73.04 H new ATOM 0 HA3 GLY A 60 -11.612 21.744 2.763 1.00 73.04 H new ATOM 864 N ASN A 61 -9.385 22.877 0.677 1.00 20.34 N ATOM 865 CA ASN A 61 -9.079 23.916 -0.295 1.00 35.34 C ATOM 866 C ASN A 61 -9.082 23.344 -1.712 1.00 54.34 C ATOM 867 O ASN A 61 -9.372 24.056 -2.674 1.00 43.41 O ATOM 868 CB ASN A 61 -7.675 24.494 -0.029 1.00 14.14 C ATOM 869 CG ASN A 61 -7.432 25.055 1.373 1.00 43.22 C ATOM 870 OD1 ASN A 61 -8.195 24.839 2.311 1.00 63.02 O ATOM 871 ND2 ASN A 61 -6.339 25.761 1.581 1.00 52.52 N ATOM 0 H ASN A 61 -8.549 22.466 1.092 1.00 20.34 H new ATOM 0 HA ASN A 61 -9.839 24.692 -0.201 1.00 35.34 H new ATOM 0 HB2 ASN A 61 -6.940 23.711 -0.217 1.00 14.14 H new ATOM 0 HB3 ASN A 61 -7.488 25.287 -0.753 1.00 14.14 H new ATOM 0 HD21 ASN A 61 -6.134 26.121 2.513 1.00 52.52 H new ATOM 0 HD22 ASN A 61 -5.698 25.947 0.810 1.00 52.52 H new ATOM 877 N LYS A 62 -8.706 22.066 -1.849 1.00 71.20 N ATOM 878 CA LYS A 62 -8.474 21.372 -3.111 1.00 15.24 C ATOM 879 C LYS A 62 -8.929 19.927 -3.010 1.00 15.51 C ATOM 880 O LYS A 62 -9.143 19.395 -1.914 1.00 72.30 O ATOM 881 CB LYS A 62 -6.974 21.427 -3.460 1.00 35.15 C ATOM 882 CG LYS A 62 -6.598 22.636 -4.320 1.00 42.24 C ATOM 883 CD LYS A 62 -6.984 22.436 -5.796 1.00 55.50 C ATOM 884 CE LYS A 62 -6.867 23.777 -6.522 1.00 14.25 C ATOM 885 NZ LYS A 62 -7.314 23.717 -7.927 1.00 62.31 N ATOM 0 H LYS A 62 -8.549 21.464 -1.041 1.00 71.20 H new ATOM 0 HA LYS A 62 -9.048 21.863 -3.897 1.00 15.24 H new ATOM 0 HB2 LYS A 62 -6.394 21.451 -2.538 1.00 35.15 H new ATOM 0 HB3 LYS A 62 -6.697 20.514 -3.987 1.00 35.15 H new ATOM 0 HG2 LYS A 62 -7.095 23.525 -3.933 1.00 42.24 H new ATOM 0 HG3 LYS A 62 -5.525 22.813 -4.247 1.00 42.24 H new ATOM 0 HD2 LYS A 62 -6.331 21.697 -6.260 1.00 55.50 H new ATOM 0 HD3 LYS A 62 -8.002 22.054 -5.871 1.00 55.50 H new ATOM 0 HE2 LYS A 62 -7.458 24.523 -5.991 1.00 14.25 H new ATOM 0 HE3 LYS A 62 -5.830 24.111 -6.491 1.00 14.25 H new ATOM 0 HZ1 LYS A 62 -7.211 24.655 -8.365 1.00 62.31 H new ATOM 0 HZ2 LYS A 62 -6.735 23.027 -8.446 1.00 62.31 H new ATOM 0 HZ3 LYS A 62 -8.312 23.427 -7.962 1.00 62.31 H new ATOM 895 N ASP A 63 -9.069 19.292 -4.166 1.00 42.42 N ATOM 896 CA ASP A 63 -9.174 17.854 -4.340 1.00 3.45 C ATOM 897 C ASP A 63 -7.788 17.213 -4.228 1.00 14.21 C ATOM 898 O ASP A 63 -6.761 17.886 -4.337 1.00 55.43 O ATOM 899 CB ASP A 63 -9.852 17.533 -5.686 1.00 41.54 C ATOM 900 CG ASP A 63 -9.206 18.086 -6.964 1.00 75.41 C ATOM 901 OD1 ASP A 63 -8.260 18.899 -6.886 1.00 71.13 O ATOM 902 OD2 ASP A 63 -9.752 17.791 -8.057 1.00 34.32 O ATOM 0 H ASP A 63 -9.114 19.795 -5.052 1.00 42.42 H new ATOM 0 HA ASP A 63 -9.797 17.433 -3.551 1.00 3.45 H new ATOM 0 HB2 ASP A 63 -9.909 16.449 -5.782 1.00 41.54 H new ATOM 0 HB3 ASP A 63 -10.876 17.903 -5.642 1.00 41.54 H new ATOM 906 N PHE A 64 -7.753 15.904 -3.977 1.00 20.31 N ATOM 907 CA PHE A 64 -6.538 15.093 -4.027 1.00 41.50 C ATOM 908 C PHE A 64 -6.053 14.971 -5.482 1.00 42.33 C ATOM 909 O PHE A 64 -6.847 15.160 -6.412 1.00 24.05 O ATOM 910 CB PHE A 64 -6.816 13.708 -3.401 1.00 20.15 C ATOM 911 CG PHE A 64 -8.132 13.072 -3.810 1.00 13.41 C ATOM 912 CD1 PHE A 64 -8.387 12.757 -5.157 1.00 62.30 C ATOM 913 CD2 PHE A 64 -9.140 12.864 -2.853 1.00 52.24 C ATOM 914 CE1 PHE A 64 -9.664 12.337 -5.553 1.00 12.31 C ATOM 915 CE2 PHE A 64 -10.406 12.399 -3.248 1.00 14.35 C ATOM 916 CZ PHE A 64 -10.683 12.170 -4.604 1.00 2.44 C ATOM 0 H PHE A 64 -8.585 15.368 -3.729 1.00 20.31 H new ATOM 0 HA PHE A 64 -5.746 15.572 -3.451 1.00 41.50 H new ATOM 0 HB2 PHE A 64 -6.004 13.034 -3.673 1.00 20.15 H new ATOM 0 HB3 PHE A 64 -6.799 13.807 -2.316 1.00 20.15 H new ATOM 0 HD1 PHE A 64 -7.596 12.839 -5.888 1.00 62.30 H new ATOM 0 HD2 PHE A 64 -8.941 13.062 -1.810 1.00 52.24 H new ATOM 0 HE1 PHE A 64 -9.865 12.141 -6.596 1.00 12.31 H new ATOM 0 HE2 PHE A 64 -11.168 12.217 -2.505 1.00 14.35 H new ATOM 0 HZ PHE A 64 -11.672 11.868 -4.914 1.00 2.44 H new ATOM 925 N PRO A 65 -4.787 14.586 -5.713 1.00 41.50 N ATOM 926 CA PRO A 65 -4.289 14.323 -7.056 1.00 15.25 C ATOM 927 C PRO A 65 -4.900 13.062 -7.661 1.00 43.13 C ATOM 928 O PRO A 65 -5.316 12.133 -6.964 1.00 64.30 O ATOM 929 CB PRO A 65 -2.775 14.175 -6.920 1.00 2.14 C ATOM 930 CG PRO A 65 -2.569 13.774 -5.456 1.00 12.34 C ATOM 931 CD PRO A 65 -3.736 14.421 -4.722 1.00 64.42 C ATOM 0 HA PRO A 65 -4.562 15.136 -7.729 1.00 15.25 H new ATOM 0 HB2 PRO A 65 -2.386 13.417 -7.600 1.00 2.14 H new ATOM 0 HB3 PRO A 65 -2.261 15.107 -7.154 1.00 2.14 H new ATOM 0 HG2 PRO A 65 -2.575 12.691 -5.336 1.00 12.34 H new ATOM 0 HG3 PRO A 65 -1.612 14.132 -5.076 1.00 12.34 H new ATOM 0 HD2 PRO A 65 -4.073 13.795 -3.896 1.00 64.42 H new ATOM 0 HD3 PRO A 65 -3.446 15.382 -4.297 1.00 64.42 H new ATOM 936 N GLU A 66 -4.843 13.002 -8.985 1.00 71.31 N ATOM 937 CA GLU A 66 -5.185 11.845 -9.811 1.00 12.53 C ATOM 938 C GLU A 66 -4.120 10.737 -9.685 1.00 1.34 C ATOM 939 O GLU A 66 -3.079 10.956 -9.053 1.00 44.54 O ATOM 940 CB GLU A 66 -5.338 12.319 -11.267 1.00 20.32 C ATOM 941 CG GLU A 66 -4.085 13.027 -11.797 1.00 60.41 C ATOM 942 CD GLU A 66 -4.140 13.235 -13.311 1.00 2.41 C ATOM 943 OE1 GLU A 66 -3.718 12.317 -14.053 1.00 15.52 O ATOM 944 OE2 GLU A 66 -4.582 14.309 -13.758 1.00 64.33 O ATOM 0 H GLU A 66 -4.541 13.800 -9.544 1.00 71.31 H new ATOM 0 HA GLU A 66 -6.125 11.411 -9.470 1.00 12.53 H new ATOM 0 HB2 GLU A 66 -5.561 11.461 -11.902 1.00 20.32 H new ATOM 0 HB3 GLU A 66 -6.189 12.997 -11.336 1.00 20.32 H new ATOM 0 HG2 GLU A 66 -3.978 13.992 -11.302 1.00 60.41 H new ATOM 0 HG3 GLU A 66 -3.203 12.439 -11.544 1.00 60.41 H new ATOM 949 N ILE A 67 -4.341 9.566 -10.298 1.00 74.10 N ATOM 950 CA ILE A 67 -3.345 8.492 -10.410 1.00 52.20 C ATOM 951 C ILE A 67 -3.138 8.044 -11.860 1.00 51.32 C ATOM 952 O ILE A 67 -3.983 8.299 -12.722 1.00 13.44 O ATOM 953 CB ILE A 67 -3.701 7.278 -9.518 1.00 44.13 C ATOM 954 CG1 ILE A 67 -4.983 6.542 -9.971 1.00 53.21 C ATOM 955 CG2 ILE A 67 -3.768 7.684 -8.043 1.00 13.32 C ATOM 956 CD1 ILE A 67 -5.188 5.225 -9.218 1.00 14.12 C ATOM 0 H ILE A 67 -5.232 9.335 -10.737 1.00 74.10 H new ATOM 0 HA ILE A 67 -2.405 8.912 -10.052 1.00 52.20 H new ATOM 0 HB ILE A 67 -2.892 6.557 -9.636 1.00 44.13 H new ATOM 0 HG12 ILE A 67 -5.847 7.188 -9.812 1.00 53.21 H new ATOM 0 HG13 ILE A 67 -4.927 6.342 -11.041 1.00 53.21 H new ATOM 0 HG21 ILE A 67 -4.020 6.814 -7.437 1.00 13.32 H new ATOM 0 HG22 ILE A 67 -2.801 8.077 -7.729 1.00 13.32 H new ATOM 0 HG23 ILE A 67 -4.531 8.451 -7.911 1.00 13.32 H new ATOM 0 HD11 ILE A 67 -6.100 4.743 -9.569 1.00 14.12 H new ATOM 0 HD12 ILE A 67 -4.338 4.567 -9.398 1.00 14.12 H new ATOM 0 HD13 ILE A 67 -5.272 5.426 -8.150 1.00 14.12 H new ATOM 967 N GLN A 68 -2.054 7.292 -12.089 1.00 64.30 N ATOM 968 CA GLN A 68 -1.625 6.748 -13.380 1.00 73.42 C ATOM 969 C GLN A 68 -1.430 5.224 -13.316 1.00 22.02 C ATOM 970 O GLN A 68 -0.571 4.656 -13.996 1.00 32.13 O ATOM 971 CB GLN A 68 -0.318 7.417 -13.831 1.00 54.52 C ATOM 972 CG GLN A 68 -0.194 8.910 -13.541 1.00 74.22 C ATOM 973 CD GLN A 68 -1.239 9.799 -14.209 1.00 23.01 C ATOM 974 OE1 GLN A 68 -2.036 9.381 -15.042 1.00 62.03 O ATOM 975 NE2 GLN A 68 -1.266 11.056 -13.819 1.00 11.45 N ATOM 0 H GLN A 68 -1.418 7.033 -11.335 1.00 64.30 H new ATOM 0 HA GLN A 68 -2.412 6.960 -14.103 1.00 73.42 H new ATOM 0 HB2 GLN A 68 0.514 6.904 -13.350 1.00 54.52 H new ATOM 0 HB3 GLN A 68 -0.208 7.266 -14.905 1.00 54.52 H new ATOM 0 HG2 GLN A 68 -0.252 9.059 -12.463 1.00 74.22 H new ATOM 0 HG3 GLN A 68 0.795 9.242 -13.856 1.00 74.22 H new ATOM 0 HE21 GLN A 68 -0.597 11.389 -13.125 1.00 11.45 H new ATOM 0 HE22 GLN A 68 -1.956 11.697 -14.211 1.00 11.45 H new ATOM 982 N LEU A 69 -2.137 4.558 -12.407 1.00 1.25 N ATOM 983 CA LEU A 69 -2.223 3.105 -12.358 1.00 20.11 C ATOM 984 C LEU A 69 -3.517 2.659 -13.059 1.00 61.43 C ATOM 985 O LEU A 69 -4.495 3.403 -13.068 1.00 41.20 O ATOM 986 CB LEU A 69 -2.167 2.637 -10.893 1.00 53.21 C ATOM 987 CG LEU A 69 -2.206 1.105 -10.775 1.00 12.55 C ATOM 988 CD1 LEU A 69 -1.030 0.471 -11.524 1.00 32.01 C ATOM 989 CD2 LEU A 69 -2.195 0.628 -9.329 1.00 53.41 C ATOM 0 H LEU A 69 -2.674 5.021 -11.674 1.00 1.25 H new ATOM 0 HA LEU A 69 -1.381 2.650 -12.880 1.00 20.11 H new ATOM 0 HB2 LEU A 69 -1.256 3.013 -10.427 1.00 53.21 H new ATOM 0 HB3 LEU A 69 -3.006 3.064 -10.344 1.00 53.21 H new ATOM 0 HG LEU A 69 -3.146 0.788 -11.226 1.00 12.55 H new ATOM 0 HD11 LEU A 69 -1.079 -0.614 -11.426 1.00 32.01 H new ATOM 0 HD12 LEU A 69 -1.081 0.743 -12.578 1.00 32.01 H new ATOM 0 HD13 LEU A 69 -0.092 0.832 -11.101 1.00 32.01 H new ATOM 0 HD21 LEU A 69 -2.224 -0.461 -9.305 1.00 53.41 H new ATOM 0 HD22 LEU A 69 -1.287 0.978 -8.837 1.00 53.41 H new ATOM 0 HD23 LEU A 69 -3.066 1.025 -8.808 1.00 53.41 H new ATOM 1000 N ASP A 70 -3.519 1.445 -13.616 1.00 53.20 N ATOM 1001 CA ASP A 70 -4.648 0.850 -14.337 1.00 51.30 C ATOM 1002 C ASP A 70 -5.635 0.193 -13.371 1.00 44.50 C ATOM 1003 O ASP A 70 -5.331 -0.004 -12.190 1.00 34.33 O ATOM 1004 CB ASP A 70 -4.153 -0.233 -15.314 1.00 0.35 C ATOM 1005 CG ASP A 70 -3.301 0.278 -16.468 1.00 33.15 C ATOM 1006 OD1 ASP A 70 -3.295 1.494 -16.773 1.00 51.40 O ATOM 1007 OD2 ASP A 70 -2.585 -0.550 -17.066 1.00 2.53 O ATOM 0 H ASP A 70 -2.707 0.828 -13.576 1.00 53.20 H new ATOM 0 HA ASP A 70 -5.143 1.656 -14.879 1.00 51.30 H new ATOM 0 HB2 ASP A 70 -3.575 -0.968 -14.754 1.00 0.35 H new ATOM 0 HB3 ASP A 70 -5.019 -0.753 -15.724 1.00 0.35 H new ATOM 1011 N ASN A 71 -6.804 -0.217 -13.871 1.00 73.02 N ATOM 1012 CA ASN A 71 -7.780 -0.976 -13.100 1.00 11.22 C ATOM 1013 C ASN A 71 -7.570 -2.475 -13.231 1.00 41.24 C ATOM 1014 O ASN A 71 -7.501 -3.021 -14.338 1.00 52.43 O ATOM 1015 CB ASN A 71 -9.219 -0.613 -13.501 1.00 72.12 C ATOM 1016 CG ASN A 71 -10.245 -1.452 -12.743 1.00 54.34 C ATOM 1017 OD1 ASN A 71 -10.449 -2.629 -13.026 1.00 62.12 O ATOM 1018 ND2 ASN A 71 -10.878 -0.880 -11.736 1.00 42.52 N ATOM 0 H ASN A 71 -7.097 -0.028 -14.829 1.00 73.02 H new ATOM 0 HA ASN A 71 -7.627 -0.702 -12.056 1.00 11.22 H new ATOM 0 HB2 ASN A 71 -9.396 0.444 -13.304 1.00 72.12 H new ATOM 0 HB3 ASN A 71 -9.347 -0.763 -14.573 1.00 72.12 H new ATOM 0 HD21 ASN A 71 -11.546 -1.417 -11.182 1.00 42.52 H new ATOM 0 HD22 ASN A 71 -10.699 0.099 -11.511 1.00 42.52 H new ATOM 1024 N ILE A 72 -7.548 -3.125 -12.071 1.00 63.13 N ATOM 1025 CA ILE A 72 -7.399 -4.550 -11.842 1.00 24.24 C ATOM 1026 C ILE A 72 -8.395 -4.922 -10.743 1.00 73.00 C ATOM 1027 O ILE A 72 -8.665 -4.134 -9.830 1.00 22.42 O ATOM 1028 CB ILE A 72 -5.932 -4.842 -11.451 1.00 60.02 C ATOM 1029 CG1 ILE A 72 -5.030 -4.604 -12.679 1.00 0.22 C ATOM 1030 CG2 ILE A 72 -5.736 -6.260 -10.885 1.00 41.14 C ATOM 1031 CD1 ILE A 72 -3.550 -4.742 -12.356 1.00 3.54 C ATOM 0 H ILE A 72 -7.643 -2.618 -11.191 1.00 63.13 H new ATOM 0 HA ILE A 72 -7.611 -5.149 -12.728 1.00 24.24 H new ATOM 0 HB ILE A 72 -5.653 -4.160 -10.647 1.00 60.02 H new ATOM 0 HG12 ILE A 72 -5.295 -5.315 -13.462 1.00 0.22 H new ATOM 0 HG13 ILE A 72 -5.220 -3.607 -13.076 1.00 0.22 H new ATOM 0 HG21 ILE A 72 -4.687 -6.408 -10.628 1.00 41.14 H new ATOM 0 HG22 ILE A 72 -6.349 -6.383 -9.992 1.00 41.14 H new ATOM 0 HG23 ILE A 72 -6.033 -6.995 -11.633 1.00 41.14 H new ATOM 0 HD11 ILE A 72 -2.963 -4.564 -13.257 1.00 3.54 H new ATOM 0 HD12 ILE A 72 -3.275 -4.013 -11.594 1.00 3.54 H new ATOM 0 HD13 ILE A 72 -3.351 -5.748 -11.986 1.00 3.54 H new ATOM 1042 N ASP A 73 -8.920 -6.139 -10.830 1.00 4.21 N ATOM 1043 CA ASP A 73 -9.723 -6.766 -9.799 1.00 41.42 C ATOM 1044 C ASP A 73 -8.789 -7.143 -8.660 1.00 41.13 C ATOM 1045 O ASP A 73 -7.853 -7.912 -8.872 1.00 21.21 O ATOM 1046 CB ASP A 73 -10.392 -8.017 -10.378 1.00 44.22 C ATOM 1047 CG ASP A 73 -11.686 -7.642 -11.085 1.00 72.20 C ATOM 1048 OD1 ASP A 73 -11.617 -7.269 -12.279 1.00 13.14 O ATOM 1049 OD2 ASP A 73 -12.729 -7.657 -10.394 1.00 44.44 O ATOM 0 H ASP A 73 -8.791 -6.732 -11.650 1.00 4.21 H new ATOM 0 HA ASP A 73 -10.501 -6.094 -9.437 1.00 41.42 H new ATOM 0 HB2 ASP A 73 -9.716 -8.509 -11.078 1.00 44.22 H new ATOM 0 HB3 ASP A 73 -10.599 -8.730 -9.580 1.00 44.22 H new ATOM 1053 N TYR A 74 -9.005 -6.595 -7.466 1.00 20.42 N ATOM 1054 CA TYR A 74 -8.135 -6.832 -6.311 1.00 74.11 C ATOM 1055 C TYR A 74 -8.650 -7.949 -5.396 1.00 42.11 C ATOM 1056 O TYR A 74 -8.006 -8.265 -4.398 1.00 35.25 O ATOM 1057 CB TYR A 74 -7.912 -5.529 -5.527 1.00 62.10 C ATOM 1058 CG TYR A 74 -7.210 -4.431 -6.311 1.00 40.13 C ATOM 1059 CD1 TYR A 74 -5.949 -4.682 -6.887 1.00 62.22 C ATOM 1060 CD2 TYR A 74 -7.773 -3.141 -6.410 1.00 13.13 C ATOM 1061 CE1 TYR A 74 -5.252 -3.655 -7.545 1.00 41.22 C ATOM 1062 CE2 TYR A 74 -7.086 -2.117 -7.078 1.00 23.44 C ATOM 1063 CZ TYR A 74 -5.817 -2.368 -7.640 1.00 72.30 C ATOM 1064 OH TYR A 74 -5.057 -1.348 -8.119 1.00 72.12 O ATOM 0 H TYR A 74 -9.789 -5.973 -7.270 1.00 20.42 H new ATOM 0 HA TYR A 74 -7.177 -7.175 -6.700 1.00 74.11 H new ATOM 0 HB2 TYR A 74 -8.878 -5.155 -5.188 1.00 62.10 H new ATOM 0 HB3 TYR A 74 -7.326 -5.752 -4.636 1.00 62.10 H new ATOM 0 HD1 TYR A 74 -5.516 -5.669 -6.822 1.00 62.22 H new ATOM 0 HD2 TYR A 74 -8.738 -2.941 -5.969 1.00 13.13 H new ATOM 0 HE1 TYR A 74 -4.283 -3.852 -7.978 1.00 41.22 H new ATOM 0 HE2 TYR A 74 -7.529 -1.136 -7.162 1.00 23.44 H new ATOM 0 HH TYR A 74 -5.585 -0.522 -8.126 1.00 72.12 H new ATOM 1073 N ASN A 75 -9.797 -8.562 -5.697 1.00 13.41 N ATOM 1074 CA ASN A 75 -10.380 -9.594 -4.835 1.00 11.34 C ATOM 1075 C ASN A 75 -9.662 -10.939 -4.961 1.00 12.03 C ATOM 1076 O ASN A 75 -9.832 -11.801 -4.104 1.00 24.54 O ATOM 1077 CB ASN A 75 -11.891 -9.715 -5.097 1.00 22.51 C ATOM 1078 CG ASN A 75 -12.785 -9.405 -3.910 1.00 74.40 C ATOM 1079 OD1 ASN A 75 -13.872 -9.971 -3.815 1.00 33.41 O ATOM 1080 ND2 ASN A 75 -12.444 -8.444 -3.066 1.00 21.21 N ATOM 0 H ASN A 75 -10.343 -8.361 -6.535 1.00 13.41 H new ATOM 0 HA ASN A 75 -10.238 -9.282 -3.800 1.00 11.34 H new ATOM 0 HB2 ASN A 75 -12.156 -9.044 -5.914 1.00 22.51 H new ATOM 0 HB3 ASN A 75 -12.104 -10.729 -5.435 1.00 22.51 H new ATOM 0 HD21 ASN A 75 -13.087 -8.164 -2.325 1.00 21.21 H new ATOM 0 HD22 ASN A 75 -11.539 -7.983 -3.157 1.00 21.21 H new ATOM 1086 N ASN A 76 -8.816 -11.120 -5.978 1.00 14.45 N ATOM 1087 CA ASN A 76 -7.983 -12.299 -6.205 1.00 62.11 C ATOM 1088 C ASN A 76 -6.613 -12.167 -5.523 1.00 33.33 C ATOM 1089 O ASN A 76 -5.596 -12.607 -6.058 1.00 32.15 O ATOM 1090 CB ASN A 76 -7.931 -12.644 -7.707 1.00 60.13 C ATOM 1091 CG ASN A 76 -7.527 -11.497 -8.624 1.00 1.15 C ATOM 1092 OD1 ASN A 76 -8.460 -10.608 -8.919 1.00 64.11 O flip ATOM 1093 ND2 ASN A 76 -6.414 -11.413 -9.135 1.00 51.40 N flip ATOM 0 H ASN A 76 -8.689 -10.411 -6.701 1.00 14.45 H new ATOM 0 HA ASN A 76 -8.442 -13.162 -5.722 1.00 62.11 H new ATOM 0 HB2 ASN A 76 -7.230 -13.466 -7.850 1.00 60.13 H new ATOM 0 HB3 ASN A 76 -8.913 -13.005 -8.014 1.00 60.13 H new ATOM 0 HD21 ASN A 76 -5.695 -12.099 -8.907 1.00 51.40 H new ATOM 0 HD22 ASN A 76 -6.208 -10.657 -9.788 1.00 51.40 H new ATOM 1099 N TYR A 77 -6.607 -11.584 -4.322 1.00 4.44 N ATOM 1100 CA TYR A 77 -5.482 -11.422 -3.413 1.00 4.24 C ATOM 1101 C TYR A 77 -6.015 -11.650 -2.000 1.00 61.54 C ATOM 1102 O TYR A 77 -7.084 -11.143 -1.667 1.00 63.34 O ATOM 1103 CB TYR A 77 -4.883 -10.028 -3.585 1.00 33.21 C ATOM 1104 CG TYR A 77 -4.186 -9.873 -4.922 1.00 62.12 C ATOM 1105 CD1 TYR A 77 -2.960 -10.525 -5.126 1.00 51.20 C ATOM 1106 CD2 TYR A 77 -4.777 -9.158 -5.980 1.00 0.23 C ATOM 1107 CE1 TYR A 77 -2.309 -10.466 -6.369 1.00 14.33 C ATOM 1108 CE2 TYR A 77 -4.141 -9.090 -7.234 1.00 21.42 C ATOM 1109 CZ TYR A 77 -2.898 -9.742 -7.429 1.00 43.42 C ATOM 1110 OH TYR A 77 -2.244 -9.646 -8.620 1.00 62.30 O ATOM 0 H TYR A 77 -7.460 -11.182 -3.934 1.00 4.44 H new ATOM 0 HA TYR A 77 -4.684 -12.135 -3.619 1.00 4.24 H new ATOM 0 HB2 TYR A 77 -5.672 -9.281 -3.498 1.00 33.21 H new ATOM 0 HB3 TYR A 77 -4.172 -9.836 -2.781 1.00 33.21 H new ATOM 0 HD1 TYR A 77 -2.511 -11.080 -4.316 1.00 51.20 H new ATOM 0 HD2 TYR A 77 -5.723 -8.659 -5.829 1.00 0.23 H new ATOM 0 HE1 TYR A 77 -1.365 -10.970 -6.513 1.00 14.33 H new ATOM 0 HE2 TYR A 77 -4.599 -8.543 -8.045 1.00 21.42 H new ATOM 0 HH TYR A 77 -1.308 -9.913 -8.502 1.00 62.30 H new ATOM 1119 N ASP A 78 -5.307 -12.445 -1.197 1.00 31.15 N ATOM 1120 CA ASP A 78 -5.569 -12.629 0.237 1.00 54.12 C ATOM 1121 C ASP A 78 -5.015 -11.453 1.051 1.00 73.32 C ATOM 1122 O ASP A 78 -5.718 -10.921 1.913 1.00 51.23 O ATOM 1123 CB ASP A 78 -4.948 -13.958 0.690 1.00 71.14 C ATOM 1124 CG ASP A 78 -5.233 -14.323 2.155 1.00 31.41 C ATOM 1125 OD1 ASP A 78 -6.433 -14.394 2.517 1.00 63.30 O ATOM 1126 OD2 ASP A 78 -4.285 -14.666 2.896 1.00 52.30 O ATOM 0 H ASP A 78 -4.515 -12.994 -1.531 1.00 31.15 H new ATOM 0 HA ASP A 78 -6.645 -12.659 0.408 1.00 54.12 H new ATOM 0 HB2 ASP A 78 -5.322 -14.757 0.050 1.00 71.14 H new ATOM 0 HB3 ASP A 78 -3.869 -13.910 0.543 1.00 71.14 H new ATOM 1130 N LEU A 79 -3.794 -11.011 0.727 1.00 34.12 N ATOM 1131 CA LEU A 79 -3.045 -9.925 1.366 1.00 33.21 C ATOM 1132 C LEU A 79 -2.626 -8.932 0.286 1.00 33.15 C ATOM 1133 O LEU A 79 -2.253 -9.345 -0.817 1.00 64.12 O ATOM 1134 CB LEU A 79 -1.803 -10.520 2.065 1.00 72.43 C ATOM 1135 CG LEU A 79 -0.636 -9.554 2.374 1.00 31.53 C ATOM 1136 CD1 LEU A 79 -0.954 -8.536 3.474 1.00 34.35 C ATOM 1137 CD2 LEU A 79 0.597 -10.354 2.800 1.00 52.41 C ATOM 0 H LEU A 79 -3.269 -11.431 -0.040 1.00 34.12 H new ATOM 0 HA LEU A 79 -3.656 -9.414 2.110 1.00 33.21 H new ATOM 0 HB2 LEU A 79 -2.127 -10.970 3.004 1.00 72.43 H new ATOM 0 HB3 LEU A 79 -1.418 -11.326 1.441 1.00 72.43 H new ATOM 0 HG LEU A 79 -0.455 -8.997 1.455 1.00 31.53 H new ATOM 0 HD11 LEU A 79 -0.089 -7.893 3.636 1.00 34.35 H new ATOM 0 HD12 LEU A 79 -1.807 -7.928 3.172 1.00 34.35 H new ATOM 0 HD13 LEU A 79 -1.193 -9.062 4.398 1.00 34.35 H new ATOM 0 HD21 LEU A 79 1.417 -9.670 3.017 1.00 52.41 H new ATOM 0 HD22 LEU A 79 0.363 -10.935 3.692 1.00 52.41 H new ATOM 0 HD23 LEU A 79 0.890 -11.028 1.995 1.00 52.41 H new ATOM 1148 N ILE A 80 -2.622 -7.635 0.605 1.00 40.20 N ATOM 1149 CA ILE A 80 -2.116 -6.609 -0.296 1.00 2.11 C ATOM 1150 C ILE A 80 -1.302 -5.589 0.507 1.00 55.10 C ATOM 1151 O ILE A 80 -1.764 -5.074 1.521 1.00 12.05 O ATOM 1152 CB ILE A 80 -3.269 -5.951 -1.093 1.00 34.41 C ATOM 1153 CG1 ILE A 80 -4.175 -6.986 -1.809 1.00 51.43 C ATOM 1154 CG2 ILE A 80 -2.619 -4.965 -2.081 1.00 40.41 C ATOM 1155 CD1 ILE A 80 -5.390 -6.401 -2.537 1.00 73.10 C ATOM 0 H ILE A 80 -2.969 -7.273 1.493 1.00 40.20 H new ATOM 0 HA ILE A 80 -1.456 -7.063 -1.035 1.00 2.11 H new ATOM 0 HB ILE A 80 -3.942 -5.429 -0.413 1.00 34.41 H new ATOM 0 HG12 ILE A 80 -3.570 -7.536 -2.530 1.00 51.43 H new ATOM 0 HG13 ILE A 80 -4.527 -7.708 -1.072 1.00 51.43 H new ATOM 0 HG21 ILE A 80 -3.395 -4.474 -2.668 1.00 40.41 H new ATOM 0 HG22 ILE A 80 -2.054 -4.215 -1.528 1.00 40.41 H new ATOM 0 HG23 ILE A 80 -1.948 -5.507 -2.747 1.00 40.41 H new ATOM 0 HD11 ILE A 80 -5.957 -7.206 -3.004 1.00 73.10 H new ATOM 0 HD12 ILE A 80 -6.025 -5.877 -1.822 1.00 73.10 H new ATOM 0 HD13 ILE A 80 -5.054 -5.703 -3.303 1.00 73.10 H new ATOM 1166 N LEU A 81 -0.088 -5.268 0.059 1.00 21.34 N ATOM 1167 CA LEU A 81 0.750 -4.248 0.689 1.00 43.14 C ATOM 1168 C LEU A 81 0.801 -3.000 -0.181 1.00 72.01 C ATOM 1169 O LEU A 81 0.682 -3.088 -1.404 1.00 74.01 O ATOM 1170 CB LEU A 81 2.165 -4.782 0.916 1.00 23.22 C ATOM 1171 CG LEU A 81 2.199 -5.943 1.933 1.00 51.01 C ATOM 1172 CD1 LEU A 81 2.605 -7.257 1.258 1.00 11.44 C ATOM 1173 CD2 LEU A 81 3.162 -5.624 3.070 1.00 30.53 C ATOM 0 H LEU A 81 0.343 -5.709 -0.753 1.00 21.34 H new ATOM 0 HA LEU A 81 0.314 -3.992 1.654 1.00 43.14 H new ATOM 0 HB2 LEU A 81 2.579 -5.122 -0.033 1.00 23.22 H new ATOM 0 HB3 LEU A 81 2.803 -3.973 1.271 1.00 23.22 H new ATOM 0 HG LEU A 81 1.194 -6.062 2.339 1.00 51.01 H new ATOM 0 HD11 LEU A 81 2.620 -8.057 1.998 1.00 11.44 H new ATOM 0 HD12 LEU A 81 1.887 -7.501 0.475 1.00 11.44 H new ATOM 0 HD13 LEU A 81 3.597 -7.149 0.819 1.00 11.44 H new ATOM 0 HD21 LEU A 81 3.175 -6.452 3.779 1.00 30.53 H new ATOM 0 HD22 LEU A 81 4.164 -5.475 2.667 1.00 30.53 H new ATOM 0 HD23 LEU A 81 2.837 -4.716 3.578 1.00 30.53 H new ATOM 1184 N ILE A 82 1.014 -1.845 0.450 1.00 72.30 N ATOM 1185 CA ILE A 82 1.045 -0.522 -0.160 1.00 73.20 C ATOM 1186 C ILE A 82 2.207 0.257 0.470 1.00 54.34 C ATOM 1187 O ILE A 82 2.625 -0.051 1.586 1.00 5.34 O ATOM 1188 CB ILE A 82 -0.340 0.138 0.058 1.00 15.11 C ATOM 1189 CG1 ILE A 82 -1.413 -0.494 -0.865 1.00 60.24 C ATOM 1190 CG2 ILE A 82 -0.374 1.667 -0.098 1.00 40.31 C ATOM 1191 CD1 ILE A 82 -2.358 -1.428 -0.104 1.00 42.30 C ATOM 0 H ILE A 82 1.178 -1.809 1.456 1.00 72.30 H new ATOM 0 HA ILE A 82 1.220 -0.551 -1.236 1.00 73.20 H new ATOM 0 HB ILE A 82 -0.564 -0.063 1.105 1.00 15.11 H new ATOM 0 HG12 ILE A 82 -1.993 0.298 -1.339 1.00 60.24 H new ATOM 0 HG13 ILE A 82 -0.921 -1.050 -1.663 1.00 60.24 H new ATOM 0 HG21 ILE A 82 -1.388 2.028 0.075 1.00 40.31 H new ATOM 0 HG22 ILE A 82 0.301 2.122 0.627 1.00 40.31 H new ATOM 0 HG23 ILE A 82 -0.060 1.937 -1.106 1.00 40.31 H new ATOM 0 HD11 ILE A 82 -3.091 -1.845 -0.794 1.00 42.30 H new ATOM 0 HD12 ILE A 82 -1.784 -2.237 0.348 1.00 42.30 H new ATOM 0 HD13 ILE A 82 -2.873 -0.868 0.677 1.00 42.30 H new ATOM 1202 N GLY A 83 2.702 1.308 -0.193 1.00 24.34 N ATOM 1203 CA GLY A 83 3.729 2.186 0.357 1.00 44.21 C ATOM 1204 C GLY A 83 3.624 3.608 -0.172 1.00 42.43 C ATOM 1205 O GLY A 83 3.143 3.828 -1.294 1.00 73.24 O ATOM 0 H GLY A 83 2.397 1.571 -1.130 1.00 24.34 H new ATOM 0 HA2 GLY A 83 3.647 2.199 1.444 1.00 44.21 H new ATOM 0 HA3 GLY A 83 4.713 1.784 0.116 1.00 44.21 H new ATOM 1209 N SER A 84 4.134 4.576 0.594 1.00 14.21 N ATOM 1210 CA SER A 84 4.123 5.978 0.196 1.00 61.10 C ATOM 1211 C SER A 84 5.196 6.801 0.960 1.00 51.50 C ATOM 1212 O SER A 84 5.585 6.431 2.071 1.00 3.51 O ATOM 1213 CB SER A 84 2.705 6.568 0.341 1.00 61.14 C ATOM 1214 OG SER A 84 1.816 5.814 1.153 1.00 12.14 O ATOM 0 H SER A 84 4.564 4.407 1.503 1.00 14.21 H new ATOM 0 HA SER A 84 4.394 6.039 -0.858 1.00 61.10 H new ATOM 0 HB2 SER A 84 2.788 7.572 0.756 1.00 61.14 H new ATOM 0 HB3 SER A 84 2.267 6.669 -0.652 1.00 61.14 H new ATOM 0 HG SER A 84 1.829 6.167 2.067 1.00 12.14 H new ATOM 1219 N PRO A 85 5.679 7.913 0.366 1.00 1.14 N ATOM 1220 CA PRO A 85 6.717 8.787 0.923 1.00 34.03 C ATOM 1221 C PRO A 85 6.213 9.592 2.115 1.00 25.41 C ATOM 1222 O PRO A 85 5.126 10.171 2.030 1.00 23.42 O ATOM 1223 CB PRO A 85 7.131 9.742 -0.209 1.00 31.22 C ATOM 1224 CG PRO A 85 6.068 9.598 -1.291 1.00 1.32 C ATOM 1225 CD PRO A 85 5.311 8.326 -0.975 1.00 3.43 C ATOM 0 HA PRO A 85 7.552 8.187 1.285 1.00 34.03 H new ATOM 0 HB2 PRO A 85 7.186 10.770 0.149 1.00 31.22 H new ATOM 0 HB3 PRO A 85 8.118 9.485 -0.595 1.00 31.22 H new ATOM 0 HG2 PRO A 85 5.399 10.458 -1.295 1.00 1.32 H new ATOM 0 HG3 PRO A 85 6.524 9.544 -2.280 1.00 1.32 H new ATOM 0 HD2 PRO A 85 4.236 8.495 -1.041 1.00 3.43 H new ATOM 0 HD3 PRO A 85 5.557 7.546 -1.696 1.00 3.43 H new ATOM 1230 N VAL A 86 7.008 9.693 3.190 1.00 4.23 N ATOM 1231 CA VAL A 86 6.701 10.567 4.317 1.00 52.10 C ATOM 1232 C VAL A 86 7.113 12.000 3.935 1.00 13.31 C ATOM 1233 O VAL A 86 8.305 12.311 4.004 1.00 10.11 O ATOM 1234 CB VAL A 86 7.415 10.130 5.608 1.00 61.02 C ATOM 1235 CG1 VAL A 86 7.099 11.072 6.774 1.00 45.53 C ATOM 1236 CG2 VAL A 86 7.053 8.710 6.038 1.00 43.52 C ATOM 0 H VAL A 86 7.878 9.171 3.297 1.00 4.23 H new ATOM 0 HA VAL A 86 5.632 10.513 4.523 1.00 52.10 H new ATOM 0 HB VAL A 86 8.478 10.166 5.369 1.00 61.02 H new ATOM 0 HG11 VAL A 86 7.621 10.732 7.668 1.00 45.53 H new ATOM 0 HG12 VAL A 86 7.426 12.082 6.525 1.00 45.53 H new ATOM 0 HG13 VAL A 86 6.025 11.074 6.959 1.00 45.53 H new ATOM 0 HG21 VAL A 86 7.588 8.460 6.954 1.00 43.52 H new ATOM 0 HG22 VAL A 86 5.979 8.646 6.216 1.00 43.52 H new ATOM 0 HG23 VAL A 86 7.333 8.009 5.252 1.00 43.52 H new ATOM 1246 N TRP A 87 6.173 12.877 3.562 1.00 74.03 N ATOM 1247 CA TRP A 87 6.421 14.323 3.581 1.00 31.03 C ATOM 1248 C TRP A 87 6.449 14.841 5.030 1.00 2.35 C ATOM 1249 O TRP A 87 6.283 14.067 5.975 1.00 61.03 O ATOM 1250 CB TRP A 87 5.389 15.074 2.717 1.00 62.14 C ATOM 1251 CG TRP A 87 5.932 15.598 1.419 1.00 30.32 C ATOM 1252 CD1 TRP A 87 6.542 16.785 1.195 1.00 25.05 C ATOM 1253 CD2 TRP A 87 5.878 14.938 0.126 1.00 43.23 C ATOM 1254 NE1 TRP A 87 6.843 16.906 -0.152 1.00 41.40 N ATOM 1255 CE2 TRP A 87 6.455 15.791 -0.859 1.00 41.20 C ATOM 1256 CE3 TRP A 87 5.316 13.730 -0.319 1.00 11.11 C ATOM 1257 CZ2 TRP A 87 6.485 15.451 -2.219 1.00 33.11 C ATOM 1258 CZ3 TRP A 87 5.317 13.394 -1.680 1.00 51.40 C ATOM 1259 CH2 TRP A 87 5.901 14.241 -2.632 1.00 25.24 C ATOM 0 H TRP A 87 5.240 12.613 3.246 1.00 74.03 H new ATOM 0 HA TRP A 87 7.400 14.516 3.142 1.00 31.03 H new ATOM 0 HB2 TRP A 87 4.555 14.405 2.504 1.00 62.14 H new ATOM 0 HB3 TRP A 87 4.989 15.908 3.293 1.00 62.14 H new ATOM 0 HD1 TRP A 87 6.761 17.525 1.951 1.00 25.05 H new ATOM 0 HE1 TRP A 87 7.296 17.720 -0.568 1.00 41.40 H new ATOM 0 HE3 TRP A 87 4.877 13.051 0.397 1.00 11.11 H new ATOM 0 HZ2 TRP A 87 6.950 16.109 -2.938 1.00 33.11 H new ATOM 0 HZ3 TRP A 87 4.861 12.469 -2.000 1.00 51.40 H new ATOM 0 HH2 TRP A 87 5.902 13.966 -3.676 1.00 25.24 H new ATOM 1269 N SER A 88 6.669 16.151 5.191 1.00 64.14 N ATOM 1270 CA SER A 88 6.957 16.923 6.404 1.00 22.25 C ATOM 1271 C SER A 88 5.849 16.898 7.478 1.00 62.02 C ATOM 1272 O SER A 88 5.392 17.946 7.949 1.00 42.31 O ATOM 1273 CB SER A 88 7.239 18.369 5.962 1.00 25.15 C ATOM 1274 OG SER A 88 8.025 18.407 4.785 1.00 71.40 O ATOM 0 H SER A 88 6.647 16.767 4.378 1.00 64.14 H new ATOM 0 HA SER A 88 7.812 16.458 6.894 1.00 22.25 H new ATOM 0 HB2 SER A 88 6.296 18.888 5.788 1.00 25.15 H new ATOM 0 HB3 SER A 88 7.753 18.901 6.762 1.00 25.15 H new ATOM 0 HG SER A 88 8.186 19.339 4.529 1.00 71.40 H new ATOM 1279 N GLY A 89 5.406 15.721 7.906 1.00 70.22 N ATOM 1280 CA GLY A 89 4.323 15.525 8.851 1.00 1.41 C ATOM 1281 C GLY A 89 3.314 14.539 8.303 1.00 73.03 C ATOM 1282 O GLY A 89 2.887 13.625 9.011 1.00 63.40 O ATOM 0 H GLY A 89 5.813 14.842 7.587 1.00 70.22 H new ATOM 0 HA2 GLY A 89 4.720 15.159 9.798 1.00 1.41 H new ATOM 0 HA3 GLY A 89 3.835 16.478 9.057 1.00 1.41 H new ATOM 1286 N TYR A 90 2.937 14.707 7.037 1.00 23.03 N ATOM 1287 CA TYR A 90 1.829 14.014 6.411 1.00 31.12 C ATOM 1288 C TYR A 90 2.244 13.668 4.990 1.00 45.24 C ATOM 1289 O TYR A 90 3.058 14.388 4.412 1.00 14.42 O ATOM 1290 CB TYR A 90 0.543 14.868 6.447 1.00 20.14 C ATOM 1291 CG TYR A 90 0.727 16.376 6.558 1.00 0.24 C ATOM 1292 CD1 TYR A 90 1.421 17.111 5.575 1.00 75.34 C ATOM 1293 CD2 TYR A 90 0.240 17.035 7.703 1.00 12.25 C ATOM 1294 CE1 TYR A 90 1.653 18.489 5.753 1.00 1.43 C ATOM 1295 CE2 TYR A 90 0.462 18.409 7.884 1.00 71.22 C ATOM 1296 CZ TYR A 90 1.172 19.142 6.911 1.00 1.45 C ATOM 1297 OH TYR A 90 1.439 20.463 7.115 1.00 2.22 O ATOM 0 H TYR A 90 3.413 15.350 6.405 1.00 23.03 H new ATOM 0 HA TYR A 90 1.596 13.100 6.956 1.00 31.12 H new ATOM 0 HB2 TYR A 90 -0.029 14.661 5.543 1.00 20.14 H new ATOM 0 HB3 TYR A 90 -0.063 14.536 7.290 1.00 20.14 H new ATOM 0 HD1 TYR A 90 1.776 16.616 4.683 1.00 75.34 H new ATOM 0 HD2 TYR A 90 -0.309 16.479 8.448 1.00 12.25 H new ATOM 0 HE1 TYR A 90 2.198 19.046 5.005 1.00 1.43 H new ATOM 0 HE2 TYR A 90 0.089 18.905 8.768 1.00 71.22 H new ATOM 0 HH TYR A 90 1.033 20.752 7.959 1.00 2.22 H new ATOM 1306 N PRO A 91 1.714 12.582 4.418 1.00 54.20 N ATOM 1307 CA PRO A 91 1.932 12.253 3.019 1.00 1.32 C ATOM 1308 C PRO A 91 1.290 13.278 2.091 1.00 73.13 C ATOM 1309 O PRO A 91 0.343 13.974 2.464 1.00 34.14 O ATOM 1310 CB PRO A 91 1.323 10.872 2.812 1.00 55.41 C ATOM 1311 CG PRO A 91 0.372 10.684 3.988 1.00 14.12 C ATOM 1312 CD PRO A 91 0.879 11.598 5.083 1.00 20.44 C ATOM 0 HA PRO A 91 2.996 12.262 2.780 1.00 1.32 H new ATOM 0 HB2 PRO A 91 0.793 10.812 1.861 1.00 55.41 H new ATOM 0 HB3 PRO A 91 2.092 10.099 2.798 1.00 55.41 H new ATOM 0 HG2 PRO A 91 -0.650 10.939 3.708 1.00 14.12 H new ATOM 0 HG3 PRO A 91 0.362 9.646 4.320 1.00 14.12 H new ATOM 0 HD2 PRO A 91 0.052 12.077 5.608 1.00 20.44 H new ATOM 0 HD3 PRO A 91 1.448 11.040 5.827 1.00 20.44 H new ATOM 1317 N ALA A 92 1.745 13.279 0.841 1.00 35.11 N ATOM 1318 CA ALA A 92 1.204 14.040 -0.271 1.00 40.34 C ATOM 1319 C ALA A 92 -0.062 13.369 -0.848 1.00 55.32 C ATOM 1320 O ALA A 92 -0.127 13.068 -2.042 1.00 43.43 O ATOM 1321 CB ALA A 92 2.276 14.185 -1.332 1.00 53.50 C ATOM 0 H ALA A 92 2.548 12.714 0.566 1.00 35.11 H new ATOM 0 HA ALA A 92 0.906 15.027 0.081 1.00 40.34 H new ATOM 0 HB1 ALA A 92 1.881 14.755 -2.173 1.00 53.50 H new ATOM 0 HB2 ALA A 92 3.136 14.707 -0.912 1.00 53.50 H new ATOM 0 HB3 ALA A 92 2.583 13.197 -1.676 1.00 53.50 H new ATOM 1327 N THR A 93 -0.935 12.917 0.054 1.00 64.21 N ATOM 1328 CA THR A 93 -2.244 12.282 -0.151 1.00 42.22 C ATOM 1329 C THR A 93 -2.266 11.226 -1.291 1.00 15.21 C ATOM 1330 O THR A 93 -3.238 11.151 -2.044 1.00 11.42 O ATOM 1331 CB THR A 93 -3.300 13.398 -0.364 1.00 61.23 C ATOM 1332 OG1 THR A 93 -2.980 14.159 -1.511 1.00 1.13 O ATOM 1333 CG2 THR A 93 -3.400 14.365 0.822 1.00 53.53 C ATOM 0 H THR A 93 -0.724 12.993 1.049 1.00 64.21 H new ATOM 0 HA THR A 93 -2.483 11.705 0.742 1.00 42.22 H new ATOM 0 HB THR A 93 -4.256 12.887 -0.477 1.00 61.23 H new ATOM 0 HG1 THR A 93 -3.197 15.101 -1.350 1.00 1.13 H new ATOM 0 HG21 THR A 93 -4.155 15.122 0.612 1.00 53.53 H new ATOM 0 HG22 THR A 93 -3.680 13.813 1.719 1.00 53.53 H new ATOM 0 HG23 THR A 93 -2.436 14.849 0.979 1.00 53.53 H new ATOM 1341 N PRO A 94 -1.353 10.234 -1.346 1.00 22.04 N ATOM 1342 CA PRO A 94 -1.226 9.420 -2.554 1.00 51.44 C ATOM 1343 C PRO A 94 -2.203 8.242 -2.564 1.00 63.23 C ATOM 1344 O PRO A 94 -2.660 7.807 -3.623 1.00 15.55 O ATOM 1345 CB PRO A 94 0.237 8.969 -2.560 1.00 54.23 C ATOM 1346 CG PRO A 94 0.577 8.862 -1.082 1.00 21.23 C ATOM 1347 CD PRO A 94 -0.198 10.029 -0.489 1.00 53.42 C ATOM 0 HA PRO A 94 -1.480 9.980 -3.454 1.00 51.44 H new ATOM 0 HB2 PRO A 94 0.361 8.014 -3.071 1.00 54.23 H new ATOM 0 HB3 PRO A 94 0.878 9.689 -3.069 1.00 54.23 H new ATOM 0 HG2 PRO A 94 0.262 7.908 -0.660 1.00 21.23 H new ATOM 0 HG3 PRO A 94 1.648 8.952 -0.903 1.00 21.23 H new ATOM 0 HD2 PRO A 94 -0.507 9.810 0.533 1.00 53.42 H new ATOM 0 HD3 PRO A 94 0.420 10.926 -0.450 1.00 53.42 H new ATOM 1352 N ILE A 95 -2.524 7.683 -1.400 1.00 62.32 N ATOM 1353 CA ILE A 95 -3.345 6.483 -1.359 1.00 54.10 C ATOM 1354 C ILE A 95 -4.831 6.870 -1.368 1.00 63.21 C ATOM 1355 O ILE A 95 -5.643 6.035 -1.734 1.00 53.44 O ATOM 1356 CB ILE A 95 -2.899 5.537 -0.219 1.00 64.42 C ATOM 1357 CG1 ILE A 95 -1.362 5.425 -0.042 1.00 44.14 C ATOM 1358 CG2 ILE A 95 -3.422 4.110 -0.444 1.00 60.40 C ATOM 1359 CD1 ILE A 95 -0.510 5.094 -1.283 1.00 2.32 C ATOM 0 H ILE A 95 -2.233 8.037 -0.489 1.00 62.32 H new ATOM 0 HA ILE A 95 -3.198 5.887 -2.259 1.00 54.10 H new ATOM 0 HB ILE A 95 -3.321 5.991 0.678 1.00 64.42 H new ATOM 0 HG12 ILE A 95 -1.004 6.370 0.366 1.00 44.14 H new ATOM 0 HG13 ILE A 95 -1.168 4.660 0.709 1.00 44.14 H new ATOM 0 HG21 ILE A 95 -3.092 3.469 0.373 1.00 60.40 H new ATOM 0 HG22 ILE A 95 -4.511 4.123 -0.478 1.00 60.40 H new ATOM 0 HG23 ILE A 95 -3.034 3.725 -1.387 1.00 60.40 H new ATOM 0 HD11 ILE A 95 0.542 5.050 -1.001 1.00 2.32 H new ATOM 0 HD12 ILE A 95 -0.818 4.130 -1.689 1.00 2.32 H new ATOM 0 HD13 ILE A 95 -0.651 5.868 -2.038 1.00 2.32 H new ATOM 1370 N LYS A 96 -5.209 8.128 -1.077 1.00 34.32 N ATOM 1371 CA LYS A 96 -6.612 8.561 -0.982 1.00 0.43 C ATOM 1372 C LYS A 96 -7.390 8.198 -2.252 1.00 35.12 C ATOM 1373 O LYS A 96 -8.435 7.550 -2.177 1.00 24.41 O ATOM 1374 CB LYS A 96 -6.680 10.078 -0.691 1.00 1.35 C ATOM 1375 CG LYS A 96 -7.851 10.514 0.206 1.00 40.31 C ATOM 1376 CD LYS A 96 -9.252 10.209 -0.340 1.00 4.31 C ATOM 1377 CE LYS A 96 -10.331 10.771 0.596 1.00 63.00 C ATOM 1378 NZ LYS A 96 -11.686 10.664 0.018 1.00 2.33 N ATOM 0 H LYS A 96 -4.541 8.879 -0.900 1.00 34.32 H new ATOM 0 HA LYS A 96 -7.084 8.032 -0.154 1.00 0.43 H new ATOM 0 HB2 LYS A 96 -5.746 10.385 -0.219 1.00 1.35 H new ATOM 0 HB3 LYS A 96 -6.749 10.612 -1.639 1.00 1.35 H new ATOM 0 HG2 LYS A 96 -7.744 10.027 1.175 1.00 40.31 H new ATOM 0 HG3 LYS A 96 -7.773 11.587 0.379 1.00 40.31 H new ATOM 0 HD2 LYS A 96 -9.363 10.643 -1.334 1.00 4.31 H new ATOM 0 HD3 LYS A 96 -9.380 9.132 -0.446 1.00 4.31 H new ATOM 0 HE2 LYS A 96 -10.300 10.236 1.545 1.00 63.00 H new ATOM 0 HE3 LYS A 96 -10.112 11.817 0.812 1.00 63.00 H new ATOM 0 HZ1 LYS A 96 -12.380 11.056 0.686 1.00 2.33 H new ATOM 0 HZ2 LYS A 96 -11.726 11.196 -0.875 1.00 2.33 H new ATOM 0 HZ3 LYS A 96 -11.908 9.664 -0.165 1.00 2.33 H new ATOM 1388 N THR A 97 -6.870 8.607 -3.406 1.00 14.35 N ATOM 1389 CA THR A 97 -7.480 8.412 -4.711 1.00 15.25 C ATOM 1390 C THR A 97 -7.607 6.916 -5.015 1.00 34.21 C ATOM 1391 O THR A 97 -8.703 6.445 -5.309 1.00 42.13 O ATOM 1392 CB THR A 97 -6.624 9.174 -5.742 1.00 12.55 C ATOM 1393 OG1 THR A 97 -6.286 10.429 -5.189 1.00 3.45 O ATOM 1394 CG2 THR A 97 -7.333 9.382 -7.080 1.00 12.42 C ATOM 0 H THR A 97 -5.979 9.101 -3.456 1.00 14.35 H new ATOM 0 HA THR A 97 -8.495 8.808 -4.746 1.00 15.25 H new ATOM 0 HB THR A 97 -5.739 8.573 -5.952 1.00 12.55 H new ATOM 0 HG1 THR A 97 -5.696 10.910 -5.806 1.00 3.45 H new ATOM 0 HG21 THR A 97 -6.676 9.924 -7.760 1.00 12.42 H new ATOM 0 HG22 THR A 97 -7.584 8.414 -7.513 1.00 12.42 H new ATOM 0 HG23 THR A 97 -8.246 9.957 -6.923 1.00 12.42 H new ATOM 1402 N LEU A 98 -6.507 6.160 -4.889 1.00 71.01 N ATOM 1403 CA LEU A 98 -6.482 4.717 -5.124 1.00 20.03 C ATOM 1404 C LEU A 98 -7.508 4.021 -4.228 1.00 74.11 C ATOM 1405 O LEU A 98 -8.321 3.245 -4.713 1.00 74.21 O ATOM 1406 CB LEU A 98 -5.056 4.187 -4.868 1.00 64.02 C ATOM 1407 CG LEU A 98 -4.858 2.719 -5.292 1.00 52.14 C ATOM 1408 CD1 LEU A 98 -4.668 2.611 -6.810 1.00 71.02 C ATOM 1409 CD2 LEU A 98 -3.626 2.123 -4.604 1.00 53.22 C ATOM 0 H LEU A 98 -5.601 6.542 -4.618 1.00 71.01 H new ATOM 0 HA LEU A 98 -6.750 4.503 -6.159 1.00 20.03 H new ATOM 0 HB2 LEU A 98 -4.343 4.811 -5.407 1.00 64.02 H new ATOM 0 HB3 LEU A 98 -4.826 4.284 -3.807 1.00 64.02 H new ATOM 0 HG LEU A 98 -5.751 2.168 -4.996 1.00 52.14 H new ATOM 0 HD11 LEU A 98 -4.530 1.566 -7.086 1.00 71.02 H new ATOM 0 HD12 LEU A 98 -5.549 3.007 -7.316 1.00 71.02 H new ATOM 0 HD13 LEU A 98 -3.790 3.184 -7.108 1.00 71.02 H new ATOM 0 HD21 LEU A 98 -3.502 1.086 -4.915 1.00 53.22 H new ATOM 0 HD22 LEU A 98 -2.741 2.694 -4.884 1.00 53.22 H new ATOM 0 HD23 LEU A 98 -3.758 2.164 -3.523 1.00 53.22 H new ATOM 1420 N LEU A 99 -7.515 4.336 -2.930 1.00 12.33 N ATOM 1421 CA LEU A 99 -8.424 3.769 -1.938 1.00 72.01 C ATOM 1422 C LEU A 99 -9.876 3.881 -2.373 1.00 54.54 C ATOM 1423 O LEU A 99 -10.642 2.930 -2.224 1.00 73.12 O ATOM 1424 CB LEU A 99 -8.221 4.423 -0.562 1.00 52.20 C ATOM 1425 CG LEU A 99 -7.207 3.611 0.262 1.00 4.51 C ATOM 1426 CD1 LEU A 99 -6.540 4.501 1.307 1.00 4.52 C ATOM 1427 CD2 LEU A 99 -7.907 2.441 0.952 1.00 43.11 C ATOM 0 H LEU A 99 -6.866 5.015 -2.531 1.00 12.33 H new ATOM 0 HA LEU A 99 -8.184 2.709 -1.854 1.00 72.01 H new ATOM 0 HB2 LEU A 99 -7.866 5.446 -0.685 1.00 52.20 H new ATOM 0 HB3 LEU A 99 -9.172 4.478 -0.032 1.00 52.20 H new ATOM 0 HG LEU A 99 -6.443 3.223 -0.412 1.00 4.51 H new ATOM 0 HD11 LEU A 99 -5.825 3.913 1.883 1.00 4.52 H new ATOM 0 HD12 LEU A 99 -6.020 5.319 0.809 1.00 4.52 H new ATOM 0 HD13 LEU A 99 -7.298 4.907 1.977 1.00 4.52 H new ATOM 0 HD21 LEU A 99 -7.180 1.873 1.532 1.00 43.11 H new ATOM 0 HD22 LEU A 99 -8.683 2.822 1.616 1.00 43.11 H new ATOM 0 HD23 LEU A 99 -8.358 1.792 0.201 1.00 43.11 H new ATOM 1438 N ASP A 100 -10.268 5.018 -2.943 1.00 51.20 N ATOM 1439 CA ASP A 100 -11.648 5.213 -3.379 1.00 24.02 C ATOM 1440 C ASP A 100 -12.052 4.241 -4.489 1.00 13.25 C ATOM 1441 O ASP A 100 -13.207 3.812 -4.562 1.00 34.34 O ATOM 1442 CB ASP A 100 -11.865 6.655 -3.827 1.00 3.45 C ATOM 1443 CG ASP A 100 -13.298 7.046 -3.515 1.00 53.44 C ATOM 1444 OD1 ASP A 100 -13.564 7.293 -2.316 1.00 73.23 O ATOM 1445 OD2 ASP A 100 -14.138 7.107 -4.439 1.00 55.31 O ATOM 0 H ASP A 100 -9.653 5.814 -3.113 1.00 51.20 H new ATOM 0 HA ASP A 100 -12.288 5.003 -2.522 1.00 24.02 H new ATOM 0 HB2 ASP A 100 -11.171 7.320 -3.313 1.00 3.45 H new ATOM 0 HB3 ASP A 100 -11.669 6.753 -4.895 1.00 3.45 H new ATOM 1449 N GLN A 101 -11.091 3.835 -5.320 1.00 62.12 N ATOM 1450 CA GLN A 101 -11.297 2.883 -6.404 1.00 63.02 C ATOM 1451 C GLN A 101 -11.318 1.431 -5.912 1.00 22.11 C ATOM 1452 O GLN A 101 -11.779 0.564 -6.648 1.00 20.23 O ATOM 1453 CB GLN A 101 -10.229 3.077 -7.494 1.00 63.30 C ATOM 1454 CG GLN A 101 -10.314 4.451 -8.166 1.00 4.32 C ATOM 1455 CD GLN A 101 -9.752 4.435 -9.585 1.00 32.34 C ATOM 1456 OE1 GLN A 101 -8.487 4.756 -9.776 1.00 43.14 O flip ATOM 1457 NE2 GLN A 101 -10.464 4.176 -10.548 1.00 4.54 N flip ATOM 0 H GLN A 101 -10.129 4.168 -5.254 1.00 62.12 H new ATOM 0 HA GLN A 101 -12.280 3.084 -6.830 1.00 63.02 H new ATOM 0 HB2 GLN A 101 -9.240 2.953 -7.054 1.00 63.30 H new ATOM 0 HB3 GLN A 101 -10.342 2.300 -8.250 1.00 63.30 H new ATOM 0 HG2 GLN A 101 -11.354 4.777 -8.193 1.00 4.32 H new ATOM 0 HG3 GLN A 101 -9.767 5.180 -7.569 1.00 4.32 H new ATOM 0 HE21 GLN A 101 -11.443 3.927 -10.406 1.00 4.54 H new ATOM 0 HE22 GLN A 101 -10.078 4.209 -11.491 1.00 4.54 H new ATOM 1464 N MET A 102 -10.872 1.143 -4.684 1.00 34.35 N ATOM 1465 CA MET A 102 -10.575 -0.218 -4.217 1.00 13.14 C ATOM 1466 C MET A 102 -11.221 -0.585 -2.877 1.00 15.43 C ATOM 1467 O MET A 102 -10.925 -1.647 -2.343 1.00 52.52 O ATOM 1468 CB MET A 102 -9.054 -0.448 -4.183 1.00 2.55 C ATOM 1469 CG MET A 102 -8.307 0.570 -3.330 1.00 53.50 C ATOM 1470 SD MET A 102 -7.463 -0.029 -1.850 1.00 64.22 S ATOM 1471 CE MET A 102 -5.774 0.335 -2.387 1.00 71.33 C ATOM 0 H MET A 102 -10.705 1.858 -3.976 1.00 34.35 H new ATOM 0 HA MET A 102 -11.032 -0.891 -4.942 1.00 13.14 H new ATOM 0 HB2 MET A 102 -8.854 -1.449 -3.800 1.00 2.55 H new ATOM 0 HB3 MET A 102 -8.666 -0.413 -5.201 1.00 2.55 H new ATOM 0 HG2 MET A 102 -7.566 1.059 -3.963 1.00 53.50 H new ATOM 0 HG3 MET A 102 -9.019 1.336 -3.023 1.00 53.50 H new ATOM 0 HE1 MET A 102 -5.066 -0.148 -1.714 1.00 71.33 H new ATOM 0 HE2 MET A 102 -5.625 -0.040 -3.400 1.00 71.33 H new ATOM 0 HE3 MET A 102 -5.612 1.413 -2.372 1.00 71.33 H new ATOM 1479 N LYS A 103 -12.136 0.222 -2.329 1.00 55.41 N ATOM 1480 CA LYS A 103 -12.757 0.005 -1.011 1.00 14.14 C ATOM 1481 C LYS A 103 -13.303 -1.404 -0.736 1.00 44.14 C ATOM 1482 O LYS A 103 -13.423 -1.784 0.425 1.00 60.10 O ATOM 1483 CB LYS A 103 -13.871 1.031 -0.771 1.00 73.14 C ATOM 1484 CG LYS A 103 -13.341 2.470 -0.732 1.00 32.42 C ATOM 1485 CD LYS A 103 -14.171 3.327 0.220 1.00 73.32 C ATOM 1486 CE LYS A 103 -13.844 4.813 0.027 1.00 53.32 C ATOM 1487 NZ LYS A 103 -14.612 5.661 0.956 1.00 14.24 N ATOM 0 H LYS A 103 -12.475 1.063 -2.797 1.00 55.41 H new ATOM 0 HA LYS A 103 -11.931 0.131 -0.311 1.00 14.14 H new ATOM 0 HB2 LYS A 103 -14.618 0.943 -1.559 1.00 73.14 H new ATOM 0 HB3 LYS A 103 -14.372 0.806 0.170 1.00 73.14 H new ATOM 0 HG2 LYS A 103 -12.299 2.470 -0.414 1.00 32.42 H new ATOM 0 HG3 LYS A 103 -13.368 2.900 -1.733 1.00 32.42 H new ATOM 0 HD2 LYS A 103 -15.233 3.156 0.041 1.00 73.32 H new ATOM 0 HD3 LYS A 103 -13.970 3.035 1.251 1.00 73.32 H new ATOM 0 HE2 LYS A 103 -12.777 4.975 0.182 1.00 53.32 H new ATOM 0 HE3 LYS A 103 -14.064 5.105 -1.000 1.00 53.32 H new ATOM 0 HZ1 LYS A 103 -14.367 6.659 0.798 1.00 14.24 H new ATOM 0 HZ2 LYS A 103 -15.630 5.524 0.790 1.00 14.24 H new ATOM 0 HZ3 LYS A 103 -14.383 5.399 1.936 1.00 14.24 H new ATOM 1497 N ASN A 104 -13.628 -2.182 -1.772 1.00 61.20 N ATOM 1498 CA ASN A 104 -14.097 -3.570 -1.646 1.00 52.33 C ATOM 1499 C ASN A 104 -12.953 -4.578 -1.408 1.00 4.11 C ATOM 1500 O ASN A 104 -13.207 -5.785 -1.408 1.00 61.52 O ATOM 1501 CB ASN A 104 -14.976 -3.947 -2.859 1.00 21.22 C ATOM 1502 CG ASN A 104 -16.418 -3.500 -2.656 1.00 24.52 C ATOM 1503 OD1 ASN A 104 -17.325 -4.316 -2.516 1.00 34.55 O ATOM 1504 ND2 ASN A 104 -16.664 -2.203 -2.585 1.00 14.42 N ATOM 0 H ASN A 104 -13.573 -1.862 -2.739 1.00 61.20 H new ATOM 0 HA ASN A 104 -14.712 -3.628 -0.748 1.00 52.33 H new ATOM 0 HB2 ASN A 104 -14.573 -3.485 -3.761 1.00 21.22 H new ATOM 0 HB3 ASN A 104 -14.945 -5.026 -3.012 1.00 21.22 H new ATOM 0 HD21 ASN A 104 -17.614 -1.873 -2.413 1.00 14.42 H new ATOM 0 HD22 ASN A 104 -15.904 -1.533 -2.703 1.00 14.42 H new ATOM 1510 N TYR A 105 -11.723 -4.100 -1.189 1.00 63.40 N ATOM 1511 CA TYR A 105 -10.592 -4.847 -0.635 1.00 14.04 C ATOM 1512 C TYR A 105 -11.063 -5.662 0.575 1.00 22.34 C ATOM 1513 O TYR A 105 -11.832 -5.157 1.401 1.00 0.25 O ATOM 1514 CB TYR A 105 -9.495 -3.867 -0.162 1.00 14.35 C ATOM 1515 CG TYR A 105 -8.189 -3.753 -0.923 1.00 24.34 C ATOM 1516 CD1 TYR A 105 -8.167 -3.534 -2.312 1.00 71.32 C ATOM 1517 CD2 TYR A 105 -6.986 -3.690 -0.191 1.00 21.33 C ATOM 1518 CE1 TYR A 105 -6.962 -3.180 -2.949 1.00 24.15 C ATOM 1519 CE2 TYR A 105 -5.782 -3.335 -0.820 1.00 11.31 C ATOM 1520 CZ TYR A 105 -5.774 -3.044 -2.200 1.00 52.41 C ATOM 1521 OH TYR A 105 -4.636 -2.587 -2.786 1.00 2.53 O ATOM 0 H TYR A 105 -11.479 -3.133 -1.405 1.00 63.40 H new ATOM 0 HA TYR A 105 -10.194 -5.506 -1.407 1.00 14.04 H new ATOM 0 HB2 TYR A 105 -9.941 -2.873 -0.136 1.00 14.35 H new ATOM 0 HB3 TYR A 105 -9.247 -4.132 0.866 1.00 14.35 H new ATOM 0 HD1 TYR A 105 -9.074 -3.637 -2.890 1.00 71.32 H new ATOM 0 HD2 TYR A 105 -6.990 -3.917 0.865 1.00 21.33 H new ATOM 0 HE1 TYR A 105 -6.947 -3.012 -4.016 1.00 24.15 H new ATOM 0 HE2 TYR A 105 -4.866 -3.285 -0.250 1.00 11.31 H new ATOM 0 HH TYR A 105 -4.830 -2.309 -3.705 1.00 2.53 H new ATOM 1530 N ARG A 106 -10.556 -6.880 0.745 1.00 41.11 N ATOM 1531 CA ARG A 106 -10.759 -7.692 1.946 1.00 75.31 C ATOM 1532 C ARG A 106 -9.399 -8.189 2.439 1.00 71.33 C ATOM 1533 O ARG A 106 -8.383 -7.959 1.779 1.00 41.13 O ATOM 1534 CB ARG A 106 -11.755 -8.824 1.674 1.00 4.35 C ATOM 1535 CG ARG A 106 -13.106 -8.281 1.168 1.00 11.31 C ATOM 1536 CD ARG A 106 -14.204 -9.267 1.540 1.00 44.13 C ATOM 1537 NE ARG A 106 -15.453 -9.023 0.800 1.00 74.24 N ATOM 1538 CZ ARG A 106 -16.677 -9.412 1.176 1.00 73.12 C ATOM 1539 NH1 ARG A 106 -16.888 -10.014 2.345 1.00 53.04 N ATOM 1540 NH2 ARG A 106 -17.701 -9.205 0.361 1.00 33.54 N ATOM 0 H ARG A 106 -9.981 -7.341 0.040 1.00 41.11 H new ATOM 0 HA ARG A 106 -11.203 -7.093 2.741 1.00 75.31 H new ATOM 0 HB2 ARG A 106 -11.337 -9.508 0.935 1.00 4.35 H new ATOM 0 HB3 ARG A 106 -11.912 -9.399 2.587 1.00 4.35 H new ATOM 0 HG2 ARG A 106 -13.310 -7.306 1.610 1.00 11.31 H new ATOM 0 HG3 ARG A 106 -13.075 -8.141 0.087 1.00 11.31 H new ATOM 0 HD2 ARG A 106 -13.860 -10.282 1.341 1.00 44.13 H new ATOM 0 HD3 ARG A 106 -14.400 -9.201 2.610 1.00 44.13 H new ATOM 0 HE ARG A 106 -15.379 -8.511 -0.079 1.00 74.24 H new ATOM 0 HH11 ARG A 106 -16.107 -10.188 2.977 1.00 53.04 H new ATOM 0 HH12 ARG A 106 -17.831 -10.301 2.608 1.00 53.04 H new ATOM 0 HH21 ARG A 106 -17.551 -8.754 -0.541 1.00 33.54 H new ATOM 0 HH22 ARG A 106 -18.639 -9.497 0.636 1.00 33.54 H new ATOM 1551 N GLY A 107 -9.367 -8.876 3.578 1.00 11.04 N ATOM 1552 CA GLY A 107 -8.157 -9.536 4.039 1.00 1.31 C ATOM 1553 C GLY A 107 -7.260 -8.620 4.850 1.00 71.33 C ATOM 1554 O GLY A 107 -7.739 -7.834 5.672 1.00 53.23 O ATOM 0 H GLY A 107 -10.170 -8.988 4.197 1.00 11.04 H new ATOM 0 HA2 GLY A 107 -8.428 -10.401 4.645 1.00 1.31 H new ATOM 0 HA3 GLY A 107 -7.603 -9.911 3.179 1.00 1.31 H new ATOM 1558 N GLU A 108 -5.956 -8.808 4.677 1.00 73.51 N ATOM 1559 CA GLU A 108 -4.897 -8.095 5.377 1.00 15.23 C ATOM 1560 C GLU A 108 -4.416 -6.951 4.486 1.00 31.52 C ATOM 1561 O GLU A 108 -4.378 -7.121 3.259 1.00 21.54 O ATOM 1562 CB GLU A 108 -3.726 -9.063 5.589 1.00 35.43 C ATOM 1563 CG GLU A 108 -4.034 -10.197 6.571 1.00 44.40 C ATOM 1564 CD GLU A 108 -2.878 -11.204 6.644 1.00 33.45 C ATOM 1565 OE1 GLU A 108 -2.422 -11.722 5.600 1.00 23.35 O ATOM 1566 OE2 GLU A 108 -2.437 -11.505 7.777 1.00 55.03 O ATOM 0 H GLU A 108 -5.594 -9.493 4.014 1.00 73.51 H new ATOM 0 HA GLU A 108 -5.259 -7.712 6.331 1.00 15.23 H new ATOM 0 HB2 GLU A 108 -3.443 -9.493 4.628 1.00 35.43 H new ATOM 0 HB3 GLU A 108 -2.865 -8.503 5.953 1.00 35.43 H new ATOM 0 HG2 GLU A 108 -4.220 -9.782 7.562 1.00 44.40 H new ATOM 0 HG3 GLU A 108 -4.946 -10.709 6.263 1.00 44.40 H new ATOM 1571 N VAL A 109 -3.973 -5.833 5.076 1.00 23.54 N ATOM 1572 CA VAL A 109 -3.327 -4.753 4.341 1.00 23.32 C ATOM 1573 C VAL A 109 -2.125 -4.246 5.151 1.00 61.34 C ATOM 1574 O VAL A 109 -2.145 -4.315 6.379 1.00 54.33 O ATOM 1575 CB VAL A 109 -4.359 -3.639 4.048 1.00 23.32 C ATOM 1576 CG1 VAL A 109 -3.799 -2.574 3.093 1.00 74.22 C ATOM 1577 CG2 VAL A 109 -5.642 -4.138 3.369 1.00 13.35 C ATOM 0 H VAL A 109 -4.055 -5.658 6.077 1.00 23.54 H new ATOM 0 HA VAL A 109 -2.953 -5.106 3.380 1.00 23.32 H new ATOM 0 HB VAL A 109 -4.581 -3.240 5.038 1.00 23.32 H new ATOM 0 HG11 VAL A 109 -4.557 -1.811 2.914 1.00 74.22 H new ATOM 0 HG12 VAL A 109 -2.918 -2.113 3.539 1.00 74.22 H new ATOM 0 HG13 VAL A 109 -3.525 -3.041 2.147 1.00 74.22 H new ATOM 0 HG21 VAL A 109 -6.314 -3.297 3.198 1.00 13.35 H new ATOM 0 HG22 VAL A 109 -5.392 -4.603 2.415 1.00 13.35 H new ATOM 0 HG23 VAL A 109 -6.133 -4.869 4.011 1.00 13.35 H new ATOM 1587 N ALA A 110 -1.078 -3.718 4.510 1.00 75.51 N ATOM 1588 CA ALA A 110 -0.002 -2.982 5.184 1.00 14.15 C ATOM 1589 C ALA A 110 0.401 -1.719 4.406 1.00 24.22 C ATOM 1590 O ALA A 110 -0.062 -1.508 3.281 1.00 20.24 O ATOM 1591 CB ALA A 110 1.148 -3.949 5.484 1.00 11.35 C ATOM 0 H ALA A 110 -0.952 -3.789 3.500 1.00 75.51 H new ATOM 0 HA ALA A 110 -0.350 -2.595 6.142 1.00 14.15 H new ATOM 0 HB1 ALA A 110 1.953 -3.412 5.985 1.00 11.35 H new ATOM 0 HB2 ALA A 110 0.790 -4.751 6.129 1.00 11.35 H new ATOM 0 HB3 ALA A 110 1.520 -4.373 4.551 1.00 11.35 H new ATOM 1597 N SER A 111 1.223 -0.856 5.019 1.00 12.02 N ATOM 1598 CA SER A 111 1.575 0.481 4.558 1.00 10.43 C ATOM 1599 C SER A 111 3.021 0.795 4.978 1.00 70.24 C ATOM 1600 O SER A 111 3.237 1.362 6.057 1.00 64.03 O ATOM 1601 CB SER A 111 0.561 1.483 5.132 1.00 51.52 C ATOM 1602 OG SER A 111 0.749 2.795 4.624 1.00 52.13 O ATOM 0 H SER A 111 1.682 -1.092 5.899 1.00 12.02 H new ATOM 0 HA SER A 111 1.531 0.550 3.471 1.00 10.43 H new ATOM 0 HB2 SER A 111 -0.449 1.147 4.898 1.00 51.52 H new ATOM 0 HB3 SER A 111 0.648 1.501 6.218 1.00 51.52 H new ATOM 0 HG SER A 111 -0.116 3.253 4.572 1.00 52.13 H new ATOM 1607 N PHE A 112 4.027 0.467 4.158 1.00 1.42 N ATOM 1608 CA PHE A 112 5.427 0.727 4.505 1.00 72.03 C ATOM 1609 C PHE A 112 5.891 2.133 4.068 1.00 32.02 C ATOM 1610 O PHE A 112 5.567 2.604 2.975 1.00 34.05 O ATOM 1611 CB PHE A 112 6.361 -0.389 4.001 1.00 70.41 C ATOM 1612 CG PHE A 112 5.935 -1.158 2.762 1.00 34.35 C ATOM 1613 CD1 PHE A 112 5.624 -0.474 1.576 1.00 30.03 C ATOM 1614 CD2 PHE A 112 5.887 -2.567 2.775 1.00 21.25 C ATOM 1615 CE1 PHE A 112 5.180 -1.177 0.446 1.00 13.24 C ATOM 1616 CE2 PHE A 112 5.514 -3.270 1.618 1.00 34.24 C ATOM 1617 CZ PHE A 112 5.136 -2.574 0.462 1.00 13.42 C ATOM 0 H PHE A 112 3.896 0.021 3.250 1.00 1.42 H new ATOM 0 HA PHE A 112 5.489 0.716 5.593 1.00 72.03 H new ATOM 0 HB2 PHE A 112 7.337 0.054 3.802 1.00 70.41 H new ATOM 0 HB3 PHE A 112 6.496 -1.106 4.811 1.00 70.41 H new ATOM 0 HD1 PHE A 112 5.727 0.600 1.533 1.00 30.03 H new ATOM 0 HD2 PHE A 112 6.138 -3.107 3.676 1.00 21.25 H new ATOM 0 HE1 PHE A 112 4.872 -0.638 -0.438 1.00 13.24 H new ATOM 0 HE2 PHE A 112 5.518 -4.350 1.619 1.00 34.24 H new ATOM 0 HZ PHE A 112 4.812 -3.116 -0.414 1.00 13.42 H new ATOM 1626 N PHE A 113 6.683 2.812 4.906 1.00 22.14 N ATOM 1627 CA PHE A 113 7.345 4.098 4.606 1.00 34.24 C ATOM 1628 C PHE A 113 8.726 3.862 3.988 1.00 43.53 C ATOM 1629 O PHE A 113 9.210 2.733 4.022 1.00 70.43 O ATOM 1630 CB PHE A 113 7.578 4.891 5.898 1.00 30.34 C ATOM 1631 CG PHE A 113 6.376 5.080 6.783 1.00 13.12 C ATOM 1632 CD1 PHE A 113 5.408 6.026 6.429 1.00 41.30 C ATOM 1633 CD2 PHE A 113 6.214 4.315 7.959 1.00 31.42 C ATOM 1634 CE1 PHE A 113 4.308 6.172 7.269 1.00 52.30 C ATOM 1635 CE2 PHE A 113 5.133 4.528 8.822 1.00 31.02 C ATOM 1636 CZ PHE A 113 4.160 5.465 8.466 1.00 52.31 C ATOM 0 H PHE A 113 6.891 2.474 5.846 1.00 22.14 H new ATOM 0 HA PHE A 113 6.697 4.642 3.919 1.00 34.24 H new ATOM 0 HB2 PHE A 113 8.353 4.387 6.475 1.00 30.34 H new ATOM 0 HB3 PHE A 113 7.967 5.874 5.632 1.00 30.34 H new ATOM 0 HD1 PHE A 113 5.511 6.623 5.535 1.00 41.30 H new ATOM 0 HD2 PHE A 113 6.939 3.550 8.197 1.00 31.42 H new ATOM 0 HE1 PHE A 113 3.531 6.865 6.982 1.00 52.30 H new ATOM 0 HE2 PHE A 113 5.052 3.977 9.748 1.00 31.02 H new ATOM 0 HZ PHE A 113 3.307 5.640 9.105 1.00 52.31 H new ATOM 1645 N THR A 114 9.418 4.918 3.538 1.00 65.44 N ATOM 1646 CA THR A 114 10.837 4.836 3.165 1.00 54.31 C ATOM 1647 C THR A 114 11.706 6.018 3.613 1.00 73.41 C ATOM 1648 O THR A 114 12.846 6.152 3.153 1.00 1.44 O ATOM 1649 CB THR A 114 11.003 4.539 1.655 1.00 31.22 C ATOM 1650 OG1 THR A 114 9.810 4.659 0.891 1.00 5.32 O ATOM 1651 CG2 THR A 114 11.599 3.144 1.512 1.00 5.21 C ATOM 0 H THR A 114 9.013 5.847 3.423 1.00 65.44 H new ATOM 0 HA THR A 114 11.225 3.993 3.736 1.00 54.31 H new ATOM 0 HB THR A 114 11.665 5.301 1.244 1.00 31.22 H new ATOM 0 HG1 THR A 114 10.013 5.084 0.032 1.00 5.32 H new ATOM 0 HG21 THR A 114 11.727 2.909 0.455 1.00 5.21 H new ATOM 0 HG22 THR A 114 12.568 3.109 2.011 1.00 5.21 H new ATOM 0 HG23 THR A 114 10.930 2.414 1.968 1.00 5.21 H new ATOM 1659 N SER A 115 11.186 6.884 4.484 1.00 44.30 N ATOM 1660 CA SER A 115 11.866 8.112 4.892 1.00 1.24 C ATOM 1661 C SER A 115 13.062 7.831 5.808 1.00 3.44 C ATOM 1662 O SER A 115 13.234 6.728 6.331 1.00 43.51 O ATOM 1663 CB SER A 115 10.891 9.099 5.547 1.00 21.32 C ATOM 1664 OG SER A 115 10.761 10.215 4.685 1.00 65.34 O ATOM 0 H SER A 115 10.277 6.752 4.928 1.00 44.30 H new ATOM 0 HA SER A 115 12.256 8.574 3.985 1.00 1.24 H new ATOM 0 HB2 SER A 115 9.922 8.627 5.710 1.00 21.32 H new ATOM 0 HB3 SER A 115 11.262 9.411 6.523 1.00 21.32 H new ATOM 0 HG SER A 115 10.447 10.989 5.197 1.00 65.34 H new ATOM 1669 N ALA A 116 13.822 8.886 6.108 1.00 11.21 N ATOM 1670 CA ALA A 116 14.961 8.907 6.999 1.00 5.24 C ATOM 1671 C ALA A 116 14.398 9.117 8.400 1.00 62.23 C ATOM 1672 O ALA A 116 14.611 10.156 9.026 1.00 72.02 O ATOM 1673 CB ALA A 116 15.915 10.036 6.576 1.00 51.14 C ATOM 0 H ALA A 116 13.638 9.804 5.703 1.00 11.21 H new ATOM 0 HA ALA A 116 15.539 7.983 6.969 1.00 5.24 H new ATOM 0 HB1 ALA A 116 16.775 10.055 7.245 1.00 51.14 H new ATOM 0 HB2 ALA A 116 16.254 9.863 5.555 1.00 51.14 H new ATOM 0 HB3 ALA A 116 15.393 10.992 6.628 1.00 51.14 H new ATOM 1679 N GLY A 117 13.577 8.166 8.837 1.00 1.31 N ATOM 1680 CA GLY A 117 13.181 8.025 10.220 1.00 62.34 C ATOM 1681 C GLY A 117 12.289 9.130 10.798 1.00 74.13 C ATOM 1682 O GLY A 117 12.066 9.171 12.012 1.00 45.22 O ATOM 0 H GLY A 117 13.165 7.463 8.223 1.00 1.31 H new ATOM 0 HA2 GLY A 117 12.659 7.075 10.329 1.00 62.34 H new ATOM 0 HA3 GLY A 117 14.084 7.964 10.828 1.00 62.34 H new ATOM 1686 N THR A 118 11.788 10.037 9.971 1.00 44.41 N ATOM 1687 CA THR A 118 11.275 11.334 10.388 1.00 50.40 C ATOM 1688 C THR A 118 9.752 11.386 10.240 1.00 70.12 C ATOM 1689 O THR A 118 9.184 10.673 9.411 1.00 72.24 O ATOM 1690 CB THR A 118 12.005 12.416 9.559 1.00 62.31 C ATOM 1691 OG1 THR A 118 12.569 11.907 8.357 1.00 52.11 O ATOM 1692 CG2 THR A 118 13.159 13.015 10.361 1.00 10.23 C ATOM 0 H THR A 118 11.726 9.887 8.964 1.00 44.41 H new ATOM 0 HA THR A 118 11.471 11.515 11.445 1.00 50.40 H new ATOM 0 HB THR A 118 11.245 13.160 9.318 1.00 62.31 H new ATOM 0 HG1 THR A 118 13.373 11.388 8.567 1.00 52.11 H new ATOM 0 HG21 THR A 118 13.662 13.775 9.763 1.00 10.23 H new ATOM 0 HG22 THR A 118 12.771 13.469 11.273 1.00 10.23 H new ATOM 0 HG23 THR A 118 13.868 12.229 10.620 1.00 10.23 H new ATOM 1700 N ASN A 119 9.083 12.211 11.061 1.00 52.53 N ATOM 1701 CA ASN A 119 7.646 12.515 11.011 1.00 70.21 C ATOM 1702 C ASN A 119 6.765 11.268 11.202 1.00 71.23 C ATOM 1703 O ASN A 119 5.578 11.278 10.873 1.00 43.52 O ATOM 1704 CB ASN A 119 7.259 13.300 9.738 1.00 3.21 C ATOM 1705 CG ASN A 119 8.281 14.320 9.260 1.00 14.25 C ATOM 1706 OD1 ASN A 119 9.182 13.981 8.505 1.00 72.20 O ATOM 1707 ND2 ASN A 119 8.206 15.567 9.682 1.00 4.55 N ATOM 0 H ASN A 119 9.555 12.709 11.816 1.00 52.53 H new ATOM 0 HA ASN A 119 7.448 13.166 11.863 1.00 70.21 H new ATOM 0 HB2 ASN A 119 7.080 12.587 8.933 1.00 3.21 H new ATOM 0 HB3 ASN A 119 6.317 13.815 9.923 1.00 3.21 H new ATOM 0 HD21 ASN A 119 8.900 16.251 9.379 1.00 4.55 H new ATOM 0 HD22 ASN A 119 7.454 15.848 10.311 1.00 4.55 H new ATOM 1713 N HIS A 120 7.335 10.163 11.698 1.00 14.43 N ATOM 1714 CA HIS A 120 6.749 8.836 11.567 1.00 13.54 C ATOM 1715 C HIS A 120 5.434 8.746 12.334 1.00 73.20 C ATOM 1716 O HIS A 120 4.439 8.281 11.782 1.00 14.35 O ATOM 1717 CB HIS A 120 7.741 7.756 12.040 1.00 41.22 C ATOM 1718 CG HIS A 120 8.768 7.332 11.015 1.00 74.32 C ATOM 1719 ND1 HIS A 120 9.054 7.945 9.813 1.00 54.20 N ATOM 1720 CD2 HIS A 120 9.517 6.187 11.072 1.00 43.24 C ATOM 1721 CE1 HIS A 120 9.923 7.168 9.149 1.00 33.33 C ATOM 1722 NE2 HIS A 120 10.232 6.083 9.876 1.00 42.44 N ATOM 0 H HIS A 120 8.221 10.171 12.203 1.00 14.43 H new ATOM 0 HA HIS A 120 6.534 8.659 10.513 1.00 13.54 H new ATOM 0 HB2 HIS A 120 8.263 8.126 12.922 1.00 41.22 H new ATOM 0 HB3 HIS A 120 7.176 6.877 12.350 1.00 41.22 H new ATOM 0 HD1 HIS A 120 8.672 8.833 9.486 1.00 54.20 H new ATOM 0 HD2 HIS A 120 9.549 5.489 11.895 1.00 43.24 H new ATOM 0 HE1 HIS A 120 10.318 7.385 8.168 1.00 33.33 H new ATOM 1729 N LYS A 121 5.409 9.179 13.603 1.00 42.32 N ATOM 1730 CA LYS A 121 4.192 9.056 14.412 1.00 41.04 C ATOM 1731 C LYS A 121 3.049 9.823 13.742 1.00 63.11 C ATOM 1732 O LYS A 121 1.944 9.295 13.650 1.00 2.02 O ATOM 1733 CB LYS A 121 4.417 9.525 15.866 1.00 73.42 C ATOM 1734 CG LYS A 121 3.913 8.504 16.899 1.00 71.40 C ATOM 1735 CD LYS A 121 3.677 9.086 18.306 1.00 50.12 C ATOM 1736 CE LYS A 121 2.296 9.749 18.388 1.00 70.32 C ATOM 1737 NZ LYS A 121 1.889 10.092 19.767 1.00 70.20 N ATOM 0 H LYS A 121 6.201 9.609 14.082 1.00 42.32 H new ATOM 0 HA LYS A 121 3.920 8.002 14.469 1.00 41.04 H new ATOM 0 HB2 LYS A 121 5.480 9.704 16.026 1.00 73.42 H new ATOM 0 HB3 LYS A 121 3.907 10.476 16.021 1.00 73.42 H new ATOM 0 HG2 LYS A 121 2.981 8.070 16.538 1.00 71.40 H new ATOM 0 HG3 LYS A 121 4.636 7.692 16.972 1.00 71.40 H new ATOM 0 HD2 LYS A 121 3.751 8.294 19.051 1.00 50.12 H new ATOM 0 HD3 LYS A 121 4.452 9.816 18.539 1.00 50.12 H new ATOM 0 HE2 LYS A 121 2.300 10.655 17.783 1.00 70.32 H new ATOM 0 HE3 LYS A 121 1.554 9.079 17.954 1.00 70.32 H new ATOM 0 HZ1 LYS A 121 0.949 10.536 19.751 1.00 70.20 H new ATOM 0 HZ2 LYS A 121 1.854 9.227 20.344 1.00 70.20 H new ATOM 0 HZ3 LYS A 121 2.577 10.755 20.178 1.00 70.20 H new ATOM 1747 N ALA A 122 3.330 11.031 13.239 1.00 3.35 N ATOM 1748 CA ALA A 122 2.309 11.890 12.654 1.00 1.32 C ATOM 1749 C ALA A 122 1.697 11.256 11.413 1.00 4.54 C ATOM 1750 O ALA A 122 0.489 11.370 11.221 1.00 31.31 O ATOM 1751 CB ALA A 122 2.885 13.267 12.313 1.00 62.31 C ATOM 0 H ALA A 122 4.267 11.433 13.229 1.00 3.35 H new ATOM 0 HA ALA A 122 1.521 12.015 13.397 1.00 1.32 H new ATOM 0 HB1 ALA A 122 2.104 13.890 11.878 1.00 62.31 H new ATOM 0 HB2 ALA A 122 3.262 13.739 13.221 1.00 62.31 H new ATOM 0 HB3 ALA A 122 3.700 13.154 11.598 1.00 62.31 H new ATOM 1757 N TYR A 123 2.497 10.610 10.566 1.00 43.42 N ATOM 1758 CA TYR A 123 1.973 9.941 9.386 1.00 14.11 C ATOM 1759 C TYR A 123 1.040 8.807 9.798 1.00 1.44 C ATOM 1760 O TYR A 123 -0.072 8.780 9.285 1.00 3.21 O ATOM 1761 CB TYR A 123 3.103 9.431 8.514 1.00 12.22 C ATOM 1762 CG TYR A 123 2.695 9.083 7.094 1.00 51.33 C ATOM 1763 CD1 TYR A 123 1.665 8.154 6.799 1.00 53.41 C ATOM 1764 CD2 TYR A 123 3.516 9.545 6.056 1.00 12.31 C ATOM 1765 CE1 TYR A 123 1.547 7.599 5.515 1.00 1.43 C ATOM 1766 CE2 TYR A 123 3.410 8.986 4.781 1.00 54.10 C ATOM 1767 CZ TYR A 123 2.464 7.984 4.523 1.00 2.14 C ATOM 1768 OH TYR A 123 2.446 7.437 3.294 1.00 10.31 O ATOM 0 H TYR A 123 3.508 10.538 10.678 1.00 43.42 H new ATOM 0 HA TYR A 123 1.400 10.659 8.799 1.00 14.11 H new ATOM 0 HB2 TYR A 123 3.887 10.187 8.478 1.00 12.22 H new ATOM 0 HB3 TYR A 123 3.535 8.546 8.982 1.00 12.22 H new ATOM 0 HD1 TYR A 123 0.964 7.871 7.570 1.00 53.41 H new ATOM 0 HD2 TYR A 123 4.230 10.333 6.242 1.00 12.31 H new ATOM 0 HE1 TYR A 123 0.765 6.888 5.294 1.00 1.43 H new ATOM 0 HE2 TYR A 123 4.060 9.327 3.989 1.00 54.10 H new ATOM 0 HH TYR A 123 3.365 7.288 2.989 1.00 10.31 H new ATOM 1777 N VAL A 124 1.438 7.887 10.692 1.00 53.34 N ATOM 1778 CA VAL A 124 0.593 6.756 11.117 1.00 14.35 C ATOM 1779 C VAL A 124 -0.790 7.308 11.519 1.00 55.21 C ATOM 1780 O VAL A 124 -1.819 6.874 10.993 1.00 53.34 O ATOM 1781 CB VAL A 124 1.276 5.963 12.258 1.00 24.15 C ATOM 1782 CG1 VAL A 124 0.463 4.732 12.692 1.00 3.15 C ATOM 1783 CG2 VAL A 124 2.655 5.413 11.845 1.00 54.31 C ATOM 0 H VAL A 124 2.354 7.905 11.141 1.00 53.34 H new ATOM 0 HA VAL A 124 0.457 6.049 10.299 1.00 14.35 H new ATOM 0 HB VAL A 124 1.360 6.687 13.069 1.00 24.15 H new ATOM 0 HG11 VAL A 124 0.988 4.213 13.494 1.00 3.15 H new ATOM 0 HG12 VAL A 124 -0.518 5.050 13.046 1.00 3.15 H new ATOM 0 HG13 VAL A 124 0.341 4.059 11.843 1.00 3.15 H new ATOM 0 HG21 VAL A 124 3.093 4.865 12.679 1.00 54.31 H new ATOM 0 HG22 VAL A 124 2.539 4.744 10.992 1.00 54.31 H new ATOM 0 HG23 VAL A 124 3.310 6.240 11.571 1.00 54.31 H new ATOM 1793 N SER A 125 -0.812 8.332 12.376 1.00 53.14 N ATOM 1794 CA SER A 125 -2.025 9.005 12.823 1.00 3.33 C ATOM 1795 C SER A 125 -2.829 9.686 11.701 1.00 75.42 C ATOM 1796 O SER A 125 -4.024 9.929 11.866 1.00 63.33 O ATOM 1797 CB SER A 125 -1.593 10.071 13.832 1.00 43.33 C ATOM 1798 OG SER A 125 -0.784 9.529 14.862 1.00 43.31 O ATOM 0 H SER A 125 0.036 8.722 12.786 1.00 53.14 H new ATOM 0 HA SER A 125 -2.687 8.248 13.243 1.00 3.33 H new ATOM 0 HB2 SER A 125 -1.044 10.858 13.315 1.00 43.33 H new ATOM 0 HB3 SER A 125 -2.477 10.534 14.271 1.00 43.33 H new ATOM 0 HG SER A 125 0.153 9.525 14.574 1.00 43.31 H new ATOM 1803 N HIS A 126 -2.194 10.042 10.586 1.00 32.12 N ATOM 1804 CA HIS A 126 -2.815 10.742 9.468 1.00 64.14 C ATOM 1805 C HIS A 126 -3.320 9.778 8.406 1.00 4.22 C ATOM 1806 O HIS A 126 -4.334 10.039 7.771 1.00 15.13 O ATOM 1807 CB HIS A 126 -1.791 11.695 8.850 1.00 15.42 C ATOM 1808 CG HIS A 126 -2.403 12.866 8.140 1.00 51.24 C ATOM 1809 ND1 HIS A 126 -2.844 13.997 8.769 1.00 63.03 N flip ATOM 1810 CD2 HIS A 126 -2.548 13.049 6.780 1.00 4.24 C flip ATOM 1811 CE1 HIS A 126 -3.284 14.882 7.785 1.00 14.44 C flip ATOM 1812 NE2 HIS A 126 -3.076 14.271 6.605 1.00 55.40 N flip ATOM 0 H HIS A 126 -1.205 9.845 10.433 1.00 32.12 H new ATOM 0 HA HIS A 126 -3.675 11.295 9.846 1.00 64.14 H new ATOM 0 HB2 HIS A 126 -1.131 12.063 9.636 1.00 15.42 H new ATOM 0 HB3 HIS A 126 -1.170 11.140 8.147 1.00 15.42 H new ATOM 0 HD1 HIS A 126 -2.850 14.163 9.775 1.00 63.03 H new ATOM 0 HD2 HIS A 126 -2.287 12.344 6.005 1.00 4.24 H new ATOM 0 HE1 HIS A 126 -3.708 15.863 7.940 1.00 14.44 H new ATOM 1819 N PHE A 127 -2.609 8.679 8.152 1.00 60.21 N ATOM 1820 CA PHE A 127 -3.057 7.652 7.217 1.00 64.41 C ATOM 1821 C PHE A 127 -4.391 7.095 7.676 1.00 3.45 C ATOM 1822 O PHE A 127 -5.285 6.943 6.858 1.00 11.01 O ATOM 1823 CB PHE A 127 -1.985 6.575 7.079 1.00 51.44 C ATOM 1824 CG PHE A 127 -2.235 5.562 5.976 1.00 20.05 C ATOM 1825 CD1 PHE A 127 -2.379 5.973 4.634 1.00 73.10 C ATOM 1826 CD2 PHE A 127 -2.258 4.189 6.283 1.00 51.01 C ATOM 1827 CE1 PHE A 127 -2.521 5.019 3.617 1.00 43.52 C ATOM 1828 CE2 PHE A 127 -2.392 3.243 5.252 1.00 34.52 C ATOM 1829 CZ PHE A 127 -2.523 3.653 3.918 1.00 33.15 C ATOM 0 H PHE A 127 -1.709 8.478 8.588 1.00 60.21 H new ATOM 0 HA PHE A 127 -3.208 8.081 6.226 1.00 64.41 H new ATOM 0 HB2 PHE A 127 -1.026 7.059 6.897 1.00 51.44 H new ATOM 0 HB3 PHE A 127 -1.900 6.044 8.027 1.00 51.44 H new ATOM 0 HD1 PHE A 127 -2.380 7.025 4.390 1.00 73.10 H new ATOM 0 HD2 PHE A 127 -2.173 3.863 7.309 1.00 51.01 H new ATOM 0 HE1 PHE A 127 -2.630 5.341 2.592 1.00 43.52 H new ATOM 0 HE2 PHE A 127 -2.394 2.190 5.490 1.00 34.52 H new ATOM 0 HZ PHE A 127 -2.624 2.921 3.130 1.00 33.15 H new ATOM 1838 N ASN A 128 -4.554 6.922 8.988 1.00 14.01 N ATOM 1839 CA ASN A 128 -5.793 6.475 9.603 1.00 13.45 C ATOM 1840 C ASN A 128 -7.005 7.305 9.142 1.00 15.11 C ATOM 1841 O ASN A 128 -8.016 6.709 8.788 1.00 60.32 O ATOM 1842 CB ASN A 128 -5.617 6.427 11.134 1.00 44.22 C ATOM 1843 CG ASN A 128 -5.037 5.081 11.567 1.00 54.21 C ATOM 1844 OD1 ASN A 128 -5.786 4.151 11.841 1.00 1.01 O ATOM 1845 ND2 ASN A 128 -3.717 4.918 11.590 1.00 4.32 N ATOM 0 H ASN A 128 -3.809 7.094 9.663 1.00 14.01 H new ATOM 0 HA ASN A 128 -6.016 5.462 9.267 1.00 13.45 H new ATOM 0 HB2 ASN A 128 -4.958 7.233 11.455 1.00 44.22 H new ATOM 0 HB3 ASN A 128 -6.579 6.588 11.621 1.00 44.22 H new ATOM 0 HD21 ASN A 128 -3.319 4.012 11.837 1.00 4.32 H new ATOM 0 HD22 ASN A 128 -3.103 5.699 11.360 1.00 4.32 H new ATOM 1851 N GLU A 129 -6.920 8.641 9.053 1.00 4.24 N ATOM 1852 CA GLU A 129 -8.042 9.470 8.573 1.00 34.44 C ATOM 1853 C GLU A 129 -8.372 9.259 7.085 1.00 53.12 C ATOM 1854 O GLU A 129 -9.497 9.511 6.647 1.00 0.14 O ATOM 1855 CB GLU A 129 -7.749 10.965 8.795 1.00 2.34 C ATOM 1856 CG GLU A 129 -8.098 11.495 10.196 1.00 33.13 C ATOM 1857 CD GLU A 129 -8.973 12.748 10.076 1.00 60.12 C ATOM 1858 OE1 GLU A 129 -10.202 12.620 9.848 1.00 1.41 O ATOM 1859 OE2 GLU A 129 -8.426 13.872 10.140 1.00 73.53 O ATOM 0 H GLU A 129 -6.087 9.173 9.306 1.00 4.24 H new ATOM 0 HA GLU A 129 -8.906 9.151 9.156 1.00 34.44 H new ATOM 0 HB2 GLU A 129 -6.690 11.144 8.609 1.00 2.34 H new ATOM 0 HB3 GLU A 129 -8.304 11.542 8.056 1.00 2.34 H new ATOM 0 HG2 GLU A 129 -8.623 10.727 10.765 1.00 33.13 H new ATOM 0 HG3 GLU A 129 -7.185 11.729 10.744 1.00 33.13 H new ATOM 1864 N TRP A 130 -7.407 8.820 6.276 1.00 24.15 N ATOM 1865 CA TRP A 130 -7.549 8.753 4.825 1.00 40.12 C ATOM 1866 C TRP A 130 -7.595 7.309 4.314 1.00 74.14 C ATOM 1867 O TRP A 130 -7.787 7.110 3.112 1.00 22.14 O ATOM 1868 CB TRP A 130 -6.443 9.581 4.165 1.00 44.51 C ATOM 1869 CG TRP A 130 -6.441 11.054 4.488 1.00 55.22 C ATOM 1870 CD1 TRP A 130 -5.533 11.680 5.267 1.00 34.34 C ATOM 1871 CD2 TRP A 130 -7.382 12.104 4.087 1.00 61.31 C ATOM 1872 NE1 TRP A 130 -5.835 13.016 5.382 1.00 63.41 N ATOM 1873 CE2 TRP A 130 -6.928 13.348 4.621 1.00 1.22 C ATOM 1874 CE3 TRP A 130 -8.574 12.141 3.334 1.00 4.31 C ATOM 1875 CZ2 TRP A 130 -7.579 14.564 4.378 1.00 51.32 C ATOM 1876 CZ3 TRP A 130 -9.255 13.354 3.099 1.00 64.30 C ATOM 1877 CH2 TRP A 130 -8.757 14.566 3.614 1.00 12.44 C ATOM 0 H TRP A 130 -6.500 8.499 6.614 1.00 24.15 H new ATOM 0 HA TRP A 130 -8.510 9.186 4.546 1.00 40.12 H new ATOM 0 HB2 TRP A 130 -5.480 9.163 4.457 1.00 44.51 H new ATOM 0 HB3 TRP A 130 -6.525 9.466 3.084 1.00 44.51 H new ATOM 0 HD1 TRP A 130 -4.687 11.198 5.735 1.00 34.34 H new ATOM 0 HE1 TRP A 130 -5.314 13.676 5.959 1.00 63.41 H new ATOM 0 HE3 TRP A 130 -8.973 11.223 2.929 1.00 4.31 H new ATOM 0 HZ2 TRP A 130 -7.181 15.487 4.773 1.00 51.32 H new ATOM 0 HZ3 TRP A 130 -10.166 13.353 2.519 1.00 64.30 H new ATOM 0 HH2 TRP A 130 -9.278 15.492 3.422 1.00 12.44 H new ATOM 1887 N ALA A 131 -7.472 6.318 5.197 1.00 72.50 N ATOM 1888 CA ALA A 131 -7.465 4.887 4.918 1.00 2.35 C ATOM 1889 C ALA A 131 -8.451 4.159 5.834 1.00 74.40 C ATOM 1890 O ALA A 131 -8.385 2.934 5.973 1.00 55.01 O ATOM 1891 CB ALA A 131 -6.038 4.344 5.051 1.00 4.45 C ATOM 0 H ALA A 131 -7.368 6.510 6.193 1.00 72.50 H new ATOM 0 HA ALA A 131 -7.794 4.710 3.894 1.00 2.35 H new ATOM 0 HB1 ALA A 131 -6.035 3.274 4.842 1.00 4.45 H new ATOM 0 HB2 ALA A 131 -5.387 4.854 4.341 1.00 4.45 H new ATOM 0 HB3 ALA A 131 -5.676 4.517 6.064 1.00 4.45 H new ATOM 1897 N ASP A 132 -9.348 4.910 6.472 1.00 63.31 N ATOM 1898 CA ASP A 132 -10.470 4.367 7.208 1.00 54.13 C ATOM 1899 C ASP A 132 -11.345 3.590 6.223 1.00 35.13 C ATOM 1900 O ASP A 132 -11.842 4.161 5.247 1.00 54.13 O ATOM 1901 CB ASP A 132 -11.261 5.485 7.893 1.00 40.30 C ATOM 1902 CG ASP A 132 -12.198 4.880 8.933 1.00 4.14 C ATOM 1903 OD1 ASP A 132 -13.069 4.063 8.558 1.00 75.33 O ATOM 1904 OD2 ASP A 132 -12.030 5.191 10.134 1.00 12.04 O ATOM 0 H ASP A 132 -9.307 5.929 6.487 1.00 63.31 H new ATOM 0 HA ASP A 132 -10.120 3.700 7.996 1.00 54.13 H new ATOM 0 HB2 ASP A 132 -10.578 6.189 8.369 1.00 40.30 H new ATOM 0 HB3 ASP A 132 -11.834 6.046 7.154 1.00 40.30 H new ATOM 1908 N GLY A 133 -11.466 2.282 6.437 1.00 20.33 N ATOM 1909 CA GLY A 133 -12.264 1.372 5.629 1.00 21.12 C ATOM 1910 C GLY A 133 -11.652 -0.028 5.571 1.00 63.10 C ATOM 1911 O GLY A 133 -12.406 -0.994 5.493 1.00 33.23 O ATOM 0 H GLY A 133 -10.992 1.812 7.208 1.00 20.33 H new ATOM 0 HA2 GLY A 133 -13.272 1.311 6.040 1.00 21.12 H new ATOM 0 HA3 GLY A 133 -12.356 1.770 4.618 1.00 21.12 H new ATOM 1915 N LEU A 134 -10.319 -0.172 5.641 1.00 3.25 N ATOM 1916 CA LEU A 134 -9.625 -1.468 5.555 1.00 15.15 C ATOM 1917 C LEU A 134 -8.942 -1.828 6.887 1.00 64.21 C ATOM 1918 O LEU A 134 -9.065 -1.083 7.863 1.00 12.11 O ATOM 1919 CB LEU A 134 -8.670 -1.512 4.338 1.00 33.33 C ATOM 1920 CG LEU A 134 -9.294 -1.582 2.923 1.00 72.54 C ATOM 1921 CD1 LEU A 134 -10.516 -2.500 2.837 1.00 73.32 C ATOM 1922 CD2 LEU A 134 -9.666 -0.219 2.332 1.00 54.04 C ATOM 0 H LEU A 134 -9.685 0.618 5.760 1.00 3.25 H new ATOM 0 HA LEU A 134 -10.368 -2.247 5.382 1.00 15.15 H new ATOM 0 HB2 LEU A 134 -8.036 -0.626 4.379 1.00 33.33 H new ATOM 0 HB3 LEU A 134 -8.017 -2.377 4.458 1.00 33.33 H new ATOM 0 HG LEU A 134 -8.487 -2.006 2.326 1.00 72.54 H new ATOM 0 HD11 LEU A 134 -10.900 -2.500 1.817 1.00 73.32 H new ATOM 0 HD12 LEU A 134 -10.230 -3.514 3.117 1.00 73.32 H new ATOM 0 HD13 LEU A 134 -11.289 -2.141 3.516 1.00 73.32 H new ATOM 0 HD21 LEU A 134 -10.096 -0.358 1.340 1.00 54.04 H new ATOM 0 HD22 LEU A 134 -10.394 0.271 2.978 1.00 54.04 H new ATOM 0 HD23 LEU A 134 -8.773 0.401 2.257 1.00 54.04 H new ATOM 1933 N ASN A 135 -8.291 -2.994 6.975 1.00 31.23 N ATOM 1934 CA ASN A 135 -7.730 -3.581 8.197 1.00 74.54 C ATOM 1935 C ASN A 135 -6.237 -3.838 8.004 1.00 20.35 C ATOM 1936 O ASN A 135 -5.861 -4.538 7.061 1.00 2.13 O ATOM 1937 CB ASN A 135 -8.441 -4.906 8.506 1.00 55.03 C ATOM 1938 CG ASN A 135 -7.689 -5.697 9.573 1.00 31.32 C ATOM 1939 OD1 ASN A 135 -7.761 -5.371 10.757 1.00 73.12 O ATOM 1940 ND2 ASN A 135 -6.941 -6.707 9.151 1.00 71.34 N ATOM 0 H ASN A 135 -8.134 -3.582 6.156 1.00 31.23 H new ATOM 0 HA ASN A 135 -7.875 -2.890 9.027 1.00 74.54 H new ATOM 0 HB2 ASN A 135 -9.457 -4.706 8.846 1.00 55.03 H new ATOM 0 HB3 ASN A 135 -8.520 -5.501 7.596 1.00 55.03 H new ATOM 0 HD21 ASN A 135 -6.394 -7.250 9.819 1.00 71.34 H new ATOM 0 HD22 ASN A 135 -6.913 -6.941 8.159 1.00 71.34 H new ATOM 1946 N VAL A 136 -5.400 -3.318 8.908 1.00 74.33 N ATOM 1947 CA VAL A 136 -3.959 -3.236 8.696 1.00 43.12 C ATOM 1948 C VAL A 136 -3.162 -4.052 9.716 1.00 42.23 C ATOM 1949 O VAL A 136 -3.351 -3.919 10.930 1.00 24.14 O ATOM 1950 CB VAL A 136 -3.511 -1.768 8.569 1.00 34.12 C ATOM 1951 CG1 VAL A 136 -4.040 -0.886 9.691 1.00 23.14 C ATOM 1952 CG2 VAL A 136 -1.988 -1.596 8.521 1.00 41.13 C ATOM 0 H VAL A 136 -5.707 -2.943 9.806 1.00 74.33 H new ATOM 0 HA VAL A 136 -3.729 -3.711 7.743 1.00 43.12 H new ATOM 0 HB VAL A 136 -3.939 -1.452 7.618 1.00 34.12 H new ATOM 0 HG11 VAL A 136 -3.690 0.136 9.546 1.00 23.14 H new ATOM 0 HG12 VAL A 136 -5.130 -0.901 9.683 1.00 23.14 H new ATOM 0 HG13 VAL A 136 -3.679 -1.260 10.649 1.00 23.14 H new ATOM 0 HG21 VAL A 136 -1.744 -0.537 8.431 1.00 41.13 H new ATOM 0 HG22 VAL A 136 -1.548 -1.993 9.436 1.00 41.13 H new ATOM 0 HG23 VAL A 136 -1.588 -2.135 7.662 1.00 41.13 H new ATOM 1962 N ILE A 137 -2.234 -4.872 9.217 1.00 34.52 N ATOM 1963 CA ILE A 137 -1.415 -5.794 10.009 1.00 73.34 C ATOM 1964 C ILE A 137 -0.122 -5.153 10.549 1.00 70.12 C ATOM 1965 O ILE A 137 0.592 -5.773 11.344 1.00 51.02 O ATOM 1966 CB ILE A 137 -1.148 -7.086 9.201 1.00 72.23 C ATOM 1967 CG1 ILE A 137 -0.384 -6.831 7.884 1.00 70.52 C ATOM 1968 CG2 ILE A 137 -2.494 -7.775 8.919 1.00 15.42 C ATOM 1969 CD1 ILE A 137 0.074 -8.105 7.174 1.00 41.02 C ATOM 0 H ILE A 137 -2.025 -4.914 8.220 1.00 34.52 H new ATOM 0 HA ILE A 137 -1.983 -6.057 10.902 1.00 73.34 H new ATOM 0 HB ILE A 137 -0.504 -7.730 9.800 1.00 72.23 H new ATOM 0 HG12 ILE A 137 -1.023 -6.261 7.210 1.00 70.52 H new ATOM 0 HG13 ILE A 137 0.488 -6.212 8.096 1.00 70.52 H new ATOM 0 HG21 ILE A 137 -2.323 -8.688 8.349 1.00 15.42 H new ATOM 0 HG22 ILE A 137 -2.981 -8.021 9.862 1.00 15.42 H new ATOM 0 HG23 ILE A 137 -3.133 -7.104 8.345 1.00 15.42 H new ATOM 0 HD11 ILE A 137 0.603 -7.841 6.258 1.00 41.02 H new ATOM 0 HD12 ILE A 137 0.740 -8.667 7.828 1.00 41.02 H new ATOM 0 HD13 ILE A 137 -0.794 -8.717 6.929 1.00 41.02 H new ATOM 1980 N GLY A 138 0.189 -3.914 10.157 1.00 32.35 N ATOM 1981 CA GLY A 138 1.292 -3.138 10.710 1.00 12.24 C ATOM 1982 C GLY A 138 1.650 -1.958 9.816 1.00 41.20 C ATOM 1983 O GLY A 138 1.303 -1.957 8.634 1.00 54.13 O ATOM 0 H GLY A 138 -0.331 -3.417 9.433 1.00 32.35 H new ATOM 0 HA2 GLY A 138 1.021 -2.775 11.702 1.00 12.24 H new ATOM 0 HA3 GLY A 138 2.164 -3.780 10.833 1.00 12.24 H new ATOM 1987 N VAL A 139 2.364 -0.972 10.363 1.00 22.23 N ATOM 1988 CA VAL A 139 2.774 0.266 9.689 1.00 73.54 C ATOM 1989 C VAL A 139 4.200 0.567 10.165 1.00 50.00 C ATOM 1990 O VAL A 139 4.382 0.999 11.305 1.00 41.30 O ATOM 1991 CB VAL A 139 1.766 1.420 9.966 1.00 73.30 C ATOM 1992 CG1 VAL A 139 2.039 2.648 9.094 1.00 14.15 C ATOM 1993 CG2 VAL A 139 0.320 0.996 9.675 1.00 45.33 C ATOM 0 H VAL A 139 2.687 -1.014 11.330 1.00 22.23 H new ATOM 0 HA VAL A 139 2.770 0.158 8.604 1.00 73.54 H new ATOM 0 HB VAL A 139 1.897 1.662 11.021 1.00 73.30 H new ATOM 0 HG11 VAL A 139 1.311 3.426 9.323 1.00 14.15 H new ATOM 0 HG12 VAL A 139 3.043 3.021 9.295 1.00 14.15 H new ATOM 0 HG13 VAL A 139 1.958 2.373 8.042 1.00 14.15 H new ATOM 0 HG21 VAL A 139 -0.352 1.829 9.881 1.00 45.33 H new ATOM 0 HG22 VAL A 139 0.229 0.707 8.628 1.00 45.33 H new ATOM 0 HG23 VAL A 139 0.054 0.150 10.309 1.00 45.33 H new ATOM 2003 N ALA A 140 5.220 0.277 9.349 1.00 52.31 N ATOM 2004 CA ALA A 140 6.646 0.467 9.675 1.00 4.33 C ATOM 2005 C ALA A 140 7.425 0.963 8.448 1.00 63.20 C ATOM 2006 O ALA A 140 6.813 1.195 7.406 1.00 43.51 O ATOM 2007 CB ALA A 140 7.245 -0.816 10.265 1.00 74.12 C ATOM 0 H ALA A 140 5.076 -0.108 8.415 1.00 52.31 H new ATOM 0 HA ALA A 140 6.729 1.240 10.439 1.00 4.33 H new ATOM 0 HB1 ALA A 140 8.297 -0.653 10.498 1.00 74.12 H new ATOM 0 HB2 ALA A 140 6.709 -1.082 11.176 1.00 74.12 H new ATOM 0 HB3 ALA A 140 7.155 -1.626 9.541 1.00 74.12 H new ATOM 2013 N ARG A 141 8.738 1.214 8.551 1.00 30.23 N ATOM 2014 CA ARG A 141 9.522 1.858 7.506 1.00 21.05 C ATOM 2015 C ARG A 141 10.483 0.830 6.901 1.00 2.45 C ATOM 2016 O ARG A 141 11.085 0.038 7.639 1.00 11.44 O ATOM 2017 CB ARG A 141 10.172 3.107 8.141 1.00 21.02 C ATOM 2018 CG ARG A 141 11.315 3.763 7.359 1.00 22.41 C ATOM 2019 CD ARG A 141 12.635 3.070 7.710 1.00 2.35 C ATOM 2020 NE ARG A 141 13.785 3.738 7.089 1.00 42.14 N ATOM 2021 CZ ARG A 141 14.828 4.323 7.692 1.00 43.53 C ATOM 2022 NH1 ARG A 141 14.904 4.411 9.017 1.00 54.55 N ATOM 2023 NH2 ARG A 141 15.824 4.831 6.979 1.00 42.35 N ATOM 0 H ARG A 141 9.285 0.969 9.376 1.00 30.23 H new ATOM 0 HA ARG A 141 8.933 2.210 6.659 1.00 21.05 H new ATOM 0 HB2 ARG A 141 9.393 3.854 8.296 1.00 21.02 H new ATOM 0 HB3 ARG A 141 10.549 2.831 9.126 1.00 21.02 H new ATOM 0 HG2 ARG A 141 11.127 3.690 6.288 1.00 22.41 H new ATOM 0 HG3 ARG A 141 11.373 4.824 7.600 1.00 22.41 H new ATOM 0 HD2 ARG A 141 12.763 3.059 8.792 1.00 2.35 H new ATOM 0 HD3 ARG A 141 12.598 2.031 7.382 1.00 2.35 H new ATOM 0 HE ARG A 141 13.791 3.759 6.069 1.00 42.14 H new ATOM 0 HH11 ARG A 141 14.158 4.028 9.597 1.00 54.55 H new ATOM 0 HH12 ARG A 141 15.709 4.861 9.453 1.00 54.55 H new ATOM 0 HH21 ARG A 141 15.801 4.779 5.961 1.00 42.35 H new ATOM 0 HH22 ARG A 141 16.613 5.274 7.449 1.00 42.35 H new ATOM 2034 N ASP A 142 10.684 0.943 5.581 1.00 12.55 N ATOM 2035 CA ASP A 142 11.373 0.034 4.678 1.00 30.43 C ATOM 2036 C ASP A 142 10.864 -1.390 4.916 1.00 41.52 C ATOM 2037 O ASP A 142 9.868 -1.619 5.604 1.00 63.34 O ATOM 2038 CB ASP A 142 12.907 0.108 4.807 1.00 42.34 C ATOM 2039 CG ASP A 142 13.625 1.460 4.740 1.00 13.12 C ATOM 2040 OD1 ASP A 142 13.026 2.552 4.644 1.00 2.11 O ATOM 2041 OD2 ASP A 142 14.878 1.414 4.826 1.00 71.02 O ATOM 0 H ASP A 142 10.330 1.756 5.077 1.00 12.55 H new ATOM 0 HA ASP A 142 11.148 0.340 3.656 1.00 30.43 H new ATOM 0 HB2 ASP A 142 13.173 -0.352 5.759 1.00 42.34 H new ATOM 0 HB3 ASP A 142 13.327 -0.520 4.021 1.00 42.34 H new ATOM 2045 N ASP A 143 11.566 -2.368 4.358 1.00 2.34 N ATOM 2046 CA ASP A 143 11.426 -3.810 4.513 1.00 13.14 C ATOM 2047 C ASP A 143 11.948 -4.285 5.875 1.00 61.00 C ATOM 2048 O ASP A 143 12.603 -5.320 5.971 1.00 22.20 O ATOM 2049 CB ASP A 143 12.130 -4.502 3.327 1.00 71.20 C ATOM 2050 CG ASP A 143 13.579 -4.071 3.104 1.00 62.12 C ATOM 2051 OD1 ASP A 143 13.777 -2.873 2.773 1.00 74.23 O ATOM 2052 OD2 ASP A 143 14.498 -4.922 3.143 1.00 2.52 O ATOM 0 H ASP A 143 12.328 -2.146 3.718 1.00 2.34 H new ATOM 0 HA ASP A 143 10.371 -4.084 4.498 1.00 13.14 H new ATOM 0 HB2 ASP A 143 12.107 -5.580 3.487 1.00 71.20 H new ATOM 0 HB3 ASP A 143 11.562 -4.302 2.418 1.00 71.20 H new ATOM 2056 N SER A 144 11.645 -3.546 6.950 1.00 65.50 N ATOM 2057 CA SER A 144 11.961 -3.946 8.321 1.00 42.45 C ATOM 2058 C SER A 144 11.064 -5.094 8.798 1.00 62.40 C ATOM 2059 O SER A 144 11.498 -5.847 9.663 1.00 5.01 O ATOM 2060 CB SER A 144 11.884 -2.718 9.247 1.00 33.52 C ATOM 2061 OG SER A 144 12.283 -2.982 10.583 1.00 64.52 O ATOM 0 H SER A 144 11.169 -2.646 6.888 1.00 65.50 H new ATOM 0 HA SER A 144 12.980 -4.332 8.351 1.00 42.45 H new ATOM 0 HB2 SER A 144 12.514 -1.927 8.839 1.00 33.52 H new ATOM 0 HB3 SER A 144 10.861 -2.341 9.251 1.00 33.52 H new ATOM 0 HG SER A 144 12.211 -2.161 11.114 1.00 64.52 H new ATOM 2066 N GLU A 145 9.851 -5.260 8.252 1.00 22.41 N ATOM 2067 CA GLU A 145 8.836 -6.185 8.785 1.00 4.14 C ATOM 2068 C GLU A 145 8.222 -7.098 7.712 1.00 11.21 C ATOM 2069 O GLU A 145 7.193 -7.739 7.944 1.00 74.40 O ATOM 2070 CB GLU A 145 7.747 -5.406 9.538 1.00 32.43 C ATOM 2071 CG GLU A 145 8.277 -4.557 10.701 1.00 63.34 C ATOM 2072 CD GLU A 145 7.361 -4.569 11.928 1.00 72.30 C ATOM 2073 OE1 GLU A 145 6.118 -4.469 11.824 1.00 23.25 O ATOM 2074 OE2 GLU A 145 7.899 -4.764 13.041 1.00 71.22 O ATOM 0 H GLU A 145 9.543 -4.753 7.422 1.00 22.41 H new ATOM 0 HA GLU A 145 9.349 -6.847 9.482 1.00 4.14 H new ATOM 0 HB2 GLU A 145 7.228 -4.756 8.834 1.00 32.43 H new ATOM 0 HB3 GLU A 145 7.011 -6.111 9.923 1.00 32.43 H new ATOM 0 HG2 GLU A 145 9.263 -4.923 10.989 1.00 63.34 H new ATOM 0 HG3 GLU A 145 8.405 -3.529 10.362 1.00 63.34 H new ATOM 2079 N VAL A 146 8.844 -7.197 6.536 1.00 14.44 N ATOM 2080 CA VAL A 146 8.377 -8.078 5.468 1.00 4.11 C ATOM 2081 C VAL A 146 8.174 -9.515 5.947 1.00 24.51 C ATOM 2082 O VAL A 146 7.243 -10.186 5.499 1.00 41.33 O ATOM 2083 CB VAL A 146 9.322 -7.972 4.245 1.00 54.24 C ATOM 2084 CG1 VAL A 146 10.811 -8.019 4.618 1.00 2.32 C ATOM 2085 CG2 VAL A 146 9.079 -9.043 3.166 1.00 70.22 C ATOM 0 H VAL A 146 9.684 -6.669 6.299 1.00 14.44 H new ATOM 0 HA VAL A 146 7.389 -7.744 5.152 1.00 4.11 H new ATOM 0 HB VAL A 146 9.073 -6.993 3.836 1.00 54.24 H new ATOM 0 HG11 VAL A 146 11.415 -7.940 3.714 1.00 2.32 H new ATOM 0 HG12 VAL A 146 11.045 -7.189 5.285 1.00 2.32 H new ATOM 0 HG13 VAL A 146 11.031 -8.961 5.120 1.00 2.32 H new ATOM 0 HG21 VAL A 146 9.781 -8.898 2.345 1.00 70.22 H new ATOM 0 HG22 VAL A 146 9.224 -10.033 3.597 1.00 70.22 H new ATOM 0 HG23 VAL A 146 8.059 -8.957 2.791 1.00 70.22 H new ATOM 2095 N ASP A 147 9.008 -9.966 6.883 1.00 2.31 N ATOM 2096 CA ASP A 147 9.035 -11.352 7.318 1.00 25.54 C ATOM 2097 C ASP A 147 7.765 -11.754 8.051 1.00 23.12 C ATOM 2098 O ASP A 147 7.390 -12.923 8.056 1.00 23.45 O ATOM 2099 CB ASP A 147 10.242 -11.578 8.228 1.00 23.25 C ATOM 2100 CG ASP A 147 10.834 -12.944 7.961 1.00 23.24 C ATOM 2101 OD1 ASP A 147 10.403 -13.943 8.575 1.00 10.21 O ATOM 2102 OD2 ASP A 147 11.777 -12.995 7.136 1.00 33.22 O ATOM 0 H ASP A 147 9.686 -9.372 7.361 1.00 2.31 H new ATOM 0 HA ASP A 147 9.109 -11.973 6.425 1.00 25.54 H new ATOM 0 HB2 ASP A 147 10.991 -10.806 8.053 1.00 23.25 H new ATOM 0 HB3 ASP A 147 9.942 -11.499 9.273 1.00 23.25 H new ATOM 2106 N LYS A 148 7.089 -10.782 8.665 1.00 71.13 N ATOM 2107 CA LYS A 148 5.886 -10.995 9.447 1.00 61.40 C ATOM 2108 C LYS A 148 4.673 -10.679 8.605 1.00 41.31 C ATOM 2109 O LYS A 148 3.670 -11.375 8.735 1.00 10.45 O ATOM 2110 CB LYS A 148 5.935 -10.207 10.767 1.00 53.30 C ATOM 2111 CG LYS A 148 6.519 -8.794 10.701 1.00 5.21 C ATOM 2112 CD LYS A 148 6.727 -8.150 12.075 1.00 44.44 C ATOM 2113 CE LYS A 148 5.445 -7.609 12.717 1.00 61.11 C ATOM 2114 NZ LYS A 148 5.749 -6.571 13.729 1.00 11.43 N ATOM 0 H LYS A 148 7.376 -9.804 8.627 1.00 71.13 H new ATOM 0 HA LYS A 148 5.816 -12.044 9.735 1.00 61.40 H new ATOM 0 HB2 LYS A 148 4.921 -10.138 11.160 1.00 53.30 H new ATOM 0 HB3 LYS A 148 6.517 -10.783 11.486 1.00 53.30 H new ATOM 0 HG2 LYS A 148 7.474 -8.829 10.177 1.00 5.21 H new ATOM 0 HG3 LYS A 148 5.855 -8.163 10.110 1.00 5.21 H new ATOM 0 HD2 LYS A 148 7.173 -8.886 12.745 1.00 44.44 H new ATOM 0 HD3 LYS A 148 7.443 -7.334 11.976 1.00 44.44 H new ATOM 0 HE2 LYS A 148 4.798 -7.190 11.946 1.00 61.11 H new ATOM 0 HE3 LYS A 148 4.896 -8.427 13.184 1.00 61.11 H new ATOM 0 HZ1 LYS A 148 5.157 -6.723 14.571 1.00 11.43 H new ATOM 0 HZ2 LYS A 148 6.752 -6.630 13.996 1.00 11.43 H new ATOM 0 HZ3 LYS A 148 5.551 -5.630 13.332 1.00 11.43 H new ATOM 2124 N TRP A 149 4.732 -9.683 7.720 1.00 14.45 N ATOM 2125 CA TRP A 149 3.587 -9.298 6.896 1.00 25.12 C ATOM 2126 C TRP A 149 3.412 -10.243 5.694 1.00 61.50 C ATOM 2127 O TRP A 149 3.202 -9.783 4.571 1.00 41.33 O ATOM 2128 CB TRP A 149 3.758 -7.853 6.436 1.00 64.13 C ATOM 2129 CG TRP A 149 3.845 -6.812 7.500 1.00 2.21 C ATOM 2130 CD1 TRP A 149 3.351 -6.901 8.754 1.00 12.32 C ATOM 2131 CD2 TRP A 149 4.469 -5.503 7.404 1.00 52.04 C ATOM 2132 NE1 TRP A 149 3.666 -5.757 9.449 1.00 12.32 N ATOM 2133 CE2 TRP A 149 4.344 -4.846 8.663 1.00 73.10 C ATOM 2134 CE3 TRP A 149 5.140 -4.817 6.371 1.00 62.13 C ATOM 2135 CZ2 TRP A 149 4.874 -3.565 8.891 1.00 43.33 C ATOM 2136 CZ3 TRP A 149 5.707 -3.554 6.603 1.00 13.04 C ATOM 2137 CH2 TRP A 149 5.578 -2.931 7.853 1.00 62.33 C ATOM 0 H TRP A 149 5.569 -9.124 7.555 1.00 14.45 H new ATOM 0 HA TRP A 149 2.682 -9.379 7.497 1.00 25.12 H new ATOM 0 HB2 TRP A 149 4.662 -7.795 5.830 1.00 64.13 H new ATOM 0 HB3 TRP A 149 2.921 -7.603 5.785 1.00 64.13 H new ATOM 0 HD1 TRP A 149 2.796 -7.739 9.149 1.00 12.32 H new ATOM 0 HE1 TRP A 149 3.427 -5.600 10.428 1.00 12.32 H new ATOM 0 HE3 TRP A 149 5.218 -5.267 5.392 1.00 62.13 H new ATOM 0 HZ2 TRP A 149 4.743 -3.077 9.845 1.00 43.33 H new ATOM 0 HZ3 TRP A 149 6.248 -3.057 5.811 1.00 13.04 H new ATOM 0 HH2 TRP A 149 6.021 -1.960 8.018 1.00 62.33 H new ATOM 2147 N SER A 150 3.645 -11.543 5.868 1.00 1.03 N ATOM 2148 CA SER A 150 3.601 -12.535 4.796 1.00 31.51 C ATOM 2149 C SER A 150 3.419 -13.959 5.360 1.00 71.30 C ATOM 2150 O SER A 150 3.993 -14.909 4.810 1.00 5.23 O ATOM 2151 CB SER A 150 4.886 -12.368 3.952 1.00 74.32 C ATOM 2152 OG SER A 150 4.805 -12.927 2.654 1.00 4.22 O ATOM 0 H SER A 150 3.874 -11.944 6.777 1.00 1.03 H new ATOM 0 HA SER A 150 2.736 -12.376 4.152 1.00 31.51 H new ATOM 0 HB2 SER A 150 5.114 -11.306 3.864 1.00 74.32 H new ATOM 0 HB3 SER A 150 5.718 -12.830 4.483 1.00 74.32 H new ATOM 0 HG SER A 150 4.500 -13.856 2.716 1.00 4.22 H new ATOM 2157 N LYS A 151 2.714 -14.133 6.485 1.00 14.15 N ATOM 2158 CA LYS A 151 2.631 -15.406 7.205 1.00 21.53 C ATOM 2159 C LYS A 151 1.233 -15.765 7.647 1.00 45.40 C ATOM 2160 O LYS A 151 0.878 -16.961 7.509 1.00 45.12 O ATOM 2161 CB LYS A 151 3.576 -15.395 8.403 1.00 24.53 C ATOM 2162 CG LYS A 151 5.055 -15.447 8.025 1.00 12.04 C ATOM 2163 CD LYS A 151 5.428 -16.752 7.308 1.00 11.35 C ATOM 2164 CE LYS A 151 6.877 -16.711 6.856 1.00 74.51 C ATOM 2165 NZ LYS A 151 7.818 -16.918 7.972 1.00 72.23 N ATOM 0 H LYS A 151 2.180 -13.384 6.924 1.00 14.15 H new ATOM 0 HA LYS A 151 2.933 -16.177 6.497 1.00 21.53 H new ATOM 0 HB2 LYS A 151 3.392 -14.495 8.990 1.00 24.53 H new ATOM 0 HB3 LYS A 151 3.345 -16.246 9.044 1.00 24.53 H new ATOM 0 HG2 LYS A 151 5.293 -14.600 7.381 1.00 12.04 H new ATOM 0 HG3 LYS A 151 5.661 -15.343 8.925 1.00 12.04 H new ATOM 0 HD2 LYS A 151 5.273 -17.599 7.976 1.00 11.35 H new ATOM 0 HD3 LYS A 151 4.776 -16.901 6.447 1.00 11.35 H new ATOM 0 HE2 LYS A 151 7.041 -17.478 6.099 1.00 74.51 H new ATOM 0 HE3 LYS A 151 7.081 -15.749 6.385 1.00 74.51 H new ATOM 0 HZ1 LYS A 151 8.794 -16.882 7.614 1.00 72.23 H new ATOM 0 HZ2 LYS A 151 7.682 -16.172 8.684 1.00 72.23 H new ATOM 0 HZ3 LYS A 151 7.643 -17.847 8.406 1.00 72.23 H new TER 2175 LYS A 151