USER MOD reduce.3.24.130724 H: found=0, std=0, add=1306, rem=0, adj=47 USER MOD reduce.3.24.130724 removed 1309 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 77 ASN : amide:sc= -2.96! C(o=-7.2!,f=-5.9!) USER MOD Set 1.2: A 82 GLN : amide:sc= -0.789 K(o=-7.2,f=-6!) USER MOD Set 1.3: A 109 ASN : amide:sc= -3.06 K(o=-7.2,f=-6) USER MOD Set 1.4: A 114 ASN : amide:sc= -0.4 K(o=-7.2,f=-6) USER MOD Set 2.1: A 76 SER OG : rot -70:sc= 1.05 USER MOD Set 2.2: A 86 ASN : amide:sc= -0.591 X(o=0.46,f=0.52) USER MOD Set 3.1: A 61 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 65 LYS NZ :NH3+ 166:sc= -0.0512 (180deg=-0.341) USER MOD Set 4.1: A 29 ASN : amide:sc= -4.66! C(o=-11!,f=-9.8!) USER MOD Set 4.2: A 32 GLN : amide:sc= -0.762 K(o=-11,f=-9.8) USER MOD Set 4.3: A 33 HIS : no HE2:sc= -5.39! C(o=-11!,f=-15!) USER MOD Single : A 11 MET CE :methyl 160:sc= -0.185 (180deg=-0.779) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot -139:sc= 0.736 USER MOD Single : A 25 HIS : no HD1:sc= -3.79! C(o=-3.8!,f=-5.3!) USER MOD Single : A 26 LYS NZ :NH3+ -176:sc= 0.335 (180deg=0.329) USER MOD Single : A 28 TYR OH : rot 30:sc= -0.264 USER MOD Single : A 34 LYS NZ :NH3+ -156:sc= -0.68 (180deg=-1.42) USER MOD Single : A 36 SER OG : rot 133:sc= 0.504 USER MOD Single : A 41 TYR OH : rot 1:sc= -1.19 USER MOD Single : A 42 ASN : amide:sc= -3.73! C(o=-3.7!,f=-9.8!) USER MOD Single : A 45 SER OG : rot -110:sc= -2.89! USER MOD Single : A 46 LYS NZ :NH3+ -166:sc= -0.0927 (180deg=-0.291) USER MOD Single : A 47 CYS SG : rot -51:sc= 0 USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 THR OG1 : rot 24:sc= 0.592 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 71:sc= -1.75! USER MOD Single : A 58 THR OG1 : rot 94:sc= 0.641 USER MOD Single : A 59 THR OG1 : rot 86:sc= 1.3 USER MOD Single : A 62 ASN : amide:sc= -1.41! K(o=-1.4!,f=-0.014) USER MOD Single : A 63 LYS NZ :NH3+ 179:sc= 1.2 (180deg=1.14) USER MOD Single : A 64 TYR OH : rot -150:sc= 1.22 USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 67 GLN : amide:sc= -2.34! K(o=-2.3!,f=-0.54) USER MOD Single : A 70 THR OG1 : rot 46:sc= -2.28! USER MOD Single : A 78 GLN : amide:sc= -1.12 K(o=-1.1,f=-6!) USER MOD Single : A 91 LYS NZ :NH3+ 172:sc= 1.26 (180deg=1.2) USER MOD Single : A 95 CYS SG : rot -160:sc= 1.11 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0.0102 USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0213) USER MOD Single : A 105 MET CE :methyl -140:sc= -7.96! (180deg=-10.3!) USER MOD Single : A 107 LYS NZ :NH3+ 143:sc= -0.606 (180deg=-1.83) USER MOD Single : A 111 ASN : amide:sc= -2 K(o=-2,f=-6.6!) USER MOD Single : A 116 HIS : no HD1:sc= -5.31! C(o=-5.3!,f=-10!) USER MOD Single : A 119 TYR OH : rot 89:sc= -6.49! USER MOD Single : A 121 TYR OH : rot 28:sc= 0.56 USER MOD Single : A 122 MET CE :methyl -119:sc= -8.62! (180deg=-14.2!) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 1.22 (180deg=1.22) USER MOD Single : A 124 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.123) USER MOD Single : A 125 THR OG1 : rot 81:sc= 1.24 USER MOD Single : A 126 LYS NZ :NH3+ -120:sc= 0.759 (180deg=-1.95!) USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ -134:sc= -0.0825 (180deg=-2.11!) USER MOD Single : A 136 LYS NZ :NH3+ -165:sc= 1.17 (180deg=1) USER MOD Single : A 138 ASN : amide:sc= -1.39 K(o=-1.4,f=-0.61) USER MOD Single : A 140 THR OG1 : rot 81:sc= -3.64! USER MOD Single : A 141 SER OG : rot -96:sc= 1.96 USER MOD Single : A 155 SER OG : rot 180:sc= 0.0126 USER MOD Single : A 159 SER OG : rot 180:sc= -0.0993 USER MOD Single : A 161 LYS NZ :NH3+ -157:sc= 1.15 (180deg=0.575) USER MOD Single : A 166 LYS NZ :NH3+ -170:sc= 0.0925 (180deg=0.0739) USER MOD Single : A 173 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 10 -9.119 20.724 4.535 1.00 5.22 N ATOM 2 CA GLY A 10 -7.898 20.464 3.741 1.00 4.42 C ATOM 3 C GLY A 10 -8.205 19.726 2.459 1.00 3.29 C ATOM 4 O GLY A 10 -9.324 19.249 2.267 1.00 3.60 O ATOM 0 HA2 GLY A 10 -7.409 21.410 3.507 1.00 4.42 H new ATOM 0 HA3 GLY A 10 -7.195 19.881 4.336 1.00 4.42 H new ATOM 10 N MET A 11 -7.221 19.645 1.574 1.00 2.49 N ATOM 11 CA MET A 11 -7.383 18.924 0.320 1.00 1.84 C ATOM 12 C MET A 11 -7.254 17.423 0.549 1.00 1.40 C ATOM 13 O MET A 11 -6.545 16.982 1.457 1.00 2.20 O ATOM 14 CB MET A 11 -6.349 19.389 -0.711 1.00 2.43 C ATOM 15 CG MET A 11 -4.909 19.099 -0.319 1.00 3.11 C ATOM 16 SD MET A 11 -3.724 19.673 -1.555 1.00 4.02 S ATOM 17 CE MET A 11 -4.055 21.436 -1.548 1.00 4.85 C ATOM 0 H MET A 11 -6.302 20.070 1.702 1.00 2.49 H new ATOM 0 HA MET A 11 -8.379 19.137 -0.068 1.00 1.84 H new ATOM 0 HB2 MET A 11 -6.559 18.905 -1.665 1.00 2.43 H new ATOM 0 HB3 MET A 11 -6.463 20.462 -0.866 1.00 2.43 H new ATOM 0 HG2 MET A 11 -4.693 19.578 0.636 1.00 3.11 H new ATOM 0 HG3 MET A 11 -4.785 18.026 -0.173 1.00 3.11 H new ATOM 0 HE1 MET A 11 -3.202 21.968 -1.968 1.00 4.85 H new ATOM 0 HE2 MET A 11 -4.942 21.642 -2.147 1.00 4.85 H new ATOM 0 HE3 MET A 11 -4.223 21.771 -0.524 1.00 4.85 H new ATOM 27 N GLY A 12 -7.942 16.647 -0.276 1.00 0.92 N ATOM 28 CA GLY A 12 -7.898 15.208 -0.150 1.00 0.85 C ATOM 29 C GLY A 12 -9.176 14.639 0.433 1.00 0.79 C ATOM 30 O GLY A 12 -9.306 14.493 1.646 1.00 1.55 O ATOM 0 H GLY A 12 -8.532 16.992 -1.033 1.00 0.92 H new ATOM 0 HA2 GLY A 12 -7.721 14.766 -1.130 1.00 0.85 H new ATOM 0 HA3 GLY A 12 -7.057 14.927 0.483 1.00 0.85 H new ATOM 34 N SER A 13 -10.121 14.319 -0.431 1.00 0.52 N ATOM 35 CA SER A 13 -11.386 13.740 0.000 1.00 0.53 C ATOM 36 C SER A 13 -11.346 12.217 -0.134 1.00 0.41 C ATOM 37 O SER A 13 -12.057 11.500 0.571 1.00 0.53 O ATOM 38 CB SER A 13 -12.522 14.339 -0.829 1.00 0.79 C ATOM 39 OG SER A 13 -13.784 13.805 -0.467 1.00 1.58 O ATOM 0 H SER A 13 -10.039 14.450 -1.439 1.00 0.52 H new ATOM 0 HA SER A 13 -11.558 13.974 1.051 1.00 0.53 H new ATOM 0 HB2 SER A 13 -12.535 15.421 -0.697 1.00 0.79 H new ATOM 0 HB3 SER A 13 -12.338 14.149 -1.886 1.00 0.79 H new ATOM 0 HG SER A 13 -14.483 14.215 -1.019 1.00 1.58 H new ATOM 45 N SER A 14 -10.471 11.749 -1.018 1.00 0.32 N ATOM 46 CA SER A 14 -10.281 10.355 -1.311 1.00 0.22 C ATOM 47 C SER A 14 -8.962 10.288 -2.024 1.00 0.21 C ATOM 48 O SER A 14 -8.541 11.252 -2.668 1.00 0.35 O ATOM 49 CB SER A 14 -11.393 9.784 -2.203 1.00 0.25 C ATOM 50 OG SER A 14 -12.676 9.986 -1.644 1.00 1.17 O ATOM 0 H SER A 14 -9.861 12.359 -1.562 1.00 0.32 H new ATOM 0 HA SER A 14 -10.305 9.761 -0.397 1.00 0.22 H new ATOM 0 HB2 SER A 14 -11.347 10.254 -3.185 1.00 0.25 H new ATOM 0 HB3 SER A 14 -11.226 8.717 -2.352 1.00 0.25 H new ATOM 0 HG SER A 14 -13.222 9.183 -1.779 1.00 1.17 H new ATOM 56 N ILE A 15 -8.316 9.169 -1.882 1.00 0.18 N ATOM 57 CA ILE A 15 -6.990 8.963 -2.405 1.00 0.18 C ATOM 58 C ILE A 15 -6.942 9.158 -3.920 1.00 0.17 C ATOM 59 O ILE A 15 -5.893 9.441 -4.486 1.00 0.19 O ATOM 60 CB ILE A 15 -6.537 7.550 -2.043 1.00 0.17 C ATOM 61 CG1 ILE A 15 -7.533 6.528 -2.588 1.00 0.18 C ATOM 62 CG2 ILE A 15 -6.407 7.424 -0.545 1.00 0.23 C ATOM 63 CD1 ILE A 15 -6.912 5.201 -2.942 1.00 0.38 C ATOM 0 H ILE A 15 -8.697 8.359 -1.393 1.00 0.18 H new ATOM 0 HA ILE A 15 -6.321 9.702 -1.963 1.00 0.18 H new ATOM 0 HB ILE A 15 -5.564 7.355 -2.493 1.00 0.17 H new ATOM 0 HG12 ILE A 15 -8.315 6.366 -1.846 1.00 0.18 H new ATOM 0 HG13 ILE A 15 -8.015 6.941 -3.474 1.00 0.18 H new ATOM 0 HG21 ILE A 15 -6.084 6.414 -0.291 1.00 0.23 H new ATOM 0 HG22 ILE A 15 -5.672 8.142 -0.182 1.00 0.23 H new ATOM 0 HG23 ILE A 15 -7.371 7.624 -0.078 1.00 0.23 H new ATOM 0 HD11 ILE A 15 -7.682 4.529 -3.322 1.00 0.38 H new ATOM 0 HD12 ILE A 15 -6.150 5.349 -3.707 1.00 0.38 H new ATOM 0 HD13 ILE A 15 -6.455 4.765 -2.054 1.00 0.38 H new ATOM 75 N PHE A 16 -8.100 9.055 -4.557 1.00 0.18 N ATOM 76 CA PHE A 16 -8.206 9.114 -6.010 1.00 0.19 C ATOM 77 C PHE A 16 -7.861 10.482 -6.584 1.00 0.21 C ATOM 78 O PHE A 16 -7.805 10.647 -7.803 1.00 0.30 O ATOM 79 CB PHE A 16 -9.606 8.761 -6.437 1.00 0.20 C ATOM 80 CG PHE A 16 -10.014 7.374 -6.083 1.00 0.19 C ATOM 81 CD1 PHE A 16 -9.268 6.298 -6.521 1.00 0.22 C ATOM 82 CD2 PHE A 16 -11.166 7.144 -5.365 1.00 0.18 C ATOM 83 CE1 PHE A 16 -9.668 5.013 -6.255 1.00 0.22 C ATOM 84 CE2 PHE A 16 -11.562 5.859 -5.083 1.00 0.19 C ATOM 85 CZ PHE A 16 -10.815 4.794 -5.535 1.00 0.19 C ATOM 0 H PHE A 16 -8.994 8.928 -4.082 1.00 0.18 H new ATOM 0 HA PHE A 16 -7.481 8.398 -6.396 1.00 0.19 H new ATOM 0 HB2 PHE A 16 -10.303 9.462 -5.978 1.00 0.20 H new ATOM 0 HB3 PHE A 16 -9.689 8.889 -7.516 1.00 0.20 H new ATOM 0 HD1 PHE A 16 -8.360 6.470 -7.079 1.00 0.22 H new ATOM 0 HD2 PHE A 16 -11.761 7.977 -5.022 1.00 0.18 H new ATOM 0 HE1 PHE A 16 -9.083 4.178 -6.611 1.00 0.22 H new ATOM 0 HE2 PHE A 16 -12.459 5.684 -4.507 1.00 0.19 H new ATOM 0 HZ PHE A 16 -11.133 3.784 -5.322 1.00 0.19 H new ATOM 95 N ASP A 17 -7.641 11.457 -5.722 1.00 0.21 N ATOM 96 CA ASP A 17 -7.284 12.786 -6.177 1.00 0.26 C ATOM 97 C ASP A 17 -5.820 12.771 -6.549 1.00 0.25 C ATOM 98 O ASP A 17 -5.316 13.656 -7.243 1.00 0.32 O ATOM 99 CB ASP A 17 -7.536 13.826 -5.087 1.00 0.32 C ATOM 100 CG ASP A 17 -7.573 15.239 -5.633 1.00 1.13 C ATOM 101 OD1 ASP A 17 -8.666 15.695 -6.035 1.00 2.11 O ATOM 102 OD2 ASP A 17 -6.519 15.906 -5.656 1.00 1.30 O ATOM 0 H ASP A 17 -7.703 11.354 -4.709 1.00 0.21 H new ATOM 0 HA ASP A 17 -7.898 13.057 -7.036 1.00 0.26 H new ATOM 0 HB2 ASP A 17 -8.481 13.606 -4.591 1.00 0.32 H new ATOM 0 HB3 ASP A 17 -6.755 13.752 -4.331 1.00 0.32 H new ATOM 107 N PHE A 18 -5.147 11.732 -6.089 1.00 0.22 N ATOM 108 CA PHE A 18 -3.745 11.568 -6.343 1.00 0.23 C ATOM 109 C PHE A 18 -3.508 10.469 -7.333 1.00 0.26 C ATOM 110 O PHE A 18 -3.827 9.304 -7.094 1.00 0.29 O ATOM 111 CB PHE A 18 -3.008 11.295 -5.059 1.00 0.21 C ATOM 112 CG PHE A 18 -3.145 12.427 -4.103 1.00 0.22 C ATOM 113 CD1 PHE A 18 -2.791 13.711 -4.480 1.00 0.27 C ATOM 114 CD2 PHE A 18 -3.643 12.217 -2.841 1.00 0.23 C ATOM 115 CE1 PHE A 18 -2.926 14.765 -3.605 1.00 0.31 C ATOM 116 CE2 PHE A 18 -3.786 13.264 -1.965 1.00 0.29 C ATOM 117 CZ PHE A 18 -3.426 14.541 -2.341 1.00 0.31 C ATOM 0 H PHE A 18 -5.564 10.986 -5.532 1.00 0.22 H new ATOM 0 HA PHE A 18 -3.363 12.495 -6.770 1.00 0.23 H new ATOM 0 HB2 PHE A 18 -3.394 10.383 -4.603 1.00 0.21 H new ATOM 0 HB3 PHE A 18 -1.953 11.123 -5.273 1.00 0.21 H new ATOM 0 HD1 PHE A 18 -2.404 13.888 -5.473 1.00 0.27 H new ATOM 0 HD2 PHE A 18 -3.924 11.220 -2.535 1.00 0.23 H new ATOM 0 HE1 PHE A 18 -2.642 15.762 -3.908 1.00 0.31 H new ATOM 0 HE2 PHE A 18 -4.183 13.087 -0.976 1.00 0.29 H new ATOM 0 HZ PHE A 18 -3.536 15.362 -1.648 1.00 0.31 H new ATOM 127 N GLU A 19 -2.973 10.873 -8.454 1.00 0.35 N ATOM 128 CA GLU A 19 -2.575 9.956 -9.494 1.00 0.43 C ATOM 129 C GLU A 19 -1.608 8.922 -8.936 1.00 0.34 C ATOM 130 O GLU A 19 -0.775 9.217 -8.074 1.00 0.37 O ATOM 131 CB GLU A 19 -1.921 10.713 -10.649 1.00 0.63 C ATOM 132 CG GLU A 19 -1.726 9.864 -11.893 1.00 1.08 C ATOM 133 CD GLU A 19 -3.040 9.479 -12.543 1.00 2.04 C ATOM 134 OE1 GLU A 19 -3.839 8.771 -11.894 1.00 2.86 O ATOM 135 OE2 GLU A 19 -3.277 9.869 -13.708 1.00 2.30 O ATOM 0 H GLU A 19 -2.799 11.853 -8.675 1.00 0.35 H new ATOM 0 HA GLU A 19 -3.463 9.447 -9.868 1.00 0.43 H new ATOM 0 HB2 GLU A 19 -2.535 11.578 -10.901 1.00 0.63 H new ATOM 0 HB3 GLU A 19 -0.953 11.094 -10.322 1.00 0.63 H new ATOM 0 HG2 GLU A 19 -1.116 10.412 -12.611 1.00 1.08 H new ATOM 0 HG3 GLU A 19 -1.176 8.961 -11.630 1.00 1.08 H new ATOM 142 N VAL A 20 -1.726 7.718 -9.440 1.00 0.29 N ATOM 143 CA VAL A 20 -0.873 6.626 -9.033 1.00 0.26 C ATOM 144 C VAL A 20 0.006 6.263 -10.205 1.00 0.25 C ATOM 145 O VAL A 20 -0.221 6.740 -11.308 1.00 0.28 O ATOM 146 CB VAL A 20 -1.726 5.415 -8.563 1.00 0.31 C ATOM 147 CG1 VAL A 20 -0.896 4.167 -8.318 1.00 0.67 C ATOM 148 CG2 VAL A 20 -2.460 5.799 -7.306 1.00 0.49 C ATOM 0 H VAL A 20 -2.418 7.466 -10.146 1.00 0.29 H new ATOM 0 HA VAL A 20 -0.250 6.921 -8.188 1.00 0.26 H new ATOM 0 HB VAL A 20 -2.426 5.170 -9.362 1.00 0.31 H new ATOM 0 HG11 VAL A 20 -1.547 3.356 -7.992 1.00 0.67 H new ATOM 0 HG12 VAL A 20 -0.391 3.879 -9.240 1.00 0.67 H new ATOM 0 HG13 VAL A 20 -0.154 4.369 -7.546 1.00 0.67 H new ATOM 0 HG21 VAL A 20 -3.063 4.957 -6.965 1.00 0.49 H new ATOM 0 HG22 VAL A 20 -1.741 6.067 -6.532 1.00 0.49 H new ATOM 0 HG23 VAL A 20 -3.109 6.651 -7.509 1.00 0.49 H new ATOM 158 N LEU A 21 1.039 5.490 -9.970 1.00 0.28 N ATOM 159 CA LEU A 21 1.905 5.068 -11.039 1.00 0.35 C ATOM 160 C LEU A 21 2.016 3.564 -11.048 1.00 0.38 C ATOM 161 O LEU A 21 1.928 2.929 -10.009 1.00 0.58 O ATOM 162 CB LEU A 21 3.285 5.694 -10.872 1.00 0.45 C ATOM 163 CG LEU A 21 3.272 7.214 -10.751 1.00 0.46 C ATOM 164 CD1 LEU A 21 4.646 7.744 -10.425 1.00 0.69 C ATOM 165 CD2 LEU A 21 2.773 7.829 -12.032 1.00 0.68 C ATOM 0 H LEU A 21 1.299 5.142 -9.047 1.00 0.28 H new ATOM 0 HA LEU A 21 1.482 5.397 -11.988 1.00 0.35 H new ATOM 0 HB2 LEU A 21 3.757 5.274 -9.984 1.00 0.45 H new ATOM 0 HB3 LEU A 21 3.904 5.414 -11.724 1.00 0.45 H new ATOM 0 HG LEU A 21 2.601 7.485 -9.936 1.00 0.46 H new ATOM 0 HD11 LEU A 21 4.607 8.830 -10.345 1.00 0.69 H new ATOM 0 HD12 LEU A 21 4.984 7.322 -9.478 1.00 0.69 H new ATOM 0 HD13 LEU A 21 5.341 7.463 -11.216 1.00 0.69 H new ATOM 0 HD21 LEU A 21 2.767 8.915 -11.936 1.00 0.68 H new ATOM 0 HD22 LEU A 21 3.429 7.541 -12.854 1.00 0.68 H new ATOM 0 HD23 LEU A 21 1.761 7.477 -12.235 1.00 0.68 H new ATOM 177 N ASP A 22 2.152 2.998 -12.226 1.00 0.33 N ATOM 178 CA ASP A 22 2.567 1.619 -12.340 1.00 0.37 C ATOM 179 C ASP A 22 4.072 1.609 -12.107 1.00 0.35 C ATOM 180 O ASP A 22 4.686 2.675 -12.064 1.00 0.40 O ATOM 181 CB ASP A 22 2.195 1.065 -13.720 1.00 0.50 C ATOM 182 CG ASP A 22 2.439 -0.424 -13.846 1.00 1.16 C ATOM 183 OD1 ASP A 22 3.571 -0.819 -14.189 1.00 1.87 O ATOM 184 OD2 ASP A 22 1.500 -1.203 -13.586 1.00 1.48 O ATOM 0 H ASP A 22 1.982 3.469 -13.115 1.00 0.33 H new ATOM 0 HA ASP A 22 2.068 0.980 -11.612 1.00 0.37 H new ATOM 0 HB2 ASP A 22 1.143 1.273 -13.917 1.00 0.50 H new ATOM 0 HB3 ASP A 22 2.772 1.588 -14.483 1.00 0.50 H new ATOM 189 N ALA A 23 4.665 0.436 -11.955 1.00 0.39 N ATOM 190 CA ALA A 23 6.051 0.322 -11.490 1.00 0.42 C ATOM 191 C ALA A 23 7.063 0.945 -12.451 1.00 0.47 C ATOM 192 O ALA A 23 8.257 0.974 -12.157 1.00 0.59 O ATOM 193 CB ALA A 23 6.401 -1.135 -11.228 1.00 0.52 C ATOM 0 H ALA A 23 4.212 -0.458 -12.146 1.00 0.39 H new ATOM 0 HA ALA A 23 6.115 0.889 -10.561 1.00 0.42 H new ATOM 0 HB1 ALA A 23 7.433 -1.205 -10.883 1.00 0.52 H new ATOM 0 HB2 ALA A 23 5.735 -1.538 -10.465 1.00 0.52 H new ATOM 0 HB3 ALA A 23 6.286 -1.708 -12.148 1.00 0.52 H new ATOM 199 N ASP A 24 6.591 1.430 -13.589 1.00 0.46 N ATOM 200 CA ASP A 24 7.457 2.120 -14.539 1.00 0.54 C ATOM 201 C ASP A 24 7.196 3.629 -14.541 1.00 0.51 C ATOM 202 O ASP A 24 7.726 4.341 -15.391 1.00 0.62 O ATOM 203 CB ASP A 24 7.265 1.565 -15.954 1.00 0.69 C ATOM 204 CG ASP A 24 7.762 0.140 -16.111 1.00 1.43 C ATOM 205 OD1 ASP A 24 7.083 -0.790 -15.632 1.00 2.34 O ATOM 206 OD2 ASP A 24 8.826 -0.057 -16.729 1.00 1.51 O ATOM 0 H ASP A 24 5.616 1.360 -13.879 1.00 0.46 H new ATOM 0 HA ASP A 24 8.485 1.946 -14.222 1.00 0.54 H new ATOM 0 HB2 ASP A 24 6.207 1.604 -16.212 1.00 0.69 H new ATOM 0 HB3 ASP A 24 7.790 2.206 -16.663 1.00 0.69 H new ATOM 211 N HIS A 25 6.339 4.109 -13.621 1.00 0.43 N ATOM 212 CA HIS A 25 6.050 5.542 -13.474 1.00 0.44 C ATOM 213 C HIS A 25 5.054 5.971 -14.532 1.00 0.47 C ATOM 214 O HIS A 25 4.752 7.152 -14.689 1.00 0.54 O ATOM 215 CB HIS A 25 7.317 6.420 -13.517 1.00 0.54 C ATOM 216 CG HIS A 25 8.073 6.475 -12.224 1.00 0.64 C ATOM 217 ND1 HIS A 25 7.703 7.265 -11.154 1.00 0.73 N ATOM 218 CD2 HIS A 25 9.172 5.803 -11.825 1.00 1.47 C ATOM 219 CE1 HIS A 25 8.540 7.064 -10.148 1.00 0.59 C ATOM 220 NE2 HIS A 25 9.442 6.184 -10.534 1.00 1.26 N ATOM 0 H HIS A 25 5.832 3.516 -12.964 1.00 0.43 H new ATOM 0 HA HIS A 25 5.618 5.689 -12.484 1.00 0.44 H new ATOM 0 HB2 HIS A 25 7.980 6.043 -14.296 1.00 0.54 H new ATOM 0 HB3 HIS A 25 7.033 7.433 -13.802 1.00 0.54 H new ATOM 0 HD2 HIS A 25 9.736 5.095 -12.413 1.00 1.47 H new ATOM 0 HE1 HIS A 25 8.492 7.539 -9.179 1.00 0.59 H new ATOM 0 HE2 HIS A 25 10.216 5.841 -9.965 1.00 1.26 H new ATOM 229 N LYS A 26 4.564 4.982 -15.265 1.00 0.48 N ATOM 230 CA LYS A 26 3.414 5.151 -16.127 1.00 0.53 C ATOM 231 C LYS A 26 2.211 5.408 -15.243 1.00 0.41 C ATOM 232 O LYS A 26 1.866 4.543 -14.437 1.00 0.38 O ATOM 233 CB LYS A 26 3.168 3.871 -16.925 1.00 0.67 C ATOM 234 CG LYS A 26 4.409 3.296 -17.581 1.00 1.00 C ATOM 235 CD LYS A 26 4.187 1.847 -17.989 1.00 2.12 C ATOM 236 CE LYS A 26 4.039 0.950 -16.768 1.00 3.15 C ATOM 237 NZ LYS A 26 3.735 -0.459 -17.129 1.00 4.25 N ATOM 0 H LYS A 26 4.956 4.041 -15.276 1.00 0.48 H new ATOM 0 HA LYS A 26 3.583 5.977 -16.818 1.00 0.53 H new ATOM 0 HB2 LYS A 26 2.741 3.119 -16.261 1.00 0.67 H new ATOM 0 HB3 LYS A 26 2.425 4.075 -17.696 1.00 0.67 H new ATOM 0 HG2 LYS A 26 4.669 3.889 -18.458 1.00 1.00 H new ATOM 0 HG3 LYS A 26 5.251 3.359 -16.892 1.00 1.00 H new ATOM 0 HD2 LYS A 26 3.293 1.773 -18.609 1.00 2.12 H new ATOM 0 HD3 LYS A 26 5.025 1.505 -18.596 1.00 2.12 H new ATOM 0 HE2 LYS A 26 4.959 0.982 -16.185 1.00 3.15 H new ATOM 0 HE3 LYS A 26 3.244 1.338 -16.131 1.00 3.15 H new ATOM 0 HZ1 LYS A 26 3.577 -1.013 -16.263 1.00 4.25 H new ATOM 0 HZ2 LYS A 26 2.880 -0.489 -17.720 1.00 4.25 H new ATOM 0 HZ3 LYS A 26 4.535 -0.862 -17.657 1.00 4.25 H new ATOM 251 N PRO A 27 1.588 6.589 -15.329 1.00 0.41 N ATOM 252 CA PRO A 27 0.444 6.920 -14.481 1.00 0.37 C ATOM 253 C PRO A 27 -0.606 5.818 -14.471 1.00 0.32 C ATOM 254 O PRO A 27 -1.230 5.498 -15.485 1.00 0.36 O ATOM 255 CB PRO A 27 -0.078 8.206 -15.113 1.00 0.46 C ATOM 256 CG PRO A 27 1.158 8.844 -15.643 1.00 0.54 C ATOM 257 CD PRO A 27 1.956 7.708 -16.216 1.00 0.50 C ATOM 0 HA PRO A 27 0.710 7.034 -13.430 1.00 0.37 H new ATOM 0 HB2 PRO A 27 -0.799 8.003 -15.905 1.00 0.46 H new ATOM 0 HB3 PRO A 27 -0.578 8.841 -14.382 1.00 0.46 H new ATOM 0 HG2 PRO A 27 0.925 9.588 -16.405 1.00 0.54 H new ATOM 0 HG3 PRO A 27 1.709 9.357 -14.854 1.00 0.54 H new ATOM 0 HD2 PRO A 27 1.692 7.508 -17.254 1.00 0.50 H new ATOM 0 HD3 PRO A 27 3.027 7.910 -16.193 1.00 0.50 H new ATOM 265 N TYR A 28 -0.756 5.244 -13.295 1.00 0.28 N ATOM 266 CA TYR A 28 -1.701 4.175 -13.032 1.00 0.26 C ATOM 267 C TYR A 28 -3.116 4.702 -12.868 1.00 0.25 C ATOM 268 O TYR A 28 -3.334 5.840 -12.450 1.00 0.37 O ATOM 269 CB TYR A 28 -1.280 3.467 -11.751 1.00 0.30 C ATOM 270 CG TYR A 28 -1.795 2.063 -11.588 1.00 0.37 C ATOM 271 CD1 TYR A 28 -2.335 1.351 -12.651 1.00 0.50 C ATOM 272 CD2 TYR A 28 -1.721 1.445 -10.355 1.00 0.82 C ATOM 273 CE1 TYR A 28 -2.790 0.061 -12.483 1.00 0.64 C ATOM 274 CE2 TYR A 28 -2.168 0.160 -10.176 1.00 1.10 C ATOM 275 CZ TYR A 28 -2.705 -0.532 -11.245 1.00 0.92 C ATOM 276 OH TYR A 28 -3.168 -1.815 -11.074 1.00 1.20 O ATOM 0 H TYR A 28 -0.212 5.513 -12.475 1.00 0.28 H new ATOM 0 HA TYR A 28 -1.697 3.491 -13.881 1.00 0.26 H new ATOM 0 HB2 TYR A 28 -0.191 3.443 -11.711 1.00 0.30 H new ATOM 0 HB3 TYR A 28 -1.617 4.060 -10.901 1.00 0.30 H new ATOM 0 HD1 TYR A 28 -2.399 1.815 -13.624 1.00 0.50 H new ATOM 0 HD2 TYR A 28 -1.304 1.983 -9.517 1.00 0.82 H new ATOM 0 HE1 TYR A 28 -3.210 -0.480 -13.318 1.00 0.64 H new ATOM 0 HE2 TYR A 28 -2.101 -0.308 -9.205 1.00 1.10 H new ATOM 0 HH TYR A 28 -3.071 -2.312 -11.913 1.00 1.20 H new ATOM 286 N ASN A 29 -4.064 3.854 -13.208 1.00 0.34 N ATOM 287 CA ASN A 29 -5.468 4.141 -13.018 1.00 0.42 C ATOM 288 C ASN A 29 -5.896 3.727 -11.611 1.00 0.34 C ATOM 289 O ASN A 29 -6.296 2.590 -11.380 1.00 0.44 O ATOM 290 CB ASN A 29 -6.293 3.397 -14.070 1.00 0.67 C ATOM 291 CG ASN A 29 -7.774 3.686 -13.965 1.00 0.73 C ATOM 292 OD1 ASN A 29 -8.609 2.841 -14.285 1.00 1.18 O ATOM 293 ND2 ASN A 29 -8.110 4.883 -13.521 1.00 1.51 N ATOM 0 H ASN A 29 -3.880 2.942 -13.626 1.00 0.34 H new ATOM 0 HA ASN A 29 -5.638 5.212 -13.132 1.00 0.42 H new ATOM 0 HB2 ASN A 29 -5.943 3.676 -15.064 1.00 0.67 H new ATOM 0 HB3 ASN A 29 -6.128 2.325 -13.963 1.00 0.67 H new ATOM 0 HD21 ASN A 29 -9.094 5.136 -13.433 1.00 1.51 H new ATOM 0 HD22 ASN A 29 -7.386 5.554 -13.266 1.00 1.51 H new ATOM 300 N LEU A 30 -5.789 4.650 -10.669 1.00 0.25 N ATOM 301 CA LEU A 30 -6.161 4.374 -9.285 1.00 0.20 C ATOM 302 C LEU A 30 -7.674 4.261 -9.149 1.00 0.19 C ATOM 303 O LEU A 30 -8.190 3.349 -8.500 1.00 0.19 O ATOM 304 CB LEU A 30 -5.665 5.490 -8.366 1.00 0.22 C ATOM 305 CG LEU A 30 -6.090 5.386 -6.923 1.00 0.22 C ATOM 306 CD1 LEU A 30 -5.530 4.128 -6.283 1.00 0.23 C ATOM 307 CD2 LEU A 30 -5.658 6.617 -6.150 1.00 0.28 C ATOM 0 H LEU A 30 -5.448 5.597 -10.834 1.00 0.25 H new ATOM 0 HA LEU A 30 -5.699 3.430 -8.997 1.00 0.20 H new ATOM 0 HB2 LEU A 30 -4.576 5.510 -8.404 1.00 0.22 H new ATOM 0 HB3 LEU A 30 -6.015 6.444 -8.761 1.00 0.22 H new ATOM 0 HG LEU A 30 -7.178 5.325 -6.893 1.00 0.22 H new ATOM 0 HD11 LEU A 30 -5.850 4.076 -5.242 1.00 0.23 H new ATOM 0 HD12 LEU A 30 -5.896 3.253 -6.820 1.00 0.23 H new ATOM 0 HD13 LEU A 30 -4.441 4.151 -6.327 1.00 0.23 H new ATOM 0 HD21 LEU A 30 -5.974 6.523 -5.111 1.00 0.28 H new ATOM 0 HD22 LEU A 30 -4.573 6.711 -6.193 1.00 0.28 H new ATOM 0 HD23 LEU A 30 -6.117 7.503 -6.590 1.00 0.28 H new ATOM 319 N VAL A 31 -8.369 5.185 -9.797 1.00 0.20 N ATOM 320 CA VAL A 31 -9.814 5.337 -9.648 1.00 0.19 C ATOM 321 C VAL A 31 -10.604 4.162 -10.220 1.00 0.20 C ATOM 322 O VAL A 31 -11.828 4.169 -10.188 1.00 0.23 O ATOM 323 CB VAL A 31 -10.322 6.641 -10.289 1.00 0.22 C ATOM 324 CG1 VAL A 31 -10.724 7.647 -9.240 1.00 1.02 C ATOM 325 CG2 VAL A 31 -9.272 7.255 -11.180 1.00 0.87 C ATOM 0 H VAL A 31 -7.948 5.853 -10.443 1.00 0.20 H new ATOM 0 HA VAL A 31 -9.985 5.369 -8.572 1.00 0.19 H new ATOM 0 HB VAL A 31 -11.195 6.380 -10.888 1.00 0.22 H new ATOM 0 HG11 VAL A 31 -11.078 8.557 -9.725 1.00 1.02 H new ATOM 0 HG12 VAL A 31 -11.521 7.231 -8.623 1.00 1.02 H new ATOM 0 HG13 VAL A 31 -9.864 7.882 -8.612 1.00 1.02 H new ATOM 0 HG21 VAL A 31 -9.659 8.175 -11.619 1.00 0.87 H new ATOM 0 HG22 VAL A 31 -8.382 7.480 -10.592 1.00 0.87 H new ATOM 0 HG23 VAL A 31 -9.014 6.555 -11.974 1.00 0.87 H new ATOM 335 N GLN A 32 -9.919 3.162 -10.752 1.00 0.21 N ATOM 336 CA GLN A 32 -10.592 1.937 -11.162 1.00 0.23 C ATOM 337 C GLN A 32 -11.003 1.148 -9.923 1.00 0.22 C ATOM 338 O GLN A 32 -11.759 0.184 -9.997 1.00 0.28 O ATOM 339 CB GLN A 32 -9.683 1.083 -12.047 1.00 0.26 C ATOM 340 CG GLN A 32 -8.482 0.514 -11.310 1.00 0.29 C ATOM 341 CD GLN A 32 -7.566 -0.298 -12.203 1.00 0.35 C ATOM 342 OE1 GLN A 32 -6.924 -1.243 -11.749 1.00 1.02 O ATOM 343 NE2 GLN A 32 -7.491 0.070 -13.473 1.00 0.75 N ATOM 0 H GLN A 32 -8.911 3.172 -10.909 1.00 0.21 H new ATOM 0 HA GLN A 32 -11.477 2.201 -11.741 1.00 0.23 H new ATOM 0 HB2 GLN A 32 -10.264 0.262 -12.467 1.00 0.26 H new ATOM 0 HB3 GLN A 32 -9.333 1.686 -12.885 1.00 0.26 H new ATOM 0 HG2 GLN A 32 -7.915 1.332 -10.866 1.00 0.29 H new ATOM 0 HG3 GLN A 32 -8.831 -0.114 -10.490 1.00 0.29 H new ATOM 0 HE21 GLN A 32 -8.041 0.861 -13.808 1.00 0.75 H new ATOM 0 HE22 GLN A 32 -6.883 -0.437 -14.116 1.00 0.75 H new ATOM 352 N HIS A 33 -10.474 1.571 -8.780 1.00 0.17 N ATOM 353 CA HIS A 33 -10.819 0.973 -7.497 1.00 0.16 C ATOM 354 C HIS A 33 -11.858 1.832 -6.815 1.00 0.16 C ATOM 355 O HIS A 33 -12.036 1.791 -5.603 1.00 0.17 O ATOM 356 CB HIS A 33 -9.551 0.785 -6.645 1.00 0.16 C ATOM 357 CG HIS A 33 -8.561 -0.088 -7.345 1.00 0.16 C ATOM 358 ND1 HIS A 33 -8.854 -1.389 -7.668 1.00 0.21 N ATOM 359 CD2 HIS A 33 -7.326 0.163 -7.868 1.00 0.22 C ATOM 360 CE1 HIS A 33 -7.867 -1.908 -8.359 1.00 0.27 C ATOM 361 NE2 HIS A 33 -6.923 -0.989 -8.506 1.00 0.28 N ATOM 0 H HIS A 33 -9.799 2.333 -8.717 1.00 0.17 H new ATOM 0 HA HIS A 33 -11.250 -0.018 -7.641 1.00 0.16 H new ATOM 0 HB2 HIS A 33 -9.102 1.756 -6.436 1.00 0.16 H new ATOM 0 HB3 HIS A 33 -9.816 0.343 -5.684 1.00 0.16 H new ATOM 0 HD1 HIS A 33 -9.711 -1.879 -7.410 1.00 0.21 H new ATOM 0 HD2 HIS A 33 -6.771 1.087 -7.796 1.00 0.22 H new ATOM 0 HE1 HIS A 33 -7.830 -2.916 -8.744 1.00 0.27 H new ATOM 370 N LYS A 34 -12.538 2.624 -7.630 1.00 0.19 N ATOM 371 CA LYS A 34 -13.706 3.349 -7.190 1.00 0.19 C ATOM 372 C LYS A 34 -14.901 2.413 -7.189 1.00 0.21 C ATOM 373 O LYS A 34 -15.365 1.983 -8.246 1.00 0.33 O ATOM 374 CB LYS A 34 -13.995 4.534 -8.108 1.00 0.22 C ATOM 375 CG LYS A 34 -13.142 5.758 -7.843 1.00 0.28 C ATOM 376 CD LYS A 34 -13.938 7.036 -8.057 1.00 0.69 C ATOM 377 CE LYS A 34 -14.580 7.055 -9.428 1.00 1.01 C ATOM 378 NZ LYS A 34 -13.673 7.586 -10.483 1.00 1.56 N ATOM 0 H LYS A 34 -12.293 2.778 -8.608 1.00 0.19 H new ATOM 0 HA LYS A 34 -13.520 3.729 -6.185 1.00 0.19 H new ATOM 0 HB2 LYS A 34 -13.847 4.221 -9.142 1.00 0.22 H new ATOM 0 HB3 LYS A 34 -15.045 4.809 -8.005 1.00 0.22 H new ATOM 0 HG2 LYS A 34 -12.764 5.728 -6.821 1.00 0.28 H new ATOM 0 HG3 LYS A 34 -12.275 5.751 -8.503 1.00 0.28 H new ATOM 0 HD2 LYS A 34 -14.708 7.121 -7.290 1.00 0.69 H new ATOM 0 HD3 LYS A 34 -13.282 7.899 -7.947 1.00 0.69 H new ATOM 0 HE2 LYS A 34 -14.887 6.044 -9.694 1.00 1.01 H new ATOM 0 HE3 LYS A 34 -15.484 7.663 -9.392 1.00 1.01 H new ATOM 0 HZ1 LYS A 34 -14.239 7.956 -11.273 1.00 1.56 H new ATOM 0 HZ2 LYS A 34 -13.090 8.350 -10.087 1.00 1.56 H new ATOM 0 HZ3 LYS A 34 -13.056 6.823 -10.827 1.00 1.56 H new ATOM 392 N GLY A 35 -15.378 2.081 -6.010 1.00 0.18 N ATOM 393 CA GLY A 35 -16.516 1.207 -5.896 1.00 0.20 C ATOM 394 C GLY A 35 -16.293 0.127 -4.868 1.00 0.17 C ATOM 395 O GLY A 35 -17.182 -0.171 -4.071 1.00 0.20 O ATOM 0 H GLY A 35 -14.995 2.403 -5.121 1.00 0.18 H new ATOM 0 HA2 GLY A 35 -17.396 1.790 -5.625 1.00 0.20 H new ATOM 0 HA3 GLY A 35 -16.722 0.750 -6.864 1.00 0.20 H new ATOM 399 N SER A 36 -15.107 -0.461 -4.871 1.00 0.16 N ATOM 400 CA SER A 36 -14.740 -1.411 -3.854 1.00 0.16 C ATOM 401 C SER A 36 -13.431 -0.982 -3.247 1.00 0.14 C ATOM 402 O SER A 36 -12.543 -0.518 -3.957 1.00 0.16 O ATOM 403 CB SER A 36 -14.611 -2.814 -4.439 1.00 0.20 C ATOM 404 OG SER A 36 -15.871 -3.297 -4.880 1.00 0.29 O ATOM 0 H SER A 36 -14.386 -0.291 -5.572 1.00 0.16 H new ATOM 0 HA SER A 36 -15.517 -1.439 -3.090 1.00 0.16 H new ATOM 0 HB2 SER A 36 -13.910 -2.801 -5.273 1.00 0.20 H new ATOM 0 HB3 SER A 36 -14.201 -3.489 -3.688 1.00 0.20 H new ATOM 0 HG SER A 36 -15.777 -3.686 -5.775 1.00 0.29 H new ATOM 410 N PRO A 37 -13.323 -1.084 -1.922 1.00 0.12 N ATOM 411 CA PRO A 37 -12.099 -0.816 -1.195 1.00 0.12 C ATOM 412 C PRO A 37 -10.894 -1.413 -1.875 1.00 0.12 C ATOM 413 O PRO A 37 -10.978 -2.432 -2.552 1.00 0.15 O ATOM 414 CB PRO A 37 -12.329 -1.481 0.172 1.00 0.15 C ATOM 415 CG PRO A 37 -13.619 -2.204 0.036 1.00 0.18 C ATOM 416 CD PRO A 37 -14.385 -1.462 -1.005 1.00 0.15 C ATOM 0 HA PRO A 37 -11.894 0.252 -1.128 1.00 0.12 H new ATOM 0 HB2 PRO A 37 -11.517 -2.165 0.420 1.00 0.15 H new ATOM 0 HB3 PRO A 37 -12.375 -0.739 0.969 1.00 0.15 H new ATOM 0 HG2 PRO A 37 -13.458 -3.241 -0.260 1.00 0.18 H new ATOM 0 HG3 PRO A 37 -14.160 -2.223 0.982 1.00 0.18 H new ATOM 0 HD2 PRO A 37 -15.139 -2.086 -1.484 1.00 0.15 H new ATOM 0 HD3 PRO A 37 -14.903 -0.595 -0.595 1.00 0.15 H new ATOM 424 N LEU A 38 -9.797 -0.741 -1.692 1.00 0.14 N ATOM 425 CA LEU A 38 -8.519 -1.134 -2.216 1.00 0.13 C ATOM 426 C LEU A 38 -7.528 -0.937 -1.092 1.00 0.13 C ATOM 427 O LEU A 38 -7.746 -0.119 -0.220 1.00 0.20 O ATOM 428 CB LEU A 38 -8.132 -0.282 -3.431 1.00 0.16 C ATOM 429 CG LEU A 38 -8.247 1.235 -3.278 1.00 0.20 C ATOM 430 CD1 LEU A 38 -7.496 1.926 -4.396 1.00 0.31 C ATOM 431 CD2 LEU A 38 -9.700 1.695 -3.291 1.00 0.26 C ATOM 0 H LEU A 38 -9.764 0.126 -1.156 1.00 0.14 H new ATOM 0 HA LEU A 38 -8.539 -2.169 -2.557 1.00 0.13 H new ATOM 0 HB2 LEU A 38 -7.102 -0.519 -3.697 1.00 0.16 H new ATOM 0 HB3 LEU A 38 -8.756 -0.586 -4.271 1.00 0.16 H new ATOM 0 HG LEU A 38 -7.812 1.501 -2.314 1.00 0.20 H new ATOM 0 HD11 LEU A 38 -7.583 3.006 -4.279 1.00 0.31 H new ATOM 0 HD12 LEU A 38 -6.445 1.641 -4.359 1.00 0.31 H new ATOM 0 HD13 LEU A 38 -7.919 1.629 -5.356 1.00 0.31 H new ATOM 0 HD21 LEU A 38 -9.740 2.779 -3.180 1.00 0.26 H new ATOM 0 HD22 LEU A 38 -10.163 1.410 -4.235 1.00 0.26 H new ATOM 0 HD23 LEU A 38 -10.238 1.226 -2.467 1.00 0.26 H new ATOM 443 N LEU A 39 -6.493 -1.710 -1.058 1.00 0.18 N ATOM 444 CA LEU A 39 -5.468 -1.504 -0.083 1.00 0.19 C ATOM 445 C LEU A 39 -4.202 -1.146 -0.773 1.00 0.18 C ATOM 446 O LEU A 39 -3.782 -1.806 -1.723 1.00 0.21 O ATOM 447 CB LEU A 39 -5.230 -2.718 0.790 1.00 0.23 C ATOM 448 CG LEU A 39 -5.804 -2.615 2.203 1.00 0.35 C ATOM 449 CD1 LEU A 39 -7.309 -2.772 2.186 1.00 1.10 C ATOM 450 CD2 LEU A 39 -5.176 -3.644 3.118 1.00 1.19 C ATOM 0 H LEU A 39 -6.333 -2.491 -1.694 1.00 0.18 H new ATOM 0 HA LEU A 39 -5.803 -0.697 0.569 1.00 0.19 H new ATOM 0 HB2 LEU A 39 -5.662 -3.590 0.300 1.00 0.23 H new ATOM 0 HB3 LEU A 39 -4.156 -2.892 0.861 1.00 0.23 H new ATOM 0 HG LEU A 39 -5.566 -1.624 2.589 1.00 0.35 H new ATOM 0 HD11 LEU A 39 -7.694 -2.695 3.203 1.00 1.10 H new ATOM 0 HD12 LEU A 39 -7.750 -1.988 1.571 1.00 1.10 H new ATOM 0 HD13 LEU A 39 -7.569 -3.747 1.772 1.00 1.10 H new ATOM 0 HD21 LEU A 39 -5.601 -3.550 4.117 1.00 1.19 H new ATOM 0 HD22 LEU A 39 -5.374 -4.644 2.732 1.00 1.19 H new ATOM 0 HD23 LEU A 39 -4.099 -3.480 3.165 1.00 1.19 H new ATOM 462 N ILE A 40 -3.615 -0.087 -0.323 1.00 0.19 N ATOM 463 CA ILE A 40 -2.373 0.344 -0.880 1.00 0.20 C ATOM 464 C ILE A 40 -1.275 0.145 0.148 1.00 0.18 C ATOM 465 O ILE A 40 -1.373 0.631 1.277 1.00 0.20 O ATOM 466 CB ILE A 40 -2.475 1.802 -1.318 1.00 0.23 C ATOM 467 CG1 ILE A 40 -3.917 2.125 -1.690 1.00 0.30 C ATOM 468 CG2 ILE A 40 -1.573 2.069 -2.512 1.00 0.37 C ATOM 469 CD1 ILE A 40 -4.060 3.515 -2.237 1.00 0.35 C ATOM 0 H ILE A 40 -3.975 0.498 0.431 1.00 0.19 H new ATOM 0 HA ILE A 40 -2.132 -0.247 -1.763 1.00 0.20 H new ATOM 0 HB ILE A 40 -2.156 2.435 -0.490 1.00 0.23 H new ATOM 0 HG12 ILE A 40 -4.270 1.406 -2.430 1.00 0.30 H new ATOM 0 HG13 ILE A 40 -4.551 2.015 -0.811 1.00 0.30 H new ATOM 0 HG21 ILE A 40 -1.661 3.114 -2.808 1.00 0.37 H new ATOM 0 HG22 ILE A 40 -0.539 1.854 -2.242 1.00 0.37 H new ATOM 0 HG23 ILE A 40 -1.871 1.430 -3.343 1.00 0.37 H new ATOM 0 HD11 ILE A 40 -5.104 3.701 -2.489 1.00 0.35 H new ATOM 0 HD12 ILE A 40 -3.733 4.236 -1.488 1.00 0.35 H new ATOM 0 HD13 ILE A 40 -3.447 3.618 -3.132 1.00 0.35 H new ATOM 481 N TYR A 41 -0.253 -0.602 -0.233 1.00 0.18 N ATOM 482 CA TYR A 41 0.781 -1.009 0.697 1.00 0.19 C ATOM 483 C TYR A 41 2.079 -0.276 0.414 1.00 0.20 C ATOM 484 O TYR A 41 2.599 -0.358 -0.681 1.00 0.27 O ATOM 485 CB TYR A 41 1.058 -2.527 0.591 1.00 0.20 C ATOM 486 CG TYR A 41 -0.091 -3.452 0.930 1.00 0.20 C ATOM 487 CD1 TYR A 41 -1.391 -3.171 0.552 1.00 0.27 C ATOM 488 CD2 TYR A 41 0.151 -4.643 1.604 1.00 0.29 C ATOM 489 CE1 TYR A 41 -2.415 -4.045 0.834 1.00 0.32 C ATOM 490 CE2 TYR A 41 -0.873 -5.520 1.896 1.00 0.35 C ATOM 491 CZ TYR A 41 -2.154 -5.215 1.505 1.00 0.33 C ATOM 492 OH TYR A 41 -3.179 -6.088 1.770 1.00 0.42 O ATOM 0 H TYR A 41 -0.119 -0.940 -1.186 1.00 0.18 H new ATOM 0 HA TYR A 41 0.423 -0.766 1.698 1.00 0.19 H new ATOM 0 HB2 TYR A 41 1.381 -2.744 -0.427 1.00 0.20 H new ATOM 0 HB3 TYR A 41 1.894 -2.767 1.248 1.00 0.20 H new ATOM 0 HD1 TYR A 41 -1.606 -2.252 0.028 1.00 0.27 H new ATOM 0 HD2 TYR A 41 1.159 -4.886 1.905 1.00 0.29 H new ATOM 0 HE1 TYR A 41 -3.424 -3.811 0.528 1.00 0.32 H new ATOM 0 HE2 TYR A 41 -0.669 -6.438 2.427 1.00 0.35 H new ATOM 0 HH TYR A 41 -4.016 -5.730 1.407 1.00 0.42 H new ATOM 502 N ASN A 42 2.610 0.412 1.402 1.00 0.28 N ATOM 503 CA ASN A 42 3.983 0.888 1.322 1.00 0.34 C ATOM 504 C ASN A 42 4.830 -0.328 1.589 1.00 0.37 C ATOM 505 O ASN A 42 4.662 -0.990 2.599 1.00 0.54 O ATOM 506 CB ASN A 42 4.250 1.971 2.374 1.00 0.46 C ATOM 507 CG ASN A 42 5.447 1.664 3.251 1.00 1.50 C ATOM 508 OD1 ASN A 42 6.576 2.014 2.925 1.00 2.27 O ATOM 509 ND2 ASN A 42 5.206 0.998 4.364 1.00 2.35 N ATOM 0 H ASN A 42 2.121 0.655 2.264 1.00 0.28 H new ATOM 0 HA ASN A 42 4.201 1.339 0.354 1.00 0.34 H new ATOM 0 HB2 ASN A 42 4.410 2.925 1.872 1.00 0.46 H new ATOM 0 HB3 ASN A 42 3.366 2.085 3.002 1.00 0.46 H new ATOM 0 HD21 ASN A 42 5.974 0.756 4.990 1.00 2.35 H new ATOM 0 HD22 ASN A 42 4.252 0.725 4.599 1.00 2.35 H new ATOM 516 N VAL A 43 5.688 -0.677 0.679 1.00 0.36 N ATOM 517 CA VAL A 43 6.283 -1.980 0.756 1.00 0.38 C ATOM 518 C VAL A 43 7.788 -1.955 0.566 1.00 0.42 C ATOM 519 O VAL A 43 8.330 -1.128 -0.164 1.00 0.50 O ATOM 520 CB VAL A 43 5.599 -2.927 -0.253 1.00 0.39 C ATOM 521 CG1 VAL A 43 5.496 -2.302 -1.624 1.00 1.03 C ATOM 522 CG2 VAL A 43 6.326 -4.238 -0.342 1.00 0.98 C ATOM 0 H VAL A 43 5.987 -0.098 -0.106 1.00 0.36 H new ATOM 0 HA VAL A 43 6.120 -2.357 1.766 1.00 0.38 H new ATOM 0 HB VAL A 43 4.589 -3.108 0.115 1.00 0.39 H new ATOM 0 HG11 VAL A 43 5.009 -2.999 -2.306 1.00 1.03 H new ATOM 0 HG12 VAL A 43 4.910 -1.385 -1.563 1.00 1.03 H new ATOM 0 HG13 VAL A 43 6.495 -2.070 -1.994 1.00 1.03 H new ATOM 0 HG21 VAL A 43 5.822 -4.885 -1.060 1.00 0.98 H new ATOM 0 HG22 VAL A 43 7.352 -4.064 -0.668 1.00 0.98 H new ATOM 0 HG23 VAL A 43 6.332 -4.718 0.637 1.00 0.98 H new ATOM 532 N ALA A 44 8.453 -2.855 1.269 1.00 0.50 N ATOM 533 CA ALA A 44 9.875 -3.046 1.130 1.00 0.59 C ATOM 534 C ALA A 44 10.156 -4.161 0.137 1.00 0.58 C ATOM 535 O ALA A 44 9.937 -5.333 0.440 1.00 0.88 O ATOM 536 CB ALA A 44 10.495 -3.372 2.474 1.00 0.83 C ATOM 0 H ALA A 44 8.015 -3.473 1.953 1.00 0.50 H new ATOM 0 HA ALA A 44 10.319 -2.123 0.757 1.00 0.59 H new ATOM 0 HB1 ALA A 44 11.569 -3.514 2.354 1.00 0.83 H new ATOM 0 HB2 ALA A 44 10.312 -2.551 3.168 1.00 0.83 H new ATOM 0 HB3 ALA A 44 10.050 -4.286 2.868 1.00 0.83 H new ATOM 542 N SER A 45 10.534 -3.760 -1.067 1.00 0.57 N ATOM 543 CA SER A 45 11.097 -4.657 -2.087 1.00 0.63 C ATOM 544 C SER A 45 12.194 -5.545 -1.503 1.00 1.01 C ATOM 545 O SER A 45 13.380 -5.271 -1.656 1.00 1.78 O ATOM 546 CB SER A 45 11.673 -3.829 -3.241 1.00 0.73 C ATOM 547 OG SER A 45 10.747 -2.861 -3.697 1.00 1.62 O ATOM 0 H SER A 45 10.461 -2.791 -1.376 1.00 0.57 H new ATOM 0 HA SER A 45 10.295 -5.299 -2.451 1.00 0.63 H new ATOM 0 HB2 SER A 45 12.587 -3.334 -2.914 1.00 0.73 H new ATOM 0 HB3 SER A 45 11.945 -4.490 -4.064 1.00 0.73 H new ATOM 0 HG SER A 45 10.425 -3.111 -4.588 1.00 1.62 H new ATOM 553 N LYS A 46 11.784 -6.615 -0.850 1.00 1.32 N ATOM 554 CA LYS A 46 12.699 -7.490 -0.152 1.00 1.69 C ATOM 555 C LYS A 46 13.074 -8.692 -0.990 1.00 1.14 C ATOM 556 O LYS A 46 12.356 -9.081 -1.910 1.00 1.47 O ATOM 557 CB LYS A 46 12.066 -7.965 1.153 1.00 2.68 C ATOM 558 CG LYS A 46 12.310 -7.042 2.337 1.00 3.45 C ATOM 559 CD LYS A 46 13.782 -7.015 2.731 1.00 4.39 C ATOM 560 CE LYS A 46 14.320 -8.419 2.966 1.00 5.19 C ATOM 561 NZ LYS A 46 15.698 -8.416 3.514 1.00 5.84 N ATOM 0 H LYS A 46 10.807 -6.900 -0.790 1.00 1.32 H new ATOM 0 HA LYS A 46 13.606 -6.922 0.054 1.00 1.69 H new ATOM 0 HB2 LYS A 46 10.991 -8.071 1.005 1.00 2.68 H new ATOM 0 HB3 LYS A 46 12.454 -8.955 1.393 1.00 2.68 H new ATOM 0 HG2 LYS A 46 11.981 -6.033 2.087 1.00 3.45 H new ATOM 0 HG3 LYS A 46 11.711 -7.372 3.186 1.00 3.45 H new ATOM 0 HD2 LYS A 46 14.361 -6.528 1.946 1.00 4.39 H new ATOM 0 HD3 LYS A 46 13.907 -6.420 3.635 1.00 4.39 H new ATOM 0 HE2 LYS A 46 13.660 -8.947 3.655 1.00 5.19 H new ATOM 0 HE3 LYS A 46 14.308 -8.971 2.026 1.00 5.19 H new ATOM 0 HZ1 LYS A 46 16.105 -9.370 3.435 1.00 5.84 H new ATOM 0 HZ2 LYS A 46 16.283 -7.744 2.978 1.00 5.84 H new ATOM 0 HZ3 LYS A 46 15.673 -8.132 4.514 1.00 5.84 H new ATOM 575 N CYS A 47 14.206 -9.271 -0.660 1.00 1.21 N ATOM 576 CA CYS A 47 14.634 -10.505 -1.270 1.00 1.53 C ATOM 577 C CYS A 47 14.591 -11.615 -0.234 1.00 1.99 C ATOM 578 O CYS A 47 15.288 -11.555 0.780 1.00 2.46 O ATOM 579 CB CYS A 47 16.046 -10.336 -1.829 1.00 2.04 C ATOM 580 SG CYS A 47 16.799 -11.858 -2.443 1.00 3.55 S ATOM 0 H CYS A 47 14.852 -8.900 0.036 1.00 1.21 H new ATOM 0 HA CYS A 47 13.968 -10.767 -2.092 1.00 1.53 H new ATOM 0 HB2 CYS A 47 16.017 -9.608 -2.640 1.00 2.04 H new ATOM 0 HB3 CYS A 47 16.684 -9.920 -1.049 1.00 2.04 H new ATOM 0 HG CYS A 47 16.700 -12.787 -1.539 1.00 3.55 H new ATOM 586 N GLY A 48 13.744 -12.606 -0.484 1.00 2.39 N ATOM 587 CA GLY A 48 13.634 -13.748 0.405 1.00 2.91 C ATOM 588 C GLY A 48 13.215 -13.378 1.818 1.00 2.40 C ATOM 589 O GLY A 48 13.755 -13.917 2.786 1.00 2.46 O ATOM 0 H GLY A 48 13.126 -12.639 -1.295 1.00 2.39 H new ATOM 0 HA2 GLY A 48 12.911 -14.451 -0.008 1.00 2.91 H new ATOM 0 HA3 GLY A 48 14.594 -14.263 0.442 1.00 2.91 H new ATOM 593 N TYR A 49 12.258 -12.461 1.944 1.00 2.15 N ATOM 594 CA TYR A 49 11.761 -12.062 3.255 1.00 1.79 C ATOM 595 C TYR A 49 10.403 -11.370 3.147 1.00 1.42 C ATOM 596 O TYR A 49 10.196 -10.501 2.301 1.00 1.67 O ATOM 597 CB TYR A 49 12.769 -11.143 3.961 1.00 2.10 C ATOM 598 CG TYR A 49 12.360 -10.733 5.362 1.00 2.40 C ATOM 599 CD1 TYR A 49 12.661 -11.534 6.459 1.00 2.66 C ATOM 600 CD2 TYR A 49 11.668 -9.548 5.586 1.00 3.01 C ATOM 601 CE1 TYR A 49 12.288 -11.163 7.737 1.00 3.26 C ATOM 602 CE2 TYR A 49 11.291 -9.172 6.862 1.00 3.74 C ATOM 603 CZ TYR A 49 11.615 -9.979 7.936 1.00 3.76 C ATOM 604 OH TYR A 49 11.236 -9.610 9.207 1.00 4.63 O ATOM 0 H TYR A 49 11.815 -11.984 1.159 1.00 2.15 H new ATOM 0 HA TYR A 49 11.635 -12.967 3.849 1.00 1.79 H new ATOM 0 HB2 TYR A 49 13.733 -11.649 4.009 1.00 2.10 H new ATOM 0 HB3 TYR A 49 12.910 -10.246 3.358 1.00 2.10 H new ATOM 0 HD1 TYR A 49 13.195 -12.461 6.309 1.00 2.66 H new ATOM 0 HD2 TYR A 49 11.421 -8.911 4.750 1.00 3.01 H new ATOM 0 HE1 TYR A 49 12.524 -11.800 8.577 1.00 3.26 H new ATOM 0 HE2 TYR A 49 10.746 -8.253 7.018 1.00 3.74 H new ATOM 0 HH TYR A 49 10.772 -8.747 9.173 1.00 4.63 H new ATOM 614 N THR A 50 9.487 -11.782 4.006 1.00 1.05 N ATOM 615 CA THR A 50 8.169 -11.180 4.109 1.00 0.81 C ATOM 616 C THR A 50 7.749 -11.166 5.584 1.00 0.77 C ATOM 617 O THR A 50 8.074 -12.093 6.324 1.00 1.44 O ATOM 618 CB THR A 50 7.130 -11.972 3.271 1.00 1.09 C ATOM 619 OG1 THR A 50 5.803 -11.472 3.500 1.00 1.93 O ATOM 620 CG2 THR A 50 7.170 -13.459 3.598 1.00 1.87 C ATOM 0 H THR A 50 9.639 -12.552 4.658 1.00 1.05 H new ATOM 0 HA THR A 50 8.209 -10.163 3.719 1.00 0.81 H new ATOM 0 HB THR A 50 7.392 -11.837 2.222 1.00 1.09 H new ATOM 0 HG1 THR A 50 5.852 -10.543 3.809 1.00 1.93 H new ATOM 0 HG21 THR A 50 6.430 -13.984 2.994 1.00 1.87 H new ATOM 0 HG22 THR A 50 8.163 -13.853 3.380 1.00 1.87 H new ATOM 0 HG23 THR A 50 6.946 -13.605 4.655 1.00 1.87 H new ATOM 628 N LYS A 51 7.057 -10.119 6.035 1.00 0.61 N ATOM 629 CA LYS A 51 6.563 -10.092 7.403 1.00 0.56 C ATOM 630 C LYS A 51 5.119 -10.591 7.416 1.00 0.76 C ATOM 631 O LYS A 51 4.387 -10.436 8.389 1.00 1.55 O ATOM 632 CB LYS A 51 6.670 -8.673 7.984 1.00 0.59 C ATOM 633 CG LYS A 51 6.522 -8.632 9.492 1.00 1.22 C ATOM 634 CD LYS A 51 7.155 -7.390 10.091 1.00 1.39 C ATOM 635 CE LYS A 51 6.845 -7.293 11.572 1.00 1.46 C ATOM 636 NZ LYS A 51 7.799 -6.409 12.291 1.00 2.01 N ATOM 0 H LYS A 51 6.831 -9.294 5.480 1.00 0.61 H new ATOM 0 HA LYS A 51 7.169 -10.746 8.030 1.00 0.56 H new ATOM 0 HB2 LYS A 51 7.634 -8.246 7.708 1.00 0.59 H new ATOM 0 HB3 LYS A 51 5.903 -8.044 7.533 1.00 0.59 H new ATOM 0 HG2 LYS A 51 5.464 -8.662 9.754 1.00 1.22 H new ATOM 0 HG3 LYS A 51 6.983 -9.519 9.926 1.00 1.22 H new ATOM 0 HD2 LYS A 51 8.234 -7.417 9.941 1.00 1.39 H new ATOM 0 HD3 LYS A 51 6.784 -6.503 9.578 1.00 1.39 H new ATOM 0 HE2 LYS A 51 5.832 -6.914 11.705 1.00 1.46 H new ATOM 0 HE3 LYS A 51 6.873 -8.289 12.013 1.00 1.46 H new ATOM 0 HZ1 LYS A 51 7.547 -6.374 13.299 1.00 2.01 H new ATOM 0 HZ2 LYS A 51 8.764 -6.783 12.188 1.00 2.01 H new ATOM 0 HZ3 LYS A 51 7.754 -5.451 11.889 1.00 2.01 H new ATOM 650 N GLY A 52 4.739 -11.217 6.314 1.00 0.45 N ATOM 651 CA GLY A 52 3.369 -11.628 6.108 1.00 0.51 C ATOM 652 C GLY A 52 2.782 -10.903 4.921 1.00 0.41 C ATOM 653 O GLY A 52 2.068 -11.491 4.110 1.00 0.41 O ATOM 0 H GLY A 52 5.369 -11.451 5.546 1.00 0.45 H new ATOM 0 HA2 GLY A 52 3.325 -12.705 5.944 1.00 0.51 H new ATOM 0 HA3 GLY A 52 2.780 -11.417 7.000 1.00 0.51 H new ATOM 657 N GLY A 53 3.154 -9.626 4.817 1.00 0.44 N ATOM 658 CA GLY A 53 2.703 -8.741 3.750 1.00 0.50 C ATOM 659 C GLY A 53 2.564 -9.399 2.387 1.00 0.36 C ATOM 660 O GLY A 53 1.525 -9.270 1.755 1.00 0.32 O ATOM 0 H GLY A 53 3.784 -9.175 5.481 1.00 0.44 H new ATOM 0 HA2 GLY A 53 1.739 -8.317 4.032 1.00 0.50 H new ATOM 0 HA3 GLY A 53 3.404 -7.911 3.666 1.00 0.50 H new ATOM 664 N TYR A 54 3.599 -10.101 1.929 1.00 0.37 N ATOM 665 CA TYR A 54 3.617 -10.630 0.562 1.00 0.36 C ATOM 666 C TYR A 54 2.424 -11.542 0.301 1.00 0.26 C ATOM 667 O TYR A 54 1.610 -11.280 -0.586 1.00 0.25 O ATOM 668 CB TYR A 54 4.907 -11.400 0.297 1.00 0.45 C ATOM 669 CG TYR A 54 5.480 -11.171 -1.084 1.00 0.41 C ATOM 670 CD1 TYR A 54 4.677 -11.198 -2.226 1.00 0.45 C ATOM 671 CD2 TYR A 54 6.831 -10.912 -1.239 1.00 0.53 C ATOM 672 CE1 TYR A 54 5.216 -10.976 -3.484 1.00 0.46 C ATOM 673 CE2 TYR A 54 7.377 -10.690 -2.482 1.00 0.65 C ATOM 674 CZ TYR A 54 6.569 -10.721 -3.604 1.00 0.56 C ATOM 675 OH TYR A 54 7.114 -10.497 -4.847 1.00 0.70 O ATOM 0 H TYR A 54 4.431 -10.317 2.478 1.00 0.37 H new ATOM 0 HA TYR A 54 3.559 -9.777 -0.114 1.00 0.36 H new ATOM 0 HB2 TYR A 54 5.650 -11.113 1.041 1.00 0.45 H new ATOM 0 HB3 TYR A 54 4.718 -12.465 0.430 1.00 0.45 H new ATOM 0 HD1 TYR A 54 3.620 -11.395 -2.128 1.00 0.45 H new ATOM 0 HD2 TYR A 54 7.468 -10.884 -0.368 1.00 0.53 H new ATOM 0 HE1 TYR A 54 4.585 -11.002 -4.360 1.00 0.46 H new ATOM 0 HE2 TYR A 54 8.434 -10.492 -2.581 1.00 0.65 H new ATOM 0 HH TYR A 54 8.076 -10.332 -4.758 1.00 0.70 H new ATOM 685 N GLU A 55 2.324 -12.599 1.093 1.00 0.25 N ATOM 686 CA GLU A 55 1.262 -13.590 0.948 1.00 0.27 C ATOM 687 C GLU A 55 -0.093 -12.943 1.183 1.00 0.22 C ATOM 688 O GLU A 55 -1.114 -13.377 0.645 1.00 0.25 O ATOM 689 CB GLU A 55 1.471 -14.707 1.965 1.00 0.36 C ATOM 690 CG GLU A 55 2.912 -15.166 2.058 1.00 1.14 C ATOM 691 CD GLU A 55 3.209 -15.873 3.360 1.00 1.92 C ATOM 692 OE1 GLU A 55 3.576 -15.202 4.344 1.00 2.61 O ATOM 693 OE2 GLU A 55 3.084 -17.114 3.399 1.00 2.39 O ATOM 0 H GLU A 55 2.974 -12.796 1.854 1.00 0.25 H new ATOM 0 HA GLU A 55 1.292 -13.998 -0.062 1.00 0.27 H new ATOM 0 HB2 GLU A 55 1.142 -14.363 2.946 1.00 0.36 H new ATOM 0 HB3 GLU A 55 0.842 -15.556 1.697 1.00 0.36 H new ATOM 0 HG2 GLU A 55 3.132 -15.835 1.226 1.00 1.14 H new ATOM 0 HG3 GLU A 55 3.572 -14.304 1.957 1.00 1.14 H new ATOM 700 N THR A 56 -0.074 -11.885 1.971 1.00 0.25 N ATOM 701 CA THR A 56 -1.271 -11.175 2.347 1.00 0.24 C ATOM 702 C THR A 56 -1.805 -10.400 1.161 1.00 0.21 C ATOM 703 O THR A 56 -2.908 -10.647 0.677 1.00 0.22 O ATOM 704 CB THR A 56 -0.963 -10.216 3.515 1.00 0.26 C ATOM 705 OG1 THR A 56 -0.549 -10.966 4.665 1.00 0.33 O ATOM 706 CG2 THR A 56 -2.164 -9.368 3.866 1.00 0.25 C ATOM 0 H THR A 56 0.781 -11.495 2.368 1.00 0.25 H new ATOM 0 HA THR A 56 -2.028 -11.891 2.667 1.00 0.24 H new ATOM 0 HB THR A 56 -0.159 -9.551 3.200 1.00 0.26 H new ATOM 0 HG1 THR A 56 0.345 -11.336 4.510 1.00 0.33 H new ATOM 0 HG21 THR A 56 -1.912 -8.704 4.693 1.00 0.25 H new ATOM 0 HG22 THR A 56 -2.456 -8.774 3.000 1.00 0.25 H new ATOM 0 HG23 THR A 56 -2.992 -10.013 4.159 1.00 0.25 H new ATOM 714 N ALA A 57 -0.974 -9.511 0.668 1.00 0.19 N ATOM 715 CA ALA A 57 -1.315 -8.652 -0.438 1.00 0.20 C ATOM 716 C ALA A 57 -1.642 -9.459 -1.687 1.00 0.19 C ATOM 717 O ALA A 57 -2.578 -9.132 -2.416 1.00 0.22 O ATOM 718 CB ALA A 57 -0.162 -7.711 -0.694 1.00 0.22 C ATOM 0 H ALA A 57 -0.032 -9.364 1.029 1.00 0.19 H new ATOM 0 HA ALA A 57 -2.208 -8.080 -0.185 1.00 0.20 H new ATOM 0 HB1 ALA A 57 -0.407 -7.055 -1.529 1.00 0.22 H new ATOM 0 HB2 ALA A 57 0.023 -7.111 0.197 1.00 0.22 H new ATOM 0 HB3 ALA A 57 0.731 -8.287 -0.935 1.00 0.22 H new ATOM 724 N THR A 58 -0.876 -10.521 -1.915 1.00 0.17 N ATOM 725 CA THR A 58 -1.080 -11.370 -3.077 1.00 0.17 C ATOM 726 C THR A 58 -2.497 -11.947 -3.080 1.00 0.17 C ATOM 727 O THR A 58 -3.286 -11.719 -4.001 1.00 0.19 O ATOM 728 CB THR A 58 -0.085 -12.545 -3.095 1.00 0.20 C ATOM 729 OG1 THR A 58 1.265 -12.065 -3.081 1.00 0.24 O ATOM 730 CG2 THR A 58 -0.302 -13.423 -4.317 1.00 0.26 C ATOM 0 H THR A 58 -0.109 -10.812 -1.309 1.00 0.17 H new ATOM 0 HA THR A 58 -0.924 -10.747 -3.958 1.00 0.17 H new ATOM 0 HB THR A 58 -0.260 -13.141 -2.199 1.00 0.20 H new ATOM 0 HG1 THR A 58 1.591 -12.032 -2.157 1.00 0.24 H new ATOM 0 HG21 THR A 58 0.413 -14.245 -4.306 1.00 0.26 H new ATOM 0 HG22 THR A 58 -1.316 -13.824 -4.302 1.00 0.26 H new ATOM 0 HG23 THR A 58 -0.159 -12.830 -5.221 1.00 0.26 H new ATOM 738 N THR A 59 -2.810 -12.671 -2.010 1.00 0.16 N ATOM 739 CA THR A 59 -4.064 -13.396 -1.896 1.00 0.17 C ATOM 740 C THR A 59 -5.252 -12.443 -1.775 1.00 0.16 C ATOM 741 O THR A 59 -6.332 -12.719 -2.290 1.00 0.19 O ATOM 742 CB THR A 59 -4.030 -14.336 -0.675 1.00 0.20 C ATOM 743 OG1 THR A 59 -2.792 -15.063 -0.658 1.00 0.48 O ATOM 744 CG2 THR A 59 -5.197 -15.317 -0.703 1.00 0.46 C ATOM 0 H THR A 59 -2.199 -12.770 -1.199 1.00 0.16 H new ATOM 0 HA THR A 59 -4.187 -13.984 -2.805 1.00 0.17 H new ATOM 0 HB THR A 59 -4.114 -13.727 0.225 1.00 0.20 H new ATOM 0 HG1 THR A 59 -2.106 -14.531 -0.203 1.00 0.48 H new ATOM 0 HG21 THR A 59 -5.147 -15.967 0.170 1.00 0.46 H new ATOM 0 HG22 THR A 59 -6.137 -14.765 -0.691 1.00 0.46 H new ATOM 0 HG23 THR A 59 -5.143 -15.921 -1.609 1.00 0.46 H new ATOM 752 N LEU A 60 -5.036 -11.309 -1.124 1.00 0.13 N ATOM 753 CA LEU A 60 -6.099 -10.348 -0.888 1.00 0.13 C ATOM 754 C LEU A 60 -6.545 -9.731 -2.186 1.00 0.13 C ATOM 755 O LEU A 60 -7.732 -9.701 -2.503 1.00 0.15 O ATOM 756 CB LEU A 60 -5.616 -9.270 0.058 1.00 0.13 C ATOM 757 CG LEU A 60 -5.703 -9.655 1.520 1.00 0.14 C ATOM 758 CD1 LEU A 60 -5.047 -8.600 2.381 1.00 0.43 C ATOM 759 CD2 LEU A 60 -7.158 -9.827 1.911 1.00 0.35 C ATOM 0 H LEU A 60 -4.129 -11.033 -0.749 1.00 0.13 H new ATOM 0 HA LEU A 60 -6.947 -10.865 -0.439 1.00 0.13 H new ATOM 0 HB2 LEU A 60 -4.581 -9.026 -0.183 1.00 0.13 H new ATOM 0 HB3 LEU A 60 -6.203 -8.366 -0.106 1.00 0.13 H new ATOM 0 HG LEU A 60 -5.177 -10.597 1.675 1.00 0.14 H new ATOM 0 HD11 LEU A 60 -5.117 -8.890 3.429 1.00 0.43 H new ATOM 0 HD12 LEU A 60 -3.998 -8.502 2.101 1.00 0.43 H new ATOM 0 HD13 LEU A 60 -5.552 -7.645 2.234 1.00 0.43 H new ATOM 0 HD21 LEU A 60 -7.222 -10.104 2.963 1.00 0.35 H new ATOM 0 HD22 LEU A 60 -7.691 -8.890 1.750 1.00 0.35 H new ATOM 0 HD23 LEU A 60 -7.608 -10.610 1.302 1.00 0.35 H new ATOM 771 N TYR A 61 -5.574 -9.254 -2.938 1.00 0.14 N ATOM 772 CA TYR A 61 -5.831 -8.684 -4.235 1.00 0.15 C ATOM 773 C TYR A 61 -6.590 -9.666 -5.112 1.00 0.17 C ATOM 774 O TYR A 61 -7.613 -9.341 -5.657 1.00 0.22 O ATOM 775 CB TYR A 61 -4.534 -8.322 -4.923 1.00 0.17 C ATOM 776 CG TYR A 61 -4.787 -7.697 -6.259 1.00 0.18 C ATOM 777 CD1 TYR A 61 -5.857 -6.842 -6.430 1.00 0.16 C ATOM 778 CD2 TYR A 61 -3.958 -7.939 -7.331 1.00 0.28 C ATOM 779 CE1 TYR A 61 -6.094 -6.240 -7.643 1.00 0.18 C ATOM 780 CE2 TYR A 61 -4.185 -7.351 -8.554 1.00 0.31 C ATOM 781 CZ TYR A 61 -5.259 -6.497 -8.710 1.00 0.23 C ATOM 782 OH TYR A 61 -5.486 -5.891 -9.922 1.00 0.28 O ATOM 0 H TYR A 61 -4.591 -9.253 -2.665 1.00 0.14 H new ATOM 0 HA TYR A 61 -6.431 -7.786 -4.088 1.00 0.15 H new ATOM 0 HB2 TYR A 61 -3.967 -7.632 -4.297 1.00 0.17 H new ATOM 0 HB3 TYR A 61 -3.923 -9.216 -5.047 1.00 0.17 H new ATOM 0 HD1 TYR A 61 -6.517 -6.643 -5.599 1.00 0.16 H new ATOM 0 HD2 TYR A 61 -3.114 -8.602 -7.210 1.00 0.28 H new ATOM 0 HE1 TYR A 61 -6.931 -5.568 -7.760 1.00 0.18 H new ATOM 0 HE2 TYR A 61 -3.528 -7.556 -9.386 1.00 0.31 H new ATOM 0 HH TYR A 61 -4.805 -6.180 -10.565 1.00 0.28 H new ATOM 792 N ASN A 62 -6.100 -10.880 -5.195 1.00 0.18 N ATOM 793 CA ASN A 62 -6.608 -11.863 -6.137 1.00 0.22 C ATOM 794 C ASN A 62 -7.969 -12.364 -5.707 1.00 0.20 C ATOM 795 O ASN A 62 -8.766 -12.794 -6.538 1.00 0.24 O ATOM 796 CB ASN A 62 -5.635 -13.039 -6.291 1.00 0.27 C ATOM 797 CG ASN A 62 -4.417 -12.703 -7.140 1.00 0.75 C ATOM 798 OD1 ASN A 62 -3.885 -13.560 -7.843 1.00 1.21 O ATOM 799 ND2 ASN A 62 -3.962 -11.459 -7.080 1.00 1.12 N ATOM 0 H ASN A 62 -5.335 -11.220 -4.612 1.00 0.18 H new ATOM 0 HA ASN A 62 -6.706 -11.373 -7.106 1.00 0.22 H new ATOM 0 HB2 ASN A 62 -5.304 -13.360 -5.303 1.00 0.27 H new ATOM 0 HB3 ASN A 62 -6.161 -13.881 -6.740 1.00 0.27 H new ATOM 0 HD21 ASN A 62 -3.146 -11.188 -7.628 1.00 1.12 H new ATOM 0 HD22 ASN A 62 -4.428 -10.774 -6.486 1.00 1.12 H new ATOM 806 N LYS A 63 -8.251 -12.300 -4.411 1.00 0.18 N ATOM 807 CA LYS A 63 -9.512 -12.788 -3.917 1.00 0.20 C ATOM 808 C LYS A 63 -10.540 -11.687 -4.018 1.00 0.18 C ATOM 809 O LYS A 63 -11.740 -11.947 -4.097 1.00 0.22 O ATOM 810 CB LYS A 63 -9.375 -13.280 -2.468 1.00 0.26 C ATOM 811 CG LYS A 63 -10.672 -13.805 -1.860 1.00 0.29 C ATOM 812 CD LYS A 63 -10.413 -14.730 -0.675 1.00 0.64 C ATOM 813 CE LYS A 63 -9.780 -13.998 0.497 1.00 0.91 C ATOM 814 NZ LYS A 63 -9.577 -14.891 1.669 1.00 1.54 N ATOM 0 H LYS A 63 -7.627 -11.919 -3.700 1.00 0.18 H new ATOM 0 HA LYS A 63 -9.834 -13.636 -4.521 1.00 0.20 H new ATOM 0 HB2 LYS A 63 -8.625 -14.070 -2.434 1.00 0.26 H new ATOM 0 HB3 LYS A 63 -9.003 -12.461 -1.852 1.00 0.26 H new ATOM 0 HG2 LYS A 63 -11.287 -12.965 -1.537 1.00 0.29 H new ATOM 0 HG3 LYS A 63 -11.239 -14.341 -2.621 1.00 0.29 H new ATOM 0 HD2 LYS A 63 -11.353 -15.180 -0.355 1.00 0.64 H new ATOM 0 HD3 LYS A 63 -9.760 -15.545 -0.988 1.00 0.64 H new ATOM 0 HE2 LYS A 63 -8.821 -13.581 0.189 1.00 0.91 H new ATOM 0 HE3 LYS A 63 -10.414 -13.160 0.786 1.00 0.91 H new ATOM 0 HZ1 LYS A 63 -9.128 -14.356 2.439 1.00 1.54 H new ATOM 0 HZ2 LYS A 63 -10.496 -15.256 1.991 1.00 1.54 H new ATOM 0 HZ3 LYS A 63 -8.965 -15.687 1.397 1.00 1.54 H new ATOM 828 N TYR A 64 -10.074 -10.444 -4.047 1.00 0.16 N ATOM 829 CA TYR A 64 -10.998 -9.350 -3.914 1.00 0.16 C ATOM 830 C TYR A 64 -10.976 -8.341 -5.048 1.00 0.17 C ATOM 831 O TYR A 64 -11.840 -7.465 -5.100 1.00 0.17 O ATOM 832 CB TYR A 64 -10.828 -8.717 -2.551 1.00 0.15 C ATOM 833 CG TYR A 64 -11.324 -9.631 -1.462 1.00 0.17 C ATOM 834 CD1 TYR A 64 -12.606 -10.153 -1.533 1.00 0.19 C ATOM 835 CD2 TYR A 64 -10.529 -9.985 -0.382 1.00 0.19 C ATOM 836 CE1 TYR A 64 -13.090 -10.995 -0.567 1.00 0.23 C ATOM 837 CE2 TYR A 64 -11.008 -10.831 0.600 1.00 0.23 C ATOM 838 CZ TYR A 64 -12.291 -11.334 0.502 1.00 0.24 C ATOM 839 OH TYR A 64 -12.773 -12.194 1.465 1.00 0.31 O ATOM 0 H TYR A 64 -9.094 -10.184 -4.158 1.00 0.16 H new ATOM 0 HA TYR A 64 -12.001 -9.770 -3.994 1.00 0.16 H new ATOM 0 HB2 TYR A 64 -9.776 -8.484 -2.384 1.00 0.15 H new ATOM 0 HB3 TYR A 64 -11.373 -7.774 -2.514 1.00 0.15 H new ATOM 0 HD1 TYR A 64 -13.238 -9.890 -2.369 1.00 0.19 H new ATOM 0 HD2 TYR A 64 -9.525 -9.595 -0.308 1.00 0.19 H new ATOM 0 HE1 TYR A 64 -14.092 -11.391 -0.643 1.00 0.23 H new ATOM 0 HE2 TYR A 64 -10.383 -11.098 1.439 1.00 0.23 H new ATOM 0 HH TYR A 64 -12.360 -11.983 2.328 1.00 0.31 H new ATOM 849 N LYS A 65 -10.056 -8.481 -5.987 1.00 0.20 N ATOM 850 CA LYS A 65 -10.121 -7.683 -7.202 1.00 0.23 C ATOM 851 C LYS A 65 -11.367 -8.073 -7.950 1.00 0.20 C ATOM 852 O LYS A 65 -11.923 -7.289 -8.717 1.00 0.22 O ATOM 853 CB LYS A 65 -8.879 -7.845 -8.086 1.00 0.34 C ATOM 854 CG LYS A 65 -8.467 -9.278 -8.353 1.00 0.29 C ATOM 855 CD LYS A 65 -7.169 -9.336 -9.145 1.00 0.38 C ATOM 856 CE LYS A 65 -7.401 -9.519 -10.639 1.00 0.80 C ATOM 857 NZ LYS A 65 -8.035 -8.332 -11.279 1.00 1.35 N ATOM 0 H LYS A 65 -9.268 -9.127 -5.936 1.00 0.20 H new ATOM 0 HA LYS A 65 -10.152 -6.629 -6.926 1.00 0.23 H new ATOM 0 HB2 LYS A 65 -9.064 -7.352 -9.040 1.00 0.34 H new ATOM 0 HB3 LYS A 65 -8.045 -7.325 -7.614 1.00 0.34 H new ATOM 0 HG2 LYS A 65 -8.344 -9.806 -7.408 1.00 0.29 H new ATOM 0 HG3 LYS A 65 -9.256 -9.790 -8.904 1.00 0.29 H new ATOM 0 HD2 LYS A 65 -6.605 -8.418 -8.979 1.00 0.38 H new ATOM 0 HD3 LYS A 65 -6.557 -10.158 -8.773 1.00 0.38 H new ATOM 0 HE2 LYS A 65 -6.448 -9.722 -11.127 1.00 0.80 H new ATOM 0 HE3 LYS A 65 -8.033 -10.392 -10.799 1.00 0.80 H new ATOM 0 HZ1 LYS A 65 -7.954 -8.410 -12.313 1.00 1.35 H new ATOM 0 HZ2 LYS A 65 -9.039 -8.289 -11.013 1.00 1.35 H new ATOM 0 HZ3 LYS A 65 -7.555 -7.467 -10.959 1.00 1.35 H new ATOM 871 N SER A 66 -11.819 -9.287 -7.656 1.00 0.23 N ATOM 872 CA SER A 66 -13.107 -9.778 -8.141 1.00 0.26 C ATOM 873 C SER A 66 -14.211 -8.729 -7.921 1.00 0.25 C ATOM 874 O SER A 66 -15.068 -8.523 -8.784 1.00 0.31 O ATOM 875 CB SER A 66 -13.465 -11.081 -7.415 1.00 0.32 C ATOM 876 OG SER A 66 -14.750 -11.560 -7.780 1.00 1.28 O ATOM 0 H SER A 66 -11.308 -9.956 -7.079 1.00 0.23 H new ATOM 0 HA SER A 66 -13.029 -9.968 -9.211 1.00 0.26 H new ATOM 0 HB2 SER A 66 -12.717 -11.840 -7.644 1.00 0.32 H new ATOM 0 HB3 SER A 66 -13.433 -10.916 -6.338 1.00 0.32 H new ATOM 0 HG SER A 66 -14.939 -12.392 -7.297 1.00 1.28 H new ATOM 882 N GLN A 67 -14.179 -8.060 -6.769 1.00 0.21 N ATOM 883 CA GLN A 67 -15.141 -7.002 -6.482 1.00 0.20 C ATOM 884 C GLN A 67 -14.626 -5.637 -6.953 1.00 0.20 C ATOM 885 O GLN A 67 -15.404 -4.785 -7.381 1.00 0.27 O ATOM 886 CB GLN A 67 -15.448 -6.970 -4.984 1.00 0.21 C ATOM 887 CG GLN A 67 -16.124 -8.237 -4.489 1.00 0.38 C ATOM 888 CD GLN A 67 -16.349 -8.242 -2.990 1.00 0.52 C ATOM 889 OE1 GLN A 67 -17.369 -7.768 -2.498 1.00 1.11 O ATOM 890 NE2 GLN A 67 -15.401 -8.798 -2.256 1.00 0.46 N ATOM 0 H GLN A 67 -13.502 -8.232 -6.026 1.00 0.21 H new ATOM 0 HA GLN A 67 -16.058 -7.216 -7.031 1.00 0.20 H new ATOM 0 HB2 GLN A 67 -14.520 -6.820 -4.432 1.00 0.21 H new ATOM 0 HB3 GLN A 67 -16.089 -6.115 -4.768 1.00 0.21 H new ATOM 0 HG2 GLN A 67 -17.083 -8.352 -4.995 1.00 0.38 H new ATOM 0 HG3 GLN A 67 -15.514 -9.098 -4.762 1.00 0.38 H new ATOM 0 HE21 GLN A 67 -14.568 -9.181 -2.703 1.00 0.46 H new ATOM 0 HE22 GLN A 67 -15.502 -8.844 -1.242 1.00 0.46 H new ATOM 899 N GLY A 68 -13.315 -5.448 -6.901 1.00 0.17 N ATOM 900 CA GLY A 68 -12.722 -4.167 -7.228 1.00 0.18 C ATOM 901 C GLY A 68 -11.532 -3.867 -6.340 1.00 0.15 C ATOM 902 O GLY A 68 -10.825 -2.877 -6.541 1.00 0.17 O ATOM 0 H GLY A 68 -12.644 -6.169 -6.635 1.00 0.17 H new ATOM 0 HA2 GLY A 68 -12.409 -4.165 -8.272 1.00 0.18 H new ATOM 0 HA3 GLY A 68 -13.468 -3.380 -7.118 1.00 0.18 H new ATOM 906 N PHE A 69 -11.311 -4.741 -5.363 1.00 0.14 N ATOM 907 CA PHE A 69 -10.224 -4.585 -4.406 1.00 0.13 C ATOM 908 C PHE A 69 -8.881 -4.735 -5.088 1.00 0.14 C ATOM 909 O PHE A 69 -8.715 -5.558 -5.977 1.00 0.18 O ATOM 910 CB PHE A 69 -10.341 -5.624 -3.284 1.00 0.14 C ATOM 911 CG PHE A 69 -9.293 -5.471 -2.226 1.00 0.12 C ATOM 912 CD1 PHE A 69 -9.021 -4.250 -1.620 1.00 0.14 C ATOM 913 CD2 PHE A 69 -8.593 -6.570 -1.830 1.00 0.14 C ATOM 914 CE1 PHE A 69 -8.051 -4.156 -0.635 1.00 0.16 C ATOM 915 CE2 PHE A 69 -7.647 -6.496 -0.864 1.00 0.16 C ATOM 916 CZ PHE A 69 -7.356 -5.087 -0.290 1.00 0.14 C ATOM 0 H PHE A 69 -11.879 -5.575 -5.214 1.00 0.14 H new ATOM 0 HA PHE A 69 -10.297 -3.584 -3.980 1.00 0.13 H new ATOM 0 HB2 PHE A 69 -11.326 -5.544 -2.825 1.00 0.14 H new ATOM 0 HB3 PHE A 69 -10.271 -6.623 -3.714 1.00 0.14 H new ATOM 0 HD1 PHE A 69 -9.569 -3.369 -1.919 1.00 0.14 H new ATOM 0 HD2 PHE A 69 -8.797 -7.522 -2.297 1.00 0.14 H new ATOM 0 HE1 PHE A 69 -7.907 -3.202 -0.149 1.00 0.16 H new ATOM 0 HE2 PHE A 69 -7.123 -7.373 -0.512 1.00 0.16 H new ATOM 0 HZ PHE A 69 -6.545 -4.936 0.408 1.00 0.14 H new ATOM 926 N THR A 70 -7.924 -3.930 -4.682 1.00 0.13 N ATOM 927 CA THR A 70 -6.592 -4.058 -5.164 1.00 0.12 C ATOM 928 C THR A 70 -5.680 -4.015 -4.002 1.00 0.12 C ATOM 929 O THR A 70 -6.011 -3.478 -2.964 1.00 0.19 O ATOM 930 CB THR A 70 -6.217 -2.921 -6.117 1.00 0.15 C ATOM 931 OG1 THR A 70 -5.066 -3.271 -6.880 1.00 0.20 O ATOM 932 CG2 THR A 70 -5.944 -1.634 -5.361 1.00 0.19 C ATOM 0 H THR A 70 -8.060 -3.175 -4.010 1.00 0.13 H new ATOM 0 HA THR A 70 -6.511 -4.997 -5.711 1.00 0.12 H new ATOM 0 HB THR A 70 -7.064 -2.761 -6.784 1.00 0.15 H new ATOM 0 HG1 THR A 70 -5.167 -4.182 -7.225 1.00 0.20 H new ATOM 0 HG21 THR A 70 -5.680 -0.846 -6.067 1.00 0.19 H new ATOM 0 HG22 THR A 70 -6.836 -1.341 -4.807 1.00 0.19 H new ATOM 0 HG23 THR A 70 -5.119 -1.789 -4.665 1.00 0.19 H new ATOM 940 N VAL A 71 -4.570 -4.625 -4.149 1.00 0.13 N ATOM 941 CA VAL A 71 -3.479 -4.289 -3.330 1.00 0.13 C ATOM 942 C VAL A 71 -2.438 -3.637 -4.201 1.00 0.13 C ATOM 943 O VAL A 71 -1.710 -4.315 -4.915 1.00 0.15 O ATOM 944 CB VAL A 71 -2.898 -5.522 -2.649 1.00 0.15 C ATOM 945 CG1 VAL A 71 -1.540 -5.202 -2.062 1.00 0.16 C ATOM 946 CG2 VAL A 71 -3.839 -6.023 -1.571 1.00 0.17 C ATOM 0 H VAL A 71 -4.394 -5.362 -4.832 1.00 0.13 H new ATOM 0 HA VAL A 71 -3.806 -3.610 -2.542 1.00 0.13 H new ATOM 0 HB VAL A 71 -2.778 -6.310 -3.393 1.00 0.15 H new ATOM 0 HG11 VAL A 71 -1.134 -6.090 -1.578 1.00 0.16 H new ATOM 0 HG12 VAL A 71 -0.866 -4.882 -2.857 1.00 0.16 H new ATOM 0 HG13 VAL A 71 -1.640 -4.403 -1.328 1.00 0.16 H new ATOM 0 HG21 VAL A 71 -3.410 -6.904 -1.094 1.00 0.17 H new ATOM 0 HG22 VAL A 71 -3.986 -5.242 -0.825 1.00 0.17 H new ATOM 0 HG23 VAL A 71 -4.798 -6.284 -2.018 1.00 0.17 H new ATOM 956 N LEU A 72 -2.379 -2.326 -4.180 1.00 0.17 N ATOM 957 CA LEU A 72 -1.309 -1.676 -4.909 1.00 0.22 C ATOM 958 C LEU A 72 -0.188 -1.459 -3.937 1.00 0.19 C ATOM 959 O LEU A 72 -0.371 -0.806 -2.921 1.00 0.28 O ATOM 960 CB LEU A 72 -1.661 -0.319 -5.538 1.00 0.43 C ATOM 961 CG LEU A 72 -3.115 -0.016 -5.824 1.00 0.34 C ATOM 962 CD1 LEU A 72 -3.460 1.392 -5.373 1.00 1.04 C ATOM 963 CD2 LEU A 72 -3.363 -0.157 -7.297 1.00 1.00 C ATOM 0 H LEU A 72 -3.027 -1.709 -3.690 1.00 0.17 H new ATOM 0 HA LEU A 72 -1.061 -2.329 -5.746 1.00 0.22 H new ATOM 0 HB2 LEU A 72 -1.283 0.461 -4.878 1.00 0.43 H new ATOM 0 HB3 LEU A 72 -1.113 -0.236 -6.477 1.00 0.43 H new ATOM 0 HG LEU A 72 -3.744 -0.717 -5.275 1.00 0.34 H new ATOM 0 HD11 LEU A 72 -4.510 1.595 -5.586 1.00 1.04 H new ATOM 0 HD12 LEU A 72 -3.282 1.485 -4.302 1.00 1.04 H new ATOM 0 HD13 LEU A 72 -2.836 2.108 -5.908 1.00 1.04 H new ATOM 0 HD21 LEU A 72 -4.409 0.060 -7.512 1.00 1.00 H new ATOM 0 HD22 LEU A 72 -2.728 0.542 -7.841 1.00 1.00 H new ATOM 0 HD23 LEU A 72 -3.132 -1.175 -7.609 1.00 1.00 H new ATOM 975 N ALA A 73 0.956 -2.003 -4.225 1.00 0.22 N ATOM 976 CA ALA A 73 2.063 -1.854 -3.328 1.00 0.30 C ATOM 977 C ALA A 73 3.112 -0.911 -3.898 1.00 0.23 C ATOM 978 O ALA A 73 3.640 -1.109 -4.989 1.00 0.32 O ATOM 979 CB ALA A 73 2.644 -3.206 -2.976 1.00 0.51 C ATOM 0 H ALA A 73 1.147 -2.549 -5.065 1.00 0.22 H new ATOM 0 HA ALA A 73 1.702 -1.400 -2.405 1.00 0.30 H new ATOM 0 HB1 ALA A 73 3.484 -3.075 -2.294 1.00 0.51 H new ATOM 0 HB2 ALA A 73 1.879 -3.817 -2.496 1.00 0.51 H new ATOM 0 HB3 ALA A 73 2.988 -3.702 -3.884 1.00 0.51 H new ATOM 985 N PHE A 74 3.364 0.138 -3.147 1.00 0.29 N ATOM 986 CA PHE A 74 4.346 1.142 -3.476 1.00 0.33 C ATOM 987 C PHE A 74 5.652 0.812 -2.762 1.00 0.35 C ATOM 988 O PHE A 74 5.799 1.067 -1.568 1.00 0.37 O ATOM 989 CB PHE A 74 3.814 2.515 -3.056 1.00 0.44 C ATOM 990 CG PHE A 74 2.694 3.026 -3.930 1.00 0.36 C ATOM 991 CD1 PHE A 74 1.787 2.162 -4.546 1.00 0.43 C ATOM 992 CD2 PHE A 74 2.569 4.382 -4.163 1.00 0.41 C ATOM 993 CE1 PHE A 74 0.796 2.649 -5.364 1.00 0.41 C ATOM 994 CE2 PHE A 74 1.573 4.875 -4.989 1.00 0.43 C ATOM 995 CZ PHE A 74 0.687 3.999 -5.591 1.00 0.35 C ATOM 0 H PHE A 74 2.878 0.319 -2.269 1.00 0.29 H new ATOM 0 HA PHE A 74 4.536 1.159 -4.549 1.00 0.33 H new ATOM 0 HB2 PHE A 74 3.462 2.459 -2.026 1.00 0.44 H new ATOM 0 HB3 PHE A 74 4.634 3.233 -3.074 1.00 0.44 H new ATOM 0 HD1 PHE A 74 1.865 1.098 -4.378 1.00 0.43 H new ATOM 0 HD2 PHE A 74 3.259 5.068 -3.694 1.00 0.41 H new ATOM 0 HE1 PHE A 74 0.100 1.967 -5.830 1.00 0.41 H new ATOM 0 HE2 PHE A 74 1.488 5.938 -5.162 1.00 0.43 H new ATOM 0 HZ PHE A 74 -0.090 4.377 -6.239 1.00 0.35 H new ATOM 1005 N PRO A 75 6.616 0.228 -3.488 1.00 0.37 N ATOM 1006 CA PRO A 75 7.794 -0.386 -2.888 1.00 0.46 C ATOM 1007 C PRO A 75 8.882 0.607 -2.548 1.00 0.61 C ATOM 1008 O PRO A 75 9.919 0.631 -3.186 1.00 1.30 O ATOM 1009 CB PRO A 75 8.247 -1.365 -3.960 1.00 0.54 C ATOM 1010 CG PRO A 75 7.832 -0.749 -5.249 1.00 0.44 C ATOM 1011 CD PRO A 75 6.644 0.140 -4.955 1.00 0.38 C ATOM 0 HA PRO A 75 7.569 -0.853 -1.929 1.00 0.46 H new ATOM 0 HB2 PRO A 75 9.326 -1.516 -3.925 1.00 0.54 H new ATOM 0 HB3 PRO A 75 7.783 -2.342 -3.823 1.00 0.54 H new ATOM 0 HG2 PRO A 75 8.649 -0.170 -5.680 1.00 0.44 H new ATOM 0 HG3 PRO A 75 7.568 -1.517 -5.976 1.00 0.44 H new ATOM 0 HD2 PRO A 75 6.759 1.123 -5.411 1.00 0.38 H new ATOM 0 HD3 PRO A 75 5.720 -0.287 -5.346 1.00 0.38 H new ATOM 1019 N SER A 76 8.614 1.333 -1.473 1.00 0.41 N ATOM 1020 CA SER A 76 9.433 2.418 -0.916 1.00 0.37 C ATOM 1021 C SER A 76 10.711 2.758 -1.649 1.00 0.50 C ATOM 1022 O SER A 76 11.582 1.919 -1.906 1.00 0.74 O ATOM 1023 CB SER A 76 9.727 2.106 0.555 1.00 0.53 C ATOM 1024 OG SER A 76 10.311 0.818 0.685 1.00 1.44 O ATOM 0 H SER A 76 7.767 1.176 -0.926 1.00 0.41 H new ATOM 0 HA SER A 76 8.831 3.319 -1.037 1.00 0.37 H new ATOM 0 HB2 SER A 76 10.400 2.859 0.965 1.00 0.53 H new ATOM 0 HB3 SER A 76 8.805 2.153 1.134 1.00 0.53 H new ATOM 0 HG SER A 76 9.640 0.133 0.483 1.00 1.44 H new ATOM 1030 N ASN A 77 10.811 4.045 -1.917 1.00 0.52 N ATOM 1031 CA ASN A 77 11.962 4.624 -2.558 1.00 0.72 C ATOM 1032 C ASN A 77 13.142 4.578 -1.597 1.00 0.70 C ATOM 1033 O ASN A 77 13.533 5.589 -1.014 1.00 0.75 O ATOM 1034 CB ASN A 77 11.640 6.060 -2.979 1.00 0.93 C ATOM 1035 CG ASN A 77 12.683 6.665 -3.896 1.00 0.96 C ATOM 1036 OD1 ASN A 77 12.648 6.457 -5.108 1.00 1.81 O ATOM 1037 ND2 ASN A 77 13.597 7.437 -3.336 1.00 1.46 N ATOM 0 H ASN A 77 10.082 4.722 -1.690 1.00 0.52 H new ATOM 0 HA ASN A 77 12.224 4.060 -3.453 1.00 0.72 H new ATOM 0 HB2 ASN A 77 10.672 6.076 -3.481 1.00 0.93 H new ATOM 0 HB3 ASN A 77 11.547 6.680 -2.087 1.00 0.93 H new ATOM 0 HD21 ASN A 77 14.308 7.886 -3.913 1.00 1.46 H new ATOM 0 HD22 ASN A 77 13.591 7.584 -2.327 1.00 1.46 H new ATOM 1044 N GLN A 78 13.688 3.367 -1.443 1.00 0.85 N ATOM 1045 CA GLN A 78 14.859 3.078 -0.608 1.00 0.98 C ATOM 1046 C GLN A 78 16.012 4.021 -0.904 1.00 0.98 C ATOM 1047 O GLN A 78 16.993 4.074 -0.169 1.00 1.12 O ATOM 1048 CB GLN A 78 15.296 1.619 -0.803 1.00 1.35 C ATOM 1049 CG GLN A 78 15.415 1.186 -2.264 1.00 2.07 C ATOM 1050 CD GLN A 78 16.829 1.268 -2.819 1.00 2.74 C ATOM 1051 OE1 GLN A 78 17.635 2.100 -2.408 1.00 3.34 O ATOM 1052 NE2 GLN A 78 17.141 0.397 -3.766 1.00 3.30 N ATOM 0 H GLN A 78 13.318 2.538 -1.908 1.00 0.85 H new ATOM 0 HA GLN A 78 14.572 3.232 0.432 1.00 0.98 H new ATOM 0 HB2 GLN A 78 16.259 1.472 -0.314 1.00 1.35 H new ATOM 0 HB3 GLN A 78 14.581 0.968 -0.301 1.00 1.35 H new ATOM 0 HG2 GLN A 78 15.057 0.161 -2.359 1.00 2.07 H new ATOM 0 HG3 GLN A 78 14.760 1.810 -2.872 1.00 2.07 H new ATOM 0 HE21 GLN A 78 16.448 -0.280 -4.084 1.00 3.30 H new ATOM 0 HE22 GLN A 78 18.074 0.403 -4.177 1.00 3.30 H new ATOM 1061 N PHE A 79 15.864 4.754 -1.991 1.00 0.98 N ATOM 1062 CA PHE A 79 16.910 5.624 -2.527 1.00 1.19 C ATOM 1063 C PHE A 79 17.202 6.836 -1.629 1.00 1.20 C ATOM 1064 O PHE A 79 17.609 7.895 -2.111 1.00 1.54 O ATOM 1065 CB PHE A 79 16.487 6.097 -3.909 1.00 1.32 C ATOM 1066 CG PHE A 79 16.375 4.982 -4.913 1.00 1.57 C ATOM 1067 CD1 PHE A 79 17.494 4.531 -5.594 1.00 1.82 C ATOM 1068 CD2 PHE A 79 15.152 4.384 -5.172 1.00 2.02 C ATOM 1069 CE1 PHE A 79 17.394 3.506 -6.515 1.00 2.25 C ATOM 1070 CE2 PHE A 79 15.047 3.359 -6.092 1.00 2.64 C ATOM 1071 CZ PHE A 79 16.171 2.920 -6.764 1.00 2.68 C ATOM 0 H PHE A 79 15.004 4.767 -2.539 1.00 0.98 H new ATOM 0 HA PHE A 79 17.832 5.045 -2.575 1.00 1.19 H new ATOM 0 HB2 PHE A 79 15.526 6.605 -3.833 1.00 1.32 H new ATOM 0 HB3 PHE A 79 17.208 6.831 -4.270 1.00 1.32 H new ATOM 0 HD1 PHE A 79 18.455 4.986 -5.403 1.00 1.82 H new ATOM 0 HD2 PHE A 79 14.271 4.723 -4.648 1.00 2.02 H new ATOM 0 HE1 PHE A 79 18.274 3.164 -7.040 1.00 2.25 H new ATOM 0 HE2 PHE A 79 14.088 2.902 -6.285 1.00 2.64 H new ATOM 0 HZ PHE A 79 16.092 2.119 -7.484 1.00 2.68 H new ATOM 1081 N GLY A 80 17.007 6.672 -0.332 1.00 1.10 N ATOM 1082 CA GLY A 80 17.309 7.715 0.621 1.00 1.22 C ATOM 1083 C GLY A 80 17.843 7.131 1.911 1.00 1.24 C ATOM 1084 O GLY A 80 18.668 6.216 1.888 1.00 1.98 O ATOM 0 H GLY A 80 16.637 5.817 0.084 1.00 1.10 H new ATOM 0 HA2 GLY A 80 18.043 8.400 0.196 1.00 1.22 H new ATOM 0 HA3 GLY A 80 16.411 8.297 0.825 1.00 1.22 H new ATOM 1088 N GLY A 81 17.368 7.638 3.034 1.00 1.18 N ATOM 1089 CA GLY A 81 17.783 7.109 4.316 1.00 1.21 C ATOM 1090 C GLY A 81 16.726 7.315 5.375 1.00 1.14 C ATOM 1091 O GLY A 81 17.039 7.551 6.538 1.00 1.49 O ATOM 0 H GLY A 81 16.701 8.408 3.083 1.00 1.18 H new ATOM 0 HA2 GLY A 81 17.997 6.045 4.218 1.00 1.21 H new ATOM 0 HA3 GLY A 81 18.709 7.593 4.627 1.00 1.21 H new ATOM 1095 N GLN A 82 15.474 7.238 4.966 1.00 0.86 N ATOM 1096 CA GLN A 82 14.357 7.463 5.869 1.00 0.82 C ATOM 1097 C GLN A 82 13.352 6.323 5.786 1.00 0.77 C ATOM 1098 O GLN A 82 12.467 6.220 6.625 1.00 0.91 O ATOM 1099 CB GLN A 82 13.658 8.806 5.561 1.00 0.80 C ATOM 1100 CG GLN A 82 13.044 8.918 4.159 1.00 0.75 C ATOM 1101 CD GLN A 82 14.080 8.885 3.049 1.00 1.09 C ATOM 1102 OE1 GLN A 82 15.176 9.430 3.181 1.00 1.74 O ATOM 1103 NE2 GLN A 82 13.774 8.184 1.979 1.00 1.14 N ATOM 0 H GLN A 82 15.202 7.020 4.007 1.00 0.86 H new ATOM 0 HA GLN A 82 14.756 7.503 6.883 1.00 0.82 H new ATOM 0 HB2 GLN A 82 12.871 8.965 6.298 1.00 0.80 H new ATOM 0 HB3 GLN A 82 14.382 9.611 5.688 1.00 0.80 H new ATOM 0 HG2 GLN A 82 12.337 8.101 4.012 1.00 0.75 H new ATOM 0 HG3 GLN A 82 12.477 9.846 4.091 1.00 0.75 H new ATOM 0 HE21 GLN A 82 12.856 7.745 1.902 1.00 1.14 H new ATOM 0 HE22 GLN A 82 14.454 8.079 1.226 1.00 1.14 H new ATOM 1112 N GLU A 83 13.537 5.442 4.807 1.00 0.75 N ATOM 1113 CA GLU A 83 12.526 4.446 4.463 1.00 0.74 C ATOM 1114 C GLU A 83 12.238 3.480 5.620 1.00 0.72 C ATOM 1115 O GLU A 83 13.147 3.075 6.347 1.00 0.88 O ATOM 1116 CB GLU A 83 12.949 3.660 3.213 1.00 0.87 C ATOM 1117 CG GLU A 83 13.033 4.496 1.937 1.00 1.16 C ATOM 1118 CD GLU A 83 11.831 5.400 1.742 1.00 2.33 C ATOM 1119 OE1 GLU A 83 11.763 6.461 2.397 1.00 2.83 O ATOM 1120 OE2 GLU A 83 10.939 5.032 0.948 1.00 3.07 O ATOM 0 H GLU A 83 14.381 5.397 4.236 1.00 0.75 H new ATOM 0 HA GLU A 83 11.604 4.989 4.255 1.00 0.74 H new ATOM 0 HB2 GLU A 83 13.922 3.204 3.398 1.00 0.87 H new ATOM 0 HB3 GLU A 83 12.241 2.847 3.054 1.00 0.87 H new ATOM 0 HG2 GLU A 83 13.937 5.104 1.966 1.00 1.16 H new ATOM 0 HG3 GLU A 83 13.124 3.831 1.078 1.00 1.16 H new ATOM 1127 N PRO A 84 10.945 3.109 5.759 1.00 0.63 N ATOM 1128 CA PRO A 84 10.382 2.222 6.780 1.00 0.75 C ATOM 1129 C PRO A 84 11.367 1.302 7.506 1.00 1.00 C ATOM 1130 O PRO A 84 11.850 1.615 8.592 1.00 1.75 O ATOM 1131 CB PRO A 84 9.451 1.393 5.915 1.00 1.02 C ATOM 1132 CG PRO A 84 8.941 2.330 4.873 1.00 0.72 C ATOM 1133 CD PRO A 84 9.863 3.525 4.860 1.00 0.61 C ATOM 0 HA PRO A 84 9.950 2.787 7.606 1.00 0.75 H new ATOM 0 HB2 PRO A 84 9.978 0.552 5.464 1.00 1.02 H new ATOM 0 HB3 PRO A 84 8.633 0.977 6.504 1.00 1.02 H new ATOM 0 HG2 PRO A 84 8.923 1.847 3.896 1.00 0.72 H new ATOM 0 HG3 PRO A 84 7.919 2.635 5.096 1.00 0.72 H new ATOM 0 HD2 PRO A 84 10.231 3.741 3.857 1.00 0.61 H new ATOM 0 HD3 PRO A 84 9.363 4.425 5.217 1.00 0.61 H new ATOM 1141 N GLY A 85 11.636 0.151 6.913 1.00 1.45 N ATOM 1142 CA GLY A 85 12.538 -0.809 7.516 1.00 1.82 C ATOM 1143 C GLY A 85 13.494 -1.338 6.488 1.00 1.61 C ATOM 1144 O GLY A 85 13.905 -2.498 6.525 1.00 2.20 O ATOM 0 H GLY A 85 11.243 -0.139 6.017 1.00 1.45 H new ATOM 0 HA2 GLY A 85 13.091 -0.339 8.329 1.00 1.82 H new ATOM 0 HA3 GLY A 85 11.969 -1.631 7.951 1.00 1.82 H new ATOM 1148 N ASN A 86 13.827 -0.472 5.555 1.00 1.49 N ATOM 1149 CA ASN A 86 14.634 -0.840 4.414 1.00 2.04 C ATOM 1150 C ASN A 86 15.454 0.353 3.949 1.00 1.94 C ATOM 1151 O ASN A 86 15.741 0.512 2.763 1.00 2.70 O ATOM 1152 CB ASN A 86 13.736 -1.361 3.293 1.00 2.78 C ATOM 1153 CG ASN A 86 12.562 -0.443 3.006 1.00 3.58 C ATOM 1154 OD1 ASN A 86 11.513 -0.547 3.641 1.00 4.07 O ATOM 1155 ND2 ASN A 86 12.727 0.453 2.050 1.00 4.20 N ATOM 0 H ASN A 86 13.545 0.508 5.567 1.00 1.49 H new ATOM 0 HA ASN A 86 15.324 -1.634 4.698 1.00 2.04 H new ATOM 0 HB2 ASN A 86 14.328 -1.481 2.386 1.00 2.78 H new ATOM 0 HB3 ASN A 86 13.362 -2.349 3.563 1.00 2.78 H new ATOM 0 HD21 ASN A 86 11.968 1.092 1.814 1.00 4.20 H new ATOM 0 HD22 ASN A 86 13.613 0.506 1.548 1.00 4.20 H new ATOM 1162 N GLU A 87 15.848 1.173 4.912 1.00 1.52 N ATOM 1163 CA GLU A 87 16.660 2.353 4.658 1.00 1.46 C ATOM 1164 C GLU A 87 18.132 1.958 4.565 1.00 1.60 C ATOM 1165 O GLU A 87 19.025 2.807 4.565 1.00 2.15 O ATOM 1166 CB GLU A 87 16.462 3.406 5.764 1.00 1.61 C ATOM 1167 CG GLU A 87 17.027 3.010 7.127 1.00 2.19 C ATOM 1168 CD GLU A 87 16.128 2.074 7.917 1.00 2.58 C ATOM 1169 OE1 GLU A 87 15.969 0.904 7.513 1.00 3.02 O ATOM 1170 OE2 GLU A 87 15.603 2.500 8.970 1.00 2.84 O ATOM 0 H GLU A 87 15.612 1.038 5.895 1.00 1.52 H new ATOM 0 HA GLU A 87 16.345 2.792 3.712 1.00 1.46 H new ATOM 0 HB2 GLU A 87 16.930 4.338 5.448 1.00 1.61 H new ATOM 0 HB3 GLU A 87 15.396 3.605 5.871 1.00 1.61 H new ATOM 0 HG2 GLU A 87 17.996 2.532 6.983 1.00 2.19 H new ATOM 0 HG3 GLU A 87 17.201 3.912 7.713 1.00 2.19 H new ATOM 1177 N GLU A 88 18.361 0.655 4.487 1.00 1.57 N ATOM 1178 CA GLU A 88 19.694 0.092 4.372 1.00 1.77 C ATOM 1179 C GLU A 88 19.599 -1.315 3.791 1.00 1.62 C ATOM 1180 O GLU A 88 20.363 -1.689 2.897 1.00 1.62 O ATOM 1181 CB GLU A 88 20.346 0.043 5.751 1.00 2.18 C ATOM 1182 CG GLU A 88 21.752 -0.524 5.757 1.00 2.68 C ATOM 1183 CD GLU A 88 22.243 -0.803 7.160 1.00 3.33 C ATOM 1184 OE1 GLU A 88 22.633 0.151 7.865 1.00 3.66 O ATOM 1185 OE2 GLU A 88 22.222 -1.980 7.573 1.00 3.92 O ATOM 0 H GLU A 88 17.619 -0.045 4.502 1.00 1.57 H new ATOM 0 HA GLU A 88 20.300 0.713 3.713 1.00 1.77 H new ATOM 0 HB2 GLU A 88 20.372 1.052 6.164 1.00 2.18 H new ATOM 0 HB3 GLU A 88 19.722 -0.557 6.414 1.00 2.18 H new ATOM 0 HG2 GLU A 88 21.774 -1.445 5.175 1.00 2.68 H new ATOM 0 HG3 GLU A 88 22.428 0.178 5.269 1.00 2.68 H new ATOM 1192 N GLU A 89 18.613 -2.064 4.293 1.00 1.62 N ATOM 1193 CA GLU A 89 18.381 -3.456 3.911 1.00 1.59 C ATOM 1194 C GLU A 89 18.372 -3.635 2.398 1.00 1.49 C ATOM 1195 O GLU A 89 19.196 -4.347 1.845 1.00 1.59 O ATOM 1196 CB GLU A 89 17.036 -3.912 4.489 1.00 1.70 C ATOM 1197 CG GLU A 89 16.686 -5.367 4.214 1.00 1.75 C ATOM 1198 CD GLU A 89 17.651 -6.333 4.865 1.00 2.11 C ATOM 1199 OE1 GLU A 89 17.624 -6.456 6.103 1.00 2.65 O ATOM 1200 OE2 GLU A 89 18.417 -6.990 4.135 1.00 2.45 O ATOM 0 H GLU A 89 17.948 -1.715 4.983 1.00 1.62 H new ATOM 0 HA GLU A 89 19.196 -4.060 4.310 1.00 1.59 H new ATOM 0 HB2 GLU A 89 17.047 -3.753 5.567 1.00 1.70 H new ATOM 0 HB3 GLU A 89 16.248 -3.280 4.081 1.00 1.70 H new ATOM 0 HG2 GLU A 89 15.678 -5.568 4.575 1.00 1.75 H new ATOM 0 HG3 GLU A 89 16.679 -5.537 3.137 1.00 1.75 H new ATOM 1207 N ILE A 90 17.464 -2.966 1.721 1.00 1.43 N ATOM 1208 CA ILE A 90 17.318 -3.162 0.289 1.00 1.39 C ATOM 1209 C ILE A 90 18.050 -2.085 -0.498 1.00 1.49 C ATOM 1210 O ILE A 90 17.725 -1.815 -1.652 1.00 1.57 O ATOM 1211 CB ILE A 90 15.841 -3.195 -0.114 1.00 1.45 C ATOM 1212 CG1 ILE A 90 15.140 -1.906 0.314 1.00 1.74 C ATOM 1213 CG2 ILE A 90 15.176 -4.405 0.524 1.00 1.76 C ATOM 1214 CD1 ILE A 90 13.808 -1.686 -0.370 1.00 2.15 C ATOM 0 H ILE A 90 16.821 -2.288 2.130 1.00 1.43 H new ATOM 0 HA ILE A 90 17.767 -4.125 0.048 1.00 1.39 H new ATOM 0 HB ILE A 90 15.764 -3.273 -1.198 1.00 1.45 H new ATOM 0 HG12 ILE A 90 14.986 -1.927 1.393 1.00 1.74 H new ATOM 0 HG13 ILE A 90 15.793 -1.059 0.101 1.00 1.74 H new ATOM 0 HG21 ILE A 90 14.124 -4.434 0.240 1.00 1.76 H new ATOM 0 HG22 ILE A 90 15.669 -5.314 0.181 1.00 1.76 H new ATOM 0 HG23 ILE A 90 15.258 -4.335 1.609 1.00 1.76 H new ATOM 0 HD11 ILE A 90 13.368 -0.753 -0.018 1.00 2.15 H new ATOM 0 HD12 ILE A 90 13.957 -1.633 -1.448 1.00 2.15 H new ATOM 0 HD13 ILE A 90 13.138 -2.514 -0.137 1.00 2.15 H new ATOM 1226 N LYS A 91 19.040 -1.480 0.135 1.00 1.71 N ATOM 1227 CA LYS A 91 19.856 -0.466 -0.514 1.00 1.89 C ATOM 1228 C LYS A 91 21.191 -1.044 -0.953 1.00 1.98 C ATOM 1229 O LYS A 91 21.643 -0.815 -2.074 1.00 2.17 O ATOM 1230 CB LYS A 91 20.099 0.707 0.427 1.00 2.00 C ATOM 1231 CG LYS A 91 18.917 1.647 0.552 1.00 2.10 C ATOM 1232 CD LYS A 91 19.177 2.729 1.582 1.00 2.33 C ATOM 1233 CE LYS A 91 20.516 3.406 1.366 1.00 2.39 C ATOM 1234 NZ LYS A 91 20.766 4.468 2.373 1.00 2.79 N ATOM 0 H LYS A 91 19.300 -1.674 1.102 1.00 1.71 H new ATOM 0 HA LYS A 91 19.315 -0.117 -1.393 1.00 1.89 H new ATOM 0 HB2 LYS A 91 20.351 0.322 1.415 1.00 2.00 H new ATOM 0 HB3 LYS A 91 20.963 1.270 0.075 1.00 2.00 H new ATOM 0 HG2 LYS A 91 18.711 2.105 -0.415 1.00 2.10 H new ATOM 0 HG3 LYS A 91 18.028 1.081 0.833 1.00 2.10 H new ATOM 0 HD2 LYS A 91 18.382 3.473 1.535 1.00 2.33 H new ATOM 0 HD3 LYS A 91 19.147 2.294 2.581 1.00 2.33 H new ATOM 0 HE2 LYS A 91 21.311 2.663 1.417 1.00 2.39 H new ATOM 0 HE3 LYS A 91 20.547 3.839 0.366 1.00 2.39 H new ATOM 0 HZ1 LYS A 91 21.742 4.814 2.278 1.00 2.79 H new ATOM 0 HZ2 LYS A 91 20.103 5.255 2.220 1.00 2.79 H new ATOM 0 HZ3 LYS A 91 20.628 4.080 3.328 1.00 2.79 H new ATOM 1248 N GLU A 92 21.822 -1.786 -0.055 1.00 2.07 N ATOM 1249 CA GLU A 92 23.135 -2.344 -0.327 1.00 2.27 C ATOM 1250 C GLU A 92 23.138 -3.860 -0.197 1.00 2.10 C ATOM 1251 O GLU A 92 24.178 -4.501 -0.352 1.00 2.26 O ATOM 1252 CB GLU A 92 24.169 -1.714 0.604 1.00 2.54 C ATOM 1253 CG GLU A 92 23.737 -1.673 2.058 1.00 2.47 C ATOM 1254 CD GLU A 92 24.566 -0.702 2.866 1.00 2.96 C ATOM 1255 OE1 GLU A 92 24.231 0.501 2.873 1.00 3.20 O ATOM 1256 OE2 GLU A 92 25.563 -1.130 3.479 1.00 3.29 O ATOM 0 H GLU A 92 21.446 -2.014 0.865 1.00 2.07 H new ATOM 0 HA GLU A 92 23.398 -2.111 -1.359 1.00 2.27 H new ATOM 0 HB2 GLU A 92 25.102 -2.272 0.527 1.00 2.54 H new ATOM 0 HB3 GLU A 92 24.377 -0.698 0.267 1.00 2.54 H new ATOM 0 HG2 GLU A 92 22.686 -1.389 2.116 1.00 2.47 H new ATOM 0 HG3 GLU A 92 23.822 -2.670 2.490 1.00 2.47 H new ATOM 1263 N PHE A 93 21.976 -4.431 0.084 1.00 1.86 N ATOM 1264 CA PHE A 93 21.832 -5.878 0.091 1.00 1.75 C ATOM 1265 C PHE A 93 21.011 -6.297 -1.117 1.00 1.59 C ATOM 1266 O PHE A 93 20.431 -5.451 -1.799 1.00 1.69 O ATOM 1267 CB PHE A 93 21.172 -6.378 1.381 1.00 1.73 C ATOM 1268 CG PHE A 93 21.961 -6.094 2.632 1.00 2.09 C ATOM 1269 CD1 PHE A 93 21.814 -4.890 3.300 1.00 2.65 C ATOM 1270 CD2 PHE A 93 22.855 -7.027 3.133 1.00 2.34 C ATOM 1271 CE1 PHE A 93 22.542 -4.621 4.443 1.00 3.40 C ATOM 1272 CE2 PHE A 93 23.585 -6.764 4.275 1.00 2.87 C ATOM 1273 CZ PHE A 93 23.404 -5.581 4.951 1.00 3.42 C ATOM 0 H PHE A 93 21.124 -3.917 0.309 1.00 1.86 H new ATOM 0 HA PHE A 93 22.825 -6.326 0.043 1.00 1.75 H new ATOM 0 HB2 PHE A 93 20.188 -5.918 1.474 1.00 1.73 H new ATOM 0 HB3 PHE A 93 21.015 -7.454 1.301 1.00 1.73 H new ATOM 0 HD1 PHE A 93 21.122 -4.152 2.923 1.00 2.65 H new ATOM 0 HD2 PHE A 93 22.982 -7.971 2.624 1.00 2.34 H new ATOM 0 HE1 PHE A 93 22.440 -3.667 4.939 1.00 3.40 H new ATOM 0 HE2 PHE A 93 24.299 -7.489 4.638 1.00 2.87 H new ATOM 0 HZ PHE A 93 23.932 -5.400 5.876 1.00 3.42 H new ATOM 1283 N VAL A 94 20.975 -7.592 -1.384 1.00 1.62 N ATOM 1284 CA VAL A 94 20.255 -8.112 -2.536 1.00 1.68 C ATOM 1285 C VAL A 94 18.756 -7.877 -2.394 1.00 1.54 C ATOM 1286 O VAL A 94 18.151 -8.254 -1.391 1.00 1.74 O ATOM 1287 CB VAL A 94 20.524 -9.620 -2.739 1.00 2.11 C ATOM 1288 CG1 VAL A 94 19.788 -10.141 -3.963 1.00 2.63 C ATOM 1289 CG2 VAL A 94 22.017 -9.889 -2.857 1.00 2.56 C ATOM 0 H VAL A 94 21.437 -8.304 -0.818 1.00 1.62 H new ATOM 0 HA VAL A 94 20.620 -7.573 -3.411 1.00 1.68 H new ATOM 0 HB VAL A 94 20.148 -10.151 -1.865 1.00 2.11 H new ATOM 0 HG11 VAL A 94 19.993 -11.205 -4.085 1.00 2.63 H new ATOM 0 HG12 VAL A 94 18.716 -9.990 -3.835 1.00 2.63 H new ATOM 0 HG13 VAL A 94 20.127 -9.602 -4.848 1.00 2.63 H new ATOM 0 HG21 VAL A 94 22.184 -10.957 -2.999 1.00 2.56 H new ATOM 0 HG22 VAL A 94 22.419 -9.342 -3.710 1.00 2.56 H new ATOM 0 HG23 VAL A 94 22.519 -9.561 -1.947 1.00 2.56 H new ATOM 1299 N CYS A 95 18.174 -7.230 -3.392 1.00 1.47 N ATOM 1300 CA CYS A 95 16.741 -7.014 -3.437 1.00 1.46 C ATOM 1301 C CYS A 95 16.231 -7.076 -4.859 1.00 1.37 C ATOM 1302 O CYS A 95 16.839 -6.528 -5.779 1.00 1.52 O ATOM 1303 CB CYS A 95 16.365 -5.655 -2.836 1.00 1.77 C ATOM 1304 SG CYS A 95 17.396 -4.284 -3.417 1.00 2.83 S ATOM 0 H CYS A 95 18.681 -6.843 -4.188 1.00 1.47 H new ATOM 0 HA CYS A 95 16.279 -7.807 -2.848 1.00 1.46 H new ATOM 0 HB2 CYS A 95 15.323 -5.439 -3.074 1.00 1.77 H new ATOM 0 HB3 CYS A 95 16.438 -5.716 -1.750 1.00 1.77 H new ATOM 0 HG CYS A 95 17.302 -3.288 -2.587 1.00 2.83 H new ATOM 1310 N THR A 96 15.141 -7.786 -5.039 1.00 1.52 N ATOM 1311 CA THR A 96 14.333 -7.615 -6.217 1.00 1.59 C ATOM 1312 C THR A 96 13.504 -6.375 -5.981 1.00 1.08 C ATOM 1313 O THR A 96 13.216 -6.047 -4.830 1.00 1.31 O ATOM 1314 CB THR A 96 13.378 -8.799 -6.420 1.00 2.27 C ATOM 1315 OG1 THR A 96 13.968 -9.998 -5.890 1.00 2.76 O ATOM 1316 CG2 THR A 96 13.060 -8.998 -7.896 1.00 2.98 C ATOM 0 H THR A 96 14.796 -8.487 -4.383 1.00 1.52 H new ATOM 0 HA THR A 96 14.970 -7.543 -7.098 1.00 1.59 H new ATOM 0 HB THR A 96 12.449 -8.581 -5.892 1.00 2.27 H new ATOM 0 HG1 THR A 96 13.354 -10.750 -6.021 1.00 2.76 H new ATOM 0 HG21 THR A 96 12.382 -9.843 -8.011 1.00 2.98 H new ATOM 0 HG22 THR A 96 12.589 -8.098 -8.291 1.00 2.98 H new ATOM 0 HG23 THR A 96 13.982 -9.195 -8.443 1.00 2.98 H new ATOM 1324 N LYS A 97 13.116 -5.678 -7.023 1.00 1.14 N ATOM 1325 CA LYS A 97 12.239 -4.543 -6.833 1.00 1.11 C ATOM 1326 C LYS A 97 10.801 -5.012 -6.658 1.00 1.04 C ATOM 1327 O LYS A 97 9.881 -4.524 -7.317 1.00 1.76 O ATOM 1328 CB LYS A 97 12.369 -3.519 -7.957 1.00 1.47 C ATOM 1329 CG LYS A 97 12.270 -4.066 -9.371 1.00 1.47 C ATOM 1330 CD LYS A 97 12.684 -2.997 -10.374 1.00 1.89 C ATOM 1331 CE LYS A 97 12.581 -3.474 -11.812 1.00 2.34 C ATOM 1332 NZ LYS A 97 11.170 -3.592 -12.273 1.00 2.72 N ATOM 0 H LYS A 97 13.384 -5.868 -7.989 1.00 1.14 H new ATOM 0 HA LYS A 97 12.546 -4.032 -5.920 1.00 1.11 H new ATOM 0 HB2 LYS A 97 11.594 -2.764 -7.826 1.00 1.47 H new ATOM 0 HB3 LYS A 97 13.328 -3.012 -7.851 1.00 1.47 H new ATOM 0 HG2 LYS A 97 12.910 -4.942 -9.476 1.00 1.47 H new ATOM 0 HG3 LYS A 97 11.249 -4.390 -9.573 1.00 1.47 H new ATOM 0 HD2 LYS A 97 12.055 -2.117 -10.241 1.00 1.89 H new ATOM 0 HD3 LYS A 97 13.710 -2.690 -10.170 1.00 1.89 H new ATOM 0 HE2 LYS A 97 13.115 -2.780 -12.461 1.00 2.34 H new ATOM 0 HE3 LYS A 97 13.073 -4.442 -11.907 1.00 2.34 H new ATOM 0 HZ1 LYS A 97 11.153 -3.921 -13.260 1.00 2.72 H new ATOM 0 HZ2 LYS A 97 10.664 -4.274 -11.672 1.00 2.72 H new ATOM 0 HZ3 LYS A 97 10.705 -2.664 -12.209 1.00 2.72 H new ATOM 1346 N PHE A 98 10.644 -5.968 -5.740 1.00 0.89 N ATOM 1347 CA PHE A 98 9.359 -6.543 -5.395 1.00 0.92 C ATOM 1348 C PHE A 98 8.723 -7.205 -6.621 1.00 1.11 C ATOM 1349 O PHE A 98 9.186 -8.256 -7.063 1.00 2.12 O ATOM 1350 CB PHE A 98 8.464 -5.453 -4.786 1.00 1.15 C ATOM 1351 CG PHE A 98 7.146 -5.924 -4.245 1.00 0.75 C ATOM 1352 CD1 PHE A 98 6.805 -7.254 -4.344 1.00 1.02 C ATOM 1353 CD2 PHE A 98 6.261 -5.057 -3.621 1.00 0.96 C ATOM 1354 CE1 PHE A 98 5.615 -7.713 -3.834 1.00 0.94 C ATOM 1355 CE2 PHE A 98 5.073 -5.519 -3.104 1.00 0.87 C ATOM 1356 CZ PHE A 98 4.684 -6.732 -3.289 1.00 0.45 C ATOM 0 H PHE A 98 11.422 -6.364 -5.213 1.00 0.89 H new ATOM 0 HA PHE A 98 9.488 -7.327 -4.648 1.00 0.92 H new ATOM 0 HB2 PHE A 98 9.013 -4.965 -3.981 1.00 1.15 H new ATOM 0 HB3 PHE A 98 8.274 -4.696 -5.547 1.00 1.15 H new ATOM 0 HD1 PHE A 98 7.480 -7.944 -4.828 1.00 1.02 H new ATOM 0 HD2 PHE A 98 6.507 -4.009 -3.540 1.00 0.96 H new ATOM 0 HE1 PHE A 98 5.377 -8.766 -3.837 1.00 0.94 H new ATOM 0 HE2 PHE A 98 4.452 -4.848 -2.529 1.00 0.87 H new ATOM 0 HZ PHE A 98 3.673 -7.022 -3.042 1.00 0.45 H new ATOM 1366 N LYS A 99 7.706 -6.549 -7.182 1.00 0.80 N ATOM 1367 CA LYS A 99 6.930 -7.084 -8.297 1.00 0.78 C ATOM 1368 C LYS A 99 6.227 -8.385 -7.919 1.00 0.79 C ATOM 1369 O LYS A 99 6.848 -9.435 -7.769 1.00 1.43 O ATOM 1370 CB LYS A 99 7.823 -7.272 -9.531 1.00 1.02 C ATOM 1371 CG LYS A 99 7.104 -7.838 -10.747 1.00 1.34 C ATOM 1372 CD LYS A 99 8.039 -7.935 -11.946 1.00 1.63 C ATOM 1373 CE LYS A 99 9.206 -8.876 -11.680 1.00 2.05 C ATOM 1374 NZ LYS A 99 8.774 -10.296 -11.584 1.00 2.69 N ATOM 0 H LYS A 99 7.398 -5.627 -6.873 1.00 0.80 H new ATOM 0 HA LYS A 99 6.153 -6.360 -8.544 1.00 0.78 H new ATOM 0 HB2 LYS A 99 8.260 -6.310 -9.798 1.00 1.02 H new ATOM 0 HB3 LYS A 99 8.647 -7.936 -9.270 1.00 1.02 H new ATOM 0 HG2 LYS A 99 6.708 -8.826 -10.511 1.00 1.34 H new ATOM 0 HG3 LYS A 99 6.253 -7.204 -10.997 1.00 1.34 H new ATOM 0 HD2 LYS A 99 7.481 -8.285 -12.814 1.00 1.63 H new ATOM 0 HD3 LYS A 99 8.420 -6.944 -12.190 1.00 1.63 H new ATOM 0 HE2 LYS A 99 9.941 -8.775 -12.479 1.00 2.05 H new ATOM 0 HE3 LYS A 99 9.701 -8.585 -10.753 1.00 2.05 H new ATOM 0 HZ1 LYS A 99 9.610 -10.907 -11.487 1.00 2.69 H new ATOM 0 HZ2 LYS A 99 8.159 -10.416 -10.754 1.00 2.69 H new ATOM 0 HZ3 LYS A 99 8.251 -10.559 -12.444 1.00 2.69 H new ATOM 1388 N ALA A 100 4.913 -8.308 -7.801 1.00 0.51 N ATOM 1389 CA ALA A 100 4.120 -9.427 -7.331 1.00 0.43 C ATOM 1390 C ALA A 100 2.935 -9.682 -8.243 1.00 0.40 C ATOM 1391 O ALA A 100 2.923 -9.263 -9.400 1.00 0.55 O ATOM 1392 CB ALA A 100 3.626 -9.150 -5.930 1.00 0.43 C ATOM 0 H ALA A 100 4.370 -7.474 -8.027 1.00 0.51 H new ATOM 0 HA ALA A 100 4.753 -10.315 -7.333 1.00 0.43 H new ATOM 0 HB1 ALA A 100 3.030 -9.994 -5.581 1.00 0.43 H new ATOM 0 HB2 ALA A 100 4.478 -9.007 -5.265 1.00 0.43 H new ATOM 0 HB3 ALA A 100 3.013 -8.249 -5.932 1.00 0.43 H new ATOM 1398 N GLU A 101 1.937 -10.374 -7.712 1.00 0.34 N ATOM 1399 CA GLU A 101 0.730 -10.661 -8.460 1.00 0.40 C ATOM 1400 C GLU A 101 -0.359 -9.629 -8.162 1.00 0.43 C ATOM 1401 O GLU A 101 -1.554 -9.915 -8.266 1.00 0.67 O ATOM 1402 CB GLU A 101 0.238 -12.067 -8.137 1.00 0.50 C ATOM 1403 CG GLU A 101 1.291 -13.133 -8.392 1.00 0.67 C ATOM 1404 CD GLU A 101 0.898 -14.486 -7.848 1.00 1.24 C ATOM 1405 OE1 GLU A 101 0.133 -15.205 -8.527 1.00 1.57 O ATOM 1406 OE2 GLU A 101 1.348 -14.834 -6.738 1.00 1.99 O ATOM 0 H GLU A 101 1.943 -10.746 -6.762 1.00 0.34 H new ATOM 0 HA GLU A 101 0.962 -10.604 -9.523 1.00 0.40 H new ATOM 0 HB2 GLU A 101 -0.069 -12.108 -7.092 1.00 0.50 H new ATOM 0 HB3 GLU A 101 -0.645 -12.285 -8.737 1.00 0.50 H new ATOM 0 HG2 GLU A 101 1.466 -13.215 -9.465 1.00 0.67 H new ATOM 0 HG3 GLU A 101 2.232 -12.823 -7.938 1.00 0.67 H new ATOM 1413 N PHE A 102 0.077 -8.436 -7.776 1.00 0.38 N ATOM 1414 CA PHE A 102 -0.799 -7.311 -7.521 1.00 0.40 C ATOM 1415 C PHE A 102 -0.071 -6.022 -7.929 1.00 0.45 C ATOM 1416 O PHE A 102 1.140 -6.040 -8.151 1.00 0.80 O ATOM 1417 CB PHE A 102 -1.251 -7.280 -6.053 1.00 0.84 C ATOM 1418 CG PHE A 102 -0.178 -7.507 -5.061 1.00 0.45 C ATOM 1419 CD1 PHE A 102 0.171 -8.784 -4.707 1.00 0.52 C ATOM 1420 CD2 PHE A 102 0.479 -6.441 -4.493 1.00 0.62 C ATOM 1421 CE1 PHE A 102 1.173 -9.003 -3.791 1.00 0.59 C ATOM 1422 CE2 PHE A 102 1.480 -6.646 -3.577 1.00 0.58 C ATOM 1423 CZ PHE A 102 1.812 -7.934 -3.205 1.00 0.44 C ATOM 0 H PHE A 102 1.064 -8.225 -7.631 1.00 0.38 H new ATOM 0 HA PHE A 102 -1.707 -7.407 -8.116 1.00 0.40 H new ATOM 0 HB2 PHE A 102 -1.712 -6.313 -5.851 1.00 0.84 H new ATOM 0 HB3 PHE A 102 -2.022 -8.037 -5.910 1.00 0.84 H new ATOM 0 HD1 PHE A 102 -0.344 -9.624 -5.150 1.00 0.52 H new ATOM 0 HD2 PHE A 102 0.205 -5.434 -4.770 1.00 0.62 H new ATOM 0 HE1 PHE A 102 1.458 -10.012 -3.532 1.00 0.59 H new ATOM 0 HE2 PHE A 102 2.005 -5.805 -3.149 1.00 0.58 H new ATOM 0 HZ PHE A 102 2.572 -8.102 -2.456 1.00 0.44 H new ATOM 1433 N PRO A 103 -0.812 -4.913 -8.067 1.00 0.33 N ATOM 1434 CA PRO A 103 -0.306 -3.619 -8.583 1.00 0.39 C ATOM 1435 C PRO A 103 0.842 -3.008 -7.795 1.00 0.41 C ATOM 1436 O PRO A 103 0.628 -2.165 -6.936 1.00 0.62 O ATOM 1437 CB PRO A 103 -1.537 -2.719 -8.496 1.00 0.42 C ATOM 1438 CG PRO A 103 -2.677 -3.664 -8.560 1.00 0.58 C ATOM 1439 CD PRO A 103 -2.240 -4.828 -7.752 1.00 0.27 C ATOM 0 HA PRO A 103 0.117 -3.746 -9.579 1.00 0.39 H new ATOM 0 HB2 PRO A 103 -1.547 -2.144 -7.570 1.00 0.42 H new ATOM 0 HB3 PRO A 103 -1.566 -2.002 -9.317 1.00 0.42 H new ATOM 0 HG2 PRO A 103 -3.585 -3.218 -8.155 1.00 0.58 H new ATOM 0 HG3 PRO A 103 -2.895 -3.954 -9.588 1.00 0.58 H new ATOM 0 HD2 PRO A 103 -2.412 -4.671 -6.687 1.00 0.27 H new ATOM 0 HD3 PRO A 103 -2.772 -5.738 -8.030 1.00 0.27 H new ATOM 1447 N ILE A 104 2.066 -3.405 -8.107 1.00 0.35 N ATOM 1448 CA ILE A 104 3.224 -2.742 -7.531 1.00 0.35 C ATOM 1449 C ILE A 104 3.561 -1.533 -8.380 1.00 0.33 C ATOM 1450 O ILE A 104 3.629 -1.628 -9.609 1.00 0.44 O ATOM 1451 CB ILE A 104 4.479 -3.639 -7.436 1.00 0.41 C ATOM 1452 CG1 ILE A 104 4.159 -4.992 -6.793 1.00 0.52 C ATOM 1453 CG2 ILE A 104 5.578 -2.914 -6.653 1.00 0.45 C ATOM 1454 CD1 ILE A 104 3.116 -4.920 -5.717 1.00 1.34 C ATOM 0 H ILE A 104 2.281 -4.171 -8.746 1.00 0.35 H new ATOM 0 HA ILE A 104 2.953 -2.470 -6.511 1.00 0.35 H new ATOM 0 HB ILE A 104 4.832 -3.837 -8.448 1.00 0.41 H new ATOM 0 HG12 ILE A 104 3.822 -5.681 -7.567 1.00 0.52 H new ATOM 0 HG13 ILE A 104 5.074 -5.409 -6.372 1.00 0.52 H new ATOM 0 HG21 ILE A 104 6.460 -3.551 -6.589 1.00 0.45 H new ATOM 0 HG22 ILE A 104 5.837 -1.986 -7.163 1.00 0.45 H new ATOM 0 HG23 ILE A 104 5.220 -2.688 -5.648 1.00 0.45 H new ATOM 0 HD11 ILE A 104 2.944 -5.916 -5.310 1.00 1.34 H new ATOM 0 HD12 ILE A 104 3.458 -4.257 -4.922 1.00 1.34 H new ATOM 0 HD13 ILE A 104 2.187 -4.534 -6.136 1.00 1.34 H new ATOM 1466 N MET A 105 3.759 -0.406 -7.732 1.00 0.29 N ATOM 1467 CA MET A 105 4.005 0.834 -8.440 1.00 0.30 C ATOM 1468 C MET A 105 5.501 1.110 -8.528 1.00 0.27 C ATOM 1469 O MET A 105 6.323 0.310 -8.083 1.00 0.35 O ATOM 1470 CB MET A 105 3.275 1.980 -7.745 1.00 0.43 C ATOM 1471 CG MET A 105 4.048 2.641 -6.629 1.00 1.50 C ATOM 1472 SD MET A 105 4.845 4.186 -7.118 1.00 2.49 S ATOM 1473 CE MET A 105 3.441 5.175 -7.608 1.00 3.03 C ATOM 0 H MET A 105 3.755 -0.321 -6.716 1.00 0.29 H new ATOM 0 HA MET A 105 3.622 0.747 -9.457 1.00 0.30 H new ATOM 0 HB2 MET A 105 3.022 2.735 -8.489 1.00 0.43 H new ATOM 0 HB3 MET A 105 2.335 1.602 -7.342 1.00 0.43 H new ATOM 0 HG2 MET A 105 3.372 2.838 -5.797 1.00 1.50 H new ATOM 0 HG3 MET A 105 4.808 1.949 -6.265 1.00 1.50 H new ATOM 0 HE1 MET A 105 3.694 5.749 -8.499 1.00 3.03 H new ATOM 0 HE2 MET A 105 2.594 4.523 -7.824 1.00 3.03 H new ATOM 0 HE3 MET A 105 3.177 5.857 -6.800 1.00 3.03 H new ATOM 1483 N ALA A 106 5.833 2.266 -9.078 1.00 0.33 N ATOM 1484 CA ALA A 106 7.208 2.611 -9.433 1.00 0.52 C ATOM 1485 C ALA A 106 8.029 3.062 -8.231 1.00 0.66 C ATOM 1486 O ALA A 106 9.079 3.687 -8.397 1.00 1.46 O ATOM 1487 CB ALA A 106 7.184 3.710 -10.466 1.00 0.70 C ATOM 0 H ALA A 106 5.156 2.998 -9.294 1.00 0.33 H new ATOM 0 HA ALA A 106 7.684 1.713 -9.828 1.00 0.52 H new ATOM 0 HB1 ALA A 106 8.205 3.976 -10.738 1.00 0.70 H new ATOM 0 HB2 ALA A 106 6.650 3.365 -11.352 1.00 0.70 H new ATOM 0 HB3 ALA A 106 6.679 4.584 -10.055 1.00 0.70 H new ATOM 1493 N LYS A 107 7.556 2.706 -7.039 1.00 0.40 N ATOM 1494 CA LYS A 107 8.065 3.239 -5.772 1.00 0.36 C ATOM 1495 C LYS A 107 7.879 4.722 -5.707 1.00 0.38 C ATOM 1496 O LYS A 107 8.232 5.471 -6.618 1.00 0.59 O ATOM 1497 CB LYS A 107 9.566 3.027 -5.552 1.00 0.49 C ATOM 1498 CG LYS A 107 10.083 1.637 -5.775 1.00 0.84 C ATOM 1499 CD LYS A 107 11.593 1.609 -5.617 1.00 0.83 C ATOM 1500 CE LYS A 107 12.140 0.197 -5.630 1.00 0.95 C ATOM 1501 NZ LYS A 107 11.954 -0.456 -6.948 1.00 1.76 N ATOM 0 H LYS A 107 6.800 2.032 -6.921 1.00 0.40 H new ATOM 0 HA LYS A 107 7.498 2.694 -5.017 1.00 0.36 H new ATOM 0 HB2 LYS A 107 10.107 3.703 -6.214 1.00 0.49 H new ATOM 0 HB3 LYS A 107 9.806 3.321 -4.530 1.00 0.49 H new ATOM 0 HG2 LYS A 107 9.623 0.951 -5.064 1.00 0.84 H new ATOM 0 HG3 LYS A 107 9.808 1.294 -6.772 1.00 0.84 H new ATOM 0 HD2 LYS A 107 12.052 2.183 -6.422 1.00 0.83 H new ATOM 0 HD3 LYS A 107 11.868 2.096 -4.681 1.00 0.83 H new ATOM 0 HE2 LYS A 107 13.201 0.216 -5.381 1.00 0.95 H new ATOM 0 HE3 LYS A 107 11.643 -0.392 -4.860 1.00 0.95 H new ATOM 0 HZ1 LYS A 107 12.779 -1.052 -7.160 1.00 1.76 H new ATOM 0 HZ2 LYS A 107 11.098 -1.046 -6.926 1.00 1.76 H new ATOM 0 HZ3 LYS A 107 11.854 0.271 -7.685 1.00 1.76 H new ATOM 1515 N ILE A 108 7.344 5.136 -4.614 1.00 0.31 N ATOM 1516 CA ILE A 108 7.454 6.483 -4.208 1.00 0.35 C ATOM 1517 C ILE A 108 7.969 6.458 -2.795 1.00 0.36 C ATOM 1518 O ILE A 108 7.959 5.401 -2.158 1.00 0.42 O ATOM 1519 CB ILE A 108 6.113 7.216 -4.361 1.00 0.48 C ATOM 1520 CG1 ILE A 108 4.950 6.411 -3.771 1.00 0.82 C ATOM 1521 CG2 ILE A 108 5.859 7.437 -5.849 1.00 0.68 C ATOM 1522 CD1 ILE A 108 4.941 6.296 -2.266 1.00 0.64 C ATOM 0 H ILE A 108 6.815 4.542 -3.975 1.00 0.31 H new ATOM 0 HA ILE A 108 8.146 7.045 -4.836 1.00 0.35 H new ATOM 0 HB ILE A 108 6.171 8.161 -3.820 1.00 0.48 H new ATOM 0 HG12 ILE A 108 4.014 6.870 -4.089 1.00 0.82 H new ATOM 0 HG13 ILE A 108 4.973 5.407 -4.195 1.00 0.82 H new ATOM 0 HG21 ILE A 108 4.910 7.957 -5.983 1.00 0.68 H new ATOM 0 HG22 ILE A 108 6.665 8.038 -6.270 1.00 0.68 H new ATOM 0 HG23 ILE A 108 5.820 6.474 -6.358 1.00 0.68 H new ATOM 0 HD11 ILE A 108 4.079 5.708 -1.951 1.00 0.64 H new ATOM 0 HD12 ILE A 108 5.856 5.806 -1.933 1.00 0.64 H new ATOM 0 HD13 ILE A 108 4.882 7.291 -1.825 1.00 0.64 H new ATOM 1534 N ASN A 109 8.453 7.566 -2.317 1.00 0.38 N ATOM 1535 CA ASN A 109 9.102 7.583 -1.027 1.00 0.44 C ATOM 1536 C ASN A 109 8.080 7.533 0.076 1.00 0.47 C ATOM 1537 O ASN A 109 7.680 8.569 0.607 1.00 0.76 O ATOM 1538 CB ASN A 109 9.943 8.827 -0.872 1.00 0.53 C ATOM 1539 CG ASN A 109 11.022 8.644 0.158 1.00 0.98 C ATOM 1540 OD1 ASN A 109 12.167 8.354 -0.184 1.00 1.73 O ATOM 1541 ND2 ASN A 109 10.666 8.790 1.420 1.00 1.16 N ATOM 0 H ASN A 109 8.415 8.468 -2.792 1.00 0.38 H new ATOM 0 HA ASN A 109 9.746 6.706 -0.962 1.00 0.44 H new ATOM 0 HB2 ASN A 109 10.395 9.083 -1.831 1.00 0.53 H new ATOM 0 HB3 ASN A 109 9.306 9.664 -0.587 1.00 0.53 H new ATOM 0 HD21 ASN A 109 11.354 8.662 2.162 1.00 1.16 H new ATOM 0 HD22 ASN A 109 9.703 9.031 1.654 1.00 1.16 H new ATOM 1548 N VAL A 110 7.638 6.342 0.424 1.00 0.41 N ATOM 1549 CA VAL A 110 6.669 6.232 1.476 1.00 0.42 C ATOM 1550 C VAL A 110 7.369 6.349 2.807 1.00 0.44 C ATOM 1551 O VAL A 110 7.768 5.358 3.409 1.00 0.48 O ATOM 1552 CB VAL A 110 5.932 4.886 1.394 1.00 0.43 C ATOM 1553 CG1 VAL A 110 4.548 5.104 0.847 1.00 0.60 C ATOM 1554 CG2 VAL A 110 6.689 3.901 0.519 1.00 0.77 C ATOM 0 H VAL A 110 7.930 5.461 0.001 1.00 0.41 H new ATOM 0 HA VAL A 110 5.937 7.033 1.370 1.00 0.42 H new ATOM 0 HB VAL A 110 5.867 4.464 2.397 1.00 0.43 H new ATOM 0 HG11 VAL A 110 4.025 4.149 0.789 1.00 0.60 H new ATOM 0 HG12 VAL A 110 3.999 5.779 1.504 1.00 0.60 H new ATOM 0 HG13 VAL A 110 4.615 5.542 -0.149 1.00 0.60 H new ATOM 0 HG21 VAL A 110 6.145 2.957 0.479 1.00 0.77 H new ATOM 0 HG22 VAL A 110 6.785 4.308 -0.488 1.00 0.77 H new ATOM 0 HG23 VAL A 110 7.681 3.730 0.937 1.00 0.77 H new ATOM 1564 N ASN A 111 7.456 7.585 3.268 1.00 0.48 N ATOM 1565 CA ASN A 111 8.000 7.907 4.567 1.00 0.56 C ATOM 1566 C ASN A 111 8.060 9.416 4.706 1.00 0.62 C ATOM 1567 O ASN A 111 8.017 10.130 3.701 1.00 0.67 O ATOM 1568 CB ASN A 111 9.407 7.331 4.753 1.00 0.65 C ATOM 1569 CG ASN A 111 9.737 7.146 6.224 1.00 1.20 C ATOM 1570 OD1 ASN A 111 9.409 6.123 6.824 1.00 1.90 O ATOM 1571 ND2 ASN A 111 10.381 8.139 6.824 1.00 1.72 N ATOM 0 H ASN A 111 7.145 8.401 2.740 1.00 0.48 H new ATOM 0 HA ASN A 111 7.355 7.468 5.328 1.00 0.56 H new ATOM 0 HB2 ASN A 111 9.481 6.373 4.238 1.00 0.65 H new ATOM 0 HB3 ASN A 111 10.138 7.997 4.295 1.00 0.65 H new ATOM 0 HD21 ASN A 111 10.619 8.068 7.813 1.00 1.72 H new ATOM 0 HD22 ASN A 111 10.638 8.973 6.296 1.00 1.72 H new ATOM 1578 N GLY A 112 8.163 9.883 5.939 1.00 0.73 N ATOM 1579 CA GLY A 112 8.563 11.253 6.207 1.00 0.85 C ATOM 1580 C GLY A 112 7.876 12.308 5.358 1.00 0.93 C ATOM 1581 O GLY A 112 6.648 12.402 5.325 1.00 1.47 O ATOM 0 H GLY A 112 7.974 9.329 6.774 1.00 0.73 H new ATOM 0 HA2 GLY A 112 8.368 11.472 7.257 1.00 0.85 H new ATOM 0 HA3 GLY A 112 9.640 11.335 6.058 1.00 0.85 H new ATOM 1585 N GLU A 113 8.699 13.095 4.669 1.00 0.88 N ATOM 1586 CA GLU A 113 8.244 14.296 3.968 1.00 1.23 C ATOM 1587 C GLU A 113 8.214 14.078 2.467 1.00 1.10 C ATOM 1588 O GLU A 113 7.925 14.998 1.701 1.00 1.39 O ATOM 1589 CB GLU A 113 9.186 15.468 4.259 1.00 1.61 C ATOM 1590 CG GLU A 113 10.132 15.230 5.421 1.00 1.83 C ATOM 1591 CD GLU A 113 9.451 15.352 6.770 1.00 2.29 C ATOM 1592 OE1 GLU A 113 9.315 16.482 7.277 1.00 2.65 O ATOM 1593 OE2 GLU A 113 9.045 14.311 7.332 1.00 2.81 O ATOM 0 H GLU A 113 9.700 12.919 4.580 1.00 0.88 H new ATOM 0 HA GLU A 113 7.238 14.517 4.324 1.00 1.23 H new ATOM 0 HB2 GLU A 113 9.772 15.679 3.365 1.00 1.61 H new ATOM 0 HB3 GLU A 113 8.590 16.356 4.466 1.00 1.61 H new ATOM 0 HG2 GLU A 113 10.570 14.236 5.329 1.00 1.83 H new ATOM 0 HG3 GLU A 113 10.952 15.946 5.368 1.00 1.83 H new ATOM 1600 N ASN A 114 8.540 12.875 2.044 1.00 0.79 N ATOM 1601 CA ASN A 114 8.777 12.612 0.639 1.00 0.79 C ATOM 1602 C ASN A 114 7.681 11.727 0.136 1.00 0.79 C ATOM 1603 O ASN A 114 7.658 11.304 -1.022 1.00 1.22 O ATOM 1604 CB ASN A 114 10.126 11.938 0.452 1.00 0.87 C ATOM 1605 CG ASN A 114 11.044 12.159 1.643 1.00 1.45 C ATOM 1606 OD1 ASN A 114 11.227 11.287 2.487 1.00 2.06 O ATOM 1607 ND2 ASN A 114 11.556 13.366 1.758 1.00 2.16 N ATOM 0 H ASN A 114 8.647 12.063 2.652 1.00 0.79 H new ATOM 0 HA ASN A 114 8.786 13.548 0.080 1.00 0.79 H new ATOM 0 HB2 ASN A 114 9.979 10.869 0.301 1.00 0.87 H new ATOM 0 HB3 ASN A 114 10.602 12.324 -0.449 1.00 0.87 H new ATOM 0 HD21 ASN A 114 12.127 13.603 2.569 1.00 2.16 H new ATOM 0 HD22 ASN A 114 11.382 14.065 1.036 1.00 2.16 H new ATOM 1614 N ALA A 115 6.788 11.447 1.061 1.00 0.59 N ATOM 1615 CA ALA A 115 5.605 10.686 0.809 1.00 0.61 C ATOM 1616 C ALA A 115 4.887 11.218 -0.411 1.00 0.68 C ATOM 1617 O ALA A 115 4.796 12.427 -0.621 1.00 1.26 O ATOM 1618 CB ALA A 115 4.752 10.724 2.045 1.00 0.86 C ATOM 0 H ALA A 115 6.876 11.754 2.030 1.00 0.59 H new ATOM 0 HA ALA A 115 5.850 9.647 0.589 1.00 0.61 H new ATOM 0 HB1 ALA A 115 3.842 10.149 1.877 1.00 0.86 H new ATOM 0 HB2 ALA A 115 5.303 10.294 2.881 1.00 0.86 H new ATOM 0 HB3 ALA A 115 4.491 11.757 2.275 1.00 0.86 H new ATOM 1624 N HIS A 116 4.387 10.313 -1.224 1.00 0.42 N ATOM 1625 CA HIS A 116 3.817 10.691 -2.483 1.00 0.35 C ATOM 1626 C HIS A 116 2.431 11.190 -2.208 1.00 0.29 C ATOM 1627 O HIS A 116 1.767 10.597 -1.384 1.00 0.29 O ATOM 1628 CB HIS A 116 3.812 9.469 -3.407 1.00 0.35 C ATOM 1629 CG HIS A 116 2.801 9.518 -4.498 1.00 0.31 C ATOM 1630 ND1 HIS A 116 1.488 9.318 -4.231 1.00 0.33 N ATOM 1631 CD2 HIS A 116 2.876 9.813 -5.820 1.00 0.31 C ATOM 1632 CE1 HIS A 116 0.785 9.502 -5.306 1.00 0.32 C ATOM 1633 NE2 HIS A 116 1.591 9.803 -6.302 1.00 0.32 N ATOM 0 H HIS A 116 4.367 9.312 -1.029 1.00 0.42 H new ATOM 0 HA HIS A 116 4.389 11.476 -2.978 1.00 0.35 H new ATOM 0 HB2 HIS A 116 4.801 9.363 -3.852 1.00 0.35 H new ATOM 0 HB3 HIS A 116 3.635 8.577 -2.806 1.00 0.35 H new ATOM 0 HD2 HIS A 116 3.774 10.017 -6.384 1.00 0.31 H new ATOM 0 HE1 HIS A 116 -0.290 9.421 -5.373 1.00 0.32 H new ATOM 0 HE2 HIS A 116 1.310 9.995 -7.263 1.00 0.32 H new ATOM 1642 N PRO A 117 1.992 12.270 -2.880 1.00 0.31 N ATOM 1643 CA PRO A 117 0.683 12.887 -2.700 1.00 0.31 C ATOM 1644 C PRO A 117 -0.381 11.938 -2.142 1.00 0.26 C ATOM 1645 O PRO A 117 -1.061 12.268 -1.188 1.00 0.27 O ATOM 1646 CB PRO A 117 0.351 13.315 -4.126 1.00 0.37 C ATOM 1647 CG PRO A 117 1.671 13.591 -4.782 1.00 0.40 C ATOM 1648 CD PRO A 117 2.749 13.013 -3.892 1.00 0.38 C ATOM 0 HA PRO A 117 0.699 13.693 -1.966 1.00 0.31 H new ATOM 0 HB2 PRO A 117 -0.193 12.532 -4.654 1.00 0.37 H new ATOM 0 HB3 PRO A 117 -0.283 14.202 -4.132 1.00 0.37 H new ATOM 0 HG2 PRO A 117 1.709 13.139 -5.773 1.00 0.40 H new ATOM 0 HG3 PRO A 117 1.817 14.663 -4.915 1.00 0.40 H new ATOM 0 HD2 PRO A 117 3.423 12.361 -4.448 1.00 0.38 H new ATOM 0 HD3 PRO A 117 3.361 13.795 -3.442 1.00 0.38 H new ATOM 1656 N LEU A 118 -0.468 10.738 -2.711 1.00 0.24 N ATOM 1657 CA LEU A 118 -1.445 9.739 -2.308 1.00 0.23 C ATOM 1658 C LEU A 118 -1.163 9.203 -0.898 1.00 0.27 C ATOM 1659 O LEU A 118 -2.042 9.180 -0.049 1.00 0.28 O ATOM 1660 CB LEU A 118 -1.409 8.622 -3.334 1.00 0.24 C ATOM 1661 CG LEU A 118 -2.292 7.424 -3.063 1.00 0.25 C ATOM 1662 CD1 LEU A 118 -3.735 7.785 -3.336 1.00 0.39 C ATOM 1663 CD2 LEU A 118 -1.862 6.240 -3.911 1.00 0.27 C ATOM 0 H LEU A 118 0.143 10.433 -3.469 1.00 0.24 H new ATOM 0 HA LEU A 118 -2.437 10.189 -2.269 1.00 0.23 H new ATOM 0 HB2 LEU A 118 -1.688 9.039 -4.301 1.00 0.24 H new ATOM 0 HB3 LEU A 118 -0.380 8.274 -3.422 1.00 0.24 H new ATOM 0 HG LEU A 118 -2.192 7.138 -2.016 1.00 0.25 H new ATOM 0 HD11 LEU A 118 -4.370 6.921 -3.140 1.00 0.39 H new ATOM 0 HD12 LEU A 118 -4.033 8.608 -2.687 1.00 0.39 H new ATOM 0 HD13 LEU A 118 -3.844 8.086 -4.378 1.00 0.39 H new ATOM 0 HD21 LEU A 118 -2.509 5.388 -3.702 1.00 0.27 H new ATOM 0 HD22 LEU A 118 -1.937 6.502 -4.966 1.00 0.27 H new ATOM 0 HD23 LEU A 118 -0.831 5.979 -3.675 1.00 0.27 H new ATOM 1675 N TYR A 119 0.078 8.793 -0.656 1.00 0.32 N ATOM 1676 CA TYR A 119 0.462 8.201 0.620 1.00 0.42 C ATOM 1677 C TYR A 119 0.711 9.261 1.627 1.00 0.40 C ATOM 1678 O TYR A 119 0.482 9.081 2.813 1.00 0.41 O ATOM 1679 CB TYR A 119 1.707 7.370 0.504 1.00 0.57 C ATOM 1680 CG TYR A 119 1.429 5.966 0.116 1.00 0.54 C ATOM 1681 CD1 TYR A 119 1.161 5.633 -1.202 1.00 0.92 C ATOM 1682 CD2 TYR A 119 1.403 4.984 1.070 1.00 1.09 C ATOM 1683 CE1 TYR A 119 0.855 4.341 -1.549 1.00 1.74 C ATOM 1684 CE2 TYR A 119 1.119 3.696 0.737 1.00 1.88 C ATOM 1685 CZ TYR A 119 0.992 3.357 -0.630 1.00 2.20 C ATOM 1686 OH TYR A 119 0.498 2.094 -0.911 1.00 3.04 O ATOM 0 H TYR A 119 0.839 8.861 -1.332 1.00 0.32 H new ATOM 0 HA TYR A 119 -0.365 7.562 0.928 1.00 0.42 H new ATOM 0 HB2 TYR A 119 2.371 7.821 -0.233 1.00 0.57 H new ATOM 0 HB3 TYR A 119 2.235 7.380 1.457 1.00 0.57 H new ATOM 0 HD1 TYR A 119 1.193 6.398 -1.964 1.00 0.92 H new ATOM 0 HD2 TYR A 119 1.611 5.235 2.100 1.00 1.09 H new ATOM 0 HE1 TYR A 119 0.508 4.112 -2.546 1.00 1.74 H new ATOM 0 HE2 TYR A 119 0.993 2.945 1.503 1.00 1.88 H new ATOM 0 HH TYR A 119 1.188 1.566 -1.365 1.00 3.04 H new ATOM 1696 N GLU A 120 1.228 10.352 1.136 1.00 0.40 N ATOM 1697 CA GLU A 120 1.435 11.501 1.943 1.00 0.42 C ATOM 1698 C GLU A 120 0.082 11.959 2.405 1.00 0.37 C ATOM 1699 O GLU A 120 -0.081 12.386 3.538 1.00 0.43 O ATOM 1700 CB GLU A 120 2.158 12.574 1.135 1.00 0.50 C ATOM 1701 CG GLU A 120 2.403 13.823 1.919 1.00 0.76 C ATOM 1702 CD GLU A 120 3.589 13.736 2.860 1.00 1.58 C ATOM 1703 OE1 GLU A 120 3.439 13.185 3.972 1.00 1.93 O ATOM 1704 OE2 GLU A 120 4.673 14.236 2.499 1.00 2.44 O ATOM 0 H GLU A 120 1.515 10.461 0.163 1.00 0.40 H new ATOM 0 HA GLU A 120 2.062 11.283 2.808 1.00 0.42 H new ATOM 0 HB2 GLU A 120 3.111 12.178 0.784 1.00 0.50 H new ATOM 0 HB3 GLU A 120 1.568 12.815 0.251 1.00 0.50 H new ATOM 0 HG2 GLU A 120 2.561 14.650 1.226 1.00 0.76 H new ATOM 0 HG3 GLU A 120 1.510 14.058 2.497 1.00 0.76 H new ATOM 1711 N TYR A 121 -0.909 11.783 1.540 1.00 0.29 N ATOM 1712 CA TYR A 121 -2.281 12.004 1.955 1.00 0.28 C ATOM 1713 C TYR A 121 -2.727 10.883 2.876 1.00 0.27 C ATOM 1714 O TYR A 121 -3.550 11.086 3.765 1.00 0.29 O ATOM 1715 CB TYR A 121 -3.225 12.101 0.753 1.00 0.28 C ATOM 1716 CG TYR A 121 -4.686 11.971 1.104 1.00 0.30 C ATOM 1717 CD1 TYR A 121 -5.376 13.040 1.656 1.00 0.39 C ATOM 1718 CD2 TYR A 121 -5.374 10.789 0.883 1.00 0.33 C ATOM 1719 CE1 TYR A 121 -6.710 12.935 1.978 1.00 0.46 C ATOM 1720 CE2 TYR A 121 -6.712 10.677 1.201 1.00 0.41 C ATOM 1721 CZ TYR A 121 -7.372 11.710 1.753 1.00 0.46 C ATOM 1722 OH TYR A 121 -8.712 11.648 2.064 1.00 0.56 O ATOM 0 H TYR A 121 -0.790 11.494 0.569 1.00 0.29 H new ATOM 0 HA TYR A 121 -2.322 12.954 2.488 1.00 0.28 H new ATOM 0 HB2 TYR A 121 -3.066 13.058 0.256 1.00 0.28 H new ATOM 0 HB3 TYR A 121 -2.964 11.322 0.036 1.00 0.28 H new ATOM 0 HD1 TYR A 121 -4.858 13.970 1.836 1.00 0.39 H new ATOM 0 HD2 TYR A 121 -4.856 9.943 0.456 1.00 0.33 H new ATOM 0 HE1 TYR A 121 -7.241 13.777 2.396 1.00 0.46 H new ATOM 0 HE2 TYR A 121 -7.233 9.752 1.005 1.00 0.41 H new ATOM 0 HH TYR A 121 -9.109 12.540 1.978 1.00 0.56 H new ATOM 1732 N MET A 122 -2.151 9.710 2.691 1.00 0.27 N ATOM 1733 CA MET A 122 -2.672 8.531 3.355 1.00 0.29 C ATOM 1734 C MET A 122 -2.284 8.535 4.819 1.00 0.33 C ATOM 1735 O MET A 122 -3.143 8.473 5.688 1.00 0.35 O ATOM 1736 CB MET A 122 -2.220 7.245 2.681 1.00 0.33 C ATOM 1737 CG MET A 122 -3.365 6.281 2.469 1.00 0.71 C ATOM 1738 SD MET A 122 -3.062 5.132 1.125 1.00 0.56 S ATOM 1739 CE MET A 122 -3.279 6.244 -0.248 1.00 0.55 C ATOM 0 H MET A 122 -1.337 9.549 2.098 1.00 0.27 H new ATOM 0 HA MET A 122 -3.759 8.567 3.277 1.00 0.29 H new ATOM 0 HB2 MET A 122 -1.763 7.481 1.720 1.00 0.33 H new ATOM 0 HB3 MET A 122 -1.453 6.767 3.290 1.00 0.33 H new ATOM 0 HG2 MET A 122 -3.538 5.721 3.388 1.00 0.71 H new ATOM 0 HG3 MET A 122 -4.275 6.844 2.262 1.00 0.71 H new ATOM 0 HE1 MET A 122 -4.104 5.897 -0.870 1.00 0.55 H new ATOM 0 HE2 MET A 122 -3.501 7.244 0.125 1.00 0.55 H new ATOM 0 HE3 MET A 122 -2.365 6.273 -0.841 1.00 0.55 H new ATOM 1749 N LYS A 123 -0.985 8.623 5.090 1.00 0.37 N ATOM 1750 CA LYS A 123 -0.516 8.703 6.462 1.00 0.45 C ATOM 1751 C LYS A 123 -0.819 10.060 7.090 1.00 0.47 C ATOM 1752 O LYS A 123 -0.870 10.170 8.311 1.00 0.54 O ATOM 1753 CB LYS A 123 0.963 8.290 6.648 1.00 0.53 C ATOM 1754 CG LYS A 123 1.902 8.596 5.495 1.00 0.48 C ATOM 1755 CD LYS A 123 2.082 10.092 5.281 1.00 1.00 C ATOM 1756 CE LYS A 123 2.900 10.713 6.405 1.00 1.05 C ATOM 1757 NZ LYS A 123 2.956 12.194 6.318 1.00 1.46 N ATOM 0 H LYS A 123 -0.249 8.640 4.384 1.00 0.37 H new ATOM 0 HA LYS A 123 -1.090 7.954 7.007 1.00 0.45 H new ATOM 0 HB2 LYS A 123 1.346 8.785 7.540 1.00 0.53 H new ATOM 0 HB3 LYS A 123 0.996 7.217 6.840 1.00 0.53 H new ATOM 0 HG2 LYS A 123 2.873 8.139 5.688 1.00 0.48 H new ATOM 0 HG3 LYS A 123 1.513 8.144 4.582 1.00 0.48 H new ATOM 0 HD2 LYS A 123 2.577 10.269 4.326 1.00 1.00 H new ATOM 0 HD3 LYS A 123 1.106 10.575 5.228 1.00 1.00 H new ATOM 0 HE2 LYS A 123 2.470 10.425 7.364 1.00 1.05 H new ATOM 0 HE3 LYS A 123 3.913 10.312 6.376 1.00 1.05 H new ATOM 0 HZ1 LYS A 123 3.524 12.567 7.105 1.00 1.46 H new ATOM 0 HZ2 LYS A 123 3.391 12.473 5.415 1.00 1.46 H new ATOM 0 HZ3 LYS A 123 1.992 12.582 6.372 1.00 1.46 H new ATOM 1771 N LYS A 124 -0.998 11.109 6.281 1.00 0.43 N ATOM 1772 CA LYS A 124 -1.386 12.392 6.855 1.00 0.50 C ATOM 1773 C LYS A 124 -2.827 12.321 7.355 1.00 0.49 C ATOM 1774 O LYS A 124 -3.214 13.021 8.292 1.00 0.57 O ATOM 1775 CB LYS A 124 -1.201 13.561 5.878 1.00 0.56 C ATOM 1776 CG LYS A 124 -2.410 13.861 5.004 1.00 0.59 C ATOM 1777 CD LYS A 124 -2.122 14.989 4.029 1.00 0.97 C ATOM 1778 CE LYS A 124 -3.379 15.426 3.295 1.00 1.41 C ATOM 1779 NZ LYS A 124 -4.328 16.141 4.189 1.00 1.99 N ATOM 0 H LYS A 124 -0.885 11.096 5.267 1.00 0.43 H new ATOM 0 HA LYS A 124 -0.720 12.589 7.695 1.00 0.50 H new ATOM 0 HB2 LYS A 124 -0.951 14.456 6.448 1.00 0.56 H new ATOM 0 HB3 LYS A 124 -0.349 13.346 5.233 1.00 0.56 H new ATOM 0 HG2 LYS A 124 -2.694 12.965 4.452 1.00 0.59 H new ATOM 0 HG3 LYS A 124 -3.258 14.130 5.633 1.00 0.59 H new ATOM 0 HD2 LYS A 124 -1.700 15.838 4.567 1.00 0.97 H new ATOM 0 HD3 LYS A 124 -1.372 14.665 3.307 1.00 0.97 H new ATOM 0 HE2 LYS A 124 -3.106 16.075 2.463 1.00 1.41 H new ATOM 0 HE3 LYS A 124 -3.872 14.552 2.868 1.00 1.41 H new ATOM 0 HZ1 LYS A 124 -5.078 16.581 3.618 1.00 1.99 H new ATOM 0 HZ2 LYS A 124 -4.752 15.465 4.856 1.00 1.99 H new ATOM 0 HZ3 LYS A 124 -3.819 16.877 4.719 1.00 1.99 H new ATOM 1793 N THR A 125 -3.611 11.454 6.728 1.00 0.42 N ATOM 1794 CA THR A 125 -4.986 11.218 7.154 1.00 0.44 C ATOM 1795 C THR A 125 -5.036 10.094 8.192 1.00 0.44 C ATOM 1796 O THR A 125 -5.953 10.016 9.009 1.00 0.56 O ATOM 1797 CB THR A 125 -5.883 10.856 5.952 1.00 0.49 C ATOM 1798 OG1 THR A 125 -5.768 11.867 4.946 1.00 0.57 O ATOM 1799 CG2 THR A 125 -7.343 10.719 6.365 1.00 0.59 C ATOM 0 H THR A 125 -3.319 10.902 5.922 1.00 0.42 H new ATOM 0 HA THR A 125 -5.361 12.138 7.602 1.00 0.44 H new ATOM 0 HB THR A 125 -5.548 9.895 5.560 1.00 0.49 H new ATOM 0 HG1 THR A 125 -4.955 11.715 4.421 1.00 0.57 H new ATOM 0 HG21 THR A 125 -7.945 10.464 5.493 1.00 0.59 H new ATOM 0 HG22 THR A 125 -7.437 9.933 7.114 1.00 0.59 H new ATOM 0 HG23 THR A 125 -7.693 11.663 6.784 1.00 0.59 H new ATOM 1807 N LYS A 126 -4.034 9.229 8.148 1.00 0.44 N ATOM 1808 CA LYS A 126 -3.949 8.079 9.038 1.00 0.54 C ATOM 1809 C LYS A 126 -2.519 7.886 9.539 1.00 0.57 C ATOM 1810 O LYS A 126 -1.783 7.065 8.992 1.00 0.68 O ATOM 1811 CB LYS A 126 -4.417 6.819 8.304 1.00 0.78 C ATOM 1812 CG LYS A 126 -5.906 6.803 8.026 1.00 1.26 C ATOM 1813 CD LYS A 126 -6.692 6.464 9.278 1.00 0.92 C ATOM 1814 CE LYS A 126 -8.153 6.864 9.146 1.00 1.27 C ATOM 1815 NZ LYS A 126 -8.333 8.339 9.068 1.00 1.85 N ATOM 0 H LYS A 126 -3.255 9.304 7.493 1.00 0.44 H new ATOM 0 HA LYS A 126 -4.594 8.259 9.898 1.00 0.54 H new ATOM 0 HB2 LYS A 126 -3.878 6.736 7.360 1.00 0.78 H new ATOM 0 HB3 LYS A 126 -4.156 5.943 8.898 1.00 0.78 H new ATOM 0 HG2 LYS A 126 -6.219 7.777 7.649 1.00 1.26 H new ATOM 0 HG3 LYS A 126 -6.126 6.074 7.246 1.00 1.26 H new ATOM 0 HD2 LYS A 126 -6.623 5.394 9.473 1.00 0.92 H new ATOM 0 HD3 LYS A 126 -6.251 6.973 10.135 1.00 0.92 H new ATOM 0 HE2 LYS A 126 -8.574 6.402 8.253 1.00 1.27 H new ATOM 0 HE3 LYS A 126 -8.711 6.477 9.999 1.00 1.27 H new ATOM 0 HZ1 LYS A 126 -8.926 8.659 9.860 1.00 1.85 H new ATOM 0 HZ2 LYS A 126 -7.405 8.805 9.121 1.00 1.85 H new ATOM 0 HZ3 LYS A 126 -8.794 8.585 8.169 1.00 1.85 H new ATOM 1829 N PRO A 127 -2.139 8.644 10.594 1.00 0.77 N ATOM 1830 CA PRO A 127 -0.795 8.662 11.194 1.00 1.04 C ATOM 1831 C PRO A 127 0.008 7.368 11.026 1.00 1.27 C ATOM 1832 O PRO A 127 0.792 7.244 10.087 1.00 1.69 O ATOM 1833 CB PRO A 127 -1.124 8.926 12.656 1.00 1.28 C ATOM 1834 CG PRO A 127 -2.302 9.843 12.613 1.00 1.22 C ATOM 1835 CD PRO A 127 -3.023 9.581 11.308 1.00 0.95 C ATOM 0 HA PRO A 127 -0.145 9.396 10.718 1.00 1.04 H new ATOM 0 HB2 PRO A 127 -1.359 8.002 13.183 1.00 1.28 H new ATOM 0 HB3 PRO A 127 -0.283 9.384 13.176 1.00 1.28 H new ATOM 0 HG2 PRO A 127 -2.962 9.662 13.461 1.00 1.22 H new ATOM 0 HG3 PRO A 127 -1.983 10.883 12.674 1.00 1.22 H new ATOM 0 HD2 PRO A 127 -4.009 9.149 11.477 1.00 0.95 H new ATOM 0 HD3 PRO A 127 -3.170 10.501 10.742 1.00 0.95 H new ATOM 1843 N GLY A 128 -0.201 6.398 11.910 1.00 1.55 N ATOM 1844 CA GLY A 128 0.566 5.167 11.840 1.00 1.96 C ATOM 1845 C GLY A 128 0.415 4.312 13.079 1.00 2.13 C ATOM 1846 O GLY A 128 1.403 3.982 13.733 1.00 2.59 O ATOM 0 H GLY A 128 -0.882 6.441 12.668 1.00 1.55 H new ATOM 0 HA2 GLY A 128 0.248 4.595 10.968 1.00 1.96 H new ATOM 0 HA3 GLY A 128 1.619 5.408 11.696 1.00 1.96 H new ATOM 1850 N ILE A 129 -0.830 3.955 13.396 1.00 2.17 N ATOM 1851 CA ILE A 129 -1.146 3.158 14.584 1.00 2.46 C ATOM 1852 C ILE A 129 -0.720 3.930 15.833 1.00 2.36 C ATOM 1853 O ILE A 129 -0.358 3.367 16.869 1.00 2.70 O ATOM 1854 CB ILE A 129 -0.476 1.759 14.549 1.00 2.91 C ATOM 1855 CG1 ILE A 129 -0.638 1.122 13.165 1.00 3.06 C ATOM 1856 CG2 ILE A 129 -1.091 0.848 15.604 1.00 3.44 C ATOM 1857 CD1 ILE A 129 0.034 -0.230 13.025 1.00 3.58 C ATOM 0 H ILE A 129 -1.646 4.209 12.839 1.00 2.17 H new ATOM 0 HA ILE A 129 -2.222 2.987 14.603 1.00 2.46 H new ATOM 0 HB ILE A 129 0.586 1.885 14.761 1.00 2.91 H new ATOM 0 HG12 ILE A 129 -1.701 1.012 12.949 1.00 3.06 H new ATOM 0 HG13 ILE A 129 -0.229 1.799 12.415 1.00 3.06 H new ATOM 0 HG21 ILE A 129 -0.610 -0.129 15.566 1.00 3.44 H new ATOM 0 HG22 ILE A 129 -0.946 1.286 16.592 1.00 3.44 H new ATOM 0 HG23 ILE A 129 -2.158 0.735 15.410 1.00 3.44 H new ATOM 0 HD11 ILE A 129 -0.127 -0.614 12.017 1.00 3.58 H new ATOM 0 HD12 ILE A 129 1.104 -0.125 13.207 1.00 3.58 H new ATOM 0 HD13 ILE A 129 -0.391 -0.924 13.750 1.00 3.58 H new ATOM 1869 N LEU A 130 -0.760 5.244 15.702 1.00 2.12 N ATOM 1870 CA LEU A 130 -0.388 6.150 16.771 1.00 2.29 C ATOM 1871 C LEU A 130 -0.974 7.524 16.466 1.00 2.20 C ATOM 1872 O LEU A 130 -1.664 7.682 15.460 1.00 2.44 O ATOM 1873 CB LEU A 130 1.144 6.218 16.887 1.00 2.58 C ATOM 1874 CG LEU A 130 1.695 6.974 18.099 1.00 2.89 C ATOM 1875 CD1 LEU A 130 1.217 6.340 19.396 1.00 3.36 C ATOM 1876 CD2 LEU A 130 3.214 7.011 18.055 1.00 3.47 C ATOM 0 H LEU A 130 -1.053 5.714 14.846 1.00 2.12 H new ATOM 0 HA LEU A 130 -0.781 5.796 17.724 1.00 2.29 H new ATOM 0 HB2 LEU A 130 1.532 5.200 16.913 1.00 2.58 H new ATOM 0 HB3 LEU A 130 1.536 6.686 15.984 1.00 2.58 H new ATOM 0 HG LEU A 130 1.320 7.997 18.062 1.00 2.89 H new ATOM 0 HD11 LEU A 130 1.621 6.895 20.243 1.00 3.36 H new ATOM 0 HD12 LEU A 130 0.128 6.364 19.433 1.00 3.36 H new ATOM 0 HD13 LEU A 130 1.559 5.306 19.443 1.00 3.36 H new ATOM 0 HD21 LEU A 130 3.590 7.552 18.923 1.00 3.47 H new ATOM 0 HD22 LEU A 130 3.603 5.993 18.065 1.00 3.47 H new ATOM 0 HD23 LEU A 130 3.539 7.515 17.145 1.00 3.47 H new ATOM 1888 N ALA A 131 -0.722 8.506 17.317 1.00 2.45 N ATOM 1889 CA ALA A 131 -1.153 9.869 17.040 1.00 2.67 C ATOM 1890 C ALA A 131 -0.284 10.475 15.944 1.00 2.55 C ATOM 1891 O ALA A 131 -0.663 11.451 15.292 1.00 3.21 O ATOM 1892 CB ALA A 131 -1.096 10.711 18.302 1.00 3.28 C ATOM 0 H ALA A 131 -0.225 8.387 18.200 1.00 2.45 H new ATOM 0 HA ALA A 131 -2.186 9.851 16.694 1.00 2.67 H new ATOM 0 HB1 ALA A 131 -1.421 11.727 18.077 1.00 3.28 H new ATOM 0 HB2 ALA A 131 -1.752 10.279 19.058 1.00 3.28 H new ATOM 0 HB3 ALA A 131 -0.073 10.733 18.679 1.00 3.28 H new ATOM 1898 N THR A 132 0.888 9.884 15.758 1.00 2.02 N ATOM 1899 CA THR A 132 1.813 10.288 14.712 1.00 2.10 C ATOM 1900 C THR A 132 2.281 9.049 13.950 1.00 1.56 C ATOM 1901 O THR A 132 1.517 8.096 13.800 1.00 2.12 O ATOM 1902 CB THR A 132 3.039 10.991 15.312 1.00 2.73 C ATOM 1903 OG1 THR A 132 2.731 11.495 16.621 1.00 3.34 O ATOM 1904 CG2 THR A 132 3.502 12.138 14.428 1.00 3.56 C ATOM 0 H THR A 132 1.224 9.109 16.330 1.00 2.02 H new ATOM 0 HA THR A 132 1.300 10.979 14.042 1.00 2.10 H new ATOM 0 HB THR A 132 3.842 10.257 15.381 1.00 2.73 H new ATOM 0 HG1 THR A 132 3.520 11.940 16.994 1.00 3.34 H new ATOM 0 HG21 THR A 132 4.371 12.617 14.879 1.00 3.56 H new ATOM 0 HG22 THR A 132 3.769 11.754 13.443 1.00 3.56 H new ATOM 0 HG23 THR A 132 2.698 12.867 14.327 1.00 3.56 H new ATOM 1912 N LYS A 133 3.539 9.070 13.492 1.00 1.29 N ATOM 1913 CA LYS A 133 4.155 7.943 12.787 1.00 1.47 C ATOM 1914 C LYS A 133 3.679 7.905 11.335 1.00 1.14 C ATOM 1915 O LYS A 133 3.130 8.886 10.833 1.00 1.58 O ATOM 1916 CB LYS A 133 3.852 6.611 13.496 1.00 2.24 C ATOM 1917 CG LYS A 133 5.047 5.680 13.600 1.00 3.04 C ATOM 1918 CD LYS A 133 6.120 6.255 14.511 1.00 3.81 C ATOM 1919 CE LYS A 133 7.288 5.295 14.675 1.00 4.63 C ATOM 1920 NZ LYS A 133 6.860 3.995 15.255 1.00 5.17 N ATOM 0 H LYS A 133 4.159 9.873 13.601 1.00 1.29 H new ATOM 0 HA LYS A 133 5.236 8.084 12.796 1.00 1.47 H new ATOM 0 HB2 LYS A 133 3.480 6.822 14.499 1.00 2.24 H new ATOM 0 HB3 LYS A 133 3.052 6.100 12.960 1.00 2.24 H new ATOM 0 HG2 LYS A 133 4.724 4.712 13.982 1.00 3.04 H new ATOM 0 HG3 LYS A 133 5.464 5.508 12.608 1.00 3.04 H new ATOM 0 HD2 LYS A 133 6.479 7.199 14.101 1.00 3.81 H new ATOM 0 HD3 LYS A 133 5.689 6.475 15.488 1.00 3.81 H new ATOM 0 HE2 LYS A 133 7.756 5.124 13.706 1.00 4.63 H new ATOM 0 HE3 LYS A 133 8.043 5.748 15.317 1.00 4.63 H new ATOM 0 HZ1 LYS A 133 7.518 3.719 16.012 1.00 5.17 H new ATOM 0 HZ2 LYS A 133 5.901 4.089 15.647 1.00 5.17 H new ATOM 0 HZ3 LYS A 133 6.861 3.267 14.513 1.00 5.17 H new ATOM 1934 N ALA A 134 3.907 6.782 10.664 1.00 0.92 N ATOM 1935 CA ALA A 134 3.562 6.638 9.255 1.00 0.77 C ATOM 1936 C ALA A 134 3.590 5.169 8.850 1.00 0.81 C ATOM 1937 O ALA A 134 3.700 4.287 9.702 1.00 1.59 O ATOM 1938 CB ALA A 134 4.532 7.434 8.389 1.00 1.02 C ATOM 0 H ALA A 134 4.333 5.952 11.077 1.00 0.92 H new ATOM 0 HA ALA A 134 2.554 7.026 9.105 1.00 0.77 H new ATOM 0 HB1 ALA A 134 4.262 7.317 7.339 1.00 1.02 H new ATOM 0 HB2 ALA A 134 4.482 8.488 8.661 1.00 1.02 H new ATOM 0 HB3 ALA A 134 5.546 7.066 8.546 1.00 1.02 H new ATOM 1944 N ILE A 135 3.480 4.922 7.549 1.00 0.69 N ATOM 1945 CA ILE A 135 3.739 3.604 6.965 1.00 0.74 C ATOM 1946 C ILE A 135 5.242 3.256 7.101 1.00 1.09 C ATOM 1947 O ILE A 135 5.895 2.925 6.123 1.00 2.00 O ATOM 1948 CB ILE A 135 3.368 3.575 5.461 1.00 0.86 C ATOM 1949 CG1 ILE A 135 3.196 4.986 4.879 1.00 0.88 C ATOM 1950 CG2 ILE A 135 2.107 2.766 5.249 1.00 1.54 C ATOM 1951 CD1 ILE A 135 4.482 5.774 4.749 1.00 0.89 C ATOM 0 H ILE A 135 3.208 5.629 6.866 1.00 0.69 H new ATOM 0 HA ILE A 135 3.126 2.878 7.500 1.00 0.74 H new ATOM 0 HB ILE A 135 4.196 3.103 4.931 1.00 0.86 H new ATOM 0 HG12 ILE A 135 2.733 4.905 3.895 1.00 0.88 H new ATOM 0 HG13 ILE A 135 2.505 5.544 5.511 1.00 0.88 H new ATOM 0 HG21 ILE A 135 1.857 2.753 4.188 1.00 1.54 H new ATOM 0 HG22 ILE A 135 2.267 1.745 5.596 1.00 1.54 H new ATOM 0 HG23 ILE A 135 1.288 3.216 5.810 1.00 1.54 H new ATOM 0 HD11 ILE A 135 4.266 6.757 4.330 1.00 0.89 H new ATOM 0 HD12 ILE A 135 4.938 5.891 5.732 1.00 0.89 H new ATOM 0 HD13 ILE A 135 5.170 5.242 4.091 1.00 0.89 H new ATOM 1963 N LYS A 136 5.788 3.348 8.313 1.00 0.85 N ATOM 1964 CA LYS A 136 7.243 3.270 8.525 1.00 1.14 C ATOM 1965 C LYS A 136 7.706 1.815 8.683 1.00 0.75 C ATOM 1966 O LYS A 136 8.568 1.495 9.503 1.00 0.78 O ATOM 1967 CB LYS A 136 7.625 4.103 9.762 1.00 1.71 C ATOM 1968 CG LYS A 136 9.042 4.665 9.728 1.00 2.72 C ATOM 1969 CD LYS A 136 10.051 3.768 10.437 1.00 3.21 C ATOM 1970 CE LYS A 136 11.477 4.207 10.135 1.00 4.09 C ATOM 1971 NZ LYS A 136 12.490 3.245 10.648 1.00 4.81 N ATOM 0 H LYS A 136 5.248 3.477 9.168 1.00 0.85 H new ATOM 0 HA LYS A 136 7.747 3.677 7.648 1.00 1.14 H new ATOM 0 HB2 LYS A 136 6.921 4.930 9.860 1.00 1.71 H new ATOM 0 HB3 LYS A 136 7.514 3.483 10.651 1.00 1.71 H new ATOM 0 HG2 LYS A 136 9.349 4.801 8.691 1.00 2.72 H new ATOM 0 HG3 LYS A 136 9.048 5.650 10.194 1.00 2.72 H new ATOM 0 HD2 LYS A 136 9.877 3.798 11.513 1.00 3.21 H new ATOM 0 HD3 LYS A 136 9.910 2.735 10.120 1.00 3.21 H new ATOM 0 HE2 LYS A 136 11.599 4.318 9.058 1.00 4.09 H new ATOM 0 HE3 LYS A 136 11.654 5.187 10.579 1.00 4.09 H new ATOM 0 HZ1 LYS A 136 13.427 3.696 10.649 1.00 4.81 H new ATOM 0 HZ2 LYS A 136 12.240 2.962 11.617 1.00 4.81 H new ATOM 0 HZ3 LYS A 136 12.511 2.404 10.036 1.00 4.81 H new ATOM 1985 N TRP A 137 7.121 0.939 7.892 1.00 0.69 N ATOM 1986 CA TRP A 137 7.413 -0.486 7.947 1.00 0.45 C ATOM 1987 C TRP A 137 7.414 -1.062 6.550 1.00 0.43 C ATOM 1988 O TRP A 137 7.185 -0.341 5.588 1.00 0.55 O ATOM 1989 CB TRP A 137 6.380 -1.253 8.780 1.00 0.42 C ATOM 1990 CG TRP A 137 6.530 -1.112 10.253 1.00 0.62 C ATOM 1991 CD1 TRP A 137 7.012 -2.039 11.129 1.00 0.93 C ATOM 1992 CD2 TRP A 137 6.163 0.025 11.026 1.00 1.00 C ATOM 1993 NE1 TRP A 137 7.020 -1.512 12.395 1.00 1.11 N ATOM 1994 CE2 TRP A 137 6.495 -0.248 12.356 1.00 1.16 C ATOM 1995 CE3 TRP A 137 5.605 1.258 10.710 1.00 1.47 C ATOM 1996 CZ2 TRP A 137 6.284 0.673 13.373 1.00 1.59 C ATOM 1997 CZ3 TRP A 137 5.396 2.173 11.710 1.00 1.97 C ATOM 1998 CH2 TRP A 137 5.737 1.880 13.034 1.00 1.97 C ATOM 0 H TRP A 137 6.427 1.192 7.189 1.00 0.69 H new ATOM 0 HA TRP A 137 8.391 -0.595 8.416 1.00 0.45 H new ATOM 0 HB2 TRP A 137 5.383 -0.914 8.497 1.00 0.42 H new ATOM 0 HB3 TRP A 137 6.441 -2.311 8.523 1.00 0.42 H new ATOM 0 HD1 TRP A 137 7.337 -3.035 10.866 1.00 0.93 H new ATOM 0 HE1 TRP A 137 7.362 -1.985 13.231 1.00 1.11 H new ATOM 0 HE3 TRP A 137 5.339 1.493 9.690 1.00 1.47 H new ATOM 0 HZ2 TRP A 137 6.543 0.444 14.396 1.00 1.59 H new ATOM 0 HZ3 TRP A 137 4.962 3.133 11.472 1.00 1.97 H new ATOM 0 HH2 TRP A 137 5.566 2.619 13.802 1.00 1.97 H new ATOM 2009 N ASN A 138 7.759 -2.335 6.451 1.00 0.37 N ATOM 2010 CA ASN A 138 7.453 -3.168 5.278 1.00 0.38 C ATOM 2011 C ASN A 138 5.999 -2.956 4.803 1.00 0.31 C ATOM 2012 O ASN A 138 5.399 -1.937 5.065 1.00 0.30 O ATOM 2013 CB ASN A 138 7.688 -4.649 5.594 1.00 0.41 C ATOM 2014 CG ASN A 138 9.045 -4.908 6.222 1.00 1.06 C ATOM 2015 OD1 ASN A 138 9.181 -4.886 7.443 1.00 2.04 O ATOM 2016 ND2 ASN A 138 10.055 -5.153 5.398 1.00 1.40 N ATOM 0 H ASN A 138 8.264 -2.833 7.184 1.00 0.37 H new ATOM 0 HA ASN A 138 8.123 -2.864 4.474 1.00 0.38 H new ATOM 0 HB2 ASN A 138 6.907 -5.000 6.269 1.00 0.41 H new ATOM 0 HB3 ASN A 138 7.601 -5.230 4.676 1.00 0.41 H new ATOM 0 HD21 ASN A 138 10.987 -5.332 5.772 1.00 1.40 H new ATOM 0 HD22 ASN A 138 9.900 -5.162 4.390 1.00 1.40 H new ATOM 2023 N PHE A 139 5.458 -3.942 4.098 1.00 0.34 N ATOM 2024 CA PHE A 139 4.180 -3.854 3.355 1.00 0.36 C ATOM 2025 C PHE A 139 3.067 -2.918 3.919 1.00 0.32 C ATOM 2026 O PHE A 139 2.236 -2.516 3.131 1.00 0.57 O ATOM 2027 CB PHE A 139 3.605 -5.256 3.273 1.00 0.55 C ATOM 2028 CG PHE A 139 3.913 -6.007 2.015 1.00 0.55 C ATOM 2029 CD1 PHE A 139 5.211 -6.386 1.676 1.00 0.61 C ATOM 2030 CD2 PHE A 139 2.875 -6.376 1.188 1.00 1.23 C ATOM 2031 CE1 PHE A 139 5.443 -7.117 0.526 1.00 1.22 C ATOM 2032 CE2 PHE A 139 3.102 -7.108 0.050 1.00 1.93 C ATOM 2033 CZ PHE A 139 4.387 -7.484 -0.283 1.00 1.89 C ATOM 0 H PHE A 139 5.900 -4.858 4.017 1.00 0.34 H new ATOM 0 HA PHE A 139 4.451 -3.402 2.401 1.00 0.36 H new ATOM 0 HB2 PHE A 139 3.977 -5.833 4.120 1.00 0.55 H new ATOM 0 HB3 PHE A 139 2.522 -5.193 3.382 1.00 0.55 H new ATOM 0 HD1 PHE A 139 6.037 -6.108 2.313 1.00 0.61 H new ATOM 0 HD2 PHE A 139 1.866 -6.084 1.440 1.00 1.23 H new ATOM 0 HE1 PHE A 139 6.451 -7.401 0.261 1.00 1.22 H new ATOM 0 HE2 PHE A 139 2.275 -7.390 -0.585 1.00 1.93 H new ATOM 0 HZ PHE A 139 4.566 -8.065 -1.176 1.00 1.89 H new ATOM 2043 N THR A 140 3.012 -2.636 5.240 1.00 0.25 N ATOM 2044 CA THR A 140 2.107 -1.632 5.847 1.00 0.25 C ATOM 2045 C THR A 140 1.080 -1.034 4.885 1.00 0.22 C ATOM 2046 O THR A 140 1.380 -0.150 4.076 1.00 0.29 O ATOM 2047 CB THR A 140 2.909 -0.485 6.477 1.00 0.37 C ATOM 2048 OG1 THR A 140 4.092 -1.007 7.069 1.00 0.48 O ATOM 2049 CG2 THR A 140 2.097 0.241 7.541 1.00 0.60 C ATOM 0 H THR A 140 3.604 -3.106 5.925 1.00 0.25 H new ATOM 0 HA THR A 140 1.551 -2.187 6.603 1.00 0.25 H new ATOM 0 HB THR A 140 3.159 0.227 5.690 1.00 0.37 H new ATOM 0 HG1 THR A 140 4.772 -1.141 6.377 1.00 0.48 H new ATOM 0 HG21 THR A 140 2.694 1.047 7.967 1.00 0.60 H new ATOM 0 HG22 THR A 140 1.195 0.656 7.090 1.00 0.60 H new ATOM 0 HG23 THR A 140 1.819 -0.460 8.328 1.00 0.60 H new ATOM 2057 N SER A 141 -0.133 -1.505 5.023 1.00 0.19 N ATOM 2058 CA SER A 141 -1.210 -1.182 4.098 1.00 0.20 C ATOM 2059 C SER A 141 -1.983 0.039 4.566 1.00 0.22 C ATOM 2060 O SER A 141 -1.732 0.542 5.651 1.00 0.39 O ATOM 2061 CB SER A 141 -2.150 -2.363 4.032 1.00 0.26 C ATOM 2062 OG SER A 141 -1.431 -3.574 4.158 1.00 0.62 O ATOM 0 H SER A 141 -0.411 -2.127 5.782 1.00 0.19 H new ATOM 0 HA SER A 141 -0.784 -0.965 3.119 1.00 0.20 H new ATOM 0 HB2 SER A 141 -2.893 -2.289 4.826 1.00 0.26 H new ATOM 0 HB3 SER A 141 -2.692 -2.352 3.087 1.00 0.26 H new ATOM 0 HG SER A 141 -1.239 -3.935 3.267 1.00 0.62 H new ATOM 2068 N PHE A 142 -2.907 0.512 3.741 1.00 0.19 N ATOM 2069 CA PHE A 142 -3.934 1.441 4.165 1.00 0.18 C ATOM 2070 C PHE A 142 -5.221 0.901 3.627 1.00 0.18 C ATOM 2071 O PHE A 142 -5.342 0.688 2.433 1.00 0.21 O ATOM 2072 CB PHE A 142 -3.718 2.842 3.601 1.00 0.22 C ATOM 2073 CG PHE A 142 -2.636 3.639 4.264 1.00 0.26 C ATOM 2074 CD1 PHE A 142 -2.897 4.350 5.423 1.00 0.35 C ATOM 2075 CD2 PHE A 142 -1.373 3.712 3.705 1.00 0.42 C ATOM 2076 CE1 PHE A 142 -1.915 5.118 6.015 1.00 0.50 C ATOM 2077 CE2 PHE A 142 -0.389 4.474 4.295 1.00 0.55 C ATOM 2078 CZ PHE A 142 -0.659 5.178 5.450 1.00 0.57 C ATOM 0 H PHE A 142 -2.962 0.258 2.755 1.00 0.19 H new ATOM 0 HA PHE A 142 -3.924 1.530 5.251 1.00 0.18 H new ATOM 0 HB2 PHE A 142 -3.485 2.757 2.540 1.00 0.22 H new ATOM 0 HB3 PHE A 142 -4.654 3.395 3.679 1.00 0.22 H new ATOM 0 HD1 PHE A 142 -3.880 4.303 5.869 1.00 0.35 H new ATOM 0 HD2 PHE A 142 -1.157 3.167 2.798 1.00 0.42 H new ATOM 0 HE1 PHE A 142 -2.130 5.670 6.918 1.00 0.50 H new ATOM 0 HE2 PHE A 142 0.595 4.520 3.853 1.00 0.55 H new ATOM 0 HZ PHE A 142 0.113 5.776 5.911 1.00 0.57 H new ATOM 2088 N LEU A 143 -6.176 0.648 4.464 1.00 0.17 N ATOM 2089 CA LEU A 143 -7.406 0.149 3.953 1.00 0.16 C ATOM 2090 C LEU A 143 -8.198 1.302 3.410 1.00 0.15 C ATOM 2091 O LEU A 143 -8.747 2.122 4.139 1.00 0.18 O ATOM 2092 CB LEU A 143 -8.166 -0.629 5.003 1.00 0.21 C ATOM 2093 CG LEU A 143 -9.677 -0.679 4.801 1.00 0.23 C ATOM 2094 CD1 LEU A 143 -10.051 -1.512 3.587 1.00 0.41 C ATOM 2095 CD2 LEU A 143 -10.362 -1.209 6.043 1.00 0.43 C ATOM 0 H LEU A 143 -6.130 0.775 5.475 1.00 0.17 H new ATOM 0 HA LEU A 143 -7.212 -0.557 3.145 1.00 0.16 H new ATOM 0 HB2 LEU A 143 -7.784 -1.649 5.025 1.00 0.21 H new ATOM 0 HB3 LEU A 143 -7.959 -0.190 5.979 1.00 0.21 H new ATOM 0 HG LEU A 143 -10.021 0.340 4.620 1.00 0.23 H new ATOM 0 HD11 LEU A 143 -11.135 -1.525 3.475 1.00 0.41 H new ATOM 0 HD12 LEU A 143 -9.599 -1.078 2.695 1.00 0.41 H new ATOM 0 HD13 LEU A 143 -9.688 -2.531 3.719 1.00 0.41 H new ATOM 0 HD21 LEU A 143 -11.439 -1.237 5.880 1.00 0.43 H new ATOM 0 HD22 LEU A 143 -10.001 -2.215 6.257 1.00 0.43 H new ATOM 0 HD23 LEU A 143 -10.140 -0.557 6.887 1.00 0.43 H new ATOM 2107 N ILE A 144 -8.194 1.350 2.111 1.00 0.14 N ATOM 2108 CA ILE A 144 -8.838 2.373 1.358 1.00 0.14 C ATOM 2109 C ILE A 144 -10.263 1.926 1.104 1.00 0.15 C ATOM 2110 O ILE A 144 -10.498 0.746 0.870 1.00 0.19 O ATOM 2111 CB ILE A 144 -8.095 2.554 0.030 1.00 0.15 C ATOM 2112 CG1 ILE A 144 -6.604 2.799 0.247 1.00 0.17 C ATOM 2113 CG2 ILE A 144 -8.717 3.667 -0.772 1.00 0.17 C ATOM 2114 CD1 ILE A 144 -6.290 4.067 0.973 1.00 0.19 C ATOM 0 H ILE A 144 -7.726 0.653 1.532 1.00 0.14 H new ATOM 0 HA ILE A 144 -8.834 3.322 1.894 1.00 0.14 H new ATOM 0 HB ILE A 144 -8.189 1.627 -0.535 1.00 0.15 H new ATOM 0 HG12 ILE A 144 -6.187 1.961 0.806 1.00 0.17 H new ATOM 0 HG13 ILE A 144 -6.105 2.815 -0.722 1.00 0.17 H new ATOM 0 HG21 ILE A 144 -8.178 3.783 -1.712 1.00 0.17 H new ATOM 0 HG22 ILE A 144 -9.760 3.427 -0.979 1.00 0.17 H new ATOM 0 HG23 ILE A 144 -8.664 4.597 -0.206 1.00 0.17 H new ATOM 0 HD11 ILE A 144 -5.210 4.164 1.085 1.00 0.19 H new ATOM 0 HD12 ILE A 144 -6.674 4.915 0.406 1.00 0.19 H new ATOM 0 HD13 ILE A 144 -6.757 4.048 1.958 1.00 0.19 H new ATOM 2126 N ASP A 145 -11.212 2.836 1.152 1.00 0.14 N ATOM 2127 CA ASP A 145 -12.617 2.414 1.124 1.00 0.15 C ATOM 2128 C ASP A 145 -13.178 2.437 -0.298 1.00 0.14 C ATOM 2129 O ASP A 145 -12.437 2.686 -1.247 1.00 0.15 O ATOM 2130 CB ASP A 145 -13.466 3.256 2.091 1.00 0.19 C ATOM 2131 CG ASP A 145 -14.357 4.274 1.400 1.00 0.58 C ATOM 2132 OD1 ASP A 145 -13.819 5.270 0.863 1.00 0.98 O ATOM 2133 OD2 ASP A 145 -15.587 4.109 1.428 1.00 0.75 O ATOM 0 H ASP A 145 -11.057 3.843 1.209 1.00 0.14 H new ATOM 0 HA ASP A 145 -12.664 1.380 1.467 1.00 0.15 H new ATOM 0 HB2 ASP A 145 -14.088 2.589 2.688 1.00 0.19 H new ATOM 0 HB3 ASP A 145 -12.803 3.777 2.782 1.00 0.19 H new ATOM 2138 N ARG A 146 -14.475 2.165 -0.441 1.00 0.17 N ATOM 2139 CA ARG A 146 -15.112 2.086 -1.754 1.00 0.17 C ATOM 2140 C ARG A 146 -14.908 3.370 -2.555 1.00 0.18 C ATOM 2141 O ARG A 146 -14.791 3.337 -3.776 1.00 0.22 O ATOM 2142 CB ARG A 146 -16.608 1.816 -1.610 1.00 0.19 C ATOM 2143 CG ARG A 146 -16.938 0.614 -0.740 1.00 0.24 C ATOM 2144 CD ARG A 146 -18.391 0.208 -0.888 1.00 0.29 C ATOM 2145 NE ARG A 146 -19.290 1.341 -0.689 1.00 1.00 N ATOM 2146 CZ ARG A 146 -20.383 1.556 -1.419 1.00 1.46 C ATOM 2147 NH1 ARG A 146 -20.718 0.713 -2.390 1.00 1.63 N ATOM 2148 NH2 ARG A 146 -21.143 2.620 -1.180 1.00 2.22 N ATOM 0 H ARG A 146 -15.107 1.995 0.341 1.00 0.17 H new ATOM 0 HA ARG A 146 -14.641 1.262 -2.291 1.00 0.17 H new ATOM 0 HB2 ARG A 146 -17.087 2.699 -1.188 1.00 0.19 H new ATOM 0 HB3 ARG A 146 -17.036 1.663 -2.601 1.00 0.19 H new ATOM 0 HG2 ARG A 146 -16.295 -0.223 -1.013 1.00 0.24 H new ATOM 0 HG3 ARG A 146 -16.729 0.849 0.303 1.00 0.24 H new ATOM 0 HD2 ARG A 146 -18.552 -0.215 -1.880 1.00 0.29 H new ATOM 0 HD3 ARG A 146 -18.626 -0.574 -0.166 1.00 0.29 H new ATOM 0 HE ARG A 146 -19.068 2.006 0.052 1.00 1.00 H new ATOM 0 HH11 ARG A 146 -20.137 -0.104 -2.579 1.00 1.63 H new ATOM 0 HH12 ARG A 146 -21.556 0.883 -2.946 1.00 1.63 H new ATOM 0 HH21 ARG A 146 -20.889 3.272 -0.438 1.00 2.22 H new ATOM 0 HH22 ARG A 146 -21.980 2.785 -1.739 1.00 2.22 H new ATOM 2162 N ASP A 147 -14.862 4.502 -1.871 1.00 0.18 N ATOM 2163 CA ASP A 147 -14.681 5.781 -2.545 1.00 0.21 C ATOM 2164 C ASP A 147 -13.261 6.261 -2.362 1.00 0.18 C ATOM 2165 O ASP A 147 -12.983 7.445 -2.487 1.00 0.24 O ATOM 2166 CB ASP A 147 -15.657 6.835 -2.017 1.00 0.28 C ATOM 2167 CG ASP A 147 -17.105 6.459 -2.240 1.00 1.09 C ATOM 2168 OD1 ASP A 147 -17.583 6.556 -3.390 1.00 1.19 O ATOM 2169 OD2 ASP A 147 -17.777 6.079 -1.262 1.00 2.00 O ATOM 0 H ASP A 147 -14.947 4.563 -0.856 1.00 0.18 H new ATOM 0 HA ASP A 147 -14.885 5.634 -3.606 1.00 0.21 H new ATOM 0 HB2 ASP A 147 -15.485 6.981 -0.951 1.00 0.28 H new ATOM 0 HB3 ASP A 147 -15.455 7.788 -2.506 1.00 0.28 H new ATOM 2174 N GLY A 148 -12.359 5.328 -2.093 1.00 0.16 N ATOM 2175 CA GLY A 148 -10.963 5.659 -1.942 1.00 0.16 C ATOM 2176 C GLY A 148 -10.644 6.441 -0.688 1.00 0.15 C ATOM 2177 O GLY A 148 -9.788 7.322 -0.717 1.00 0.17 O ATOM 0 H GLY A 148 -12.576 4.338 -1.976 1.00 0.16 H new ATOM 0 HA2 GLY A 148 -10.381 4.738 -1.940 1.00 0.16 H new ATOM 0 HA3 GLY A 148 -10.642 6.237 -2.809 1.00 0.16 H new ATOM 2181 N VAL A 149 -11.303 6.146 0.414 1.00 0.17 N ATOM 2182 CA VAL A 149 -10.949 6.792 1.668 1.00 0.18 C ATOM 2183 C VAL A 149 -10.225 5.823 2.606 1.00 0.17 C ATOM 2184 O VAL A 149 -10.816 4.883 3.127 1.00 0.24 O ATOM 2185 CB VAL A 149 -12.175 7.394 2.386 1.00 0.28 C ATOM 2186 CG1 VAL A 149 -11.753 8.098 3.669 1.00 0.97 C ATOM 2187 CG2 VAL A 149 -12.915 8.356 1.467 1.00 1.12 C ATOM 0 H VAL A 149 -12.071 5.478 0.472 1.00 0.17 H new ATOM 0 HA VAL A 149 -10.276 7.610 1.411 1.00 0.18 H new ATOM 0 HB VAL A 149 -12.852 6.581 2.648 1.00 0.28 H new ATOM 0 HG11 VAL A 149 -12.632 8.516 4.161 1.00 0.97 H new ATOM 0 HG12 VAL A 149 -11.270 7.383 4.335 1.00 0.97 H new ATOM 0 HG13 VAL A 149 -11.055 8.900 3.431 1.00 0.97 H new ATOM 0 HG21 VAL A 149 -13.776 8.770 1.991 1.00 1.12 H new ATOM 0 HG22 VAL A 149 -12.246 9.165 1.172 1.00 1.12 H new ATOM 0 HG23 VAL A 149 -13.253 7.823 0.578 1.00 1.12 H new ATOM 2197 N PRO A 150 -8.914 6.038 2.782 1.00 0.21 N ATOM 2198 CA PRO A 150 -8.084 5.286 3.732 1.00 0.20 C ATOM 2199 C PRO A 150 -8.617 5.415 5.158 1.00 0.23 C ATOM 2200 O PRO A 150 -8.529 6.482 5.770 1.00 0.34 O ATOM 2201 CB PRO A 150 -6.708 5.952 3.643 1.00 0.26 C ATOM 2202 CG PRO A 150 -6.895 7.200 2.847 1.00 0.29 C ATOM 2203 CD PRO A 150 -8.148 7.039 2.049 1.00 0.41 C ATOM 0 HA PRO A 150 -8.068 4.222 3.496 1.00 0.20 H new ATOM 0 HB2 PRO A 150 -6.322 6.179 4.637 1.00 0.26 H new ATOM 0 HB3 PRO A 150 -5.986 5.290 3.164 1.00 0.26 H new ATOM 0 HG2 PRO A 150 -6.967 8.067 3.504 1.00 0.29 H new ATOM 0 HG3 PRO A 150 -6.041 7.368 2.191 1.00 0.29 H new ATOM 0 HD2 PRO A 150 -8.694 7.979 1.971 1.00 0.41 H new ATOM 0 HD3 PRO A 150 -7.933 6.710 1.032 1.00 0.41 H new ATOM 2211 N VAL A 151 -9.155 4.335 5.690 1.00 0.22 N ATOM 2212 CA VAL A 151 -9.758 4.359 7.007 1.00 0.29 C ATOM 2213 C VAL A 151 -8.881 3.597 7.981 1.00 0.32 C ATOM 2214 O VAL A 151 -8.904 3.840 9.186 1.00 0.61 O ATOM 2215 CB VAL A 151 -11.189 3.770 6.998 1.00 0.42 C ATOM 2216 CG1 VAL A 151 -12.136 4.679 6.231 1.00 1.45 C ATOM 2217 CG2 VAL A 151 -11.200 2.368 6.401 1.00 1.13 C ATOM 0 H VAL A 151 -9.186 3.426 5.228 1.00 0.22 H new ATOM 0 HA VAL A 151 -9.839 5.399 7.322 1.00 0.29 H new ATOM 0 HB VAL A 151 -11.531 3.702 8.031 1.00 0.42 H new ATOM 0 HG11 VAL A 151 -13.137 4.248 6.236 1.00 1.45 H new ATOM 0 HG12 VAL A 151 -12.161 5.661 6.704 1.00 1.45 H new ATOM 0 HG13 VAL A 151 -11.790 4.781 5.203 1.00 1.45 H new ATOM 0 HG21 VAL A 151 -12.218 1.978 6.407 1.00 1.13 H new ATOM 0 HG22 VAL A 151 -10.832 2.406 5.376 1.00 1.13 H new ATOM 0 HG23 VAL A 151 -10.558 1.716 6.993 1.00 1.13 H new ATOM 2227 N GLU A 152 -8.079 2.697 7.435 1.00 0.19 N ATOM 2228 CA GLU A 152 -7.165 1.896 8.237 1.00 0.20 C ATOM 2229 C GLU A 152 -5.795 1.879 7.613 1.00 0.20 C ATOM 2230 O GLU A 152 -5.598 2.343 6.498 1.00 0.19 O ATOM 2231 CB GLU A 152 -7.620 0.443 8.361 1.00 0.21 C ATOM 2232 CG GLU A 152 -9.061 0.285 8.747 1.00 0.57 C ATOM 2233 CD GLU A 152 -9.346 0.758 10.160 1.00 0.63 C ATOM 2234 OE1 GLU A 152 -8.525 0.494 11.058 1.00 1.17 O ATOM 2235 OE2 GLU A 152 -10.400 1.402 10.376 1.00 1.17 O ATOM 0 H GLU A 152 -8.042 2.501 6.435 1.00 0.19 H new ATOM 0 HA GLU A 152 -7.148 2.357 9.225 1.00 0.20 H new ATOM 0 HB2 GLU A 152 -7.452 -0.062 7.410 1.00 0.21 H new ATOM 0 HB3 GLU A 152 -6.999 -0.059 9.103 1.00 0.21 H new ATOM 0 HG2 GLU A 152 -9.683 0.845 8.049 1.00 0.57 H new ATOM 0 HG3 GLU A 152 -9.344 -0.764 8.656 1.00 0.57 H new ATOM 2242 N ARG A 153 -4.856 1.393 8.377 1.00 0.23 N ATOM 2243 CA ARG A 153 -3.576 0.962 7.858 1.00 0.24 C ATOM 2244 C ARG A 153 -3.111 -0.249 8.657 1.00 0.25 C ATOM 2245 O ARG A 153 -3.413 -0.359 9.846 1.00 0.39 O ATOM 2246 CB ARG A 153 -2.554 2.094 7.890 1.00 0.36 C ATOM 2247 CG ARG A 153 -1.229 1.736 8.546 1.00 0.40 C ATOM 2248 CD ARG A 153 -0.449 2.992 8.893 1.00 0.47 C ATOM 2249 NE ARG A 153 -1.305 4.079 9.405 1.00 0.65 N ATOM 2250 CZ ARG A 153 -2.199 3.961 10.404 1.00 1.51 C ATOM 2251 NH1 ARG A 153 -2.380 2.807 11.035 1.00 2.16 N ATOM 2252 NH2 ARG A 153 -2.900 5.015 10.787 1.00 1.85 N ATOM 0 H ARG A 153 -4.953 1.282 9.386 1.00 0.23 H new ATOM 0 HA ARG A 153 -3.681 0.678 6.811 1.00 0.24 H new ATOM 0 HB2 ARG A 153 -2.361 2.420 6.868 1.00 0.36 H new ATOM 0 HB3 ARG A 153 -2.988 2.942 8.419 1.00 0.36 H new ATOM 0 HG2 ARG A 153 -1.410 1.152 9.449 1.00 0.40 H new ATOM 0 HG3 ARG A 153 -0.641 1.110 7.874 1.00 0.40 H new ATOM 0 HD2 ARG A 153 0.306 2.749 9.640 1.00 0.47 H new ATOM 0 HD3 ARG A 153 0.080 3.341 8.006 1.00 0.47 H new ATOM 0 HE ARG A 153 -1.212 4.995 8.966 1.00 0.65 H new ATOM 0 HH11 ARG A 153 -1.836 1.987 10.765 1.00 2.16 H new ATOM 0 HH12 ARG A 153 -3.063 2.740 11.790 1.00 2.16 H new ATOM 0 HH21 ARG A 153 -2.762 5.914 10.326 1.00 1.85 H new ATOM 0 HH22 ARG A 153 -3.578 4.929 11.544 1.00 1.85 H new ATOM 2266 N PHE A 154 -2.378 -1.146 8.021 1.00 0.24 N ATOM 2267 CA PHE A 154 -2.073 -2.429 8.628 1.00 0.22 C ATOM 2268 C PHE A 154 -0.581 -2.616 8.728 1.00 0.24 C ATOM 2269 O PHE A 154 0.161 -2.174 7.859 1.00 0.32 O ATOM 2270 CB PHE A 154 -2.675 -3.567 7.801 1.00 0.22 C ATOM 2271 CG PHE A 154 -4.176 -3.604 7.815 1.00 0.20 C ATOM 2272 CD1 PHE A 154 -4.913 -2.845 6.917 1.00 0.22 C ATOM 2273 CD2 PHE A 154 -4.850 -4.389 8.736 1.00 0.21 C ATOM 2274 CE1 PHE A 154 -6.295 -2.871 6.940 1.00 0.24 C ATOM 2275 CE2 PHE A 154 -6.228 -4.416 8.764 1.00 0.22 C ATOM 2276 CZ PHE A 154 -6.950 -3.687 7.812 1.00 0.22 C ATOM 0 H PHE A 154 -1.985 -1.011 7.090 1.00 0.24 H new ATOM 0 HA PHE A 154 -2.506 -2.447 9.628 1.00 0.22 H new ATOM 0 HB2 PHE A 154 -2.334 -3.473 6.770 1.00 0.22 H new ATOM 0 HB3 PHE A 154 -2.295 -4.517 8.178 1.00 0.22 H new ATOM 0 HD1 PHE A 154 -4.402 -2.228 6.193 1.00 0.22 H new ATOM 0 HD2 PHE A 154 -4.290 -4.986 9.440 1.00 0.21 H new ATOM 0 HE1 PHE A 154 -6.857 -2.243 6.265 1.00 0.24 H new ATOM 0 HE2 PHE A 154 -6.746 -4.995 9.514 1.00 0.22 H new ATOM 0 HZ PHE A 154 -8.026 -3.771 7.769 1.00 0.22 H new ATOM 2286 N SER A 155 -0.149 -3.256 9.796 1.00 0.22 N ATOM 2287 CA SER A 155 1.247 -3.609 9.954 1.00 0.25 C ATOM 2288 C SER A 155 1.651 -4.597 8.861 1.00 0.22 C ATOM 2289 O SER A 155 0.823 -5.371 8.391 1.00 0.26 O ATOM 2290 CB SER A 155 1.455 -4.225 11.341 1.00 0.35 C ATOM 2291 OG SER A 155 0.473 -5.217 11.604 1.00 1.11 O ATOM 0 H SER A 155 -0.748 -3.543 10.570 1.00 0.22 H new ATOM 0 HA SER A 155 1.870 -2.719 9.865 1.00 0.25 H new ATOM 0 HB2 SER A 155 2.450 -4.666 11.403 1.00 0.35 H new ATOM 0 HB3 SER A 155 1.404 -3.446 12.101 1.00 0.35 H new ATOM 0 HG SER A 155 0.624 -5.599 12.494 1.00 1.11 H new ATOM 2297 N PRO A 156 2.919 -4.580 8.428 1.00 0.25 N ATOM 2298 CA PRO A 156 3.425 -5.542 7.443 1.00 0.29 C ATOM 2299 C PRO A 156 3.364 -6.949 7.990 1.00 0.39 C ATOM 2300 O PRO A 156 3.315 -7.927 7.248 1.00 0.78 O ATOM 2301 CB PRO A 156 4.876 -5.121 7.238 1.00 0.34 C ATOM 2302 CG PRO A 156 5.223 -4.339 8.457 1.00 0.36 C ATOM 2303 CD PRO A 156 3.959 -3.640 8.863 1.00 0.33 C ATOM 0 HA PRO A 156 2.844 -5.543 6.521 1.00 0.29 H new ATOM 0 HB2 PRO A 156 5.527 -5.988 7.126 1.00 0.34 H new ATOM 0 HB3 PRO A 156 4.989 -4.519 6.337 1.00 0.34 H new ATOM 0 HG2 PRO A 156 5.582 -4.992 9.252 1.00 0.36 H new ATOM 0 HG3 PRO A 156 6.018 -3.622 8.250 1.00 0.36 H new ATOM 0 HD2 PRO A 156 3.921 -3.463 9.938 1.00 0.33 H new ATOM 0 HD3 PRO A 156 3.858 -2.670 8.376 1.00 0.33 H new ATOM 2311 N GLY A 157 3.422 -7.011 9.306 1.00 0.36 N ATOM 2312 CA GLY A 157 3.204 -8.231 10.036 1.00 0.46 C ATOM 2313 C GLY A 157 1.735 -8.588 10.190 1.00 0.41 C ATOM 2314 O GLY A 157 1.379 -9.407 11.040 1.00 0.50 O ATOM 0 H GLY A 157 3.624 -6.205 9.898 1.00 0.36 H new ATOM 0 HA2 GLY A 157 3.717 -9.047 9.527 1.00 0.46 H new ATOM 0 HA3 GLY A 157 3.654 -8.139 11.025 1.00 0.46 H new ATOM 2318 N ALA A 158 0.872 -7.975 9.385 1.00 0.34 N ATOM 2319 CA ALA A 158 -0.521 -8.388 9.317 1.00 0.31 C ATOM 2320 C ALA A 158 -0.710 -9.350 8.152 1.00 0.34 C ATOM 2321 O ALA A 158 0.036 -9.308 7.169 1.00 0.50 O ATOM 2322 CB ALA A 158 -1.445 -7.187 9.178 1.00 0.37 C ATOM 0 H ALA A 158 1.114 -7.194 8.774 1.00 0.34 H new ATOM 0 HA ALA A 158 -0.781 -8.895 10.246 1.00 0.31 H new ATOM 0 HB1 ALA A 158 -2.479 -7.527 9.130 1.00 0.37 H new ATOM 0 HB2 ALA A 158 -1.319 -6.530 10.038 1.00 0.37 H new ATOM 0 HB3 ALA A 158 -1.199 -6.642 8.266 1.00 0.37 H new ATOM 2328 N SER A 159 -1.696 -10.215 8.258 1.00 0.26 N ATOM 2329 CA SER A 159 -1.917 -11.230 7.267 1.00 0.30 C ATOM 2330 C SER A 159 -3.227 -10.968 6.550 1.00 0.23 C ATOM 2331 O SER A 159 -3.948 -10.022 6.884 1.00 0.22 O ATOM 2332 CB SER A 159 -1.926 -12.614 7.928 1.00 0.41 C ATOM 2333 OG SER A 159 -1.967 -13.656 6.967 1.00 1.42 O ATOM 0 H SER A 159 -2.360 -10.230 9.032 1.00 0.26 H new ATOM 0 HA SER A 159 -1.109 -11.205 6.536 1.00 0.30 H new ATOM 0 HB2 SER A 159 -1.037 -12.726 8.548 1.00 0.41 H new ATOM 0 HB3 SER A 159 -2.789 -12.695 8.589 1.00 0.41 H new ATOM 0 HG SER A 159 -1.970 -14.523 7.424 1.00 1.42 H new ATOM 2339 N VAL A 160 -3.510 -11.801 5.567 1.00 0.22 N ATOM 2340 CA VAL A 160 -4.730 -11.725 4.777 1.00 0.20 C ATOM 2341 C VAL A 160 -5.949 -11.528 5.675 1.00 0.21 C ATOM 2342 O VAL A 160 -6.756 -10.629 5.455 1.00 0.20 O ATOM 2343 CB VAL A 160 -4.900 -13.035 3.997 1.00 0.24 C ATOM 2344 CG1 VAL A 160 -6.122 -12.995 3.099 1.00 0.28 C ATOM 2345 CG2 VAL A 160 -3.655 -13.354 3.186 1.00 0.26 C ATOM 0 H VAL A 160 -2.891 -12.562 5.288 1.00 0.22 H new ATOM 0 HA VAL A 160 -4.653 -10.876 4.097 1.00 0.20 H new ATOM 0 HB VAL A 160 -5.048 -13.830 4.728 1.00 0.24 H new ATOM 0 HG11 VAL A 160 -6.210 -13.940 2.562 1.00 0.28 H new ATOM 0 HG12 VAL A 160 -7.014 -12.837 3.705 1.00 0.28 H new ATOM 0 HG13 VAL A 160 -6.021 -12.179 2.383 1.00 0.28 H new ATOM 0 HG21 VAL A 160 -3.804 -14.288 2.643 1.00 0.26 H new ATOM 0 HG22 VAL A 160 -3.466 -12.548 2.477 1.00 0.26 H new ATOM 0 HG23 VAL A 160 -2.801 -13.455 3.855 1.00 0.26 H new ATOM 2355 N LYS A 161 -6.037 -12.346 6.720 1.00 0.26 N ATOM 2356 CA LYS A 161 -7.185 -12.340 7.614 1.00 0.31 C ATOM 2357 C LYS A 161 -7.282 -11.027 8.373 1.00 0.26 C ATOM 2358 O LYS A 161 -8.367 -10.463 8.514 1.00 0.27 O ATOM 2359 CB LYS A 161 -7.087 -13.496 8.610 1.00 0.45 C ATOM 2360 CG LYS A 161 -8.097 -13.403 9.743 1.00 1.12 C ATOM 2361 CD LYS A 161 -7.838 -14.449 10.811 1.00 1.80 C ATOM 2362 CE LYS A 161 -8.685 -14.204 12.048 1.00 2.67 C ATOM 2363 NZ LYS A 161 -8.392 -12.886 12.680 1.00 3.46 N ATOM 0 H LYS A 161 -5.319 -13.026 6.968 1.00 0.26 H new ATOM 0 HA LYS A 161 -8.081 -12.458 7.005 1.00 0.31 H new ATOM 0 HB2 LYS A 161 -7.233 -14.437 8.079 1.00 0.45 H new ATOM 0 HB3 LYS A 161 -6.082 -13.520 9.030 1.00 0.45 H new ATOM 0 HG2 LYS A 161 -8.054 -12.409 10.189 1.00 1.12 H new ATOM 0 HG3 LYS A 161 -9.104 -13.530 9.345 1.00 1.12 H new ATOM 0 HD2 LYS A 161 -8.054 -15.440 10.411 1.00 1.80 H new ATOM 0 HD3 LYS A 161 -6.783 -14.439 11.084 1.00 1.80 H new ATOM 0 HE2 LYS A 161 -9.740 -14.249 11.778 1.00 2.67 H new ATOM 0 HE3 LYS A 161 -8.507 -14.999 12.772 1.00 2.67 H new ATOM 0 HZ1 LYS A 161 -8.670 -12.912 13.682 1.00 3.46 H new ATOM 0 HZ2 LYS A 161 -7.374 -12.685 12.608 1.00 3.46 H new ATOM 0 HZ3 LYS A 161 -8.927 -12.140 12.191 1.00 3.46 H new ATOM 2377 N ASP A 162 -6.135 -10.529 8.818 1.00 0.26 N ATOM 2378 CA ASP A 162 -6.083 -9.359 9.677 1.00 0.27 C ATOM 2379 C ASP A 162 -6.593 -8.157 8.921 1.00 0.22 C ATOM 2380 O ASP A 162 -7.223 -7.259 9.481 1.00 0.26 O ATOM 2381 CB ASP A 162 -4.651 -9.093 10.130 1.00 0.33 C ATOM 2382 CG ASP A 162 -4.050 -10.239 10.912 1.00 0.78 C ATOM 2383 OD1 ASP A 162 -4.305 -10.327 12.129 1.00 0.86 O ATOM 2384 OD2 ASP A 162 -3.334 -11.066 10.311 1.00 1.40 O ATOM 0 H ASP A 162 -5.222 -10.924 8.594 1.00 0.26 H new ATOM 0 HA ASP A 162 -6.705 -9.541 10.553 1.00 0.27 H new ATOM 0 HB2 ASP A 162 -4.031 -8.894 9.256 1.00 0.33 H new ATOM 0 HB3 ASP A 162 -4.633 -8.193 10.745 1.00 0.33 H new ATOM 2389 N ILE A 163 -6.307 -8.160 7.635 1.00 0.18 N ATOM 2390 CA ILE A 163 -6.749 -7.116 6.749 1.00 0.15 C ATOM 2391 C ILE A 163 -8.199 -7.329 6.330 1.00 0.14 C ATOM 2392 O ILE A 163 -9.000 -6.392 6.374 1.00 0.15 O ATOM 2393 CB ILE A 163 -5.846 -7.046 5.504 1.00 0.14 C ATOM 2394 CG1 ILE A 163 -4.500 -6.383 5.851 1.00 0.15 C ATOM 2395 CG2 ILE A 163 -6.554 -6.300 4.381 1.00 0.15 C ATOM 2396 CD1 ILE A 163 -3.484 -6.447 4.731 1.00 0.21 C ATOM 0 H ILE A 163 -5.760 -8.890 7.179 1.00 0.18 H new ATOM 0 HA ILE A 163 -6.683 -6.171 7.288 1.00 0.15 H new ATOM 0 HB ILE A 163 -5.640 -8.060 5.160 1.00 0.14 H new ATOM 0 HG12 ILE A 163 -4.676 -5.339 6.111 1.00 0.15 H new ATOM 0 HG13 ILE A 163 -4.084 -6.866 6.735 1.00 0.15 H new ATOM 0 HG21 ILE A 163 -5.905 -6.258 3.507 1.00 0.15 H new ATOM 0 HG22 ILE A 163 -7.476 -6.821 4.123 1.00 0.15 H new ATOM 0 HG23 ILE A 163 -6.788 -5.287 4.708 1.00 0.15 H new ATOM 0 HD11 ILE A 163 -2.562 -5.960 5.048 1.00 0.21 H new ATOM 0 HD12 ILE A 163 -3.279 -7.489 4.485 1.00 0.21 H new ATOM 0 HD13 ILE A 163 -3.879 -5.938 3.852 1.00 0.21 H new ATOM 2408 N GLU A 164 -8.542 -8.560 5.945 1.00 0.13 N ATOM 2409 CA GLU A 164 -9.879 -8.855 5.440 1.00 0.13 C ATOM 2410 C GLU A 164 -10.960 -8.388 6.404 1.00 0.15 C ATOM 2411 O GLU A 164 -11.946 -7.806 5.989 1.00 0.15 O ATOM 2412 CB GLU A 164 -10.101 -10.348 5.208 1.00 0.14 C ATOM 2413 CG GLU A 164 -9.424 -10.924 3.985 1.00 0.20 C ATOM 2414 CD GLU A 164 -9.896 -12.334 3.698 1.00 0.30 C ATOM 2415 OE1 GLU A 164 -11.090 -12.511 3.388 1.00 0.60 O ATOM 2416 OE2 GLU A 164 -9.081 -13.275 3.771 1.00 0.67 O ATOM 0 H GLU A 164 -7.914 -9.363 5.974 1.00 0.13 H new ATOM 0 HA GLU A 164 -9.948 -8.319 4.493 1.00 0.13 H new ATOM 0 HB2 GLU A 164 -9.750 -10.891 6.086 1.00 0.14 H new ATOM 0 HB3 GLU A 164 -11.173 -10.530 5.128 1.00 0.14 H new ATOM 0 HG2 GLU A 164 -9.628 -10.289 3.123 1.00 0.20 H new ATOM 0 HG3 GLU A 164 -8.344 -10.924 4.133 1.00 0.20 H new ATOM 2423 N GLU A 165 -10.776 -8.647 7.688 1.00 0.18 N ATOM 2424 CA GLU A 165 -11.802 -8.329 8.684 1.00 0.21 C ATOM 2425 C GLU A 165 -12.095 -6.834 8.766 1.00 0.21 C ATOM 2426 O GLU A 165 -13.096 -6.419 9.352 1.00 0.27 O ATOM 2427 CB GLU A 165 -11.415 -8.866 10.060 1.00 0.27 C ATOM 2428 CG GLU A 165 -9.949 -8.725 10.402 1.00 0.47 C ATOM 2429 CD GLU A 165 -9.609 -9.422 11.702 1.00 0.66 C ATOM 2430 OE1 GLU A 165 -9.428 -10.657 11.684 1.00 0.83 O ATOM 2431 OE2 GLU A 165 -9.493 -8.735 12.742 1.00 0.87 O ATOM 0 H GLU A 165 -9.932 -9.074 8.070 1.00 0.18 H new ATOM 0 HA GLU A 165 -12.716 -8.822 8.354 1.00 0.21 H new ATOM 0 HB2 GLU A 165 -12.003 -8.346 10.817 1.00 0.27 H new ATOM 0 HB3 GLU A 165 -11.687 -9.920 10.114 1.00 0.27 H new ATOM 0 HG2 GLU A 165 -9.345 -9.143 9.596 1.00 0.47 H new ATOM 0 HG3 GLU A 165 -9.693 -7.668 10.478 1.00 0.47 H new ATOM 2438 N LYS A 166 -11.229 -6.026 8.185 1.00 0.19 N ATOM 2439 CA LYS A 166 -11.469 -4.596 8.116 1.00 0.20 C ATOM 2440 C LYS A 166 -11.879 -4.229 6.693 1.00 0.19 C ATOM 2441 O LYS A 166 -12.584 -3.248 6.457 1.00 0.25 O ATOM 2442 CB LYS A 166 -10.210 -3.840 8.546 1.00 0.25 C ATOM 2443 CG LYS A 166 -9.529 -4.466 9.759 1.00 0.38 C ATOM 2444 CD LYS A 166 -9.995 -3.844 11.065 1.00 0.58 C ATOM 2445 CE LYS A 166 -9.421 -2.451 11.234 1.00 1.09 C ATOM 2446 NZ LYS A 166 -9.732 -1.865 12.562 1.00 1.71 N ATOM 0 H LYS A 166 -10.356 -6.333 7.755 1.00 0.19 H new ATOM 0 HA LYS A 166 -12.276 -4.315 8.793 1.00 0.20 H new ATOM 0 HB2 LYS A 166 -9.506 -3.813 7.714 1.00 0.25 H new ATOM 0 HB3 LYS A 166 -10.473 -2.807 8.775 1.00 0.25 H new ATOM 0 HG2 LYS A 166 -9.733 -5.537 9.776 1.00 0.38 H new ATOM 0 HG3 LYS A 166 -8.449 -4.349 9.668 1.00 0.38 H new ATOM 0 HD2 LYS A 166 -11.084 -3.798 11.083 1.00 0.58 H new ATOM 0 HD3 LYS A 166 -9.689 -4.472 11.902 1.00 0.58 H new ATOM 0 HE2 LYS A 166 -8.340 -2.489 11.101 1.00 1.09 H new ATOM 0 HE3 LYS A 166 -9.816 -1.802 10.453 1.00 1.09 H new ATOM 0 HZ1 LYS A 166 -9.469 -0.859 12.568 1.00 1.71 H new ATOM 0 HZ2 LYS A 166 -10.750 -1.957 12.752 1.00 1.71 H new ATOM 0 HZ3 LYS A 166 -9.195 -2.368 13.298 1.00 1.71 H new ATOM 2460 N LEU A 167 -11.467 -5.081 5.766 1.00 0.15 N ATOM 2461 CA LEU A 167 -11.676 -4.890 4.339 1.00 0.15 C ATOM 2462 C LEU A 167 -13.060 -5.357 3.890 1.00 0.15 C ATOM 2463 O LEU A 167 -13.780 -4.635 3.199 1.00 0.16 O ATOM 2464 CB LEU A 167 -10.617 -5.689 3.585 1.00 0.13 C ATOM 2465 CG LEU A 167 -10.953 -5.989 2.133 1.00 0.14 C ATOM 2466 CD1 LEU A 167 -10.781 -4.746 1.288 1.00 0.16 C ATOM 2467 CD2 LEU A 167 -10.103 -7.133 1.611 1.00 0.16 C ATOM 0 H LEU A 167 -10.968 -5.942 5.990 1.00 0.15 H new ATOM 0 HA LEU A 167 -11.601 -3.824 4.125 1.00 0.15 H new ATOM 0 HB2 LEU A 167 -9.676 -5.140 3.619 1.00 0.13 H new ATOM 0 HB3 LEU A 167 -10.454 -6.632 4.107 1.00 0.13 H new ATOM 0 HG LEU A 167 -11.996 -6.298 2.072 1.00 0.14 H new ATOM 0 HD11 LEU A 167 -11.025 -4.975 0.251 1.00 0.16 H new ATOM 0 HD12 LEU A 167 -11.446 -3.963 1.653 1.00 0.16 H new ATOM 0 HD13 LEU A 167 -9.748 -4.403 1.351 1.00 0.16 H new ATOM 0 HD21 LEU A 167 -10.359 -7.331 0.570 1.00 0.16 H new ATOM 0 HD22 LEU A 167 -9.049 -6.864 1.680 1.00 0.16 H new ATOM 0 HD23 LEU A 167 -10.289 -8.026 2.207 1.00 0.16 H new ATOM 2479 N ILE A 168 -13.403 -6.582 4.270 1.00 0.16 N ATOM 2480 CA ILE A 168 -14.642 -7.227 3.848 1.00 0.19 C ATOM 2481 C ILE A 168 -15.875 -6.370 4.164 1.00 0.22 C ATOM 2482 O ILE A 168 -16.748 -6.236 3.314 1.00 0.25 O ATOM 2483 CB ILE A 168 -14.798 -8.632 4.475 1.00 0.20 C ATOM 2484 CG1 ILE A 168 -13.584 -9.508 4.136 1.00 0.19 C ATOM 2485 CG2 ILE A 168 -16.081 -9.296 3.992 1.00 0.26 C ATOM 2486 CD1 ILE A 168 -13.615 -10.868 4.801 1.00 0.24 C ATOM 0 H ILE A 168 -12.827 -7.159 4.883 1.00 0.16 H new ATOM 0 HA ILE A 168 -14.576 -7.338 2.766 1.00 0.19 H new ATOM 0 HB ILE A 168 -14.855 -8.519 5.558 1.00 0.20 H new ATOM 0 HG12 ILE A 168 -13.533 -9.642 3.055 1.00 0.19 H new ATOM 0 HG13 ILE A 168 -12.675 -8.987 4.436 1.00 0.19 H new ATOM 0 HG21 ILE A 168 -16.172 -10.283 4.444 1.00 0.26 H new ATOM 0 HG22 ILE A 168 -16.937 -8.685 4.278 1.00 0.26 H new ATOM 0 HG23 ILE A 168 -16.053 -9.395 2.907 1.00 0.26 H new ATOM 0 HD11 ILE A 168 -12.727 -11.432 4.517 1.00 0.24 H new ATOM 0 HD12 ILE A 168 -13.634 -10.743 5.884 1.00 0.24 H new ATOM 0 HD13 ILE A 168 -14.506 -11.409 4.482 1.00 0.24 H new ATOM 2498 N PRO A 169 -15.977 -5.778 5.379 1.00 0.24 N ATOM 2499 CA PRO A 169 -17.052 -4.826 5.699 1.00 0.29 C ATOM 2500 C PRO A 169 -17.204 -3.710 4.657 1.00 0.29 C ATOM 2501 O PRO A 169 -18.275 -3.130 4.519 1.00 0.41 O ATOM 2502 CB PRO A 169 -16.615 -4.239 7.041 1.00 0.34 C ATOM 2503 CG PRO A 169 -15.822 -5.321 7.677 1.00 0.40 C ATOM 2504 CD PRO A 169 -15.113 -6.027 6.553 1.00 0.24 C ATOM 0 HA PRO A 169 -18.024 -5.318 5.719 1.00 0.29 H new ATOM 0 HB2 PRO A 169 -16.019 -3.337 6.905 1.00 0.34 H new ATOM 0 HB3 PRO A 169 -17.474 -3.964 7.653 1.00 0.34 H new ATOM 0 HG2 PRO A 169 -15.109 -4.913 8.394 1.00 0.40 H new ATOM 0 HG3 PRO A 169 -16.467 -6.008 8.225 1.00 0.40 H new ATOM 0 HD2 PRO A 169 -14.109 -5.631 6.402 1.00 0.24 H new ATOM 0 HD3 PRO A 169 -15.008 -7.093 6.753 1.00 0.24 H new ATOM 2512 N LEU A 170 -16.136 -3.411 3.926 1.00 0.22 N ATOM 2513 CA LEU A 170 -16.199 -2.398 2.882 1.00 0.22 C ATOM 2514 C LEU A 170 -16.465 -3.019 1.514 1.00 0.20 C ATOM 2515 O LEU A 170 -17.246 -2.480 0.729 1.00 0.23 O ATOM 2516 CB LEU A 170 -14.922 -1.561 2.840 1.00 0.24 C ATOM 2517 CG LEU A 170 -14.705 -0.613 4.011 1.00 0.33 C ATOM 2518 CD1 LEU A 170 -13.323 0.012 3.910 1.00 0.71 C ATOM 2519 CD2 LEU A 170 -15.781 0.464 4.024 1.00 0.69 C ATOM 0 H LEU A 170 -15.223 -3.852 4.036 1.00 0.22 H new ATOM 0 HA LEU A 170 -17.034 -1.741 3.127 1.00 0.22 H new ATOM 0 HB2 LEU A 170 -14.070 -2.238 2.784 1.00 0.24 H new ATOM 0 HB3 LEU A 170 -14.925 -0.976 1.921 1.00 0.24 H new ATOM 0 HG LEU A 170 -14.772 -1.172 4.944 1.00 0.33 H new ATOM 0 HD11 LEU A 170 -13.168 0.691 4.749 1.00 0.71 H new ATOM 0 HD12 LEU A 170 -12.566 -0.772 3.934 1.00 0.71 H new ATOM 0 HD13 LEU A 170 -13.242 0.566 2.975 1.00 0.71 H new ATOM 0 HD21 LEU A 170 -15.614 1.135 4.866 1.00 0.69 H new ATOM 0 HD22 LEU A 170 -15.739 1.031 3.094 1.00 0.69 H new ATOM 0 HD23 LEU A 170 -16.761 -0.002 4.121 1.00 0.69 H new ATOM 2531 N LEU A 171 -15.800 -4.136 1.216 1.00 0.18 N ATOM 2532 CA LEU A 171 -16.034 -4.843 -0.047 1.00 0.20 C ATOM 2533 C LEU A 171 -17.468 -5.301 -0.120 1.00 0.27 C ATOM 2534 O LEU A 171 -18.190 -5.047 -1.086 1.00 0.34 O ATOM 2535 CB LEU A 171 -15.159 -6.091 -0.158 1.00 0.26 C ATOM 2536 CG LEU A 171 -13.671 -5.848 -0.296 1.00 0.17 C ATOM 2537 CD1 LEU A 171 -12.925 -7.165 -0.330 1.00 0.26 C ATOM 2538 CD2 LEU A 171 -13.380 -5.051 -1.555 1.00 0.31 C ATOM 0 H LEU A 171 -15.103 -4.568 1.823 1.00 0.18 H new ATOM 0 HA LEU A 171 -15.795 -4.148 -0.852 1.00 0.20 H new ATOM 0 HB2 LEU A 171 -15.326 -6.707 0.725 1.00 0.26 H new ATOM 0 HB3 LEU A 171 -15.494 -6.670 -1.019 1.00 0.26 H new ATOM 0 HG LEU A 171 -13.332 -5.275 0.567 1.00 0.17 H new ATOM 0 HD11 LEU A 171 -11.856 -6.975 -0.430 1.00 0.26 H new ATOM 0 HD12 LEU A 171 -13.112 -7.713 0.594 1.00 0.26 H new ATOM 0 HD13 LEU A 171 -13.269 -7.756 -1.179 1.00 0.26 H new ATOM 0 HD21 LEU A 171 -12.306 -4.884 -1.640 1.00 0.31 H new ATOM 0 HD22 LEU A 171 -13.731 -5.605 -2.426 1.00 0.31 H new ATOM 0 HD23 LEU A 171 -13.893 -4.091 -1.504 1.00 0.31 H new ATOM 2550 N GLY A 172 -17.843 -5.986 0.934 1.00 0.29 N ATOM 2551 CA GLY A 172 -19.107 -6.654 1.002 1.00 0.39 C ATOM 2552 C GLY A 172 -20.289 -5.733 1.209 1.00 0.66 C ATOM 2553 O GLY A 172 -21.209 -5.708 0.391 1.00 1.12 O ATOM 0 H GLY A 172 -17.270 -6.092 1.771 1.00 0.29 H new ATOM 0 HA2 GLY A 172 -19.257 -7.217 0.081 1.00 0.39 H new ATOM 0 HA3 GLY A 172 -19.079 -7.378 1.816 1.00 0.39 H new ATOM 2557 N SER A 173 -20.277 -4.971 2.293 1.00 0.85 N ATOM 2558 CA SER A 173 -21.457 -4.210 2.675 1.00 1.33 C ATOM 2559 C SER A 173 -21.085 -2.955 3.455 1.00 1.84 C ATOM 2560 O SER A 173 -21.022 -2.964 4.688 1.00 2.43 O ATOM 2561 CB SER A 173 -22.391 -5.094 3.504 1.00 2.03 C ATOM 2562 OG SER A 173 -23.605 -4.430 3.809 1.00 2.64 O ATOM 0 H SER A 173 -19.476 -4.864 2.915 1.00 0.85 H new ATOM 0 HA SER A 173 -21.968 -3.892 1.766 1.00 1.33 H new ATOM 0 HB2 SER A 173 -22.605 -6.012 2.956 1.00 2.03 H new ATOM 0 HB3 SER A 173 -21.892 -5.384 4.429 1.00 2.03 H new ATOM 0 HG SER A 173 -24.178 -5.023 4.338 1.00 2.64 H new ATOM 2568 N ALA A 174 -20.838 -1.875 2.729 1.00 2.40 N ATOM 2569 CA ALA A 174 -20.555 -0.586 3.342 1.00 3.35 C ATOM 2570 C ALA A 174 -21.842 0.219 3.482 1.00 3.69 C ATOM 2571 O ALA A 174 -21.851 1.325 4.028 1.00 4.35 O ATOM 2572 CB ALA A 174 -19.529 0.180 2.523 1.00 4.30 C ATOM 0 H ALA A 174 -20.828 -1.866 1.709 1.00 2.40 H new ATOM 0 HA ALA A 174 -20.139 -0.753 4.335 1.00 3.35 H new ATOM 0 HB1 ALA A 174 -19.330 1.141 2.996 1.00 4.30 H new ATOM 0 HB2 ALA A 174 -18.605 -0.395 2.467 1.00 4.30 H new ATOM 0 HB3 ALA A 174 -19.915 0.344 1.517 1.00 4.30 H new ATOM 2578 N ARG A 175 -22.924 -0.338 2.958 1.00 3.66 N ATOM 2579 CA ARG A 175 -24.234 0.281 3.052 1.00 4.44 C ATOM 2580 C ARG A 175 -25.129 -0.516 3.990 1.00 4.81 C ATOM 2581 O ARG A 175 -25.707 -1.528 3.604 1.00 5.15 O ATOM 2582 CB ARG A 175 -24.880 0.389 1.667 1.00 5.16 C ATOM 2583 CG ARG A 175 -24.202 1.389 0.738 1.00 5.82 C ATOM 2584 CD ARG A 175 -24.363 2.825 1.222 1.00 6.62 C ATOM 2585 NE ARG A 175 -23.642 3.075 2.469 1.00 7.03 N ATOM 2586 CZ ARG A 175 -24.026 3.954 3.390 1.00 7.84 C ATOM 2587 NH1 ARG A 175 -25.129 4.671 3.223 1.00 8.30 N ATOM 2588 NH2 ARG A 175 -23.311 4.104 4.495 1.00 8.45 N ATOM 0 H ARG A 175 -22.917 -1.227 2.458 1.00 3.66 H new ATOM 0 HA ARG A 175 -24.111 1.286 3.455 1.00 4.44 H new ATOM 0 HB2 ARG A 175 -24.869 -0.594 1.195 1.00 5.16 H new ATOM 0 HB3 ARG A 175 -25.926 0.673 1.787 1.00 5.16 H new ATOM 0 HG2 ARG A 175 -23.141 1.150 0.662 1.00 5.82 H new ATOM 0 HG3 ARG A 175 -24.623 1.295 -0.263 1.00 5.82 H new ATOM 0 HD2 ARG A 175 -24.002 3.508 0.453 1.00 6.62 H new ATOM 0 HD3 ARG A 175 -25.422 3.040 1.368 1.00 6.62 H new ATOM 0 HE ARG A 175 -22.790 2.541 2.644 1.00 7.03 H new ATOM 0 HH11 ARG A 175 -25.693 4.551 2.381 1.00 8.30 H new ATOM 0 HH12 ARG A 175 -25.414 5.342 3.936 1.00 8.30 H new ATOM 0 HH21 ARG A 175 -22.469 3.546 4.637 1.00 8.45 H new ATOM 0 HH22 ARG A 175 -23.603 4.777 5.204 1.00 8.45 H new ATOM 2602 N LEU A 176 -25.216 -0.060 5.228 1.00 5.22 N ATOM 2603 CA LEU A 176 -26.044 -0.715 6.224 1.00 6.05 C ATOM 2604 C LEU A 176 -27.381 0.002 6.331 1.00 6.72 C ATOM 2605 O LEU A 176 -27.410 1.118 6.888 1.00 7.14 O ATOM 2606 CB LEU A 176 -25.339 -0.722 7.583 1.00 6.60 C ATOM 2607 CG LEU A 176 -26.079 -1.468 8.696 1.00 7.19 C ATOM 2608 CD1 LEU A 176 -26.174 -2.953 8.378 1.00 7.69 C ATOM 2609 CD2 LEU A 176 -25.387 -1.254 10.033 1.00 7.60 C ATOM 2610 OXT LEU A 176 -28.398 -0.550 5.860 1.00 7.13 O ATOM 0 H LEU A 176 -24.721 0.765 5.567 1.00 5.22 H new ATOM 0 HA LEU A 176 -26.215 -1.747 5.918 1.00 6.05 H new ATOM 0 HB2 LEU A 176 -24.353 -1.170 7.461 1.00 6.60 H new ATOM 0 HB3 LEU A 176 -25.184 0.309 7.899 1.00 6.60 H new ATOM 0 HG LEU A 176 -27.090 -1.067 8.762 1.00 7.19 H new ATOM 0 HD11 LEU A 176 -26.704 -3.464 9.182 1.00 7.69 H new ATOM 0 HD12 LEU A 176 -26.715 -3.091 7.442 1.00 7.69 H new ATOM 0 HD13 LEU A 176 -25.171 -3.369 8.282 1.00 7.69 H new ATOM 0 HD21 LEU A 176 -25.927 -1.792 10.812 1.00 7.60 H new ATOM 0 HD22 LEU A 176 -24.364 -1.627 9.977 1.00 7.60 H new ATOM 0 HD23 LEU A 176 -25.373 -0.190 10.269 1.00 7.60 H new TER 2622 LEU A 176