USER MOD reduce.3.24.130724 H: found=0, std=0, add=1095, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1093 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 SER OG : rot -58:sc= 0.0298 USER MOD Set 1.2: A 79 THR OG1 : rot 180:sc= 0.202 USER MOD Set 2.1: A 54 SER OG : rot 166:sc= -4.06! USER MOD Set 2.2: A 94 THR OG1 : rot -70:sc= -7.67! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -138:sc= 0.913 (180deg=-1.57!) USER MOD Single : A 2 ASN :FLIP amide:sc= 0 F(o=-1.1,f=0) USER MOD Single : A 3 LYS NZ :NH3+ -156:sc= -0.0122 (180deg=-0.166) USER MOD Single : A 7 GLN :FLIP amide:sc= -0.132 F(o=-1.5!,f=-0.13) USER MOD Single : A 13 SER OG : rot 84:sc= -0.0568 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 18 CYS SG : rot 92:sc= -3.03! USER MOD Single : A 21 SER OG : rot 63:sc= -2.46! USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 100:sc= 1.63 USER MOD Single : A 29 SER OG : rot -89:sc= 2.04 USER MOD Single : A 31 CYS SG : rot 150:sc= -10.1! USER MOD Single : A 40 GLN : amide:sc= -7.19! C(o=-7.2!,f=-8.2!) USER MOD Single : A 45 GLN : amide:sc= -0.0473 X(o=-0.047,f=0) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 57:sc= 0.3 USER MOD Single : A 55 MET CE :methyl 162:sc= -3.55! (180deg=-5.69!) USER MOD Single : A 59 LYS NZ :NH3+ 164:sc= -1.72! (180deg=-3.24!) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0.021) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -164:sc= -0.722 (180deg=-1.56!) USER MOD Single : A 75 SER OG : rot -88:sc= -1.98! USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 GLN : amide:sc= -6.15! C(o=-6.2!,f=-6.3!) USER MOD Single : A 85 LYS NZ :NH3+ 153:sc= -0.724 (180deg=-2.39!) USER MOD Single : A 86 THR OG1 : rot 48:sc= -2.62! USER MOD Single : A 87 ASN : amide:sc= -0.315 X(o=-0.31,f=-0.072) USER MOD Single : A 89 ASN : amide:sc= -5.85! C(o=-5.8!,f=-7.1!) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 CYS SG : rot 4:sc= -8.08! USER MOD Single : A 99 GLN :FLIP amide:sc= -0.816 F(o=-4.5!,f=-0.82) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0.389 USER MOD Single : A 104 LYS NZ :NH3+ -177:sc= 0.0497 (180deg=0.0484) USER MOD Single : A 113 TYR OH : rot 150:sc= -1.02 USER MOD Single : A 116 TYR OH : rot 180:sc= 0 USER MOD Single : A 118 GLN :FLIP amide:sc= -0.602 F(o=-6.4!,f=-0.6) USER MOD Single : A 119 LYS NZ :NH3+ 177:sc= -0.0212 (180deg=-0.0666) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 125 GLN : amide:sc= -6.45! C(o=-6.5!,f=-7.4!) USER MOD Single : A 126 HIS : no HE2:sc= -1.66! X(o=-1.7!,f=-1.7) USER MOD Single : A 129 THR OG1 : rot 53:sc= 0.253 USER MOD Single : A 130 TYR OH : rot -31:sc= -0.032 USER MOD Single : A 131 ASN : amide:sc= -1.08! C(o=-1.1!,f=-3.2!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 5.434 11.227 -16.688 1.00 0.00 N ATOM 2 CA MET A 1 6.882 11.069 -16.613 1.00 0.00 C ATOM 3 C MET A 1 7.296 10.549 -15.241 1.00 0.00 C ATOM 4 O MET A 1 8.197 9.717 -15.127 1.00 0.00 O ATOM 5 CB MET A 1 7.570 12.410 -16.875 1.00 0.00 C ATOM 6 CG MET A 1 6.936 13.082 -18.094 1.00 0.00 C ATOM 7 SD MET A 1 5.453 13.986 -17.581 1.00 0.00 S ATOM 8 CE MET A 1 5.708 15.446 -18.619 1.00 0.00 C ATOM 0 H1 MET A 1 5.095 10.884 -17.609 1.00 0.00 H new ATOM 0 H2 MET A 1 4.985 10.678 -15.927 1.00 0.00 H new ATOM 0 H3 MET A 1 5.188 12.232 -16.581 1.00 0.00 H new ATOM 0 HA MET A 1 7.186 10.348 -17.372 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.476 13.055 -16.002 1.00 0.00 H new ATOM 0 HB3 MET A 1 8.636 12.256 -17.045 1.00 0.00 H new ATOM 0 HG2 MET A 1 7.648 13.764 -18.558 1.00 0.00 H new ATOM 0 HG3 MET A 1 6.678 12.333 -18.842 1.00 0.00 H new ATOM 0 HE1 MET A 1 4.893 16.152 -18.460 1.00 0.00 H new ATOM 0 HE2 MET A 1 6.654 15.919 -18.356 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.731 15.148 -19.667 1.00 0.00 H new ATOM 18 N ASN A 2 6.635 11.046 -14.201 1.00 0.00 N ATOM 19 CA ASN A 2 6.949 10.627 -12.840 1.00 0.00 C ATOM 20 C ASN A 2 5.672 10.401 -12.035 1.00 0.00 C ATOM 21 O ASN A 2 5.267 9.262 -11.804 1.00 0.00 O ATOM 22 CB ASN A 2 7.803 11.691 -12.151 1.00 0.00 C ATOM 23 CG ASN A 2 8.735 11.035 -11.138 1.00 0.00 C ATOM 24 OD1 ASN A 2 8.316 10.010 -10.446 1.00 0.00 O flip ATOM 25 ND2 ASN A 2 9.876 11.467 -10.971 1.00 0.00 N flip ATOM 0 H ASN A 2 5.885 11.733 -14.273 1.00 0.00 H new ATOM 0 HA ASN A 2 7.503 9.689 -12.890 1.00 0.00 H new ATOM 0 HB2 ASN A 2 8.385 12.238 -12.892 1.00 0.00 H new ATOM 0 HB3 ASN A 2 7.161 12.417 -11.651 1.00 0.00 H new ATOM 0 HD21 ASN A 2 10.202 12.268 -11.512 1.00 0.00 H new ATOM 0 HD22 ASN A 2 10.495 11.024 -10.292 1.00 0.00 H new ATOM 32 N LYS A 3 5.046 11.493 -11.608 1.00 0.00 N ATOM 33 CA LYS A 3 3.819 11.399 -10.826 1.00 0.00 C ATOM 34 C LYS A 3 3.820 10.123 -9.990 1.00 0.00 C ATOM 35 O LYS A 3 3.250 9.108 -10.390 1.00 0.00 O ATOM 36 CB LYS A 3 2.604 11.407 -11.754 1.00 0.00 C ATOM 37 CG LYS A 3 2.819 12.434 -12.868 1.00 0.00 C ATOM 38 CD LYS A 3 1.531 12.588 -13.680 1.00 0.00 C ATOM 39 CE LYS A 3 1.182 14.072 -13.805 1.00 0.00 C ATOM 40 NZ LYS A 3 0.750 14.593 -12.478 1.00 0.00 N ATOM 0 H LYS A 3 5.365 12.445 -11.788 1.00 0.00 H new ATOM 0 HA LYS A 3 3.766 12.259 -10.158 1.00 0.00 H new ATOM 0 HB2 LYS A 3 2.454 10.416 -12.182 1.00 0.00 H new ATOM 0 HB3 LYS A 3 1.704 11.650 -11.190 1.00 0.00 H new ATOM 0 HG2 LYS A 3 3.108 13.394 -12.440 1.00 0.00 H new ATOM 0 HG3 LYS A 3 3.634 12.116 -13.517 1.00 0.00 H new ATOM 0 HD2 LYS A 3 1.657 12.148 -14.669 1.00 0.00 H new ATOM 0 HD3 LYS A 3 0.716 12.051 -13.195 1.00 0.00 H new ATOM 0 HE2 LYS A 3 2.046 14.631 -14.163 1.00 0.00 H new ATOM 0 HE3 LYS A 3 0.387 14.209 -14.538 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 0.147 15.429 -12.613 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 0.215 13.858 -11.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 1.587 14.856 -11.919 1.00 0.00 H new ATOM 54 N GLU A 4 4.466 10.184 -8.830 1.00 0.00 N ATOM 55 CA GLU A 4 4.539 9.026 -7.946 1.00 0.00 C ATOM 56 C GLU A 4 3.200 8.791 -7.256 1.00 0.00 C ATOM 57 O GLU A 4 2.277 9.597 -7.377 1.00 0.00 O ATOM 58 CB GLU A 4 5.633 9.237 -6.897 1.00 0.00 C ATOM 59 CG GLU A 4 6.989 8.841 -7.485 1.00 0.00 C ATOM 60 CD GLU A 4 8.030 9.913 -7.177 1.00 0.00 C ATOM 61 OE1 GLU A 4 7.652 11.068 -7.074 1.00 0.00 O ATOM 62 OE2 GLU A 4 9.192 9.563 -7.051 1.00 0.00 O ATOM 0 H GLU A 4 4.943 11.016 -8.482 1.00 0.00 H new ATOM 0 HA GLU A 4 4.780 8.149 -8.546 1.00 0.00 H new ATOM 0 HB2 GLU A 4 5.652 10.280 -6.582 1.00 0.00 H new ATOM 0 HB3 GLU A 4 5.421 8.640 -6.010 1.00 0.00 H new ATOM 0 HG2 GLU A 4 7.308 7.884 -7.071 1.00 0.00 H new ATOM 0 HG3 GLU A 4 6.901 8.708 -8.563 1.00 0.00 H new ATOM 69 N LEU A 5 3.099 7.676 -6.539 1.00 0.00 N ATOM 70 CA LEU A 5 1.866 7.336 -5.840 1.00 0.00 C ATOM 71 C LEU A 5 1.414 8.476 -4.943 1.00 0.00 C ATOM 72 O LEU A 5 0.224 8.612 -4.665 1.00 0.00 O ATOM 73 CB LEU A 5 2.070 6.065 -5.005 1.00 0.00 C ATOM 74 CG LEU A 5 0.733 5.548 -4.443 1.00 0.00 C ATOM 75 CD1 LEU A 5 0.270 6.430 -3.285 1.00 0.00 C ATOM 76 CD2 LEU A 5 -0.344 5.532 -5.536 1.00 0.00 C ATOM 0 H LEU A 5 3.852 6.997 -6.427 1.00 0.00 H new ATOM 0 HA LEU A 5 1.091 7.159 -6.585 1.00 0.00 H new ATOM 0 HB2 LEU A 5 2.532 5.293 -5.620 1.00 0.00 H new ATOM 0 HB3 LEU A 5 2.757 6.272 -4.184 1.00 0.00 H new ATOM 0 HG LEU A 5 0.887 4.531 -4.083 1.00 0.00 H new ATOM 0 HD11 LEU A 5 -0.676 6.054 -2.897 1.00 0.00 H new ATOM 0 HD12 LEU A 5 1.019 6.414 -2.493 1.00 0.00 H new ATOM 0 HD13 LEU A 5 0.136 7.453 -3.637 1.00 0.00 H new ATOM 0 HD21 LEU A 5 -1.281 5.163 -5.118 1.00 0.00 H new ATOM 0 HD22 LEU A 5 -0.490 6.542 -5.918 1.00 0.00 H new ATOM 0 HD23 LEU A 5 -0.028 4.879 -6.349 1.00 0.00 H new ATOM 88 N LEU A 6 2.351 9.293 -4.482 1.00 0.00 N ATOM 89 CA LEU A 6 1.989 10.401 -3.608 1.00 0.00 C ATOM 90 C LEU A 6 0.879 11.240 -4.230 1.00 0.00 C ATOM 91 O LEU A 6 0.522 12.293 -3.704 1.00 0.00 O ATOM 92 CB LEU A 6 3.196 11.290 -3.322 1.00 0.00 C ATOM 93 CG LEU A 6 3.931 11.594 -4.629 1.00 0.00 C ATOM 94 CD1 LEU A 6 3.158 12.650 -5.421 1.00 0.00 C ATOM 95 CD2 LEU A 6 5.334 12.117 -4.312 1.00 0.00 C ATOM 0 H LEU A 6 3.346 9.214 -4.692 1.00 0.00 H new ATOM 0 HA LEU A 6 1.633 9.975 -2.670 1.00 0.00 H new ATOM 0 HB2 LEU A 6 2.873 12.218 -2.850 1.00 0.00 H new ATOM 0 HB3 LEU A 6 3.868 10.794 -2.622 1.00 0.00 H new ATOM 0 HG LEU A 6 4.006 10.683 -5.223 1.00 0.00 H new ATOM 0 HD11 LEU A 6 3.684 12.864 -6.351 1.00 0.00 H new ATOM 0 HD12 LEU A 6 2.159 12.277 -5.647 1.00 0.00 H new ATOM 0 HD13 LEU A 6 3.079 13.563 -4.830 1.00 0.00 H new ATOM 0 HD21 LEU A 6 5.860 12.334 -5.242 1.00 0.00 H new ATOM 0 HD22 LEU A 6 5.257 13.027 -3.717 1.00 0.00 H new ATOM 0 HD23 LEU A 6 5.885 11.362 -3.751 1.00 0.00 H new ATOM 107 N GLN A 7 0.322 10.765 -5.341 1.00 0.00 N ATOM 108 CA GLN A 7 -0.753 11.483 -5.999 1.00 0.00 C ATOM 109 C GLN A 7 -1.966 11.520 -5.080 1.00 0.00 C ATOM 110 O GLN A 7 -2.964 12.178 -5.372 1.00 0.00 O ATOM 111 CB GLN A 7 -1.120 10.794 -7.314 1.00 0.00 C ATOM 112 CG GLN A 7 -1.600 11.842 -8.320 1.00 0.00 C ATOM 113 CD GLN A 7 -2.564 11.206 -9.317 1.00 0.00 C ATOM 114 OE1 GLN A 7 -2.679 9.907 -9.363 1.00 0.00 O flip ATOM 115 NE2 GLN A 7 -3.231 11.913 -10.074 1.00 0.00 N flip ATOM 0 H GLN A 7 0.597 9.895 -5.797 1.00 0.00 H new ATOM 0 HA GLN A 7 -0.427 12.500 -6.217 1.00 0.00 H new ATOM 0 HB2 GLN A 7 -0.256 10.261 -7.712 1.00 0.00 H new ATOM 0 HB3 GLN A 7 -1.901 10.053 -7.144 1.00 0.00 H new ATOM 0 HG2 GLN A 7 -2.093 12.661 -7.797 1.00 0.00 H new ATOM 0 HG3 GLN A 7 -0.747 12.269 -8.848 1.00 0.00 H new ATOM 0 HE21 GLN A 7 -3.140 12.928 -10.036 1.00 0.00 H new ATOM 0 HE22 GLN A 7 -3.875 11.483 -10.738 1.00 0.00 H new ATOM 124 N LEU A 8 -1.863 10.813 -3.957 1.00 0.00 N ATOM 125 CA LEU A 8 -2.947 10.777 -2.986 1.00 0.00 C ATOM 126 C LEU A 8 -3.093 12.137 -2.299 1.00 0.00 C ATOM 127 O LEU A 8 -2.152 12.921 -2.248 1.00 0.00 O ATOM 128 CB LEU A 8 -2.673 9.699 -1.935 1.00 0.00 C ATOM 129 CG LEU A 8 -3.439 8.426 -2.296 1.00 0.00 C ATOM 130 CD1 LEU A 8 -3.172 8.068 -3.758 1.00 0.00 C ATOM 131 CD2 LEU A 8 -2.972 7.278 -1.398 1.00 0.00 C ATOM 0 H LEU A 8 -1.044 10.261 -3.700 1.00 0.00 H new ATOM 0 HA LEU A 8 -3.874 10.543 -3.510 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -1.604 9.490 -1.883 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -2.977 10.052 -0.949 1.00 0.00 H new ATOM 0 HG LEU A 8 -4.507 8.591 -2.151 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -3.718 7.160 -4.016 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -3.503 8.885 -4.399 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -2.104 7.903 -3.903 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -3.518 6.370 -1.655 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -1.904 7.113 -1.544 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -3.161 7.532 -0.355 1.00 0.00 H new ATOM 143 N PRO A 9 -4.252 12.416 -1.774 1.00 0.00 N ATOM 144 CA PRO A 9 -4.552 13.700 -1.071 1.00 0.00 C ATOM 145 C PRO A 9 -3.445 14.172 -0.120 1.00 0.00 C ATOM 146 O PRO A 9 -3.446 15.328 0.305 1.00 0.00 O ATOM 147 CB PRO A 9 -5.821 13.386 -0.282 1.00 0.00 C ATOM 148 CG PRO A 9 -6.508 12.299 -1.039 1.00 0.00 C ATOM 149 CD PRO A 9 -5.427 11.527 -1.800 1.00 0.00 C ATOM 0 HA PRO A 9 -4.650 14.515 -1.788 1.00 0.00 H new ATOM 0 HB2 PRO A 9 -5.582 13.066 0.732 1.00 0.00 H new ATOM 0 HB3 PRO A 9 -6.457 14.267 -0.197 1.00 0.00 H new ATOM 0 HG2 PRO A 9 -7.047 11.638 -0.360 1.00 0.00 H new ATOM 0 HG3 PRO A 9 -7.242 12.715 -1.729 1.00 0.00 H new ATOM 0 HD2 PRO A 9 -5.212 10.571 -1.323 1.00 0.00 H new ATOM 0 HD3 PRO A 9 -5.739 11.311 -2.822 1.00 0.00 H new ATOM 157 N LEU A 10 -2.533 13.279 0.254 1.00 0.00 N ATOM 158 CA LEU A 10 -1.480 13.651 1.203 1.00 0.00 C ATOM 159 C LEU A 10 -0.711 14.882 0.756 1.00 0.00 C ATOM 160 O LEU A 10 -0.492 15.796 1.548 1.00 0.00 O ATOM 161 CB LEU A 10 -0.465 12.532 1.442 1.00 0.00 C ATOM 162 CG LEU A 10 -0.522 11.466 0.349 1.00 0.00 C ATOM 163 CD1 LEU A 10 0.601 11.746 -0.648 1.00 0.00 C ATOM 164 CD2 LEU A 10 -0.350 10.083 0.993 1.00 0.00 C ATOM 0 H LEU A 10 -2.497 12.314 -0.074 1.00 0.00 H new ATOM 0 HA LEU A 10 -2.013 13.858 2.131 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.539 12.955 1.484 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -0.656 12.069 2.410 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.479 11.487 -0.173 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.580 10.996 -1.439 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.463 12.736 -1.083 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.562 11.705 -0.135 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.389 9.315 0.221 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.612 10.036 1.503 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.151 9.915 1.713 1.00 0.00 H new ATOM 176 N PHE A 11 -0.284 14.908 -0.496 1.00 0.00 N ATOM 177 CA PHE A 11 0.474 16.054 -0.972 1.00 0.00 C ATOM 178 C PHE A 11 -0.431 17.054 -1.687 1.00 0.00 C ATOM 179 O PHE A 11 -0.283 18.266 -1.523 1.00 0.00 O ATOM 180 CB PHE A 11 1.610 15.636 -1.900 1.00 0.00 C ATOM 181 CG PHE A 11 1.057 15.495 -3.288 1.00 0.00 C ATOM 182 CD1 PHE A 11 -0.027 14.666 -3.468 1.00 0.00 C ATOM 183 CD2 PHE A 11 1.598 16.199 -4.374 1.00 0.00 C ATOM 184 CE1 PHE A 11 -0.599 14.512 -4.734 1.00 0.00 C ATOM 185 CE2 PHE A 11 1.035 16.049 -5.647 1.00 0.00 C ATOM 186 CZ PHE A 11 -0.065 15.203 -5.828 1.00 0.00 C ATOM 0 H PHE A 11 -0.443 14.172 -1.184 1.00 0.00 H new ATOM 0 HA PHE A 11 0.907 16.531 -0.093 1.00 0.00 H new ATOM 0 HB2 PHE A 11 2.407 16.379 -1.883 1.00 0.00 H new ATOM 0 HB3 PHE A 11 2.045 14.694 -1.567 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -0.438 14.131 -2.625 1.00 0.00 H new ATOM 0 HD2 PHE A 11 2.445 16.854 -4.229 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -1.451 13.862 -4.868 1.00 0.00 H new ATOM 0 HE2 PHE A 11 1.449 16.585 -6.488 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.501 15.084 -6.809 1.00 0.00 H new ATOM 196 N GLU A 12 -1.369 16.542 -2.482 1.00 0.00 N ATOM 197 CA GLU A 12 -2.289 17.403 -3.216 1.00 0.00 C ATOM 198 C GLU A 12 -3.002 18.346 -2.257 1.00 0.00 C ATOM 199 O GLU A 12 -3.202 19.523 -2.558 1.00 0.00 O ATOM 200 CB GLU A 12 -3.319 16.554 -3.962 1.00 0.00 C ATOM 201 CG GLU A 12 -4.291 17.463 -4.708 1.00 0.00 C ATOM 202 CD GLU A 12 -3.528 18.531 -5.484 1.00 0.00 C ATOM 203 OE1 GLU A 12 -2.845 18.173 -6.429 1.00 0.00 O ATOM 204 OE2 GLU A 12 -3.638 19.690 -5.120 1.00 0.00 O ATOM 0 H GLU A 12 -1.510 15.543 -2.632 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.719 17.990 -3.936 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -2.816 15.889 -4.664 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -3.863 15.923 -3.259 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -4.900 16.872 -5.392 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -4.973 17.935 -4.001 1.00 0.00 H new ATOM 211 N SER A 13 -3.378 17.819 -1.098 1.00 0.00 N ATOM 212 CA SER A 13 -4.063 18.619 -0.094 1.00 0.00 C ATOM 213 C SER A 13 -3.057 19.452 0.692 1.00 0.00 C ATOM 214 O SER A 13 -3.435 20.336 1.459 1.00 0.00 O ATOM 215 CB SER A 13 -4.833 17.709 0.864 1.00 0.00 C ATOM 216 OG SER A 13 -3.934 17.166 1.822 1.00 0.00 O ATOM 0 H SER A 13 -3.221 16.847 -0.832 1.00 0.00 H new ATOM 0 HA SER A 13 -4.762 19.286 -0.598 1.00 0.00 H new ATOM 0 HB2 SER A 13 -5.620 18.273 1.365 1.00 0.00 H new ATOM 0 HB3 SER A 13 -5.320 16.907 0.309 1.00 0.00 H new ATOM 0 HG SER A 13 -3.814 17.804 2.556 1.00 0.00 H new ATOM 222 N ALA A 14 -1.775 19.163 0.494 1.00 0.00 N ATOM 223 CA ALA A 14 -0.724 19.887 1.188 1.00 0.00 C ATOM 224 C ALA A 14 -0.072 20.890 0.264 1.00 0.00 C ATOM 225 O ALA A 14 -0.328 20.907 -0.940 1.00 0.00 O ATOM 226 CB ALA A 14 0.357 18.914 1.651 1.00 0.00 C ATOM 0 H ALA A 14 -1.443 18.435 -0.139 1.00 0.00 H new ATOM 0 HA ALA A 14 -1.175 20.398 2.039 1.00 0.00 H new ATOM 0 HB1 ALA A 14 1.142 19.463 2.171 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -0.080 18.179 2.327 1.00 0.00 H new ATOM 0 HB3 ALA A 14 0.782 18.404 0.786 1.00 0.00 H new ATOM 232 N SER A 15 0.817 21.686 0.826 1.00 0.00 N ATOM 233 CA SER A 15 1.550 22.642 0.034 1.00 0.00 C ATOM 234 C SER A 15 2.630 21.880 -0.716 1.00 0.00 C ATOM 235 O SER A 15 3.152 20.871 -0.222 1.00 0.00 O ATOM 236 CB SER A 15 2.182 23.706 0.930 1.00 0.00 C ATOM 237 OG SER A 15 1.788 24.995 0.479 1.00 0.00 O ATOM 0 H SER A 15 1.045 21.687 1.820 1.00 0.00 H new ATOM 0 HA SER A 15 0.882 23.149 -0.662 1.00 0.00 H new ATOM 0 HB2 SER A 15 1.870 23.559 1.964 1.00 0.00 H new ATOM 0 HB3 SER A 15 3.268 23.617 0.909 1.00 0.00 H new ATOM 0 HG SER A 15 2.191 25.680 1.053 1.00 0.00 H new ATOM 243 N ARG A 16 2.972 22.334 -1.904 1.00 0.00 N ATOM 244 CA ARG A 16 3.990 21.634 -2.651 1.00 0.00 C ATOM 245 C ARG A 16 5.148 21.336 -1.715 1.00 0.00 C ATOM 246 O ARG A 16 5.969 20.455 -1.974 1.00 0.00 O ATOM 247 CB ARG A 16 4.463 22.469 -3.843 1.00 0.00 C ATOM 248 CG ARG A 16 3.266 22.819 -4.730 1.00 0.00 C ATOM 249 CD ARG A 16 2.781 21.562 -5.452 1.00 0.00 C ATOM 250 NE ARG A 16 2.002 21.925 -6.631 1.00 0.00 N ATOM 251 CZ ARG A 16 0.844 22.567 -6.519 1.00 0.00 C ATOM 252 NH1 ARG A 16 0.386 22.887 -5.340 1.00 0.00 N ATOM 253 NH2 ARG A 16 0.164 22.877 -7.589 1.00 0.00 N ATOM 0 H ARG A 16 2.575 23.156 -2.359 1.00 0.00 H new ATOM 0 HA ARG A 16 3.581 20.704 -3.047 1.00 0.00 H new ATOM 0 HB2 ARG A 16 4.948 23.380 -3.492 1.00 0.00 H new ATOM 0 HB3 ARG A 16 5.205 21.914 -4.418 1.00 0.00 H new ATOM 0 HG2 ARG A 16 2.461 23.237 -4.125 1.00 0.00 H new ATOM 0 HG3 ARG A 16 3.548 23.582 -5.456 1.00 0.00 H new ATOM 0 HD2 ARG A 16 3.634 20.951 -5.745 1.00 0.00 H new ATOM 0 HD3 ARG A 16 2.173 20.958 -4.778 1.00 0.00 H new ATOM 0 HE ARG A 16 2.352 21.682 -7.557 1.00 0.00 H new ATOM 0 HH11 ARG A 16 0.917 22.644 -4.504 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -0.503 23.380 -5.255 1.00 0.00 H new ATOM 0 HH21 ARG A 16 0.521 22.626 -8.511 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -0.725 23.370 -7.503 1.00 0.00 H new ATOM 267 N GLY A 17 5.188 22.074 -0.609 1.00 0.00 N ATOM 268 CA GLY A 17 6.228 21.884 0.387 1.00 0.00 C ATOM 269 C GLY A 17 6.196 20.453 0.910 1.00 0.00 C ATOM 270 O GLY A 17 7.240 19.822 1.062 1.00 0.00 O ATOM 0 H GLY A 17 4.513 22.805 -0.384 1.00 0.00 H new ATOM 0 HA2 GLY A 17 7.204 22.098 -0.049 1.00 0.00 H new ATOM 0 HA3 GLY A 17 6.086 22.584 1.211 1.00 0.00 H new ATOM 274 N CYS A 18 4.993 19.928 1.161 1.00 0.00 N ATOM 275 CA CYS A 18 4.873 18.558 1.638 1.00 0.00 C ATOM 276 C CYS A 18 5.289 17.619 0.533 1.00 0.00 C ATOM 277 O CYS A 18 5.816 16.543 0.788 1.00 0.00 O ATOM 278 CB CYS A 18 3.434 18.243 2.048 1.00 0.00 C ATOM 279 SG CYS A 18 3.444 17.275 3.578 1.00 0.00 S ATOM 0 H CYS A 18 4.109 20.423 1.043 1.00 0.00 H new ATOM 0 HA CYS A 18 5.515 18.434 2.510 1.00 0.00 H new ATOM 0 HB2 CYS A 18 2.875 19.167 2.193 1.00 0.00 H new ATOM 0 HB3 CYS A 18 2.932 17.687 1.256 1.00 0.00 H new ATOM 0 HG CYS A 18 3.362 18.076 4.599 1.00 0.00 H new ATOM 285 N LEU A 19 5.054 18.031 -0.702 1.00 0.00 N ATOM 286 CA LEU A 19 5.436 17.196 -1.824 1.00 0.00 C ATOM 287 C LEU A 19 6.952 17.062 -1.853 1.00 0.00 C ATOM 288 O LEU A 19 7.484 15.970 -2.050 1.00 0.00 O ATOM 289 CB LEU A 19 4.921 17.791 -3.132 1.00 0.00 C ATOM 290 CG LEU A 19 5.195 16.821 -4.289 1.00 0.00 C ATOM 291 CD1 LEU A 19 4.679 15.418 -3.940 1.00 0.00 C ATOM 292 CD2 LEU A 19 4.489 17.323 -5.551 1.00 0.00 C ATOM 0 H LEU A 19 4.612 18.917 -0.948 1.00 0.00 H new ATOM 0 HA LEU A 19 4.991 16.208 -1.709 1.00 0.00 H new ATOM 0 HB2 LEU A 19 3.852 17.988 -3.056 1.00 0.00 H new ATOM 0 HB3 LEU A 19 5.408 18.747 -3.324 1.00 0.00 H new ATOM 0 HG LEU A 19 6.270 16.770 -4.462 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.880 14.740 -4.769 1.00 0.00 H new ATOM 0 HD12 LEU A 19 5.185 15.056 -3.045 1.00 0.00 H new ATOM 0 HD13 LEU A 19 3.605 15.460 -3.758 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.682 16.635 -6.374 1.00 0.00 H new ATOM 0 HD22 LEU A 19 3.416 17.379 -5.370 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.865 18.313 -5.809 1.00 0.00 H new ATOM 304 N ARG A 20 7.643 18.173 -1.610 1.00 0.00 N ATOM 305 CA ARG A 20 9.099 18.152 -1.565 1.00 0.00 C ATOM 306 C ARG A 20 9.525 17.352 -0.340 1.00 0.00 C ATOM 307 O ARG A 20 10.541 16.663 -0.345 1.00 0.00 O ATOM 308 CB ARG A 20 9.647 19.581 -1.487 1.00 0.00 C ATOM 309 CG ARG A 20 10.990 19.587 -0.770 1.00 0.00 C ATOM 310 CD ARG A 20 10.781 19.453 0.740 1.00 0.00 C ATOM 311 NE ARG A 20 11.402 20.575 1.438 1.00 0.00 N ATOM 312 CZ ARG A 20 10.692 21.636 1.808 1.00 0.00 C ATOM 313 NH1 ARG A 20 9.414 21.691 1.545 1.00 0.00 N ATOM 314 NH2 ARG A 20 11.272 22.624 2.432 1.00 0.00 N ATOM 0 H ARG A 20 7.223 19.087 -1.443 1.00 0.00 H new ATOM 0 HA ARG A 20 9.496 17.689 -2.468 1.00 0.00 H new ATOM 0 HB2 ARG A 20 9.760 19.991 -2.491 1.00 0.00 H new ATOM 0 HB3 ARG A 20 8.941 20.221 -0.959 1.00 0.00 H new ATOM 0 HG2 ARG A 20 11.609 18.766 -1.133 1.00 0.00 H new ATOM 0 HG3 ARG A 20 11.524 20.511 -0.990 1.00 0.00 H new ATOM 0 HD2 ARG A 20 9.715 19.421 0.965 1.00 0.00 H new ATOM 0 HD3 ARG A 20 11.210 18.515 1.092 1.00 0.00 H new ATOM 0 HE ARG A 20 12.400 20.544 1.646 1.00 0.00 H new ATOM 0 HH11 ARG A 20 8.960 20.920 1.056 1.00 0.00 H new ATOM 0 HH12 ARG A 20 8.869 22.505 1.829 1.00 0.00 H new ATOM 0 HH21 ARG A 20 12.271 22.582 2.636 1.00 0.00 H new ATOM 0 HH22 ARG A 20 10.727 23.438 2.716 1.00 0.00 H new ATOM 328 N SER A 21 8.701 17.440 0.696 1.00 0.00 N ATOM 329 CA SER A 21 8.931 16.717 1.938 1.00 0.00 C ATOM 330 C SER A 21 8.867 15.212 1.674 1.00 0.00 C ATOM 331 O SER A 21 9.826 14.476 1.947 1.00 0.00 O ATOM 332 CB SER A 21 7.854 17.172 2.923 1.00 0.00 C ATOM 333 OG SER A 21 7.711 18.582 2.825 1.00 0.00 O ATOM 0 H SER A 21 7.857 18.013 0.698 1.00 0.00 H new ATOM 0 HA SER A 21 9.917 16.924 2.354 1.00 0.00 H new ATOM 0 HB2 SER A 21 6.907 16.680 2.701 1.00 0.00 H new ATOM 0 HB3 SER A 21 8.129 16.890 3.939 1.00 0.00 H new ATOM 0 HG SER A 21 7.408 18.818 1.924 1.00 0.00 H new ATOM 339 N LEU A 22 7.768 14.761 1.097 1.00 0.00 N ATOM 340 CA LEU A 22 7.621 13.352 0.779 1.00 0.00 C ATOM 341 C LEU A 22 8.702 12.919 -0.199 1.00 0.00 C ATOM 342 O LEU A 22 9.428 11.951 0.039 1.00 0.00 O ATOM 343 CB LEU A 22 6.262 13.103 0.141 1.00 0.00 C ATOM 344 CG LEU A 22 5.479 12.110 0.985 1.00 0.00 C ATOM 345 CD1 LEU A 22 4.993 12.787 2.255 1.00 0.00 C ATOM 346 CD2 LEU A 22 4.282 11.622 0.195 1.00 0.00 C ATOM 0 H LEU A 22 6.971 15.343 0.841 1.00 0.00 H new ATOM 0 HA LEU A 22 7.710 12.780 1.703 1.00 0.00 H new ATOM 0 HB2 LEU A 22 5.711 14.040 0.058 1.00 0.00 H new ATOM 0 HB3 LEU A 22 6.389 12.716 -0.870 1.00 0.00 H new ATOM 0 HG LEU A 22 6.123 11.270 1.245 1.00 0.00 H new ATOM 0 HD11 LEU A 22 4.432 12.072 2.857 1.00 0.00 H new ATOM 0 HD12 LEU A 22 5.849 13.149 2.825 1.00 0.00 H new ATOM 0 HD13 LEU A 22 4.349 13.627 1.996 1.00 0.00 H new ATOM 0 HD21 LEU A 22 3.716 10.909 0.795 1.00 0.00 H new ATOM 0 HD22 LEU A 22 3.645 12.469 -0.060 1.00 0.00 H new ATOM 0 HD23 LEU A 22 4.623 11.136 -0.719 1.00 0.00 H new ATOM 358 N SER A 23 8.791 13.633 -1.315 1.00 0.00 N ATOM 359 CA SER A 23 9.767 13.291 -2.326 1.00 0.00 C ATOM 360 C SER A 23 11.163 13.262 -1.734 1.00 0.00 C ATOM 361 O SER A 23 12.009 12.479 -2.166 1.00 0.00 O ATOM 362 CB SER A 23 9.685 14.230 -3.519 1.00 0.00 C ATOM 363 OG SER A 23 10.997 14.584 -3.934 1.00 0.00 O ATOM 0 H SER A 23 8.206 14.439 -1.535 1.00 0.00 H new ATOM 0 HA SER A 23 9.537 12.290 -2.691 1.00 0.00 H new ATOM 0 HB2 SER A 23 9.150 13.749 -4.338 1.00 0.00 H new ATOM 0 HB3 SER A 23 9.122 15.125 -3.253 1.00 0.00 H new ATOM 0 HG SER A 23 10.945 15.188 -4.704 1.00 0.00 H new ATOM 369 N LEU A 24 11.393 14.079 -0.717 1.00 0.00 N ATOM 370 CA LEU A 24 12.682 14.079 -0.061 1.00 0.00 C ATOM 371 C LEU A 24 12.957 12.677 0.463 1.00 0.00 C ATOM 372 O LEU A 24 14.101 12.224 0.487 1.00 0.00 O ATOM 373 CB LEU A 24 12.688 15.081 1.085 1.00 0.00 C ATOM 374 CG LEU A 24 13.713 16.180 0.801 1.00 0.00 C ATOM 375 CD1 LEU A 24 15.127 15.609 0.916 1.00 0.00 C ATOM 376 CD2 LEU A 24 13.509 16.745 -0.609 1.00 0.00 C ATOM 0 H LEU A 24 10.714 14.738 -0.337 1.00 0.00 H new ATOM 0 HA LEU A 24 13.459 14.368 -0.769 1.00 0.00 H new ATOM 0 HB2 LEU A 24 11.696 15.517 1.205 1.00 0.00 H new ATOM 0 HB3 LEU A 24 12.930 14.577 2.021 1.00 0.00 H new ATOM 0 HG LEU A 24 13.579 16.980 1.530 1.00 0.00 H new ATOM 0 HD11 LEU A 24 15.854 16.395 0.713 1.00 0.00 H new ATOM 0 HD12 LEU A 24 15.282 15.222 1.923 1.00 0.00 H new ATOM 0 HD13 LEU A 24 15.253 14.802 0.194 1.00 0.00 H new ATOM 0 HD21 LEU A 24 14.245 17.526 -0.798 1.00 0.00 H new ATOM 0 HD22 LEU A 24 13.630 15.947 -1.342 1.00 0.00 H new ATOM 0 HD23 LEU A 24 12.506 17.164 -0.692 1.00 0.00 H new ATOM 388 N ILE A 25 11.890 11.986 0.872 1.00 0.00 N ATOM 389 CA ILE A 25 12.041 10.623 1.381 1.00 0.00 C ATOM 390 C ILE A 25 11.326 9.592 0.503 1.00 0.00 C ATOM 391 O ILE A 25 11.004 8.498 0.967 1.00 0.00 O ATOM 392 CB ILE A 25 11.512 10.507 2.808 1.00 0.00 C ATOM 393 CG1 ILE A 25 12.126 9.261 3.452 1.00 0.00 C ATOM 394 CG2 ILE A 25 10.003 10.331 2.781 1.00 0.00 C ATOM 395 CD1 ILE A 25 13.047 9.662 4.605 1.00 0.00 C ATOM 0 H ILE A 25 10.933 12.339 0.861 1.00 0.00 H new ATOM 0 HA ILE A 25 13.110 10.410 1.365 1.00 0.00 H new ATOM 0 HB ILE A 25 11.770 11.406 3.368 1.00 0.00 H new ATOM 0 HG12 ILE A 25 11.336 8.606 3.819 1.00 0.00 H new ATOM 0 HG13 ILE A 25 12.688 8.697 2.707 1.00 0.00 H new ATOM 0 HG21 ILE A 25 9.628 10.248 3.801 1.00 0.00 H new ATOM 0 HG22 ILE A 25 9.545 11.192 2.295 1.00 0.00 H new ATOM 0 HG23 ILE A 25 9.752 9.426 2.228 1.00 0.00 H new ATOM 0 HD11 ILE A 25 13.477 8.767 5.055 1.00 0.00 H new ATOM 0 HD12 ILE A 25 13.847 10.299 4.227 1.00 0.00 H new ATOM 0 HD13 ILE A 25 12.474 10.206 5.356 1.00 0.00 H new ATOM 407 N ILE A 26 11.077 9.936 -0.755 1.00 0.00 N ATOM 408 CA ILE A 26 10.406 9.035 -1.666 1.00 0.00 C ATOM 409 C ILE A 26 11.257 7.793 -1.927 1.00 0.00 C ATOM 410 O ILE A 26 12.447 7.900 -2.222 1.00 0.00 O ATOM 411 CB ILE A 26 10.154 9.789 -2.981 1.00 0.00 C ATOM 412 CG1 ILE A 26 8.680 10.171 -3.097 1.00 0.00 C ATOM 413 CG2 ILE A 26 10.537 8.929 -4.169 1.00 0.00 C ATOM 414 CD1 ILE A 26 7.860 8.941 -3.418 1.00 0.00 C ATOM 0 H ILE A 26 11.333 10.836 -1.162 1.00 0.00 H new ATOM 0 HA ILE A 26 9.464 8.704 -1.230 1.00 0.00 H new ATOM 0 HB ILE A 26 10.766 10.691 -2.977 1.00 0.00 H new ATOM 0 HG12 ILE A 26 8.335 10.617 -2.164 1.00 0.00 H new ATOM 0 HG13 ILE A 26 8.549 10.921 -3.877 1.00 0.00 H new ATOM 0 HG21 ILE A 26 10.352 9.479 -5.091 1.00 0.00 H new ATOM 0 HG22 ILE A 26 11.594 8.672 -4.106 1.00 0.00 H new ATOM 0 HG23 ILE A 26 9.941 8.017 -4.165 1.00 0.00 H new ATOM 0 HD11 ILE A 26 6.808 9.216 -3.500 1.00 0.00 H new ATOM 0 HD12 ILE A 26 8.198 8.514 -4.362 1.00 0.00 H new ATOM 0 HD13 ILE A 26 7.981 8.205 -2.623 1.00 0.00 H new ATOM 426 N LYS A 27 10.638 6.617 -1.846 1.00 0.00 N ATOM 427 CA LYS A 27 11.370 5.378 -2.112 1.00 0.00 C ATOM 428 C LYS A 27 10.724 4.611 -3.266 1.00 0.00 C ATOM 429 O LYS A 27 9.526 4.746 -3.519 1.00 0.00 O ATOM 430 CB LYS A 27 11.427 4.498 -0.859 1.00 0.00 C ATOM 431 CG LYS A 27 11.881 5.337 0.337 1.00 0.00 C ATOM 432 CD LYS A 27 13.405 5.465 0.318 1.00 0.00 C ATOM 433 CE LYS A 27 13.899 5.939 1.684 1.00 0.00 C ATOM 434 NZ LYS A 27 15.294 5.464 1.895 1.00 0.00 N ATOM 0 H LYS A 27 9.655 6.495 -1.604 1.00 0.00 H new ATOM 0 HA LYS A 27 12.389 5.642 -2.394 1.00 0.00 H new ATOM 0 HB2 LYS A 27 10.446 4.065 -0.661 1.00 0.00 H new ATOM 0 HB3 LYS A 27 12.116 3.668 -1.016 1.00 0.00 H new ATOM 0 HG2 LYS A 27 11.422 6.325 0.298 1.00 0.00 H new ATOM 0 HG3 LYS A 27 11.556 4.871 1.267 1.00 0.00 H new ATOM 0 HD2 LYS A 27 13.857 4.505 0.070 1.00 0.00 H new ATOM 0 HD3 LYS A 27 13.711 6.170 -0.455 1.00 0.00 H new ATOM 0 HE2 LYS A 27 13.861 7.027 1.740 1.00 0.00 H new ATOM 0 HE3 LYS A 27 13.249 5.556 2.471 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 15.633 5.785 2.824 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 15.316 4.425 1.858 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 15.909 5.850 1.150 1.00 0.00 H new ATOM 448 N THR A 28 11.522 3.811 -3.967 1.00 0.00 N ATOM 449 CA THR A 28 11.008 3.035 -5.093 1.00 0.00 C ATOM 450 C THR A 28 11.374 1.557 -4.955 1.00 0.00 C ATOM 451 O THR A 28 12.498 1.216 -4.586 1.00 0.00 O ATOM 452 CB THR A 28 11.575 3.580 -6.405 1.00 0.00 C ATOM 453 OG1 THR A 28 12.955 3.254 -6.492 1.00 0.00 O ATOM 454 CG2 THR A 28 11.405 5.100 -6.447 1.00 0.00 C ATOM 0 H THR A 28 12.516 3.683 -3.779 1.00 0.00 H new ATOM 0 HA THR A 28 9.922 3.125 -5.097 1.00 0.00 H new ATOM 0 HB THR A 28 11.041 3.135 -7.244 1.00 0.00 H new ATOM 0 HG1 THR A 28 13.071 2.474 -7.073 1.00 0.00 H new ATOM 0 HG21 THR A 28 11.810 5.486 -7.383 1.00 0.00 H new ATOM 0 HG22 THR A 28 10.346 5.350 -6.379 1.00 0.00 H new ATOM 0 HG23 THR A 28 11.938 5.549 -5.609 1.00 0.00 H new ATOM 462 N SER A 29 10.416 0.687 -5.265 1.00 0.00 N ATOM 463 CA SER A 29 10.639 -0.755 -5.187 1.00 0.00 C ATOM 464 C SER A 29 10.151 -1.428 -6.469 1.00 0.00 C ATOM 465 O SER A 29 9.106 -1.067 -7.007 1.00 0.00 O ATOM 466 CB SER A 29 9.895 -1.337 -3.982 1.00 0.00 C ATOM 467 OG SER A 29 8.705 -0.592 -3.760 1.00 0.00 O ATOM 0 H SER A 29 9.480 0.954 -5.572 1.00 0.00 H new ATOM 0 HA SER A 29 11.707 -0.940 -5.070 1.00 0.00 H new ATOM 0 HB2 SER A 29 9.654 -2.385 -4.160 1.00 0.00 H new ATOM 0 HB3 SER A 29 10.530 -1.302 -3.097 1.00 0.00 H new ATOM 0 HG SER A 29 8.897 0.160 -3.161 1.00 0.00 H new ATOM 473 N PHE A 30 10.916 -2.399 -6.962 1.00 0.00 N ATOM 474 CA PHE A 30 10.540 -3.092 -8.190 1.00 0.00 C ATOM 475 C PHE A 30 10.660 -4.609 -8.038 1.00 0.00 C ATOM 476 O PHE A 30 11.593 -5.108 -7.410 1.00 0.00 O ATOM 477 CB PHE A 30 11.432 -2.626 -9.343 1.00 0.00 C ATOM 478 CG PHE A 30 12.264 -1.447 -8.900 1.00 0.00 C ATOM 479 CD1 PHE A 30 13.491 -1.660 -8.265 1.00 0.00 C ATOM 480 CD2 PHE A 30 11.812 -0.142 -9.130 1.00 0.00 C ATOM 481 CE1 PHE A 30 14.269 -0.569 -7.858 1.00 0.00 C ATOM 482 CE2 PHE A 30 12.587 0.950 -8.723 1.00 0.00 C ATOM 483 CZ PHE A 30 13.816 0.736 -8.087 1.00 0.00 C ATOM 0 H PHE A 30 11.786 -2.720 -6.538 1.00 0.00 H new ATOM 0 HA PHE A 30 9.498 -2.851 -8.403 1.00 0.00 H new ATOM 0 HB2 PHE A 30 12.081 -3.440 -9.665 1.00 0.00 H new ATOM 0 HB3 PHE A 30 10.819 -2.349 -10.200 1.00 0.00 H new ATOM 0 HD1 PHE A 30 13.839 -2.667 -8.088 1.00 0.00 H new ATOM 0 HD2 PHE A 30 10.865 0.022 -9.622 1.00 0.00 H new ATOM 0 HE1 PHE A 30 15.217 -0.734 -7.368 1.00 0.00 H new ATOM 0 HE2 PHE A 30 12.238 1.957 -8.899 1.00 0.00 H new ATOM 0 HZ PHE A 30 14.415 1.578 -7.773 1.00 0.00 H new ATOM 493 N CYS A 31 9.710 -5.334 -8.631 1.00 0.00 N ATOM 494 CA CYS A 31 9.719 -6.795 -8.571 1.00 0.00 C ATOM 495 C CYS A 31 9.711 -7.392 -9.974 1.00 0.00 C ATOM 496 O CYS A 31 9.218 -6.780 -10.922 1.00 0.00 O ATOM 497 CB CYS A 31 8.505 -7.310 -7.799 1.00 0.00 C ATOM 498 SG CYS A 31 8.184 -6.225 -6.390 1.00 0.00 S ATOM 0 H CYS A 31 8.930 -4.936 -9.155 1.00 0.00 H new ATOM 0 HA CYS A 31 10.630 -7.101 -8.056 1.00 0.00 H new ATOM 0 HB2 CYS A 31 7.633 -7.344 -8.452 1.00 0.00 H new ATOM 0 HB3 CYS A 31 8.685 -8.328 -7.454 1.00 0.00 H new ATOM 0 HG CYS A 31 6.911 -6.223 -6.125 1.00 0.00 H new ATOM 504 N ALA A 32 10.267 -8.590 -10.094 1.00 0.00 N ATOM 505 CA ALA A 32 10.334 -9.273 -11.380 1.00 0.00 C ATOM 506 C ALA A 32 9.395 -10.480 -11.401 1.00 0.00 C ATOM 507 O ALA A 32 8.855 -10.868 -10.365 1.00 0.00 O ATOM 508 CB ALA A 32 11.768 -9.745 -11.620 1.00 0.00 C ATOM 0 H ALA A 32 10.678 -9.109 -9.318 1.00 0.00 H new ATOM 0 HA ALA A 32 10.028 -8.580 -12.164 1.00 0.00 H new ATOM 0 HB1 ALA A 32 11.827 -10.257 -12.580 1.00 0.00 H new ATOM 0 HB2 ALA A 32 12.438 -8.885 -11.626 1.00 0.00 H new ATOM 0 HB3 ALA A 32 12.064 -10.430 -10.825 1.00 0.00 H new ATOM 514 N PRO A 33 9.202 -11.093 -12.544 1.00 0.00 N ATOM 515 CA PRO A 33 8.329 -12.296 -12.658 1.00 0.00 C ATOM 516 C PRO A 33 8.902 -13.453 -11.844 1.00 0.00 C ATOM 517 O PRO A 33 10.073 -13.801 -11.993 1.00 0.00 O ATOM 518 CB PRO A 33 8.324 -12.629 -14.156 1.00 0.00 C ATOM 519 CG PRO A 33 8.881 -11.429 -14.849 1.00 0.00 C ATOM 520 CD PRO A 33 9.781 -10.716 -13.842 1.00 0.00 C ATOM 0 HA PRO A 33 7.324 -12.120 -12.274 1.00 0.00 H new ATOM 0 HB2 PRO A 33 8.928 -13.513 -14.361 1.00 0.00 H new ATOM 0 HB3 PRO A 33 7.314 -12.846 -14.504 1.00 0.00 H new ATOM 0 HG2 PRO A 33 9.447 -11.721 -15.734 1.00 0.00 H new ATOM 0 HG3 PRO A 33 8.080 -10.771 -15.186 1.00 0.00 H new ATOM 0 HD2 PRO A 33 10.818 -11.040 -13.929 1.00 0.00 H new ATOM 0 HD3 PRO A 33 9.771 -9.636 -13.988 1.00 0.00 H new ATOM 528 N GLY A 34 8.084 -14.036 -10.976 1.00 0.00 N ATOM 529 CA GLY A 34 8.551 -15.137 -10.145 1.00 0.00 C ATOM 530 C GLY A 34 9.527 -14.626 -9.087 1.00 0.00 C ATOM 531 O GLY A 34 10.122 -15.408 -8.347 1.00 0.00 O ATOM 0 H GLY A 34 7.110 -13.770 -10.831 1.00 0.00 H new ATOM 0 HA2 GLY A 34 7.703 -15.623 -9.663 1.00 0.00 H new ATOM 0 HA3 GLY A 34 9.038 -15.889 -10.766 1.00 0.00 H new ATOM 535 N GLU A 35 9.702 -13.306 -9.040 1.00 0.00 N ATOM 536 CA GLU A 35 10.631 -12.697 -8.086 1.00 0.00 C ATOM 537 C GLU A 35 10.037 -12.645 -6.680 1.00 0.00 C ATOM 538 O GLU A 35 8.918 -12.185 -6.485 1.00 0.00 O ATOM 539 CB GLU A 35 11.002 -11.292 -8.542 1.00 0.00 C ATOM 540 CG GLU A 35 12.458 -11.021 -8.189 1.00 0.00 C ATOM 541 CD GLU A 35 13.371 -11.521 -9.304 1.00 0.00 C ATOM 542 OE1 GLU A 35 13.080 -12.568 -9.857 1.00 0.00 O ATOM 543 OE2 GLU A 35 14.348 -10.848 -9.587 1.00 0.00 O ATOM 0 H GLU A 35 9.218 -12.642 -9.645 1.00 0.00 H new ATOM 0 HA GLU A 35 11.526 -13.318 -8.051 1.00 0.00 H new ATOM 0 HB2 GLU A 35 10.851 -11.194 -9.617 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.356 -10.558 -8.061 1.00 0.00 H new ATOM 0 HG2 GLU A 35 12.610 -9.953 -8.036 1.00 0.00 H new ATOM 0 HG3 GLU A 35 12.711 -11.517 -7.252 1.00 0.00 H new ATOM 550 N PHE A 36 10.800 -13.126 -5.701 1.00 0.00 N ATOM 551 CA PHE A 36 10.337 -13.138 -4.314 1.00 0.00 C ATOM 552 C PHE A 36 10.554 -11.783 -3.642 1.00 0.00 C ATOM 553 O PHE A 36 11.688 -11.325 -3.497 1.00 0.00 O ATOM 554 CB PHE A 36 11.077 -14.221 -3.526 1.00 0.00 C ATOM 555 CG PHE A 36 11.258 -15.440 -4.396 1.00 0.00 C ATOM 556 CD1 PHE A 36 12.318 -15.499 -5.309 1.00 0.00 C ATOM 557 CD2 PHE A 36 10.366 -16.514 -4.289 1.00 0.00 C ATOM 558 CE1 PHE A 36 12.485 -16.630 -6.116 1.00 0.00 C ATOM 559 CE2 PHE A 36 10.533 -17.646 -5.097 1.00 0.00 C ATOM 560 CZ PHE A 36 11.592 -17.704 -6.010 1.00 0.00 C ATOM 0 H PHE A 36 11.735 -13.510 -5.840 1.00 0.00 H new ATOM 0 HA PHE A 36 9.268 -13.350 -4.321 1.00 0.00 H new ATOM 0 HB2 PHE A 36 12.047 -13.848 -3.197 1.00 0.00 H new ATOM 0 HB3 PHE A 36 10.515 -14.481 -2.629 1.00 0.00 H new ATOM 0 HD1 PHE A 36 13.007 -14.671 -5.390 1.00 0.00 H new ATOM 0 HD2 PHE A 36 9.549 -16.470 -3.584 1.00 0.00 H new ATOM 0 HE1 PHE A 36 13.302 -16.675 -6.821 1.00 0.00 H new ATOM 0 HE2 PHE A 36 9.844 -18.474 -5.015 1.00 0.00 H new ATOM 0 HZ PHE A 36 11.721 -18.577 -6.633 1.00 0.00 H new ATOM 570 N LEU A 37 9.458 -11.147 -3.228 1.00 0.00 N ATOM 571 CA LEU A 37 9.544 -9.848 -2.569 1.00 0.00 C ATOM 572 C LEU A 37 9.611 -9.992 -1.051 1.00 0.00 C ATOM 573 O LEU A 37 10.362 -9.267 -0.399 1.00 0.00 O ATOM 574 CB LEU A 37 8.349 -8.971 -2.930 1.00 0.00 C ATOM 575 CG LEU A 37 8.765 -7.498 -2.885 1.00 0.00 C ATOM 576 CD1 LEU A 37 9.782 -7.210 -3.991 1.00 0.00 C ATOM 577 CD2 LEU A 37 7.528 -6.619 -3.086 1.00 0.00 C ATOM 0 H LEU A 37 8.510 -11.507 -3.337 1.00 0.00 H new ATOM 0 HA LEU A 37 10.462 -9.377 -2.921 1.00 0.00 H new ATOM 0 HB2 LEU A 37 7.984 -9.227 -3.925 1.00 0.00 H new ATOM 0 HB3 LEU A 37 7.529 -9.150 -2.234 1.00 0.00 H new ATOM 0 HG LEU A 37 9.219 -7.280 -1.918 1.00 0.00 H new ATOM 0 HD11 LEU A 37 10.073 -6.160 -3.953 1.00 0.00 H new ATOM 0 HD12 LEU A 37 10.662 -7.836 -3.848 1.00 0.00 H new ATOM 0 HD13 LEU A 37 9.336 -7.428 -4.961 1.00 0.00 H new ATOM 0 HD21 LEU A 37 7.819 -5.569 -3.055 1.00 0.00 H new ATOM 0 HD22 LEU A 37 7.076 -6.842 -4.053 1.00 0.00 H new ATOM 0 HD23 LEU A 37 6.807 -6.819 -2.294 1.00 0.00 H new ATOM 589 N ILE A 38 8.847 -10.928 -0.471 1.00 0.00 N ATOM 590 CA ILE A 38 8.903 -11.098 0.966 1.00 0.00 C ATOM 591 C ILE A 38 9.035 -12.553 1.324 1.00 0.00 C ATOM 592 O ILE A 38 8.652 -13.442 0.564 1.00 0.00 O ATOM 593 CB ILE A 38 7.698 -10.472 1.693 1.00 0.00 C ATOM 594 CG1 ILE A 38 6.497 -11.406 1.701 1.00 0.00 C ATOM 595 CG2 ILE A 38 7.307 -9.154 1.046 1.00 0.00 C ATOM 596 CD1 ILE A 38 6.602 -12.352 2.877 1.00 0.00 C ATOM 0 H ILE A 38 8.208 -11.553 -0.963 1.00 0.00 H new ATOM 0 HA ILE A 38 9.789 -10.562 1.307 1.00 0.00 H new ATOM 0 HB ILE A 38 8.003 -10.295 2.724 1.00 0.00 H new ATOM 0 HG12 ILE A 38 5.575 -10.829 1.766 1.00 0.00 H new ATOM 0 HG13 ILE A 38 6.455 -11.970 0.769 1.00 0.00 H new ATOM 0 HG21 ILE A 38 6.454 -8.728 1.574 1.00 0.00 H new ATOM 0 HG22 ILE A 38 8.147 -8.461 1.095 1.00 0.00 H new ATOM 0 HG23 ILE A 38 7.039 -9.326 0.003 1.00 0.00 H new ATOM 0 HD11 ILE A 38 5.742 -13.021 2.883 1.00 0.00 H new ATOM 0 HD12 ILE A 38 7.517 -12.938 2.792 1.00 0.00 H new ATOM 0 HD13 ILE A 38 6.623 -11.779 3.804 1.00 0.00 H new ATOM 608 N ARG A 39 9.583 -12.779 2.499 1.00 0.00 N ATOM 609 CA ARG A 39 9.781 -14.125 2.995 1.00 0.00 C ATOM 610 C ARG A 39 9.218 -14.247 4.405 1.00 0.00 C ATOM 611 O ARG A 39 9.695 -13.600 5.338 1.00 0.00 O ATOM 612 CB ARG A 39 11.268 -14.443 2.990 1.00 0.00 C ATOM 613 CG ARG A 39 11.507 -15.836 3.553 1.00 0.00 C ATOM 614 CD ARG A 39 10.996 -16.870 2.556 1.00 0.00 C ATOM 615 NE ARG A 39 12.053 -17.822 2.232 1.00 0.00 N ATOM 616 CZ ARG A 39 12.973 -17.543 1.315 1.00 0.00 C ATOM 617 NH1 ARG A 39 12.935 -16.407 0.673 1.00 0.00 N ATOM 618 NH2 ARG A 39 13.916 -18.407 1.054 1.00 0.00 N ATOM 0 H ARG A 39 9.901 -12.044 3.131 1.00 0.00 H new ATOM 0 HA ARG A 39 9.259 -14.834 2.353 1.00 0.00 H new ATOM 0 HB2 ARG A 39 11.657 -14.381 1.974 1.00 0.00 H new ATOM 0 HB3 ARG A 39 11.808 -13.705 3.584 1.00 0.00 H new ATOM 0 HG2 ARG A 39 12.570 -15.988 3.742 1.00 0.00 H new ATOM 0 HG3 ARG A 39 10.994 -15.949 4.508 1.00 0.00 H new ATOM 0 HD2 ARG A 39 10.138 -17.396 2.974 1.00 0.00 H new ATOM 0 HD3 ARG A 39 10.654 -16.373 1.648 1.00 0.00 H new ATOM 0 HE ARG A 39 12.086 -18.718 2.718 1.00 0.00 H new ATOM 0 HH11 ARG A 39 12.198 -15.731 0.875 1.00 0.00 H new ATOM 0 HH12 ARG A 39 13.642 -16.195 -0.031 1.00 0.00 H new ATOM 0 HH21 ARG A 39 13.946 -19.296 1.554 1.00 0.00 H new ATOM 0 HH22 ARG A 39 14.623 -18.194 0.350 1.00 0.00 H new ATOM 632 N GLN A 40 8.196 -15.073 4.540 1.00 0.00 N ATOM 633 CA GLN A 40 7.539 -15.284 5.826 1.00 0.00 C ATOM 634 C GLN A 40 8.454 -14.918 6.991 1.00 0.00 C ATOM 635 O GLN A 40 9.598 -15.366 7.062 1.00 0.00 O ATOM 636 CB GLN A 40 7.109 -16.747 5.956 1.00 0.00 C ATOM 637 CG GLN A 40 8.197 -17.657 5.388 1.00 0.00 C ATOM 638 CD GLN A 40 9.398 -17.694 6.326 1.00 0.00 C ATOM 639 OE1 GLN A 40 9.239 -17.589 7.543 1.00 0.00 O ATOM 640 NE2 GLN A 40 10.596 -17.836 5.831 1.00 0.00 N ATOM 0 H GLN A 40 7.798 -15.614 3.772 1.00 0.00 H new ATOM 0 HA GLN A 40 6.665 -14.634 5.863 1.00 0.00 H new ATOM 0 HB2 GLN A 40 6.928 -16.991 7.003 1.00 0.00 H new ATOM 0 HB3 GLN A 40 6.172 -16.909 5.424 1.00 0.00 H new ATOM 0 HG2 GLN A 40 7.803 -18.664 5.250 1.00 0.00 H new ATOM 0 HG3 GLN A 40 8.505 -17.298 4.406 1.00 0.00 H new ATOM 0 HE21 GLN A 40 10.724 -17.923 4.823 1.00 0.00 H new ATOM 0 HE22 GLN A 40 11.405 -17.860 6.452 1.00 0.00 H new ATOM 649 N GLY A 41 7.932 -14.113 7.914 1.00 0.00 N ATOM 650 CA GLY A 41 8.699 -13.710 9.085 1.00 0.00 C ATOM 651 C GLY A 41 9.388 -12.365 8.888 1.00 0.00 C ATOM 652 O GLY A 41 10.167 -11.938 9.741 1.00 0.00 O ATOM 0 H GLY A 41 6.987 -13.730 7.872 1.00 0.00 H new ATOM 0 HA2 GLY A 41 8.037 -13.654 9.949 1.00 0.00 H new ATOM 0 HA3 GLY A 41 9.448 -14.471 9.306 1.00 0.00 H new ATOM 656 N ASP A 42 9.104 -11.694 7.780 1.00 0.00 N ATOM 657 CA ASP A 42 9.724 -10.398 7.533 1.00 0.00 C ATOM 658 C ASP A 42 8.969 -9.308 8.280 1.00 0.00 C ATOM 659 O ASP A 42 8.001 -9.582 8.989 1.00 0.00 O ATOM 660 CB ASP A 42 9.740 -10.077 6.040 1.00 0.00 C ATOM 661 CG ASP A 42 11.137 -10.307 5.474 1.00 0.00 C ATOM 662 OD1 ASP A 42 12.088 -9.854 6.089 1.00 0.00 O ATOM 663 OD2 ASP A 42 11.236 -10.933 4.430 1.00 0.00 O ATOM 0 H ASP A 42 8.464 -12.015 7.053 1.00 0.00 H new ATOM 0 HA ASP A 42 10.753 -10.440 7.891 1.00 0.00 H new ATOM 0 HB2 ASP A 42 9.018 -10.704 5.517 1.00 0.00 H new ATOM 0 HB3 ASP A 42 9.439 -9.042 5.879 1.00 0.00 H new ATOM 668 N ALA A 43 9.423 -8.073 8.122 1.00 0.00 N ATOM 669 CA ALA A 43 8.789 -6.948 8.793 1.00 0.00 C ATOM 670 C ALA A 43 8.332 -5.902 7.781 1.00 0.00 C ATOM 671 O ALA A 43 9.092 -5.508 6.896 1.00 0.00 O ATOM 672 CB ALA A 43 9.778 -6.315 9.767 1.00 0.00 C ATOM 0 H ALA A 43 10.223 -7.826 7.539 1.00 0.00 H new ATOM 0 HA ALA A 43 7.916 -7.313 9.334 1.00 0.00 H new ATOM 0 HB1 ALA A 43 9.304 -5.472 10.270 1.00 0.00 H new ATOM 0 HB2 ALA A 43 10.084 -7.054 10.507 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.654 -5.965 9.220 1.00 0.00 H new ATOM 678 N LEU A 44 7.091 -5.451 7.920 1.00 0.00 N ATOM 679 CA LEU A 44 6.549 -4.446 7.014 1.00 0.00 C ATOM 680 C LEU A 44 6.656 -3.057 7.633 1.00 0.00 C ATOM 681 O LEU A 44 6.092 -2.795 8.696 1.00 0.00 O ATOM 682 CB LEU A 44 5.085 -4.755 6.701 1.00 0.00 C ATOM 683 CG LEU A 44 4.710 -4.150 5.344 1.00 0.00 C ATOM 684 CD1 LEU A 44 4.399 -5.271 4.352 1.00 0.00 C ATOM 685 CD2 LEU A 44 3.482 -3.258 5.510 1.00 0.00 C ATOM 0 H LEU A 44 6.445 -5.762 8.646 1.00 0.00 H new ATOM 0 HA LEU A 44 7.128 -4.468 6.091 1.00 0.00 H new ATOM 0 HB2 LEU A 44 4.926 -5.833 6.686 1.00 0.00 H new ATOM 0 HB3 LEU A 44 4.442 -4.348 7.482 1.00 0.00 H new ATOM 0 HG LEU A 44 5.543 -3.556 4.967 1.00 0.00 H new ATOM 0 HD11 LEU A 44 4.132 -4.839 3.387 1.00 0.00 H new ATOM 0 HD12 LEU A 44 5.276 -5.907 4.235 1.00 0.00 H new ATOM 0 HD13 LEU A 44 3.566 -5.867 4.726 1.00 0.00 H new ATOM 0 HD21 LEU A 44 3.213 -2.826 4.546 1.00 0.00 H new ATOM 0 HD22 LEU A 44 2.649 -3.852 5.887 1.00 0.00 H new ATOM 0 HD23 LEU A 44 3.706 -2.458 6.216 1.00 0.00 H new ATOM 697 N GLN A 45 7.384 -2.170 6.963 1.00 0.00 N ATOM 698 CA GLN A 45 7.560 -0.810 7.457 1.00 0.00 C ATOM 699 C GLN A 45 7.138 0.206 6.400 1.00 0.00 C ATOM 700 O GLN A 45 6.574 1.252 6.719 1.00 0.00 O ATOM 701 CB GLN A 45 9.024 -0.583 7.838 1.00 0.00 C ATOM 702 CG GLN A 45 9.285 0.914 8.014 1.00 0.00 C ATOM 703 CD GLN A 45 10.536 1.128 8.859 1.00 0.00 C ATOM 704 OE1 GLN A 45 11.527 1.675 8.374 1.00 0.00 O ATOM 705 NE2 GLN A 45 10.552 0.727 10.101 1.00 0.00 N ATOM 0 H GLN A 45 7.859 -2.367 6.082 1.00 0.00 H new ATOM 0 HA GLN A 45 6.931 -0.677 8.337 1.00 0.00 H new ATOM 0 HB2 GLN A 45 9.256 -1.113 8.762 1.00 0.00 H new ATOM 0 HB3 GLN A 45 9.678 -0.988 7.065 1.00 0.00 H new ATOM 0 HG2 GLN A 45 9.408 1.387 7.040 1.00 0.00 H new ATOM 0 HG3 GLN A 45 8.428 1.388 8.492 1.00 0.00 H new ATOM 0 HE21 GLN A 45 9.730 0.274 10.501 1.00 0.00 H new ATOM 0 HE22 GLN A 45 11.386 0.867 10.671 1.00 0.00 H new ATOM 714 N ALA A 46 7.417 -0.110 5.139 1.00 0.00 N ATOM 715 CA ALA A 46 7.065 0.784 4.041 1.00 0.00 C ATOM 716 C ALA A 46 5.861 0.247 3.269 1.00 0.00 C ATOM 717 O ALA A 46 5.660 -0.964 3.176 1.00 0.00 O ATOM 718 CB ALA A 46 8.258 0.933 3.096 1.00 0.00 C ATOM 0 H ALA A 46 7.882 -0.972 4.853 1.00 0.00 H new ATOM 0 HA ALA A 46 6.803 1.757 4.457 1.00 0.00 H new ATOM 0 HB1 ALA A 46 7.992 1.601 2.277 1.00 0.00 H new ATOM 0 HB2 ALA A 46 9.105 1.348 3.642 1.00 0.00 H new ATOM 0 HB3 ALA A 46 8.528 -0.044 2.694 1.00 0.00 H new ATOM 724 N ILE A 47 5.069 1.159 2.711 1.00 0.00 N ATOM 725 CA ILE A 47 3.889 0.775 1.939 1.00 0.00 C ATOM 726 C ILE A 47 4.191 0.886 0.448 1.00 0.00 C ATOM 727 O ILE A 47 4.805 1.856 0.015 1.00 0.00 O ATOM 728 CB ILE A 47 2.716 1.687 2.306 1.00 0.00 C ATOM 729 CG1 ILE A 47 1.579 1.495 1.302 1.00 0.00 C ATOM 730 CG2 ILE A 47 3.173 3.147 2.279 1.00 0.00 C ATOM 731 CD1 ILE A 47 0.373 2.327 1.743 1.00 0.00 C ATOM 0 H ILE A 47 5.221 2.165 2.778 1.00 0.00 H new ATOM 0 HA ILE A 47 3.624 -0.257 2.171 1.00 0.00 H new ATOM 0 HB ILE A 47 2.364 1.432 3.306 1.00 0.00 H new ATOM 0 HG12 ILE A 47 1.902 1.800 0.306 1.00 0.00 H new ATOM 0 HG13 ILE A 47 1.306 0.441 1.240 1.00 0.00 H new ATOM 0 HG21 ILE A 47 2.336 3.795 2.541 1.00 0.00 H new ATOM 0 HG22 ILE A 47 3.980 3.289 2.997 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.528 3.399 1.280 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -0.441 2.194 1.030 1.00 0.00 H new ATOM 0 HD12 ILE A 47 0.048 2.001 2.731 1.00 0.00 H new ATOM 0 HD13 ILE A 47 0.652 3.380 1.782 1.00 0.00 H new ATOM 743 N TYR A 48 3.765 -0.110 -0.332 1.00 0.00 N ATOM 744 CA TYR A 48 4.023 -0.095 -1.772 1.00 0.00 C ATOM 745 C TYR A 48 2.731 -0.063 -2.585 1.00 0.00 C ATOM 746 O TYR A 48 1.677 -0.511 -2.134 1.00 0.00 O ATOM 747 CB TYR A 48 4.838 -1.323 -2.236 1.00 0.00 C ATOM 748 CG TYR A 48 5.672 -1.938 -1.119 1.00 0.00 C ATOM 749 CD1 TYR A 48 5.091 -2.331 0.097 1.00 0.00 C ATOM 750 CD2 TYR A 48 7.043 -2.142 -1.327 1.00 0.00 C ATOM 751 CE1 TYR A 48 5.879 -2.920 1.095 1.00 0.00 C ATOM 752 CE2 TYR A 48 7.827 -2.730 -0.328 1.00 0.00 C ATOM 753 CZ TYR A 48 7.246 -3.118 0.882 1.00 0.00 C ATOM 754 OH TYR A 48 8.021 -3.698 1.866 1.00 0.00 O ATOM 0 H TYR A 48 3.249 -0.924 0.002 1.00 0.00 H new ATOM 0 HA TYR A 48 4.597 0.815 -1.948 1.00 0.00 H new ATOM 0 HB2 TYR A 48 4.157 -2.077 -2.631 1.00 0.00 H new ATOM 0 HB3 TYR A 48 5.496 -1.028 -3.054 1.00 0.00 H new ATOM 0 HD1 TYR A 48 4.035 -2.179 0.264 1.00 0.00 H new ATOM 0 HD2 TYR A 48 7.496 -1.844 -2.261 1.00 0.00 H new ATOM 0 HE1 TYR A 48 5.429 -3.221 2.030 1.00 0.00 H new ATOM 0 HE2 TYR A 48 8.883 -2.884 -0.493 1.00 0.00 H new ATOM 0 HH TYR A 48 8.948 -3.764 1.556 1.00 0.00 H new ATOM 764 N PHE A 49 2.851 0.449 -3.806 1.00 0.00 N ATOM 765 CA PHE A 49 1.731 0.528 -4.740 1.00 0.00 C ATOM 766 C PHE A 49 2.152 -0.117 -6.051 1.00 0.00 C ATOM 767 O PHE A 49 3.313 -0.016 -6.448 1.00 0.00 O ATOM 768 CB PHE A 49 1.374 1.990 -5.023 1.00 0.00 C ATOM 769 CG PHE A 49 -0.126 2.199 -4.974 1.00 0.00 C ATOM 770 CD1 PHE A 49 -0.931 1.906 -6.092 1.00 0.00 C ATOM 771 CD2 PHE A 49 -0.710 2.715 -3.813 1.00 0.00 C ATOM 772 CE1 PHE A 49 -2.312 2.130 -6.033 1.00 0.00 C ATOM 773 CE2 PHE A 49 -2.090 2.933 -3.756 1.00 0.00 C ATOM 774 CZ PHE A 49 -2.891 2.642 -4.866 1.00 0.00 C ATOM 0 H PHE A 49 3.726 0.821 -4.176 1.00 0.00 H new ATOM 0 HA PHE A 49 0.869 0.021 -4.307 1.00 0.00 H new ATOM 0 HB2 PHE A 49 1.859 2.635 -4.291 1.00 0.00 H new ATOM 0 HB3 PHE A 49 1.754 2.278 -6.003 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -0.485 1.510 -6.992 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -0.093 2.946 -2.957 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.931 1.907 -6.889 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -2.538 3.326 -2.855 1.00 0.00 H new ATOM 0 HZ PHE A 49 -3.957 2.813 -4.822 1.00 0.00 H new ATOM 784 N VAL A 50 1.224 -0.759 -6.733 1.00 0.00 N ATOM 785 CA VAL A 50 1.539 -1.379 -7.994 1.00 0.00 C ATOM 786 C VAL A 50 1.015 -0.501 -9.132 1.00 0.00 C ATOM 787 O VAL A 50 -0.150 -0.109 -9.135 1.00 0.00 O ATOM 788 CB VAL A 50 0.933 -2.780 -8.003 1.00 0.00 C ATOM 789 CG1 VAL A 50 0.222 -3.020 -9.312 1.00 0.00 C ATOM 790 CG2 VAL A 50 2.034 -3.822 -7.814 1.00 0.00 C ATOM 0 H VAL A 50 0.254 -0.862 -6.434 1.00 0.00 H new ATOM 0 HA VAL A 50 2.615 -1.476 -8.135 1.00 0.00 H new ATOM 0 HB VAL A 50 0.217 -2.865 -7.186 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -0.209 -4.021 -9.314 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.572 -2.283 -9.435 1.00 0.00 H new ATOM 0 HG13 VAL A 50 0.932 -2.929 -10.134 1.00 0.00 H new ATOM 0 HG21 VAL A 50 1.596 -4.820 -7.821 1.00 0.00 H new ATOM 0 HG22 VAL A 50 2.758 -3.738 -8.625 1.00 0.00 H new ATOM 0 HG23 VAL A 50 2.535 -3.653 -6.861 1.00 0.00 H new ATOM 800 N CYS A 51 1.886 -0.177 -10.082 1.00 0.00 N ATOM 801 CA CYS A 51 1.489 0.670 -11.202 1.00 0.00 C ATOM 802 C CYS A 51 1.050 -0.180 -12.389 1.00 0.00 C ATOM 803 O CYS A 51 0.143 0.192 -13.134 1.00 0.00 O ATOM 804 CB CYS A 51 2.658 1.565 -11.618 1.00 0.00 C ATOM 805 SG CYS A 51 2.031 2.989 -12.544 1.00 0.00 S ATOM 0 H CYS A 51 2.859 -0.483 -10.100 1.00 0.00 H new ATOM 0 HA CYS A 51 0.650 1.290 -10.885 1.00 0.00 H new ATOM 0 HB2 CYS A 51 3.203 1.903 -10.736 1.00 0.00 H new ATOM 0 HB3 CYS A 51 3.361 1.001 -12.230 1.00 0.00 H new ATOM 0 HG CYS A 51 3.025 3.750 -12.895 1.00 0.00 H new ATOM 811 N SER A 52 1.702 -1.323 -12.554 1.00 0.00 N ATOM 812 CA SER A 52 1.380 -2.231 -13.649 1.00 0.00 C ATOM 813 C SER A 52 2.158 -3.530 -13.487 1.00 0.00 C ATOM 814 O SER A 52 3.332 -3.509 -13.129 1.00 0.00 O ATOM 815 CB SER A 52 1.736 -1.583 -14.987 1.00 0.00 C ATOM 816 OG SER A 52 0.542 -1.195 -15.654 1.00 0.00 O ATOM 0 H SER A 52 2.455 -1.644 -11.946 1.00 0.00 H new ATOM 0 HA SER A 52 0.311 -2.445 -13.629 1.00 0.00 H new ATOM 0 HB2 SER A 52 2.374 -0.714 -14.825 1.00 0.00 H new ATOM 0 HB3 SER A 52 2.300 -2.282 -15.604 1.00 0.00 H new ATOM 0 HG SER A 52 0.026 -0.593 -15.078 1.00 0.00 H new ATOM 822 N GLY A 53 1.498 -4.653 -13.747 1.00 0.00 N ATOM 823 CA GLY A 53 2.143 -5.957 -13.614 1.00 0.00 C ATOM 824 C GLY A 53 1.268 -6.899 -12.796 1.00 0.00 C ATOM 825 O GLY A 53 0.059 -6.692 -12.690 1.00 0.00 O ATOM 0 H GLY A 53 0.524 -4.689 -14.049 1.00 0.00 H new ATOM 0 HA2 GLY A 53 2.324 -6.383 -14.601 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.114 -5.842 -13.133 1.00 0.00 H new ATOM 829 N SER A 54 1.872 -7.936 -12.222 1.00 0.00 N ATOM 830 CA SER A 54 1.102 -8.889 -11.423 1.00 0.00 C ATOM 831 C SER A 54 1.932 -9.449 -10.272 1.00 0.00 C ATOM 832 O SER A 54 3.117 -9.739 -10.434 1.00 0.00 O ATOM 833 CB SER A 54 0.624 -10.039 -12.310 1.00 0.00 C ATOM 834 OG SER A 54 1.679 -10.980 -12.464 1.00 0.00 O ATOM 0 H SER A 54 2.870 -8.137 -12.291 1.00 0.00 H new ATOM 0 HA SER A 54 0.246 -8.361 -11.003 1.00 0.00 H new ATOM 0 HB2 SER A 54 -0.247 -10.520 -11.864 1.00 0.00 H new ATOM 0 HB3 SER A 54 0.315 -9.659 -13.284 1.00 0.00 H new ATOM 0 HG SER A 54 1.322 -11.814 -12.834 1.00 0.00 H new ATOM 840 N MET A 55 1.299 -9.610 -9.108 1.00 0.00 N ATOM 841 CA MET A 55 2.003 -10.151 -7.947 1.00 0.00 C ATOM 842 C MET A 55 1.031 -10.826 -6.986 1.00 0.00 C ATOM 843 O MET A 55 -0.173 -10.571 -7.027 1.00 0.00 O ATOM 844 CB MET A 55 2.749 -9.038 -7.207 1.00 0.00 C ATOM 845 CG MET A 55 2.054 -7.700 -7.448 1.00 0.00 C ATOM 846 SD MET A 55 2.249 -6.649 -5.987 1.00 0.00 S ATOM 847 CE MET A 55 4.013 -6.953 -5.713 1.00 0.00 C ATOM 0 H MET A 55 0.319 -9.378 -8.947 1.00 0.00 H new ATOM 0 HA MET A 55 2.717 -10.891 -8.308 1.00 0.00 H new ATOM 0 HB2 MET A 55 2.779 -9.255 -6.139 1.00 0.00 H new ATOM 0 HB3 MET A 55 3.782 -8.989 -7.551 1.00 0.00 H new ATOM 0 HG2 MET A 55 2.480 -7.209 -8.323 1.00 0.00 H new ATOM 0 HG3 MET A 55 0.996 -7.860 -7.656 1.00 0.00 H new ATOM 0 HE1 MET A 55 4.421 -6.174 -5.069 1.00 0.00 H new ATOM 0 HE2 MET A 55 4.145 -7.924 -5.236 1.00 0.00 H new ATOM 0 HE3 MET A 55 4.537 -6.944 -6.669 1.00 0.00 H new ATOM 857 N GLU A 56 1.557 -11.696 -6.126 1.00 0.00 N ATOM 858 CA GLU A 56 0.713 -12.394 -5.163 1.00 0.00 C ATOM 859 C GLU A 56 1.544 -13.058 -4.065 1.00 0.00 C ATOM 860 O GLU A 56 2.692 -13.442 -4.290 1.00 0.00 O ATOM 861 CB GLU A 56 -0.124 -13.450 -5.890 1.00 0.00 C ATOM 862 CG GLU A 56 0.769 -14.261 -6.840 1.00 0.00 C ATOM 863 CD GLU A 56 1.913 -14.911 -6.068 1.00 0.00 C ATOM 864 OE1 GLU A 56 1.682 -15.345 -4.953 1.00 0.00 O ATOM 865 OE2 GLU A 56 3.007 -14.965 -6.606 1.00 0.00 O ATOM 0 H GLU A 56 2.548 -11.931 -6.077 1.00 0.00 H new ATOM 0 HA GLU A 56 0.059 -11.661 -4.690 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -0.597 -14.114 -5.166 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -0.925 -12.969 -6.452 1.00 0.00 H new ATOM 0 HG2 GLU A 56 0.177 -15.028 -7.340 1.00 0.00 H new ATOM 0 HG3 GLU A 56 1.170 -13.610 -7.617 1.00 0.00 H new ATOM 872 N VAL A 57 0.947 -13.223 -2.883 1.00 0.00 N ATOM 873 CA VAL A 57 1.637 -13.883 -1.776 1.00 0.00 C ATOM 874 C VAL A 57 1.214 -15.353 -1.748 1.00 0.00 C ATOM 875 O VAL A 57 0.023 -15.662 -1.871 1.00 0.00 O ATOM 876 CB VAL A 57 1.314 -13.209 -0.436 1.00 0.00 C ATOM 877 CG1 VAL A 57 1.209 -11.694 -0.624 1.00 0.00 C ATOM 878 CG2 VAL A 57 -0.003 -13.752 0.107 1.00 0.00 C ATOM 0 H VAL A 57 -0.001 -12.913 -2.670 1.00 0.00 H new ATOM 0 HA VAL A 57 2.714 -13.804 -1.927 1.00 0.00 H new ATOM 0 HB VAL A 57 2.114 -13.425 0.273 1.00 0.00 H new ATOM 0 HG11 VAL A 57 0.979 -11.224 0.332 1.00 0.00 H new ATOM 0 HG12 VAL A 57 2.156 -11.308 -1.000 1.00 0.00 H new ATOM 0 HG13 VAL A 57 0.416 -11.470 -1.338 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -0.230 -13.272 1.059 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -0.803 -13.545 -0.604 1.00 0.00 H new ATOM 0 HG23 VAL A 57 0.081 -14.829 0.255 1.00 0.00 H new ATOM 888 N LEU A 58 2.192 -16.252 -1.619 1.00 0.00 N ATOM 889 CA LEU A 58 1.921 -17.683 -1.618 1.00 0.00 C ATOM 890 C LEU A 58 2.042 -18.271 -0.224 1.00 0.00 C ATOM 891 O LEU A 58 3.081 -18.152 0.430 1.00 0.00 O ATOM 892 CB LEU A 58 2.905 -18.394 -2.552 1.00 0.00 C ATOM 893 CG LEU A 58 2.156 -18.975 -3.752 1.00 0.00 C ATOM 894 CD1 LEU A 58 3.136 -19.757 -4.625 1.00 0.00 C ATOM 895 CD2 LEU A 58 1.052 -19.915 -3.258 1.00 0.00 C ATOM 0 H LEU A 58 3.177 -16.010 -1.514 1.00 0.00 H new ATOM 0 HA LEU A 58 0.898 -17.830 -1.965 1.00 0.00 H new ATOM 0 HB2 LEU A 58 3.668 -17.694 -2.893 1.00 0.00 H new ATOM 0 HB3 LEU A 58 3.420 -19.190 -2.014 1.00 0.00 H new ATOM 0 HG LEU A 58 1.711 -18.167 -4.333 1.00 0.00 H new ATOM 0 HD11 LEU A 58 2.607 -20.174 -5.482 1.00 0.00 H new ATOM 0 HD12 LEU A 58 3.924 -19.090 -4.974 1.00 0.00 H new ATOM 0 HD13 LEU A 58 3.577 -20.566 -4.042 1.00 0.00 H new ATOM 0 HD21 LEU A 58 0.518 -20.330 -4.113 1.00 0.00 H new ATOM 0 HD22 LEU A 58 1.496 -20.725 -2.680 1.00 0.00 H new ATOM 0 HD23 LEU A 58 0.356 -19.360 -2.629 1.00 0.00 H new ATOM 907 N LYS A 59 0.971 -18.913 0.222 1.00 0.00 N ATOM 908 CA LYS A 59 0.964 -19.529 1.534 1.00 0.00 C ATOM 909 C LYS A 59 -0.161 -20.559 1.638 1.00 0.00 C ATOM 910 O LYS A 59 -1.247 -20.366 1.091 1.00 0.00 O ATOM 911 CB LYS A 59 0.826 -18.446 2.604 1.00 0.00 C ATOM 912 CG LYS A 59 0.457 -19.064 3.959 1.00 0.00 C ATOM 913 CD LYS A 59 1.571 -20.002 4.446 1.00 0.00 C ATOM 914 CE LYS A 59 2.824 -19.190 4.781 1.00 0.00 C ATOM 915 NZ LYS A 59 2.446 -18.050 5.663 1.00 0.00 N ATOM 0 H LYS A 59 0.103 -19.018 -0.304 1.00 0.00 H new ATOM 0 HA LYS A 59 1.905 -20.056 1.691 1.00 0.00 H new ATOM 0 HB2 LYS A 59 1.762 -17.895 2.693 1.00 0.00 H new ATOM 0 HB3 LYS A 59 0.061 -17.729 2.306 1.00 0.00 H new ATOM 0 HG2 LYS A 59 0.292 -18.274 4.692 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -0.478 -19.617 3.870 1.00 0.00 H new ATOM 0 HD2 LYS A 59 1.237 -20.552 5.326 1.00 0.00 H new ATOM 0 HD3 LYS A 59 1.800 -20.740 3.677 1.00 0.00 H new ATOM 0 HE2 LYS A 59 3.560 -19.822 5.278 1.00 0.00 H new ATOM 0 HE3 LYS A 59 3.288 -18.820 3.867 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 3.300 -17.660 6.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 1.984 -17.311 5.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 1.790 -18.383 6.399 1.00 0.00 H new ATOM 929 N ASP A 60 0.111 -21.654 2.341 1.00 0.00 N ATOM 930 CA ASP A 60 -0.872 -22.718 2.517 1.00 0.00 C ATOM 931 C ASP A 60 -1.305 -23.308 1.176 1.00 0.00 C ATOM 932 O ASP A 60 -2.484 -23.588 0.961 1.00 0.00 O ATOM 933 CB ASP A 60 -2.096 -22.173 3.254 1.00 0.00 C ATOM 934 CG ASP A 60 -1.858 -22.221 4.759 1.00 0.00 C ATOM 935 OD1 ASP A 60 -1.480 -23.274 5.247 1.00 0.00 O ATOM 936 OD2 ASP A 60 -2.055 -21.204 5.403 1.00 0.00 O ATOM 0 H ASP A 60 1.006 -21.828 2.799 1.00 0.00 H new ATOM 0 HA ASP A 60 -0.407 -23.511 3.103 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -2.294 -21.148 2.941 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -2.978 -22.760 2.997 1.00 0.00 H new ATOM 941 N ASN A 61 -0.337 -23.522 0.291 1.00 0.00 N ATOM 942 CA ASN A 61 -0.617 -24.112 -1.016 1.00 0.00 C ATOM 943 C ASN A 61 -1.454 -23.185 -1.892 1.00 0.00 C ATOM 944 O ASN A 61 -1.689 -23.481 -3.064 1.00 0.00 O ATOM 945 CB ASN A 61 -1.355 -25.441 -0.836 1.00 0.00 C ATOM 946 CG ASN A 61 -0.719 -26.515 -1.713 1.00 0.00 C ATOM 947 OD1 ASN A 61 -0.896 -26.506 -2.932 1.00 0.00 O ATOM 948 ND2 ASN A 61 0.013 -27.443 -1.163 1.00 0.00 N ATOM 0 H ASN A 61 0.645 -23.297 0.452 1.00 0.00 H new ATOM 0 HA ASN A 61 0.338 -24.275 -1.515 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.321 -25.747 0.210 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -2.406 -25.321 -1.099 1.00 0.00 H new ATOM 0 HD21 ASN A 61 0.441 -28.165 -1.742 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.157 -27.447 -0.153 1.00 0.00 H new ATOM 955 N THR A 62 -1.903 -22.067 -1.333 1.00 0.00 N ATOM 956 CA THR A 62 -2.710 -21.129 -2.108 1.00 0.00 C ATOM 957 C THR A 62 -2.179 -19.722 -1.971 1.00 0.00 C ATOM 958 O THR A 62 -1.545 -19.377 -0.974 1.00 0.00 O ATOM 959 CB THR A 62 -4.161 -21.135 -1.635 1.00 0.00 C ATOM 960 OG1 THR A 62 -4.632 -22.474 -1.568 1.00 0.00 O ATOM 961 CG2 THR A 62 -5.028 -20.328 -2.617 1.00 0.00 C ATOM 0 H THR A 62 -1.728 -21.791 -0.367 1.00 0.00 H new ATOM 0 HA THR A 62 -2.658 -21.448 -3.149 1.00 0.00 H new ATOM 0 HB THR A 62 -4.222 -20.681 -0.646 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.563 -22.478 -1.263 1.00 0.00 H new ATOM 0 HG21 THR A 62 -6.064 -20.334 -2.277 1.00 0.00 H new ATOM 0 HG22 THR A 62 -4.666 -19.301 -2.662 1.00 0.00 H new ATOM 0 HG23 THR A 62 -4.969 -20.777 -3.608 1.00 0.00 H new ATOM 969 N VAL A 63 -2.479 -18.898 -2.959 1.00 0.00 N ATOM 970 CA VAL A 63 -2.064 -17.519 -2.909 1.00 0.00 C ATOM 971 C VAL A 63 -2.887 -16.818 -1.843 1.00 0.00 C ATOM 972 O VAL A 63 -4.108 -16.718 -1.958 1.00 0.00 O ATOM 973 CB VAL A 63 -2.267 -16.858 -4.268 1.00 0.00 C ATOM 974 CG1 VAL A 63 -0.910 -16.659 -4.941 1.00 0.00 C ATOM 975 CG2 VAL A 63 -3.127 -17.770 -5.137 1.00 0.00 C ATOM 0 H VAL A 63 -3.003 -19.161 -3.794 1.00 0.00 H new ATOM 0 HA VAL A 63 -1.004 -17.451 -2.663 1.00 0.00 H new ATOM 0 HB VAL A 63 -2.757 -15.893 -4.141 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -1.052 -16.187 -5.913 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -0.284 -16.022 -4.316 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -0.425 -17.626 -5.075 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -3.279 -17.307 -6.112 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -2.626 -18.729 -5.265 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -4.092 -17.927 -4.656 1.00 0.00 H new ATOM 985 N LEU A 64 -2.224 -16.359 -0.792 1.00 0.00 N ATOM 986 CA LEU A 64 -2.933 -15.704 0.293 1.00 0.00 C ATOM 987 C LEU A 64 -3.365 -14.318 -0.149 1.00 0.00 C ATOM 988 O LEU A 64 -4.188 -13.674 0.501 1.00 0.00 O ATOM 989 CB LEU A 64 -2.028 -15.606 1.527 1.00 0.00 C ATOM 990 CG LEU A 64 -2.753 -16.125 2.774 1.00 0.00 C ATOM 991 CD1 LEU A 64 -2.362 -17.585 3.018 1.00 0.00 C ATOM 992 CD2 LEU A 64 -2.336 -15.284 3.982 1.00 0.00 C ATOM 0 H LEU A 64 -1.214 -16.427 -0.669 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.815 -16.289 0.553 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -1.118 -16.183 1.363 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -1.726 -14.570 1.681 1.00 0.00 H new ATOM 0 HG LEU A 64 -3.831 -16.055 2.628 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -2.876 -17.956 3.904 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -2.646 -18.187 2.155 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.285 -17.653 3.169 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -2.848 -15.648 4.873 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -1.258 -15.363 4.125 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -2.604 -14.242 3.810 1.00 0.00 H new ATOM 1004 N ALA A 65 -2.823 -13.877 -1.277 1.00 0.00 N ATOM 1005 CA ALA A 65 -3.186 -12.576 -1.810 1.00 0.00 C ATOM 1006 C ALA A 65 -3.042 -12.565 -3.323 1.00 0.00 C ATOM 1007 O ALA A 65 -2.022 -12.992 -3.865 1.00 0.00 O ATOM 1008 CB ALA A 65 -2.294 -11.491 -1.204 1.00 0.00 C ATOM 0 H ALA A 65 -2.141 -14.394 -1.832 1.00 0.00 H new ATOM 0 HA ALA A 65 -4.225 -12.375 -1.550 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -2.575 -10.520 -1.611 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -2.418 -11.481 -0.121 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -1.252 -11.699 -1.448 1.00 0.00 H new ATOM 1014 N ILE A 66 -4.064 -12.057 -3.999 1.00 0.00 N ATOM 1015 CA ILE A 66 -4.038 -11.975 -5.449 1.00 0.00 C ATOM 1016 C ILE A 66 -4.324 -10.534 -5.866 1.00 0.00 C ATOM 1017 O ILE A 66 -5.463 -10.076 -5.770 1.00 0.00 O ATOM 1018 CB ILE A 66 -5.105 -12.897 -6.047 1.00 0.00 C ATOM 1019 CG1 ILE A 66 -4.638 -14.352 -5.951 1.00 0.00 C ATOM 1020 CG2 ILE A 66 -5.328 -12.534 -7.516 1.00 0.00 C ATOM 1021 CD1 ILE A 66 -5.049 -14.929 -4.596 1.00 0.00 C ATOM 0 H ILE A 66 -4.916 -11.698 -3.567 1.00 0.00 H new ATOM 0 HA ILE A 66 -3.058 -12.285 -5.813 1.00 0.00 H new ATOM 0 HB ILE A 66 -6.037 -12.776 -5.495 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -5.076 -14.940 -6.757 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -3.556 -14.407 -6.069 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -6.087 -13.190 -7.942 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -5.661 -11.499 -7.588 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -4.395 -12.654 -8.066 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -4.717 -15.965 -4.526 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -4.589 -14.346 -3.798 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -6.134 -14.888 -4.497 1.00 0.00 H new ATOM 1033 N LEU A 67 -3.300 -9.807 -6.311 1.00 0.00 N ATOM 1034 CA LEU A 67 -3.512 -8.417 -6.706 1.00 0.00 C ATOM 1035 C LEU A 67 -2.873 -8.092 -8.055 1.00 0.00 C ATOM 1036 O LEU A 67 -1.994 -8.815 -8.543 1.00 0.00 O ATOM 1037 CB LEU A 67 -2.974 -7.464 -5.636 1.00 0.00 C ATOM 1038 CG LEU A 67 -1.957 -8.180 -4.752 1.00 0.00 C ATOM 1039 CD1 LEU A 67 -0.708 -8.460 -5.575 1.00 0.00 C ATOM 1040 CD2 LEU A 67 -1.595 -7.286 -3.563 1.00 0.00 C ATOM 0 H LEU A 67 -2.342 -10.145 -6.405 1.00 0.00 H new ATOM 0 HA LEU A 67 -4.589 -8.280 -6.808 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -2.509 -6.599 -6.110 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -3.796 -7.090 -5.026 1.00 0.00 H new ATOM 0 HG LEU A 67 -2.377 -9.115 -4.382 1.00 0.00 H new ATOM 0 HD11 LEU A 67 0.029 -8.972 -4.956 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -0.967 -9.090 -6.426 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -0.290 -7.519 -5.933 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -0.869 -7.797 -2.931 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -1.166 -6.352 -3.927 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -2.492 -7.071 -2.983 1.00 0.00 H new ATOM 1052 N GLY A 68 -3.325 -6.986 -8.647 1.00 0.00 N ATOM 1053 CA GLY A 68 -2.808 -6.548 -9.936 1.00 0.00 C ATOM 1054 C GLY A 68 -2.598 -5.033 -9.971 1.00 0.00 C ATOM 1055 O GLY A 68 -2.379 -4.396 -8.941 1.00 0.00 O ATOM 0 H GLY A 68 -4.046 -6.381 -8.253 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.863 -7.052 -10.141 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -3.502 -6.838 -10.725 1.00 0.00 H new ATOM 1059 N LYS A 69 -2.653 -4.477 -11.177 1.00 0.00 N ATOM 1060 CA LYS A 69 -2.455 -3.052 -11.399 1.00 0.00 C ATOM 1061 C LYS A 69 -3.237 -2.171 -10.424 1.00 0.00 C ATOM 1062 O LYS A 69 -4.454 -2.301 -10.287 1.00 0.00 O ATOM 1063 CB LYS A 69 -2.892 -2.713 -12.816 1.00 0.00 C ATOM 1064 CG LYS A 69 -2.404 -3.797 -13.779 1.00 0.00 C ATOM 1065 CD LYS A 69 -2.613 -3.331 -15.221 1.00 0.00 C ATOM 1066 CE LYS A 69 -2.601 -4.542 -16.156 1.00 0.00 C ATOM 1067 NZ LYS A 69 -1.878 -5.668 -15.498 1.00 0.00 N ATOM 0 H LYS A 69 -2.837 -5.005 -12.030 1.00 0.00 H new ATOM 0 HA LYS A 69 -1.396 -2.848 -11.239 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -3.978 -2.634 -12.863 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -2.489 -1.744 -13.109 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -1.349 -4.007 -13.603 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -2.947 -4.726 -13.603 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -3.561 -2.800 -15.309 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -1.828 -2.631 -15.506 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -3.622 -4.841 -16.395 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -2.116 -4.284 -17.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -1.630 -6.385 -16.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -1.010 -5.309 -15.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -2.489 -6.096 -14.773 1.00 0.00 H new ATOM 1081 N GLY A 70 -2.526 -1.240 -9.787 1.00 0.00 N ATOM 1082 CA GLY A 70 -3.147 -0.293 -8.867 1.00 0.00 C ATOM 1083 C GLY A 70 -3.285 -0.856 -7.457 1.00 0.00 C ATOM 1084 O GLY A 70 -3.578 -0.123 -6.514 1.00 0.00 O ATOM 0 H GLY A 70 -1.518 -1.123 -9.893 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -2.552 0.620 -8.834 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -4.132 -0.018 -9.243 1.00 0.00 H new ATOM 1088 N ASP A 71 -3.093 -2.156 -7.312 1.00 0.00 N ATOM 1089 CA ASP A 71 -3.221 -2.778 -6.002 1.00 0.00 C ATOM 1090 C ASP A 71 -2.281 -2.130 -4.993 1.00 0.00 C ATOM 1091 O ASP A 71 -1.222 -1.617 -5.353 1.00 0.00 O ATOM 1092 CB ASP A 71 -2.905 -4.264 -6.093 1.00 0.00 C ATOM 1093 CG ASP A 71 -1.404 -4.464 -6.272 1.00 0.00 C ATOM 1094 OD1 ASP A 71 -0.660 -4.020 -5.412 1.00 0.00 O ATOM 1095 OD2 ASP A 71 -1.019 -5.061 -7.264 1.00 0.00 O ATOM 0 H ASP A 71 -2.852 -2.794 -8.070 1.00 0.00 H new ATOM 0 HA ASP A 71 -4.249 -2.639 -5.667 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -3.244 -4.773 -5.191 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -3.443 -4.709 -6.930 1.00 0.00 H new ATOM 1100 N LEU A 72 -2.674 -2.174 -3.724 1.00 0.00 N ATOM 1101 CA LEU A 72 -1.859 -1.606 -2.660 1.00 0.00 C ATOM 1102 C LEU A 72 -1.437 -2.701 -1.691 1.00 0.00 C ATOM 1103 O LEU A 72 -2.228 -3.586 -1.356 1.00 0.00 O ATOM 1104 CB LEU A 72 -2.636 -0.522 -1.908 1.00 0.00 C ATOM 1105 CG LEU A 72 -1.762 0.055 -0.789 1.00 0.00 C ATOM 1106 CD1 LEU A 72 -0.838 1.126 -1.361 1.00 0.00 C ATOM 1107 CD2 LEU A 72 -2.657 0.677 0.286 1.00 0.00 C ATOM 0 H LEU A 72 -3.548 -2.595 -3.410 1.00 0.00 H new ATOM 0 HA LEU A 72 -0.972 -1.155 -3.106 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.933 0.270 -2.596 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -3.551 -0.941 -1.489 1.00 0.00 H new ATOM 0 HG LEU A 72 -1.163 -0.743 -0.350 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -0.218 1.535 -0.564 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -0.200 0.685 -2.127 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -1.435 1.924 -1.802 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -2.037 1.088 1.083 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -3.256 1.474 -0.155 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -3.317 -0.087 0.697 1.00 0.00 H new ATOM 1119 N ILE A 73 -0.187 -2.633 -1.251 1.00 0.00 N ATOM 1120 CA ILE A 73 0.348 -3.622 -0.328 1.00 0.00 C ATOM 1121 C ILE A 73 0.748 -2.971 0.997 1.00 0.00 C ATOM 1122 O ILE A 73 1.321 -1.881 1.021 1.00 0.00 O ATOM 1123 CB ILE A 73 1.557 -4.292 -0.972 1.00 0.00 C ATOM 1124 CG1 ILE A 73 2.279 -5.195 0.033 1.00 0.00 C ATOM 1125 CG2 ILE A 73 2.476 -3.219 -1.447 1.00 0.00 C ATOM 1126 CD1 ILE A 73 1.403 -6.407 0.351 1.00 0.00 C ATOM 0 H ILE A 73 0.474 -1.904 -1.519 1.00 0.00 H new ATOM 0 HA ILE A 73 -0.419 -4.366 -0.115 1.00 0.00 H new ATOM 0 HB ILE A 73 1.234 -4.917 -1.805 1.00 0.00 H new ATOM 0 HG12 ILE A 73 3.235 -5.521 -0.377 1.00 0.00 H new ATOM 0 HG13 ILE A 73 2.496 -4.640 0.946 1.00 0.00 H new ATOM 0 HG21 ILE A 73 3.352 -3.670 -1.913 1.00 0.00 H new ATOM 0 HG22 ILE A 73 1.959 -2.593 -2.175 1.00 0.00 H new ATOM 0 HG23 ILE A 73 2.790 -2.608 -0.601 1.00 0.00 H new ATOM 0 HD11 ILE A 73 1.917 -7.050 1.066 1.00 0.00 H new ATOM 0 HD12 ILE A 73 0.458 -6.071 0.778 1.00 0.00 H new ATOM 0 HD13 ILE A 73 1.209 -6.966 -0.565 1.00 0.00 H new ATOM 1138 N GLY A 74 0.440 -3.653 2.098 1.00 0.00 N ATOM 1139 CA GLY A 74 0.768 -3.145 3.428 1.00 0.00 C ATOM 1140 C GLY A 74 -0.488 -3.057 4.290 1.00 0.00 C ATOM 1141 O GLY A 74 -1.581 -2.835 3.779 1.00 0.00 O ATOM 0 H GLY A 74 -0.035 -4.556 2.096 1.00 0.00 H new ATOM 0 HA2 GLY A 74 1.498 -3.800 3.904 1.00 0.00 H new ATOM 0 HA3 GLY A 74 1.229 -2.161 3.345 1.00 0.00 H new ATOM 1145 N SER A 75 -0.327 -3.239 5.599 1.00 0.00 N ATOM 1146 CA SER A 75 -1.466 -3.195 6.513 1.00 0.00 C ATOM 1147 C SER A 75 -1.919 -1.761 6.787 1.00 0.00 C ATOM 1148 O SER A 75 -1.109 -0.840 6.896 1.00 0.00 O ATOM 1149 CB SER A 75 -1.094 -3.869 7.833 1.00 0.00 C ATOM 1150 OG SER A 75 0.322 -3.932 7.944 1.00 0.00 O ATOM 0 H SER A 75 0.572 -3.417 6.047 1.00 0.00 H new ATOM 0 HA SER A 75 -2.292 -3.726 6.039 1.00 0.00 H new ATOM 0 HB2 SER A 75 -1.512 -3.310 8.671 1.00 0.00 H new ATOM 0 HB3 SER A 75 -1.519 -4.872 7.875 1.00 0.00 H new ATOM 0 HG SER A 75 0.646 -4.758 7.527 1.00 0.00 H new ATOM 1156 N ASP A 76 -3.235 -1.601 6.896 1.00 0.00 N ATOM 1157 CA ASP A 76 -3.858 -0.305 7.159 1.00 0.00 C ATOM 1158 C ASP A 76 -3.563 0.175 8.579 1.00 0.00 C ATOM 1159 O ASP A 76 -2.665 -0.336 9.248 1.00 0.00 O ATOM 1160 CB ASP A 76 -5.371 -0.408 6.956 1.00 0.00 C ATOM 1161 CG ASP A 76 -6.049 -0.820 8.258 1.00 0.00 C ATOM 1162 OD1 ASP A 76 -5.788 -1.921 8.716 1.00 0.00 O ATOM 1163 OD2 ASP A 76 -6.818 -0.029 8.779 1.00 0.00 O ATOM 0 H ASP A 76 -3.902 -2.367 6.804 1.00 0.00 H new ATOM 0 HA ASP A 76 -3.439 0.419 6.460 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -5.766 0.550 6.619 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -5.592 -1.136 6.176 1.00 0.00 H new ATOM 1168 N SER A 77 -4.328 1.171 9.027 1.00 0.00 N ATOM 1169 CA SER A 77 -4.151 1.734 10.364 1.00 0.00 C ATOM 1170 C SER A 77 -2.922 2.636 10.432 1.00 0.00 C ATOM 1171 O SER A 77 -2.158 2.596 11.395 1.00 0.00 O ATOM 1172 CB SER A 77 -4.011 0.604 11.384 1.00 0.00 C ATOM 1173 OG SER A 77 -4.331 1.098 12.678 1.00 0.00 O ATOM 0 H SER A 77 -5.075 1.603 8.484 1.00 0.00 H new ATOM 0 HA SER A 77 -5.029 2.338 10.594 1.00 0.00 H new ATOM 0 HB2 SER A 77 -4.673 -0.221 11.123 1.00 0.00 H new ATOM 0 HB3 SER A 77 -2.994 0.212 11.373 1.00 0.00 H new ATOM 0 HG SER A 77 -3.738 1.847 12.898 1.00 0.00 H new ATOM 1179 N LEU A 78 -2.763 3.465 9.407 1.00 0.00 N ATOM 1180 CA LEU A 78 -1.650 4.408 9.347 1.00 0.00 C ATOM 1181 C LEU A 78 -1.847 5.524 10.374 1.00 0.00 C ATOM 1182 O LEU A 78 -1.018 6.424 10.495 1.00 0.00 O ATOM 1183 CB LEU A 78 -1.550 5.026 7.949 1.00 0.00 C ATOM 1184 CG LEU A 78 -0.644 4.158 7.076 1.00 0.00 C ATOM 1185 CD1 LEU A 78 -1.356 2.843 6.764 1.00 0.00 C ATOM 1186 CD2 LEU A 78 -0.332 4.898 5.772 1.00 0.00 C ATOM 0 H LEU A 78 -3.391 3.504 8.604 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.731 3.866 9.570 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -2.541 5.103 7.501 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -1.150 6.038 8.014 1.00 0.00 H new ATOM 0 HG LEU A 78 0.287 3.951 7.604 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.714 2.220 6.141 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -1.578 2.320 7.694 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -2.286 3.050 6.234 1.00 0.00 H new ATOM 0 HD21 LEU A 78 0.314 4.280 5.149 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -1.260 5.104 5.240 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.173 5.837 5.998 1.00 0.00 H new ATOM 1198 N THR A 79 -2.981 5.478 11.069 1.00 0.00 N ATOM 1199 CA THR A 79 -3.333 6.510 12.044 1.00 0.00 C ATOM 1200 C THR A 79 -2.159 6.908 12.939 1.00 0.00 C ATOM 1201 O THR A 79 -1.761 8.073 12.945 1.00 0.00 O ATOM 1202 CB THR A 79 -4.489 6.008 12.918 1.00 0.00 C ATOM 1203 OG1 THR A 79 -4.915 4.737 12.449 1.00 0.00 O ATOM 1204 CG2 THR A 79 -5.657 6.995 12.852 1.00 0.00 C ATOM 0 H THR A 79 -3.674 4.736 10.975 1.00 0.00 H new ATOM 0 HA THR A 79 -3.626 7.397 11.483 1.00 0.00 H new ATOM 0 HB THR A 79 -4.150 5.923 13.951 1.00 0.00 H new ATOM 0 HG1 THR A 79 -5.653 4.413 13.007 1.00 0.00 H new ATOM 0 HG21 THR A 79 -6.475 6.633 13.475 1.00 0.00 H new ATOM 0 HG22 THR A 79 -5.330 7.970 13.213 1.00 0.00 H new ATOM 0 HG23 THR A 79 -5.999 7.086 11.821 1.00 0.00 H new ATOM 1212 N LYS A 80 -1.610 5.971 13.704 1.00 0.00 N ATOM 1213 CA LYS A 80 -0.496 6.316 14.586 1.00 0.00 C ATOM 1214 C LYS A 80 0.706 5.404 14.359 1.00 0.00 C ATOM 1215 O LYS A 80 1.839 5.768 14.677 1.00 0.00 O ATOM 1216 CB LYS A 80 -0.949 6.213 16.046 1.00 0.00 C ATOM 1217 CG LYS A 80 0.260 6.336 16.971 1.00 0.00 C ATOM 1218 CD LYS A 80 0.635 4.948 17.486 1.00 0.00 C ATOM 1219 CE LYS A 80 2.102 4.940 17.886 1.00 0.00 C ATOM 1220 NZ LYS A 80 2.253 5.540 19.243 1.00 0.00 N ATOM 0 H LYS A 80 -1.905 4.995 13.735 1.00 0.00 H new ATOM 0 HA LYS A 80 -0.190 7.337 14.358 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -1.671 6.999 16.269 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -1.452 5.261 16.214 1.00 0.00 H new ATOM 0 HG2 LYS A 80 1.100 6.779 16.436 1.00 0.00 H new ATOM 0 HG3 LYS A 80 0.030 6.998 17.806 1.00 0.00 H new ATOM 0 HD2 LYS A 80 0.012 4.684 18.340 1.00 0.00 H new ATOM 0 HD3 LYS A 80 0.452 4.200 16.715 1.00 0.00 H new ATOM 0 HE2 LYS A 80 2.485 3.919 17.884 1.00 0.00 H new ATOM 0 HE3 LYS A 80 2.690 5.502 17.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 3.257 5.534 19.516 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 1.904 6.519 19.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 1.704 4.986 19.931 1.00 0.00 H new ATOM 1234 N GLU A 81 0.470 4.226 13.806 1.00 0.00 N ATOM 1235 CA GLU A 81 1.566 3.301 13.555 1.00 0.00 C ATOM 1236 C GLU A 81 1.103 2.123 12.712 1.00 0.00 C ATOM 1237 O GLU A 81 -0.049 2.062 12.282 1.00 0.00 O ATOM 1238 CB GLU A 81 2.129 2.790 14.884 1.00 0.00 C ATOM 1239 CG GLU A 81 3.470 2.092 14.643 1.00 0.00 C ATOM 1240 CD GLU A 81 4.440 2.427 15.770 1.00 0.00 C ATOM 1241 OE1 GLU A 81 3.978 2.637 16.879 1.00 0.00 O ATOM 1242 OE2 GLU A 81 5.630 2.470 15.506 1.00 0.00 O ATOM 0 H GLU A 81 -0.452 3.890 13.526 1.00 0.00 H new ATOM 0 HA GLU A 81 2.343 3.834 13.007 1.00 0.00 H new ATOM 0 HB2 GLU A 81 2.260 3.621 15.578 1.00 0.00 H new ATOM 0 HB3 GLU A 81 1.425 2.097 15.346 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.323 1.013 14.587 1.00 0.00 H new ATOM 0 HG3 GLU A 81 3.887 2.407 13.687 1.00 0.00 H new ATOM 1249 N GLN A 82 2.010 1.181 12.497 1.00 0.00 N ATOM 1250 CA GLN A 82 1.694 -0.007 11.723 1.00 0.00 C ATOM 1251 C GLN A 82 2.869 -0.978 11.735 1.00 0.00 C ATOM 1252 O GLN A 82 3.865 -0.780 11.040 1.00 0.00 O ATOM 1253 CB GLN A 82 1.338 0.391 10.293 1.00 0.00 C ATOM 1254 CG GLN A 82 1.675 -0.727 9.324 1.00 0.00 C ATOM 1255 CD GLN A 82 3.086 -0.544 8.772 1.00 0.00 C ATOM 1256 OE1 GLN A 82 3.440 0.545 8.319 1.00 0.00 O ATOM 1257 NE2 GLN A 82 3.916 -1.551 8.783 1.00 0.00 N ATOM 0 H GLN A 82 2.967 1.217 12.847 1.00 0.00 H new ATOM 0 HA GLN A 82 0.837 -0.508 12.173 1.00 0.00 H new ATOM 0 HB2 GLN A 82 0.275 0.626 10.230 1.00 0.00 H new ATOM 0 HB3 GLN A 82 1.881 1.295 10.016 1.00 0.00 H new ATOM 0 HG2 GLN A 82 1.597 -1.690 9.828 1.00 0.00 H new ATOM 0 HG3 GLN A 82 0.956 -0.737 8.505 1.00 0.00 H new ATOM 0 HE21 GLN A 82 3.620 -2.452 9.159 1.00 0.00 H new ATOM 0 HE22 GLN A 82 4.861 -1.437 8.416 1.00 0.00 H new ATOM 1266 N VAL A 83 2.743 -2.031 12.535 1.00 0.00 N ATOM 1267 CA VAL A 83 3.794 -3.033 12.627 1.00 0.00 C ATOM 1268 C VAL A 83 3.243 -4.416 12.302 1.00 0.00 C ATOM 1269 O VAL A 83 2.552 -5.030 13.114 1.00 0.00 O ATOM 1270 CB VAL A 83 4.395 -3.019 14.031 1.00 0.00 C ATOM 1271 CG1 VAL A 83 4.793 -1.587 14.388 1.00 0.00 C ATOM 1272 CG2 VAL A 83 3.358 -3.525 15.036 1.00 0.00 C ATOM 0 H VAL A 83 1.930 -2.211 13.124 1.00 0.00 H new ATOM 0 HA VAL A 83 4.573 -2.796 11.902 1.00 0.00 H new ATOM 0 HB VAL A 83 5.272 -3.665 14.062 1.00 0.00 H new ATOM 0 HG11 VAL A 83 5.223 -1.568 15.389 1.00 0.00 H new ATOM 0 HG12 VAL A 83 5.528 -1.224 13.670 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.911 -0.947 14.360 1.00 0.00 H new ATOM 0 HG21 VAL A 83 3.787 -3.515 16.038 1.00 0.00 H new ATOM 0 HG22 VAL A 83 2.481 -2.878 15.010 1.00 0.00 H new ATOM 0 HG23 VAL A 83 3.066 -4.543 14.777 1.00 0.00 H new ATOM 1282 N ILE A 84 3.553 -4.913 11.118 1.00 0.00 N ATOM 1283 CA ILE A 84 3.076 -6.227 10.730 1.00 0.00 C ATOM 1284 C ILE A 84 4.193 -7.033 10.083 1.00 0.00 C ATOM 1285 O ILE A 84 4.879 -6.548 9.185 1.00 0.00 O ATOM 1286 CB ILE A 84 1.898 -6.100 9.762 1.00 0.00 C ATOM 1287 CG1 ILE A 84 0.661 -5.623 10.527 1.00 0.00 C ATOM 1288 CG2 ILE A 84 1.606 -7.463 9.134 1.00 0.00 C ATOM 1289 CD1 ILE A 84 0.785 -4.127 10.824 1.00 0.00 C ATOM 0 H ILE A 84 4.123 -4.436 10.419 1.00 0.00 H new ATOM 0 HA ILE A 84 2.743 -6.748 11.628 1.00 0.00 H new ATOM 0 HB ILE A 84 2.146 -5.382 8.980 1.00 0.00 H new ATOM 0 HG12 ILE A 84 -0.238 -5.814 9.940 1.00 0.00 H new ATOM 0 HG13 ILE A 84 0.559 -6.181 11.458 1.00 0.00 H new ATOM 0 HG21 ILE A 84 0.767 -7.374 8.444 1.00 0.00 H new ATOM 0 HG22 ILE A 84 2.486 -7.810 8.592 1.00 0.00 H new ATOM 0 HG23 ILE A 84 1.357 -8.179 9.917 1.00 0.00 H new ATOM 0 HD11 ILE A 84 -0.097 -3.790 11.369 1.00 0.00 H new ATOM 0 HD12 ILE A 84 1.675 -3.948 11.428 1.00 0.00 H new ATOM 0 HD13 ILE A 84 0.866 -3.576 9.887 1.00 0.00 H new ATOM 1301 N LYS A 85 4.360 -8.272 10.528 1.00 0.00 N ATOM 1302 CA LYS A 85 5.388 -9.131 9.959 1.00 0.00 C ATOM 1303 C LYS A 85 4.759 -10.066 8.939 1.00 0.00 C ATOM 1304 O LYS A 85 3.749 -10.710 9.215 1.00 0.00 O ATOM 1305 CB LYS A 85 6.082 -9.936 11.053 1.00 0.00 C ATOM 1306 CG LYS A 85 5.109 -10.177 12.198 1.00 0.00 C ATOM 1307 CD LYS A 85 5.488 -11.466 12.930 1.00 0.00 C ATOM 1308 CE LYS A 85 5.344 -11.263 14.435 1.00 0.00 C ATOM 1309 NZ LYS A 85 4.223 -10.321 14.709 1.00 0.00 N ATOM 0 H LYS A 85 3.806 -8.699 11.270 1.00 0.00 H new ATOM 0 HA LYS A 85 6.136 -8.509 9.467 1.00 0.00 H new ATOM 0 HB2 LYS A 85 6.433 -10.887 10.653 1.00 0.00 H new ATOM 0 HB3 LYS A 85 6.959 -9.399 11.414 1.00 0.00 H new ATOM 0 HG2 LYS A 85 5.129 -9.335 12.889 1.00 0.00 H new ATOM 0 HG3 LYS A 85 4.091 -10.250 11.815 1.00 0.00 H new ATOM 0 HD2 LYS A 85 4.848 -12.284 12.601 1.00 0.00 H new ATOM 0 HD3 LYS A 85 6.513 -11.746 12.687 1.00 0.00 H new ATOM 0 HE2 LYS A 85 5.157 -12.219 14.924 1.00 0.00 H new ATOM 0 HE3 LYS A 85 6.272 -10.869 14.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 3.826 -10.518 15.650 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 4.576 -9.343 14.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 3.483 -10.443 13.988 1.00 0.00 H new ATOM 1323 N THR A 86 5.348 -10.127 7.755 1.00 0.00 N ATOM 1324 CA THR A 86 4.817 -10.975 6.698 1.00 0.00 C ATOM 1325 C THR A 86 5.105 -12.439 6.999 1.00 0.00 C ATOM 1326 O THR A 86 6.260 -12.852 7.044 1.00 0.00 O ATOM 1327 CB THR A 86 5.442 -10.557 5.365 1.00 0.00 C ATOM 1328 OG1 THR A 86 6.855 -10.575 5.484 1.00 0.00 O ATOM 1329 CG2 THR A 86 4.977 -9.146 5.026 1.00 0.00 C ATOM 0 H THR A 86 6.187 -9.605 7.502 1.00 0.00 H new ATOM 0 HA THR A 86 3.735 -10.856 6.638 1.00 0.00 H new ATOM 0 HB THR A 86 5.138 -11.246 4.577 1.00 0.00 H new ATOM 0 HG1 THR A 86 7.137 -11.415 5.903 1.00 0.00 H new ATOM 0 HG21 THR A 86 5.416 -8.836 4.078 1.00 0.00 H new ATOM 0 HG22 THR A 86 3.890 -9.131 4.945 1.00 0.00 H new ATOM 0 HG23 THR A 86 5.292 -8.460 5.813 1.00 0.00 H new ATOM 1337 N ASN A 87 4.040 -13.211 7.220 1.00 0.00 N ATOM 1338 CA ASN A 87 4.177 -14.631 7.543 1.00 0.00 C ATOM 1339 C ASN A 87 4.032 -15.503 6.297 1.00 0.00 C ATOM 1340 O ASN A 87 4.244 -16.712 6.351 1.00 0.00 O ATOM 1341 CB ASN A 87 3.115 -15.027 8.573 1.00 0.00 C ATOM 1342 CG ASN A 87 3.774 -15.704 9.770 1.00 0.00 C ATOM 1343 OD1 ASN A 87 3.316 -16.755 10.221 1.00 0.00 O ATOM 1344 ND2 ASN A 87 4.828 -15.163 10.317 1.00 0.00 N ATOM 0 H ASN A 87 3.077 -12.878 7.181 1.00 0.00 H new ATOM 0 HA ASN A 87 5.174 -14.791 7.954 1.00 0.00 H new ATOM 0 HB2 ASN A 87 2.568 -14.143 8.901 1.00 0.00 H new ATOM 0 HB3 ASN A 87 2.389 -15.701 8.118 1.00 0.00 H new ATOM 0 HD21 ASN A 87 5.273 -15.610 11.118 1.00 0.00 H new ATOM 0 HD22 ASN A 87 5.207 -14.293 9.943 1.00 0.00 H new ATOM 1351 N ALA A 88 3.685 -14.880 5.178 1.00 0.00 N ATOM 1352 CA ALA A 88 3.533 -15.601 3.916 1.00 0.00 C ATOM 1353 C ALA A 88 4.736 -15.309 3.032 1.00 0.00 C ATOM 1354 O ALA A 88 5.717 -14.740 3.497 1.00 0.00 O ATOM 1355 CB ALA A 88 2.240 -15.175 3.205 1.00 0.00 C ATOM 0 H ALA A 88 3.503 -13.878 5.116 1.00 0.00 H new ATOM 0 HA ALA A 88 3.474 -16.671 4.117 1.00 0.00 H new ATOM 0 HB1 ALA A 88 2.143 -15.722 2.267 1.00 0.00 H new ATOM 0 HB2 ALA A 88 1.384 -15.395 3.843 1.00 0.00 H new ATOM 0 HB3 ALA A 88 2.273 -14.105 2.999 1.00 0.00 H new ATOM 1361 N ASN A 89 4.673 -15.693 1.765 1.00 0.00 N ATOM 1362 CA ASN A 89 5.787 -15.426 0.857 1.00 0.00 C ATOM 1363 C ASN A 89 5.281 -14.608 -0.324 1.00 0.00 C ATOM 1364 O ASN A 89 4.256 -14.937 -0.899 1.00 0.00 O ATOM 1365 CB ASN A 89 6.389 -16.743 0.362 1.00 0.00 C ATOM 1366 CG ASN A 89 7.693 -17.028 1.098 1.00 0.00 C ATOM 1367 OD1 ASN A 89 8.775 -16.816 0.551 1.00 0.00 O ATOM 1368 ND2 ASN A 89 7.656 -17.500 2.314 1.00 0.00 N ATOM 0 H ASN A 89 3.881 -16.181 1.346 1.00 0.00 H new ATOM 0 HA ASN A 89 6.560 -14.867 1.384 1.00 0.00 H new ATOM 0 HB2 ASN A 89 5.684 -17.559 0.524 1.00 0.00 H new ATOM 0 HB3 ASN A 89 6.572 -16.688 -0.711 1.00 0.00 H new ATOM 0 HD21 ASN A 89 8.525 -17.694 2.813 1.00 0.00 H new ATOM 0 HD22 ASN A 89 6.759 -17.675 2.766 1.00 0.00 H new ATOM 1375 N VAL A 90 5.982 -13.540 -0.692 1.00 0.00 N ATOM 1376 CA VAL A 90 5.545 -12.730 -1.794 1.00 0.00 C ATOM 1377 C VAL A 90 6.371 -13.033 -3.016 1.00 0.00 C ATOM 1378 O VAL A 90 7.601 -13.026 -2.956 1.00 0.00 O ATOM 1379 CB VAL A 90 5.678 -11.262 -1.455 1.00 0.00 C ATOM 1380 CG1 VAL A 90 5.585 -10.484 -2.741 1.00 0.00 C ATOM 1381 CG2 VAL A 90 4.566 -10.827 -0.504 1.00 0.00 C ATOM 0 H VAL A 90 6.843 -13.228 -0.242 1.00 0.00 H new ATOM 0 HA VAL A 90 4.498 -12.958 -1.994 1.00 0.00 H new ATOM 0 HB VAL A 90 6.632 -11.078 -0.961 1.00 0.00 H new ATOM 0 HG11 VAL A 90 5.678 -9.419 -2.529 1.00 0.00 H new ATOM 0 HG12 VAL A 90 6.387 -10.792 -3.411 1.00 0.00 H new ATOM 0 HG13 VAL A 90 4.622 -10.677 -3.214 1.00 0.00 H new ATOM 0 HG21 VAL A 90 4.679 -9.768 -0.272 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.598 -10.994 -0.976 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.626 -11.408 0.416 1.00 0.00 H new ATOM 1391 N LYS A 91 5.683 -13.275 -4.123 1.00 0.00 N ATOM 1392 CA LYS A 91 6.350 -13.564 -5.376 1.00 0.00 C ATOM 1393 C LYS A 91 5.646 -12.850 -6.521 1.00 0.00 C ATOM 1394 O LYS A 91 4.473 -13.106 -6.801 1.00 0.00 O ATOM 1395 CB LYS A 91 6.349 -15.073 -5.630 1.00 0.00 C ATOM 1396 CG LYS A 91 7.100 -15.375 -6.927 1.00 0.00 C ATOM 1397 CD LYS A 91 7.215 -16.891 -7.109 1.00 0.00 C ATOM 1398 CE LYS A 91 5.943 -17.425 -7.770 1.00 0.00 C ATOM 1399 NZ LYS A 91 5.865 -18.902 -7.582 1.00 0.00 N ATOM 0 H LYS A 91 4.664 -13.276 -4.175 1.00 0.00 H new ATOM 0 HA LYS A 91 7.379 -13.210 -5.317 1.00 0.00 H new ATOM 0 HB2 LYS A 91 6.820 -15.593 -4.796 1.00 0.00 H new ATOM 0 HB3 LYS A 91 5.325 -15.440 -5.697 1.00 0.00 H new ATOM 0 HG2 LYS A 91 6.575 -14.935 -7.775 1.00 0.00 H new ATOM 0 HG3 LYS A 91 8.092 -14.925 -6.898 1.00 0.00 H new ATOM 0 HD2 LYS A 91 8.084 -17.129 -7.723 1.00 0.00 H new ATOM 0 HD3 LYS A 91 7.365 -17.373 -6.143 1.00 0.00 H new ATOM 0 HE2 LYS A 91 5.066 -16.946 -7.335 1.00 0.00 H new ATOM 0 HE3 LYS A 91 5.944 -17.183 -8.833 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 5.000 -19.264 -8.032 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 6.696 -19.352 -8.017 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 5.845 -19.122 -6.566 1.00 0.00 H new ATOM 1413 N ALA A 92 6.372 -11.961 -7.187 1.00 0.00 N ATOM 1414 CA ALA A 92 5.814 -11.231 -8.308 1.00 0.00 C ATOM 1415 C ALA A 92 5.563 -12.201 -9.446 1.00 0.00 C ATOM 1416 O ALA A 92 6.498 -12.847 -9.925 1.00 0.00 O ATOM 1417 CB ALA A 92 6.779 -10.135 -8.763 1.00 0.00 C ATOM 0 H ALA A 92 7.342 -11.732 -6.969 1.00 0.00 H new ATOM 0 HA ALA A 92 4.878 -10.761 -8.006 1.00 0.00 H new ATOM 0 HB1 ALA A 92 6.346 -9.596 -9.605 1.00 0.00 H new ATOM 0 HB2 ALA A 92 6.956 -9.442 -7.941 1.00 0.00 H new ATOM 0 HB3 ALA A 92 7.724 -10.585 -9.068 1.00 0.00 H new ATOM 1423 N LEU A 93 4.302 -12.307 -9.860 1.00 0.00 N ATOM 1424 CA LEU A 93 3.929 -13.220 -10.935 1.00 0.00 C ATOM 1425 C LEU A 93 4.446 -12.698 -12.269 1.00 0.00 C ATOM 1426 O LEU A 93 5.058 -13.434 -13.043 1.00 0.00 O ATOM 1427 CB LEU A 93 2.405 -13.352 -10.992 1.00 0.00 C ATOM 1428 CG LEU A 93 1.984 -14.735 -10.488 1.00 0.00 C ATOM 1429 CD1 LEU A 93 2.701 -15.047 -9.174 1.00 0.00 C ATOM 1430 CD2 LEU A 93 0.471 -14.750 -10.256 1.00 0.00 C ATOM 0 H LEU A 93 3.525 -11.774 -9.469 1.00 0.00 H new ATOM 0 HA LEU A 93 4.372 -14.197 -10.740 1.00 0.00 H new ATOM 0 HB2 LEU A 93 1.941 -12.576 -10.383 1.00 0.00 H new ATOM 0 HB3 LEU A 93 2.056 -13.206 -12.014 1.00 0.00 H new ATOM 0 HG LEU A 93 2.251 -15.487 -11.231 1.00 0.00 H new ATOM 0 HD11 LEU A 93 2.398 -16.032 -8.819 1.00 0.00 H new ATOM 0 HD12 LEU A 93 3.779 -15.035 -9.336 1.00 0.00 H new ATOM 0 HD13 LEU A 93 2.438 -14.296 -8.429 1.00 0.00 H new ATOM 0 HD21 LEU A 93 0.168 -15.733 -9.897 1.00 0.00 H new ATOM 0 HD22 LEU A 93 0.209 -13.996 -9.514 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -0.043 -14.531 -11.192 1.00 0.00 H new ATOM 1442 N THR A 94 4.212 -11.417 -12.518 1.00 0.00 N ATOM 1443 CA THR A 94 4.673 -10.787 -13.747 1.00 0.00 C ATOM 1444 C THR A 94 5.424 -9.510 -13.405 1.00 0.00 C ATOM 1445 O THR A 94 5.115 -8.853 -12.408 1.00 0.00 O ATOM 1446 CB THR A 94 3.486 -10.463 -14.656 1.00 0.00 C ATOM 1447 OG1 THR A 94 2.591 -9.599 -13.972 1.00 0.00 O ATOM 1448 CG2 THR A 94 2.764 -11.757 -15.035 1.00 0.00 C ATOM 0 H THR A 94 3.707 -10.795 -11.887 1.00 0.00 H new ATOM 0 HA THR A 94 5.337 -11.473 -14.273 1.00 0.00 H new ATOM 0 HB THR A 94 3.843 -9.972 -15.561 1.00 0.00 H new ATOM 0 HG1 THR A 94 2.146 -10.093 -13.252 1.00 0.00 H new ATOM 0 HG21 THR A 94 1.918 -11.526 -15.683 1.00 0.00 H new ATOM 0 HG22 THR A 94 3.453 -12.418 -15.561 1.00 0.00 H new ATOM 0 HG23 THR A 94 2.405 -12.251 -14.132 1.00 0.00 H new ATOM 1456 N TYR A 95 6.409 -9.158 -14.224 1.00 0.00 N ATOM 1457 CA TYR A 95 7.189 -7.957 -13.961 1.00 0.00 C ATOM 1458 C TYR A 95 6.257 -6.806 -13.621 1.00 0.00 C ATOM 1459 O TYR A 95 5.422 -6.406 -14.434 1.00 0.00 O ATOM 1460 CB TYR A 95 8.028 -7.590 -15.186 1.00 0.00 C ATOM 1461 CG TYR A 95 7.699 -8.522 -16.328 1.00 0.00 C ATOM 1462 CD1 TYR A 95 6.376 -8.653 -16.766 1.00 0.00 C ATOM 1463 CD2 TYR A 95 8.718 -9.254 -16.950 1.00 0.00 C ATOM 1464 CE1 TYR A 95 6.071 -9.515 -17.827 1.00 0.00 C ATOM 1465 CE2 TYR A 95 8.413 -10.115 -18.011 1.00 0.00 C ATOM 1466 CZ TYR A 95 7.089 -10.246 -18.449 1.00 0.00 C ATOM 1467 OH TYR A 95 6.789 -11.097 -19.494 1.00 0.00 O ATOM 0 H TYR A 95 6.682 -9.676 -15.059 1.00 0.00 H new ATOM 0 HA TYR A 95 7.855 -8.149 -13.120 1.00 0.00 H new ATOM 0 HB2 TYR A 95 7.831 -6.558 -15.478 1.00 0.00 H new ATOM 0 HB3 TYR A 95 9.089 -7.656 -14.945 1.00 0.00 H new ATOM 0 HD1 TYR A 95 5.590 -8.089 -16.286 1.00 0.00 H new ATOM 0 HD2 TYR A 95 9.739 -9.154 -16.611 1.00 0.00 H new ATOM 0 HE1 TYR A 95 5.050 -9.615 -18.165 1.00 0.00 H new ATOM 0 HE2 TYR A 95 9.199 -10.678 -18.492 1.00 0.00 H new ATOM 0 HH TYR A 95 7.610 -11.526 -19.813 1.00 0.00 H new ATOM 1477 N CYS A 96 6.393 -6.284 -12.409 1.00 0.00 N ATOM 1478 CA CYS A 96 5.543 -5.190 -11.971 1.00 0.00 C ATOM 1479 C CYS A 96 6.358 -4.083 -11.317 1.00 0.00 C ATOM 1480 O CYS A 96 7.211 -4.342 -10.469 1.00 0.00 O ATOM 1481 CB CYS A 96 4.500 -5.711 -10.977 1.00 0.00 C ATOM 1482 SG CYS A 96 3.154 -4.509 -10.823 1.00 0.00 S ATOM 0 H CYS A 96 7.077 -6.598 -11.720 1.00 0.00 H new ATOM 0 HA CYS A 96 5.046 -4.777 -12.849 1.00 0.00 H new ATOM 0 HB2 CYS A 96 4.108 -6.670 -11.315 1.00 0.00 H new ATOM 0 HB3 CYS A 96 4.962 -5.881 -10.005 1.00 0.00 H new ATOM 0 HG CYS A 96 3.347 -3.532 -11.659 1.00 0.00 H new ATOM 1488 N ASP A 97 6.070 -2.846 -11.705 1.00 0.00 N ATOM 1489 CA ASP A 97 6.760 -1.697 -11.138 1.00 0.00 C ATOM 1490 C ASP A 97 5.991 -1.206 -9.919 1.00 0.00 C ATOM 1491 O ASP A 97 4.782 -0.991 -9.990 1.00 0.00 O ATOM 1492 CB ASP A 97 6.859 -0.576 -12.174 1.00 0.00 C ATOM 1493 CG ASP A 97 6.925 0.778 -11.474 1.00 0.00 C ATOM 1494 OD1 ASP A 97 7.392 0.818 -10.348 1.00 0.00 O ATOM 1495 OD2 ASP A 97 6.504 1.754 -12.073 1.00 0.00 O ATOM 0 H ASP A 97 5.367 -2.615 -12.407 1.00 0.00 H new ATOM 0 HA ASP A 97 7.768 -1.990 -10.844 1.00 0.00 H new ATOM 0 HB2 ASP A 97 7.745 -0.718 -12.792 1.00 0.00 H new ATOM 0 HB3 ASP A 97 5.997 -0.608 -12.840 1.00 0.00 H new ATOM 1500 N LEU A 98 6.682 -1.047 -8.798 1.00 0.00 N ATOM 1501 CA LEU A 98 6.018 -0.603 -7.582 1.00 0.00 C ATOM 1502 C LEU A 98 6.717 0.601 -6.963 1.00 0.00 C ATOM 1503 O LEU A 98 7.922 0.794 -7.124 1.00 0.00 O ATOM 1504 CB LEU A 98 5.984 -1.739 -6.557 1.00 0.00 C ATOM 1505 CG LEU A 98 5.704 -3.068 -7.265 1.00 0.00 C ATOM 1506 CD1 LEU A 98 7.021 -3.692 -7.727 1.00 0.00 C ATOM 1507 CD2 LEU A 98 5.008 -4.031 -6.300 1.00 0.00 C ATOM 0 H LEU A 98 7.684 -1.215 -8.706 1.00 0.00 H new ATOM 0 HA LEU A 98 5.004 -0.311 -7.855 1.00 0.00 H new ATOM 0 HB2 LEU A 98 6.935 -1.792 -6.027 1.00 0.00 H new ATOM 0 HB3 LEU A 98 5.214 -1.545 -5.811 1.00 0.00 H new ATOM 0 HG LEU A 98 5.062 -2.883 -8.126 1.00 0.00 H new ATOM 0 HD11 LEU A 98 6.819 -4.637 -8.230 1.00 0.00 H new ATOM 0 HD12 LEU A 98 7.523 -3.014 -8.417 1.00 0.00 H new ATOM 0 HD13 LEU A 98 7.662 -3.871 -6.863 1.00 0.00 H new ATOM 0 HD21 LEU A 98 4.811 -4.975 -6.808 1.00 0.00 H new ATOM 0 HD22 LEU A 98 5.651 -4.210 -5.438 1.00 0.00 H new ATOM 0 HD23 LEU A 98 4.067 -3.595 -5.966 1.00 0.00 H new ATOM 1519 N GLN A 99 5.943 1.392 -6.233 1.00 0.00 N ATOM 1520 CA GLN A 99 6.471 2.565 -5.554 1.00 0.00 C ATOM 1521 C GLN A 99 6.133 2.471 -4.072 1.00 0.00 C ATOM 1522 O GLN A 99 5.004 2.146 -3.709 1.00 0.00 O ATOM 1523 CB GLN A 99 5.871 3.842 -6.146 1.00 0.00 C ATOM 1524 CG GLN A 99 5.847 3.738 -7.673 1.00 0.00 C ATOM 1525 CD GLN A 99 6.405 5.013 -8.293 1.00 0.00 C ATOM 1526 OE1 GLN A 99 5.754 6.136 -8.153 1.00 0.00 O flip ATOM 1527 NE2 GLN A 99 7.463 4.988 -8.922 1.00 0.00 N flip ATOM 0 H GLN A 99 4.944 1.241 -6.096 1.00 0.00 H new ATOM 0 HA GLN A 99 7.552 2.602 -5.686 1.00 0.00 H new ATOM 0 HB2 GLN A 99 4.860 3.991 -5.766 1.00 0.00 H new ATOM 0 HB3 GLN A 99 6.458 4.708 -5.840 1.00 0.00 H new ATOM 0 HG2 GLN A 99 6.436 2.879 -7.996 1.00 0.00 H new ATOM 0 HG3 GLN A 99 4.826 3.573 -8.018 1.00 0.00 H new ATOM 0 HE21 GLN A 99 7.971 4.110 -9.031 1.00 0.00 H new ATOM 0 HE22 GLN A 99 7.832 5.845 -9.334 1.00 0.00 H new ATOM 1536 N TYR A 100 7.107 2.744 -3.220 1.00 0.00 N ATOM 1537 CA TYR A 100 6.878 2.667 -1.786 1.00 0.00 C ATOM 1538 C TYR A 100 7.676 3.718 -1.037 1.00 0.00 C ATOM 1539 O TYR A 100 8.557 4.373 -1.592 1.00 0.00 O ATOM 1540 CB TYR A 100 7.222 1.271 -1.237 1.00 0.00 C ATOM 1541 CG TYR A 100 8.722 1.033 -1.210 1.00 0.00 C ATOM 1542 CD1 TYR A 100 9.601 1.780 -2.010 1.00 0.00 C ATOM 1543 CD2 TYR A 100 9.232 0.031 -0.377 1.00 0.00 C ATOM 1544 CE1 TYR A 100 10.979 1.520 -1.967 1.00 0.00 C ATOM 1545 CE2 TYR A 100 10.605 -0.228 -0.341 1.00 0.00 C ATOM 1546 CZ TYR A 100 11.478 0.517 -1.135 1.00 0.00 C ATOM 1547 OH TYR A 100 12.833 0.261 -1.097 1.00 0.00 O ATOM 0 H TYR A 100 8.052 3.017 -3.490 1.00 0.00 H new ATOM 0 HA TYR A 100 5.816 2.856 -1.627 1.00 0.00 H new ATOM 0 HB2 TYR A 100 6.819 1.166 -0.230 1.00 0.00 H new ATOM 0 HB3 TYR A 100 6.744 0.509 -1.853 1.00 0.00 H new ATOM 0 HD1 TYR A 100 9.217 2.554 -2.658 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.561 -0.546 0.242 1.00 0.00 H new ATOM 0 HE1 TYR A 100 11.655 2.098 -2.579 1.00 0.00 H new ATOM 0 HE2 TYR A 100 10.991 -1.005 0.302 1.00 0.00 H new ATOM 0 HH TYR A 100 13.011 -0.467 -0.465 1.00 0.00 H new ATOM 1557 N ILE A 101 7.339 3.874 0.231 1.00 0.00 N ATOM 1558 CA ILE A 101 8.009 4.839 1.081 1.00 0.00 C ATOM 1559 C ILE A 101 7.916 4.382 2.532 1.00 0.00 C ATOM 1560 O ILE A 101 6.985 3.669 2.908 1.00 0.00 O ATOM 1561 CB ILE A 101 7.376 6.221 0.883 1.00 0.00 C ATOM 1562 CG1 ILE A 101 6.991 6.845 2.224 1.00 0.00 C ATOM 1563 CG2 ILE A 101 6.121 6.058 0.044 1.00 0.00 C ATOM 1564 CD1 ILE A 101 5.758 6.124 2.774 1.00 0.00 C ATOM 0 H ILE A 101 6.603 3.342 0.695 1.00 0.00 H new ATOM 0 HA ILE A 101 9.063 4.911 0.814 1.00 0.00 H new ATOM 0 HB ILE A 101 8.098 6.873 0.391 1.00 0.00 H new ATOM 0 HG12 ILE A 101 7.819 6.765 2.928 1.00 0.00 H new ATOM 0 HG13 ILE A 101 6.781 7.907 2.098 1.00 0.00 H new ATOM 0 HG21 ILE A 101 5.656 7.032 -0.108 1.00 0.00 H new ATOM 0 HG22 ILE A 101 6.383 5.626 -0.922 1.00 0.00 H new ATOM 0 HG23 ILE A 101 5.422 5.399 0.559 1.00 0.00 H new ATOM 0 HD11 ILE A 101 5.476 6.563 3.731 1.00 0.00 H new ATOM 0 HD12 ILE A 101 4.932 6.227 2.070 1.00 0.00 H new ATOM 0 HD13 ILE A 101 5.986 5.067 2.913 1.00 0.00 H new ATOM 1576 N SER A 102 8.877 4.787 3.346 1.00 0.00 N ATOM 1577 CA SER A 102 8.860 4.399 4.744 1.00 0.00 C ATOM 1578 C SER A 102 7.799 5.199 5.489 1.00 0.00 C ATOM 1579 O SER A 102 7.794 6.429 5.448 1.00 0.00 O ATOM 1580 CB SER A 102 10.229 4.638 5.375 1.00 0.00 C ATOM 1581 OG SER A 102 10.458 6.037 5.488 1.00 0.00 O ATOM 0 H SER A 102 9.664 5.373 3.069 1.00 0.00 H new ATOM 0 HA SER A 102 8.623 3.337 4.812 1.00 0.00 H new ATOM 0 HB2 SER A 102 10.275 4.170 6.358 1.00 0.00 H new ATOM 0 HB3 SER A 102 11.008 4.179 4.766 1.00 0.00 H new ATOM 0 HG SER A 102 11.336 6.193 5.895 1.00 0.00 H new ATOM 1587 N LEU A 103 6.899 4.495 6.164 1.00 0.00 N ATOM 1588 CA LEU A 103 5.836 5.157 6.907 1.00 0.00 C ATOM 1589 C LEU A 103 6.427 6.262 7.775 1.00 0.00 C ATOM 1590 O LEU A 103 5.811 7.309 7.970 1.00 0.00 O ATOM 1591 CB LEU A 103 5.107 4.145 7.794 1.00 0.00 C ATOM 1592 CG LEU A 103 3.605 4.439 7.788 1.00 0.00 C ATOM 1593 CD1 LEU A 103 3.359 5.868 8.279 1.00 0.00 C ATOM 1594 CD2 LEU A 103 3.061 4.288 6.365 1.00 0.00 C ATOM 0 H LEU A 103 6.884 3.476 6.212 1.00 0.00 H new ATOM 0 HA LEU A 103 5.127 5.589 6.201 1.00 0.00 H new ATOM 0 HB2 LEU A 103 5.290 3.133 7.433 1.00 0.00 H new ATOM 0 HB3 LEU A 103 5.493 4.195 8.812 1.00 0.00 H new ATOM 0 HG LEU A 103 3.097 3.737 8.449 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.289 6.075 8.274 1.00 0.00 H new ATOM 0 HD12 LEU A 103 3.745 5.976 9.293 1.00 0.00 H new ATOM 0 HD13 LEU A 103 3.868 6.572 7.620 1.00 0.00 H new ATOM 0 HD21 LEU A 103 1.991 4.497 6.360 1.00 0.00 H new ATOM 0 HD22 LEU A 103 3.571 4.989 5.704 1.00 0.00 H new ATOM 0 HD23 LEU A 103 3.233 3.270 6.016 1.00 0.00 H new ATOM 1606 N LYS A 104 7.635 6.026 8.276 1.00 0.00 N ATOM 1607 CA LYS A 104 8.313 7.017 9.102 1.00 0.00 C ATOM 1608 C LYS A 104 8.701 8.218 8.247 1.00 0.00 C ATOM 1609 O LYS A 104 8.649 9.362 8.696 1.00 0.00 O ATOM 1610 CB LYS A 104 9.569 6.414 9.725 1.00 0.00 C ATOM 1611 CG LYS A 104 9.218 5.124 10.467 1.00 0.00 C ATOM 1612 CD LYS A 104 7.822 5.228 11.089 1.00 0.00 C ATOM 1613 CE LYS A 104 7.566 3.999 11.963 1.00 0.00 C ATOM 1614 NZ LYS A 104 6.626 4.359 13.064 1.00 0.00 N ATOM 0 H LYS A 104 8.161 5.165 8.126 1.00 0.00 H new ATOM 0 HA LYS A 104 7.637 7.334 9.896 1.00 0.00 H new ATOM 0 HB2 LYS A 104 10.306 6.208 8.949 1.00 0.00 H new ATOM 0 HB3 LYS A 104 10.022 7.127 10.414 1.00 0.00 H new ATOM 0 HG2 LYS A 104 9.254 4.280 9.779 1.00 0.00 H new ATOM 0 HG3 LYS A 104 9.956 4.932 11.245 1.00 0.00 H new ATOM 0 HD2 LYS A 104 7.744 6.136 11.687 1.00 0.00 H new ATOM 0 HD3 LYS A 104 7.067 5.296 10.306 1.00 0.00 H new ATOM 0 HE2 LYS A 104 7.147 3.193 11.361 1.00 0.00 H new ATOM 0 HE3 LYS A 104 8.505 3.632 12.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 6.491 3.538 13.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 7.020 5.150 13.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 5.710 4.641 12.660 1.00 0.00 H new ATOM 1628 N GLY A 105 9.092 7.933 7.009 1.00 0.00 N ATOM 1629 CA GLY A 105 9.498 8.975 6.075 1.00 0.00 C ATOM 1630 C GLY A 105 8.326 9.864 5.688 1.00 0.00 C ATOM 1631 O GLY A 105 8.449 11.088 5.661 1.00 0.00 O ATOM 0 H GLY A 105 9.136 6.987 6.630 1.00 0.00 H new ATOM 0 HA2 GLY A 105 10.284 9.582 6.525 1.00 0.00 H new ATOM 0 HA3 GLY A 105 9.921 8.518 5.180 1.00 0.00 H new ATOM 1635 N LEU A 106 7.201 9.235 5.364 1.00 0.00 N ATOM 1636 CA LEU A 106 6.015 9.969 4.946 1.00 0.00 C ATOM 1637 C LEU A 106 5.387 10.743 6.094 1.00 0.00 C ATOM 1638 O LEU A 106 4.925 11.860 5.909 1.00 0.00 O ATOM 1639 CB LEU A 106 4.981 9.007 4.362 1.00 0.00 C ATOM 1640 CG LEU A 106 3.606 9.676 4.335 1.00 0.00 C ATOM 1641 CD1 LEU A 106 2.850 9.233 3.081 1.00 0.00 C ATOM 1642 CD2 LEU A 106 2.808 9.262 5.574 1.00 0.00 C ATOM 0 H LEU A 106 7.087 8.222 5.383 1.00 0.00 H new ATOM 0 HA LEU A 106 6.331 10.686 4.188 1.00 0.00 H new ATOM 0 HB2 LEU A 106 5.273 8.714 3.353 1.00 0.00 H new ATOM 0 HB3 LEU A 106 4.940 8.096 4.959 1.00 0.00 H new ATOM 0 HG LEU A 106 3.732 10.759 4.327 1.00 0.00 H new ATOM 0 HD11 LEU A 106 1.870 9.709 3.060 1.00 0.00 H new ATOM 0 HD12 LEU A 106 3.414 9.524 2.195 1.00 0.00 H new ATOM 0 HD13 LEU A 106 2.727 8.150 3.094 1.00 0.00 H new ATOM 0 HD21 LEU A 106 1.829 9.740 5.552 1.00 0.00 H new ATOM 0 HD22 LEU A 106 2.683 8.179 5.581 1.00 0.00 H new ATOM 0 HD23 LEU A 106 3.343 9.572 6.472 1.00 0.00 H new ATOM 1654 N ARG A 107 5.331 10.137 7.267 1.00 0.00 N ATOM 1655 CA ARG A 107 4.712 10.795 8.411 1.00 0.00 C ATOM 1656 C ARG A 107 5.539 11.975 8.921 1.00 0.00 C ATOM 1657 O ARG A 107 4.991 12.931 9.464 1.00 0.00 O ATOM 1658 CB ARG A 107 4.459 9.796 9.542 1.00 0.00 C ATOM 1659 CG ARG A 107 3.912 10.534 10.767 1.00 0.00 C ATOM 1660 CD ARG A 107 2.576 11.182 10.414 1.00 0.00 C ATOM 1661 NE ARG A 107 1.540 10.743 11.342 1.00 0.00 N ATOM 1662 CZ ARG A 107 1.532 11.152 12.607 1.00 0.00 C ATOM 1663 NH1 ARG A 107 2.461 11.959 13.039 1.00 0.00 N ATOM 1664 NH2 ARG A 107 0.594 10.743 13.418 1.00 0.00 N ATOM 0 H ARG A 107 5.700 9.205 7.454 1.00 0.00 H new ATOM 0 HA ARG A 107 3.757 11.192 8.067 1.00 0.00 H new ATOM 0 HB2 ARG A 107 3.750 9.035 9.217 1.00 0.00 H new ATOM 0 HB3 ARG A 107 5.384 9.280 9.799 1.00 0.00 H new ATOM 0 HG2 ARG A 107 3.784 9.839 11.597 1.00 0.00 H new ATOM 0 HG3 ARG A 107 4.622 11.294 11.095 1.00 0.00 H new ATOM 0 HD2 ARG A 107 2.670 12.267 10.450 1.00 0.00 H new ATOM 0 HD3 ARG A 107 2.295 10.920 9.394 1.00 0.00 H new ATOM 0 HE ARG A 107 0.809 10.111 11.015 1.00 0.00 H new ATOM 0 HH11 ARG A 107 3.195 12.277 12.406 1.00 0.00 H new ATOM 0 HH12 ARG A 107 2.454 12.272 14.010 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -0.132 10.110 13.081 1.00 0.00 H new ATOM 0 HH22 ARG A 107 0.587 11.056 14.389 1.00 0.00 H new ATOM 1678 N GLU A 108 6.852 11.896 8.760 1.00 0.00 N ATOM 1679 CA GLU A 108 7.741 12.964 9.222 1.00 0.00 C ATOM 1680 C GLU A 108 7.522 14.206 8.375 1.00 0.00 C ATOM 1681 O GLU A 108 7.249 15.295 8.883 1.00 0.00 O ATOM 1682 CB GLU A 108 9.201 12.520 9.117 1.00 0.00 C ATOM 1683 CG GLU A 108 10.102 13.591 9.734 1.00 0.00 C ATOM 1684 CD GLU A 108 11.451 13.612 9.024 1.00 0.00 C ATOM 1685 OE1 GLU A 108 11.818 12.594 8.461 1.00 0.00 O ATOM 1686 OE2 GLU A 108 12.099 14.646 9.055 1.00 0.00 O ATOM 0 H GLU A 108 7.328 11.110 8.316 1.00 0.00 H new ATOM 0 HA GLU A 108 7.516 13.188 10.265 1.00 0.00 H new ATOM 0 HB2 GLU A 108 9.342 11.570 9.632 1.00 0.00 H new ATOM 0 HB3 GLU A 108 9.470 12.360 8.073 1.00 0.00 H new ATOM 0 HG2 GLU A 108 9.625 14.568 9.655 1.00 0.00 H new ATOM 0 HG3 GLU A 108 10.244 13.390 10.796 1.00 0.00 H new ATOM 1693 N VAL A 109 7.605 14.012 7.075 1.00 0.00 N ATOM 1694 CA VAL A 109 7.377 15.090 6.132 1.00 0.00 C ATOM 1695 C VAL A 109 5.997 15.668 6.416 1.00 0.00 C ATOM 1696 O VAL A 109 5.783 16.888 6.487 1.00 0.00 O ATOM 1697 CB VAL A 109 7.456 14.504 4.717 1.00 0.00 C ATOM 1698 CG1 VAL A 109 8.924 14.268 4.364 1.00 0.00 C ATOM 1699 CG2 VAL A 109 6.719 13.179 4.669 1.00 0.00 C ATOM 0 H VAL A 109 7.829 13.115 6.645 1.00 0.00 H new ATOM 0 HA VAL A 109 8.119 15.883 6.223 1.00 0.00 H new ATOM 0 HB VAL A 109 7.002 15.197 4.009 1.00 0.00 H new ATOM 0 HG11 VAL A 109 8.994 13.851 3.359 1.00 0.00 H new ATOM 0 HG12 VAL A 109 9.464 15.214 4.403 1.00 0.00 H new ATOM 0 HG13 VAL A 109 9.362 13.570 5.078 1.00 0.00 H new ATOM 0 HG21 VAL A 109 6.778 12.766 3.662 1.00 0.00 H new ATOM 0 HG22 VAL A 109 7.175 12.483 5.373 1.00 0.00 H new ATOM 0 HG23 VAL A 109 5.674 13.334 4.937 1.00 0.00 H new ATOM 1709 N LEU A 110 5.072 14.761 6.641 1.00 0.00 N ATOM 1710 CA LEU A 110 3.722 15.132 6.980 1.00 0.00 C ATOM 1711 C LEU A 110 3.727 15.868 8.316 1.00 0.00 C ATOM 1712 O LEU A 110 2.887 16.734 8.563 1.00 0.00 O ATOM 1713 CB LEU A 110 2.883 13.861 7.037 1.00 0.00 C ATOM 1714 CG LEU A 110 1.952 13.790 5.826 1.00 0.00 C ATOM 1715 CD1 LEU A 110 2.765 13.825 4.532 1.00 0.00 C ATOM 1716 CD2 LEU A 110 1.181 12.477 5.872 1.00 0.00 C ATOM 0 H LEU A 110 5.235 13.755 6.594 1.00 0.00 H new ATOM 0 HA LEU A 110 3.293 15.802 6.235 1.00 0.00 H new ATOM 0 HB2 LEU A 110 3.534 12.987 7.056 1.00 0.00 H new ATOM 0 HB3 LEU A 110 2.298 13.843 7.957 1.00 0.00 H new ATOM 0 HG LEU A 110 1.271 14.641 5.852 1.00 0.00 H new ATOM 0 HD11 LEU A 110 2.091 13.774 3.677 1.00 0.00 H new ATOM 0 HD12 LEU A 110 3.338 14.751 4.487 1.00 0.00 H new ATOM 0 HD13 LEU A 110 3.447 12.975 4.508 1.00 0.00 H new ATOM 0 HD21 LEU A 110 0.514 12.417 5.012 1.00 0.00 H new ATOM 0 HD22 LEU A 110 1.882 11.642 5.847 1.00 0.00 H new ATOM 0 HD23 LEU A 110 0.595 12.431 6.790 1.00 0.00 H new ATOM 1728 N ARG A 111 4.709 15.552 9.163 1.00 0.00 N ATOM 1729 CA ARG A 111 4.826 16.233 10.443 1.00 0.00 C ATOM 1730 C ARG A 111 4.927 17.722 10.175 1.00 0.00 C ATOM 1731 O ARG A 111 4.377 18.541 10.914 1.00 0.00 O ATOM 1732 CB ARG A 111 6.066 15.757 11.205 1.00 0.00 C ATOM 1733 CG ARG A 111 5.910 16.090 12.690 1.00 0.00 C ATOM 1734 CD ARG A 111 4.993 15.063 13.349 1.00 0.00 C ATOM 1735 NE ARG A 111 5.687 14.395 14.445 1.00 0.00 N ATOM 1736 CZ ARG A 111 6.023 15.057 15.547 1.00 0.00 C ATOM 1737 NH1 ARG A 111 5.741 16.326 15.658 1.00 0.00 N ATOM 1738 NH2 ARG A 111 6.640 14.438 16.518 1.00 0.00 N ATOM 0 H ARG A 111 5.420 14.842 8.986 1.00 0.00 H new ATOM 0 HA ARG A 111 3.953 16.010 11.056 1.00 0.00 H new ATOM 0 HB2 ARG A 111 6.197 14.683 11.074 1.00 0.00 H new ATOM 0 HB3 ARG A 111 6.959 16.238 10.805 1.00 0.00 H new ATOM 0 HG2 ARG A 111 6.885 16.089 13.178 1.00 0.00 H new ATOM 0 HG3 ARG A 111 5.496 17.091 12.807 1.00 0.00 H new ATOM 0 HD2 ARG A 111 4.095 15.554 13.724 1.00 0.00 H new ATOM 0 HD3 ARG A 111 4.670 14.328 12.612 1.00 0.00 H new ATOM 0 HE ARG A 111 5.918 13.405 14.364 1.00 0.00 H new ATOM 0 HH11 ARG A 111 5.262 16.810 14.899 1.00 0.00 H new ATOM 0 HH12 ARG A 111 5.999 16.834 16.504 1.00 0.00 H new ATOM 0 HH21 ARG A 111 6.864 13.447 16.430 1.00 0.00 H new ATOM 0 HH22 ARG A 111 6.898 14.946 17.364 1.00 0.00 H new ATOM 1752 N LEU A 112 5.605 18.062 9.081 1.00 0.00 N ATOM 1753 CA LEU A 112 5.736 19.456 8.690 1.00 0.00 C ATOM 1754 C LEU A 112 4.342 19.992 8.425 1.00 0.00 C ATOM 1755 O LEU A 112 4.049 21.165 8.663 1.00 0.00 O ATOM 1756 CB LEU A 112 6.594 19.582 7.430 1.00 0.00 C ATOM 1757 CG LEU A 112 7.267 20.954 7.406 1.00 0.00 C ATOM 1758 CD1 LEU A 112 8.538 20.914 8.255 1.00 0.00 C ATOM 1759 CD2 LEU A 112 7.627 21.317 5.964 1.00 0.00 C ATOM 0 H LEU A 112 6.066 17.398 8.459 1.00 0.00 H new ATOM 0 HA LEU A 112 6.223 20.024 9.482 1.00 0.00 H new ATOM 0 HB2 LEU A 112 7.348 18.795 7.411 1.00 0.00 H new ATOM 0 HB3 LEU A 112 5.976 19.453 6.542 1.00 0.00 H new ATOM 0 HG LEU A 112 6.585 21.702 7.811 1.00 0.00 H new ATOM 0 HD11 LEU A 112 9.018 21.892 8.238 1.00 0.00 H new ATOM 0 HD12 LEU A 112 8.282 20.654 9.282 1.00 0.00 H new ATOM 0 HD13 LEU A 112 9.222 20.167 7.851 1.00 0.00 H new ATOM 0 HD21 LEU A 112 8.107 22.295 5.944 1.00 0.00 H new ATOM 0 HD22 LEU A 112 8.310 20.569 5.560 1.00 0.00 H new ATOM 0 HD23 LEU A 112 6.721 21.345 5.359 1.00 0.00 H new ATOM 1771 N TYR A 113 3.476 19.095 7.961 1.00 0.00 N ATOM 1772 CA TYR A 113 2.078 19.441 7.697 1.00 0.00 C ATOM 1773 C TYR A 113 1.170 18.595 8.596 1.00 0.00 C ATOM 1774 O TYR A 113 0.665 17.557 8.180 1.00 0.00 O ATOM 1775 CB TYR A 113 1.742 19.187 6.227 1.00 0.00 C ATOM 1776 CG TYR A 113 2.367 20.269 5.377 1.00 0.00 C ATOM 1777 CD1 TYR A 113 1.660 21.450 5.119 1.00 0.00 C ATOM 1778 CD2 TYR A 113 3.652 20.092 4.849 1.00 0.00 C ATOM 1779 CE1 TYR A 113 2.239 22.454 4.333 1.00 0.00 C ATOM 1780 CE2 TYR A 113 4.231 21.097 4.063 1.00 0.00 C ATOM 1781 CZ TYR A 113 3.524 22.278 3.805 1.00 0.00 C ATOM 1782 OH TYR A 113 4.094 23.267 3.032 1.00 0.00 O ATOM 0 H TYR A 113 3.715 18.124 7.760 1.00 0.00 H new ATOM 0 HA TYR A 113 1.920 20.498 7.912 1.00 0.00 H new ATOM 0 HB2 TYR A 113 2.113 18.209 5.921 1.00 0.00 H new ATOM 0 HB3 TYR A 113 0.661 19.177 6.086 1.00 0.00 H new ATOM 0 HD1 TYR A 113 0.669 21.586 5.526 1.00 0.00 H new ATOM 0 HD2 TYR A 113 4.197 19.181 5.048 1.00 0.00 H new ATOM 0 HE1 TYR A 113 1.694 23.365 4.134 1.00 0.00 H new ATOM 0 HE2 TYR A 113 5.222 20.961 3.656 1.00 0.00 H new ATOM 0 HH TYR A 113 5.068 23.246 3.139 1.00 0.00 H new ATOM 1792 N PRO A 114 1.000 19.009 9.829 1.00 0.00 N ATOM 1793 CA PRO A 114 0.186 18.267 10.852 1.00 0.00 C ATOM 1794 C PRO A 114 -1.303 18.103 10.520 1.00 0.00 C ATOM 1795 O PRO A 114 -1.874 17.043 10.776 1.00 0.00 O ATOM 1796 CB PRO A 114 0.342 19.101 12.131 1.00 0.00 C ATOM 1797 CG PRO A 114 1.494 20.020 11.893 1.00 0.00 C ATOM 1798 CD PRO A 114 1.572 20.238 10.387 1.00 0.00 C ATOM 0 HA PRO A 114 0.547 17.241 10.922 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -0.567 19.664 12.342 1.00 0.00 H new ATOM 0 HB3 PRO A 114 0.527 18.460 12.993 1.00 0.00 H new ATOM 0 HG2 PRO A 114 1.349 20.966 12.415 1.00 0.00 H new ATOM 0 HG3 PRO A 114 2.420 19.586 12.270 1.00 0.00 H new ATOM 0 HD2 PRO A 114 1.007 21.118 10.080 1.00 0.00 H new ATOM 0 HD3 PRO A 114 2.600 20.388 10.057 1.00 0.00 H new ATOM 1806 N GLU A 115 -1.945 19.136 9.987 1.00 0.00 N ATOM 1807 CA GLU A 115 -3.374 19.034 9.691 1.00 0.00 C ATOM 1808 C GLU A 115 -3.619 18.048 8.559 1.00 0.00 C ATOM 1809 O GLU A 115 -4.415 17.113 8.683 1.00 0.00 O ATOM 1810 CB GLU A 115 -3.926 20.407 9.298 1.00 0.00 C ATOM 1811 CG GLU A 115 -3.705 21.396 10.444 1.00 0.00 C ATOM 1812 CD GLU A 115 -3.041 22.663 9.917 1.00 0.00 C ATOM 1813 OE1 GLU A 115 -3.525 23.197 8.932 1.00 0.00 O ATOM 1814 OE2 GLU A 115 -2.058 23.083 10.506 1.00 0.00 O ATOM 0 H GLU A 115 -1.516 20.032 9.755 1.00 0.00 H new ATOM 0 HA GLU A 115 -3.884 18.677 10.586 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -3.431 20.764 8.395 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -4.989 20.331 9.070 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -4.658 21.642 10.912 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -3.081 20.941 11.213 1.00 0.00 H new ATOM 1821 N TYR A 116 -2.913 18.255 7.464 1.00 0.00 N ATOM 1822 CA TYR A 116 -3.039 17.383 6.312 1.00 0.00 C ATOM 1823 C TYR A 116 -2.484 16.004 6.639 1.00 0.00 C ATOM 1824 O TYR A 116 -2.963 14.989 6.133 1.00 0.00 O ATOM 1825 CB TYR A 116 -2.277 17.989 5.135 1.00 0.00 C ATOM 1826 CG TYR A 116 -3.102 19.100 4.530 1.00 0.00 C ATOM 1827 CD1 TYR A 116 -4.368 18.822 4.000 1.00 0.00 C ATOM 1828 CD2 TYR A 116 -2.606 20.410 4.506 1.00 0.00 C ATOM 1829 CE1 TYR A 116 -5.137 19.853 3.447 1.00 0.00 C ATOM 1830 CE2 TYR A 116 -3.375 21.440 3.952 1.00 0.00 C ATOM 1831 CZ TYR A 116 -4.641 21.163 3.423 1.00 0.00 C ATOM 1832 OH TYR A 116 -5.399 22.179 2.877 1.00 0.00 O ATOM 0 H TYR A 116 -2.247 19.019 7.348 1.00 0.00 H new ATOM 0 HA TYR A 116 -4.092 17.281 6.048 1.00 0.00 H new ATOM 0 HB2 TYR A 116 -1.314 18.375 5.470 1.00 0.00 H new ATOM 0 HB3 TYR A 116 -2.071 17.224 4.387 1.00 0.00 H new ATOM 0 HD1 TYR A 116 -4.751 17.812 4.018 1.00 0.00 H new ATOM 0 HD2 TYR A 116 -1.630 20.625 4.915 1.00 0.00 H new ATOM 0 HE1 TYR A 116 -6.113 19.638 3.039 1.00 0.00 H new ATOM 0 HE2 TYR A 116 -2.991 22.449 3.933 1.00 0.00 H new ATOM 0 HH TYR A 116 -4.908 23.025 2.941 1.00 0.00 H new ATOM 1842 N ALA A 117 -1.455 15.988 7.474 1.00 0.00 N ATOM 1843 CA ALA A 117 -0.805 14.748 7.862 1.00 0.00 C ATOM 1844 C ALA A 117 -1.736 13.816 8.616 1.00 0.00 C ATOM 1845 O ALA A 117 -1.994 12.698 8.175 1.00 0.00 O ATOM 1846 CB ALA A 117 0.388 15.079 8.743 1.00 0.00 C ATOM 0 H ALA A 117 -1.052 16.824 7.896 1.00 0.00 H new ATOM 0 HA ALA A 117 -0.495 14.234 6.952 1.00 0.00 H new ATOM 0 HB1 ALA A 117 0.886 14.157 9.042 1.00 0.00 H new ATOM 0 HB2 ALA A 117 1.087 15.706 8.189 1.00 0.00 H new ATOM 0 HB3 ALA A 117 0.048 15.612 9.631 1.00 0.00 H new ATOM 1852 N GLN A 118 -2.246 14.271 9.746 1.00 0.00 N ATOM 1853 CA GLN A 118 -3.142 13.438 10.522 1.00 0.00 C ATOM 1854 C GLN A 118 -4.251 12.946 9.611 1.00 0.00 C ATOM 1855 O GLN A 118 -4.785 11.850 9.783 1.00 0.00 O ATOM 1856 CB GLN A 118 -3.730 14.249 11.675 1.00 0.00 C ATOM 1857 CG GLN A 118 -2.628 14.635 12.662 1.00 0.00 C ATOM 1858 CD GLN A 118 -1.792 13.414 13.031 1.00 0.00 C ATOM 1859 OE1 GLN A 118 -0.726 13.130 12.334 1.00 0.00 O flip ATOM 1860 NE2 GLN A 118 -2.119 12.699 13.979 1.00 0.00 N flip ATOM 0 H GLN A 118 -2.060 15.193 10.140 1.00 0.00 H new ATOM 0 HA GLN A 118 -2.601 12.588 10.937 1.00 0.00 H new ATOM 0 HB2 GLN A 118 -4.214 15.146 11.289 1.00 0.00 H new ATOM 0 HB3 GLN A 118 -4.498 13.667 12.185 1.00 0.00 H new ATOM 0 HG2 GLN A 118 -1.989 15.401 12.222 1.00 0.00 H new ATOM 0 HG3 GLN A 118 -3.070 15.066 13.560 1.00 0.00 H new ATOM 0 HE21 GLN A 118 -2.953 12.923 14.523 1.00 0.00 H new ATOM 0 HE22 GLN A 118 -1.556 11.883 14.220 1.00 0.00 H new ATOM 1869 N LYS A 119 -4.568 13.769 8.625 1.00 0.00 N ATOM 1870 CA LYS A 119 -5.591 13.437 7.648 1.00 0.00 C ATOM 1871 C LYS A 119 -5.102 12.367 6.663 1.00 0.00 C ATOM 1872 O LYS A 119 -5.911 11.660 6.063 1.00 0.00 O ATOM 1873 CB LYS A 119 -5.993 14.693 6.873 1.00 0.00 C ATOM 1874 CG LYS A 119 -7.407 14.520 6.317 1.00 0.00 C ATOM 1875 CD LYS A 119 -8.429 14.835 7.410 1.00 0.00 C ATOM 1876 CE LYS A 119 -9.560 13.805 7.365 1.00 0.00 C ATOM 1877 NZ LYS A 119 -9.181 12.616 8.178 1.00 0.00 N ATOM 0 H LYS A 119 -4.128 14.678 8.480 1.00 0.00 H new ATOM 0 HA LYS A 119 -6.451 13.039 8.187 1.00 0.00 H new ATOM 0 HB2 LYS A 119 -5.952 15.565 7.526 1.00 0.00 H new ATOM 0 HB3 LYS A 119 -5.290 14.871 6.059 1.00 0.00 H new ATOM 0 HG2 LYS A 119 -7.557 15.181 5.463 1.00 0.00 H new ATOM 0 HG3 LYS A 119 -7.546 13.500 5.958 1.00 0.00 H new ATOM 0 HD2 LYS A 119 -7.948 14.819 8.388 1.00 0.00 H new ATOM 0 HD3 LYS A 119 -8.831 15.838 7.268 1.00 0.00 H new ATOM 0 HE2 LYS A 119 -10.481 14.243 7.750 1.00 0.00 H new ATOM 0 HE3 LYS A 119 -9.755 13.507 6.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 -9.969 11.938 8.190 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 -8.342 12.164 7.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 -8.967 12.915 9.151 1.00 0.00 H new ATOM 1891 N PHE A 120 -3.780 12.277 6.462 1.00 0.00 N ATOM 1892 CA PHE A 120 -3.231 11.319 5.504 1.00 0.00 C ATOM 1893 C PHE A 120 -3.598 9.880 5.845 1.00 0.00 C ATOM 1894 O PHE A 120 -3.918 9.089 4.958 1.00 0.00 O ATOM 1895 CB PHE A 120 -1.711 11.482 5.435 1.00 0.00 C ATOM 1896 CG PHE A 120 -0.990 10.240 5.929 1.00 0.00 C ATOM 1897 CD1 PHE A 120 -0.796 9.145 5.073 1.00 0.00 C ATOM 1898 CD2 PHE A 120 -0.476 10.203 7.232 1.00 0.00 C ATOM 1899 CE1 PHE A 120 -0.097 8.026 5.519 1.00 0.00 C ATOM 1900 CE2 PHE A 120 0.219 9.074 7.680 1.00 0.00 C ATOM 1901 CZ PHE A 120 0.410 7.986 6.825 1.00 0.00 C ATOM 0 H PHE A 120 -3.084 12.847 6.943 1.00 0.00 H new ATOM 0 HA PHE A 120 -3.671 11.532 4.530 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -1.414 11.691 4.407 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -1.409 12.341 6.035 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -1.189 9.170 4.067 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -0.616 11.047 7.891 1.00 0.00 H new ATOM 0 HE1 PHE A 120 0.055 7.187 4.857 1.00 0.00 H new ATOM 0 HE2 PHE A 120 0.608 9.044 8.687 1.00 0.00 H new ATOM 0 HZ PHE A 120 0.948 7.115 7.170 1.00 0.00 H new ATOM 1911 N VAL A 121 -3.533 9.538 7.118 1.00 0.00 N ATOM 1912 CA VAL A 121 -3.844 8.181 7.534 1.00 0.00 C ATOM 1913 C VAL A 121 -5.211 7.747 7.009 1.00 0.00 C ATOM 1914 O VAL A 121 -5.367 6.638 6.499 1.00 0.00 O ATOM 1915 CB VAL A 121 -3.842 8.087 9.058 1.00 0.00 C ATOM 1916 CG1 VAL A 121 -2.697 8.930 9.626 1.00 0.00 C ATOM 1917 CG2 VAL A 121 -5.179 8.614 9.592 1.00 0.00 C ATOM 0 H VAL A 121 -3.271 10.171 7.874 1.00 0.00 H new ATOM 0 HA VAL A 121 -3.081 7.521 7.121 1.00 0.00 H new ATOM 0 HB VAL A 121 -3.706 7.049 9.361 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -2.699 8.860 10.714 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -1.747 8.560 9.240 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -2.829 9.970 9.329 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -5.187 8.551 10.680 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -5.308 9.653 9.288 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -5.994 8.014 9.188 1.00 0.00 H new ATOM 1927 N SER A 122 -6.200 8.623 7.148 1.00 0.00 N ATOM 1928 CA SER A 122 -7.551 8.314 6.695 1.00 0.00 C ATOM 1929 C SER A 122 -7.660 8.431 5.178 1.00 0.00 C ATOM 1930 O SER A 122 -8.301 7.605 4.529 1.00 0.00 O ATOM 1931 CB SER A 122 -8.552 9.264 7.354 1.00 0.00 C ATOM 1932 OG SER A 122 -9.856 8.706 7.268 1.00 0.00 O ATOM 0 H SER A 122 -6.093 9.546 7.568 1.00 0.00 H new ATOM 0 HA SER A 122 -7.777 7.287 6.981 1.00 0.00 H new ATOM 0 HB2 SER A 122 -8.282 9.428 8.397 1.00 0.00 H new ATOM 0 HB3 SER A 122 -8.527 10.236 6.861 1.00 0.00 H new ATOM 0 HG SER A 122 -10.500 9.312 7.691 1.00 0.00 H new ATOM 1938 N GLU A 123 -7.036 9.461 4.620 1.00 0.00 N ATOM 1939 CA GLU A 123 -7.079 9.674 3.178 1.00 0.00 C ATOM 1940 C GLU A 123 -6.509 8.467 2.435 1.00 0.00 C ATOM 1941 O GLU A 123 -6.917 8.174 1.312 1.00 0.00 O ATOM 1942 CB GLU A 123 -6.286 10.928 2.810 1.00 0.00 C ATOM 1943 CG GLU A 123 -7.232 12.128 2.741 1.00 0.00 C ATOM 1944 CD GLU A 123 -6.505 13.390 3.192 1.00 0.00 C ATOM 1945 OE1 GLU A 123 -5.308 13.312 3.416 1.00 0.00 O ATOM 1946 OE2 GLU A 123 -7.155 14.416 3.308 1.00 0.00 O ATOM 0 H GLU A 123 -6.499 10.156 5.138 1.00 0.00 H new ATOM 0 HA GLU A 123 -8.120 9.805 2.882 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -5.506 11.108 3.550 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -5.788 10.788 1.850 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -7.599 12.254 1.723 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -8.102 11.953 3.374 1.00 0.00 H new ATOM 1953 N ILE A 124 -5.565 7.773 3.064 1.00 0.00 N ATOM 1954 CA ILE A 124 -4.954 6.606 2.446 1.00 0.00 C ATOM 1955 C ILE A 124 -6.021 5.582 2.059 1.00 0.00 C ATOM 1956 O ILE A 124 -5.954 4.968 0.993 1.00 0.00 O ATOM 1957 CB ILE A 124 -3.969 5.963 3.428 1.00 0.00 C ATOM 1958 CG1 ILE A 124 -2.784 5.396 2.645 1.00 0.00 C ATOM 1959 CG2 ILE A 124 -4.665 4.845 4.221 1.00 0.00 C ATOM 1960 CD1 ILE A 124 -2.278 4.114 3.310 1.00 0.00 C ATOM 0 H ILE A 124 -5.210 7.998 3.994 1.00 0.00 H new ATOM 0 HA ILE A 124 -4.428 6.924 1.546 1.00 0.00 H new ATOM 0 HB ILE A 124 -3.614 6.714 4.133 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -3.083 5.188 1.618 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -1.982 6.133 2.601 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -3.955 4.395 4.915 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -5.504 5.262 4.778 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -5.030 4.083 3.532 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -1.434 3.719 2.744 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -1.960 4.334 4.329 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -3.079 3.375 3.331 1.00 0.00 H new ATOM 1972 N GLN A 125 -6.992 5.393 2.950 1.00 0.00 N ATOM 1973 CA GLN A 125 -8.063 4.434 2.727 1.00 0.00 C ATOM 1974 C GLN A 125 -8.676 4.584 1.342 1.00 0.00 C ATOM 1975 O GLN A 125 -9.134 3.607 0.748 1.00 0.00 O ATOM 1976 CB GLN A 125 -9.126 4.633 3.784 1.00 0.00 C ATOM 1977 CG GLN A 125 -8.489 4.415 5.145 1.00 0.00 C ATOM 1978 CD GLN A 125 -7.777 3.065 5.199 1.00 0.00 C ATOM 1979 OE1 GLN A 125 -8.411 2.020 5.048 1.00 0.00 O ATOM 1980 NE2 GLN A 125 -6.489 3.023 5.410 1.00 0.00 N ATOM 0 H GLN A 125 -7.056 5.895 3.835 1.00 0.00 H new ATOM 0 HA GLN A 125 -7.646 3.429 2.792 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -9.545 5.637 3.717 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -9.948 3.933 3.633 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -7.778 5.215 5.351 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -9.253 4.460 5.921 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -5.964 3.889 5.535 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -6.008 2.125 5.450 1.00 0.00 H new ATOM 1989 N HIS A 126 -8.686 5.808 0.830 1.00 0.00 N ATOM 1990 CA HIS A 126 -9.253 6.057 -0.487 1.00 0.00 C ATOM 1991 C HIS A 126 -8.537 5.222 -1.545 1.00 0.00 C ATOM 1992 O HIS A 126 -9.014 5.092 -2.673 1.00 0.00 O ATOM 1993 CB HIS A 126 -9.138 7.537 -0.836 1.00 0.00 C ATOM 1994 CG HIS A 126 -9.189 7.709 -2.330 1.00 0.00 C ATOM 1995 ND1 HIS A 126 -8.125 8.227 -3.052 1.00 0.00 N ATOM 1996 CD2 HIS A 126 -10.169 7.434 -3.251 1.00 0.00 C ATOM 1997 CE1 HIS A 126 -8.486 8.248 -4.348 1.00 0.00 C ATOM 1998 NE2 HIS A 126 -9.723 7.775 -4.524 1.00 0.00 N ATOM 0 H HIS A 126 -8.313 6.633 1.300 1.00 0.00 H new ATOM 0 HA HIS A 126 -10.305 5.773 -0.468 1.00 0.00 H new ATOM 0 HB2 HIS A 126 -9.949 8.095 -0.368 1.00 0.00 H new ATOM 0 HB3 HIS A 126 -8.205 7.942 -0.445 1.00 0.00 H new ATOM 0 HD1 HIS A 126 -7.231 8.536 -2.670 1.00 0.00 H new ATOM 0 HD2 HIS A 126 -11.138 7.017 -3.022 1.00 0.00 H new ATOM 0 HE1 HIS A 126 -7.853 8.604 -5.148 1.00 0.00 H new ATOM 2007 N ASP A 127 -7.390 4.655 -1.176 1.00 0.00 N ATOM 2008 CA ASP A 127 -6.627 3.835 -2.111 1.00 0.00 C ATOM 2009 C ASP A 127 -6.457 2.416 -1.577 1.00 0.00 C ATOM 2010 O ASP A 127 -6.228 1.478 -2.341 1.00 0.00 O ATOM 2011 CB ASP A 127 -5.253 4.459 -2.352 1.00 0.00 C ATOM 2012 CG ASP A 127 -5.405 5.803 -3.056 1.00 0.00 C ATOM 2013 OD1 ASP A 127 -5.795 6.754 -2.398 1.00 0.00 O ATOM 2014 OD2 ASP A 127 -5.128 5.863 -4.243 1.00 0.00 O ATOM 0 H ASP A 127 -6.974 4.747 -0.249 1.00 0.00 H new ATOM 0 HA ASP A 127 -7.177 3.790 -3.051 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -4.734 4.593 -1.403 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -4.642 3.790 -2.957 1.00 0.00 H new ATOM 2019 N LEU A 128 -6.569 2.267 -0.263 1.00 0.00 N ATOM 2020 CA LEU A 128 -6.423 0.961 0.367 1.00 0.00 C ATOM 2021 C LEU A 128 -7.060 -0.131 -0.490 1.00 0.00 C ATOM 2022 O LEU A 128 -8.281 -0.288 -0.501 1.00 0.00 O ATOM 2023 CB LEU A 128 -7.084 0.979 1.747 1.00 0.00 C ATOM 2024 CG LEU A 128 -7.142 -0.442 2.310 1.00 0.00 C ATOM 2025 CD1 LEU A 128 -5.729 -1.020 2.388 1.00 0.00 C ATOM 2026 CD2 LEU A 128 -7.759 -0.409 3.710 1.00 0.00 C ATOM 0 H LEU A 128 -6.760 3.031 0.385 1.00 0.00 H new ATOM 0 HA LEU A 128 -5.360 0.745 0.470 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -6.522 1.625 2.422 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -8.090 1.393 1.674 1.00 0.00 H new ATOM 0 HG LEU A 128 -7.752 -1.067 1.658 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -5.772 -2.033 2.789 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -5.290 -1.043 1.391 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -5.116 -0.397 3.040 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -7.801 -1.421 4.113 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -7.149 0.216 4.362 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -8.767 0.001 3.654 1.00 0.00 H new ATOM 2038 N THR A 129 -6.228 -0.890 -1.202 1.00 0.00 N ATOM 2039 CA THR A 129 -6.730 -1.966 -2.046 1.00 0.00 C ATOM 2040 C THR A 129 -6.533 -3.314 -1.360 1.00 0.00 C ATOM 2041 O THR A 129 -7.480 -4.088 -1.213 1.00 0.00 O ATOM 2042 CB THR A 129 -6.006 -1.964 -3.395 1.00 0.00 C ATOM 2043 OG1 THR A 129 -6.551 -0.944 -4.221 1.00 0.00 O ATOM 2044 CG2 THR A 129 -6.187 -3.324 -4.073 1.00 0.00 C ATOM 0 H THR A 129 -5.214 -0.779 -1.210 1.00 0.00 H new ATOM 0 HA THR A 129 -7.795 -1.804 -2.213 1.00 0.00 H new ATOM 0 HB THR A 129 -4.944 -1.776 -3.239 1.00 0.00 H new ATOM 0 HG1 THR A 129 -6.534 -0.090 -3.741 1.00 0.00 H new ATOM 0 HG21 THR A 129 -5.672 -3.323 -5.034 1.00 0.00 H new ATOM 0 HG22 THR A 129 -5.770 -4.106 -3.438 1.00 0.00 H new ATOM 0 HG23 THR A 129 -7.249 -3.513 -4.231 1.00 0.00 H new ATOM 2052 N TYR A 130 -5.302 -3.591 -0.935 1.00 0.00 N ATOM 2053 CA TYR A 130 -5.007 -4.848 -0.261 1.00 0.00 C ATOM 2054 C TYR A 130 -4.184 -4.594 0.995 1.00 0.00 C ATOM 2055 O TYR A 130 -3.067 -4.082 0.924 1.00 0.00 O ATOM 2056 CB TYR A 130 -4.238 -5.780 -1.197 1.00 0.00 C ATOM 2057 CG TYR A 130 -4.487 -7.214 -0.791 1.00 0.00 C ATOM 2058 CD1 TYR A 130 -3.726 -7.797 0.231 1.00 0.00 C ATOM 2059 CD2 TYR A 130 -5.479 -7.962 -1.438 1.00 0.00 C ATOM 2060 CE1 TYR A 130 -3.959 -9.126 0.606 1.00 0.00 C ATOM 2061 CE2 TYR A 130 -5.711 -9.291 -1.062 1.00 0.00 C ATOM 2062 CZ TYR A 130 -4.952 -9.872 -0.040 1.00 0.00 C ATOM 2063 OH TYR A 130 -5.179 -11.182 0.331 1.00 0.00 O ATOM 0 H TYR A 130 -4.502 -2.968 -1.045 1.00 0.00 H new ATOM 0 HA TYR A 130 -5.949 -5.319 0.020 1.00 0.00 H new ATOM 0 HB2 TYR A 130 -4.555 -5.622 -2.228 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -3.172 -5.558 -1.154 1.00 0.00 H new ATOM 0 HD1 TYR A 130 -2.960 -7.222 0.729 1.00 0.00 H new ATOM 0 HD2 TYR A 130 -6.065 -7.514 -2.227 1.00 0.00 H new ATOM 0 HE1 TYR A 130 -3.373 -9.575 1.394 1.00 0.00 H new ATOM 0 HE2 TYR A 130 -6.476 -9.868 -1.561 1.00 0.00 H new ATOM 0 HH TYR A 130 -4.341 -11.584 0.641 1.00 0.00 H new ATOM 2073 N ASN A 131 -4.745 -4.951 2.145 1.00 0.00 N ATOM 2074 CA ASN A 131 -4.053 -4.752 3.411 1.00 0.00 C ATOM 2075 C ASN A 131 -3.301 -6.014 3.816 1.00 0.00 C ATOM 2076 O ASN A 131 -3.901 -7.076 3.976 1.00 0.00 O ATOM 2077 CB ASN A 131 -5.058 -4.380 4.503 1.00 0.00 C ATOM 2078 CG ASN A 131 -5.621 -5.642 5.148 1.00 0.00 C ATOM 2079 OD1 ASN A 131 -6.286 -6.437 4.484 1.00 0.00 O ATOM 2080 ND2 ASN A 131 -5.394 -5.874 6.412 1.00 0.00 N ATOM 0 H ASN A 131 -5.669 -5.376 2.226 1.00 0.00 H new ATOM 0 HA ASN A 131 -3.335 -3.941 3.287 1.00 0.00 H new ATOM 0 HB2 ASN A 131 -4.574 -3.761 5.258 1.00 0.00 H new ATOM 0 HB3 ASN A 131 -5.868 -3.788 4.077 1.00 0.00 H new ATOM 0 HD21 ASN A 131 -5.768 -6.715 6.851 1.00 0.00 H new ATOM 0 HD22 ASN A 131 -4.843 -5.214 6.961 1.00 0.00 H new ATOM 2087 N LEU A 132 -1.983 -5.901 3.979 1.00 0.00 N ATOM 2088 CA LEU A 132 -1.186 -7.061 4.363 1.00 0.00 C ATOM 2089 C LEU A 132 -1.132 -7.200 5.880 1.00 0.00 C ATOM 2090 O LEU A 132 -0.542 -6.375 6.575 1.00 0.00 O ATOM 2091 CB LEU A 132 0.238 -6.924 3.819 1.00 0.00 C ATOM 2092 CG LEU A 132 0.721 -8.270 3.268 1.00 0.00 C ATOM 2093 CD1 LEU A 132 0.717 -9.317 4.386 1.00 0.00 C ATOM 2094 CD2 LEU A 132 -0.209 -8.725 2.141 1.00 0.00 C ATOM 0 H LEU A 132 -1.455 -5.037 3.854 1.00 0.00 H new ATOM 0 HA LEU A 132 -1.656 -7.950 3.941 1.00 0.00 H new ATOM 0 HB2 LEU A 132 0.265 -6.169 3.033 1.00 0.00 H new ATOM 0 HB3 LEU A 132 0.907 -6.584 4.610 1.00 0.00 H new ATOM 0 HG LEU A 132 1.734 -8.158 2.882 1.00 0.00 H new ATOM 0 HD11 LEU A 132 1.061 -10.273 3.991 1.00 0.00 H new ATOM 0 HD12 LEU A 132 1.382 -8.996 5.188 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -0.295 -9.429 4.776 1.00 0.00 H new ATOM 0 HD21 LEU A 132 0.135 -9.682 1.750 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -1.222 -8.834 2.527 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -0.203 -7.983 1.342 1.00 0.00 H new ATOM 2106 N ARG A 133 -1.740 -8.269 6.370 1.00 0.00 N ATOM 2107 CA ARG A 133 -1.763 -8.560 7.797 1.00 0.00 C ATOM 2108 C ARG A 133 -0.820 -9.715 8.117 1.00 0.00 C ATOM 2109 O ARG A 133 -0.564 -10.568 7.268 1.00 0.00 O ATOM 2110 CB ARG A 133 -3.183 -8.911 8.237 1.00 0.00 C ATOM 2111 CG ARG A 133 -3.423 -10.406 8.054 1.00 0.00 C ATOM 2112 CD ARG A 133 -4.899 -10.706 8.291 1.00 0.00 C ATOM 2113 NE ARG A 133 -5.727 -9.893 7.407 1.00 0.00 N ATOM 2114 CZ ARG A 133 -5.936 -10.250 6.144 1.00 0.00 C ATOM 2115 NH1 ARG A 133 -5.406 -11.347 5.680 1.00 0.00 N ATOM 2116 NH2 ARG A 133 -6.675 -9.503 5.370 1.00 0.00 N ATOM 0 H ARG A 133 -2.229 -8.956 5.795 1.00 0.00 H new ATOM 0 HA ARG A 133 -1.431 -7.675 8.339 1.00 0.00 H new ATOM 0 HB2 ARG A 133 -3.329 -8.635 9.281 1.00 0.00 H new ATOM 0 HB3 ARG A 133 -3.906 -8.342 7.652 1.00 0.00 H new ATOM 0 HG2 ARG A 133 -3.133 -10.713 7.049 1.00 0.00 H new ATOM 0 HG3 ARG A 133 -2.807 -10.974 8.751 1.00 0.00 H new ATOM 0 HD2 ARG A 133 -5.095 -11.764 8.114 1.00 0.00 H new ATOM 0 HD3 ARG A 133 -5.156 -10.503 9.331 1.00 0.00 H new ATOM 0 HE ARG A 133 -6.152 -9.037 7.764 1.00 0.00 H new ATOM 0 HH11 ARG A 133 -4.831 -11.932 6.286 1.00 0.00 H new ATOM 0 HH12 ARG A 133 -5.567 -11.621 4.711 1.00 0.00 H new ATOM 0 HH21 ARG A 133 -7.091 -8.646 5.735 1.00 0.00 H new ATOM 0 HH22 ARG A 133 -6.836 -9.776 4.400 1.00 0.00 H new ATOM 2130 N GLU A 134 -0.314 -9.748 9.343 1.00 0.00 N ATOM 2131 CA GLU A 134 0.589 -10.820 9.747 1.00 0.00 C ATOM 2132 C GLU A 134 0.114 -12.154 9.180 1.00 0.00 C ATOM 2133 O GLU A 134 -0.914 -12.688 9.598 1.00 0.00 O ATOM 2134 CB GLU A 134 0.647 -10.904 11.274 1.00 0.00 C ATOM 2135 CG GLU A 134 1.765 -11.861 11.691 1.00 0.00 C ATOM 2136 CD GLU A 134 1.181 -13.224 12.045 1.00 0.00 C ATOM 2137 OE1 GLU A 134 0.289 -13.265 12.877 1.00 0.00 O ATOM 2138 OE2 GLU A 134 1.633 -14.206 11.480 1.00 0.00 O ATOM 0 H GLU A 134 -0.509 -9.056 10.066 1.00 0.00 H new ATOM 0 HA GLU A 134 1.584 -10.603 9.358 1.00 0.00 H new ATOM 0 HB2 GLU A 134 0.824 -9.915 11.697 1.00 0.00 H new ATOM 0 HB3 GLU A 134 -0.309 -11.252 11.666 1.00 0.00 H new ATOM 0 HG2 GLU A 134 2.487 -11.965 10.881 1.00 0.00 H new ATOM 0 HG3 GLU A 134 2.303 -11.454 12.547 1.00 0.00 H new ATOM 2145 N GLY A 135 0.868 -12.686 8.223 1.00 0.00 N ATOM 2146 CA GLY A 135 0.514 -13.958 7.604 1.00 0.00 C ATOM 2147 C GLY A 135 -0.799 -13.845 6.838 1.00 0.00 C ATOM 2148 O GLY A 135 -1.551 -12.885 7.012 1.00 0.00 O ATOM 0 H GLY A 135 1.721 -12.260 7.862 1.00 0.00 H new ATOM 0 HA2 GLY A 135 1.309 -14.271 6.927 1.00 0.00 H new ATOM 0 HA3 GLY A 135 0.427 -14.728 8.371 1.00 0.00 H new TER 2152 GLY A 135