USER MOD reduce.3.24.130724 H: found=0, std=0, add=915, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 916 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 135 THR OG1 : rot 170:sc= 0.912 USER MOD Set 1.2: A 136 ASN :FLIP amide:sc= -0.194 F(o=0.11,f=0.72) USER MOD Set 2.1: A 91 THR OG1 : rot -88:sc= 1.36 USER MOD Set 2.2: A 112 TYR OH : rot 166:sc= 0.126 USER MOD Set 3.1: A 29 ASN :FLIP amide:sc= 0 F(o=-0.24,f=0.85) USER MOD Set 3.2: A 30 THR OG1 : rot 11:sc= 0.855 USER MOD Single : A 22 ASN :FLIP amide:sc= 0 F(o=-1,f=0) USER MOD Single : A 34 THR OG1 : rot -62:sc= 1.01 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot -43:sc= 0.305 USER MOD Single : A 40 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 TYR OH : rot 82:sc= 0.295 USER MOD Single : A 46 THR OG1 : rot 74:sc= 1.09 USER MOD Single : A 47 GLN :FLIP amide:sc= 0 F(o=-0.96,f=0) USER MOD Single : A 50 TYR OH : rot -56:sc= 0.114 USER MOD Single : A 51 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0616) USER MOD Single : A 56 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot -131:sc= 1.34 USER MOD Single : A 61 ASN : amide:sc= 0.901 K(o=0.9,f=0) USER MOD Single : A 64 MET CE :methyl -121:sc= -0.614 (180deg=-1.45) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -1.32 K(o=-1.3,f=-9.1!) USER MOD Single : A 79 LYS NZ :NH3+ 154:sc= 1.17 (180deg=0.615) USER MOD Single : A 81 GLN : amide:sc= -0.58 X(o=-0.58,f=-0.58) USER MOD Single : A 82 LYS NZ :NH3+ 164:sc= 2.08 (180deg=1.34) USER MOD Single : A 87 HIS : no HD1:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 95 THR OG1 : rot 180:sc= 0.331 USER MOD Single : A 97 THR OG1 : rot 84:sc= -2.51! USER MOD Single : A 99 THR OG1 : rot -33:sc= 0.162 USER MOD Single : A 102 ASN : amide:sc= -0.0846 X(o=-0.085,f=-0.15) USER MOD Single : A 106 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 146:sc= -0.403 (180deg=-1.83!) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= 0.715 K(o=0.71,f=-5.8!) USER MOD Single : A 118 TYR OH : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 125 ASN : amide:sc= -0.0652 K(o=-0.065,f=-3.1!) USER MOD Single : A 126 TYR OH : rot 39:sc= 0.499 USER MOD Single : A 131 THR OG1 : rot -78:sc= 1.12 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 20 30.655 -1.539 2.343 1.00 0.00 N ATOM 2 CA ASP A 20 29.941 -2.547 1.611 1.00 0.00 C ATOM 3 C ASP A 20 28.986 -3.231 2.541 1.00 0.00 C ATOM 4 O ASP A 20 29.349 -3.580 3.672 1.00 0.00 O ATOM 5 CB ASP A 20 30.930 -3.572 1.050 1.00 0.00 C ATOM 6 CG ASP A 20 32.043 -2.933 0.260 1.00 0.00 C ATOM 7 OD1 ASP A 20 33.070 -2.539 0.870 1.00 0.00 O ATOM 8 OD2 ASP A 20 31.932 -2.795 -0.968 1.00 0.00 O ATOM 0 HA ASP A 20 29.395 -2.089 0.786 1.00 0.00 H new ATOM 0 HB2 ASP A 20 31.357 -4.147 1.872 1.00 0.00 H new ATOM 0 HB3 ASP A 20 30.395 -4.276 0.413 1.00 0.00 H new ATOM 13 N CYS A 21 27.792 -3.410 2.096 1.00 0.00 N ATOM 14 CA CYS A 21 26.762 -4.015 2.885 1.00 0.00 C ATOM 15 C CYS A 21 27.038 -5.453 3.103 1.00 0.00 C ATOM 16 O CYS A 21 27.281 -6.195 2.165 1.00 0.00 O ATOM 17 CB CYS A 21 25.416 -3.840 2.241 1.00 0.00 C ATOM 18 SG CYS A 21 24.947 -2.122 2.047 1.00 0.00 S ATOM 0 H CYS A 21 27.493 -3.138 1.160 1.00 0.00 H new ATOM 0 HA CYS A 21 26.750 -3.513 3.852 1.00 0.00 H new ATOM 0 HB2 CYS A 21 25.423 -4.321 1.263 1.00 0.00 H new ATOM 0 HB3 CYS A 21 24.663 -4.350 2.842 1.00 0.00 H new ATOM 23 N ASN A 22 27.015 -5.845 4.337 1.00 0.00 N ATOM 24 CA ASN A 22 27.256 -7.221 4.715 1.00 0.00 C ATOM 25 C ASN A 22 25.938 -7.902 4.974 1.00 0.00 C ATOM 26 O ASN A 22 25.841 -8.816 5.795 1.00 0.00 O ATOM 27 CB ASN A 22 28.135 -7.296 5.966 1.00 0.00 C ATOM 28 CG ASN A 22 29.617 -7.020 5.752 1.00 0.00 C ATOM 29 OD1 ASN A 22 29.964 -6.185 4.816 1.00 0.00 O flip ATOM 30 ND2 ASN A 22 30.454 -7.558 6.462 1.00 0.00 N flip ATOM 0 H ASN A 22 26.828 -5.223 5.124 1.00 0.00 H new ATOM 0 HA ASN A 22 27.779 -7.724 3.901 1.00 0.00 H new ATOM 0 HB2 ASN A 22 27.754 -6.584 6.698 1.00 0.00 H new ATOM 0 HB3 ASN A 22 28.029 -8.289 6.403 1.00 0.00 H new ATOM 0 HD21 ASN A 22 30.162 -8.210 7.190 1.00 0.00 H new ATOM 0 HD22 ASN A 22 31.444 -7.355 6.326 1.00 0.00 H new ATOM 37 N GLU A 23 24.935 -7.471 4.252 1.00 0.00 N ATOM 38 CA GLU A 23 23.612 -8.009 4.352 1.00 0.00 C ATOM 39 C GLU A 23 22.819 -7.624 3.116 1.00 0.00 C ATOM 40 O GLU A 23 23.200 -6.683 2.390 1.00 0.00 O ATOM 41 CB GLU A 23 22.911 -7.481 5.618 1.00 0.00 C ATOM 42 CG GLU A 23 22.805 -5.962 5.692 1.00 0.00 C ATOM 43 CD GLU A 23 22.169 -5.494 6.968 1.00 0.00 C ATOM 44 OE1 GLU A 23 20.930 -5.354 7.019 1.00 0.00 O ATOM 45 OE2 GLU A 23 22.895 -5.258 7.959 1.00 0.00 O ATOM 0 H GLU A 23 25.022 -6.721 3.566 1.00 0.00 H new ATOM 0 HA GLU A 23 23.672 -9.095 4.421 1.00 0.00 H new ATOM 0 HB2 GLU A 23 21.908 -7.906 5.667 1.00 0.00 H new ATOM 0 HB3 GLU A 23 23.452 -7.838 6.494 1.00 0.00 H new ATOM 0 HG2 GLU A 23 23.800 -5.526 5.604 1.00 0.00 H new ATOM 0 HG3 GLU A 23 22.223 -5.600 4.845 1.00 0.00 H new ATOM 52 N LEU A 24 21.775 -8.372 2.852 1.00 0.00 N ATOM 53 CA LEU A 24 20.819 -8.062 1.813 1.00 0.00 C ATOM 54 C LEU A 24 19.893 -6.965 2.304 1.00 0.00 C ATOM 55 O LEU A 24 19.745 -6.783 3.521 1.00 0.00 O ATOM 56 CB LEU A 24 20.016 -9.314 1.409 1.00 0.00 C ATOM 57 CG LEU A 24 20.703 -10.320 0.473 1.00 0.00 C ATOM 58 CD1 LEU A 24 19.734 -11.412 0.100 1.00 0.00 C ATOM 59 CD2 LEU A 24 21.184 -9.610 -0.768 1.00 0.00 C ATOM 0 H LEU A 24 21.561 -9.229 3.362 1.00 0.00 H new ATOM 0 HA LEU A 24 21.353 -7.717 0.927 1.00 0.00 H new ATOM 0 HB2 LEU A 24 19.732 -9.841 2.320 1.00 0.00 H new ATOM 0 HB3 LEU A 24 19.094 -8.984 0.931 1.00 0.00 H new ATOM 0 HG LEU A 24 21.558 -10.764 0.984 1.00 0.00 H new ATOM 0 HD11 LEU A 24 20.225 -12.123 -0.564 1.00 0.00 H new ATOM 0 HD12 LEU A 24 19.402 -11.927 1.001 1.00 0.00 H new ATOM 0 HD13 LEU A 24 18.873 -10.977 -0.408 1.00 0.00 H new ATOM 0 HD21 LEU A 24 21.671 -10.325 -1.431 1.00 0.00 H new ATOM 0 HD22 LEU A 24 20.335 -9.159 -1.282 1.00 0.00 H new ATOM 0 HD23 LEU A 24 21.894 -8.831 -0.490 1.00 0.00 H new ATOM 71 N PRO A 25 19.284 -6.194 1.382 1.00 0.00 N ATOM 72 CA PRO A 25 18.397 -5.090 1.732 1.00 0.00 C ATOM 73 C PRO A 25 17.281 -5.509 2.689 1.00 0.00 C ATOM 74 O PRO A 25 16.651 -6.574 2.524 1.00 0.00 O ATOM 75 CB PRO A 25 17.819 -4.625 0.389 1.00 0.00 C ATOM 76 CG PRO A 25 18.166 -5.697 -0.578 1.00 0.00 C ATOM 77 CD PRO A 25 19.418 -6.320 -0.072 1.00 0.00 C ATOM 0 HA PRO A 25 18.936 -4.304 2.261 1.00 0.00 H new ATOM 0 HB2 PRO A 25 16.740 -4.486 0.452 1.00 0.00 H new ATOM 0 HB3 PRO A 25 18.246 -3.669 0.087 1.00 0.00 H new ATOM 0 HG2 PRO A 25 17.365 -6.433 -0.648 1.00 0.00 H new ATOM 0 HG3 PRO A 25 18.311 -5.288 -1.578 1.00 0.00 H new ATOM 0 HD2 PRO A 25 19.504 -7.362 -0.381 1.00 0.00 H new ATOM 0 HD3 PRO A 25 20.304 -5.804 -0.442 1.00 0.00 H new ATOM 85 N PRO A 26 17.072 -4.726 3.743 1.00 0.00 N ATOM 86 CA PRO A 26 16.042 -4.989 4.705 1.00 0.00 C ATOM 87 C PRO A 26 14.658 -4.699 4.151 1.00 0.00 C ATOM 88 O PRO A 26 14.299 -3.538 3.898 1.00 0.00 O ATOM 89 CB PRO A 26 16.369 -4.059 5.868 1.00 0.00 C ATOM 90 CG PRO A 26 17.151 -2.948 5.269 1.00 0.00 C ATOM 91 CD PRO A 26 17.859 -3.525 4.083 1.00 0.00 C ATOM 0 HA PRO A 26 16.019 -6.039 4.996 1.00 0.00 H new ATOM 0 HB2 PRO A 26 15.461 -3.689 6.344 1.00 0.00 H new ATOM 0 HB3 PRO A 26 16.944 -4.576 6.636 1.00 0.00 H new ATOM 0 HG2 PRO A 26 16.497 -2.129 4.971 1.00 0.00 H new ATOM 0 HG3 PRO A 26 17.863 -2.542 5.987 1.00 0.00 H new ATOM 0 HD2 PRO A 26 17.887 -2.819 3.253 1.00 0.00 H new ATOM 0 HD3 PRO A 26 18.892 -3.779 4.320 1.00 0.00 H new ATOM 99 N ARG A 27 13.904 -5.764 3.954 1.00 0.00 N ATOM 100 CA ARG A 27 12.531 -5.705 3.474 1.00 0.00 C ATOM 101 C ARG A 27 11.709 -4.872 4.430 1.00 0.00 C ATOM 102 O ARG A 27 11.965 -4.884 5.645 1.00 0.00 O ATOM 103 CB ARG A 27 11.988 -7.119 3.348 1.00 0.00 C ATOM 104 CG ARG A 27 12.587 -7.875 2.178 1.00 0.00 C ATOM 105 CD ARG A 27 12.615 -9.365 2.417 1.00 0.00 C ATOM 106 NE ARG A 27 13.656 -9.727 3.404 1.00 0.00 N ATOM 107 CZ ARG A 27 14.494 -10.779 3.312 1.00 0.00 C ATOM 108 NH1 ARG A 27 14.361 -11.664 2.333 1.00 0.00 N ATOM 109 NH2 ARG A 27 15.466 -10.940 4.211 1.00 0.00 N ATOM 0 H ARG A 27 14.233 -6.714 4.126 1.00 0.00 H new ATOM 0 HA ARG A 27 12.484 -5.236 2.491 1.00 0.00 H new ATOM 0 HB2 ARG A 27 12.190 -7.665 4.270 1.00 0.00 H new ATOM 0 HB3 ARG A 27 10.905 -7.079 3.233 1.00 0.00 H new ATOM 0 HG2 ARG A 27 12.010 -7.664 1.277 1.00 0.00 H new ATOM 0 HG3 ARG A 27 13.601 -7.518 1.998 1.00 0.00 H new ATOM 0 HD2 ARG A 27 11.640 -9.698 2.774 1.00 0.00 H new ATOM 0 HD3 ARG A 27 12.805 -9.884 1.477 1.00 0.00 H new ATOM 0 HE ARG A 27 13.748 -9.129 4.225 1.00 0.00 H new ATOM 0 HH11 ARG A 27 13.620 -11.552 1.641 1.00 0.00 H new ATOM 0 HH12 ARG A 27 15.000 -12.457 2.272 1.00 0.00 H new ATOM 0 HH21 ARG A 27 15.576 -10.267 4.969 1.00 0.00 H new ATOM 0 HH22 ARG A 27 16.099 -11.736 4.140 1.00 0.00 H new ATOM 123 N ARG A 28 10.728 -4.170 3.935 1.00 0.00 N ATOM 124 CA ARG A 28 10.061 -3.196 4.798 1.00 0.00 C ATOM 125 C ARG A 28 8.574 -3.468 4.894 1.00 0.00 C ATOM 126 O ARG A 28 8.036 -4.277 4.132 1.00 0.00 O ATOM 127 CB ARG A 28 10.313 -1.750 4.339 1.00 0.00 C ATOM 128 CG ARG A 28 11.762 -1.425 3.993 1.00 0.00 C ATOM 129 CD ARG A 28 11.950 0.050 3.662 1.00 0.00 C ATOM 130 NE ARG A 28 11.953 0.910 4.865 1.00 0.00 N ATOM 131 CZ ARG A 28 11.559 2.199 4.895 1.00 0.00 C ATOM 132 NH1 ARG A 28 10.733 2.668 3.979 1.00 0.00 N ATOM 133 NH2 ARG A 28 11.897 2.979 5.917 1.00 0.00 N ATOM 0 H ARG A 28 10.373 -4.237 2.981 1.00 0.00 H new ATOM 0 HA ARG A 28 10.496 -3.310 5.791 1.00 0.00 H new ATOM 0 HB2 ARG A 28 9.693 -1.549 3.465 1.00 0.00 H new ATOM 0 HB3 ARG A 28 9.983 -1.072 5.126 1.00 0.00 H new ATOM 0 HG2 ARG A 28 12.404 -1.694 4.832 1.00 0.00 H new ATOM 0 HG3 ARG A 28 12.077 -2.031 3.143 1.00 0.00 H new ATOM 0 HD2 ARG A 28 12.890 0.181 3.125 1.00 0.00 H new ATOM 0 HD3 ARG A 28 11.153 0.372 2.992 1.00 0.00 H new ATOM 0 HE ARG A 28 12.278 0.496 5.739 1.00 0.00 H new ATOM 0 HH11 ARG A 28 10.388 2.054 3.241 1.00 0.00 H new ATOM 0 HH12 ARG A 28 10.440 3.644 4.009 1.00 0.00 H new ATOM 0 HH21 ARG A 28 12.457 2.603 6.682 1.00 0.00 H new ATOM 0 HH22 ARG A 28 11.597 3.954 5.936 1.00 0.00 H new ATOM 147 N ASN A 29 7.931 -2.784 5.820 1.00 0.00 N ATOM 148 CA ASN A 29 6.498 -2.946 6.144 1.00 0.00 C ATOM 149 C ASN A 29 5.559 -2.903 4.934 1.00 0.00 C ATOM 150 O ASN A 29 4.570 -3.623 4.894 1.00 0.00 O ATOM 151 CB ASN A 29 6.032 -1.931 7.225 1.00 0.00 C ATOM 152 CG ASN A 29 5.988 -0.434 6.804 1.00 0.00 C ATOM 153 OD1 ASN A 29 6.882 0.021 5.944 1.00 0.00 O flip ATOM 154 ND2 ASN A 29 5.153 0.317 7.305 1.00 0.00 N flip ATOM 0 H ASN A 29 8.390 -2.076 6.393 1.00 0.00 H new ATOM 0 HA ASN A 29 6.425 -3.957 6.545 1.00 0.00 H new ATOM 0 HB2 ASN A 29 5.035 -2.221 7.557 1.00 0.00 H new ATOM 0 HB3 ASN A 29 6.694 -2.023 8.086 1.00 0.00 H new ATOM 0 HD21 ASN A 29 4.469 -0.050 7.967 1.00 0.00 H new ATOM 0 HD22 ASN A 29 5.144 1.307 7.058 1.00 0.00 H new ATOM 161 N THR A 30 5.863 -2.092 3.963 1.00 0.00 N ATOM 162 CA THR A 30 5.025 -1.970 2.806 1.00 0.00 C ATOM 163 C THR A 30 5.847 -2.156 1.552 1.00 0.00 C ATOM 164 O THR A 30 5.399 -1.873 0.470 1.00 0.00 O ATOM 165 CB THR A 30 4.341 -0.569 2.785 1.00 0.00 C ATOM 166 OG1 THR A 30 5.319 0.469 3.048 1.00 0.00 O ATOM 167 CG2 THR A 30 3.218 -0.482 3.814 1.00 0.00 C ATOM 0 H THR A 30 6.693 -1.500 3.950 1.00 0.00 H new ATOM 0 HA THR A 30 4.255 -2.740 2.847 1.00 0.00 H new ATOM 0 HB THR A 30 3.911 -0.426 1.794 1.00 0.00 H new ATOM 0 HG1 THR A 30 6.220 0.086 3.012 1.00 0.00 H new ATOM 0 HG21 THR A 30 2.763 0.507 3.773 1.00 0.00 H new ATOM 0 HG22 THR A 30 2.464 -1.238 3.594 1.00 0.00 H new ATOM 0 HG23 THR A 30 3.624 -0.653 4.811 1.00 0.00 H new ATOM 175 N GLU A 31 7.051 -2.680 1.700 1.00 0.00 N ATOM 176 CA GLU A 31 7.948 -2.734 0.578 1.00 0.00 C ATOM 177 C GLU A 31 8.568 -4.090 0.374 1.00 0.00 C ATOM 178 O GLU A 31 8.869 -4.812 1.335 1.00 0.00 O ATOM 179 CB GLU A 31 9.059 -1.699 0.692 1.00 0.00 C ATOM 180 CG GLU A 31 8.597 -0.261 0.803 1.00 0.00 C ATOM 181 CD GLU A 31 8.504 0.243 2.231 1.00 0.00 C ATOM 182 OE1 GLU A 31 7.795 -0.361 3.077 1.00 0.00 O ATOM 183 OE2 GLU A 31 9.111 1.266 2.527 1.00 0.00 O ATOM 0 H GLU A 31 7.418 -3.065 2.571 1.00 0.00 H new ATOM 0 HA GLU A 31 7.325 -2.513 -0.289 1.00 0.00 H new ATOM 0 HB2 GLU A 31 9.666 -1.937 1.566 1.00 0.00 H new ATOM 0 HB3 GLU A 31 9.707 -1.789 -0.180 1.00 0.00 H new ATOM 0 HG2 GLU A 31 9.285 0.376 0.247 1.00 0.00 H new ATOM 0 HG3 GLU A 31 7.620 -0.165 0.329 1.00 0.00 H new ATOM 190 N ILE A 32 8.754 -4.427 -0.884 1.00 0.00 N ATOM 191 CA ILE A 32 9.397 -5.671 -1.295 1.00 0.00 C ATOM 192 C ILE A 32 10.383 -5.282 -2.348 1.00 0.00 C ATOM 193 O ILE A 32 10.240 -4.252 -2.971 1.00 0.00 O ATOM 194 CB ILE A 32 8.376 -6.677 -1.914 1.00 0.00 C ATOM 195 CG1 ILE A 32 7.049 -6.692 -1.145 1.00 0.00 C ATOM 196 CG2 ILE A 32 8.965 -8.072 -1.873 1.00 0.00 C ATOM 197 CD1 ILE A 32 5.950 -7.483 -1.837 1.00 0.00 C ATOM 0 H ILE A 32 8.461 -3.841 -1.666 1.00 0.00 H new ATOM 0 HA ILE A 32 9.853 -6.162 -0.435 1.00 0.00 H new ATOM 0 HB ILE A 32 8.179 -6.360 -2.938 1.00 0.00 H new ATOM 0 HG12 ILE A 32 7.218 -7.113 -0.154 1.00 0.00 H new ATOM 0 HG13 ILE A 32 6.711 -5.666 -1.002 1.00 0.00 H new ATOM 0 HG21 ILE A 32 8.256 -8.779 -2.304 1.00 0.00 H new ATOM 0 HG22 ILE A 32 9.892 -8.093 -2.446 1.00 0.00 H new ATOM 0 HG23 ILE A 32 9.171 -8.350 -0.839 1.00 0.00 H new ATOM 0 HD11 ILE A 32 5.042 -7.448 -1.234 1.00 0.00 H new ATOM 0 HD12 ILE A 32 5.752 -7.049 -2.817 1.00 0.00 H new ATOM 0 HD13 ILE A 32 6.267 -8.519 -1.956 1.00 0.00 H new ATOM 209 N LEU A 33 11.361 -6.072 -2.531 1.00 0.00 N ATOM 210 CA LEU A 33 12.391 -5.782 -3.464 1.00 0.00 C ATOM 211 C LEU A 33 11.974 -6.068 -4.880 1.00 0.00 C ATOM 212 O LEU A 33 11.215 -7.000 -5.147 1.00 0.00 O ATOM 213 CB LEU A 33 13.599 -6.604 -3.158 1.00 0.00 C ATOM 214 CG LEU A 33 14.508 -6.170 -2.033 1.00 0.00 C ATOM 215 CD1 LEU A 33 15.068 -4.780 -2.224 1.00 0.00 C ATOM 216 CD2 LEU A 33 13.917 -6.361 -0.683 1.00 0.00 C ATOM 0 H LEU A 33 11.480 -6.955 -2.034 1.00 0.00 H new ATOM 0 HA LEU A 33 12.609 -4.718 -3.374 1.00 0.00 H new ATOM 0 HB2 LEU A 33 13.262 -7.617 -2.938 1.00 0.00 H new ATOM 0 HB3 LEU A 33 14.200 -6.658 -4.066 1.00 0.00 H new ATOM 0 HG LEU A 33 15.358 -6.851 -2.083 1.00 0.00 H new ATOM 0 HD11 LEU A 33 15.713 -4.529 -1.382 1.00 0.00 H new ATOM 0 HD12 LEU A 33 15.647 -4.745 -3.147 1.00 0.00 H new ATOM 0 HD13 LEU A 33 14.249 -4.063 -2.281 1.00 0.00 H new ATOM 0 HD21 LEU A 33 14.626 -6.028 0.075 1.00 0.00 H new ATOM 0 HD22 LEU A 33 12.999 -5.779 -0.602 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.692 -7.417 -0.530 1.00 0.00 H new ATOM 228 N THR A 34 12.460 -5.272 -5.779 1.00 0.00 N ATOM 229 CA THR A 34 12.251 -5.518 -7.170 1.00 0.00 C ATOM 230 C THR A 34 13.564 -6.014 -7.768 1.00 0.00 C ATOM 231 O THR A 34 14.557 -5.281 -7.811 1.00 0.00 O ATOM 232 CB THR A 34 11.727 -4.264 -7.921 1.00 0.00 C ATOM 233 OG1 THR A 34 12.603 -3.148 -7.718 1.00 0.00 O ATOM 234 CG2 THR A 34 10.330 -3.897 -7.448 1.00 0.00 C ATOM 0 H THR A 34 13.010 -4.438 -5.571 1.00 0.00 H new ATOM 0 HA THR A 34 11.476 -6.276 -7.284 1.00 0.00 H new ATOM 0 HB THR A 34 11.693 -4.505 -8.983 1.00 0.00 H new ATOM 0 HG1 THR A 34 12.633 -2.925 -6.764 1.00 0.00 H new ATOM 0 HG21 THR A 34 9.983 -3.016 -7.988 1.00 0.00 H new ATOM 0 HG22 THR A 34 9.652 -4.729 -7.637 1.00 0.00 H new ATOM 0 HG23 THR A 34 10.352 -3.683 -6.379 1.00 0.00 H new ATOM 242 N GLY A 35 13.594 -7.270 -8.125 1.00 0.00 N ATOM 243 CA GLY A 35 14.782 -7.850 -8.662 1.00 0.00 C ATOM 244 C GLY A 35 14.961 -9.232 -8.118 1.00 0.00 C ATOM 245 O GLY A 35 13.984 -9.979 -7.990 1.00 0.00 O ATOM 0 H GLY A 35 12.802 -7.909 -8.051 1.00 0.00 H new ATOM 0 HA2 GLY A 35 14.722 -7.882 -9.750 1.00 0.00 H new ATOM 0 HA3 GLY A 35 15.645 -7.235 -8.408 1.00 0.00 H new ATOM 249 N SER A 36 16.166 -9.567 -7.777 1.00 0.00 N ATOM 250 CA SER A 36 16.477 -10.847 -7.210 1.00 0.00 C ATOM 251 C SER A 36 17.690 -10.672 -6.306 1.00 0.00 C ATOM 252 O SER A 36 18.671 -10.015 -6.691 1.00 0.00 O ATOM 253 CB SER A 36 16.750 -11.873 -8.327 1.00 0.00 C ATOM 254 OG SER A 36 16.928 -13.182 -7.810 1.00 0.00 O ATOM 0 H SER A 36 16.973 -8.953 -7.885 1.00 0.00 H new ATOM 0 HA SER A 36 15.638 -11.226 -6.626 1.00 0.00 H new ATOM 0 HB2 SER A 36 15.919 -11.871 -9.033 1.00 0.00 H new ATOM 0 HB3 SER A 36 17.640 -11.577 -8.882 1.00 0.00 H new ATOM 0 HG SER A 36 17.097 -13.805 -8.548 1.00 0.00 H new ATOM 260 N TRP A 37 17.618 -11.200 -5.108 1.00 0.00 N ATOM 261 CA TRP A 37 18.687 -11.053 -4.150 1.00 0.00 C ATOM 262 C TRP A 37 18.948 -12.389 -3.476 1.00 0.00 C ATOM 263 O TRP A 37 18.036 -12.972 -2.886 1.00 0.00 O ATOM 264 CB TRP A 37 18.298 -10.042 -3.064 1.00 0.00 C ATOM 265 CG TRP A 37 17.881 -8.686 -3.549 1.00 0.00 C ATOM 266 CD1 TRP A 37 16.621 -8.298 -3.847 1.00 0.00 C ATOM 267 CD2 TRP A 37 18.714 -7.535 -3.773 1.00 0.00 C ATOM 268 NE1 TRP A 37 16.610 -6.990 -4.228 1.00 0.00 N ATOM 269 CE2 TRP A 37 17.875 -6.497 -4.196 1.00 0.00 C ATOM 270 CE3 TRP A 37 20.072 -7.282 -3.653 1.00 0.00 C ATOM 271 CZ2 TRP A 37 18.354 -5.220 -4.501 1.00 0.00 C ATOM 272 CZ3 TRP A 37 20.547 -6.018 -3.957 1.00 0.00 C ATOM 273 CH2 TRP A 37 19.690 -5.004 -4.373 1.00 0.00 C ATOM 0 H TRP A 37 16.822 -11.741 -4.771 1.00 0.00 H new ATOM 0 HA TRP A 37 19.575 -10.705 -4.677 1.00 0.00 H new ATOM 0 HB2 TRP A 37 17.481 -10.464 -2.478 1.00 0.00 H new ATOM 0 HB3 TRP A 37 19.145 -9.920 -2.389 1.00 0.00 H new ATOM 0 HD1 TRP A 37 15.749 -8.933 -3.791 1.00 0.00 H new ATOM 0 HE1 TRP A 37 15.779 -6.462 -4.496 1.00 0.00 H new ATOM 0 HE3 TRP A 37 20.748 -8.059 -3.328 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 17.688 -4.434 -4.826 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 21.604 -5.815 -3.870 1.00 0.00 H new ATOM 0 HH2 TRP A 37 20.093 -4.028 -4.598 1.00 0.00 H new ATOM 284 N SER A 38 20.155 -12.883 -3.570 1.00 0.00 N ATOM 285 CA SER A 38 20.515 -14.125 -2.899 1.00 0.00 C ATOM 286 C SER A 38 21.957 -14.011 -2.403 1.00 0.00 C ATOM 287 O SER A 38 22.631 -15.017 -2.142 1.00 0.00 O ATOM 288 CB SER A 38 20.360 -15.306 -3.889 1.00 0.00 C ATOM 289 OG SER A 38 20.517 -16.577 -3.254 1.00 0.00 O ATOM 0 H SER A 38 20.911 -12.452 -4.102 1.00 0.00 H new ATOM 0 HA SER A 38 19.860 -14.306 -2.047 1.00 0.00 H new ATOM 0 HB2 SER A 38 19.377 -15.257 -4.357 1.00 0.00 H new ATOM 0 HB3 SER A 38 21.098 -15.208 -4.685 1.00 0.00 H new ATOM 0 HG SER A 38 21.272 -16.540 -2.630 1.00 0.00 H new ATOM 295 N ASP A 39 22.395 -12.785 -2.206 1.00 0.00 N ATOM 296 CA ASP A 39 23.788 -12.526 -1.878 1.00 0.00 C ATOM 297 C ASP A 39 23.952 -12.281 -0.373 1.00 0.00 C ATOM 298 O ASP A 39 23.000 -12.449 0.405 1.00 0.00 O ATOM 299 CB ASP A 39 24.292 -11.326 -2.699 1.00 0.00 C ATOM 300 CG ASP A 39 25.794 -11.292 -2.937 1.00 0.00 C ATOM 301 OD1 ASP A 39 26.571 -11.119 -1.992 1.00 0.00 O ATOM 302 OD2 ASP A 39 26.216 -11.402 -4.102 1.00 0.00 O ATOM 0 H ASP A 39 21.811 -11.951 -2.266 1.00 0.00 H new ATOM 0 HA ASP A 39 24.388 -13.399 -2.133 1.00 0.00 H new ATOM 0 HB2 ASP A 39 23.787 -11.329 -3.665 1.00 0.00 H new ATOM 0 HB3 ASP A 39 24.000 -10.408 -2.189 1.00 0.00 H new ATOM 307 N GLN A 40 25.134 -11.905 0.020 1.00 0.00 N ATOM 308 CA GLN A 40 25.464 -11.659 1.393 1.00 0.00 C ATOM 309 C GLN A 40 26.177 -10.315 1.531 1.00 0.00 C ATOM 310 O GLN A 40 26.126 -9.694 2.573 1.00 0.00 O ATOM 311 CB GLN A 40 26.358 -12.783 1.927 1.00 0.00 C ATOM 312 CG GLN A 40 27.704 -12.895 1.224 1.00 0.00 C ATOM 313 CD GLN A 40 28.544 -14.031 1.739 1.00 0.00 C ATOM 314 OE1 GLN A 40 29.309 -13.879 2.685 1.00 0.00 O ATOM 315 NE2 GLN A 40 28.432 -15.165 1.112 1.00 0.00 N ATOM 0 H GLN A 40 25.914 -11.757 -0.621 1.00 0.00 H new ATOM 0 HA GLN A 40 24.543 -11.630 1.976 1.00 0.00 H new ATOM 0 HB2 GLN A 40 26.529 -12.622 2.991 1.00 0.00 H new ATOM 0 HB3 GLN A 40 25.829 -13.731 1.829 1.00 0.00 H new ATOM 0 HG2 GLN A 40 27.539 -13.028 0.155 1.00 0.00 H new ATOM 0 HG3 GLN A 40 28.251 -11.961 1.348 1.00 0.00 H new ATOM 0 HE21 GLN A 40 27.784 -15.253 0.329 1.00 0.00 H new ATOM 0 HE22 GLN A 40 28.992 -15.966 1.403 1.00 0.00 H new ATOM 324 N THR A 41 26.825 -9.863 0.469 1.00 0.00 N ATOM 325 CA THR A 41 27.597 -8.642 0.515 1.00 0.00 C ATOM 326 C THR A 41 27.472 -7.848 -0.792 1.00 0.00 C ATOM 327 O THR A 41 27.627 -8.399 -1.883 1.00 0.00 O ATOM 328 CB THR A 41 29.095 -8.935 0.811 1.00 0.00 C ATOM 329 OG1 THR A 41 29.549 -10.070 0.048 1.00 0.00 O ATOM 330 CG2 THR A 41 29.356 -9.178 2.292 1.00 0.00 C ATOM 0 H THR A 41 26.828 -10.330 -0.438 1.00 0.00 H new ATOM 0 HA THR A 41 27.190 -8.038 1.326 1.00 0.00 H new ATOM 0 HB THR A 41 29.653 -8.047 0.516 1.00 0.00 H new ATOM 0 HG1 THR A 41 30.494 -10.240 0.245 1.00 0.00 H new ATOM 0 HG21 THR A 41 30.416 -9.378 2.447 1.00 0.00 H new ATOM 0 HG22 THR A 41 29.066 -8.295 2.862 1.00 0.00 H new ATOM 0 HG23 THR A 41 28.772 -10.035 2.629 1.00 0.00 H new ATOM 338 N TYR A 42 27.194 -6.572 -0.674 1.00 0.00 N ATOM 339 CA TYR A 42 27.058 -5.687 -1.826 1.00 0.00 C ATOM 340 C TYR A 42 27.935 -4.479 -1.680 1.00 0.00 C ATOM 341 O TYR A 42 28.094 -3.976 -0.579 1.00 0.00 O ATOM 342 CB TYR A 42 25.608 -5.245 -2.052 1.00 0.00 C ATOM 343 CG TYR A 42 24.789 -6.240 -2.815 1.00 0.00 C ATOM 344 CD1 TYR A 42 24.093 -7.234 -2.171 1.00 0.00 C ATOM 345 CD2 TYR A 42 24.721 -6.180 -4.202 1.00 0.00 C ATOM 346 CE1 TYR A 42 23.356 -8.141 -2.880 1.00 0.00 C ATOM 347 CE2 TYR A 42 23.980 -7.091 -4.915 1.00 0.00 C ATOM 348 CZ TYR A 42 23.299 -8.072 -4.245 1.00 0.00 C ATOM 349 OH TYR A 42 22.552 -8.997 -4.940 1.00 0.00 O ATOM 0 H TYR A 42 27.054 -6.108 0.223 1.00 0.00 H new ATOM 0 HA TYR A 42 27.374 -6.261 -2.697 1.00 0.00 H new ATOM 0 HB2 TYR A 42 25.137 -5.065 -1.086 1.00 0.00 H new ATOM 0 HB3 TYR A 42 25.606 -4.297 -2.590 1.00 0.00 H new ATOM 0 HD1 TYR A 42 24.128 -7.300 -1.094 1.00 0.00 H new ATOM 0 HD2 TYR A 42 25.259 -5.405 -4.727 1.00 0.00 H new ATOM 0 HE1 TYR A 42 22.815 -8.917 -2.359 1.00 0.00 H new ATOM 0 HE2 TYR A 42 23.935 -7.034 -5.993 1.00 0.00 H new ATOM 0 HH TYR A 42 21.610 -8.726 -4.936 1.00 0.00 H new ATOM 359 N PRO A 43 28.514 -3.996 -2.791 1.00 0.00 N ATOM 360 CA PRO A 43 29.382 -2.817 -2.782 1.00 0.00 C ATOM 361 C PRO A 43 28.630 -1.563 -2.333 1.00 0.00 C ATOM 362 O PRO A 43 27.409 -1.412 -2.594 1.00 0.00 O ATOM 363 CB PRO A 43 29.835 -2.678 -4.243 1.00 0.00 C ATOM 364 CG PRO A 43 28.843 -3.457 -5.036 1.00 0.00 C ATOM 365 CD PRO A 43 28.376 -4.567 -4.144 1.00 0.00 C ATOM 0 HA PRO A 43 30.212 -2.927 -2.084 1.00 0.00 H new ATOM 0 HB2 PRO A 43 29.852 -1.633 -4.552 1.00 0.00 H new ATOM 0 HB3 PRO A 43 30.843 -3.068 -4.381 1.00 0.00 H new ATOM 0 HG2 PRO A 43 28.008 -2.827 -5.343 1.00 0.00 H new ATOM 0 HG3 PRO A 43 29.295 -3.852 -5.946 1.00 0.00 H new ATOM 0 HD2 PRO A 43 27.345 -4.849 -4.358 1.00 0.00 H new ATOM 0 HD3 PRO A 43 28.983 -5.464 -4.266 1.00 0.00 H new ATOM 373 N GLU A 44 29.333 -0.679 -1.668 1.00 0.00 N ATOM 374 CA GLU A 44 28.753 0.525 -1.151 1.00 0.00 C ATOM 375 C GLU A 44 28.356 1.423 -2.322 1.00 0.00 C ATOM 376 O GLU A 44 29.160 1.683 -3.214 1.00 0.00 O ATOM 377 CB GLU A 44 29.741 1.264 -0.241 1.00 0.00 C ATOM 378 CG GLU A 44 29.056 2.288 0.633 1.00 0.00 C ATOM 379 CD GLU A 44 29.977 3.252 1.310 1.00 0.00 C ATOM 380 OE1 GLU A 44 30.566 4.096 0.618 1.00 0.00 O ATOM 381 OE2 GLU A 44 30.059 3.253 2.553 1.00 0.00 O ATOM 0 H GLU A 44 30.329 -0.780 -1.472 1.00 0.00 H new ATOM 0 HA GLU A 44 27.875 0.270 -0.558 1.00 0.00 H new ATOM 0 HB2 GLU A 44 30.262 0.542 0.388 1.00 0.00 H new ATOM 0 HB3 GLU A 44 30.496 1.758 -0.853 1.00 0.00 H new ATOM 0 HG2 GLU A 44 28.349 2.850 0.023 1.00 0.00 H new ATOM 0 HG3 GLU A 44 28.476 1.766 1.394 1.00 0.00 H new ATOM 388 N GLY A 45 27.135 1.894 -2.310 1.00 0.00 N ATOM 389 CA GLY A 45 26.644 2.705 -3.400 1.00 0.00 C ATOM 390 C GLY A 45 25.591 1.983 -4.196 1.00 0.00 C ATOM 391 O GLY A 45 25.076 2.504 -5.179 1.00 0.00 O ATOM 0 H GLY A 45 26.462 1.732 -1.561 1.00 0.00 H new ATOM 0 HA2 GLY A 45 26.231 3.633 -3.006 1.00 0.00 H new ATOM 0 HA3 GLY A 45 27.473 2.977 -4.054 1.00 0.00 H new ATOM 395 N THR A 46 25.268 0.783 -3.777 1.00 0.00 N ATOM 396 CA THR A 46 24.260 -0.013 -4.461 1.00 0.00 C ATOM 397 C THR A 46 22.849 0.334 -4.018 1.00 0.00 C ATOM 398 O THR A 46 22.531 0.223 -2.856 1.00 0.00 O ATOM 399 CB THR A 46 24.539 -1.520 -4.294 1.00 0.00 C ATOM 400 OG1 THR A 46 25.865 -1.821 -4.758 1.00 0.00 O ATOM 401 CG2 THR A 46 23.516 -2.380 -5.033 1.00 0.00 C ATOM 0 H THR A 46 25.686 0.330 -2.964 1.00 0.00 H new ATOM 0 HA THR A 46 24.327 0.233 -5.521 1.00 0.00 H new ATOM 0 HB THR A 46 24.455 -1.757 -3.233 1.00 0.00 H new ATOM 0 HG1 THR A 46 26.521 -1.488 -4.111 1.00 0.00 H new ATOM 0 HG21 THR A 46 23.753 -3.434 -4.887 1.00 0.00 H new ATOM 0 HG22 THR A 46 22.519 -2.175 -4.643 1.00 0.00 H new ATOM 0 HG23 THR A 46 23.545 -2.146 -6.097 1.00 0.00 H new ATOM 409 N GLN A 47 22.017 0.769 -4.949 1.00 0.00 N ATOM 410 CA GLN A 47 20.671 1.120 -4.621 1.00 0.00 C ATOM 411 C GLN A 47 19.718 -0.045 -4.816 1.00 0.00 C ATOM 412 O GLN A 47 19.956 -0.943 -5.636 1.00 0.00 O ATOM 413 CB GLN A 47 20.222 2.341 -5.404 1.00 0.00 C ATOM 414 CG GLN A 47 20.102 2.129 -6.892 1.00 0.00 C ATOM 415 CD GLN A 47 19.886 3.422 -7.630 1.00 0.00 C ATOM 416 OE1 GLN A 47 19.301 4.386 -6.978 1.00 0.00 O flip ATOM 417 NE2 GLN A 47 20.268 3.553 -8.786 1.00 0.00 N flip ATOM 0 H GLN A 47 22.262 0.883 -5.933 1.00 0.00 H new ATOM 0 HA GLN A 47 20.649 1.374 -3.561 1.00 0.00 H new ATOM 0 HB2 GLN A 47 19.256 2.667 -5.019 1.00 0.00 H new ATOM 0 HB3 GLN A 47 20.928 3.151 -5.222 1.00 0.00 H new ATOM 0 HG2 GLN A 47 21.006 1.646 -7.263 1.00 0.00 H new ATOM 0 HG3 GLN A 47 19.272 1.452 -7.096 1.00 0.00 H new ATOM 0 HE21 GLN A 47 20.722 2.775 -9.264 1.00 0.00 H new ATOM 0 HE22 GLN A 47 20.132 4.440 -9.271 1.00 0.00 H new ATOM 426 N ALA A 48 18.668 -0.022 -4.056 1.00 0.00 N ATOM 427 CA ALA A 48 17.643 -1.019 -4.082 1.00 0.00 C ATOM 428 C ALA A 48 16.319 -0.342 -4.341 1.00 0.00 C ATOM 429 O ALA A 48 15.996 0.675 -3.698 1.00 0.00 O ATOM 430 CB ALA A 48 17.603 -1.757 -2.754 1.00 0.00 C ATOM 0 H ALA A 48 18.495 0.718 -3.376 1.00 0.00 H new ATOM 0 HA ALA A 48 17.848 -1.742 -4.871 1.00 0.00 H new ATOM 0 HB1 ALA A 48 16.820 -2.514 -2.782 1.00 0.00 H new ATOM 0 HB2 ALA A 48 18.565 -2.237 -2.575 1.00 0.00 H new ATOM 0 HB3 ALA A 48 17.395 -1.050 -1.951 1.00 0.00 H new ATOM 436 N ILE A 49 15.580 -0.861 -5.281 1.00 0.00 N ATOM 437 CA ILE A 49 14.301 -0.304 -5.643 1.00 0.00 C ATOM 438 C ILE A 49 13.198 -1.139 -5.017 1.00 0.00 C ATOM 439 O ILE A 49 13.153 -2.379 -5.188 1.00 0.00 O ATOM 440 CB ILE A 49 14.124 -0.256 -7.182 1.00 0.00 C ATOM 441 CG1 ILE A 49 15.273 0.551 -7.810 1.00 0.00 C ATOM 442 CG2 ILE A 49 12.776 0.370 -7.540 1.00 0.00 C ATOM 443 CD1 ILE A 49 15.271 0.573 -9.325 1.00 0.00 C ATOM 0 H ILE A 49 15.846 -1.685 -5.821 1.00 0.00 H new ATOM 0 HA ILE A 49 14.248 0.719 -5.271 1.00 0.00 H new ATOM 0 HB ILE A 49 14.147 -1.272 -7.576 1.00 0.00 H new ATOM 0 HG12 ILE A 49 15.222 1.577 -7.444 1.00 0.00 H new ATOM 0 HG13 ILE A 49 16.221 0.137 -7.467 1.00 0.00 H new ATOM 0 HG21 ILE A 49 12.664 0.398 -8.624 1.00 0.00 H new ATOM 0 HG22 ILE A 49 11.972 -0.225 -7.107 1.00 0.00 H new ATOM 0 HG23 ILE A 49 12.729 1.385 -7.144 1.00 0.00 H new ATOM 0 HD11 ILE A 49 16.115 1.164 -9.681 1.00 0.00 H new ATOM 0 HD12 ILE A 49 15.356 -0.446 -9.704 1.00 0.00 H new ATOM 0 HD13 ILE A 49 14.341 1.016 -9.681 1.00 0.00 H new ATOM 455 N TYR A 50 12.336 -0.495 -4.287 1.00 0.00 N ATOM 456 CA TYR A 50 11.283 -1.176 -3.602 1.00 0.00 C ATOM 457 C TYR A 50 9.939 -1.064 -4.269 1.00 0.00 C ATOM 458 O TYR A 50 9.579 -0.030 -4.856 1.00 0.00 O ATOM 459 CB TYR A 50 11.186 -0.717 -2.167 1.00 0.00 C ATOM 460 CG TYR A 50 12.270 -1.264 -1.288 1.00 0.00 C ATOM 461 CD1 TYR A 50 12.148 -2.523 -0.725 1.00 0.00 C ATOM 462 CD2 TYR A 50 13.407 -0.534 -1.018 1.00 0.00 C ATOM 463 CE1 TYR A 50 13.126 -3.036 0.083 1.00 0.00 C ATOM 464 CE2 TYR A 50 14.392 -1.043 -0.213 1.00 0.00 C ATOM 465 CZ TYR A 50 14.249 -2.291 0.336 1.00 0.00 C ATOM 466 OH TYR A 50 15.230 -2.792 1.146 1.00 0.00 O ATOM 0 H TYR A 50 12.345 0.516 -4.151 1.00 0.00 H new ATOM 0 HA TYR A 50 11.555 -2.231 -3.636 1.00 0.00 H new ATOM 0 HB2 TYR A 50 11.222 0.372 -2.139 1.00 0.00 H new ATOM 0 HB3 TYR A 50 10.218 -1.014 -1.764 1.00 0.00 H new ATOM 0 HD1 TYR A 50 11.265 -3.111 -0.927 1.00 0.00 H new ATOM 0 HD2 TYR A 50 13.523 0.451 -1.446 1.00 0.00 H new ATOM 0 HE1 TYR A 50 13.014 -4.018 0.517 1.00 0.00 H new ATOM 0 HE2 TYR A 50 15.280 -0.462 -0.011 1.00 0.00 H new ATOM 0 HH TYR A 50 14.847 -3.025 2.018 1.00 0.00 H new ATOM 476 N LYS A 51 9.218 -2.148 -4.174 1.00 0.00 N ATOM 477 CA LYS A 51 7.872 -2.251 -4.608 1.00 0.00 C ATOM 478 C LYS A 51 7.037 -1.925 -3.412 1.00 0.00 C ATOM 479 O LYS A 51 7.352 -2.369 -2.322 1.00 0.00 O ATOM 480 CB LYS A 51 7.551 -3.682 -5.039 1.00 0.00 C ATOM 481 CG LYS A 51 6.260 -3.771 -5.786 1.00 0.00 C ATOM 482 CD LYS A 51 5.937 -5.177 -6.239 1.00 0.00 C ATOM 483 CE LYS A 51 4.812 -5.172 -7.269 1.00 0.00 C ATOM 484 NZ LYS A 51 3.583 -4.486 -6.795 1.00 0.00 N ATOM 0 H LYS A 51 9.578 -3.014 -3.773 1.00 0.00 H new ATOM 0 HA LYS A 51 7.687 -1.589 -5.454 1.00 0.00 H new ATOM 0 HB2 LYS A 51 8.358 -4.060 -5.666 1.00 0.00 H new ATOM 0 HB3 LYS A 51 7.504 -4.323 -4.159 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.453 -3.405 -5.151 1.00 0.00 H new ATOM 0 HG3 LYS A 51 6.304 -3.116 -6.656 1.00 0.00 H new ATOM 0 HD2 LYS A 51 6.826 -5.638 -6.668 1.00 0.00 H new ATOM 0 HD3 LYS A 51 5.647 -5.782 -5.380 1.00 0.00 H new ATOM 0 HE2 LYS A 51 5.164 -4.685 -8.178 1.00 0.00 H new ATOM 0 HE3 LYS A 51 4.566 -6.201 -7.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 2.807 -4.662 -7.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 3.321 -4.852 -5.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 3.759 -3.463 -6.731 1.00 0.00 H new ATOM 498 N CYS A 52 5.975 -1.232 -3.612 1.00 0.00 N ATOM 499 CA CYS A 52 5.146 -0.776 -2.520 1.00 0.00 C ATOM 500 C CYS A 52 4.052 -1.754 -2.165 1.00 0.00 C ATOM 501 O CYS A 52 3.142 -1.411 -1.451 1.00 0.00 O ATOM 502 CB CYS A 52 4.541 0.552 -2.886 1.00 0.00 C ATOM 503 SG CYS A 52 5.751 1.903 -2.976 1.00 0.00 S ATOM 0 H CYS A 52 5.642 -0.956 -4.536 1.00 0.00 H new ATOM 0 HA CYS A 52 5.783 -0.683 -1.640 1.00 0.00 H new ATOM 0 HB2 CYS A 52 4.039 0.460 -3.849 1.00 0.00 H new ATOM 0 HB3 CYS A 52 3.777 0.808 -2.152 1.00 0.00 H new ATOM 508 N ARG A 53 4.193 -2.992 -2.624 1.00 0.00 N ATOM 509 CA ARG A 53 3.179 -4.052 -2.428 1.00 0.00 C ATOM 510 C ARG A 53 1.865 -3.717 -3.188 1.00 0.00 C ATOM 511 O ARG A 53 1.655 -2.577 -3.633 1.00 0.00 O ATOM 512 CB ARG A 53 2.902 -4.319 -0.912 1.00 0.00 C ATOM 513 CG ARG A 53 4.096 -4.845 -0.144 1.00 0.00 C ATOM 514 CD ARG A 53 3.736 -5.207 1.285 1.00 0.00 C ATOM 515 NE ARG A 53 4.900 -5.737 2.023 1.00 0.00 N ATOM 516 CZ ARG A 53 4.839 -6.619 3.046 1.00 0.00 C ATOM 517 NH1 ARG A 53 3.669 -7.083 3.470 1.00 0.00 N ATOM 518 NH2 ARG A 53 5.957 -7.037 3.628 1.00 0.00 N ATOM 0 H ARG A 53 5.013 -3.302 -3.146 1.00 0.00 H new ATOM 0 HA ARG A 53 3.586 -4.971 -2.848 1.00 0.00 H new ATOM 0 HB2 ARG A 53 2.565 -3.392 -0.447 1.00 0.00 H new ATOM 0 HB3 ARG A 53 2.084 -5.035 -0.825 1.00 0.00 H new ATOM 0 HG2 ARG A 53 4.495 -5.723 -0.651 1.00 0.00 H new ATOM 0 HG3 ARG A 53 4.885 -4.093 -0.140 1.00 0.00 H new ATOM 0 HD2 ARG A 53 3.350 -4.326 1.798 1.00 0.00 H new ATOM 0 HD3 ARG A 53 2.938 -5.949 1.283 1.00 0.00 H new ATOM 0 HE ARG A 53 5.824 -5.412 1.738 1.00 0.00 H new ATOM 0 HH11 ARG A 53 2.806 -6.774 3.023 1.00 0.00 H new ATOM 0 HH12 ARG A 53 3.634 -7.748 4.243 1.00 0.00 H new ATOM 0 HH21 ARG A 53 6.861 -6.693 3.303 1.00 0.00 H new ATOM 0 HH22 ARG A 53 5.912 -7.702 4.400 1.00 0.00 H new ATOM 532 N PRO A 54 1.005 -4.706 -3.428 1.00 0.00 N ATOM 533 CA PRO A 54 -0.269 -4.452 -4.048 1.00 0.00 C ATOM 534 C PRO A 54 -1.226 -3.813 -3.044 1.00 0.00 C ATOM 535 O PRO A 54 -1.245 -4.177 -1.860 1.00 0.00 O ATOM 536 CB PRO A 54 -0.751 -5.836 -4.492 1.00 0.00 C ATOM 537 CG PRO A 54 -0.047 -6.805 -3.611 1.00 0.00 C ATOM 538 CD PRO A 54 1.208 -6.131 -3.128 1.00 0.00 C ATOM 0 HA PRO A 54 -0.210 -3.757 -4.886 1.00 0.00 H new ATOM 0 HB2 PRO A 54 -1.832 -5.926 -4.389 1.00 0.00 H new ATOM 0 HB3 PRO A 54 -0.514 -6.016 -5.541 1.00 0.00 H new ATOM 0 HG2 PRO A 54 -0.679 -7.091 -2.770 1.00 0.00 H new ATOM 0 HG3 PRO A 54 0.191 -7.719 -4.156 1.00 0.00 H new ATOM 0 HD2 PRO A 54 1.359 -6.293 -2.061 1.00 0.00 H new ATOM 0 HD3 PRO A 54 2.089 -6.522 -3.638 1.00 0.00 H new ATOM 546 N GLY A 55 -1.988 -2.864 -3.503 1.00 0.00 N ATOM 547 CA GLY A 55 -2.893 -2.151 -2.636 1.00 0.00 C ATOM 548 C GLY A 55 -2.287 -0.862 -2.163 1.00 0.00 C ATOM 549 O GLY A 55 -2.902 -0.095 -1.418 1.00 0.00 O ATOM 0 H GLY A 55 -2.004 -2.561 -4.477 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -3.823 -1.946 -3.166 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -3.146 -2.774 -1.778 1.00 0.00 H new ATOM 553 N TYR A 56 -1.098 -0.607 -2.593 1.00 0.00 N ATOM 554 CA TYR A 56 -0.416 0.584 -2.218 1.00 0.00 C ATOM 555 C TYR A 56 0.095 1.281 -3.441 1.00 0.00 C ATOM 556 O TYR A 56 -0.045 0.787 -4.563 1.00 0.00 O ATOM 557 CB TYR A 56 0.742 0.283 -1.270 1.00 0.00 C ATOM 558 CG TYR A 56 0.344 -0.374 0.027 1.00 0.00 C ATOM 559 CD1 TYR A 56 -0.032 0.384 1.121 1.00 0.00 C ATOM 560 CD2 TYR A 56 0.353 -1.756 0.157 1.00 0.00 C ATOM 561 CE1 TYR A 56 -0.391 -0.212 2.306 1.00 0.00 C ATOM 562 CE2 TYR A 56 -0.003 -2.360 1.336 1.00 0.00 C ATOM 563 CZ TYR A 56 -0.374 -1.585 2.407 1.00 0.00 C ATOM 564 OH TYR A 56 -0.724 -2.184 3.583 1.00 0.00 O ATOM 0 H TYR A 56 -0.571 -1.220 -3.215 1.00 0.00 H new ATOM 0 HA TYR A 56 -1.121 1.231 -1.696 1.00 0.00 H new ATOM 0 HB2 TYR A 56 1.455 -0.362 -1.784 1.00 0.00 H new ATOM 0 HB3 TYR A 56 1.260 1.215 -1.045 1.00 0.00 H new ATOM 0 HD1 TYR A 56 -0.044 1.461 1.043 1.00 0.00 H new ATOM 0 HD2 TYR A 56 0.645 -2.366 -0.685 1.00 0.00 H new ATOM 0 HE1 TYR A 56 -0.684 0.392 3.152 1.00 0.00 H new ATOM 0 HE2 TYR A 56 0.008 -3.437 1.421 1.00 0.00 H new ATOM 0 HH TYR A 56 -0.660 -3.157 3.486 1.00 0.00 H new ATOM 574 N ARG A 57 0.657 2.414 -3.230 1.00 0.00 N ATOM 575 CA ARG A 57 1.228 3.218 -4.253 1.00 0.00 C ATOM 576 C ARG A 57 2.275 4.079 -3.602 1.00 0.00 C ATOM 577 O ARG A 57 2.572 3.902 -2.414 1.00 0.00 O ATOM 578 CB ARG A 57 0.169 4.110 -4.902 1.00 0.00 C ATOM 579 CG ARG A 57 -0.487 5.087 -3.941 1.00 0.00 C ATOM 580 CD ARG A 57 -1.412 6.047 -4.655 1.00 0.00 C ATOM 581 NE ARG A 57 -0.696 6.924 -5.592 1.00 0.00 N ATOM 582 CZ ARG A 57 -0.848 8.257 -5.668 1.00 0.00 C ATOM 583 NH1 ARG A 57 -1.654 8.889 -4.819 1.00 0.00 N ATOM 584 NH2 ARG A 57 -0.181 8.955 -6.588 1.00 0.00 N ATOM 0 H ARG A 57 0.736 2.826 -2.300 1.00 0.00 H new ATOM 0 HA ARG A 57 1.654 2.587 -5.033 1.00 0.00 H new ATOM 0 HB2 ARG A 57 0.629 4.670 -5.716 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.601 3.479 -5.345 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -1.049 4.534 -3.189 1.00 0.00 H new ATOM 0 HG3 ARG A 57 0.283 5.650 -3.414 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -2.169 5.481 -5.198 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -1.936 6.657 -3.919 1.00 0.00 H new ATOM 0 HE ARG A 57 -0.033 6.488 -6.233 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -2.159 8.362 -4.107 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -1.767 9.901 -4.880 1.00 0.00 H new ATOM 0 HH21 ARG A 57 0.446 8.477 -7.235 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -0.298 9.967 -6.644 1.00 0.00 H new ATOM 598 N SER A 58 2.803 5.007 -4.330 1.00 0.00 N ATOM 599 CA SER A 58 3.779 5.894 -3.803 1.00 0.00 C ATOM 600 C SER A 58 3.932 7.101 -4.685 1.00 0.00 C ATOM 601 O SER A 58 3.613 7.059 -5.883 1.00 0.00 O ATOM 602 CB SER A 58 5.109 5.166 -3.615 1.00 0.00 C ATOM 603 OG SER A 58 5.458 4.401 -4.766 1.00 0.00 O ATOM 0 H SER A 58 2.567 5.169 -5.309 1.00 0.00 H new ATOM 0 HA SER A 58 3.445 6.243 -2.826 1.00 0.00 H new ATOM 0 HB2 SER A 58 5.895 5.892 -3.408 1.00 0.00 H new ATOM 0 HB3 SER A 58 5.045 4.510 -2.747 1.00 0.00 H new ATOM 0 HG SER A 58 5.707 3.493 -4.492 1.00 0.00 H new ATOM 609 N LEU A 59 4.367 8.183 -4.088 1.00 0.00 N ATOM 610 CA LEU A 59 4.654 9.404 -4.808 1.00 0.00 C ATOM 611 C LEU A 59 5.970 9.203 -5.550 1.00 0.00 C ATOM 612 O LEU A 59 6.234 9.817 -6.584 1.00 0.00 O ATOM 613 CB LEU A 59 4.749 10.552 -3.808 1.00 0.00 C ATOM 614 CG LEU A 59 3.505 10.753 -2.924 1.00 0.00 C ATOM 615 CD1 LEU A 59 3.729 11.859 -1.918 1.00 0.00 C ATOM 616 CD2 LEU A 59 2.276 11.047 -3.772 1.00 0.00 C ATOM 0 H LEU A 59 4.534 8.244 -3.084 1.00 0.00 H new ATOM 0 HA LEU A 59 3.870 9.645 -5.526 1.00 0.00 H new ATOM 0 HB2 LEU A 59 5.610 10.381 -3.162 1.00 0.00 H new ATOM 0 HB3 LEU A 59 4.940 11.475 -4.355 1.00 0.00 H new ATOM 0 HG LEU A 59 3.331 9.825 -2.379 1.00 0.00 H new ATOM 0 HD11 LEU A 59 2.835 11.981 -1.306 1.00 0.00 H new ATOM 0 HD12 LEU A 59 4.574 11.604 -1.279 1.00 0.00 H new ATOM 0 HD13 LEU A 59 3.939 12.791 -2.443 1.00 0.00 H new ATOM 0 HD21 LEU A 59 1.411 11.185 -3.123 1.00 0.00 H new ATOM 0 HD22 LEU A 59 2.443 11.955 -4.352 1.00 0.00 H new ATOM 0 HD23 LEU A 59 2.093 10.212 -4.449 1.00 0.00 H new ATOM 628 N GLY A 60 6.774 8.335 -4.982 1.00 0.00 N ATOM 629 CA GLY A 60 7.973 7.874 -5.558 1.00 0.00 C ATOM 630 C GLY A 60 8.349 6.620 -4.831 1.00 0.00 C ATOM 631 O GLY A 60 8.114 6.538 -3.618 1.00 0.00 O ATOM 0 H GLY A 60 6.584 7.926 -4.067 1.00 0.00 H new ATOM 0 HA2 GLY A 60 7.840 7.679 -6.622 1.00 0.00 H new ATOM 0 HA3 GLY A 60 8.759 8.624 -5.467 1.00 0.00 H new ATOM 635 N ASN A 61 8.855 5.647 -5.542 1.00 0.00 N ATOM 636 CA ASN A 61 9.263 4.363 -4.967 1.00 0.00 C ATOM 637 C ASN A 61 10.323 4.549 -3.915 1.00 0.00 C ATOM 638 O ASN A 61 11.184 5.428 -4.043 1.00 0.00 O ATOM 639 CB ASN A 61 9.801 3.423 -6.061 1.00 0.00 C ATOM 640 CG ASN A 61 8.721 2.886 -6.975 1.00 0.00 C ATOM 641 OD1 ASN A 61 8.345 3.530 -7.957 1.00 0.00 O ATOM 642 ND2 ASN A 61 8.254 1.690 -6.705 1.00 0.00 N ATOM 0 H ASN A 61 9.003 5.710 -6.549 1.00 0.00 H new ATOM 0 HA ASN A 61 8.380 3.919 -4.507 1.00 0.00 H new ATOM 0 HB2 ASN A 61 10.540 3.958 -6.658 1.00 0.00 H new ATOM 0 HB3 ASN A 61 10.317 2.587 -5.590 1.00 0.00 H new ATOM 0 HD21 ASN A 61 7.557 1.265 -7.316 1.00 0.00 H new ATOM 0 HD22 ASN A 61 8.588 1.186 -5.884 1.00 0.00 H new ATOM 649 N VAL A 62 10.243 3.755 -2.867 1.00 0.00 N ATOM 650 CA VAL A 62 11.238 3.771 -1.821 1.00 0.00 C ATOM 651 C VAL A 62 12.540 3.248 -2.386 1.00 0.00 C ATOM 652 O VAL A 62 12.610 2.118 -2.884 1.00 0.00 O ATOM 653 CB VAL A 62 10.803 2.918 -0.596 1.00 0.00 C ATOM 654 CG1 VAL A 62 11.893 2.876 0.471 1.00 0.00 C ATOM 655 CG2 VAL A 62 9.526 3.470 -0.006 1.00 0.00 C ATOM 0 H VAL A 62 9.489 3.084 -2.719 1.00 0.00 H new ATOM 0 HA VAL A 62 11.360 4.796 -1.470 1.00 0.00 H new ATOM 0 HB VAL A 62 10.632 1.899 -0.943 1.00 0.00 H new ATOM 0 HG11 VAL A 62 11.555 2.271 1.313 1.00 0.00 H new ATOM 0 HG12 VAL A 62 12.798 2.438 0.050 1.00 0.00 H new ATOM 0 HG13 VAL A 62 12.106 3.889 0.814 1.00 0.00 H new ATOM 0 HG21 VAL A 62 9.230 2.865 0.851 1.00 0.00 H new ATOM 0 HG22 VAL A 62 9.688 4.499 0.315 1.00 0.00 H new ATOM 0 HG23 VAL A 62 8.737 3.444 -0.758 1.00 0.00 H new ATOM 665 N ILE A 63 13.538 4.081 -2.375 1.00 0.00 N ATOM 666 CA ILE A 63 14.816 3.722 -2.896 1.00 0.00 C ATOM 667 C ILE A 63 15.809 3.738 -1.773 1.00 0.00 C ATOM 668 O ILE A 63 15.952 4.744 -1.055 1.00 0.00 O ATOM 669 CB ILE A 63 15.292 4.696 -4.017 1.00 0.00 C ATOM 670 CG1 ILE A 63 14.248 4.799 -5.142 1.00 0.00 C ATOM 671 CG2 ILE A 63 16.645 4.253 -4.586 1.00 0.00 C ATOM 672 CD1 ILE A 63 13.948 3.495 -5.838 1.00 0.00 C ATOM 0 H ILE A 63 13.485 5.029 -2.003 1.00 0.00 H new ATOM 0 HA ILE A 63 14.736 2.729 -3.339 1.00 0.00 H new ATOM 0 HB ILE A 63 15.410 5.683 -3.570 1.00 0.00 H new ATOM 0 HG12 ILE A 63 13.322 5.196 -4.726 1.00 0.00 H new ATOM 0 HG13 ILE A 63 14.599 5.519 -5.882 1.00 0.00 H new ATOM 0 HG21 ILE A 63 16.957 4.947 -5.366 1.00 0.00 H new ATOM 0 HG22 ILE A 63 17.389 4.244 -3.790 1.00 0.00 H new ATOM 0 HG23 ILE A 63 16.552 3.252 -5.007 1.00 0.00 H new ATOM 0 HD11 ILE A 63 13.202 3.661 -6.616 1.00 0.00 H new ATOM 0 HD12 ILE A 63 14.861 3.104 -6.288 1.00 0.00 H new ATOM 0 HD13 ILE A 63 13.564 2.776 -5.114 1.00 0.00 H new ATOM 684 N MET A 64 16.466 2.650 -1.588 1.00 0.00 N ATOM 685 CA MET A 64 17.487 2.568 -0.574 1.00 0.00 C ATOM 686 C MET A 64 18.800 2.406 -1.233 1.00 0.00 C ATOM 687 O MET A 64 18.853 2.140 -2.422 1.00 0.00 O ATOM 688 CB MET A 64 17.246 1.437 0.425 1.00 0.00 C ATOM 689 CG MET A 64 16.027 1.652 1.289 1.00 0.00 C ATOM 690 SD MET A 64 15.768 0.350 2.514 1.00 0.00 S ATOM 691 CE MET A 64 17.202 0.591 3.556 1.00 0.00 C ATOM 0 H MET A 64 16.323 1.793 -2.122 1.00 0.00 H new ATOM 0 HA MET A 64 17.461 3.492 0.004 1.00 0.00 H new ATOM 0 HB2 MET A 64 17.136 0.499 -0.119 1.00 0.00 H new ATOM 0 HB3 MET A 64 18.122 1.334 1.065 1.00 0.00 H new ATOM 0 HG2 MET A 64 16.121 2.609 1.803 1.00 0.00 H new ATOM 0 HG3 MET A 64 15.146 1.718 0.650 1.00 0.00 H new ATOM 0 HE1 MET A 64 17.796 -0.323 3.575 1.00 0.00 H new ATOM 0 HE2 MET A 64 17.806 1.408 3.161 1.00 0.00 H new ATOM 0 HE3 MET A 64 16.879 0.835 4.568 1.00 0.00 H new ATOM 701 N VAL A 65 19.840 2.576 -0.506 1.00 0.00 N ATOM 702 CA VAL A 65 21.149 2.426 -1.063 1.00 0.00 C ATOM 703 C VAL A 65 22.121 1.936 0.005 1.00 0.00 C ATOM 704 O VAL A 65 21.996 2.258 1.180 1.00 0.00 O ATOM 705 CB VAL A 65 21.664 3.735 -1.782 1.00 0.00 C ATOM 706 CG1 VAL A 65 22.118 4.759 -0.825 1.00 0.00 C ATOM 707 CG2 VAL A 65 22.760 3.465 -2.777 1.00 0.00 C ATOM 0 H VAL A 65 19.819 2.821 0.484 1.00 0.00 H new ATOM 0 HA VAL A 65 21.089 1.670 -1.846 1.00 0.00 H new ATOM 0 HB VAL A 65 20.798 4.117 -2.323 1.00 0.00 H new ATOM 0 HG11 VAL A 65 22.462 5.639 -1.369 1.00 0.00 H new ATOM 0 HG12 VAL A 65 21.292 5.037 -0.171 1.00 0.00 H new ATOM 0 HG13 VAL A 65 22.937 4.360 -0.226 1.00 0.00 H new ATOM 0 HG21 VAL A 65 23.072 4.402 -3.238 1.00 0.00 H new ATOM 0 HG22 VAL A 65 23.610 3.010 -2.268 1.00 0.00 H new ATOM 0 HG23 VAL A 65 22.393 2.786 -3.547 1.00 0.00 H new ATOM 717 N CYS A 66 22.998 1.110 -0.420 1.00 0.00 N ATOM 718 CA CYS A 66 24.017 0.508 0.380 1.00 0.00 C ATOM 719 C CYS A 66 25.046 1.558 0.800 1.00 0.00 C ATOM 720 O CYS A 66 25.637 2.235 -0.069 1.00 0.00 O ATOM 721 CB CYS A 66 24.683 -0.555 -0.482 1.00 0.00 C ATOM 722 SG CYS A 66 25.902 -1.552 0.357 1.00 0.00 S ATOM 0 H CYS A 66 23.034 0.811 -1.395 1.00 0.00 H new ATOM 0 HA CYS A 66 23.595 0.072 1.285 1.00 0.00 H new ATOM 0 HB2 CYS A 66 23.911 -1.212 -0.883 1.00 0.00 H new ATOM 0 HB3 CYS A 66 25.158 -0.066 -1.332 1.00 0.00 H new ATOM 727 N ARG A 67 25.252 1.718 2.094 1.00 0.00 N ATOM 728 CA ARG A 67 26.204 2.672 2.597 1.00 0.00 C ATOM 729 C ARG A 67 26.588 2.336 4.038 1.00 0.00 C ATOM 730 O ARG A 67 25.721 2.042 4.852 1.00 0.00 O ATOM 731 CB ARG A 67 25.626 4.084 2.498 1.00 0.00 C ATOM 732 CG ARG A 67 26.631 5.173 2.762 1.00 0.00 C ATOM 733 CD ARG A 67 26.056 6.524 2.448 1.00 0.00 C ATOM 734 NE ARG A 67 27.042 7.591 2.612 1.00 0.00 N ATOM 735 CZ ARG A 67 26.983 8.778 1.998 1.00 0.00 C ATOM 736 NH1 ARG A 67 26.039 9.023 1.083 1.00 0.00 N ATOM 737 NH2 ARG A 67 27.881 9.704 2.275 1.00 0.00 N ATOM 0 H ARG A 67 24.763 1.190 2.817 1.00 0.00 H new ATOM 0 HA ARG A 67 27.109 2.625 1.991 1.00 0.00 H new ATOM 0 HB2 ARG A 67 25.205 4.225 1.503 1.00 0.00 H new ATOM 0 HB3 ARG A 67 24.805 4.181 3.208 1.00 0.00 H new ATOM 0 HG2 ARG A 67 26.942 5.140 3.806 1.00 0.00 H new ATOM 0 HG3 ARG A 67 27.523 5.004 2.158 1.00 0.00 H new ATOM 0 HD2 ARG A 67 25.683 6.530 1.424 1.00 0.00 H new ATOM 0 HD3 ARG A 67 25.203 6.715 3.099 1.00 0.00 H new ATOM 0 HE ARG A 67 27.829 7.418 3.238 1.00 0.00 H new ATOM 0 HH11 ARG A 67 25.357 8.302 0.848 1.00 0.00 H new ATOM 0 HH12 ARG A 67 26.001 9.931 0.620 1.00 0.00 H new ATOM 0 HH21 ARG A 67 28.617 9.514 2.955 1.00 0.00 H new ATOM 0 HH22 ARG A 67 27.839 10.610 1.809 1.00 0.00 H new ATOM 751 N LYS A 68 27.899 2.345 4.335 1.00 0.00 N ATOM 752 CA LYS A 68 28.424 2.091 5.703 1.00 0.00 C ATOM 753 C LYS A 68 28.166 0.669 6.166 1.00 0.00 C ATOM 754 O LYS A 68 28.103 0.388 7.373 1.00 0.00 O ATOM 755 CB LYS A 68 27.832 3.073 6.710 1.00 0.00 C ATOM 756 CG LYS A 68 28.194 4.525 6.439 1.00 0.00 C ATOM 757 CD LYS A 68 29.691 4.721 6.475 1.00 0.00 C ATOM 758 CE LYS A 68 30.097 6.171 6.293 1.00 0.00 C ATOM 759 NZ LYS A 68 31.552 6.292 6.042 1.00 0.00 N ATOM 0 H LYS A 68 28.627 2.527 3.644 1.00 0.00 H new ATOM 0 HA LYS A 68 29.503 2.236 5.650 1.00 0.00 H new ATOM 0 HB2 LYS A 68 26.747 2.972 6.706 1.00 0.00 H new ATOM 0 HB3 LYS A 68 28.174 2.804 7.709 1.00 0.00 H new ATOM 0 HG2 LYS A 68 27.807 4.825 5.465 1.00 0.00 H new ATOM 0 HG3 LYS A 68 27.721 5.167 7.182 1.00 0.00 H new ATOM 0 HD2 LYS A 68 30.078 4.356 7.427 1.00 0.00 H new ATOM 0 HD3 LYS A 68 30.151 4.118 5.692 1.00 0.00 H new ATOM 0 HE2 LYS A 68 29.544 6.604 5.460 1.00 0.00 H new ATOM 0 HE3 LYS A 68 29.830 6.741 7.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 31.801 7.294 5.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 32.077 5.899 6.849 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 31.800 5.767 5.179 1.00 0.00 H new ATOM 773 N GLY A 69 28.038 -0.216 5.231 1.00 0.00 N ATOM 774 CA GLY A 69 27.845 -1.601 5.549 1.00 0.00 C ATOM 775 C GLY A 69 26.401 -2.000 5.642 1.00 0.00 C ATOM 776 O GLY A 69 26.091 -3.200 5.691 1.00 0.00 O ATOM 0 H GLY A 69 28.063 -0.006 4.233 1.00 0.00 H new ATOM 0 HA2 GLY A 69 28.334 -2.211 4.790 1.00 0.00 H new ATOM 0 HA3 GLY A 69 28.336 -1.819 6.498 1.00 0.00 H new ATOM 780 N GLU A 70 25.514 -1.032 5.649 1.00 0.00 N ATOM 781 CA GLU A 70 24.114 -1.328 5.742 1.00 0.00 C ATOM 782 C GLU A 70 23.346 -0.608 4.663 1.00 0.00 C ATOM 783 O GLU A 70 23.896 0.218 3.940 1.00 0.00 O ATOM 784 CB GLU A 70 23.584 -0.957 7.116 1.00 0.00 C ATOM 785 CG GLU A 70 23.730 0.507 7.479 1.00 0.00 C ATOM 786 CD GLU A 70 23.247 0.775 8.867 1.00 0.00 C ATOM 787 OE1 GLU A 70 24.039 0.622 9.810 1.00 0.00 O ATOM 788 OE2 GLU A 70 22.056 1.115 9.051 1.00 0.00 O ATOM 0 H GLU A 70 25.741 -0.039 5.591 1.00 0.00 H new ATOM 0 HA GLU A 70 23.978 -2.400 5.599 1.00 0.00 H new ATOM 0 HB2 GLU A 70 22.529 -1.226 7.168 1.00 0.00 H new ATOM 0 HB3 GLU A 70 24.103 -1.556 7.864 1.00 0.00 H new ATOM 0 HG2 GLU A 70 24.776 0.802 7.393 1.00 0.00 H new ATOM 0 HG3 GLU A 70 23.167 1.117 6.772 1.00 0.00 H new ATOM 795 N TRP A 71 22.106 -0.918 4.542 1.00 0.00 N ATOM 796 CA TRP A 71 21.289 -0.278 3.574 1.00 0.00 C ATOM 797 C TRP A 71 20.611 0.881 4.222 1.00 0.00 C ATOM 798 O TRP A 71 19.945 0.735 5.250 1.00 0.00 O ATOM 799 CB TRP A 71 20.295 -1.260 2.959 1.00 0.00 C ATOM 800 CG TRP A 71 20.963 -2.375 2.206 1.00 0.00 C ATOM 801 CD1 TRP A 71 21.540 -3.493 2.732 1.00 0.00 C ATOM 802 CD2 TRP A 71 21.120 -2.472 0.792 1.00 0.00 C ATOM 803 NE1 TRP A 71 22.057 -4.270 1.731 1.00 0.00 N ATOM 804 CE2 TRP A 71 21.813 -3.668 0.528 1.00 0.00 C ATOM 805 CE3 TRP A 71 20.742 -1.664 -0.276 1.00 0.00 C ATOM 806 CZ2 TRP A 71 22.141 -4.070 -0.764 1.00 0.00 C ATOM 807 CZ3 TRP A 71 21.065 -2.068 -1.554 1.00 0.00 C ATOM 808 CH2 TRP A 71 21.757 -3.258 -1.787 1.00 0.00 C ATOM 0 H TRP A 71 21.629 -1.620 5.108 1.00 0.00 H new ATOM 0 HA TRP A 71 21.901 0.088 2.750 1.00 0.00 H new ATOM 0 HB2 TRP A 71 19.674 -1.683 3.749 1.00 0.00 H new ATOM 0 HB3 TRP A 71 19.630 -0.721 2.285 1.00 0.00 H new ATOM 0 HD1 TRP A 71 21.583 -3.731 3.785 1.00 0.00 H new ATOM 0 HE1 TRP A 71 22.546 -5.156 1.861 1.00 0.00 H new ATOM 0 HE3 TRP A 71 20.207 -0.741 -0.108 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 22.678 -4.989 -0.947 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 20.777 -1.451 -2.392 1.00 0.00 H new ATOM 0 HH2 TRP A 71 21.993 -3.541 -2.802 1.00 0.00 H new ATOM 819 N VAL A 72 20.812 2.027 3.661 1.00 0.00 N ATOM 820 CA VAL A 72 20.269 3.235 4.190 1.00 0.00 C ATOM 821 C VAL A 72 19.316 3.829 3.183 1.00 0.00 C ATOM 822 O VAL A 72 19.269 3.389 2.025 1.00 0.00 O ATOM 823 CB VAL A 72 21.377 4.268 4.562 1.00 0.00 C ATOM 824 CG1 VAL A 72 22.349 3.687 5.581 1.00 0.00 C ATOM 825 CG2 VAL A 72 22.121 4.762 3.329 1.00 0.00 C ATOM 0 H VAL A 72 21.364 2.153 2.813 1.00 0.00 H new ATOM 0 HA VAL A 72 19.740 2.994 5.112 1.00 0.00 H new ATOM 0 HB VAL A 72 20.880 5.126 5.015 1.00 0.00 H new ATOM 0 HG11 VAL A 72 23.110 4.429 5.822 1.00 0.00 H new ATOM 0 HG12 VAL A 72 21.807 3.416 6.487 1.00 0.00 H new ATOM 0 HG13 VAL A 72 22.826 2.800 5.164 1.00 0.00 H new ATOM 0 HG21 VAL A 72 22.885 5.480 3.628 1.00 0.00 H new ATOM 0 HG22 VAL A 72 22.593 3.918 2.827 1.00 0.00 H new ATOM 0 HG23 VAL A 72 21.418 5.242 2.648 1.00 0.00 H new ATOM 835 N ALA A 73 18.564 4.790 3.594 1.00 0.00 N ATOM 836 CA ALA A 73 17.624 5.416 2.719 1.00 0.00 C ATOM 837 C ALA A 73 18.311 6.417 1.804 1.00 0.00 C ATOM 838 O ALA A 73 18.899 7.397 2.270 1.00 0.00 O ATOM 839 CB ALA A 73 16.519 6.088 3.516 1.00 0.00 C ATOM 0 H ALA A 73 18.580 5.166 4.542 1.00 0.00 H new ATOM 0 HA ALA A 73 17.178 4.642 2.094 1.00 0.00 H new ATOM 0 HB1 ALA A 73 15.813 6.559 2.833 1.00 0.00 H new ATOM 0 HB2 ALA A 73 15.999 5.342 4.118 1.00 0.00 H new ATOM 0 HB3 ALA A 73 16.951 6.845 4.170 1.00 0.00 H new ATOM 845 N LEU A 74 18.290 6.120 0.504 1.00 0.00 N ATOM 846 CA LEU A 74 18.750 7.045 -0.525 1.00 0.00 C ATOM 847 C LEU A 74 17.864 8.264 -0.479 1.00 0.00 C ATOM 848 O LEU A 74 18.310 9.404 -0.624 1.00 0.00 O ATOM 849 CB LEU A 74 18.625 6.378 -1.903 1.00 0.00 C ATOM 850 CG LEU A 74 19.082 7.205 -3.111 1.00 0.00 C ATOM 851 CD1 LEU A 74 19.955 6.367 -4.009 1.00 0.00 C ATOM 852 CD2 LEU A 74 17.882 7.715 -3.891 1.00 0.00 C ATOM 0 H LEU A 74 17.953 5.230 0.138 1.00 0.00 H new ATOM 0 HA LEU A 74 19.791 7.320 -0.355 1.00 0.00 H new ATOM 0 HB2 LEU A 74 19.200 5.452 -1.887 1.00 0.00 H new ATOM 0 HB3 LEU A 74 17.581 6.102 -2.054 1.00 0.00 H new ATOM 0 HG LEU A 74 19.654 8.059 -2.749 1.00 0.00 H new ATOM 0 HD11 LEU A 74 20.275 6.962 -4.864 1.00 0.00 H new ATOM 0 HD12 LEU A 74 20.830 6.030 -3.454 1.00 0.00 H new ATOM 0 HD13 LEU A 74 19.392 5.502 -4.359 1.00 0.00 H new ATOM 0 HD21 LEU A 74 18.225 8.300 -4.745 1.00 0.00 H new ATOM 0 HD22 LEU A 74 17.291 6.870 -4.244 1.00 0.00 H new ATOM 0 HD23 LEU A 74 17.268 8.342 -3.245 1.00 0.00 H new ATOM 864 N ASN A 75 16.603 8.000 -0.262 1.00 0.00 N ATOM 865 CA ASN A 75 15.619 9.028 -0.172 1.00 0.00 C ATOM 866 C ASN A 75 14.595 8.637 0.880 1.00 0.00 C ATOM 867 O ASN A 75 13.714 7.820 0.622 1.00 0.00 O ATOM 868 CB ASN A 75 14.971 9.234 -1.540 1.00 0.00 C ATOM 869 CG ASN A 75 14.076 10.438 -1.621 1.00 0.00 C ATOM 870 OD1 ASN A 75 13.389 10.807 -0.675 1.00 0.00 O ATOM 871 ND2 ASN A 75 14.127 11.085 -2.742 1.00 0.00 N ATOM 0 H ASN A 75 16.234 7.056 -0.143 1.00 0.00 H new ATOM 0 HA ASN A 75 16.076 9.972 0.126 1.00 0.00 H new ATOM 0 HB2 ASN A 75 15.755 9.327 -2.291 1.00 0.00 H new ATOM 0 HB3 ASN A 75 14.391 8.346 -1.793 1.00 0.00 H new ATOM 0 HD21 ASN A 75 13.581 11.938 -2.864 1.00 0.00 H new ATOM 0 HD22 ASN A 75 14.713 10.741 -3.503 1.00 0.00 H new ATOM 878 N PRO A 76 14.735 9.181 2.103 1.00 0.00 N ATOM 879 CA PRO A 76 13.837 8.864 3.225 1.00 0.00 C ATOM 880 C PRO A 76 12.488 9.588 3.139 1.00 0.00 C ATOM 881 O PRO A 76 11.598 9.370 3.968 1.00 0.00 O ATOM 882 CB PRO A 76 14.624 9.340 4.449 1.00 0.00 C ATOM 883 CG PRO A 76 15.480 10.452 3.940 1.00 0.00 C ATOM 884 CD PRO A 76 15.805 10.125 2.505 1.00 0.00 C ATOM 0 HA PRO A 76 13.578 7.805 3.245 1.00 0.00 H new ATOM 0 HB2 PRO A 76 13.957 9.684 5.240 1.00 0.00 H new ATOM 0 HB3 PRO A 76 15.228 8.536 4.869 1.00 0.00 H new ATOM 0 HG2 PRO A 76 14.958 11.406 4.011 1.00 0.00 H new ATOM 0 HG3 PRO A 76 16.391 10.542 4.532 1.00 0.00 H new ATOM 0 HD2 PRO A 76 15.804 11.019 1.881 1.00 0.00 H new ATOM 0 HD3 PRO A 76 16.792 9.673 2.412 1.00 0.00 H new ATOM 892 N LEU A 77 12.341 10.445 2.143 1.00 0.00 N ATOM 893 CA LEU A 77 11.103 11.170 1.946 1.00 0.00 C ATOM 894 C LEU A 77 10.111 10.255 1.262 1.00 0.00 C ATOM 895 O LEU A 77 8.893 10.331 1.494 1.00 0.00 O ATOM 896 CB LEU A 77 11.299 12.463 1.111 1.00 0.00 C ATOM 897 CG LEU A 77 12.208 13.576 1.690 1.00 0.00 C ATOM 898 CD1 LEU A 77 11.827 13.919 3.113 1.00 0.00 C ATOM 899 CD2 LEU A 77 13.692 13.242 1.577 1.00 0.00 C ATOM 0 H LEU A 77 13.067 10.654 1.458 1.00 0.00 H new ATOM 0 HA LEU A 77 10.731 11.481 2.922 1.00 0.00 H new ATOM 0 HB2 LEU A 77 11.702 12.175 0.140 1.00 0.00 H new ATOM 0 HB3 LEU A 77 10.315 12.896 0.932 1.00 0.00 H new ATOM 0 HG LEU A 77 12.041 14.461 1.076 1.00 0.00 H new ATOM 0 HD11 LEU A 77 12.485 14.703 3.487 1.00 0.00 H new ATOM 0 HD12 LEU A 77 10.795 14.269 3.139 1.00 0.00 H new ATOM 0 HD13 LEU A 77 11.926 13.033 3.740 1.00 0.00 H new ATOM 0 HD21 LEU A 77 14.281 14.057 1.998 1.00 0.00 H new ATOM 0 HD22 LEU A 77 13.901 12.323 2.124 1.00 0.00 H new ATOM 0 HD23 LEU A 77 13.956 13.108 0.528 1.00 0.00 H new ATOM 911 N ARG A 78 10.638 9.360 0.448 1.00 0.00 N ATOM 912 CA ARG A 78 9.816 8.412 -0.245 1.00 0.00 C ATOM 913 C ARG A 78 9.309 7.377 0.716 1.00 0.00 C ATOM 914 O ARG A 78 10.019 6.955 1.631 1.00 0.00 O ATOM 915 CB ARG A 78 10.547 7.727 -1.388 1.00 0.00 C ATOM 916 CG ARG A 78 11.001 8.641 -2.506 1.00 0.00 C ATOM 917 CD ARG A 78 9.873 9.509 -3.032 1.00 0.00 C ATOM 918 NE ARG A 78 10.237 10.112 -4.312 1.00 0.00 N ATOM 919 CZ ARG A 78 9.609 11.123 -4.917 1.00 0.00 C ATOM 920 NH1 ARG A 78 8.645 11.806 -4.292 1.00 0.00 N ATOM 921 NH2 ARG A 78 9.975 11.464 -6.146 1.00 0.00 N ATOM 0 H ARG A 78 11.636 9.277 0.256 1.00 0.00 H new ATOM 0 HA ARG A 78 8.984 8.968 -0.677 1.00 0.00 H new ATOM 0 HB2 ARG A 78 11.419 7.214 -0.984 1.00 0.00 H new ATOM 0 HB3 ARG A 78 9.894 6.962 -1.809 1.00 0.00 H new ATOM 0 HG2 ARG A 78 11.809 9.278 -2.147 1.00 0.00 H new ATOM 0 HG3 ARG A 78 11.406 8.041 -3.321 1.00 0.00 H new ATOM 0 HD2 ARG A 78 8.971 8.909 -3.151 1.00 0.00 H new ATOM 0 HD3 ARG A 78 9.642 10.291 -2.309 1.00 0.00 H new ATOM 0 HE ARG A 78 11.050 9.723 -4.790 1.00 0.00 H new ATOM 0 HH11 ARG A 78 8.380 11.557 -3.339 1.00 0.00 H new ATOM 0 HH12 ARG A 78 8.175 12.576 -4.768 1.00 0.00 H new ATOM 0 HH21 ARG A 78 10.726 10.956 -6.614 1.00 0.00 H new ATOM 0 HH22 ARG A 78 9.506 12.234 -6.623 1.00 0.00 H new ATOM 935 N LYS A 79 8.092 6.992 0.523 1.00 0.00 N ATOM 936 CA LYS A 79 7.440 6.026 1.346 1.00 0.00 C ATOM 937 C LYS A 79 6.311 5.454 0.545 1.00 0.00 C ATOM 938 O LYS A 79 5.887 6.068 -0.458 1.00 0.00 O ATOM 939 CB LYS A 79 6.914 6.684 2.631 1.00 0.00 C ATOM 940 CG LYS A 79 5.882 7.784 2.400 1.00 0.00 C ATOM 941 CD LYS A 79 5.467 8.447 3.705 1.00 0.00 C ATOM 942 CE LYS A 79 6.601 9.242 4.354 1.00 0.00 C ATOM 943 NZ LYS A 79 7.014 10.409 3.537 1.00 0.00 N ATOM 0 H LYS A 79 7.506 7.350 -0.232 1.00 0.00 H new ATOM 0 HA LYS A 79 8.134 5.240 1.645 1.00 0.00 H new ATOM 0 HB2 LYS A 79 6.471 5.915 3.264 1.00 0.00 H new ATOM 0 HB3 LYS A 79 7.757 7.103 3.181 1.00 0.00 H new ATOM 0 HG2 LYS A 79 6.294 8.534 1.725 1.00 0.00 H new ATOM 0 HG3 LYS A 79 5.004 7.363 1.910 1.00 0.00 H new ATOM 0 HD2 LYS A 79 4.624 9.112 3.517 1.00 0.00 H new ATOM 0 HD3 LYS A 79 5.121 7.683 4.401 1.00 0.00 H new ATOM 0 HE2 LYS A 79 6.283 9.586 5.338 1.00 0.00 H new ATOM 0 HE3 LYS A 79 7.459 8.587 4.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 7.428 11.136 4.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 7.720 10.109 2.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 6.184 10.801 3.048 1.00 0.00 H new ATOM 957 N CYS A 80 5.845 4.322 0.931 1.00 0.00 N ATOM 958 CA CYS A 80 4.762 3.698 0.248 1.00 0.00 C ATOM 959 C CYS A 80 3.490 3.894 1.036 1.00 0.00 C ATOM 960 O CYS A 80 3.451 3.677 2.252 1.00 0.00 O ATOM 961 CB CYS A 80 5.060 2.229 -0.024 1.00 0.00 C ATOM 962 SG CYS A 80 6.526 1.974 -1.101 1.00 0.00 S ATOM 0 H CYS A 80 6.202 3.798 1.730 1.00 0.00 H new ATOM 0 HA CYS A 80 4.628 4.167 -0.727 1.00 0.00 H new ATOM 0 HB2 CYS A 80 5.221 1.716 0.924 1.00 0.00 H new ATOM 0 HB3 CYS A 80 4.189 1.769 -0.492 1.00 0.00 H new ATOM 967 N GLN A 81 2.471 4.344 0.358 1.00 0.00 N ATOM 968 CA GLN A 81 1.214 4.685 0.978 1.00 0.00 C ATOM 969 C GLN A 81 0.093 3.962 0.296 1.00 0.00 C ATOM 970 O GLN A 81 0.302 3.323 -0.717 1.00 0.00 O ATOM 971 CB GLN A 81 1.003 6.200 0.939 1.00 0.00 C ATOM 972 CG GLN A 81 2.045 6.957 1.745 1.00 0.00 C ATOM 973 CD GLN A 81 1.910 8.452 1.661 1.00 0.00 C ATOM 974 OE1 GLN A 81 1.474 9.000 0.656 1.00 0.00 O ATOM 975 NE2 GLN A 81 2.275 9.124 2.714 1.00 0.00 N ATOM 0 H GLN A 81 2.487 4.487 -0.652 1.00 0.00 H new ATOM 0 HA GLN A 81 1.231 4.374 2.023 1.00 0.00 H new ATOM 0 HB2 GLN A 81 1.032 6.540 -0.096 1.00 0.00 H new ATOM 0 HB3 GLN A 81 0.011 6.435 1.324 1.00 0.00 H new ATOM 0 HG2 GLN A 81 1.974 6.653 2.789 1.00 0.00 H new ATOM 0 HG3 GLN A 81 3.038 6.671 1.397 1.00 0.00 H new ATOM 0 HE21 GLN A 81 2.634 8.633 3.533 1.00 0.00 H new ATOM 0 HE22 GLN A 81 2.202 10.141 2.720 1.00 0.00 H new ATOM 984 N LYS A 82 -1.075 4.064 0.848 1.00 0.00 N ATOM 985 CA LYS A 82 -2.253 3.372 0.346 1.00 0.00 C ATOM 986 C LYS A 82 -2.649 3.855 -1.029 1.00 0.00 C ATOM 987 O LYS A 82 -2.416 5.013 -1.388 1.00 0.00 O ATOM 988 CB LYS A 82 -3.412 3.657 1.253 1.00 0.00 C ATOM 989 CG LYS A 82 -3.226 3.254 2.678 1.00 0.00 C ATOM 990 CD LYS A 82 -3.180 1.772 2.873 1.00 0.00 C ATOM 991 CE LYS A 82 -3.274 1.451 4.352 1.00 0.00 C ATOM 992 NZ LYS A 82 -4.562 1.931 4.920 1.00 0.00 N ATOM 0 H LYS A 82 -1.255 4.636 1.673 1.00 0.00 H new ATOM 0 HA LYS A 82 -2.009 2.310 0.303 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -3.622 4.726 1.220 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -4.292 3.147 0.861 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -2.301 3.692 3.054 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -4.040 3.667 3.274 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -4.001 1.298 2.335 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -2.255 1.369 2.461 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -3.185 0.375 4.501 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -2.443 1.916 4.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -4.727 1.475 5.840 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -4.523 2.963 5.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -5.338 1.691 4.271 1.00 0.00 H new ATOM 1006 N ARG A 83 -3.261 2.984 -1.781 1.00 0.00 N ATOM 1007 CA ARG A 83 -3.813 3.371 -3.056 1.00 0.00 C ATOM 1008 C ARG A 83 -5.222 3.893 -2.800 1.00 0.00 C ATOM 1009 O ARG A 83 -5.850 3.498 -1.798 1.00 0.00 O ATOM 1010 CB ARG A 83 -3.876 2.190 -4.044 1.00 0.00 C ATOM 1011 CG ARG A 83 -4.847 1.090 -3.638 1.00 0.00 C ATOM 1012 CD ARG A 83 -4.974 0.037 -4.713 1.00 0.00 C ATOM 1013 NE ARG A 83 -5.526 0.581 -5.958 1.00 0.00 N ATOM 1014 CZ ARG A 83 -5.185 0.166 -7.186 1.00 0.00 C ATOM 1015 NH1 ARG A 83 -4.230 -0.740 -7.352 1.00 0.00 N ATOM 1016 NH2 ARG A 83 -5.797 0.667 -8.244 1.00 0.00 N ATOM 0 H ARG A 83 -3.392 2.002 -1.537 1.00 0.00 H new ATOM 0 HA ARG A 83 -3.174 4.130 -3.507 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -4.161 2.567 -5.026 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -2.879 1.761 -4.144 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -4.506 0.627 -2.712 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -5.826 1.524 -3.436 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -3.994 -0.398 -4.911 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -5.614 -0.770 -4.356 1.00 0.00 H new ATOM 0 HE ARG A 83 -6.218 1.327 -5.884 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -3.748 -1.127 -6.541 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -3.978 -1.049 -8.291 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -6.528 1.369 -8.126 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -5.539 0.352 -9.179 1.00 0.00 H new ATOM 1030 N PRO A 84 -5.726 4.800 -3.636 1.00 0.00 N ATOM 1031 CA PRO A 84 -7.089 5.279 -3.504 1.00 0.00 C ATOM 1032 C PRO A 84 -8.071 4.232 -4.049 1.00 0.00 C ATOM 1033 O PRO A 84 -7.684 3.342 -4.835 1.00 0.00 O ATOM 1034 CB PRO A 84 -7.107 6.541 -4.360 1.00 0.00 C ATOM 1035 CG PRO A 84 -6.070 6.308 -5.396 1.00 0.00 C ATOM 1036 CD PRO A 84 -5.015 5.453 -4.755 1.00 0.00 C ATOM 0 HA PRO A 84 -7.384 5.468 -2.472 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -8.087 6.701 -4.810 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -6.881 7.426 -3.765 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -6.496 5.811 -6.267 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -5.648 7.251 -5.742 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -4.613 4.721 -5.455 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -4.175 6.051 -4.401 1.00 0.00 H new ATOM 1044 N CYS A 85 -9.309 4.324 -3.669 1.00 0.00 N ATOM 1045 CA CYS A 85 -10.268 3.293 -4.058 1.00 0.00 C ATOM 1046 C CYS A 85 -11.346 3.827 -4.977 1.00 0.00 C ATOM 1047 O CYS A 85 -11.970 3.062 -5.743 1.00 0.00 O ATOM 1048 CB CYS A 85 -10.902 2.717 -2.817 1.00 0.00 C ATOM 1049 SG CYS A 85 -9.696 2.344 -1.538 1.00 0.00 S ATOM 0 H CYS A 85 -9.690 5.081 -3.101 1.00 0.00 H new ATOM 0 HA CYS A 85 -9.726 2.523 -4.607 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -11.635 3.423 -2.426 1.00 0.00 H new ATOM 0 HB3 CYS A 85 -11.443 1.808 -3.078 1.00 0.00 H new ATOM 1054 N GLY A 86 -11.559 5.119 -4.929 1.00 0.00 N ATOM 1055 CA GLY A 86 -12.604 5.715 -5.689 1.00 0.00 C ATOM 1056 C GLY A 86 -13.939 5.540 -5.011 1.00 0.00 C ATOM 1057 O GLY A 86 -14.030 4.948 -3.929 1.00 0.00 O ATOM 0 H GLY A 86 -11.014 5.772 -4.366 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -12.398 6.777 -5.825 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -12.636 5.267 -6.682 1.00 0.00 H new ATOM 1061 N HIS A 87 -14.958 6.032 -5.628 1.00 0.00 N ATOM 1062 CA HIS A 87 -16.295 5.959 -5.074 1.00 0.00 C ATOM 1063 C HIS A 87 -16.862 4.529 -5.307 1.00 0.00 C ATOM 1064 O HIS A 87 -16.818 4.027 -6.427 1.00 0.00 O ATOM 1065 CB HIS A 87 -17.161 7.042 -5.739 1.00 0.00 C ATOM 1066 CG HIS A 87 -18.450 7.345 -5.046 1.00 0.00 C ATOM 1067 ND1 HIS A 87 -19.668 7.012 -5.550 1.00 0.00 N ATOM 1068 CD2 HIS A 87 -18.696 8.003 -3.888 1.00 0.00 C ATOM 1069 CE1 HIS A 87 -20.610 7.440 -4.747 1.00 0.00 C ATOM 1070 NE2 HIS A 87 -20.051 8.044 -3.728 1.00 0.00 N ATOM 0 H HIS A 87 -14.903 6.500 -6.533 1.00 0.00 H new ATOM 0 HA HIS A 87 -16.290 6.142 -4.000 1.00 0.00 H new ATOM 0 HB2 HIS A 87 -16.578 7.961 -5.804 1.00 0.00 H new ATOM 0 HB3 HIS A 87 -17.381 6.731 -6.760 1.00 0.00 H new ATOM 0 HD2 HIS A 87 -17.958 8.418 -3.217 1.00 0.00 H new ATOM 0 HE1 HIS A 87 -21.672 7.316 -4.900 1.00 0.00 H new ATOM 0 HE2 HIS A 87 -20.545 8.473 -2.946 1.00 0.00 H new ATOM 1079 N PRO A 88 -17.368 3.854 -4.240 1.00 0.00 N ATOM 1080 CA PRO A 88 -17.867 2.432 -4.299 1.00 0.00 C ATOM 1081 C PRO A 88 -19.197 2.265 -5.035 1.00 0.00 C ATOM 1082 O PRO A 88 -20.099 1.555 -4.569 1.00 0.00 O ATOM 1083 CB PRO A 88 -18.030 2.079 -2.814 1.00 0.00 C ATOM 1084 CG PRO A 88 -18.310 3.377 -2.146 1.00 0.00 C ATOM 1085 CD PRO A 88 -17.488 4.403 -2.871 1.00 0.00 C ATOM 0 HA PRO A 88 -17.183 1.792 -4.856 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -18.845 1.372 -2.662 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -17.127 1.615 -2.416 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -19.371 3.621 -2.197 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -18.042 3.338 -1.090 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -17.975 5.378 -2.872 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -16.511 4.535 -2.406 1.00 0.00 H new ATOM 1093 N GLY A 89 -19.288 2.849 -6.192 1.00 0.00 N ATOM 1094 CA GLY A 89 -20.485 2.776 -6.954 1.00 0.00 C ATOM 1095 C GLY A 89 -21.382 3.921 -6.617 1.00 0.00 C ATOM 1096 O GLY A 89 -21.271 4.504 -5.528 1.00 0.00 O ATOM 0 H GLY A 89 -18.537 3.385 -6.627 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -20.249 2.791 -8.018 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -20.995 1.834 -6.754 1.00 0.00 H new ATOM 1100 N ASP A 90 -22.265 4.254 -7.496 1.00 0.00 N ATOM 1101 CA ASP A 90 -23.105 5.395 -7.284 1.00 0.00 C ATOM 1102 C ASP A 90 -24.515 4.962 -7.047 1.00 0.00 C ATOM 1103 O ASP A 90 -25.084 4.206 -7.839 1.00 0.00 O ATOM 1104 CB ASP A 90 -23.043 6.340 -8.474 1.00 0.00 C ATOM 1105 CG ASP A 90 -23.779 7.622 -8.222 1.00 0.00 C ATOM 1106 OD1 ASP A 90 -23.259 8.473 -7.480 1.00 0.00 O ATOM 1107 OD2 ASP A 90 -24.876 7.821 -8.781 1.00 0.00 O ATOM 0 H ASP A 90 -22.428 3.755 -8.371 1.00 0.00 H new ATOM 0 HA ASP A 90 -22.744 5.926 -6.403 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -22.001 6.561 -8.705 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -23.466 5.847 -9.349 1.00 0.00 H new ATOM 1112 N THR A 91 -25.078 5.417 -5.979 1.00 0.00 N ATOM 1113 CA THR A 91 -26.409 5.090 -5.640 1.00 0.00 C ATOM 1114 C THR A 91 -27.128 6.383 -5.188 1.00 0.00 C ATOM 1115 O THR A 91 -26.626 7.112 -4.332 1.00 0.00 O ATOM 1116 CB THR A 91 -26.447 3.968 -4.536 1.00 0.00 C ATOM 1117 OG1 THR A 91 -27.794 3.565 -4.250 1.00 0.00 O ATOM 1118 CG2 THR A 91 -25.749 4.406 -3.247 1.00 0.00 C ATOM 0 H THR A 91 -24.615 6.034 -5.312 1.00 0.00 H new ATOM 0 HA THR A 91 -26.931 4.682 -6.506 1.00 0.00 H new ATOM 0 HB THR A 91 -25.902 3.115 -4.941 1.00 0.00 H new ATOM 0 HG1 THR A 91 -28.164 4.136 -3.545 1.00 0.00 H new ATOM 0 HG21 THR A 91 -25.800 3.601 -2.514 1.00 0.00 H new ATOM 0 HG22 THR A 91 -24.705 4.638 -3.459 1.00 0.00 H new ATOM 0 HG23 THR A 91 -26.244 5.292 -2.848 1.00 0.00 H new ATOM 1126 N PRO A 92 -28.269 6.731 -5.806 1.00 0.00 N ATOM 1127 CA PRO A 92 -29.031 7.939 -5.433 1.00 0.00 C ATOM 1128 C PRO A 92 -29.781 7.760 -4.106 1.00 0.00 C ATOM 1129 O PRO A 92 -30.301 8.719 -3.526 1.00 0.00 O ATOM 1130 CB PRO A 92 -30.044 8.106 -6.585 1.00 0.00 C ATOM 1131 CG PRO A 92 -29.622 7.133 -7.643 1.00 0.00 C ATOM 1132 CD PRO A 92 -28.890 6.032 -6.941 1.00 0.00 C ATOM 0 HA PRO A 92 -28.377 8.799 -5.293 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -31.059 7.899 -6.246 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -30.037 9.127 -6.967 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -30.487 6.743 -8.179 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -28.981 7.616 -8.381 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -29.565 5.243 -6.610 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -28.145 5.565 -7.586 1.00 0.00 H new ATOM 1140 N PHE A 93 -29.815 6.540 -3.644 1.00 0.00 N ATOM 1141 CA PHE A 93 -30.509 6.171 -2.437 1.00 0.00 C ATOM 1142 C PHE A 93 -29.552 5.415 -1.530 1.00 0.00 C ATOM 1143 O PHE A 93 -28.722 4.643 -2.015 1.00 0.00 O ATOM 1144 CB PHE A 93 -31.752 5.311 -2.790 1.00 0.00 C ATOM 1145 CG PHE A 93 -31.450 4.075 -3.624 1.00 0.00 C ATOM 1146 CD1 PHE A 93 -31.331 4.159 -5.001 1.00 0.00 C ATOM 1147 CD2 PHE A 93 -31.286 2.845 -3.029 1.00 0.00 C ATOM 1148 CE1 PHE A 93 -31.051 3.039 -5.758 1.00 0.00 C ATOM 1149 CE2 PHE A 93 -31.006 1.718 -3.784 1.00 0.00 C ATOM 1150 CZ PHE A 93 -30.890 1.819 -5.148 1.00 0.00 C ATOM 0 H PHE A 93 -29.352 5.757 -4.105 1.00 0.00 H new ATOM 0 HA PHE A 93 -30.857 7.061 -1.913 1.00 0.00 H new ATOM 0 HB2 PHE A 93 -32.237 4.999 -1.865 1.00 0.00 H new ATOM 0 HB3 PHE A 93 -32.466 5.932 -3.330 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -31.459 5.114 -5.489 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -31.377 2.757 -1.956 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -30.958 3.122 -6.831 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -30.879 0.761 -3.300 1.00 0.00 H new ATOM 0 HZ PHE A 93 -30.673 0.942 -5.740 1.00 0.00 H new ATOM 1160 N GLY A 94 -29.634 5.653 -0.250 1.00 0.00 N ATOM 1161 CA GLY A 94 -28.758 4.985 0.677 1.00 0.00 C ATOM 1162 C GLY A 94 -27.437 5.709 0.796 1.00 0.00 C ATOM 1163 O GLY A 94 -27.290 6.821 0.272 1.00 0.00 O ATOM 0 H GLY A 94 -30.296 6.302 0.176 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -29.234 4.928 1.656 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -28.586 3.961 0.346 1.00 0.00 H new ATOM 1167 N THR A 95 -26.491 5.120 1.486 1.00 0.00 N ATOM 1168 CA THR A 95 -25.197 5.725 1.665 1.00 0.00 C ATOM 1169 C THR A 95 -24.197 4.678 2.143 1.00 0.00 C ATOM 1170 O THR A 95 -24.493 3.470 2.137 1.00 0.00 O ATOM 1171 CB THR A 95 -25.271 6.932 2.644 1.00 0.00 C ATOM 1172 OG1 THR A 95 -24.021 7.661 2.706 1.00 0.00 O ATOM 1173 CG2 THR A 95 -25.672 6.466 3.999 1.00 0.00 C ATOM 0 H THR A 95 -26.597 4.211 1.937 1.00 0.00 H new ATOM 0 HA THR A 95 -24.856 6.113 0.705 1.00 0.00 H new ATOM 0 HB THR A 95 -26.025 7.621 2.263 1.00 0.00 H new ATOM 0 HG1 THR A 95 -24.110 8.411 3.330 1.00 0.00 H new ATOM 0 HG21 THR A 95 -25.721 7.318 4.677 1.00 0.00 H new ATOM 0 HG22 THR A 95 -26.650 5.989 3.945 1.00 0.00 H new ATOM 0 HG23 THR A 95 -24.939 5.749 4.369 1.00 0.00 H new ATOM 1181 N PHE A 96 -23.051 5.123 2.551 1.00 0.00 N ATOM 1182 CA PHE A 96 -21.999 4.244 2.983 1.00 0.00 C ATOM 1183 C PHE A 96 -21.242 4.822 4.159 1.00 0.00 C ATOM 1184 O PHE A 96 -21.316 6.027 4.428 1.00 0.00 O ATOM 1185 CB PHE A 96 -21.026 3.895 1.835 1.00 0.00 C ATOM 1186 CG PHE A 96 -20.320 5.070 1.235 1.00 0.00 C ATOM 1187 CD1 PHE A 96 -19.156 5.566 1.806 1.00 0.00 C ATOM 1188 CD2 PHE A 96 -20.822 5.683 0.106 1.00 0.00 C ATOM 1189 CE1 PHE A 96 -18.515 6.649 1.260 1.00 0.00 C ATOM 1190 CE2 PHE A 96 -20.186 6.764 -0.443 1.00 0.00 C ATOM 1191 CZ PHE A 96 -19.034 7.249 0.134 1.00 0.00 C ATOM 0 H PHE A 96 -22.812 6.114 2.596 1.00 0.00 H new ATOM 0 HA PHE A 96 -22.479 3.319 3.304 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -20.281 3.193 2.209 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -21.581 3.382 1.050 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -18.751 5.094 2.689 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -21.726 5.306 -0.350 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -17.610 7.029 1.710 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -20.588 7.236 -1.328 1.00 0.00 H new ATOM 0 HZ PHE A 96 -18.535 8.104 -0.298 1.00 0.00 H new ATOM 1201 N THR A 97 -20.557 3.965 4.868 1.00 0.00 N ATOM 1202 CA THR A 97 -19.717 4.360 5.972 1.00 0.00 C ATOM 1203 C THR A 97 -18.277 4.077 5.610 1.00 0.00 C ATOM 1204 O THR A 97 -18.014 3.491 4.577 1.00 0.00 O ATOM 1205 CB THR A 97 -20.070 3.487 7.166 1.00 0.00 C ATOM 1206 OG1 THR A 97 -19.847 2.165 6.789 1.00 0.00 O ATOM 1207 CG2 THR A 97 -21.515 3.677 7.597 1.00 0.00 C ATOM 0 H THR A 97 -20.565 2.960 4.695 1.00 0.00 H new ATOM 0 HA THR A 97 -19.858 5.417 6.196 1.00 0.00 H new ATOM 0 HB THR A 97 -19.452 3.764 8.020 1.00 0.00 H new ATOM 0 HG1 THR A 97 -18.900 1.945 6.912 1.00 0.00 H new ATOM 0 HG21 THR A 97 -21.727 3.036 8.453 1.00 0.00 H new ATOM 0 HG22 THR A 97 -21.678 4.718 7.875 1.00 0.00 H new ATOM 0 HG23 THR A 97 -22.178 3.413 6.773 1.00 0.00 H new ATOM 1215 N LEU A 98 -17.365 4.508 6.448 1.00 0.00 N ATOM 1216 CA LEU A 98 -15.966 4.178 6.327 1.00 0.00 C ATOM 1217 C LEU A 98 -15.428 3.947 7.697 1.00 0.00 C ATOM 1218 O LEU A 98 -15.433 4.842 8.534 1.00 0.00 O ATOM 1219 CB LEU A 98 -15.174 5.271 5.658 1.00 0.00 C ATOM 1220 CG LEU A 98 -15.541 5.588 4.224 1.00 0.00 C ATOM 1221 CD1 LEU A 98 -14.730 6.750 3.759 1.00 0.00 C ATOM 1222 CD2 LEU A 98 -15.289 4.391 3.330 1.00 0.00 C ATOM 0 H LEU A 98 -17.578 5.107 7.246 1.00 0.00 H new ATOM 0 HA LEU A 98 -15.874 3.288 5.704 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -15.283 6.181 6.248 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -14.120 4.996 5.688 1.00 0.00 H new ATOM 0 HG LEU A 98 -16.602 5.833 4.173 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -14.989 6.984 2.726 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -14.937 7.614 4.390 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -13.670 6.502 3.820 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -15.559 4.640 2.304 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -14.234 4.121 3.372 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -15.892 3.549 3.670 1.00 0.00 H new ATOM 1234 N THR A 99 -14.976 2.775 7.927 1.00 0.00 N ATOM 1235 CA THR A 99 -14.530 2.403 9.272 1.00 0.00 C ATOM 1236 C THR A 99 -13.017 2.153 9.337 1.00 0.00 C ATOM 1237 O THR A 99 -12.437 2.014 10.417 1.00 0.00 O ATOM 1238 CB THR A 99 -15.340 1.185 9.840 1.00 0.00 C ATOM 1239 OG1 THR A 99 -15.053 0.952 11.235 1.00 0.00 O ATOM 1240 CG2 THR A 99 -15.022 -0.067 9.063 1.00 0.00 C ATOM 0 H THR A 99 -14.893 2.039 7.226 1.00 0.00 H new ATOM 0 HA THR A 99 -14.736 3.259 9.914 1.00 0.00 H new ATOM 0 HB THR A 99 -16.397 1.431 9.738 1.00 0.00 H new ATOM 0 HG1 THR A 99 -14.119 1.183 11.420 1.00 0.00 H new ATOM 0 HG21 THR A 99 -15.592 -0.902 9.470 1.00 0.00 H new ATOM 0 HG22 THR A 99 -15.287 0.078 8.016 1.00 0.00 H new ATOM 0 HG23 THR A 99 -13.956 -0.283 9.141 1.00 0.00 H new ATOM 1248 N GLY A 100 -12.381 2.149 8.199 1.00 0.00 N ATOM 1249 CA GLY A 100 -10.961 1.904 8.169 1.00 0.00 C ATOM 1250 C GLY A 100 -10.237 3.123 7.714 1.00 0.00 C ATOM 1251 O GLY A 100 -9.173 3.046 7.108 1.00 0.00 O ATOM 0 H GLY A 100 -12.814 2.310 7.289 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.614 1.615 9.161 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.742 1.072 7.500 1.00 0.00 H new ATOM 1255 N GLY A 101 -10.822 4.246 7.991 1.00 0.00 N ATOM 1256 CA GLY A 101 -10.310 5.499 7.561 1.00 0.00 C ATOM 1257 C GLY A 101 -11.453 6.425 7.295 1.00 0.00 C ATOM 1258 O GLY A 101 -12.606 6.084 7.591 1.00 0.00 O ATOM 0 H GLY A 101 -11.684 4.314 8.532 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -9.654 5.920 8.323 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -9.711 5.372 6.660 1.00 0.00 H new ATOM 1262 N ASN A 102 -11.170 7.555 6.724 1.00 0.00 N ATOM 1263 CA ASN A 102 -12.192 8.551 6.460 1.00 0.00 C ATOM 1264 C ASN A 102 -12.109 8.998 4.996 1.00 0.00 C ATOM 1265 O ASN A 102 -12.791 9.912 4.552 1.00 0.00 O ATOM 1266 CB ASN A 102 -12.002 9.726 7.454 1.00 0.00 C ATOM 1267 CG ASN A 102 -13.058 10.825 7.376 1.00 0.00 C ATOM 1268 OD1 ASN A 102 -12.887 11.831 6.683 1.00 0.00 O ATOM 1269 ND2 ASN A 102 -14.147 10.657 8.084 1.00 0.00 N ATOM 0 H ASN A 102 -10.232 7.823 6.425 1.00 0.00 H new ATOM 0 HA ASN A 102 -13.190 8.140 6.610 1.00 0.00 H new ATOM 0 HB2 ASN A 102 -11.993 9.325 8.467 1.00 0.00 H new ATOM 0 HB3 ASN A 102 -11.023 10.173 7.280 1.00 0.00 H new ATOM 0 HD21 ASN A 102 -14.879 11.368 8.071 1.00 0.00 H new ATOM 0 HD22 ASN A 102 -14.263 9.816 8.649 1.00 0.00 H new ATOM 1276 N VAL A 103 -11.325 8.270 4.224 1.00 0.00 N ATOM 1277 CA VAL A 103 -11.094 8.592 2.824 1.00 0.00 C ATOM 1278 C VAL A 103 -11.079 7.306 2.055 1.00 0.00 C ATOM 1279 O VAL A 103 -11.144 6.235 2.658 1.00 0.00 O ATOM 1280 CB VAL A 103 -9.747 9.364 2.578 1.00 0.00 C ATOM 1281 CG1 VAL A 103 -9.731 10.715 3.280 1.00 0.00 C ATOM 1282 CG2 VAL A 103 -8.547 8.534 3.004 1.00 0.00 C ATOM 0 H VAL A 103 -10.830 7.439 4.547 1.00 0.00 H new ATOM 0 HA VAL A 103 -11.893 9.256 2.494 1.00 0.00 H new ATOM 0 HB VAL A 103 -9.679 9.543 1.505 1.00 0.00 H new ATOM 0 HG11 VAL A 103 -8.783 11.216 3.084 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -10.550 11.329 2.905 1.00 0.00 H new ATOM 0 HG13 VAL A 103 -9.849 10.569 4.354 1.00 0.00 H new ATOM 0 HG21 VAL A 103 -7.632 9.097 2.821 1.00 0.00 H new ATOM 0 HG22 VAL A 103 -8.624 8.302 4.066 1.00 0.00 H new ATOM 0 HG23 VAL A 103 -8.524 7.607 2.431 1.00 0.00 H new ATOM 1292 N PHE A 104 -10.990 7.374 0.761 1.00 0.00 N ATOM 1293 CA PHE A 104 -10.966 6.177 -0.021 1.00 0.00 C ATOM 1294 C PHE A 104 -9.557 5.683 -0.196 1.00 0.00 C ATOM 1295 O PHE A 104 -8.863 6.068 -1.140 1.00 0.00 O ATOM 1296 CB PHE A 104 -11.642 6.366 -1.372 1.00 0.00 C ATOM 1297 CG PHE A 104 -13.071 6.773 -1.270 1.00 0.00 C ATOM 1298 CD1 PHE A 104 -13.951 6.039 -0.502 1.00 0.00 C ATOM 1299 CD2 PHE A 104 -13.531 7.899 -1.927 1.00 0.00 C ATOM 1300 CE1 PHE A 104 -15.259 6.411 -0.390 1.00 0.00 C ATOM 1301 CE2 PHE A 104 -14.844 8.280 -1.821 1.00 0.00 C ATOM 1302 CZ PHE A 104 -15.712 7.537 -1.052 1.00 0.00 C ATOM 0 H PHE A 104 -10.933 8.241 0.227 1.00 0.00 H new ATOM 0 HA PHE A 104 -11.534 5.423 0.524 1.00 0.00 H new ATOM 0 HB2 PHE A 104 -11.097 7.121 -1.939 1.00 0.00 H new ATOM 0 HB3 PHE A 104 -11.577 5.435 -1.935 1.00 0.00 H new ATOM 0 HD1 PHE A 104 -13.600 5.159 0.017 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -12.851 8.483 -2.529 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -15.938 5.828 0.214 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -15.196 9.160 -2.339 1.00 0.00 H new ATOM 0 HZ PHE A 104 -16.747 7.834 -0.966 1.00 0.00 H new ATOM 1312 N GLU A 105 -9.120 4.887 0.736 1.00 0.00 N ATOM 1313 CA GLU A 105 -7.826 4.291 0.667 1.00 0.00 C ATOM 1314 C GLU A 105 -7.927 2.829 1.062 1.00 0.00 C ATOM 1315 O GLU A 105 -8.848 2.441 1.823 1.00 0.00 O ATOM 1316 CB GLU A 105 -6.794 5.020 1.546 1.00 0.00 C ATOM 1317 CG GLU A 105 -7.074 4.962 3.059 1.00 0.00 C ATOM 1318 CD GLU A 105 -5.905 5.432 3.914 1.00 0.00 C ATOM 1319 OE1 GLU A 105 -5.584 6.644 3.926 1.00 0.00 O ATOM 1320 OE2 GLU A 105 -5.264 4.579 4.600 1.00 0.00 O ATOM 0 H GLU A 105 -9.656 4.635 1.566 1.00 0.00 H new ATOM 0 HA GLU A 105 -7.472 4.375 -0.360 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -5.810 4.591 1.357 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -6.751 6.065 1.239 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.946 5.576 3.282 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.326 3.938 3.334 1.00 0.00 H new ATOM 1327 N TYR A 106 -7.039 2.027 0.493 1.00 0.00 N ATOM 1328 CA TYR A 106 -6.937 0.592 0.765 1.00 0.00 C ATOM 1329 C TYR A 106 -6.989 0.314 2.264 1.00 0.00 C ATOM 1330 O TYR A 106 -6.132 0.766 3.028 1.00 0.00 O ATOM 1331 CB TYR A 106 -5.645 0.040 0.124 1.00 0.00 C ATOM 1332 CG TYR A 106 -5.272 -1.393 0.473 1.00 0.00 C ATOM 1333 CD1 TYR A 106 -5.875 -2.456 -0.158 1.00 0.00 C ATOM 1334 CD2 TYR A 106 -4.289 -1.672 1.422 1.00 0.00 C ATOM 1335 CE1 TYR A 106 -5.528 -3.759 0.138 1.00 0.00 C ATOM 1336 CE2 TYR A 106 -3.933 -2.971 1.721 1.00 0.00 C ATOM 1337 CZ TYR A 106 -4.559 -4.011 1.073 1.00 0.00 C ATOM 1338 OH TYR A 106 -4.208 -5.315 1.361 1.00 0.00 O ATOM 0 H TYR A 106 -6.353 2.358 -0.185 1.00 0.00 H new ATOM 0 HA TYR A 106 -7.790 0.079 0.321 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -5.744 0.113 -0.959 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -4.817 0.688 0.413 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -6.636 -2.267 -0.901 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -3.798 -0.857 1.932 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -6.019 -4.578 -0.366 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -3.169 -3.170 2.458 1.00 0.00 H new ATOM 0 HH TYR A 106 -3.506 -5.321 2.044 1.00 0.00 H new ATOM 1348 N GLY A 107 -8.004 -0.390 2.680 1.00 0.00 N ATOM 1349 CA GLY A 107 -8.163 -0.673 4.074 1.00 0.00 C ATOM 1350 C GLY A 107 -9.505 -0.220 4.612 1.00 0.00 C ATOM 1351 O GLY A 107 -9.958 -0.728 5.640 1.00 0.00 O ATOM 0 H GLY A 107 -8.729 -0.776 2.075 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -8.053 -1.745 4.238 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -7.367 -0.182 4.634 1.00 0.00 H new ATOM 1355 N VAL A 108 -10.144 0.750 3.960 1.00 0.00 N ATOM 1356 CA VAL A 108 -11.446 1.180 4.439 1.00 0.00 C ATOM 1357 C VAL A 108 -12.525 0.199 4.036 1.00 0.00 C ATOM 1358 O VAL A 108 -12.504 -0.381 2.933 1.00 0.00 O ATOM 1359 CB VAL A 108 -11.890 2.640 4.033 1.00 0.00 C ATOM 1360 CG1 VAL A 108 -10.922 3.691 4.450 1.00 0.00 C ATOM 1361 CG2 VAL A 108 -12.261 2.774 2.575 1.00 0.00 C ATOM 0 H VAL A 108 -9.795 1.233 3.132 1.00 0.00 H new ATOM 0 HA VAL A 108 -11.322 1.205 5.522 1.00 0.00 H new ATOM 0 HB VAL A 108 -12.803 2.813 4.603 1.00 0.00 H new ATOM 0 HG11 VAL A 108 -11.290 4.669 4.139 1.00 0.00 H new ATOM 0 HG12 VAL A 108 -10.810 3.673 5.534 1.00 0.00 H new ATOM 0 HG13 VAL A 108 -9.956 3.502 3.983 1.00 0.00 H new ATOM 0 HG21 VAL A 108 -12.556 3.803 2.368 1.00 0.00 H new ATOM 0 HG22 VAL A 108 -11.404 2.510 1.956 1.00 0.00 H new ATOM 0 HG23 VAL A 108 -13.092 2.106 2.348 1.00 0.00 H new ATOM 1371 N LYS A 109 -13.404 -0.036 4.948 1.00 0.00 N ATOM 1372 CA LYS A 109 -14.568 -0.812 4.699 1.00 0.00 C ATOM 1373 C LYS A 109 -15.699 0.179 4.548 1.00 0.00 C ATOM 1374 O LYS A 109 -15.936 0.977 5.468 1.00 0.00 O ATOM 1375 CB LYS A 109 -14.857 -1.734 5.889 1.00 0.00 C ATOM 1376 CG LYS A 109 -15.988 -2.709 5.654 1.00 0.00 C ATOM 1377 CD LYS A 109 -16.326 -3.561 6.893 1.00 0.00 C ATOM 1378 CE LYS A 109 -15.347 -4.728 7.151 1.00 0.00 C ATOM 1379 NZ LYS A 109 -13.987 -4.329 7.604 1.00 0.00 N ATOM 0 H LYS A 109 -13.332 0.312 5.904 1.00 0.00 H new ATOM 0 HA LYS A 109 -14.446 -1.436 3.814 1.00 0.00 H new ATOM 0 HB2 LYS A 109 -13.953 -2.294 6.129 1.00 0.00 H new ATOM 0 HB3 LYS A 109 -15.094 -1.122 6.760 1.00 0.00 H new ATOM 0 HG2 LYS A 109 -16.877 -2.157 5.348 1.00 0.00 H new ATOM 0 HG3 LYS A 109 -15.723 -3.370 4.829 1.00 0.00 H new ATOM 0 HD2 LYS A 109 -16.341 -2.914 7.770 1.00 0.00 H new ATOM 0 HD3 LYS A 109 -17.332 -3.965 6.778 1.00 0.00 H new ATOM 0 HE2 LYS A 109 -15.783 -5.387 7.902 1.00 0.00 H new ATOM 0 HE3 LYS A 109 -15.251 -5.309 6.234 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 -13.618 -5.042 8.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 -13.354 -4.258 6.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 -14.037 -3.407 8.083 1.00 0.00 H new ATOM 1393 N ALA A 110 -16.342 0.175 3.413 1.00 0.00 N ATOM 1394 CA ALA A 110 -17.428 1.070 3.159 1.00 0.00 C ATOM 1395 C ALA A 110 -18.733 0.323 3.328 1.00 0.00 C ATOM 1396 O ALA A 110 -19.116 -0.449 2.438 1.00 0.00 O ATOM 1397 CB ALA A 110 -17.333 1.644 1.750 1.00 0.00 C ATOM 0 H ALA A 110 -16.124 -0.452 2.639 1.00 0.00 H new ATOM 0 HA ALA A 110 -17.383 1.898 3.867 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -18.168 2.322 1.576 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.395 2.188 1.641 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -17.368 0.832 1.023 1.00 0.00 H new ATOM 1403 N VAL A 111 -19.404 0.495 4.451 1.00 0.00 N ATOM 1404 CA VAL A 111 -20.624 -0.265 4.677 1.00 0.00 C ATOM 1405 C VAL A 111 -21.793 0.436 4.020 1.00 0.00 C ATOM 1406 O VAL A 111 -21.866 1.632 4.032 1.00 0.00 O ATOM 1407 CB VAL A 111 -20.921 -0.595 6.185 1.00 0.00 C ATOM 1408 CG1 VAL A 111 -19.701 -0.882 7.043 1.00 0.00 C ATOM 1409 CG2 VAL A 111 -22.002 0.236 6.869 1.00 0.00 C ATOM 0 H VAL A 111 -19.139 1.133 5.201 1.00 0.00 H new ATOM 0 HA VAL A 111 -20.470 -1.239 4.213 1.00 0.00 H new ATOM 0 HB VAL A 111 -21.408 -1.566 6.092 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -20.017 -1.097 8.064 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -19.167 -1.742 6.639 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -19.043 -0.013 7.042 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -22.111 -0.089 7.904 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -21.720 1.289 6.847 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -22.949 0.103 6.346 1.00 0.00 H new ATOM 1419 N TYR A 112 -22.667 -0.307 3.424 1.00 0.00 N ATOM 1420 CA TYR A 112 -23.792 0.256 2.726 1.00 0.00 C ATOM 1421 C TYR A 112 -24.973 0.225 3.622 1.00 0.00 C ATOM 1422 O TYR A 112 -25.458 -0.835 4.002 1.00 0.00 O ATOM 1423 CB TYR A 112 -24.063 -0.510 1.417 1.00 0.00 C ATOM 1424 CG TYR A 112 -25.184 0.044 0.526 1.00 0.00 C ATOM 1425 CD1 TYR A 112 -26.532 -0.159 0.833 1.00 0.00 C ATOM 1426 CD2 TYR A 112 -24.886 0.733 -0.637 1.00 0.00 C ATOM 1427 CE1 TYR A 112 -27.532 0.312 0.013 1.00 0.00 C ATOM 1428 CE2 TYR A 112 -25.884 1.211 -1.461 1.00 0.00 C ATOM 1429 CZ TYR A 112 -27.206 0.995 -1.134 1.00 0.00 C ATOM 1430 OH TYR A 112 -28.203 1.469 -1.956 1.00 0.00 O ATOM 0 H TYR A 112 -22.627 -1.326 3.403 1.00 0.00 H new ATOM 0 HA TYR A 112 -23.576 1.289 2.454 1.00 0.00 H new ATOM 0 HB2 TYR A 112 -23.142 -0.530 0.835 1.00 0.00 H new ATOM 0 HB3 TYR A 112 -24.304 -1.543 1.668 1.00 0.00 H new ATOM 0 HD1 TYR A 112 -26.795 -0.697 1.732 1.00 0.00 H new ATOM 0 HD2 TYR A 112 -23.853 0.900 -0.904 1.00 0.00 H new ATOM 0 HE1 TYR A 112 -28.568 0.146 0.270 1.00 0.00 H new ATOM 0 HE2 TYR A 112 -25.630 1.753 -2.360 1.00 0.00 H new ATOM 0 HH TYR A 112 -27.825 2.114 -2.590 1.00 0.00 H new ATOM 1440 N THR A 113 -25.406 1.367 3.984 1.00 0.00 N ATOM 1441 CA THR A 113 -26.531 1.503 4.810 1.00 0.00 C ATOM 1442 C THR A 113 -27.575 2.263 4.014 1.00 0.00 C ATOM 1443 O THR A 113 -27.246 2.936 3.030 1.00 0.00 O ATOM 1444 CB THR A 113 -26.160 2.275 6.079 1.00 0.00 C ATOM 1445 OG1 THR A 113 -24.902 1.785 6.576 1.00 0.00 O ATOM 1446 CG2 THR A 113 -27.192 2.036 7.144 1.00 0.00 C ATOM 0 H THR A 113 -24.978 2.251 3.708 1.00 0.00 H new ATOM 0 HA THR A 113 -26.913 0.529 5.116 1.00 0.00 H new ATOM 0 HB THR A 113 -26.102 3.337 5.840 1.00 0.00 H new ATOM 0 HG1 THR A 113 -24.657 2.276 7.388 1.00 0.00 H new ATOM 0 HG21 THR A 113 -26.921 2.589 8.044 1.00 0.00 H new ATOM 0 HG22 THR A 113 -28.166 2.374 6.790 1.00 0.00 H new ATOM 0 HG23 THR A 113 -27.239 0.971 7.373 1.00 0.00 H new ATOM 1454 N CYS A 114 -28.795 2.157 4.391 1.00 0.00 N ATOM 1455 CA CYS A 114 -29.821 2.820 3.666 1.00 0.00 C ATOM 1456 C CYS A 114 -30.772 3.503 4.607 1.00 0.00 C ATOM 1457 O CYS A 114 -30.878 4.735 4.603 1.00 0.00 O ATOM 1458 CB CYS A 114 -30.544 1.857 2.737 1.00 0.00 C ATOM 1459 SG CYS A 114 -31.809 2.645 1.703 1.00 0.00 S ATOM 0 H CYS A 114 -29.111 1.618 5.197 1.00 0.00 H new ATOM 0 HA CYS A 114 -29.362 3.586 3.041 1.00 0.00 H new ATOM 0 HB2 CYS A 114 -29.812 1.371 2.092 1.00 0.00 H new ATOM 0 HB3 CYS A 114 -31.012 1.074 3.334 1.00 0.00 H new ATOM 1464 N ASN A 115 -31.432 2.732 5.442 1.00 0.00 N ATOM 1465 CA ASN A 115 -32.371 3.286 6.373 1.00 0.00 C ATOM 1466 C ASN A 115 -32.480 2.306 7.524 1.00 0.00 C ATOM 1467 O ASN A 115 -31.689 1.366 7.598 1.00 0.00 O ATOM 1468 CB ASN A 115 -33.733 3.475 5.682 1.00 0.00 C ATOM 1469 CG ASN A 115 -34.570 4.590 6.284 1.00 0.00 C ATOM 1470 OD1 ASN A 115 -34.510 4.868 7.477 1.00 0.00 O ATOM 1471 ND2 ASN A 115 -35.331 5.249 5.455 1.00 0.00 N ATOM 0 H ASN A 115 -31.331 1.718 5.490 1.00 0.00 H new ATOM 0 HA ASN A 115 -32.047 4.261 6.736 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -33.569 3.685 4.625 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -34.292 2.541 5.738 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -35.902 6.024 5.793 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -35.355 4.989 4.469 1.00 0.00 H new ATOM 1478 N GLU A 116 -33.420 2.502 8.394 1.00 0.00 N ATOM 1479 CA GLU A 116 -33.610 1.633 9.522 1.00 0.00 C ATOM 1480 C GLU A 116 -34.289 0.347 9.066 1.00 0.00 C ATOM 1481 O GLU A 116 -33.780 -0.765 9.273 1.00 0.00 O ATOM 1482 CB GLU A 116 -34.450 2.356 10.559 1.00 0.00 C ATOM 1483 CG GLU A 116 -34.646 1.603 11.856 1.00 0.00 C ATOM 1484 CD GLU A 116 -35.498 2.369 12.813 1.00 0.00 C ATOM 1485 OE1 GLU A 116 -36.727 2.232 12.767 1.00 0.00 O ATOM 1486 OE2 GLU A 116 -34.945 3.156 13.626 1.00 0.00 O ATOM 0 H GLU A 116 -34.085 3.274 8.345 1.00 0.00 H new ATOM 0 HA GLU A 116 -32.650 1.370 9.966 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -33.982 3.315 10.780 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -35.428 2.570 10.128 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -35.107 0.637 11.650 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -33.676 1.403 12.311 1.00 0.00 H new ATOM 1493 N GLY A 117 -35.398 0.519 8.394 1.00 0.00 N ATOM 1494 CA GLY A 117 -36.176 -0.600 7.913 1.00 0.00 C ATOM 1495 C GLY A 117 -35.629 -1.183 6.639 1.00 0.00 C ATOM 1496 O GLY A 117 -36.012 -2.266 6.237 1.00 0.00 O ATOM 0 H GLY A 117 -35.788 1.433 8.164 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -36.203 -1.374 8.680 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -37.204 -0.278 7.748 1.00 0.00 H new ATOM 1500 N TYR A 118 -34.727 -0.474 6.019 1.00 0.00 N ATOM 1501 CA TYR A 118 -34.130 -0.910 4.778 1.00 0.00 C ATOM 1502 C TYR A 118 -32.678 -1.236 4.968 1.00 0.00 C ATOM 1503 O TYR A 118 -31.887 -0.365 5.378 1.00 0.00 O ATOM 1504 CB TYR A 118 -34.212 0.172 3.706 1.00 0.00 C ATOM 1505 CG TYR A 118 -35.592 0.494 3.195 1.00 0.00 C ATOM 1506 CD1 TYR A 118 -36.431 1.361 3.875 1.00 0.00 C ATOM 1507 CD2 TYR A 118 -36.049 -0.074 2.017 1.00 0.00 C ATOM 1508 CE1 TYR A 118 -37.686 1.653 3.395 1.00 0.00 C ATOM 1509 CE2 TYR A 118 -37.304 0.212 1.529 1.00 0.00 C ATOM 1510 CZ TYR A 118 -38.120 1.075 2.222 1.00 0.00 C ATOM 1511 OH TYR A 118 -39.381 1.373 1.737 1.00 0.00 O ATOM 0 H TYR A 118 -34.382 0.424 6.357 1.00 0.00 H new ATOM 0 HA TYR A 118 -34.687 -1.793 4.463 1.00 0.00 H new ATOM 0 HB2 TYR A 118 -33.772 1.086 4.106 1.00 0.00 H new ATOM 0 HB3 TYR A 118 -33.596 -0.135 2.861 1.00 0.00 H new ATOM 0 HD1 TYR A 118 -36.095 1.814 4.796 1.00 0.00 H new ATOM 0 HD2 TYR A 118 -35.410 -0.753 1.472 1.00 0.00 H new ATOM 0 HE1 TYR A 118 -38.329 2.332 3.935 1.00 0.00 H new ATOM 0 HE2 TYR A 118 -37.645 -0.238 0.609 1.00 0.00 H new ATOM 0 HH TYR A 118 -39.534 0.885 0.901 1.00 0.00 H new ATOM 1521 N GLN A 119 -32.310 -2.447 4.661 1.00 0.00 N ATOM 1522 CA GLN A 119 -30.938 -2.798 4.641 1.00 0.00 C ATOM 1523 C GLN A 119 -30.564 -2.828 3.224 1.00 0.00 C ATOM 1524 O GLN A 119 -30.655 -1.790 2.540 1.00 0.00 O ATOM 1525 CB GLN A 119 -30.598 -4.136 5.315 1.00 0.00 C ATOM 1526 CG GLN A 119 -30.804 -4.149 6.822 1.00 0.00 C ATOM 1527 CD GLN A 119 -30.427 -5.471 7.454 1.00 0.00 C ATOM 1528 OE1 GLN A 119 -29.286 -5.681 7.877 1.00 0.00 O ATOM 1529 NE2 GLN A 119 -31.358 -6.374 7.511 1.00 0.00 N ATOM 0 H GLN A 119 -32.951 -3.203 4.422 1.00 0.00 H new ATOM 0 HA GLN A 119 -30.379 -2.067 5.225 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -31.211 -4.920 4.870 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -29.558 -4.384 5.100 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -30.210 -3.354 7.272 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -31.849 -3.931 7.043 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -32.291 -6.168 7.153 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -31.157 -7.289 7.914 1.00 0.00 H new ATOM 1538 N LEU A 120 -30.214 -3.984 2.718 1.00 0.00 N ATOM 1539 CA LEU A 120 -29.854 -4.075 1.434 1.00 0.00 C ATOM 1540 C LEU A 120 -29.899 -5.555 1.015 1.00 0.00 C ATOM 1541 O LEU A 120 -29.874 -6.454 1.881 1.00 0.00 O ATOM 1542 CB LEU A 120 -28.465 -3.482 1.375 1.00 0.00 C ATOM 1543 CG LEU A 120 -27.293 -4.322 1.793 1.00 0.00 C ATOM 1544 CD1 LEU A 120 -26.073 -3.500 1.835 1.00 0.00 C ATOM 1545 CD2 LEU A 120 -27.360 -5.048 3.090 1.00 0.00 C ATOM 0 H LEU A 120 -30.190 -4.862 3.237 1.00 0.00 H new ATOM 0 HA LEU A 120 -30.511 -3.544 0.746 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -28.289 -3.160 0.349 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -28.464 -2.585 1.995 1.00 0.00 H new ATOM 0 HG LEU A 120 -27.297 -5.098 1.027 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -25.228 -4.118 2.139 1.00 0.00 H new ATOM 0 HD12 LEU A 120 -25.881 -3.084 0.846 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -26.205 -2.689 2.551 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -26.436 -5.606 3.243 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -27.489 -4.332 3.902 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -28.203 -5.738 3.077 1.00 0.00 H new ATOM 1557 N LEU A 121 -30.048 -5.797 -0.251 1.00 0.00 N ATOM 1558 CA LEU A 121 -29.978 -7.116 -0.792 1.00 0.00 C ATOM 1559 C LEU A 121 -28.572 -7.421 -1.169 1.00 0.00 C ATOM 1560 O LEU A 121 -28.025 -6.903 -2.163 1.00 0.00 O ATOM 1561 CB LEU A 121 -30.927 -7.329 -1.966 1.00 0.00 C ATOM 1562 CG LEU A 121 -32.403 -7.429 -1.610 1.00 0.00 C ATOM 1563 CD1 LEU A 121 -33.245 -7.542 -2.859 1.00 0.00 C ATOM 1564 CD2 LEU A 121 -32.664 -8.619 -0.688 1.00 0.00 C ATOM 0 H LEU A 121 -30.224 -5.072 -0.946 1.00 0.00 H new ATOM 0 HA LEU A 121 -30.306 -7.811 -0.019 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -30.796 -6.506 -2.669 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -30.634 -8.242 -2.485 1.00 0.00 H new ATOM 0 HG LEU A 121 -32.683 -6.518 -1.081 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -34.297 -7.612 -2.583 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -33.091 -6.661 -3.482 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -32.955 -8.434 -3.414 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -33.726 -8.668 -0.449 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -32.362 -9.539 -1.188 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -32.090 -8.500 0.231 1.00 0.00 H new ATOM 1576 N GLY A 122 -27.988 -8.192 -0.345 1.00 0.00 N ATOM 1577 CA GLY A 122 -26.646 -8.601 -0.483 1.00 0.00 C ATOM 1578 C GLY A 122 -26.227 -9.218 0.795 1.00 0.00 C ATOM 1579 O GLY A 122 -26.806 -8.910 1.840 1.00 0.00 O ATOM 0 H GLY A 122 -28.448 -8.574 0.481 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -26.546 -9.313 -1.302 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -26.010 -7.749 -0.722 1.00 0.00 H new ATOM 1583 N GLU A 123 -25.262 -10.073 0.756 1.00 0.00 N ATOM 1584 CA GLU A 123 -24.845 -10.764 1.945 1.00 0.00 C ATOM 1585 C GLU A 123 -23.718 -10.018 2.590 1.00 0.00 C ATOM 1586 O GLU A 123 -23.404 -10.201 3.773 1.00 0.00 O ATOM 1587 CB GLU A 123 -24.440 -12.185 1.609 1.00 0.00 C ATOM 1588 CG GLU A 123 -25.586 -13.007 1.067 1.00 0.00 C ATOM 1589 CD GLU A 123 -26.689 -13.200 2.075 1.00 0.00 C ATOM 1590 OE1 GLU A 123 -26.585 -14.111 2.900 1.00 0.00 O ATOM 1591 OE2 GLU A 123 -27.682 -12.431 2.055 1.00 0.00 O ATOM 0 H GLU A 123 -24.741 -10.316 -0.086 1.00 0.00 H new ATOM 0 HA GLU A 123 -25.676 -10.811 2.649 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -23.634 -12.165 0.875 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -24.044 -12.666 2.503 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -25.991 -12.519 0.180 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -25.212 -13.981 0.752 1.00 0.00 H new ATOM 1598 N ILE A 124 -23.120 -9.182 1.815 1.00 0.00 N ATOM 1599 CA ILE A 124 -22.058 -8.370 2.244 1.00 0.00 C ATOM 1600 C ILE A 124 -22.579 -6.967 2.221 1.00 0.00 C ATOM 1601 O ILE A 124 -22.784 -6.387 1.158 1.00 0.00 O ATOM 1602 CB ILE A 124 -20.830 -8.509 1.306 1.00 0.00 C ATOM 1603 CG1 ILE A 124 -20.406 -9.989 1.187 1.00 0.00 C ATOM 1604 CG2 ILE A 124 -19.668 -7.660 1.800 1.00 0.00 C ATOM 1605 CD1 ILE A 124 -19.999 -10.637 2.494 1.00 0.00 C ATOM 0 H ILE A 124 -23.372 -9.047 0.836 1.00 0.00 H new ATOM 0 HA ILE A 124 -21.721 -8.660 3.239 1.00 0.00 H new ATOM 0 HB ILE A 124 -21.116 -8.149 0.318 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -21.232 -10.556 0.758 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -19.573 -10.059 0.487 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -18.820 -7.776 1.125 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -19.969 -6.613 1.829 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -19.381 -7.983 2.801 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -19.718 -11.674 2.314 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -19.151 -10.099 2.918 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -20.835 -10.604 3.192 1.00 0.00 H new ATOM 1617 N ASN A 125 -22.835 -6.432 3.379 1.00 0.00 N ATOM 1618 CA ASN A 125 -23.439 -5.113 3.492 1.00 0.00 C ATOM 1619 C ASN A 125 -22.398 -4.019 3.396 1.00 0.00 C ATOM 1620 O ASN A 125 -22.585 -2.923 3.902 1.00 0.00 O ATOM 1621 CB ASN A 125 -24.227 -4.965 4.805 1.00 0.00 C ATOM 1622 CG ASN A 125 -23.359 -4.958 6.065 1.00 0.00 C ATOM 1623 OD1 ASN A 125 -22.308 -5.599 6.124 1.00 0.00 O ATOM 1624 ND2 ASN A 125 -23.777 -4.227 7.062 1.00 0.00 N ATOM 0 H ASN A 125 -22.637 -6.884 4.272 1.00 0.00 H new ATOM 0 HA ASN A 125 -24.132 -5.011 2.657 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -24.800 -4.039 4.768 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -24.945 -5.782 4.878 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -23.229 -4.175 7.921 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -24.651 -3.708 6.982 1.00 0.00 H new ATOM 1631 N TYR A 126 -21.362 -4.278 2.666 1.00 0.00 N ATOM 1632 CA TYR A 126 -20.249 -3.384 2.617 1.00 0.00 C ATOM 1633 C TYR A 126 -19.363 -3.689 1.444 1.00 0.00 C ATOM 1634 O TYR A 126 -19.611 -4.608 0.674 1.00 0.00 O ATOM 1635 CB TYR A 126 -19.436 -3.463 3.949 1.00 0.00 C ATOM 1636 CG TYR A 126 -18.677 -4.781 4.191 1.00 0.00 C ATOM 1637 CD1 TYR A 126 -17.479 -5.031 3.540 1.00 0.00 C ATOM 1638 CD2 TYR A 126 -19.147 -5.749 5.072 1.00 0.00 C ATOM 1639 CE1 TYR A 126 -16.778 -6.180 3.739 1.00 0.00 C ATOM 1640 CE2 TYR A 126 -18.428 -6.923 5.286 1.00 0.00 C ATOM 1641 CZ TYR A 126 -17.239 -7.122 4.606 1.00 0.00 C ATOM 1642 OH TYR A 126 -16.498 -8.263 4.802 1.00 0.00 O ATOM 0 H TYR A 126 -21.262 -5.113 2.088 1.00 0.00 H new ATOM 0 HA TYR A 126 -20.631 -2.370 2.495 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -18.718 -2.643 3.964 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -20.121 -3.301 4.781 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -17.091 -4.292 2.855 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -20.078 -5.589 5.595 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -15.853 -6.345 3.207 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -18.794 -7.670 5.975 1.00 0.00 H new ATOM 0 HH TYR A 126 -15.545 -8.036 4.816 1.00 0.00 H new ATOM 1652 N ARG A 127 -18.353 -2.893 1.317 1.00 0.00 N ATOM 1653 CA ARG A 127 -17.320 -3.081 0.362 1.00 0.00 C ATOM 1654 C ARG A 127 -16.029 -2.873 1.101 1.00 0.00 C ATOM 1655 O ARG A 127 -15.945 -1.984 1.926 1.00 0.00 O ATOM 1656 CB ARG A 127 -17.338 -2.033 -0.751 1.00 0.00 C ATOM 1657 CG ARG A 127 -18.609 -1.800 -1.544 1.00 0.00 C ATOM 1658 CD ARG A 127 -19.642 -0.992 -0.788 1.00 0.00 C ATOM 1659 NE ARG A 127 -20.586 -0.370 -1.708 1.00 0.00 N ATOM 1660 CZ ARG A 127 -21.321 0.709 -1.435 1.00 0.00 C ATOM 1661 NH1 ARG A 127 -21.446 1.146 -0.174 1.00 0.00 N ATOM 1662 NH2 ARG A 127 -21.937 1.345 -2.417 1.00 0.00 N ATOM 0 H ARG A 127 -18.223 -2.065 1.898 1.00 0.00 H new ATOM 0 HA ARG A 127 -17.444 -4.066 -0.088 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -17.053 -1.080 -0.305 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -16.555 -2.299 -1.461 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -18.362 -1.285 -2.472 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -19.040 -2.763 -1.819 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -20.177 -1.638 -0.092 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -19.146 -0.224 -0.194 1.00 0.00 H new ATOM 0 HE ARG A 127 -20.693 -0.792 -2.631 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -20.977 0.653 0.586 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -22.010 1.972 0.026 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -21.849 1.010 -3.376 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -22.501 2.171 -2.215 1.00 0.00 H new ATOM 1676 N GLU A 128 -15.063 -3.665 0.851 1.00 0.00 N ATOM 1677 CA GLU A 128 -13.766 -3.440 1.415 1.00 0.00 C ATOM 1678 C GLU A 128 -12.834 -3.059 0.312 1.00 0.00 C ATOM 1679 O GLU A 128 -12.913 -3.618 -0.780 1.00 0.00 O ATOM 1680 CB GLU A 128 -13.261 -4.658 2.172 1.00 0.00 C ATOM 1681 CG GLU A 128 -13.708 -4.715 3.610 1.00 0.00 C ATOM 1682 CD GLU A 128 -13.168 -5.913 4.340 1.00 0.00 C ATOM 1683 OE1 GLU A 128 -11.955 -5.960 4.600 1.00 0.00 O ATOM 1684 OE2 GLU A 128 -13.956 -6.803 4.724 1.00 0.00 O ATOM 0 H GLU A 128 -15.133 -4.489 0.254 1.00 0.00 H new ATOM 0 HA GLU A 128 -13.824 -2.632 2.144 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -13.602 -5.558 1.660 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -12.171 -4.667 2.140 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -13.387 -3.808 4.122 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -14.797 -4.733 3.647 1.00 0.00 H new ATOM 1691 N CYS A 129 -12.021 -2.079 0.543 1.00 0.00 N ATOM 1692 CA CYS A 129 -11.088 -1.678 -0.462 1.00 0.00 C ATOM 1693 C CYS A 129 -9.886 -2.581 -0.425 1.00 0.00 C ATOM 1694 O CYS A 129 -9.084 -2.539 0.523 1.00 0.00 O ATOM 1695 CB CYS A 129 -10.674 -0.233 -0.305 1.00 0.00 C ATOM 1696 SG CYS A 129 -9.528 0.327 -1.593 1.00 0.00 S ATOM 0 H CYS A 129 -11.983 -1.545 1.411 1.00 0.00 H new ATOM 0 HA CYS A 129 -11.578 -1.765 -1.432 1.00 0.00 H new ATOM 0 HB2 CYS A 129 -11.564 0.397 -0.321 1.00 0.00 H new ATOM 0 HB3 CYS A 129 -10.207 -0.100 0.671 1.00 0.00 H new ATOM 1701 N ASP A 130 -9.798 -3.421 -1.422 1.00 0.00 N ATOM 1702 CA ASP A 130 -8.734 -4.367 -1.560 1.00 0.00 C ATOM 1703 C ASP A 130 -7.728 -3.796 -2.580 1.00 0.00 C ATOM 1704 O ASP A 130 -7.845 -2.643 -2.990 1.00 0.00 O ATOM 1705 CB ASP A 130 -9.323 -5.721 -2.040 1.00 0.00 C ATOM 1706 CG ASP A 130 -8.366 -6.904 -1.933 1.00 0.00 C ATOM 1707 OD1 ASP A 130 -7.501 -7.070 -2.811 1.00 0.00 O ATOM 1708 OD2 ASP A 130 -8.476 -7.700 -0.982 1.00 0.00 O ATOM 0 H ASP A 130 -10.483 -3.464 -2.176 1.00 0.00 H new ATOM 0 HA ASP A 130 -8.224 -4.540 -0.613 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -10.217 -5.940 -1.457 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -9.637 -5.618 -3.079 1.00 0.00 H new ATOM 1713 N THR A 131 -6.790 -4.596 -2.982 1.00 0.00 N ATOM 1714 CA THR A 131 -5.721 -4.219 -3.867 1.00 0.00 C ATOM 1715 C THR A 131 -6.266 -3.892 -5.263 1.00 0.00 C ATOM 1716 O THR A 131 -5.844 -2.939 -5.913 1.00 0.00 O ATOM 1717 CB THR A 131 -4.724 -5.398 -3.959 1.00 0.00 C ATOM 1718 OG1 THR A 131 -5.422 -6.587 -4.386 1.00 0.00 O ATOM 1719 CG2 THR A 131 -4.112 -5.679 -2.605 1.00 0.00 C ATOM 0 H THR A 131 -6.742 -5.573 -2.692 1.00 0.00 H new ATOM 0 HA THR A 131 -5.223 -3.330 -3.479 1.00 0.00 H new ATOM 0 HB THR A 131 -3.943 -5.131 -4.671 1.00 0.00 H new ATOM 0 HG1 THR A 131 -5.914 -6.967 -3.629 1.00 0.00 H new ATOM 0 HG21 THR A 131 -3.413 -6.511 -2.687 1.00 0.00 H new ATOM 0 HG22 THR A 131 -3.582 -4.793 -2.254 1.00 0.00 H new ATOM 0 HG23 THR A 131 -4.899 -5.935 -1.896 1.00 0.00 H new ATOM 1727 N ASP A 132 -7.213 -4.697 -5.692 1.00 0.00 N ATOM 1728 CA ASP A 132 -7.854 -4.537 -6.982 1.00 0.00 C ATOM 1729 C ASP A 132 -8.826 -3.369 -6.939 1.00 0.00 C ATOM 1730 O ASP A 132 -8.962 -2.598 -7.902 1.00 0.00 O ATOM 1731 CB ASP A 132 -8.589 -5.826 -7.354 1.00 0.00 C ATOM 1732 CG ASP A 132 -9.288 -5.754 -8.691 1.00 0.00 C ATOM 1733 OD1 ASP A 132 -8.618 -5.890 -9.730 1.00 0.00 O ATOM 1734 OD2 ASP A 132 -10.517 -5.568 -8.732 1.00 0.00 O ATOM 0 H ASP A 132 -7.564 -5.488 -5.152 1.00 0.00 H new ATOM 0 HA ASP A 132 -7.096 -4.330 -7.737 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -7.876 -6.650 -7.369 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -9.323 -6.053 -6.581 1.00 0.00 H new ATOM 1739 N GLY A 133 -9.455 -3.216 -5.812 1.00 0.00 N ATOM 1740 CA GLY A 133 -10.435 -2.198 -5.625 1.00 0.00 C ATOM 1741 C GLY A 133 -11.443 -2.654 -4.629 1.00 0.00 C ATOM 1742 O GLY A 133 -11.126 -3.484 -3.781 1.00 0.00 O ATOM 0 H GLY A 133 -9.298 -3.801 -4.992 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -9.959 -1.279 -5.282 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -10.923 -1.970 -6.573 1.00 0.00 H new ATOM 1746 N TRP A 134 -12.648 -2.154 -4.728 1.00 0.00 N ATOM 1747 CA TRP A 134 -13.711 -2.547 -3.825 1.00 0.00 C ATOM 1748 C TRP A 134 -14.079 -4.008 -4.065 1.00 0.00 C ATOM 1749 O TRP A 134 -14.339 -4.399 -5.198 1.00 0.00 O ATOM 1750 CB TRP A 134 -14.946 -1.654 -4.001 1.00 0.00 C ATOM 1751 CG TRP A 134 -14.715 -0.202 -3.681 1.00 0.00 C ATOM 1752 CD1 TRP A 134 -14.628 0.833 -4.566 1.00 0.00 C ATOM 1753 CD2 TRP A 134 -14.541 0.374 -2.381 1.00 0.00 C ATOM 1754 NE1 TRP A 134 -14.426 2.010 -3.893 1.00 0.00 N ATOM 1755 CE2 TRP A 134 -14.367 1.755 -2.558 1.00 0.00 C ATOM 1756 CE3 TRP A 134 -14.520 -0.141 -1.087 1.00 0.00 C ATOM 1757 CZ2 TRP A 134 -14.179 2.623 -1.496 1.00 0.00 C ATOM 1758 CZ3 TRP A 134 -14.330 0.723 -0.033 1.00 0.00 C ATOM 1759 CH2 TRP A 134 -14.164 2.093 -0.246 1.00 0.00 C ATOM 0 H TRP A 134 -12.924 -1.467 -5.430 1.00 0.00 H new ATOM 0 HA TRP A 134 -13.354 -2.428 -2.802 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -15.294 -1.735 -5.031 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -15.746 -2.031 -3.363 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -14.707 0.739 -5.639 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -14.335 2.930 -4.324 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -14.650 -1.199 -0.914 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -14.049 3.683 -1.656 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -14.309 0.335 0.975 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -14.020 2.746 0.602 1.00 0.00 H new ATOM 1770 N THR A 135 -14.069 -4.792 -3.005 1.00 0.00 N ATOM 1771 CA THR A 135 -14.351 -6.222 -3.057 1.00 0.00 C ATOM 1772 C THR A 135 -15.737 -6.535 -3.619 1.00 0.00 C ATOM 1773 O THR A 135 -15.928 -7.526 -4.330 1.00 0.00 O ATOM 1774 CB THR A 135 -14.212 -6.842 -1.653 1.00 0.00 C ATOM 1775 OG1 THR A 135 -14.954 -6.050 -0.683 1.00 0.00 O ATOM 1776 CG2 THR A 135 -12.753 -6.912 -1.237 1.00 0.00 C ATOM 0 H THR A 135 -13.862 -4.452 -2.066 1.00 0.00 H new ATOM 0 HA THR A 135 -13.620 -6.660 -3.736 1.00 0.00 H new ATOM 0 HB THR A 135 -14.617 -7.853 -1.686 1.00 0.00 H new ATOM 0 HG1 THR A 135 -14.996 -6.532 0.169 1.00 0.00 H new ATOM 0 HG21 THR A 135 -12.679 -7.353 -0.243 1.00 0.00 H new ATOM 0 HG22 THR A 135 -12.201 -7.526 -1.948 1.00 0.00 H new ATOM 0 HG23 THR A 135 -12.331 -5.907 -1.221 1.00 0.00 H new ATOM 1784 N ASN A 136 -16.679 -5.688 -3.302 1.00 0.00 N ATOM 1785 CA ASN A 136 -18.041 -5.833 -3.732 1.00 0.00 C ATOM 1786 C ASN A 136 -18.456 -4.534 -4.338 1.00 0.00 C ATOM 1787 O ASN A 136 -17.754 -3.529 -4.163 1.00 0.00 O ATOM 1788 CB ASN A 136 -18.968 -6.230 -2.563 1.00 0.00 C ATOM 1789 CG ASN A 136 -18.689 -7.636 -2.035 1.00 0.00 C ATOM 1790 OD1 ASN A 136 -17.797 -7.751 -1.071 1.00 0.00 O flip ATOM 1791 ND2 ASN A 136 -19.275 -8.618 -2.498 1.00 0.00 N flip ATOM 0 H ASN A 136 -16.516 -4.862 -2.726 1.00 0.00 H new ATOM 0 HA ASN A 136 -18.120 -6.637 -4.464 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -18.849 -5.512 -1.751 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -20.005 -6.170 -2.892 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -19.960 -8.498 -3.244 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -19.074 -9.550 -2.135 1.00 0.00 H new ATOM 1798 N ASP A 137 -19.561 -4.512 -5.018 1.00 0.00 N ATOM 1799 CA ASP A 137 -19.944 -3.330 -5.749 1.00 0.00 C ATOM 1800 C ASP A 137 -21.036 -2.525 -5.037 1.00 0.00 C ATOM 1801 O ASP A 137 -20.741 -1.750 -4.113 1.00 0.00 O ATOM 1802 CB ASP A 137 -20.315 -3.703 -7.182 1.00 0.00 C ATOM 1803 CG ASP A 137 -20.620 -2.530 -8.066 1.00 0.00 C ATOM 1804 OD1 ASP A 137 -19.674 -1.847 -8.509 1.00 0.00 O ATOM 1805 OD2 ASP A 137 -21.801 -2.303 -8.378 1.00 0.00 O ATOM 0 H ASP A 137 -20.215 -5.292 -5.086 1.00 0.00 H new ATOM 0 HA ASP A 137 -19.086 -2.660 -5.790 1.00 0.00 H new ATOM 0 HB2 ASP A 137 -19.495 -4.270 -7.621 1.00 0.00 H new ATOM 0 HB3 ASP A 137 -21.183 -4.362 -7.160 1.00 0.00 H new ATOM 1810 N ILE A 138 -22.285 -2.712 -5.410 1.00 0.00 N ATOM 1811 CA ILE A 138 -23.357 -1.968 -4.793 1.00 0.00 C ATOM 1812 C ILE A 138 -24.519 -2.889 -4.396 1.00 0.00 C ATOM 1813 O ILE A 138 -25.342 -3.244 -5.248 1.00 0.00 O ATOM 1814 CB ILE A 138 -23.916 -0.883 -5.756 1.00 0.00 C ATOM 1815 CG1 ILE A 138 -22.806 0.007 -6.309 1.00 0.00 C ATOM 1816 CG2 ILE A 138 -24.953 -0.011 -5.036 1.00 0.00 C ATOM 1817 CD1 ILE A 138 -23.219 0.699 -7.578 1.00 0.00 C ATOM 0 H ILE A 138 -22.579 -3.369 -6.133 1.00 0.00 H new ATOM 0 HA ILE A 138 -22.936 -1.497 -3.905 1.00 0.00 H new ATOM 0 HB ILE A 138 -24.388 -1.403 -6.590 1.00 0.00 H new ATOM 0 HG12 ILE A 138 -22.533 0.752 -5.562 1.00 0.00 H new ATOM 0 HG13 ILE A 138 -21.918 -0.596 -6.497 1.00 0.00 H new ATOM 0 HG21 ILE A 138 -25.335 0.744 -5.724 1.00 0.00 H new ATOM 0 HG22 ILE A 138 -25.776 -0.636 -4.690 1.00 0.00 H new ATOM 0 HG23 ILE A 138 -24.486 0.480 -4.182 1.00 0.00 H new ATOM 0 HD11 ILE A 138 -22.399 1.322 -7.936 1.00 0.00 H new ATOM 0 HD12 ILE A 138 -23.467 -0.046 -8.334 1.00 0.00 H new ATOM 0 HD13 ILE A 138 -24.091 1.324 -7.385 1.00 0.00 H new ATOM 1829 N PRO A 139 -24.523 -3.389 -3.141 1.00 0.00 N ATOM 1830 CA PRO A 139 -25.702 -4.038 -2.547 1.00 0.00 C ATOM 1831 C PRO A 139 -26.923 -3.087 -2.660 1.00 0.00 C ATOM 1832 O PRO A 139 -26.807 -1.883 -2.420 1.00 0.00 O ATOM 1833 CB PRO A 139 -25.306 -4.185 -1.071 1.00 0.00 C ATOM 1834 CG PRO A 139 -24.007 -3.471 -0.913 1.00 0.00 C ATOM 1835 CD PRO A 139 -23.371 -3.447 -2.245 1.00 0.00 C ATOM 0 HA PRO A 139 -25.970 -4.981 -3.024 1.00 0.00 H new ATOM 0 HB2 PRO A 139 -26.067 -3.756 -0.420 1.00 0.00 H new ATOM 0 HB3 PRO A 139 -25.208 -5.236 -0.798 1.00 0.00 H new ATOM 0 HG2 PRO A 139 -24.165 -2.459 -0.541 1.00 0.00 H new ATOM 0 HG3 PRO A 139 -23.371 -3.981 -0.190 1.00 0.00 H new ATOM 0 HD2 PRO A 139 -22.717 -2.584 -2.368 1.00 0.00 H new ATOM 0 HD3 PRO A 139 -22.763 -4.335 -2.421 1.00 0.00 H new ATOM 1843 N ILE A 140 -28.053 -3.619 -3.016 1.00 0.00 N ATOM 1844 CA ILE A 140 -29.260 -2.815 -3.297 1.00 0.00 C ATOM 1845 C ILE A 140 -30.077 -2.556 -2.036 1.00 0.00 C ATOM 1846 O ILE A 140 -30.465 -3.492 -1.393 1.00 0.00 O ATOM 1847 CB ILE A 140 -30.152 -3.555 -4.348 1.00 0.00 C ATOM 1848 CG1 ILE A 140 -29.461 -3.617 -5.728 1.00 0.00 C ATOM 1849 CG2 ILE A 140 -31.581 -2.992 -4.440 1.00 0.00 C ATOM 1850 CD1 ILE A 140 -29.146 -2.260 -6.342 1.00 0.00 C ATOM 0 H ILE A 140 -28.190 -4.624 -3.127 1.00 0.00 H new ATOM 0 HA ILE A 140 -28.932 -1.853 -3.689 1.00 0.00 H new ATOM 0 HB ILE A 140 -30.266 -4.577 -3.988 1.00 0.00 H new ATOM 0 HG12 ILE A 140 -28.533 -4.181 -5.630 1.00 0.00 H new ATOM 0 HG13 ILE A 140 -30.100 -4.172 -6.415 1.00 0.00 H new ATOM 0 HG21 ILE A 140 -32.145 -3.551 -5.187 1.00 0.00 H new ATOM 0 HG22 ILE A 140 -32.072 -3.085 -3.471 1.00 0.00 H new ATOM 0 HG23 ILE A 140 -31.540 -1.941 -4.727 1.00 0.00 H new ATOM 0 HD11 ILE A 140 -28.662 -2.401 -7.309 1.00 0.00 H new ATOM 0 HD12 ILE A 140 -30.070 -1.698 -6.477 1.00 0.00 H new ATOM 0 HD13 ILE A 140 -28.479 -1.707 -5.680 1.00 0.00 H new ATOM 1862 N CYS A 141 -30.324 -1.283 -1.698 1.00 0.00 N ATOM 1863 CA CYS A 141 -31.182 -0.921 -0.543 1.00 0.00 C ATOM 1864 C CYS A 141 -32.514 -1.624 -0.625 1.00 0.00 C ATOM 1865 O CYS A 141 -33.228 -1.505 -1.640 1.00 0.00 O ATOM 1866 CB CYS A 141 -31.441 0.578 -0.492 1.00 0.00 C ATOM 1867 SG CYS A 141 -32.680 1.085 0.749 1.00 0.00 S ATOM 0 H CYS A 141 -29.946 -0.481 -2.203 1.00 0.00 H new ATOM 0 HA CYS A 141 -30.648 -1.230 0.356 1.00 0.00 H new ATOM 0 HB2 CYS A 141 -30.502 1.090 -0.281 1.00 0.00 H new ATOM 0 HB3 CYS A 141 -31.772 0.911 -1.476 1.00 0.00 H new ATOM 1872 N GLU A 142 -32.840 -2.346 0.420 1.00 0.00 N ATOM 1873 CA GLU A 142 -34.030 -3.126 0.480 1.00 0.00 C ATOM 1874 C GLU A 142 -34.158 -3.632 1.914 1.00 0.00 C ATOM 1875 O GLU A 142 -35.004 -3.126 2.664 1.00 0.00 O ATOM 1876 CB GLU A 142 -33.897 -4.286 -0.510 1.00 0.00 C ATOM 1877 CG GLU A 142 -35.142 -5.114 -0.758 1.00 0.00 C ATOM 1878 CD GLU A 142 -36.311 -4.325 -1.314 1.00 0.00 C ATOM 1879 OE1 GLU A 142 -36.397 -4.157 -2.554 1.00 0.00 O ATOM 1880 OE2 GLU A 142 -37.206 -3.919 -0.533 1.00 0.00 O ATOM 1881 OXT GLU A 142 -33.341 -4.465 2.323 1.00 0.00 O ATOM 0 H GLU A 142 -32.268 -2.402 1.263 1.00 0.00 H new ATOM 0 HA GLU A 142 -34.918 -2.552 0.214 1.00 0.00 H new ATOM 0 HB2 GLU A 142 -33.561 -3.882 -1.465 1.00 0.00 H new ATOM 0 HB3 GLU A 142 -33.111 -4.951 -0.151 1.00 0.00 H new ATOM 0 HG2 GLU A 142 -34.898 -5.918 -1.452 1.00 0.00 H new ATOM 0 HG3 GLU A 142 -35.446 -5.582 0.178 1.00 0.00 H new TER 1888 GLU A 142