USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 943 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 80 TYR OH : rot 130:sc= 0.887 USER MOD Set 1.2: A 101 TYR OH : rot -65:sc= 1.22 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 3 ASN : amide:sc= -0.637 K(o=-0.64,f=-3.1) USER MOD Single : A 7 TYR OH : rot 162:sc= -0.827 USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -2 SER OG : rot 62:sc= 0.162 USER MOD Single : A -3 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= -0.91 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 ASN : amide:sc=-0.00562 X(o=-0.0056,f=-0.097) USER MOD Single : A 25 ASN : amide:sc= -4.11 K(o=-4.1,f=-6.9!) USER MOD Single : A 30 THR OG1 : rot 74:sc= 1.3 USER MOD Single : A 32 THR OG1 : rot 93:sc= 1.34 USER MOD Single : A 34 MET CE :methyl 156:sc= -5! (180deg=-6.81!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 SER OG : rot 180:sc= -0.0712 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 CYS SG : rot -80:sc= -2.98! USER MOD Single : A 48 SER OG : rot -170:sc= -0.507 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0.0997 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -1.08 K(o=-1.1,f=-4.8!) USER MOD Single : A 66 ASN : amide:sc= -0.724 X(o=-0.72,f=-0.83) USER MOD Single : A 69 GLN : amide:sc= -0.295 X(o=-0.3,f=-0.39) USER MOD Single : A 70 ASN : amide:sc= 0.99 K(o=0.99,f=-0.045) USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 77 SER OG : rot -80:sc= -1.14 USER MOD Single : A 83 GLN :FLIP amide:sc= -1.83 F(o=-2.8,f=-1.8) USER MOD Single : A 86 LYS NZ :NH3+ -173:sc= -0.413 (180deg=-0.613) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN : amide:sc= -0.302 X(o=-0.3,f=-0.084) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= -0.456 K(o=-0.46,f=-1.2) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 4.796 -18.712 -4.965 1.00 0.00 N ATOM 2 CA GLY A -3 4.193 -17.524 -4.387 1.00 0.00 C ATOM 3 C GLY A -3 4.809 -16.245 -4.918 1.00 0.00 C ATOM 4 O GLY A -3 5.996 -15.990 -4.717 1.00 0.00 O ATOM 0 H1 GLY A -3 4.341 -19.560 -4.570 1.00 0.00 H new ATOM 0 H2 GLY A -3 4.668 -18.699 -5.997 1.00 0.00 H new ATOM 0 H3 GLY A -3 5.812 -18.729 -4.742 1.00 0.00 H new ATOM 0 HA2 GLY A -3 3.124 -17.524 -4.598 1.00 0.00 H new ATOM 0 HA3 GLY A -3 4.304 -17.554 -3.303 1.00 0.00 H new ATOM 8 N SER A -2 4.001 -15.440 -5.600 1.00 0.00 N ATOM 9 CA SER A -2 4.475 -14.182 -6.167 1.00 0.00 C ATOM 10 C SER A -2 3.341 -13.441 -6.868 1.00 0.00 C ATOM 11 O SER A -2 3.282 -12.211 -6.849 1.00 0.00 O ATOM 12 CB SER A -2 5.617 -14.441 -7.152 1.00 0.00 C ATOM 13 OG SER A -2 6.849 -13.961 -6.641 1.00 0.00 O ATOM 0 H SER A -2 3.015 -15.636 -5.774 1.00 0.00 H new ATOM 0 HA SER A -2 4.843 -13.559 -5.351 1.00 0.00 H new ATOM 0 HB2 SER A -2 5.694 -15.510 -7.352 1.00 0.00 H new ATOM 0 HB3 SER A -2 5.399 -13.954 -8.103 1.00 0.00 H new ATOM 0 HG SER A -2 7.070 -14.441 -5.816 1.00 0.00 H new ATOM 19 N HIS A -1 2.442 -14.199 -7.488 1.00 0.00 N ATOM 20 CA HIS A -1 1.308 -13.615 -8.196 1.00 0.00 C ATOM 21 C HIS A -1 0.208 -13.209 -7.220 1.00 0.00 C ATOM 22 O HIS A -1 -0.826 -12.677 -7.622 1.00 0.00 O ATOM 23 CB HIS A -1 0.756 -14.605 -9.222 1.00 0.00 C ATOM 24 CG HIS A -1 1.542 -14.649 -10.496 1.00 0.00 C ATOM 25 ND1 HIS A -1 1.186 -13.940 -11.625 1.00 0.00 N ATOM 26 CD2 HIS A -1 2.673 -15.320 -10.816 1.00 0.00 C ATOM 27 CE1 HIS A -1 2.063 -14.176 -12.584 1.00 0.00 C ATOM 28 NE2 HIS A -1 2.976 -15.010 -12.119 1.00 0.00 N ATOM 0 H HIS A -1 2.477 -15.218 -7.515 1.00 0.00 H new ATOM 0 HA HIS A -1 1.656 -12.722 -8.715 1.00 0.00 H new ATOM 0 HB2 HIS A -1 0.739 -15.601 -8.781 1.00 0.00 H new ATOM 0 HB3 HIS A -1 -0.276 -14.341 -9.451 1.00 0.00 H new ATOM 0 HD2 HIS A -1 3.233 -15.977 -10.167 1.00 0.00 H new ATOM 0 HE1 HIS A -1 2.038 -13.758 -13.580 1.00 0.00 H new ATOM 0 HE2 HIS A -1 3.776 -15.366 -12.643 1.00 0.00 H new ATOM 36 N MET A 1 0.439 -13.464 -5.936 1.00 0.00 N ATOM 37 CA MET A 1 -0.532 -13.124 -4.903 1.00 0.00 C ATOM 38 C MET A 1 0.166 -12.605 -3.650 1.00 0.00 C ATOM 39 O MET A 1 -0.443 -12.508 -2.585 1.00 0.00 O ATOM 40 CB MET A 1 -1.387 -14.345 -4.556 1.00 0.00 C ATOM 41 CG MET A 1 -0.622 -15.657 -4.606 1.00 0.00 C ATOM 42 SD MET A 1 -1.635 -17.071 -4.130 1.00 0.00 S ATOM 43 CE MET A 1 -1.141 -18.272 -5.364 1.00 0.00 C ATOM 0 H MET A 1 1.290 -13.905 -5.587 1.00 0.00 H new ATOM 0 HA MET A 1 -1.177 -12.335 -5.291 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.803 -14.215 -3.557 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.228 -14.398 -5.247 1.00 0.00 H new ATOM 0 HG2 MET A 1 -0.240 -15.812 -5.615 1.00 0.00 H new ATOM 0 HG3 MET A 1 0.242 -15.595 -3.944 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.683 -19.204 -5.202 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.369 -17.887 -6.358 1.00 0.00 H new ATOM 0 HE3 MET A 1 -0.070 -18.457 -5.284 1.00 0.00 H new ATOM 53 N ILE A 2 1.445 -12.274 -3.786 1.00 0.00 N ATOM 54 CA ILE A 2 2.225 -11.764 -2.664 1.00 0.00 C ATOM 55 C ILE A 2 3.204 -10.688 -3.120 1.00 0.00 C ATOM 56 O ILE A 2 3.053 -10.112 -4.196 1.00 0.00 O ATOM 57 CB ILE A 2 3.006 -12.891 -1.963 1.00 0.00 C ATOM 58 CG1 ILE A 2 2.443 -14.256 -2.362 1.00 0.00 C ATOM 59 CG2 ILE A 2 2.955 -12.711 -0.454 1.00 0.00 C ATOM 60 CD1 ILE A 2 3.129 -15.417 -1.675 1.00 0.00 C ATOM 0 H ILE A 2 1.964 -12.349 -4.661 1.00 0.00 H new ATOM 0 HA ILE A 2 1.517 -11.331 -1.957 1.00 0.00 H new ATOM 0 HB ILE A 2 4.048 -12.843 -2.280 1.00 0.00 H new ATOM 0 HG12 ILE A 2 1.379 -14.283 -2.128 1.00 0.00 H new ATOM 0 HG13 ILE A 2 2.536 -14.377 -3.441 1.00 0.00 H new ATOM 0 HG21 ILE A 2 3.511 -13.515 0.027 1.00 0.00 H new ATOM 0 HG22 ILE A 2 3.399 -11.752 -0.187 1.00 0.00 H new ATOM 0 HG23 ILE A 2 1.918 -12.737 -0.119 1.00 0.00 H new ATOM 0 HD11 ILE A 2 2.678 -16.353 -2.005 1.00 0.00 H new ATOM 0 HD12 ILE A 2 4.189 -15.415 -1.929 1.00 0.00 H new ATOM 0 HD13 ILE A 2 3.014 -15.320 -0.595 1.00 0.00 H new ATOM 72 N ASN A 3 4.211 -10.423 -2.293 1.00 0.00 N ATOM 73 CA ASN A 3 5.217 -9.417 -2.611 1.00 0.00 C ATOM 74 C ASN A 3 6.310 -9.384 -1.547 1.00 0.00 C ATOM 75 O ASN A 3 6.026 -9.428 -0.349 1.00 0.00 O ATOM 76 CB ASN A 3 4.568 -8.037 -2.734 1.00 0.00 C ATOM 77 CG ASN A 3 5.575 -6.951 -3.058 1.00 0.00 C ATOM 78 OD1 ASN A 3 6.643 -7.223 -3.606 1.00 0.00 O ATOM 79 ND2 ASN A 3 5.238 -5.711 -2.719 1.00 0.00 N ATOM 0 H ASN A 3 4.351 -10.891 -1.398 1.00 0.00 H new ATOM 0 HA ASN A 3 5.672 -9.684 -3.565 1.00 0.00 H new ATOM 0 HB2 ASN A 3 3.805 -8.065 -3.512 1.00 0.00 H new ATOM 0 HB3 ASN A 3 4.062 -7.792 -1.800 1.00 0.00 H new ATOM 0 HD21 ASN A 3 5.876 -4.938 -2.912 1.00 0.00 H new ATOM 0 HD22 ASN A 3 4.342 -5.532 -2.266 1.00 0.00 H new ATOM 86 N LEU A 4 7.559 -9.307 -1.992 1.00 0.00 N ATOM 87 CA LEU A 4 8.696 -9.268 -1.078 1.00 0.00 C ATOM 88 C LEU A 4 8.632 -8.034 -0.183 1.00 0.00 C ATOM 89 O LEU A 4 9.028 -8.080 0.981 1.00 0.00 O ATOM 90 CB LEU A 4 10.008 -9.275 -1.864 1.00 0.00 C ATOM 91 CG LEU A 4 10.324 -8.004 -2.654 1.00 0.00 C ATOM 92 CD1 LEU A 4 11.293 -7.123 -1.881 1.00 0.00 C ATOM 93 CD2 LEU A 4 10.893 -8.354 -4.021 1.00 0.00 C ATOM 0 H LEU A 4 7.811 -9.270 -2.980 1.00 0.00 H new ATOM 0 HA LEU A 4 8.654 -10.155 -0.446 1.00 0.00 H new ATOM 0 HB2 LEU A 4 10.825 -9.458 -1.166 1.00 0.00 H new ATOM 0 HB3 LEU A 4 9.988 -10.115 -2.558 1.00 0.00 H new ATOM 0 HG LEU A 4 9.397 -7.449 -2.800 1.00 0.00 H new ATOM 0 HD11 LEU A 4 11.506 -6.223 -2.458 1.00 0.00 H new ATOM 0 HD12 LEU A 4 10.848 -6.844 -0.926 1.00 0.00 H new ATOM 0 HD13 LEU A 4 12.220 -7.669 -1.704 1.00 0.00 H new ATOM 0 HD21 LEU A 4 11.112 -7.438 -4.569 1.00 0.00 H new ATOM 0 HD22 LEU A 4 11.810 -8.931 -3.897 1.00 0.00 H new ATOM 0 HD23 LEU A 4 10.165 -8.945 -4.578 1.00 0.00 H new ATOM 105 N GLU A 5 8.131 -6.934 -0.735 1.00 0.00 N ATOM 106 CA GLU A 5 8.015 -5.688 0.014 1.00 0.00 C ATOM 107 C GLU A 5 6.808 -5.725 0.947 1.00 0.00 C ATOM 108 O GLU A 5 6.577 -4.793 1.718 1.00 0.00 O ATOM 109 CB GLU A 5 7.898 -4.500 -0.943 1.00 0.00 C ATOM 110 CG GLU A 5 8.533 -3.226 -0.412 1.00 0.00 C ATOM 111 CD GLU A 5 10.047 -3.246 -0.507 1.00 0.00 C ATOM 112 OE1 GLU A 5 10.696 -3.707 0.454 1.00 0.00 O ATOM 113 OE2 GLU A 5 10.581 -2.799 -1.544 1.00 0.00 O ATOM 0 H GLU A 5 7.799 -6.880 -1.698 1.00 0.00 H new ATOM 0 HA GLU A 5 8.915 -5.571 0.617 1.00 0.00 H new ATOM 0 HB2 GLU A 5 8.366 -4.761 -1.892 1.00 0.00 H new ATOM 0 HB3 GLU A 5 6.844 -4.312 -1.149 1.00 0.00 H new ATOM 0 HG2 GLU A 5 8.149 -2.373 -0.971 1.00 0.00 H new ATOM 0 HG3 GLU A 5 8.240 -3.084 0.628 1.00 0.00 H new ATOM 120 N ASP A 6 6.042 -6.808 0.871 1.00 0.00 N ATOM 121 CA ASP A 6 4.858 -6.967 1.708 1.00 0.00 C ATOM 122 C ASP A 6 5.009 -8.167 2.638 1.00 0.00 C ATOM 123 O ASP A 6 4.019 -8.769 3.056 1.00 0.00 O ATOM 124 CB ASP A 6 3.611 -7.133 0.839 1.00 0.00 C ATOM 125 CG ASP A 6 3.310 -5.896 0.016 1.00 0.00 C ATOM 126 OD1 ASP A 6 4.037 -4.892 0.166 1.00 0.00 O ATOM 127 OD2 ASP A 6 2.348 -5.933 -0.779 1.00 0.00 O ATOM 0 H ASP A 6 6.220 -7.588 0.239 1.00 0.00 H new ATOM 0 HA ASP A 6 4.749 -6.069 2.316 1.00 0.00 H new ATOM 0 HB2 ASP A 6 3.747 -7.985 0.173 1.00 0.00 H new ATOM 0 HB3 ASP A 6 2.756 -7.359 1.476 1.00 0.00 H new ATOM 132 N TYR A 7 6.252 -8.510 2.957 1.00 0.00 N ATOM 133 CA TYR A 7 6.532 -9.640 3.835 1.00 0.00 C ATOM 134 C TYR A 7 8.032 -9.792 4.066 1.00 0.00 C ATOM 135 O TYR A 7 8.538 -10.903 4.224 1.00 0.00 O ATOM 136 CB TYR A 7 5.963 -10.929 3.239 1.00 0.00 C ATOM 137 CG TYR A 7 5.376 -11.865 4.270 1.00 0.00 C ATOM 138 CD1 TYR A 7 5.991 -12.047 5.503 1.00 0.00 C ATOM 139 CD2 TYR A 7 4.206 -12.569 4.012 1.00 0.00 C ATOM 140 CE1 TYR A 7 5.458 -12.902 6.448 1.00 0.00 C ATOM 141 CE2 TYR A 7 3.665 -13.424 4.952 1.00 0.00 C ATOM 142 CZ TYR A 7 4.295 -13.588 6.168 1.00 0.00 C ATOM 143 OH TYR A 7 3.760 -14.441 7.106 1.00 0.00 O ATOM 0 H TYR A 7 7.082 -8.022 2.621 1.00 0.00 H new ATOM 0 HA TYR A 7 6.053 -9.449 4.795 1.00 0.00 H new ATOM 0 HB2 TYR A 7 5.192 -10.674 2.512 1.00 0.00 H new ATOM 0 HB3 TYR A 7 6.753 -11.449 2.697 1.00 0.00 H new ATOM 0 HD1 TYR A 7 6.901 -11.511 5.726 1.00 0.00 H new ATOM 0 HD2 TYR A 7 3.711 -12.445 3.060 1.00 0.00 H new ATOM 0 HE1 TYR A 7 5.949 -13.032 7.401 1.00 0.00 H new ATOM 0 HE2 TYR A 7 2.753 -13.961 4.736 1.00 0.00 H new ATOM 0 HH TYR A 7 2.821 -14.619 6.888 1.00 0.00 H new ATOM 153 N TRP A 8 8.738 -8.667 4.083 1.00 0.00 N ATOM 154 CA TRP A 8 10.181 -8.673 4.295 1.00 0.00 C ATOM 155 C TRP A 8 10.514 -8.547 5.778 1.00 0.00 C ATOM 156 O TRP A 8 11.663 -8.725 6.182 1.00 0.00 O ATOM 157 CB TRP A 8 10.837 -7.534 3.514 1.00 0.00 C ATOM 158 CG TRP A 8 12.063 -7.957 2.763 1.00 0.00 C ATOM 159 CD1 TRP A 8 12.111 -8.489 1.506 1.00 0.00 C ATOM 160 CD2 TRP A 8 13.417 -7.885 3.222 1.00 0.00 C ATOM 161 NE1 TRP A 8 13.413 -8.753 1.157 1.00 0.00 N ATOM 162 CE2 TRP A 8 14.234 -8.390 2.192 1.00 0.00 C ATOM 163 CE3 TRP A 8 14.019 -7.442 4.403 1.00 0.00 C ATOM 164 CZ2 TRP A 8 15.619 -8.464 2.309 1.00 0.00 C ATOM 165 CZ3 TRP A 8 15.394 -7.516 4.518 1.00 0.00 C ATOM 166 CH2 TRP A 8 16.182 -8.023 3.476 1.00 0.00 C ATOM 0 H TRP A 8 8.335 -7.739 3.953 1.00 0.00 H new ATOM 0 HA TRP A 8 10.572 -9.624 3.933 1.00 0.00 H new ATOM 0 HB2 TRP A 8 10.113 -7.121 2.811 1.00 0.00 H new ATOM 0 HB3 TRP A 8 11.101 -6.734 4.206 1.00 0.00 H new ATOM 0 HD1 TRP A 8 11.252 -8.675 0.879 1.00 0.00 H new ATOM 0 HE1 TRP A 8 13.719 -9.154 0.271 1.00 0.00 H new ATOM 0 HE3 TRP A 8 13.420 -7.049 5.211 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 16.228 -8.855 1.507 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 15.870 -7.177 5.427 1.00 0.00 H new ATOM 0 HH2 TRP A 8 17.254 -8.067 3.596 1.00 0.00 H new ATOM 177 N GLU A 9 9.502 -8.240 6.583 1.00 0.00 N ATOM 178 CA GLU A 9 9.690 -8.090 8.022 1.00 0.00 C ATOM 179 C GLU A 9 9.087 -9.273 8.775 1.00 0.00 C ATOM 180 O GLU A 9 7.884 -9.309 9.034 1.00 0.00 O ATOM 181 CB GLU A 9 9.056 -6.785 8.508 1.00 0.00 C ATOM 182 CG GLU A 9 9.431 -5.576 7.667 1.00 0.00 C ATOM 183 CD GLU A 9 9.395 -4.282 8.456 1.00 0.00 C ATOM 184 OE1 GLU A 9 9.685 -4.321 9.670 1.00 0.00 O ATOM 185 OE2 GLU A 9 9.075 -3.232 7.861 1.00 0.00 O ATOM 0 H GLU A 9 8.545 -8.090 6.264 1.00 0.00 H new ATOM 0 HA GLU A 9 10.761 -8.062 8.222 1.00 0.00 H new ATOM 0 HB2 GLU A 9 7.972 -6.895 8.507 1.00 0.00 H new ATOM 0 HB3 GLU A 9 9.358 -6.607 9.540 1.00 0.00 H new ATOM 0 HG2 GLU A 9 10.431 -5.719 7.257 1.00 0.00 H new ATOM 0 HG3 GLU A 9 8.748 -5.500 6.821 1.00 0.00 H new ATOM 192 N ASP A 10 9.932 -10.237 9.124 1.00 0.00 N ATOM 193 CA ASP A 10 9.484 -11.421 9.848 1.00 0.00 C ATOM 194 C ASP A 10 10.293 -11.614 11.127 1.00 0.00 C ATOM 195 O ASP A 10 10.289 -12.694 11.717 1.00 0.00 O ATOM 196 CB ASP A 10 9.603 -12.662 8.962 1.00 0.00 C ATOM 197 CG ASP A 10 8.254 -13.169 8.492 1.00 0.00 C ATOM 198 OD1 ASP A 10 7.285 -13.095 9.277 1.00 0.00 O ATOM 199 OD2 ASP A 10 8.167 -13.640 7.339 1.00 0.00 O ATOM 0 H ASP A 10 10.931 -10.222 8.917 1.00 0.00 H new ATOM 0 HA ASP A 10 8.438 -11.277 10.119 1.00 0.00 H new ATOM 0 HB2 ASP A 10 10.222 -12.428 8.096 1.00 0.00 H new ATOM 0 HB3 ASP A 10 10.112 -13.452 9.514 1.00 0.00 H new ATOM 204 N GLU A 11 10.985 -10.560 11.548 1.00 0.00 N ATOM 205 CA GLU A 11 11.800 -10.616 12.756 1.00 0.00 C ATOM 206 C GLU A 11 11.966 -9.226 13.365 1.00 0.00 C ATOM 207 O GLU A 11 13.045 -8.866 13.836 1.00 0.00 O ATOM 208 CB GLU A 11 13.173 -11.215 12.444 1.00 0.00 C ATOM 209 CG GLU A 11 13.661 -12.199 13.494 1.00 0.00 C ATOM 210 CD GLU A 11 14.946 -12.894 13.090 1.00 0.00 C ATOM 211 OE1 GLU A 11 14.933 -13.619 12.074 1.00 0.00 O ATOM 212 OE2 GLU A 11 15.964 -12.714 13.790 1.00 0.00 O ATOM 0 H GLU A 11 10.998 -9.658 11.071 1.00 0.00 H new ATOM 0 HA GLU A 11 11.290 -11.252 13.479 1.00 0.00 H new ATOM 0 HB2 GLU A 11 13.129 -11.719 11.479 1.00 0.00 H new ATOM 0 HB3 GLU A 11 13.899 -10.408 12.349 1.00 0.00 H new ATOM 0 HG2 GLU A 11 13.818 -11.672 14.435 1.00 0.00 H new ATOM 0 HG3 GLU A 11 12.888 -12.947 13.672 1.00 0.00 H new ATOM 219 N THR A 12 10.887 -8.448 13.351 1.00 0.00 N ATOM 220 CA THR A 12 10.912 -7.098 13.900 1.00 0.00 C ATOM 221 C THR A 12 10.069 -7.004 15.166 1.00 0.00 C ATOM 222 O THR A 12 9.053 -7.684 15.317 1.00 0.00 O ATOM 223 CB THR A 12 10.399 -6.067 12.877 1.00 0.00 C ATOM 224 OG1 THR A 12 10.039 -4.853 13.545 1.00 0.00 O ATOM 225 CG2 THR A 12 9.197 -6.610 12.118 1.00 0.00 C ATOM 0 H THR A 12 9.986 -8.730 12.966 1.00 0.00 H new ATOM 0 HA THR A 12 11.951 -6.874 14.142 1.00 0.00 H new ATOM 0 HB THR A 12 11.198 -5.866 12.164 1.00 0.00 H new ATOM 0 HG1 THR A 12 9.715 -4.202 12.888 1.00 0.00 H new ATOM 0 HG21 THR A 12 8.852 -5.865 11.401 1.00 0.00 H new ATOM 0 HG22 THR A 12 9.482 -7.519 11.588 1.00 0.00 H new ATOM 0 HG23 THR A 12 8.395 -6.836 12.821 1.00 0.00 H new ATOM 233 N PRO A 13 10.497 -6.142 16.100 1.00 0.00 N ATOM 234 CA PRO A 13 9.795 -5.937 17.370 1.00 0.00 C ATOM 235 C PRO A 13 8.458 -5.226 17.186 1.00 0.00 C ATOM 236 O PRO A 13 8.003 -5.021 16.062 1.00 0.00 O ATOM 237 CB PRO A 13 10.760 -5.062 18.173 1.00 0.00 C ATOM 238 CG PRO A 13 11.568 -4.348 17.145 1.00 0.00 C ATOM 239 CD PRO A 13 11.699 -5.299 15.988 1.00 0.00 C ATOM 0 HA PRO A 13 9.550 -6.881 17.856 1.00 0.00 H new ATOM 0 HB2 PRO A 13 10.222 -4.361 18.811 1.00 0.00 H new ATOM 0 HB3 PRO A 13 11.392 -5.665 18.825 1.00 0.00 H new ATOM 0 HG2 PRO A 13 11.079 -3.424 16.837 1.00 0.00 H new ATOM 0 HG3 PRO A 13 12.547 -4.075 17.539 1.00 0.00 H new ATOM 0 HD2 PRO A 13 11.731 -4.770 15.035 1.00 0.00 H new ATOM 0 HD3 PRO A 13 12.612 -5.890 16.056 1.00 0.00 H new ATOM 247 N GLY A 14 7.833 -4.852 18.299 1.00 0.00 N ATOM 248 CA GLY A 14 6.555 -4.168 18.237 1.00 0.00 C ATOM 249 C GLY A 14 6.387 -3.152 19.350 1.00 0.00 C ATOM 250 O GLY A 14 7.139 -3.138 20.325 1.00 0.00 O ATOM 0 H GLY A 14 8.189 -5.011 19.242 1.00 0.00 H new ATOM 0 HA2 GLY A 14 6.461 -3.666 17.274 1.00 0.00 H new ATOM 0 HA3 GLY A 14 5.751 -4.901 18.294 1.00 0.00 H new ATOM 254 N PRO A 15 5.382 -2.276 19.210 1.00 0.00 N ATOM 255 CA PRO A 15 5.095 -1.235 20.201 1.00 0.00 C ATOM 256 C PRO A 15 4.544 -1.809 21.502 1.00 0.00 C ATOM 257 O PRO A 15 4.514 -3.026 21.691 1.00 0.00 O ATOM 258 CB PRO A 15 4.039 -0.368 19.510 1.00 0.00 C ATOM 259 CG PRO A 15 3.380 -1.280 18.534 1.00 0.00 C ATOM 260 CD PRO A 15 4.446 -2.235 18.073 1.00 0.00 C ATOM 0 HA PRO A 15 5.993 -0.689 20.489 1.00 0.00 H new ATOM 0 HB2 PRO A 15 3.321 0.029 20.228 1.00 0.00 H new ATOM 0 HB3 PRO A 15 4.494 0.486 19.009 1.00 0.00 H new ATOM 0 HG2 PRO A 15 2.551 -1.815 18.998 1.00 0.00 H new ATOM 0 HG3 PRO A 15 2.968 -0.721 17.694 1.00 0.00 H new ATOM 0 HD2 PRO A 15 4.035 -3.221 17.855 1.00 0.00 H new ATOM 0 HD3 PRO A 15 4.934 -1.884 17.163 1.00 0.00 H new ATOM 268 N ASP A 16 4.107 -0.928 22.395 1.00 0.00 N ATOM 269 CA ASP A 16 3.555 -1.348 23.678 1.00 0.00 C ATOM 270 C ASP A 16 2.253 -0.611 23.976 1.00 0.00 C ATOM 271 O ASP A 16 1.877 -0.440 25.136 1.00 0.00 O ATOM 272 CB ASP A 16 4.566 -1.097 24.798 1.00 0.00 C ATOM 273 CG ASP A 16 4.922 -2.364 25.551 1.00 0.00 C ATOM 274 OD1 ASP A 16 4.046 -2.896 26.264 1.00 0.00 O ATOM 275 OD2 ASP A 16 6.077 -2.823 25.428 1.00 0.00 O ATOM 0 H ASP A 16 4.124 0.082 22.254 1.00 0.00 H new ATOM 0 HA ASP A 16 3.343 -2.416 23.623 1.00 0.00 H new ATOM 0 HB2 ASP A 16 5.472 -0.662 24.375 1.00 0.00 H new ATOM 0 HB3 ASP A 16 4.157 -0.366 25.495 1.00 0.00 H new ATOM 280 N ARG A 17 1.570 -0.177 22.922 1.00 0.00 N ATOM 281 CA ARG A 17 0.311 0.543 23.071 1.00 0.00 C ATOM 282 C ARG A 17 -0.290 0.875 21.709 1.00 0.00 C ATOM 283 O ARG A 17 -1.257 0.248 21.277 1.00 0.00 O ATOM 284 CB ARG A 17 0.526 1.828 23.873 1.00 0.00 C ATOM 285 CG ARG A 17 -0.685 2.746 23.888 1.00 0.00 C ATOM 286 CD ARG A 17 -0.785 3.515 25.196 1.00 0.00 C ATOM 287 NE ARG A 17 -0.768 4.960 24.985 1.00 0.00 N ATOM 288 CZ ARG A 17 -0.974 5.847 25.952 1.00 0.00 C ATOM 289 NH1 ARG A 17 -1.212 5.438 27.191 1.00 0.00 N ATOM 290 NH2 ARG A 17 -0.943 7.145 25.681 1.00 0.00 N ATOM 0 H ARG A 17 1.867 -0.311 21.956 1.00 0.00 H new ATOM 0 HA ARG A 17 -0.385 -0.101 23.609 1.00 0.00 H new ATOM 0 HB2 ARG A 17 0.786 1.567 24.899 1.00 0.00 H new ATOM 0 HB3 ARG A 17 1.376 2.368 23.456 1.00 0.00 H new ATOM 0 HG2 ARG A 17 -0.621 3.448 23.056 1.00 0.00 H new ATOM 0 HG3 ARG A 17 -1.591 2.158 23.740 1.00 0.00 H new ATOM 0 HD2 ARG A 17 -1.704 3.235 25.712 1.00 0.00 H new ATOM 0 HD3 ARG A 17 0.044 3.234 25.846 1.00 0.00 H new ATOM 0 HE ARG A 17 -0.588 5.307 24.043 1.00 0.00 H new ATOM 0 HH11 ARG A 17 -1.237 4.441 27.403 1.00 0.00 H new ATOM 0 HH12 ARG A 17 -1.370 6.121 27.932 1.00 0.00 H new ATOM 0 HH21 ARG A 17 -0.761 7.463 24.729 1.00 0.00 H new ATOM 0 HH22 ARG A 17 -1.101 7.825 26.424 1.00 0.00 H new ATOM 304 N GLU A 18 0.289 1.866 21.038 1.00 0.00 N ATOM 305 CA GLU A 18 -0.192 2.281 19.725 1.00 0.00 C ATOM 306 C GLU A 18 -0.163 1.115 18.741 1.00 0.00 C ATOM 307 O GLU A 18 0.875 0.498 18.501 1.00 0.00 O ATOM 308 CB GLU A 18 0.657 3.436 19.189 1.00 0.00 C ATOM 309 CG GLU A 18 0.598 4.686 20.051 1.00 0.00 C ATOM 310 CD GLU A 18 1.973 5.177 20.461 1.00 0.00 C ATOM 311 OE1 GLU A 18 2.696 5.710 19.594 1.00 0.00 O ATOM 312 OE2 GLU A 18 2.325 5.028 21.650 1.00 0.00 O ATOM 0 H GLU A 18 1.090 2.396 21.381 1.00 0.00 H new ATOM 0 HA GLU A 18 -1.223 2.617 19.833 1.00 0.00 H new ATOM 0 HB2 GLU A 18 1.693 3.108 19.110 1.00 0.00 H new ATOM 0 HB3 GLU A 18 0.324 3.684 18.181 1.00 0.00 H new ATOM 0 HG2 GLU A 18 0.082 5.476 19.505 1.00 0.00 H new ATOM 0 HG3 GLU A 18 0.009 4.479 20.944 1.00 0.00 H new ATOM 319 N PRO A 19 -1.330 0.805 18.158 1.00 0.00 N ATOM 320 CA PRO A 19 -1.466 -0.288 17.190 1.00 0.00 C ATOM 321 C PRO A 19 -0.774 0.020 15.867 1.00 0.00 C ATOM 322 O PRO A 19 -0.945 1.100 15.301 1.00 0.00 O ATOM 323 CB PRO A 19 -2.979 -0.398 16.990 1.00 0.00 C ATOM 324 CG PRO A 19 -3.505 0.957 17.318 1.00 0.00 C ATOM 325 CD PRO A 19 -2.607 1.498 18.397 1.00 0.00 C ATOM 0 HA PRO A 19 -1.002 -1.208 17.545 1.00 0.00 H new ATOM 0 HB2 PRO A 19 -3.223 -0.680 15.966 1.00 0.00 H new ATOM 0 HB3 PRO A 19 -3.410 -1.158 17.641 1.00 0.00 H new ATOM 0 HG2 PRO A 19 -3.494 1.603 16.440 1.00 0.00 H new ATOM 0 HG3 PRO A 19 -4.538 0.902 17.661 1.00 0.00 H new ATOM 0 HD2 PRO A 19 -2.497 2.580 18.323 1.00 0.00 H new ATOM 0 HD3 PRO A 19 -3.000 1.285 19.391 1.00 0.00 H new ATOM 333 N THR A 20 0.009 -0.937 15.377 1.00 0.00 N ATOM 334 CA THR A 20 0.727 -0.768 14.121 1.00 0.00 C ATOM 335 C THR A 20 0.286 -1.803 13.092 1.00 0.00 C ATOM 336 O THR A 20 0.102 -2.975 13.416 1.00 0.00 O ATOM 337 CB THR A 20 2.250 -0.880 14.325 1.00 0.00 C ATOM 338 OG1 THR A 20 2.567 -2.112 14.982 1.00 0.00 O ATOM 339 CG2 THR A 20 2.774 0.288 15.146 1.00 0.00 C ATOM 0 H THR A 20 0.161 -1.837 15.832 1.00 0.00 H new ATOM 0 HA THR A 20 0.490 0.230 13.753 1.00 0.00 H new ATOM 0 HB THR A 20 2.728 -0.858 13.346 1.00 0.00 H new ATOM 0 HG1 THR A 20 3.537 -2.176 15.106 1.00 0.00 H new ATOM 0 HG21 THR A 20 3.851 0.187 15.277 1.00 0.00 H new ATOM 0 HG22 THR A 20 2.558 1.223 14.629 1.00 0.00 H new ATOM 0 HG23 THR A 20 2.289 0.293 16.122 1.00 0.00 H new ATOM 347 N ASN A 21 0.119 -1.361 11.849 1.00 0.00 N ATOM 348 CA ASN A 21 -0.301 -2.250 10.772 1.00 0.00 C ATOM 349 C ASN A 21 0.575 -3.499 10.725 1.00 0.00 C ATOM 350 O ASN A 21 0.075 -4.613 10.580 1.00 0.00 O ATOM 351 CB ASN A 21 -0.241 -1.521 9.428 1.00 0.00 C ATOM 352 CG ASN A 21 -1.606 -1.384 8.783 1.00 0.00 C ATOM 353 OD1 ASN A 21 -2.360 -2.353 8.688 1.00 0.00 O ATOM 354 ND2 ASN A 21 -1.931 -0.176 8.336 1.00 0.00 N ATOM 0 H ASN A 21 0.268 -0.393 11.563 1.00 0.00 H new ATOM 0 HA ASN A 21 -1.329 -2.555 10.967 1.00 0.00 H new ATOM 0 HB2 ASN A 21 0.190 -0.530 9.574 1.00 0.00 H new ATOM 0 HB3 ASN A 21 0.424 -2.061 8.754 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -2.837 -0.023 7.893 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -1.275 0.598 8.436 1.00 0.00 H new ATOM 361 N GLU A 22 1.884 -3.302 10.849 1.00 0.00 N ATOM 362 CA GLU A 22 2.828 -4.413 10.821 1.00 0.00 C ATOM 363 C GLU A 22 2.401 -5.516 11.785 1.00 0.00 C ATOM 364 O GLU A 22 2.330 -6.688 11.414 1.00 0.00 O ATOM 365 CB GLU A 22 4.234 -3.925 11.178 1.00 0.00 C ATOM 366 CG GLU A 22 5.290 -4.313 10.156 1.00 0.00 C ATOM 367 CD GLU A 22 6.351 -3.244 9.979 1.00 0.00 C ATOM 368 OE1 GLU A 22 7.183 -3.075 10.895 1.00 0.00 O ATOM 369 OE2 GLU A 22 6.348 -2.576 8.924 1.00 0.00 O ATOM 0 H GLU A 22 2.314 -2.385 10.970 1.00 0.00 H new ATOM 0 HA GLU A 22 2.838 -4.822 9.811 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.218 -2.840 11.278 1.00 0.00 H new ATOM 0 HB3 GLU A 22 4.515 -4.331 12.150 1.00 0.00 H new ATOM 0 HG2 GLU A 22 5.765 -5.244 10.466 1.00 0.00 H new ATOM 0 HG3 GLU A 22 4.809 -4.505 9.197 1.00 0.00 H new ATOM 376 N LEU A 23 2.117 -5.132 13.025 1.00 0.00 N ATOM 377 CA LEU A 23 1.697 -6.087 14.044 1.00 0.00 C ATOM 378 C LEU A 23 0.329 -6.673 13.711 1.00 0.00 C ATOM 379 O LEU A 23 0.048 -7.832 14.014 1.00 0.00 O ATOM 380 CB LEU A 23 1.655 -5.413 15.417 1.00 0.00 C ATOM 381 CG LEU A 23 1.251 -6.305 16.591 1.00 0.00 C ATOM 382 CD1 LEU A 23 2.439 -6.553 17.507 1.00 0.00 C ATOM 383 CD2 LEU A 23 0.100 -5.679 17.365 1.00 0.00 C ATOM 0 H LEU A 23 2.170 -4.166 13.349 1.00 0.00 H new ATOM 0 HA LEU A 23 2.424 -6.899 14.067 1.00 0.00 H new ATOM 0 HB2 LEU A 23 2.641 -4.997 15.625 1.00 0.00 H new ATOM 0 HB3 LEU A 23 0.959 -4.575 15.367 1.00 0.00 H new ATOM 0 HG LEU A 23 0.917 -7.264 16.195 1.00 0.00 H new ATOM 0 HD11 LEU A 23 2.132 -7.190 18.337 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.234 -7.045 16.947 1.00 0.00 H new ATOM 0 HD13 LEU A 23 2.804 -5.602 17.895 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -0.174 -6.328 18.197 1.00 0.00 H new ATOM 0 HD22 LEU A 23 0.406 -4.706 17.749 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -0.758 -5.554 16.704 1.00 0.00 H new ATOM 395 N ARG A 24 -0.518 -5.864 13.082 1.00 0.00 N ATOM 396 CA ARG A 24 -1.857 -6.303 12.705 1.00 0.00 C ATOM 397 C ARG A 24 -1.791 -7.435 11.684 1.00 0.00 C ATOM 398 O ARG A 24 -2.406 -8.484 11.866 1.00 0.00 O ATOM 399 CB ARG A 24 -2.658 -5.132 12.134 1.00 0.00 C ATOM 400 CG ARG A 24 -2.738 -3.935 13.067 1.00 0.00 C ATOM 401 CD ARG A 24 -4.150 -3.376 13.138 1.00 0.00 C ATOM 402 NE ARG A 24 -4.579 -2.810 11.862 1.00 0.00 N ATOM 403 CZ ARG A 24 -5.719 -2.147 11.698 1.00 0.00 C ATOM 404 NH1 ARG A 24 -6.539 -1.968 12.724 1.00 0.00 N ATOM 405 NH2 ARG A 24 -6.040 -1.662 10.505 1.00 0.00 N ATOM 0 H ARG A 24 -0.301 -4.902 12.823 1.00 0.00 H new ATOM 0 HA ARG A 24 -2.356 -6.674 13.600 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -2.206 -4.819 11.193 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -3.668 -5.471 11.905 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -2.411 -4.228 14.065 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -2.055 -3.158 12.723 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -4.839 -4.167 13.433 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -4.197 -2.608 13.910 1.00 0.00 H new ATOM 0 HE ARG A 24 -3.970 -2.930 11.052 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -6.296 -2.340 13.642 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -7.413 -1.459 12.595 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -5.412 -1.798 9.713 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -6.915 -1.153 10.380 1.00 0.00 H new ATOM 419 N ASN A 25 -1.041 -7.212 10.610 1.00 0.00 N ATOM 420 CA ASN A 25 -0.896 -8.213 9.559 1.00 0.00 C ATOM 421 C ASN A 25 -0.038 -9.381 10.035 1.00 0.00 C ATOM 422 O ASN A 25 -0.186 -10.507 9.560 1.00 0.00 O ATOM 423 CB ASN A 25 -0.274 -7.585 8.310 1.00 0.00 C ATOM 424 CG ASN A 25 1.084 -6.970 8.587 1.00 0.00 C ATOM 425 OD1 ASN A 25 1.231 -5.748 8.612 1.00 0.00 O ATOM 426 ND2 ASN A 25 2.086 -7.817 8.797 1.00 0.00 N ATOM 0 H ASN A 25 -0.525 -6.348 10.444 1.00 0.00 H new ATOM 0 HA ASN A 25 -1.888 -8.591 9.312 1.00 0.00 H new ATOM 0 HB2 ASN A 25 -0.174 -8.346 7.536 1.00 0.00 H new ATOM 0 HB3 ASN A 25 -0.944 -6.819 7.920 1.00 0.00 H new ATOM 0 HD21 ASN A 25 3.023 -7.461 8.988 1.00 0.00 H new ATOM 0 HD22 ASN A 25 1.918 -8.823 8.767 1.00 0.00 H new ATOM 433 N GLU A 26 0.859 -9.105 10.976 1.00 0.00 N ATOM 434 CA GLU A 26 1.740 -10.133 11.516 1.00 0.00 C ATOM 435 C GLU A 26 0.969 -11.092 12.418 1.00 0.00 C ATOM 436 O GLU A 26 1.132 -12.310 12.333 1.00 0.00 O ATOM 437 CB GLU A 26 2.889 -9.493 12.298 1.00 0.00 C ATOM 438 CG GLU A 26 4.034 -9.019 11.419 1.00 0.00 C ATOM 439 CD GLU A 26 5.268 -9.891 11.548 1.00 0.00 C ATOM 440 OE1 GLU A 26 5.119 -11.085 11.882 1.00 0.00 O ATOM 441 OE2 GLU A 26 6.383 -9.378 11.315 1.00 0.00 O ATOM 0 H GLU A 26 0.995 -8.178 11.380 1.00 0.00 H new ATOM 0 HA GLU A 26 2.150 -10.699 10.680 1.00 0.00 H new ATOM 0 HB2 GLU A 26 2.503 -8.646 12.866 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.271 -10.214 13.021 1.00 0.00 H new ATOM 0 HG2 GLU A 26 3.708 -9.008 10.379 1.00 0.00 H new ATOM 0 HG3 GLU A 26 4.289 -7.993 11.683 1.00 0.00 H new ATOM 448 N VAL A 27 0.128 -10.534 13.284 1.00 0.00 N ATOM 449 CA VAL A 27 -0.669 -11.339 14.202 1.00 0.00 C ATOM 450 C VAL A 27 -1.787 -12.068 13.465 1.00 0.00 C ATOM 451 O VAL A 27 -2.140 -13.194 13.812 1.00 0.00 O ATOM 452 CB VAL A 27 -1.285 -10.473 15.317 1.00 0.00 C ATOM 453 CG1 VAL A 27 -2.184 -11.313 16.211 1.00 0.00 C ATOM 454 CG2 VAL A 27 -0.191 -9.797 16.131 1.00 0.00 C ATOM 0 H VAL A 27 -0.019 -9.528 13.369 1.00 0.00 H new ATOM 0 HA VAL A 27 0.005 -12.070 14.649 1.00 0.00 H new ATOM 0 HB VAL A 27 -1.896 -9.697 14.855 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -2.610 -10.684 16.993 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -2.988 -11.746 15.615 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -1.600 -12.112 16.667 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -0.643 -9.189 16.914 1.00 0.00 H new ATOM 0 HG22 VAL A 27 0.447 -10.556 16.584 1.00 0.00 H new ATOM 0 HG23 VAL A 27 0.408 -9.161 15.479 1.00 0.00 H new ATOM 464 N GLU A 28 -2.340 -11.417 12.446 1.00 0.00 N ATOM 465 CA GLU A 28 -3.418 -12.005 11.660 1.00 0.00 C ATOM 466 C GLU A 28 -2.913 -13.191 10.844 1.00 0.00 C ATOM 467 O GLU A 28 -3.504 -14.270 10.867 1.00 0.00 O ATOM 468 CB GLU A 28 -4.031 -10.955 10.729 1.00 0.00 C ATOM 469 CG GLU A 28 -4.941 -9.968 11.441 1.00 0.00 C ATOM 470 CD GLU A 28 -6.377 -10.047 10.959 1.00 0.00 C ATOM 471 OE1 GLU A 28 -6.613 -9.815 9.755 1.00 0.00 O ATOM 472 OE2 GLU A 28 -7.264 -10.340 11.788 1.00 0.00 O ATOM 0 H GLU A 28 -2.059 -10.483 12.146 1.00 0.00 H new ATOM 0 HA GLU A 28 -4.183 -12.361 12.350 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -3.229 -10.406 10.236 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -4.598 -11.461 9.948 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -4.910 -10.160 12.514 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -4.565 -8.957 11.287 1.00 0.00 H new ATOM 479 N GLU A 29 -1.816 -12.981 10.123 1.00 0.00 N ATOM 480 CA GLU A 29 -1.232 -14.033 9.298 1.00 0.00 C ATOM 481 C GLU A 29 -0.655 -15.148 10.166 1.00 0.00 C ATOM 482 O GLU A 29 -0.739 -16.327 9.820 1.00 0.00 O ATOM 483 CB GLU A 29 -0.138 -13.457 8.396 1.00 0.00 C ATOM 484 CG GLU A 29 1.119 -13.051 9.147 1.00 0.00 C ATOM 485 CD GLU A 29 2.074 -14.210 9.355 1.00 0.00 C ATOM 486 OE1 GLU A 29 1.828 -15.291 8.780 1.00 0.00 O ATOM 487 OE2 GLU A 29 3.066 -14.036 10.093 1.00 0.00 O ATOM 0 H GLU A 29 -1.314 -12.093 10.093 1.00 0.00 H new ATOM 0 HA GLU A 29 -2.023 -14.452 8.676 1.00 0.00 H new ATOM 0 HB2 GLU A 29 0.124 -14.197 7.639 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -0.533 -12.588 7.869 1.00 0.00 H new ATOM 0 HG2 GLU A 29 1.628 -12.260 8.596 1.00 0.00 H new ATOM 0 HG3 GLU A 29 0.841 -12.636 10.116 1.00 0.00 H new ATOM 494 N THR A 30 -0.069 -14.766 11.297 1.00 0.00 N ATOM 495 CA THR A 30 0.523 -15.732 12.214 1.00 0.00 C ATOM 496 C THR A 30 -0.547 -16.599 12.866 1.00 0.00 C ATOM 497 O THR A 30 -0.399 -17.818 12.961 1.00 0.00 O ATOM 498 CB THR A 30 1.341 -15.032 13.315 1.00 0.00 C ATOM 499 OG1 THR A 30 2.512 -14.432 12.750 1.00 0.00 O ATOM 500 CG2 THR A 30 1.745 -16.019 14.400 1.00 0.00 C ATOM 0 H THR A 30 0.008 -13.795 11.599 1.00 0.00 H new ATOM 0 HA THR A 30 1.187 -16.363 11.623 1.00 0.00 H new ATOM 0 HB THR A 30 0.717 -14.259 13.763 1.00 0.00 H new ATOM 0 HG1 THR A 30 2.259 -13.629 12.248 1.00 0.00 H new ATOM 0 HG21 THR A 30 2.322 -15.501 15.166 1.00 0.00 H new ATOM 0 HG22 THR A 30 0.851 -16.452 14.849 1.00 0.00 H new ATOM 0 HG23 THR A 30 2.352 -16.812 13.963 1.00 0.00 H new ATOM 508 N ILE A 31 -1.625 -15.964 13.313 1.00 0.00 N ATOM 509 CA ILE A 31 -2.722 -16.679 13.954 1.00 0.00 C ATOM 510 C ILE A 31 -3.446 -17.581 12.961 1.00 0.00 C ATOM 511 O ILE A 31 -3.861 -18.690 13.299 1.00 0.00 O ATOM 512 CB ILE A 31 -3.737 -15.707 14.582 1.00 0.00 C ATOM 513 CG1 ILE A 31 -3.137 -15.037 15.820 1.00 0.00 C ATOM 514 CG2 ILE A 31 -5.022 -16.440 14.940 1.00 0.00 C ATOM 515 CD1 ILE A 31 -2.949 -15.982 16.987 1.00 0.00 C ATOM 0 H ILE A 31 -1.762 -14.956 13.243 1.00 0.00 H new ATOM 0 HA ILE A 31 -2.282 -17.290 14.742 1.00 0.00 H new ATOM 0 HB ILE A 31 -3.975 -14.933 13.852 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -2.173 -14.602 15.556 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -3.784 -14.216 16.128 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -5.729 -15.739 15.383 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -5.457 -16.874 14.039 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -4.802 -17.233 15.654 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -2.520 -15.439 17.829 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -3.914 -16.398 17.277 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -2.278 -16.790 16.696 1.00 0.00 H new ATOM 527 N THR A 32 -3.593 -17.099 11.730 1.00 0.00 N ATOM 528 CA THR A 32 -4.266 -17.861 10.686 1.00 0.00 C ATOM 529 C THR A 32 -3.457 -19.093 10.297 1.00 0.00 C ATOM 530 O THR A 32 -4.002 -20.190 10.162 1.00 0.00 O ATOM 531 CB THR A 32 -4.507 -17.002 9.431 1.00 0.00 C ATOM 532 OG1 THR A 32 -5.313 -15.866 9.762 1.00 0.00 O ATOM 533 CG2 THR A 32 -5.191 -17.815 8.342 1.00 0.00 C ATOM 0 H THR A 32 -3.255 -16.184 11.432 1.00 0.00 H new ATOM 0 HA THR A 32 -5.227 -18.174 11.093 1.00 0.00 H new ATOM 0 HB THR A 32 -3.540 -16.665 9.058 1.00 0.00 H new ATOM 0 HG1 THR A 32 -4.734 -15.106 9.979 1.00 0.00 H new ATOM 0 HG21 THR A 32 -5.351 -17.187 7.465 1.00 0.00 H new ATOM 0 HG22 THR A 32 -4.562 -18.663 8.071 1.00 0.00 H new ATOM 0 HG23 THR A 32 -6.151 -18.178 8.708 1.00 0.00 H new ATOM 541 N LEU A 33 -2.154 -18.908 10.118 1.00 0.00 N ATOM 542 CA LEU A 33 -1.269 -20.006 9.745 1.00 0.00 C ATOM 543 C LEU A 33 -1.056 -20.957 10.918 1.00 0.00 C ATOM 544 O LEU A 33 -1.068 -22.176 10.751 1.00 0.00 O ATOM 545 CB LEU A 33 0.078 -19.461 9.265 1.00 0.00 C ATOM 546 CG LEU A 33 0.064 -18.724 7.925 1.00 0.00 C ATOM 547 CD1 LEU A 33 1.469 -18.278 7.547 1.00 0.00 C ATOM 548 CD2 LEU A 33 -0.528 -19.607 6.836 1.00 0.00 C ATOM 0 H LEU A 33 -1.687 -18.008 10.225 1.00 0.00 H new ATOM 0 HA LEU A 33 -1.741 -20.560 8.933 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.465 -18.783 10.026 1.00 0.00 H new ATOM 0 HB3 LEU A 33 0.779 -20.293 9.192 1.00 0.00 H new ATOM 0 HG LEU A 33 -0.562 -17.838 8.026 1.00 0.00 H new ATOM 0 HD11 LEU A 33 1.440 -17.755 6.591 1.00 0.00 H new ATOM 0 HD12 LEU A 33 1.857 -17.609 8.315 1.00 0.00 H new ATOM 0 HD13 LEU A 33 2.118 -19.150 7.464 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -0.530 -19.066 5.890 1.00 0.00 H new ATOM 0 HD22 LEU A 33 0.071 -20.512 6.735 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -1.550 -19.877 7.102 1.00 0.00 H new ATOM 560 N MET A 34 -0.863 -20.390 12.105 1.00 0.00 N ATOM 561 CA MET A 34 -0.652 -21.189 13.306 1.00 0.00 C ATOM 562 C MET A 34 -1.944 -21.875 13.738 1.00 0.00 C ATOM 563 O MET A 34 -1.916 -22.887 14.437 1.00 0.00 O ATOM 564 CB MET A 34 -0.124 -20.310 14.442 1.00 0.00 C ATOM 565 CG MET A 34 -1.214 -19.547 15.177 1.00 0.00 C ATOM 566 SD MET A 34 -1.762 -20.390 16.674 1.00 0.00 S ATOM 567 CE MET A 34 -3.466 -19.846 16.763 1.00 0.00 C ATOM 0 H MET A 34 -0.848 -19.382 12.260 1.00 0.00 H new ATOM 0 HA MET A 34 0.086 -21.957 13.076 1.00 0.00 H new ATOM 0 HB2 MET A 34 0.414 -20.936 15.154 1.00 0.00 H new ATOM 0 HB3 MET A 34 0.595 -19.599 14.036 1.00 0.00 H new ATOM 0 HG2 MET A 34 -0.845 -18.555 15.437 1.00 0.00 H new ATOM 0 HG3 MET A 34 -2.066 -19.406 14.511 1.00 0.00 H new ATOM 0 HE1 MET A 34 -4.048 -20.567 17.337 1.00 0.00 H new ATOM 0 HE2 MET A 34 -3.512 -18.872 17.250 1.00 0.00 H new ATOM 0 HE3 MET A 34 -3.876 -19.768 15.756 1.00 0.00 H new ATOM 577 N GLU A 35 -3.075 -21.317 13.316 1.00 0.00 N ATOM 578 CA GLU A 35 -4.376 -21.876 13.661 1.00 0.00 C ATOM 579 C GLU A 35 -4.475 -23.335 13.226 1.00 0.00 C ATOM 580 O GLU A 35 -5.278 -24.101 13.760 1.00 0.00 O ATOM 581 CB GLU A 35 -5.495 -21.061 13.009 1.00 0.00 C ATOM 582 CG GLU A 35 -6.319 -20.255 13.999 1.00 0.00 C ATOM 583 CD GLU A 35 -7.730 -20.787 14.154 1.00 0.00 C ATOM 584 OE1 GLU A 35 -7.929 -22.005 13.959 1.00 0.00 O ATOM 585 OE2 GLU A 35 -8.635 -19.987 14.470 1.00 0.00 O ATOM 0 H GLU A 35 -3.116 -20.479 12.735 1.00 0.00 H new ATOM 0 HA GLU A 35 -4.486 -21.830 14.744 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -5.059 -20.383 12.276 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -6.155 -21.737 12.465 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -5.823 -20.263 14.970 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -6.360 -19.216 13.671 1.00 0.00 H new ATOM 592 N LEU A 36 -3.653 -23.712 12.252 1.00 0.00 N ATOM 593 CA LEU A 36 -3.647 -25.079 11.743 1.00 0.00 C ATOM 594 C LEU A 36 -2.586 -25.918 12.449 1.00 0.00 C ATOM 595 O LEU A 36 -2.138 -26.940 11.927 1.00 0.00 O ATOM 596 CB LEU A 36 -3.395 -25.081 10.235 1.00 0.00 C ATOM 597 CG LEU A 36 -4.600 -24.753 9.352 1.00 0.00 C ATOM 598 CD1 LEU A 36 -4.204 -24.759 7.884 1.00 0.00 C ATOM 599 CD2 LEU A 36 -5.731 -25.740 9.606 1.00 0.00 C ATOM 0 H LEU A 36 -2.983 -23.090 11.799 1.00 0.00 H new ATOM 0 HA LEU A 36 -4.624 -25.519 11.942 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -2.605 -24.362 10.018 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -3.019 -26.064 9.951 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.952 -23.754 9.607 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -5.074 -24.524 7.271 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.428 -24.013 7.714 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.826 -25.745 7.613 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -6.580 -25.492 8.969 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -5.390 -26.750 9.379 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -6.033 -25.686 10.652 1.00 0.00 H new ATOM 611 N LEU A 37 -2.188 -25.481 13.639 1.00 0.00 N ATOM 612 CA LEU A 37 -1.181 -26.192 14.418 1.00 0.00 C ATOM 613 C LEU A 37 -1.587 -27.647 14.634 1.00 0.00 C ATOM 614 O LEU A 37 -2.734 -27.939 14.974 1.00 0.00 O ATOM 615 CB LEU A 37 -0.971 -25.503 15.767 1.00 0.00 C ATOM 616 CG LEU A 37 0.425 -24.933 16.020 1.00 0.00 C ATOM 617 CD1 LEU A 37 0.375 -23.415 16.099 1.00 0.00 C ATOM 618 CD2 LEU A 37 1.016 -25.516 17.295 1.00 0.00 C ATOM 0 H LEU A 37 -2.548 -24.637 14.085 1.00 0.00 H new ATOM 0 HA LEU A 37 -0.245 -26.174 13.859 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -1.694 -24.692 15.854 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -1.198 -26.219 16.557 1.00 0.00 H new ATOM 0 HG LEU A 37 1.068 -25.212 15.185 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.377 -23.027 16.279 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -0.006 -23.014 15.160 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.283 -23.115 16.915 1.00 0.00 H new ATOM 0 HD21 LEU A 37 2.010 -25.099 17.459 1.00 0.00 H new ATOM 0 HD22 LEU A 37 0.374 -25.268 18.140 1.00 0.00 H new ATOM 0 HD23 LEU A 37 1.088 -26.599 17.200 1.00 0.00 H new ATOM 630 N LYS A 38 -0.639 -28.556 14.436 1.00 0.00 N ATOM 631 CA LYS A 38 -0.895 -29.980 14.613 1.00 0.00 C ATOM 632 C LYS A 38 -0.288 -30.485 15.918 1.00 0.00 C ATOM 633 O LYS A 38 0.442 -29.761 16.595 1.00 0.00 O ATOM 634 CB LYS A 38 -0.326 -30.772 13.433 1.00 0.00 C ATOM 635 CG LYS A 38 1.104 -30.398 13.084 1.00 0.00 C ATOM 636 CD LYS A 38 1.871 -31.587 12.529 1.00 0.00 C ATOM 637 CE LYS A 38 1.434 -31.919 11.110 1.00 0.00 C ATOM 638 NZ LYS A 38 2.253 -33.013 10.519 1.00 0.00 N ATOM 0 H LYS A 38 0.315 -28.331 14.153 1.00 0.00 H new ATOM 0 HA LYS A 38 -1.974 -30.127 14.655 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -0.368 -31.836 13.666 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -0.958 -30.612 12.560 1.00 0.00 H new ATOM 0 HG2 LYS A 38 1.102 -29.591 12.351 1.00 0.00 H new ATOM 0 HG3 LYS A 38 1.610 -30.020 13.973 1.00 0.00 H new ATOM 0 HD2 LYS A 38 2.939 -31.370 12.541 1.00 0.00 H new ATOM 0 HD3 LYS A 38 1.715 -32.454 13.171 1.00 0.00 H new ATOM 0 HE2 LYS A 38 0.384 -32.212 11.113 1.00 0.00 H new ATOM 0 HE3 LYS A 38 1.515 -31.028 10.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 1.924 -33.209 9.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 3.252 -32.724 10.493 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 2.156 -33.871 11.099 1.00 0.00 H new ATOM 652 N VAL A 39 -0.593 -31.732 16.264 1.00 0.00 N ATOM 653 CA VAL A 39 -0.075 -32.334 17.487 1.00 0.00 C ATOM 654 C VAL A 39 1.439 -32.176 17.578 1.00 0.00 C ATOM 655 O VAL A 39 1.985 -31.946 18.657 1.00 0.00 O ATOM 656 CB VAL A 39 -0.430 -33.830 17.570 1.00 0.00 C ATOM 657 CG1 VAL A 39 -1.915 -34.012 17.846 1.00 0.00 C ATOM 658 CG2 VAL A 39 -0.027 -34.545 16.289 1.00 0.00 C ATOM 0 H VAL A 39 -1.196 -32.345 15.715 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.543 -31.811 18.321 1.00 0.00 H new ATOM 0 HB VAL A 39 0.126 -34.272 18.397 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -2.147 -35.076 17.901 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -2.170 -33.535 18.792 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -2.493 -33.556 17.042 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -0.285 -35.601 16.365 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -0.554 -34.103 15.444 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.048 -34.444 16.139 1.00 0.00 H new ATOM 668 N SER A 40 2.111 -32.303 16.439 1.00 0.00 N ATOM 669 CA SER A 40 3.563 -32.178 16.390 1.00 0.00 C ATOM 670 C SER A 40 4.004 -30.785 16.832 1.00 0.00 C ATOM 671 O SER A 40 4.877 -30.642 17.687 1.00 0.00 O ATOM 672 CB SER A 40 4.074 -32.462 14.976 1.00 0.00 C ATOM 673 OG SER A 40 3.485 -33.638 14.448 1.00 0.00 O ATOM 0 H SER A 40 1.673 -32.492 15.537 1.00 0.00 H new ATOM 0 HA SER A 40 3.989 -32.910 17.076 1.00 0.00 H new ATOM 0 HB2 SER A 40 3.848 -31.616 14.327 1.00 0.00 H new ATOM 0 HB3 SER A 40 5.158 -32.570 14.993 1.00 0.00 H new ATOM 0 HG SER A 40 3.826 -33.797 13.543 1.00 0.00 H new ATOM 679 N GLU A 41 3.393 -29.763 16.241 1.00 0.00 N ATOM 680 CA GLU A 41 3.722 -28.382 16.573 1.00 0.00 C ATOM 681 C GLU A 41 3.370 -28.072 18.025 1.00 0.00 C ATOM 682 O GLU A 41 4.202 -27.575 18.785 1.00 0.00 O ATOM 683 CB GLU A 41 2.983 -27.420 15.641 1.00 0.00 C ATOM 684 CG GLU A 41 3.184 -27.726 14.166 1.00 0.00 C ATOM 685 CD GLU A 41 3.493 -26.486 13.350 1.00 0.00 C ATOM 686 OE1 GLU A 41 4.201 -25.596 13.868 1.00 0.00 O ATOM 687 OE2 GLU A 41 3.028 -26.404 12.194 1.00 0.00 O ATOM 0 H GLU A 41 2.668 -29.865 15.531 1.00 0.00 H new ATOM 0 HA GLU A 41 4.796 -28.250 16.442 1.00 0.00 H new ATOM 0 HB2 GLU A 41 1.918 -27.454 15.868 1.00 0.00 H new ATOM 0 HB3 GLU A 41 3.320 -26.403 15.842 1.00 0.00 H new ATOM 0 HG2 GLU A 41 3.999 -28.442 14.055 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.286 -28.201 13.772 1.00 0.00 H new ATOM 694 N LEU A 42 2.131 -28.369 18.403 1.00 0.00 N ATOM 695 CA LEU A 42 1.667 -28.122 19.764 1.00 0.00 C ATOM 696 C LEU A 42 2.612 -28.749 20.784 1.00 0.00 C ATOM 697 O LEU A 42 3.090 -28.078 21.699 1.00 0.00 O ATOM 698 CB LEU A 42 0.255 -28.679 19.951 1.00 0.00 C ATOM 699 CG LEU A 42 -0.782 -28.238 18.918 1.00 0.00 C ATOM 700 CD1 LEU A 42 -1.831 -29.321 18.719 1.00 0.00 C ATOM 701 CD2 LEU A 42 -1.437 -26.931 19.342 1.00 0.00 C ATOM 0 H LEU A 42 1.430 -28.781 17.787 1.00 0.00 H new ATOM 0 HA LEU A 42 1.651 -27.044 19.926 1.00 0.00 H new ATOM 0 HB2 LEU A 42 0.311 -29.768 19.939 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -0.100 -28.389 20.940 1.00 0.00 H new ATOM 0 HG LEU A 42 -0.273 -28.074 17.968 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -2.561 -28.989 17.980 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -1.349 -30.234 18.369 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -2.336 -29.517 19.665 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -2.172 -26.633 18.594 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -1.932 -27.067 20.303 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -0.676 -26.155 19.432 1.00 0.00 H new ATOM 713 N LYS A 43 2.881 -30.040 20.619 1.00 0.00 N ATOM 714 CA LYS A 43 3.772 -30.758 21.522 1.00 0.00 C ATOM 715 C LYS A 43 5.155 -30.114 21.548 1.00 0.00 C ATOM 716 O LYS A 43 5.748 -29.939 22.612 1.00 0.00 O ATOM 717 CB LYS A 43 3.888 -32.224 21.098 1.00 0.00 C ATOM 718 CG LYS A 43 4.813 -33.041 21.983 1.00 0.00 C ATOM 719 CD LYS A 43 4.500 -34.526 21.896 1.00 0.00 C ATOM 720 CE LYS A 43 5.154 -35.163 20.680 1.00 0.00 C ATOM 721 NZ LYS A 43 6.354 -35.963 21.051 1.00 0.00 N ATOM 0 H LYS A 43 2.494 -30.611 19.867 1.00 0.00 H new ATOM 0 HA LYS A 43 3.349 -30.709 22.525 1.00 0.00 H new ATOM 0 HB2 LYS A 43 2.896 -32.676 21.108 1.00 0.00 H new ATOM 0 HB3 LYS A 43 4.248 -32.269 20.070 1.00 0.00 H new ATOM 0 HG2 LYS A 43 5.848 -32.868 21.687 1.00 0.00 H new ATOM 0 HG3 LYS A 43 4.717 -32.708 23.016 1.00 0.00 H new ATOM 0 HD2 LYS A 43 4.847 -35.026 22.801 1.00 0.00 H new ATOM 0 HD3 LYS A 43 3.421 -34.669 21.847 1.00 0.00 H new ATOM 0 HE2 LYS A 43 4.432 -35.804 20.174 1.00 0.00 H new ATOM 0 HE3 LYS A 43 5.441 -34.385 19.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 6.771 -36.381 20.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 7.054 -35.346 21.511 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 6.077 -36.721 21.706 1.00 0.00 H new ATOM 735 N ASP A 44 5.661 -29.763 20.371 1.00 0.00 N ATOM 736 CA ASP A 44 6.973 -29.136 20.260 1.00 0.00 C ATOM 737 C ASP A 44 7.062 -27.900 21.150 1.00 0.00 C ATOM 738 O ASP A 44 8.006 -27.750 21.927 1.00 0.00 O ATOM 739 CB ASP A 44 7.257 -28.755 18.806 1.00 0.00 C ATOM 740 CG ASP A 44 8.343 -29.611 18.185 1.00 0.00 C ATOM 741 OD1 ASP A 44 9.508 -29.499 18.619 1.00 0.00 O ATOM 742 OD2 ASP A 44 8.028 -30.393 17.263 1.00 0.00 O ATOM 0 H ASP A 44 5.183 -29.902 19.481 1.00 0.00 H new ATOM 0 HA ASP A 44 7.722 -29.855 20.592 1.00 0.00 H new ATOM 0 HB2 ASP A 44 6.342 -28.854 18.222 1.00 0.00 H new ATOM 0 HB3 ASP A 44 7.553 -27.707 18.759 1.00 0.00 H new ATOM 747 N ILE A 45 6.075 -27.019 21.030 1.00 0.00 N ATOM 748 CA ILE A 45 6.043 -25.797 21.824 1.00 0.00 C ATOM 749 C ILE A 45 5.875 -26.109 23.307 1.00 0.00 C ATOM 750 O ILE A 45 6.620 -25.602 24.147 1.00 0.00 O ATOM 751 CB ILE A 45 4.903 -24.864 21.375 1.00 0.00 C ATOM 752 CG1 ILE A 45 5.115 -24.424 19.925 1.00 0.00 C ATOM 753 CG2 ILE A 45 4.815 -23.655 22.294 1.00 0.00 C ATOM 754 CD1 ILE A 45 3.902 -24.633 19.046 1.00 0.00 C ATOM 0 H ILE A 45 5.287 -27.128 20.391 1.00 0.00 H new ATOM 0 HA ILE A 45 6.997 -25.294 21.667 1.00 0.00 H new ATOM 0 HB ILE A 45 3.962 -25.410 21.435 1.00 0.00 H new ATOM 0 HG12 ILE A 45 5.387 -23.368 19.910 1.00 0.00 H new ATOM 0 HG13 ILE A 45 5.957 -24.976 19.506 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.005 -23.005 21.964 1.00 0.00 H new ATOM 0 HG22 ILE A 45 4.621 -23.987 23.314 1.00 0.00 H new ATOM 0 HG23 ILE A 45 5.756 -23.106 22.264 1.00 0.00 H new ATOM 0 HD11 ILE A 45 4.125 -24.299 18.033 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.642 -25.691 19.030 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.063 -24.059 19.441 1.00 0.00 H new ATOM 766 N CYS A 46 4.894 -26.947 23.622 1.00 0.00 N ATOM 767 CA CYS A 46 4.629 -27.328 25.005 1.00 0.00 C ATOM 768 C CYS A 46 5.903 -27.813 25.689 1.00 0.00 C ATOM 769 O CYS A 46 6.119 -27.557 26.874 1.00 0.00 O ATOM 770 CB CYS A 46 3.560 -28.421 25.058 1.00 0.00 C ATOM 771 SG CYS A 46 2.210 -28.077 26.211 1.00 0.00 S ATOM 0 H CYS A 46 4.269 -27.376 22.939 1.00 0.00 H new ATOM 0 HA CYS A 46 4.266 -26.448 25.536 1.00 0.00 H new ATOM 0 HB2 CYS A 46 3.145 -28.557 24.059 1.00 0.00 H new ATOM 0 HB3 CYS A 46 4.032 -29.363 25.338 1.00 0.00 H new ATOM 0 HG CYS A 46 2.588 -28.367 27.421 1.00 0.00 H new ATOM 777 N ARG A 47 6.743 -28.515 24.936 1.00 0.00 N ATOM 778 CA ARG A 47 7.994 -29.038 25.471 1.00 0.00 C ATOM 779 C ARG A 47 9.023 -27.923 25.636 1.00 0.00 C ATOM 780 O ARG A 47 9.609 -27.759 26.705 1.00 0.00 O ATOM 781 CB ARG A 47 8.550 -30.128 24.553 1.00 0.00 C ATOM 782 CG ARG A 47 10.067 -30.137 24.467 1.00 0.00 C ATOM 783 CD ARG A 47 10.579 -31.390 23.774 1.00 0.00 C ATOM 784 NE ARG A 47 10.075 -31.504 22.408 1.00 0.00 N ATOM 785 CZ ARG A 47 10.466 -32.446 21.557 1.00 0.00 C ATOM 786 NH1 ARG A 47 11.361 -33.351 21.929 1.00 0.00 N ATOM 787 NH2 ARG A 47 9.961 -32.485 20.330 1.00 0.00 N ATOM 0 H ARG A 47 6.580 -28.735 23.953 1.00 0.00 H new ATOM 0 HA ARG A 47 7.789 -29.468 26.451 1.00 0.00 H new ATOM 0 HB2 ARG A 47 8.209 -31.100 24.909 1.00 0.00 H new ATOM 0 HB3 ARG A 47 8.139 -29.993 23.553 1.00 0.00 H new ATOM 0 HG2 ARG A 47 10.407 -29.255 23.924 1.00 0.00 H new ATOM 0 HG3 ARG A 47 10.490 -30.076 25.470 1.00 0.00 H new ATOM 0 HD2 ARG A 47 11.669 -31.376 23.758 1.00 0.00 H new ATOM 0 HD3 ARG A 47 10.280 -32.269 24.346 1.00 0.00 H new ATOM 0 HE ARG A 47 9.385 -30.823 22.090 1.00 0.00 H new ATOM 0 HH11 ARG A 47 11.751 -33.325 22.871 1.00 0.00 H new ATOM 0 HH12 ARG A 47 11.659 -34.073 21.273 1.00 0.00 H new ATOM 0 HH21 ARG A 47 9.272 -31.791 20.040 1.00 0.00 H new ATOM 0 HH22 ARG A 47 10.262 -33.209 19.677 1.00 0.00 H new ATOM 801 N SER A 48 9.237 -27.160 24.569 1.00 0.00 N ATOM 802 CA SER A 48 10.198 -26.064 24.593 1.00 0.00 C ATOM 803 C SER A 48 9.923 -25.127 25.765 1.00 0.00 C ATOM 804 O SER A 48 10.822 -24.803 26.541 1.00 0.00 O ATOM 805 CB SER A 48 10.147 -25.283 23.279 1.00 0.00 C ATOM 806 OG SER A 48 11.428 -24.791 22.928 1.00 0.00 O ATOM 0 H SER A 48 8.758 -27.281 23.677 1.00 0.00 H new ATOM 0 HA SER A 48 11.194 -26.490 24.715 1.00 0.00 H new ATOM 0 HB2 SER A 48 9.771 -25.927 22.484 1.00 0.00 H new ATOM 0 HB3 SER A 48 9.448 -24.452 23.373 1.00 0.00 H new ATOM 0 HG SER A 48 11.344 -24.168 22.176 1.00 0.00 H new ATOM 812 N VAL A 49 8.672 -24.693 25.888 1.00 0.00 N ATOM 813 CA VAL A 49 8.276 -23.794 26.965 1.00 0.00 C ATOM 814 C VAL A 49 8.207 -24.531 28.298 1.00 0.00 C ATOM 815 O VAL A 49 8.030 -23.916 29.350 1.00 0.00 O ATOM 816 CB VAL A 49 6.910 -23.143 26.679 1.00 0.00 C ATOM 817 CG1 VAL A 49 6.624 -22.039 27.686 1.00 0.00 C ATOM 818 CG2 VAL A 49 6.865 -22.604 25.257 1.00 0.00 C ATOM 0 H VAL A 49 7.915 -24.950 25.254 1.00 0.00 H new ATOM 0 HA VAL A 49 9.036 -23.015 27.023 1.00 0.00 H new ATOM 0 HB VAL A 49 6.135 -23.903 26.780 1.00 0.00 H new ATOM 0 HG11 VAL A 49 5.655 -21.590 27.468 1.00 0.00 H new ATOM 0 HG12 VAL A 49 6.612 -22.458 28.692 1.00 0.00 H new ATOM 0 HG13 VAL A 49 7.400 -21.276 27.620 1.00 0.00 H new ATOM 0 HG21 VAL A 49 5.893 -22.147 25.072 1.00 0.00 H new ATOM 0 HG22 VAL A 49 7.648 -21.857 25.126 1.00 0.00 H new ATOM 0 HG23 VAL A 49 7.022 -23.421 24.553 1.00 0.00 H new ATOM 828 N SER A 50 8.349 -25.851 28.246 1.00 0.00 N ATOM 829 CA SER A 50 8.299 -26.673 29.450 1.00 0.00 C ATOM 830 C SER A 50 6.919 -26.604 30.098 1.00 0.00 C ATOM 831 O SER A 50 6.775 -26.818 31.302 1.00 0.00 O ATOM 832 CB SER A 50 9.367 -26.220 30.447 1.00 0.00 C ATOM 833 OG SER A 50 10.584 -25.918 29.788 1.00 0.00 O ATOM 0 H SER A 50 8.500 -26.375 27.384 1.00 0.00 H new ATOM 0 HA SER A 50 8.495 -27.706 29.163 1.00 0.00 H new ATOM 0 HB2 SER A 50 9.015 -25.342 30.988 1.00 0.00 H new ATOM 0 HB3 SER A 50 9.535 -27.003 31.186 1.00 0.00 H new ATOM 0 HG SER A 50 11.250 -25.629 30.447 1.00 0.00 H new ATOM 839 N PHE A 51 5.908 -26.302 29.291 1.00 0.00 N ATOM 840 CA PHE A 51 4.539 -26.203 29.785 1.00 0.00 C ATOM 841 C PHE A 51 3.888 -27.581 29.864 1.00 0.00 C ATOM 842 O PHE A 51 4.318 -28.536 29.217 1.00 0.00 O ATOM 843 CB PHE A 51 3.713 -25.288 28.879 1.00 0.00 C ATOM 844 CG PHE A 51 3.387 -23.961 29.505 1.00 0.00 C ATOM 845 CD1 PHE A 51 4.349 -23.259 30.212 1.00 0.00 C ATOM 846 CD2 PHE A 51 2.119 -23.416 29.384 1.00 0.00 C ATOM 847 CE1 PHE A 51 4.052 -22.039 30.789 1.00 0.00 C ATOM 848 CE2 PHE A 51 1.816 -22.196 29.959 1.00 0.00 C ATOM 849 CZ PHE A 51 2.784 -21.507 30.662 1.00 0.00 C ATOM 0 H PHE A 51 6.010 -26.122 28.292 1.00 0.00 H new ATOM 0 HA PHE A 51 4.571 -25.778 30.788 1.00 0.00 H new ATOM 0 HB2 PHE A 51 4.260 -25.119 27.951 1.00 0.00 H new ATOM 0 HB3 PHE A 51 2.785 -25.794 28.614 1.00 0.00 H new ATOM 0 HD1 PHE A 51 5.343 -23.670 30.314 1.00 0.00 H new ATOM 0 HD2 PHE A 51 1.359 -23.950 28.834 1.00 0.00 H new ATOM 0 HE1 PHE A 51 4.811 -21.502 31.339 1.00 0.00 H new ATOM 0 HE2 PHE A 51 0.823 -21.782 29.858 1.00 0.00 H new ATOM 0 HZ PHE A 51 2.550 -20.553 31.112 1.00 0.00 H new ATOM 859 N PRO A 52 2.826 -27.688 30.676 1.00 0.00 N ATOM 860 CA PRO A 52 2.093 -28.943 30.860 1.00 0.00 C ATOM 861 C PRO A 52 1.305 -29.342 29.616 1.00 0.00 C ATOM 862 O PRO A 52 0.321 -28.694 29.259 1.00 0.00 O ATOM 863 CB PRO A 52 1.142 -28.633 32.018 1.00 0.00 C ATOM 864 CG PRO A 52 0.956 -27.156 31.970 1.00 0.00 C ATOM 865 CD PRO A 52 2.259 -26.590 31.477 1.00 0.00 C ATOM 0 HA PRO A 52 2.763 -29.781 31.053 1.00 0.00 H new ATOM 0 HB2 PRO A 52 0.193 -29.156 31.901 1.00 0.00 H new ATOM 0 HB3 PRO A 52 1.564 -28.948 32.972 1.00 0.00 H new ATOM 0 HG2 PRO A 52 0.137 -26.887 31.303 1.00 0.00 H new ATOM 0 HG3 PRO A 52 0.707 -26.762 32.955 1.00 0.00 H new ATOM 0 HD2 PRO A 52 2.106 -25.693 30.878 1.00 0.00 H new ATOM 0 HD3 PRO A 52 2.915 -26.314 32.302 1.00 0.00 H new ATOM 873 N VAL A 53 1.744 -30.412 28.961 1.00 0.00 N ATOM 874 CA VAL A 53 1.078 -30.897 27.758 1.00 0.00 C ATOM 875 C VAL A 53 0.079 -32.000 28.089 1.00 0.00 C ATOM 876 O VAL A 53 -0.254 -32.826 27.240 1.00 0.00 O ATOM 877 CB VAL A 53 2.095 -31.432 26.731 1.00 0.00 C ATOM 878 CG1 VAL A 53 2.641 -32.781 27.174 1.00 0.00 C ATOM 879 CG2 VAL A 53 1.457 -31.532 25.353 1.00 0.00 C ATOM 0 H VAL A 53 2.557 -30.959 29.243 1.00 0.00 H new ATOM 0 HA VAL A 53 0.548 -30.048 27.326 1.00 0.00 H new ATOM 0 HB VAL A 53 2.928 -30.732 26.671 1.00 0.00 H new ATOM 0 HG11 VAL A 53 3.357 -33.143 26.437 1.00 0.00 H new ATOM 0 HG12 VAL A 53 3.136 -32.674 28.139 1.00 0.00 H new ATOM 0 HG13 VAL A 53 1.821 -33.494 27.264 1.00 0.00 H new ATOM 0 HG21 VAL A 53 2.189 -31.911 24.640 1.00 0.00 H new ATOM 0 HG22 VAL A 53 0.605 -32.211 25.395 1.00 0.00 H new ATOM 0 HG23 VAL A 53 1.119 -30.545 25.036 1.00 0.00 H new ATOM 889 N SER A 54 -0.396 -32.007 29.331 1.00 0.00 N ATOM 890 CA SER A 54 -1.355 -33.010 29.777 1.00 0.00 C ATOM 891 C SER A 54 -2.725 -32.768 29.151 1.00 0.00 C ATOM 892 O SER A 54 -3.600 -33.632 29.190 1.00 0.00 O ATOM 893 CB SER A 54 -1.468 -32.996 31.302 1.00 0.00 C ATOM 894 OG SER A 54 -0.956 -31.789 31.840 1.00 0.00 O ATOM 0 H SER A 54 -0.132 -31.329 30.046 1.00 0.00 H new ATOM 0 HA SER A 54 -0.996 -33.988 29.456 1.00 0.00 H new ATOM 0 HB2 SER A 54 -2.512 -33.114 31.594 1.00 0.00 H new ATOM 0 HB3 SER A 54 -0.923 -33.843 31.718 1.00 0.00 H new ATOM 0 HG SER A 54 -1.041 -31.804 32.816 1.00 0.00 H new ATOM 900 N GLY A 55 -2.904 -31.583 28.574 1.00 0.00 N ATOM 901 CA GLY A 55 -4.170 -31.247 27.948 1.00 0.00 C ATOM 902 C GLY A 55 -4.341 -31.907 26.595 1.00 0.00 C ATOM 903 O GLY A 55 -4.108 -33.107 26.448 1.00 0.00 O ATOM 0 H GLY A 55 -2.196 -30.851 28.529 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -4.987 -31.550 28.603 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -4.239 -30.165 27.832 1.00 0.00 H new ATOM 907 N ARG A 56 -4.751 -31.123 25.603 1.00 0.00 N ATOM 908 CA ARG A 56 -4.956 -31.639 24.255 1.00 0.00 C ATOM 909 C ARG A 56 -4.560 -30.601 23.209 1.00 0.00 C ATOM 910 O ARG A 56 -4.146 -29.491 23.545 1.00 0.00 O ATOM 911 CB ARG A 56 -6.418 -32.045 24.059 1.00 0.00 C ATOM 912 CG ARG A 56 -7.387 -30.875 24.112 1.00 0.00 C ATOM 913 CD ARG A 56 -8.658 -31.239 24.864 1.00 0.00 C ATOM 914 NE ARG A 56 -9.574 -32.026 24.042 1.00 0.00 N ATOM 915 CZ ARG A 56 -10.864 -32.178 24.319 1.00 0.00 C ATOM 916 NH1 ARG A 56 -11.388 -31.600 25.391 1.00 0.00 N ATOM 917 NH2 ARG A 56 -11.633 -32.910 23.523 1.00 0.00 N ATOM 0 H ARG A 56 -4.948 -30.128 25.708 1.00 0.00 H new ATOM 0 HA ARG A 56 -4.322 -32.517 24.128 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -6.521 -32.548 23.097 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -6.692 -32.768 24.828 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -6.907 -30.025 24.597 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -7.639 -30.563 23.098 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -8.400 -31.803 25.760 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -9.158 -30.328 25.193 1.00 0.00 H new ATOM 0 HE ARG A 56 -9.202 -32.484 23.210 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -10.800 -31.037 26.005 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -12.379 -31.718 25.601 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -11.234 -33.357 22.698 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -12.624 -33.026 23.737 1.00 0.00 H new ATOM 931 N LYS A 57 -4.689 -30.970 21.939 1.00 0.00 N ATOM 932 CA LYS A 57 -4.346 -30.072 20.843 1.00 0.00 C ATOM 933 C LYS A 57 -5.174 -28.792 20.908 1.00 0.00 C ATOM 934 O LYS A 57 -4.683 -27.707 20.599 1.00 0.00 O ATOM 935 CB LYS A 57 -4.568 -30.768 19.498 1.00 0.00 C ATOM 936 CG LYS A 57 -5.938 -31.411 19.365 1.00 0.00 C ATOM 937 CD LYS A 57 -5.829 -32.893 19.050 1.00 0.00 C ATOM 938 CE LYS A 57 -7.010 -33.670 19.611 1.00 0.00 C ATOM 939 NZ LYS A 57 -6.776 -35.140 19.573 1.00 0.00 N ATOM 0 H LYS A 57 -5.029 -31.885 21.643 1.00 0.00 H new ATOM 0 HA LYS A 57 -3.293 -29.808 20.939 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.438 -30.041 18.696 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -3.803 -31.532 19.363 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -6.496 -31.275 20.291 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -6.501 -30.911 18.577 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -5.779 -33.034 17.970 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -4.902 -33.287 19.466 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -7.194 -33.358 20.639 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -7.907 -33.430 19.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -7.604 -35.634 19.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -6.625 -35.442 18.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -5.935 -35.372 20.139 1.00 0.00 H new ATOM 953 N ALA A 58 -6.433 -28.927 21.313 1.00 0.00 N ATOM 954 CA ALA A 58 -7.327 -27.782 21.422 1.00 0.00 C ATOM 955 C ALA A 58 -6.871 -26.831 22.524 1.00 0.00 C ATOM 956 O ALA A 58 -6.883 -25.613 22.351 1.00 0.00 O ATOM 957 CB ALA A 58 -8.752 -28.248 21.682 1.00 0.00 C ATOM 0 H ALA A 58 -6.856 -29.819 21.571 1.00 0.00 H new ATOM 0 HA ALA A 58 -7.299 -27.240 20.476 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -9.409 -27.382 21.761 1.00 0.00 H new ATOM 0 HB2 ALA A 58 -9.084 -28.881 20.859 1.00 0.00 H new ATOM 0 HB3 ALA A 58 -8.785 -28.815 22.612 1.00 0.00 H new ATOM 963 N VAL A 59 -6.469 -27.397 23.658 1.00 0.00 N ATOM 964 CA VAL A 59 -6.008 -26.600 24.788 1.00 0.00 C ATOM 965 C VAL A 59 -4.734 -25.837 24.439 1.00 0.00 C ATOM 966 O VAL A 59 -4.618 -24.642 24.715 1.00 0.00 O ATOM 967 CB VAL A 59 -5.744 -27.479 26.025 1.00 0.00 C ATOM 968 CG1 VAL A 59 -5.206 -26.639 27.173 1.00 0.00 C ATOM 969 CG2 VAL A 59 -7.011 -28.211 26.437 1.00 0.00 C ATOM 0 H VAL A 59 -6.453 -28.404 23.818 1.00 0.00 H new ATOM 0 HA VAL A 59 -6.802 -25.890 25.019 1.00 0.00 H new ATOM 0 HB VAL A 59 -4.990 -28.222 25.767 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -5.026 -27.278 28.038 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -4.272 -26.165 26.871 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -5.934 -25.871 27.434 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -6.807 -28.827 27.312 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -7.788 -27.486 26.677 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -7.348 -28.845 25.617 1.00 0.00 H new ATOM 979 N LEU A 60 -3.781 -26.534 23.831 1.00 0.00 N ATOM 980 CA LEU A 60 -2.515 -25.923 23.444 1.00 0.00 C ATOM 981 C LEU A 60 -2.737 -24.807 22.428 1.00 0.00 C ATOM 982 O LEU A 60 -2.314 -23.670 22.639 1.00 0.00 O ATOM 983 CB LEU A 60 -1.574 -26.978 22.860 1.00 0.00 C ATOM 984 CG LEU A 60 -0.352 -27.330 23.709 1.00 0.00 C ATOM 985 CD1 LEU A 60 -0.234 -28.837 23.877 1.00 0.00 C ATOM 986 CD2 LEU A 60 0.914 -26.761 23.084 1.00 0.00 C ATOM 0 H LEU A 60 -3.861 -27.523 23.595 1.00 0.00 H new ATOM 0 HA LEU A 60 -2.060 -25.493 24.336 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -2.146 -27.890 22.686 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.227 -26.629 21.887 1.00 0.00 H new ATOM 0 HG LEU A 60 -0.479 -26.884 24.695 1.00 0.00 H new ATOM 0 HD11 LEU A 60 0.641 -29.068 24.484 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -1.128 -29.219 24.369 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -0.131 -29.305 22.898 1.00 0.00 H new ATOM 0 HD21 LEU A 60 1.773 -27.021 23.702 1.00 0.00 H new ATOM 0 HD22 LEU A 60 1.046 -27.177 22.085 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.831 -25.676 23.017 1.00 0.00 H new ATOM 998 N GLN A 61 -3.406 -25.139 21.328 1.00 0.00 N ATOM 999 CA GLN A 61 -3.686 -24.164 20.281 1.00 0.00 C ATOM 1000 C GLN A 61 -4.493 -22.992 20.830 1.00 0.00 C ATOM 1001 O GLN A 61 -4.340 -21.856 20.381 1.00 0.00 O ATOM 1002 CB GLN A 61 -4.444 -24.825 19.129 1.00 0.00 C ATOM 1003 CG GLN A 61 -5.909 -25.086 19.435 1.00 0.00 C ATOM 1004 CD GLN A 61 -6.679 -25.583 18.227 1.00 0.00 C ATOM 1005 OE1 GLN A 61 -7.380 -26.593 18.296 1.00 0.00 O ATOM 1006 NE2 GLN A 61 -6.551 -24.874 17.111 1.00 0.00 N ATOM 0 H GLN A 61 -3.764 -26.075 21.139 1.00 0.00 H new ATOM 0 HA GLN A 61 -2.734 -23.784 19.910 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -4.374 -24.189 18.247 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -3.959 -25.769 18.881 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -5.983 -25.822 20.236 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -6.369 -24.168 19.801 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -5.959 -24.043 17.100 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -7.045 -25.160 16.266 1.00 0.00 H new ATOM 1015 N ASP A 62 -5.351 -23.276 21.803 1.00 0.00 N ATOM 1016 CA ASP A 62 -6.183 -22.245 22.415 1.00 0.00 C ATOM 1017 C ASP A 62 -5.336 -21.290 23.250 1.00 0.00 C ATOM 1018 O ASP A 62 -5.550 -20.077 23.232 1.00 0.00 O ATOM 1019 CB ASP A 62 -7.265 -22.884 23.287 1.00 0.00 C ATOM 1020 CG ASP A 62 -8.480 -23.306 22.485 1.00 0.00 C ATOM 1021 OD1 ASP A 62 -8.419 -23.247 21.239 1.00 0.00 O ATOM 1022 OD2 ASP A 62 -9.492 -23.696 23.104 1.00 0.00 O ATOM 0 H ASP A 62 -5.489 -24.211 22.186 1.00 0.00 H new ATOM 0 HA ASP A 62 -6.661 -21.676 21.617 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -6.850 -23.753 23.797 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -7.570 -22.177 24.059 1.00 0.00 H new ATOM 1027 N LEU A 63 -4.377 -21.844 23.982 1.00 0.00 N ATOM 1028 CA LEU A 63 -3.498 -21.041 24.826 1.00 0.00 C ATOM 1029 C LEU A 63 -2.628 -20.115 23.982 1.00 0.00 C ATOM 1030 O LEU A 63 -2.553 -18.913 24.238 1.00 0.00 O ATOM 1031 CB LEU A 63 -2.614 -21.947 25.684 1.00 0.00 C ATOM 1032 CG LEU A 63 -3.263 -22.520 26.945 1.00 0.00 C ATOM 1033 CD1 LEU A 63 -2.296 -23.442 27.672 1.00 0.00 C ATOM 1034 CD2 LEU A 63 -3.727 -21.398 27.863 1.00 0.00 C ATOM 0 H LEU A 63 -4.188 -22.846 24.009 1.00 0.00 H new ATOM 0 HA LEU A 63 -4.122 -20.429 25.478 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.272 -22.777 25.066 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -1.729 -21.383 25.979 1.00 0.00 H new ATOM 0 HG LEU A 63 -4.135 -23.104 26.649 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -2.775 -23.840 28.566 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -2.014 -24.265 27.015 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -1.405 -22.883 27.956 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -4.186 -21.824 28.755 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.872 -20.787 28.152 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -4.456 -20.778 27.341 1.00 0.00 H new ATOM 1046 N ILE A 64 -1.975 -20.682 22.973 1.00 0.00 N ATOM 1047 CA ILE A 64 -1.114 -19.907 22.089 1.00 0.00 C ATOM 1048 C ILE A 64 -1.913 -18.855 21.327 1.00 0.00 C ATOM 1049 O ILE A 64 -1.546 -17.680 21.302 1.00 0.00 O ATOM 1050 CB ILE A 64 -0.384 -20.812 21.079 1.00 0.00 C ATOM 1051 CG1 ILE A 64 0.463 -21.853 21.813 1.00 0.00 C ATOM 1052 CG2 ILE A 64 0.483 -19.976 20.149 1.00 0.00 C ATOM 1053 CD1 ILE A 64 1.469 -21.249 22.768 1.00 0.00 C ATOM 0 H ILE A 64 -2.026 -21.675 22.748 1.00 0.00 H new ATOM 0 HA ILE A 64 -0.376 -19.412 22.721 1.00 0.00 H new ATOM 0 HB ILE A 64 -1.128 -21.335 20.478 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -0.196 -22.521 22.367 1.00 0.00 H new ATOM 0 HG13 ILE A 64 0.991 -22.463 21.080 1.00 0.00 H new ATOM 0 HG21 ILE A 64 0.992 -20.630 19.441 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -0.144 -19.270 19.605 1.00 0.00 H new ATOM 0 HG23 ILE A 64 1.222 -19.429 20.734 1.00 0.00 H new ATOM 0 HD11 ILE A 64 2.034 -22.045 23.253 1.00 0.00 H new ATOM 0 HD12 ILE A 64 2.152 -20.603 22.216 1.00 0.00 H new ATOM 0 HD13 ILE A 64 0.947 -20.663 23.524 1.00 0.00 H new ATOM 1065 N ARG A 65 -3.008 -19.285 20.708 1.00 0.00 N ATOM 1066 CA ARG A 65 -3.859 -18.380 19.946 1.00 0.00 C ATOM 1067 C ARG A 65 -4.295 -17.193 20.801 1.00 0.00 C ATOM 1068 O ARG A 65 -4.186 -16.041 20.383 1.00 0.00 O ATOM 1069 CB ARG A 65 -5.089 -19.123 19.422 1.00 0.00 C ATOM 1070 CG ARG A 65 -5.852 -18.359 18.352 1.00 0.00 C ATOM 1071 CD ARG A 65 -6.649 -19.297 17.459 1.00 0.00 C ATOM 1072 NE ARG A 65 -7.982 -19.561 17.993 1.00 0.00 N ATOM 1073 CZ ARG A 65 -8.982 -18.689 17.936 1.00 0.00 C ATOM 1074 NH1 ARG A 65 -8.801 -17.503 17.371 1.00 0.00 N ATOM 1075 NH2 ARG A 65 -10.167 -19.002 18.444 1.00 0.00 N ATOM 0 H ARG A 65 -3.326 -20.254 20.720 1.00 0.00 H new ATOM 0 HA ARG A 65 -3.282 -18.004 19.101 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -4.776 -20.085 19.016 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -5.760 -19.331 20.256 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -6.526 -17.644 18.824 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -5.152 -17.784 17.745 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -6.737 -18.862 16.464 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -6.110 -20.238 17.349 1.00 0.00 H new ATOM 0 HE ARG A 65 -8.155 -20.464 18.434 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -7.892 -17.258 16.979 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -9.571 -16.835 17.329 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -10.311 -19.913 18.879 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -10.934 -18.331 18.400 1.00 0.00 H new ATOM 1089 N ASN A 66 -4.788 -17.484 22.000 1.00 0.00 N ATOM 1090 CA ASN A 66 -5.241 -16.442 22.914 1.00 0.00 C ATOM 1091 C ASN A 66 -4.085 -15.533 23.318 1.00 0.00 C ATOM 1092 O ASN A 66 -4.252 -14.321 23.455 1.00 0.00 O ATOM 1093 CB ASN A 66 -5.874 -17.066 24.160 1.00 0.00 C ATOM 1094 CG ASN A 66 -7.263 -17.610 23.891 1.00 0.00 C ATOM 1095 OD1 ASN A 66 -7.564 -18.761 24.211 1.00 0.00 O ATOM 1096 ND2 ASN A 66 -8.119 -16.784 23.301 1.00 0.00 N ATOM 0 H ASN A 66 -4.884 -18.433 22.362 1.00 0.00 H new ATOM 0 HA ASN A 66 -5.989 -15.841 22.397 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -5.236 -17.871 24.524 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -5.926 -16.318 24.951 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -9.069 -17.095 23.096 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -7.827 -15.839 23.053 1.00 0.00 H new ATOM 1103 N PHE A 67 -2.911 -16.126 23.508 1.00 0.00 N ATOM 1104 CA PHE A 67 -1.726 -15.371 23.897 1.00 0.00 C ATOM 1105 C PHE A 67 -1.408 -14.290 22.868 1.00 0.00 C ATOM 1106 O PHE A 67 -1.212 -13.125 23.214 1.00 0.00 O ATOM 1107 CB PHE A 67 -0.527 -16.308 24.056 1.00 0.00 C ATOM 1108 CG PHE A 67 -0.315 -16.775 25.468 1.00 0.00 C ATOM 1109 CD1 PHE A 67 -0.209 -15.862 26.505 1.00 0.00 C ATOM 1110 CD2 PHE A 67 -0.220 -18.127 25.758 1.00 0.00 C ATOM 1111 CE1 PHE A 67 -0.014 -16.289 27.805 1.00 0.00 C ATOM 1112 CE2 PHE A 67 -0.025 -18.559 27.056 1.00 0.00 C ATOM 1113 CZ PHE A 67 0.080 -17.639 28.081 1.00 0.00 C ATOM 0 H PHE A 67 -2.755 -17.128 23.399 1.00 0.00 H new ATOM 0 HA PHE A 67 -1.931 -14.889 24.853 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -0.666 -17.176 23.412 1.00 0.00 H new ATOM 0 HB3 PHE A 67 0.372 -15.797 23.712 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -0.280 -14.805 26.295 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -0.299 -18.851 24.961 1.00 0.00 H new ATOM 0 HE1 PHE A 67 0.065 -15.567 28.605 1.00 0.00 H new ATOM 0 HE2 PHE A 67 0.045 -19.615 27.269 1.00 0.00 H new ATOM 0 HZ PHE A 67 0.235 -17.975 29.096 1.00 0.00 H new ATOM 1123 N LEU A 68 -1.357 -14.686 21.600 1.00 0.00 N ATOM 1124 CA LEU A 68 -1.062 -13.752 20.519 1.00 0.00 C ATOM 1125 C LEU A 68 -2.201 -12.755 20.334 1.00 0.00 C ATOM 1126 O LEU A 68 -1.971 -11.584 20.034 1.00 0.00 O ATOM 1127 CB LEU A 68 -0.818 -14.513 19.214 1.00 0.00 C ATOM 1128 CG LEU A 68 0.425 -14.105 18.422 1.00 0.00 C ATOM 1129 CD1 LEU A 68 0.602 -15.004 17.208 1.00 0.00 C ATOM 1130 CD2 LEU A 68 0.332 -12.646 17.999 1.00 0.00 C ATOM 0 H LEU A 68 -1.516 -15.647 21.296 1.00 0.00 H new ATOM 0 HA LEU A 68 -0.161 -13.200 20.785 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -0.745 -15.576 19.445 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -1.691 -14.385 18.574 1.00 0.00 H new ATOM 0 HG LEU A 68 1.297 -14.221 19.065 1.00 0.00 H new ATOM 0 HD11 LEU A 68 1.491 -14.699 16.656 1.00 0.00 H new ATOM 0 HD12 LEU A 68 0.714 -16.038 17.534 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.272 -14.920 16.562 1.00 0.00 H new ATOM 0 HD21 LEU A 68 1.225 -12.373 17.437 1.00 0.00 H new ATOM 0 HD22 LEU A 68 -0.549 -12.504 17.373 1.00 0.00 H new ATOM 0 HD23 LEU A 68 0.253 -12.015 18.884 1.00 0.00 H new ATOM 1142 N GLN A 69 -3.430 -13.228 20.518 1.00 0.00 N ATOM 1143 CA GLN A 69 -4.605 -12.377 20.372 1.00 0.00 C ATOM 1144 C GLN A 69 -4.649 -11.318 21.469 1.00 0.00 C ATOM 1145 O GLN A 69 -5.006 -10.167 21.220 1.00 0.00 O ATOM 1146 CB GLN A 69 -5.880 -13.221 20.411 1.00 0.00 C ATOM 1147 CG GLN A 69 -6.391 -13.615 19.035 1.00 0.00 C ATOM 1148 CD GLN A 69 -6.730 -12.415 18.172 1.00 0.00 C ATOM 1149 OE1 GLN A 69 -7.376 -11.471 18.628 1.00 0.00 O ATOM 1150 NE2 GLN A 69 -6.295 -12.445 16.918 1.00 0.00 N ATOM 0 H GLN A 69 -3.637 -14.195 20.768 1.00 0.00 H new ATOM 0 HA GLN A 69 -4.540 -11.873 19.408 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -5.690 -14.124 20.991 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -6.658 -12.664 20.933 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -5.636 -14.219 18.531 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -7.277 -14.240 19.146 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -5.763 -13.248 16.582 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -6.493 -11.665 16.291 1.00 0.00 H new ATOM 1159 N ASN A 70 -4.283 -11.715 22.684 1.00 0.00 N ATOM 1160 CA ASN A 70 -4.282 -10.800 23.819 1.00 0.00 C ATOM 1161 C ASN A 70 -2.970 -10.024 23.891 1.00 0.00 C ATOM 1162 O ASN A 70 -2.872 -9.013 24.586 1.00 0.00 O ATOM 1163 CB ASN A 70 -4.504 -11.570 25.122 1.00 0.00 C ATOM 1164 CG ASN A 70 -5.944 -12.011 25.295 1.00 0.00 C ATOM 1165 OD1 ASN A 70 -6.816 -11.206 25.625 1.00 0.00 O ATOM 1166 ND2 ASN A 70 -6.201 -13.295 25.074 1.00 0.00 N ATOM 0 H ASN A 70 -3.983 -12.664 22.907 1.00 0.00 H new ATOM 0 HA ASN A 70 -5.097 -10.089 23.681 1.00 0.00 H new ATOM 0 HB2 ASN A 70 -3.854 -12.445 25.139 1.00 0.00 H new ATOM 0 HB3 ASN A 70 -4.215 -10.943 25.965 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -7.152 -13.650 25.176 1.00 0.00 H new ATOM 0 HD22 ASN A 70 -5.448 -13.927 24.802 1.00 0.00 H new ATOM 1173 N ALA A 71 -1.965 -10.504 23.166 1.00 0.00 N ATOM 1174 CA ALA A 71 -0.660 -9.854 23.145 1.00 0.00 C ATOM 1175 C ALA A 71 -0.767 -8.424 22.626 1.00 0.00 C ATOM 1176 O ALA A 71 0.132 -7.608 22.835 1.00 0.00 O ATOM 1177 CB ALA A 71 0.314 -10.655 22.294 1.00 0.00 C ATOM 0 H ALA A 71 -2.029 -11.340 22.586 1.00 0.00 H new ATOM 0 HA ALA A 71 -0.285 -9.814 24.168 1.00 0.00 H new ATOM 0 HB1 ALA A 71 1.284 -10.159 22.287 1.00 0.00 H new ATOM 0 HB2 ALA A 71 0.422 -11.657 22.710 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -0.065 -10.724 21.275 1.00 0.00 H new ATOM 1183 N LEU A 72 -1.870 -8.127 21.949 1.00 0.00 N ATOM 1184 CA LEU A 72 -2.095 -6.794 21.399 1.00 0.00 C ATOM 1185 C LEU A 72 -3.369 -6.178 21.968 1.00 0.00 C ATOM 1186 O LEU A 72 -4.305 -5.869 21.230 1.00 0.00 O ATOM 1187 CB LEU A 72 -2.183 -6.859 19.873 1.00 0.00 C ATOM 1188 CG LEU A 72 -3.087 -7.949 19.299 1.00 0.00 C ATOM 1189 CD1 LEU A 72 -4.368 -7.343 18.746 1.00 0.00 C ATOM 1190 CD2 LEU A 72 -2.357 -8.734 18.218 1.00 0.00 C ATOM 0 H LEU A 72 -2.623 -8.791 21.767 1.00 0.00 H new ATOM 0 HA LEU A 72 -1.252 -6.164 21.682 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -2.534 -5.894 19.508 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -1.178 -7.003 19.477 1.00 0.00 H new ATOM 0 HG LEU A 72 -3.351 -8.636 20.103 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -5.000 -8.134 18.341 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -4.900 -6.826 19.545 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -4.123 -6.634 17.955 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -3.016 -9.506 17.821 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -2.063 -8.059 17.414 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -1.468 -9.200 18.644 1.00 0.00 H new ATOM 1202 N VAL A 73 -3.397 -5.999 23.285 1.00 0.00 N ATOM 1203 CA VAL A 73 -4.555 -5.416 23.952 1.00 0.00 C ATOM 1204 C VAL A 73 -4.302 -3.957 24.317 1.00 0.00 C ATOM 1205 O VAL A 73 -3.201 -3.591 24.729 1.00 0.00 O ATOM 1206 CB VAL A 73 -4.919 -6.197 25.229 1.00 0.00 C ATOM 1207 CG1 VAL A 73 -5.987 -5.459 26.021 1.00 0.00 C ATOM 1208 CG2 VAL A 73 -5.380 -7.604 24.878 1.00 0.00 C ATOM 0 H VAL A 73 -2.631 -6.249 23.911 1.00 0.00 H new ATOM 0 HA VAL A 73 -5.387 -5.473 23.250 1.00 0.00 H new ATOM 0 HB VAL A 73 -4.029 -6.275 25.853 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -6.231 -6.026 26.919 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -5.615 -4.474 26.303 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -6.882 -5.347 25.409 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -5.633 -8.142 25.791 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -6.258 -7.549 24.234 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -4.580 -8.130 24.357 1.00 0.00 H new ATOM 1218 N VAL A 74 -5.330 -3.128 24.164 1.00 0.00 N ATOM 1219 CA VAL A 74 -5.220 -1.709 24.479 1.00 0.00 C ATOM 1220 C VAL A 74 -5.100 -1.487 25.982 1.00 0.00 C ATOM 1221 O VAL A 74 -6.045 -1.726 26.733 1.00 0.00 O ATOM 1222 CB VAL A 74 -6.434 -0.921 23.950 1.00 0.00 C ATOM 1223 CG1 VAL A 74 -6.238 0.571 24.168 1.00 0.00 C ATOM 1224 CG2 VAL A 74 -6.667 -1.228 22.479 1.00 0.00 C ATOM 0 H VAL A 74 -6.248 -3.415 23.824 1.00 0.00 H new ATOM 0 HA VAL A 74 -4.317 -1.345 23.988 1.00 0.00 H new ATOM 0 HB VAL A 74 -7.318 -1.231 24.507 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -7.105 1.111 23.788 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -6.124 0.771 25.233 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -5.344 0.902 23.639 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -7.528 -0.663 22.121 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -5.784 -0.947 21.904 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -6.856 -2.294 22.355 1.00 0.00 H new ATOM 1234 N GLY A 75 -3.930 -1.027 26.416 1.00 0.00 N ATOM 1235 CA GLY A 75 -3.707 -0.780 27.828 1.00 0.00 C ATOM 1236 C GLY A 75 -3.042 -1.952 28.524 1.00 0.00 C ATOM 1237 O GLY A 75 -3.237 -2.165 29.721 1.00 0.00 O ATOM 0 H GLY A 75 -3.133 -0.821 25.814 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -3.086 0.108 27.945 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -4.661 -0.568 28.312 1.00 0.00 H new ATOM 1241 N LYS A 76 -2.256 -2.715 27.773 1.00 0.00 N ATOM 1242 CA LYS A 76 -1.559 -3.872 28.323 1.00 0.00 C ATOM 1243 C LYS A 76 -0.361 -4.247 27.458 1.00 0.00 C ATOM 1244 O LYS A 76 0.786 -4.163 27.899 1.00 0.00 O ATOM 1245 CB LYS A 76 -2.515 -5.062 28.434 1.00 0.00 C ATOM 1246 CG LYS A 76 -1.824 -6.364 28.803 1.00 0.00 C ATOM 1247 CD LYS A 76 -2.554 -7.085 29.923 1.00 0.00 C ATOM 1248 CE LYS A 76 -2.300 -8.584 29.880 1.00 0.00 C ATOM 1249 NZ LYS A 76 -3.471 -9.359 30.374 1.00 0.00 N ATOM 0 H LYS A 76 -2.085 -2.553 26.781 1.00 0.00 H new ATOM 0 HA LYS A 76 -1.198 -3.610 29.317 1.00 0.00 H new ATOM 0 HB2 LYS A 76 -3.275 -4.839 29.183 1.00 0.00 H new ATOM 0 HB3 LYS A 76 -3.033 -5.192 27.484 1.00 0.00 H new ATOM 0 HG2 LYS A 76 -1.772 -7.010 27.927 1.00 0.00 H new ATOM 0 HG3 LYS A 76 -0.798 -6.158 29.109 1.00 0.00 H new ATOM 0 HD2 LYS A 76 -2.230 -6.688 30.885 1.00 0.00 H new ATOM 0 HD3 LYS A 76 -3.624 -6.894 29.843 1.00 0.00 H new ATOM 0 HE2 LYS A 76 -2.071 -8.884 28.858 1.00 0.00 H new ATOM 0 HE3 LYS A 76 -1.425 -8.822 30.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 -3.258 -10.376 30.329 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 -3.674 -9.091 31.358 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 -4.300 -9.152 29.781 1.00 0.00 H new ATOM 1263 N SER A 77 -0.633 -4.661 26.225 1.00 0.00 N ATOM 1264 CA SER A 77 0.424 -5.051 25.299 1.00 0.00 C ATOM 1265 C SER A 77 1.173 -6.276 25.814 1.00 0.00 C ATOM 1266 O SER A 77 1.155 -6.571 27.010 1.00 0.00 O ATOM 1267 CB SER A 77 1.401 -3.893 25.089 1.00 0.00 C ATOM 1268 OG SER A 77 1.237 -3.313 23.806 1.00 0.00 O ATOM 0 H SER A 77 -1.576 -4.735 25.844 1.00 0.00 H new ATOM 0 HA SER A 77 -0.039 -5.304 24.345 1.00 0.00 H new ATOM 0 HB2 SER A 77 1.243 -3.136 25.857 1.00 0.00 H new ATOM 0 HB3 SER A 77 2.424 -4.252 25.201 1.00 0.00 H new ATOM 0 HG SER A 77 1.697 -3.862 23.137 1.00 0.00 H new ATOM 1274 N ASP A 78 1.830 -6.987 24.904 1.00 0.00 N ATOM 1275 CA ASP A 78 2.586 -8.180 25.266 1.00 0.00 C ATOM 1276 C ASP A 78 3.255 -8.791 24.039 1.00 0.00 C ATOM 1277 O ASP A 78 2.805 -9.799 23.493 1.00 0.00 O ATOM 1278 CB ASP A 78 1.670 -9.209 25.929 1.00 0.00 C ATOM 1279 CG ASP A 78 1.832 -9.243 27.436 1.00 0.00 C ATOM 1280 OD1 ASP A 78 2.978 -9.103 27.912 1.00 0.00 O ATOM 1281 OD2 ASP A 78 0.814 -9.412 28.139 1.00 0.00 O ATOM 0 H ASP A 78 1.854 -6.758 23.910 1.00 0.00 H new ATOM 0 HA ASP A 78 3.362 -7.888 25.974 1.00 0.00 H new ATOM 0 HB2 ASP A 78 0.633 -8.980 25.683 1.00 0.00 H new ATOM 0 HB3 ASP A 78 1.883 -10.197 25.521 1.00 0.00 H new ATOM 1286 N PRO A 79 4.356 -8.168 23.592 1.00 0.00 N ATOM 1287 CA PRO A 79 5.110 -8.633 22.424 1.00 0.00 C ATOM 1288 C PRO A 79 5.841 -9.944 22.691 1.00 0.00 C ATOM 1289 O PRO A 79 6.151 -10.693 21.764 1.00 0.00 O ATOM 1290 CB PRO A 79 6.111 -7.503 22.175 1.00 0.00 C ATOM 1291 CG PRO A 79 6.280 -6.847 23.502 1.00 0.00 C ATOM 1292 CD PRO A 79 4.949 -6.962 24.192 1.00 0.00 C ATOM 0 HA PRO A 79 4.459 -8.839 21.574 1.00 0.00 H new ATOM 0 HB2 PRO A 79 7.059 -7.889 21.801 1.00 0.00 H new ATOM 0 HB3 PRO A 79 5.737 -6.800 21.431 1.00 0.00 H new ATOM 0 HG2 PRO A 79 7.064 -7.335 24.082 1.00 0.00 H new ATOM 0 HG3 PRO A 79 6.571 -5.803 23.387 1.00 0.00 H new ATOM 0 HD2 PRO A 79 5.064 -7.065 25.271 1.00 0.00 H new ATOM 0 HD3 PRO A 79 4.330 -6.082 24.020 1.00 0.00 H new ATOM 1300 N TYR A 80 6.115 -10.215 23.962 1.00 0.00 N ATOM 1301 CA TYR A 80 6.812 -11.435 24.351 1.00 0.00 C ATOM 1302 C TYR A 80 6.140 -12.664 23.745 1.00 0.00 C ATOM 1303 O TYR A 80 6.808 -13.557 23.225 1.00 0.00 O ATOM 1304 CB TYR A 80 6.852 -11.562 25.875 1.00 0.00 C ATOM 1305 CG TYR A 80 7.282 -12.929 26.358 1.00 0.00 C ATOM 1306 CD1 TYR A 80 8.314 -13.616 25.732 1.00 0.00 C ATOM 1307 CD2 TYR A 80 6.655 -13.532 27.441 1.00 0.00 C ATOM 1308 CE1 TYR A 80 8.709 -14.865 26.169 1.00 0.00 C ATOM 1309 CE2 TYR A 80 7.045 -14.780 27.887 1.00 0.00 C ATOM 1310 CZ TYR A 80 8.072 -15.443 27.247 1.00 0.00 C ATOM 1311 OH TYR A 80 8.463 -16.687 27.687 1.00 0.00 O ATOM 0 H TYR A 80 5.865 -9.606 24.741 1.00 0.00 H new ATOM 0 HA TYR A 80 7.832 -11.376 23.971 1.00 0.00 H new ATOM 0 HB2 TYR A 80 7.535 -10.813 26.276 1.00 0.00 H new ATOM 0 HB3 TYR A 80 5.863 -11.339 26.276 1.00 0.00 H new ATOM 0 HD1 TYR A 80 8.816 -13.166 24.889 1.00 0.00 H new ATOM 0 HD2 TYR A 80 5.849 -13.017 27.943 1.00 0.00 H new ATOM 0 HE1 TYR A 80 9.512 -15.386 25.669 1.00 0.00 H new ATOM 0 HE2 TYR A 80 6.549 -15.234 28.732 1.00 0.00 H new ATOM 0 HH TYR A 80 8.610 -16.660 28.656 1.00 0.00 H new ATOM 1321 N ARG A 81 4.813 -12.699 23.816 1.00 0.00 N ATOM 1322 CA ARG A 81 4.049 -13.817 23.276 1.00 0.00 C ATOM 1323 C ARG A 81 4.253 -13.937 21.768 1.00 0.00 C ATOM 1324 O ARG A 81 4.302 -15.039 21.223 1.00 0.00 O ATOM 1325 CB ARG A 81 2.562 -13.644 23.588 1.00 0.00 C ATOM 1326 CG ARG A 81 2.154 -14.206 24.941 1.00 0.00 C ATOM 1327 CD ARG A 81 2.964 -13.586 26.068 1.00 0.00 C ATOM 1328 NE ARG A 81 2.219 -13.553 27.324 1.00 0.00 N ATOM 1329 CZ ARG A 81 2.520 -12.748 28.337 1.00 0.00 C ATOM 1330 NH1 ARG A 81 3.546 -11.914 28.242 1.00 0.00 N ATOM 1331 NH2 ARG A 81 1.794 -12.777 29.447 1.00 0.00 N ATOM 0 H ARG A 81 4.245 -11.966 24.242 1.00 0.00 H new ATOM 0 HA ARG A 81 4.408 -14.732 23.748 1.00 0.00 H new ATOM 0 HB2 ARG A 81 2.313 -12.583 23.555 1.00 0.00 H new ATOM 0 HB3 ARG A 81 1.977 -14.133 22.809 1.00 0.00 H new ATOM 0 HG2 ARG A 81 1.093 -14.020 25.109 1.00 0.00 H new ATOM 0 HG3 ARG A 81 2.292 -15.287 24.944 1.00 0.00 H new ATOM 0 HD2 ARG A 81 3.884 -14.153 26.207 1.00 0.00 H new ATOM 0 HD3 ARG A 81 3.253 -12.572 25.791 1.00 0.00 H new ATOM 0 HE ARG A 81 1.424 -14.183 27.429 1.00 0.00 H new ATOM 0 HH11 ARG A 81 4.106 -11.889 27.390 1.00 0.00 H new ATOM 0 HH12 ARG A 81 3.775 -11.297 29.021 1.00 0.00 H new ATOM 0 HH21 ARG A 81 1.004 -13.418 29.523 1.00 0.00 H new ATOM 0 HH22 ARG A 81 2.026 -12.159 30.224 1.00 0.00 H new ATOM 1345 N VAL A 82 4.370 -12.794 21.100 1.00 0.00 N ATOM 1346 CA VAL A 82 4.568 -12.770 19.655 1.00 0.00 C ATOM 1347 C VAL A 82 5.920 -13.364 19.276 1.00 0.00 C ATOM 1348 O VAL A 82 5.993 -14.327 18.513 1.00 0.00 O ATOM 1349 CB VAL A 82 4.477 -11.336 19.100 1.00 0.00 C ATOM 1350 CG1 VAL A 82 4.567 -11.344 17.582 1.00 0.00 C ATOM 1351 CG2 VAL A 82 3.192 -10.666 19.563 1.00 0.00 C ATOM 0 H VAL A 82 4.331 -11.873 21.536 1.00 0.00 H new ATOM 0 HA VAL A 82 3.773 -13.373 19.216 1.00 0.00 H new ATOM 0 HB VAL A 82 5.319 -10.761 19.487 1.00 0.00 H new ATOM 0 HG11 VAL A 82 4.501 -10.322 17.208 1.00 0.00 H new ATOM 0 HG12 VAL A 82 5.517 -11.781 17.276 1.00 0.00 H new ATOM 0 HG13 VAL A 82 3.747 -11.934 17.172 1.00 0.00 H new ATOM 0 HG21 VAL A 82 3.144 -9.654 19.162 1.00 0.00 H new ATOM 0 HG22 VAL A 82 2.335 -11.238 19.208 1.00 0.00 H new ATOM 0 HG23 VAL A 82 3.175 -10.626 20.652 1.00 0.00 H new ATOM 1361 N GLN A 83 6.987 -12.785 19.816 1.00 0.00 N ATOM 1362 CA GLN A 83 8.337 -13.259 19.534 1.00 0.00 C ATOM 1363 C GLN A 83 8.472 -14.743 19.855 1.00 0.00 C ATOM 1364 O GLN A 83 9.054 -15.505 19.084 1.00 0.00 O ATOM 1365 CB GLN A 83 9.361 -12.455 20.338 1.00 0.00 C ATOM 1366 CG GLN A 83 9.041 -12.375 21.822 1.00 0.00 C ATOM 1367 CD GLN A 83 10.030 -11.519 22.587 1.00 0.00 C ATOM 1368 OE1 GLN A 83 10.644 -12.096 23.613 1.00 0.00 O flip ATOM 1369 NE2 GLN A 83 10.241 -10.350 22.260 1.00 0.00 N flip ATOM 0 H GLN A 83 6.943 -11.988 20.451 1.00 0.00 H new ATOM 0 HA GLN A 83 8.529 -13.118 18.470 1.00 0.00 H new ATOM 0 HB2 GLN A 83 10.345 -12.905 20.211 1.00 0.00 H new ATOM 0 HB3 GLN A 83 9.418 -11.445 19.932 1.00 0.00 H new ATOM 0 HG2 GLN A 83 8.038 -11.969 21.952 1.00 0.00 H new ATOM 0 HG3 GLN A 83 9.035 -13.380 22.243 1.00 0.00 H new ATOM 0 HE21 GLN A 83 9.747 -9.946 21.464 1.00 0.00 H new ATOM 0 HE22 GLN A 83 10.910 -9.786 22.785 1.00 0.00 H new ATOM 1378 N ALA A 84 7.930 -15.147 21.000 1.00 0.00 N ATOM 1379 CA ALA A 84 7.988 -16.541 21.422 1.00 0.00 C ATOM 1380 C ALA A 84 7.296 -17.450 20.413 1.00 0.00 C ATOM 1381 O ALA A 84 7.861 -18.452 19.975 1.00 0.00 O ATOM 1382 CB ALA A 84 7.359 -16.701 22.799 1.00 0.00 C ATOM 0 H ALA A 84 7.446 -14.529 21.651 1.00 0.00 H new ATOM 0 HA ALA A 84 9.036 -16.836 21.476 1.00 0.00 H new ATOM 0 HB1 ALA A 84 7.409 -17.747 23.102 1.00 0.00 H new ATOM 0 HB2 ALA A 84 7.900 -16.088 23.520 1.00 0.00 H new ATOM 0 HB3 ALA A 84 6.317 -16.383 22.762 1.00 0.00 H new ATOM 1388 N VAL A 85 6.068 -17.095 20.048 1.00 0.00 N ATOM 1389 CA VAL A 85 5.298 -17.879 19.090 1.00 0.00 C ATOM 1390 C VAL A 85 5.992 -17.924 17.733 1.00 0.00 C ATOM 1391 O VAL A 85 6.179 -18.994 17.153 1.00 0.00 O ATOM 1392 CB VAL A 85 3.879 -17.309 18.909 1.00 0.00 C ATOM 1393 CG1 VAL A 85 3.166 -18.005 17.760 1.00 0.00 C ATOM 1394 CG2 VAL A 85 3.084 -17.441 20.199 1.00 0.00 C ATOM 0 H VAL A 85 5.585 -16.269 20.402 1.00 0.00 H new ATOM 0 HA VAL A 85 5.227 -18.889 19.493 1.00 0.00 H new ATOM 0 HB VAL A 85 3.960 -16.250 18.666 1.00 0.00 H new ATOM 0 HG11 VAL A 85 2.165 -17.589 17.648 1.00 0.00 H new ATOM 0 HG12 VAL A 85 3.728 -17.854 16.838 1.00 0.00 H new ATOM 0 HG13 VAL A 85 3.094 -19.072 17.970 1.00 0.00 H new ATOM 0 HG21 VAL A 85 2.084 -17.033 20.053 1.00 0.00 H new ATOM 0 HG22 VAL A 85 3.010 -18.493 20.475 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.587 -16.892 20.994 1.00 0.00 H new ATOM 1404 N LYS A 86 6.374 -16.755 17.231 1.00 0.00 N ATOM 1405 CA LYS A 86 7.050 -16.659 15.943 1.00 0.00 C ATOM 1406 C LYS A 86 8.241 -17.610 15.881 1.00 0.00 C ATOM 1407 O LYS A 86 8.387 -18.376 14.928 1.00 0.00 O ATOM 1408 CB LYS A 86 7.517 -15.223 15.694 1.00 0.00 C ATOM 1409 CG LYS A 86 8.424 -15.079 14.485 1.00 0.00 C ATOM 1410 CD LYS A 86 9.890 -15.199 14.868 1.00 0.00 C ATOM 1411 CE LYS A 86 10.642 -13.902 14.610 1.00 0.00 C ATOM 1412 NZ LYS A 86 11.591 -13.582 15.712 1.00 0.00 N ATOM 0 H LYS A 86 6.227 -15.860 17.697 1.00 0.00 H new ATOM 0 HA LYS A 86 6.340 -16.943 15.167 1.00 0.00 H new ATOM 0 HB2 LYS A 86 6.644 -14.584 15.561 1.00 0.00 H new ATOM 0 HB3 LYS A 86 8.044 -14.863 16.578 1.00 0.00 H new ATOM 0 HG2 LYS A 86 8.176 -15.844 13.750 1.00 0.00 H new ATOM 0 HG3 LYS A 86 8.249 -14.113 14.011 1.00 0.00 H new ATOM 0 HD2 LYS A 86 9.971 -15.464 15.922 1.00 0.00 H new ATOM 0 HD3 LYS A 86 10.351 -16.007 14.300 1.00 0.00 H new ATOM 0 HE2 LYS A 86 11.189 -13.980 13.671 1.00 0.00 H new ATOM 0 HE3 LYS A 86 9.929 -13.085 14.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 11.995 -12.636 15.558 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 11.086 -13.599 16.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 12.355 -14.287 15.728 1.00 0.00 H new ATOM 1426 N PHE A 87 9.089 -17.556 16.903 1.00 0.00 N ATOM 1427 CA PHE A 87 10.267 -18.414 16.965 1.00 0.00 C ATOM 1428 C PHE A 87 9.869 -19.887 16.949 1.00 0.00 C ATOM 1429 O PHE A 87 10.416 -20.682 16.184 1.00 0.00 O ATOM 1430 CB PHE A 87 11.081 -18.107 18.223 1.00 0.00 C ATOM 1431 CG PHE A 87 12.547 -17.916 17.956 1.00 0.00 C ATOM 1432 CD1 PHE A 87 13.387 -19.009 17.815 1.00 0.00 C ATOM 1433 CD2 PHE A 87 13.085 -16.644 17.848 1.00 0.00 C ATOM 1434 CE1 PHE A 87 14.737 -18.837 17.569 1.00 0.00 C ATOM 1435 CE2 PHE A 87 14.433 -16.465 17.602 1.00 0.00 C ATOM 1436 CZ PHE A 87 15.260 -17.563 17.463 1.00 0.00 C ATOM 0 H PHE A 87 8.983 -16.927 17.699 1.00 0.00 H new ATOM 0 HA PHE A 87 10.879 -18.213 16.086 1.00 0.00 H new ATOM 0 HB2 PHE A 87 10.685 -17.206 18.692 1.00 0.00 H new ATOM 0 HB3 PHE A 87 10.953 -18.921 18.937 1.00 0.00 H new ATOM 0 HD1 PHE A 87 12.983 -20.007 17.898 1.00 0.00 H new ATOM 0 HD2 PHE A 87 12.443 -15.782 17.957 1.00 0.00 H new ATOM 0 HE1 PHE A 87 15.381 -19.697 17.460 1.00 0.00 H new ATOM 0 HE2 PHE A 87 14.840 -15.468 17.518 1.00 0.00 H new ATOM 0 HZ PHE A 87 16.314 -17.425 17.272 1.00 0.00 H new ATOM 1446 N LEU A 88 8.913 -20.244 17.799 1.00 0.00 N ATOM 1447 CA LEU A 88 8.440 -21.621 17.885 1.00 0.00 C ATOM 1448 C LEU A 88 7.930 -22.107 16.532 1.00 0.00 C ATOM 1449 O LEU A 88 8.323 -23.173 16.056 1.00 0.00 O ATOM 1450 CB LEU A 88 7.332 -21.737 18.933 1.00 0.00 C ATOM 1451 CG LEU A 88 7.723 -21.377 20.366 1.00 0.00 C ATOM 1452 CD1 LEU A 88 6.535 -20.790 21.112 1.00 0.00 C ATOM 1453 CD2 LEU A 88 8.261 -22.600 21.095 1.00 0.00 C ATOM 0 H LEU A 88 8.450 -19.599 18.439 1.00 0.00 H new ATOM 0 HA LEU A 88 9.279 -22.249 18.183 1.00 0.00 H new ATOM 0 HB2 LEU A 88 6.505 -21.094 18.631 1.00 0.00 H new ATOM 0 HB3 LEU A 88 6.959 -22.761 18.926 1.00 0.00 H new ATOM 0 HG LEU A 88 8.511 -20.624 20.329 1.00 0.00 H new ATOM 0 HD11 LEU A 88 6.832 -20.540 22.130 1.00 0.00 H new ATOM 0 HD12 LEU A 88 6.194 -19.889 20.602 1.00 0.00 H new ATOM 0 HD13 LEU A 88 5.726 -21.520 21.139 1.00 0.00 H new ATOM 0 HD21 LEU A 88 8.534 -22.325 22.114 1.00 0.00 H new ATOM 0 HD22 LEU A 88 7.494 -23.374 21.121 1.00 0.00 H new ATOM 0 HD23 LEU A 88 9.140 -22.977 20.573 1.00 0.00 H new ATOM 1465 N ILE A 89 7.055 -21.319 15.918 1.00 0.00 N ATOM 1466 CA ILE A 89 6.494 -21.667 14.618 1.00 0.00 C ATOM 1467 C ILE A 89 7.595 -21.920 13.594 1.00 0.00 C ATOM 1468 O ILE A 89 7.557 -22.906 12.860 1.00 0.00 O ATOM 1469 CB ILE A 89 5.563 -20.559 14.092 1.00 0.00 C ATOM 1470 CG1 ILE A 89 4.335 -20.422 14.995 1.00 0.00 C ATOM 1471 CG2 ILE A 89 5.143 -20.856 12.660 1.00 0.00 C ATOM 1472 CD1 ILE A 89 3.437 -21.638 14.982 1.00 0.00 C ATOM 0 H ILE A 89 6.719 -20.435 16.299 1.00 0.00 H new ATOM 0 HA ILE A 89 5.915 -22.580 14.758 1.00 0.00 H new ATOM 0 HB ILE A 89 6.106 -19.614 14.103 1.00 0.00 H new ATOM 0 HG12 ILE A 89 4.665 -20.235 16.017 1.00 0.00 H new ATOM 0 HG13 ILE A 89 3.759 -19.552 14.681 1.00 0.00 H new ATOM 0 HG21 ILE A 89 4.485 -20.064 12.302 1.00 0.00 H new ATOM 0 HG22 ILE A 89 6.027 -20.908 12.025 1.00 0.00 H new ATOM 0 HG23 ILE A 89 4.615 -21.809 12.626 1.00 0.00 H new ATOM 0 HD11 ILE A 89 2.588 -21.470 15.644 1.00 0.00 H new ATOM 0 HD12 ILE A 89 3.078 -21.814 13.968 1.00 0.00 H new ATOM 0 HD13 ILE A 89 3.997 -22.508 15.324 1.00 0.00 H new ATOM 1484 N GLU A 90 8.575 -21.022 13.553 1.00 0.00 N ATOM 1485 CA GLU A 90 9.687 -21.149 12.619 1.00 0.00 C ATOM 1486 C GLU A 90 10.419 -22.473 12.822 1.00 0.00 C ATOM 1487 O GLU A 90 10.596 -23.247 11.881 1.00 0.00 O ATOM 1488 CB GLU A 90 10.663 -19.983 12.792 1.00 0.00 C ATOM 1489 CG GLU A 90 11.103 -19.359 11.478 1.00 0.00 C ATOM 1490 CD GLU A 90 9.973 -18.642 10.765 1.00 0.00 C ATOM 1491 OE1 GLU A 90 9.171 -17.973 11.449 1.00 0.00 O ATOM 1492 OE2 GLU A 90 9.892 -18.750 9.523 1.00 0.00 O ATOM 0 H GLU A 90 8.621 -20.200 14.155 1.00 0.00 H new ATOM 0 HA GLU A 90 9.282 -21.128 11.607 1.00 0.00 H new ATOM 0 HB2 GLU A 90 10.195 -19.217 13.410 1.00 0.00 H new ATOM 0 HB3 GLU A 90 11.543 -20.334 13.331 1.00 0.00 H new ATOM 0 HG2 GLU A 90 11.913 -18.654 11.668 1.00 0.00 H new ATOM 0 HG3 GLU A 90 11.503 -20.136 10.827 1.00 0.00 H new ATOM 1499 N ARG A 91 10.843 -22.725 14.056 1.00 0.00 N ATOM 1500 CA ARG A 91 11.557 -23.953 14.382 1.00 0.00 C ATOM 1501 C ARG A 91 10.794 -25.176 13.881 1.00 0.00 C ATOM 1502 O ARG A 91 11.367 -26.058 13.241 1.00 0.00 O ATOM 1503 CB ARG A 91 11.772 -24.057 15.893 1.00 0.00 C ATOM 1504 CG ARG A 91 13.234 -24.173 16.294 1.00 0.00 C ATOM 1505 CD ARG A 91 13.993 -22.886 16.011 1.00 0.00 C ATOM 1506 NE ARG A 91 15.399 -22.984 16.393 1.00 0.00 N ATOM 1507 CZ ARG A 91 16.342 -22.166 15.940 1.00 0.00 C ATOM 1508 NH1 ARG A 91 16.031 -21.194 15.094 1.00 0.00 N ATOM 1509 NH2 ARG A 91 17.600 -22.319 16.334 1.00 0.00 N ATOM 0 H ARG A 91 10.704 -22.095 14.846 1.00 0.00 H new ATOM 0 HA ARG A 91 12.526 -23.922 13.885 1.00 0.00 H new ATOM 0 HB2 ARG A 91 11.341 -23.179 16.374 1.00 0.00 H new ATOM 0 HB3 ARG A 91 11.231 -24.925 16.270 1.00 0.00 H new ATOM 0 HG2 ARG A 91 13.303 -24.412 17.355 1.00 0.00 H new ATOM 0 HG3 ARG A 91 13.697 -24.997 15.751 1.00 0.00 H new ATOM 0 HD2 ARG A 91 13.922 -22.649 14.949 1.00 0.00 H new ATOM 0 HD3 ARG A 91 13.527 -22.063 16.553 1.00 0.00 H new ATOM 0 HE ARG A 91 15.672 -23.721 17.043 1.00 0.00 H new ATOM 0 HH11 ARG A 91 15.065 -21.073 14.789 1.00 0.00 H new ATOM 0 HH12 ARG A 91 16.758 -20.567 14.748 1.00 0.00 H new ATOM 0 HH21 ARG A 91 17.843 -23.065 16.985 1.00 0.00 H new ATOM 0 HH22 ARG A 91 18.324 -21.690 15.986 1.00 0.00 H new ATOM 1523 N ILE A 92 9.500 -25.221 14.177 1.00 0.00 N ATOM 1524 CA ILE A 92 8.659 -26.334 13.755 1.00 0.00 C ATOM 1525 C ILE A 92 8.505 -26.364 12.239 1.00 0.00 C ATOM 1526 O ILE A 92 8.421 -27.433 11.634 1.00 0.00 O ATOM 1527 CB ILE A 92 7.262 -26.260 14.400 1.00 0.00 C ATOM 1528 CG1 ILE A 92 7.382 -26.198 15.924 1.00 0.00 C ATOM 1529 CG2 ILE A 92 6.420 -27.455 13.978 1.00 0.00 C ATOM 1530 CD1 ILE A 92 6.092 -25.822 16.618 1.00 0.00 C ATOM 0 H ILE A 92 9.011 -24.500 14.707 1.00 0.00 H new ATOM 0 HA ILE A 92 9.155 -27.247 14.085 1.00 0.00 H new ATOM 0 HB ILE A 92 6.767 -25.352 14.056 1.00 0.00 H new ATOM 0 HG12 ILE A 92 7.714 -27.168 16.294 1.00 0.00 H new ATOM 0 HG13 ILE A 92 8.152 -25.474 16.190 1.00 0.00 H new ATOM 0 HG21 ILE A 92 5.436 -27.389 14.442 1.00 0.00 H new ATOM 0 HG22 ILE A 92 6.311 -27.458 12.894 1.00 0.00 H new ATOM 0 HG23 ILE A 92 6.910 -28.375 14.296 1.00 0.00 H new ATOM 0 HD11 ILE A 92 6.252 -25.798 17.696 1.00 0.00 H new ATOM 0 HD12 ILE A 92 5.769 -24.839 16.277 1.00 0.00 H new ATOM 0 HD13 ILE A 92 5.324 -26.558 16.382 1.00 0.00 H new ATOM 1542 N ARG A 93 8.472 -25.183 11.629 1.00 0.00 N ATOM 1543 CA ARG A 93 8.329 -25.074 10.183 1.00 0.00 C ATOM 1544 C ARG A 93 9.637 -25.426 9.479 1.00 0.00 C ATOM 1545 O ARG A 93 9.658 -25.679 8.275 1.00 0.00 O ATOM 1546 CB ARG A 93 7.895 -23.659 9.797 1.00 0.00 C ATOM 1547 CG ARG A 93 6.421 -23.549 9.442 1.00 0.00 C ATOM 1548 CD ARG A 93 6.214 -23.496 7.936 1.00 0.00 C ATOM 1549 NE ARG A 93 6.833 -24.631 7.258 1.00 0.00 N ATOM 1550 CZ ARG A 93 6.487 -25.039 6.042 1.00 0.00 C ATOM 1551 NH1 ARG A 93 5.531 -24.407 5.374 1.00 0.00 N ATOM 1552 NH2 ARG A 93 7.097 -26.081 5.492 1.00 0.00 N ATOM 0 H ARG A 93 8.542 -24.289 12.114 1.00 0.00 H new ATOM 0 HA ARG A 93 7.563 -25.781 9.865 1.00 0.00 H new ATOM 0 HB2 ARG A 93 8.112 -22.983 10.624 1.00 0.00 H new ATOM 0 HB3 ARG A 93 8.490 -23.325 8.947 1.00 0.00 H new ATOM 0 HG2 ARG A 93 5.881 -24.401 9.855 1.00 0.00 H new ATOM 0 HG3 ARG A 93 6.001 -22.654 9.900 1.00 0.00 H new ATOM 0 HD2 ARG A 93 5.146 -23.482 7.717 1.00 0.00 H new ATOM 0 HD3 ARG A 93 6.632 -22.568 7.545 1.00 0.00 H new ATOM 0 HE ARG A 93 7.572 -25.139 7.745 1.00 0.00 H new ATOM 0 HH11 ARG A 93 5.060 -23.606 5.794 1.00 0.00 H new ATOM 0 HH12 ARG A 93 5.267 -24.722 4.440 1.00 0.00 H new ATOM 0 HH21 ARG A 93 7.832 -26.570 6.003 1.00 0.00 H new ATOM 0 HH22 ARG A 93 6.831 -26.394 4.558 1.00 0.00 H new ATOM 1566 N LYS A 94 10.726 -25.439 10.240 1.00 0.00 N ATOM 1567 CA LYS A 94 12.039 -25.760 9.691 1.00 0.00 C ATOM 1568 C LYS A 94 12.491 -27.146 10.139 1.00 0.00 C ATOM 1569 O LYS A 94 13.443 -27.704 9.596 1.00 0.00 O ATOM 1570 CB LYS A 94 13.066 -24.712 10.125 1.00 0.00 C ATOM 1571 CG LYS A 94 13.313 -23.636 9.082 1.00 0.00 C ATOM 1572 CD LYS A 94 13.024 -22.249 9.633 1.00 0.00 C ATOM 1573 CE LYS A 94 12.744 -21.254 8.517 1.00 0.00 C ATOM 1574 NZ LYS A 94 13.821 -20.232 8.402 1.00 0.00 N ATOM 0 H LYS A 94 10.726 -25.231 11.239 1.00 0.00 H new ATOM 0 HA LYS A 94 11.962 -25.756 8.604 1.00 0.00 H new ATOM 0 HB2 LYS A 94 12.725 -24.241 11.047 1.00 0.00 H new ATOM 0 HB3 LYS A 94 14.009 -25.211 10.351 1.00 0.00 H new ATOM 0 HG2 LYS A 94 14.348 -23.686 8.744 1.00 0.00 H new ATOM 0 HG3 LYS A 94 12.684 -23.821 8.211 1.00 0.00 H new ATOM 0 HD2 LYS A 94 12.167 -22.294 10.305 1.00 0.00 H new ATOM 0 HD3 LYS A 94 13.874 -21.906 10.223 1.00 0.00 H new ATOM 0 HE2 LYS A 94 12.647 -21.787 7.571 1.00 0.00 H new ATOM 0 HE3 LYS A 94 11.791 -20.758 8.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 13.593 -19.573 7.631 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 13.897 -19.706 9.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 14.726 -20.703 8.199 1.00 0.00 H new ATOM 1588 N ASN A 95 11.801 -27.697 11.133 1.00 0.00 N ATOM 1589 CA ASN A 95 12.132 -29.019 11.653 1.00 0.00 C ATOM 1590 C ASN A 95 13.517 -29.021 12.292 1.00 0.00 C ATOM 1591 O ASN A 95 14.428 -29.699 11.819 1.00 0.00 O ATOM 1592 CB ASN A 95 12.073 -30.060 10.533 1.00 0.00 C ATOM 1593 CG ASN A 95 11.411 -31.350 10.977 1.00 0.00 C ATOM 1594 OD1 ASN A 95 11.960 -32.436 10.797 1.00 0.00 O ATOM 1595 ND2 ASN A 95 10.223 -31.234 11.560 1.00 0.00 N ATOM 0 H ASN A 95 11.009 -27.249 11.594 1.00 0.00 H new ATOM 0 HA ASN A 95 11.398 -29.276 12.417 1.00 0.00 H new ATOM 0 HB2 ASN A 95 11.526 -29.647 9.685 1.00 0.00 H new ATOM 0 HB3 ASN A 95 13.084 -30.274 10.186 1.00 0.00 H new ATOM 0 HD21 ASN A 95 9.728 -32.067 11.879 1.00 0.00 H new ATOM 0 HD22 ASN A 95 9.806 -30.312 11.688 1.00 0.00 H new ATOM 1602 N GLU A 96 13.667 -28.256 13.369 1.00 0.00 N ATOM 1603 CA GLU A 96 14.941 -28.170 14.073 1.00 0.00 C ATOM 1604 C GLU A 96 14.724 -27.955 15.568 1.00 0.00 C ATOM 1605 O GLU A 96 13.656 -27.532 16.011 1.00 0.00 O ATOM 1606 CB GLU A 96 15.789 -27.032 13.501 1.00 0.00 C ATOM 1607 CG GLU A 96 16.712 -27.468 12.375 1.00 0.00 C ATOM 1608 CD GLU A 96 16.754 -26.469 11.235 1.00 0.00 C ATOM 1609 OE1 GLU A 96 16.983 -25.271 11.504 1.00 0.00 O ATOM 1610 OE2 GLU A 96 16.557 -26.885 10.074 1.00 0.00 O ATOM 0 H GLU A 96 12.923 -27.687 13.773 1.00 0.00 H new ATOM 0 HA GLU A 96 15.469 -29.113 13.932 1.00 0.00 H new ATOM 0 HB2 GLU A 96 15.128 -26.246 13.134 1.00 0.00 H new ATOM 0 HB3 GLU A 96 16.387 -26.597 14.302 1.00 0.00 H new ATOM 0 HG2 GLU A 96 17.719 -27.607 12.769 1.00 0.00 H new ATOM 0 HG3 GLU A 96 16.383 -28.435 11.994 1.00 0.00 H new ATOM 1617 N PRO A 97 15.760 -28.253 16.365 1.00 0.00 N ATOM 1618 CA PRO A 97 15.708 -28.101 17.822 1.00 0.00 C ATOM 1619 C PRO A 97 15.673 -26.638 18.251 1.00 0.00 C ATOM 1620 O PRO A 97 16.509 -25.837 17.830 1.00 0.00 O ATOM 1621 CB PRO A 97 17.003 -28.766 18.295 1.00 0.00 C ATOM 1622 CG PRO A 97 17.928 -28.664 17.132 1.00 0.00 C ATOM 1623 CD PRO A 97 17.064 -28.762 15.905 1.00 0.00 C ATOM 0 HA PRO A 97 14.806 -28.543 18.246 1.00 0.00 H new ATOM 0 HB2 PRO A 97 17.411 -28.261 19.171 1.00 0.00 H new ATOM 0 HB3 PRO A 97 16.834 -29.805 18.577 1.00 0.00 H new ATOM 0 HG2 PRO A 97 18.475 -27.721 17.150 1.00 0.00 H new ATOM 0 HG3 PRO A 97 18.669 -29.463 17.152 1.00 0.00 H new ATOM 0 HD2 PRO A 97 17.462 -28.165 15.085 1.00 0.00 H new ATOM 0 HD3 PRO A 97 16.991 -29.789 15.546 1.00 0.00 H new ATOM 1631 N LEU A 98 14.703 -26.295 19.091 1.00 0.00 N ATOM 1632 CA LEU A 98 14.559 -24.928 19.578 1.00 0.00 C ATOM 1633 C LEU A 98 15.571 -24.633 20.680 1.00 0.00 C ATOM 1634 O LEU A 98 15.988 -25.519 21.427 1.00 0.00 O ATOM 1635 CB LEU A 98 13.139 -24.697 20.098 1.00 0.00 C ATOM 1636 CG LEU A 98 12.027 -25.457 19.374 1.00 0.00 C ATOM 1637 CD1 LEU A 98 11.571 -26.650 20.200 1.00 0.00 C ATOM 1638 CD2 LEU A 98 10.856 -24.532 19.076 1.00 0.00 C ATOM 0 H LEU A 98 14.004 -26.946 19.449 1.00 0.00 H new ATOM 0 HA LEU A 98 14.749 -24.250 18.745 1.00 0.00 H new ATOM 0 HB2 LEU A 98 13.111 -24.970 21.153 1.00 0.00 H new ATOM 0 HB3 LEU A 98 12.921 -23.631 20.039 1.00 0.00 H new ATOM 0 HG LEU A 98 12.422 -25.827 18.428 1.00 0.00 H new ATOM 0 HD11 LEU A 98 10.779 -27.179 19.669 1.00 0.00 H new ATOM 0 HD12 LEU A 98 12.412 -27.324 20.361 1.00 0.00 H new ATOM 0 HD13 LEU A 98 11.194 -26.304 21.162 1.00 0.00 H new ATOM 0 HD21 LEU A 98 10.074 -25.090 18.561 1.00 0.00 H new ATOM 0 HD22 LEU A 98 10.461 -24.132 20.010 1.00 0.00 H new ATOM 0 HD23 LEU A 98 11.193 -23.711 18.444 1.00 0.00 H new ATOM 1650 N PRO A 99 15.976 -23.359 20.787 1.00 0.00 N ATOM 1651 CA PRO A 99 16.942 -22.917 21.798 1.00 0.00 C ATOM 1652 C PRO A 99 16.363 -22.955 23.208 1.00 0.00 C ATOM 1653 O PRO A 99 15.233 -23.396 23.415 1.00 0.00 O ATOM 1654 CB PRO A 99 17.253 -21.476 21.386 1.00 0.00 C ATOM 1655 CG PRO A 99 16.048 -21.030 20.633 1.00 0.00 C ATOM 1656 CD PRO A 99 15.521 -22.251 19.931 1.00 0.00 C ATOM 0 HA PRO A 99 17.819 -23.563 21.833 1.00 0.00 H new ATOM 0 HB2 PRO A 99 17.432 -20.845 22.257 1.00 0.00 H new ATOM 0 HB3 PRO A 99 18.148 -21.426 20.766 1.00 0.00 H new ATOM 0 HG2 PRO A 99 15.299 -20.614 21.307 1.00 0.00 H new ATOM 0 HG3 PRO A 99 16.303 -20.248 19.917 1.00 0.00 H new ATOM 0 HD2 PRO A 99 14.435 -22.228 19.846 1.00 0.00 H new ATOM 0 HD3 PRO A 99 15.918 -22.336 18.919 1.00 0.00 H new ATOM 1664 N VAL A 100 17.146 -22.489 24.177 1.00 0.00 N ATOM 1665 CA VAL A 100 16.710 -22.469 25.568 1.00 0.00 C ATOM 1666 C VAL A 100 15.588 -21.458 25.777 1.00 0.00 C ATOM 1667 O VAL A 100 15.581 -20.388 25.169 1.00 0.00 O ATOM 1668 CB VAL A 100 17.876 -22.129 26.516 1.00 0.00 C ATOM 1669 CG1 VAL A 100 17.454 -22.305 27.966 1.00 0.00 C ATOM 1670 CG2 VAL A 100 19.090 -22.988 26.197 1.00 0.00 C ATOM 0 H VAL A 100 18.085 -22.121 24.024 1.00 0.00 H new ATOM 0 HA VAL A 100 16.342 -23.469 25.800 1.00 0.00 H new ATOM 0 HB VAL A 100 18.150 -21.085 26.367 1.00 0.00 H new ATOM 0 HG11 VAL A 100 18.290 -22.060 28.621 1.00 0.00 H new ATOM 0 HG12 VAL A 100 16.617 -21.642 28.184 1.00 0.00 H new ATOM 0 HG13 VAL A 100 17.152 -23.339 28.134 1.00 0.00 H new ATOM 0 HG21 VAL A 100 19.904 -22.734 26.876 1.00 0.00 H new ATOM 0 HG22 VAL A 100 18.833 -24.040 26.316 1.00 0.00 H new ATOM 0 HG23 VAL A 100 19.405 -22.806 25.170 1.00 0.00 H new ATOM 1680 N TYR A 101 14.641 -21.805 26.642 1.00 0.00 N ATOM 1681 CA TYR A 101 13.512 -20.929 26.930 1.00 0.00 C ATOM 1682 C TYR A 101 13.985 -19.615 27.544 1.00 0.00 C ATOM 1683 O TYR A 101 13.536 -18.537 27.154 1.00 0.00 O ATOM 1684 CB TYR A 101 12.531 -21.623 27.877 1.00 0.00 C ATOM 1685 CG TYR A 101 11.188 -20.933 27.969 1.00 0.00 C ATOM 1686 CD1 TYR A 101 10.470 -20.612 26.823 1.00 0.00 C ATOM 1687 CD2 TYR A 101 10.638 -20.602 29.201 1.00 0.00 C ATOM 1688 CE1 TYR A 101 9.244 -19.981 26.902 1.00 0.00 C ATOM 1689 CE2 TYR A 101 9.411 -19.973 29.290 1.00 0.00 C ATOM 1690 CZ TYR A 101 8.718 -19.665 28.138 1.00 0.00 C ATOM 1691 OH TYR A 101 7.497 -19.036 28.222 1.00 0.00 O ATOM 0 H TYR A 101 14.633 -22.686 27.155 1.00 0.00 H new ATOM 0 HA TYR A 101 13.006 -20.709 25.990 1.00 0.00 H new ATOM 0 HB2 TYR A 101 12.381 -22.650 27.543 1.00 0.00 H new ATOM 0 HB3 TYR A 101 12.973 -21.673 28.872 1.00 0.00 H new ATOM 0 HD1 TYR A 101 10.878 -20.860 25.854 1.00 0.00 H new ATOM 0 HD2 TYR A 101 11.179 -20.840 30.105 1.00 0.00 H new ATOM 0 HE1 TYR A 101 8.700 -19.736 26.002 1.00 0.00 H new ATOM 0 HE2 TYR A 101 8.997 -19.724 30.256 1.00 0.00 H new ATOM 0 HH TYR A 101 7.560 -18.144 27.821 1.00 0.00 H new ATOM 1701 N LYS A 102 14.895 -19.713 28.507 1.00 0.00 N ATOM 1702 CA LYS A 102 15.433 -18.533 29.175 1.00 0.00 C ATOM 1703 C LYS A 102 16.295 -17.713 28.220 1.00 0.00 C ATOM 1704 O LYS A 102 16.124 -16.500 28.101 1.00 0.00 O ATOM 1705 CB LYS A 102 16.256 -18.945 30.397 1.00 0.00 C ATOM 1706 CG LYS A 102 15.913 -18.162 31.653 1.00 0.00 C ATOM 1707 CD LYS A 102 14.462 -18.362 32.057 1.00 0.00 C ATOM 1708 CE LYS A 102 14.187 -17.804 33.444 1.00 0.00 C ATOM 1709 NZ LYS A 102 13.068 -18.519 34.118 1.00 0.00 N ATOM 0 H LYS A 102 15.276 -20.598 28.843 1.00 0.00 H new ATOM 0 HA LYS A 102 14.595 -17.916 29.500 1.00 0.00 H new ATOM 0 HB2 LYS A 102 16.102 -20.007 30.587 1.00 0.00 H new ATOM 0 HB3 LYS A 102 17.315 -18.812 30.174 1.00 0.00 H new ATOM 0 HG2 LYS A 102 16.565 -18.476 32.468 1.00 0.00 H new ATOM 0 HG3 LYS A 102 16.102 -17.102 31.485 1.00 0.00 H new ATOM 0 HD2 LYS A 102 13.811 -17.874 31.332 1.00 0.00 H new ATOM 0 HD3 LYS A 102 14.221 -19.425 32.037 1.00 0.00 H new ATOM 0 HE2 LYS A 102 15.088 -17.884 34.053 1.00 0.00 H new ATOM 0 HE3 LYS A 102 13.947 -16.744 33.368 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 12.912 -18.109 35.061 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 12.202 -18.422 33.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 13.308 -19.526 34.214 1.00 0.00 H new ATOM 1723 N ASP A 103 17.221 -18.384 27.543 1.00 0.00 N ATOM 1724 CA ASP A 103 18.109 -17.717 26.597 1.00 0.00 C ATOM 1725 C ASP A 103 17.312 -17.061 25.474 1.00 0.00 C ATOM 1726 O ASP A 103 17.471 -15.870 25.200 1.00 0.00 O ATOM 1727 CB ASP A 103 19.109 -18.716 26.013 1.00 0.00 C ATOM 1728 CG ASP A 103 20.231 -18.035 25.254 1.00 0.00 C ATOM 1729 OD1 ASP A 103 21.139 -17.483 25.909 1.00 0.00 O ATOM 1730 OD2 ASP A 103 20.200 -18.054 24.006 1.00 0.00 O ATOM 0 H ASP A 103 17.376 -19.388 27.631 1.00 0.00 H new ATOM 0 HA ASP A 103 18.654 -16.940 27.133 1.00 0.00 H new ATOM 0 HB2 ASP A 103 19.531 -19.316 26.819 1.00 0.00 H new ATOM 0 HB3 ASP A 103 18.586 -19.401 25.346 1.00 0.00 H new ATOM 1735 N LEU A 104 16.456 -17.844 24.827 1.00 0.00 N ATOM 1736 CA LEU A 104 15.634 -17.339 23.732 1.00 0.00 C ATOM 1737 C LEU A 104 14.800 -16.144 24.184 1.00 0.00 C ATOM 1738 O LEU A 104 14.785 -15.102 23.528 1.00 0.00 O ATOM 1739 CB LEU A 104 14.718 -18.444 23.204 1.00 0.00 C ATOM 1740 CG LEU A 104 13.790 -18.054 22.054 1.00 0.00 C ATOM 1741 CD1 LEU A 104 14.491 -18.232 20.717 1.00 0.00 C ATOM 1742 CD2 LEU A 104 12.509 -18.875 22.100 1.00 0.00 C ATOM 0 H LEU A 104 16.313 -18.831 25.041 1.00 0.00 H new ATOM 0 HA LEU A 104 16.299 -17.013 22.932 1.00 0.00 H new ATOM 0 HB2 LEU A 104 15.339 -19.278 22.876 1.00 0.00 H new ATOM 0 HB3 LEU A 104 14.107 -18.807 24.030 1.00 0.00 H new ATOM 0 HG LEU A 104 13.528 -17.002 22.166 1.00 0.00 H new ATOM 0 HD11 LEU A 104 13.814 -17.949 19.911 1.00 0.00 H new ATOM 0 HD12 LEU A 104 15.378 -17.600 20.684 1.00 0.00 H new ATOM 0 HD13 LEU A 104 14.784 -19.275 20.596 1.00 0.00 H new ATOM 0 HD21 LEU A 104 11.860 -18.584 21.274 1.00 0.00 H new ATOM 0 HD22 LEU A 104 12.752 -19.934 22.014 1.00 0.00 H new ATOM 0 HD23 LEU A 104 11.996 -18.696 23.045 1.00 0.00 H new ATOM 1754 N TRP A 105 14.110 -16.302 25.307 1.00 0.00 N ATOM 1755 CA TRP A 105 13.275 -15.235 25.847 1.00 0.00 C ATOM 1756 C TRP A 105 14.087 -13.962 26.057 1.00 0.00 C ATOM 1757 O TRP A 105 13.715 -12.892 25.578 1.00 0.00 O ATOM 1758 CB TRP A 105 12.641 -15.674 27.169 1.00 0.00 C ATOM 1759 CG TRP A 105 11.993 -14.551 27.919 1.00 0.00 C ATOM 1760 CD1 TRP A 105 11.321 -13.489 27.385 1.00 0.00 C ATOM 1761 CD2 TRP A 105 11.957 -14.378 29.340 1.00 0.00 C ATOM 1762 NE1 TRP A 105 10.869 -12.666 28.388 1.00 0.00 N ATOM 1763 CE2 TRP A 105 11.245 -13.189 29.596 1.00 0.00 C ATOM 1764 CE3 TRP A 105 12.454 -15.111 30.420 1.00 0.00 C ATOM 1765 CZ2 TRP A 105 11.022 -12.720 30.888 1.00 0.00 C ATOM 1766 CZ3 TRP A 105 12.231 -14.644 31.701 1.00 0.00 C ATOM 1767 CH2 TRP A 105 11.520 -13.458 31.927 1.00 0.00 C ATOM 0 H TRP A 105 14.112 -17.158 25.862 1.00 0.00 H new ATOM 0 HA TRP A 105 12.485 -15.025 25.125 1.00 0.00 H new ATOM 0 HB2 TRP A 105 11.897 -16.444 26.968 1.00 0.00 H new ATOM 0 HB3 TRP A 105 13.407 -16.127 27.798 1.00 0.00 H new ATOM 0 HD1 TRP A 105 11.167 -13.321 26.329 1.00 0.00 H new ATOM 0 HE1 TRP A 105 10.339 -11.805 28.254 1.00 0.00 H new ATOM 0 HE3 TRP A 105 13.003 -16.027 30.257 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 10.475 -11.806 31.064 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 12.611 -15.203 32.543 1.00 0.00 H new ATOM 0 HH2 TRP A 105 11.362 -13.120 32.940 1.00 0.00 H new ATOM 1778 N ASN A 106 15.197 -14.085 26.777 1.00 0.00 N ATOM 1779 CA ASN A 106 16.062 -12.943 27.050 1.00 0.00 C ATOM 1780 C ASN A 106 16.590 -12.337 25.753 1.00 0.00 C ATOM 1781 O ASN A 106 16.657 -11.117 25.608 1.00 0.00 O ATOM 1782 CB ASN A 106 17.231 -13.363 27.943 1.00 0.00 C ATOM 1783 CG ASN A 106 16.810 -13.582 29.383 1.00 0.00 C ATOM 1784 OD1 ASN A 106 16.173 -12.723 29.992 1.00 0.00 O ATOM 1785 ND2 ASN A 106 17.165 -14.737 29.935 1.00 0.00 N ATOM 0 H ASN A 106 15.519 -14.964 27.182 1.00 0.00 H new ATOM 0 HA ASN A 106 15.471 -12.188 27.568 1.00 0.00 H new ATOM 0 HB2 ASN A 106 17.671 -14.281 27.553 1.00 0.00 H new ATOM 0 HB3 ASN A 106 18.006 -12.597 27.906 1.00 0.00 H new ATOM 0 HD21 ASN A 106 16.909 -14.940 30.901 1.00 0.00 H new ATOM 0 HD22 ASN A 106 17.693 -15.421 29.392 1.00 0.00 H new ATOM 1792 N ALA A 107 16.962 -13.199 24.813 1.00 0.00 N ATOM 1793 CA ALA A 107 17.481 -12.750 23.527 1.00 0.00 C ATOM 1794 C ALA A 107 16.429 -11.961 22.755 1.00 0.00 C ATOM 1795 O ALA A 107 16.701 -10.871 22.251 1.00 0.00 O ATOM 1796 CB ALA A 107 17.959 -13.939 22.707 1.00 0.00 C ATOM 0 H ALA A 107 16.914 -14.212 24.918 1.00 0.00 H new ATOM 0 HA ALA A 107 18.327 -12.089 23.715 1.00 0.00 H new ATOM 0 HB1 ALA A 107 18.344 -13.589 21.749 1.00 0.00 H new ATOM 0 HB2 ALA A 107 18.750 -14.460 23.248 1.00 0.00 H new ATOM 0 HB3 ALA A 107 17.126 -14.621 22.536 1.00 0.00 H new ATOM 1802 N LEU A 108 15.226 -12.519 22.666 1.00 0.00 N ATOM 1803 CA LEU A 108 14.132 -11.867 21.955 1.00 0.00 C ATOM 1804 C LEU A 108 13.667 -10.618 22.697 1.00 0.00 C ATOM 1805 O LEU A 108 13.139 -9.685 22.091 1.00 0.00 O ATOM 1806 CB LEU A 108 12.961 -12.837 21.782 1.00 0.00 C ATOM 1807 CG LEU A 108 13.232 -14.070 20.920 1.00 0.00 C ATOM 1808 CD1 LEU A 108 11.958 -14.878 20.727 1.00 0.00 C ATOM 1809 CD2 LEU A 108 13.815 -13.662 19.575 1.00 0.00 C ATOM 0 H LEU A 108 14.984 -13.421 23.077 1.00 0.00 H new ATOM 0 HA LEU A 108 14.497 -11.568 20.972 1.00 0.00 H new ATOM 0 HB2 LEU A 108 12.644 -13.172 22.770 1.00 0.00 H new ATOM 0 HB3 LEU A 108 12.124 -12.291 21.346 1.00 0.00 H new ATOM 0 HG LEU A 108 13.960 -14.696 21.435 1.00 0.00 H new ATOM 0 HD11 LEU A 108 12.171 -15.752 20.111 1.00 0.00 H new ATOM 0 HD12 LEU A 108 11.582 -15.201 21.698 1.00 0.00 H new ATOM 0 HD13 LEU A 108 11.207 -14.261 20.234 1.00 0.00 H new ATOM 0 HD21 LEU A 108 14.002 -14.552 18.974 1.00 0.00 H new ATOM 0 HD22 LEU A 108 13.110 -13.014 19.054 1.00 0.00 H new ATOM 0 HD23 LEU A 108 14.752 -13.127 19.732 1.00 0.00 H new ATOM 1821 N ARG A 109 13.869 -10.607 24.010 1.00 0.00 N ATOM 1822 CA ARG A 109 13.472 -9.472 24.835 1.00 0.00 C ATOM 1823 C ARG A 109 14.361 -8.262 24.559 1.00 0.00 C ATOM 1824 O ARG A 109 13.871 -7.173 24.262 1.00 0.00 O ATOM 1825 CB ARG A 109 13.541 -9.842 26.317 1.00 0.00 C ATOM 1826 CG ARG A 109 12.179 -9.950 26.982 1.00 0.00 C ATOM 1827 CD ARG A 109 12.243 -9.558 28.450 1.00 0.00 C ATOM 1828 NE ARG A 109 12.905 -10.577 29.260 1.00 0.00 N ATOM 1829 CZ ARG A 109 13.388 -10.349 30.477 1.00 0.00 C ATOM 1830 NH1 ARG A 109 13.283 -9.145 31.020 1.00 0.00 N ATOM 1831 NH2 ARG A 109 13.978 -11.327 31.152 1.00 0.00 N ATOM 0 H ARG A 109 14.305 -11.371 24.526 1.00 0.00 H new ATOM 0 HA ARG A 109 12.444 -9.212 24.581 1.00 0.00 H new ATOM 0 HB2 ARG A 109 14.063 -10.793 26.421 1.00 0.00 H new ATOM 0 HB3 ARG A 109 14.134 -9.093 26.842 1.00 0.00 H new ATOM 0 HG2 ARG A 109 11.468 -9.307 26.463 1.00 0.00 H new ATOM 0 HG3 ARG A 109 11.809 -10.972 26.893 1.00 0.00 H new ATOM 0 HD2 ARG A 109 12.776 -8.613 28.550 1.00 0.00 H new ATOM 0 HD3 ARG A 109 11.233 -9.396 28.826 1.00 0.00 H new ATOM 0 HE ARG A 109 13.002 -11.515 28.871 1.00 0.00 H new ATOM 0 HH11 ARG A 109 12.831 -8.390 30.504 1.00 0.00 H new ATOM 0 HH12 ARG A 109 13.655 -8.973 31.954 1.00 0.00 H new ATOM 0 HH21 ARG A 109 14.061 -12.255 30.737 1.00 0.00 H new ATOM 0 HH22 ARG A 109 14.348 -11.151 32.086 1.00 0.00 H new ATOM 1845 N LYS A 110 15.670 -8.462 24.660 1.00 0.00 N ATOM 1846 CA LYS A 110 16.629 -7.390 24.422 1.00 0.00 C ATOM 1847 C LYS A 110 16.790 -7.126 22.928 1.00 0.00 C ATOM 1848 O LYS A 110 17.200 -6.040 22.520 1.00 0.00 O ATOM 1849 CB LYS A 110 17.985 -7.743 25.037 1.00 0.00 C ATOM 1850 CG LYS A 110 18.882 -6.539 25.265 1.00 0.00 C ATOM 1851 CD LYS A 110 20.195 -6.671 24.512 1.00 0.00 C ATOM 1852 CE LYS A 110 21.327 -5.960 25.237 1.00 0.00 C ATOM 1853 NZ LYS A 110 22.117 -6.896 26.084 1.00 0.00 N ATOM 0 H LYS A 110 16.092 -9.358 24.905 1.00 0.00 H new ATOM 0 HA LYS A 110 16.248 -6.485 24.895 1.00 0.00 H new ATOM 0 HB2 LYS A 110 17.822 -8.249 25.988 1.00 0.00 H new ATOM 0 HB3 LYS A 110 18.498 -8.449 24.384 1.00 0.00 H new ATOM 0 HG2 LYS A 110 18.367 -5.634 24.943 1.00 0.00 H new ATOM 0 HG3 LYS A 110 19.082 -6.430 26.331 1.00 0.00 H new ATOM 0 HD2 LYS A 110 20.443 -7.726 24.393 1.00 0.00 H new ATOM 0 HD3 LYS A 110 20.085 -6.255 23.511 1.00 0.00 H new ATOM 0 HE2 LYS A 110 21.985 -5.487 24.508 1.00 0.00 H new ATOM 0 HE3 LYS A 110 20.917 -5.165 25.860 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 22.879 -6.373 26.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 21.495 -7.329 26.796 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 22.530 -7.641 25.487 1.00 0.00 H new ATOM 1867 N GLY A 111 16.462 -8.126 22.116 1.00 0.00 N ATOM 1868 CA GLY A 111 16.576 -7.981 20.676 1.00 0.00 C ATOM 1869 C GLY A 111 18.015 -8.027 20.201 1.00 0.00 C ATOM 1870 O GLY A 111 18.426 -7.219 19.369 1.00 0.00 O ATOM 0 H GLY A 111 16.119 -9.034 22.429 1.00 0.00 H new ATOM 0 HA2 GLY A 111 16.010 -8.774 20.188 1.00 0.00 H new ATOM 0 HA3 GLY A 111 16.126 -7.036 20.372 1.00 0.00 H new TER 1874 GLY A 111