USER MOD reduce.3.24.130724 H: found=0, std=0, add=887, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 887 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 83 TYR OH : rot 180:sc= 0.626 USER MOD Set 1.2: A 85 LYS NZ :NH3+ -160:sc= 0.829 (180deg=0.00504) USER MOD Set 2.1: A 32 SER OG : rot -168:sc= 1.89 USER MOD Set 2.2: A 33 GLN : amide:sc= 0.693 K(o=2.6,f=1.2) USER MOD Set 3.1: A 10 TYR OH : rot -95:sc= 0.0349 USER MOD Set 3.2: A 12 ASN : amide:sc= 0.387 K(o=1.9,f=1.1) USER MOD Set 3.3: A 51 GLN : amide:sc= 1.46 K(o=1.9,f=0.42) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -113:sc= 0.0795 (180deg=0) USER MOD Single : A 3 MET CE :methyl 179:sc= -0.993 (180deg=-0.997) USER MOD Single : A 6 ASN : amide:sc= 0.43 K(o=0.43,f=-8.2!) USER MOD Single : A 7 GLN : amide:sc= 0.824 K(o=0.82,f=-0.35) USER MOD Single : A 8 THR OG1 : rot 103:sc= 1.27 USER MOD Single : A 13 ASN : amide:sc= 0.925 K(o=0.93,f=-0.63) USER MOD Single : A 15 ASN : amide:sc= 0.847 K(o=0.85,f=-6.3!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 178:sc= 1.21 (180deg=1.21) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 SER OG : rot 96:sc= 1.23 USER MOD Single : A 28 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0.718 K(o=0.72,f=-0.12) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0.0744 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 MET CE :methyl -172:sc= -0.336 (180deg=-0.425) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 72:sc= 1.11 USER MOD Single : A 64 ASN : amide:sc= 1.07 K(o=1.1,f=0) USER MOD Single : A 68 THR OG1 : rot 87:sc= 1.31 USER MOD Single : A 69 MET CE :methyl 173:sc= -1.13 (180deg=-1.33) USER MOD Single : A 70 GLN : amide:sc= 1.31 K(o=1.3,f=-5.7!) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 MET CE :methyl -169:sc=-0.00313 (180deg=-0.223) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 SER OG : rot -96:sc=-0.000777 USER MOD Single : A 86 SER OG : rot 180:sc= 0 USER MOD Single : A 88 SER OG : rot 180:sc= 0.0055 USER MOD Single : A 93 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 THR OG1 : rot 170:sc= -0.1 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.627 -19.232 1.820 1.00 0.00 N ATOM 2 CA MET A 1 1.395 -18.033 2.236 1.00 0.00 C ATOM 3 C MET A 1 2.839 -18.103 1.720 1.00 0.00 C ATOM 4 O MET A 1 3.349 -19.192 1.450 1.00 0.00 O ATOM 5 CB MET A 1 1.339 -17.789 3.761 1.00 0.00 C ATOM 6 CG MET A 1 2.066 -18.835 4.620 1.00 0.00 C ATOM 7 SD MET A 1 1.989 -18.501 6.403 1.00 0.00 S ATOM 8 CE MET A 1 2.944 -19.915 7.019 1.00 0.00 C ATOM 0 H1 MET A 1 -0.113 -18.953 1.144 1.00 0.00 H new ATOM 0 H2 MET A 1 1.268 -19.916 1.369 1.00 0.00 H new ATOM 0 H3 MET A 1 0.187 -19.669 2.655 1.00 0.00 H new ATOM 0 HA MET A 1 0.915 -17.169 1.776 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.767 -16.809 3.972 1.00 0.00 H new ATOM 0 HB3 MET A 1 0.294 -17.753 4.069 1.00 0.00 H new ATOM 0 HG2 MET A 1 1.633 -19.816 4.425 1.00 0.00 H new ATOM 0 HG3 MET A 1 3.111 -18.881 4.313 1.00 0.00 H new ATOM 0 HE1 MET A 1 2.999 -19.871 8.107 1.00 0.00 H new ATOM 0 HE2 MET A 1 2.456 -20.842 6.718 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.951 -19.883 6.603 1.00 0.00 H new ATOM 20 N GLU A 2 3.505 -16.942 1.626 1.00 0.00 N ATOM 21 CA GLU A 2 4.838 -16.751 1.039 1.00 0.00 C ATOM 22 C GLU A 2 4.905 -17.196 -0.437 1.00 0.00 C ATOM 23 O GLU A 2 3.910 -17.626 -1.029 1.00 0.00 O ATOM 24 CB GLU A 2 5.935 -17.398 1.912 1.00 0.00 C ATOM 25 CG GLU A 2 5.994 -16.832 3.339 1.00 0.00 C ATOM 26 CD GLU A 2 7.150 -17.456 4.136 1.00 0.00 C ATOM 27 OE1 GLU A 2 8.322 -17.289 3.730 1.00 0.00 O ATOM 28 OE2 GLU A 2 6.899 -18.105 5.179 1.00 0.00 O ATOM 0 H GLU A 2 3.108 -16.069 1.974 1.00 0.00 H new ATOM 0 HA GLU A 2 5.035 -15.679 1.028 1.00 0.00 H new ATOM 0 HB2 GLU A 2 5.761 -18.473 1.963 1.00 0.00 H new ATOM 0 HB3 GLU A 2 6.903 -17.254 1.432 1.00 0.00 H new ATOM 0 HG2 GLU A 2 6.119 -15.750 3.299 1.00 0.00 H new ATOM 0 HG3 GLU A 2 5.051 -17.026 3.849 1.00 0.00 H new ATOM 35 N MET A 3 6.078 -17.031 -1.058 1.00 0.00 N ATOM 36 CA MET A 3 6.362 -17.535 -2.398 1.00 0.00 C ATOM 37 C MET A 3 6.444 -19.065 -2.417 1.00 0.00 C ATOM 38 O MET A 3 6.555 -19.709 -1.368 1.00 0.00 O ATOM 39 CB MET A 3 7.658 -16.896 -2.935 1.00 0.00 C ATOM 40 CG MET A 3 8.975 -17.388 -2.298 1.00 0.00 C ATOM 41 SD MET A 3 9.168 -17.238 -0.497 1.00 0.00 S ATOM 42 CE MET A 3 9.034 -15.444 -0.276 1.00 0.00 C ATOM 0 H MET A 3 6.864 -16.537 -0.635 1.00 0.00 H new ATOM 0 HA MET A 3 5.538 -17.254 -3.054 1.00 0.00 H new ATOM 0 HB2 MET A 3 7.709 -17.075 -4.009 1.00 0.00 H new ATOM 0 HB3 MET A 3 7.592 -15.817 -2.795 1.00 0.00 H new ATOM 0 HG2 MET A 3 9.099 -18.439 -2.559 1.00 0.00 H new ATOM 0 HG3 MET A 3 9.795 -16.844 -2.767 1.00 0.00 H new ATOM 0 HE1 MET A 3 9.116 -15.201 0.783 1.00 0.00 H new ATOM 0 HE2 MET A 3 9.835 -14.949 -0.825 1.00 0.00 H new ATOM 0 HE3 MET A 3 8.070 -15.102 -0.654 1.00 0.00 H new ATOM 52 N LEU A 4 6.457 -19.639 -3.624 1.00 0.00 N ATOM 53 CA LEU A 4 6.714 -21.056 -3.852 1.00 0.00 C ATOM 54 C LEU A 4 8.055 -21.154 -4.591 1.00 0.00 C ATOM 55 O LEU A 4 8.242 -20.404 -5.554 1.00 0.00 O ATOM 56 CB LEU A 4 5.601 -21.691 -4.709 1.00 0.00 C ATOM 57 CG LEU A 4 4.168 -21.566 -4.154 1.00 0.00 C ATOM 58 CD1 LEU A 4 3.212 -22.383 -5.030 1.00 0.00 C ATOM 59 CD2 LEU A 4 4.037 -22.034 -2.700 1.00 0.00 C ATOM 0 H LEU A 4 6.285 -19.118 -4.484 1.00 0.00 H new ATOM 0 HA LEU A 4 6.740 -21.591 -2.902 1.00 0.00 H new ATOM 0 HB2 LEU A 4 5.627 -21.236 -5.699 1.00 0.00 H new ATOM 0 HB3 LEU A 4 5.828 -22.749 -4.839 1.00 0.00 H new ATOM 0 HG LEU A 4 3.914 -20.506 -4.173 1.00 0.00 H new ATOM 0 HD11 LEU A 4 2.198 -22.297 -4.640 1.00 0.00 H new ATOM 0 HD12 LEU A 4 3.241 -22.004 -6.052 1.00 0.00 H new ATOM 0 HD13 LEU A 4 3.516 -23.430 -5.022 1.00 0.00 H new ATOM 0 HD21 LEU A 4 3.004 -21.919 -2.372 1.00 0.00 H new ATOM 0 HD22 LEU A 4 4.326 -23.082 -2.628 1.00 0.00 H new ATOM 0 HD23 LEU A 4 4.688 -21.434 -2.064 1.00 0.00 H new ATOM 71 N PRO A 5 8.983 -22.036 -4.174 1.00 0.00 N ATOM 72 CA PRO A 5 10.221 -22.308 -4.894 1.00 0.00 C ATOM 73 C PRO A 5 9.997 -22.527 -6.389 1.00 0.00 C ATOM 74 O PRO A 5 9.220 -23.390 -6.809 1.00 0.00 O ATOM 75 CB PRO A 5 10.854 -23.511 -4.192 1.00 0.00 C ATOM 76 CG PRO A 5 10.402 -23.302 -2.754 1.00 0.00 C ATOM 77 CD PRO A 5 8.974 -22.785 -2.927 1.00 0.00 C ATOM 0 HA PRO A 5 10.893 -21.450 -4.864 1.00 0.00 H new ATOM 0 HB2 PRO A 5 10.498 -24.457 -4.600 1.00 0.00 H new ATOM 0 HB3 PRO A 5 11.940 -23.513 -4.283 1.00 0.00 H new ATOM 0 HG2 PRO A 5 10.431 -24.229 -2.181 1.00 0.00 H new ATOM 0 HG3 PRO A 5 11.033 -22.584 -2.231 1.00 0.00 H new ATOM 0 HD2 PRO A 5 8.260 -23.608 -2.968 1.00 0.00 H new ATOM 0 HD3 PRO A 5 8.682 -22.151 -2.090 1.00 0.00 H new ATOM 85 N ASN A 6 10.688 -21.714 -7.183 1.00 0.00 N ATOM 86 CA ASN A 6 10.606 -21.610 -8.632 1.00 0.00 C ATOM 87 C ASN A 6 11.923 -20.958 -9.047 1.00 0.00 C ATOM 88 O ASN A 6 12.410 -20.104 -8.309 1.00 0.00 O ATOM 89 CB ASN A 6 9.425 -20.692 -8.979 1.00 0.00 C ATOM 90 CG ASN A 6 9.166 -20.578 -10.474 1.00 0.00 C ATOM 91 OD1 ASN A 6 10.032 -20.183 -11.245 1.00 0.00 O ATOM 92 ND2 ASN A 6 7.962 -20.907 -10.907 1.00 0.00 N ATOM 0 H ASN A 6 11.371 -21.062 -6.798 1.00 0.00 H new ATOM 0 HA ASN A 6 10.456 -22.567 -9.132 1.00 0.00 H new ATOM 0 HB2 ASN A 6 8.526 -21.068 -8.490 1.00 0.00 H new ATOM 0 HB3 ASN A 6 9.616 -19.698 -8.574 1.00 0.00 H new ATOM 0 HD21 ASN A 6 7.740 -20.834 -11.900 1.00 0.00 H new ATOM 0 HD22 ASN A 6 7.255 -21.234 -10.249 1.00 0.00 H new ATOM 99 N GLN A 7 12.538 -21.354 -10.164 1.00 0.00 N ATOM 100 CA GLN A 7 13.868 -20.851 -10.516 1.00 0.00 C ATOM 101 C GLN A 7 13.847 -19.366 -10.929 1.00 0.00 C ATOM 102 O GLN A 7 14.906 -18.734 -10.976 1.00 0.00 O ATOM 103 CB GLN A 7 14.498 -21.759 -11.587 1.00 0.00 C ATOM 104 CG GLN A 7 16.013 -21.522 -11.709 1.00 0.00 C ATOM 105 CD GLN A 7 16.759 -22.534 -12.578 1.00 0.00 C ATOM 106 OE1 GLN A 7 16.195 -23.461 -13.159 1.00 0.00 O ATOM 107 NE2 GLN A 7 18.066 -22.367 -12.678 1.00 0.00 N ATOM 0 H GLN A 7 12.142 -22.014 -10.833 1.00 0.00 H new ATOM 0 HA GLN A 7 14.497 -20.888 -9.627 1.00 0.00 H new ATOM 0 HB2 GLN A 7 14.311 -22.803 -11.336 1.00 0.00 H new ATOM 0 HB3 GLN A 7 14.021 -21.573 -12.549 1.00 0.00 H new ATOM 0 HG2 GLN A 7 16.177 -20.525 -12.117 1.00 0.00 H new ATOM 0 HG3 GLN A 7 16.449 -21.533 -10.710 1.00 0.00 H new ATOM 0 HE21 GLN A 7 18.520 -21.594 -12.191 1.00 0.00 H new ATOM 0 HE22 GLN A 7 18.621 -23.011 -13.242 1.00 0.00 H new ATOM 116 N THR A 8 12.671 -18.791 -11.182 1.00 0.00 N ATOM 117 CA THR A 8 12.519 -17.449 -11.713 1.00 0.00 C ATOM 118 C THR A 8 11.511 -16.692 -10.843 1.00 0.00 C ATOM 119 O THR A 8 10.590 -17.282 -10.260 1.00 0.00 O ATOM 120 CB THR A 8 12.088 -17.538 -13.193 1.00 0.00 C ATOM 121 OG1 THR A 8 12.849 -18.509 -13.884 1.00 0.00 O ATOM 122 CG2 THR A 8 12.254 -16.208 -13.938 1.00 0.00 C ATOM 0 H THR A 8 11.781 -19.262 -11.017 1.00 0.00 H new ATOM 0 HA THR A 8 13.459 -16.898 -11.685 1.00 0.00 H new ATOM 0 HB THR A 8 11.033 -17.810 -13.175 1.00 0.00 H new ATOM 0 HG1 THR A 8 12.312 -19.319 -14.006 1.00 0.00 H new ATOM 0 HG21 THR A 8 11.936 -16.329 -14.974 1.00 0.00 H new ATOM 0 HG22 THR A 8 11.643 -15.443 -13.458 1.00 0.00 H new ATOM 0 HG23 THR A 8 13.301 -15.905 -13.913 1.00 0.00 H new ATOM 130 N ILE A 9 11.697 -15.375 -10.745 1.00 0.00 N ATOM 131 CA ILE A 9 10.797 -14.480 -10.031 1.00 0.00 C ATOM 132 C ILE A 9 10.416 -13.341 -10.976 1.00 0.00 C ATOM 133 O ILE A 9 11.106 -13.075 -11.966 1.00 0.00 O ATOM 134 CB ILE A 9 11.394 -14.008 -8.676 1.00 0.00 C ATOM 135 CG1 ILE A 9 12.325 -12.785 -8.836 1.00 0.00 C ATOM 136 CG2 ILE A 9 12.063 -15.182 -7.929 1.00 0.00 C ATOM 137 CD1 ILE A 9 13.129 -12.403 -7.585 1.00 0.00 C ATOM 0 H ILE A 9 12.492 -14.896 -11.168 1.00 0.00 H new ATOM 0 HA ILE A 9 9.886 -15.006 -9.745 1.00 0.00 H new ATOM 0 HB ILE A 9 10.569 -13.663 -8.053 1.00 0.00 H new ATOM 0 HG12 ILE A 9 13.023 -12.985 -9.649 1.00 0.00 H new ATOM 0 HG13 ILE A 9 11.723 -11.928 -9.136 1.00 0.00 H new ATOM 0 HG21 ILE A 9 12.473 -14.826 -6.984 1.00 0.00 H new ATOM 0 HG22 ILE A 9 11.323 -15.958 -7.734 1.00 0.00 H new ATOM 0 HG23 ILE A 9 12.866 -15.592 -8.541 1.00 0.00 H new ATOM 0 HD11 ILE A 9 13.750 -11.534 -7.803 1.00 0.00 H new ATOM 0 HD12 ILE A 9 12.444 -12.165 -6.771 1.00 0.00 H new ATOM 0 HD13 ILE A 9 13.765 -13.238 -7.292 1.00 0.00 H new ATOM 149 N TYR A 10 9.332 -12.655 -10.634 1.00 0.00 N ATOM 150 CA TYR A 10 8.673 -11.640 -11.428 1.00 0.00 C ATOM 151 C TYR A 10 8.537 -10.425 -10.526 1.00 0.00 C ATOM 152 O TYR A 10 7.892 -10.485 -9.478 1.00 0.00 O ATOM 153 CB TYR A 10 7.313 -12.182 -11.895 1.00 0.00 C ATOM 154 CG TYR A 10 6.471 -11.249 -12.754 1.00 0.00 C ATOM 155 CD1 TYR A 10 7.046 -10.530 -13.822 1.00 0.00 C ATOM 156 CD2 TYR A 10 5.083 -11.160 -12.528 1.00 0.00 C ATOM 157 CE1 TYR A 10 6.245 -9.743 -14.665 1.00 0.00 C ATOM 158 CE2 TYR A 10 4.271 -10.384 -13.376 1.00 0.00 C ATOM 159 CZ TYR A 10 4.849 -9.682 -14.459 1.00 0.00 C ATOM 160 OH TYR A 10 4.079 -8.947 -15.308 1.00 0.00 O ATOM 0 H TYR A 10 8.866 -12.806 -9.739 1.00 0.00 H new ATOM 0 HA TYR A 10 9.229 -11.368 -12.325 1.00 0.00 H new ATOM 0 HB2 TYR A 10 7.486 -13.100 -12.456 1.00 0.00 H new ATOM 0 HB3 TYR A 10 6.732 -12.452 -11.013 1.00 0.00 H new ATOM 0 HD1 TYR A 10 8.111 -10.585 -13.993 1.00 0.00 H new ATOM 0 HD2 TYR A 10 4.639 -11.691 -11.699 1.00 0.00 H new ATOM 0 HE1 TYR A 10 6.697 -9.184 -15.471 1.00 0.00 H new ATOM 0 HE2 TYR A 10 3.207 -10.325 -13.200 1.00 0.00 H new ATOM 0 HH TYR A 10 3.935 -8.054 -14.930 1.00 0.00 H new ATOM 170 N ILE A 11 9.203 -9.342 -10.907 1.00 0.00 N ATOM 171 CA ILE A 11 9.275 -8.089 -10.172 1.00 0.00 C ATOM 172 C ILE A 11 8.212 -7.222 -10.849 1.00 0.00 C ATOM 173 O ILE A 11 8.170 -7.160 -12.080 1.00 0.00 O ATOM 174 CB ILE A 11 10.730 -7.559 -10.253 1.00 0.00 C ATOM 175 CG1 ILE A 11 11.684 -8.533 -9.507 1.00 0.00 C ATOM 176 CG2 ILE A 11 10.851 -6.141 -9.668 1.00 0.00 C ATOM 177 CD1 ILE A 11 13.177 -8.341 -9.796 1.00 0.00 C ATOM 0 H ILE A 11 9.732 -9.314 -11.779 1.00 0.00 H new ATOM 0 HA ILE A 11 9.068 -8.139 -9.103 1.00 0.00 H new ATOM 0 HB ILE A 11 11.013 -7.505 -11.304 1.00 0.00 H new ATOM 0 HG12 ILE A 11 11.522 -8.423 -8.435 1.00 0.00 H new ATOM 0 HG13 ILE A 11 11.409 -9.555 -9.768 1.00 0.00 H new ATOM 0 HG21 ILE A 11 11.885 -5.804 -9.742 1.00 0.00 H new ATOM 0 HG22 ILE A 11 10.206 -5.461 -10.225 1.00 0.00 H new ATOM 0 HG23 ILE A 11 10.548 -6.152 -8.621 1.00 0.00 H new ATOM 0 HD11 ILE A 11 13.754 -9.069 -9.227 1.00 0.00 H new ATOM 0 HD12 ILE A 11 13.363 -8.483 -10.861 1.00 0.00 H new ATOM 0 HD13 ILE A 11 13.477 -7.334 -9.507 1.00 0.00 H new ATOM 189 N ASN A 12 7.351 -6.570 -10.061 1.00 0.00 N ATOM 190 CA ASN A 12 6.146 -5.923 -10.583 1.00 0.00 C ATOM 191 C ASN A 12 5.884 -4.496 -10.086 1.00 0.00 C ATOM 192 O ASN A 12 4.847 -3.924 -10.418 1.00 0.00 O ATOM 193 CB ASN A 12 4.943 -6.838 -10.272 1.00 0.00 C ATOM 194 CG ASN A 12 3.861 -6.662 -11.327 1.00 0.00 C ATOM 195 OD1 ASN A 12 2.797 -6.100 -11.089 1.00 0.00 O ATOM 196 ND2 ASN A 12 4.136 -7.149 -12.524 1.00 0.00 N ATOM 0 H ASN A 12 7.469 -6.477 -9.052 1.00 0.00 H new ATOM 0 HA ASN A 12 6.301 -5.796 -11.654 1.00 0.00 H new ATOM 0 HB2 ASN A 12 5.266 -7.878 -10.243 1.00 0.00 H new ATOM 0 HB3 ASN A 12 4.542 -6.601 -9.287 1.00 0.00 H new ATOM 0 HD21 ASN A 12 3.455 -7.062 -13.279 1.00 0.00 H new ATOM 0 HD22 ASN A 12 5.029 -7.612 -12.694 1.00 0.00 H new ATOM 203 N ASN A 13 6.799 -3.898 -9.314 1.00 0.00 N ATOM 204 CA ASN A 13 6.722 -2.488 -8.919 1.00 0.00 C ATOM 205 C ASN A 13 8.106 -1.842 -9.000 1.00 0.00 C ATOM 206 O ASN A 13 8.553 -1.147 -8.088 1.00 0.00 O ATOM 207 CB ASN A 13 6.052 -2.315 -7.545 1.00 0.00 C ATOM 208 CG ASN A 13 5.651 -0.859 -7.305 1.00 0.00 C ATOM 209 OD1 ASN A 13 5.064 -0.213 -8.170 1.00 0.00 O ATOM 210 ND2 ASN A 13 5.916 -0.311 -6.132 1.00 0.00 N ATOM 0 H ASN A 13 7.617 -4.382 -8.944 1.00 0.00 H new ATOM 0 HA ASN A 13 6.078 -1.961 -9.623 1.00 0.00 H new ATOM 0 HB2 ASN A 13 5.170 -2.953 -7.485 1.00 0.00 H new ATOM 0 HB3 ASN A 13 6.735 -2.641 -6.761 1.00 0.00 H new ATOM 0 HD21 ASN A 13 5.633 0.651 -5.943 1.00 0.00 H new ATOM 0 HD22 ASN A 13 6.403 -0.850 -5.416 1.00 0.00 H new ATOM 217 N LEU A 14 8.824 -2.170 -10.075 1.00 0.00 N ATOM 218 CA LEU A 14 10.169 -1.682 -10.359 1.00 0.00 C ATOM 219 C LEU A 14 10.074 -0.174 -10.613 1.00 0.00 C ATOM 220 O LEU A 14 9.151 0.265 -11.306 1.00 0.00 O ATOM 221 CB LEU A 14 10.673 -2.447 -11.597 1.00 0.00 C ATOM 222 CG LEU A 14 12.187 -2.685 -11.689 1.00 0.00 C ATOM 223 CD1 LEU A 14 12.413 -3.664 -12.846 1.00 0.00 C ATOM 224 CD2 LEU A 14 13.005 -1.413 -11.931 1.00 0.00 C ATOM 0 H LEU A 14 8.472 -2.803 -10.793 1.00 0.00 H new ATOM 0 HA LEU A 14 10.866 -1.844 -9.537 1.00 0.00 H new ATOM 0 HB2 LEU A 14 10.174 -3.415 -11.626 1.00 0.00 H new ATOM 0 HB3 LEU A 14 10.359 -1.900 -12.486 1.00 0.00 H new ATOM 0 HG LEU A 14 12.529 -3.075 -10.730 1.00 0.00 H new ATOM 0 HD11 LEU A 14 13.479 -3.864 -12.950 1.00 0.00 H new ATOM 0 HD12 LEU A 14 11.887 -4.597 -12.642 1.00 0.00 H new ATOM 0 HD13 LEU A 14 12.034 -3.229 -13.770 1.00 0.00 H new ATOM 0 HD21 LEU A 14 14.064 -1.666 -11.983 1.00 0.00 H new ATOM 0 HD22 LEU A 14 12.695 -0.954 -12.870 1.00 0.00 H new ATOM 0 HD23 LEU A 14 12.839 -0.713 -11.112 1.00 0.00 H new ATOM 236 N ASN A 15 10.996 0.629 -10.069 1.00 0.00 N ATOM 237 CA ASN A 15 11.058 2.053 -10.396 1.00 0.00 C ATOM 238 C ASN A 15 11.487 2.193 -11.857 1.00 0.00 C ATOM 239 O ASN A 15 12.648 1.952 -12.190 1.00 0.00 O ATOM 240 CB ASN A 15 12.002 2.829 -9.462 1.00 0.00 C ATOM 241 CG ASN A 15 11.894 4.341 -9.687 1.00 0.00 C ATOM 242 OD1 ASN A 15 11.515 4.813 -10.754 1.00 0.00 O ATOM 243 ND2 ASN A 15 12.189 5.137 -8.676 1.00 0.00 N ATOM 0 H ASN A 15 11.704 0.317 -9.405 1.00 0.00 H new ATOM 0 HA ASN A 15 10.070 2.491 -10.252 1.00 0.00 H new ATOM 0 HB2 ASN A 15 11.762 2.596 -8.425 1.00 0.00 H new ATOM 0 HB3 ASN A 15 13.029 2.507 -9.632 1.00 0.00 H new ATOM 0 HD21 ASN A 15 12.102 6.148 -8.781 1.00 0.00 H new ATOM 0 HD22 ASN A 15 12.504 4.741 -7.790 1.00 0.00 H new ATOM 250 N GLU A 16 10.555 2.568 -12.732 1.00 0.00 N ATOM 251 CA GLU A 16 10.776 2.594 -14.172 1.00 0.00 C ATOM 252 C GLU A 16 11.868 3.577 -14.615 1.00 0.00 C ATOM 253 O GLU A 16 12.310 3.487 -15.759 1.00 0.00 O ATOM 254 CB GLU A 16 9.441 2.787 -14.919 1.00 0.00 C ATOM 255 CG GLU A 16 8.681 4.101 -14.653 1.00 0.00 C ATOM 256 CD GLU A 16 9.278 5.340 -15.347 1.00 0.00 C ATOM 257 OE1 GLU A 16 9.291 5.399 -16.599 1.00 0.00 O ATOM 258 OE2 GLU A 16 9.695 6.286 -14.641 1.00 0.00 O ATOM 0 H GLU A 16 9.619 2.864 -12.456 1.00 0.00 H new ATOM 0 HA GLU A 16 11.175 1.619 -14.452 1.00 0.00 H new ATOM 0 HB2 GLU A 16 9.637 2.718 -15.989 1.00 0.00 H new ATOM 0 HB3 GLU A 16 8.784 1.956 -14.661 1.00 0.00 H new ATOM 0 HG2 GLU A 16 7.648 3.980 -14.980 1.00 0.00 H new ATOM 0 HG3 GLU A 16 8.656 4.280 -13.578 1.00 0.00 H new ATOM 265 N LYS A 17 12.356 4.489 -13.762 1.00 0.00 N ATOM 266 CA LYS A 17 13.474 5.353 -14.145 1.00 0.00 C ATOM 267 C LYS A 17 14.742 4.551 -14.467 1.00 0.00 C ATOM 268 O LYS A 17 15.596 5.033 -15.211 1.00 0.00 O ATOM 269 CB LYS A 17 13.727 6.441 -13.089 1.00 0.00 C ATOM 270 CG LYS A 17 14.521 5.973 -11.856 1.00 0.00 C ATOM 271 CD LYS A 17 14.609 7.113 -10.837 1.00 0.00 C ATOM 272 CE LYS A 17 15.424 6.686 -9.607 1.00 0.00 C ATOM 273 NZ LYS A 17 15.611 7.805 -8.647 1.00 0.00 N ATOM 0 H LYS A 17 11.999 4.644 -12.819 1.00 0.00 H new ATOM 0 HA LYS A 17 13.190 5.859 -15.068 1.00 0.00 H new ATOM 0 HB2 LYS A 17 14.265 7.265 -13.558 1.00 0.00 H new ATOM 0 HB3 LYS A 17 12.767 6.835 -12.757 1.00 0.00 H new ATOM 0 HG2 LYS A 17 14.036 5.107 -11.406 1.00 0.00 H new ATOM 0 HG3 LYS A 17 15.522 5.660 -12.153 1.00 0.00 H new ATOM 0 HD2 LYS A 17 15.071 7.985 -11.300 1.00 0.00 H new ATOM 0 HD3 LYS A 17 13.606 7.409 -10.529 1.00 0.00 H new ATOM 0 HE2 LYS A 17 14.919 5.860 -9.107 1.00 0.00 H new ATOM 0 HE3 LYS A 17 16.398 6.317 -9.928 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 16.166 7.474 -7.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 16.116 8.584 -9.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 14.683 8.141 -8.320 1.00 0.00 H new ATOM 287 N ILE A 18 14.878 3.355 -13.891 1.00 0.00 N ATOM 288 CA ILE A 18 16.047 2.502 -14.035 1.00 0.00 C ATOM 289 C ILE A 18 16.056 1.943 -15.464 1.00 0.00 C ATOM 290 O ILE A 18 15.108 1.276 -15.887 1.00 0.00 O ATOM 291 CB ILE A 18 16.006 1.428 -12.919 1.00 0.00 C ATOM 292 CG1 ILE A 18 15.962 2.049 -11.498 1.00 0.00 C ATOM 293 CG2 ILE A 18 17.188 0.456 -13.008 1.00 0.00 C ATOM 294 CD1 ILE A 18 17.110 3.012 -11.157 1.00 0.00 C ATOM 0 H ILE A 18 14.156 2.947 -13.297 1.00 0.00 H new ATOM 0 HA ILE A 18 16.987 3.039 -13.907 1.00 0.00 H new ATOM 0 HB ILE A 18 15.081 0.876 -13.084 1.00 0.00 H new ATOM 0 HG12 ILE A 18 15.018 2.582 -11.383 1.00 0.00 H new ATOM 0 HG13 ILE A 18 15.962 1.240 -10.768 1.00 0.00 H new ATOM 0 HG21 ILE A 18 17.116 -0.278 -12.206 1.00 0.00 H new ATOM 0 HG22 ILE A 18 17.167 -0.055 -13.971 1.00 0.00 H new ATOM 0 HG23 ILE A 18 18.122 1.009 -12.911 1.00 0.00 H new ATOM 0 HD11 ILE A 18 16.981 3.387 -10.142 1.00 0.00 H new ATOM 0 HD12 ILE A 18 18.061 2.485 -11.231 1.00 0.00 H new ATOM 0 HD13 ILE A 18 17.103 3.848 -11.856 1.00 0.00 H new ATOM 306 N LYS A 19 17.117 2.242 -16.222 1.00 0.00 N ATOM 307 CA LYS A 19 17.331 1.741 -17.586 1.00 0.00 C ATOM 308 C LYS A 19 17.577 0.227 -17.556 1.00 0.00 C ATOM 309 O LYS A 19 17.939 -0.309 -16.512 1.00 0.00 O ATOM 310 CB LYS A 19 18.517 2.519 -18.192 1.00 0.00 C ATOM 311 CG LYS A 19 18.606 2.468 -19.726 1.00 0.00 C ATOM 312 CD LYS A 19 19.796 3.272 -20.279 1.00 0.00 C ATOM 313 CE LYS A 19 19.688 4.787 -20.019 1.00 0.00 C ATOM 314 NZ LYS A 19 20.706 5.296 -19.063 1.00 0.00 N ATOM 0 H LYS A 19 17.867 2.852 -15.898 1.00 0.00 H new ATOM 0 HA LYS A 19 16.451 1.900 -18.210 1.00 0.00 H new ATOM 0 HB2 LYS A 19 18.446 3.561 -17.881 1.00 0.00 H new ATOM 0 HB3 LYS A 19 19.443 2.124 -17.775 1.00 0.00 H new ATOM 0 HG2 LYS A 19 18.694 1.430 -20.046 1.00 0.00 H new ATOM 0 HG3 LYS A 19 17.681 2.856 -20.153 1.00 0.00 H new ATOM 0 HD2 LYS A 19 20.716 2.899 -19.830 1.00 0.00 H new ATOM 0 HD3 LYS A 19 19.873 3.100 -21.353 1.00 0.00 H new ATOM 0 HE2 LYS A 19 19.791 5.319 -20.965 1.00 0.00 H new ATOM 0 HE3 LYS A 19 18.694 5.012 -19.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 20.600 6.325 -18.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 20.573 4.838 -18.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 21.658 5.081 -19.422 1.00 0.00 H new ATOM 328 N LYS A 20 17.473 -0.469 -18.693 1.00 0.00 N ATOM 329 CA LYS A 20 17.726 -1.916 -18.781 1.00 0.00 C ATOM 330 C LYS A 20 19.117 -2.280 -18.258 1.00 0.00 C ATOM 331 O LYS A 20 19.264 -3.225 -17.488 1.00 0.00 O ATOM 332 CB LYS A 20 17.561 -2.384 -20.239 1.00 0.00 C ATOM 333 CG LYS A 20 17.616 -3.919 -20.356 1.00 0.00 C ATOM 334 CD LYS A 20 17.527 -4.416 -21.809 1.00 0.00 C ATOM 335 CE LYS A 20 18.770 -4.044 -22.635 1.00 0.00 C ATOM 336 NZ LYS A 20 18.715 -4.597 -24.013 1.00 0.00 N ATOM 0 H LYS A 20 17.210 -0.045 -19.583 1.00 0.00 H new ATOM 0 HA LYS A 20 16.998 -2.426 -18.151 1.00 0.00 H new ATOM 0 HB2 LYS A 20 16.610 -2.023 -20.631 1.00 0.00 H new ATOM 0 HB3 LYS A 20 18.347 -1.944 -20.853 1.00 0.00 H new ATOM 0 HG2 LYS A 20 18.544 -4.278 -19.911 1.00 0.00 H new ATOM 0 HG3 LYS A 20 16.798 -4.351 -19.780 1.00 0.00 H new ATOM 0 HD2 LYS A 20 17.403 -5.499 -21.812 1.00 0.00 H new ATOM 0 HD3 LYS A 20 16.641 -3.992 -22.281 1.00 0.00 H new ATOM 0 HE2 LYS A 20 18.860 -2.959 -22.684 1.00 0.00 H new ATOM 0 HE3 LYS A 20 19.663 -4.415 -22.132 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 19.573 -4.321 -24.532 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 18.656 -5.634 -23.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 17.878 -4.223 -24.504 1.00 0.00 H new ATOM 350 N GLU A 21 20.142 -1.535 -18.671 1.00 0.00 N ATOM 351 CA GLU A 21 21.515 -1.798 -18.250 1.00 0.00 C ATOM 352 C GLU A 21 21.663 -1.565 -16.744 1.00 0.00 C ATOM 353 O GLU A 21 22.331 -2.331 -16.053 1.00 0.00 O ATOM 354 CB GLU A 21 22.450 -0.903 -19.075 1.00 0.00 C ATOM 355 CG GLU A 21 23.916 -1.017 -18.638 1.00 0.00 C ATOM 356 CD GLU A 21 24.857 -0.298 -19.619 1.00 0.00 C ATOM 357 OE1 GLU A 21 25.120 0.914 -19.445 1.00 0.00 O ATOM 358 OE2 GLU A 21 25.364 -0.941 -20.568 1.00 0.00 O ATOM 0 H GLU A 21 20.044 -0.739 -19.301 1.00 0.00 H new ATOM 0 HA GLU A 21 21.782 -2.839 -18.429 1.00 0.00 H new ATOM 0 HB2 GLU A 21 22.367 -1.171 -20.128 1.00 0.00 H new ATOM 0 HB3 GLU A 21 22.127 0.134 -18.984 1.00 0.00 H new ATOM 0 HG2 GLU A 21 24.033 -0.591 -17.642 1.00 0.00 H new ATOM 0 HG3 GLU A 21 24.195 -2.068 -18.570 1.00 0.00 H new ATOM 365 N GLU A 22 21.004 -0.531 -16.222 1.00 0.00 N ATOM 366 CA GLU A 22 21.054 -0.179 -14.808 1.00 0.00 C ATOM 367 C GLU A 22 20.319 -1.238 -13.980 1.00 0.00 C ATOM 368 O GLU A 22 20.775 -1.593 -12.897 1.00 0.00 O ATOM 369 CB GLU A 22 20.433 1.208 -14.607 1.00 0.00 C ATOM 370 CG GLU A 22 21.239 2.331 -15.285 1.00 0.00 C ATOM 371 CD GLU A 22 20.400 3.589 -15.582 1.00 0.00 C ATOM 372 OE1 GLU A 22 19.304 3.768 -15.005 1.00 0.00 O ATOM 373 OE2 GLU A 22 20.825 4.385 -16.451 1.00 0.00 O ATOM 0 H GLU A 22 20.415 0.090 -16.777 1.00 0.00 H new ATOM 0 HA GLU A 22 22.090 -0.148 -14.472 1.00 0.00 H new ATOM 0 HB2 GLU A 22 19.418 1.207 -15.004 1.00 0.00 H new ATOM 0 HB3 GLU A 22 20.358 1.415 -13.540 1.00 0.00 H new ATOM 0 HG2 GLU A 22 22.077 2.605 -14.644 1.00 0.00 H new ATOM 0 HG3 GLU A 22 21.660 1.955 -16.217 1.00 0.00 H new ATOM 380 N LEU A 23 19.218 -1.785 -14.501 1.00 0.00 N ATOM 381 CA LEU A 23 18.475 -2.897 -13.918 1.00 0.00 C ATOM 382 C LEU A 23 19.397 -4.110 -13.825 1.00 0.00 C ATOM 383 O LEU A 23 19.546 -4.681 -12.742 1.00 0.00 O ATOM 384 CB LEU A 23 17.201 -3.131 -14.769 1.00 0.00 C ATOM 385 CG LEU A 23 16.351 -4.395 -14.527 1.00 0.00 C ATOM 386 CD1 LEU A 23 16.943 -5.663 -15.147 1.00 0.00 C ATOM 387 CD2 LEU A 23 16.069 -4.612 -13.040 1.00 0.00 C ATOM 0 H LEU A 23 18.807 -1.451 -15.373 1.00 0.00 H new ATOM 0 HA LEU A 23 18.142 -2.687 -12.902 1.00 0.00 H new ATOM 0 HB2 LEU A 23 16.551 -2.268 -14.629 1.00 0.00 H new ATOM 0 HB3 LEU A 23 17.503 -3.136 -15.816 1.00 0.00 H new ATOM 0 HG LEU A 23 15.408 -4.206 -15.041 1.00 0.00 H new ATOM 0 HD11 LEU A 23 16.291 -6.510 -14.935 1.00 0.00 H new ATOM 0 HD12 LEU A 23 17.031 -5.534 -16.226 1.00 0.00 H new ATOM 0 HD13 LEU A 23 17.929 -5.850 -14.722 1.00 0.00 H new ATOM 0 HD21 LEU A 23 15.468 -5.512 -12.911 1.00 0.00 H new ATOM 0 HD22 LEU A 23 17.011 -4.725 -12.504 1.00 0.00 H new ATOM 0 HD23 LEU A 23 15.527 -3.754 -12.643 1.00 0.00 H new ATOM 399 N LYS A 24 20.064 -4.477 -14.926 1.00 0.00 N ATOM 400 CA LYS A 24 20.996 -5.605 -14.941 1.00 0.00 C ATOM 401 C LYS A 24 22.094 -5.395 -13.902 1.00 0.00 C ATOM 402 O LYS A 24 22.340 -6.284 -13.083 1.00 0.00 O ATOM 403 CB LYS A 24 21.586 -5.787 -16.350 1.00 0.00 C ATOM 404 CG LYS A 24 20.572 -6.405 -17.331 1.00 0.00 C ATOM 405 CD LYS A 24 21.022 -6.317 -18.799 1.00 0.00 C ATOM 406 CE LYS A 24 22.405 -6.949 -19.031 1.00 0.00 C ATOM 407 NZ LYS A 24 22.767 -7.010 -20.470 1.00 0.00 N ATOM 0 H LYS A 24 19.972 -4.003 -15.824 1.00 0.00 H new ATOM 0 HA LYS A 24 20.458 -6.517 -14.681 1.00 0.00 H new ATOM 0 HB2 LYS A 24 21.915 -4.821 -16.732 1.00 0.00 H new ATOM 0 HB3 LYS A 24 22.468 -6.424 -16.293 1.00 0.00 H new ATOM 0 HG2 LYS A 24 20.412 -7.451 -17.068 1.00 0.00 H new ATOM 0 HG3 LYS A 24 19.613 -5.899 -17.220 1.00 0.00 H new ATOM 0 HD2 LYS A 24 20.288 -6.816 -19.431 1.00 0.00 H new ATOM 0 HD3 LYS A 24 21.048 -5.271 -19.105 1.00 0.00 H new ATOM 0 HE2 LYS A 24 23.159 -6.373 -18.494 1.00 0.00 H new ATOM 0 HE3 LYS A 24 22.416 -7.956 -18.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 23.707 -7.444 -20.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 22.064 -7.581 -20.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 22.784 -6.048 -20.865 1.00 0.00 H new ATOM 421 N LYS A 25 22.713 -4.212 -13.894 1.00 0.00 N ATOM 422 CA LYS A 25 23.758 -3.863 -12.937 1.00 0.00 C ATOM 423 C LYS A 25 23.236 -3.990 -11.509 1.00 0.00 C ATOM 424 O LYS A 25 23.905 -4.597 -10.679 1.00 0.00 O ATOM 425 CB LYS A 25 24.273 -2.446 -13.249 1.00 0.00 C ATOM 426 CG LYS A 25 25.445 -2.032 -12.346 1.00 0.00 C ATOM 427 CD LYS A 25 25.985 -0.652 -12.745 1.00 0.00 C ATOM 428 CE LYS A 25 27.156 -0.263 -11.833 1.00 0.00 C ATOM 429 NZ LYS A 25 27.720 1.066 -12.178 1.00 0.00 N ATOM 0 H LYS A 25 22.500 -3.467 -14.557 1.00 0.00 H new ATOM 0 HA LYS A 25 24.595 -4.555 -13.027 1.00 0.00 H new ATOM 0 HB2 LYS A 25 24.588 -2.399 -14.291 1.00 0.00 H new ATOM 0 HB3 LYS A 25 23.458 -1.733 -13.130 1.00 0.00 H new ATOM 0 HG2 LYS A 25 25.118 -2.012 -11.306 1.00 0.00 H new ATOM 0 HG3 LYS A 25 26.242 -2.772 -12.416 1.00 0.00 H new ATOM 0 HD2 LYS A 25 26.312 -0.667 -13.785 1.00 0.00 H new ATOM 0 HD3 LYS A 25 25.193 0.093 -12.671 1.00 0.00 H new ATOM 0 HE2 LYS A 25 26.819 -0.255 -10.796 1.00 0.00 H new ATOM 0 HE3 LYS A 25 27.939 -1.018 -11.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 28.508 1.286 -11.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 28.066 1.052 -13.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 26.982 1.792 -12.082 1.00 0.00 H new ATOM 443 N SER A 26 22.052 -3.457 -11.214 1.00 0.00 N ATOM 444 CA SER A 26 21.507 -3.437 -9.862 1.00 0.00 C ATOM 445 C SER A 26 21.221 -4.850 -9.359 1.00 0.00 C ATOM 446 O SER A 26 21.582 -5.192 -8.233 1.00 0.00 O ATOM 447 CB SER A 26 20.248 -2.567 -9.825 1.00 0.00 C ATOM 448 OG SER A 26 20.530 -1.257 -10.280 1.00 0.00 O ATOM 0 H SER A 26 21.443 -3.026 -11.910 1.00 0.00 H new ATOM 0 HA SER A 26 22.250 -3.004 -9.192 1.00 0.00 H new ATOM 0 HB2 SER A 26 19.473 -3.014 -10.447 1.00 0.00 H new ATOM 0 HB3 SER A 26 19.857 -2.528 -8.808 1.00 0.00 H new ATOM 0 HG SER A 26 20.301 -1.184 -11.230 1.00 0.00 H new ATOM 454 N LEU A 27 20.631 -5.702 -10.196 1.00 0.00 N ATOM 455 CA LEU A 27 20.377 -7.094 -9.834 1.00 0.00 C ATOM 456 C LEU A 27 21.700 -7.806 -9.544 1.00 0.00 C ATOM 457 O LEU A 27 21.833 -8.461 -8.510 1.00 0.00 O ATOM 458 CB LEU A 27 19.616 -7.809 -10.960 1.00 0.00 C ATOM 459 CG LEU A 27 18.138 -7.393 -11.088 1.00 0.00 C ATOM 460 CD1 LEU A 27 17.536 -8.008 -12.345 1.00 0.00 C ATOM 461 CD2 LEU A 27 17.295 -7.855 -9.905 1.00 0.00 C ATOM 0 H LEU A 27 20.319 -5.450 -11.134 1.00 0.00 H new ATOM 0 HA LEU A 27 19.761 -7.119 -8.935 1.00 0.00 H new ATOM 0 HB2 LEU A 27 20.120 -7.612 -11.906 1.00 0.00 H new ATOM 0 HB3 LEU A 27 19.665 -8.885 -10.790 1.00 0.00 H new ATOM 0 HG LEU A 27 18.126 -6.304 -11.126 1.00 0.00 H new ATOM 0 HD11 LEU A 27 16.491 -7.711 -12.431 1.00 0.00 H new ATOM 0 HD12 LEU A 27 18.085 -7.659 -13.220 1.00 0.00 H new ATOM 0 HD13 LEU A 27 17.601 -9.094 -12.285 1.00 0.00 H new ATOM 0 HD21 LEU A 27 16.263 -7.535 -10.047 1.00 0.00 H new ATOM 0 HD22 LEU A 27 17.332 -8.942 -9.835 1.00 0.00 H new ATOM 0 HD23 LEU A 27 17.687 -7.419 -8.986 1.00 0.00 H new ATOM 473 N TYR A 28 22.694 -7.625 -10.417 1.00 0.00 N ATOM 474 CA TYR A 28 24.027 -8.184 -10.229 1.00 0.00 C ATOM 475 C TYR A 28 24.732 -7.607 -8.990 1.00 0.00 C ATOM 476 O TYR A 28 25.585 -8.279 -8.410 1.00 0.00 O ATOM 477 CB TYR A 28 24.849 -7.955 -11.506 1.00 0.00 C ATOM 478 CG TYR A 28 26.183 -8.677 -11.524 1.00 0.00 C ATOM 479 CD1 TYR A 28 26.231 -10.056 -11.808 1.00 0.00 C ATOM 480 CD2 TYR A 28 27.375 -7.975 -11.251 1.00 0.00 C ATOM 481 CE1 TYR A 28 27.462 -10.734 -11.818 1.00 0.00 C ATOM 482 CE2 TYR A 28 28.610 -8.648 -11.258 1.00 0.00 C ATOM 483 CZ TYR A 28 28.659 -10.034 -11.542 1.00 0.00 C ATOM 484 OH TYR A 28 29.848 -10.703 -11.553 1.00 0.00 O ATOM 0 H TYR A 28 22.592 -7.084 -11.276 1.00 0.00 H new ATOM 0 HA TYR A 28 23.934 -9.255 -10.046 1.00 0.00 H new ATOM 0 HB2 TYR A 28 24.262 -8.278 -12.366 1.00 0.00 H new ATOM 0 HB3 TYR A 28 25.025 -6.886 -11.624 1.00 0.00 H new ATOM 0 HD1 TYR A 28 25.319 -10.594 -12.019 1.00 0.00 H new ATOM 0 HD2 TYR A 28 27.340 -6.917 -11.036 1.00 0.00 H new ATOM 0 HE1 TYR A 28 27.494 -11.791 -12.037 1.00 0.00 H new ATOM 0 HE2 TYR A 28 29.521 -8.107 -11.047 1.00 0.00 H new ATOM 0 HH TYR A 28 30.576 -10.080 -11.345 1.00 0.00 H new ATOM 494 N ALA A 29 24.389 -6.389 -8.558 1.00 0.00 N ATOM 495 CA ALA A 29 25.027 -5.725 -7.428 1.00 0.00 C ATOM 496 C ALA A 29 24.441 -6.148 -6.076 1.00 0.00 C ATOM 497 O ALA A 29 25.209 -6.278 -5.121 1.00 0.00 O ATOM 498 CB ALA A 29 24.909 -4.203 -7.584 1.00 0.00 C ATOM 0 H ALA A 29 23.651 -5.834 -8.992 1.00 0.00 H new ATOM 0 HA ALA A 29 26.074 -6.029 -7.434 1.00 0.00 H new ATOM 0 HB1 ALA A 29 25.388 -3.712 -6.737 1.00 0.00 H new ATOM 0 HB2 ALA A 29 25.399 -3.893 -8.507 1.00 0.00 H new ATOM 0 HB3 ALA A 29 23.857 -3.921 -7.619 1.00 0.00 H new ATOM 504 N ILE A 30 23.117 -6.344 -5.971 1.00 0.00 N ATOM 505 CA ILE A 30 22.455 -6.534 -4.672 1.00 0.00 C ATOM 506 C ILE A 30 21.540 -7.757 -4.603 1.00 0.00 C ATOM 507 O ILE A 30 21.634 -8.490 -3.621 1.00 0.00 O ATOM 508 CB ILE A 30 21.731 -5.253 -4.193 1.00 0.00 C ATOM 509 CG1 ILE A 30 20.845 -4.574 -5.260 1.00 0.00 C ATOM 510 CG2 ILE A 30 22.764 -4.255 -3.634 1.00 0.00 C ATOM 511 CD1 ILE A 30 19.864 -3.548 -4.682 1.00 0.00 C ATOM 0 H ILE A 30 22.484 -6.375 -6.771 1.00 0.00 H new ATOM 0 HA ILE A 30 23.267 -6.741 -3.975 1.00 0.00 H new ATOM 0 HB ILE A 30 21.040 -5.571 -3.412 1.00 0.00 H new ATOM 0 HG12 ILE A 30 21.485 -4.080 -5.991 1.00 0.00 H new ATOM 0 HG13 ILE A 30 20.283 -5.340 -5.795 1.00 0.00 H new ATOM 0 HG21 ILE A 30 22.253 -3.353 -3.297 1.00 0.00 H new ATOM 0 HG22 ILE A 30 23.291 -4.709 -2.795 1.00 0.00 H new ATOM 0 HG23 ILE A 30 23.479 -3.996 -4.415 1.00 0.00 H new ATOM 0 HD11 ILE A 30 19.275 -3.112 -5.489 1.00 0.00 H new ATOM 0 HD12 ILE A 30 19.199 -4.040 -3.973 1.00 0.00 H new ATOM 0 HD13 ILE A 30 20.419 -2.761 -4.172 1.00 0.00 H new ATOM 523 N PHE A 31 20.708 -8.042 -5.612 1.00 0.00 N ATOM 524 CA PHE A 31 19.905 -9.275 -5.597 1.00 0.00 C ATOM 525 C PHE A 31 20.823 -10.500 -5.545 1.00 0.00 C ATOM 526 O PHE A 31 20.532 -11.451 -4.818 1.00 0.00 O ATOM 527 CB PHE A 31 18.954 -9.372 -6.801 1.00 0.00 C ATOM 528 CG PHE A 31 17.589 -8.733 -6.610 1.00 0.00 C ATOM 529 CD1 PHE A 31 17.458 -7.338 -6.457 1.00 0.00 C ATOM 530 CD2 PHE A 31 16.431 -9.536 -6.643 1.00 0.00 C ATOM 531 CE1 PHE A 31 16.181 -6.754 -6.370 1.00 0.00 C ATOM 532 CE2 PHE A 31 15.157 -8.953 -6.534 1.00 0.00 C ATOM 533 CZ PHE A 31 15.031 -7.562 -6.404 1.00 0.00 C ATOM 0 H PHE A 31 20.573 -7.452 -6.433 1.00 0.00 H new ATOM 0 HA PHE A 31 19.284 -9.246 -4.702 1.00 0.00 H new ATOM 0 HB2 PHE A 31 19.436 -8.907 -7.661 1.00 0.00 H new ATOM 0 HB3 PHE A 31 18.812 -10.425 -7.046 1.00 0.00 H new ATOM 0 HD1 PHE A 31 18.340 -6.716 -6.406 1.00 0.00 H new ATOM 0 HD2 PHE A 31 16.523 -10.606 -6.753 1.00 0.00 H new ATOM 0 HE1 PHE A 31 16.084 -5.682 -6.277 1.00 0.00 H new ATOM 0 HE2 PHE A 31 14.275 -9.576 -6.550 1.00 0.00 H new ATOM 0 HZ PHE A 31 14.052 -7.112 -6.330 1.00 0.00 H new ATOM 543 N SER A 32 21.969 -10.437 -6.232 1.00 0.00 N ATOM 544 CA SER A 32 23.018 -11.450 -6.214 1.00 0.00 C ATOM 545 C SER A 32 23.407 -11.890 -4.800 1.00 0.00 C ATOM 546 O SER A 32 23.687 -13.068 -4.574 1.00 0.00 O ATOM 547 CB SER A 32 24.240 -10.872 -6.927 1.00 0.00 C ATOM 548 OG SER A 32 24.582 -9.615 -6.367 1.00 0.00 O ATOM 0 H SER A 32 22.195 -9.648 -6.837 1.00 0.00 H new ATOM 0 HA SER A 32 22.639 -12.339 -6.718 1.00 0.00 H new ATOM 0 HB2 SER A 32 25.081 -11.559 -6.838 1.00 0.00 H new ATOM 0 HB3 SER A 32 24.031 -10.760 -7.991 1.00 0.00 H new ATOM 0 HG SER A 32 25.239 -9.169 -6.941 1.00 0.00 H new ATOM 554 N GLN A 33 23.412 -10.952 -3.847 1.00 0.00 N ATOM 555 CA GLN A 33 23.864 -11.177 -2.481 1.00 0.00 C ATOM 556 C GLN A 33 22.870 -12.043 -1.692 1.00 0.00 C ATOM 557 O GLN A 33 23.222 -12.530 -0.615 1.00 0.00 O ATOM 558 CB GLN A 33 24.107 -9.830 -1.775 1.00 0.00 C ATOM 559 CG GLN A 33 24.993 -8.851 -2.569 1.00 0.00 C ATOM 560 CD GLN A 33 26.355 -9.442 -2.937 1.00 0.00 C ATOM 561 OE1 GLN A 33 27.223 -9.625 -2.087 1.00 0.00 O ATOM 562 NE2 GLN A 33 26.575 -9.763 -4.202 1.00 0.00 N ATOM 0 H GLN A 33 23.094 -9.997 -4.013 1.00 0.00 H new ATOM 0 HA GLN A 33 24.805 -11.725 -2.521 1.00 0.00 H new ATOM 0 HB2 GLN A 33 23.145 -9.356 -1.581 1.00 0.00 H new ATOM 0 HB3 GLN A 33 24.571 -10.019 -0.807 1.00 0.00 H new ATOM 0 HG2 GLN A 33 24.473 -8.556 -3.480 1.00 0.00 H new ATOM 0 HG3 GLN A 33 25.143 -7.946 -1.980 1.00 0.00 H new ATOM 0 HE21 GLN A 33 25.849 -9.608 -4.901 1.00 0.00 H new ATOM 0 HE22 GLN A 33 27.471 -10.166 -4.478 1.00 0.00 H new ATOM 571 N PHE A 34 21.660 -12.261 -2.222 1.00 0.00 N ATOM 572 CA PHE A 34 20.610 -13.045 -1.579 1.00 0.00 C ATOM 573 C PHE A 34 20.116 -14.186 -2.462 1.00 0.00 C ATOM 574 O PHE A 34 19.526 -15.136 -1.947 1.00 0.00 O ATOM 575 CB PHE A 34 19.462 -12.116 -1.149 1.00 0.00 C ATOM 576 CG PHE A 34 19.907 -10.882 -0.383 1.00 0.00 C ATOM 577 CD1 PHE A 34 20.500 -11.013 0.889 1.00 0.00 C ATOM 578 CD2 PHE A 34 19.768 -9.602 -0.957 1.00 0.00 C ATOM 579 CE1 PHE A 34 20.945 -9.873 1.581 1.00 0.00 C ATOM 580 CE2 PHE A 34 20.211 -8.464 -0.263 1.00 0.00 C ATOM 581 CZ PHE A 34 20.799 -8.597 1.007 1.00 0.00 C ATOM 0 H PHE A 34 21.382 -11.887 -3.130 1.00 0.00 H new ATOM 0 HA PHE A 34 21.031 -13.516 -0.691 1.00 0.00 H new ATOM 0 HB2 PHE A 34 18.915 -11.800 -2.037 1.00 0.00 H new ATOM 0 HB3 PHE A 34 18.766 -12.682 -0.530 1.00 0.00 H new ATOM 0 HD1 PHE A 34 20.613 -11.991 1.333 1.00 0.00 H new ATOM 0 HD2 PHE A 34 19.319 -9.496 -1.934 1.00 0.00 H new ATOM 0 HE1 PHE A 34 21.400 -9.977 2.555 1.00 0.00 H new ATOM 0 HE2 PHE A 34 20.100 -7.485 -0.706 1.00 0.00 H new ATOM 0 HZ PHE A 34 21.138 -7.721 1.541 1.00 0.00 H new ATOM 591 N GLY A 35 20.405 -14.142 -3.757 1.00 0.00 N ATOM 592 CA GLY A 35 20.201 -15.236 -4.674 1.00 0.00 C ATOM 593 C GLY A 35 21.091 -14.959 -5.868 1.00 0.00 C ATOM 594 O GLY A 35 20.873 -13.981 -6.580 1.00 0.00 O ATOM 0 H GLY A 35 20.800 -13.314 -4.203 1.00 0.00 H new ATOM 0 HA2 GLY A 35 20.459 -16.187 -4.209 1.00 0.00 H new ATOM 0 HA3 GLY A 35 19.155 -15.302 -4.975 1.00 0.00 H new ATOM 598 N GLN A 36 22.120 -15.782 -6.065 1.00 0.00 N ATOM 599 CA GLN A 36 22.990 -15.650 -7.229 1.00 0.00 C ATOM 600 C GLN A 36 22.158 -15.749 -8.517 1.00 0.00 C ATOM 601 O GLN A 36 21.445 -16.729 -8.757 1.00 0.00 O ATOM 602 CB GLN A 36 24.146 -16.662 -7.176 1.00 0.00 C ATOM 603 CG GLN A 36 25.072 -16.610 -8.410 1.00 0.00 C ATOM 604 CD GLN A 36 25.607 -15.207 -8.725 1.00 0.00 C ATOM 605 OE1 GLN A 36 26.276 -14.581 -7.909 1.00 0.00 O ATOM 606 NE2 GLN A 36 25.291 -14.665 -9.894 1.00 0.00 N ATOM 0 H GLN A 36 22.370 -16.544 -5.435 1.00 0.00 H new ATOM 0 HA GLN A 36 23.457 -14.665 -7.222 1.00 0.00 H new ATOM 0 HB2 GLN A 36 24.738 -16.477 -6.280 1.00 0.00 H new ATOM 0 HB3 GLN A 36 23.734 -17.667 -7.084 1.00 0.00 H new ATOM 0 HG2 GLN A 36 25.915 -17.282 -8.249 1.00 0.00 H new ATOM 0 HG3 GLN A 36 24.528 -16.984 -9.277 1.00 0.00 H new ATOM 0 HE21 GLN A 36 24.734 -15.192 -10.567 1.00 0.00 H new ATOM 0 HE22 GLN A 36 25.605 -13.721 -10.120 1.00 0.00 H new ATOM 615 N ILE A 37 22.288 -14.705 -9.332 1.00 0.00 N ATOM 616 CA ILE A 37 21.692 -14.535 -10.648 1.00 0.00 C ATOM 617 C ILE A 37 22.184 -15.644 -11.585 1.00 0.00 C ATOM 618 O ILE A 37 23.340 -16.067 -11.491 1.00 0.00 O ATOM 619 CB ILE A 37 22.127 -13.147 -11.198 1.00 0.00 C ATOM 620 CG1 ILE A 37 21.975 -11.966 -10.203 1.00 0.00 C ATOM 621 CG2 ILE A 37 21.427 -12.805 -12.521 1.00 0.00 C ATOM 622 CD1 ILE A 37 20.558 -11.731 -9.673 1.00 0.00 C ATOM 0 H ILE A 37 22.854 -13.899 -9.067 1.00 0.00 H new ATOM 0 HA ILE A 37 20.605 -14.591 -10.583 1.00 0.00 H new ATOM 0 HB ILE A 37 23.197 -13.264 -11.369 1.00 0.00 H new ATOM 0 HG12 ILE A 37 22.637 -12.140 -9.355 1.00 0.00 H new ATOM 0 HG13 ILE A 37 22.317 -11.054 -10.693 1.00 0.00 H new ATOM 0 HG21 ILE A 37 21.761 -11.827 -12.867 1.00 0.00 H new ATOM 0 HG22 ILE A 37 21.674 -13.559 -13.269 1.00 0.00 H new ATOM 0 HG23 ILE A 37 20.348 -12.786 -12.367 1.00 0.00 H new ATOM 0 HD11 ILE A 37 20.562 -10.884 -8.987 1.00 0.00 H new ATOM 0 HD12 ILE A 37 19.888 -11.519 -10.506 1.00 0.00 H new ATOM 0 HD13 ILE A 37 20.213 -12.622 -9.148 1.00 0.00 H new ATOM 634 N LEU A 38 21.336 -16.039 -12.535 1.00 0.00 N ATOM 635 CA LEU A 38 21.664 -16.904 -13.655 1.00 0.00 C ATOM 636 C LEU A 38 21.267 -16.211 -14.966 1.00 0.00 C ATOM 637 O LEU A 38 22.036 -16.283 -15.925 1.00 0.00 O ATOM 638 CB LEU A 38 20.963 -18.261 -13.483 1.00 0.00 C ATOM 639 CG LEU A 38 21.151 -19.229 -14.668 1.00 0.00 C ATOM 640 CD1 LEU A 38 22.626 -19.541 -14.949 1.00 0.00 C ATOM 641 CD2 LEU A 38 20.411 -20.533 -14.360 1.00 0.00 C ATOM 0 H LEU A 38 20.358 -15.748 -12.540 1.00 0.00 H new ATOM 0 HA LEU A 38 22.737 -17.091 -13.688 1.00 0.00 H new ATOM 0 HB2 LEU A 38 21.338 -18.738 -12.577 1.00 0.00 H new ATOM 0 HB3 LEU A 38 19.897 -18.089 -13.335 1.00 0.00 H new ATOM 0 HG LEU A 38 20.748 -18.745 -15.558 1.00 0.00 H new ATOM 0 HD11 LEU A 38 22.698 -20.227 -15.793 1.00 0.00 H new ATOM 0 HD12 LEU A 38 23.155 -18.618 -15.186 1.00 0.00 H new ATOM 0 HD13 LEU A 38 23.075 -20.001 -14.068 1.00 0.00 H new ATOM 0 HD21 LEU A 38 20.536 -21.227 -15.191 1.00 0.00 H new ATOM 0 HD22 LEU A 38 20.819 -20.977 -13.452 1.00 0.00 H new ATOM 0 HD23 LEU A 38 19.351 -20.325 -14.218 1.00 0.00 H new ATOM 653 N ASP A 39 20.134 -15.494 -15.018 1.00 0.00 N ATOM 654 CA ASP A 39 19.759 -14.672 -16.183 1.00 0.00 C ATOM 655 C ASP A 39 18.769 -13.578 -15.763 1.00 0.00 C ATOM 656 O ASP A 39 18.193 -13.665 -14.681 1.00 0.00 O ATOM 657 CB ASP A 39 19.168 -15.551 -17.304 1.00 0.00 C ATOM 658 CG ASP A 39 18.895 -14.766 -18.599 1.00 0.00 C ATOM 659 OD1 ASP A 39 19.674 -13.844 -18.929 1.00 0.00 O ATOM 660 OD2 ASP A 39 17.913 -15.090 -19.302 1.00 0.00 O ATOM 0 H ASP A 39 19.454 -15.466 -14.259 1.00 0.00 H new ATOM 0 HA ASP A 39 20.656 -14.192 -16.574 1.00 0.00 H new ATOM 0 HB2 ASP A 39 19.856 -16.368 -17.519 1.00 0.00 H new ATOM 0 HB3 ASP A 39 18.238 -16.000 -16.955 1.00 0.00 H new ATOM 665 N ILE A 40 18.562 -12.543 -16.579 1.00 0.00 N ATOM 666 CA ILE A 40 17.764 -11.353 -16.280 1.00 0.00 C ATOM 667 C ILE A 40 17.012 -10.981 -17.566 1.00 0.00 C ATOM 668 O ILE A 40 17.579 -11.088 -18.657 1.00 0.00 O ATOM 669 CB ILE A 40 18.701 -10.204 -15.813 1.00 0.00 C ATOM 670 CG1 ILE A 40 19.380 -10.539 -14.460 1.00 0.00 C ATOM 671 CG2 ILE A 40 17.940 -8.870 -15.711 1.00 0.00 C ATOM 672 CD1 ILE A 40 20.490 -9.582 -14.002 1.00 0.00 C ATOM 0 H ILE A 40 18.967 -12.511 -17.514 1.00 0.00 H new ATOM 0 HA ILE A 40 17.051 -11.536 -15.476 1.00 0.00 H new ATOM 0 HB ILE A 40 19.480 -10.099 -16.568 1.00 0.00 H new ATOM 0 HG12 ILE A 40 18.611 -10.565 -13.688 1.00 0.00 H new ATOM 0 HG13 ILE A 40 19.799 -11.543 -14.527 1.00 0.00 H new ATOM 0 HG21 ILE A 40 18.622 -8.086 -15.382 1.00 0.00 H new ATOM 0 HG22 ILE A 40 17.531 -8.609 -16.687 1.00 0.00 H new ATOM 0 HG23 ILE A 40 17.127 -8.969 -14.992 1.00 0.00 H new ATOM 0 HD11 ILE A 40 20.888 -9.918 -13.045 1.00 0.00 H new ATOM 0 HD12 ILE A 40 21.289 -9.570 -14.744 1.00 0.00 H new ATOM 0 HD13 ILE A 40 20.082 -8.577 -13.892 1.00 0.00 H new ATOM 684 N VAL A 41 15.766 -10.505 -17.446 1.00 0.00 N ATOM 685 CA VAL A 41 14.951 -10.062 -18.574 1.00 0.00 C ATOM 686 C VAL A 41 14.181 -8.795 -18.168 1.00 0.00 C ATOM 687 O VAL A 41 13.287 -8.839 -17.322 1.00 0.00 O ATOM 688 CB VAL A 41 13.996 -11.190 -19.045 1.00 0.00 C ATOM 689 CG1 VAL A 41 13.249 -10.782 -20.326 1.00 0.00 C ATOM 690 CG2 VAL A 41 14.705 -12.529 -19.320 1.00 0.00 C ATOM 0 H VAL A 41 15.293 -10.417 -16.547 1.00 0.00 H new ATOM 0 HA VAL A 41 15.596 -9.824 -19.420 1.00 0.00 H new ATOM 0 HB VAL A 41 13.304 -11.334 -18.215 1.00 0.00 H new ATOM 0 HG11 VAL A 41 12.587 -11.591 -20.634 1.00 0.00 H new ATOM 0 HG12 VAL A 41 12.661 -9.884 -20.134 1.00 0.00 H new ATOM 0 HG13 VAL A 41 13.969 -10.581 -21.119 1.00 0.00 H new ATOM 0 HG21 VAL A 41 13.973 -13.268 -19.645 1.00 0.00 H new ATOM 0 HG22 VAL A 41 15.453 -12.391 -20.101 1.00 0.00 H new ATOM 0 HG23 VAL A 41 15.192 -12.877 -18.409 1.00 0.00 H new ATOM 700 N ALA A 42 14.534 -7.668 -18.787 1.00 0.00 N ATOM 701 CA ALA A 42 13.837 -6.388 -18.759 1.00 0.00 C ATOM 702 C ALA A 42 14.078 -5.743 -20.132 1.00 0.00 C ATOM 703 O ALA A 42 14.943 -6.206 -20.883 1.00 0.00 O ATOM 704 CB ALA A 42 14.381 -5.505 -17.632 1.00 0.00 C ATOM 0 H ALA A 42 15.376 -7.626 -19.362 1.00 0.00 H new ATOM 0 HA ALA A 42 12.771 -6.515 -18.568 1.00 0.00 H new ATOM 0 HB1 ALA A 42 13.849 -4.554 -17.626 1.00 0.00 H new ATOM 0 HB2 ALA A 42 14.237 -6.007 -16.675 1.00 0.00 H new ATOM 0 HB3 ALA A 42 15.444 -5.325 -17.792 1.00 0.00 H new ATOM 710 N LEU A 43 13.351 -4.677 -20.466 1.00 0.00 N ATOM 711 CA LEU A 43 13.450 -3.967 -21.746 1.00 0.00 C ATOM 712 C LEU A 43 13.387 -2.464 -21.475 1.00 0.00 C ATOM 713 O LEU A 43 13.045 -2.042 -20.371 1.00 0.00 O ATOM 714 CB LEU A 43 12.294 -4.360 -22.696 1.00 0.00 C ATOM 715 CG LEU A 43 12.174 -5.859 -23.043 1.00 0.00 C ATOM 716 CD1 LEU A 43 10.857 -6.121 -23.782 1.00 0.00 C ATOM 717 CD2 LEU A 43 13.338 -6.339 -23.918 1.00 0.00 C ATOM 0 H LEU A 43 12.657 -4.271 -19.838 1.00 0.00 H new ATOM 0 HA LEU A 43 14.391 -4.237 -22.225 1.00 0.00 H new ATOM 0 HB2 LEU A 43 11.356 -4.037 -22.245 1.00 0.00 H new ATOM 0 HB3 LEU A 43 12.410 -3.802 -23.625 1.00 0.00 H new ATOM 0 HG LEU A 43 12.199 -6.412 -22.104 1.00 0.00 H new ATOM 0 HD11 LEU A 43 10.780 -7.181 -24.023 1.00 0.00 H new ATOM 0 HD12 LEU A 43 10.020 -5.832 -23.147 1.00 0.00 H new ATOM 0 HD13 LEU A 43 10.834 -5.537 -24.702 1.00 0.00 H new ATOM 0 HD21 LEU A 43 13.214 -7.399 -24.139 1.00 0.00 H new ATOM 0 HD22 LEU A 43 13.350 -5.773 -24.850 1.00 0.00 H new ATOM 0 HD23 LEU A 43 14.278 -6.186 -23.388 1.00 0.00 H new ATOM 729 N LYS A 44 13.685 -1.640 -22.487 1.00 0.00 N ATOM 730 CA LYS A 44 13.438 -0.197 -22.400 1.00 0.00 C ATOM 731 C LYS A 44 11.943 0.106 -22.537 1.00 0.00 C ATOM 732 O LYS A 44 11.493 1.148 -22.056 1.00 0.00 O ATOM 733 CB LYS A 44 14.248 0.563 -23.466 1.00 0.00 C ATOM 734 CG LYS A 44 15.762 0.493 -23.198 1.00 0.00 C ATOM 735 CD LYS A 44 16.598 1.195 -24.280 1.00 0.00 C ATOM 736 CE LYS A 44 16.342 2.710 -24.335 1.00 0.00 C ATOM 737 NZ LYS A 44 17.175 3.383 -25.363 1.00 0.00 N ATOM 0 H LYS A 44 14.095 -1.946 -23.370 1.00 0.00 H new ATOM 0 HA LYS A 44 13.767 0.144 -21.418 1.00 0.00 H new ATOM 0 HB2 LYS A 44 14.034 0.145 -24.450 1.00 0.00 H new ATOM 0 HB3 LYS A 44 13.931 1.606 -23.487 1.00 0.00 H new ATOM 0 HG2 LYS A 44 15.975 0.947 -22.230 1.00 0.00 H new ATOM 0 HG3 LYS A 44 16.066 -0.552 -23.133 1.00 0.00 H new ATOM 0 HD2 LYS A 44 17.656 1.016 -24.090 1.00 0.00 H new ATOM 0 HD3 LYS A 44 16.370 0.756 -25.251 1.00 0.00 H new ATOM 0 HE2 LYS A 44 15.288 2.891 -24.548 1.00 0.00 H new ATOM 0 HE3 LYS A 44 16.549 3.147 -23.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 16.969 4.402 -25.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 18.181 3.234 -25.147 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 16.959 2.985 -26.299 1.00 0.00 H new ATOM 751 N THR A 45 11.173 -0.783 -23.164 1.00 0.00 N ATOM 752 CA THR A 45 9.722 -0.725 -23.272 1.00 0.00 C ATOM 753 C THR A 45 9.126 -0.553 -21.870 1.00 0.00 C ATOM 754 O THR A 45 9.419 -1.364 -20.992 1.00 0.00 O ATOM 755 CB THR A 45 9.253 -2.036 -23.939 1.00 0.00 C ATOM 756 OG1 THR A 45 10.152 -2.417 -24.972 1.00 0.00 O ATOM 757 CG2 THR A 45 7.848 -1.913 -24.529 1.00 0.00 C ATOM 0 H THR A 45 11.566 -1.600 -23.631 1.00 0.00 H new ATOM 0 HA THR A 45 9.392 0.119 -23.877 1.00 0.00 H new ATOM 0 HB THR A 45 9.233 -2.796 -23.158 1.00 0.00 H new ATOM 0 HG1 THR A 45 9.842 -3.250 -25.384 1.00 0.00 H new ATOM 0 HG21 THR A 45 7.562 -2.860 -24.987 1.00 0.00 H new ATOM 0 HG22 THR A 45 7.141 -1.665 -23.737 1.00 0.00 H new ATOM 0 HG23 THR A 45 7.838 -1.127 -25.284 1.00 0.00 H new ATOM 765 N LEU A 46 8.294 0.475 -21.646 1.00 0.00 N ATOM 766 CA LEU A 46 7.791 0.833 -20.312 1.00 0.00 C ATOM 767 C LEU A 46 7.168 -0.365 -19.597 1.00 0.00 C ATOM 768 O LEU A 46 7.489 -0.627 -18.434 1.00 0.00 O ATOM 769 CB LEU A 46 6.770 1.981 -20.417 1.00 0.00 C ATOM 770 CG LEU A 46 6.113 2.355 -19.067 1.00 0.00 C ATOM 771 CD1 LEU A 46 7.127 2.904 -18.056 1.00 0.00 C ATOM 772 CD2 LEU A 46 5.003 3.379 -19.301 1.00 0.00 C ATOM 0 H LEU A 46 7.950 1.084 -22.389 1.00 0.00 H new ATOM 0 HA LEU A 46 8.643 1.163 -19.718 1.00 0.00 H new ATOM 0 HB2 LEU A 46 7.267 2.861 -20.825 1.00 0.00 H new ATOM 0 HB3 LEU A 46 5.990 1.698 -21.124 1.00 0.00 H new ATOM 0 HG LEU A 46 5.696 1.442 -18.642 1.00 0.00 H new ATOM 0 HD11 LEU A 46 6.616 3.151 -17.126 1.00 0.00 H new ATOM 0 HD12 LEU A 46 7.891 2.151 -17.861 1.00 0.00 H new ATOM 0 HD13 LEU A 46 7.596 3.800 -18.461 1.00 0.00 H new ATOM 0 HD21 LEU A 46 4.542 3.640 -18.348 1.00 0.00 H new ATOM 0 HD22 LEU A 46 5.424 4.274 -19.758 1.00 0.00 H new ATOM 0 HD23 LEU A 46 4.249 2.954 -19.964 1.00 0.00 H new ATOM 784 N LYS A 47 6.317 -1.123 -20.299 1.00 0.00 N ATOM 785 CA LYS A 47 5.612 -2.267 -19.717 1.00 0.00 C ATOM 786 C LYS A 47 6.556 -3.359 -19.207 1.00 0.00 C ATOM 787 O LYS A 47 6.124 -4.200 -18.423 1.00 0.00 O ATOM 788 CB LYS A 47 4.568 -2.830 -20.702 1.00 0.00 C ATOM 789 CG LYS A 47 5.182 -3.552 -21.916 1.00 0.00 C ATOM 790 CD LYS A 47 4.138 -3.964 -22.966 1.00 0.00 C ATOM 791 CE LYS A 47 3.148 -5.008 -22.425 1.00 0.00 C ATOM 792 NZ LYS A 47 2.174 -5.444 -23.456 1.00 0.00 N ATOM 0 H LYS A 47 6.100 -0.960 -21.282 1.00 0.00 H new ATOM 0 HA LYS A 47 5.086 -1.895 -18.838 1.00 0.00 H new ATOM 0 HB2 LYS A 47 3.918 -3.524 -20.170 1.00 0.00 H new ATOM 0 HB3 LYS A 47 3.940 -2.013 -21.057 1.00 0.00 H new ATOM 0 HG2 LYS A 47 5.920 -2.900 -22.383 1.00 0.00 H new ATOM 0 HG3 LYS A 47 5.713 -4.440 -21.573 1.00 0.00 H new ATOM 0 HD2 LYS A 47 3.589 -3.082 -23.295 1.00 0.00 H new ATOM 0 HD3 LYS A 47 4.646 -4.368 -23.842 1.00 0.00 H new ATOM 0 HE2 LYS A 47 3.700 -5.874 -22.059 1.00 0.00 H new ATOM 0 HE3 LYS A 47 2.611 -4.590 -21.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 1.527 -6.148 -23.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 1.628 -4.623 -23.787 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 2.683 -5.867 -24.258 1.00 0.00 H new ATOM 806 N MET A 48 7.831 -3.350 -19.609 1.00 0.00 N ATOM 807 CA MET A 48 8.848 -4.290 -19.153 1.00 0.00 C ATOM 808 C MET A 48 10.082 -3.543 -18.620 1.00 0.00 C ATOM 809 O MET A 48 11.198 -4.065 -18.629 1.00 0.00 O ATOM 810 CB MET A 48 9.154 -5.301 -20.268 1.00 0.00 C ATOM 811 CG MET A 48 9.431 -6.676 -19.664 1.00 0.00 C ATOM 812 SD MET A 48 7.942 -7.500 -19.032 1.00 0.00 S ATOM 813 CE MET A 48 8.726 -8.631 -17.861 1.00 0.00 C ATOM 0 H MET A 48 8.189 -2.669 -20.278 1.00 0.00 H new ATOM 0 HA MET A 48 8.476 -4.867 -18.307 1.00 0.00 H new ATOM 0 HB2 MET A 48 8.312 -5.360 -20.958 1.00 0.00 H new ATOM 0 HB3 MET A 48 10.016 -4.968 -20.846 1.00 0.00 H new ATOM 0 HG2 MET A 48 9.895 -7.310 -20.420 1.00 0.00 H new ATOM 0 HG3 MET A 48 10.151 -6.570 -18.852 1.00 0.00 H new ATOM 0 HE1 MET A 48 7.982 -9.326 -17.472 1.00 0.00 H new ATOM 0 HE2 MET A 48 9.514 -9.189 -18.366 1.00 0.00 H new ATOM 0 HE3 MET A 48 9.156 -8.061 -17.037 1.00 0.00 H new ATOM 823 N ARG A 49 9.862 -2.313 -18.143 1.00 0.00 N ATOM 824 CA ARG A 49 10.811 -1.491 -17.398 1.00 0.00 C ATOM 825 C ARG A 49 10.247 -1.227 -16.000 1.00 0.00 C ATOM 826 O ARG A 49 11.016 -1.101 -15.053 1.00 0.00 O ATOM 827 CB ARG A 49 11.098 -0.214 -18.203 1.00 0.00 C ATOM 828 CG ARG A 49 12.161 0.687 -17.559 1.00 0.00 C ATOM 829 CD ARG A 49 12.818 1.664 -18.550 1.00 0.00 C ATOM 830 NE ARG A 49 11.869 2.268 -19.507 1.00 0.00 N ATOM 831 CZ ARG A 49 11.015 3.274 -19.294 1.00 0.00 C ATOM 832 NH1 ARG A 49 10.979 3.882 -18.120 1.00 0.00 N ATOM 833 NH2 ARG A 49 10.195 3.645 -20.270 1.00 0.00 N ATOM 0 H ARG A 49 8.967 -1.842 -18.276 1.00 0.00 H new ATOM 0 HA ARG A 49 11.766 -1.997 -17.259 1.00 0.00 H new ATOM 0 HB2 ARG A 49 11.426 -0.491 -19.205 1.00 0.00 H new ATOM 0 HB3 ARG A 49 10.173 0.351 -18.315 1.00 0.00 H new ATOM 0 HG2 ARG A 49 11.702 1.256 -16.750 1.00 0.00 H new ATOM 0 HG3 ARG A 49 12.933 0.062 -17.111 1.00 0.00 H new ATOM 0 HD2 ARG A 49 13.311 2.459 -17.990 1.00 0.00 H new ATOM 0 HD3 ARG A 49 13.594 1.137 -19.105 1.00 0.00 H new ATOM 0 HE ARG A 49 11.865 1.869 -20.446 1.00 0.00 H new ATOM 0 HH11 ARG A 49 11.605 3.584 -17.372 1.00 0.00 H new ATOM 0 HH12 ARG A 49 10.325 4.649 -17.963 1.00 0.00 H new ATOM 0 HH21 ARG A 49 10.222 3.164 -21.169 1.00 0.00 H new ATOM 0 HH22 ARG A 49 9.538 4.411 -20.121 1.00 0.00 H new ATOM 847 N GLY A 50 8.915 -1.207 -15.851 1.00 0.00 N ATOM 848 CA GLY A 50 8.243 -1.199 -14.552 1.00 0.00 C ATOM 849 C GLY A 50 8.009 -2.629 -14.032 1.00 0.00 C ATOM 850 O GLY A 50 7.601 -2.805 -12.883 1.00 0.00 O ATOM 0 H GLY A 50 8.270 -1.196 -16.641 1.00 0.00 H new ATOM 0 HA2 GLY A 50 8.844 -0.643 -13.833 1.00 0.00 H new ATOM 0 HA3 GLY A 50 7.288 -0.681 -14.638 1.00 0.00 H new ATOM 854 N GLN A 51 8.283 -3.650 -14.855 1.00 0.00 N ATOM 855 CA GLN A 51 8.135 -5.071 -14.555 1.00 0.00 C ATOM 856 C GLN A 51 9.379 -5.762 -15.132 1.00 0.00 C ATOM 857 O GLN A 51 9.886 -5.304 -16.156 1.00 0.00 O ATOM 858 CB GLN A 51 6.859 -5.640 -15.218 1.00 0.00 C ATOM 859 CG GLN A 51 5.572 -4.838 -14.938 1.00 0.00 C ATOM 860 CD GLN A 51 4.319 -5.470 -15.558 1.00 0.00 C ATOM 861 OE1 GLN A 51 3.371 -5.830 -14.864 1.00 0.00 O ATOM 862 NE2 GLN A 51 4.259 -5.601 -16.872 1.00 0.00 N ATOM 0 H GLN A 51 8.633 -3.492 -15.800 1.00 0.00 H new ATOM 0 HA GLN A 51 8.043 -5.236 -13.482 1.00 0.00 H new ATOM 0 HB2 GLN A 51 7.015 -5.684 -16.296 1.00 0.00 H new ATOM 0 HB3 GLN A 51 6.714 -6.664 -14.875 1.00 0.00 H new ATOM 0 HG2 GLN A 51 5.432 -4.752 -13.860 1.00 0.00 H new ATOM 0 HG3 GLN A 51 5.691 -3.826 -15.326 1.00 0.00 H new ATOM 0 HE21 GLN A 51 5.044 -5.303 -17.451 1.00 0.00 H new ATOM 0 HE22 GLN A 51 3.427 -6.000 -17.307 1.00 0.00 H new ATOM 871 N ALA A 52 9.867 -6.843 -14.522 1.00 0.00 N ATOM 872 CA ALA A 52 11.045 -7.581 -14.989 1.00 0.00 C ATOM 873 C ALA A 52 10.983 -9.031 -14.506 1.00 0.00 C ATOM 874 O ALA A 52 10.225 -9.342 -13.585 1.00 0.00 O ATOM 875 CB ALA A 52 12.323 -6.916 -14.456 1.00 0.00 C ATOM 0 H ALA A 52 9.451 -7.237 -13.678 1.00 0.00 H new ATOM 0 HA ALA A 52 11.058 -7.568 -16.079 1.00 0.00 H new ATOM 0 HB1 ALA A 52 13.194 -7.469 -14.807 1.00 0.00 H new ATOM 0 HB2 ALA A 52 12.376 -5.889 -14.817 1.00 0.00 H new ATOM 0 HB3 ALA A 52 12.307 -6.918 -13.366 1.00 0.00 H new ATOM 881 N PHE A 53 11.830 -9.897 -15.066 1.00 0.00 N ATOM 882 CA PHE A 53 12.051 -11.254 -14.581 1.00 0.00 C ATOM 883 C PHE A 53 13.537 -11.410 -14.286 1.00 0.00 C ATOM 884 O PHE A 53 14.378 -10.762 -14.918 1.00 0.00 O ATOM 885 CB PHE A 53 11.648 -12.316 -15.617 1.00 0.00 C ATOM 886 CG PHE A 53 10.182 -12.398 -15.992 1.00 0.00 C ATOM 887 CD1 PHE A 53 9.272 -13.022 -15.120 1.00 0.00 C ATOM 888 CD2 PHE A 53 9.745 -11.940 -17.249 1.00 0.00 C ATOM 889 CE1 PHE A 53 7.929 -13.191 -15.505 1.00 0.00 C ATOM 890 CE2 PHE A 53 8.400 -12.102 -17.630 1.00 0.00 C ATOM 891 CZ PHE A 53 7.492 -12.727 -16.757 1.00 0.00 C ATOM 0 H PHE A 53 12.391 -9.666 -15.886 1.00 0.00 H new ATOM 0 HA PHE A 53 11.437 -11.404 -13.693 1.00 0.00 H new ATOM 0 HB2 PHE A 53 12.220 -12.134 -16.527 1.00 0.00 H new ATOM 0 HB3 PHE A 53 11.955 -13.291 -15.238 1.00 0.00 H new ATOM 0 HD1 PHE A 53 9.604 -13.372 -14.154 1.00 0.00 H new ATOM 0 HD2 PHE A 53 10.443 -11.464 -17.922 1.00 0.00 H new ATOM 0 HE1 PHE A 53 7.234 -13.678 -14.837 1.00 0.00 H new ATOM 0 HE2 PHE A 53 8.065 -11.746 -18.593 1.00 0.00 H new ATOM 0 HZ PHE A 53 6.459 -12.850 -17.049 1.00 0.00 H new ATOM 901 N VAL A 54 13.871 -12.320 -13.379 1.00 0.00 N ATOM 902 CA VAL A 54 15.244 -12.723 -13.128 1.00 0.00 C ATOM 903 C VAL A 54 15.219 -14.182 -12.675 1.00 0.00 C ATOM 904 O VAL A 54 14.319 -14.611 -11.945 1.00 0.00 O ATOM 905 CB VAL A 54 15.958 -11.717 -12.192 1.00 0.00 C ATOM 906 CG1 VAL A 54 15.117 -11.221 -11.004 1.00 0.00 C ATOM 907 CG2 VAL A 54 17.296 -12.230 -11.651 1.00 0.00 C ATOM 0 H VAL A 54 13.189 -12.801 -12.793 1.00 0.00 H new ATOM 0 HA VAL A 54 15.861 -12.689 -14.026 1.00 0.00 H new ATOM 0 HB VAL A 54 16.130 -10.871 -12.858 1.00 0.00 H new ATOM 0 HG11 VAL A 54 15.705 -10.522 -10.409 1.00 0.00 H new ATOM 0 HG12 VAL A 54 14.223 -10.720 -11.375 1.00 0.00 H new ATOM 0 HG13 VAL A 54 14.826 -12.069 -10.385 1.00 0.00 H new ATOM 0 HG21 VAL A 54 17.740 -11.474 -11.003 1.00 0.00 H new ATOM 0 HG22 VAL A 54 17.132 -13.145 -11.082 1.00 0.00 H new ATOM 0 HG23 VAL A 54 17.970 -12.436 -12.483 1.00 0.00 H new ATOM 917 N ILE A 55 16.179 -14.934 -13.203 1.00 0.00 N ATOM 918 CA ILE A 55 16.342 -16.371 -13.133 1.00 0.00 C ATOM 919 C ILE A 55 17.587 -16.559 -12.266 1.00 0.00 C ATOM 920 O ILE A 55 18.573 -15.834 -12.450 1.00 0.00 O ATOM 921 CB ILE A 55 16.579 -16.956 -14.555 1.00 0.00 C ATOM 922 CG1 ILE A 55 15.508 -16.701 -15.650 1.00 0.00 C ATOM 923 CG2 ILE A 55 16.762 -18.483 -14.463 1.00 0.00 C ATOM 924 CD1 ILE A 55 15.281 -15.252 -16.111 1.00 0.00 C ATOM 0 H ILE A 55 16.932 -14.505 -13.741 1.00 0.00 H new ATOM 0 HA ILE A 55 15.466 -16.877 -12.728 1.00 0.00 H new ATOM 0 HB ILE A 55 17.461 -16.406 -14.883 1.00 0.00 H new ATOM 0 HG12 ILE A 55 15.777 -17.292 -16.525 1.00 0.00 H new ATOM 0 HG13 ILE A 55 14.557 -17.088 -15.284 1.00 0.00 H new ATOM 0 HG21 ILE A 55 16.928 -18.890 -15.460 1.00 0.00 H new ATOM 0 HG22 ILE A 55 17.621 -18.709 -13.831 1.00 0.00 H new ATOM 0 HG23 ILE A 55 15.867 -18.931 -14.032 1.00 0.00 H new ATOM 0 HD11 ILE A 55 14.506 -15.231 -16.877 1.00 0.00 H new ATOM 0 HD12 ILE A 55 14.968 -14.645 -15.262 1.00 0.00 H new ATOM 0 HD13 ILE A 55 16.208 -14.851 -16.522 1.00 0.00 H new ATOM 936 N PHE A 56 17.575 -17.544 -11.371 1.00 0.00 N ATOM 937 CA PHE A 56 18.599 -17.740 -10.347 1.00 0.00 C ATOM 938 C PHE A 56 19.245 -19.118 -10.485 1.00 0.00 C ATOM 939 O PHE A 56 18.758 -19.980 -11.221 1.00 0.00 O ATOM 940 CB PHE A 56 17.952 -17.564 -8.965 1.00 0.00 C ATOM 941 CG PHE A 56 17.442 -16.157 -8.713 1.00 0.00 C ATOM 942 CD1 PHE A 56 16.165 -15.760 -9.153 1.00 0.00 C ATOM 943 CD2 PHE A 56 18.273 -15.223 -8.072 1.00 0.00 C ATOM 944 CE1 PHE A 56 15.740 -14.437 -8.960 1.00 0.00 C ATOM 945 CE2 PHE A 56 17.838 -13.903 -7.861 1.00 0.00 C ATOM 946 CZ PHE A 56 16.568 -13.509 -8.309 1.00 0.00 C ATOM 0 H PHE A 56 16.835 -18.245 -11.337 1.00 0.00 H new ATOM 0 HA PHE A 56 19.390 -17.001 -10.470 1.00 0.00 H new ATOM 0 HB2 PHE A 56 17.124 -18.266 -8.868 1.00 0.00 H new ATOM 0 HB3 PHE A 56 18.680 -17.822 -8.196 1.00 0.00 H new ATOM 0 HD1 PHE A 56 15.514 -16.472 -9.638 1.00 0.00 H new ATOM 0 HD2 PHE A 56 19.256 -15.522 -7.738 1.00 0.00 H new ATOM 0 HE1 PHE A 56 14.767 -14.130 -9.315 1.00 0.00 H new ATOM 0 HE2 PHE A 56 18.479 -13.195 -7.356 1.00 0.00 H new ATOM 0 HZ PHE A 56 16.229 -12.496 -8.154 1.00 0.00 H new ATOM 956 N LYS A 57 20.352 -19.341 -9.768 1.00 0.00 N ATOM 957 CA LYS A 57 21.045 -20.632 -9.762 1.00 0.00 C ATOM 958 C LYS A 57 20.151 -21.768 -9.269 1.00 0.00 C ATOM 959 O LYS A 57 20.310 -22.894 -9.738 1.00 0.00 O ATOM 960 CB LYS A 57 22.294 -20.563 -8.863 1.00 0.00 C ATOM 961 CG LYS A 57 23.472 -19.778 -9.465 1.00 0.00 C ATOM 962 CD LYS A 57 24.498 -20.636 -10.226 1.00 0.00 C ATOM 963 CE LYS A 57 23.912 -21.367 -11.440 1.00 0.00 C ATOM 964 NZ LYS A 57 24.945 -22.139 -12.181 1.00 0.00 N ATOM 0 H LYS A 57 20.791 -18.634 -9.178 1.00 0.00 H new ATOM 0 HA LYS A 57 21.328 -20.840 -10.794 1.00 0.00 H new ATOM 0 HB2 LYS A 57 22.017 -20.106 -7.913 1.00 0.00 H new ATOM 0 HB3 LYS A 57 22.625 -21.578 -8.644 1.00 0.00 H new ATOM 0 HG2 LYS A 57 23.077 -19.022 -10.144 1.00 0.00 H new ATOM 0 HG3 LYS A 57 23.986 -19.249 -8.662 1.00 0.00 H new ATOM 0 HD2 LYS A 57 25.317 -19.998 -10.558 1.00 0.00 H new ATOM 0 HD3 LYS A 57 24.923 -21.370 -9.542 1.00 0.00 H new ATOM 0 HE2 LYS A 57 23.123 -22.043 -11.110 1.00 0.00 H new ATOM 0 HE3 LYS A 57 23.451 -20.642 -12.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 24.505 -22.617 -12.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 25.686 -21.492 -12.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 25.368 -22.849 -11.549 1.00 0.00 H new ATOM 978 N GLU A 58 19.252 -21.505 -8.319 1.00 0.00 N ATOM 979 CA GLU A 58 18.497 -22.539 -7.624 1.00 0.00 C ATOM 980 C GLU A 58 17.182 -21.941 -7.125 1.00 0.00 C ATOM 981 O GLU A 58 17.107 -20.743 -6.842 1.00 0.00 O ATOM 982 CB GLU A 58 19.360 -23.061 -6.458 1.00 0.00 C ATOM 983 CG GLU A 58 18.817 -24.352 -5.834 1.00 0.00 C ATOM 984 CD GLU A 58 19.746 -24.877 -4.723 1.00 0.00 C ATOM 985 OE1 GLU A 58 20.671 -25.668 -5.017 1.00 0.00 O ATOM 986 OE2 GLU A 58 19.543 -24.523 -3.540 1.00 0.00 O ATOM 0 H GLU A 58 19.028 -20.559 -8.011 1.00 0.00 H new ATOM 0 HA GLU A 58 18.259 -23.372 -8.286 1.00 0.00 H new ATOM 0 HB2 GLU A 58 20.374 -23.237 -6.816 1.00 0.00 H new ATOM 0 HB3 GLU A 58 19.423 -22.292 -5.688 1.00 0.00 H new ATOM 0 HG2 GLU A 58 17.824 -24.169 -5.423 1.00 0.00 H new ATOM 0 HG3 GLU A 58 18.707 -25.113 -6.607 1.00 0.00 H new ATOM 993 N ILE A 59 16.155 -22.782 -6.981 1.00 0.00 N ATOM 994 CA ILE A 59 14.829 -22.392 -6.499 1.00 0.00 C ATOM 995 C ILE A 59 14.871 -21.801 -5.078 1.00 0.00 C ATOM 996 O ILE A 59 14.082 -20.911 -4.757 1.00 0.00 O ATOM 997 CB ILE A 59 13.860 -23.597 -6.613 1.00 0.00 C ATOM 998 CG1 ILE A 59 14.214 -24.763 -5.655 1.00 0.00 C ATOM 999 CG2 ILE A 59 13.791 -24.092 -8.070 1.00 0.00 C ATOM 1000 CD1 ILE A 59 13.288 -25.982 -5.773 1.00 0.00 C ATOM 0 H ILE A 59 16.224 -23.775 -7.201 1.00 0.00 H new ATOM 0 HA ILE A 59 14.454 -21.588 -7.133 1.00 0.00 H new ATOM 0 HB ILE A 59 12.879 -23.237 -6.304 1.00 0.00 H new ATOM 0 HG12 ILE A 59 15.239 -25.080 -5.850 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.184 -24.396 -4.629 1.00 0.00 H new ATOM 0 HG21 ILE A 59 13.107 -24.938 -8.135 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.433 -23.286 -8.711 1.00 0.00 H new ATOM 0 HG23 ILE A 59 14.784 -24.402 -8.396 1.00 0.00 H new ATOM 0 HD11 ILE A 59 13.606 -26.750 -5.068 1.00 0.00 H new ATOM 0 HD12 ILE A 59 12.264 -25.684 -5.547 1.00 0.00 H new ATOM 0 HD13 ILE A 59 13.335 -26.378 -6.787 1.00 0.00 H new ATOM 1012 N GLY A 60 15.804 -22.254 -4.233 1.00 0.00 N ATOM 1013 CA GLY A 60 15.972 -21.716 -2.888 1.00 0.00 C ATOM 1014 C GLY A 60 16.567 -20.313 -2.947 1.00 0.00 C ATOM 1015 O GLY A 60 16.086 -19.410 -2.263 1.00 0.00 O ATOM 0 H GLY A 60 16.459 -23.001 -4.466 1.00 0.00 H new ATOM 0 HA2 GLY A 60 15.009 -21.688 -2.378 1.00 0.00 H new ATOM 0 HA3 GLY A 60 16.622 -22.370 -2.307 1.00 0.00 H new ATOM 1019 N SER A 61 17.558 -20.102 -3.816 1.00 0.00 N ATOM 1020 CA SER A 61 18.179 -18.802 -4.037 1.00 0.00 C ATOM 1021 C SER A 61 17.149 -17.808 -4.578 1.00 0.00 C ATOM 1022 O SER A 61 17.077 -16.678 -4.093 1.00 0.00 O ATOM 1023 CB SER A 61 19.357 -18.969 -5.005 1.00 0.00 C ATOM 1024 OG SER A 61 20.235 -19.981 -4.539 1.00 0.00 O ATOM 0 H SER A 61 17.955 -20.844 -4.393 1.00 0.00 H new ATOM 0 HA SER A 61 18.554 -18.404 -3.094 1.00 0.00 H new ATOM 0 HB2 SER A 61 18.988 -19.227 -5.998 1.00 0.00 H new ATOM 0 HB3 SER A 61 19.895 -18.026 -5.100 1.00 0.00 H new ATOM 0 HG SER A 61 20.982 -20.080 -5.166 1.00 0.00 H new ATOM 1030 N ALA A 62 16.310 -18.242 -5.525 1.00 0.00 N ATOM 1031 CA ALA A 62 15.210 -17.444 -6.045 1.00 0.00 C ATOM 1032 C ALA A 62 14.262 -17.037 -4.918 1.00 0.00 C ATOM 1033 O ALA A 62 13.942 -15.857 -4.779 1.00 0.00 O ATOM 1034 CB ALA A 62 14.450 -18.258 -7.093 1.00 0.00 C ATOM 0 H ALA A 62 16.382 -19.166 -5.951 1.00 0.00 H new ATOM 0 HA ALA A 62 15.612 -16.539 -6.500 1.00 0.00 H new ATOM 0 HB1 ALA A 62 13.624 -17.665 -7.486 1.00 0.00 H new ATOM 0 HB2 ALA A 62 15.125 -18.524 -7.906 1.00 0.00 H new ATOM 0 HB3 ALA A 62 14.058 -19.166 -6.635 1.00 0.00 H new ATOM 1040 N SER A 63 13.835 -17.999 -4.094 1.00 0.00 N ATOM 1041 CA SER A 63 12.913 -17.742 -2.995 1.00 0.00 C ATOM 1042 C SER A 63 13.509 -16.760 -1.989 1.00 0.00 C ATOM 1043 O SER A 63 12.818 -15.855 -1.520 1.00 0.00 O ATOM 1044 CB SER A 63 12.540 -19.056 -2.301 1.00 0.00 C ATOM 1045 OG SER A 63 12.025 -19.983 -3.236 1.00 0.00 O ATOM 0 H SER A 63 14.121 -18.975 -4.174 1.00 0.00 H new ATOM 0 HA SER A 63 12.012 -17.290 -3.409 1.00 0.00 H new ATOM 0 HB2 SER A 63 13.418 -19.476 -1.810 1.00 0.00 H new ATOM 0 HB3 SER A 63 11.800 -18.866 -1.524 1.00 0.00 H new ATOM 0 HG SER A 63 12.752 -20.313 -3.804 1.00 0.00 H new ATOM 1051 N ASN A 64 14.796 -16.912 -1.674 1.00 0.00 N ATOM 1052 CA ASN A 64 15.462 -16.074 -0.687 1.00 0.00 C ATOM 1053 C ASN A 64 15.650 -14.650 -1.201 1.00 0.00 C ATOM 1054 O ASN A 64 15.407 -13.701 -0.454 1.00 0.00 O ATOM 1055 CB ASN A 64 16.802 -16.686 -0.270 1.00 0.00 C ATOM 1056 CG ASN A 64 17.393 -15.899 0.895 1.00 0.00 C ATOM 1057 OD1 ASN A 64 16.823 -15.862 1.981 1.00 0.00 O ATOM 1058 ND2 ASN A 64 18.535 -15.265 0.703 1.00 0.00 N ATOM 0 H ASN A 64 15.400 -17.617 -2.096 1.00 0.00 H new ATOM 0 HA ASN A 64 14.821 -16.024 0.193 1.00 0.00 H new ATOM 0 HB2 ASN A 64 16.662 -17.728 0.018 1.00 0.00 H new ATOM 0 HB3 ASN A 64 17.493 -16.678 -1.113 1.00 0.00 H new ATOM 0 HD21 ASN A 64 18.957 -14.733 1.464 1.00 0.00 H new ATOM 0 HD22 ASN A 64 18.995 -15.307 -0.206 1.00 0.00 H new ATOM 1065 N ALA A 65 16.021 -14.487 -2.475 1.00 0.00 N ATOM 1066 CA ALA A 65 16.074 -13.193 -3.140 1.00 0.00 C ATOM 1067 C ALA A 65 14.699 -12.535 -3.087 1.00 0.00 C ATOM 1068 O ALA A 65 14.585 -11.399 -2.632 1.00 0.00 O ATOM 1069 CB ALA A 65 16.531 -13.362 -4.595 1.00 0.00 C ATOM 0 H ALA A 65 16.295 -15.264 -3.076 1.00 0.00 H new ATOM 0 HA ALA A 65 16.793 -12.555 -2.627 1.00 0.00 H new ATOM 0 HB1 ALA A 65 16.566 -12.387 -5.081 1.00 0.00 H new ATOM 0 HB2 ALA A 65 17.523 -13.813 -4.615 1.00 0.00 H new ATOM 0 HB3 ALA A 65 15.829 -14.006 -5.124 1.00 0.00 H new ATOM 1075 N LEU A 66 13.658 -13.266 -3.499 1.00 0.00 N ATOM 1076 CA LEU A 66 12.285 -12.778 -3.517 1.00 0.00 C ATOM 1077 C LEU A 66 11.910 -12.281 -2.127 1.00 0.00 C ATOM 1078 O LEU A 66 11.548 -11.118 -1.987 1.00 0.00 O ATOM 1079 CB LEU A 66 11.351 -13.895 -4.016 1.00 0.00 C ATOM 1080 CG LEU A 66 9.948 -13.448 -4.469 1.00 0.00 C ATOM 1081 CD1 LEU A 66 9.282 -14.624 -5.187 1.00 0.00 C ATOM 1082 CD2 LEU A 66 9.027 -12.968 -3.342 1.00 0.00 C ATOM 0 H LEU A 66 13.752 -14.225 -3.833 1.00 0.00 H new ATOM 0 HA LEU A 66 12.183 -11.938 -4.204 1.00 0.00 H new ATOM 0 HB2 LEU A 66 11.836 -14.402 -4.850 1.00 0.00 H new ATOM 0 HB3 LEU A 66 11.237 -14.630 -3.219 1.00 0.00 H new ATOM 0 HG LEU A 66 10.093 -12.584 -5.118 1.00 0.00 H new ATOM 0 HD11 LEU A 66 8.285 -14.331 -5.518 1.00 0.00 H new ATOM 0 HD12 LEU A 66 9.882 -14.910 -6.051 1.00 0.00 H new ATOM 0 HD13 LEU A 66 9.204 -15.470 -4.504 1.00 0.00 H new ATOM 0 HD21 LEU A 66 8.064 -12.675 -3.759 1.00 0.00 H new ATOM 0 HD22 LEU A 66 8.881 -13.774 -2.623 1.00 0.00 H new ATOM 0 HD23 LEU A 66 9.481 -12.113 -2.841 1.00 0.00 H new ATOM 1094 N ARG A 67 12.050 -13.119 -1.093 1.00 0.00 N ATOM 1095 CA ARG A 67 11.631 -12.753 0.256 1.00 0.00 C ATOM 1096 C ARG A 67 12.401 -11.526 0.744 1.00 0.00 C ATOM 1097 O ARG A 67 11.790 -10.597 1.268 1.00 0.00 O ATOM 1098 CB ARG A 67 11.851 -13.930 1.224 1.00 0.00 C ATOM 1099 CG ARG A 67 11.138 -13.678 2.566 1.00 0.00 C ATOM 1100 CD ARG A 67 11.430 -14.772 3.601 1.00 0.00 C ATOM 1101 NE ARG A 67 10.814 -16.064 3.254 1.00 0.00 N ATOM 1102 CZ ARG A 67 11.407 -17.150 2.751 1.00 0.00 C ATOM 1103 NH1 ARG A 67 12.701 -17.163 2.429 1.00 0.00 N ATOM 1104 NH2 ARG A 67 10.659 -18.230 2.589 1.00 0.00 N ATOM 0 H ARG A 67 12.451 -14.054 -1.169 1.00 0.00 H new ATOM 0 HA ARG A 67 10.569 -12.511 0.229 1.00 0.00 H new ATOM 0 HB2 ARG A 67 11.476 -14.850 0.775 1.00 0.00 H new ATOM 0 HB3 ARG A 67 12.918 -14.071 1.395 1.00 0.00 H new ATOM 0 HG2 ARG A 67 11.451 -12.713 2.964 1.00 0.00 H new ATOM 0 HG3 ARG A 67 10.063 -13.620 2.397 1.00 0.00 H new ATOM 0 HD2 ARG A 67 12.508 -14.901 3.692 1.00 0.00 H new ATOM 0 HD3 ARG A 67 11.064 -14.450 4.576 1.00 0.00 H new ATOM 0 HE ARG A 67 9.810 -16.139 3.418 1.00 0.00 H new ATOM 0 HH11 ARG A 67 13.269 -16.327 2.565 1.00 0.00 H new ATOM 0 HH12 ARG A 67 13.123 -18.009 2.047 1.00 0.00 H new ATOM 0 HH21 ARG A 67 9.672 -18.210 2.845 1.00 0.00 H new ATOM 0 HH22 ARG A 67 11.070 -19.082 2.208 1.00 0.00 H new ATOM 1118 N THR A 68 13.727 -11.517 0.587 1.00 0.00 N ATOM 1119 CA THR A 68 14.565 -10.453 1.128 1.00 0.00 C ATOM 1120 C THR A 68 14.245 -9.120 0.441 1.00 0.00 C ATOM 1121 O THR A 68 14.204 -8.080 1.101 1.00 0.00 O ATOM 1122 CB THR A 68 16.054 -10.830 0.993 1.00 0.00 C ATOM 1123 OG1 THR A 68 16.287 -12.118 1.531 1.00 0.00 O ATOM 1124 CG2 THR A 68 16.959 -9.848 1.743 1.00 0.00 C ATOM 0 H THR A 68 14.242 -12.241 0.086 1.00 0.00 H new ATOM 0 HA THR A 68 14.351 -10.330 2.190 1.00 0.00 H new ATOM 0 HB THR A 68 16.288 -10.803 -0.071 1.00 0.00 H new ATOM 0 HG1 THR A 68 16.120 -12.795 0.843 1.00 0.00 H new ATOM 0 HG21 THR A 68 18.000 -10.148 1.623 1.00 0.00 H new ATOM 0 HG22 THR A 68 16.822 -8.845 1.338 1.00 0.00 H new ATOM 0 HG23 THR A 68 16.700 -9.851 2.802 1.00 0.00 H new ATOM 1132 N MET A 69 13.984 -9.144 -0.869 1.00 0.00 N ATOM 1133 CA MET A 69 13.775 -7.937 -1.657 1.00 0.00 C ATOM 1134 C MET A 69 12.295 -7.532 -1.703 1.00 0.00 C ATOM 1135 O MET A 69 11.981 -6.438 -2.168 1.00 0.00 O ATOM 1136 CB MET A 69 14.389 -8.126 -3.053 1.00 0.00 C ATOM 1137 CG MET A 69 15.898 -8.440 -3.002 1.00 0.00 C ATOM 1138 SD MET A 69 16.935 -7.271 -2.072 1.00 0.00 S ATOM 1139 CE MET A 69 16.767 -5.776 -3.085 1.00 0.00 C ATOM 0 H MET A 69 13.913 -10.006 -1.410 1.00 0.00 H new ATOM 0 HA MET A 69 14.285 -7.103 -1.175 1.00 0.00 H new ATOM 0 HB2 MET A 69 13.871 -8.936 -3.567 1.00 0.00 H new ATOM 0 HB3 MET A 69 14.230 -7.222 -3.641 1.00 0.00 H new ATOM 0 HG2 MET A 69 16.026 -9.431 -2.567 1.00 0.00 H new ATOM 0 HG3 MET A 69 16.272 -8.490 -4.025 1.00 0.00 H new ATOM 0 HE1 MET A 69 17.245 -4.938 -2.578 1.00 0.00 H new ATOM 0 HE2 MET A 69 17.245 -5.936 -4.052 1.00 0.00 H new ATOM 0 HE3 MET A 69 15.710 -5.555 -3.235 1.00 0.00 H new ATOM 1149 N GLN A 70 11.377 -8.365 -1.206 1.00 0.00 N ATOM 1150 CA GLN A 70 9.960 -8.049 -1.090 1.00 0.00 C ATOM 1151 C GLN A 70 9.797 -6.781 -0.246 1.00 0.00 C ATOM 1152 O GLN A 70 10.286 -6.718 0.885 1.00 0.00 O ATOM 1153 CB GLN A 70 9.224 -9.254 -0.467 1.00 0.00 C ATOM 1154 CG GLN A 70 7.694 -9.175 -0.483 1.00 0.00 C ATOM 1155 CD GLN A 70 7.129 -9.305 -1.899 1.00 0.00 C ATOM 1156 OE1 GLN A 70 7.153 -8.361 -2.683 1.00 0.00 O ATOM 1157 NE2 GLN A 70 6.630 -10.472 -2.272 1.00 0.00 N ATOM 0 H GLN A 70 11.609 -9.299 -0.867 1.00 0.00 H new ATOM 0 HA GLN A 70 9.523 -7.858 -2.070 1.00 0.00 H new ATOM 0 HB2 GLN A 70 9.529 -10.157 -0.996 1.00 0.00 H new ATOM 0 HB3 GLN A 70 9.554 -9.364 0.566 1.00 0.00 H new ATOM 0 HG2 GLN A 70 7.283 -9.965 0.145 1.00 0.00 H new ATOM 0 HG3 GLN A 70 7.375 -8.226 -0.051 1.00 0.00 H new ATOM 0 HE21 GLN A 70 6.613 -11.253 -1.616 1.00 0.00 H new ATOM 0 HE22 GLN A 70 6.262 -10.591 -3.216 1.00 0.00 H new ATOM 1166 N GLY A 71 9.127 -5.766 -0.796 1.00 0.00 N ATOM 1167 CA GLY A 71 8.904 -4.486 -0.133 1.00 0.00 C ATOM 1168 C GLY A 71 10.164 -3.624 0.004 1.00 0.00 C ATOM 1169 O GLY A 71 10.077 -2.535 0.574 1.00 0.00 O ATOM 0 H GLY A 71 8.719 -5.814 -1.730 1.00 0.00 H new ATOM 0 HA2 GLY A 71 8.153 -3.926 -0.690 1.00 0.00 H new ATOM 0 HA3 GLY A 71 8.493 -4.670 0.860 1.00 0.00 H new ATOM 1173 N PHE A 72 11.329 -4.076 -0.477 1.00 0.00 N ATOM 1174 CA PHE A 72 12.588 -3.357 -0.287 1.00 0.00 C ATOM 1175 C PHE A 72 12.572 -2.065 -1.117 1.00 0.00 C ATOM 1176 O PHE A 72 12.142 -2.114 -2.273 1.00 0.00 O ATOM 1177 CB PHE A 72 13.763 -4.259 -0.686 1.00 0.00 C ATOM 1178 CG PHE A 72 15.126 -3.650 -0.421 1.00 0.00 C ATOM 1179 CD1 PHE A 72 15.726 -3.779 0.847 1.00 0.00 C ATOM 1180 CD2 PHE A 72 15.788 -2.935 -1.436 1.00 0.00 C ATOM 1181 CE1 PHE A 72 16.978 -3.189 1.096 1.00 0.00 C ATOM 1182 CE2 PHE A 72 17.039 -2.343 -1.186 1.00 0.00 C ATOM 1183 CZ PHE A 72 17.634 -2.469 0.082 1.00 0.00 C ATOM 0 H PHE A 72 11.422 -4.944 -1.004 1.00 0.00 H new ATOM 0 HA PHE A 72 12.707 -3.088 0.763 1.00 0.00 H new ATOM 0 HB2 PHE A 72 13.685 -5.201 -0.143 1.00 0.00 H new ATOM 0 HB3 PHE A 72 13.682 -4.495 -1.747 1.00 0.00 H new ATOM 0 HD1 PHE A 72 15.224 -4.331 1.628 1.00 0.00 H new ATOM 0 HD2 PHE A 72 15.334 -2.840 -2.411 1.00 0.00 H new ATOM 0 HE1 PHE A 72 17.437 -3.289 2.069 1.00 0.00 H new ATOM 0 HE2 PHE A 72 17.542 -1.792 -1.967 1.00 0.00 H new ATOM 0 HZ PHE A 72 18.594 -2.013 0.277 1.00 0.00 H new ATOM 1193 N PRO A 73 13.040 -0.918 -0.591 1.00 0.00 N ATOM 1194 CA PRO A 73 13.108 0.341 -1.325 1.00 0.00 C ATOM 1195 C PRO A 73 14.305 0.347 -2.295 1.00 0.00 C ATOM 1196 O PRO A 73 15.314 1.016 -2.066 1.00 0.00 O ATOM 1197 CB PRO A 73 13.166 1.424 -0.248 1.00 0.00 C ATOM 1198 CG PRO A 73 13.926 0.741 0.887 1.00 0.00 C ATOM 1199 CD PRO A 73 13.452 -0.709 0.793 1.00 0.00 C ATOM 0 HA PRO A 73 12.248 0.510 -1.973 1.00 0.00 H new ATOM 0 HB2 PRO A 73 13.684 2.316 -0.601 1.00 0.00 H new ATOM 0 HB3 PRO A 73 12.169 1.736 0.064 1.00 0.00 H new ATOM 0 HG2 PRO A 73 15.005 0.822 0.757 1.00 0.00 H new ATOM 0 HG3 PRO A 73 13.688 1.182 1.855 1.00 0.00 H new ATOM 0 HD2 PRO A 73 14.251 -1.397 1.069 1.00 0.00 H new ATOM 0 HD3 PRO A 73 12.623 -0.892 1.477 1.00 0.00 H new ATOM 1207 N PHE A 74 14.198 -0.436 -3.371 1.00 0.00 N ATOM 1208 CA PHE A 74 15.244 -0.660 -4.371 1.00 0.00 C ATOM 1209 C PHE A 74 15.790 0.653 -4.935 1.00 0.00 C ATOM 1210 O PHE A 74 17.007 0.849 -4.949 1.00 0.00 O ATOM 1211 CB PHE A 74 14.640 -1.565 -5.450 1.00 0.00 C ATOM 1212 CG PHE A 74 15.463 -1.868 -6.686 1.00 0.00 C ATOM 1213 CD1 PHE A 74 16.546 -2.765 -6.613 1.00 0.00 C ATOM 1214 CD2 PHE A 74 15.055 -1.367 -7.939 1.00 0.00 C ATOM 1215 CE1 PHE A 74 17.211 -3.165 -7.786 1.00 0.00 C ATOM 1216 CE2 PHE A 74 15.725 -1.761 -9.110 1.00 0.00 C ATOM 1217 CZ PHE A 74 16.797 -2.667 -9.035 1.00 0.00 C ATOM 0 H PHE A 74 13.343 -0.953 -3.578 1.00 0.00 H new ATOM 0 HA PHE A 74 16.110 -1.145 -3.921 1.00 0.00 H new ATOM 0 HB2 PHE A 74 14.385 -2.515 -4.981 1.00 0.00 H new ATOM 0 HB3 PHE A 74 13.705 -1.111 -5.778 1.00 0.00 H new ATOM 0 HD1 PHE A 74 16.866 -3.146 -5.655 1.00 0.00 H new ATOM 0 HD2 PHE A 74 14.225 -0.678 -7.999 1.00 0.00 H new ATOM 0 HE1 PHE A 74 18.040 -3.855 -7.728 1.00 0.00 H new ATOM 0 HE2 PHE A 74 15.416 -1.368 -10.067 1.00 0.00 H new ATOM 0 HZ PHE A 74 17.303 -2.981 -9.936 1.00 0.00 H new ATOM 1227 N TYR A 75 14.894 1.564 -5.326 1.00 0.00 N ATOM 1228 CA TYR A 75 15.217 2.919 -5.758 1.00 0.00 C ATOM 1229 C TYR A 75 14.039 3.817 -5.387 1.00 0.00 C ATOM 1230 O TYR A 75 13.202 4.142 -6.229 1.00 0.00 O ATOM 1231 CB TYR A 75 15.570 2.972 -7.258 1.00 0.00 C ATOM 1232 CG TYR A 75 17.038 2.708 -7.547 1.00 0.00 C ATOM 1233 CD1 TYR A 75 17.989 3.717 -7.299 1.00 0.00 C ATOM 1234 CD2 TYR A 75 17.456 1.470 -8.070 1.00 0.00 C ATOM 1235 CE1 TYR A 75 19.351 3.491 -7.565 1.00 0.00 C ATOM 1236 CE2 TYR A 75 18.815 1.235 -8.337 1.00 0.00 C ATOM 1237 CZ TYR A 75 19.772 2.245 -8.086 1.00 0.00 C ATOM 1238 OH TYR A 75 21.090 2.009 -8.344 1.00 0.00 O ATOM 0 H TYR A 75 13.893 1.368 -5.350 1.00 0.00 H new ATOM 0 HA TYR A 75 16.112 3.278 -5.250 1.00 0.00 H new ATOM 0 HB2 TYR A 75 14.966 2.238 -7.791 1.00 0.00 H new ATOM 0 HB3 TYR A 75 15.301 3.952 -7.652 1.00 0.00 H new ATOM 0 HD1 TYR A 75 17.670 4.670 -6.902 1.00 0.00 H new ATOM 0 HD2 TYR A 75 16.728 0.697 -8.267 1.00 0.00 H new ATOM 0 HE1 TYR A 75 20.075 4.268 -7.372 1.00 0.00 H new ATOM 0 HE2 TYR A 75 19.129 0.281 -8.735 1.00 0.00 H new ATOM 0 HH TYR A 75 21.197 1.101 -8.697 1.00 0.00 H new ATOM 1248 N ASP A 76 13.959 4.168 -4.098 1.00 0.00 N ATOM 1249 CA ASP A 76 12.953 5.068 -3.511 1.00 0.00 C ATOM 1250 C ASP A 76 11.504 4.664 -3.840 1.00 0.00 C ATOM 1251 O ASP A 76 10.599 5.496 -3.928 1.00 0.00 O ATOM 1252 CB ASP A 76 13.289 6.528 -3.864 1.00 0.00 C ATOM 1253 CG ASP A 76 12.440 7.545 -3.075 1.00 0.00 C ATOM 1254 OD1 ASP A 76 12.336 7.430 -1.833 1.00 0.00 O ATOM 1255 OD2 ASP A 76 11.928 8.513 -3.685 1.00 0.00 O ATOM 0 H ASP A 76 14.620 3.819 -3.404 1.00 0.00 H new ATOM 0 HA ASP A 76 13.004 4.972 -2.426 1.00 0.00 H new ATOM 0 HB2 ASP A 76 14.345 6.711 -3.665 1.00 0.00 H new ATOM 0 HB3 ASP A 76 13.134 6.684 -4.932 1.00 0.00 H new ATOM 1260 N LYS A 77 11.278 3.360 -4.039 1.00 0.00 N ATOM 1261 CA LYS A 77 9.981 2.760 -4.326 1.00 0.00 C ATOM 1262 C LYS A 77 10.034 1.333 -3.774 1.00 0.00 C ATOM 1263 O LYS A 77 11.018 0.644 -4.057 1.00 0.00 O ATOM 1264 CB LYS A 77 9.747 2.773 -5.849 1.00 0.00 C ATOM 1265 CG LYS A 77 8.360 2.233 -6.231 1.00 0.00 C ATOM 1266 CD LYS A 77 8.082 2.298 -7.742 1.00 0.00 C ATOM 1267 CE LYS A 77 8.025 3.722 -8.327 1.00 0.00 C ATOM 1268 NZ LYS A 77 6.880 4.522 -7.813 1.00 0.00 N ATOM 0 H LYS A 77 12.029 2.670 -4.002 1.00 0.00 H new ATOM 0 HA LYS A 77 9.157 3.306 -3.866 1.00 0.00 H new ATOM 0 HB2 LYS A 77 9.853 3.792 -6.222 1.00 0.00 H new ATOM 0 HB3 LYS A 77 10.515 2.173 -6.337 1.00 0.00 H new ATOM 0 HG2 LYS A 77 8.274 1.199 -5.896 1.00 0.00 H new ATOM 0 HG3 LYS A 77 7.596 2.804 -5.702 1.00 0.00 H new ATOM 0 HD2 LYS A 77 8.857 1.736 -8.264 1.00 0.00 H new ATOM 0 HD3 LYS A 77 7.135 1.799 -7.945 1.00 0.00 H new ATOM 0 HE2 LYS A 77 8.955 4.241 -8.095 1.00 0.00 H new ATOM 0 HE3 LYS A 77 7.957 3.659 -9.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 6.897 5.469 -8.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 5.987 4.047 -8.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 6.954 4.610 -6.779 1.00 0.00 H new ATOM 1282 N PRO A 78 9.047 0.888 -2.977 1.00 0.00 N ATOM 1283 CA PRO A 78 9.033 -0.465 -2.447 1.00 0.00 C ATOM 1284 C PRO A 78 8.784 -1.448 -3.591 1.00 0.00 C ATOM 1285 O PRO A 78 7.778 -1.345 -4.299 1.00 0.00 O ATOM 1286 CB PRO A 78 7.916 -0.496 -1.400 1.00 0.00 C ATOM 1287 CG PRO A 78 6.960 0.607 -1.852 1.00 0.00 C ATOM 1288 CD PRO A 78 7.881 1.631 -2.516 1.00 0.00 C ATOM 0 HA PRO A 78 9.979 -0.752 -1.987 1.00 0.00 H new ATOM 0 HB2 PRO A 78 7.421 -1.467 -1.372 1.00 0.00 H new ATOM 0 HB3 PRO A 78 8.301 -0.305 -0.398 1.00 0.00 H new ATOM 0 HG2 PRO A 78 6.212 0.229 -2.549 1.00 0.00 H new ATOM 0 HG3 PRO A 78 6.420 1.040 -1.010 1.00 0.00 H new ATOM 0 HD2 PRO A 78 7.379 2.124 -3.349 1.00 0.00 H new ATOM 0 HD3 PRO A 78 8.170 2.410 -1.811 1.00 0.00 H new ATOM 1296 N MET A 79 9.688 -2.405 -3.769 1.00 0.00 N ATOM 1297 CA MET A 79 9.517 -3.488 -4.729 1.00 0.00 C ATOM 1298 C MET A 79 8.299 -4.327 -4.343 1.00 0.00 C ATOM 1299 O MET A 79 7.963 -4.449 -3.164 1.00 0.00 O ATOM 1300 CB MET A 79 10.772 -4.370 -4.746 1.00 0.00 C ATOM 1301 CG MET A 79 11.994 -3.611 -5.258 1.00 0.00 C ATOM 1302 SD MET A 79 12.011 -3.301 -7.047 1.00 0.00 S ATOM 1303 CE MET A 79 13.244 -4.536 -7.544 1.00 0.00 C ATOM 0 H MET A 79 10.564 -2.451 -3.249 1.00 0.00 H new ATOM 0 HA MET A 79 9.364 -3.068 -5.723 1.00 0.00 H new ATOM 0 HB2 MET A 79 10.970 -4.740 -3.740 1.00 0.00 H new ATOM 0 HB3 MET A 79 10.595 -5.241 -5.377 1.00 0.00 H new ATOM 0 HG2 MET A 79 12.053 -2.655 -4.738 1.00 0.00 H new ATOM 0 HG3 MET A 79 12.889 -4.173 -4.993 1.00 0.00 H new ATOM 0 HE1 MET A 79 13.532 -4.365 -8.581 1.00 0.00 H new ATOM 0 HE2 MET A 79 14.123 -4.451 -6.905 1.00 0.00 H new ATOM 0 HE3 MET A 79 12.819 -5.535 -7.445 1.00 0.00 H new ATOM 1313 N GLN A 80 7.693 -4.979 -5.329 1.00 0.00 N ATOM 1314 CA GLN A 80 6.655 -5.970 -5.148 1.00 0.00 C ATOM 1315 C GLN A 80 7.060 -7.101 -6.079 1.00 0.00 C ATOM 1316 O GLN A 80 7.415 -6.839 -7.232 1.00 0.00 O ATOM 1317 CB GLN A 80 5.303 -5.343 -5.507 1.00 0.00 C ATOM 1318 CG GLN A 80 4.155 -6.311 -5.220 1.00 0.00 C ATOM 1319 CD GLN A 80 2.795 -5.649 -5.445 1.00 0.00 C ATOM 1320 OE1 GLN A 80 2.118 -5.898 -6.440 1.00 0.00 O ATOM 1321 NE2 GLN A 80 2.365 -4.784 -4.538 1.00 0.00 N ATOM 0 H GLN A 80 7.924 -4.821 -6.310 1.00 0.00 H new ATOM 0 HA GLN A 80 6.548 -6.338 -4.127 1.00 0.00 H new ATOM 0 HB2 GLN A 80 5.161 -4.426 -4.936 1.00 0.00 H new ATOM 0 HB3 GLN A 80 5.295 -5.067 -6.561 1.00 0.00 H new ATOM 0 HG2 GLN A 80 4.246 -7.186 -5.864 1.00 0.00 H new ATOM 0 HG3 GLN A 80 4.224 -6.664 -4.191 1.00 0.00 H new ATOM 0 HE21 GLN A 80 2.933 -4.583 -3.715 1.00 0.00 H new ATOM 0 HE22 GLN A 80 1.466 -4.319 -4.663 1.00 0.00 H new ATOM 1330 N ILE A 81 7.072 -8.332 -5.575 1.00 0.00 N ATOM 1331 CA ILE A 81 7.642 -9.475 -6.274 1.00 0.00 C ATOM 1332 C ILE A 81 6.716 -10.677 -6.074 1.00 0.00 C ATOM 1333 O ILE A 81 6.054 -10.796 -5.040 1.00 0.00 O ATOM 1334 CB ILE A 81 9.088 -9.767 -5.776 1.00 0.00 C ATOM 1335 CG1 ILE A 81 9.885 -8.504 -5.359 1.00 0.00 C ATOM 1336 CG2 ILE A 81 9.840 -10.549 -6.869 1.00 0.00 C ATOM 1337 CD1 ILE A 81 11.358 -8.729 -5.005 1.00 0.00 C ATOM 0 H ILE A 81 6.682 -8.564 -4.661 1.00 0.00 H new ATOM 0 HA ILE A 81 7.720 -9.260 -7.340 1.00 0.00 H new ATOM 0 HB ILE A 81 9.000 -10.359 -4.865 1.00 0.00 H new ATOM 0 HG12 ILE A 81 9.833 -7.780 -6.173 1.00 0.00 H new ATOM 0 HG13 ILE A 81 9.390 -8.053 -4.499 1.00 0.00 H new ATOM 0 HG21 ILE A 81 10.855 -10.760 -6.532 1.00 0.00 H new ATOM 0 HG22 ILE A 81 9.321 -11.487 -7.068 1.00 0.00 H new ATOM 0 HG23 ILE A 81 9.877 -9.954 -7.782 1.00 0.00 H new ATOM 0 HD11 ILE A 81 11.815 -7.779 -4.729 1.00 0.00 H new ATOM 0 HD12 ILE A 81 11.429 -9.423 -4.167 1.00 0.00 H new ATOM 0 HD13 ILE A 81 11.880 -9.146 -5.866 1.00 0.00 H new ATOM 1349 N ALA A 82 6.705 -11.582 -7.049 1.00 0.00 N ATOM 1350 CA ALA A 82 6.021 -12.867 -7.023 1.00 0.00 C ATOM 1351 C ALA A 82 6.926 -13.897 -7.705 1.00 0.00 C ATOM 1352 O ALA A 82 7.890 -13.528 -8.379 1.00 0.00 O ATOM 1353 CB ALA A 82 4.676 -12.749 -7.752 1.00 0.00 C ATOM 0 H ALA A 82 7.202 -11.427 -7.926 1.00 0.00 H new ATOM 0 HA ALA A 82 5.820 -13.180 -5.999 1.00 0.00 H new ATOM 0 HB1 ALA A 82 4.165 -13.712 -7.732 1.00 0.00 H new ATOM 0 HB2 ALA A 82 4.058 -12.000 -7.257 1.00 0.00 H new ATOM 0 HB3 ALA A 82 4.848 -12.451 -8.786 1.00 0.00 H new ATOM 1359 N TYR A 83 6.644 -15.187 -7.528 1.00 0.00 N ATOM 1360 CA TYR A 83 7.346 -16.230 -8.269 1.00 0.00 C ATOM 1361 C TYR A 83 6.787 -16.285 -9.695 1.00 0.00 C ATOM 1362 O TYR A 83 5.644 -15.883 -9.937 1.00 0.00 O ATOM 1363 CB TYR A 83 7.238 -17.576 -7.535 1.00 0.00 C ATOM 1364 CG TYR A 83 5.856 -18.200 -7.473 1.00 0.00 C ATOM 1365 CD1 TYR A 83 4.958 -17.844 -6.447 1.00 0.00 C ATOM 1366 CD2 TYR A 83 5.479 -19.159 -8.433 1.00 0.00 C ATOM 1367 CE1 TYR A 83 3.680 -18.429 -6.395 1.00 0.00 C ATOM 1368 CE2 TYR A 83 4.211 -19.760 -8.377 1.00 0.00 C ATOM 1369 CZ TYR A 83 3.301 -19.387 -7.363 1.00 0.00 C ATOM 1370 OH TYR A 83 2.044 -19.916 -7.328 1.00 0.00 O ATOM 0 H TYR A 83 5.936 -15.533 -6.880 1.00 0.00 H new ATOM 0 HA TYR A 83 8.410 -16.001 -8.333 1.00 0.00 H new ATOM 0 HB2 TYR A 83 7.911 -18.284 -8.018 1.00 0.00 H new ATOM 0 HB3 TYR A 83 7.597 -17.439 -6.515 1.00 0.00 H new ATOM 0 HD1 TYR A 83 5.251 -17.121 -5.700 1.00 0.00 H new ATOM 0 HD2 TYR A 83 6.169 -19.434 -9.217 1.00 0.00 H new ATOM 0 HE1 TYR A 83 2.988 -18.146 -5.615 1.00 0.00 H new ATOM 0 HE2 TYR A 83 3.932 -20.505 -9.107 1.00 0.00 H new ATOM 0 HH TYR A 83 1.939 -20.559 -8.060 1.00 0.00 H new ATOM 1380 N SER A 84 7.578 -16.776 -10.650 1.00 0.00 N ATOM 1381 CA SER A 84 7.167 -16.892 -12.043 1.00 0.00 C ATOM 1382 C SER A 84 6.143 -18.017 -12.231 1.00 0.00 C ATOM 1383 O SER A 84 6.485 -19.148 -12.579 1.00 0.00 O ATOM 1384 CB SER A 84 8.409 -17.076 -12.912 1.00 0.00 C ATOM 1385 OG SER A 84 9.204 -15.910 -12.810 1.00 0.00 O ATOM 0 H SER A 84 8.527 -17.105 -10.474 1.00 0.00 H new ATOM 0 HA SER A 84 6.663 -15.978 -12.355 1.00 0.00 H new ATOM 0 HB2 SER A 84 8.974 -17.949 -12.586 1.00 0.00 H new ATOM 0 HB3 SER A 84 8.123 -17.250 -13.949 1.00 0.00 H new ATOM 0 HG SER A 84 9.012 -15.316 -13.566 1.00 0.00 H new ATOM 1391 N LYS A 85 4.861 -17.697 -12.041 1.00 0.00 N ATOM 1392 CA LYS A 85 3.727 -18.597 -12.278 1.00 0.00 C ATOM 1393 C LYS A 85 3.667 -19.142 -13.718 1.00 0.00 C ATOM 1394 O LYS A 85 2.964 -20.127 -13.951 1.00 0.00 O ATOM 1395 CB LYS A 85 2.424 -17.867 -11.903 1.00 0.00 C ATOM 1396 CG LYS A 85 2.303 -17.666 -10.381 1.00 0.00 C ATOM 1397 CD LYS A 85 1.220 -16.642 -10.019 1.00 0.00 C ATOM 1398 CE LYS A 85 1.145 -16.402 -8.502 1.00 0.00 C ATOM 1399 NZ LYS A 85 0.424 -17.477 -7.772 1.00 0.00 N ATOM 0 H LYS A 85 4.573 -16.777 -11.708 1.00 0.00 H new ATOM 0 HA LYS A 85 3.861 -19.474 -11.645 1.00 0.00 H new ATOM 0 HB2 LYS A 85 2.393 -16.898 -12.402 1.00 0.00 H new ATOM 0 HB3 LYS A 85 1.569 -18.439 -12.264 1.00 0.00 H new ATOM 0 HG2 LYS A 85 2.072 -18.620 -9.907 1.00 0.00 H new ATOM 0 HG3 LYS A 85 3.262 -17.335 -9.982 1.00 0.00 H new ATOM 0 HD2 LYS A 85 1.427 -15.700 -10.526 1.00 0.00 H new ATOM 0 HD3 LYS A 85 0.253 -16.993 -10.380 1.00 0.00 H new ATOM 0 HE2 LYS A 85 2.156 -16.317 -8.104 1.00 0.00 H new ATOM 0 HE3 LYS A 85 0.648 -15.450 -8.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 0.110 -17.119 -6.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -0.404 -17.778 -8.326 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 1.060 -18.288 -7.632 1.00 0.00 H new ATOM 1413 N SER A 86 4.416 -18.557 -14.657 1.00 0.00 N ATOM 1414 CA SER A 86 4.502 -18.979 -16.054 1.00 0.00 C ATOM 1415 C SER A 86 5.947 -19.354 -16.428 1.00 0.00 C ATOM 1416 O SER A 86 6.319 -19.289 -17.601 1.00 0.00 O ATOM 1417 CB SER A 86 3.927 -17.872 -16.951 1.00 0.00 C ATOM 1418 OG SER A 86 2.632 -17.479 -16.511 1.00 0.00 O ATOM 0 H SER A 86 5.001 -17.746 -14.455 1.00 0.00 H new ATOM 0 HA SER A 86 3.907 -19.880 -16.206 1.00 0.00 H new ATOM 0 HB2 SER A 86 4.594 -17.010 -16.944 1.00 0.00 H new ATOM 0 HB3 SER A 86 3.873 -18.225 -17.981 1.00 0.00 H new ATOM 0 HG SER A 86 2.288 -16.772 -17.097 1.00 0.00 H new ATOM 1424 N ASP A 87 6.773 -19.731 -15.440 1.00 0.00 N ATOM 1425 CA ASP A 87 8.187 -20.083 -15.622 1.00 0.00 C ATOM 1426 C ASP A 87 8.390 -21.088 -16.753 1.00 0.00 C ATOM 1427 O ASP A 87 9.249 -20.886 -17.608 1.00 0.00 O ATOM 1428 CB ASP A 87 8.762 -20.658 -14.327 1.00 0.00 C ATOM 1429 CG ASP A 87 10.206 -21.145 -14.522 1.00 0.00 C ATOM 1430 OD1 ASP A 87 11.111 -20.291 -14.642 1.00 0.00 O ATOM 1431 OD2 ASP A 87 10.428 -22.378 -14.529 1.00 0.00 O ATOM 0 H ASP A 87 6.467 -19.801 -14.469 1.00 0.00 H new ATOM 0 HA ASP A 87 8.711 -19.165 -15.888 1.00 0.00 H new ATOM 0 HB2 ASP A 87 8.735 -19.898 -13.546 1.00 0.00 H new ATOM 0 HB3 ASP A 87 8.140 -21.486 -13.987 1.00 0.00 H new ATOM 1436 N SER A 88 7.563 -22.134 -16.808 1.00 0.00 N ATOM 1437 CA SER A 88 7.672 -23.180 -17.814 1.00 0.00 C ATOM 1438 C SER A 88 7.547 -22.616 -19.236 1.00 0.00 C ATOM 1439 O SER A 88 8.259 -23.062 -20.137 1.00 0.00 O ATOM 1440 CB SER A 88 6.593 -24.240 -17.551 1.00 0.00 C ATOM 1441 OG SER A 88 6.549 -24.590 -16.173 1.00 0.00 O ATOM 0 H SER A 88 6.796 -22.275 -16.150 1.00 0.00 H new ATOM 0 HA SER A 88 8.660 -23.635 -17.741 1.00 0.00 H new ATOM 0 HB2 SER A 88 5.621 -23.860 -17.865 1.00 0.00 H new ATOM 0 HB3 SER A 88 6.797 -25.128 -18.149 1.00 0.00 H new ATOM 0 HG SER A 88 5.853 -25.265 -16.029 1.00 0.00 H new ATOM 1447 N ASP A 89 6.677 -21.621 -19.446 1.00 0.00 N ATOM 1448 CA ASP A 89 6.431 -21.050 -20.766 1.00 0.00 C ATOM 1449 C ASP A 89 7.589 -20.162 -21.199 1.00 0.00 C ATOM 1450 O ASP A 89 8.053 -20.277 -22.332 1.00 0.00 O ATOM 1451 CB ASP A 89 5.128 -20.247 -20.775 1.00 0.00 C ATOM 1452 CG ASP A 89 4.886 -19.621 -22.160 1.00 0.00 C ATOM 1453 OD1 ASP A 89 4.493 -20.356 -23.094 1.00 0.00 O ATOM 1454 OD2 ASP A 89 5.045 -18.390 -22.309 1.00 0.00 O ATOM 0 H ASP A 89 6.126 -21.192 -18.702 1.00 0.00 H new ATOM 0 HA ASP A 89 6.341 -21.875 -21.473 1.00 0.00 H new ATOM 0 HB2 ASP A 89 4.293 -20.896 -20.513 1.00 0.00 H new ATOM 0 HB3 ASP A 89 5.172 -19.463 -20.019 1.00 0.00 H new ATOM 1459 N ILE A 90 8.098 -19.314 -20.303 1.00 0.00 N ATOM 1460 CA ILE A 90 9.223 -18.438 -20.637 1.00 0.00 C ATOM 1461 C ILE A 90 10.508 -19.252 -20.806 1.00 0.00 C ATOM 1462 O ILE A 90 11.293 -18.956 -21.708 1.00 0.00 O ATOM 1463 CB ILE A 90 9.371 -17.255 -19.653 1.00 0.00 C ATOM 1464 CG1 ILE A 90 9.680 -17.692 -18.208 1.00 0.00 C ATOM 1465 CG2 ILE A 90 8.098 -16.396 -19.723 1.00 0.00 C ATOM 1466 CD1 ILE A 90 9.841 -16.544 -17.204 1.00 0.00 C ATOM 0 H ILE A 90 7.753 -19.215 -19.348 1.00 0.00 H new ATOM 0 HA ILE A 90 9.010 -17.973 -21.599 1.00 0.00 H new ATOM 0 HB ILE A 90 10.237 -16.668 -19.959 1.00 0.00 H new ATOM 0 HG12 ILE A 90 8.879 -18.346 -17.863 1.00 0.00 H new ATOM 0 HG13 ILE A 90 10.596 -18.283 -18.211 1.00 0.00 H new ATOM 0 HG21 ILE A 90 8.187 -15.556 -19.034 1.00 0.00 H new ATOM 0 HG22 ILE A 90 7.968 -16.020 -20.738 1.00 0.00 H new ATOM 0 HG23 ILE A 90 7.235 -17.002 -19.447 1.00 0.00 H new ATOM 0 HD11 ILE A 90 10.056 -16.952 -16.216 1.00 0.00 H new ATOM 0 HD12 ILE A 90 10.662 -15.899 -17.517 1.00 0.00 H new ATOM 0 HD13 ILE A 90 8.919 -15.964 -17.164 1.00 0.00 H new ATOM 1478 N VAL A 91 10.704 -20.313 -20.016 1.00 0.00 N ATOM 1479 CA VAL A 91 11.831 -21.213 -20.206 1.00 0.00 C ATOM 1480 C VAL A 91 11.694 -21.896 -21.570 1.00 0.00 C ATOM 1481 O VAL A 91 12.659 -21.914 -22.332 1.00 0.00 O ATOM 1482 CB VAL A 91 11.957 -22.195 -19.021 1.00 0.00 C ATOM 1483 CG1 VAL A 91 12.948 -23.339 -19.292 1.00 0.00 C ATOM 1484 CG2 VAL A 91 12.450 -21.443 -17.773 1.00 0.00 C ATOM 0 H VAL A 91 10.092 -20.564 -19.240 1.00 0.00 H new ATOM 0 HA VAL A 91 12.769 -20.658 -20.215 1.00 0.00 H new ATOM 0 HB VAL A 91 10.965 -22.622 -18.872 1.00 0.00 H new ATOM 0 HG11 VAL A 91 12.993 -23.995 -18.423 1.00 0.00 H new ATOM 0 HG12 VAL A 91 12.617 -23.909 -20.160 1.00 0.00 H new ATOM 0 HG13 VAL A 91 13.938 -22.925 -19.485 1.00 0.00 H new ATOM 0 HG21 VAL A 91 12.537 -22.140 -16.939 1.00 0.00 H new ATOM 0 HG22 VAL A 91 13.424 -20.998 -17.977 1.00 0.00 H new ATOM 0 HG23 VAL A 91 11.739 -20.658 -17.517 1.00 0.00 H new ATOM 1494 N ALA A 92 10.502 -22.390 -21.931 1.00 0.00 N ATOM 1495 CA ALA A 92 10.288 -22.986 -23.242 1.00 0.00 C ATOM 1496 C ALA A 92 10.518 -21.973 -24.368 1.00 0.00 C ATOM 1497 O ALA A 92 11.003 -22.349 -25.438 1.00 0.00 O ATOM 1498 CB ALA A 92 8.886 -23.601 -23.330 1.00 0.00 C ATOM 0 H ALA A 92 9.678 -22.385 -21.330 1.00 0.00 H new ATOM 0 HA ALA A 92 11.022 -23.782 -23.370 1.00 0.00 H new ATOM 0 HB1 ALA A 92 8.743 -24.042 -24.317 1.00 0.00 H new ATOM 0 HB2 ALA A 92 8.779 -24.373 -22.568 1.00 0.00 H new ATOM 0 HB3 ALA A 92 8.138 -22.825 -23.168 1.00 0.00 H new ATOM 1504 N LYS A 93 10.196 -20.692 -24.146 1.00 0.00 N ATOM 1505 CA LYS A 93 10.428 -19.634 -25.122 1.00 0.00 C ATOM 1506 C LYS A 93 11.922 -19.472 -25.378 1.00 0.00 C ATOM 1507 O LYS A 93 12.342 -19.542 -26.532 1.00 0.00 O ATOM 1508 CB LYS A 93 9.757 -18.323 -24.678 1.00 0.00 C ATOM 1509 CG LYS A 93 9.764 -17.286 -25.815 1.00 0.00 C ATOM 1510 CD LYS A 93 9.005 -15.997 -25.460 1.00 0.00 C ATOM 1511 CE LYS A 93 9.684 -15.212 -24.326 1.00 0.00 C ATOM 1512 NZ LYS A 93 8.994 -13.927 -24.047 1.00 0.00 N ATOM 0 H LYS A 93 9.766 -20.365 -23.280 1.00 0.00 H new ATOM 0 HA LYS A 93 9.967 -19.913 -26.069 1.00 0.00 H new ATOM 0 HB2 LYS A 93 8.731 -18.522 -24.369 1.00 0.00 H new ATOM 0 HB3 LYS A 93 10.278 -17.919 -23.810 1.00 0.00 H new ATOM 0 HG2 LYS A 93 10.795 -17.036 -26.065 1.00 0.00 H new ATOM 0 HG3 LYS A 93 9.319 -17.729 -26.706 1.00 0.00 H new ATOM 0 HD2 LYS A 93 8.935 -15.364 -26.345 1.00 0.00 H new ATOM 0 HD3 LYS A 93 7.986 -16.248 -25.165 1.00 0.00 H new ATOM 0 HE2 LYS A 93 9.697 -15.820 -23.422 1.00 0.00 H new ATOM 0 HE3 LYS A 93 10.722 -15.015 -24.593 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 9.484 -13.430 -23.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 9.004 -13.335 -24.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 8.010 -14.115 -23.767 1.00 0.00 H new ATOM 1526 N ILE A 94 12.733 -19.292 -24.329 1.00 0.00 N ATOM 1527 CA ILE A 94 14.172 -19.086 -24.515 1.00 0.00 C ATOM 1528 C ILE A 94 14.861 -20.367 -25.014 1.00 0.00 C ATOM 1529 O ILE A 94 15.817 -20.286 -25.787 1.00 0.00 O ATOM 1530 CB ILE A 94 14.841 -18.474 -23.260 1.00 0.00 C ATOM 1531 CG1 ILE A 94 14.873 -19.436 -22.055 1.00 0.00 C ATOM 1532 CG2 ILE A 94 14.155 -17.139 -22.900 1.00 0.00 C ATOM 1533 CD1 ILE A 94 15.587 -18.884 -20.816 1.00 0.00 C ATOM 0 H ILE A 94 12.423 -19.285 -23.357 1.00 0.00 H new ATOM 0 HA ILE A 94 14.303 -18.343 -25.302 1.00 0.00 H new ATOM 0 HB ILE A 94 15.885 -18.286 -23.509 1.00 0.00 H new ATOM 0 HG12 ILE A 94 13.849 -19.692 -21.784 1.00 0.00 H new ATOM 0 HG13 ILE A 94 15.363 -20.361 -22.358 1.00 0.00 H new ATOM 0 HG21 ILE A 94 14.630 -16.713 -22.016 1.00 0.00 H new ATOM 0 HG22 ILE A 94 14.251 -16.444 -23.734 1.00 0.00 H new ATOM 0 HG23 ILE A 94 13.099 -17.316 -22.695 1.00 0.00 H new ATOM 0 HD11 ILE A 94 15.561 -19.628 -20.019 1.00 0.00 H new ATOM 0 HD12 ILE A 94 16.623 -18.655 -21.065 1.00 0.00 H new ATOM 0 HD13 ILE A 94 15.085 -17.976 -20.481 1.00 0.00 H new ATOM 1545 N LYS A 95 14.372 -21.548 -24.612 1.00 0.00 N ATOM 1546 CA LYS A 95 14.921 -22.836 -25.038 1.00 0.00 C ATOM 1547 C LYS A 95 14.617 -23.104 -26.513 1.00 0.00 C ATOM 1548 O LYS A 95 15.473 -23.637 -27.220 1.00 0.00 O ATOM 1549 CB LYS A 95 14.363 -23.943 -24.126 1.00 0.00 C ATOM 1550 CG LYS A 95 14.966 -25.325 -24.420 1.00 0.00 C ATOM 1551 CD LYS A 95 14.509 -26.355 -23.375 1.00 0.00 C ATOM 1552 CE LYS A 95 15.016 -27.774 -23.681 1.00 0.00 C ATOM 1553 NZ LYS A 95 16.488 -27.913 -23.530 1.00 0.00 N ATOM 0 H LYS A 95 13.578 -21.634 -23.977 1.00 0.00 H new ATOM 0 HA LYS A 95 16.007 -22.819 -24.945 1.00 0.00 H new ATOM 0 HB2 LYS A 95 14.558 -23.682 -23.086 1.00 0.00 H new ATOM 0 HB3 LYS A 95 13.281 -23.992 -24.245 1.00 0.00 H new ATOM 0 HG2 LYS A 95 14.666 -25.653 -25.415 1.00 0.00 H new ATOM 0 HG3 LYS A 95 16.054 -25.259 -24.420 1.00 0.00 H new ATOM 0 HD2 LYS A 95 14.865 -26.051 -22.391 1.00 0.00 H new ATOM 0 HD3 LYS A 95 13.420 -26.364 -23.331 1.00 0.00 H new ATOM 0 HE2 LYS A 95 14.520 -28.482 -23.016 1.00 0.00 H new ATOM 0 HE3 LYS A 95 14.734 -28.042 -24.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 16.769 -28.890 -23.749 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 16.967 -27.260 -24.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 16.760 -27.686 -22.552 1.00 0.00 H new ATOM 1567 N GLY A 96 13.417 -22.749 -26.978 1.00 0.00 N ATOM 1568 CA GLY A 96 12.939 -23.005 -28.333 1.00 0.00 C ATOM 1569 C GLY A 96 11.827 -24.054 -28.351 1.00 0.00 C ATOM 1570 O GLY A 96 11.081 -24.146 -29.326 1.00 0.00 O ATOM 0 H GLY A 96 12.732 -22.260 -26.402 1.00 0.00 H new ATOM 0 HA2 GLY A 96 12.571 -22.077 -28.771 1.00 0.00 H new ATOM 0 HA3 GLY A 96 13.769 -23.343 -28.954 1.00 0.00 H new ATOM 1574 N THR A 97 11.649 -24.819 -27.270 1.00 0.00 N ATOM 1575 CA THR A 97 10.624 -25.848 -27.158 1.00 0.00 C ATOM 1576 C THR A 97 9.206 -25.289 -27.327 1.00 0.00 C ATOM 1577 O THR A 97 8.334 -26.034 -27.770 1.00 0.00 O ATOM 1578 CB THR A 97 10.806 -26.609 -25.832 1.00 0.00 C ATOM 1579 OG1 THR A 97 11.252 -25.734 -24.815 1.00 0.00 O ATOM 1580 CG2 THR A 97 11.867 -27.702 -25.979 1.00 0.00 C ATOM 0 H THR A 97 12.228 -24.735 -26.434 1.00 0.00 H new ATOM 0 HA THR A 97 10.749 -26.552 -27.981 1.00 0.00 H new ATOM 0 HB THR A 97 9.840 -27.042 -25.574 1.00 0.00 H new ATOM 0 HG1 THR A 97 11.209 -26.190 -23.949 1.00 0.00 H new ATOM 0 HG21 THR A 97 11.981 -28.228 -25.031 1.00 0.00 H new ATOM 0 HG22 THR A 97 11.558 -28.407 -26.751 1.00 0.00 H new ATOM 0 HG23 THR A 97 12.818 -27.250 -26.260 1.00 0.00 H new ATOM 1588 N PHE A 98 8.980 -23.986 -27.098 1.00 0.00 N ATOM 1589 CA PHE A 98 7.681 -23.345 -27.332 1.00 0.00 C ATOM 1590 C PHE A 98 7.173 -23.537 -28.772 1.00 0.00 C ATOM 1591 O PHE A 98 5.962 -23.493 -29.000 1.00 0.00 O ATOM 1592 CB PHE A 98 7.729 -21.851 -26.978 1.00 0.00 C ATOM 1593 CG PHE A 98 8.296 -20.929 -28.050 1.00 0.00 C ATOM 1594 CD1 PHE A 98 9.677 -20.909 -28.331 1.00 0.00 C ATOM 1595 CD2 PHE A 98 7.436 -20.072 -28.765 1.00 0.00 C ATOM 1596 CE1 PHE A 98 10.196 -20.019 -29.287 1.00 0.00 C ATOM 1597 CE2 PHE A 98 7.953 -19.194 -29.736 1.00 0.00 C ATOM 1598 CZ PHE A 98 9.335 -19.161 -29.990 1.00 0.00 C ATOM 0 H PHE A 98 9.694 -23.349 -26.745 1.00 0.00 H new ATOM 0 HA PHE A 98 6.971 -23.843 -26.671 1.00 0.00 H new ATOM 0 HB2 PHE A 98 6.717 -21.521 -26.741 1.00 0.00 H new ATOM 0 HB3 PHE A 98 8.324 -21.731 -26.072 1.00 0.00 H new ATOM 0 HD1 PHE A 98 10.341 -21.582 -27.808 1.00 0.00 H new ATOM 0 HD2 PHE A 98 6.374 -20.089 -28.567 1.00 0.00 H new ATOM 0 HE1 PHE A 98 11.258 -19.995 -29.481 1.00 0.00 H new ATOM 0 HE2 PHE A 98 7.287 -18.545 -30.286 1.00 0.00 H new ATOM 0 HZ PHE A 98 9.734 -18.477 -30.724 1.00 0.00 H new ATOM 1608 N LYS A 99 8.079 -23.765 -29.734 1.00 0.00 N ATOM 1609 CA LYS A 99 7.759 -23.993 -31.143 1.00 0.00 C ATOM 1610 C LYS A 99 8.358 -25.298 -31.663 1.00 0.00 C ATOM 1611 O LYS A 99 7.806 -25.877 -32.595 1.00 0.00 O ATOM 1612 CB LYS A 99 8.201 -22.784 -31.990 1.00 0.00 C ATOM 1613 CG LYS A 99 9.715 -22.499 -31.927 1.00 0.00 C ATOM 1614 CD LYS A 99 10.145 -21.333 -32.825 1.00 0.00 C ATOM 1615 CE LYS A 99 10.081 -21.729 -34.306 1.00 0.00 C ATOM 1616 NZ LYS A 99 10.549 -20.641 -35.202 1.00 0.00 N ATOM 0 H LYS A 99 9.081 -23.796 -29.544 1.00 0.00 H new ATOM 0 HA LYS A 99 6.678 -24.097 -31.231 1.00 0.00 H new ATOM 0 HB2 LYS A 99 7.916 -22.956 -33.028 1.00 0.00 H new ATOM 0 HB3 LYS A 99 7.660 -21.900 -31.654 1.00 0.00 H new ATOM 0 HG2 LYS A 99 9.995 -22.279 -30.897 1.00 0.00 H new ATOM 0 HG3 LYS A 99 10.260 -23.396 -32.220 1.00 0.00 H new ATOM 0 HD2 LYS A 99 9.499 -20.474 -32.646 1.00 0.00 H new ATOM 0 HD3 LYS A 99 11.160 -21.027 -32.570 1.00 0.00 H new ATOM 0 HE2 LYS A 99 10.691 -22.618 -34.469 1.00 0.00 H new ATOM 0 HE3 LYS A 99 9.056 -21.994 -34.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 10.487 -20.955 -36.191 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 9.952 -19.800 -35.068 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 11.536 -20.405 -34.975 1.00 0.00 H new ATOM 1630 N GLU A 100 9.456 -25.783 -31.074 1.00 0.00 N ATOM 1631 CA GLU A 100 10.080 -27.033 -31.494 1.00 0.00 C ATOM 1632 C GLU A 100 9.285 -28.244 -30.974 1.00 0.00 C ATOM 1633 O GLU A 100 9.198 -29.258 -31.668 1.00 0.00 O ATOM 1634 CB GLU A 100 11.551 -27.040 -31.034 1.00 0.00 C ATOM 1635 CG GLU A 100 12.368 -28.175 -31.669 1.00 0.00 C ATOM 1636 CD GLU A 100 13.874 -28.032 -31.381 1.00 0.00 C ATOM 1637 OE1 GLU A 100 14.571 -27.293 -32.114 1.00 0.00 O ATOM 1638 OE2 GLU A 100 14.380 -28.685 -30.440 1.00 0.00 O ATOM 0 H GLU A 100 9.931 -25.321 -30.299 1.00 0.00 H new ATOM 0 HA GLU A 100 10.068 -27.110 -32.581 1.00 0.00 H new ATOM 0 HB2 GLU A 100 12.010 -26.084 -31.285 1.00 0.00 H new ATOM 0 HB3 GLU A 100 11.587 -27.136 -29.949 1.00 0.00 H new ATOM 0 HG2 GLU A 100 12.015 -29.133 -31.287 1.00 0.00 H new ATOM 0 HG3 GLU A 100 12.204 -28.181 -32.747 1.00 0.00 H new ATOM 1645 N ARG A 101 8.667 -28.143 -29.785 1.00 0.00 N ATOM 1646 CA ARG A 101 7.867 -29.204 -29.157 1.00 0.00 C ATOM 1647 C ARG A 101 6.672 -28.569 -28.436 1.00 0.00 C ATOM 1648 O ARG A 101 6.617 -28.598 -27.205 1.00 0.00 O ATOM 1649 CB ARG A 101 8.720 -30.079 -28.206 1.00 0.00 C ATOM 1650 CG ARG A 101 9.802 -30.889 -28.932 1.00 0.00 C ATOM 1651 CD ARG A 101 10.642 -31.732 -27.960 1.00 0.00 C ATOM 1652 NE ARG A 101 11.777 -32.371 -28.656 1.00 0.00 N ATOM 1653 CZ ARG A 101 12.870 -31.741 -29.114 1.00 0.00 C ATOM 1654 NH1 ARG A 101 13.086 -30.464 -28.814 1.00 0.00 N ATOM 1655 NH2 ARG A 101 13.738 -32.386 -29.886 1.00 0.00 N ATOM 0 H ARG A 101 8.713 -27.296 -29.219 1.00 0.00 H new ATOM 0 HA ARG A 101 7.495 -29.876 -29.930 1.00 0.00 H new ATOM 0 HB2 ARG A 101 9.194 -29.439 -27.462 1.00 0.00 H new ATOM 0 HB3 ARG A 101 8.064 -30.763 -27.667 1.00 0.00 H new ATOM 0 HG2 ARG A 101 9.333 -31.543 -29.667 1.00 0.00 H new ATOM 0 HG3 ARG A 101 10.455 -30.211 -29.481 1.00 0.00 H new ATOM 0 HD2 ARG A 101 11.015 -31.100 -27.154 1.00 0.00 H new ATOM 0 HD3 ARG A 101 10.015 -32.497 -27.502 1.00 0.00 H new ATOM 0 HE ARG A 101 11.726 -33.379 -28.801 1.00 0.00 H new ATOM 0 HH11 ARG A 101 12.419 -29.957 -28.232 1.00 0.00 H new ATOM 0 HH12 ARG A 101 13.919 -29.991 -29.165 1.00 0.00 H new ATOM 0 HH21 ARG A 101 13.574 -33.362 -30.132 1.00 0.00 H new ATOM 0 HH22 ARG A 101 14.568 -31.905 -30.233 1.00 0.00 H new ATOM 1669 N PRO A 102 5.709 -27.985 -29.177 1.00 0.00 N ATOM 1670 CA PRO A 102 4.552 -27.341 -28.567 1.00 0.00 C ATOM 1671 C PRO A 102 3.676 -28.343 -27.799 1.00 0.00 C ATOM 1672 O PRO A 102 2.977 -27.959 -26.858 1.00 0.00 O ATOM 1673 CB PRO A 102 3.806 -26.653 -29.714 1.00 0.00 C ATOM 1674 CG PRO A 102 4.190 -27.479 -30.941 1.00 0.00 C ATOM 1675 CD PRO A 102 5.618 -27.925 -30.629 1.00 0.00 C ATOM 0 HA PRO A 102 4.850 -26.613 -27.813 1.00 0.00 H new ATOM 0 HB2 PRO A 102 2.728 -26.656 -29.550 1.00 0.00 H new ATOM 0 HB3 PRO A 102 4.109 -25.611 -29.821 1.00 0.00 H new ATOM 0 HG2 PRO A 102 3.523 -28.330 -31.078 1.00 0.00 H new ATOM 0 HG3 PRO A 102 4.144 -26.887 -31.855 1.00 0.00 H new ATOM 0 HD2 PRO A 102 5.830 -28.897 -31.074 1.00 0.00 H new ATOM 0 HD3 PRO A 102 6.345 -27.223 -31.037 1.00 0.00 H new ATOM 1683 N LYS A 103 3.741 -29.628 -28.165 1.00 0.00 N ATOM 1684 CA LYS A 103 3.168 -30.756 -27.445 1.00 0.00 C ATOM 1685 C LYS A 103 4.163 -31.901 -27.635 1.00 0.00 C ATOM 1686 O LYS A 103 4.613 -32.129 -28.763 1.00 0.00 O ATOM 1687 CB LYS A 103 1.774 -31.078 -28.012 1.00 0.00 C ATOM 1688 CG LYS A 103 1.057 -32.170 -27.205 1.00 0.00 C ATOM 1689 CD LYS A 103 -0.348 -32.434 -27.761 1.00 0.00 C ATOM 1690 CE LYS A 103 -1.045 -33.528 -26.942 1.00 0.00 C ATOM 1691 NZ LYS A 103 -2.410 -33.823 -27.444 1.00 0.00 N ATOM 0 H LYS A 103 4.221 -29.917 -29.017 1.00 0.00 H new ATOM 0 HA LYS A 103 3.019 -30.559 -26.383 1.00 0.00 H new ATOM 0 HB2 LYS A 103 1.167 -30.173 -28.014 1.00 0.00 H new ATOM 0 HB3 LYS A 103 1.871 -31.400 -29.049 1.00 0.00 H new ATOM 0 HG2 LYS A 103 1.641 -33.090 -27.233 1.00 0.00 H new ATOM 0 HG3 LYS A 103 0.987 -31.868 -26.160 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -0.937 -31.517 -27.732 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -0.282 -32.738 -28.806 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -0.445 -34.438 -26.970 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -1.103 -33.217 -25.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -2.841 -34.568 -26.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -2.992 -32.963 -27.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -2.355 -34.146 -28.431 1.00 0.00 H new ATOM 1705 N LYS A 104 4.564 -32.558 -26.545 1.00 0.00 N ATOM 1706 CA LYS A 104 5.503 -33.677 -26.593 1.00 0.00 C ATOM 1707 C LYS A 104 4.893 -34.802 -27.423 1.00 0.00 C ATOM 1708 O LYS A 104 3.708 -35.138 -27.210 1.00 0.00 O ATOM 1709 CB LYS A 104 5.866 -34.162 -25.181 1.00 0.00 C ATOM 1710 CG LYS A 104 6.660 -33.110 -24.388 1.00 0.00 C ATOM 1711 CD LYS A 104 7.056 -33.643 -23.005 1.00 0.00 C ATOM 1712 CE LYS A 104 7.845 -32.576 -22.234 1.00 0.00 C ATOM 1713 NZ LYS A 104 8.251 -33.042 -20.884 1.00 0.00 N ATOM 1714 OXT LYS A 104 5.606 -35.368 -28.276 1.00 0.00 O ATOM 0 H LYS A 104 4.246 -32.328 -25.604 1.00 0.00 H new ATOM 0 HA LYS A 104 6.430 -33.346 -27.062 1.00 0.00 H new ATOM 0 HB2 LYS A 104 4.954 -34.410 -24.639 1.00 0.00 H new ATOM 0 HB3 LYS A 104 6.453 -35.078 -25.254 1.00 0.00 H new ATOM 0 HG2 LYS A 104 7.555 -32.831 -24.944 1.00 0.00 H new ATOM 0 HG3 LYS A 104 6.061 -32.207 -24.275 1.00 0.00 H new ATOM 0 HD2 LYS A 104 6.163 -33.922 -22.445 1.00 0.00 H new ATOM 0 HD3 LYS A 104 7.659 -34.545 -23.113 1.00 0.00 H new ATOM 0 HE2 LYS A 104 8.733 -32.301 -22.804 1.00 0.00 H new ATOM 0 HE3 LYS A 104 7.237 -31.676 -22.138 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 8.781 -32.288 -20.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 7.404 -33.279 -20.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 8.853 -33.885 -20.974 1.00 0.00 H new TER 1728 LYS A 104