USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1330 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 27 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 140 GLN : amide:sc= -0.341 X(o=-0.34,f=-0.47) USER MOD Set 2.1: A 71 TYR OH : rot 130:sc= -0.0225 USER MOD Set 2.2: A 109 THR OG1 : rot 141:sc= -4.19! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -155:sc= -0.155 (180deg=-1.18) USER MOD Single : A 2 ASN : amide:sc= -0.931 X(o=-0.93,f=-0.74) USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 THR OG1 : rot 75:sc= 0.859 USER MOD Single : A 9 THR OG1 : rot 71:sc= 0.11 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 THR OG1 : rot 90:sc= 1.25 USER MOD Single : A 19 GLN : amide:sc= -1.14 K(o=-1.1,f=-2.2) USER MOD Single : A 20 GLN : amide:sc= -1.12 K(o=-1.1,f=-3.5!) USER MOD Single : A 23 HIS : no HD1:sc= -0.724 K(o=-0.72,f=-0.096) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot -53:sc= 1.11 USER MOD Single : A 34 HIS : no HD1:sc= -0.16 X(o=-0.16,f=-0.25) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot -71:sc= 0.431 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=-0.044) USER MOD Single : A 59 SER OG : rot -160:sc= 0.684 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc=-0.00511 K(o=-0.0051,f=-3.2!) USER MOD Single : A 68 HIS : no HD1:sc= -1.52 K(o=-1.5,f=-0.66) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 76 LYS NZ :NH3+ 149:sc= -0.281 (180deg=-1.11!) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.27 X(o=-0.27,f=-0.68) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 34:sc= 0.389 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=-0.029) USER MOD Single : A 103 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 119 ASN : amide:sc= -0.452 K(o=-0.45,f=-2.6) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot -140:sc= 0 USER MOD Single : A 141 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 142 THR OG1 : rot 111:sc=-0.00434 USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 ASN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 150 ASN : amide:sc= -0.795 X(o=-0.8,f=-0.51) USER MOD Single : A 152 ASN : amide:sc= -0.338 X(o=-0.34,f=0) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 161 GLN : amide:sc= -0.936 X(o=-0.94,f=-0.94) USER MOD Single : A 165 HIS : no HD1:sc= 0 X(o=0,f=-0.046) USER MOD Single : A 166 HIS : no HD1:sc= -0.676 X(o=-0.68,f=-0.31) USER MOD Single : A 167 HIS : no HE2:sc= -1.15 K(o=-1.1,f=-2.8!) USER MOD Single : A 168 HIS : no HD1:sc= -1.05 X(o=-1.1,f=-0.56) USER MOD Single : A 169 HIS : no HD1:sc= -0.534 X(o=-0.53,f=-0.2) USER MOD Single : A 170 HIS : no HD1:sc= -1 K(o=-1,f=-0.25) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -29.956 -19.121 28.874 1.00 0.00 N ATOM 2 CA MET A 1 -30.164 -20.538 28.476 1.00 0.00 C ATOM 3 C MET A 1 -29.122 -20.984 27.456 1.00 0.00 C ATOM 4 O MET A 1 -28.745 -22.155 27.410 1.00 0.00 O ATOM 5 CB MET A 1 -31.571 -20.676 27.888 1.00 0.00 C ATOM 6 CG MET A 1 -32.669 -20.188 28.818 1.00 0.00 C ATOM 7 SD MET A 1 -32.978 -21.322 30.185 1.00 0.00 S ATOM 8 CE MET A 1 -32.345 -20.371 31.564 1.00 0.00 C ATOM 0 H1 MET A 1 -30.358 -18.963 29.820 1.00 0.00 H new ATOM 0 H2 MET A 1 -28.938 -18.911 28.892 1.00 0.00 H new ATOM 0 H3 MET A 1 -30.426 -18.495 28.189 1.00 0.00 H new ATOM 0 HA MET A 1 -30.057 -21.176 29.353 1.00 0.00 H new ATOM 0 HB2 MET A 1 -31.622 -20.116 26.954 1.00 0.00 H new ATOM 0 HB3 MET A 1 -31.752 -21.722 27.643 1.00 0.00 H new ATOM 0 HG2 MET A 1 -32.394 -19.211 29.217 1.00 0.00 H new ATOM 0 HG3 MET A 1 -33.588 -20.053 28.248 1.00 0.00 H new ATOM 0 HE1 MET A 1 -32.466 -20.941 32.485 1.00 0.00 H new ATOM 0 HE2 MET A 1 -31.288 -20.159 31.405 1.00 0.00 H new ATOM 0 HE3 MET A 1 -32.896 -19.434 31.643 1.00 0.00 H new ATOM 20 N ASN A 2 -28.659 -20.043 26.639 1.00 0.00 N ATOM 21 CA ASN A 2 -27.659 -20.339 25.619 1.00 0.00 C ATOM 22 C ASN A 2 -26.976 -19.063 25.141 1.00 0.00 C ATOM 23 O ASN A 2 -25.752 -19.009 25.024 1.00 0.00 O ATOM 24 CB ASN A 2 -28.306 -21.060 24.436 1.00 0.00 C ATOM 25 CG ASN A 2 -28.332 -22.564 24.619 1.00 0.00 C ATOM 26 OD1 ASN A 2 -29.392 -23.189 24.564 1.00 0.00 O ATOM 27 ND2 ASN A 2 -27.163 -23.154 24.838 1.00 0.00 N ATOM 0 H ASN A 2 -28.960 -19.069 26.663 1.00 0.00 H new ATOM 0 HA ASN A 2 -26.904 -20.989 26.062 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -29.325 -20.695 24.305 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -27.761 -20.817 23.524 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -27.118 -24.165 24.969 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -26.310 -22.597 24.876 1.00 0.00 H new ATOM 34 N ALA A 3 -27.775 -18.036 24.867 1.00 0.00 N ATOM 35 CA ALA A 3 -27.248 -16.758 24.403 1.00 0.00 C ATOM 36 C ALA A 3 -26.254 -16.170 25.400 1.00 0.00 C ATOM 37 O ALA A 3 -25.420 -15.338 25.043 1.00 0.00 O ATOM 38 CB ALA A 3 -28.385 -15.780 24.151 1.00 0.00 C ATOM 0 H ALA A 3 -28.790 -18.065 24.959 1.00 0.00 H new ATOM 0 HA ALA A 3 -26.717 -16.934 23.468 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -27.978 -14.830 23.805 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -29.053 -16.187 23.392 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -28.940 -15.622 25.075 1.00 0.00 H new ATOM 44 N ASP A 4 -26.345 -16.608 26.653 1.00 0.00 N ATOM 45 CA ASP A 4 -25.450 -16.125 27.698 1.00 0.00 C ATOM 46 C ASP A 4 -24.080 -16.782 27.578 1.00 0.00 C ATOM 47 O ASP A 4 -23.063 -16.101 27.448 1.00 0.00 O ATOM 48 CB ASP A 4 -26.045 -16.405 29.080 1.00 0.00 C ATOM 49 CG ASP A 4 -25.565 -15.418 30.127 1.00 0.00 C ATOM 50 OD1 ASP A 4 -24.416 -15.559 30.592 1.00 0.00 O ATOM 51 OD2 ASP A 4 -26.340 -14.505 30.479 1.00 0.00 O ATOM 0 H ASP A 4 -27.029 -17.296 26.968 1.00 0.00 H new ATOM 0 HA ASP A 4 -25.332 -15.048 27.575 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -27.133 -16.366 29.019 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -25.779 -17.416 29.389 1.00 0.00 H new ATOM 57 N GLU A 5 -24.064 -18.109 27.618 1.00 0.00 N ATOM 58 CA GLU A 5 -22.822 -18.861 27.507 1.00 0.00 C ATOM 59 C GLU A 5 -22.233 -18.726 26.107 1.00 0.00 C ATOM 60 O GLU A 5 -21.024 -18.855 25.916 1.00 0.00 O ATOM 61 CB GLU A 5 -23.063 -20.337 27.833 1.00 0.00 C ATOM 62 CG GLU A 5 -23.591 -20.572 29.239 1.00 0.00 C ATOM 63 CD GLU A 5 -25.062 -20.934 29.257 1.00 0.00 C ATOM 64 OE1 GLU A 5 -25.444 -21.904 28.567 1.00 0.00 O ATOM 65 OE2 GLU A 5 -25.834 -20.251 29.961 1.00 0.00 O ATOM 0 H GLU A 5 -24.898 -18.686 27.727 1.00 0.00 H new ATOM 0 HA GLU A 5 -22.111 -18.451 28.224 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -23.772 -20.748 27.114 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -22.129 -20.885 27.708 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -23.018 -21.371 29.709 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -23.434 -19.674 29.837 1.00 0.00 H new ATOM 73 N TRP A 6 -23.096 -18.466 25.128 1.00 0.00 N ATOM 74 CA TRP A 6 -22.659 -18.313 23.745 1.00 0.00 C ATOM 75 C TRP A 6 -21.866 -17.022 23.565 1.00 0.00 C ATOM 76 O TRP A 6 -20.774 -17.026 22.998 1.00 0.00 O ATOM 77 CB TRP A 6 -23.863 -18.322 22.802 1.00 0.00 C ATOM 78 CG TRP A 6 -24.186 -19.683 22.265 1.00 0.00 C ATOM 79 CD1 TRP A 6 -24.068 -20.873 22.922 1.00 0.00 C ATOM 80 CD2 TRP A 6 -24.680 -19.993 20.956 1.00 0.00 C ATOM 81 NE1 TRP A 6 -24.459 -21.905 22.102 1.00 0.00 N ATOM 82 CE2 TRP A 6 -24.839 -21.390 20.891 1.00 0.00 C ATOM 83 CE3 TRP A 6 -25.005 -19.225 19.835 1.00 0.00 C ATOM 84 CZ2 TRP A 6 -25.307 -22.034 19.749 1.00 0.00 C ATOM 85 CZ3 TRP A 6 -25.469 -19.865 18.701 1.00 0.00 C ATOM 86 CH2 TRP A 6 -25.617 -21.258 18.666 1.00 0.00 C ATOM 0 H TRP A 6 -24.101 -18.357 25.268 1.00 0.00 H new ATOM 0 HA TRP A 6 -22.010 -19.154 23.501 1.00 0.00 H new ATOM 0 HB2 TRP A 6 -24.733 -17.932 23.331 1.00 0.00 H new ATOM 0 HB3 TRP A 6 -23.668 -17.647 21.969 1.00 0.00 H new ATOM 0 HD1 TRP A 6 -23.719 -20.988 23.937 1.00 0.00 H new ATOM 0 HE1 TRP A 6 -24.465 -22.893 22.354 1.00 0.00 H new ATOM 0 HE3 TRP A 6 -24.896 -18.151 19.854 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 -25.421 -23.108 19.719 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 -25.722 -19.282 17.828 1.00 0.00 H new ATOM 0 HH2 TRP A 6 -25.983 -21.729 17.766 1.00 0.00 H new ATOM 97 N MET A 7 -22.425 -15.918 24.052 1.00 0.00 N ATOM 98 CA MET A 7 -21.771 -14.620 23.945 1.00 0.00 C ATOM 99 C MET A 7 -20.422 -14.629 24.656 1.00 0.00 C ATOM 100 O MET A 7 -19.472 -13.985 24.214 1.00 0.00 O ATOM 101 CB MET A 7 -22.664 -13.527 24.535 1.00 0.00 C ATOM 102 CG MET A 7 -22.341 -12.134 24.020 1.00 0.00 C ATOM 103 SD MET A 7 -23.789 -11.062 23.960 1.00 0.00 S ATOM 104 CE MET A 7 -23.853 -10.675 22.212 1.00 0.00 C ATOM 0 H MET A 7 -23.329 -15.897 24.524 1.00 0.00 H new ATOM 0 HA MET A 7 -21.602 -14.412 22.888 1.00 0.00 H new ATOM 0 HB2 MET A 7 -23.705 -13.757 24.307 1.00 0.00 H new ATOM 0 HB3 MET A 7 -22.566 -13.536 25.621 1.00 0.00 H new ATOM 0 HG2 MET A 7 -21.585 -11.681 24.660 1.00 0.00 H new ATOM 0 HG3 MET A 7 -21.909 -12.211 23.022 1.00 0.00 H new ATOM 0 HE1 MET A 7 -24.700 -10.017 22.016 1.00 0.00 H new ATOM 0 HE2 MET A 7 -22.930 -10.177 21.916 1.00 0.00 H new ATOM 0 HE3 MET A 7 -23.969 -11.595 21.640 1.00 0.00 H new ATOM 114 N THR A 8 -20.347 -15.365 25.761 1.00 0.00 N ATOM 115 CA THR A 8 -19.114 -15.459 26.533 1.00 0.00 C ATOM 116 C THR A 8 -17.984 -16.037 25.687 1.00 0.00 C ATOM 117 O THR A 8 -16.816 -15.696 25.876 1.00 0.00 O ATOM 118 CB THR A 8 -19.330 -16.325 27.775 1.00 0.00 C ATOM 119 OG1 THR A 8 -20.492 -15.916 28.475 1.00 0.00 O ATOM 120 CG2 THR A 8 -18.169 -16.280 28.745 1.00 0.00 C ATOM 0 H THR A 8 -21.125 -15.904 26.141 1.00 0.00 H new ATOM 0 HA THR A 8 -18.833 -14.453 26.844 1.00 0.00 H new ATOM 0 HB THR A 8 -19.432 -17.344 27.403 1.00 0.00 H new ATOM 0 HG1 THR A 8 -21.289 -16.217 27.990 1.00 0.00 H new ATOM 0 HG21 THR A 8 -18.387 -16.916 29.603 1.00 0.00 H new ATOM 0 HG22 THR A 8 -17.266 -16.637 28.249 1.00 0.00 H new ATOM 0 HG23 THR A 8 -18.016 -15.255 29.082 1.00 0.00 H new ATOM 128 N THR A 9 -18.339 -16.915 24.755 1.00 0.00 N ATOM 129 CA THR A 9 -17.355 -17.541 23.880 1.00 0.00 C ATOM 130 C THR A 9 -16.911 -16.579 22.783 1.00 0.00 C ATOM 131 O THR A 9 -15.739 -16.547 22.408 1.00 0.00 O ATOM 132 CB THR A 9 -17.934 -18.811 23.254 1.00 0.00 C ATOM 133 OG1 THR A 9 -18.448 -19.672 24.255 1.00 0.00 O ATOM 134 CG2 THR A 9 -16.921 -19.596 22.449 1.00 0.00 C ATOM 0 H THR A 9 -19.301 -17.209 24.586 1.00 0.00 H new ATOM 0 HA THR A 9 -16.485 -17.803 24.483 1.00 0.00 H new ATOM 0 HB THR A 9 -18.722 -18.470 22.582 1.00 0.00 H new ATOM 0 HG1 THR A 9 -19.266 -19.285 24.631 1.00 0.00 H new ATOM 0 HG21 THR A 9 -17.396 -20.484 22.033 1.00 0.00 H new ATOM 0 HG22 THR A 9 -16.540 -18.975 21.638 1.00 0.00 H new ATOM 0 HG23 THR A 9 -16.096 -19.895 23.095 1.00 0.00 H new ATOM 142 N PHE A 10 -17.855 -15.794 22.273 1.00 0.00 N ATOM 143 CA PHE A 10 -17.561 -14.830 21.219 1.00 0.00 C ATOM 144 C PHE A 10 -16.820 -13.622 21.779 1.00 0.00 C ATOM 145 O PHE A 10 -15.935 -13.066 21.128 1.00 0.00 O ATOM 146 CB PHE A 10 -18.853 -14.380 20.535 1.00 0.00 C ATOM 147 CG PHE A 10 -19.378 -15.369 19.534 1.00 0.00 C ATOM 148 CD1 PHE A 10 -18.612 -15.740 18.441 1.00 0.00 C ATOM 149 CD2 PHE A 10 -20.639 -15.924 19.685 1.00 0.00 C ATOM 150 CE1 PHE A 10 -19.092 -16.650 17.518 1.00 0.00 C ATOM 151 CE2 PHE A 10 -21.125 -16.834 18.765 1.00 0.00 C ATOM 152 CZ PHE A 10 -20.351 -17.197 17.679 1.00 0.00 C ATOM 0 H PHE A 10 -18.830 -15.807 22.573 1.00 0.00 H new ATOM 0 HA PHE A 10 -16.921 -15.317 20.484 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -19.615 -14.205 21.295 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -18.677 -13.428 20.035 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -17.629 -15.313 18.309 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -21.249 -15.642 20.531 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -18.484 -16.933 16.672 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -22.109 -17.261 18.895 1.00 0.00 H new ATOM 0 HZ PHE A 10 -20.729 -17.906 16.958 1.00 0.00 H new ATOM 162 N ARG A 11 -17.186 -13.218 22.992 1.00 0.00 N ATOM 163 CA ARG A 11 -16.557 -12.075 23.640 1.00 0.00 C ATOM 164 C ARG A 11 -15.075 -12.341 23.896 1.00 0.00 C ATOM 165 O ARG A 11 -14.230 -11.477 23.667 1.00 0.00 O ATOM 166 CB ARG A 11 -17.267 -11.754 24.958 1.00 0.00 C ATOM 167 CG ARG A 11 -18.060 -10.456 24.920 1.00 0.00 C ATOM 168 CD ARG A 11 -17.921 -9.675 26.218 1.00 0.00 C ATOM 169 NE ARG A 11 -19.149 -9.703 27.009 1.00 0.00 N ATOM 170 CZ ARG A 11 -19.507 -10.721 27.789 1.00 0.00 C ATOM 171 NH1 ARG A 11 -18.735 -11.795 27.887 1.00 0.00 N ATOM 172 NH2 ARG A 11 -20.641 -10.663 28.474 1.00 0.00 N ATOM 0 H ARG A 11 -17.916 -13.667 23.545 1.00 0.00 H new ATOM 0 HA ARG A 11 -16.643 -11.218 22.972 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -17.940 -12.574 25.208 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -16.526 -11.695 25.755 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -17.715 -9.843 24.087 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -19.112 -10.677 24.739 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -17.102 -10.091 26.805 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -17.659 -8.641 25.993 1.00 0.00 H new ATOM 0 HE ARG A 11 -19.769 -8.895 26.961 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -17.861 -11.845 27.363 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -19.015 -12.571 28.486 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -21.238 -9.839 28.403 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -20.916 -11.442 29.072 1.00 0.00 H new ATOM 186 N GLU A 12 -14.770 -13.544 24.372 1.00 0.00 N ATOM 187 CA GLU A 12 -13.392 -13.925 24.658 1.00 0.00 C ATOM 188 C GLU A 12 -12.601 -14.117 23.369 1.00 0.00 C ATOM 189 O GLU A 12 -11.411 -13.811 23.309 1.00 0.00 O ATOM 190 CB GLU A 12 -13.358 -15.210 25.489 1.00 0.00 C ATOM 191 CG GLU A 12 -13.415 -14.967 26.988 1.00 0.00 C ATOM 192 CD GLU A 12 -12.045 -15.009 27.637 1.00 0.00 C ATOM 193 OE1 GLU A 12 -11.123 -14.341 27.122 1.00 0.00 O ATOM 194 OE2 GLU A 12 -11.894 -15.708 28.661 1.00 0.00 O ATOM 0 H GLU A 12 -15.458 -14.271 24.568 1.00 0.00 H new ATOM 0 HA GLU A 12 -12.930 -13.119 25.229 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -14.198 -15.842 25.200 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -12.448 -15.761 25.253 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -13.874 -13.997 27.178 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -14.055 -15.718 27.450 1.00 0.00 H new ATOM 202 N ASN A 13 -13.270 -14.627 22.340 1.00 0.00 N ATOM 203 CA ASN A 13 -12.629 -14.860 21.052 1.00 0.00 C ATOM 204 C ASN A 13 -12.294 -13.541 20.364 1.00 0.00 C ATOM 205 O ASN A 13 -11.166 -13.331 19.918 1.00 0.00 O ATOM 206 CB ASN A 13 -13.536 -15.702 20.153 1.00 0.00 C ATOM 207 CG ASN A 13 -12.756 -16.694 19.311 1.00 0.00 C ATOM 208 OD1 ASN A 13 -12.413 -16.416 18.162 1.00 0.00 O ATOM 209 ND2 ASN A 13 -12.471 -17.858 19.882 1.00 0.00 N ATOM 0 H ASN A 13 -14.256 -14.887 22.374 1.00 0.00 H new ATOM 0 HA ASN A 13 -11.700 -15.402 21.229 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -14.256 -16.240 20.770 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -14.107 -15.043 19.498 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -11.947 -18.565 19.365 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -12.775 -18.046 20.837 1.00 0.00 H new ATOM 216 N ILE A 14 -13.282 -12.656 20.281 1.00 0.00 N ATOM 217 CA ILE A 14 -13.093 -11.358 19.648 1.00 0.00 C ATOM 218 C ILE A 14 -12.122 -10.492 20.446 1.00 0.00 C ATOM 219 O ILE A 14 -11.312 -9.762 19.874 1.00 0.00 O ATOM 220 CB ILE A 14 -14.432 -10.608 19.494 1.00 0.00 C ATOM 221 CG1 ILE A 14 -14.227 -9.295 18.733 1.00 0.00 C ATOM 222 CG2 ILE A 14 -15.056 -10.346 20.856 1.00 0.00 C ATOM 223 CD1 ILE A 14 -13.882 -9.490 17.273 1.00 0.00 C ATOM 0 H ILE A 14 -14.222 -12.815 20.645 1.00 0.00 H new ATOM 0 HA ILE A 14 -12.676 -11.545 18.659 1.00 0.00 H new ATOM 0 HB ILE A 14 -15.114 -11.235 18.919 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -15.135 -8.696 18.807 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -13.431 -8.727 19.213 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -16.000 -9.816 20.728 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -15.238 -11.294 21.361 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -14.378 -9.739 21.456 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -13.751 -8.518 16.797 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -12.958 -10.062 17.191 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -14.688 -10.031 16.778 1.00 0.00 H new ATOM 235 N ALA A 15 -12.207 -10.581 21.769 1.00 0.00 N ATOM 236 CA ALA A 15 -11.336 -9.808 22.645 1.00 0.00 C ATOM 237 C ALA A 15 -9.917 -10.366 22.641 1.00 0.00 C ATOM 238 O ALA A 15 -8.947 -9.625 22.802 1.00 0.00 O ATOM 239 CB ALA A 15 -11.893 -9.789 24.061 1.00 0.00 C ATOM 0 H ALA A 15 -12.871 -11.181 22.258 1.00 0.00 H new ATOM 0 HA ALA A 15 -11.298 -8.786 22.267 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -11.232 -9.208 24.704 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -12.884 -9.336 24.056 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -11.962 -10.809 24.439 1.00 0.00 H new ATOM 245 N GLN A 16 -9.803 -11.677 22.453 1.00 0.00 N ATOM 246 CA GLN A 16 -8.501 -12.335 22.427 1.00 0.00 C ATOM 247 C GLN A 16 -7.761 -12.024 21.130 1.00 0.00 C ATOM 248 O GLN A 16 -6.654 -11.485 21.149 1.00 0.00 O ATOM 249 CB GLN A 16 -8.668 -13.848 22.583 1.00 0.00 C ATOM 250 CG GLN A 16 -7.350 -14.606 22.605 1.00 0.00 C ATOM 251 CD GLN A 16 -6.762 -14.709 23.999 1.00 0.00 C ATOM 252 OE1 GLN A 16 -5.800 -14.015 24.332 1.00 0.00 O ATOM 253 NE2 GLN A 16 -7.335 -15.579 24.821 1.00 0.00 N ATOM 0 H GLN A 16 -10.596 -12.304 22.317 1.00 0.00 H new ATOM 0 HA GLN A 16 -7.912 -11.954 23.261 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -9.211 -14.052 23.506 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -9.280 -14.224 21.763 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -7.504 -15.608 22.204 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -6.637 -14.107 21.949 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -8.130 -16.133 24.503 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -6.980 -15.693 25.771 1.00 0.00 H new ATOM 262 N THR A 17 -8.378 -12.369 20.005 1.00 0.00 N ATOM 263 CA THR A 17 -7.777 -12.127 18.697 1.00 0.00 C ATOM 264 C THR A 17 -7.529 -10.638 18.480 1.00 0.00 C ATOM 265 O THR A 17 -6.544 -10.248 17.853 1.00 0.00 O ATOM 266 CB THR A 17 -8.679 -12.672 17.589 1.00 0.00 C ATOM 267 OG1 THR A 17 -9.409 -13.798 18.045 1.00 0.00 O ATOM 268 CG2 THR A 17 -7.918 -13.089 16.350 1.00 0.00 C ATOM 0 H THR A 17 -9.294 -12.817 19.972 1.00 0.00 H new ATOM 0 HA THR A 17 -6.819 -12.646 18.664 1.00 0.00 H new ATOM 0 HB THR A 17 -9.345 -11.850 17.327 1.00 0.00 H new ATOM 0 HG1 THR A 17 -10.259 -13.502 18.431 1.00 0.00 H new ATOM 0 HG21 THR A 17 -8.617 -13.466 15.603 1.00 0.00 H new ATOM 0 HG22 THR A 17 -7.383 -12.230 15.945 1.00 0.00 H new ATOM 0 HG23 THR A 17 -7.205 -13.872 16.607 1.00 0.00 H new ATOM 276 N TRP A 18 -8.427 -9.810 19.003 1.00 0.00 N ATOM 277 CA TRP A 18 -8.305 -8.363 18.867 1.00 0.00 C ATOM 278 C TRP A 18 -7.208 -7.822 19.777 1.00 0.00 C ATOM 279 O TRP A 18 -6.560 -6.825 19.459 1.00 0.00 O ATOM 280 CB TRP A 18 -9.636 -7.685 19.194 1.00 0.00 C ATOM 281 CG TRP A 18 -9.607 -6.198 19.009 1.00 0.00 C ATOM 282 CD1 TRP A 18 -9.957 -5.252 19.928 1.00 0.00 C ATOM 283 CD2 TRP A 18 -9.208 -5.488 17.831 1.00 0.00 C ATOM 284 NE1 TRP A 18 -9.800 -3.995 19.393 1.00 0.00 N ATOM 285 CE2 TRP A 18 -9.341 -4.114 18.107 1.00 0.00 C ATOM 286 CE3 TRP A 18 -8.750 -5.880 16.570 1.00 0.00 C ATOM 287 CZ2 TRP A 18 -9.032 -3.132 17.169 1.00 0.00 C ATOM 288 CZ3 TRP A 18 -8.444 -4.905 15.640 1.00 0.00 C ATOM 289 CH2 TRP A 18 -8.586 -3.545 15.944 1.00 0.00 C ATOM 0 H TRP A 18 -9.248 -10.116 19.525 1.00 0.00 H new ATOM 0 HA TRP A 18 -8.037 -8.141 17.834 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -10.416 -8.107 18.560 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -9.906 -7.910 20.226 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -10.306 -5.460 20.929 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -9.994 -3.117 19.875 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -8.637 -6.926 16.327 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -9.141 -2.083 17.401 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -8.089 -5.196 14.662 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -8.338 -2.807 15.195 1.00 0.00 H new ATOM 300 N GLN A 19 -7.003 -8.486 20.909 1.00 0.00 N ATOM 301 CA GLN A 19 -5.985 -8.070 21.866 1.00 0.00 C ATOM 302 C GLN A 19 -4.589 -8.437 21.369 1.00 0.00 C ATOM 303 O GLN A 19 -3.842 -7.578 20.902 1.00 0.00 O ATOM 304 CB GLN A 19 -6.240 -8.717 23.229 1.00 0.00 C ATOM 305 CG GLN A 19 -7.123 -7.883 24.142 1.00 0.00 C ATOM 306 CD GLN A 19 -7.851 -8.722 25.174 1.00 0.00 C ATOM 307 OE1 GLN A 19 -7.551 -9.901 25.357 1.00 0.00 O ATOM 308 NE2 GLN A 19 -8.817 -8.114 25.855 1.00 0.00 N ATOM 0 H GLN A 19 -7.529 -9.315 21.186 1.00 0.00 H new ATOM 0 HA GLN A 19 -6.042 -6.986 21.970 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -6.705 -9.691 23.078 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -5.284 -8.893 23.723 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -6.512 -7.137 24.651 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -7.852 -7.341 23.540 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -9.032 -7.134 25.670 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -9.343 -8.627 26.562 1.00 0.00 H new ATOM 317 N GLN A 20 -4.245 -9.717 21.473 1.00 0.00 N ATOM 318 CA GLN A 20 -2.940 -10.196 21.034 1.00 0.00 C ATOM 319 C GLN A 20 -2.797 -10.076 19.517 1.00 0.00 C ATOM 320 O GLN A 20 -3.470 -10.783 18.767 1.00 0.00 O ATOM 321 CB GLN A 20 -2.740 -11.652 21.461 1.00 0.00 C ATOM 322 CG GLN A 20 -3.745 -12.610 20.843 1.00 0.00 C ATOM 323 CD GLN A 20 -3.158 -13.409 19.695 1.00 0.00 C ATOM 324 OE1 GLN A 20 -1.940 -13.492 19.540 1.00 0.00 O ATOM 325 NE2 GLN A 20 -4.025 -14.001 18.882 1.00 0.00 N ATOM 0 H GLN A 20 -4.852 -10.441 21.858 1.00 0.00 H new ATOM 0 HA GLN A 20 -2.176 -9.576 21.504 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -1.733 -11.968 21.187 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -2.809 -11.716 22.547 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -4.108 -13.295 21.610 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -4.607 -12.046 20.486 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -5.027 -13.906 19.048 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -3.689 -14.551 18.092 1.00 0.00 H new ATOM 334 N PRO A 21 -1.916 -9.177 19.040 1.00 0.00 N ATOM 335 CA PRO A 21 -1.697 -8.976 17.603 1.00 0.00 C ATOM 336 C PRO A 21 -1.277 -10.261 16.897 1.00 0.00 C ATOM 337 O PRO A 21 -0.320 -10.920 17.303 1.00 0.00 O ATOM 338 CB PRO A 21 -0.565 -7.944 17.547 1.00 0.00 C ATOM 339 CG PRO A 21 -0.608 -7.254 18.868 1.00 0.00 C ATOM 340 CD PRO A 21 -1.068 -8.289 19.855 1.00 0.00 C ATOM 0 HA PRO A 21 -2.607 -8.654 17.098 1.00 0.00 H new ATOM 0 HB2 PRO A 21 0.400 -8.424 17.384 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -0.713 -7.240 16.728 1.00 0.00 H new ATOM 0 HG2 PRO A 21 0.374 -6.865 19.138 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -1.292 -6.405 18.844 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -0.228 -8.827 20.296 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -1.627 -7.841 20.677 1.00 0.00 H new ATOM 348 N GLU A 22 -1.999 -10.612 15.837 1.00 0.00 N ATOM 349 CA GLU A 22 -1.700 -11.817 15.075 1.00 0.00 C ATOM 350 C GLU A 22 -0.464 -11.617 14.205 1.00 0.00 C ATOM 351 O GLU A 22 0.288 -12.557 13.950 1.00 0.00 O ATOM 352 CB GLU A 22 -2.895 -12.206 14.202 1.00 0.00 C ATOM 353 CG GLU A 22 -3.054 -13.706 14.021 1.00 0.00 C ATOM 354 CD GLU A 22 -3.576 -14.393 15.268 1.00 0.00 C ATOM 355 OE1 GLU A 22 -4.791 -14.288 15.538 1.00 0.00 O ATOM 356 OE2 GLU A 22 -2.771 -15.035 15.974 1.00 0.00 O ATOM 0 H GLU A 22 -2.795 -10.078 15.487 1.00 0.00 H new ATOM 0 HA GLU A 22 -1.499 -12.622 15.782 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -3.805 -11.804 14.647 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -2.786 -11.740 13.223 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -3.736 -13.898 13.193 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -2.092 -14.139 13.748 1.00 0.00 H new ATOM 364 N HIS A 23 -0.261 -10.384 13.751 1.00 0.00 N ATOM 365 CA HIS A 23 0.884 -10.057 12.910 1.00 0.00 C ATOM 366 C HIS A 23 1.390 -8.648 13.206 1.00 0.00 C ATOM 367 O HIS A 23 0.672 -7.829 13.778 1.00 0.00 O ATOM 368 CB HIS A 23 0.509 -10.178 11.432 1.00 0.00 C ATOM 369 CG HIS A 23 1.604 -10.742 10.581 1.00 0.00 C ATOM 370 ND1 HIS A 23 1.936 -10.231 9.343 1.00 0.00 N ATOM 371 CD2 HIS A 23 2.448 -11.780 10.795 1.00 0.00 C ATOM 372 CE1 HIS A 23 2.934 -10.930 8.833 1.00 0.00 C ATOM 373 NE2 HIS A 23 3.263 -11.875 9.693 1.00 0.00 N ATOM 0 H HIS A 23 -0.875 -9.595 13.952 1.00 0.00 H new ATOM 0 HA HIS A 23 1.682 -10.765 13.133 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -0.374 -10.811 11.340 1.00 0.00 H new ATOM 0 HB3 HIS A 23 0.236 -9.193 11.053 1.00 0.00 H new ATOM 0 HD2 HIS A 23 2.475 -12.414 11.669 1.00 0.00 H new ATOM 0 HE1 HIS A 23 3.401 -10.757 7.875 1.00 0.00 H new ATOM 0 HE2 HIS A 23 4.003 -12.565 9.561 1.00 0.00 H new ATOM 382 N TYR A 24 2.629 -8.375 12.812 1.00 0.00 N ATOM 383 CA TYR A 24 3.229 -7.065 13.036 1.00 0.00 C ATOM 384 C TYR A 24 3.796 -6.496 11.739 1.00 0.00 C ATOM 385 O TYR A 24 4.752 -7.033 11.179 1.00 0.00 O ATOM 386 CB TYR A 24 4.332 -7.161 14.093 1.00 0.00 C ATOM 387 CG TYR A 24 4.236 -6.100 15.166 1.00 0.00 C ATOM 388 CD1 TYR A 24 4.850 -4.864 15.006 1.00 0.00 C ATOM 389 CD2 TYR A 24 3.533 -6.335 16.340 1.00 0.00 C ATOM 390 CE1 TYR A 24 4.765 -3.892 15.984 1.00 0.00 C ATOM 391 CE2 TYR A 24 3.442 -5.368 17.324 1.00 0.00 C ATOM 392 CZ TYR A 24 4.060 -4.148 17.141 1.00 0.00 C ATOM 393 OH TYR A 24 3.973 -3.183 18.118 1.00 0.00 O ATOM 0 H TYR A 24 3.237 -9.042 12.337 1.00 0.00 H new ATOM 0 HA TYR A 24 2.450 -6.392 13.394 1.00 0.00 H new ATOM 0 HB2 TYR A 24 4.290 -8.144 14.561 1.00 0.00 H new ATOM 0 HB3 TYR A 24 5.302 -7.083 13.602 1.00 0.00 H new ATOM 0 HD1 TYR A 24 5.403 -4.660 14.101 1.00 0.00 H new ATOM 0 HD2 TYR A 24 3.049 -7.289 16.487 1.00 0.00 H new ATOM 0 HE1 TYR A 24 5.248 -2.937 15.843 1.00 0.00 H new ATOM 0 HE2 TYR A 24 2.890 -5.566 18.231 1.00 0.00 H new ATOM 0 HH TYR A 24 3.440 -3.523 18.867 1.00 0.00 H new ATOM 403 N ASP A 25 3.201 -5.406 11.266 1.00 0.00 N ATOM 404 CA ASP A 25 3.648 -4.764 10.036 1.00 0.00 C ATOM 405 C ASP A 25 4.109 -3.336 10.305 1.00 0.00 C ATOM 406 O ASP A 25 3.618 -2.676 11.222 1.00 0.00 O ATOM 407 CB ASP A 25 2.523 -4.761 8.999 1.00 0.00 C ATOM 408 CG ASP A 25 1.884 -6.127 8.836 1.00 0.00 C ATOM 409 OD1 ASP A 25 2.627 -7.109 8.630 1.00 0.00 O ATOM 410 OD2 ASP A 25 0.640 -6.213 8.916 1.00 0.00 O ATOM 0 H ASP A 25 2.408 -4.949 11.716 1.00 0.00 H new ATOM 0 HA ASP A 25 4.492 -5.333 9.645 1.00 0.00 H new ATOM 0 HB2 ASP A 25 1.761 -4.040 9.295 1.00 0.00 H new ATOM 0 HB3 ASP A 25 2.919 -4.431 8.038 1.00 0.00 H new ATOM 416 N LEU A 26 5.056 -2.862 9.502 1.00 0.00 N ATOM 417 CA LEU A 26 5.584 -1.513 9.654 1.00 0.00 C ATOM 418 C LEU A 26 5.822 -0.864 8.294 1.00 0.00 C ATOM 419 O LEU A 26 6.376 -1.486 7.387 1.00 0.00 O ATOM 420 CB LEU A 26 6.886 -1.540 10.458 1.00 0.00 C ATOM 421 CG LEU A 26 6.749 -1.144 11.929 1.00 0.00 C ATOM 422 CD1 LEU A 26 6.391 -2.355 12.777 1.00 0.00 C ATOM 423 CD2 LEU A 26 8.033 -0.501 12.429 1.00 0.00 C ATOM 0 H LEU A 26 5.473 -3.394 8.738 1.00 0.00 H new ATOM 0 HA LEU A 26 4.846 -0.919 10.193 1.00 0.00 H new ATOM 0 HB2 LEU A 26 7.306 -2.544 10.406 1.00 0.00 H new ATOM 0 HB3 LEU A 26 7.602 -0.870 9.983 1.00 0.00 H new ATOM 0 HG LEU A 26 5.943 -0.415 12.016 1.00 0.00 H new ATOM 0 HD11 LEU A 26 6.298 -2.054 13.820 1.00 0.00 H new ATOM 0 HD12 LEU A 26 5.444 -2.772 12.434 1.00 0.00 H new ATOM 0 HD13 LEU A 26 7.174 -3.108 12.685 1.00 0.00 H new ATOM 0 HD21 LEU A 26 7.918 -0.226 13.477 1.00 0.00 H new ATOM 0 HD22 LEU A 26 8.857 -1.207 12.328 1.00 0.00 H new ATOM 0 HD23 LEU A 26 8.246 0.392 11.841 1.00 0.00 H new ATOM 435 N TYR A 27 5.398 0.388 8.159 1.00 0.00 N ATOM 436 CA TYR A 27 5.565 1.122 6.908 1.00 0.00 C ATOM 437 C TYR A 27 6.581 2.247 7.071 1.00 0.00 C ATOM 438 O TYR A 27 6.394 3.153 7.882 1.00 0.00 O ATOM 439 CB TYR A 27 4.223 1.691 6.445 1.00 0.00 C ATOM 440 CG TYR A 27 3.220 0.634 6.045 1.00 0.00 C ATOM 441 CD1 TYR A 27 2.672 -0.224 6.990 1.00 0.00 C ATOM 442 CD2 TYR A 27 2.821 0.493 4.721 1.00 0.00 C ATOM 443 CE1 TYR A 27 1.755 -1.192 6.628 1.00 0.00 C ATOM 444 CE2 TYR A 27 1.904 -0.472 4.351 1.00 0.00 C ATOM 445 CZ TYR A 27 1.375 -1.313 5.308 1.00 0.00 C ATOM 446 OH TYR A 27 0.461 -2.275 4.944 1.00 0.00 O ATOM 0 H TYR A 27 4.936 0.916 8.899 1.00 0.00 H new ATOM 0 HA TYR A 27 5.937 0.429 6.153 1.00 0.00 H new ATOM 0 HB2 TYR A 27 3.799 2.296 7.246 1.00 0.00 H new ATOM 0 HB3 TYR A 27 4.393 2.356 5.599 1.00 0.00 H new ATOM 0 HD1 TYR A 27 2.968 -0.133 8.025 1.00 0.00 H new ATOM 0 HD2 TYR A 27 3.235 1.149 3.969 1.00 0.00 H new ATOM 0 HE1 TYR A 27 1.338 -1.851 7.375 1.00 0.00 H new ATOM 0 HE2 TYR A 27 1.603 -0.567 3.318 1.00 0.00 H new ATOM 0 HH TYR A 27 0.301 -2.226 3.978 1.00 0.00 H new ATOM 456 N ILE A 28 7.656 2.183 6.292 1.00 0.00 N ATOM 457 CA ILE A 28 8.702 3.197 6.349 1.00 0.00 C ATOM 458 C ILE A 28 9.190 3.564 4.950 1.00 0.00 C ATOM 459 O ILE A 28 9.098 2.761 4.021 1.00 0.00 O ATOM 460 CB ILE A 28 9.902 2.721 7.190 1.00 0.00 C ATOM 461 CG1 ILE A 28 10.421 1.381 6.667 1.00 0.00 C ATOM 462 CG2 ILE A 28 9.509 2.609 8.656 1.00 0.00 C ATOM 463 CD1 ILE A 28 11.928 1.255 6.719 1.00 0.00 C ATOM 0 H ILE A 28 7.825 1.440 5.614 1.00 0.00 H new ATOM 0 HA ILE A 28 8.263 4.076 6.821 1.00 0.00 H new ATOM 0 HB ILE A 28 10.702 3.456 7.103 1.00 0.00 H new ATOM 0 HG12 ILE A 28 9.977 0.575 7.251 1.00 0.00 H new ATOM 0 HG13 ILE A 28 10.089 1.249 5.637 1.00 0.00 H new ATOM 0 HG21 ILE A 28 10.367 2.272 9.238 1.00 0.00 H new ATOM 0 HG22 ILE A 28 9.183 3.583 9.021 1.00 0.00 H new ATOM 0 HG23 ILE A 28 8.695 1.892 8.761 1.00 0.00 H new ATOM 0 HD11 ILE A 28 12.225 0.280 6.333 1.00 0.00 H new ATOM 0 HD12 ILE A 28 12.380 2.039 6.111 1.00 0.00 H new ATOM 0 HD13 ILE A 28 12.266 1.355 7.750 1.00 0.00 H new ATOM 475 N PRO A 29 9.719 4.787 4.781 1.00 0.00 N ATOM 476 CA PRO A 29 10.223 5.258 3.487 1.00 0.00 C ATOM 477 C PRO A 29 11.484 4.518 3.053 1.00 0.00 C ATOM 478 O PRO A 29 11.987 3.654 3.772 1.00 0.00 O ATOM 479 CB PRO A 29 10.531 6.737 3.738 1.00 0.00 C ATOM 480 CG PRO A 29 10.768 6.831 5.206 1.00 0.00 C ATOM 481 CD PRO A 29 9.867 5.806 5.837 1.00 0.00 C ATOM 0 HA PRO A 29 9.503 5.090 2.686 1.00 0.00 H new ATOM 0 HB2 PRO A 29 11.406 7.060 3.174 1.00 0.00 H new ATOM 0 HB3 PRO A 29 9.701 7.372 3.430 1.00 0.00 H new ATOM 0 HG2 PRO A 29 11.813 6.633 5.446 1.00 0.00 H new ATOM 0 HG3 PRO A 29 10.540 7.831 5.575 1.00 0.00 H new ATOM 0 HD2 PRO A 29 10.307 5.386 6.742 1.00 0.00 H new ATOM 0 HD3 PRO A 29 8.906 6.235 6.119 1.00 0.00 H new ATOM 489 N ALA A 30 11.990 4.862 1.874 1.00 0.00 N ATOM 490 CA ALA A 30 13.193 4.230 1.344 1.00 0.00 C ATOM 491 C ALA A 30 14.276 5.265 1.060 1.00 0.00 C ATOM 492 O ALA A 30 14.248 5.943 0.034 1.00 0.00 O ATOM 493 CB ALA A 30 12.864 3.448 0.081 1.00 0.00 C ATOM 0 H ALA A 30 11.586 5.575 1.267 1.00 0.00 H new ATOM 0 HA ALA A 30 13.574 3.540 2.097 1.00 0.00 H new ATOM 0 HB1 ALA A 30 13.770 2.981 -0.304 1.00 0.00 H new ATOM 0 HB2 ALA A 30 12.129 2.677 0.312 1.00 0.00 H new ATOM 0 HB3 ALA A 30 12.457 4.125 -0.670 1.00 0.00 H new ATOM 499 N ILE A 31 15.232 5.380 1.977 1.00 0.00 N ATOM 500 CA ILE A 31 16.325 6.331 1.826 1.00 0.00 C ATOM 501 C ILE A 31 17.535 5.914 2.654 1.00 0.00 C ATOM 502 O ILE A 31 17.437 5.732 3.867 1.00 0.00 O ATOM 503 CB ILE A 31 15.897 7.751 2.243 1.00 0.00 C ATOM 504 CG1 ILE A 31 15.290 7.734 3.647 1.00 0.00 C ATOM 505 CG2 ILE A 31 14.907 8.323 1.237 1.00 0.00 C ATOM 506 CD1 ILE A 31 16.260 8.157 4.730 1.00 0.00 C ATOM 0 H ILE A 31 15.271 4.826 2.832 1.00 0.00 H new ATOM 0 HA ILE A 31 16.595 6.336 0.770 1.00 0.00 H new ATOM 0 HB ILE A 31 16.780 8.390 2.258 1.00 0.00 H new ATOM 0 HG12 ILE A 31 14.424 8.395 3.668 1.00 0.00 H new ATOM 0 HG13 ILE A 31 14.929 6.729 3.866 1.00 0.00 H new ATOM 0 HG21 ILE A 31 14.614 9.327 1.545 1.00 0.00 H new ATOM 0 HG22 ILE A 31 15.373 8.367 0.253 1.00 0.00 H new ATOM 0 HG23 ILE A 31 14.024 7.685 1.192 1.00 0.00 H new ATOM 0 HD11 ILE A 31 15.762 8.121 5.699 1.00 0.00 H new ATOM 0 HD12 ILE A 31 17.115 7.481 4.737 1.00 0.00 H new ATOM 0 HD13 ILE A 31 16.602 9.173 4.535 1.00 0.00 H new ATOM 518 N THR A 32 18.677 5.764 1.990 1.00 0.00 N ATOM 519 CA THR A 32 19.908 5.369 2.665 1.00 0.00 C ATOM 520 C THR A 32 21.130 5.892 1.919 1.00 0.00 C ATOM 521 O THR A 32 22.162 5.224 1.854 1.00 0.00 O ATOM 522 CB THR A 32 19.981 3.846 2.785 1.00 0.00 C ATOM 523 OG1 THR A 32 21.171 3.451 3.446 1.00 0.00 O ATOM 524 CG2 THR A 32 19.944 3.139 1.448 1.00 0.00 C ATOM 0 H THR A 32 18.775 5.910 0.985 1.00 0.00 H new ATOM 0 HA THR A 32 19.902 5.805 3.664 1.00 0.00 H new ATOM 0 HB THR A 32 19.098 3.559 3.356 1.00 0.00 H new ATOM 0 HG1 THR A 32 21.943 3.864 3.005 1.00 0.00 H new ATOM 0 HG21 THR A 32 19.999 2.062 1.604 1.00 0.00 H new ATOM 0 HG22 THR A 32 19.015 3.384 0.933 1.00 0.00 H new ATOM 0 HG23 THR A 32 20.791 3.462 0.842 1.00 0.00 H new ATOM 532 N TRP A 33 21.007 7.088 1.355 1.00 0.00 N ATOM 533 CA TRP A 33 22.102 7.700 0.613 1.00 0.00 C ATOM 534 C TRP A 33 21.871 9.198 0.434 1.00 0.00 C ATOM 535 O TRP A 33 21.470 9.650 -0.639 1.00 0.00 O ATOM 536 CB TRP A 33 22.258 7.026 -0.753 1.00 0.00 C ATOM 537 CG TRP A 33 23.406 6.065 -0.812 1.00 0.00 C ATOM 538 CD1 TRP A 33 24.605 6.180 -0.171 1.00 0.00 C ATOM 539 CD2 TRP A 33 23.463 4.843 -1.557 1.00 0.00 C ATOM 540 NE1 TRP A 33 25.405 5.103 -0.470 1.00 0.00 N ATOM 541 CE2 TRP A 33 24.726 4.269 -1.319 1.00 0.00 C ATOM 542 CE3 TRP A 33 22.570 4.177 -2.401 1.00 0.00 C ATOM 543 CZ2 TRP A 33 25.117 3.062 -1.895 1.00 0.00 C ATOM 544 CZ3 TRP A 33 22.957 2.980 -2.971 1.00 0.00 C ATOM 545 CH2 TRP A 33 24.222 2.432 -2.715 1.00 0.00 C ATOM 0 H TRP A 33 20.159 7.653 1.398 1.00 0.00 H new ATOM 0 HA TRP A 33 23.019 7.561 1.186 1.00 0.00 H new ATOM 0 HB2 TRP A 33 21.337 6.496 -0.996 1.00 0.00 H new ATOM 0 HB3 TRP A 33 22.396 7.793 -1.515 1.00 0.00 H new ATOM 0 HD1 TRP A 33 24.885 6.998 0.477 1.00 0.00 H new ATOM 0 HE1 TRP A 33 26.350 4.950 -0.117 1.00 0.00 H new ATOM 0 HE3 TRP A 33 21.594 4.591 -2.604 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 26.092 2.639 -1.701 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 22.274 2.458 -3.625 1.00 0.00 H new ATOM 0 HH2 TRP A 33 24.495 1.494 -3.175 1.00 0.00 H new ATOM 556 N HIS A 34 22.129 9.961 1.490 1.00 0.00 N ATOM 557 CA HIS A 34 21.950 11.408 1.449 1.00 0.00 C ATOM 558 C HIS A 34 23.285 12.113 1.225 1.00 0.00 C ATOM 559 O HIS A 34 23.352 13.136 0.543 1.00 0.00 O ATOM 560 CB HIS A 34 21.309 11.901 2.749 1.00 0.00 C ATOM 561 CG HIS A 34 19.863 12.262 2.603 1.00 0.00 C ATOM 562 ND1 HIS A 34 19.033 11.683 1.665 1.00 0.00 N ATOM 563 CD2 HIS A 34 19.098 13.148 3.283 1.00 0.00 C ATOM 564 CE1 HIS A 34 17.822 12.199 1.773 1.00 0.00 C ATOM 565 NE2 HIS A 34 17.835 13.089 2.748 1.00 0.00 N ATOM 0 H HIS A 34 22.463 9.602 2.385 1.00 0.00 H new ATOM 0 HA HIS A 34 21.289 11.646 0.615 1.00 0.00 H new ATOM 0 HB2 HIS A 34 21.407 11.126 3.510 1.00 0.00 H new ATOM 0 HB3 HIS A 34 21.858 12.771 3.108 1.00 0.00 H new ATOM 0 HD2 HIS A 34 19.421 13.783 4.095 1.00 0.00 H new ATOM 0 HE1 HIS A 34 16.967 11.937 1.167 1.00 0.00 H new ATOM 0 HE2 HIS A 34 17.036 13.643 3.054 1.00 0.00 H new ATOM 574 N ALA A 35 24.345 11.556 1.802 1.00 0.00 N ATOM 575 CA ALA A 35 25.679 12.129 1.665 1.00 0.00 C ATOM 576 C ALA A 35 26.483 11.399 0.593 1.00 0.00 C ATOM 577 O ALA A 35 27.379 11.976 -0.023 1.00 0.00 O ATOM 578 CB ALA A 35 26.410 12.084 2.998 1.00 0.00 C ATOM 0 H ALA A 35 24.306 10.709 2.369 1.00 0.00 H new ATOM 0 HA ALA A 35 25.572 13.169 1.356 1.00 0.00 H new ATOM 0 HB1 ALA A 35 27.405 12.515 2.882 1.00 0.00 H new ATOM 0 HB2 ALA A 35 25.851 12.656 3.739 1.00 0.00 H new ATOM 0 HB3 ALA A 35 26.499 11.049 3.329 1.00 0.00 H new ATOM 584 N ARG A 36 26.158 10.128 0.377 1.00 0.00 N ATOM 585 CA ARG A 36 26.850 9.319 -0.621 1.00 0.00 C ATOM 586 C ARG A 36 28.310 9.107 -0.233 1.00 0.00 C ATOM 587 O ARG A 36 29.194 9.083 -1.090 1.00 0.00 O ATOM 588 CB ARG A 36 26.763 9.981 -2.000 1.00 0.00 C ATOM 589 CG ARG A 36 26.320 9.034 -3.103 1.00 0.00 C ATOM 590 CD ARG A 36 27.502 8.301 -3.715 1.00 0.00 C ATOM 591 NE ARG A 36 27.204 6.891 -3.961 1.00 0.00 N ATOM 592 CZ ARG A 36 27.910 6.117 -4.782 1.00 0.00 C ATOM 593 NH1 ARG A 36 28.951 6.610 -5.439 1.00 0.00 N ATOM 594 NH2 ARG A 36 27.571 4.845 -4.947 1.00 0.00 N ATOM 0 H ARG A 36 25.420 9.636 0.880 1.00 0.00 H new ATOM 0 HA ARG A 36 26.361 8.346 -0.665 1.00 0.00 H new ATOM 0 HB2 ARG A 36 26.066 10.817 -1.949 1.00 0.00 H new ATOM 0 HB3 ARG A 36 27.738 10.394 -2.257 1.00 0.00 H new ATOM 0 HG2 ARG A 36 25.611 8.311 -2.700 1.00 0.00 H new ATOM 0 HG3 ARG A 36 25.798 9.595 -3.878 1.00 0.00 H new ATOM 0 HD2 ARG A 36 27.781 8.782 -4.653 1.00 0.00 H new ATOM 0 HD3 ARG A 36 28.361 8.379 -3.049 1.00 0.00 H new ATOM 0 HE ARG A 36 26.409 6.476 -3.475 1.00 0.00 H new ATOM 0 HH11 ARG A 36 29.215 7.588 -5.317 1.00 0.00 H new ATOM 0 HH12 ARG A 36 29.488 6.012 -6.067 1.00 0.00 H new ATOM 0 HH21 ARG A 36 26.770 4.461 -4.445 1.00 0.00 H new ATOM 0 HH22 ARG A 36 28.111 4.251 -5.576 1.00 0.00 H new ATOM 608 N PHE A 37 28.556 8.953 1.064 1.00 0.00 N ATOM 609 CA PHE A 37 29.907 8.742 1.567 1.00 0.00 C ATOM 610 C PHE A 37 29.885 7.942 2.866 1.00 0.00 C ATOM 611 O PHE A 37 30.064 8.496 3.951 1.00 0.00 O ATOM 612 CB PHE A 37 30.608 10.085 1.788 1.00 0.00 C ATOM 613 CG PHE A 37 31.629 10.409 0.735 1.00 0.00 C ATOM 614 CD1 PHE A 37 31.237 10.904 -0.499 1.00 0.00 C ATOM 615 CD2 PHE A 37 32.979 10.220 0.979 1.00 0.00 C ATOM 616 CE1 PHE A 37 32.175 11.204 -1.470 1.00 0.00 C ATOM 617 CE2 PHE A 37 33.921 10.517 0.012 1.00 0.00 C ATOM 618 CZ PHE A 37 33.517 11.010 -1.214 1.00 0.00 C ATOM 0 H PHE A 37 27.836 8.971 1.786 1.00 0.00 H new ATOM 0 HA PHE A 37 30.461 8.172 0.822 1.00 0.00 H new ATOM 0 HB2 PHE A 37 29.859 10.877 1.813 1.00 0.00 H new ATOM 0 HB3 PHE A 37 31.094 10.076 2.763 1.00 0.00 H new ATOM 0 HD1 PHE A 37 30.188 11.057 -0.704 1.00 0.00 H new ATOM 0 HD2 PHE A 37 33.300 9.836 1.936 1.00 0.00 H new ATOM 0 HE1 PHE A 37 31.858 11.590 -2.428 1.00 0.00 H new ATOM 0 HE2 PHE A 37 34.971 10.364 0.214 1.00 0.00 H new ATOM 0 HZ PHE A 37 34.251 11.243 -1.971 1.00 0.00 H new ATOM 628 N ALA A 38 29.662 6.637 2.747 1.00 0.00 N ATOM 629 CA ALA A 38 29.614 5.761 3.911 1.00 0.00 C ATOM 630 C ALA A 38 30.974 5.678 4.593 1.00 0.00 C ATOM 631 O ALA A 38 31.946 5.203 4.004 1.00 0.00 O ATOM 632 CB ALA A 38 29.138 4.373 3.506 1.00 0.00 C ATOM 0 H ALA A 38 29.512 6.163 1.856 1.00 0.00 H new ATOM 0 HA ALA A 38 28.906 6.183 4.624 1.00 0.00 H new ATOM 0 HB1 ALA A 38 29.107 3.728 4.384 1.00 0.00 H new ATOM 0 HB2 ALA A 38 28.141 4.443 3.071 1.00 0.00 H new ATOM 0 HB3 ALA A 38 29.825 3.953 2.772 1.00 0.00 H new ATOM 638 N TYR A 39 31.037 6.142 5.836 1.00 0.00 N ATOM 639 CA TYR A 39 32.279 6.118 6.599 1.00 0.00 C ATOM 640 C TYR A 39 32.315 4.920 7.541 1.00 0.00 C ATOM 641 O TYR A 39 31.513 4.823 8.470 1.00 0.00 O ATOM 642 CB TYR A 39 32.436 7.414 7.397 1.00 0.00 C ATOM 643 CG TYR A 39 31.190 7.817 8.151 1.00 0.00 C ATOM 644 CD1 TYR A 39 30.937 7.326 9.426 1.00 0.00 C ATOM 645 CD2 TYR A 39 30.264 8.688 7.589 1.00 0.00 C ATOM 646 CE1 TYR A 39 29.799 7.693 10.119 1.00 0.00 C ATOM 647 CE2 TYR A 39 29.124 9.058 8.275 1.00 0.00 C ATOM 648 CZ TYR A 39 28.895 8.558 9.539 1.00 0.00 C ATOM 649 OH TYR A 39 27.760 8.924 10.225 1.00 0.00 O ATOM 0 H TYR A 39 30.242 6.539 6.337 1.00 0.00 H new ATOM 0 HA TYR A 39 33.107 6.029 5.896 1.00 0.00 H new ATOM 0 HB2 TYR A 39 33.257 7.297 8.105 1.00 0.00 H new ATOM 0 HB3 TYR A 39 32.714 8.218 6.716 1.00 0.00 H new ATOM 0 HD1 TYR A 39 31.641 6.646 9.883 1.00 0.00 H new ATOM 0 HD2 TYR A 39 30.439 9.082 6.599 1.00 0.00 H new ATOM 0 HE1 TYR A 39 29.618 7.304 11.110 1.00 0.00 H new ATOM 0 HE2 TYR A 39 28.415 9.736 7.823 1.00 0.00 H new ATOM 0 HH TYR A 39 27.230 9.539 9.676 1.00 0.00 H new ATOM 659 N ASP A 40 33.251 4.008 7.296 1.00 0.00 N ATOM 660 CA ASP A 40 33.392 2.816 8.122 1.00 0.00 C ATOM 661 C ASP A 40 33.873 3.177 9.524 1.00 0.00 C ATOM 662 O ASP A 40 34.497 4.219 9.728 1.00 0.00 O ATOM 663 CB ASP A 40 34.367 1.832 7.474 1.00 0.00 C ATOM 664 CG ASP A 40 33.672 0.853 6.548 1.00 0.00 C ATOM 665 OD1 ASP A 40 34.027 -0.344 6.575 1.00 0.00 O ATOM 666 OD2 ASP A 40 32.772 1.284 5.797 1.00 0.00 O ATOM 0 H ASP A 40 33.923 4.073 6.531 1.00 0.00 H new ATOM 0 HA ASP A 40 32.412 2.345 8.204 1.00 0.00 H new ATOM 0 HB2 ASP A 40 35.119 2.387 6.913 1.00 0.00 H new ATOM 0 HB3 ASP A 40 34.893 1.280 8.253 1.00 0.00 H new ATOM 672 N LYS A 41 33.579 2.310 10.487 1.00 0.00 N ATOM 673 CA LYS A 41 33.981 2.537 11.871 1.00 0.00 C ATOM 674 C LYS A 41 35.002 1.494 12.318 1.00 0.00 C ATOM 675 O LYS A 41 36.097 1.836 12.763 1.00 0.00 O ATOM 676 CB LYS A 41 32.760 2.500 12.792 1.00 0.00 C ATOM 677 CG LYS A 41 31.772 3.626 12.534 1.00 0.00 C ATOM 678 CD LYS A 41 30.452 3.383 13.249 1.00 0.00 C ATOM 679 CE LYS A 41 30.376 4.156 14.556 1.00 0.00 C ATOM 680 NZ LYS A 41 29.006 4.680 14.811 1.00 0.00 N ATOM 0 H LYS A 41 33.064 1.443 10.335 1.00 0.00 H new ATOM 0 HA LYS A 41 34.443 3.522 11.932 1.00 0.00 H new ATOM 0 HB2 LYS A 41 32.250 1.545 12.668 1.00 0.00 H new ATOM 0 HB3 LYS A 41 33.095 2.551 13.828 1.00 0.00 H new ATOM 0 HG2 LYS A 41 32.200 4.571 12.869 1.00 0.00 H new ATOM 0 HG3 LYS A 41 31.595 3.718 11.462 1.00 0.00 H new ATOM 0 HD2 LYS A 41 29.626 3.679 12.602 1.00 0.00 H new ATOM 0 HD3 LYS A 41 30.335 2.318 13.448 1.00 0.00 H new ATOM 0 HE2 LYS A 41 30.676 3.508 15.379 1.00 0.00 H new ATOM 0 HE3 LYS A 41 31.083 4.985 14.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 28.995 5.201 15.711 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 28.729 5.319 14.038 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 28.335 3.887 14.862 1.00 0.00 H new ATOM 694 N GLU A 42 34.634 0.223 12.195 1.00 0.00 N ATOM 695 CA GLU A 42 35.518 -0.869 12.586 1.00 0.00 C ATOM 696 C GLU A 42 34.889 -2.220 12.259 1.00 0.00 C ATOM 697 O GLU A 42 34.394 -2.917 13.145 1.00 0.00 O ATOM 698 CB GLU A 42 35.834 -0.787 14.080 1.00 0.00 C ATOM 699 CG GLU A 42 34.597 -0.788 14.964 1.00 0.00 C ATOM 700 CD GLU A 42 34.740 0.124 16.167 1.00 0.00 C ATOM 701 OE1 GLU A 42 33.745 0.786 16.531 1.00 0.00 O ATOM 702 OE2 GLU A 42 35.846 0.177 16.744 1.00 0.00 O ATOM 0 H GLU A 42 33.731 -0.076 11.828 1.00 0.00 H new ATOM 0 HA GLU A 42 36.445 -0.774 12.021 1.00 0.00 H new ATOM 0 HB2 GLU A 42 36.468 -1.630 14.356 1.00 0.00 H new ATOM 0 HB3 GLU A 42 36.407 0.120 14.272 1.00 0.00 H new ATOM 0 HG2 GLU A 42 33.734 -0.475 14.376 1.00 0.00 H new ATOM 0 HG3 GLU A 42 34.399 -1.804 15.305 1.00 0.00 H new ATOM 710 N LYS A 43 34.913 -2.584 10.980 1.00 0.00 N ATOM 711 CA LYS A 43 34.347 -3.853 10.536 1.00 0.00 C ATOM 712 C LYS A 43 32.861 -3.933 10.871 1.00 0.00 C ATOM 713 O LYS A 43 32.331 -5.012 11.132 1.00 0.00 O ATOM 714 CB LYS A 43 35.091 -5.023 11.181 1.00 0.00 C ATOM 715 CG LYS A 43 34.866 -6.350 10.473 1.00 0.00 C ATOM 716 CD LYS A 43 35.124 -7.526 11.402 1.00 0.00 C ATOM 717 CE LYS A 43 34.714 -8.841 10.759 1.00 0.00 C ATOM 718 NZ LYS A 43 33.327 -9.233 11.130 1.00 0.00 N ATOM 0 H LYS A 43 35.318 -2.019 10.234 1.00 0.00 H new ATOM 0 HA LYS A 43 34.461 -3.913 9.454 1.00 0.00 H new ATOM 0 HB2 LYS A 43 36.158 -4.803 11.192 1.00 0.00 H new ATOM 0 HB3 LYS A 43 34.774 -5.116 12.220 1.00 0.00 H new ATOM 0 HG2 LYS A 43 33.843 -6.396 10.101 1.00 0.00 H new ATOM 0 HG3 LYS A 43 35.524 -6.418 9.607 1.00 0.00 H new ATOM 0 HD2 LYS A 43 36.182 -7.561 11.662 1.00 0.00 H new ATOM 0 HD3 LYS A 43 34.572 -7.386 12.331 1.00 0.00 H new ATOM 0 HE2 LYS A 43 34.789 -8.754 9.675 1.00 0.00 H new ATOM 0 HE3 LYS A 43 35.407 -9.625 11.064 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 33.087 -10.135 10.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 33.261 -9.342 12.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 32.663 -8.497 10.816 1.00 0.00 H new ATOM 732 N THR A 44 32.194 -2.783 10.862 1.00 0.00 N ATOM 733 CA THR A 44 30.769 -2.723 11.165 1.00 0.00 C ATOM 734 C THR A 44 30.106 -1.561 10.433 1.00 0.00 C ATOM 735 O THR A 44 30.758 -0.572 10.097 1.00 0.00 O ATOM 736 CB THR A 44 30.553 -2.582 12.672 1.00 0.00 C ATOM 737 OG1 THR A 44 31.615 -1.859 13.267 1.00 0.00 O ATOM 738 CG2 THR A 44 30.444 -3.911 13.388 1.00 0.00 C ATOM 0 H THR A 44 32.618 -1.880 10.648 1.00 0.00 H new ATOM 0 HA THR A 44 30.311 -3.652 10.825 1.00 0.00 H new ATOM 0 HB THR A 44 29.607 -2.051 12.779 1.00 0.00 H new ATOM 0 HG1 THR A 44 32.427 -2.408 13.264 1.00 0.00 H new ATOM 0 HG21 THR A 44 30.292 -3.739 14.453 1.00 0.00 H new ATOM 0 HG22 THR A 44 29.600 -4.472 12.987 1.00 0.00 H new ATOM 0 HG23 THR A 44 31.362 -4.480 13.240 1.00 0.00 H new ATOM 746 N ASP A 45 28.806 -1.687 10.189 1.00 0.00 N ATOM 747 CA ASP A 45 28.054 -0.648 9.495 1.00 0.00 C ATOM 748 C ASP A 45 26.926 -0.116 10.374 1.00 0.00 C ATOM 749 O ASP A 45 26.746 1.096 10.505 1.00 0.00 O ATOM 750 CB ASP A 45 27.482 -1.191 8.185 1.00 0.00 C ATOM 751 CG ASP A 45 28.426 -0.993 7.016 1.00 0.00 C ATOM 752 OD1 ASP A 45 28.558 -1.926 6.196 1.00 0.00 O ATOM 753 OD2 ASP A 45 29.033 0.094 6.921 1.00 0.00 O ATOM 0 H ASP A 45 28.251 -2.498 10.462 1.00 0.00 H new ATOM 0 HA ASP A 45 28.736 0.172 9.272 1.00 0.00 H new ATOM 0 HB2 ASP A 45 27.267 -2.253 8.299 1.00 0.00 H new ATOM 0 HB3 ASP A 45 26.535 -0.695 7.972 1.00 0.00 H new ATOM 759 N ARG A 46 26.169 -1.028 10.974 1.00 0.00 N ATOM 760 CA ARG A 46 25.059 -0.650 11.840 1.00 0.00 C ATOM 761 C ARG A 46 24.022 0.165 11.071 1.00 0.00 C ATOM 762 O ARG A 46 24.302 0.683 9.991 1.00 0.00 O ATOM 763 CB ARG A 46 25.569 0.154 13.038 1.00 0.00 C ATOM 764 CG ARG A 46 25.998 -0.711 14.212 1.00 0.00 C ATOM 765 CD ARG A 46 25.662 -0.052 15.541 1.00 0.00 C ATOM 766 NE ARG A 46 26.706 -0.272 16.540 1.00 0.00 N ATOM 767 CZ ARG A 46 26.629 0.155 17.798 1.00 0.00 C ATOM 768 NH1 ARG A 46 25.561 0.825 18.215 1.00 0.00 N ATOM 769 NH2 ARG A 46 27.623 -0.086 18.642 1.00 0.00 N ATOM 0 H ARG A 46 26.304 -2.034 10.876 1.00 0.00 H new ATOM 0 HA ARG A 46 24.585 -1.563 12.199 1.00 0.00 H new ATOM 0 HB2 ARG A 46 26.413 0.767 12.721 1.00 0.00 H new ATOM 0 HB3 ARG A 46 24.785 0.836 13.367 1.00 0.00 H new ATOM 0 HG2 ARG A 46 25.504 -1.681 14.150 1.00 0.00 H new ATOM 0 HG3 ARG A 46 27.071 -0.895 14.157 1.00 0.00 H new ATOM 0 HD2 ARG A 46 25.524 1.019 15.390 1.00 0.00 H new ATOM 0 HD3 ARG A 46 24.716 -0.446 15.912 1.00 0.00 H new ATOM 0 HE ARG A 46 27.542 -0.783 16.256 1.00 0.00 H new ATOM 0 HH11 ARG A 46 24.794 1.015 17.570 1.00 0.00 H new ATOM 0 HH12 ARG A 46 25.508 1.150 19.180 1.00 0.00 H new ATOM 0 HH21 ARG A 46 28.447 -0.599 18.327 1.00 0.00 H new ATOM 0 HH22 ARG A 46 27.564 0.241 19.606 1.00 0.00 H new ATOM 783 N TYR A 47 22.825 0.273 11.637 1.00 0.00 N ATOM 784 CA TYR A 47 21.747 1.025 11.006 1.00 0.00 C ATOM 785 C TYR A 47 21.574 2.388 11.667 1.00 0.00 C ATOM 786 O TYR A 47 21.516 2.491 12.892 1.00 0.00 O ATOM 787 CB TYR A 47 20.436 0.237 11.078 1.00 0.00 C ATOM 788 CG TYR A 47 19.645 0.260 9.790 1.00 0.00 C ATOM 789 CD1 TYR A 47 20.235 -0.094 8.583 1.00 0.00 C ATOM 790 CD2 TYR A 47 18.307 0.635 9.781 1.00 0.00 C ATOM 791 CE1 TYR A 47 19.515 -0.074 7.403 1.00 0.00 C ATOM 792 CE2 TYR A 47 17.580 0.657 8.605 1.00 0.00 C ATOM 793 CZ TYR A 47 18.188 0.302 7.420 1.00 0.00 C ATOM 794 OH TYR A 47 17.468 0.323 6.248 1.00 0.00 O ATOM 0 H TYR A 47 22.577 -0.150 12.531 1.00 0.00 H new ATOM 0 HA TYR A 47 22.011 1.181 9.960 1.00 0.00 H new ATOM 0 HB2 TYR A 47 20.658 -0.798 11.340 1.00 0.00 H new ATOM 0 HB3 TYR A 47 19.820 0.644 11.880 1.00 0.00 H new ATOM 0 HD1 TYR A 47 21.274 -0.390 8.566 1.00 0.00 H new ATOM 0 HD2 TYR A 47 17.827 0.914 10.708 1.00 0.00 H new ATOM 0 HE1 TYR A 47 19.989 -0.351 6.473 1.00 0.00 H new ATOM 0 HE2 TYR A 47 16.541 0.951 8.615 1.00 0.00 H new ATOM 0 HH TYR A 47 16.549 0.609 6.434 1.00 0.00 H new ATOM 804 N ASN A 48 21.493 3.431 10.848 1.00 0.00 N ATOM 805 CA ASN A 48 21.327 4.789 11.354 1.00 0.00 C ATOM 806 C ASN A 48 19.861 5.087 11.649 1.00 0.00 C ATOM 807 O ASN A 48 18.997 4.917 10.788 1.00 0.00 O ATOM 808 CB ASN A 48 21.870 5.801 10.344 1.00 0.00 C ATOM 809 CG ASN A 48 23.309 5.516 9.956 1.00 0.00 C ATOM 810 OD1 ASN A 48 23.576 4.698 9.077 1.00 0.00 O ATOM 811 ND2 ASN A 48 24.244 6.193 10.612 1.00 0.00 N ATOM 0 H ASN A 48 21.540 3.362 9.831 1.00 0.00 H new ATOM 0 HA ASN A 48 21.890 4.873 12.284 1.00 0.00 H new ATOM 0 HB2 ASN A 48 21.246 5.789 9.450 1.00 0.00 H new ATOM 0 HB3 ASN A 48 21.802 6.804 10.766 1.00 0.00 H new ATOM 0 HD21 ASN A 48 25.229 6.044 10.394 1.00 0.00 H new ATOM 0 HD22 ASN A 48 23.977 6.862 11.334 1.00 0.00 H new ATOM 818 N GLU A 49 19.587 5.531 12.872 1.00 0.00 N ATOM 819 CA GLU A 49 18.225 5.853 13.280 1.00 0.00 C ATOM 820 C GLU A 49 17.824 7.241 12.788 1.00 0.00 C ATOM 821 O GLU A 49 18.532 8.220 13.022 1.00 0.00 O ATOM 822 CB GLU A 49 18.095 5.780 14.803 1.00 0.00 C ATOM 823 CG GLU A 49 17.617 4.429 15.309 1.00 0.00 C ATOM 824 CD GLU A 49 18.718 3.387 15.319 1.00 0.00 C ATOM 825 OE1 GLU A 49 18.456 2.243 14.894 1.00 0.00 O ATOM 826 OE2 GLU A 49 19.842 3.716 15.753 1.00 0.00 O ATOM 0 H GLU A 49 20.290 5.676 13.597 1.00 0.00 H new ATOM 0 HA GLU A 49 17.554 5.120 12.831 1.00 0.00 H new ATOM 0 HB2 GLU A 49 19.062 6.006 15.253 1.00 0.00 H new ATOM 0 HB3 GLU A 49 17.400 6.550 15.137 1.00 0.00 H new ATOM 0 HG2 GLU A 49 17.220 4.543 16.318 1.00 0.00 H new ATOM 0 HG3 GLU A 49 16.797 4.080 14.682 1.00 0.00 H new ATOM 834 N ARG A 50 16.686 7.316 12.106 1.00 0.00 N ATOM 835 CA ARG A 50 16.193 8.584 11.582 1.00 0.00 C ATOM 836 C ARG A 50 14.718 8.778 11.922 1.00 0.00 C ATOM 837 O ARG A 50 13.839 8.390 11.153 1.00 0.00 O ATOM 838 CB ARG A 50 16.391 8.643 10.066 1.00 0.00 C ATOM 839 CG ARG A 50 17.834 8.438 9.633 1.00 0.00 C ATOM 840 CD ARG A 50 18.469 9.737 9.160 1.00 0.00 C ATOM 841 NE ARG A 50 18.291 10.817 10.126 1.00 0.00 N ATOM 842 CZ ARG A 50 18.982 11.954 10.103 1.00 0.00 C ATOM 843 NH1 ARG A 50 19.897 12.164 9.165 1.00 0.00 N ATOM 844 NH2 ARG A 50 18.758 12.885 11.021 1.00 0.00 N ATOM 0 H ARG A 50 16.089 6.514 11.903 1.00 0.00 H new ATOM 0 HA ARG A 50 16.763 9.388 12.048 1.00 0.00 H new ATOM 0 HB2 ARG A 50 15.768 7.882 9.597 1.00 0.00 H new ATOM 0 HB3 ARG A 50 16.044 9.609 9.700 1.00 0.00 H new ATOM 0 HG2 ARG A 50 18.410 8.033 10.465 1.00 0.00 H new ATOM 0 HG3 ARG A 50 17.872 7.701 8.831 1.00 0.00 H new ATOM 0 HD2 ARG A 50 19.533 9.578 8.986 1.00 0.00 H new ATOM 0 HD3 ARG A 50 18.030 10.028 8.206 1.00 0.00 H new ATOM 0 HE ARG A 50 17.596 10.693 10.862 1.00 0.00 H new ATOM 0 HH11 ARG A 50 20.074 11.452 8.456 1.00 0.00 H new ATOM 0 HH12 ARG A 50 20.423 13.038 9.153 1.00 0.00 H new ATOM 0 HH21 ARG A 50 18.056 12.729 11.745 1.00 0.00 H new ATOM 0 HH22 ARG A 50 19.288 13.757 11.003 1.00 0.00 H new ATOM 858 N PRO A 51 14.425 9.385 13.087 1.00 0.00 N ATOM 859 CA PRO A 51 13.046 9.628 13.524 1.00 0.00 C ATOM 860 C PRO A 51 12.337 10.661 12.654 1.00 0.00 C ATOM 861 O PRO A 51 12.603 11.858 12.753 1.00 0.00 O ATOM 862 CB PRO A 51 13.209 10.154 14.952 1.00 0.00 C ATOM 863 CG PRO A 51 14.584 10.725 14.993 1.00 0.00 C ATOM 864 CD PRO A 51 15.411 9.880 14.064 1.00 0.00 C ATOM 0 HA PRO A 51 12.434 8.729 13.456 1.00 0.00 H new ATOM 0 HB2 PRO A 51 12.459 10.911 15.183 1.00 0.00 H new ATOM 0 HB3 PRO A 51 13.091 9.355 15.684 1.00 0.00 H new ATOM 0 HG2 PRO A 51 14.583 11.768 14.675 1.00 0.00 H new ATOM 0 HG3 PRO A 51 14.987 10.700 16.006 1.00 0.00 H new ATOM 0 HD2 PRO A 51 16.197 10.462 13.583 1.00 0.00 H new ATOM 0 HD3 PRO A 51 15.899 9.061 14.592 1.00 0.00 H new ATOM 872 N TRP A 52 11.435 10.187 11.800 1.00 0.00 N ATOM 873 CA TRP A 52 10.686 11.069 10.910 1.00 0.00 C ATOM 874 C TRP A 52 9.206 10.706 10.906 1.00 0.00 C ATOM 875 O TRP A 52 8.343 11.578 11.015 1.00 0.00 O ATOM 876 CB TRP A 52 11.248 10.987 9.489 1.00 0.00 C ATOM 877 CG TRP A 52 11.268 12.308 8.781 1.00 0.00 C ATOM 878 CD1 TRP A 52 10.232 13.189 8.661 1.00 0.00 C ATOM 879 CD2 TRP A 52 12.378 12.896 8.094 1.00 0.00 C ATOM 880 NE1 TRP A 52 10.630 14.289 7.940 1.00 0.00 N ATOM 881 CE2 TRP A 52 11.944 14.133 7.582 1.00 0.00 C ATOM 882 CE3 TRP A 52 13.698 12.498 7.863 1.00 0.00 C ATOM 883 CZ2 TRP A 52 12.781 14.973 6.853 1.00 0.00 C ATOM 884 CZ3 TRP A 52 14.529 13.332 7.140 1.00 0.00 C ATOM 885 CH2 TRP A 52 14.068 14.558 6.643 1.00 0.00 C ATOM 0 H TRP A 52 11.205 9.198 11.705 1.00 0.00 H new ATOM 0 HA TRP A 52 10.790 12.090 11.277 1.00 0.00 H new ATOM 0 HB2 TRP A 52 12.262 10.589 9.529 1.00 0.00 H new ATOM 0 HB3 TRP A 52 10.652 10.282 8.910 1.00 0.00 H new ATOM 0 HD1 TRP A 52 9.244 13.043 9.073 1.00 0.00 H new ATOM 0 HE1 TRP A 52 10.043 15.091 7.709 1.00 0.00 H new ATOM 0 HE3 TRP A 52 14.062 11.555 8.243 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 12.428 15.918 6.467 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 15.550 13.034 6.955 1.00 0.00 H new ATOM 0 HH2 TRP A 52 14.742 15.189 6.083 1.00 0.00 H new ATOM 896 N GLY A 53 8.918 9.415 10.779 1.00 0.00 N ATOM 897 CA GLY A 53 7.541 8.959 10.762 1.00 0.00 C ATOM 898 C GLY A 53 7.422 7.494 10.392 1.00 0.00 C ATOM 899 O GLY A 53 8.428 6.820 10.166 1.00 0.00 O ATOM 0 H GLY A 53 9.615 8.676 10.687 1.00 0.00 H new ATOM 0 HA2 GLY A 53 7.096 9.120 11.744 1.00 0.00 H new ATOM 0 HA3 GLY A 53 6.972 9.558 10.051 1.00 0.00 H new ATOM 903 N GLY A 54 6.191 6.998 10.330 1.00 0.00 N ATOM 904 CA GLY A 54 5.971 5.606 9.984 1.00 0.00 C ATOM 905 C GLY A 54 4.599 5.112 10.400 1.00 0.00 C ATOM 906 O GLY A 54 3.795 5.873 10.941 1.00 0.00 O ATOM 0 H GLY A 54 5.343 7.534 10.513 1.00 0.00 H new ATOM 0 HA2 GLY A 54 6.088 5.480 8.908 1.00 0.00 H new ATOM 0 HA3 GLY A 54 6.735 4.992 10.461 1.00 0.00 H new ATOM 910 N GLY A 55 4.330 3.835 10.149 1.00 0.00 N ATOM 911 CA GLY A 55 3.047 3.263 10.508 1.00 0.00 C ATOM 912 C GLY A 55 3.156 1.811 10.929 1.00 0.00 C ATOM 913 O GLY A 55 4.150 1.146 10.635 1.00 0.00 O ATOM 0 H GLY A 55 4.979 3.186 9.703 1.00 0.00 H new ATOM 0 HA2 GLY A 55 2.610 3.842 11.321 1.00 0.00 H new ATOM 0 HA3 GLY A 55 2.367 3.342 9.659 1.00 0.00 H new ATOM 917 N PHE A 56 2.133 1.318 11.619 1.00 0.00 N ATOM 918 CA PHE A 56 2.117 -0.065 12.082 1.00 0.00 C ATOM 919 C PHE A 56 0.687 -0.581 12.206 1.00 0.00 C ATOM 920 O PHE A 56 -0.216 0.155 12.602 1.00 0.00 O ATOM 921 CB PHE A 56 2.832 -0.180 13.429 1.00 0.00 C ATOM 922 CG PHE A 56 2.322 0.784 14.463 1.00 0.00 C ATOM 923 CD1 PHE A 56 2.652 2.128 14.397 1.00 0.00 C ATOM 924 CD2 PHE A 56 1.515 0.345 15.499 1.00 0.00 C ATOM 925 CE1 PHE A 56 2.185 3.017 15.346 1.00 0.00 C ATOM 926 CE2 PHE A 56 1.045 1.230 16.451 1.00 0.00 C ATOM 927 CZ PHE A 56 1.380 2.567 16.374 1.00 0.00 C ATOM 0 H PHE A 56 1.304 1.856 11.870 1.00 0.00 H new ATOM 0 HA PHE A 56 2.641 -0.675 11.346 1.00 0.00 H new ATOM 0 HB2 PHE A 56 2.720 -1.197 13.805 1.00 0.00 H new ATOM 0 HB3 PHE A 56 3.899 -0.011 13.281 1.00 0.00 H new ATOM 0 HD1 PHE A 56 3.281 2.485 13.595 1.00 0.00 H new ATOM 0 HD2 PHE A 56 1.250 -0.700 15.564 1.00 0.00 H new ATOM 0 HE1 PHE A 56 2.449 4.062 15.284 1.00 0.00 H new ATOM 0 HE2 PHE A 56 0.416 0.876 17.254 1.00 0.00 H new ATOM 0 HZ PHE A 56 1.013 3.260 17.117 1.00 0.00 H new ATOM 937 N GLY A 57 0.490 -1.850 11.864 1.00 0.00 N ATOM 938 CA GLY A 57 -0.832 -2.442 11.945 1.00 0.00 C ATOM 939 C GLY A 57 -0.799 -3.954 11.859 1.00 0.00 C ATOM 940 O GLY A 57 0.212 -4.579 12.185 1.00 0.00 O ATOM 0 H GLY A 57 1.222 -2.478 11.532 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -1.302 -2.145 12.883 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -1.452 -2.049 11.139 1.00 0.00 H new ATOM 944 N LEU A 58 -1.905 -4.545 11.421 1.00 0.00 N ATOM 945 CA LEU A 58 -1.999 -5.995 11.293 1.00 0.00 C ATOM 946 C LEU A 58 -2.569 -6.385 9.934 1.00 0.00 C ATOM 947 O LEU A 58 -2.933 -5.525 9.132 1.00 0.00 O ATOM 948 CB LEU A 58 -2.872 -6.570 12.410 1.00 0.00 C ATOM 949 CG LEU A 58 -2.262 -6.493 13.812 1.00 0.00 C ATOM 950 CD1 LEU A 58 -2.620 -5.173 14.477 1.00 0.00 C ATOM 951 CD2 LEU A 58 -2.733 -7.664 14.661 1.00 0.00 C ATOM 0 H LEU A 58 -2.750 -4.042 11.148 1.00 0.00 H new ATOM 0 HA LEU A 58 -0.994 -6.409 11.377 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.825 -6.041 12.415 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -3.088 -7.613 12.181 1.00 0.00 H new ATOM 0 HG LEU A 58 -1.177 -6.548 13.720 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -2.178 -5.136 15.473 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -2.235 -4.348 13.878 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -3.704 -5.088 14.558 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.290 -7.594 15.655 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -3.819 -7.639 14.745 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -2.427 -8.599 14.192 1.00 0.00 H new ATOM 963 N SER A 59 -2.646 -7.688 9.682 1.00 0.00 N ATOM 964 CA SER A 59 -3.172 -8.191 8.419 1.00 0.00 C ATOM 965 C SER A 59 -3.974 -9.471 8.635 1.00 0.00 C ATOM 966 O SER A 59 -3.595 -10.325 9.437 1.00 0.00 O ATOM 967 CB SER A 59 -2.032 -8.452 7.434 1.00 0.00 C ATOM 968 OG SER A 59 -1.715 -7.282 6.699 1.00 0.00 O ATOM 0 H SER A 59 -2.351 -8.414 10.335 1.00 0.00 H new ATOM 0 HA SER A 59 -3.835 -7.432 8.004 1.00 0.00 H new ATOM 0 HB2 SER A 59 -1.150 -8.795 7.976 1.00 0.00 H new ATOM 0 HB3 SER A 59 -2.315 -9.250 6.748 1.00 0.00 H new ATOM 0 HG SER A 59 -1.229 -7.529 5.884 1.00 0.00 H new ATOM 974 N ARG A 60 -5.084 -9.596 7.915 1.00 0.00 N ATOM 975 CA ARG A 60 -5.941 -10.772 8.027 1.00 0.00 C ATOM 976 C ARG A 60 -6.089 -11.467 6.679 1.00 0.00 C ATOM 977 O ARG A 60 -6.042 -10.825 5.630 1.00 0.00 O ATOM 978 CB ARG A 60 -7.317 -10.376 8.565 1.00 0.00 C ATOM 979 CG ARG A 60 -8.092 -11.537 9.167 1.00 0.00 C ATOM 980 CD ARG A 60 -9.577 -11.435 8.860 1.00 0.00 C ATOM 981 NE ARG A 60 -10.272 -10.560 9.799 1.00 0.00 N ATOM 982 CZ ARG A 60 -10.635 -10.927 11.026 1.00 0.00 C ATOM 983 NH1 ARG A 60 -10.369 -12.151 11.465 1.00 0.00 N ATOM 984 NH2 ARG A 60 -11.263 -10.068 11.817 1.00 0.00 N ATOM 0 H ARG A 60 -5.412 -8.898 7.248 1.00 0.00 H new ATOM 0 HA ARG A 60 -5.473 -11.467 8.724 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -7.193 -9.602 9.322 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -7.903 -9.940 7.756 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -7.703 -12.477 8.776 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -7.943 -11.554 10.247 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -9.712 -11.059 7.846 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -10.023 -12.429 8.893 1.00 0.00 H new ATOM 0 HE ARG A 60 -10.493 -9.611 9.497 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -9.884 -12.815 10.861 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -10.649 -12.427 12.406 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -11.468 -9.125 11.485 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -11.541 -10.350 12.757 1.00 0.00 H new ATOM 998 N TRP A 61 -6.271 -12.783 6.713 1.00 0.00 N ATOM 999 CA TRP A 61 -6.427 -13.566 5.494 1.00 0.00 C ATOM 1000 C TRP A 61 -7.830 -14.159 5.405 1.00 0.00 C ATOM 1001 O TRP A 61 -8.387 -14.613 6.404 1.00 0.00 O ATOM 1002 CB TRP A 61 -5.384 -14.684 5.443 1.00 0.00 C ATOM 1003 CG TRP A 61 -5.336 -15.392 4.124 1.00 0.00 C ATOM 1004 CD1 TRP A 61 -4.705 -14.971 2.990 1.00 0.00 C ATOM 1005 CD2 TRP A 61 -5.943 -16.649 3.802 1.00 0.00 C ATOM 1006 NE1 TRP A 61 -4.883 -15.887 1.982 1.00 0.00 N ATOM 1007 CE2 TRP A 61 -5.639 -16.927 2.456 1.00 0.00 C ATOM 1008 CE3 TRP A 61 -6.713 -17.567 4.522 1.00 0.00 C ATOM 1009 CZ2 TRP A 61 -6.079 -18.083 1.816 1.00 0.00 C ATOM 1010 CZ3 TRP A 61 -7.149 -18.714 3.886 1.00 0.00 C ATOM 1011 CH2 TRP A 61 -6.831 -18.963 2.545 1.00 0.00 C ATOM 0 H TRP A 61 -6.314 -13.330 7.573 1.00 0.00 H new ATOM 0 HA TRP A 61 -6.278 -12.901 4.643 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -4.401 -14.264 5.658 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -5.600 -15.408 6.228 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -4.147 -14.051 2.898 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -4.513 -15.806 1.035 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -6.963 -17.383 5.557 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -5.835 -18.278 0.782 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -7.745 -19.430 4.432 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -7.187 -19.869 2.077 1.00 0.00 H new ATOM 1022 N ASP A 62 -8.395 -14.151 4.201 1.00 0.00 N ATOM 1023 CA ASP A 62 -9.733 -14.688 3.983 1.00 0.00 C ATOM 1024 C ASP A 62 -9.677 -15.972 3.162 1.00 0.00 C ATOM 1025 O ASP A 62 -8.926 -16.068 2.190 1.00 0.00 O ATOM 1026 CB ASP A 62 -10.612 -13.655 3.275 1.00 0.00 C ATOM 1027 CG ASP A 62 -12.085 -13.852 3.568 1.00 0.00 C ATOM 1028 OD1 ASP A 62 -12.780 -14.466 2.731 1.00 0.00 O ATOM 1029 OD2 ASP A 62 -12.546 -13.393 4.634 1.00 0.00 O ATOM 0 H ASP A 62 -7.947 -13.779 3.363 1.00 0.00 H new ATOM 0 HA ASP A 62 -10.167 -14.918 4.956 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -10.313 -12.654 3.586 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -10.447 -13.718 2.199 1.00 0.00 H new ATOM 1035 N GLU A 63 -10.477 -16.957 3.562 1.00 0.00 N ATOM 1036 CA GLU A 63 -10.523 -18.240 2.869 1.00 0.00 C ATOM 1037 C GLU A 63 -10.890 -18.065 1.396 1.00 0.00 C ATOM 1038 O GLU A 63 -10.629 -18.946 0.576 1.00 0.00 O ATOM 1039 CB GLU A 63 -11.529 -19.172 3.547 1.00 0.00 C ATOM 1040 CG GLU A 63 -11.386 -20.627 3.131 1.00 0.00 C ATOM 1041 CD GLU A 63 -10.549 -21.431 4.107 1.00 0.00 C ATOM 1042 OE1 GLU A 63 -9.896 -22.401 3.669 1.00 0.00 O ATOM 1043 OE2 GLU A 63 -10.548 -21.092 5.309 1.00 0.00 O ATOM 0 H GLU A 63 -11.103 -16.890 4.364 1.00 0.00 H new ATOM 0 HA GLU A 63 -9.528 -18.682 2.922 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -11.409 -19.098 4.628 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -12.539 -18.834 3.315 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -12.375 -21.077 3.049 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -10.931 -20.676 2.142 1.00 0.00 H new ATOM 1051 N LYS A 64 -11.497 -16.929 1.065 1.00 0.00 N ATOM 1052 CA LYS A 64 -11.895 -16.650 -0.311 1.00 0.00 C ATOM 1053 C LYS A 64 -10.799 -15.899 -1.065 1.00 0.00 C ATOM 1054 O LYS A 64 -11.077 -15.174 -2.020 1.00 0.00 O ATOM 1055 CB LYS A 64 -13.192 -15.838 -0.331 1.00 0.00 C ATOM 1056 CG LYS A 64 -14.441 -16.690 -0.489 1.00 0.00 C ATOM 1057 CD LYS A 64 -15.483 -16.000 -1.355 1.00 0.00 C ATOM 1058 CE LYS A 64 -16.605 -15.411 -0.515 1.00 0.00 C ATOM 1059 NZ LYS A 64 -16.407 -13.956 -0.266 1.00 0.00 N ATOM 0 H LYS A 64 -11.724 -16.189 1.729 1.00 0.00 H new ATOM 0 HA LYS A 64 -12.059 -17.604 -0.812 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -13.267 -15.266 0.594 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -13.148 -15.118 -1.148 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -14.174 -17.649 -0.934 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -14.865 -16.901 0.493 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -15.009 -15.209 -1.936 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -15.897 -16.714 -2.067 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -17.558 -15.566 -1.021 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -16.661 -15.938 0.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -17.193 -13.592 0.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -15.510 -13.809 0.240 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -16.379 -13.449 -1.174 1.00 0.00 H new ATOM 1073 N GLY A 65 -9.553 -16.078 -0.633 1.00 0.00 N ATOM 1074 CA GLY A 65 -8.442 -15.410 -1.284 1.00 0.00 C ATOM 1075 C GLY A 65 -8.469 -13.907 -1.087 1.00 0.00 C ATOM 1076 O GLY A 65 -8.472 -13.148 -2.055 1.00 0.00 O ATOM 0 H GLY A 65 -9.295 -16.673 0.155 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -7.505 -15.807 -0.894 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -8.463 -15.633 -2.351 1.00 0.00 H new ATOM 1080 N ASN A 66 -8.488 -13.477 0.170 1.00 0.00 N ATOM 1081 CA ASN A 66 -8.514 -12.053 0.488 1.00 0.00 C ATOM 1082 C ASN A 66 -7.470 -11.713 1.546 1.00 0.00 C ATOM 1083 O ASN A 66 -7.052 -12.573 2.320 1.00 0.00 O ATOM 1084 CB ASN A 66 -9.906 -11.642 0.973 1.00 0.00 C ATOM 1085 CG ASN A 66 -10.373 -10.341 0.350 1.00 0.00 C ATOM 1086 OD1 ASN A 66 -9.582 -9.422 0.136 1.00 0.00 O ATOM 1087 ND2 ASN A 66 -11.666 -10.256 0.057 1.00 0.00 N ATOM 0 H ASN A 66 -8.486 -14.092 0.984 1.00 0.00 H new ATOM 0 HA ASN A 66 -8.277 -11.498 -0.420 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -10.619 -12.432 0.736 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -9.894 -11.539 2.058 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -12.039 -9.404 -0.363 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -12.286 -11.042 0.252 1.00 0.00 H new ATOM 1094 N TRP A 67 -7.050 -10.452 1.572 1.00 0.00 N ATOM 1095 CA TRP A 67 -6.053 -9.997 2.534 1.00 0.00 C ATOM 1096 C TRP A 67 -6.401 -8.609 3.065 1.00 0.00 C ATOM 1097 O TRP A 67 -6.155 -7.601 2.403 1.00 0.00 O ATOM 1098 CB TRP A 67 -4.665 -9.977 1.892 1.00 0.00 C ATOM 1099 CG TRP A 67 -3.556 -10.237 2.864 1.00 0.00 C ATOM 1100 CD1 TRP A 67 -3.436 -11.308 3.703 1.00 0.00 C ATOM 1101 CD2 TRP A 67 -2.410 -9.411 3.099 1.00 0.00 C ATOM 1102 NE1 TRP A 67 -2.285 -11.198 4.446 1.00 0.00 N ATOM 1103 CE2 TRP A 67 -1.638 -10.041 4.093 1.00 0.00 C ATOM 1104 CE3 TRP A 67 -1.960 -8.200 2.565 1.00 0.00 C ATOM 1105 CZ2 TRP A 67 -0.443 -9.502 4.563 1.00 0.00 C ATOM 1106 CZ3 TRP A 67 -0.775 -7.664 3.033 1.00 0.00 C ATOM 1107 CH2 TRP A 67 -0.028 -8.316 4.022 1.00 0.00 C ATOM 0 H TRP A 67 -7.385 -9.727 0.937 1.00 0.00 H new ATOM 0 HA TRP A 67 -6.048 -10.695 3.371 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -4.628 -10.726 1.101 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -4.505 -9.007 1.420 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -4.142 -12.122 3.772 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -1.964 -11.867 5.146 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -2.528 -7.692 1.800 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 0.135 -10.002 5.326 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 -0.419 -6.727 2.630 1.00 0.00 H new ATOM 0 HH2 TRP A 67 0.895 -7.873 4.365 1.00 0.00 H new ATOM 1118 N HIS A 68 -6.973 -8.566 4.264 1.00 0.00 N ATOM 1119 CA HIS A 68 -7.353 -7.302 4.884 1.00 0.00 C ATOM 1120 C HIS A 68 -6.119 -6.491 5.265 1.00 0.00 C ATOM 1121 O HIS A 68 -5.234 -6.981 5.967 1.00 0.00 O ATOM 1122 CB HIS A 68 -8.212 -7.556 6.123 1.00 0.00 C ATOM 1123 CG HIS A 68 -9.482 -8.294 5.830 1.00 0.00 C ATOM 1124 ND1 HIS A 68 -10.669 -7.660 5.527 1.00 0.00 N ATOM 1125 CD2 HIS A 68 -9.746 -9.622 5.795 1.00 0.00 C ATOM 1126 CE1 HIS A 68 -11.608 -8.566 5.320 1.00 0.00 C ATOM 1127 NE2 HIS A 68 -11.074 -9.763 5.475 1.00 0.00 N ATOM 0 H HIS A 68 -7.183 -9.391 4.825 1.00 0.00 H new ATOM 0 HA HIS A 68 -7.933 -6.730 4.159 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -7.630 -8.125 6.848 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -8.455 -6.601 6.588 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -9.044 -10.420 5.983 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -12.638 -8.362 5.067 1.00 0.00 H new ATOM 0 HE2 HIS A 68 -11.568 -10.650 5.373 1.00 0.00 H new ATOM 1136 N GLY A 69 -6.065 -5.248 4.797 1.00 0.00 N ATOM 1137 CA GLY A 69 -4.935 -4.390 5.099 1.00 0.00 C ATOM 1138 C GLY A 69 -5.279 -3.314 6.110 1.00 0.00 C ATOM 1139 O GLY A 69 -6.025 -2.383 5.807 1.00 0.00 O ATOM 0 H GLY A 69 -6.784 -4.820 4.214 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.115 -4.996 5.483 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -4.582 -3.922 4.180 1.00 0.00 H new ATOM 1143 N LEU A 70 -4.733 -3.441 7.315 1.00 0.00 N ATOM 1144 CA LEU A 70 -4.985 -2.471 8.375 1.00 0.00 C ATOM 1145 C LEU A 70 -3.677 -1.893 8.903 1.00 0.00 C ATOM 1146 O LEU A 70 -2.822 -2.623 9.406 1.00 0.00 O ATOM 1147 CB LEU A 70 -5.766 -3.123 9.517 1.00 0.00 C ATOM 1148 CG LEU A 70 -7.100 -3.753 9.112 1.00 0.00 C ATOM 1149 CD1 LEU A 70 -6.875 -5.119 8.480 1.00 0.00 C ATOM 1150 CD2 LEU A 70 -8.021 -3.867 10.317 1.00 0.00 C ATOM 0 H LEU A 70 -4.113 -4.206 7.582 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.579 -1.658 7.957 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -5.141 -3.892 9.971 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.954 -2.371 10.284 1.00 0.00 H new ATOM 0 HG LEU A 70 -7.577 -3.108 8.374 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.835 -5.552 8.198 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -6.251 -5.011 7.593 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -6.378 -5.774 9.196 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -8.966 -4.317 10.012 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.551 -4.491 11.077 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -8.208 -2.875 10.727 1.00 0.00 H new ATOM 1162 N TYR A 71 -3.526 -0.577 8.787 1.00 0.00 N ATOM 1163 CA TYR A 71 -2.321 0.097 9.254 1.00 0.00 C ATOM 1164 C TYR A 71 -2.617 1.544 9.631 1.00 0.00 C ATOM 1165 O TYR A 71 -3.605 2.124 9.180 1.00 0.00 O ATOM 1166 CB TYR A 71 -1.235 0.050 8.176 1.00 0.00 C ATOM 1167 CG TYR A 71 -1.655 0.681 6.868 1.00 0.00 C ATOM 1168 CD1 TYR A 71 -1.816 2.056 6.758 1.00 0.00 C ATOM 1169 CD2 TYR A 71 -1.889 -0.099 5.742 1.00 0.00 C ATOM 1170 CE1 TYR A 71 -2.199 2.636 5.563 1.00 0.00 C ATOM 1171 CE2 TYR A 71 -2.272 0.473 4.545 1.00 0.00 C ATOM 1172 CZ TYR A 71 -2.426 1.840 4.461 1.00 0.00 C ATOM 1173 OH TYR A 71 -2.808 2.414 3.269 1.00 0.00 O ATOM 0 H TYR A 71 -4.223 0.043 8.374 1.00 0.00 H new ATOM 0 HA TYR A 71 -1.965 -0.424 10.142 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -0.345 0.559 8.546 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -0.957 -0.989 7.996 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -1.639 2.682 7.620 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -1.769 -1.171 5.804 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -2.320 3.707 5.493 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -2.450 -0.148 3.679 1.00 0.00 H new ATOM 0 HH TYR A 71 -2.237 2.079 2.547 1.00 0.00 H new ATOM 1183 N ALA A 72 -1.754 2.122 10.460 1.00 0.00 N ATOM 1184 CA ALA A 72 -1.922 3.501 10.896 1.00 0.00 C ATOM 1185 C ALA A 72 -0.580 4.222 10.966 1.00 0.00 C ATOM 1186 O ALA A 72 0.247 3.933 11.829 1.00 0.00 O ATOM 1187 CB ALA A 72 -2.618 3.546 12.248 1.00 0.00 C ATOM 0 H ALA A 72 -0.932 1.656 10.843 1.00 0.00 H new ATOM 0 HA ALA A 72 -2.543 4.015 10.162 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -2.737 4.583 12.562 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -3.598 3.076 12.168 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -2.018 3.011 12.984 1.00 0.00 H new ATOM 1193 N MET A 73 -0.371 5.160 10.048 1.00 0.00 N ATOM 1194 CA MET A 73 0.870 5.923 10.006 1.00 0.00 C ATOM 1195 C MET A 73 0.735 7.225 10.788 1.00 0.00 C ATOM 1196 O MET A 73 -0.367 7.613 11.179 1.00 0.00 O ATOM 1197 CB MET A 73 1.261 6.221 8.557 1.00 0.00 C ATOM 1198 CG MET A 73 1.284 4.989 7.667 1.00 0.00 C ATOM 1199 SD MET A 73 -0.024 4.998 6.426 1.00 0.00 S ATOM 1200 CE MET A 73 0.903 5.448 4.960 1.00 0.00 C ATOM 0 H MET A 73 -1.045 5.409 9.324 1.00 0.00 H new ATOM 0 HA MET A 73 1.653 5.323 10.469 1.00 0.00 H new ATOM 0 HB2 MET A 73 0.560 6.946 8.142 1.00 0.00 H new ATOM 0 HB3 MET A 73 2.246 6.687 8.544 1.00 0.00 H new ATOM 0 HG2 MET A 73 2.251 4.925 7.168 1.00 0.00 H new ATOM 0 HG3 MET A 73 1.185 4.097 8.286 1.00 0.00 H new ATOM 0 HE1 MET A 73 0.230 5.495 4.104 1.00 0.00 H new ATOM 0 HE2 MET A 73 1.369 6.422 5.109 1.00 0.00 H new ATOM 0 HE3 MET A 73 1.675 4.701 4.774 1.00 0.00 H new ATOM 1210 N ALA A 74 1.860 7.895 11.013 1.00 0.00 N ATOM 1211 CA ALA A 74 1.864 9.153 11.748 1.00 0.00 C ATOM 1212 C ALA A 74 3.097 9.982 11.409 1.00 0.00 C ATOM 1213 O ALA A 74 4.204 9.452 11.306 1.00 0.00 O ATOM 1214 CB ALA A 74 1.797 8.888 13.245 1.00 0.00 C ATOM 0 H ALA A 74 2.780 7.588 10.697 1.00 0.00 H new ATOM 0 HA ALA A 74 0.984 9.723 11.451 1.00 0.00 H new ATOM 0 HB1 ALA A 74 1.801 9.836 13.783 1.00 0.00 H new ATOM 0 HB2 ALA A 74 0.882 8.343 13.477 1.00 0.00 H new ATOM 0 HB3 ALA A 74 2.660 8.295 13.549 1.00 0.00 H new ATOM 1220 N PHE A 75 2.899 11.284 11.239 1.00 0.00 N ATOM 1221 CA PHE A 75 3.997 12.187 10.912 1.00 0.00 C ATOM 1222 C PHE A 75 4.348 13.068 12.107 1.00 0.00 C ATOM 1223 O PHE A 75 3.607 13.989 12.452 1.00 0.00 O ATOM 1224 CB PHE A 75 3.627 13.060 9.712 1.00 0.00 C ATOM 1225 CG PHE A 75 3.540 12.297 8.421 1.00 0.00 C ATOM 1226 CD1 PHE A 75 2.553 11.343 8.229 1.00 0.00 C ATOM 1227 CD2 PHE A 75 4.445 12.535 7.398 1.00 0.00 C ATOM 1228 CE1 PHE A 75 2.471 10.641 7.042 1.00 0.00 C ATOM 1229 CE2 PHE A 75 4.367 11.834 6.209 1.00 0.00 C ATOM 1230 CZ PHE A 75 3.379 10.887 6.031 1.00 0.00 C ATOM 0 H PHE A 75 1.989 11.738 11.322 1.00 0.00 H new ATOM 0 HA PHE A 75 4.869 11.584 10.658 1.00 0.00 H new ATOM 0 HB2 PHE A 75 2.669 13.542 9.905 1.00 0.00 H new ATOM 0 HB3 PHE A 75 4.368 13.853 9.607 1.00 0.00 H new ATOM 0 HD1 PHE A 75 1.840 11.146 9.016 1.00 0.00 H new ATOM 0 HD2 PHE A 75 5.219 13.276 7.531 1.00 0.00 H new ATOM 0 HE1 PHE A 75 1.697 9.900 6.905 1.00 0.00 H new ATOM 0 HE2 PHE A 75 5.079 12.027 5.420 1.00 0.00 H new ATOM 0 HZ PHE A 75 3.316 10.339 5.102 1.00 0.00 H new ATOM 1240 N LYS A 76 5.483 12.778 12.735 1.00 0.00 N ATOM 1241 CA LYS A 76 5.931 13.544 13.893 1.00 0.00 C ATOM 1242 C LYS A 76 7.078 14.478 13.515 1.00 0.00 C ATOM 1243 O LYS A 76 8.237 14.066 13.469 1.00 0.00 O ATOM 1244 CB LYS A 76 6.373 12.603 15.015 1.00 0.00 C ATOM 1245 CG LYS A 76 6.645 13.311 16.331 1.00 0.00 C ATOM 1246 CD LYS A 76 8.130 13.569 16.530 1.00 0.00 C ATOM 1247 CE LYS A 76 8.497 13.596 18.005 1.00 0.00 C ATOM 1248 NZ LYS A 76 8.120 12.332 18.696 1.00 0.00 N ATOM 0 H LYS A 76 6.108 12.020 12.462 1.00 0.00 H new ATOM 0 HA LYS A 76 5.094 14.147 14.244 1.00 0.00 H new ATOM 0 HB2 LYS A 76 5.601 11.849 15.170 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.275 12.077 14.702 1.00 0.00 H new ATOM 0 HG2 LYS A 76 6.104 14.257 16.355 1.00 0.00 H new ATOM 0 HG3 LYS A 76 6.266 12.707 17.155 1.00 0.00 H new ATOM 0 HD2 LYS A 76 8.706 12.794 16.025 1.00 0.00 H new ATOM 0 HD3 LYS A 76 8.401 14.519 16.069 1.00 0.00 H new ATOM 0 HE2 LYS A 76 9.570 13.760 18.109 1.00 0.00 H new ATOM 0 HE3 LYS A 76 7.998 14.436 18.488 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 8.790 12.146 19.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.159 12.422 19.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 8.148 11.544 18.018 1.00 0.00 H new ATOM 1262 N ASP A 77 6.745 15.736 13.246 1.00 0.00 N ATOM 1263 CA ASP A 77 7.746 16.728 12.872 1.00 0.00 C ATOM 1264 C ASP A 77 7.960 17.735 13.997 1.00 0.00 C ATOM 1265 O ASP A 77 7.031 18.060 14.738 1.00 0.00 O ATOM 1266 CB ASP A 77 7.323 17.455 11.595 1.00 0.00 C ATOM 1267 CG ASP A 77 7.482 16.592 10.358 1.00 0.00 C ATOM 1268 OD1 ASP A 77 8.378 15.723 10.352 1.00 0.00 O ATOM 1269 OD2 ASP A 77 6.708 16.785 9.396 1.00 0.00 O ATOM 0 H ASP A 77 5.790 16.093 13.280 1.00 0.00 H new ATOM 0 HA ASP A 77 8.686 16.208 12.690 1.00 0.00 H new ATOM 0 HB2 ASP A 77 6.283 17.767 11.686 1.00 0.00 H new ATOM 0 HB3 ASP A 77 7.919 18.361 11.482 1.00 0.00 H new ATOM 1275 N SER A 78 9.188 18.226 14.119 1.00 0.00 N ATOM 1276 CA SER A 78 9.524 19.197 15.155 1.00 0.00 C ATOM 1277 C SER A 78 9.374 20.623 14.635 1.00 0.00 C ATOM 1278 O SER A 78 9.065 21.541 15.394 1.00 0.00 O ATOM 1279 CB SER A 78 10.953 18.970 15.651 1.00 0.00 C ATOM 1280 OG SER A 78 11.319 17.606 15.549 1.00 0.00 O ATOM 0 H SER A 78 9.968 17.968 13.514 1.00 0.00 H new ATOM 0 HA SER A 78 8.832 19.059 15.986 1.00 0.00 H new ATOM 0 HB2 SER A 78 11.644 19.579 15.069 1.00 0.00 H new ATOM 0 HB3 SER A 78 11.037 19.295 16.688 1.00 0.00 H new ATOM 0 HG SER A 78 12.237 17.489 15.871 1.00 0.00 H new ATOM 1286 N TRP A 79 9.595 20.801 13.336 1.00 0.00 N ATOM 1287 CA TRP A 79 9.484 22.116 12.716 1.00 0.00 C ATOM 1288 C TRP A 79 8.268 22.187 11.798 1.00 0.00 C ATOM 1289 O TRP A 79 8.308 22.829 10.748 1.00 0.00 O ATOM 1290 CB TRP A 79 10.754 22.438 11.926 1.00 0.00 C ATOM 1291 CG TRP A 79 11.043 23.906 11.836 1.00 0.00 C ATOM 1292 CD1 TRP A 79 11.339 24.616 10.709 1.00 0.00 C ATOM 1293 CD2 TRP A 79 11.066 24.844 12.919 1.00 0.00 C ATOM 1294 NE1 TRP A 79 11.543 25.938 11.024 1.00 0.00 N ATOM 1295 CE2 TRP A 79 11.381 26.102 12.374 1.00 0.00 C ATOM 1296 CE3 TRP A 79 10.848 24.741 14.296 1.00 0.00 C ATOM 1297 CZ2 TRP A 79 11.485 27.249 13.158 1.00 0.00 C ATOM 1298 CZ3 TRP A 79 10.952 25.880 15.073 1.00 0.00 C ATOM 1299 CH2 TRP A 79 11.266 27.119 14.503 1.00 0.00 C ATOM 0 H TRP A 79 9.852 20.052 12.693 1.00 0.00 H new ATOM 0 HA TRP A 79 9.359 22.854 13.509 1.00 0.00 H new ATOM 0 HB2 TRP A 79 11.601 21.937 12.394 1.00 0.00 H new ATOM 0 HB3 TRP A 79 10.660 22.031 10.919 1.00 0.00 H new ATOM 0 HD1 TRP A 79 11.404 24.200 9.715 1.00 0.00 H new ATOM 0 HE1 TRP A 79 11.777 26.677 10.361 1.00 0.00 H new ATOM 0 HE3 TRP A 79 10.603 23.790 14.745 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 11.729 28.206 12.721 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 10.788 25.812 16.138 1.00 0.00 H new ATOM 0 HH2 TRP A 79 11.337 27.990 15.137 1.00 0.00 H new ATOM 1310 N ASN A 80 7.187 21.526 12.200 1.00 0.00 N ATOM 1311 CA ASN A 80 5.961 21.517 11.412 1.00 0.00 C ATOM 1312 C ASN A 80 4.746 21.228 12.291 1.00 0.00 C ATOM 1313 O ASN A 80 4.055 22.147 12.730 1.00 0.00 O ATOM 1314 CB ASN A 80 6.059 20.484 10.287 1.00 0.00 C ATOM 1315 CG ASN A 80 6.677 21.057 9.027 1.00 0.00 C ATOM 1316 OD1 ASN A 80 6.317 22.149 8.586 1.00 0.00 O ATOM 1317 ND2 ASN A 80 7.614 20.321 8.440 1.00 0.00 N ATOM 0 H ASN A 80 7.136 20.990 13.066 1.00 0.00 H new ATOM 0 HA ASN A 80 5.835 22.506 10.972 1.00 0.00 H new ATOM 0 HB2 ASN A 80 6.654 19.636 10.627 1.00 0.00 H new ATOM 0 HB3 ASN A 80 5.063 20.104 10.059 1.00 0.00 H new ATOM 0 HD21 ASN A 80 8.066 20.655 7.589 1.00 0.00 H new ATOM 0 HD22 ASN A 80 7.881 19.422 8.840 1.00 0.00 H new ATOM 1324 N LYS A 81 4.488 19.946 12.547 1.00 0.00 N ATOM 1325 CA LYS A 81 3.356 19.543 13.376 1.00 0.00 C ATOM 1326 C LYS A 81 3.234 18.022 13.429 1.00 0.00 C ATOM 1327 O LYS A 81 3.792 17.315 12.591 1.00 0.00 O ATOM 1328 CB LYS A 81 2.056 20.152 12.840 1.00 0.00 C ATOM 1329 CG LYS A 81 1.256 20.901 13.894 1.00 0.00 C ATOM 1330 CD LYS A 81 0.644 22.173 13.329 1.00 0.00 C ATOM 1331 CE LYS A 81 -0.820 21.975 12.970 1.00 0.00 C ATOM 1332 NZ LYS A 81 -1.726 22.419 14.065 1.00 0.00 N ATOM 0 H LYS A 81 5.048 19.171 12.192 1.00 0.00 H new ATOM 0 HA LYS A 81 3.531 19.912 14.386 1.00 0.00 H new ATOM 0 HB2 LYS A 81 2.293 20.834 12.023 1.00 0.00 H new ATOM 0 HB3 LYS A 81 1.437 19.358 12.422 1.00 0.00 H new ATOM 0 HG2 LYS A 81 0.466 20.256 14.279 1.00 0.00 H new ATOM 0 HG3 LYS A 81 1.903 21.150 14.735 1.00 0.00 H new ATOM 0 HD2 LYS A 81 0.735 22.977 14.059 1.00 0.00 H new ATOM 0 HD3 LYS A 81 1.198 22.482 12.443 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -1.049 22.532 12.061 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -1.001 20.922 12.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -2.715 22.267 13.781 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -1.525 21.871 14.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -1.572 23.430 14.255 1.00 0.00 H new ATOM 1346 N TRP A 82 2.498 17.528 14.420 1.00 0.00 N ATOM 1347 CA TRP A 82 2.298 16.092 14.583 1.00 0.00 C ATOM 1348 C TRP A 82 0.833 15.720 14.382 1.00 0.00 C ATOM 1349 O TRP A 82 -0.045 16.217 15.087 1.00 0.00 O ATOM 1350 CB TRP A 82 2.762 15.647 15.972 1.00 0.00 C ATOM 1351 CG TRP A 82 2.041 16.338 17.088 1.00 0.00 C ATOM 1352 CD1 TRP A 82 0.930 15.893 17.747 1.00 0.00 C ATOM 1353 CD2 TRP A 82 2.378 17.600 17.677 1.00 0.00 C ATOM 1354 NE1 TRP A 82 0.557 16.801 18.708 1.00 0.00 N ATOM 1355 CE2 TRP A 82 1.430 17.856 18.685 1.00 0.00 C ATOM 1356 CE3 TRP A 82 3.391 18.537 17.449 1.00 0.00 C ATOM 1357 CZ2 TRP A 82 1.466 19.010 19.464 1.00 0.00 C ATOM 1358 CZ3 TRP A 82 3.424 19.682 18.222 1.00 0.00 C ATOM 1359 CH2 TRP A 82 2.468 19.910 19.220 1.00 0.00 C ATOM 0 H TRP A 82 2.030 18.101 15.122 1.00 0.00 H new ATOM 0 HA TRP A 82 2.892 15.579 13.826 1.00 0.00 H new ATOM 0 HB2 TRP A 82 2.618 14.571 16.068 1.00 0.00 H new ATOM 0 HB3 TRP A 82 3.831 15.836 16.068 1.00 0.00 H new ATOM 0 HD1 TRP A 82 0.420 14.963 17.542 1.00 0.00 H new ATOM 0 HE1 TRP A 82 -0.241 16.705 19.337 1.00 0.00 H new ATOM 0 HE3 TRP A 82 4.134 18.369 16.683 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 0.729 19.188 20.233 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 4.200 20.414 18.054 1.00 0.00 H new ATOM 0 HH2 TRP A 82 2.523 20.814 19.809 1.00 0.00 H new ATOM 1370 N GLU A 83 0.575 14.845 13.416 1.00 0.00 N ATOM 1371 CA GLU A 83 -0.787 14.410 13.124 1.00 0.00 C ATOM 1372 C GLU A 83 -0.821 12.925 12.756 1.00 0.00 C ATOM 1373 O GLU A 83 -0.120 12.490 11.842 1.00 0.00 O ATOM 1374 CB GLU A 83 -1.375 15.241 11.983 1.00 0.00 C ATOM 1375 CG GLU A 83 -1.737 16.661 12.388 1.00 0.00 C ATOM 1376 CD GLU A 83 -3.230 16.855 12.565 1.00 0.00 C ATOM 1377 OE1 GLU A 83 -3.942 16.939 11.542 1.00 0.00 O ATOM 1378 OE2 GLU A 83 -3.687 16.923 13.724 1.00 0.00 O ATOM 0 H GLU A 83 1.289 14.423 12.823 1.00 0.00 H new ATOM 0 HA GLU A 83 -1.388 14.557 14.021 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.657 15.278 11.164 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -2.267 14.742 11.603 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -1.229 16.910 13.320 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -1.372 17.355 11.631 1.00 0.00 H new ATOM 1386 N PRO A 84 -1.641 12.124 13.463 1.00 0.00 N ATOM 1387 CA PRO A 84 -1.759 10.690 13.203 1.00 0.00 C ATOM 1388 C PRO A 84 -2.717 10.384 12.056 1.00 0.00 C ATOM 1389 O PRO A 84 -3.485 11.248 11.629 1.00 0.00 O ATOM 1390 CB PRO A 84 -2.314 10.155 14.520 1.00 0.00 C ATOM 1391 CG PRO A 84 -3.155 11.268 15.047 1.00 0.00 C ATOM 1392 CD PRO A 84 -2.515 12.551 14.575 1.00 0.00 C ATOM 0 HA PRO A 84 -0.811 10.243 12.902 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -2.903 9.251 14.365 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -1.513 9.899 15.214 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -4.178 11.188 14.681 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -3.203 11.236 16.135 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -3.262 13.271 14.242 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -1.944 13.029 15.371 1.00 0.00 H new ATOM 1400 N ILE A 85 -2.670 9.151 11.562 1.00 0.00 N ATOM 1401 CA ILE A 85 -3.535 8.733 10.465 1.00 0.00 C ATOM 1402 C ILE A 85 -3.732 7.221 10.465 1.00 0.00 C ATOM 1403 O ILE A 85 -2.796 6.463 10.717 1.00 0.00 O ATOM 1404 CB ILE A 85 -2.963 9.165 9.101 1.00 0.00 C ATOM 1405 CG1 ILE A 85 -1.564 8.581 8.901 1.00 0.00 C ATOM 1406 CG2 ILE A 85 -2.930 10.683 8.997 1.00 0.00 C ATOM 1407 CD1 ILE A 85 -1.043 8.731 7.489 1.00 0.00 C ATOM 0 H ILE A 85 -2.042 8.424 11.904 1.00 0.00 H new ATOM 0 HA ILE A 85 -4.497 9.222 10.618 1.00 0.00 H new ATOM 0 HB ILE A 85 -3.612 8.780 8.314 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -0.873 9.070 9.588 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -1.580 7.523 9.163 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -2.523 10.973 8.028 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -3.941 11.077 9.099 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -2.301 11.088 9.790 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -0.046 8.295 7.421 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -1.712 8.218 6.798 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -0.995 9.789 7.229 1.00 0.00 H new ATOM 1419 N ALA A 86 -4.958 6.788 10.179 1.00 0.00 N ATOM 1420 CA ALA A 86 -5.277 5.366 10.146 1.00 0.00 C ATOM 1421 C ALA A 86 -6.172 5.032 8.957 1.00 0.00 C ATOM 1422 O ALA A 86 -7.076 5.794 8.616 1.00 0.00 O ATOM 1423 CB ALA A 86 -5.945 4.944 11.446 1.00 0.00 C ATOM 0 H ALA A 86 -5.745 7.402 9.967 1.00 0.00 H new ATOM 0 HA ALA A 86 -4.345 4.813 10.033 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -6.177 3.880 11.407 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -5.271 5.138 12.281 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -6.865 5.512 11.583 1.00 0.00 H new ATOM 1429 N GLY A 87 -5.916 3.889 8.329 1.00 0.00 N ATOM 1430 CA GLY A 87 -6.709 3.478 7.186 1.00 0.00 C ATOM 1431 C GLY A 87 -6.818 1.971 7.063 1.00 0.00 C ATOM 1432 O GLY A 87 -6.066 1.232 7.700 1.00 0.00 O ATOM 0 H GLY A 87 -5.174 3.240 8.591 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -7.708 3.905 7.269 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -6.265 3.882 6.276 1.00 0.00 H new ATOM 1436 N TYR A 88 -7.757 1.512 6.241 1.00 0.00 N ATOM 1437 CA TYR A 88 -7.964 0.083 6.036 1.00 0.00 C ATOM 1438 C TYR A 88 -8.355 -0.209 4.591 1.00 0.00 C ATOM 1439 O TYR A 88 -8.929 0.640 3.909 1.00 0.00 O ATOM 1440 CB TYR A 88 -9.047 -0.439 6.984 1.00 0.00 C ATOM 1441 CG TYR A 88 -8.913 0.075 8.399 1.00 0.00 C ATOM 1442 CD1 TYR A 88 -7.947 -0.437 9.256 1.00 0.00 C ATOM 1443 CD2 TYR A 88 -9.754 1.071 8.879 1.00 0.00 C ATOM 1444 CE1 TYR A 88 -7.821 0.030 10.550 1.00 0.00 C ATOM 1445 CE2 TYR A 88 -9.635 1.544 10.172 1.00 0.00 C ATOM 1446 CZ TYR A 88 -8.668 1.020 11.004 1.00 0.00 C ATOM 1447 OH TYR A 88 -8.547 1.487 12.292 1.00 0.00 O ATOM 0 H TYR A 88 -8.387 2.110 5.706 1.00 0.00 H new ATOM 0 HA TYR A 88 -7.025 -0.428 6.250 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -10.025 -0.156 6.595 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -9.012 -1.528 6.997 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -7.283 -1.213 8.905 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -10.514 1.483 8.231 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -7.063 -0.378 11.203 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -10.296 2.320 10.529 1.00 0.00 H new ATOM 0 HH TYR A 88 -9.218 2.183 12.452 1.00 0.00 H new ATOM 1457 N GLY A 89 -8.040 -1.415 4.130 1.00 0.00 N ATOM 1458 CA GLY A 89 -8.366 -1.798 2.769 1.00 0.00 C ATOM 1459 C GLY A 89 -8.265 -3.295 2.547 1.00 0.00 C ATOM 1460 O GLY A 89 -8.281 -4.072 3.501 1.00 0.00 O ATOM 0 H GLY A 89 -7.565 -2.134 4.675 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -9.377 -1.467 2.534 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -7.695 -1.286 2.080 1.00 0.00 H new ATOM 1464 N TRP A 90 -8.162 -3.699 1.285 1.00 0.00 N ATOM 1465 CA TRP A 90 -8.059 -5.113 0.941 1.00 0.00 C ATOM 1466 C TRP A 90 -7.111 -5.317 -0.236 1.00 0.00 C ATOM 1467 O TRP A 90 -6.977 -4.447 -1.096 1.00 0.00 O ATOM 1468 CB TRP A 90 -9.439 -5.679 0.605 1.00 0.00 C ATOM 1469 CG TRP A 90 -10.494 -5.305 1.601 1.00 0.00 C ATOM 1470 CD1 TRP A 90 -10.501 -5.594 2.936 1.00 0.00 C ATOM 1471 CD2 TRP A 90 -11.698 -4.574 1.342 1.00 0.00 C ATOM 1472 NE1 TRP A 90 -11.635 -5.086 3.521 1.00 0.00 N ATOM 1473 CE2 TRP A 90 -12.386 -4.456 2.564 1.00 0.00 C ATOM 1474 CE3 TRP A 90 -12.261 -4.008 0.194 1.00 0.00 C ATOM 1475 CZ2 TRP A 90 -13.607 -3.794 2.670 1.00 0.00 C ATOM 1476 CZ3 TRP A 90 -13.473 -3.351 0.301 1.00 0.00 C ATOM 1477 CH2 TRP A 90 -14.134 -3.249 1.532 1.00 0.00 C ATOM 0 H TRP A 90 -8.148 -3.068 0.484 1.00 0.00 H new ATOM 0 HA TRP A 90 -7.658 -5.644 1.804 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -9.739 -5.324 -0.381 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -9.374 -6.765 0.547 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -9.728 -6.142 3.455 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -11.879 -5.165 4.508 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -11.758 -4.083 -0.759 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -14.119 -3.714 3.617 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -13.917 -2.909 -0.579 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -15.079 -2.729 1.583 1.00 0.00 H new ATOM 1488 N GLU A 91 -6.456 -6.473 -0.267 1.00 0.00 N ATOM 1489 CA GLU A 91 -5.521 -6.792 -1.340 1.00 0.00 C ATOM 1490 C GLU A 91 -5.549 -8.283 -1.662 1.00 0.00 C ATOM 1491 O GLU A 91 -5.737 -9.116 -0.775 1.00 0.00 O ATOM 1492 CB GLU A 91 -4.103 -6.370 -0.950 1.00 0.00 C ATOM 1493 CG GLU A 91 -3.825 -4.893 -1.177 1.00 0.00 C ATOM 1494 CD GLU A 91 -2.730 -4.361 -0.273 1.00 0.00 C ATOM 1495 OE1 GLU A 91 -1.582 -4.224 -0.748 1.00 0.00 O ATOM 1496 OE2 GLU A 91 -3.020 -4.080 0.909 1.00 0.00 O ATOM 0 H GLU A 91 -6.555 -7.204 0.438 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.826 -6.241 -2.230 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -3.939 -6.605 0.102 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.387 -6.959 -1.523 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -3.540 -4.736 -2.217 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.739 -4.325 -1.007 1.00 0.00 H new ATOM 1504 N SER A 92 -5.361 -8.612 -2.936 1.00 0.00 N ATOM 1505 CA SER A 92 -5.364 -10.002 -3.376 1.00 0.00 C ATOM 1506 C SER A 92 -3.952 -10.465 -3.724 1.00 0.00 C ATOM 1507 O SER A 92 -3.309 -9.911 -4.615 1.00 0.00 O ATOM 1508 CB SER A 92 -6.282 -10.174 -4.588 1.00 0.00 C ATOM 1509 OG SER A 92 -5.847 -9.374 -5.674 1.00 0.00 O ATOM 0 H SER A 92 -5.205 -7.934 -3.682 1.00 0.00 H new ATOM 0 HA SER A 92 -5.738 -10.616 -2.556 1.00 0.00 H new ATOM 0 HB2 SER A 92 -6.301 -11.222 -4.888 1.00 0.00 H new ATOM 0 HB3 SER A 92 -7.302 -9.902 -4.317 1.00 0.00 H new ATOM 0 HG SER A 92 -4.869 -9.317 -5.667 1.00 0.00 H new ATOM 1515 N THR A 93 -3.477 -11.484 -3.014 1.00 0.00 N ATOM 1516 CA THR A 93 -2.141 -12.020 -3.248 1.00 0.00 C ATOM 1517 C THR A 93 -2.200 -13.266 -4.124 1.00 0.00 C ATOM 1518 O THR A 93 -3.100 -14.095 -3.985 1.00 0.00 O ATOM 1519 CB THR A 93 -1.462 -12.350 -1.917 1.00 0.00 C ATOM 1520 OG1 THR A 93 -2.290 -13.182 -1.124 1.00 0.00 O ATOM 1521 CG2 THR A 93 -1.123 -11.124 -1.098 1.00 0.00 C ATOM 0 H THR A 93 -3.997 -11.954 -2.273 1.00 0.00 H new ATOM 0 HA THR A 93 -1.558 -11.260 -3.768 1.00 0.00 H new ATOM 0 HB THR A 93 -0.534 -12.856 -2.184 1.00 0.00 H new ATOM 0 HG1 THR A 93 -1.838 -13.383 -0.278 1.00 0.00 H new ATOM 0 HG21 THR A 93 -0.644 -11.429 -0.167 1.00 0.00 H new ATOM 0 HG22 THR A 93 -0.444 -10.485 -1.663 1.00 0.00 H new ATOM 0 HG23 THR A 93 -2.036 -10.573 -0.873 1.00 0.00 H new ATOM 1529 N TRP A 94 -1.233 -13.393 -5.027 1.00 0.00 N ATOM 1530 CA TRP A 94 -1.172 -14.539 -5.928 1.00 0.00 C ATOM 1531 C TRP A 94 0.267 -14.828 -6.342 1.00 0.00 C ATOM 1532 O TRP A 94 1.071 -13.911 -6.512 1.00 0.00 O ATOM 1533 CB TRP A 94 -2.033 -14.287 -7.167 1.00 0.00 C ATOM 1534 CG TRP A 94 -1.692 -13.012 -7.877 1.00 0.00 C ATOM 1535 CD1 TRP A 94 -2.141 -11.759 -7.572 1.00 0.00 C ATOM 1536 CD2 TRP A 94 -0.833 -12.866 -9.013 1.00 0.00 C ATOM 1537 NE1 TRP A 94 -1.612 -10.842 -8.449 1.00 0.00 N ATOM 1538 CE2 TRP A 94 -0.805 -11.497 -9.343 1.00 0.00 C ATOM 1539 CE3 TRP A 94 -0.082 -13.759 -9.783 1.00 0.00 C ATOM 1540 CZ2 TRP A 94 -0.058 -11.002 -10.409 1.00 0.00 C ATOM 1541 CZ3 TRP A 94 0.659 -13.266 -10.841 1.00 0.00 C ATOM 1542 CH2 TRP A 94 0.667 -11.898 -11.145 1.00 0.00 C ATOM 0 H TRP A 94 -0.481 -12.716 -5.154 1.00 0.00 H new ATOM 0 HA TRP A 94 -1.560 -15.409 -5.398 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -1.916 -15.122 -7.858 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -3.082 -14.261 -6.873 1.00 0.00 H new ATOM 0 HD1 TRP A 94 -2.813 -11.523 -6.760 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -1.791 -9.838 -8.437 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -0.081 -14.815 -9.556 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -0.051 -9.948 -10.646 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 1.242 -13.947 -11.444 1.00 0.00 H new ATOM 0 HH2 TRP A 94 1.258 -11.544 -11.977 1.00 0.00 H new ATOM 1553 N ARG A 95 0.586 -16.108 -6.505 1.00 0.00 N ATOM 1554 CA ARG A 95 1.930 -16.515 -6.899 1.00 0.00 C ATOM 1555 C ARG A 95 1.985 -16.837 -8.391 1.00 0.00 C ATOM 1556 O ARG A 95 1.042 -17.399 -8.948 1.00 0.00 O ATOM 1557 CB ARG A 95 2.374 -17.732 -6.086 1.00 0.00 C ATOM 1558 CG ARG A 95 2.967 -17.376 -4.732 1.00 0.00 C ATOM 1559 CD ARG A 95 1.884 -17.021 -3.726 1.00 0.00 C ATOM 1560 NE ARG A 95 1.389 -18.199 -3.017 1.00 0.00 N ATOM 1561 CZ ARG A 95 2.070 -18.831 -2.064 1.00 0.00 C ATOM 1562 NH1 ARG A 95 3.273 -18.403 -1.704 1.00 0.00 N ATOM 1563 NH2 ARG A 95 1.546 -19.895 -1.470 1.00 0.00 N ATOM 0 H ARG A 95 -0.067 -16.880 -6.371 1.00 0.00 H new ATOM 0 HA ARG A 95 2.609 -15.686 -6.699 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.518 -18.391 -5.937 1.00 0.00 H new ATOM 0 HB3 ARG A 95 3.112 -18.293 -6.660 1.00 0.00 H new ATOM 0 HG2 ARG A 95 3.552 -18.216 -4.357 1.00 0.00 H new ATOM 0 HG3 ARG A 95 3.652 -16.535 -4.843 1.00 0.00 H new ATOM 0 HD2 ARG A 95 2.279 -16.304 -3.006 1.00 0.00 H new ATOM 0 HD3 ARG A 95 1.056 -16.533 -4.241 1.00 0.00 H new ATOM 0 HE ARG A 95 0.468 -18.558 -3.267 1.00 0.00 H new ATOM 0 HH11 ARG A 95 3.681 -17.586 -2.158 1.00 0.00 H new ATOM 0 HH12 ARG A 95 3.790 -18.891 -0.973 1.00 0.00 H new ATOM 0 HH21 ARG A 95 0.622 -20.228 -1.744 1.00 0.00 H new ATOM 0 HH22 ARG A 95 2.067 -20.380 -0.740 1.00 0.00 H new ATOM 1577 N PRO A 96 3.098 -16.486 -9.063 1.00 0.00 N ATOM 1578 CA PRO A 96 3.267 -16.745 -10.498 1.00 0.00 C ATOM 1579 C PRO A 96 3.099 -18.221 -10.844 1.00 0.00 C ATOM 1580 O PRO A 96 2.594 -19.003 -10.039 1.00 0.00 O ATOM 1581 CB PRO A 96 4.702 -16.293 -10.782 1.00 0.00 C ATOM 1582 CG PRO A 96 5.027 -15.333 -9.690 1.00 0.00 C ATOM 1583 CD PRO A 96 4.274 -15.813 -8.482 1.00 0.00 C ATOM 0 HA PRO A 96 2.518 -16.223 -11.093 1.00 0.00 H new ATOM 0 HB2 PRO A 96 5.390 -17.139 -10.782 1.00 0.00 H new ATOM 0 HB3 PRO A 96 4.780 -15.819 -11.760 1.00 0.00 H new ATOM 0 HG2 PRO A 96 6.100 -15.309 -9.498 1.00 0.00 H new ATOM 0 HG3 PRO A 96 4.729 -14.320 -9.959 1.00 0.00 H new ATOM 0 HD2 PRO A 96 4.873 -16.497 -7.880 1.00 0.00 H new ATOM 0 HD3 PRO A 96 3.985 -14.986 -7.833 1.00 0.00 H new ATOM 1591 N LEU A 97 3.526 -18.593 -12.045 1.00 0.00 N ATOM 1592 CA LEU A 97 3.425 -19.976 -12.497 1.00 0.00 C ATOM 1593 C LEU A 97 4.808 -20.606 -12.635 1.00 0.00 C ATOM 1594 O LEU A 97 5.025 -21.474 -13.480 1.00 0.00 O ATOM 1595 CB LEU A 97 2.687 -20.044 -13.836 1.00 0.00 C ATOM 1596 CG LEU A 97 1.824 -21.291 -14.036 1.00 0.00 C ATOM 1597 CD1 LEU A 97 0.706 -21.012 -15.029 1.00 0.00 C ATOM 1598 CD2 LEU A 97 2.677 -22.459 -14.506 1.00 0.00 C ATOM 0 H LEU A 97 3.945 -17.957 -12.723 1.00 0.00 H new ATOM 0 HA LEU A 97 2.863 -20.536 -11.750 1.00 0.00 H new ATOM 0 HB2 LEU A 97 2.052 -19.163 -13.929 1.00 0.00 H new ATOM 0 HB3 LEU A 97 3.420 -19.995 -14.641 1.00 0.00 H new ATOM 0 HG LEU A 97 1.375 -21.557 -13.079 1.00 0.00 H new ATOM 0 HD11 LEU A 97 0.102 -21.910 -15.159 1.00 0.00 H new ATOM 0 HD12 LEU A 97 0.078 -20.204 -14.653 1.00 0.00 H new ATOM 0 HD13 LEU A 97 1.135 -20.721 -15.988 1.00 0.00 H new ATOM 0 HD21 LEU A 97 2.047 -23.338 -14.643 1.00 0.00 H new ATOM 0 HD22 LEU A 97 3.154 -22.203 -15.452 1.00 0.00 H new ATOM 0 HD23 LEU A 97 3.442 -22.674 -13.760 1.00 0.00 H new ATOM 1610 N ALA A 98 5.741 -20.161 -11.799 1.00 0.00 N ATOM 1611 CA ALA A 98 7.103 -20.681 -11.828 1.00 0.00 C ATOM 1612 C ALA A 98 7.653 -20.858 -10.415 1.00 0.00 C ATOM 1613 O ALA A 98 8.018 -21.963 -10.014 1.00 0.00 O ATOM 1614 CB ALA A 98 8.002 -19.758 -12.634 1.00 0.00 C ATOM 0 H ALA A 98 5.579 -19.442 -11.094 1.00 0.00 H new ATOM 0 HA ALA A 98 7.082 -21.660 -12.307 1.00 0.00 H new ATOM 0 HB1 ALA A 98 9.016 -20.158 -12.647 1.00 0.00 H new ATOM 0 HB2 ALA A 98 7.627 -19.685 -13.655 1.00 0.00 H new ATOM 0 HB3 ALA A 98 8.009 -18.768 -12.179 1.00 0.00 H new ATOM 1620 N ASP A 99 7.708 -19.761 -9.666 1.00 0.00 N ATOM 1621 CA ASP A 99 8.214 -19.795 -8.299 1.00 0.00 C ATOM 1622 C ASP A 99 7.071 -19.707 -7.293 1.00 0.00 C ATOM 1623 O ASP A 99 6.216 -18.826 -7.386 1.00 0.00 O ATOM 1624 CB ASP A 99 9.202 -18.650 -8.070 1.00 0.00 C ATOM 1625 CG ASP A 99 10.375 -19.063 -7.202 1.00 0.00 C ATOM 1626 OD1 ASP A 99 10.390 -18.693 -6.009 1.00 0.00 O ATOM 1627 OD2 ASP A 99 11.279 -19.755 -7.716 1.00 0.00 O ATOM 0 H ASP A 99 7.409 -18.839 -9.983 1.00 0.00 H new ATOM 0 HA ASP A 99 8.729 -20.744 -8.152 1.00 0.00 H new ATOM 0 HB2 ASP A 99 9.572 -18.296 -9.032 1.00 0.00 H new ATOM 0 HB3 ASP A 99 8.683 -17.814 -7.601 1.00 0.00 H new ATOM 1633 N GLU A 100 7.062 -20.625 -6.333 1.00 0.00 N ATOM 1634 CA GLU A 100 6.023 -20.652 -5.309 1.00 0.00 C ATOM 1635 C GLU A 100 6.527 -20.036 -4.007 1.00 0.00 C ATOM 1636 O GLU A 100 6.180 -20.494 -2.918 1.00 0.00 O ATOM 1637 CB GLU A 100 5.558 -22.087 -5.062 1.00 0.00 C ATOM 1638 CG GLU A 100 6.690 -23.044 -4.725 1.00 0.00 C ATOM 1639 CD GLU A 100 6.318 -24.023 -3.629 1.00 0.00 C ATOM 1640 OE1 GLU A 100 5.570 -23.630 -2.710 1.00 0.00 O ATOM 1641 OE2 GLU A 100 6.777 -25.183 -3.689 1.00 0.00 O ATOM 0 H GLU A 100 7.763 -21.361 -6.242 1.00 0.00 H new ATOM 0 HA GLU A 100 5.179 -20.062 -5.667 1.00 0.00 H new ATOM 0 HB2 GLU A 100 4.835 -22.091 -4.246 1.00 0.00 H new ATOM 0 HB3 GLU A 100 5.039 -22.450 -5.949 1.00 0.00 H new ATOM 0 HG2 GLU A 100 6.972 -23.597 -5.621 1.00 0.00 H new ATOM 0 HG3 GLU A 100 7.564 -22.472 -4.415 1.00 0.00 H new ATOM 1649 N ASN A 101 7.343 -18.995 -4.127 1.00 0.00 N ATOM 1650 CA ASN A 101 7.893 -18.316 -2.959 1.00 0.00 C ATOM 1651 C ASN A 101 7.632 -16.815 -3.029 1.00 0.00 C ATOM 1652 O ASN A 101 7.208 -16.201 -2.050 1.00 0.00 O ATOM 1653 CB ASN A 101 9.396 -18.580 -2.850 1.00 0.00 C ATOM 1654 CG ASN A 101 9.704 -19.994 -2.397 1.00 0.00 C ATOM 1655 OD1 ASN A 101 9.252 -20.431 -1.339 1.00 0.00 O ATOM 1656 ND2 ASN A 101 10.479 -20.717 -3.197 1.00 0.00 N ATOM 0 H ASN A 101 7.638 -18.603 -5.021 1.00 0.00 H new ATOM 0 HA ASN A 101 7.397 -18.712 -2.073 1.00 0.00 H new ATOM 0 HB2 ASN A 101 9.864 -18.401 -3.818 1.00 0.00 H new ATOM 0 HB3 ASN A 101 9.836 -17.872 -2.147 1.00 0.00 H new ATOM 0 HD21 ASN A 101 10.721 -21.675 -2.943 1.00 0.00 H new ATOM 0 HD22 ASN A 101 10.832 -20.315 -4.065 1.00 0.00 H new ATOM 1663 N PHE A 102 7.888 -16.229 -4.194 1.00 0.00 N ATOM 1664 CA PHE A 102 7.680 -14.799 -4.393 1.00 0.00 C ATOM 1665 C PHE A 102 6.194 -14.455 -4.358 1.00 0.00 C ATOM 1666 O PHE A 102 5.379 -15.113 -5.005 1.00 0.00 O ATOM 1667 CB PHE A 102 8.287 -14.355 -5.725 1.00 0.00 C ATOM 1668 CG PHE A 102 9.777 -14.167 -5.674 1.00 0.00 C ATOM 1669 CD1 PHE A 102 10.630 -15.226 -5.936 1.00 0.00 C ATOM 1670 CD2 PHE A 102 10.322 -12.932 -5.363 1.00 0.00 C ATOM 1671 CE1 PHE A 102 12.001 -15.056 -5.890 1.00 0.00 C ATOM 1672 CE2 PHE A 102 11.692 -12.757 -5.315 1.00 0.00 C ATOM 1673 CZ PHE A 102 12.532 -13.820 -5.580 1.00 0.00 C ATOM 0 H PHE A 102 8.240 -16.722 -5.015 1.00 0.00 H new ATOM 0 HA PHE A 102 8.176 -14.268 -3.580 1.00 0.00 H new ATOM 0 HB2 PHE A 102 8.049 -15.096 -6.488 1.00 0.00 H new ATOM 0 HB3 PHE A 102 7.821 -13.419 -6.033 1.00 0.00 H new ATOM 0 HD1 PHE A 102 10.220 -16.195 -6.179 1.00 0.00 H new ATOM 0 HD2 PHE A 102 9.669 -12.097 -5.156 1.00 0.00 H new ATOM 0 HE1 PHE A 102 12.656 -15.889 -6.096 1.00 0.00 H new ATOM 0 HE2 PHE A 102 12.105 -11.790 -5.070 1.00 0.00 H new ATOM 0 HZ PHE A 102 13.603 -13.685 -5.545 1.00 0.00 H new ATOM 1683 N HIS A 103 5.849 -13.421 -3.598 1.00 0.00 N ATOM 1684 CA HIS A 103 4.461 -12.989 -3.479 1.00 0.00 C ATOM 1685 C HIS A 103 4.177 -11.807 -4.399 1.00 0.00 C ATOM 1686 O HIS A 103 4.967 -10.866 -4.478 1.00 0.00 O ATOM 1687 CB HIS A 103 4.145 -12.610 -2.031 1.00 0.00 C ATOM 1688 CG HIS A 103 4.320 -13.740 -1.064 1.00 0.00 C ATOM 1689 ND1 HIS A 103 5.436 -13.882 -0.266 1.00 0.00 N ATOM 1690 CD2 HIS A 103 3.513 -14.786 -0.768 1.00 0.00 C ATOM 1691 CE1 HIS A 103 5.308 -14.966 0.478 1.00 0.00 C ATOM 1692 NE2 HIS A 103 4.150 -15.532 0.193 1.00 0.00 N ATOM 0 H HIS A 103 6.511 -12.867 -3.055 1.00 0.00 H new ATOM 0 HA HIS A 103 3.822 -13.820 -3.778 1.00 0.00 H new ATOM 0 HB2 HIS A 103 4.789 -11.783 -1.732 1.00 0.00 H new ATOM 0 HB3 HIS A 103 3.118 -12.250 -1.974 1.00 0.00 H new ATOM 0 HD2 HIS A 103 2.548 -14.995 -1.206 1.00 0.00 H new ATOM 0 HE1 HIS A 103 6.028 -15.328 1.197 1.00 0.00 H new ATOM 0 HE2 HIS A 103 3.787 -16.385 0.618 1.00 0.00 H new ATOM 1701 N LEU A 104 3.045 -11.862 -5.092 1.00 0.00 N ATOM 1702 CA LEU A 104 2.657 -10.794 -6.007 1.00 0.00 C ATOM 1703 C LEU A 104 1.142 -10.604 -6.008 1.00 0.00 C ATOM 1704 O LEU A 104 0.392 -11.521 -6.342 1.00 0.00 O ATOM 1705 CB LEU A 104 3.150 -11.104 -7.424 1.00 0.00 C ATOM 1706 CG LEU A 104 4.232 -10.160 -7.952 1.00 0.00 C ATOM 1707 CD1 LEU A 104 4.729 -10.625 -9.311 1.00 0.00 C ATOM 1708 CD2 LEU A 104 3.701 -8.736 -8.034 1.00 0.00 C ATOM 0 H LEU A 104 2.380 -12.634 -5.038 1.00 0.00 H new ATOM 0 HA LEU A 104 3.119 -9.868 -5.666 1.00 0.00 H new ATOM 0 HB2 LEU A 104 3.537 -12.123 -7.443 1.00 0.00 H new ATOM 0 HB3 LEU A 104 2.299 -11.073 -8.104 1.00 0.00 H new ATOM 0 HG LEU A 104 5.072 -10.175 -7.257 1.00 0.00 H new ATOM 0 HD11 LEU A 104 5.498 -9.941 -9.671 1.00 0.00 H new ATOM 0 HD12 LEU A 104 5.148 -11.627 -9.222 1.00 0.00 H new ATOM 0 HD13 LEU A 104 3.898 -10.640 -10.017 1.00 0.00 H new ATOM 0 HD21 LEU A 104 4.483 -8.077 -8.411 1.00 0.00 H new ATOM 0 HD22 LEU A 104 2.844 -8.705 -8.707 1.00 0.00 H new ATOM 0 HD23 LEU A 104 3.395 -8.404 -7.042 1.00 0.00 H new ATOM 1720 N GLY A 105 0.700 -9.408 -5.633 1.00 0.00 N ATOM 1721 CA GLY A 105 -0.721 -9.121 -5.599 1.00 0.00 C ATOM 1722 C GLY A 105 -1.021 -7.650 -5.807 1.00 0.00 C ATOM 1723 O GLY A 105 -0.108 -6.828 -5.881 1.00 0.00 O ATOM 0 H GLY A 105 1.301 -8.633 -5.352 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -1.225 -9.704 -6.370 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -1.130 -9.440 -4.640 1.00 0.00 H new ATOM 1727 N LEU A 106 -2.304 -7.317 -5.902 1.00 0.00 N ATOM 1728 CA LEU A 106 -2.722 -5.934 -6.102 1.00 0.00 C ATOM 1729 C LEU A 106 -4.025 -5.647 -5.364 1.00 0.00 C ATOM 1730 O LEU A 106 -4.803 -6.558 -5.081 1.00 0.00 O ATOM 1731 CB LEU A 106 -2.894 -5.642 -7.594 1.00 0.00 C ATOM 1732 CG LEU A 106 -1.589 -5.537 -8.387 1.00 0.00 C ATOM 1733 CD1 LEU A 106 -1.791 -6.024 -9.813 1.00 0.00 C ATOM 1734 CD2 LEU A 106 -1.077 -4.105 -8.379 1.00 0.00 C ATOM 0 H LEU A 106 -3.072 -7.986 -5.844 1.00 0.00 H new ATOM 0 HA LEU A 106 -1.945 -5.284 -5.698 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -3.507 -6.428 -8.034 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.445 -4.708 -7.705 1.00 0.00 H new ATOM 0 HG LEU A 106 -0.843 -6.173 -7.910 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -0.853 -5.942 -10.362 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -2.114 -7.065 -9.800 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -2.551 -5.415 -10.301 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.149 -4.047 -8.947 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.821 -3.450 -8.832 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -0.894 -3.790 -7.352 1.00 0.00 H new ATOM 1746 N GLY A 107 -4.256 -4.375 -5.054 1.00 0.00 N ATOM 1747 CA GLY A 107 -5.466 -3.992 -4.351 1.00 0.00 C ATOM 1748 C GLY A 107 -5.556 -2.495 -4.126 1.00 0.00 C ATOM 1749 O GLY A 107 -4.865 -1.719 -4.786 1.00 0.00 O ATOM 0 H GLY A 107 -3.627 -3.604 -5.277 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.334 -4.324 -4.921 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.501 -4.504 -3.389 1.00 0.00 H new ATOM 1753 N PHE A 108 -6.412 -2.089 -3.193 1.00 0.00 N ATOM 1754 CA PHE A 108 -6.590 -0.675 -2.884 1.00 0.00 C ATOM 1755 C PHE A 108 -6.632 -0.450 -1.376 1.00 0.00 C ATOM 1756 O PHE A 108 -7.108 -1.299 -0.624 1.00 0.00 O ATOM 1757 CB PHE A 108 -7.876 -0.151 -3.526 1.00 0.00 C ATOM 1758 CG PHE A 108 -7.977 -0.447 -4.995 1.00 0.00 C ATOM 1759 CD1 PHE A 108 -7.354 0.371 -5.925 1.00 0.00 C ATOM 1760 CD2 PHE A 108 -8.695 -1.543 -5.446 1.00 0.00 C ATOM 1761 CE1 PHE A 108 -7.446 0.100 -7.277 1.00 0.00 C ATOM 1762 CE2 PHE A 108 -8.790 -1.818 -6.797 1.00 0.00 C ATOM 1763 CZ PHE A 108 -8.165 -0.995 -7.713 1.00 0.00 C ATOM 0 H PHE A 108 -6.992 -2.719 -2.639 1.00 0.00 H new ATOM 0 HA PHE A 108 -5.739 -0.128 -3.291 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -8.733 -0.591 -3.015 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -7.934 0.927 -3.376 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -6.791 1.229 -5.589 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -9.186 -2.190 -4.734 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -6.956 0.744 -7.992 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -9.352 -2.675 -7.136 1.00 0.00 H new ATOM 0 HZ PHE A 108 -8.239 -1.208 -8.769 1.00 0.00 H new ATOM 1773 N THR A 109 -6.129 0.701 -0.942 1.00 0.00 N ATOM 1774 CA THR A 109 -6.108 1.040 0.477 1.00 0.00 C ATOM 1775 C THR A 109 -6.770 2.392 0.724 1.00 0.00 C ATOM 1776 O THR A 109 -6.562 3.343 -0.029 1.00 0.00 O ATOM 1777 CB THR A 109 -4.669 1.061 0.995 1.00 0.00 C ATOM 1778 OG1 THR A 109 -3.876 1.956 0.237 1.00 0.00 O ATOM 1779 CG2 THR A 109 -3.999 -0.295 0.955 1.00 0.00 C ATOM 0 H THR A 109 -5.731 1.415 -1.552 1.00 0.00 H new ATOM 0 HA THR A 109 -6.670 0.278 1.016 1.00 0.00 H new ATOM 0 HB THR A 109 -4.741 1.382 2.034 1.00 0.00 H new ATOM 0 HG1 THR A 109 -3.262 2.434 0.833 1.00 0.00 H new ATOM 0 HG21 THR A 109 -2.981 -0.209 1.336 1.00 0.00 H new ATOM 0 HG22 THR A 109 -4.560 -0.996 1.573 1.00 0.00 H new ATOM 0 HG23 THR A 109 -3.972 -0.658 -0.073 1.00 0.00 H new ATOM 1787 N ALA A 110 -7.568 2.469 1.783 1.00 0.00 N ATOM 1788 CA ALA A 110 -8.260 3.704 2.131 1.00 0.00 C ATOM 1789 C ALA A 110 -7.688 4.314 3.405 1.00 0.00 C ATOM 1790 O ALA A 110 -7.539 3.632 4.420 1.00 0.00 O ATOM 1791 CB ALA A 110 -9.750 3.446 2.290 1.00 0.00 C ATOM 0 H ALA A 110 -7.752 1.690 2.416 1.00 0.00 H new ATOM 0 HA ALA A 110 -8.110 4.417 1.320 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -10.255 4.377 2.550 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -10.155 3.063 1.353 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -9.910 2.713 3.081 1.00 0.00 H new ATOM 1797 N GLY A 111 -7.369 5.603 3.346 1.00 0.00 N ATOM 1798 CA GLY A 111 -6.817 6.285 4.503 1.00 0.00 C ATOM 1799 C GLY A 111 -7.782 7.292 5.097 1.00 0.00 C ATOM 1800 O GLY A 111 -8.486 7.993 4.370 1.00 0.00 O ATOM 0 H GLY A 111 -7.483 6.188 2.518 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -6.551 5.549 5.262 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -5.897 6.794 4.216 1.00 0.00 H new ATOM 1804 N VAL A 112 -7.815 7.363 6.423 1.00 0.00 N ATOM 1805 CA VAL A 112 -8.700 8.290 7.117 1.00 0.00 C ATOM 1806 C VAL A 112 -7.904 9.283 7.958 1.00 0.00 C ATOM 1807 O VAL A 112 -7.104 8.891 8.808 1.00 0.00 O ATOM 1808 CB VAL A 112 -9.693 7.543 8.029 1.00 0.00 C ATOM 1809 CG1 VAL A 112 -10.706 8.510 8.625 1.00 0.00 C ATOM 1810 CG2 VAL A 112 -10.396 6.434 7.259 1.00 0.00 C ATOM 0 H VAL A 112 -7.239 6.789 7.039 1.00 0.00 H new ATOM 0 HA VAL A 112 -9.257 8.830 6.351 1.00 0.00 H new ATOM 0 HB VAL A 112 -9.133 7.089 8.847 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -11.398 7.963 9.266 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -10.185 9.265 9.214 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -11.261 8.996 7.823 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -11.093 5.918 7.919 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -10.942 6.864 6.419 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -9.657 5.725 6.886 1.00 0.00 H new ATOM 1820 N THR A 113 -8.130 10.570 7.715 1.00 0.00 N ATOM 1821 CA THR A 113 -7.433 11.620 8.450 1.00 0.00 C ATOM 1822 C THR A 113 -8.410 12.433 9.294 1.00 0.00 C ATOM 1823 O THR A 113 -9.482 12.817 8.824 1.00 0.00 O ATOM 1824 CB THR A 113 -6.689 12.541 7.482 1.00 0.00 C ATOM 1825 OG1 THR A 113 -5.859 11.791 6.614 1.00 0.00 O ATOM 1826 CG2 THR A 113 -5.818 13.564 8.179 1.00 0.00 C ATOM 0 H THR A 113 -8.790 10.911 7.016 1.00 0.00 H new ATOM 0 HA THR A 113 -6.712 11.146 9.116 1.00 0.00 H new ATOM 0 HB THR A 113 -7.467 13.067 6.928 1.00 0.00 H new ATOM 0 HG1 THR A 113 -5.393 12.398 6.002 1.00 0.00 H new ATOM 0 HG21 THR A 113 -5.319 14.185 7.435 1.00 0.00 H new ATOM 0 HG22 THR A 113 -6.437 14.192 8.820 1.00 0.00 H new ATOM 0 HG23 THR A 113 -5.070 13.053 8.785 1.00 0.00 H new ATOM 1834 N ALA A 114 -8.034 12.692 10.541 1.00 0.00 N ATOM 1835 CA ALA A 114 -8.876 13.459 11.450 1.00 0.00 C ATOM 1836 C ALA A 114 -8.515 14.940 11.415 1.00 0.00 C ATOM 1837 O ALA A 114 -7.350 15.301 11.245 1.00 0.00 O ATOM 1838 CB ALA A 114 -8.755 12.917 12.867 1.00 0.00 C ATOM 0 H ALA A 114 -7.151 12.382 10.946 1.00 0.00 H new ATOM 0 HA ALA A 114 -9.910 13.356 11.121 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -9.389 13.500 13.535 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -9.070 11.874 12.886 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -7.719 12.989 13.197 1.00 0.00 H new ATOM 1844 N ARG A 115 -9.520 15.794 11.577 1.00 0.00 N ATOM 1845 CA ARG A 115 -9.306 17.236 11.565 1.00 0.00 C ATOM 1846 C ARG A 115 -10.058 17.908 12.709 1.00 0.00 C ATOM 1847 O ARG A 115 -11.218 17.591 12.973 1.00 0.00 O ATOM 1848 CB ARG A 115 -9.756 17.828 10.228 1.00 0.00 C ATOM 1849 CG ARG A 115 -11.245 17.674 9.964 1.00 0.00 C ATOM 1850 CD ARG A 115 -11.683 18.487 8.757 1.00 0.00 C ATOM 1851 NE ARG A 115 -13.124 18.396 8.529 1.00 0.00 N ATOM 1852 CZ ARG A 115 -13.714 18.703 7.376 1.00 0.00 C ATOM 1853 NH1 ARG A 115 -12.992 19.121 6.344 1.00 0.00 N ATOM 1854 NH2 ARG A 115 -15.029 18.591 7.255 1.00 0.00 N ATOM 0 H ARG A 115 -10.490 15.513 11.718 1.00 0.00 H new ATOM 0 HA ARG A 115 -8.240 17.420 11.697 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -9.499 18.887 10.204 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -9.201 17.347 9.422 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -11.480 16.622 9.800 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -11.806 17.993 10.842 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -11.404 19.531 8.902 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -11.153 18.136 7.872 1.00 0.00 H new ATOM 0 HE ARG A 115 -13.712 18.078 9.299 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -11.980 19.208 6.432 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -13.449 19.355 5.463 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -15.588 18.270 8.045 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -15.482 18.826 6.372 1.00 0.00 H new ATOM 1868 N ASP A 116 -9.390 18.835 13.387 1.00 0.00 N ATOM 1869 CA ASP A 116 -9.995 19.551 14.503 1.00 0.00 C ATOM 1870 C ASP A 116 -10.408 18.585 15.610 1.00 0.00 C ATOM 1871 O ASP A 116 -10.297 17.368 15.458 1.00 0.00 O ATOM 1872 CB ASP A 116 -11.211 20.347 14.026 1.00 0.00 C ATOM 1873 CG ASP A 116 -10.895 21.223 12.829 1.00 0.00 C ATOM 1874 OD1 ASP A 116 -11.712 21.254 11.884 1.00 0.00 O ATOM 1875 OD2 ASP A 116 -9.831 21.876 12.836 1.00 0.00 O ATOM 0 H ASP A 116 -8.429 19.108 13.183 1.00 0.00 H new ATOM 0 HA ASP A 116 -9.252 20.240 14.905 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -12.014 19.657 13.766 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -11.577 20.970 14.842 1.00 0.00 H new ATOM 1881 N ASN A 117 -10.883 19.135 16.722 1.00 0.00 N ATOM 1882 CA ASN A 117 -11.312 18.322 17.854 1.00 0.00 C ATOM 1883 C ASN A 117 -12.824 18.399 18.037 1.00 0.00 C ATOM 1884 O ASN A 117 -13.470 17.406 18.374 1.00 0.00 O ATOM 1885 CB ASN A 117 -10.608 18.778 19.133 1.00 0.00 C ATOM 1886 CG ASN A 117 -9.302 18.045 19.368 1.00 0.00 C ATOM 1887 OD1 ASN A 117 -8.564 17.751 18.427 1.00 0.00 O ATOM 1888 ND2 ASN A 117 -9.010 17.744 20.628 1.00 0.00 N ATOM 0 H ASN A 117 -10.981 20.140 16.864 1.00 0.00 H new ATOM 0 HA ASN A 117 -11.041 17.286 17.648 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -10.415 19.849 19.076 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -11.269 18.618 19.985 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -8.145 17.250 20.847 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -9.651 18.007 21.377 1.00 0.00 H new ATOM 1895 N TRP A 118 -13.383 19.583 17.813 1.00 0.00 N ATOM 1896 CA TRP A 118 -14.819 19.790 17.952 1.00 0.00 C ATOM 1897 C TRP A 118 -15.580 19.114 16.815 1.00 0.00 C ATOM 1898 O TRP A 118 -16.679 18.595 17.012 1.00 0.00 O ATOM 1899 CB TRP A 118 -15.140 21.286 17.979 1.00 0.00 C ATOM 1900 CG TRP A 118 -15.277 21.839 19.364 1.00 0.00 C ATOM 1901 CD1 TRP A 118 -14.515 22.819 19.934 1.00 0.00 C ATOM 1902 CD2 TRP A 118 -16.232 21.445 20.355 1.00 0.00 C ATOM 1903 NE1 TRP A 118 -14.939 23.058 21.219 1.00 0.00 N ATOM 1904 CE2 TRP A 118 -15.992 22.227 21.501 1.00 0.00 C ATOM 1905 CE3 TRP A 118 -17.268 20.508 20.385 1.00 0.00 C ATOM 1906 CZ2 TRP A 118 -16.750 22.099 22.662 1.00 0.00 C ATOM 1907 CZ3 TRP A 118 -18.019 20.381 21.539 1.00 0.00 C ATOM 1908 CH2 TRP A 118 -17.757 21.174 22.663 1.00 0.00 C ATOM 0 H TRP A 118 -12.863 20.415 17.534 1.00 0.00 H new ATOM 0 HA TRP A 118 -15.136 19.341 18.893 1.00 0.00 H new ATOM 0 HB2 TRP A 118 -14.353 21.829 17.455 1.00 0.00 H new ATOM 0 HB3 TRP A 118 -16.066 21.461 17.432 1.00 0.00 H new ATOM 0 HD1 TRP A 118 -13.699 23.331 19.446 1.00 0.00 H new ATOM 0 HE1 TRP A 118 -14.536 23.742 21.859 1.00 0.00 H new ATOM 0 HE3 TRP A 118 -17.479 19.894 19.522 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 -16.550 22.709 23.531 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 -18.821 19.658 21.574 1.00 0.00 H new ATOM 0 HH2 TRP A 118 -18.363 21.053 23.549 1.00 0.00 H new ATOM 1919 N ASN A 119 -14.987 19.125 15.625 1.00 0.00 N ATOM 1920 CA ASN A 119 -15.609 18.513 14.456 1.00 0.00 C ATOM 1921 C ASN A 119 -14.870 17.244 14.048 1.00 0.00 C ATOM 1922 O ASN A 119 -13.826 17.303 13.397 1.00 0.00 O ATOM 1923 CB ASN A 119 -15.631 19.502 13.289 1.00 0.00 C ATOM 1924 CG ASN A 119 -16.894 19.386 12.457 1.00 0.00 C ATOM 1925 OD1 ASN A 119 -17.448 18.299 12.297 1.00 0.00 O ATOM 1926 ND2 ASN A 119 -17.354 20.510 11.921 1.00 0.00 N ATOM 0 H ASN A 119 -14.078 19.550 15.445 1.00 0.00 H new ATOM 0 HA ASN A 119 -16.633 18.247 14.718 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -15.546 20.518 13.675 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -14.763 19.329 12.653 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -18.199 20.494 11.350 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -16.862 21.389 12.080 1.00 0.00 H new ATOM 1933 N TYR A 120 -15.417 16.096 14.433 1.00 0.00 N ATOM 1934 CA TYR A 120 -14.810 14.811 14.107 1.00 0.00 C ATOM 1935 C TYR A 120 -15.257 14.333 12.729 1.00 0.00 C ATOM 1936 O TYR A 120 -16.223 13.580 12.606 1.00 0.00 O ATOM 1937 CB TYR A 120 -15.172 13.767 15.164 1.00 0.00 C ATOM 1938 CG TYR A 120 -14.337 13.863 16.422 1.00 0.00 C ATOM 1939 CD1 TYR A 120 -13.116 13.207 16.519 1.00 0.00 C ATOM 1940 CD2 TYR A 120 -14.770 14.608 17.511 1.00 0.00 C ATOM 1941 CE1 TYR A 120 -12.351 13.291 17.667 1.00 0.00 C ATOM 1942 CE2 TYR A 120 -14.010 14.699 18.662 1.00 0.00 C ATOM 1943 CZ TYR A 120 -12.802 14.039 18.734 1.00 0.00 C ATOM 1944 OH TYR A 120 -12.043 14.125 19.879 1.00 0.00 O ATOM 0 H TYR A 120 -16.281 16.029 14.972 1.00 0.00 H new ATOM 0 HA TYR A 120 -13.728 14.942 14.094 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -16.224 13.878 15.427 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -15.054 12.772 14.735 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -12.759 12.622 15.684 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -15.717 15.125 17.458 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -11.405 12.774 17.728 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -14.361 15.284 19.500 1.00 0.00 H new ATOM 0 HH TYR A 120 -12.502 14.691 20.534 1.00 0.00 H new ATOM 1954 N ILE A 121 -14.548 14.775 11.695 1.00 0.00 N ATOM 1955 CA ILE A 121 -14.871 14.393 10.326 1.00 0.00 C ATOM 1956 C ILE A 121 -13.705 13.657 9.670 1.00 0.00 C ATOM 1957 O ILE A 121 -12.704 14.271 9.301 1.00 0.00 O ATOM 1958 CB ILE A 121 -15.229 15.623 9.470 1.00 0.00 C ATOM 1959 CG1 ILE A 121 -16.251 16.499 10.199 1.00 0.00 C ATOM 1960 CG2 ILE A 121 -15.767 15.188 8.116 1.00 0.00 C ATOM 1961 CD1 ILE A 121 -17.578 15.812 10.433 1.00 0.00 C ATOM 0 H ILE A 121 -13.745 15.399 11.780 1.00 0.00 H new ATOM 0 HA ILE A 121 -15.734 13.730 10.379 1.00 0.00 H new ATOM 0 HB ILE A 121 -14.325 16.210 9.308 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.836 16.806 11.159 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.418 17.407 9.619 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -16.015 16.068 7.523 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -15.010 14.601 7.595 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -16.662 14.582 8.258 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -18.253 16.491 10.954 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -18.015 15.530 9.475 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -17.424 14.919 11.039 1.00 0.00 H new ATOM 1973 N PRO A 122 -13.814 12.323 9.513 1.00 0.00 N ATOM 1974 CA PRO A 122 -12.756 11.516 8.896 1.00 0.00 C ATOM 1975 C PRO A 122 -12.587 11.823 7.412 1.00 0.00 C ATOM 1976 O PRO A 122 -13.562 12.078 6.705 1.00 0.00 O ATOM 1977 CB PRO A 122 -13.241 10.076 9.091 1.00 0.00 C ATOM 1978 CG PRO A 122 -14.719 10.187 9.236 1.00 0.00 C ATOM 1979 CD PRO A 122 -14.969 11.502 9.920 1.00 0.00 C ATOM 0 HA PRO A 122 -11.782 11.714 9.343 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -12.973 9.450 8.240 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -12.790 9.623 9.974 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -15.210 10.153 8.264 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -15.117 9.359 9.823 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -15.911 11.948 9.602 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -15.020 11.389 11.003 1.00 0.00 H new ATOM 1987 N LEU A 123 -11.343 11.798 6.946 1.00 0.00 N ATOM 1988 CA LEU A 123 -11.044 12.074 5.545 1.00 0.00 C ATOM 1989 C LEU A 123 -10.643 10.797 4.810 1.00 0.00 C ATOM 1990 O LEU A 123 -9.459 10.484 4.695 1.00 0.00 O ATOM 1991 CB LEU A 123 -9.927 13.113 5.436 1.00 0.00 C ATOM 1992 CG LEU A 123 -10.071 14.099 4.276 1.00 0.00 C ATOM 1993 CD1 LEU A 123 -9.376 15.413 4.602 1.00 0.00 C ATOM 1994 CD2 LEU A 123 -9.508 13.500 2.996 1.00 0.00 C ATOM 0 H LEU A 123 -10.525 11.589 7.518 1.00 0.00 H new ATOM 0 HA LEU A 123 -11.946 12.470 5.078 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -9.883 13.676 6.368 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -8.975 12.592 5.334 1.00 0.00 H new ATOM 0 HG LEU A 123 -11.131 14.301 4.125 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -9.489 16.102 3.765 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -9.824 15.850 5.495 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -8.316 15.230 4.780 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -9.618 14.215 2.181 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -8.452 13.270 3.136 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -10.050 12.586 2.753 1.00 0.00 H new ATOM 2006 N PRO A 124 -11.630 10.042 4.300 1.00 0.00 N ATOM 2007 CA PRO A 124 -11.375 8.795 3.573 1.00 0.00 C ATOM 2008 C PRO A 124 -10.800 9.043 2.182 1.00 0.00 C ATOM 2009 O PRO A 124 -11.346 9.824 1.403 1.00 0.00 O ATOM 2010 CB PRO A 124 -12.761 8.156 3.473 1.00 0.00 C ATOM 2011 CG PRO A 124 -13.707 9.305 3.505 1.00 0.00 C ATOM 2012 CD PRO A 124 -13.073 10.343 4.393 1.00 0.00 C ATOM 0 HA PRO A 124 -10.638 8.171 4.078 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -12.867 7.581 2.553 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -12.942 7.470 4.301 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -13.875 9.699 2.503 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -14.678 9.000 3.894 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -13.295 11.354 4.051 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -13.433 10.268 5.419 1.00 0.00 H new ATOM 2020 N VAL A 125 -9.695 8.370 1.875 1.00 0.00 N ATOM 2021 CA VAL A 125 -9.047 8.517 0.578 1.00 0.00 C ATOM 2022 C VAL A 125 -8.512 7.180 0.077 1.00 0.00 C ATOM 2023 O VAL A 125 -7.687 6.545 0.733 1.00 0.00 O ATOM 2024 CB VAL A 125 -7.887 9.529 0.640 1.00 0.00 C ATOM 2025 CG1 VAL A 125 -8.417 10.937 0.857 1.00 0.00 C ATOM 2026 CG2 VAL A 125 -6.904 9.146 1.737 1.00 0.00 C ATOM 0 H VAL A 125 -9.231 7.718 2.507 1.00 0.00 H new ATOM 0 HA VAL A 125 -9.805 8.886 -0.113 1.00 0.00 H new ATOM 0 HB VAL A 125 -7.359 9.508 -0.313 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -7.583 11.637 0.898 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -9.078 11.208 0.034 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -8.971 10.977 1.795 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -6.091 9.872 1.767 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -7.417 9.137 2.699 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -6.499 8.155 1.533 1.00 0.00 H new ATOM 2036 N LEU A 126 -8.988 6.757 -1.090 1.00 0.00 N ATOM 2037 CA LEU A 126 -8.557 5.495 -1.678 1.00 0.00 C ATOM 2038 C LEU A 126 -7.445 5.720 -2.697 1.00 0.00 C ATOM 2039 O LEU A 126 -7.472 6.689 -3.455 1.00 0.00 O ATOM 2040 CB LEU A 126 -9.740 4.790 -2.346 1.00 0.00 C ATOM 2041 CG LEU A 126 -10.373 5.551 -3.512 1.00 0.00 C ATOM 2042 CD1 LEU A 126 -9.687 5.189 -4.820 1.00 0.00 C ATOM 2043 CD2 LEU A 126 -11.864 5.259 -3.591 1.00 0.00 C ATOM 0 H LEU A 126 -9.672 7.270 -1.646 1.00 0.00 H new ATOM 0 HA LEU A 126 -8.170 4.864 -0.878 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -9.407 3.816 -2.706 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -10.506 4.607 -1.593 1.00 0.00 H new ATOM 0 HG LEU A 126 -10.241 6.619 -3.340 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -10.150 5.740 -5.639 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -8.630 5.449 -4.761 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -9.788 4.119 -5.000 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -12.299 5.808 -4.426 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -12.018 4.190 -3.740 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -12.345 5.569 -2.663 1.00 0.00 H new ATOM 2055 N LEU A 127 -6.468 4.820 -2.708 1.00 0.00 N ATOM 2056 CA LEU A 127 -5.346 4.921 -3.634 1.00 0.00 C ATOM 2057 C LEU A 127 -4.838 3.534 -4.029 1.00 0.00 C ATOM 2058 O LEU A 127 -4.692 2.657 -3.178 1.00 0.00 O ATOM 2059 CB LEU A 127 -4.212 5.733 -3.005 1.00 0.00 C ATOM 2060 CG LEU A 127 -4.281 7.241 -3.250 1.00 0.00 C ATOM 2061 CD1 LEU A 127 -3.752 8.003 -2.046 1.00 0.00 C ATOM 2062 CD2 LEU A 127 -3.502 7.612 -4.502 1.00 0.00 C ATOM 0 H LEU A 127 -6.430 4.012 -2.086 1.00 0.00 H new ATOM 0 HA LEU A 127 -5.693 5.430 -4.533 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -4.212 5.555 -1.930 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -3.263 5.361 -3.390 1.00 0.00 H new ATOM 0 HG LEU A 127 -5.325 7.518 -3.399 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -3.809 9.074 -2.239 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -4.352 7.760 -1.169 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -2.715 7.722 -1.865 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -3.561 8.689 -4.662 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -2.459 7.320 -4.381 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -3.927 7.094 -5.362 1.00 0.00 H new ATOM 2074 N PRO A 128 -4.559 3.314 -5.328 1.00 0.00 N ATOM 2075 CA PRO A 128 -4.067 2.021 -5.819 1.00 0.00 C ATOM 2076 C PRO A 128 -2.735 1.636 -5.184 1.00 0.00 C ATOM 2077 O PRO A 128 -1.854 2.477 -5.005 1.00 0.00 O ATOM 2078 CB PRO A 128 -3.892 2.242 -7.326 1.00 0.00 C ATOM 2079 CG PRO A 128 -4.722 3.437 -7.648 1.00 0.00 C ATOM 2080 CD PRO A 128 -4.704 4.296 -6.417 1.00 0.00 C ATOM 0 HA PRO A 128 -4.752 1.209 -5.575 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -2.845 2.410 -7.580 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -4.221 1.371 -7.892 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -4.316 3.975 -8.505 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -5.740 3.147 -7.907 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -3.877 5.006 -6.433 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -5.621 4.877 -6.317 1.00 0.00 H new ATOM 2088 N LEU A 129 -2.593 0.357 -4.849 1.00 0.00 N ATOM 2089 CA LEU A 129 -1.367 -0.141 -4.236 1.00 0.00 C ATOM 2090 C LEU A 129 -1.126 -1.601 -4.609 1.00 0.00 C ATOM 2091 O LEU A 129 -2.043 -2.302 -5.037 1.00 0.00 O ATOM 2092 CB LEU A 129 -1.437 0.005 -2.715 1.00 0.00 C ATOM 2093 CG LEU A 129 -0.961 1.354 -2.171 1.00 0.00 C ATOM 2094 CD1 LEU A 129 -2.139 2.294 -1.973 1.00 0.00 C ATOM 2095 CD2 LEU A 129 -0.203 1.165 -0.865 1.00 0.00 C ATOM 0 H LEU A 129 -3.312 -0.353 -4.992 1.00 0.00 H new ATOM 0 HA LEU A 129 -0.534 0.453 -4.613 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -2.467 -0.155 -2.397 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -0.838 -0.784 -2.262 1.00 0.00 H new ATOM 0 HG LEU A 129 -0.284 1.800 -2.900 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -1.782 3.248 -1.586 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -2.641 2.455 -2.927 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -2.840 1.854 -1.264 1.00 0.00 H new ATOM 0 HD21 LEU A 129 0.128 2.135 -0.493 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -0.857 0.698 -0.129 1.00 0.00 H new ATOM 0 HD23 LEU A 129 0.664 0.527 -1.037 1.00 0.00 H new ATOM 2107 N ALA A 130 0.114 -2.051 -4.443 1.00 0.00 N ATOM 2108 CA ALA A 130 0.475 -3.428 -4.761 1.00 0.00 C ATOM 2109 C ALA A 130 1.491 -3.972 -3.763 1.00 0.00 C ATOM 2110 O ALA A 130 2.332 -3.233 -3.252 1.00 0.00 O ATOM 2111 CB ALA A 130 1.024 -3.515 -6.177 1.00 0.00 C ATOM 0 H ALA A 130 0.885 -1.483 -4.091 1.00 0.00 H new ATOM 0 HA ALA A 130 -0.425 -4.040 -4.694 1.00 0.00 H new ATOM 0 HB1 ALA A 130 1.290 -4.548 -6.401 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.267 -3.174 -6.883 1.00 0.00 H new ATOM 0 HB3 ALA A 130 1.910 -2.886 -6.263 1.00 0.00 H new ATOM 2117 N SER A 131 1.407 -5.271 -3.491 1.00 0.00 N ATOM 2118 CA SER A 131 2.320 -5.915 -2.553 1.00 0.00 C ATOM 2119 C SER A 131 3.148 -6.990 -3.251 1.00 0.00 C ATOM 2120 O SER A 131 2.614 -8.000 -3.708 1.00 0.00 O ATOM 2121 CB SER A 131 1.539 -6.532 -1.391 1.00 0.00 C ATOM 2122 OG SER A 131 2.411 -7.158 -0.465 1.00 0.00 O ATOM 0 H SER A 131 0.717 -5.897 -3.906 1.00 0.00 H new ATOM 0 HA SER A 131 2.997 -5.155 -2.164 1.00 0.00 H new ATOM 0 HB2 SER A 131 0.962 -5.758 -0.885 1.00 0.00 H new ATOM 0 HB3 SER A 131 0.826 -7.262 -1.775 1.00 0.00 H new ATOM 0 HG SER A 131 1.887 -7.543 0.269 1.00 0.00 H new ATOM 2128 N VAL A 132 4.456 -6.764 -3.329 1.00 0.00 N ATOM 2129 CA VAL A 132 5.357 -7.712 -3.972 1.00 0.00 C ATOM 2130 C VAL A 132 6.700 -7.769 -3.248 1.00 0.00 C ATOM 2131 O VAL A 132 7.367 -6.749 -3.077 1.00 0.00 O ATOM 2132 CB VAL A 132 5.593 -7.350 -5.451 1.00 0.00 C ATOM 2133 CG1 VAL A 132 6.236 -5.977 -5.574 1.00 0.00 C ATOM 2134 CG2 VAL A 132 6.445 -8.409 -6.135 1.00 0.00 C ATOM 0 H VAL A 132 4.914 -5.933 -2.955 1.00 0.00 H new ATOM 0 HA VAL A 132 4.879 -8.690 -3.921 1.00 0.00 H new ATOM 0 HB VAL A 132 4.625 -7.317 -5.952 1.00 0.00 H new ATOM 0 HG11 VAL A 132 6.393 -5.742 -6.627 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.582 -5.228 -5.129 1.00 0.00 H new ATOM 0 HG13 VAL A 132 7.194 -5.976 -5.055 1.00 0.00 H new ATOM 0 HG21 VAL A 132 6.599 -8.134 -7.178 1.00 0.00 H new ATOM 0 HG22 VAL A 132 7.409 -8.481 -5.632 1.00 0.00 H new ATOM 0 HG23 VAL A 132 5.937 -9.372 -6.085 1.00 0.00 H new ATOM 2144 N GLY A 133 7.090 -8.967 -2.826 1.00 0.00 N ATOM 2145 CA GLY A 133 8.350 -9.134 -2.128 1.00 0.00 C ATOM 2146 C GLY A 133 8.688 -10.590 -1.878 1.00 0.00 C ATOM 2147 O GLY A 133 8.107 -11.483 -2.494 1.00 0.00 O ATOM 0 H GLY A 133 6.555 -9.826 -2.955 1.00 0.00 H new ATOM 0 HA2 GLY A 133 9.148 -8.674 -2.711 1.00 0.00 H new ATOM 0 HA3 GLY A 133 8.306 -8.606 -1.175 1.00 0.00 H new ATOM 2151 N TYR A 134 9.629 -10.830 -0.970 1.00 0.00 N ATOM 2152 CA TYR A 134 10.043 -12.189 -0.640 1.00 0.00 C ATOM 2153 C TYR A 134 10.383 -12.310 0.841 1.00 0.00 C ATOM 2154 O TYR A 134 10.968 -11.401 1.431 1.00 0.00 O ATOM 2155 CB TYR A 134 11.250 -12.597 -1.486 1.00 0.00 C ATOM 2156 CG TYR A 134 11.594 -14.065 -1.385 1.00 0.00 C ATOM 2157 CD1 TYR A 134 12.120 -14.597 -0.213 1.00 0.00 C ATOM 2158 CD2 TYR A 134 11.393 -14.922 -2.460 1.00 0.00 C ATOM 2159 CE1 TYR A 134 12.435 -15.939 -0.117 1.00 0.00 C ATOM 2160 CE2 TYR A 134 11.706 -16.265 -2.371 1.00 0.00 C ATOM 2161 CZ TYR A 134 12.225 -16.768 -1.198 1.00 0.00 C ATOM 2162 OH TYR A 134 12.539 -18.105 -1.105 1.00 0.00 O ATOM 0 H TYR A 134 10.119 -10.102 -0.450 1.00 0.00 H new ATOM 0 HA TYR A 134 9.211 -12.858 -0.859 1.00 0.00 H new ATOM 0 HB2 TYR A 134 11.052 -12.350 -2.529 1.00 0.00 H new ATOM 0 HB3 TYR A 134 12.114 -12.008 -1.178 1.00 0.00 H new ATOM 0 HD1 TYR A 134 12.285 -13.951 0.636 1.00 0.00 H new ATOM 0 HD2 TYR A 134 10.985 -14.532 -3.381 1.00 0.00 H new ATOM 0 HE1 TYR A 134 12.844 -16.336 0.800 1.00 0.00 H new ATOM 0 HE2 TYR A 134 11.545 -16.917 -3.217 1.00 0.00 H new ATOM 0 HH TYR A 134 12.330 -18.550 -1.953 1.00 0.00 H new ATOM 2172 N GLY A 135 10.012 -13.439 1.439 1.00 0.00 N ATOM 2173 CA GLY A 135 10.286 -13.657 2.847 1.00 0.00 C ATOM 2174 C GLY A 135 9.687 -12.576 3.729 1.00 0.00 C ATOM 2175 O GLY A 135 8.589 -12.091 3.456 1.00 0.00 O ATOM 0 H GLY A 135 9.527 -14.206 0.973 1.00 0.00 H new ATOM 0 HA2 GLY A 135 9.888 -14.627 3.145 1.00 0.00 H new ATOM 0 HA3 GLY A 135 11.364 -13.693 3.003 1.00 0.00 H new ATOM 2179 N PRO A 136 10.390 -12.171 4.802 1.00 0.00 N ATOM 2180 CA PRO A 136 9.902 -11.132 5.716 1.00 0.00 C ATOM 2181 C PRO A 136 9.852 -9.757 5.057 1.00 0.00 C ATOM 2182 O PRO A 136 9.124 -8.871 5.502 1.00 0.00 O ATOM 2183 CB PRO A 136 10.928 -11.143 6.853 1.00 0.00 C ATOM 2184 CG PRO A 136 12.167 -11.700 6.243 1.00 0.00 C ATOM 2185 CD PRO A 136 11.709 -12.689 5.208 1.00 0.00 C ATOM 0 HA PRO A 136 8.881 -11.328 6.045 1.00 0.00 H new ATOM 0 HB2 PRO A 136 11.096 -10.139 7.244 1.00 0.00 H new ATOM 0 HB3 PRO A 136 10.587 -11.757 7.687 1.00 0.00 H new ATOM 0 HG2 PRO A 136 12.768 -10.911 5.790 1.00 0.00 H new ATOM 0 HG3 PRO A 136 12.790 -12.183 6.996 1.00 0.00 H new ATOM 0 HD2 PRO A 136 12.399 -12.737 4.365 1.00 0.00 H new ATOM 0 HD3 PRO A 136 11.636 -13.696 5.619 1.00 0.00 H new ATOM 2193 N VAL A 137 10.631 -9.585 3.993 1.00 0.00 N ATOM 2194 CA VAL A 137 10.673 -8.318 3.273 1.00 0.00 C ATOM 2195 C VAL A 137 9.563 -8.242 2.229 1.00 0.00 C ATOM 2196 O VAL A 137 9.403 -9.148 1.413 1.00 0.00 O ATOM 2197 CB VAL A 137 12.031 -8.112 2.577 1.00 0.00 C ATOM 2198 CG1 VAL A 137 12.128 -6.709 1.998 1.00 0.00 C ATOM 2199 CG2 VAL A 137 13.173 -8.376 3.546 1.00 0.00 C ATOM 0 H VAL A 137 11.241 -10.307 3.611 1.00 0.00 H new ATOM 0 HA VAL A 137 10.529 -7.530 4.012 1.00 0.00 H new ATOM 0 HB VAL A 137 12.109 -8.825 1.756 1.00 0.00 H new ATOM 0 HG11 VAL A 137 13.095 -6.583 1.510 1.00 0.00 H new ATOM 0 HG12 VAL A 137 11.332 -6.560 1.269 1.00 0.00 H new ATOM 0 HG13 VAL A 137 12.027 -5.977 2.799 1.00 0.00 H new ATOM 0 HG21 VAL A 137 14.125 -8.226 3.036 1.00 0.00 H new ATOM 0 HG22 VAL A 137 13.101 -7.689 4.390 1.00 0.00 H new ATOM 0 HG23 VAL A 137 13.113 -9.403 3.908 1.00 0.00 H new ATOM 2209 N THR A 138 8.800 -7.155 2.263 1.00 0.00 N ATOM 2210 CA THR A 138 7.705 -6.961 1.321 1.00 0.00 C ATOM 2211 C THR A 138 7.745 -5.559 0.721 1.00 0.00 C ATOM 2212 O THR A 138 7.778 -4.563 1.445 1.00 0.00 O ATOM 2213 CB THR A 138 6.361 -7.192 2.013 1.00 0.00 C ATOM 2214 OG1 THR A 138 6.426 -8.321 2.867 1.00 0.00 O ATOM 2215 CG2 THR A 138 5.219 -7.414 1.045 1.00 0.00 C ATOM 0 H THR A 138 8.920 -6.395 2.933 1.00 0.00 H new ATOM 0 HA THR A 138 7.821 -7.686 0.515 1.00 0.00 H new ATOM 0 HB THR A 138 6.165 -6.280 2.577 1.00 0.00 H new ATOM 0 HG1 THR A 138 5.592 -8.832 2.798 1.00 0.00 H new ATOM 0 HG21 THR A 138 4.295 -7.571 1.602 1.00 0.00 H new ATOM 0 HG22 THR A 138 5.111 -6.540 0.403 1.00 0.00 H new ATOM 0 HG23 THR A 138 5.427 -8.291 0.432 1.00 0.00 H new ATOM 2223 N PHE A 139 7.743 -5.487 -0.606 1.00 0.00 N ATOM 2224 CA PHE A 139 7.779 -4.207 -1.303 1.00 0.00 C ATOM 2225 C PHE A 139 6.369 -3.723 -1.625 1.00 0.00 C ATOM 2226 O PHE A 139 5.587 -4.435 -2.256 1.00 0.00 O ATOM 2227 CB PHE A 139 8.596 -4.327 -2.591 1.00 0.00 C ATOM 2228 CG PHE A 139 9.325 -3.066 -2.958 1.00 0.00 C ATOM 2229 CD1 PHE A 139 10.545 -2.760 -2.377 1.00 0.00 C ATOM 2230 CD2 PHE A 139 8.789 -2.186 -3.886 1.00 0.00 C ATOM 2231 CE1 PHE A 139 11.218 -1.600 -2.714 1.00 0.00 C ATOM 2232 CE2 PHE A 139 9.458 -1.025 -4.227 1.00 0.00 C ATOM 2233 CZ PHE A 139 10.674 -0.732 -3.640 1.00 0.00 C ATOM 0 H PHE A 139 7.717 -6.301 -1.220 1.00 0.00 H new ATOM 0 HA PHE A 139 8.253 -3.477 -0.647 1.00 0.00 H new ATOM 0 HB2 PHE A 139 9.318 -5.136 -2.480 1.00 0.00 H new ATOM 0 HB3 PHE A 139 7.931 -4.604 -3.409 1.00 0.00 H new ATOM 0 HD1 PHE A 139 10.975 -3.435 -1.652 1.00 0.00 H new ATOM 0 HD2 PHE A 139 7.839 -2.410 -4.347 1.00 0.00 H new ATOM 0 HE1 PHE A 139 12.168 -1.373 -2.253 1.00 0.00 H new ATOM 0 HE2 PHE A 139 9.030 -0.348 -4.952 1.00 0.00 H new ATOM 0 HZ PHE A 139 11.198 0.174 -3.905 1.00 0.00 H new ATOM 2243 N GLN A 140 6.051 -2.510 -1.187 1.00 0.00 N ATOM 2244 CA GLN A 140 4.735 -1.930 -1.430 1.00 0.00 C ATOM 2245 C GLN A 140 4.816 -0.803 -2.453 1.00 0.00 C ATOM 2246 O GLN A 140 5.527 0.182 -2.253 1.00 0.00 O ATOM 2247 CB GLN A 140 4.137 -1.407 -0.122 1.00 0.00 C ATOM 2248 CG GLN A 140 3.264 -2.423 0.597 1.00 0.00 C ATOM 2249 CD GLN A 140 1.786 -2.204 0.343 1.00 0.00 C ATOM 2250 OE1 GLN A 140 1.376 -1.890 -0.775 1.00 0.00 O ATOM 2251 NE2 GLN A 140 0.976 -2.369 1.382 1.00 0.00 N ATOM 0 H GLN A 140 6.686 -1.909 -0.662 1.00 0.00 H new ATOM 0 HA GLN A 140 4.089 -2.712 -1.830 1.00 0.00 H new ATOM 0 HB2 GLN A 140 4.946 -1.102 0.541 1.00 0.00 H new ATOM 0 HB3 GLN A 140 3.545 -0.517 -0.333 1.00 0.00 H new ATOM 0 HG2 GLN A 140 3.540 -3.427 0.274 1.00 0.00 H new ATOM 0 HG3 GLN A 140 3.457 -2.369 1.668 1.00 0.00 H new ATOM 0 HE21 GLN A 140 1.359 -2.630 2.291 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -0.029 -2.235 1.271 1.00 0.00 H new ATOM 2260 N MET A 141 4.082 -0.953 -3.552 1.00 0.00 N ATOM 2261 CA MET A 141 4.069 0.053 -4.606 1.00 0.00 C ATOM 2262 C MET A 141 2.748 0.815 -4.614 1.00 0.00 C ATOM 2263 O MET A 141 1.699 0.261 -4.285 1.00 0.00 O ATOM 2264 CB MET A 141 4.301 -0.603 -5.969 1.00 0.00 C ATOM 2265 CG MET A 141 5.761 -0.913 -6.255 1.00 0.00 C ATOM 2266 SD MET A 141 6.122 -0.992 -8.019 1.00 0.00 S ATOM 2267 CE MET A 141 7.650 -1.926 -8.011 1.00 0.00 C ATOM 0 H MET A 141 3.489 -1.762 -3.735 1.00 0.00 H new ATOM 0 HA MET A 141 4.875 0.760 -4.409 1.00 0.00 H new ATOM 0 HB2 MET A 141 3.725 -1.527 -6.021 1.00 0.00 H new ATOM 0 HB3 MET A 141 3.918 0.055 -6.749 1.00 0.00 H new ATOM 0 HG2 MET A 141 6.387 -0.149 -5.794 1.00 0.00 H new ATOM 0 HG3 MET A 141 6.024 -1.864 -5.791 1.00 0.00 H new ATOM 0 HE1 MET A 141 8.001 -2.058 -9.034 1.00 0.00 H new ATOM 0 HE2 MET A 141 8.403 -1.387 -7.436 1.00 0.00 H new ATOM 0 HE3 MET A 141 7.477 -2.902 -7.558 1.00 0.00 H new ATOM 2277 N THR A 142 2.806 2.088 -4.991 1.00 0.00 N ATOM 2278 CA THR A 142 1.614 2.925 -5.040 1.00 0.00 C ATOM 2279 C THR A 142 1.508 3.646 -6.380 1.00 0.00 C ATOM 2280 O THR A 142 2.500 4.152 -6.905 1.00 0.00 O ATOM 2281 CB THR A 142 1.635 3.945 -3.900 1.00 0.00 C ATOM 2282 OG1 THR A 142 1.757 3.295 -2.648 1.00 0.00 O ATOM 2283 CG2 THR A 142 0.395 4.811 -3.848 1.00 0.00 C ATOM 0 H THR A 142 3.666 2.562 -5.267 1.00 0.00 H new ATOM 0 HA THR A 142 0.743 2.279 -4.926 1.00 0.00 H new ATOM 0 HB THR A 142 2.496 4.583 -4.100 1.00 0.00 H new ATOM 0 HG1 THR A 142 2.637 3.488 -2.263 1.00 0.00 H new ATOM 0 HG21 THR A 142 0.475 5.512 -3.017 1.00 0.00 H new ATOM 0 HG22 THR A 142 0.299 5.365 -4.782 1.00 0.00 H new ATOM 0 HG23 THR A 142 -0.483 4.181 -3.708 1.00 0.00 H new ATOM 2291 N TYR A 143 0.297 3.691 -6.928 1.00 0.00 N ATOM 2292 CA TYR A 143 0.059 4.351 -8.206 1.00 0.00 C ATOM 2293 C TYR A 143 -0.929 5.501 -8.046 1.00 0.00 C ATOM 2294 O TYR A 143 -1.818 5.453 -7.196 1.00 0.00 O ATOM 2295 CB TYR A 143 -0.471 3.347 -9.231 1.00 0.00 C ATOM 2296 CG TYR A 143 0.603 2.468 -9.833 1.00 0.00 C ATOM 2297 CD1 TYR A 143 1.499 2.975 -10.765 1.00 0.00 C ATOM 2298 CD2 TYR A 143 0.721 1.133 -9.467 1.00 0.00 C ATOM 2299 CE1 TYR A 143 2.482 2.175 -11.317 1.00 0.00 C ATOM 2300 CE2 TYR A 143 1.701 0.327 -10.014 1.00 0.00 C ATOM 2301 CZ TYR A 143 2.578 0.853 -10.938 1.00 0.00 C ATOM 2302 OH TYR A 143 3.556 0.054 -11.485 1.00 0.00 O ATOM 0 H TYR A 143 -0.535 3.278 -6.506 1.00 0.00 H new ATOM 0 HA TYR A 143 1.007 4.756 -8.561 1.00 0.00 H new ATOM 0 HB2 TYR A 143 -1.220 2.715 -8.754 1.00 0.00 H new ATOM 0 HB3 TYR A 143 -0.975 3.890 -10.031 1.00 0.00 H new ATOM 0 HD1 TYR A 143 1.427 4.010 -11.063 1.00 0.00 H new ATOM 0 HD2 TYR A 143 0.035 0.718 -8.743 1.00 0.00 H new ATOM 0 HE1 TYR A 143 3.171 2.583 -12.041 1.00 0.00 H new ATOM 0 HE2 TYR A 143 1.779 -0.709 -9.719 1.00 0.00 H new ATOM 0 HH TYR A 143 3.487 -0.849 -11.111 1.00 0.00 H new ATOM 2312 N ILE A 144 -0.768 6.534 -8.866 1.00 0.00 N ATOM 2313 CA ILE A 144 -1.647 7.696 -8.812 1.00 0.00 C ATOM 2314 C ILE A 144 -2.588 7.732 -10.015 1.00 0.00 C ATOM 2315 O ILE A 144 -2.193 7.394 -11.130 1.00 0.00 O ATOM 2316 CB ILE A 144 -0.843 9.009 -8.766 1.00 0.00 C ATOM 2317 CG1 ILE A 144 0.146 9.068 -9.931 1.00 0.00 C ATOM 2318 CG2 ILE A 144 -0.114 9.138 -7.437 1.00 0.00 C ATOM 2319 CD1 ILE A 144 0.291 10.449 -10.531 1.00 0.00 C ATOM 0 H ILE A 144 -0.037 6.590 -9.575 1.00 0.00 H new ATOM 0 HA ILE A 144 -2.233 7.605 -7.897 1.00 0.00 H new ATOM 0 HB ILE A 144 -1.536 9.845 -8.860 1.00 0.00 H new ATOM 0 HG12 ILE A 144 1.122 8.726 -9.586 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -0.178 8.375 -10.708 1.00 0.00 H new ATOM 0 HG21 ILE A 144 0.450 10.071 -7.420 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -0.839 9.137 -6.623 1.00 0.00 H new ATOM 0 HG23 ILE A 144 0.570 8.299 -7.314 1.00 0.00 H new ATOM 0 HD11 ILE A 144 1.008 10.416 -11.352 1.00 0.00 H new ATOM 0 HD12 ILE A 144 -0.675 10.786 -10.907 1.00 0.00 H new ATOM 0 HD13 ILE A 144 0.645 11.142 -9.768 1.00 0.00 H new ATOM 2331 N PRO A 145 -3.850 8.146 -9.804 1.00 0.00 N ATOM 2332 CA PRO A 145 -4.843 8.225 -10.879 1.00 0.00 C ATOM 2333 C PRO A 145 -4.600 9.413 -11.804 1.00 0.00 C ATOM 2334 O PRO A 145 -3.776 10.281 -11.512 1.00 0.00 O ATOM 2335 CB PRO A 145 -6.161 8.394 -10.126 1.00 0.00 C ATOM 2336 CG PRO A 145 -5.782 9.076 -8.857 1.00 0.00 C ATOM 2337 CD PRO A 145 -4.409 8.569 -8.504 1.00 0.00 C ATOM 0 HA PRO A 145 -4.816 7.350 -11.528 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -6.872 8.989 -10.699 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -6.634 7.431 -9.933 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -5.777 10.159 -8.983 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -6.496 8.850 -8.065 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -3.802 9.346 -8.040 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -4.457 7.739 -7.799 1.00 0.00 H new ATOM 2345 N GLY A 146 -5.322 9.448 -12.919 1.00 0.00 N ATOM 2346 CA GLY A 146 -5.170 10.535 -13.867 1.00 0.00 C ATOM 2347 C GLY A 146 -5.480 10.113 -15.290 1.00 0.00 C ATOM 2348 O GLY A 146 -5.868 8.971 -15.535 1.00 0.00 O ATOM 0 H GLY A 146 -6.010 8.743 -13.183 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -5.829 11.355 -13.583 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -4.150 10.915 -13.818 1.00 0.00 H new ATOM 2352 N THR A 147 -5.311 11.039 -16.229 1.00 0.00 N ATOM 2353 CA THR A 147 -5.576 10.757 -17.634 1.00 0.00 C ATOM 2354 C THR A 147 -4.324 10.238 -18.332 1.00 0.00 C ATOM 2355 O THR A 147 -3.367 10.983 -18.549 1.00 0.00 O ATOM 2356 CB THR A 147 -6.083 12.016 -18.341 1.00 0.00 C ATOM 2357 OG1 THR A 147 -6.201 11.796 -19.735 1.00 0.00 O ATOM 2358 CG2 THR A 147 -5.184 13.218 -18.140 1.00 0.00 C ATOM 0 H THR A 147 -4.992 11.990 -16.042 1.00 0.00 H new ATOM 0 HA THR A 147 -6.344 9.985 -17.685 1.00 0.00 H new ATOM 0 HB THR A 147 -7.053 12.228 -17.892 1.00 0.00 H new ATOM 0 HG1 THR A 147 -6.528 12.612 -20.168 1.00 0.00 H new ATOM 0 HG21 THR A 147 -5.601 14.076 -18.667 1.00 0.00 H new ATOM 0 HG22 THR A 147 -5.113 13.445 -17.076 1.00 0.00 H new ATOM 0 HG23 THR A 147 -4.191 12.999 -18.532 1.00 0.00 H new ATOM 2366 N TYR A 148 -4.335 8.956 -18.681 1.00 0.00 N ATOM 2367 CA TYR A 148 -3.199 8.336 -19.354 1.00 0.00 C ATOM 2368 C TYR A 148 -1.948 8.399 -18.482 1.00 0.00 C ATOM 2369 O TYR A 148 -0.829 8.482 -18.989 1.00 0.00 O ATOM 2370 CB TYR A 148 -2.936 9.025 -20.694 1.00 0.00 C ATOM 2371 CG TYR A 148 -3.705 8.422 -21.847 1.00 0.00 C ATOM 2372 CD1 TYR A 148 -3.648 7.058 -22.108 1.00 0.00 C ATOM 2373 CD2 TYR A 148 -4.488 9.215 -22.677 1.00 0.00 C ATOM 2374 CE1 TYR A 148 -4.350 6.503 -23.161 1.00 0.00 C ATOM 2375 CE2 TYR A 148 -5.193 8.668 -23.732 1.00 0.00 C ATOM 2376 CZ TYR A 148 -5.120 7.312 -23.970 1.00 0.00 C ATOM 2377 OH TYR A 148 -5.820 6.763 -25.019 1.00 0.00 O ATOM 0 H TYR A 148 -5.118 8.326 -18.509 1.00 0.00 H new ATOM 0 HA TYR A 148 -3.442 7.289 -19.533 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -3.196 10.080 -20.607 1.00 0.00 H new ATOM 0 HB3 TYR A 148 -1.870 8.976 -20.915 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -3.045 6.421 -21.477 1.00 0.00 H new ATOM 0 HD2 TYR A 148 -4.547 10.278 -22.494 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -4.296 5.441 -23.349 1.00 0.00 H new ATOM 0 HE2 TYR A 148 -5.798 9.299 -24.366 1.00 0.00 H new ATOM 0 HH TYR A 148 -6.312 7.468 -25.488 1.00 0.00 H new ATOM 2387 N ASN A 149 -2.147 8.359 -17.169 1.00 0.00 N ATOM 2388 CA ASN A 149 -1.034 8.412 -16.227 1.00 0.00 C ATOM 2389 C ASN A 149 -0.643 7.010 -15.769 1.00 0.00 C ATOM 2390 O ASN A 149 -1.068 6.551 -14.709 1.00 0.00 O ATOM 2391 CB ASN A 149 -1.403 9.271 -15.017 1.00 0.00 C ATOM 2392 CG ASN A 149 -0.207 10.007 -14.443 1.00 0.00 C ATOM 2393 OD1 ASN A 149 0.652 9.408 -13.796 1.00 0.00 O ATOM 2394 ND2 ASN A 149 -0.147 11.312 -14.679 1.00 0.00 N ATOM 0 H ASN A 149 -3.067 8.290 -16.733 1.00 0.00 H new ATOM 0 HA ASN A 149 -0.181 8.861 -16.736 1.00 0.00 H new ATOM 0 HB2 ASN A 149 -2.166 9.994 -15.307 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -1.841 8.638 -14.245 1.00 0.00 H new ATOM 0 HD21 ASN A 149 0.634 11.860 -14.319 1.00 0.00 H new ATOM 0 HD22 ASN A 149 -0.882 11.767 -15.221 1.00 0.00 H new ATOM 2401 N ASN A 150 0.168 6.334 -16.576 1.00 0.00 N ATOM 2402 CA ASN A 150 0.616 4.984 -16.254 1.00 0.00 C ATOM 2403 C ASN A 150 2.084 4.795 -16.620 1.00 0.00 C ATOM 2404 O ASN A 150 2.438 4.739 -17.798 1.00 0.00 O ATOM 2405 CB ASN A 150 -0.242 3.952 -16.989 1.00 0.00 C ATOM 2406 CG ASN A 150 -0.242 4.163 -18.490 1.00 0.00 C ATOM 2407 OD1 ASN A 150 0.400 3.421 -19.233 1.00 0.00 O ATOM 2408 ND2 ASN A 150 -0.964 5.182 -18.944 1.00 0.00 N ATOM 0 H ASN A 150 0.528 6.699 -17.458 1.00 0.00 H new ATOM 0 HA ASN A 150 0.508 4.839 -15.179 1.00 0.00 H new ATOM 0 HB2 ASN A 150 0.128 2.951 -16.766 1.00 0.00 H new ATOM 0 HB3 ASN A 150 -1.265 4.004 -16.618 1.00 0.00 H new ATOM 0 HD21 ASN A 150 -1.001 5.375 -19.945 1.00 0.00 H new ATOM 0 HD22 ASN A 150 -1.481 5.772 -18.292 1.00 0.00 H new ATOM 2415 N GLY A 151 2.934 4.697 -15.604 1.00 0.00 N ATOM 2416 CA GLY A 151 4.354 4.515 -15.839 1.00 0.00 C ATOM 2417 C GLY A 151 5.110 5.828 -15.884 1.00 0.00 C ATOM 2418 O GLY A 151 6.142 5.935 -16.546 1.00 0.00 O ATOM 0 H GLY A 151 2.665 4.740 -14.621 1.00 0.00 H new ATOM 0 HA2 GLY A 151 4.771 3.887 -15.052 1.00 0.00 H new ATOM 0 HA3 GLY A 151 4.498 3.985 -16.780 1.00 0.00 H new ATOM 2422 N ASN A 152 4.595 6.830 -15.178 1.00 0.00 N ATOM 2423 CA ASN A 152 5.229 8.143 -15.140 1.00 0.00 C ATOM 2424 C ASN A 152 5.811 8.428 -13.760 1.00 0.00 C ATOM 2425 O ASN A 152 6.963 8.844 -13.634 1.00 0.00 O ATOM 2426 CB ASN A 152 4.221 9.231 -15.516 1.00 0.00 C ATOM 2427 CG ASN A 152 4.836 10.320 -16.373 1.00 0.00 C ATOM 2428 OD1 ASN A 152 4.229 10.785 -17.337 1.00 0.00 O ATOM 2429 ND2 ASN A 152 6.049 10.732 -16.024 1.00 0.00 N ATOM 0 H ASN A 152 3.741 6.758 -14.625 1.00 0.00 H new ATOM 0 HA ASN A 152 6.043 8.146 -15.865 1.00 0.00 H new ATOM 0 HB2 ASN A 152 3.386 8.779 -16.052 1.00 0.00 H new ATOM 0 HB3 ASN A 152 3.814 9.674 -14.607 1.00 0.00 H new ATOM 0 HD21 ASN A 152 6.514 11.462 -16.563 1.00 0.00 H new ATOM 0 HD22 ASN A 152 6.516 10.318 -15.217 1.00 0.00 H new ATOM 2436 N VAL A 153 5.007 8.201 -12.727 1.00 0.00 N ATOM 2437 CA VAL A 153 5.443 8.433 -11.354 1.00 0.00 C ATOM 2438 C VAL A 153 4.890 7.368 -10.415 1.00 0.00 C ATOM 2439 O VAL A 153 3.679 7.153 -10.347 1.00 0.00 O ATOM 2440 CB VAL A 153 5.003 9.821 -10.853 1.00 0.00 C ATOM 2441 CG1 VAL A 153 5.854 10.912 -11.486 1.00 0.00 C ATOM 2442 CG2 VAL A 153 3.528 10.051 -11.140 1.00 0.00 C ATOM 0 H VAL A 153 4.051 7.857 -12.814 1.00 0.00 H new ATOM 0 HA VAL A 153 6.532 8.383 -11.355 1.00 0.00 H new ATOM 0 HB VAL A 153 5.148 9.859 -9.773 1.00 0.00 H new ATOM 0 HG11 VAL A 153 5.528 11.886 -11.120 1.00 0.00 H new ATOM 0 HG12 VAL A 153 6.900 10.756 -11.222 1.00 0.00 H new ATOM 0 HG13 VAL A 153 5.744 10.876 -12.570 1.00 0.00 H new ATOM 0 HG21 VAL A 153 3.236 11.037 -10.778 1.00 0.00 H new ATOM 0 HG22 VAL A 153 3.353 9.992 -12.214 1.00 0.00 H new ATOM 0 HG23 VAL A 153 2.936 9.289 -10.633 1.00 0.00 H new ATOM 2452 N TYR A 154 5.784 6.703 -9.691 1.00 0.00 N ATOM 2453 CA TYR A 154 5.385 5.659 -8.756 1.00 0.00 C ATOM 2454 C TYR A 154 6.123 5.808 -7.429 1.00 0.00 C ATOM 2455 O TYR A 154 7.309 6.136 -7.399 1.00 0.00 O ATOM 2456 CB TYR A 154 5.661 4.278 -9.353 1.00 0.00 C ATOM 2457 CG TYR A 154 7.057 4.127 -9.914 1.00 0.00 C ATOM 2458 CD1 TYR A 154 7.354 4.535 -11.208 1.00 0.00 C ATOM 2459 CD2 TYR A 154 8.077 3.578 -9.148 1.00 0.00 C ATOM 2460 CE1 TYR A 154 8.628 4.400 -11.723 1.00 0.00 C ATOM 2461 CE2 TYR A 154 9.355 3.439 -9.656 1.00 0.00 C ATOM 2462 CZ TYR A 154 9.625 3.851 -10.944 1.00 0.00 C ATOM 2463 OH TYR A 154 10.896 3.714 -11.454 1.00 0.00 O ATOM 0 H TYR A 154 6.789 6.869 -9.734 1.00 0.00 H new ATOM 0 HA TYR A 154 4.316 5.760 -8.571 1.00 0.00 H new ATOM 0 HB2 TYR A 154 5.504 3.521 -8.584 1.00 0.00 H new ATOM 0 HB3 TYR A 154 4.938 4.083 -10.145 1.00 0.00 H new ATOM 0 HD1 TYR A 154 6.576 4.965 -11.821 1.00 0.00 H new ATOM 0 HD2 TYR A 154 7.868 3.254 -8.139 1.00 0.00 H new ATOM 0 HE1 TYR A 154 8.843 4.723 -12.731 1.00 0.00 H new ATOM 0 HE2 TYR A 154 10.138 3.010 -9.048 1.00 0.00 H new ATOM 0 HH TYR A 154 11.479 3.311 -10.777 1.00 0.00 H new ATOM 2473 N PHE A 155 5.413 5.563 -6.332 1.00 0.00 N ATOM 2474 CA PHE A 155 5.999 5.670 -5.003 1.00 0.00 C ATOM 2475 C PHE A 155 6.267 4.289 -4.414 1.00 0.00 C ATOM 2476 O PHE A 155 5.427 3.393 -4.501 1.00 0.00 O ATOM 2477 CB PHE A 155 5.074 6.466 -4.077 1.00 0.00 C ATOM 2478 CG PHE A 155 5.722 7.684 -3.485 1.00 0.00 C ATOM 2479 CD1 PHE A 155 5.902 8.828 -4.246 1.00 0.00 C ATOM 2480 CD2 PHE A 155 6.151 7.686 -2.168 1.00 0.00 C ATOM 2481 CE1 PHE A 155 6.498 9.951 -3.704 1.00 0.00 C ATOM 2482 CE2 PHE A 155 6.748 8.805 -1.620 1.00 0.00 C ATOM 2483 CZ PHE A 155 6.922 9.939 -2.389 1.00 0.00 C ATOM 0 H PHE A 155 4.431 5.289 -6.339 1.00 0.00 H new ATOM 0 HA PHE A 155 6.950 6.196 -5.092 1.00 0.00 H new ATOM 0 HB2 PHE A 155 4.189 6.770 -4.635 1.00 0.00 H new ATOM 0 HB3 PHE A 155 4.734 5.817 -3.270 1.00 0.00 H new ATOM 0 HD1 PHE A 155 5.573 8.842 -5.274 1.00 0.00 H new ATOM 0 HD2 PHE A 155 6.017 6.802 -1.562 1.00 0.00 H new ATOM 0 HE1 PHE A 155 6.632 10.837 -4.307 1.00 0.00 H new ATOM 0 HE2 PHE A 155 7.078 8.793 -0.592 1.00 0.00 H new ATOM 0 HZ PHE A 155 7.389 10.815 -1.963 1.00 0.00 H new ATOM 2493 N ALA A 156 7.441 4.123 -3.815 1.00 0.00 N ATOM 2494 CA ALA A 156 7.820 2.851 -3.211 1.00 0.00 C ATOM 2495 C ALA A 156 7.790 2.934 -1.690 1.00 0.00 C ATOM 2496 O ALA A 156 7.991 4.003 -1.113 1.00 0.00 O ATOM 2497 CB ALA A 156 9.201 2.431 -3.692 1.00 0.00 C ATOM 0 H ALA A 156 8.147 4.854 -3.735 1.00 0.00 H new ATOM 0 HA ALA A 156 7.094 2.099 -3.521 1.00 0.00 H new ATOM 0 HB1 ALA A 156 9.472 1.480 -3.234 1.00 0.00 H new ATOM 0 HB2 ALA A 156 9.191 2.321 -4.776 1.00 0.00 H new ATOM 0 HB3 ALA A 156 9.931 3.190 -3.411 1.00 0.00 H new ATOM 2503 N TRP A 157 7.536 1.801 -1.045 1.00 0.00 N ATOM 2504 CA TRP A 157 7.479 1.746 0.411 1.00 0.00 C ATOM 2505 C TRP A 157 7.997 0.406 0.925 1.00 0.00 C ATOM 2506 O TRP A 157 7.927 -0.606 0.229 1.00 0.00 O ATOM 2507 CB TRP A 157 6.046 1.973 0.896 1.00 0.00 C ATOM 2508 CG TRP A 157 5.479 3.294 0.477 1.00 0.00 C ATOM 2509 CD1 TRP A 157 4.860 3.584 -0.705 1.00 0.00 C ATOM 2510 CD2 TRP A 157 5.480 4.508 1.238 1.00 0.00 C ATOM 2511 NE1 TRP A 157 4.475 4.902 -0.726 1.00 0.00 N ATOM 2512 CE2 TRP A 157 4.845 5.491 0.456 1.00 0.00 C ATOM 2513 CE3 TRP A 157 5.955 4.859 2.505 1.00 0.00 C ATOM 2514 CZ2 TRP A 157 4.673 6.800 0.900 1.00 0.00 C ATOM 2515 CZ3 TRP A 157 5.785 6.158 2.944 1.00 0.00 C ATOM 2516 CH2 TRP A 157 5.148 7.115 2.143 1.00 0.00 C ATOM 0 H TRP A 157 7.366 0.908 -1.508 1.00 0.00 H new ATOM 0 HA TRP A 157 8.117 2.537 0.805 1.00 0.00 H new ATOM 0 HB2 TRP A 157 5.410 1.175 0.513 1.00 0.00 H new ATOM 0 HB3 TRP A 157 6.023 1.905 1.984 1.00 0.00 H new ATOM 0 HD1 TRP A 157 4.697 2.879 -1.507 1.00 0.00 H new ATOM 0 HE1 TRP A 157 3.993 5.367 -1.495 1.00 0.00 H new ATOM 0 HE3 TRP A 157 6.446 4.128 3.130 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 4.182 7.540 0.285 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 6.149 6.440 3.921 1.00 0.00 H new ATOM 0 HH2 TRP A 157 5.030 8.122 2.515 1.00 0.00 H new ATOM 2527 N MET A 158 8.516 0.409 2.149 1.00 0.00 N ATOM 2528 CA MET A 158 9.046 -0.806 2.757 1.00 0.00 C ATOM 2529 C MET A 158 8.095 -1.340 3.823 1.00 0.00 C ATOM 2530 O MET A 158 7.738 -0.630 4.763 1.00 0.00 O ATOM 2531 CB MET A 158 10.420 -0.535 3.372 1.00 0.00 C ATOM 2532 CG MET A 158 11.385 -1.703 3.244 1.00 0.00 C ATOM 2533 SD MET A 158 12.632 -1.718 4.545 1.00 0.00 S ATOM 2534 CE MET A 158 14.125 -1.469 3.587 1.00 0.00 C ATOM 0 H MET A 158 8.581 1.239 2.739 1.00 0.00 H new ATOM 0 HA MET A 158 9.147 -1.560 1.976 1.00 0.00 H new ATOM 0 HB2 MET A 158 10.857 0.341 2.893 1.00 0.00 H new ATOM 0 HB3 MET A 158 10.295 -0.292 4.427 1.00 0.00 H new ATOM 0 HG2 MET A 158 10.824 -2.637 3.272 1.00 0.00 H new ATOM 0 HG3 MET A 158 11.879 -1.657 2.273 1.00 0.00 H new ATOM 0 HE1 MET A 158 14.987 -1.455 4.254 1.00 0.00 H new ATOM 0 HE2 MET A 158 14.236 -2.281 2.868 1.00 0.00 H new ATOM 0 HE3 MET A 158 14.062 -0.520 3.055 1.00 0.00 H new ATOM 2544 N ARG A 159 7.689 -2.596 3.672 1.00 0.00 N ATOM 2545 CA ARG A 159 6.779 -3.227 4.621 1.00 0.00 C ATOM 2546 C ARG A 159 7.428 -4.447 5.267 1.00 0.00 C ATOM 2547 O ARG A 159 7.573 -5.494 4.635 1.00 0.00 O ATOM 2548 CB ARG A 159 5.482 -3.636 3.923 1.00 0.00 C ATOM 2549 CG ARG A 159 4.247 -3.489 4.798 1.00 0.00 C ATOM 2550 CD ARG A 159 3.038 -4.167 4.174 1.00 0.00 C ATOM 2551 NE ARG A 159 3.315 -5.554 3.811 1.00 0.00 N ATOM 2552 CZ ARG A 159 3.333 -6.559 4.682 1.00 0.00 C ATOM 2553 NH1 ARG A 159 3.092 -6.337 5.968 1.00 0.00 N ATOM 2554 NH2 ARG A 159 3.594 -7.792 4.268 1.00 0.00 N ATOM 0 H ARG A 159 7.976 -3.198 2.900 1.00 0.00 H new ATOM 0 HA ARG A 159 6.549 -2.502 5.402 1.00 0.00 H new ATOM 0 HB2 ARG A 159 5.355 -3.030 3.026 1.00 0.00 H new ATOM 0 HB3 ARG A 159 5.565 -4.673 3.598 1.00 0.00 H new ATOM 0 HG2 ARG A 159 4.442 -3.921 5.779 1.00 0.00 H new ATOM 0 HG3 ARG A 159 4.033 -2.431 4.952 1.00 0.00 H new ATOM 0 HD2 ARG A 159 2.203 -4.135 4.874 1.00 0.00 H new ATOM 0 HD3 ARG A 159 2.731 -3.614 3.286 1.00 0.00 H new ATOM 0 HE ARG A 159 3.506 -5.765 2.831 1.00 0.00 H new ATOM 0 HH11 ARG A 159 2.891 -5.391 6.293 1.00 0.00 H new ATOM 0 HH12 ARG A 159 3.107 -7.112 6.631 1.00 0.00 H new ATOM 0 HH21 ARG A 159 3.781 -7.970 3.281 1.00 0.00 H new ATOM 0 HH22 ARG A 159 3.608 -8.562 4.937 1.00 0.00 H new ATOM 2568 N PHE A 160 7.817 -4.307 6.530 1.00 0.00 N ATOM 2569 CA PHE A 160 8.451 -5.397 7.261 1.00 0.00 C ATOM 2570 C PHE A 160 7.429 -6.150 8.108 1.00 0.00 C ATOM 2571 O PHE A 160 6.545 -5.545 8.715 1.00 0.00 O ATOM 2572 CB PHE A 160 9.573 -4.857 8.150 1.00 0.00 C ATOM 2573 CG PHE A 160 10.833 -5.674 8.088 1.00 0.00 C ATOM 2574 CD1 PHE A 160 10.875 -6.951 8.624 1.00 0.00 C ATOM 2575 CD2 PHE A 160 11.976 -5.163 7.493 1.00 0.00 C ATOM 2576 CE1 PHE A 160 12.032 -7.704 8.568 1.00 0.00 C ATOM 2577 CE2 PHE A 160 13.136 -5.911 7.435 1.00 0.00 C ATOM 2578 CZ PHE A 160 13.165 -7.183 7.972 1.00 0.00 C ATOM 0 H PHE A 160 7.704 -3.448 7.069 1.00 0.00 H new ATOM 0 HA PHE A 160 8.875 -6.091 6.536 1.00 0.00 H new ATOM 0 HB2 PHE A 160 9.799 -3.832 7.854 1.00 0.00 H new ATOM 0 HB3 PHE A 160 9.223 -4.821 9.182 1.00 0.00 H new ATOM 0 HD1 PHE A 160 9.993 -7.363 9.091 1.00 0.00 H new ATOM 0 HD2 PHE A 160 11.959 -4.169 7.070 1.00 0.00 H new ATOM 0 HE1 PHE A 160 12.051 -8.698 8.989 1.00 0.00 H new ATOM 0 HE2 PHE A 160 14.020 -5.501 6.970 1.00 0.00 H new ATOM 0 HZ PHE A 160 14.071 -7.769 7.926 1.00 0.00 H new ATOM 2588 N GLN A 161 7.557 -7.473 8.144 1.00 0.00 N ATOM 2589 CA GLN A 161 6.645 -8.308 8.916 1.00 0.00 C ATOM 2590 C GLN A 161 7.381 -9.014 10.050 1.00 0.00 C ATOM 2591 O GLN A 161 8.300 -9.798 9.813 1.00 0.00 O ATOM 2592 CB GLN A 161 5.974 -9.341 8.008 1.00 0.00 C ATOM 2593 CG GLN A 161 6.955 -10.126 7.152 1.00 0.00 C ATOM 2594 CD GLN A 161 6.580 -11.591 7.034 1.00 0.00 C ATOM 2595 OE1 GLN A 161 7.136 -12.443 7.727 1.00 0.00 O ATOM 2596 NE2 GLN A 161 5.635 -11.891 6.151 1.00 0.00 N ATOM 0 H GLN A 161 8.283 -7.989 7.648 1.00 0.00 H new ATOM 0 HA GLN A 161 5.881 -7.663 9.349 1.00 0.00 H new ATOM 0 HB2 GLN A 161 5.403 -10.037 8.623 1.00 0.00 H new ATOM 0 HB3 GLN A 161 5.262 -8.833 7.357 1.00 0.00 H new ATOM 0 HG2 GLN A 161 6.998 -9.684 6.157 1.00 0.00 H new ATOM 0 HG3 GLN A 161 7.954 -10.043 7.581 1.00 0.00 H new ATOM 0 HE21 GLN A 161 5.201 -11.152 5.598 1.00 0.00 H new ATOM 0 HE22 GLN A 161 5.343 -12.860 6.026 1.00 0.00 H new ATOM 2605 N PHE A 162 6.972 -8.730 11.281 1.00 0.00 N ATOM 2606 CA PHE A 162 7.592 -9.338 12.453 1.00 0.00 C ATOM 2607 C PHE A 162 6.541 -9.967 13.361 1.00 0.00 C ATOM 2608 O PHE A 162 5.358 -9.637 13.280 1.00 0.00 O ATOM 2609 CB PHE A 162 8.395 -8.294 13.231 1.00 0.00 C ATOM 2610 CG PHE A 162 9.496 -8.883 14.065 1.00 0.00 C ATOM 2611 CD1 PHE A 162 10.420 -9.748 13.503 1.00 0.00 C ATOM 2612 CD2 PHE A 162 9.606 -8.572 15.411 1.00 0.00 C ATOM 2613 CE1 PHE A 162 11.435 -10.292 14.268 1.00 0.00 C ATOM 2614 CE2 PHE A 162 10.618 -9.112 16.181 1.00 0.00 C ATOM 2615 CZ PHE A 162 11.534 -9.974 15.609 1.00 0.00 C ATOM 0 H PHE A 162 6.213 -8.082 11.494 1.00 0.00 H new ATOM 0 HA PHE A 162 8.266 -10.123 12.109 1.00 0.00 H new ATOM 0 HB2 PHE A 162 8.825 -7.580 12.528 1.00 0.00 H new ATOM 0 HB3 PHE A 162 7.719 -7.736 13.878 1.00 0.00 H new ATOM 0 HD1 PHE A 162 10.347 -10.000 12.455 1.00 0.00 H new ATOM 0 HD2 PHE A 162 8.892 -7.900 15.863 1.00 0.00 H new ATOM 0 HE1 PHE A 162 12.150 -10.965 13.818 1.00 0.00 H new ATOM 0 HE2 PHE A 162 10.693 -8.861 17.229 1.00 0.00 H new ATOM 0 HZ PHE A 162 12.326 -10.398 16.209 1.00 0.00 H new ATOM 2625 N LEU A 163 6.981 -10.874 14.227 1.00 0.00 N ATOM 2626 CA LEU A 163 6.079 -11.550 15.152 1.00 0.00 C ATOM 2627 C LEU A 163 6.824 -12.005 16.403 1.00 0.00 C ATOM 2628 O LEU A 163 8.006 -12.344 16.345 1.00 0.00 O ATOM 2629 CB LEU A 163 5.421 -12.751 14.470 1.00 0.00 C ATOM 2630 CG LEU A 163 4.335 -13.447 15.292 1.00 0.00 C ATOM 2631 CD1 LEU A 163 2.981 -12.801 15.041 1.00 0.00 C ATOM 2632 CD2 LEU A 163 4.289 -14.933 14.964 1.00 0.00 C ATOM 0 H LEU A 163 7.957 -11.158 14.307 1.00 0.00 H new ATOM 0 HA LEU A 163 5.306 -10.842 15.449 1.00 0.00 H new ATOM 0 HB2 LEU A 163 4.986 -12.421 13.527 1.00 0.00 H new ATOM 0 HB3 LEU A 163 6.194 -13.480 14.226 1.00 0.00 H new ATOM 0 HG LEU A 163 4.577 -13.336 16.349 1.00 0.00 H new ATOM 0 HD11 LEU A 163 2.220 -13.309 15.634 1.00 0.00 H new ATOM 0 HD12 LEU A 163 3.021 -11.750 15.326 1.00 0.00 H new ATOM 0 HD13 LEU A 163 2.730 -12.881 13.983 1.00 0.00 H new ATOM 0 HD21 LEU A 163 3.511 -15.413 15.558 1.00 0.00 H new ATOM 0 HD22 LEU A 163 4.070 -15.065 13.904 1.00 0.00 H new ATOM 0 HD23 LEU A 163 5.253 -15.387 15.195 1.00 0.00 H new ATOM 2644 N GLU A 164 6.124 -12.011 17.533 1.00 0.00 N ATOM 2645 CA GLU A 164 6.719 -12.425 18.798 1.00 0.00 C ATOM 2646 C GLU A 164 6.182 -13.784 19.234 1.00 0.00 C ATOM 2647 O GLU A 164 4.996 -13.927 19.535 1.00 0.00 O ATOM 2648 CB GLU A 164 6.440 -11.382 19.883 1.00 0.00 C ATOM 2649 CG GLU A 164 7.502 -10.297 19.970 1.00 0.00 C ATOM 2650 CD GLU A 164 7.059 -8.996 19.329 1.00 0.00 C ATOM 2651 OE1 GLU A 164 7.751 -8.526 18.401 1.00 0.00 O ATOM 2652 OE2 GLU A 164 6.022 -8.447 19.754 1.00 0.00 O ATOM 0 H GLU A 164 5.145 -11.734 17.598 1.00 0.00 H new ATOM 0 HA GLU A 164 7.796 -12.510 18.653 1.00 0.00 H new ATOM 0 HB2 GLU A 164 5.473 -10.918 19.689 1.00 0.00 H new ATOM 0 HB3 GLU A 164 6.365 -11.884 20.848 1.00 0.00 H new ATOM 0 HG2 GLU A 164 7.748 -10.117 21.017 1.00 0.00 H new ATOM 0 HG3 GLU A 164 8.413 -10.646 19.484 1.00 0.00 H new ATOM 2660 N HIS A 165 7.061 -14.780 19.262 1.00 0.00 N ATOM 2661 CA HIS A 165 6.675 -16.129 19.660 1.00 0.00 C ATOM 2662 C HIS A 165 6.309 -16.178 21.139 1.00 0.00 C ATOM 2663 O HIS A 165 5.454 -16.962 21.553 1.00 0.00 O ATOM 2664 CB HIS A 165 7.812 -17.112 19.374 1.00 0.00 C ATOM 2665 CG HIS A 165 8.069 -17.323 17.913 1.00 0.00 C ATOM 2666 ND1 HIS A 165 7.097 -17.746 17.032 1.00 0.00 N ATOM 2667 CD2 HIS A 165 9.198 -17.167 17.181 1.00 0.00 C ATOM 2668 CE1 HIS A 165 7.617 -17.842 15.820 1.00 0.00 C ATOM 2669 NE2 HIS A 165 8.889 -17.496 15.885 1.00 0.00 N ATOM 0 H HIS A 165 8.045 -14.679 19.014 1.00 0.00 H new ATOM 0 HA HIS A 165 5.799 -16.415 19.078 1.00 0.00 H new ATOM 0 HB2 HIS A 165 8.724 -16.747 19.846 1.00 0.00 H new ATOM 0 HB3 HIS A 165 7.577 -18.071 19.835 1.00 0.00 H new ATOM 0 HD2 HIS A 165 10.161 -16.844 17.548 1.00 0.00 H new ATOM 0 HE1 HIS A 165 7.091 -18.151 14.929 1.00 0.00 H new ATOM 0 HE2 HIS A 165 9.538 -17.476 15.098 1.00 0.00 H new ATOM 2678 N HIS A 166 6.962 -15.336 21.934 1.00 0.00 N ATOM 2679 CA HIS A 166 6.706 -15.285 23.369 1.00 0.00 C ATOM 2680 C HIS A 166 5.738 -14.158 23.713 1.00 0.00 C ATOM 2681 O HIS A 166 5.885 -13.491 24.737 1.00 0.00 O ATOM 2682 CB HIS A 166 8.017 -15.097 24.134 1.00 0.00 C ATOM 2683 CG HIS A 166 8.720 -13.815 23.812 1.00 0.00 C ATOM 2684 ND1 HIS A 166 8.720 -12.724 24.654 1.00 0.00 N ATOM 2685 CD2 HIS A 166 9.449 -13.453 22.730 1.00 0.00 C ATOM 2686 CE1 HIS A 166 9.417 -11.746 24.105 1.00 0.00 C ATOM 2687 NE2 HIS A 166 9.871 -12.162 22.938 1.00 0.00 N ATOM 0 H HIS A 166 7.672 -14.680 21.609 1.00 0.00 H new ATOM 0 HA HIS A 166 6.251 -16.231 23.664 1.00 0.00 H new ATOM 0 HB2 HIS A 166 7.812 -15.130 25.204 1.00 0.00 H new ATOM 0 HB3 HIS A 166 8.681 -15.932 23.911 1.00 0.00 H new ATOM 0 HD2 HIS A 166 9.659 -14.065 21.865 1.00 0.00 H new ATOM 0 HE1 HIS A 166 9.587 -10.771 24.538 1.00 0.00 H new ATOM 0 HE2 HIS A 166 10.442 -11.614 22.295 1.00 0.00 H new ATOM 2696 N HIS A 167 4.747 -13.950 22.851 1.00 0.00 N ATOM 2697 CA HIS A 167 3.754 -12.905 23.067 1.00 0.00 C ATOM 2698 C HIS A 167 2.466 -13.488 23.639 1.00 0.00 C ATOM 2699 O HIS A 167 1.368 -13.038 23.307 1.00 0.00 O ATOM 2700 CB HIS A 167 3.459 -12.171 21.758 1.00 0.00 C ATOM 2701 CG HIS A 167 2.828 -10.828 21.956 1.00 0.00 C ATOM 2702 ND1 HIS A 167 1.485 -10.658 22.220 1.00 0.00 N ATOM 2703 CD2 HIS A 167 3.364 -9.584 21.927 1.00 0.00 C ATOM 2704 CE1 HIS A 167 1.222 -9.369 22.346 1.00 0.00 C ATOM 2705 NE2 HIS A 167 2.344 -8.697 22.174 1.00 0.00 N ATOM 0 H HIS A 167 4.611 -14.491 21.997 1.00 0.00 H new ATOM 0 HA HIS A 167 4.162 -12.196 23.787 1.00 0.00 H new ATOM 0 HB2 HIS A 167 4.388 -12.049 21.202 1.00 0.00 H new ATOM 0 HB3 HIS A 167 2.800 -12.787 21.146 1.00 0.00 H new ATOM 0 HD1 HIS A 167 0.801 -11.410 22.305 1.00 0.00 H new ATOM 0 HD2 HIS A 167 4.399 -9.336 21.744 1.00 0.00 H new ATOM 0 HE1 HIS A 167 0.253 -8.939 22.554 1.00 0.00 H new ATOM 2714 N HIS A 168 2.607 -14.493 24.497 1.00 0.00 N ATOM 2715 CA HIS A 168 1.454 -15.138 25.115 1.00 0.00 C ATOM 2716 C HIS A 168 1.817 -15.708 26.482 1.00 0.00 C ATOM 2717 O HIS A 168 2.741 -16.512 26.605 1.00 0.00 O ATOM 2718 CB HIS A 168 0.923 -16.251 24.211 1.00 0.00 C ATOM 2719 CG HIS A 168 1.936 -17.312 23.908 1.00 0.00 C ATOM 2720 ND1 HIS A 168 1.658 -18.661 23.977 1.00 0.00 N ATOM 2721 CD2 HIS A 168 3.234 -17.216 23.533 1.00 0.00 C ATOM 2722 CE1 HIS A 168 2.740 -19.349 23.658 1.00 0.00 C ATOM 2723 NE2 HIS A 168 3.709 -18.496 23.384 1.00 0.00 N ATOM 0 H HIS A 168 3.508 -14.878 24.780 1.00 0.00 H new ATOM 0 HA HIS A 168 0.677 -14.386 25.250 1.00 0.00 H new ATOM 0 HB2 HIS A 168 0.057 -16.712 24.687 1.00 0.00 H new ATOM 0 HB3 HIS A 168 0.577 -15.813 23.275 1.00 0.00 H new ATOM 0 HD2 HIS A 168 3.791 -16.304 23.380 1.00 0.00 H new ATOM 0 HE1 HIS A 168 2.818 -20.426 23.627 1.00 0.00 H new ATOM 0 HE2 HIS A 168 4.658 -18.747 23.106 1.00 0.00 H new ATOM 2732 N HIS A 169 1.084 -15.285 27.507 1.00 0.00 N ATOM 2733 CA HIS A 169 1.329 -15.754 28.866 1.00 0.00 C ATOM 2734 C HIS A 169 0.665 -17.108 29.101 1.00 0.00 C ATOM 2735 O HIS A 169 -0.193 -17.532 28.327 1.00 0.00 O ATOM 2736 CB HIS A 169 0.809 -14.735 29.882 1.00 0.00 C ATOM 2737 CG HIS A 169 -0.613 -14.328 29.647 1.00 0.00 C ATOM 2738 ND1 HIS A 169 -0.986 -13.036 29.346 1.00 0.00 N ATOM 2739 CD2 HIS A 169 -1.757 -15.053 29.670 1.00 0.00 C ATOM 2740 CE1 HIS A 169 -2.298 -12.982 29.195 1.00 0.00 C ATOM 2741 NE2 HIS A 169 -2.788 -14.193 29.386 1.00 0.00 N ATOM 0 H HIS A 169 0.316 -14.619 27.422 1.00 0.00 H new ATOM 0 HA HIS A 169 2.405 -15.869 28.996 1.00 0.00 H new ATOM 0 HB2 HIS A 169 0.897 -15.155 30.884 1.00 0.00 H new ATOM 0 HB3 HIS A 169 1.442 -13.848 29.852 1.00 0.00 H new ATOM 0 HD2 HIS A 169 -1.842 -16.110 29.874 1.00 0.00 H new ATOM 0 HE1 HIS A 169 -2.871 -12.098 28.956 1.00 0.00 H new ATOM 0 HE2 HIS A 169 -3.774 -14.448 29.331 1.00 0.00 H new ATOM 2750 N HIS A 170 1.069 -17.781 30.174 1.00 0.00 N ATOM 2751 CA HIS A 170 0.513 -19.087 30.509 1.00 0.00 C ATOM 2752 C HIS A 170 0.738 -19.412 31.982 1.00 0.00 C ATOM 2753 O HIS A 170 1.882 -19.247 32.455 1.00 0.00 O ATOM 2754 CB HIS A 170 1.140 -20.172 29.633 1.00 0.00 C ATOM 2755 CG HIS A 170 2.621 -20.303 29.813 1.00 0.00 C ATOM 2756 ND1 HIS A 170 3.276 -21.517 29.804 1.00 0.00 N ATOM 2757 CD2 HIS A 170 3.577 -19.364 30.007 1.00 0.00 C ATOM 2758 CE1 HIS A 170 4.570 -21.319 29.986 1.00 0.00 C ATOM 2759 NE2 HIS A 170 4.778 -20.022 30.111 1.00 0.00 N ATOM 2760 OXT HIS A 170 -0.231 -19.830 32.650 1.00 0.00 O ATOM 0 H HIS A 170 1.778 -17.444 30.825 1.00 0.00 H new ATOM 0 HA HIS A 170 -0.560 -19.056 30.322 1.00 0.00 H new ATOM 0 HB2 HIS A 170 0.668 -21.128 29.859 1.00 0.00 H new ATOM 0 HB3 HIS A 170 0.927 -19.951 28.587 1.00 0.00 H new ATOM 0 HD2 HIS A 170 3.424 -18.297 30.068 1.00 0.00 H new ATOM 0 HE1 HIS A 170 5.328 -22.088 30.026 1.00 0.00 H new ATOM 0 HE2 HIS A 170 5.685 -19.579 30.261 1.00 0.00 H new TER 2769 HIS A 170