USER MOD reduce.3.24.130724 H: found=0, std=0, add=1046, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1045 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 120 CYS SG : rot 73:sc= -4.75! USER MOD Set 1.2: A 127 CYS SG : rot 90:sc= -6.93! USER MOD Set 2.1: A 103 LYS NZ :NH3+ 174:sc= 0.741 (180deg=0.0176) USER MOD Set 2.2: A 122 MET CE :methyl 160:sc= -0.171 (180deg=-0.522) USER MOD Set 2.3: A 123 ASN : amide:sc= 0.647 K(o=1.2,f=-6.4!) USER MOD Set 3.1: A 83 THR OG1 : rot -27:sc= 0.837 USER MOD Set 3.2: A 85 THR OG1 : rot 75:sc= 1.24 USER MOD Set 3.3: A 98 GLN : amide:sc= 0 X(o=2.1,f=1.7) USER MOD Set 4.1: A 61 LYS NZ :NH3+ 175:sc= 1.87 (180deg=1.15) USER MOD Set 4.2: A 63 THR OG1 : rot -10:sc= 1.02 USER MOD Set 5.1: A 22 TYR OH : rot -13:sc= 1.02 USER MOD Set 5.2: A 105 SER OG : rot 42:sc= 2.15 USER MOD Single : A 5 GLN : amide:sc= 0.41 X(o=0.41,f=0) USER MOD Single : A 6 GLN : amide:sc= 0.449 K(o=0.45,f=-3.5!) USER MOD Single : A 16 SER OG : rot 40:sc= 1.06 USER MOD Single : A 17 LYS NZ :NH3+ 165:sc= 1.25 (180deg=1.01) USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 135:sc= 1.26 (180deg=0.785) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 MET CE :methyl 178:sc= 0 (180deg=-0.00405) USER MOD Single : A 38 MET CE :methyl 166:sc= 0 (180deg=-0.227) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 CYS SG : rot -130:sc= -0.784 USER MOD Single : A 46 THR OG1 : rot 56:sc= 1.07 USER MOD Single : A 47 CYS SG : rot -54:sc= -0.148 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 ASN : amide:sc= 0.9 K(o=0.9,f=-0.025) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ -129:sc= 1.22 (180deg=0.465) USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 140:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot -168:sc= 0.999 USER MOD Single : A 64 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 SER OG : rot 24:sc= 0.747 USER MOD Single : A 67 CYS SG : rot -41:sc= 0.131 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -131:sc= 0.981 (180deg=-0.94!) USER MOD Single : A 76 THR OG1 : rot 180:sc=-0.000714 USER MOD Single : A 77 THR OG1 : rot -64:sc= 0.641 USER MOD Single : A 82 LYS NZ :NH3+ -146:sc= 0.63 (180deg=0.147) USER MOD Single : A 84 GLN : amide:sc= 0.562 K(o=0.56,f=0) USER MOD Single : A 87 CYS SG : rot 46:sc= -1.56 USER MOD Single : A 88 ASN : amide:sc=-0.00407 X(o=-0.0041,f=-0.4) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 1.51 K(o=1.5,f=-5.4!) USER MOD Single : A 97 HIS : no HD1:sc= -0.343 K(o=0.15,f=-8!) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 177:sc= 1.18 (180deg=1.11) USER MOD Single : A 112 LYS NZ :NH3+ 165:sc= 1.18 (180deg=1.04) USER MOD Single : A 115 LYS NZ :NH3+ -131:sc= 1.37 (180deg=-1.26) USER MOD Single : A 124 ASN : amide:sc= 0.81 K(o=0.81,f=0) USER MOD Single : A 126 THR OG1 : rot 45:sc= 0.128 USER MOD Single : A 128 THR OG1 : rot -19:sc= 1.01 USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 171:sc= 1.88 (180deg=1.35) USER MOD ----------------------------------------------------------------- ATOM 14 N VAL A 4 0.292 -0.886 -2.569 1.00 0.00 N ATOM 15 CA VAL A 4 1.385 -1.056 -3.586 1.00 0.00 C ATOM 16 C VAL A 4 2.538 -2.073 -3.278 1.00 0.00 C ATOM 17 O VAL A 4 2.889 -2.888 -4.137 1.00 0.00 O ATOM 18 CB VAL A 4 1.786 0.289 -4.294 1.00 0.00 C ATOM 19 CG1 VAL A 4 2.845 1.141 -3.559 1.00 0.00 C ATOM 20 CG2 VAL A 4 2.255 0.070 -5.750 1.00 0.00 C ATOM 0 HA VAL A 4 0.901 -1.645 -4.365 1.00 0.00 H new ATOM 0 HB VAL A 4 0.855 0.855 -4.273 1.00 0.00 H new ATOM 0 HG11 VAL A 4 3.047 2.045 -4.134 1.00 0.00 H new ATOM 0 HG12 VAL A 4 2.471 1.414 -2.572 1.00 0.00 H new ATOM 0 HG13 VAL A 4 3.765 0.566 -3.452 1.00 0.00 H new ATOM 0 HG21 VAL A 4 2.521 1.029 -6.195 1.00 0.00 H new ATOM 0 HG22 VAL A 4 3.125 -0.587 -5.757 1.00 0.00 H new ATOM 0 HG23 VAL A 4 1.451 -0.387 -6.326 1.00 0.00 H new ATOM 30 N GLN A 5 3.068 -2.062 -2.046 1.00 0.00 N ATOM 31 CA GLN A 5 3.998 -3.101 -1.515 1.00 0.00 C ATOM 32 C GLN A 5 3.518 -4.593 -1.636 1.00 0.00 C ATOM 33 O GLN A 5 4.337 -5.474 -1.907 1.00 0.00 O ATOM 34 CB GLN A 5 4.356 -2.660 -0.065 1.00 0.00 C ATOM 35 CG GLN A 5 5.602 -3.338 0.569 1.00 0.00 C ATOM 36 CD GLN A 5 5.350 -4.551 1.469 1.00 0.00 C ATOM 37 OE1 GLN A 5 5.295 -4.463 2.691 1.00 0.00 O ATOM 38 NE2 GLN A 5 5.203 -5.720 0.902 1.00 0.00 N ATOM 0 H GLN A 5 2.867 -1.325 -1.371 1.00 0.00 H new ATOM 0 HA GLN A 5 4.885 -3.140 -2.147 1.00 0.00 H new ATOM 0 HB2 GLN A 5 4.515 -1.582 -0.064 1.00 0.00 H new ATOM 0 HB3 GLN A 5 3.496 -2.856 0.575 1.00 0.00 H new ATOM 0 HG2 GLN A 5 6.267 -3.647 -0.238 1.00 0.00 H new ATOM 0 HG3 GLN A 5 6.136 -2.588 1.153 1.00 0.00 H new ATOM 0 HE21 GLN A 5 5.247 -5.803 -0.114 1.00 0.00 H new ATOM 0 HE22 GLN A 5 5.044 -6.549 1.475 1.00 0.00 H new ATOM 47 N GLN A 6 2.212 -4.886 -1.475 1.00 0.00 N ATOM 48 CA GLN A 6 1.608 -6.221 -1.777 1.00 0.00 C ATOM 49 C GLN A 6 1.849 -6.788 -3.220 1.00 0.00 C ATOM 50 O GLN A 6 2.051 -7.996 -3.365 1.00 0.00 O ATOM 51 CB GLN A 6 0.083 -6.205 -1.473 1.00 0.00 C ATOM 52 CG GLN A 6 -0.348 -5.803 -0.035 1.00 0.00 C ATOM 53 CD GLN A 6 -0.550 -4.296 0.203 1.00 0.00 C ATOM 54 OE1 GLN A 6 -0.177 -3.438 -0.592 1.00 0.00 O ATOM 55 NE2 GLN A 6 -1.125 -3.911 1.314 1.00 0.00 N ATOM 0 H GLN A 6 1.534 -4.206 -1.130 1.00 0.00 H new ATOM 0 HA GLN A 6 2.143 -6.905 -1.117 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -0.394 -5.520 -2.173 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -0.314 -7.199 -1.680 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -1.279 -6.318 0.203 1.00 0.00 H new ATOM 0 HG3 GLN A 6 0.405 -6.165 0.665 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -1.444 -4.605 1.990 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -1.255 -2.917 1.503 1.00 0.00 H new ATOM 64 N LEU A 7 1.852 -5.935 -4.265 1.00 0.00 N ATOM 65 CA LEU A 7 2.243 -6.342 -5.649 1.00 0.00 C ATOM 66 C LEU A 7 3.761 -6.652 -5.908 1.00 0.00 C ATOM 67 O LEU A 7 4.095 -7.035 -7.032 1.00 0.00 O ATOM 68 CB LEU A 7 1.773 -5.251 -6.665 1.00 0.00 C ATOM 69 CG LEU A 7 0.300 -4.758 -6.660 1.00 0.00 C ATOM 70 CD1 LEU A 7 0.079 -3.752 -7.797 1.00 0.00 C ATOM 71 CD2 LEU A 7 -0.729 -5.886 -6.799 1.00 0.00 C ATOM 0 H LEU A 7 1.588 -4.953 -4.185 1.00 0.00 H new ATOM 0 HA LEU A 7 1.742 -7.300 -5.787 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.406 -4.377 -6.516 1.00 0.00 H new ATOM 0 HB3 LEU A 7 1.983 -5.630 -7.665 1.00 0.00 H new ATOM 0 HG LEU A 7 0.145 -4.294 -5.686 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -0.957 -3.412 -7.786 1.00 0.00 H new ATOM 0 HD12 LEU A 7 0.743 -2.898 -7.662 1.00 0.00 H new ATOM 0 HD13 LEU A 7 0.293 -4.230 -8.753 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -1.734 -5.465 -6.787 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.567 -6.412 -7.740 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.618 -6.584 -5.969 1.00 0.00 H new ATOM 83 N GLU A 8 4.680 -6.505 -4.935 1.00 0.00 N ATOM 84 CA GLU A 8 6.136 -6.705 -5.157 1.00 0.00 C ATOM 85 C GLU A 8 6.558 -8.207 -5.109 1.00 0.00 C ATOM 86 O GLU A 8 6.151 -8.974 -4.222 1.00 0.00 O ATOM 87 CB GLU A 8 6.946 -5.866 -4.138 1.00 0.00 C ATOM 88 CG GLU A 8 6.767 -4.334 -4.268 1.00 0.00 C ATOM 89 CD GLU A 8 7.797 -3.535 -3.493 1.00 0.00 C ATOM 90 OE1 GLU A 8 8.920 -3.343 -4.013 1.00 0.00 O ATOM 91 OE2 GLU A 8 7.481 -3.063 -2.385 1.00 0.00 O ATOM 0 H GLU A 8 4.443 -6.246 -3.977 1.00 0.00 H new ATOM 0 HA GLU A 8 6.360 -6.361 -6.167 1.00 0.00 H new ATOM 0 HB2 GLU A 8 6.658 -6.167 -3.131 1.00 0.00 H new ATOM 0 HB3 GLU A 8 8.003 -6.105 -4.252 1.00 0.00 H new ATOM 0 HG2 GLU A 8 6.822 -4.058 -5.321 1.00 0.00 H new ATOM 0 HG3 GLU A 8 5.771 -4.062 -3.919 1.00 0.00 H new ATOM 98 N GLY A 9 7.388 -8.623 -6.080 1.00 0.00 N ATOM 99 CA GLY A 9 7.832 -10.034 -6.174 1.00 0.00 C ATOM 100 C GLY A 9 8.280 -10.554 -7.551 1.00 0.00 C ATOM 101 O GLY A 9 8.205 -9.867 -8.572 1.00 0.00 O ATOM 0 H GLY A 9 7.765 -8.014 -6.806 1.00 0.00 H new ATOM 0 HA2 GLY A 9 8.660 -10.172 -5.478 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.015 -10.666 -5.827 1.00 0.00 H new ATOM 105 N ARG A 10 8.709 -11.825 -7.553 1.00 0.00 N ATOM 106 CA ARG A 10 9.022 -12.582 -8.798 1.00 0.00 C ATOM 107 C ARG A 10 7.771 -13.392 -9.262 1.00 0.00 C ATOM 108 O ARG A 10 7.461 -14.449 -8.704 1.00 0.00 O ATOM 109 CB ARG A 10 10.265 -13.468 -8.516 1.00 0.00 C ATOM 110 CG ARG A 10 10.728 -14.330 -9.720 1.00 0.00 C ATOM 111 CD ARG A 10 12.019 -15.135 -9.473 1.00 0.00 C ATOM 112 NE ARG A 10 13.238 -14.289 -9.619 1.00 0.00 N ATOM 113 CZ ARG A 10 13.903 -14.082 -10.761 1.00 0.00 C ATOM 114 NH1 ARG A 10 13.560 -14.579 -11.928 1.00 0.00 N ATOM 115 NH2 ARG A 10 14.965 -13.332 -10.716 1.00 0.00 N ATOM 0 H ARG A 10 8.852 -12.365 -6.700 1.00 0.00 H new ATOM 0 HA ARG A 10 9.264 -11.914 -9.625 1.00 0.00 H new ATOM 0 HB2 ARG A 10 11.090 -12.826 -8.206 1.00 0.00 H new ATOM 0 HB3 ARG A 10 10.042 -14.128 -7.677 1.00 0.00 H new ATOM 0 HG2 ARG A 10 9.928 -15.022 -9.983 1.00 0.00 H new ATOM 0 HG3 ARG A 10 10.881 -13.678 -10.580 1.00 0.00 H new ATOM 0 HD2 ARG A 10 11.993 -15.565 -8.472 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.068 -15.967 -10.176 1.00 0.00 H new ATOM 0 HE ARG A 10 13.594 -13.831 -8.780 1.00 0.00 H new ATOM 0 HH11 ARG A 10 12.732 -15.170 -12.007 1.00 0.00 H new ATOM 0 HH12 ARG A 10 14.121 -14.374 -12.755 1.00 0.00 H new ATOM 0 HH21 ARG A 10 15.264 -12.925 -9.830 1.00 0.00 H new ATOM 0 HH22 ARG A 10 15.498 -13.151 -11.567 1.00 0.00 H new ATOM 129 N TRP A 11 7.061 -12.895 -10.287 1.00 0.00 N ATOM 130 CA TRP A 11 5.722 -13.427 -10.660 1.00 0.00 C ATOM 131 C TRP A 11 5.818 -14.226 -12.000 1.00 0.00 C ATOM 132 O TRP A 11 5.868 -13.644 -13.083 1.00 0.00 O ATOM 133 CB TRP A 11 4.707 -12.250 -10.713 1.00 0.00 C ATOM 134 CG TRP A 11 4.527 -11.437 -9.425 1.00 0.00 C ATOM 135 CD1 TRP A 11 4.989 -10.122 -9.231 1.00 0.00 C ATOM 136 CD2 TRP A 11 3.848 -11.770 -8.268 1.00 0.00 C ATOM 137 NE1 TRP A 11 4.613 -9.622 -7.977 1.00 0.00 N ATOM 138 CE2 TRP A 11 3.911 -10.655 -7.397 1.00 0.00 C ATOM 139 CE3 TRP A 11 3.081 -12.912 -7.916 1.00 0.00 C ATOM 140 CZ2 TRP A 11 3.208 -10.663 -6.178 1.00 0.00 C ATOM 141 CZ3 TRP A 11 2.385 -12.895 -6.706 1.00 0.00 C ATOM 142 CH2 TRP A 11 2.451 -11.789 -5.849 1.00 0.00 C ATOM 0 H TRP A 11 7.383 -12.127 -10.877 1.00 0.00 H new ATOM 0 HA TRP A 11 5.361 -14.132 -9.911 1.00 0.00 H new ATOM 0 HB2 TRP A 11 5.017 -11.568 -11.505 1.00 0.00 H new ATOM 0 HB3 TRP A 11 3.735 -12.651 -11.001 1.00 0.00 H new ATOM 0 HD1 TRP A 11 5.562 -9.567 -9.959 1.00 0.00 H new ATOM 0 HE1 TRP A 11 4.814 -8.703 -7.584 1.00 0.00 H new ATOM 0 HE3 TRP A 11 3.037 -13.772 -8.568 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 3.253 -9.815 -5.510 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 1.786 -13.749 -6.426 1.00 0.00 H new ATOM 0 HH2 TRP A 11 1.906 -11.808 -4.917 1.00 0.00 H new ATOM 153 N ARG A 12 5.838 -15.562 -11.926 1.00 0.00 N ATOM 154 CA ARG A 12 6.110 -16.462 -13.084 1.00 0.00 C ATOM 155 C ARG A 12 4.828 -16.873 -13.863 1.00 0.00 C ATOM 156 O ARG A 12 3.914 -17.454 -13.270 1.00 0.00 O ATOM 157 CB ARG A 12 6.811 -17.698 -12.466 1.00 0.00 C ATOM 158 CG ARG A 12 7.369 -18.762 -13.437 1.00 0.00 C ATOM 159 CD ARG A 12 6.449 -19.980 -13.652 1.00 0.00 C ATOM 160 NE ARG A 12 6.267 -20.871 -12.465 1.00 0.00 N ATOM 161 CZ ARG A 12 7.164 -21.717 -11.967 1.00 0.00 C ATOM 162 NH1 ARG A 12 8.371 -21.863 -12.444 1.00 0.00 N ATOM 163 NH2 ARG A 12 6.801 -22.430 -10.945 1.00 0.00 N ATOM 0 H ARG A 12 5.666 -16.067 -11.057 1.00 0.00 H new ATOM 0 HA ARG A 12 6.723 -15.955 -13.829 1.00 0.00 H new ATOM 0 HB2 ARG A 12 7.635 -17.343 -11.847 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.101 -18.189 -11.801 1.00 0.00 H new ATOM 0 HG2 ARG A 12 7.558 -18.291 -14.402 1.00 0.00 H new ATOM 0 HG3 ARG A 12 8.330 -19.111 -13.059 1.00 0.00 H new ATOM 0 HD2 ARG A 12 5.469 -19.621 -13.968 1.00 0.00 H new ATOM 0 HD3 ARG A 12 6.850 -20.575 -14.472 1.00 0.00 H new ATOM 0 HE ARG A 12 5.365 -20.825 -11.990 1.00 0.00 H new ATOM 0 HH11 ARG A 12 8.673 -21.309 -13.246 1.00 0.00 H new ATOM 0 HH12 ARG A 12 9.012 -22.531 -12.015 1.00 0.00 H new ATOM 0 HH21 ARG A 12 5.862 -22.327 -10.559 1.00 0.00 H new ATOM 0 HH22 ARG A 12 7.454 -23.093 -10.528 1.00 0.00 H new ATOM 177 N LEU A 13 4.778 -16.657 -15.192 1.00 0.00 N ATOM 178 CA LEU A 13 3.571 -16.986 -16.005 1.00 0.00 C ATOM 179 C LEU A 13 3.238 -18.518 -16.050 1.00 0.00 C ATOM 180 O LEU A 13 4.069 -19.353 -16.422 1.00 0.00 O ATOM 181 CB LEU A 13 3.704 -16.371 -17.429 1.00 0.00 C ATOM 182 CG LEU A 13 2.422 -16.418 -18.312 1.00 0.00 C ATOM 183 CD1 LEU A 13 1.296 -15.520 -17.776 1.00 0.00 C ATOM 184 CD2 LEU A 13 2.704 -16.021 -19.770 1.00 0.00 C ATOM 0 H LEU A 13 5.548 -16.260 -15.730 1.00 0.00 H new ATOM 0 HA LEU A 13 2.715 -16.533 -15.505 1.00 0.00 H new ATOM 0 HB2 LEU A 13 4.014 -15.331 -17.327 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.504 -16.892 -17.955 1.00 0.00 H new ATOM 0 HG LEU A 13 2.096 -17.457 -18.273 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.429 -15.594 -18.432 1.00 0.00 H new ATOM 0 HD12 LEU A 13 1.020 -15.842 -16.772 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.640 -14.486 -17.743 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.780 -16.069 -20.346 1.00 0.00 H new ATOM 0 HD22 LEU A 13 3.098 -15.005 -19.801 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.435 -16.707 -20.199 1.00 0.00 H new ATOM 196 N VAL A 14 1.998 -18.848 -15.668 1.00 0.00 N ATOM 197 CA VAL A 14 1.460 -20.245 -15.663 1.00 0.00 C ATOM 198 C VAL A 14 0.261 -20.448 -16.654 1.00 0.00 C ATOM 199 O VAL A 14 0.257 -21.456 -17.365 1.00 0.00 O ATOM 200 CB VAL A 14 1.178 -20.776 -14.211 1.00 0.00 C ATOM 201 CG1 VAL A 14 2.477 -21.136 -13.459 1.00 0.00 C ATOM 202 CG2 VAL A 14 0.333 -19.860 -13.291 1.00 0.00 C ATOM 0 H VAL A 14 1.320 -18.157 -15.347 1.00 0.00 H new ATOM 0 HA VAL A 14 2.255 -20.879 -16.056 1.00 0.00 H new ATOM 0 HB VAL A 14 0.574 -21.661 -14.411 1.00 0.00 H new ATOM 0 HG11 VAL A 14 2.231 -21.498 -12.461 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.010 -21.914 -14.006 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.108 -20.251 -13.379 1.00 0.00 H new ATOM 0 HG21 VAL A 14 0.208 -20.336 -12.319 1.00 0.00 H new ATOM 0 HG22 VAL A 14 0.841 -18.904 -13.164 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -0.645 -19.694 -13.742 1.00 0.00 H new ATOM 212 N ASP A 15 -0.734 -19.537 -16.715 1.00 0.00 N ATOM 213 CA ASP A 15 -1.868 -19.614 -17.687 1.00 0.00 C ATOM 214 C ASP A 15 -2.053 -18.267 -18.478 1.00 0.00 C ATOM 215 O ASP A 15 -1.676 -17.182 -18.022 1.00 0.00 O ATOM 216 CB ASP A 15 -3.124 -20.076 -16.894 1.00 0.00 C ATOM 217 CG ASP A 15 -4.409 -20.287 -17.699 1.00 0.00 C ATOM 218 OD1 ASP A 15 -4.334 -20.590 -18.912 1.00 0.00 O ATOM 219 OD2 ASP A 15 -5.502 -20.108 -17.125 1.00 0.00 O ATOM 0 H ASP A 15 -0.782 -18.726 -16.098 1.00 0.00 H new ATOM 0 HA ASP A 15 -1.669 -20.344 -18.472 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -2.882 -21.011 -16.389 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -3.326 -19.338 -16.118 1.00 0.00 H new ATOM 224 N SER A 16 -2.658 -18.354 -19.680 1.00 0.00 N ATOM 225 CA SER A 16 -3.004 -17.164 -20.510 1.00 0.00 C ATOM 226 C SER A 16 -4.216 -17.460 -21.453 1.00 0.00 C ATOM 227 O SER A 16 -4.028 -17.787 -22.633 1.00 0.00 O ATOM 228 CB SER A 16 -1.758 -16.631 -21.276 1.00 0.00 C ATOM 229 OG SER A 16 -1.402 -17.483 -22.366 1.00 0.00 O ATOM 0 H SER A 16 -2.922 -19.242 -20.108 1.00 0.00 H new ATOM 0 HA SER A 16 -3.323 -16.364 -19.842 1.00 0.00 H new ATOM 0 HB2 SER A 16 -1.963 -15.628 -21.650 1.00 0.00 H new ATOM 0 HB3 SER A 16 -0.916 -16.549 -20.589 1.00 0.00 H new ATOM 0 HG SER A 16 -2.214 -17.791 -22.819 1.00 0.00 H new ATOM 235 N LYS A 17 -5.458 -17.318 -20.951 1.00 0.00 N ATOM 236 CA LYS A 17 -6.691 -17.508 -21.772 1.00 0.00 C ATOM 237 C LYS A 17 -6.992 -16.287 -22.704 1.00 0.00 C ATOM 238 O LYS A 17 -6.837 -15.131 -22.298 1.00 0.00 O ATOM 239 CB LYS A 17 -7.886 -17.916 -20.857 1.00 0.00 C ATOM 240 CG LYS A 17 -8.402 -16.909 -19.788 1.00 0.00 C ATOM 241 CD LYS A 17 -9.804 -16.285 -20.010 1.00 0.00 C ATOM 242 CE LYS A 17 -9.856 -15.240 -21.140 1.00 0.00 C ATOM 243 NZ LYS A 17 -11.097 -14.421 -21.106 1.00 0.00 N ATOM 0 H LYS A 17 -5.644 -17.072 -19.979 1.00 0.00 H new ATOM 0 HA LYS A 17 -6.521 -18.333 -22.464 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -8.726 -18.165 -21.506 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -7.603 -18.831 -20.336 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -8.409 -17.417 -18.823 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -7.680 -16.096 -19.715 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -10.513 -17.082 -20.234 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -10.133 -15.817 -19.082 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -8.990 -14.583 -21.062 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -9.786 -15.747 -22.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -10.976 -13.583 -21.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -11.896 -14.987 -21.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -11.287 -14.120 -20.129 1.00 0.00 H new ATOM 257 N GLY A 18 -7.413 -16.546 -23.958 1.00 0.00 N ATOM 258 CA GLY A 18 -7.631 -15.476 -24.986 1.00 0.00 C ATOM 259 C GLY A 18 -6.421 -14.653 -25.509 1.00 0.00 C ATOM 260 O GLY A 18 -6.604 -13.532 -25.988 1.00 0.00 O ATOM 0 H GLY A 18 -7.613 -17.487 -24.297 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.103 -15.945 -25.849 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.351 -14.770 -24.573 1.00 0.00 H new ATOM 264 N PHE A 19 -5.193 -15.189 -25.418 1.00 0.00 N ATOM 265 CA PHE A 19 -3.948 -14.403 -25.644 1.00 0.00 C ATOM 266 C PHE A 19 -3.484 -14.293 -27.141 1.00 0.00 C ATOM 267 O PHE A 19 -3.158 -13.186 -27.578 1.00 0.00 O ATOM 268 CB PHE A 19 -2.884 -14.959 -24.654 1.00 0.00 C ATOM 269 CG PHE A 19 -1.581 -14.152 -24.481 1.00 0.00 C ATOM 270 CD1 PHE A 19 -1.600 -12.769 -24.247 1.00 0.00 C ATOM 271 CD2 PHE A 19 -0.350 -14.819 -24.513 1.00 0.00 C ATOM 272 CE1 PHE A 19 -0.410 -12.065 -24.092 1.00 0.00 C ATOM 273 CE2 PHE A 19 0.839 -14.115 -24.340 1.00 0.00 C ATOM 274 CZ PHE A 19 0.808 -12.738 -24.136 1.00 0.00 C ATOM 0 H PHE A 19 -5.025 -16.169 -25.189 1.00 0.00 H new ATOM 0 HA PHE A 19 -4.133 -13.350 -25.431 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -3.353 -15.054 -23.675 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.616 -15.965 -24.978 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.544 -12.248 -24.187 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.323 -15.887 -24.673 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.431 -10.996 -23.938 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.784 -14.637 -24.364 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.731 -12.191 -24.012 1.00 0.00 H new ATOM 284 N ASP A 20 -3.510 -15.386 -27.939 1.00 0.00 N ATOM 285 CA ASP A 20 -3.451 -15.323 -29.439 1.00 0.00 C ATOM 286 C ASP A 20 -4.472 -14.327 -30.110 1.00 0.00 C ATOM 287 O ASP A 20 -4.075 -13.526 -30.962 1.00 0.00 O ATOM 288 CB ASP A 20 -3.555 -16.794 -29.947 1.00 0.00 C ATOM 289 CG ASP A 20 -3.546 -17.017 -31.465 1.00 0.00 C ATOM 290 OD1 ASP A 20 -2.559 -16.663 -32.147 1.00 0.00 O ATOM 291 OD2 ASP A 20 -4.563 -17.505 -32.006 1.00 0.00 O ATOM 0 H ASP A 20 -3.572 -16.337 -27.575 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.505 -14.880 -29.749 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -2.727 -17.358 -29.518 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -4.474 -17.224 -29.548 1.00 0.00 H new ATOM 296 N GLU A 21 -5.754 -14.344 -29.696 1.00 0.00 N ATOM 297 CA GLU A 21 -6.755 -13.279 -30.013 1.00 0.00 C ATOM 298 C GLU A 21 -6.331 -11.814 -29.636 1.00 0.00 C ATOM 299 O GLU A 21 -6.419 -10.920 -30.481 1.00 0.00 O ATOM 300 CB GLU A 21 -8.101 -13.664 -29.338 1.00 0.00 C ATOM 301 CG GLU A 21 -8.788 -14.972 -29.807 1.00 0.00 C ATOM 302 CD GLU A 21 -9.965 -15.364 -28.930 1.00 0.00 C ATOM 303 OE1 GLU A 21 -9.732 -15.900 -27.825 1.00 0.00 O ATOM 304 OE2 GLU A 21 -11.122 -15.147 -29.345 1.00 0.00 O ATOM 0 H GLU A 21 -6.138 -15.099 -29.127 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.845 -13.246 -31.099 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.929 -13.741 -28.264 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.801 -12.843 -29.491 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -9.131 -14.849 -30.834 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.057 -15.781 -29.810 1.00 0.00 H new ATOM 311 N TYR A 22 -5.843 -11.572 -28.401 1.00 0.00 N ATOM 312 CA TYR A 22 -5.305 -10.248 -27.967 1.00 0.00 C ATOM 313 C TYR A 22 -4.064 -9.741 -28.778 1.00 0.00 C ATOM 314 O TYR A 22 -4.063 -8.588 -29.218 1.00 0.00 O ATOM 315 CB TYR A 22 -5.069 -10.346 -26.433 1.00 0.00 C ATOM 316 CG TYR A 22 -4.575 -9.065 -25.737 1.00 0.00 C ATOM 317 CD1 TYR A 22 -5.481 -8.088 -25.306 1.00 0.00 C ATOM 318 CD2 TYR A 22 -3.205 -8.874 -25.524 1.00 0.00 C ATOM 319 CE1 TYR A 22 -5.018 -6.936 -24.672 1.00 0.00 C ATOM 320 CE2 TYR A 22 -2.749 -7.713 -24.903 1.00 0.00 C ATOM 321 CZ TYR A 22 -3.653 -6.742 -24.486 1.00 0.00 C ATOM 322 OH TYR A 22 -3.178 -5.590 -23.917 1.00 0.00 O ATOM 0 H TYR A 22 -5.807 -12.283 -27.671 1.00 0.00 H new ATOM 0 HA TYR A 22 -6.033 -9.468 -28.189 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -6.003 -10.653 -25.962 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -4.343 -11.138 -26.248 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -6.540 -8.227 -25.465 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -2.500 -9.628 -25.842 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -5.720 -6.193 -24.325 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -1.691 -7.567 -24.745 1.00 0.00 H new ATOM 0 HH TYR A 22 -3.894 -4.921 -23.886 1.00 0.00 H new ATOM 332 N MET A 23 -3.035 -10.579 -29.008 1.00 0.00 N ATOM 333 CA MET A 23 -1.931 -10.255 -29.953 1.00 0.00 C ATOM 334 C MET A 23 -2.348 -10.104 -31.463 1.00 0.00 C ATOM 335 O MET A 23 -1.789 -9.241 -32.140 1.00 0.00 O ATOM 336 CB MET A 23 -0.773 -11.254 -29.710 1.00 0.00 C ATOM 337 CG MET A 23 -0.086 -11.196 -28.325 1.00 0.00 C ATOM 338 SD MET A 23 -0.242 -12.771 -27.459 1.00 0.00 S ATOM 339 CE MET A 23 1.033 -13.757 -28.261 1.00 0.00 C ATOM 0 H MET A 23 -2.939 -11.488 -28.555 1.00 0.00 H new ATOM 0 HA MET A 23 -1.590 -9.244 -29.732 1.00 0.00 H new ATOM 0 HB2 MET A 23 -1.157 -12.263 -29.857 1.00 0.00 H new ATOM 0 HB3 MET A 23 -0.014 -11.087 -30.474 1.00 0.00 H new ATOM 0 HG2 MET A 23 0.968 -10.948 -28.448 1.00 0.00 H new ATOM 0 HG3 MET A 23 -0.533 -10.402 -27.726 1.00 0.00 H new ATOM 0 HE1 MET A 23 1.049 -14.756 -27.824 1.00 0.00 H new ATOM 0 HE2 MET A 23 0.819 -13.830 -29.327 1.00 0.00 H new ATOM 0 HE3 MET A 23 2.004 -13.283 -28.117 1.00 0.00 H new ATOM 349 N LYS A 24 -3.354 -10.835 -31.995 1.00 0.00 N ATOM 350 CA LYS A 24 -4.082 -10.426 -33.243 1.00 0.00 C ATOM 351 C LYS A 24 -4.782 -9.021 -33.197 1.00 0.00 C ATOM 352 O LYS A 24 -4.578 -8.231 -34.123 1.00 0.00 O ATOM 353 CB LYS A 24 -5.071 -11.551 -33.678 1.00 0.00 C ATOM 354 CG LYS A 24 -4.435 -12.641 -34.574 1.00 0.00 C ATOM 355 CD LYS A 24 -5.301 -13.902 -34.816 1.00 0.00 C ATOM 356 CE LYS A 24 -5.325 -14.817 -33.581 1.00 0.00 C ATOM 357 NZ LYS A 24 -5.893 -16.166 -33.819 1.00 0.00 N ATOM 0 H LYS A 24 -3.688 -11.710 -31.590 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.308 -10.297 -34.000 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.482 -12.024 -32.786 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.906 -11.099 -34.212 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.195 -12.197 -35.540 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -3.492 -12.951 -34.123 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -6.318 -13.603 -35.068 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -4.910 -14.454 -35.671 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -4.307 -14.927 -33.208 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -5.901 -14.329 -32.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -5.285 -16.882 -33.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -6.847 -16.218 -33.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -5.946 -16.345 -34.842 1.00 0.00 H new ATOM 371 N GLU A 25 -5.562 -8.691 -32.147 1.00 0.00 N ATOM 372 CA GLU A 25 -6.131 -7.322 -31.942 1.00 0.00 C ATOM 373 C GLU A 25 -5.089 -6.146 -31.797 1.00 0.00 C ATOM 374 O GLU A 25 -5.289 -5.080 -32.395 1.00 0.00 O ATOM 375 CB GLU A 25 -7.191 -7.433 -30.807 1.00 0.00 C ATOM 376 CG GLU A 25 -7.968 -6.123 -30.517 1.00 0.00 C ATOM 377 CD GLU A 25 -9.281 -6.296 -29.781 1.00 0.00 C ATOM 378 OE1 GLU A 25 -10.323 -6.430 -30.454 1.00 0.00 O ATOM 379 OE2 GLU A 25 -9.312 -6.221 -28.536 1.00 0.00 O ATOM 0 H GLU A 25 -5.820 -9.354 -31.416 1.00 0.00 H new ATOM 0 HA GLU A 25 -6.615 -6.998 -32.863 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -7.906 -8.213 -31.071 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -6.692 -7.754 -29.892 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -7.328 -5.462 -29.933 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -8.165 -5.620 -31.464 1.00 0.00 H new ATOM 386 N LEU A 26 -3.968 -6.348 -31.073 1.00 0.00 N ATOM 387 CA LEU A 26 -2.742 -5.495 -31.189 1.00 0.00 C ATOM 388 C LEU A 26 -2.104 -5.407 -32.623 1.00 0.00 C ATOM 389 O LEU A 26 -1.813 -4.305 -33.096 1.00 0.00 O ATOM 390 CB LEU A 26 -1.682 -5.988 -30.154 1.00 0.00 C ATOM 391 CG LEU A 26 -1.966 -5.732 -28.651 1.00 0.00 C ATOM 392 CD1 LEU A 26 -1.015 -6.553 -27.768 1.00 0.00 C ATOM 393 CD2 LEU A 26 -1.805 -4.249 -28.280 1.00 0.00 C ATOM 0 H LEU A 26 -3.876 -7.101 -30.391 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.069 -4.477 -30.978 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -1.553 -7.061 -30.292 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -0.730 -5.518 -30.400 1.00 0.00 H new ATOM 0 HG LEU A 26 -2.999 -6.034 -28.477 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.233 -6.357 -26.718 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.152 -7.614 -27.975 1.00 0.00 H new ATOM 0 HD13 LEU A 26 0.016 -6.271 -27.983 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.013 -4.115 -27.219 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -0.785 -3.929 -28.493 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -2.503 -3.650 -28.865 1.00 0.00 H new ATOM 405 N GLY A 27 -1.868 -6.558 -33.275 1.00 0.00 N ATOM 406 CA GLY A 27 -1.275 -6.645 -34.637 1.00 0.00 C ATOM 407 C GLY A 27 0.074 -7.389 -34.718 1.00 0.00 C ATOM 408 O GLY A 27 1.045 -6.823 -35.219 1.00 0.00 O ATOM 0 H GLY A 27 -2.083 -7.470 -32.873 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -1.987 -7.143 -35.295 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -1.138 -5.634 -35.022 1.00 0.00 H new ATOM 412 N VAL A 28 0.120 -8.647 -34.250 1.00 0.00 N ATOM 413 CA VAL A 28 1.391 -9.421 -34.090 1.00 0.00 C ATOM 414 C VAL A 28 1.411 -10.608 -35.114 1.00 0.00 C ATOM 415 O VAL A 28 0.480 -11.427 -35.177 1.00 0.00 O ATOM 416 CB VAL A 28 1.548 -9.933 -32.611 1.00 0.00 C ATOM 417 CG1 VAL A 28 2.873 -10.689 -32.346 1.00 0.00 C ATOM 418 CG2 VAL A 28 1.466 -8.849 -31.509 1.00 0.00 C ATOM 0 H VAL A 28 -0.712 -9.166 -33.969 1.00 0.00 H new ATOM 0 HA VAL A 28 2.240 -8.769 -34.298 1.00 0.00 H new ATOM 0 HB VAL A 28 0.684 -10.594 -32.541 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.907 -11.010 -31.305 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.931 -11.561 -32.997 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.716 -10.028 -32.549 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.587 -9.315 -30.531 1.00 0.00 H new ATOM 0 HG22 VAL A 28 2.257 -8.114 -31.662 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.496 -8.354 -31.557 1.00 0.00 H new ATOM 428 N GLY A 29 2.523 -10.745 -35.862 1.00 0.00 N ATOM 429 CA GLY A 29 2.721 -11.873 -36.816 1.00 0.00 C ATOM 430 C GLY A 29 2.904 -13.288 -36.203 1.00 0.00 C ATOM 431 O GLY A 29 3.261 -13.450 -35.034 1.00 0.00 O ATOM 0 H GLY A 29 3.305 -10.091 -35.829 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.864 -11.903 -37.488 1.00 0.00 H new ATOM 0 HA3 GLY A 29 3.597 -11.652 -37.426 1.00 0.00 H new ATOM 435 N ILE A 30 2.665 -14.329 -37.021 1.00 0.00 N ATOM 436 CA ILE A 30 2.585 -15.755 -36.563 1.00 0.00 C ATOM 437 C ILE A 30 3.849 -16.306 -35.810 1.00 0.00 C ATOM 438 O ILE A 30 3.698 -16.884 -34.731 1.00 0.00 O ATOM 439 CB ILE A 30 2.113 -16.707 -37.727 1.00 0.00 C ATOM 440 CG1 ILE A 30 0.993 -16.154 -38.669 1.00 0.00 C ATOM 441 CG2 ILE A 30 1.642 -18.079 -37.173 1.00 0.00 C ATOM 442 CD1 ILE A 30 1.506 -15.422 -39.924 1.00 0.00 C ATOM 0 H ILE A 30 2.519 -14.219 -38.025 1.00 0.00 H new ATOM 0 HA ILE A 30 1.819 -15.750 -35.788 1.00 0.00 H new ATOM 0 HB ILE A 30 3.009 -16.799 -38.341 1.00 0.00 H new ATOM 0 HG12 ILE A 30 0.360 -16.984 -38.983 1.00 0.00 H new ATOM 0 HG13 ILE A 30 0.363 -15.471 -38.099 1.00 0.00 H new ATOM 0 HG21 ILE A 30 1.322 -18.715 -37.999 1.00 0.00 H new ATOM 0 HG22 ILE A 30 2.465 -18.559 -36.643 1.00 0.00 H new ATOM 0 HG23 ILE A 30 0.808 -17.928 -36.488 1.00 0.00 H new ATOM 0 HD11 ILE A 30 0.658 -15.075 -40.515 1.00 0.00 H new ATOM 0 HD12 ILE A 30 2.113 -14.568 -39.624 1.00 0.00 H new ATOM 0 HD13 ILE A 30 2.110 -16.105 -40.522 1.00 0.00 H new ATOM 454 N ALA A 31 5.073 -16.117 -36.342 1.00 0.00 N ATOM 455 CA ALA A 31 6.332 -16.437 -35.610 1.00 0.00 C ATOM 456 C ALA A 31 6.557 -15.705 -34.240 1.00 0.00 C ATOM 457 O ALA A 31 6.931 -16.354 -33.258 1.00 0.00 O ATOM 458 CB ALA A 31 7.493 -16.207 -36.596 1.00 0.00 C ATOM 0 H ALA A 31 5.225 -15.743 -37.279 1.00 0.00 H new ATOM 0 HA ALA A 31 6.266 -17.476 -35.287 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.439 -16.430 -36.102 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.372 -16.861 -37.460 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.491 -15.168 -36.924 1.00 0.00 H new ATOM 464 N LEU A 32 6.281 -14.390 -34.164 1.00 0.00 N ATOM 465 CA LEU A 32 6.246 -13.626 -32.882 1.00 0.00 C ATOM 466 C LEU A 32 5.117 -14.049 -31.877 1.00 0.00 C ATOM 467 O LEU A 32 5.403 -14.152 -30.681 1.00 0.00 O ATOM 468 CB LEU A 32 6.215 -12.104 -33.209 1.00 0.00 C ATOM 469 CG LEU A 32 7.495 -11.499 -33.855 1.00 0.00 C ATOM 470 CD1 LEU A 32 7.210 -10.104 -34.431 1.00 0.00 C ATOM 471 CD2 LEU A 32 8.667 -11.390 -32.863 1.00 0.00 C ATOM 0 H LEU A 32 6.075 -13.818 -34.983 1.00 0.00 H new ATOM 0 HA LEU A 32 7.156 -13.876 -32.337 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.376 -11.918 -33.879 1.00 0.00 H new ATOM 0 HB3 LEU A 32 6.012 -11.562 -32.285 1.00 0.00 H new ATOM 0 HG LEU A 32 7.782 -12.186 -34.651 1.00 0.00 H new ATOM 0 HD11 LEU A 32 8.120 -9.702 -34.877 1.00 0.00 H new ATOM 0 HD12 LEU A 32 6.434 -10.177 -35.193 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.874 -9.442 -33.633 1.00 0.00 H new ATOM 0 HD21 LEU A 32 9.533 -10.962 -33.368 1.00 0.00 H new ATOM 0 HD22 LEU A 32 8.380 -10.749 -32.029 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.920 -12.382 -32.488 1.00 0.00 H new ATOM 483 N ARG A 33 3.877 -14.354 -32.323 1.00 0.00 N ATOM 484 CA ARG A 33 2.853 -15.031 -31.464 1.00 0.00 C ATOM 485 C ARG A 33 3.223 -16.481 -30.995 1.00 0.00 C ATOM 486 O ARG A 33 3.031 -16.793 -29.819 1.00 0.00 O ATOM 487 CB ARG A 33 1.443 -15.031 -32.117 1.00 0.00 C ATOM 488 CG ARG A 33 0.842 -13.649 -32.490 1.00 0.00 C ATOM 489 CD ARG A 33 -0.692 -13.563 -32.676 1.00 0.00 C ATOM 490 NE ARG A 33 -1.307 -14.711 -33.390 1.00 0.00 N ATOM 491 CZ ARG A 33 -1.326 -14.912 -34.697 1.00 0.00 C ATOM 492 NH1 ARG A 33 -0.857 -14.062 -35.580 1.00 0.00 N ATOM 493 NH2 ARG A 33 -1.856 -16.028 -35.099 1.00 0.00 N ATOM 0 H ARG A 33 3.553 -14.147 -33.268 1.00 0.00 H new ATOM 0 HA ARG A 33 2.837 -14.418 -30.563 1.00 0.00 H new ATOM 0 HB2 ARG A 33 1.488 -15.637 -33.022 1.00 0.00 H new ATOM 0 HB3 ARG A 33 0.753 -15.528 -31.435 1.00 0.00 H new ATOM 0 HG2 ARG A 33 1.127 -12.938 -31.715 1.00 0.00 H new ATOM 0 HG3 ARG A 33 1.312 -13.317 -33.416 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -1.157 -13.475 -31.694 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.925 -12.649 -33.222 1.00 0.00 H new ATOM 0 HE ARG A 33 -1.762 -15.418 -32.812 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -0.445 -13.181 -35.271 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -0.904 -14.282 -36.575 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -2.228 -16.690 -34.418 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -1.901 -16.242 -36.095 1.00 0.00 H new ATOM 507 N LYS A 34 3.781 -17.345 -31.869 1.00 0.00 N ATOM 508 CA LYS A 34 4.426 -18.628 -31.465 1.00 0.00 C ATOM 509 C LYS A 34 5.555 -18.496 -30.379 1.00 0.00 C ATOM 510 O LYS A 34 5.491 -19.196 -29.366 1.00 0.00 O ATOM 511 CB LYS A 34 4.880 -19.322 -32.774 1.00 0.00 C ATOM 512 CG LYS A 34 5.377 -20.771 -32.581 1.00 0.00 C ATOM 513 CD LYS A 34 5.768 -21.500 -33.885 1.00 0.00 C ATOM 514 CE LYS A 34 7.032 -20.999 -34.620 1.00 0.00 C ATOM 515 NZ LYS A 34 8.274 -21.264 -33.838 1.00 0.00 N ATOM 0 H LYS A 34 3.801 -17.180 -32.875 1.00 0.00 H new ATOM 0 HA LYS A 34 3.703 -19.248 -30.934 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.048 -19.326 -33.478 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.678 -18.733 -33.227 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.240 -20.759 -31.915 1.00 0.00 H new ATOM 0 HG3 LYS A 34 4.597 -21.344 -32.081 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.908 -22.556 -33.653 1.00 0.00 H new ATOM 0 HD3 LYS A 34 4.927 -21.434 -34.575 1.00 0.00 H new ATOM 0 HE2 LYS A 34 7.104 -21.488 -35.592 1.00 0.00 H new ATOM 0 HE3 LYS A 34 6.943 -19.929 -34.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 9.098 -20.913 -34.366 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 8.217 -20.777 -32.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 8.374 -22.287 -33.681 1.00 0.00 H new ATOM 529 N MET A 35 6.535 -17.582 -30.559 1.00 0.00 N ATOM 530 CA MET A 35 7.460 -17.141 -29.470 1.00 0.00 C ATOM 531 C MET A 35 6.747 -16.645 -28.160 1.00 0.00 C ATOM 532 O MET A 35 7.014 -17.204 -27.096 1.00 0.00 O ATOM 533 CB MET A 35 8.417 -16.086 -30.092 1.00 0.00 C ATOM 534 CG MET A 35 9.581 -15.639 -29.185 1.00 0.00 C ATOM 535 SD MET A 35 10.491 -14.273 -29.939 1.00 0.00 S ATOM 536 CE MET A 35 9.441 -12.873 -29.497 1.00 0.00 C ATOM 0 H MET A 35 6.713 -17.127 -31.454 1.00 0.00 H new ATOM 0 HA MET A 35 8.022 -18.002 -29.107 1.00 0.00 H new ATOM 0 HB2 MET A 35 8.832 -16.494 -31.014 1.00 0.00 H new ATOM 0 HB3 MET A 35 7.834 -15.207 -30.367 1.00 0.00 H new ATOM 0 HG2 MET A 35 9.194 -15.332 -28.213 1.00 0.00 H new ATOM 0 HG3 MET A 35 10.254 -16.478 -29.009 1.00 0.00 H new ATOM 0 HE1 MET A 35 9.891 -11.950 -29.863 1.00 0.00 H new ATOM 0 HE2 MET A 35 8.457 -13.000 -29.947 1.00 0.00 H new ATOM 0 HE3 MET A 35 9.340 -12.822 -28.413 1.00 0.00 H new ATOM 546 N GLY A 36 5.832 -15.655 -28.234 1.00 0.00 N ATOM 547 CA GLY A 36 4.999 -15.218 -27.074 1.00 0.00 C ATOM 548 C GLY A 36 4.130 -16.256 -26.315 1.00 0.00 C ATOM 549 O GLY A 36 4.027 -16.166 -25.091 1.00 0.00 O ATOM 0 H GLY A 36 5.644 -15.134 -29.090 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.669 -14.761 -26.346 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.332 -14.433 -27.430 1.00 0.00 H new ATOM 553 N ALA A 37 3.517 -17.225 -27.015 1.00 0.00 N ATOM 554 CA ALA A 37 2.795 -18.360 -26.381 1.00 0.00 C ATOM 555 C ALA A 37 3.677 -19.373 -25.573 1.00 0.00 C ATOM 556 O ALA A 37 3.350 -19.652 -24.417 1.00 0.00 O ATOM 557 CB ALA A 37 1.980 -19.041 -27.499 1.00 0.00 C ATOM 0 H ALA A 37 3.503 -17.251 -28.035 1.00 0.00 H new ATOM 0 HA ALA A 37 2.154 -17.959 -25.596 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.429 -19.885 -27.085 1.00 0.00 H new ATOM 0 HB2 ALA A 37 1.279 -18.324 -27.926 1.00 0.00 H new ATOM 0 HB3 ALA A 37 2.656 -19.396 -28.277 1.00 0.00 H new ATOM 563 N MET A 38 4.778 -19.914 -26.142 1.00 0.00 N ATOM 564 CA MET A 38 5.739 -20.769 -25.372 1.00 0.00 C ATOM 565 C MET A 38 6.750 -20.042 -24.412 1.00 0.00 C ATOM 566 O MET A 38 7.251 -20.677 -23.478 1.00 0.00 O ATOM 567 CB MET A 38 6.407 -21.798 -26.324 1.00 0.00 C ATOM 568 CG MET A 38 7.469 -21.266 -27.308 1.00 0.00 C ATOM 569 SD MET A 38 8.117 -22.595 -28.346 1.00 0.00 S ATOM 570 CE MET A 38 6.751 -22.839 -29.497 1.00 0.00 C ATOM 0 H MET A 38 5.031 -19.782 -27.121 1.00 0.00 H new ATOM 0 HA MET A 38 5.126 -21.294 -24.640 1.00 0.00 H new ATOM 0 HB2 MET A 38 6.871 -22.571 -25.712 1.00 0.00 H new ATOM 0 HB3 MET A 38 5.621 -22.280 -26.905 1.00 0.00 H new ATOM 0 HG2 MET A 38 7.031 -20.490 -27.936 1.00 0.00 H new ATOM 0 HG3 MET A 38 8.285 -20.803 -26.752 1.00 0.00 H new ATOM 0 HE1 MET A 38 7.089 -23.441 -30.341 1.00 0.00 H new ATOM 0 HE2 MET A 38 5.935 -23.352 -28.989 1.00 0.00 H new ATOM 0 HE3 MET A 38 6.402 -21.871 -29.858 1.00 0.00 H new ATOM 580 N ALA A 39 7.031 -18.734 -24.588 1.00 0.00 N ATOM 581 CA ALA A 39 7.722 -17.903 -23.571 1.00 0.00 C ATOM 582 C ALA A 39 6.841 -17.670 -22.302 1.00 0.00 C ATOM 583 O ALA A 39 5.788 -17.027 -22.361 1.00 0.00 O ATOM 584 CB ALA A 39 8.090 -16.566 -24.243 1.00 0.00 C ATOM 0 H ALA A 39 6.787 -18.222 -25.436 1.00 0.00 H new ATOM 0 HA ALA A 39 8.616 -18.419 -23.222 1.00 0.00 H new ATOM 0 HB1 ALA A 39 8.601 -15.926 -23.524 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.747 -16.754 -25.092 1.00 0.00 H new ATOM 0 HB3 ALA A 39 7.183 -16.071 -24.589 1.00 0.00 H new ATOM 590 N LYS A 40 7.289 -18.198 -21.153 1.00 0.00 N ATOM 591 CA LYS A 40 6.566 -18.076 -19.858 1.00 0.00 C ATOM 592 C LYS A 40 7.352 -17.121 -18.887 1.00 0.00 C ATOM 593 O LYS A 40 8.144 -17.623 -18.082 1.00 0.00 O ATOM 594 CB LYS A 40 6.189 -19.486 -19.303 1.00 0.00 C ATOM 595 CG LYS A 40 7.293 -20.516 -18.936 1.00 0.00 C ATOM 596 CD LYS A 40 7.808 -21.368 -20.123 1.00 0.00 C ATOM 597 CE LYS A 40 8.975 -22.313 -19.781 1.00 0.00 C ATOM 598 NZ LYS A 40 10.238 -21.544 -19.586 1.00 0.00 N ATOM 0 H LYS A 40 8.161 -18.723 -21.085 1.00 0.00 H new ATOM 0 HA LYS A 40 5.601 -17.586 -19.991 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.588 -19.328 -18.408 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.542 -19.959 -20.042 1.00 0.00 H new ATOM 0 HG2 LYS A 40 8.136 -19.983 -18.497 1.00 0.00 H new ATOM 0 HG3 LYS A 40 6.905 -21.185 -18.168 1.00 0.00 H new ATOM 0 HD2 LYS A 40 6.981 -21.961 -20.512 1.00 0.00 H new ATOM 0 HD3 LYS A 40 8.124 -20.698 -20.923 1.00 0.00 H new ATOM 0 HE2 LYS A 40 8.742 -22.874 -18.876 1.00 0.00 H new ATOM 0 HE3 LYS A 40 9.107 -23.041 -20.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 11.012 -22.200 -19.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 10.469 -21.028 -20.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 10.115 -20.867 -18.806 1.00 0.00 H new ATOM 612 N PRO A 41 7.212 -15.757 -18.924 1.00 0.00 N ATOM 613 CA PRO A 41 8.136 -14.853 -18.193 1.00 0.00 C ATOM 614 C PRO A 41 7.939 -14.719 -16.654 1.00 0.00 C ATOM 615 O PRO A 41 6.823 -14.764 -16.124 1.00 0.00 O ATOM 616 CB PRO A 41 7.940 -13.500 -18.913 1.00 0.00 C ATOM 617 CG PRO A 41 6.546 -13.573 -19.532 1.00 0.00 C ATOM 618 CD PRO A 41 6.432 -15.035 -19.950 1.00 0.00 C ATOM 0 HA PRO A 41 9.146 -15.260 -18.228 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.017 -12.667 -18.214 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.702 -13.347 -19.677 1.00 0.00 H new ATOM 0 HG2 PRO A 41 5.772 -13.296 -18.816 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.447 -12.901 -20.384 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.394 -15.366 -19.969 1.00 0.00 H new ATOM 0 HD3 PRO A 41 6.837 -15.198 -20.949 1.00 0.00 H new ATOM 626 N ASP A 42 9.061 -14.428 -15.980 1.00 0.00 N ATOM 627 CA ASP A 42 9.065 -13.890 -14.598 1.00 0.00 C ATOM 628 C ASP A 42 8.888 -12.339 -14.641 1.00 0.00 C ATOM 629 O ASP A 42 9.824 -11.587 -14.927 1.00 0.00 O ATOM 630 CB ASP A 42 10.378 -14.307 -13.883 1.00 0.00 C ATOM 631 CG ASP A 42 10.464 -15.731 -13.334 1.00 0.00 C ATOM 632 OD1 ASP A 42 9.666 -16.617 -13.705 1.00 0.00 O ATOM 633 OD2 ASP A 42 11.362 -15.961 -12.496 1.00 0.00 O ATOM 0 H ASP A 42 9.994 -14.556 -16.371 1.00 0.00 H new ATOM 0 HA ASP A 42 8.232 -14.303 -14.029 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.201 -14.167 -14.584 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.543 -13.617 -13.055 1.00 0.00 H new ATOM 638 N CYS A 43 7.670 -11.864 -14.347 1.00 0.00 N ATOM 639 CA CYS A 43 7.380 -10.427 -14.138 1.00 0.00 C ATOM 640 C CYS A 43 7.848 -9.968 -12.719 1.00 0.00 C ATOM 641 O CYS A 43 7.202 -10.231 -11.702 1.00 0.00 O ATOM 642 CB CYS A 43 5.870 -10.269 -14.404 1.00 0.00 C ATOM 643 SG CYS A 43 5.340 -8.555 -14.107 1.00 0.00 S ATOM 0 H CYS A 43 6.851 -12.463 -14.246 1.00 0.00 H new ATOM 0 HA CYS A 43 7.931 -9.773 -14.814 1.00 0.00 H new ATOM 0 HB2 CYS A 43 5.646 -10.551 -15.433 1.00 0.00 H new ATOM 0 HB3 CYS A 43 5.309 -10.945 -13.759 1.00 0.00 H new ATOM 0 HG CYS A 43 4.294 -8.552 -13.335 1.00 0.00 H new ATOM 649 N ILE A 44 9.016 -9.313 -12.670 1.00 0.00 N ATOM 650 CA ILE A 44 9.724 -8.974 -11.400 1.00 0.00 C ATOM 651 C ILE A 44 9.330 -7.508 -11.024 1.00 0.00 C ATOM 652 O ILE A 44 9.852 -6.552 -11.608 1.00 0.00 O ATOM 653 CB ILE A 44 11.275 -9.184 -11.551 1.00 0.00 C ATOM 654 CG1 ILE A 44 11.715 -10.613 -12.003 1.00 0.00 C ATOM 655 CG2 ILE A 44 12.056 -8.823 -10.258 1.00 0.00 C ATOM 656 CD1 ILE A 44 12.963 -10.601 -12.902 1.00 0.00 C ATOM 0 H ILE A 44 9.509 -8.997 -13.505 1.00 0.00 H new ATOM 0 HA ILE A 44 9.425 -9.637 -10.588 1.00 0.00 H new ATOM 0 HB ILE A 44 11.529 -8.493 -12.355 1.00 0.00 H new ATOM 0 HG12 ILE A 44 11.915 -11.222 -11.121 1.00 0.00 H new ATOM 0 HG13 ILE A 44 10.893 -11.088 -12.538 1.00 0.00 H new ATOM 0 HG21 ILE A 44 13.122 -8.987 -10.419 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.883 -7.776 -10.009 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.712 -9.453 -9.437 1.00 0.00 H new ATOM 0 HD11 ILE A 44 13.219 -11.623 -13.183 1.00 0.00 H new ATOM 0 HD12 ILE A 44 12.759 -10.018 -13.800 1.00 0.00 H new ATOM 0 HD13 ILE A 44 13.797 -10.154 -12.361 1.00 0.00 H new ATOM 668 N ILE A 45 8.405 -7.346 -10.065 1.00 0.00 N ATOM 669 CA ILE A 45 7.863 -6.011 -9.666 1.00 0.00 C ATOM 670 C ILE A 45 8.597 -5.532 -8.368 1.00 0.00 C ATOM 671 O ILE A 45 8.621 -6.248 -7.361 1.00 0.00 O ATOM 672 CB ILE A 45 6.294 -6.063 -9.500 1.00 0.00 C ATOM 673 CG1 ILE A 45 5.546 -6.504 -10.797 1.00 0.00 C ATOM 674 CG2 ILE A 45 5.711 -4.704 -9.017 1.00 0.00 C ATOM 675 CD1 ILE A 45 4.027 -6.736 -10.679 1.00 0.00 C ATOM 0 H ILE A 45 8.005 -8.123 -9.539 1.00 0.00 H new ATOM 0 HA ILE A 45 8.055 -5.280 -10.452 1.00 0.00 H new ATOM 0 HB ILE A 45 6.124 -6.823 -8.738 1.00 0.00 H new ATOM 0 HG12 ILE A 45 5.715 -5.745 -11.561 1.00 0.00 H new ATOM 0 HG13 ILE A 45 6.003 -7.426 -11.156 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.629 -4.787 -8.917 1.00 0.00 H new ATOM 0 HG22 ILE A 45 6.146 -4.444 -8.052 1.00 0.00 H new ATOM 0 HG23 ILE A 45 5.950 -3.927 -9.743 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.629 -7.038 -11.648 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.835 -7.520 -9.947 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.542 -5.814 -10.359 1.00 0.00 H new ATOM 687 N THR A 46 9.096 -4.281 -8.362 1.00 0.00 N ATOM 688 CA THR A 46 9.372 -3.530 -7.096 1.00 0.00 C ATOM 689 C THR A 46 8.881 -2.043 -7.186 1.00 0.00 C ATOM 690 O THR A 46 9.017 -1.391 -8.227 1.00 0.00 O ATOM 691 CB THR A 46 10.835 -3.695 -6.587 1.00 0.00 C ATOM 692 OG1 THR A 46 10.967 -3.160 -5.266 1.00 0.00 O ATOM 693 CG2 THR A 46 11.931 -3.054 -7.456 1.00 0.00 C ATOM 0 H THR A 46 9.320 -3.760 -9.210 1.00 0.00 H new ATOM 0 HA THR A 46 8.771 -3.993 -6.313 1.00 0.00 H new ATOM 0 HB THR A 46 10.997 -4.772 -6.625 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.320 -3.593 -4.671 1.00 0.00 H new ATOM 0 HG21 THR A 46 12.906 -3.234 -7.003 1.00 0.00 H new ATOM 0 HG22 THR A 46 11.908 -3.493 -8.453 1.00 0.00 H new ATOM 0 HG23 THR A 46 11.757 -1.980 -7.528 1.00 0.00 H new ATOM 701 N CYS A 47 8.300 -1.512 -6.094 1.00 0.00 N ATOM 702 CA CYS A 47 7.737 -0.138 -6.046 1.00 0.00 C ATOM 703 C CYS A 47 8.439 0.742 -4.969 1.00 0.00 C ATOM 704 O CYS A 47 8.134 0.662 -3.774 1.00 0.00 O ATOM 705 CB CYS A 47 6.213 -0.260 -5.831 1.00 0.00 C ATOM 706 SG CYS A 47 5.423 1.384 -5.973 1.00 0.00 S ATOM 0 H CYS A 47 8.205 -2.020 -5.215 1.00 0.00 H new ATOM 0 HA CYS A 47 7.923 0.380 -6.987 1.00 0.00 H new ATOM 0 HB2 CYS A 47 5.788 -0.941 -6.568 1.00 0.00 H new ATOM 0 HB3 CYS A 47 6.010 -0.686 -4.848 1.00 0.00 H new ATOM 0 HG CYS A 47 6.002 2.215 -5.158 1.00 0.00 H new ATOM 712 N ASP A 48 9.328 1.650 -5.409 1.00 0.00 N ATOM 713 CA ASP A 48 9.925 2.696 -4.531 1.00 0.00 C ATOM 714 C ASP A 48 8.956 3.926 -4.395 1.00 0.00 C ATOM 715 O ASP A 48 9.131 4.976 -5.026 1.00 0.00 O ATOM 716 CB ASP A 48 11.327 2.975 -5.135 1.00 0.00 C ATOM 717 CG ASP A 48 12.160 4.034 -4.417 1.00 0.00 C ATOM 718 OD1 ASP A 48 12.362 3.918 -3.190 1.00 0.00 O ATOM 719 OD2 ASP A 48 12.613 4.990 -5.084 1.00 0.00 O ATOM 0 H ASP A 48 9.657 1.688 -6.374 1.00 0.00 H new ATOM 0 HA ASP A 48 10.057 2.393 -3.492 1.00 0.00 H new ATOM 0 HB2 ASP A 48 11.890 2.042 -5.145 1.00 0.00 H new ATOM 0 HB3 ASP A 48 11.200 3.282 -6.173 1.00 0.00 H new ATOM 724 N GLY A 49 7.890 3.758 -3.583 1.00 0.00 N ATOM 725 CA GLY A 49 6.853 4.804 -3.354 1.00 0.00 C ATOM 726 C GLY A 49 5.993 5.211 -4.575 1.00 0.00 C ATOM 727 O GLY A 49 4.873 4.731 -4.763 1.00 0.00 O ATOM 0 H GLY A 49 7.718 2.896 -3.065 1.00 0.00 H new ATOM 0 HA2 GLY A 49 6.184 4.453 -2.569 1.00 0.00 H new ATOM 0 HA3 GLY A 49 7.349 5.697 -2.975 1.00 0.00 H new ATOM 731 N LYS A 50 6.552 6.121 -5.378 1.00 0.00 N ATOM 732 CA LYS A 50 5.964 6.554 -6.679 1.00 0.00 C ATOM 733 C LYS A 50 6.663 6.012 -7.973 1.00 0.00 C ATOM 734 O LYS A 50 6.035 6.106 -9.029 1.00 0.00 O ATOM 735 CB LYS A 50 5.909 8.110 -6.687 1.00 0.00 C ATOM 736 CG LYS A 50 4.815 8.758 -5.796 1.00 0.00 C ATOM 737 CD LYS A 50 3.349 8.587 -6.260 1.00 0.00 C ATOM 738 CE LYS A 50 2.988 9.107 -7.667 1.00 0.00 C ATOM 739 NZ LYS A 50 3.108 10.586 -7.790 1.00 0.00 N ATOM 0 H LYS A 50 7.430 6.589 -5.155 1.00 0.00 H new ATOM 0 HA LYS A 50 4.972 6.106 -6.730 1.00 0.00 H new ATOM 0 HB2 LYS A 50 6.880 8.490 -6.369 1.00 0.00 H new ATOM 0 HB3 LYS A 50 5.757 8.443 -7.714 1.00 0.00 H new ATOM 0 HG2 LYS A 50 4.905 8.343 -4.792 1.00 0.00 H new ATOM 0 HG3 LYS A 50 5.026 9.825 -5.720 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.104 7.526 -6.219 1.00 0.00 H new ATOM 0 HD3 LYS A 50 2.706 9.091 -5.539 1.00 0.00 H new ATOM 0 HE2 LYS A 50 3.639 8.633 -8.401 1.00 0.00 H new ATOM 0 HE3 LYS A 50 1.967 8.810 -7.907 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 2.853 10.876 -8.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 2.467 11.044 -7.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 4.087 10.873 -7.590 1.00 0.00 H new ATOM 753 N ASN A 51 7.905 5.481 -7.952 1.00 0.00 N ATOM 754 CA ASN A 51 8.544 4.866 -9.153 1.00 0.00 C ATOM 755 C ASN A 51 8.475 3.302 -9.072 1.00 0.00 C ATOM 756 O ASN A 51 9.014 2.684 -8.149 1.00 0.00 O ATOM 757 CB ASN A 51 9.960 5.465 -9.394 1.00 0.00 C ATOM 758 CG ASN A 51 11.086 5.140 -8.403 1.00 0.00 C ATOM 759 OD1 ASN A 51 11.854 4.204 -8.596 1.00 0.00 O ATOM 760 ND2 ASN A 51 11.231 5.908 -7.349 1.00 0.00 N ATOM 0 H ASN A 51 8.492 5.462 -7.118 1.00 0.00 H new ATOM 0 HA ASN A 51 7.983 5.123 -10.051 1.00 0.00 H new ATOM 0 HB2 ASN A 51 10.289 5.144 -10.382 1.00 0.00 H new ATOM 0 HB3 ASN A 51 9.856 6.549 -9.430 1.00 0.00 H new ATOM 0 HD21 ASN A 51 11.985 5.727 -6.686 1.00 0.00 H new ATOM 0 HD22 ASN A 51 10.590 6.686 -7.192 1.00 0.00 H new ATOM 767 N LEU A 52 7.767 2.673 -10.024 1.00 0.00 N ATOM 768 CA LEU A 52 7.507 1.208 -10.030 1.00 0.00 C ATOM 769 C LEU A 52 8.261 0.538 -11.223 1.00 0.00 C ATOM 770 O LEU A 52 7.999 0.813 -12.400 1.00 0.00 O ATOM 771 CB LEU A 52 5.962 1.021 -9.970 1.00 0.00 C ATOM 772 CG LEU A 52 5.425 -0.429 -9.806 1.00 0.00 C ATOM 773 CD1 LEU A 52 4.038 -0.434 -9.136 1.00 0.00 C ATOM 774 CD2 LEU A 52 5.312 -1.165 -11.149 1.00 0.00 C ATOM 0 H LEU A 52 7.353 3.161 -10.819 1.00 0.00 H new ATOM 0 HA LEU A 52 7.909 0.684 -9.163 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.582 1.617 -9.140 1.00 0.00 H new ATOM 0 HB3 LEU A 52 5.536 1.437 -10.883 1.00 0.00 H new ATOM 0 HG LEU A 52 6.149 -0.948 -9.178 1.00 0.00 H new ATOM 0 HD11 LEU A 52 3.687 -1.461 -9.034 1.00 0.00 H new ATOM 0 HD12 LEU A 52 4.109 0.025 -8.150 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.336 0.130 -9.749 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.933 -2.173 -10.981 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.628 -0.625 -11.804 1.00 0.00 H new ATOM 0 HD23 LEU A 52 6.295 -1.221 -11.617 1.00 0.00 H new ATOM 786 N THR A 53 9.207 -0.353 -10.896 1.00 0.00 N ATOM 787 CA THR A 53 10.076 -1.046 -11.887 1.00 0.00 C ATOM 788 C THR A 53 9.522 -2.477 -12.163 1.00 0.00 C ATOM 789 O THR A 53 9.345 -3.273 -11.233 1.00 0.00 O ATOM 790 CB THR A 53 11.546 -1.036 -11.361 1.00 0.00 C ATOM 791 OG1 THR A 53 12.003 0.308 -11.232 1.00 0.00 O ATOM 792 CG2 THR A 53 12.572 -1.721 -12.278 1.00 0.00 C ATOM 0 H THR A 53 9.401 -0.623 -9.932 1.00 0.00 H new ATOM 0 HA THR A 53 10.073 -0.528 -12.846 1.00 0.00 H new ATOM 0 HB THR A 53 11.494 -1.584 -10.420 1.00 0.00 H new ATOM 0 HG1 THR A 53 12.925 0.310 -10.900 1.00 0.00 H new ATOM 0 HG21 THR A 53 13.562 -1.661 -11.825 1.00 0.00 H new ATOM 0 HG22 THR A 53 12.298 -2.767 -12.413 1.00 0.00 H new ATOM 0 HG23 THR A 53 12.585 -1.221 -13.247 1.00 0.00 H new ATOM 800 N ILE A 54 9.281 -2.805 -13.447 1.00 0.00 N ATOM 801 CA ILE A 54 8.863 -4.177 -13.871 1.00 0.00 C ATOM 802 C ILE A 54 9.955 -4.723 -14.852 1.00 0.00 C ATOM 803 O ILE A 54 10.079 -4.245 -15.986 1.00 0.00 O ATOM 804 CB ILE A 54 7.401 -4.252 -14.457 1.00 0.00 C ATOM 805 CG1 ILE A 54 6.339 -3.558 -13.545 1.00 0.00 C ATOM 806 CG2 ILE A 54 7.003 -5.728 -14.738 1.00 0.00 C ATOM 807 CD1 ILE A 54 4.849 -3.697 -13.915 1.00 0.00 C ATOM 0 H ILE A 54 9.366 -2.144 -14.219 1.00 0.00 H new ATOM 0 HA ILE A 54 8.802 -4.818 -12.992 1.00 0.00 H new ATOM 0 HB ILE A 54 7.411 -3.697 -15.395 1.00 0.00 H new ATOM 0 HG12 ILE A 54 6.467 -3.944 -12.534 1.00 0.00 H new ATOM 0 HG13 ILE A 54 6.575 -2.494 -13.512 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.991 -5.761 -15.142 1.00 0.00 H new ATOM 0 HG22 ILE A 54 7.696 -6.161 -15.459 1.00 0.00 H new ATOM 0 HG23 ILE A 54 7.042 -6.298 -13.810 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.242 -3.160 -13.186 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.680 -3.278 -14.907 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.571 -4.751 -13.914 1.00 0.00 H new ATOM 819 N LYS A 55 10.709 -5.760 -14.432 1.00 0.00 N ATOM 820 CA LYS A 55 11.553 -6.567 -15.360 1.00 0.00 C ATOM 821 C LYS A 55 10.801 -7.878 -15.761 1.00 0.00 C ATOM 822 O LYS A 55 10.647 -8.785 -14.944 1.00 0.00 O ATOM 823 CB LYS A 55 12.944 -6.840 -14.719 1.00 0.00 C ATOM 824 CG LYS A 55 13.977 -7.397 -15.728 1.00 0.00 C ATOM 825 CD LYS A 55 15.283 -7.941 -15.113 1.00 0.00 C ATOM 826 CE LYS A 55 16.317 -8.254 -16.217 1.00 0.00 C ATOM 827 NZ LYS A 55 17.396 -9.152 -15.727 1.00 0.00 N ATOM 0 H LYS A 55 10.756 -6.064 -13.459 1.00 0.00 H new ATOM 0 HA LYS A 55 11.733 -6.009 -16.279 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.327 -5.915 -14.289 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.827 -7.548 -13.899 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.505 -8.196 -16.300 1.00 0.00 H new ATOM 0 HG3 LYS A 55 14.231 -6.607 -16.434 1.00 0.00 H new ATOM 0 HD2 LYS A 55 15.696 -7.210 -14.418 1.00 0.00 H new ATOM 0 HD3 LYS A 55 15.072 -8.843 -14.539 1.00 0.00 H new ATOM 0 HE2 LYS A 55 15.814 -8.720 -17.064 1.00 0.00 H new ATOM 0 HE3 LYS A 55 16.755 -7.324 -16.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 18.322 -8.740 -15.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 17.314 -9.263 -14.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 17.307 -10.082 -16.183 1.00 0.00 H new ATOM 841 N THR A 56 10.356 -7.989 -17.022 1.00 0.00 N ATOM 842 CA THR A 56 9.704 -9.224 -17.557 1.00 0.00 C ATOM 843 C THR A 56 10.792 -10.158 -18.184 1.00 0.00 C ATOM 844 O THR A 56 11.288 -9.884 -19.281 1.00 0.00 O ATOM 845 CB THR A 56 8.584 -8.777 -18.549 1.00 0.00 C ATOM 846 OG1 THR A 56 7.659 -7.918 -17.889 1.00 0.00 O ATOM 847 CG2 THR A 56 7.737 -9.913 -19.134 1.00 0.00 C ATOM 0 H THR A 56 10.431 -7.237 -17.707 1.00 0.00 H new ATOM 0 HA THR A 56 9.228 -9.817 -16.776 1.00 0.00 H new ATOM 0 HB THR A 56 9.132 -8.297 -19.360 1.00 0.00 H new ATOM 0 HG1 THR A 56 6.962 -7.642 -18.520 1.00 0.00 H new ATOM 0 HG21 THR A 56 6.989 -9.498 -19.810 1.00 0.00 H new ATOM 0 HG22 THR A 56 8.380 -10.601 -19.683 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.239 -10.449 -18.326 1.00 0.00 H new ATOM 855 N GLU A 57 11.173 -11.232 -17.470 1.00 0.00 N ATOM 856 CA GLU A 57 12.327 -12.106 -17.837 1.00 0.00 C ATOM 857 C GLU A 57 11.897 -13.437 -18.522 1.00 0.00 C ATOM 858 O GLU A 57 11.281 -14.299 -17.891 1.00 0.00 O ATOM 859 CB GLU A 57 13.158 -12.417 -16.553 1.00 0.00 C ATOM 860 CG GLU A 57 14.312 -11.434 -16.262 1.00 0.00 C ATOM 861 CD GLU A 57 15.594 -11.635 -17.059 1.00 0.00 C ATOM 862 OE1 GLU A 57 15.551 -11.768 -18.300 1.00 0.00 O ATOM 863 OE2 GLU A 57 16.673 -11.554 -16.434 1.00 0.00 O ATOM 0 H GLU A 57 10.695 -11.528 -16.619 1.00 0.00 H new ATOM 0 HA GLU A 57 12.927 -11.562 -18.567 1.00 0.00 H new ATOM 0 HB2 GLU A 57 12.484 -12.424 -15.696 1.00 0.00 H new ATOM 0 HB3 GLU A 57 13.572 -13.422 -16.642 1.00 0.00 H new ATOM 0 HG2 GLU A 57 13.952 -10.422 -16.445 1.00 0.00 H new ATOM 0 HG3 GLU A 57 14.556 -11.499 -15.202 1.00 0.00 H new ATOM 870 N SER A 58 12.299 -13.636 -19.787 1.00 0.00 N ATOM 871 CA SER A 58 12.209 -14.957 -20.471 1.00 0.00 C ATOM 872 C SER A 58 13.444 -15.165 -21.398 1.00 0.00 C ATOM 873 O SER A 58 13.839 -14.257 -22.136 1.00 0.00 O ATOM 874 CB SER A 58 10.884 -15.049 -21.266 1.00 0.00 C ATOM 875 OG SER A 58 10.740 -16.314 -21.914 1.00 0.00 O ATOM 0 H SER A 58 12.694 -12.898 -20.370 1.00 0.00 H new ATOM 0 HA SER A 58 12.212 -15.753 -19.726 1.00 0.00 H new ATOM 0 HB2 SER A 58 10.043 -14.889 -20.591 1.00 0.00 H new ATOM 0 HB3 SER A 58 10.851 -14.254 -22.010 1.00 0.00 H new ATOM 0 HG SER A 58 9.810 -16.614 -21.843 1.00 0.00 H new ATOM 881 N THR A 59 13.991 -16.396 -21.445 1.00 0.00 N ATOM 882 CA THR A 59 15.088 -16.783 -22.400 1.00 0.00 C ATOM 883 C THR A 59 14.849 -16.445 -23.914 1.00 0.00 C ATOM 884 O THR A 59 15.735 -15.893 -24.568 1.00 0.00 O ATOM 885 CB THR A 59 15.484 -18.285 -22.234 1.00 0.00 C ATOM 886 OG1 THR A 59 14.366 -19.141 -22.453 1.00 0.00 O ATOM 887 CG2 THR A 59 16.092 -18.662 -20.874 1.00 0.00 C ATOM 0 H THR A 59 13.698 -17.157 -20.832 1.00 0.00 H new ATOM 0 HA THR A 59 15.916 -16.138 -22.105 1.00 0.00 H new ATOM 0 HB THR A 59 16.259 -18.424 -22.988 1.00 0.00 H new ATOM 0 HG1 THR A 59 14.643 -20.075 -22.344 1.00 0.00 H new ATOM 0 HG21 THR A 59 16.331 -19.725 -20.864 1.00 0.00 H new ATOM 0 HG22 THR A 59 17.002 -18.084 -20.709 1.00 0.00 H new ATOM 0 HG23 THR A 59 15.375 -18.444 -20.082 1.00 0.00 H new ATOM 895 N LEU A 60 13.641 -16.714 -24.442 1.00 0.00 N ATOM 896 CA LEU A 60 13.193 -16.197 -25.768 1.00 0.00 C ATOM 897 C LEU A 60 13.092 -14.635 -25.909 1.00 0.00 C ATOM 898 O LEU A 60 13.416 -14.124 -26.984 1.00 0.00 O ATOM 899 CB LEU A 60 11.830 -16.863 -26.127 1.00 0.00 C ATOM 900 CG LEU A 60 11.851 -18.381 -26.456 1.00 0.00 C ATOM 901 CD1 LEU A 60 10.439 -18.979 -26.370 1.00 0.00 C ATOM 902 CD2 LEU A 60 12.424 -18.668 -27.856 1.00 0.00 C ATOM 0 H LEU A 60 12.944 -17.292 -23.972 1.00 0.00 H new ATOM 0 HA LEU A 60 13.981 -16.469 -26.470 1.00 0.00 H new ATOM 0 HB2 LEU A 60 11.147 -16.707 -25.292 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.411 -16.336 -26.985 1.00 0.00 H new ATOM 0 HG LEU A 60 12.500 -18.846 -25.714 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.479 -20.043 -26.604 1.00 0.00 H new ATOM 0 HD12 LEU A 60 10.048 -18.844 -25.362 1.00 0.00 H new ATOM 0 HD13 LEU A 60 9.786 -18.475 -27.083 1.00 0.00 H new ATOM 0 HD21 LEU A 60 12.417 -19.743 -28.039 1.00 0.00 H new ATOM 0 HD22 LEU A 60 11.814 -18.168 -28.608 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.447 -18.296 -27.914 1.00 0.00 H new ATOM 914 N LYS A 61 12.592 -13.885 -24.898 1.00 0.00 N ATOM 915 CA LYS A 61 12.388 -12.410 -25.011 1.00 0.00 C ATOM 916 C LYS A 61 12.258 -11.749 -23.596 1.00 0.00 C ATOM 917 O LYS A 61 11.186 -11.766 -22.978 1.00 0.00 O ATOM 918 CB LYS A 61 11.155 -12.126 -25.927 1.00 0.00 C ATOM 919 CG LYS A 61 11.022 -10.721 -26.563 1.00 0.00 C ATOM 920 CD LYS A 61 10.677 -9.561 -25.613 1.00 0.00 C ATOM 921 CE LYS A 61 9.294 -9.657 -24.920 1.00 0.00 C ATOM 922 NZ LYS A 61 9.457 -9.624 -23.443 1.00 0.00 N ATOM 0 H LYS A 61 12.321 -14.271 -23.994 1.00 0.00 H new ATOM 0 HA LYS A 61 13.262 -11.954 -25.477 1.00 0.00 H new ATOM 0 HB2 LYS A 61 11.166 -12.857 -26.735 1.00 0.00 H new ATOM 0 HB3 LYS A 61 10.255 -12.312 -25.341 1.00 0.00 H new ATOM 0 HG2 LYS A 61 11.961 -10.484 -27.062 1.00 0.00 H new ATOM 0 HG3 LYS A 61 10.254 -10.768 -27.335 1.00 0.00 H new ATOM 0 HD2 LYS A 61 11.447 -9.503 -24.843 1.00 0.00 H new ATOM 0 HD3 LYS A 61 10.718 -8.628 -26.176 1.00 0.00 H new ATOM 0 HE2 LYS A 61 8.660 -8.831 -25.242 1.00 0.00 H new ATOM 0 HE3 LYS A 61 8.793 -10.578 -25.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 8.521 -9.604 -22.991 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 9.973 -10.471 -23.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 9.991 -8.774 -23.172 1.00 0.00 H new ATOM 936 N THR A 62 13.322 -11.073 -23.134 1.00 0.00 N ATOM 937 CA THR A 62 13.288 -10.209 -21.908 1.00 0.00 C ATOM 938 C THR A 62 12.906 -8.723 -22.261 1.00 0.00 C ATOM 939 O THR A 62 13.242 -8.196 -23.328 1.00 0.00 O ATOM 940 CB THR A 62 14.634 -10.372 -21.125 1.00 0.00 C ATOM 941 OG1 THR A 62 14.665 -11.672 -20.532 1.00 0.00 O ATOM 942 CG2 THR A 62 14.892 -9.372 -19.983 1.00 0.00 C ATOM 0 H THR A 62 14.235 -11.099 -23.587 1.00 0.00 H new ATOM 0 HA THR A 62 12.494 -10.536 -21.236 1.00 0.00 H new ATOM 0 HB THR A 62 15.402 -10.193 -21.877 1.00 0.00 H new ATOM 0 HG1 THR A 62 15.405 -11.722 -19.891 1.00 0.00 H new ATOM 0 HG21 THR A 62 15.854 -9.589 -19.520 1.00 0.00 H new ATOM 0 HG22 THR A 62 14.902 -8.358 -20.383 1.00 0.00 H new ATOM 0 HG23 THR A 62 14.102 -9.460 -19.237 1.00 0.00 H new ATOM 950 N THR A 63 12.172 -8.029 -21.366 1.00 0.00 N ATOM 951 CA THR A 63 11.884 -6.561 -21.509 1.00 0.00 C ATOM 952 C THR A 63 11.766 -5.883 -20.104 1.00 0.00 C ATOM 953 O THR A 63 11.126 -6.414 -19.193 1.00 0.00 O ATOM 954 CB THR A 63 10.627 -6.314 -22.403 1.00 0.00 C ATOM 955 OG1 THR A 63 10.757 -7.016 -23.635 1.00 0.00 O ATOM 956 CG2 THR A 63 10.387 -4.847 -22.793 1.00 0.00 C ATOM 0 H THR A 63 11.762 -8.450 -20.532 1.00 0.00 H new ATOM 0 HA THR A 63 12.723 -6.091 -22.022 1.00 0.00 H new ATOM 0 HB THR A 63 9.795 -6.655 -21.788 1.00 0.00 H new ATOM 0 HG1 THR A 63 11.668 -7.367 -23.717 1.00 0.00 H new ATOM 0 HG21 THR A 63 9.493 -4.777 -23.413 1.00 0.00 H new ATOM 0 HG22 THR A 63 10.252 -4.248 -21.892 1.00 0.00 H new ATOM 0 HG23 THR A 63 11.246 -4.474 -23.351 1.00 0.00 H new ATOM 964 N GLN A 64 12.379 -4.697 -19.932 1.00 0.00 N ATOM 965 CA GLN A 64 12.415 -3.971 -18.628 1.00 0.00 C ATOM 966 C GLN A 64 11.910 -2.503 -18.770 1.00 0.00 C ATOM 967 O GLN A 64 12.349 -1.770 -19.662 1.00 0.00 O ATOM 968 CB GLN A 64 13.871 -4.067 -18.087 1.00 0.00 C ATOM 969 CG GLN A 64 14.101 -3.612 -16.618 1.00 0.00 C ATOM 970 CD GLN A 64 14.564 -2.161 -16.436 1.00 0.00 C ATOM 971 OE1 GLN A 64 15.681 -1.794 -16.783 1.00 0.00 O ATOM 972 NE2 GLN A 64 13.763 -1.298 -15.864 1.00 0.00 N ATOM 0 H GLN A 64 12.865 -4.208 -20.684 1.00 0.00 H new ATOM 0 HA GLN A 64 11.733 -4.428 -17.911 1.00 0.00 H new ATOM 0 HB2 GLN A 64 14.200 -5.102 -18.178 1.00 0.00 H new ATOM 0 HB3 GLN A 64 14.514 -3.470 -18.733 1.00 0.00 H new ATOM 0 HG2 GLN A 64 13.172 -3.750 -16.065 1.00 0.00 H new ATOM 0 HG3 GLN A 64 14.842 -4.270 -16.165 1.00 0.00 H new ATOM 0 HE21 GLN A 64 12.830 -1.586 -15.569 1.00 0.00 H new ATOM 0 HE22 GLN A 64 14.072 -0.338 -15.713 1.00 0.00 H new ATOM 981 N PHE A 65 11.025 -2.061 -17.855 1.00 0.00 N ATOM 982 CA PHE A 65 10.586 -0.638 -17.773 1.00 0.00 C ATOM 983 C PHE A 65 10.533 -0.093 -16.307 1.00 0.00 C ATOM 984 O PHE A 65 10.290 -0.833 -15.347 1.00 0.00 O ATOM 985 CB PHE A 65 9.259 -0.425 -18.558 1.00 0.00 C ATOM 986 CG PHE A 65 7.969 -1.131 -18.084 1.00 0.00 C ATOM 987 CD1 PHE A 65 7.290 -0.690 -16.941 1.00 0.00 C ATOM 988 CD2 PHE A 65 7.396 -2.133 -18.874 1.00 0.00 C ATOM 989 CE1 PHE A 65 6.055 -1.234 -16.602 1.00 0.00 C ATOM 990 CE2 PHE A 65 6.157 -2.673 -18.537 1.00 0.00 C ATOM 991 CZ PHE A 65 5.485 -2.217 -17.406 1.00 0.00 C ATOM 0 H PHE A 65 10.594 -2.666 -17.156 1.00 0.00 H new ATOM 0 HA PHE A 65 11.350 -0.033 -18.260 1.00 0.00 H new ATOM 0 HB2 PHE A 65 9.058 0.646 -18.573 1.00 0.00 H new ATOM 0 HB3 PHE A 65 9.438 -0.730 -19.589 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.728 0.077 -16.319 1.00 0.00 H new ATOM 0 HD2 PHE A 65 7.917 -2.490 -19.750 1.00 0.00 H new ATOM 0 HE1 PHE A 65 5.539 -0.894 -15.716 1.00 0.00 H new ATOM 0 HE2 PHE A 65 5.718 -3.444 -19.152 1.00 0.00 H new ATOM 0 HZ PHE A 65 4.519 -2.627 -17.152 1.00 0.00 H new ATOM 1001 N SER A 66 10.725 1.229 -16.159 1.00 0.00 N ATOM 1002 CA SER A 66 10.506 1.960 -14.880 1.00 0.00 C ATOM 1003 C SER A 66 9.382 3.025 -15.063 1.00 0.00 C ATOM 1004 O SER A 66 9.618 4.079 -15.668 1.00 0.00 O ATOM 1005 CB SER A 66 11.842 2.588 -14.417 1.00 0.00 C ATOM 1006 OG SER A 66 12.272 3.629 -15.298 1.00 0.00 O ATOM 0 H SER A 66 11.038 1.831 -16.921 1.00 0.00 H new ATOM 0 HA SER A 66 10.173 1.273 -14.102 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.726 2.989 -13.410 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.609 1.815 -14.366 1.00 0.00 H new ATOM 0 HG SER A 66 11.498 3.995 -15.775 1.00 0.00 H new ATOM 1012 N CYS A 67 8.174 2.747 -14.551 1.00 0.00 N ATOM 1013 CA CYS A 67 7.011 3.662 -14.677 1.00 0.00 C ATOM 1014 C CYS A 67 6.817 4.598 -13.443 1.00 0.00 C ATOM 1015 O CYS A 67 7.147 4.242 -12.310 1.00 0.00 O ATOM 1016 CB CYS A 67 5.778 2.767 -14.923 1.00 0.00 C ATOM 1017 SG CYS A 67 5.336 1.742 -13.481 1.00 0.00 S ATOM 0 H CYS A 67 7.968 1.889 -14.039 1.00 0.00 H new ATOM 0 HA CYS A 67 7.173 4.352 -15.505 1.00 0.00 H new ATOM 0 HB2 CYS A 67 4.928 3.396 -15.188 1.00 0.00 H new ATOM 0 HB3 CYS A 67 5.973 2.118 -15.776 1.00 0.00 H new ATOM 0 HG CYS A 67 6.417 1.263 -12.941 1.00 0.00 H new ATOM 1023 N THR A 68 6.225 5.787 -13.646 1.00 0.00 N ATOM 1024 CA THR A 68 5.756 6.646 -12.513 1.00 0.00 C ATOM 1025 C THR A 68 4.266 6.309 -12.182 1.00 0.00 C ATOM 1026 O THR A 68 3.401 6.269 -13.063 1.00 0.00 O ATOM 1027 CB THR A 68 5.982 8.146 -12.861 1.00 0.00 C ATOM 1028 OG1 THR A 68 7.355 8.370 -13.165 1.00 0.00 O ATOM 1029 CG2 THR A 68 5.645 9.121 -11.719 1.00 0.00 C ATOM 0 H THR A 68 6.055 6.184 -14.570 1.00 0.00 H new ATOM 0 HA THR A 68 6.336 6.442 -11.613 1.00 0.00 H new ATOM 0 HB THR A 68 5.313 8.339 -13.700 1.00 0.00 H new ATOM 0 HG1 THR A 68 7.491 9.315 -13.385 1.00 0.00 H new ATOM 0 HG21 THR A 68 5.831 10.144 -12.047 1.00 0.00 H new ATOM 0 HG22 THR A 68 4.595 9.013 -11.446 1.00 0.00 H new ATOM 0 HG23 THR A 68 6.270 8.898 -10.854 1.00 0.00 H new ATOM 1037 N LEU A 69 3.963 6.084 -10.894 1.00 0.00 N ATOM 1038 CA LEU A 69 2.606 5.705 -10.431 1.00 0.00 C ATOM 1039 C LEU A 69 1.570 6.872 -10.562 1.00 0.00 C ATOM 1040 O LEU A 69 1.850 8.018 -10.196 1.00 0.00 O ATOM 1041 CB LEU A 69 2.747 5.216 -8.964 1.00 0.00 C ATOM 1042 CG LEU A 69 1.606 4.280 -8.500 1.00 0.00 C ATOM 1043 CD1 LEU A 69 1.885 2.832 -8.937 1.00 0.00 C ATOM 1044 CD2 LEU A 69 1.421 4.368 -6.980 1.00 0.00 C ATOM 0 H LEU A 69 4.646 6.158 -10.140 1.00 0.00 H new ATOM 0 HA LEU A 69 2.208 4.913 -11.065 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.698 4.694 -8.856 1.00 0.00 H new ATOM 0 HB3 LEU A 69 2.782 6.083 -8.305 1.00 0.00 H new ATOM 0 HG LEU A 69 0.679 4.604 -8.973 1.00 0.00 H new ATOM 0 HD11 LEU A 69 1.072 2.188 -8.602 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.959 2.788 -10.024 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.822 2.493 -8.496 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.614 3.703 -6.673 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.345 4.072 -6.483 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.172 5.392 -6.702 1.00 0.00 H new ATOM 1056 N GLY A 70 0.395 6.595 -11.145 1.00 0.00 N ATOM 1057 CA GLY A 70 -0.522 7.667 -11.628 1.00 0.00 C ATOM 1058 C GLY A 70 -0.148 8.481 -12.897 1.00 0.00 C ATOM 1059 O GLY A 70 -0.975 9.281 -13.337 1.00 0.00 O ATOM 0 H GLY A 70 0.048 5.648 -11.298 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -1.494 7.208 -11.809 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.653 8.377 -10.811 1.00 0.00 H new ATOM 1063 N GLU A 71 1.060 8.305 -13.459 1.00 0.00 N ATOM 1064 CA GLU A 71 1.583 9.110 -14.593 1.00 0.00 C ATOM 1065 C GLU A 71 2.045 8.207 -15.792 1.00 0.00 C ATOM 1066 O GLU A 71 2.019 6.966 -15.749 1.00 0.00 O ATOM 1067 CB GLU A 71 2.672 10.096 -14.044 1.00 0.00 C ATOM 1068 CG GLU A 71 2.374 11.599 -14.295 1.00 0.00 C ATOM 1069 CD GLU A 71 2.490 12.079 -15.737 1.00 0.00 C ATOM 1070 OE1 GLU A 71 1.748 11.574 -16.607 1.00 0.00 O ATOM 1071 OE2 GLU A 71 3.326 12.965 -16.003 1.00 0.00 O ATOM 0 H GLU A 71 1.715 7.592 -13.139 1.00 0.00 H new ATOM 0 HA GLU A 71 0.790 9.718 -15.029 1.00 0.00 H new ATOM 0 HB2 GLU A 71 2.780 9.935 -12.971 1.00 0.00 H new ATOM 0 HB3 GLU A 71 3.630 9.848 -14.501 1.00 0.00 H new ATOM 0 HG2 GLU A 71 1.364 11.811 -13.944 1.00 0.00 H new ATOM 0 HG3 GLU A 71 3.055 12.190 -13.682 1.00 0.00 H new ATOM 1078 N LYS A 72 2.370 8.880 -16.910 1.00 0.00 N ATOM 1079 CA LYS A 72 2.340 8.285 -18.270 1.00 0.00 C ATOM 1080 C LYS A 72 3.764 8.166 -18.902 1.00 0.00 C ATOM 1081 O LYS A 72 4.383 9.168 -19.272 1.00 0.00 O ATOM 1082 CB LYS A 72 1.375 9.190 -19.089 1.00 0.00 C ATOM 1083 CG LYS A 72 0.816 8.555 -20.380 1.00 0.00 C ATOM 1084 CD LYS A 72 -0.120 9.520 -21.154 1.00 0.00 C ATOM 1085 CE LYS A 72 -1.387 8.862 -21.732 1.00 0.00 C ATOM 1086 NZ LYS A 72 -2.422 8.676 -20.683 1.00 0.00 N ATOM 0 H LYS A 72 2.663 9.857 -16.902 1.00 0.00 H new ATOM 0 HA LYS A 72 1.986 7.254 -18.253 1.00 0.00 H new ATOM 0 HB2 LYS A 72 0.538 9.473 -18.450 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.900 10.108 -19.352 1.00 0.00 H new ATOM 0 HG2 LYS A 72 1.644 8.260 -21.025 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.269 7.646 -20.128 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -0.419 10.328 -20.486 1.00 0.00 H new ATOM 0 HD3 LYS A 72 0.442 9.973 -21.970 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.787 9.481 -22.536 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -1.131 7.897 -22.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -2.781 7.700 -20.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -2.005 8.858 -19.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -3.206 9.339 -20.847 1.00 0.00 H new ATOM 1100 N PHE A 73 4.265 6.929 -19.056 1.00 0.00 N ATOM 1101 CA PHE A 73 5.569 6.640 -19.734 1.00 0.00 C ATOM 1102 C PHE A 73 5.373 6.024 -21.163 1.00 0.00 C ATOM 1103 O PHE A 73 4.327 5.438 -21.451 1.00 0.00 O ATOM 1104 CB PHE A 73 6.434 5.757 -18.778 1.00 0.00 C ATOM 1105 CG PHE A 73 6.115 4.246 -18.719 1.00 0.00 C ATOM 1106 CD1 PHE A 73 4.937 3.790 -18.119 1.00 0.00 C ATOM 1107 CD2 PHE A 73 6.948 3.330 -19.373 1.00 0.00 C ATOM 1108 CE1 PHE A 73 4.583 2.447 -18.201 1.00 0.00 C ATOM 1109 CE2 PHE A 73 6.597 1.985 -19.436 1.00 0.00 C ATOM 1110 CZ PHE A 73 5.415 1.546 -18.848 1.00 0.00 C ATOM 0 H PHE A 73 3.789 6.092 -18.719 1.00 0.00 H new ATOM 0 HA PHE A 73 6.106 7.570 -19.920 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.478 5.869 -19.069 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.339 6.160 -17.770 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.300 4.483 -17.590 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.866 3.669 -19.830 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.658 2.106 -17.760 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.242 1.282 -19.941 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.145 0.501 -18.896 1.00 0.00 H new ATOM 1120 N GLU A 74 6.387 6.065 -22.050 1.00 0.00 N ATOM 1121 CA GLU A 74 6.335 5.294 -23.327 1.00 0.00 C ATOM 1122 C GLU A 74 6.763 3.801 -23.119 1.00 0.00 C ATOM 1123 O GLU A 74 7.949 3.487 -22.970 1.00 0.00 O ATOM 1124 CB GLU A 74 7.153 6.025 -24.423 1.00 0.00 C ATOM 1125 CG GLU A 74 6.961 5.407 -25.835 1.00 0.00 C ATOM 1126 CD GLU A 74 7.512 6.231 -26.981 1.00 0.00 C ATOM 1127 OE1 GLU A 74 6.776 7.108 -27.482 1.00 0.00 O ATOM 1128 OE2 GLU A 74 8.646 5.961 -27.429 1.00 0.00 O ATOM 0 H GLU A 74 7.239 6.609 -21.919 1.00 0.00 H new ATOM 0 HA GLU A 74 5.303 5.251 -23.675 1.00 0.00 H new ATOM 0 HB2 GLU A 74 6.860 7.075 -24.449 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.210 5.996 -24.160 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.436 4.426 -25.852 1.00 0.00 H new ATOM 0 HG3 GLU A 74 5.896 5.248 -26.002 1.00 0.00 H new ATOM 1135 N GLU A 75 5.786 2.878 -23.158 1.00 0.00 N ATOM 1136 CA GLU A 75 6.047 1.420 -23.207 1.00 0.00 C ATOM 1137 C GLU A 75 6.168 0.978 -24.701 1.00 0.00 C ATOM 1138 O GLU A 75 5.162 0.835 -25.412 1.00 0.00 O ATOM 1139 CB GLU A 75 4.910 0.710 -22.421 1.00 0.00 C ATOM 1140 CG GLU A 75 5.144 -0.800 -22.169 1.00 0.00 C ATOM 1141 CD GLU A 75 4.104 -1.533 -21.326 1.00 0.00 C ATOM 1142 OE1 GLU A 75 3.582 -0.979 -20.335 1.00 0.00 O ATOM 1143 OE2 GLU A 75 3.842 -2.716 -21.627 1.00 0.00 O ATOM 0 H GLU A 75 4.794 3.116 -23.157 1.00 0.00 H new ATOM 0 HA GLU A 75 6.989 1.143 -22.734 1.00 0.00 H new ATOM 0 HB2 GLU A 75 4.784 1.210 -21.461 1.00 0.00 H new ATOM 0 HB3 GLU A 75 3.976 0.833 -22.969 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.208 -1.299 -23.136 1.00 0.00 H new ATOM 0 HG3 GLU A 75 6.114 -0.916 -21.686 1.00 0.00 H new ATOM 1150 N THR A 76 7.412 0.773 -25.182 1.00 0.00 N ATOM 1151 CA THR A 76 7.656 0.185 -26.532 1.00 0.00 C ATOM 1152 C THR A 76 7.444 -1.359 -26.476 1.00 0.00 C ATOM 1153 O THR A 76 8.231 -2.109 -25.888 1.00 0.00 O ATOM 1154 CB THR A 76 9.043 0.591 -27.115 1.00 0.00 C ATOM 1155 OG1 THR A 76 9.111 2.006 -27.267 1.00 0.00 O ATOM 1156 CG2 THR A 76 9.338 0.006 -28.512 1.00 0.00 C ATOM 0 H THR A 76 8.262 1.001 -24.667 1.00 0.00 H new ATOM 0 HA THR A 76 6.928 0.599 -27.230 1.00 0.00 H new ATOM 0 HB THR A 76 9.769 0.197 -26.404 1.00 0.00 H new ATOM 0 HG1 THR A 76 9.986 2.254 -27.632 1.00 0.00 H new ATOM 0 HG21 THR A 76 10.322 0.337 -28.845 1.00 0.00 H new ATOM 0 HG22 THR A 76 9.319 -1.083 -28.462 1.00 0.00 H new ATOM 0 HG23 THR A 76 8.582 0.350 -29.218 1.00 0.00 H new ATOM 1164 N THR A 77 6.371 -1.810 -27.132 1.00 0.00 N ATOM 1165 CA THR A 77 6.031 -3.255 -27.253 1.00 0.00 C ATOM 1166 C THR A 77 6.964 -3.960 -28.292 1.00 0.00 C ATOM 1167 O THR A 77 7.207 -3.431 -29.380 1.00 0.00 O ATOM 1168 CB THR A 77 4.515 -3.431 -27.589 1.00 0.00 C ATOM 1169 OG1 THR A 77 4.176 -2.819 -28.832 1.00 0.00 O ATOM 1170 CG2 THR A 77 3.552 -2.873 -26.521 1.00 0.00 C ATOM 0 H THR A 77 5.705 -1.194 -27.599 1.00 0.00 H new ATOM 0 HA THR A 77 6.206 -3.744 -26.295 1.00 0.00 H new ATOM 0 HB THR A 77 4.386 -4.512 -27.632 1.00 0.00 H new ATOM 0 HG1 THR A 77 4.312 -1.851 -28.768 1.00 0.00 H new ATOM 0 HG21 THR A 77 2.522 -3.039 -26.838 1.00 0.00 H new ATOM 0 HG22 THR A 77 3.726 -3.381 -25.573 1.00 0.00 H new ATOM 0 HG23 THR A 77 3.726 -1.804 -26.397 1.00 0.00 H new ATOM 1178 N ALA A 78 7.503 -5.148 -27.956 1.00 0.00 N ATOM 1179 CA ALA A 78 8.561 -5.821 -28.774 1.00 0.00 C ATOM 1180 C ALA A 78 8.272 -6.184 -30.273 1.00 0.00 C ATOM 1181 O ALA A 78 9.208 -6.230 -31.074 1.00 0.00 O ATOM 1182 CB ALA A 78 9.010 -7.054 -27.970 1.00 0.00 C ATOM 0 H ALA A 78 7.230 -5.672 -27.124 1.00 0.00 H new ATOM 0 HA ALA A 78 9.335 -5.068 -28.921 1.00 0.00 H new ATOM 0 HB1 ALA A 78 9.785 -7.586 -28.522 1.00 0.00 H new ATOM 0 HB2 ALA A 78 9.405 -6.735 -27.006 1.00 0.00 H new ATOM 0 HB3 ALA A 78 8.158 -7.715 -27.812 1.00 0.00 H new ATOM 1188 N ASP A 79 7.001 -6.386 -30.659 1.00 0.00 N ATOM 1189 CA ASP A 79 6.569 -6.388 -32.089 1.00 0.00 C ATOM 1190 C ASP A 79 6.640 -4.989 -32.828 1.00 0.00 C ATOM 1191 O ASP A 79 6.831 -4.968 -34.047 1.00 0.00 O ATOM 1192 CB ASP A 79 5.171 -7.059 -32.045 1.00 0.00 C ATOM 1193 CG ASP A 79 4.439 -7.231 -33.373 1.00 0.00 C ATOM 1194 OD1 ASP A 79 4.690 -8.209 -34.103 1.00 0.00 O ATOM 1195 OD2 ASP A 79 3.539 -6.409 -33.644 1.00 0.00 O ATOM 0 H ASP A 79 6.239 -6.553 -30.002 1.00 0.00 H new ATOM 0 HA ASP A 79 7.262 -6.941 -32.723 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.283 -8.043 -31.591 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.535 -6.472 -31.382 1.00 0.00 H new ATOM 1200 N GLY A 80 6.528 -3.838 -32.129 1.00 0.00 N ATOM 1201 CA GLY A 80 6.850 -2.504 -32.717 1.00 0.00 C ATOM 1202 C GLY A 80 6.259 -1.236 -32.053 1.00 0.00 C ATOM 1203 O GLY A 80 6.908 -0.183 -32.082 1.00 0.00 O ATOM 0 H GLY A 80 6.218 -3.798 -31.158 1.00 0.00 H new ATOM 0 HA2 GLY A 80 7.935 -2.399 -32.723 1.00 0.00 H new ATOM 0 HA3 GLY A 80 6.525 -2.514 -33.757 1.00 0.00 H new ATOM 1207 N ARG A 81 5.023 -1.311 -31.531 1.00 0.00 N ATOM 1208 CA ARG A 81 4.195 -0.116 -31.184 1.00 0.00 C ATOM 1209 C ARG A 81 4.640 0.625 -29.882 1.00 0.00 C ATOM 1210 O ARG A 81 4.910 0.002 -28.848 1.00 0.00 O ATOM 1211 CB ARG A 81 2.708 -0.554 -31.052 1.00 0.00 C ATOM 1212 CG ARG A 81 2.013 -0.994 -32.369 1.00 0.00 C ATOM 1213 CD ARG A 81 0.772 -1.891 -32.158 1.00 0.00 C ATOM 1214 NE ARG A 81 1.122 -3.231 -31.610 1.00 0.00 N ATOM 1215 CZ ARG A 81 1.681 -4.224 -32.299 1.00 0.00 C ATOM 1216 NH1 ARG A 81 1.865 -4.222 -33.592 1.00 0.00 N ATOM 1217 NH2 ARG A 81 2.099 -5.264 -31.657 1.00 0.00 N ATOM 0 H ARG A 81 4.559 -2.197 -31.333 1.00 0.00 H new ATOM 0 HA ARG A 81 4.333 0.601 -31.994 1.00 0.00 H new ATOM 0 HB2 ARG A 81 2.654 -1.379 -30.342 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.142 0.273 -30.624 1.00 0.00 H new ATOM 0 HG2 ARG A 81 1.715 -0.105 -32.925 1.00 0.00 H new ATOM 0 HG3 ARG A 81 2.734 -1.529 -32.987 1.00 0.00 H new ATOM 0 HD2 ARG A 81 0.080 -1.394 -31.478 1.00 0.00 H new ATOM 0 HD3 ARG A 81 0.252 -2.015 -33.108 1.00 0.00 H new ATOM 0 HE ARG A 81 0.917 -3.402 -30.626 1.00 0.00 H new ATOM 0 HH11 ARG A 81 1.572 -3.418 -34.148 1.00 0.00 H new ATOM 0 HH12 ARG A 81 2.302 -5.024 -34.046 1.00 0.00 H new ATOM 0 HH21 ARG A 81 1.998 -5.312 -30.643 1.00 0.00 H new ATOM 0 HH22 ARG A 81 2.530 -6.037 -32.164 1.00 0.00 H new ATOM 1231 N LYS A 82 4.664 1.967 -29.960 1.00 0.00 N ATOM 1232 CA LYS A 82 5.044 2.864 -28.833 1.00 0.00 C ATOM 1233 C LYS A 82 3.758 3.292 -28.070 1.00 0.00 C ATOM 1234 O LYS A 82 2.881 3.947 -28.643 1.00 0.00 O ATOM 1235 CB LYS A 82 5.802 4.101 -29.403 1.00 0.00 C ATOM 1236 CG LYS A 82 7.312 3.930 -29.706 1.00 0.00 C ATOM 1237 CD LYS A 82 7.623 2.928 -30.834 1.00 0.00 C ATOM 1238 CE LYS A 82 9.118 2.759 -31.122 1.00 0.00 C ATOM 1239 NZ LYS A 82 9.249 1.699 -32.161 1.00 0.00 N ATOM 0 H LYS A 82 4.419 2.473 -30.811 1.00 0.00 H new ATOM 0 HA LYS A 82 5.703 2.348 -28.134 1.00 0.00 H new ATOM 0 HB2 LYS A 82 5.305 4.406 -30.324 1.00 0.00 H new ATOM 0 HB3 LYS A 82 5.691 4.921 -28.694 1.00 0.00 H new ATOM 0 HG2 LYS A 82 7.729 4.901 -29.973 1.00 0.00 H new ATOM 0 HG3 LYS A 82 7.818 3.605 -28.797 1.00 0.00 H new ATOM 0 HD2 LYS A 82 7.202 1.958 -30.570 1.00 0.00 H new ATOM 0 HD3 LYS A 82 7.123 3.256 -31.745 1.00 0.00 H new ATOM 0 HE2 LYS A 82 9.551 3.696 -31.472 1.00 0.00 H new ATOM 0 HE3 LYS A 82 9.655 2.478 -30.216 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 10.120 1.156 -31.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 8.429 1.061 -32.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 9.289 2.139 -33.103 1.00 0.00 H new ATOM 1253 N THR A 83 3.627 2.878 -26.800 1.00 0.00 N ATOM 1254 CA THR A 83 2.321 2.933 -26.084 1.00 0.00 C ATOM 1255 C THR A 83 2.408 3.845 -24.825 1.00 0.00 C ATOM 1256 O THR A 83 3.049 3.511 -23.822 1.00 0.00 O ATOM 1257 CB THR A 83 1.771 1.507 -25.783 1.00 0.00 C ATOM 1258 OG1 THR A 83 2.598 0.779 -24.884 1.00 0.00 O ATOM 1259 CG2 THR A 83 1.554 0.613 -27.015 1.00 0.00 C ATOM 0 H THR A 83 4.395 2.503 -26.243 1.00 0.00 H new ATOM 0 HA THR A 83 1.588 3.397 -26.744 1.00 0.00 H new ATOM 0 HB THR A 83 0.799 1.725 -25.339 1.00 0.00 H new ATOM 0 HG1 THR A 83 3.521 1.101 -24.954 1.00 0.00 H new ATOM 0 HG21 THR A 83 1.170 -0.357 -26.698 1.00 0.00 H new ATOM 0 HG22 THR A 83 0.837 1.086 -27.686 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.501 0.475 -27.536 1.00 0.00 H new ATOM 1267 N GLN A 84 1.718 4.996 -24.870 1.00 0.00 N ATOM 1268 CA GLN A 84 1.702 6.008 -23.779 1.00 0.00 C ATOM 1269 C GLN A 84 0.882 5.485 -22.557 1.00 0.00 C ATOM 1270 O GLN A 84 -0.350 5.493 -22.548 1.00 0.00 O ATOM 1271 CB GLN A 84 1.121 7.322 -24.386 1.00 0.00 C ATOM 1272 CG GLN A 84 2.089 8.282 -25.126 1.00 0.00 C ATOM 1273 CD GLN A 84 3.043 7.698 -26.185 1.00 0.00 C ATOM 1274 OE1 GLN A 84 2.634 7.111 -27.180 1.00 0.00 O ATOM 1275 NE2 GLN A 84 4.333 7.863 -26.003 1.00 0.00 N ATOM 0 H GLN A 84 1.145 5.262 -25.671 1.00 0.00 H new ATOM 0 HA GLN A 84 2.703 6.203 -23.395 1.00 0.00 H new ATOM 0 HB2 GLN A 84 0.330 7.045 -25.083 1.00 0.00 H new ATOM 0 HB3 GLN A 84 0.651 7.882 -23.578 1.00 0.00 H new ATOM 0 HG2 GLN A 84 1.486 9.050 -25.611 1.00 0.00 H new ATOM 0 HG3 GLN A 84 2.698 8.783 -24.373 1.00 0.00 H new ATOM 0 HE21 GLN A 84 4.673 8.352 -25.175 1.00 0.00 H new ATOM 0 HE22 GLN A 84 4.995 7.503 -26.690 1.00 0.00 H new ATOM 1284 N THR A 85 1.580 4.955 -21.548 1.00 0.00 N ATOM 1285 CA THR A 85 0.996 3.983 -20.593 1.00 0.00 C ATOM 1286 C THR A 85 0.903 4.621 -19.178 1.00 0.00 C ATOM 1287 O THR A 85 1.922 4.827 -18.510 1.00 0.00 O ATOM 1288 CB THR A 85 1.794 2.650 -20.675 1.00 0.00 C ATOM 1289 OG1 THR A 85 1.745 2.124 -22.002 1.00 0.00 O ATOM 1290 CG2 THR A 85 1.222 1.543 -19.777 1.00 0.00 C ATOM 0 H THR A 85 2.558 5.179 -21.363 1.00 0.00 H new ATOM 0 HA THR A 85 -0.032 3.729 -20.852 1.00 0.00 H new ATOM 0 HB THR A 85 2.804 2.905 -20.355 1.00 0.00 H new ATOM 0 HG1 THR A 85 2.343 2.641 -22.581 1.00 0.00 H new ATOM 0 HG21 THR A 85 1.825 0.641 -19.882 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.239 1.872 -18.738 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.195 1.329 -20.073 1.00 0.00 H new ATOM 1298 N VAL A 86 -0.325 4.939 -18.726 1.00 0.00 N ATOM 1299 CA VAL A 86 -0.568 5.518 -17.367 1.00 0.00 C ATOM 1300 C VAL A 86 -0.780 4.392 -16.295 1.00 0.00 C ATOM 1301 O VAL A 86 -1.651 3.529 -16.461 1.00 0.00 O ATOM 1302 CB VAL A 86 -1.646 6.654 -17.432 1.00 0.00 C ATOM 1303 CG1 VAL A 86 -3.074 6.226 -17.825 1.00 0.00 C ATOM 1304 CG2 VAL A 86 -1.727 7.481 -16.133 1.00 0.00 C ATOM 0 H VAL A 86 -1.174 4.809 -19.275 1.00 0.00 H new ATOM 0 HA VAL A 86 0.324 6.031 -17.008 1.00 0.00 H new ATOM 0 HB VAL A 86 -1.266 7.262 -18.253 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.726 7.099 -17.835 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.058 5.774 -18.817 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.449 5.502 -17.102 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.491 8.252 -16.239 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.985 6.827 -15.301 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -0.762 7.950 -15.940 1.00 0.00 H new ATOM 1314 N CYS A 87 0.049 4.376 -15.224 1.00 0.00 N ATOM 1315 CA CYS A 87 0.086 3.231 -14.261 1.00 0.00 C ATOM 1316 C CYS A 87 -0.602 3.539 -12.889 1.00 0.00 C ATOM 1317 O CYS A 87 0.046 3.972 -11.932 1.00 0.00 O ATOM 1318 CB CYS A 87 1.566 2.825 -14.089 1.00 0.00 C ATOM 1319 SG CYS A 87 2.363 2.496 -15.695 1.00 0.00 S ATOM 0 H CYS A 87 0.697 5.131 -15.000 1.00 0.00 H new ATOM 0 HA CYS A 87 -0.498 2.405 -14.668 1.00 0.00 H new ATOM 0 HB2 CYS A 87 2.104 3.619 -13.571 1.00 0.00 H new ATOM 0 HB3 CYS A 87 1.629 1.936 -13.462 1.00 0.00 H new ATOM 0 HG CYS A 87 2.065 3.447 -16.530 1.00 0.00 H new ATOM 1325 N ASN A 88 -1.919 3.307 -12.772 1.00 0.00 N ATOM 1326 CA ASN A 88 -2.732 3.788 -11.613 1.00 0.00 C ATOM 1327 C ASN A 88 -3.025 2.645 -10.592 1.00 0.00 C ATOM 1328 O ASN A 88 -3.698 1.665 -10.922 1.00 0.00 O ATOM 1329 CB ASN A 88 -4.080 4.370 -12.136 1.00 0.00 C ATOM 1330 CG ASN A 88 -4.009 5.589 -13.062 1.00 0.00 C ATOM 1331 OD1 ASN A 88 -3.894 5.470 -14.276 1.00 0.00 O ATOM 1332 ND2 ASN A 88 -4.107 6.789 -12.542 1.00 0.00 N ATOM 0 H ASN A 88 -2.458 2.787 -13.464 1.00 0.00 H new ATOM 0 HA ASN A 88 -2.157 4.557 -11.097 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -4.608 3.576 -12.664 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -4.689 4.638 -11.273 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.087 7.610 -13.147 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -4.203 6.901 -11.533 1.00 0.00 H new ATOM 1339 N PHE A 89 -2.575 2.784 -9.332 1.00 0.00 N ATOM 1340 CA PHE A 89 -2.941 1.829 -8.247 1.00 0.00 C ATOM 1341 C PHE A 89 -4.364 2.109 -7.648 1.00 0.00 C ATOM 1342 O PHE A 89 -4.687 3.242 -7.277 1.00 0.00 O ATOM 1343 CB PHE A 89 -1.815 1.840 -7.176 1.00 0.00 C ATOM 1344 CG PHE A 89 -1.970 0.759 -6.093 1.00 0.00 C ATOM 1345 CD1 PHE A 89 -1.671 -0.579 -6.377 1.00 0.00 C ATOM 1346 CD2 PHE A 89 -2.527 1.089 -4.852 1.00 0.00 C ATOM 1347 CE1 PHE A 89 -1.943 -1.572 -5.439 1.00 0.00 C ATOM 1348 CE2 PHE A 89 -2.801 0.094 -3.919 1.00 0.00 C ATOM 1349 CZ PHE A 89 -2.505 -1.233 -4.213 1.00 0.00 C ATOM 0 H PHE A 89 -1.960 3.541 -9.032 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.018 0.825 -8.664 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.854 1.707 -7.673 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.793 2.819 -6.697 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.228 -0.842 -7.326 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.745 2.120 -4.618 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.718 -2.604 -5.664 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.243 0.352 -2.968 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.713 -2.004 -3.486 1.00 0.00 H new ATOM 1359 N THR A 90 -5.180 1.049 -7.520 1.00 0.00 N ATOM 1360 CA THR A 90 -6.544 1.125 -6.919 1.00 0.00 C ATOM 1361 C THR A 90 -6.751 -0.034 -5.885 1.00 0.00 C ATOM 1362 O THR A 90 -7.097 -1.158 -6.260 1.00 0.00 O ATOM 1363 CB THR A 90 -7.633 1.223 -8.035 1.00 0.00 C ATOM 1364 OG1 THR A 90 -8.919 1.327 -7.438 1.00 0.00 O ATOM 1365 CG2 THR A 90 -7.715 0.082 -9.067 1.00 0.00 C ATOM 0 H THR A 90 -4.923 0.111 -7.827 1.00 0.00 H new ATOM 0 HA THR A 90 -6.651 2.044 -6.342 1.00 0.00 H new ATOM 0 HB THR A 90 -7.318 2.104 -8.595 1.00 0.00 H new ATOM 0 HG1 THR A 90 -9.601 1.390 -8.139 1.00 0.00 H new ATOM 0 HG21 THR A 90 -8.516 0.290 -9.776 1.00 0.00 H new ATOM 0 HG22 THR A 90 -6.768 0.006 -9.601 1.00 0.00 H new ATOM 0 HG23 THR A 90 -7.919 -0.858 -8.555 1.00 0.00 H new ATOM 1373 N ASP A 91 -6.557 0.255 -4.579 1.00 0.00 N ATOM 1374 CA ASP A 91 -6.855 -0.677 -3.441 1.00 0.00 C ATOM 1375 C ASP A 91 -5.928 -1.943 -3.333 1.00 0.00 C ATOM 1376 O ASP A 91 -5.051 -1.992 -2.465 1.00 0.00 O ATOM 1377 CB ASP A 91 -8.387 -0.913 -3.303 1.00 0.00 C ATOM 1378 CG ASP A 91 -8.818 -1.485 -1.956 1.00 0.00 C ATOM 1379 OD1 ASP A 91 -8.861 -0.723 -0.968 1.00 0.00 O ATOM 1380 OD2 ASP A 91 -9.109 -2.698 -1.884 1.00 0.00 O ATOM 0 H ASP A 91 -6.184 1.152 -4.269 1.00 0.00 H new ATOM 0 HA ASP A 91 -6.556 -0.166 -2.526 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -8.904 0.033 -3.464 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -8.710 -1.592 -4.092 1.00 0.00 H new ATOM 1385 N GLY A 92 -6.099 -2.934 -4.222 1.00 0.00 N ATOM 1386 CA GLY A 92 -5.122 -4.048 -4.405 1.00 0.00 C ATOM 1387 C GLY A 92 -4.772 -4.431 -5.866 1.00 0.00 C ATOM 1388 O GLY A 92 -4.549 -5.615 -6.141 1.00 0.00 O ATOM 0 H GLY A 92 -6.910 -2.997 -4.837 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.198 -3.779 -3.893 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -5.517 -4.933 -3.906 1.00 0.00 H new ATOM 1392 N ALA A 93 -4.707 -3.453 -6.791 1.00 0.00 N ATOM 1393 CA ALA A 93 -4.509 -3.710 -8.241 1.00 0.00 C ATOM 1394 C ALA A 93 -3.841 -2.512 -8.986 1.00 0.00 C ATOM 1395 O ALA A 93 -4.201 -1.350 -8.768 1.00 0.00 O ATOM 1396 CB ALA A 93 -5.879 -4.039 -8.872 1.00 0.00 C ATOM 0 H ALA A 93 -4.790 -2.463 -6.560 1.00 0.00 H new ATOM 0 HA ALA A 93 -3.824 -4.551 -8.345 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -5.752 -4.231 -9.938 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -6.298 -4.923 -8.392 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -6.556 -3.196 -8.733 1.00 0.00 H new ATOM 1402 N LEU A 94 -2.903 -2.801 -9.910 1.00 0.00 N ATOM 1403 CA LEU A 94 -2.299 -1.767 -10.803 1.00 0.00 C ATOM 1404 C LEU A 94 -2.998 -1.761 -12.198 1.00 0.00 C ATOM 1405 O LEU A 94 -2.884 -2.724 -12.962 1.00 0.00 O ATOM 1406 CB LEU A 94 -0.771 -2.039 -10.906 1.00 0.00 C ATOM 1407 CG LEU A 94 0.084 -1.014 -11.699 1.00 0.00 C ATOM 1408 CD1 LEU A 94 0.205 0.323 -10.951 1.00 0.00 C ATOM 1409 CD2 LEU A 94 1.490 -1.583 -11.960 1.00 0.00 C ATOM 0 H LEU A 94 -2.540 -3.742 -10.065 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.449 -0.772 -10.385 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.371 -2.101 -9.894 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.633 -3.019 -11.364 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.422 -0.831 -12.647 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.810 1.014 -11.537 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.788 0.747 -10.801 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.678 0.157 -9.983 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.080 -0.855 -12.517 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.979 -1.795 -11.009 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.409 -2.503 -12.539 1.00 0.00 H new ATOM 1421 N VAL A 95 -3.678 -0.657 -12.548 1.00 0.00 N ATOM 1422 CA VAL A 95 -4.300 -0.463 -13.892 1.00 0.00 C ATOM 1423 C VAL A 95 -3.227 0.173 -14.839 1.00 0.00 C ATOM 1424 O VAL A 95 -2.956 1.378 -14.804 1.00 0.00 O ATOM 1425 CB VAL A 95 -5.631 0.362 -13.783 1.00 0.00 C ATOM 1426 CG1 VAL A 95 -6.291 0.654 -15.154 1.00 0.00 C ATOM 1427 CG2 VAL A 95 -6.713 -0.324 -12.915 1.00 0.00 C ATOM 0 H VAL A 95 -3.819 0.132 -11.917 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.602 -1.416 -14.326 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.301 1.290 -13.315 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.206 1.227 -15.003 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.602 1.227 -15.775 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.530 -0.286 -15.650 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.605 0.302 -12.884 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.964 -1.293 -13.346 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.333 -0.464 -11.903 1.00 0.00 H new ATOM 1437 N GLN A 96 -2.637 -0.670 -15.695 1.00 0.00 N ATOM 1438 CA GLN A 96 -1.661 -0.260 -16.740 1.00 0.00 C ATOM 1439 C GLN A 96 -2.439 0.113 -18.046 1.00 0.00 C ATOM 1440 O GLN A 96 -2.798 -0.770 -18.833 1.00 0.00 O ATOM 1441 CB GLN A 96 -0.695 -1.482 -16.825 1.00 0.00 C ATOM 1442 CG GLN A 96 0.386 -1.513 -17.938 1.00 0.00 C ATOM 1443 CD GLN A 96 1.216 -2.812 -17.979 1.00 0.00 C ATOM 1444 OE1 GLN A 96 1.050 -3.753 -17.202 1.00 0.00 O ATOM 1445 NE2 GLN A 96 2.136 -2.937 -18.903 1.00 0.00 N ATOM 0 H GLN A 96 -2.820 -1.673 -15.690 1.00 0.00 H new ATOM 0 HA GLN A 96 -1.077 0.638 -16.536 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -0.182 -1.563 -15.867 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -1.307 -2.377 -16.936 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -0.100 -1.375 -18.904 1.00 0.00 H new ATOM 0 HG3 GLN A 96 1.061 -0.669 -17.797 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.301 -2.178 -19.564 1.00 0.00 H new ATOM 0 HE22 GLN A 96 2.687 -3.793 -18.961 1.00 0.00 H new ATOM 1454 N HIS A 97 -2.752 1.411 -18.250 1.00 0.00 N ATOM 1455 CA HIS A 97 -3.569 1.865 -19.414 1.00 0.00 C ATOM 1456 C HIS A 97 -2.684 2.355 -20.597 1.00 0.00 C ATOM 1457 O HIS A 97 -2.281 3.519 -20.639 1.00 0.00 O ATOM 1458 CB HIS A 97 -4.593 2.935 -18.947 1.00 0.00 C ATOM 1459 CG HIS A 97 -5.573 3.441 -20.019 1.00 0.00 C ATOM 1460 ND1 HIS A 97 -5.722 4.768 -20.403 1.00 0.00 N ATOM 1461 CD2 HIS A 97 -6.442 2.632 -20.771 1.00 0.00 C ATOM 1462 CE1 HIS A 97 -6.705 4.640 -21.354 1.00 0.00 C ATOM 1463 NE2 HIS A 97 -7.231 3.409 -21.588 1.00 0.00 N ATOM 0 H HIS A 97 -2.456 2.166 -17.631 1.00 0.00 H new ATOM 0 HA HIS A 97 -4.125 1.013 -19.804 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -5.171 2.521 -18.121 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -4.042 3.789 -18.554 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -6.485 1.554 -20.716 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -7.053 5.501 -21.905 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -7.999 3.136 -22.201 1.00 0.00 H new ATOM 1472 N GLN A 98 -2.472 1.468 -21.578 1.00 0.00 N ATOM 1473 CA GLN A 98 -1.771 1.786 -22.853 1.00 0.00 C ATOM 1474 C GLN A 98 -2.612 2.702 -23.803 1.00 0.00 C ATOM 1475 O GLN A 98 -3.811 2.468 -23.972 1.00 0.00 O ATOM 1476 CB GLN A 98 -1.491 0.436 -23.570 1.00 0.00 C ATOM 1477 CG GLN A 98 -0.535 -0.554 -22.859 1.00 0.00 C ATOM 1478 CD GLN A 98 -0.228 -1.801 -23.698 1.00 0.00 C ATOM 1479 OE1 GLN A 98 0.572 -1.796 -24.626 1.00 0.00 O ATOM 1480 NE2 GLN A 98 -0.879 -2.908 -23.436 1.00 0.00 N ATOM 0 H GLN A 98 -2.781 0.498 -21.519 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.858 2.334 -22.619 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -2.445 -0.068 -23.727 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -1.080 0.655 -24.555 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.398 -0.043 -22.624 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.978 -0.861 -21.912 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -1.550 -2.936 -22.668 1.00 0.00 H new ATOM 0 HE22 GLN A 98 -0.715 -3.742 -24.000 1.00 0.00 H new ATOM 1489 N GLU A 99 -1.979 3.708 -24.433 1.00 0.00 N ATOM 1490 CA GLU A 99 -2.664 4.663 -25.361 1.00 0.00 C ATOM 1491 C GLU A 99 -1.779 4.902 -26.629 1.00 0.00 C ATOM 1492 O GLU A 99 -0.626 5.333 -26.519 1.00 0.00 O ATOM 1493 CB GLU A 99 -2.947 5.991 -24.593 1.00 0.00 C ATOM 1494 CG GLU A 99 -4.188 5.937 -23.659 1.00 0.00 C ATOM 1495 CD GLU A 99 -4.238 7.019 -22.597 1.00 0.00 C ATOM 1496 OE1 GLU A 99 -4.380 8.209 -22.931 1.00 0.00 O ATOM 1497 OE2 GLU A 99 -4.093 6.701 -21.393 1.00 0.00 O ATOM 0 H GLU A 99 -0.982 3.892 -24.322 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.613 4.250 -25.701 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -2.070 6.247 -23.998 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -3.087 6.793 -25.317 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -5.088 6.007 -24.270 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -4.212 4.965 -23.167 1.00 0.00 H new ATOM 1504 N TRP A 100 -2.292 4.615 -27.842 1.00 0.00 N ATOM 1505 CA TRP A 100 -1.513 4.774 -29.109 1.00 0.00 C ATOM 1506 C TRP A 100 -2.465 4.904 -30.343 1.00 0.00 C ATOM 1507 O TRP A 100 -3.306 4.030 -30.574 1.00 0.00 O ATOM 1508 CB TRP A 100 -0.449 3.640 -29.284 1.00 0.00 C ATOM 1509 CG TRP A 100 -0.949 2.259 -29.733 1.00 0.00 C ATOM 1510 CD1 TRP A 100 -0.964 1.808 -31.070 1.00 0.00 C ATOM 1511 CD2 TRP A 100 -1.611 1.290 -29.002 1.00 0.00 C ATOM 1512 NE1 TRP A 100 -1.629 0.574 -31.195 1.00 0.00 N ATOM 1513 CE2 TRP A 100 -2.008 0.269 -29.898 1.00 0.00 C ATOM 1514 CE3 TRP A 100 -1.960 1.214 -27.626 1.00 0.00 C ATOM 1515 CZ2 TRP A 100 -2.740 -0.838 -29.427 1.00 0.00 C ATOM 1516 CZ3 TRP A 100 -2.694 0.113 -27.186 1.00 0.00 C ATOM 1517 CH2 TRP A 100 -3.081 -0.897 -28.072 1.00 0.00 C ATOM 0 H TRP A 100 -3.242 4.271 -27.982 1.00 0.00 H new ATOM 0 HA TRP A 100 -0.952 5.706 -29.042 1.00 0.00 H new ATOM 0 HB2 TRP A 100 0.290 3.982 -30.009 1.00 0.00 H new ATOM 0 HB3 TRP A 100 0.070 3.517 -28.333 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -0.520 2.344 -31.896 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -1.793 0.031 -32.043 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -1.663 1.991 -26.937 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -3.033 -1.629 -30.101 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -2.968 0.039 -26.144 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -3.653 -1.736 -27.704 1.00 0.00 H new ATOM 1528 N ASP A 101 -2.306 5.953 -31.174 1.00 0.00 N ATOM 1529 CA ASP A 101 -2.918 6.016 -32.548 1.00 0.00 C ATOM 1530 C ASP A 101 -4.480 5.790 -32.664 1.00 0.00 C ATOM 1531 O ASP A 101 -4.965 5.130 -33.590 1.00 0.00 O ATOM 1532 CB ASP A 101 -2.099 5.116 -33.525 1.00 0.00 C ATOM 1533 CG ASP A 101 -0.602 5.406 -33.654 1.00 0.00 C ATOM 1534 OD1 ASP A 101 -0.238 6.443 -34.247 1.00 0.00 O ATOM 1535 OD2 ASP A 101 0.210 4.596 -33.155 1.00 0.00 O ATOM 0 H ASP A 101 -1.759 6.779 -30.931 1.00 0.00 H new ATOM 0 HA ASP A 101 -2.841 7.063 -32.841 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -2.216 4.080 -33.208 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -2.546 5.199 -34.516 1.00 0.00 H new ATOM 1540 N GLY A 102 -5.276 6.299 -31.701 1.00 0.00 N ATOM 1541 CA GLY A 102 -6.706 5.887 -31.551 1.00 0.00 C ATOM 1542 C GLY A 102 -7.007 4.658 -30.653 1.00 0.00 C ATOM 1543 O GLY A 102 -7.975 4.678 -29.891 1.00 0.00 O ATOM 0 H GLY A 102 -4.966 6.990 -31.017 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -7.261 6.737 -31.155 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -7.103 5.682 -32.545 1.00 0.00 H new ATOM 1547 N LYS A 103 -6.214 3.583 -30.769 1.00 0.00 N ATOM 1548 CA LYS A 103 -6.337 2.365 -29.924 1.00 0.00 C ATOM 1549 C LYS A 103 -5.795 2.519 -28.460 1.00 0.00 C ATOM 1550 O LYS A 103 -4.912 3.327 -28.154 1.00 0.00 O ATOM 1551 CB LYS A 103 -5.591 1.229 -30.681 1.00 0.00 C ATOM 1552 CG LYS A 103 -6.365 0.624 -31.876 1.00 0.00 C ATOM 1553 CD LYS A 103 -5.482 -0.296 -32.743 1.00 0.00 C ATOM 1554 CE LYS A 103 -6.260 -1.110 -33.794 1.00 0.00 C ATOM 1555 NZ LYS A 103 -6.877 -2.343 -33.213 1.00 0.00 N ATOM 0 H LYS A 103 -5.461 3.524 -31.454 1.00 0.00 H new ATOM 0 HA LYS A 103 -7.396 2.147 -29.782 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -4.639 1.618 -31.043 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -5.362 0.431 -29.974 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -7.219 0.058 -31.503 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.762 1.430 -32.494 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -4.733 0.311 -33.252 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -4.945 -0.985 -32.091 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -7.041 -0.486 -34.229 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -5.587 -1.390 -34.605 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -7.473 -2.804 -33.930 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -6.127 -2.998 -32.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -7.461 -2.085 -32.392 1.00 0.00 H new ATOM 1569 N GLU A 104 -6.344 1.692 -27.553 1.00 0.00 N ATOM 1570 CA GLU A 104 -5.978 1.694 -26.110 1.00 0.00 C ATOM 1571 C GLU A 104 -6.172 0.286 -25.452 1.00 0.00 C ATOM 1572 O GLU A 104 -6.986 -0.524 -25.908 1.00 0.00 O ATOM 1573 CB GLU A 104 -6.730 2.812 -25.328 1.00 0.00 C ATOM 1574 CG GLU A 104 -8.283 2.765 -25.339 1.00 0.00 C ATOM 1575 CD GLU A 104 -8.915 3.574 -24.226 1.00 0.00 C ATOM 1576 OE1 GLU A 104 -8.964 4.816 -24.313 1.00 0.00 O ATOM 1577 OE2 GLU A 104 -9.279 2.964 -23.198 1.00 0.00 O ATOM 0 H GLU A 104 -7.055 1.000 -27.791 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.914 1.922 -26.051 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.398 2.780 -24.290 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -6.418 3.775 -25.732 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -8.644 3.136 -26.298 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -8.609 1.728 -25.255 1.00 0.00 H new ATOM 1584 N SER A 105 -5.433 -0.004 -24.360 1.00 0.00 N ATOM 1585 CA SER A 105 -5.584 -1.282 -23.603 1.00 0.00 C ATOM 1586 C SER A 105 -5.392 -1.103 -22.066 1.00 0.00 C ATOM 1587 O SER A 105 -4.324 -0.681 -21.615 1.00 0.00 O ATOM 1588 CB SER A 105 -4.619 -2.353 -24.182 1.00 0.00 C ATOM 1589 OG SER A 105 -4.836 -3.647 -23.609 1.00 0.00 O ATOM 0 H SER A 105 -4.725 0.623 -23.977 1.00 0.00 H new ATOM 0 HA SER A 105 -6.611 -1.624 -23.732 1.00 0.00 H new ATOM 0 HB2 SER A 105 -4.750 -2.410 -25.263 1.00 0.00 H new ATOM 0 HB3 SER A 105 -3.589 -2.046 -24.001 1.00 0.00 H new ATOM 0 HG SER A 105 -5.799 -3.811 -23.527 1.00 0.00 H new ATOM 1595 N THR A 106 -6.406 -1.467 -21.252 1.00 0.00 N ATOM 1596 CA THR A 106 -6.244 -1.588 -19.768 1.00 0.00 C ATOM 1597 C THR A 106 -5.723 -3.003 -19.369 1.00 0.00 C ATOM 1598 O THR A 106 -6.261 -4.034 -19.789 1.00 0.00 O ATOM 1599 CB THR A 106 -7.537 -1.270 -18.951 1.00 0.00 C ATOM 1600 OG1 THR A 106 -8.658 -2.011 -19.406 1.00 0.00 O ATOM 1601 CG2 THR A 106 -7.960 0.199 -18.938 1.00 0.00 C ATOM 0 H THR A 106 -7.345 -1.683 -21.585 1.00 0.00 H new ATOM 0 HA THR A 106 -5.508 -0.827 -19.509 1.00 0.00 H new ATOM 0 HB THR A 106 -7.247 -1.555 -17.939 1.00 0.00 H new ATOM 0 HG1 THR A 106 -9.443 -1.782 -18.866 1.00 0.00 H new ATOM 0 HG21 THR A 106 -8.867 0.311 -18.344 1.00 0.00 H new ATOM 0 HG22 THR A 106 -7.164 0.803 -18.502 1.00 0.00 H new ATOM 0 HG23 THR A 106 -8.151 0.532 -19.958 1.00 0.00 H new ATOM 1609 N ILE A 107 -4.683 -3.031 -18.519 1.00 0.00 N ATOM 1610 CA ILE A 107 -4.116 -4.295 -17.966 1.00 0.00 C ATOM 1611 C ILE A 107 -4.181 -4.166 -16.406 1.00 0.00 C ATOM 1612 O ILE A 107 -3.356 -3.485 -15.790 1.00 0.00 O ATOM 1613 CB ILE A 107 -2.709 -4.586 -18.609 1.00 0.00 C ATOM 1614 CG1 ILE A 107 -2.818 -4.822 -20.149 1.00 0.00 C ATOM 1615 CG2 ILE A 107 -1.992 -5.769 -17.917 1.00 0.00 C ATOM 1616 CD1 ILE A 107 -1.537 -5.208 -20.899 1.00 0.00 C ATOM 0 H ILE A 107 -4.207 -2.190 -18.191 1.00 0.00 H new ATOM 0 HA ILE A 107 -4.683 -5.189 -18.226 1.00 0.00 H new ATOM 0 HB ILE A 107 -2.100 -3.696 -18.451 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -3.556 -5.607 -20.318 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -3.211 -3.912 -20.602 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -1.025 -5.936 -18.391 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -1.844 -5.538 -16.862 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.601 -6.668 -18.009 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -1.761 -5.340 -21.958 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -0.794 -4.419 -20.781 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -1.144 -6.140 -20.492 1.00 0.00 H new ATOM 1628 N THR A 108 -5.181 -4.810 -15.776 1.00 0.00 N ATOM 1629 CA THR A 108 -5.444 -4.693 -14.310 1.00 0.00 C ATOM 1630 C THR A 108 -4.723 -5.846 -13.543 1.00 0.00 C ATOM 1631 O THR A 108 -5.117 -7.014 -13.616 1.00 0.00 O ATOM 1632 CB THR A 108 -6.984 -4.645 -14.074 1.00 0.00 C ATOM 1633 OG1 THR A 108 -7.551 -3.542 -14.776 1.00 0.00 O ATOM 1634 CG2 THR A 108 -7.403 -4.465 -12.607 1.00 0.00 C ATOM 0 H THR A 108 -5.834 -5.427 -16.258 1.00 0.00 H new ATOM 0 HA THR A 108 -5.031 -3.766 -13.911 1.00 0.00 H new ATOM 0 HB THR A 108 -7.341 -5.613 -14.424 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.519 -3.520 -14.624 1.00 0.00 H new ATOM 0 HG21 THR A 108 -8.491 -4.443 -12.539 1.00 0.00 H new ATOM 0 HG22 THR A 108 -7.019 -5.296 -12.015 1.00 0.00 H new ATOM 0 HG23 THR A 108 -6.997 -3.529 -12.225 1.00 0.00 H new ATOM 1642 N ARG A 109 -3.651 -5.505 -12.811 1.00 0.00 N ATOM 1643 CA ARG A 109 -2.743 -6.502 -12.178 1.00 0.00 C ATOM 1644 C ARG A 109 -3.126 -6.697 -10.675 1.00 0.00 C ATOM 1645 O ARG A 109 -2.600 -5.987 -9.811 1.00 0.00 O ATOM 1646 CB ARG A 109 -1.264 -6.030 -12.375 1.00 0.00 C ATOM 1647 CG ARG A 109 -0.803 -5.656 -13.815 1.00 0.00 C ATOM 1648 CD ARG A 109 0.709 -5.391 -13.979 1.00 0.00 C ATOM 1649 NE ARG A 109 1.456 -6.661 -14.217 1.00 0.00 N ATOM 1650 CZ ARG A 109 1.919 -7.092 -15.395 1.00 0.00 C ATOM 1651 NH1 ARG A 109 1.860 -6.407 -16.511 1.00 0.00 N ATOM 1652 NH2 ARG A 109 2.466 -8.273 -15.444 1.00 0.00 N ATOM 0 H ARG A 109 -3.381 -4.537 -12.636 1.00 0.00 H new ATOM 0 HA ARG A 109 -2.847 -7.478 -12.652 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -1.102 -5.162 -11.736 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -0.609 -6.821 -12.009 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -1.089 -6.462 -14.490 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -1.347 -4.766 -14.133 1.00 0.00 H new ATOM 0 HD2 ARG A 109 0.873 -4.708 -14.812 1.00 0.00 H new ATOM 0 HD3 ARG A 109 1.094 -4.901 -13.085 1.00 0.00 H new ATOM 0 HE ARG A 109 1.629 -7.255 -13.406 1.00 0.00 H new ATOM 0 HH11 ARG A 109 1.439 -5.478 -16.518 1.00 0.00 H new ATOM 0 HH12 ARG A 109 2.235 -6.803 -17.373 1.00 0.00 H new ATOM 0 HH21 ARG A 109 2.531 -8.840 -14.599 1.00 0.00 H new ATOM 0 HH22 ARG A 109 2.829 -8.631 -16.328 1.00 0.00 H new ATOM 1666 N LYS A 110 -4.061 -7.619 -10.360 1.00 0.00 N ATOM 1667 CA LYS A 110 -4.641 -7.757 -8.989 1.00 0.00 C ATOM 1668 C LYS A 110 -3.964 -8.873 -8.126 1.00 0.00 C ATOM 1669 O LYS A 110 -3.638 -9.958 -8.622 1.00 0.00 O ATOM 1670 CB LYS A 110 -6.188 -7.934 -9.072 1.00 0.00 C ATOM 1671 CG LYS A 110 -6.737 -9.181 -9.818 1.00 0.00 C ATOM 1672 CD LYS A 110 -7.852 -9.984 -9.105 1.00 0.00 C ATOM 1673 CE LYS A 110 -9.190 -9.271 -8.813 1.00 0.00 C ATOM 1674 NZ LYS A 110 -9.963 -9.032 -10.061 1.00 0.00 N ATOM 0 H LYS A 110 -4.437 -8.286 -11.034 1.00 0.00 H new ATOM 0 HA LYS A 110 -4.424 -6.829 -8.460 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -6.577 -7.955 -8.054 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -6.601 -7.047 -9.553 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -7.117 -8.857 -10.787 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -5.903 -9.856 -10.012 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -8.069 -10.864 -9.711 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -7.451 -10.341 -8.157 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -9.783 -9.875 -8.126 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -8.996 -8.320 -8.316 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -10.878 -8.598 -9.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -9.428 -8.394 -10.684 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -10.125 -9.937 -10.548 1.00 0.00 H new ATOM 1688 N LEU A 111 -3.798 -8.621 -6.814 1.00 0.00 N ATOM 1689 CA LEU A 111 -3.182 -9.602 -5.874 1.00 0.00 C ATOM 1690 C LEU A 111 -4.221 -10.622 -5.316 1.00 0.00 C ATOM 1691 O LEU A 111 -5.217 -10.230 -4.701 1.00 0.00 O ATOM 1692 CB LEU A 111 -2.447 -8.825 -4.740 1.00 0.00 C ATOM 1693 CG LEU A 111 -1.100 -9.404 -4.235 1.00 0.00 C ATOM 1694 CD1 LEU A 111 -1.231 -10.718 -3.447 1.00 0.00 C ATOM 1695 CD2 LEU A 111 -0.069 -9.559 -5.363 1.00 0.00 C ATOM 0 H LEU A 111 -4.080 -7.746 -6.371 1.00 0.00 H new ATOM 0 HA LEU A 111 -2.454 -10.203 -6.419 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.266 -7.809 -5.090 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.123 -8.753 -3.888 1.00 0.00 H new ATOM 0 HG LEU A 111 -0.737 -8.656 -3.531 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.243 -11.053 -3.131 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -1.856 -10.555 -2.569 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -1.687 -11.479 -4.081 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.856 -9.968 -4.957 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -0.461 -10.234 -6.124 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.130 -8.585 -5.810 1.00 0.00 H new ATOM 1707 N LYS A 112 -3.997 -11.929 -5.552 1.00 0.00 N ATOM 1708 CA LYS A 112 -4.990 -12.986 -5.215 1.00 0.00 C ATOM 1709 C LYS A 112 -4.322 -14.217 -4.507 1.00 0.00 C ATOM 1710 O LYS A 112 -3.608 -14.035 -3.515 1.00 0.00 O ATOM 1711 CB LYS A 112 -5.831 -13.197 -6.512 1.00 0.00 C ATOM 1712 CG LYS A 112 -7.228 -13.799 -6.267 1.00 0.00 C ATOM 1713 CD LYS A 112 -8.006 -13.970 -7.586 1.00 0.00 C ATOM 1714 CE LYS A 112 -9.337 -14.729 -7.456 1.00 0.00 C ATOM 1715 NZ LYS A 112 -9.123 -16.193 -7.248 1.00 0.00 N ATOM 0 H LYS A 112 -3.140 -12.285 -5.974 1.00 0.00 H new ATOM 0 HA LYS A 112 -5.702 -12.716 -4.435 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -5.944 -12.238 -7.018 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -5.279 -13.851 -7.187 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -7.128 -14.766 -5.774 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.791 -13.154 -5.592 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -8.206 -12.983 -8.004 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -7.372 -14.496 -8.300 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -9.907 -14.323 -6.620 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -9.934 -14.573 -8.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -10.006 -16.629 -6.915 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -8.837 -16.633 -8.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -8.377 -16.337 -6.538 1.00 0.00 H new ATOM 1729 N ASP A 113 -4.582 -15.464 -4.942 1.00 0.00 N ATOM 1730 CA ASP A 113 -4.337 -16.688 -4.108 1.00 0.00 C ATOM 1731 C ASP A 113 -2.848 -17.188 -4.153 1.00 0.00 C ATOM 1732 O ASP A 113 -2.513 -18.208 -4.766 1.00 0.00 O ATOM 1733 CB ASP A 113 -5.330 -17.804 -4.545 1.00 0.00 C ATOM 1734 CG ASP A 113 -6.821 -17.471 -4.503 1.00 0.00 C ATOM 1735 OD1 ASP A 113 -7.434 -17.550 -3.422 1.00 0.00 O ATOM 1736 OD2 ASP A 113 -7.385 -17.112 -5.561 1.00 0.00 O ATOM 0 H ASP A 113 -4.963 -15.666 -5.866 1.00 0.00 H new ATOM 0 HA ASP A 113 -4.513 -16.423 -3.066 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -5.079 -18.099 -5.564 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -5.161 -18.674 -3.910 1.00 0.00 H new ATOM 1741 N GLY A 114 -1.922 -16.398 -3.575 1.00 0.00 N ATOM 1742 CA GLY A 114 -0.475 -16.479 -3.964 1.00 0.00 C ATOM 1743 C GLY A 114 -0.079 -16.120 -5.435 1.00 0.00 C ATOM 1744 O GLY A 114 1.007 -16.482 -5.895 1.00 0.00 O ATOM 0 H GLY A 114 -2.129 -15.708 -2.853 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.085 -15.821 -3.299 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -0.135 -17.496 -3.767 1.00 0.00 H new ATOM 1748 N LYS A 115 -0.977 -15.438 -6.161 1.00 0.00 N ATOM 1749 CA LYS A 115 -0.942 -15.285 -7.635 1.00 0.00 C ATOM 1750 C LYS A 115 -1.302 -13.805 -7.979 1.00 0.00 C ATOM 1751 O LYS A 115 -2.325 -13.261 -7.544 1.00 0.00 O ATOM 1752 CB LYS A 115 -1.959 -16.278 -8.295 1.00 0.00 C ATOM 1753 CG LYS A 115 -1.405 -17.570 -8.948 1.00 0.00 C ATOM 1754 CD LYS A 115 -0.736 -18.598 -8.008 1.00 0.00 C ATOM 1755 CE LYS A 115 -0.551 -19.977 -8.685 1.00 0.00 C ATOM 1756 NZ LYS A 115 0.414 -20.834 -7.943 1.00 0.00 N ATOM 0 H LYS A 115 -1.772 -14.962 -5.734 1.00 0.00 H new ATOM 0 HA LYS A 115 0.050 -15.517 -8.023 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.679 -16.573 -7.531 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -2.511 -15.730 -9.058 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.226 -18.067 -9.465 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -0.678 -17.281 -9.707 1.00 0.00 H new ATOM 0 HD2 LYS A 115 0.235 -18.218 -7.690 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -1.342 -18.715 -7.110 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -1.514 -20.484 -8.746 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.200 -19.836 -9.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 1.110 -21.229 -8.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 0.906 -20.263 -7.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -0.098 -21.609 -7.476 1.00 0.00 H new ATOM 1770 N LEU A 116 -0.492 -13.185 -8.844 1.00 0.00 N ATOM 1771 CA LEU A 116 -0.854 -11.925 -9.537 1.00 0.00 C ATOM 1772 C LEU A 116 -1.743 -12.257 -10.780 1.00 0.00 C ATOM 1773 O LEU A 116 -1.280 -12.825 -11.778 1.00 0.00 O ATOM 1774 CB LEU A 116 0.478 -11.224 -9.902 1.00 0.00 C ATOM 1775 CG LEU A 116 0.364 -9.805 -10.512 1.00 0.00 C ATOM 1776 CD1 LEU A 116 0.127 -8.738 -9.427 1.00 0.00 C ATOM 1777 CD2 LEU A 116 1.646 -9.495 -11.300 1.00 0.00 C ATOM 0 H LEU A 116 0.434 -13.535 -9.089 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.445 -11.252 -8.915 1.00 0.00 H new ATOM 0 HB2 LEU A 116 1.089 -11.161 -9.001 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.015 -11.857 -10.608 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.497 -9.780 -11.180 1.00 0.00 H new ATOM 0 HD11 LEU A 116 0.052 -7.755 -9.893 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -0.799 -8.959 -8.896 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.959 -8.743 -8.723 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.575 -8.497 -11.733 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.505 -9.539 -10.630 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.770 -10.229 -12.097 1.00 0.00 H new ATOM 1789 N VAL A 117 -3.038 -11.923 -10.687 1.00 0.00 N ATOM 1790 CA VAL A 117 -4.043 -12.250 -11.740 1.00 0.00 C ATOM 1791 C VAL A 117 -4.192 -10.985 -12.642 1.00 0.00 C ATOM 1792 O VAL A 117 -4.686 -9.936 -12.215 1.00 0.00 O ATOM 1793 CB VAL A 117 -5.354 -12.785 -11.068 1.00 0.00 C ATOM 1794 CG1 VAL A 117 -6.546 -12.940 -12.038 1.00 0.00 C ATOM 1795 CG2 VAL A 117 -5.141 -14.161 -10.384 1.00 0.00 C ATOM 0 H VAL A 117 -3.429 -11.421 -9.889 1.00 0.00 H new ATOM 0 HA VAL A 117 -3.738 -13.064 -12.398 1.00 0.00 H new ATOM 0 HB VAL A 117 -5.595 -12.016 -10.334 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.412 -13.315 -11.493 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.785 -11.972 -12.478 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.283 -13.643 -12.828 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -6.076 -14.491 -9.932 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -4.819 -14.891 -11.127 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -4.378 -14.069 -9.611 1.00 0.00 H new ATOM 1805 N VAL A 118 -3.701 -11.088 -13.886 1.00 0.00 N ATOM 1806 CA VAL A 118 -3.521 -9.917 -14.787 1.00 0.00 C ATOM 1807 C VAL A 118 -4.680 -9.931 -15.837 1.00 0.00 C ATOM 1808 O VAL A 118 -4.669 -10.683 -16.819 1.00 0.00 O ATOM 1809 CB VAL A 118 -2.051 -9.922 -15.330 1.00 0.00 C ATOM 1810 CG1 VAL A 118 -1.790 -8.869 -16.422 1.00 0.00 C ATOM 1811 CG2 VAL A 118 -1.001 -9.679 -14.216 1.00 0.00 C ATOM 0 H VAL A 118 -3.416 -11.974 -14.303 1.00 0.00 H new ATOM 0 HA VAL A 118 -3.613 -8.952 -14.289 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.943 -10.921 -15.751 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.752 -8.933 -16.748 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.449 -9.053 -17.270 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -1.984 -7.874 -16.022 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -0.001 -9.693 -14.649 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -1.182 -8.710 -13.751 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.081 -10.463 -13.463 1.00 0.00 H new ATOM 1821 N GLU A 119 -5.688 -9.088 -15.574 1.00 0.00 N ATOM 1822 CA GLU A 119 -6.973 -9.052 -16.320 1.00 0.00 C ATOM 1823 C GLU A 119 -6.876 -7.955 -17.423 1.00 0.00 C ATOM 1824 O GLU A 119 -6.795 -6.755 -17.138 1.00 0.00 O ATOM 1825 CB GLU A 119 -8.104 -8.780 -15.288 1.00 0.00 C ATOM 1826 CG GLU A 119 -8.355 -9.921 -14.259 1.00 0.00 C ATOM 1827 CD GLU A 119 -9.101 -9.561 -12.985 1.00 0.00 C ATOM 1828 OE1 GLU A 119 -9.030 -8.404 -12.507 1.00 0.00 O ATOM 1829 OE2 GLU A 119 -9.711 -10.467 -12.375 1.00 0.00 O ATOM 0 H GLU A 119 -5.642 -8.396 -14.826 1.00 0.00 H new ATOM 0 HA GLU A 119 -7.193 -9.993 -16.824 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -7.863 -7.868 -14.742 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -9.031 -8.592 -15.830 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.910 -10.713 -14.762 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -7.389 -10.339 -13.977 1.00 0.00 H new ATOM 1836 N CYS A 120 -6.789 -8.384 -18.689 1.00 0.00 N ATOM 1837 CA CYS A 120 -6.247 -7.552 -19.791 1.00 0.00 C ATOM 1838 C CYS A 120 -7.230 -7.448 -20.994 1.00 0.00 C ATOM 1839 O CYS A 120 -7.744 -8.447 -21.505 1.00 0.00 O ATOM 1840 CB CYS A 120 -4.859 -8.131 -20.147 1.00 0.00 C ATOM 1841 SG CYS A 120 -4.849 -9.936 -20.198 1.00 0.00 S ATOM 0 H CYS A 120 -7.089 -9.313 -18.986 1.00 0.00 H new ATOM 0 HA CYS A 120 -6.129 -6.514 -19.480 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -4.545 -7.743 -21.116 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -4.128 -7.788 -19.415 1.00 0.00 H new ATOM 0 HG CYS A 120 -5.480 -10.344 -21.259 1.00 0.00 H new ATOM 1846 N VAL A 121 -7.493 -6.214 -21.444 1.00 0.00 N ATOM 1847 CA VAL A 121 -8.519 -5.921 -22.496 1.00 0.00 C ATOM 1848 C VAL A 121 -7.999 -4.802 -23.450 1.00 0.00 C ATOM 1849 O VAL A 121 -7.272 -3.894 -23.030 1.00 0.00 O ATOM 1850 CB VAL A 121 -9.925 -5.631 -21.862 1.00 0.00 C ATOM 1851 CG1 VAL A 121 -10.014 -4.347 -21.010 1.00 0.00 C ATOM 1852 CG2 VAL A 121 -11.072 -5.605 -22.901 1.00 0.00 C ATOM 0 H VAL A 121 -7.012 -5.383 -21.101 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.672 -6.805 -23.115 1.00 0.00 H new ATOM 0 HB VAL A 121 -10.050 -6.481 -21.192 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -11.026 -4.239 -20.619 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -9.309 -4.411 -20.181 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -9.770 -3.483 -21.628 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -12.016 -5.400 -22.396 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -10.878 -4.826 -23.638 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -11.131 -6.571 -23.402 1.00 0.00 H new ATOM 1862 N MET A 122 -8.365 -4.870 -24.741 1.00 0.00 N ATOM 1863 CA MET A 122 -8.024 -3.807 -25.728 1.00 0.00 C ATOM 1864 C MET A 122 -9.310 -3.148 -26.320 1.00 0.00 C ATOM 1865 O MET A 122 -9.828 -2.193 -25.735 1.00 0.00 O ATOM 1866 CB MET A 122 -6.947 -4.366 -26.699 1.00 0.00 C ATOM 1867 CG MET A 122 -6.428 -3.311 -27.683 1.00 0.00 C ATOM 1868 SD MET A 122 -5.223 -4.034 -28.794 1.00 0.00 S ATOM 1869 CE MET A 122 -5.507 -2.888 -30.142 1.00 0.00 C ATOM 0 H MET A 122 -8.897 -5.646 -25.135 1.00 0.00 H new ATOM 0 HA MET A 122 -7.545 -2.940 -25.273 1.00 0.00 H new ATOM 0 HB2 MET A 122 -6.111 -4.758 -26.120 1.00 0.00 H new ATOM 0 HB3 MET A 122 -7.367 -5.202 -27.258 1.00 0.00 H new ATOM 0 HG2 MET A 122 -7.259 -2.898 -28.256 1.00 0.00 H new ATOM 0 HG3 MET A 122 -5.977 -2.484 -27.135 1.00 0.00 H new ATOM 0 HE1 MET A 122 -4.649 -2.897 -30.814 1.00 0.00 H new ATOM 0 HE2 MET A 122 -6.400 -3.186 -30.691 1.00 0.00 H new ATOM 0 HE3 MET A 122 -5.645 -1.883 -29.742 1.00 0.00 H new ATOM 1879 N ASN A 123 -9.804 -3.620 -27.473 1.00 0.00 N ATOM 1880 CA ASN A 123 -11.006 -3.053 -28.155 1.00 0.00 C ATOM 1881 C ASN A 123 -12.256 -3.982 -27.999 1.00 0.00 C ATOM 1882 O ASN A 123 -13.324 -3.530 -27.581 1.00 0.00 O ATOM 1883 CB ASN A 123 -10.668 -2.742 -29.651 1.00 0.00 C ATOM 1884 CG ASN A 123 -9.509 -1.792 -30.014 1.00 0.00 C ATOM 1885 OD1 ASN A 123 -8.775 -2.003 -30.980 1.00 0.00 O ATOM 1886 ND2 ASN A 123 -9.315 -0.704 -29.305 1.00 0.00 N ATOM 0 H ASN A 123 -9.390 -4.408 -27.971 1.00 0.00 H new ATOM 0 HA ASN A 123 -11.275 -2.114 -27.670 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -10.466 -3.695 -30.139 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -11.571 -2.335 -30.106 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -8.569 -0.056 -29.559 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -9.910 -0.507 -28.500 1.00 0.00 H new ATOM 1893 N ASN A 124 -12.103 -5.267 -28.343 1.00 0.00 N ATOM 1894 CA ASN A 124 -13.139 -6.330 -28.202 1.00 0.00 C ATOM 1895 C ASN A 124 -12.673 -7.488 -27.249 1.00 0.00 C ATOM 1896 O ASN A 124 -13.497 -8.045 -26.519 1.00 0.00 O ATOM 1897 CB ASN A 124 -13.493 -6.945 -29.592 1.00 0.00 C ATOM 1898 CG ASN A 124 -13.841 -5.990 -30.741 1.00 0.00 C ATOM 1899 OD1 ASN A 124 -14.979 -5.577 -30.932 1.00 0.00 O ATOM 1900 ND2 ASN A 124 -12.865 -5.627 -31.540 1.00 0.00 N ATOM 0 H ASN A 124 -11.232 -5.619 -28.741 1.00 0.00 H new ATOM 0 HA ASN A 124 -14.016 -5.850 -27.768 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -12.648 -7.555 -29.911 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -14.338 -7.619 -29.452 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -13.053 -5.000 -32.322 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -11.919 -5.972 -31.379 1.00 0.00 H new ATOM 1907 N VAL A 125 -11.388 -7.906 -27.304 1.00 0.00 N ATOM 1908 CA VAL A 125 -10.910 -9.185 -26.719 1.00 0.00 C ATOM 1909 C VAL A 125 -10.521 -8.985 -25.219 1.00 0.00 C ATOM 1910 O VAL A 125 -9.601 -8.226 -24.892 1.00 0.00 O ATOM 1911 CB VAL A 125 -9.716 -9.742 -27.574 1.00 0.00 C ATOM 1912 CG1 VAL A 125 -9.128 -11.048 -26.993 1.00 0.00 C ATOM 1913 CG2 VAL A 125 -10.064 -10.031 -29.056 1.00 0.00 C ATOM 0 H VAL A 125 -10.650 -7.366 -27.756 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.711 -9.924 -26.744 1.00 0.00 H new ATOM 0 HB VAL A 125 -8.991 -8.930 -27.531 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -8.306 -11.389 -27.623 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -8.759 -10.864 -25.984 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -9.903 -11.814 -26.962 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -9.181 -10.412 -29.569 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -10.861 -10.773 -29.105 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -10.395 -9.111 -29.538 1.00 0.00 H new ATOM 1923 N THR A 126 -11.171 -9.752 -24.327 1.00 0.00 N ATOM 1924 CA THR A 126 -10.713 -9.910 -22.917 1.00 0.00 C ATOM 1925 C THR A 126 -9.797 -11.169 -22.785 1.00 0.00 C ATOM 1926 O THR A 126 -10.263 -12.314 -22.728 1.00 0.00 O ATOM 1927 CB THR A 126 -11.887 -9.943 -21.892 1.00 0.00 C ATOM 1928 OG1 THR A 126 -12.842 -10.952 -22.200 1.00 0.00 O ATOM 1929 CG2 THR A 126 -12.650 -8.617 -21.768 1.00 0.00 C ATOM 0 H THR A 126 -12.017 -10.277 -24.548 1.00 0.00 H new ATOM 0 HA THR A 126 -10.130 -9.024 -22.667 1.00 0.00 H new ATOM 0 HB THR A 126 -11.391 -10.153 -20.944 1.00 0.00 H new ATOM 0 HG1 THR A 126 -12.377 -11.785 -22.424 1.00 0.00 H new ATOM 0 HG21 THR A 126 -13.450 -8.725 -21.035 1.00 0.00 H new ATOM 0 HG22 THR A 126 -11.966 -7.832 -21.445 1.00 0.00 H new ATOM 0 HG23 THR A 126 -13.077 -8.351 -22.735 1.00 0.00 H new ATOM 1937 N CYS A 127 -8.480 -10.934 -22.692 1.00 0.00 N ATOM 1938 CA CYS A 127 -7.510 -11.950 -22.216 1.00 0.00 C ATOM 1939 C CYS A 127 -7.395 -11.948 -20.650 1.00 0.00 C ATOM 1940 O CYS A 127 -7.799 -11.008 -19.952 1.00 0.00 O ATOM 1941 CB CYS A 127 -6.174 -11.709 -22.948 1.00 0.00 C ATOM 1942 SG CYS A 127 -5.585 -10.022 -22.762 1.00 0.00 S ATOM 0 H CYS A 127 -8.052 -10.042 -22.941 1.00 0.00 H new ATOM 0 HA CYS A 127 -7.851 -12.957 -22.457 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -5.422 -12.398 -22.562 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -6.298 -11.933 -24.008 1.00 0.00 H new ATOM 0 HG CYS A 127 -4.834 -9.939 -21.704 1.00 0.00 H new ATOM 1947 N THR A 128 -6.879 -13.032 -20.054 1.00 0.00 N ATOM 1948 CA THR A 128 -6.641 -13.095 -18.576 1.00 0.00 C ATOM 1949 C THR A 128 -5.438 -14.043 -18.323 1.00 0.00 C ATOM 1950 O THR A 128 -5.464 -15.220 -18.700 1.00 0.00 O ATOM 1951 CB THR A 128 -7.928 -13.471 -17.779 1.00 0.00 C ATOM 1952 OG1 THR A 128 -8.986 -12.573 -18.109 1.00 0.00 O ATOM 1953 CG2 THR A 128 -7.761 -13.394 -16.252 1.00 0.00 C ATOM 0 H THR A 128 -6.615 -13.880 -20.555 1.00 0.00 H new ATOM 0 HA THR A 128 -6.386 -12.106 -18.194 1.00 0.00 H new ATOM 0 HB THR A 128 -8.143 -14.502 -18.060 1.00 0.00 H new ATOM 0 HG1 THR A 128 -8.612 -11.759 -18.506 1.00 0.00 H new ATOM 0 HG21 THR A 128 -8.699 -13.670 -15.769 1.00 0.00 H new ATOM 0 HG22 THR A 128 -6.975 -14.080 -15.937 1.00 0.00 H new ATOM 0 HG23 THR A 128 -7.491 -12.377 -15.966 1.00 0.00 H new ATOM 1961 N ARG A 129 -4.365 -13.503 -17.723 1.00 0.00 N ATOM 1962 CA ARG A 129 -3.056 -14.202 -17.626 1.00 0.00 C ATOM 1963 C ARG A 129 -2.553 -14.288 -16.148 1.00 0.00 C ATOM 1964 O ARG A 129 -2.596 -13.315 -15.387 1.00 0.00 O ATOM 1965 CB ARG A 129 -2.086 -13.570 -18.666 1.00 0.00 C ATOM 1966 CG ARG A 129 -1.548 -12.157 -18.341 1.00 0.00 C ATOM 1967 CD ARG A 129 -0.691 -11.494 -19.435 1.00 0.00 C ATOM 1968 NE ARG A 129 -1.578 -10.879 -20.464 1.00 0.00 N ATOM 1969 CZ ARG A 129 -1.254 -9.864 -21.264 1.00 0.00 C ATOM 1970 NH1 ARG A 129 -0.061 -9.326 -21.311 1.00 0.00 N ATOM 1971 NH2 ARG A 129 -2.171 -9.386 -22.049 1.00 0.00 N ATOM 0 H ARG A 129 -4.371 -12.578 -17.292 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.139 -15.254 -17.897 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -1.234 -14.239 -18.788 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -2.598 -13.527 -19.627 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -2.396 -11.507 -18.128 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -0.955 -12.217 -17.429 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -0.047 -10.733 -18.995 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -0.039 -12.234 -19.898 1.00 0.00 H new ATOM 0 HE ARG A 129 -2.515 -11.270 -20.564 1.00 0.00 H new ATOM 0 HH11 ARG A 129 0.684 -9.683 -20.712 1.00 0.00 H new ATOM 0 HH12 ARG A 129 0.124 -8.550 -21.946 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -3.109 -9.787 -22.042 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -1.954 -8.609 -22.673 1.00 0.00 H new ATOM 1985 N ILE A 130 -2.121 -15.484 -15.729 1.00 0.00 N ATOM 1986 CA ILE A 130 -1.973 -15.842 -14.287 1.00 0.00 C ATOM 1987 C ILE A 130 -0.448 -15.993 -13.982 1.00 0.00 C ATOM 1988 O ILE A 130 0.213 -16.874 -14.541 1.00 0.00 O ATOM 1989 CB ILE A 130 -2.802 -17.139 -13.954 1.00 0.00 C ATOM 1990 CG1 ILE A 130 -4.290 -17.172 -14.432 1.00 0.00 C ATOM 1991 CG2 ILE A 130 -2.736 -17.519 -12.453 1.00 0.00 C ATOM 1992 CD1 ILE A 130 -5.220 -16.055 -13.927 1.00 0.00 C ATOM 0 H ILE A 130 -1.862 -16.237 -16.366 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.376 -15.060 -13.644 1.00 0.00 H new ATOM 0 HB ILE A 130 -2.289 -17.886 -14.559 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.295 -17.147 -15.522 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -4.719 -18.128 -14.133 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.325 -18.420 -12.280 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.700 -17.702 -12.169 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -3.137 -16.702 -11.853 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -6.220 -16.201 -14.336 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -5.265 -16.084 -12.838 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -4.835 -15.087 -14.249 1.00 0.00 H new ATOM 2004 N TYR A 131 0.102 -15.151 -13.089 1.00 0.00 N ATOM 2005 CA TYR A 131 1.551 -15.173 -12.736 1.00 0.00 C ATOM 2006 C TYR A 131 1.762 -15.537 -11.222 1.00 0.00 C ATOM 2007 O TYR A 131 1.149 -14.915 -10.351 1.00 0.00 O ATOM 2008 CB TYR A 131 2.159 -13.774 -13.037 1.00 0.00 C ATOM 2009 CG TYR A 131 2.238 -13.219 -14.473 1.00 0.00 C ATOM 2010 CD1 TYR A 131 1.218 -12.399 -14.959 1.00 0.00 C ATOM 2011 CD2 TYR A 131 3.428 -13.329 -15.203 1.00 0.00 C ATOM 2012 CE1 TYR A 131 1.402 -11.664 -16.130 1.00 0.00 C ATOM 2013 CE2 TYR A 131 3.607 -12.601 -16.377 1.00 0.00 C ATOM 2014 CZ TYR A 131 2.598 -11.763 -16.835 1.00 0.00 C ATOM 2015 OH TYR A 131 2.788 -11.002 -17.958 1.00 0.00 O ATOM 0 H TYR A 131 -0.431 -14.439 -12.590 1.00 0.00 H new ATOM 0 HA TYR A 131 2.050 -15.937 -13.332 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.594 -13.051 -12.449 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.176 -13.780 -12.644 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.281 -12.333 -14.425 1.00 0.00 H new ATOM 0 HD2 TYR A 131 4.213 -13.983 -14.853 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.616 -11.017 -16.490 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.530 -12.688 -16.931 1.00 0.00 H new ATOM 0 HH TYR A 131 3.674 -11.187 -18.333 1.00 0.00 H new ATOM 2025 N GLU A 132 2.630 -16.510 -10.877 1.00 0.00 N ATOM 2026 CA GLU A 132 2.775 -17.018 -9.474 1.00 0.00 C ATOM 2027 C GLU A 132 4.069 -16.579 -8.720 1.00 0.00 C ATOM 2028 O GLU A 132 5.137 -16.465 -9.326 1.00 0.00 O ATOM 2029 CB GLU A 132 2.606 -18.555 -9.489 1.00 0.00 C ATOM 2030 CG GLU A 132 3.738 -19.438 -10.072 1.00 0.00 C ATOM 2031 CD GLU A 132 3.516 -20.938 -9.963 1.00 0.00 C ATOM 2032 OE1 GLU A 132 2.593 -21.403 -9.257 1.00 0.00 O ATOM 2033 OE2 GLU A 132 4.296 -21.669 -10.604 1.00 0.00 O ATOM 0 H GLU A 132 3.249 -16.969 -11.545 1.00 0.00 H new ATOM 0 HA GLU A 132 1.986 -16.545 -8.889 1.00 0.00 H new ATOM 0 HB2 GLU A 132 2.437 -18.876 -8.461 1.00 0.00 H new ATOM 0 HB3 GLU A 132 1.696 -18.779 -10.046 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.870 -19.183 -11.123 1.00 0.00 H new ATOM 0 HG3 GLU A 132 4.669 -19.188 -9.564 1.00 0.00 H new ATOM 2040 N LYS A 133 4.001 -16.383 -7.384 1.00 0.00 N ATOM 2041 CA LYS A 133 5.175 -15.921 -6.585 1.00 0.00 C ATOM 2042 C LYS A 133 6.279 -17.025 -6.417 1.00 0.00 C ATOM 2043 O LYS A 133 6.111 -17.976 -5.648 1.00 0.00 O ATOM 2044 CB LYS A 133 4.687 -15.368 -5.213 1.00 0.00 C ATOM 2045 CG LYS A 133 5.661 -14.330 -4.603 1.00 0.00 C ATOM 2046 CD LYS A 133 5.330 -13.870 -3.157 1.00 0.00 C ATOM 2047 CE LYS A 133 5.090 -12.354 -2.972 1.00 0.00 C ATOM 2048 NZ LYS A 133 6.349 -11.577 -3.156 1.00 0.00 N ATOM 0 H LYS A 133 3.156 -16.534 -6.833 1.00 0.00 H new ATOM 0 HA LYS A 133 5.660 -15.117 -7.139 1.00 0.00 H new ATOM 0 HB2 LYS A 133 3.707 -14.909 -5.340 1.00 0.00 H new ATOM 0 HB3 LYS A 133 4.563 -16.197 -4.516 1.00 0.00 H new ATOM 0 HG2 LYS A 133 6.666 -14.753 -4.610 1.00 0.00 H new ATOM 0 HG3 LYS A 133 5.680 -13.452 -5.249 1.00 0.00 H new ATOM 0 HD2 LYS A 133 4.441 -14.403 -2.821 1.00 0.00 H new ATOM 0 HD3 LYS A 133 6.149 -14.172 -2.504 1.00 0.00 H new ATOM 0 HE2 LYS A 133 4.342 -12.013 -3.688 1.00 0.00 H new ATOM 0 HE3 LYS A 133 4.687 -12.167 -1.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 6.130 -10.561 -3.177 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 6.997 -11.775 -2.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 6.799 -11.853 -4.052 1.00 0.00 H new ATOM 2062 N VAL A 134 7.407 -16.883 -7.135 1.00 0.00 N ATOM 2063 CA VAL A 134 8.555 -17.847 -7.060 1.00 0.00 C ATOM 2064 C VAL A 134 9.647 -17.229 -6.126 1.00 0.00 C ATOM 2065 O VAL A 134 10.568 -16.542 -6.581 1.00 0.00 O ATOM 2066 CB VAL A 134 9.072 -18.224 -8.493 1.00 0.00 C ATOM 2067 CG1 VAL A 134 10.266 -19.209 -8.490 1.00 0.00 C ATOM 2068 CG2 VAL A 134 7.989 -18.845 -9.403 1.00 0.00 C ATOM 0 H VAL A 134 7.563 -16.110 -7.782 1.00 0.00 H new ATOM 0 HA VAL A 134 8.242 -18.796 -6.624 1.00 0.00 H new ATOM 0 HB VAL A 134 9.386 -17.258 -8.888 1.00 0.00 H new ATOM 0 HG11 VAL A 134 10.566 -19.421 -9.516 1.00 0.00 H new ATOM 0 HG12 VAL A 134 11.103 -18.764 -7.952 1.00 0.00 H new ATOM 0 HG13 VAL A 134 9.971 -20.137 -7.999 1.00 0.00 H new ATOM 0 HG21 VAL A 134 8.421 -19.079 -10.376 1.00 0.00 H new ATOM 0 HG22 VAL A 134 7.609 -19.759 -8.946 1.00 0.00 H new ATOM 0 HG23 VAL A 134 7.171 -18.136 -9.531 1.00 0.00 H new ATOM 2078 N GLU A 135 9.497 -17.453 -4.812 1.00 0.00 N ATOM 2079 CA GLU A 135 10.322 -16.800 -3.761 1.00 0.00 C ATOM 2080 C GLU A 135 10.472 -17.784 -2.575 1.00 0.00 C ATOM 2081 O GLU A 135 9.456 -18.174 -1.947 1.00 0.00 O ATOM 2082 CB GLU A 135 9.692 -15.458 -3.300 1.00 0.00 C ATOM 2083 CG GLU A 135 9.769 -14.291 -4.316 1.00 0.00 C ATOM 2084 CD GLU A 135 8.944 -13.067 -3.956 1.00 0.00 C ATOM 2085 OE1 GLU A 135 9.000 -12.562 -2.816 1.00 0.00 O ATOM 2086 OE2 GLU A 135 8.176 -12.607 -4.825 1.00 0.00 O ATOM 2087 OXT GLU A 135 11.623 -18.163 -2.258 1.00 0.00 O ATOM 0 H GLU A 135 8.798 -18.095 -4.437 1.00 0.00 H new ATOM 0 HA GLU A 135 11.305 -16.561 -4.166 1.00 0.00 H new ATOM 0 HB2 GLU A 135 8.644 -15.635 -3.058 1.00 0.00 H new ATOM 0 HB3 GLU A 135 10.184 -15.145 -2.379 1.00 0.00 H new ATOM 0 HG2 GLU A 135 10.811 -13.989 -4.421 1.00 0.00 H new ATOM 0 HG3 GLU A 135 9.443 -14.656 -5.290 1.00 0.00 H new