USER MOD reduce.3.24.130724 H: found=0, std=0, add=1046, rem=0, adj=44 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 101:sc= -4.88! USER MOD Set 1.2: A 127 CYS SG : rot 43:sc= -8.69! USER MOD Set 2.1: A 67 CYS SG : rot -49:sc= 0.00912 USER MOD Set 2.2: A 87 CYS SG : rot 179:sc= 0.0142 USER MOD Set 3.1: A 83 THR OG1 : rot 81:sc= 1.15 USER MOD Set 3.2: A 85 THR OG1 : rot -140:sc= 2.07 USER MOD Set 4.1: A 55 LYS NZ :NH3+ 170:sc= 2.34 (180deg=0.854) USER MOD Set 4.2: A 64 GLN : amide:sc= 0.957 K(o=3.3,f=-5.9) USER MOD Set 5.1: A 43 CYS SG : rot 180:sc= 0.29 USER MOD Set 5.2: A 56 THR OG1 : rot -50:sc= 1.04 USER MOD Set 6.1: A 22 TYR OH : rot -25:sc= 1.11 USER MOD Set 6.2: A 105 SER OG : rot 10:sc= 2.26 USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 16 SER OG : rot 37:sc= 0.852 USER MOD Single : A 17 LYS NZ :NH3+ -163:sc= 1.11 (180deg=0.717) USER MOD Single : A 23 MET CE :methyl 180:sc= -0.0354 (180deg=-0.0354) USER MOD Single : A 24 LYS NZ :NH3+ -176:sc= 1.01 (180deg=0.815) USER MOD Single : A 34 LYS NZ :NH3+ -152:sc= 1.24 (180deg=1.16) USER MOD Single : A 35 MET CE :methyl -171:sc= 0 (180deg=-0.0702) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot -55:sc= 0.91 USER MOD Single : A 47 CYS SG : rot 18:sc= -0.0194 USER MOD Single : A 50 LYS NZ :NH3+ -156:sc= 2.32 (180deg=2.15) USER MOD Single : A 51 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ -151:sc= 1.24 (180deg=1.13) USER MOD Single : A 62 THR OG1 : rot 49:sc= 1.54 USER MOD Single : A 63 THR OG1 : rot 45:sc= 0.596 USER MOD Single : A 66 SER OG : rot 33:sc= 0.762 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 138:sc= 1.23 (180deg=0.103!) USER MOD Single : A 76 THR OG1 : rot 180:sc= -0.0173 USER MOD Single : A 77 THR OG1 : rot 153:sc= 0.812 USER MOD Single : A 82 LYS NZ :NH3+ -163:sc= 1.14 (180deg=0.7) USER MOD Single : A 84 GLN : amide:sc=-0.00341 X(o=-0.0034,f=-0.32) USER MOD Single : A 88 ASN : amide:sc= -0.0188 X(o=-0.019,f=-0.31) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 GLN : amide:sc= 1.04 K(o=1,f=-6.2!) USER MOD Single : A 97 HIS : no HE2:sc= -0.02 K(o=1.7,f=-7.7!) USER MOD Single : A 98 GLN : amide:sc= 1.27 K(o=1.3,f=-6.9!) USER MOD Single : A 103 LYS NZ :NH3+ 139:sc= 1.24 (180deg=0.938) 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+ -172:sc= 0 (180deg=-0.0229) USER MOD Single : A 112 LYS NZ :NH3+ -111:sc= 0 (180deg=-0.149) USER MOD Single : A 115 LYS NZ :NH3+ -147:sc= 1.88 (180deg=0.651) USER MOD Single : A 122 MET CE :methyl -135:sc= 0 (180deg=-0.145) USER MOD Single : A 123 ASN : amide:sc= 0.129 X(o=0.13,f=0) USER MOD Single : A 124 ASN : amide:sc= 0.86 K(o=0.86,f=0) USER MOD Single : A 126 THR OG1 : rot 35:sc= 0.0705 USER MOD Single : A 128 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 171:sc= 2.22 (180deg=1.79) USER MOD ----------------------------------------------------------------- ATOM 14 N VAL A 4 0.252 -2.186 -2.602 1.00 0.00 N ATOM 15 CA VAL A 4 1.344 -2.367 -3.621 1.00 0.00 C ATOM 16 C VAL A 4 2.619 -3.137 -3.101 1.00 0.00 C ATOM 17 O VAL A 4 3.295 -3.797 -3.891 1.00 0.00 O ATOM 18 CB VAL A 4 1.646 -1.014 -4.354 1.00 0.00 C ATOM 19 CG1 VAL A 4 2.437 0.023 -3.522 1.00 0.00 C ATOM 20 CG2 VAL A 4 2.357 -1.223 -5.711 1.00 0.00 C ATOM 0 HA VAL A 4 0.961 -3.057 -4.373 1.00 0.00 H new ATOM 0 HB VAL A 4 0.653 -0.596 -4.517 1.00 0.00 H new ATOM 0 HG11 VAL A 4 2.595 0.923 -4.117 1.00 0.00 H new ATOM 0 HG12 VAL A 4 1.873 0.276 -2.624 1.00 0.00 H new ATOM 0 HG13 VAL A 4 3.402 -0.398 -3.238 1.00 0.00 H new ATOM 0 HG21 VAL A 4 2.543 -0.255 -6.177 1.00 0.00 H new ATOM 0 HG22 VAL A 4 3.305 -1.736 -5.550 1.00 0.00 H new ATOM 0 HG23 VAL A 4 1.725 -1.825 -6.364 1.00 0.00 H new ATOM 30 N GLN A 5 2.870 -3.133 -1.774 1.00 0.00 N ATOM 31 CA GLN A 5 3.742 -4.137 -1.095 1.00 0.00 C ATOM 32 C GLN A 5 3.338 -5.648 -1.292 1.00 0.00 C ATOM 33 O GLN A 5 4.219 -6.489 -1.476 1.00 0.00 O ATOM 34 CB GLN A 5 3.806 -3.708 0.398 1.00 0.00 C ATOM 35 CG GLN A 5 4.857 -4.458 1.260 1.00 0.00 C ATOM 36 CD GLN A 5 4.929 -4.008 2.723 1.00 0.00 C ATOM 37 OE1 GLN A 5 5.850 -3.323 3.155 1.00 0.00 O ATOM 38 NE2 GLN A 5 3.974 -4.386 3.539 1.00 0.00 N ATOM 0 H GLN A 5 2.479 -2.439 -1.138 1.00 0.00 H new ATOM 0 HA GLN A 5 4.726 -4.125 -1.564 1.00 0.00 H new ATOM 0 HB2 GLN A 5 4.019 -2.640 0.443 1.00 0.00 H new ATOM 0 HB3 GLN A 5 2.822 -3.856 0.844 1.00 0.00 H new ATOM 0 HG2 GLN A 5 4.633 -5.524 1.233 1.00 0.00 H new ATOM 0 HG3 GLN A 5 5.839 -4.327 0.806 1.00 0.00 H new ATOM 0 HE21 GLN A 5 3.203 -4.956 3.192 1.00 0.00 H new ATOM 0 HE22 GLN A 5 4.003 -4.110 4.521 1.00 0.00 H new ATOM 47 N GLN A 6 2.035 -5.994 -1.284 1.00 0.00 N ATOM 48 CA GLN A 6 1.540 -7.340 -1.686 1.00 0.00 C ATOM 49 C GLN A 6 1.620 -7.677 -3.224 1.00 0.00 C ATOM 50 O GLN A 6 1.830 -8.845 -3.565 1.00 0.00 O ATOM 51 CB GLN A 6 0.107 -7.450 -1.099 1.00 0.00 C ATOM 52 CG GLN A 6 -0.427 -8.898 -1.016 1.00 0.00 C ATOM 53 CD GLN A 6 -1.867 -9.035 -0.513 1.00 0.00 C ATOM 54 OE1 GLN A 6 -2.124 -9.477 0.600 1.00 0.00 O ATOM 55 NE2 GLN A 6 -2.852 -8.679 -1.304 1.00 0.00 N ATOM 0 H GLN A 6 1.292 -5.355 -1.001 1.00 0.00 H new ATOM 0 HA GLN A 6 2.205 -8.103 -1.282 1.00 0.00 H new ATOM 0 HB2 GLN A 6 0.100 -7.013 -0.101 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -0.572 -6.857 -1.712 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -0.360 -9.350 -2.006 1.00 0.00 H new ATOM 0 HG3 GLN A 6 0.226 -9.472 -0.359 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -2.652 -8.309 -2.233 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -3.818 -8.772 -0.989 1.00 0.00 H new ATOM 64 N LEU A 7 1.509 -6.693 -4.147 1.00 0.00 N ATOM 65 CA LEU A 7 1.969 -6.869 -5.564 1.00 0.00 C ATOM 66 C LEU A 7 3.528 -6.981 -5.802 1.00 0.00 C ATOM 67 O LEU A 7 3.941 -7.265 -6.930 1.00 0.00 O ATOM 68 CB LEU A 7 1.451 -5.722 -6.488 1.00 0.00 C ATOM 69 CG LEU A 7 -0.043 -5.307 -6.541 1.00 0.00 C ATOM 70 CD1 LEU A 7 -0.265 -4.420 -7.781 1.00 0.00 C ATOM 71 CD2 LEU A 7 -1.051 -6.460 -6.583 1.00 0.00 C ATOM 0 H LEU A 7 1.111 -5.775 -3.949 1.00 0.00 H new ATOM 0 HA LEU A 7 1.538 -7.838 -5.815 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.014 -4.828 -6.221 1.00 0.00 H new ATOM 0 HB3 LEU A 7 1.738 -5.987 -7.506 1.00 0.00 H new ATOM 0 HG LEU A 7 -0.232 -4.785 -5.603 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -1.312 -4.120 -7.831 1.00 0.00 H new ATOM 0 HD12 LEU A 7 0.364 -3.532 -7.711 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -0.004 -4.979 -8.680 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -2.063 -6.057 -6.618 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.871 -7.068 -7.469 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.937 -7.076 -5.691 1.00 0.00 H new ATOM 83 N GLU A 8 4.392 -6.716 -4.805 1.00 0.00 N ATOM 84 CA GLU A 8 5.855 -6.517 -5.005 1.00 0.00 C ATOM 85 C GLU A 8 6.634 -7.873 -5.024 1.00 0.00 C ATOM 86 O GLU A 8 6.427 -8.752 -4.173 1.00 0.00 O ATOM 87 CB GLU A 8 6.354 -5.535 -3.898 1.00 0.00 C ATOM 88 CG GLU A 8 7.324 -4.416 -4.356 1.00 0.00 C ATOM 89 CD GLU A 8 8.809 -4.716 -4.491 1.00 0.00 C ATOM 90 OE1 GLU A 8 9.231 -5.888 -4.561 1.00 0.00 O ATOM 91 OE2 GLU A 8 9.571 -3.728 -4.552 1.00 0.00 O ATOM 0 H GLU A 8 4.102 -6.632 -3.831 1.00 0.00 H new ATOM 0 HA GLU A 8 6.049 -6.079 -5.984 1.00 0.00 H new ATOM 0 HB2 GLU A 8 5.483 -5.066 -3.440 1.00 0.00 H new ATOM 0 HB3 GLU A 8 6.848 -6.118 -3.121 1.00 0.00 H new ATOM 0 HG2 GLU A 8 6.975 -4.058 -5.324 1.00 0.00 H new ATOM 0 HG3 GLU A 8 7.221 -3.588 -3.654 1.00 0.00 H new ATOM 98 N GLY A 9 7.512 -8.039 -6.022 1.00 0.00 N ATOM 99 CA GLY A 9 8.375 -9.242 -6.151 1.00 0.00 C ATOM 100 C GLY A 9 8.295 -9.964 -7.514 1.00 0.00 C ATOM 101 O GLY A 9 7.885 -9.395 -8.530 1.00 0.00 O ATOM 0 H GLY A 9 7.651 -7.353 -6.764 1.00 0.00 H new ATOM 0 HA2 GLY A 9 9.410 -8.948 -5.973 1.00 0.00 H new ATOM 0 HA3 GLY A 9 8.105 -9.949 -5.367 1.00 0.00 H new ATOM 105 N ARG A 10 8.766 -11.219 -7.545 1.00 0.00 N ATOM 106 CA ARG A 10 8.913 -11.991 -8.810 1.00 0.00 C ATOM 107 C ARG A 10 7.659 -12.847 -9.145 1.00 0.00 C ATOM 108 O ARG A 10 7.173 -13.620 -8.318 1.00 0.00 O ATOM 109 CB ARG A 10 10.215 -12.823 -8.737 1.00 0.00 C ATOM 110 CG ARG A 10 10.558 -13.566 -10.060 1.00 0.00 C ATOM 111 CD ARG A 10 11.991 -14.098 -10.209 1.00 0.00 C ATOM 112 NE ARG A 10 12.451 -14.902 -9.046 1.00 0.00 N ATOM 113 CZ ARG A 10 13.109 -16.059 -9.106 1.00 0.00 C ATOM 114 NH1 ARG A 10 13.331 -16.734 -10.213 1.00 0.00 N ATOM 115 NH2 ARG A 10 13.536 -16.564 -7.986 1.00 0.00 N ATOM 0 H ARG A 10 9.055 -11.731 -6.712 1.00 0.00 H new ATOM 0 HA ARG A 10 8.991 -11.293 -9.644 1.00 0.00 H new ATOM 0 HB2 ARG A 10 11.043 -12.164 -8.476 1.00 0.00 H new ATOM 0 HB3 ARG A 10 10.124 -13.554 -7.933 1.00 0.00 H new ATOM 0 HG2 ARG A 10 9.872 -14.407 -10.164 1.00 0.00 H new ATOM 0 HG3 ARG A 10 10.360 -12.888 -10.890 1.00 0.00 H new ATOM 0 HD2 ARG A 10 12.051 -14.709 -11.109 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.669 -13.256 -10.349 1.00 0.00 H new ATOM 0 HE ARG A 10 12.244 -14.534 -8.117 1.00 0.00 H new ATOM 0 HH11 ARG A 10 12.990 -16.376 -11.105 1.00 0.00 H new ATOM 0 HH12 ARG A 10 13.844 -17.615 -10.179 1.00 0.00 H new ATOM 0 HH21 ARG A 10 13.362 -16.076 -7.107 1.00 0.00 H new ATOM 0 HH22 ARG A 10 14.044 -17.448 -7.986 1.00 0.00 H new ATOM 129 N TRP A 11 7.184 -12.726 -10.393 1.00 0.00 N ATOM 130 CA TRP A 11 5.902 -13.324 -10.841 1.00 0.00 C ATOM 131 C TRP A 11 6.113 -14.022 -12.221 1.00 0.00 C ATOM 132 O TRP A 11 6.319 -13.329 -13.220 1.00 0.00 O ATOM 133 CB TRP A 11 4.845 -12.186 -10.944 1.00 0.00 C ATOM 134 CG TRP A 11 4.455 -11.496 -9.634 1.00 0.00 C ATOM 135 CD1 TRP A 11 4.857 -10.197 -9.272 1.00 0.00 C ATOM 136 CD2 TRP A 11 3.645 -11.941 -8.603 1.00 0.00 C ATOM 137 NE1 TRP A 11 4.313 -9.812 -8.038 1.00 0.00 N ATOM 138 CE2 TRP A 11 3.559 -10.899 -7.647 1.00 0.00 C ATOM 139 CE3 TRP A 11 2.928 -13.152 -8.410 1.00 0.00 C ATOM 140 CZ2 TRP A 11 2.739 -11.042 -6.510 1.00 0.00 C ATOM 141 CZ3 TRP A 11 2.127 -13.272 -7.272 1.00 0.00 C ATOM 142 CH2 TRP A 11 2.028 -12.232 -6.338 1.00 0.00 C ATOM 0 H TRP A 11 7.672 -12.212 -11.126 1.00 0.00 H new ATOM 0 HA TRP A 11 5.552 -14.075 -10.132 1.00 0.00 H new ATOM 0 HB2 TRP A 11 5.225 -11.428 -11.629 1.00 0.00 H new ATOM 0 HB3 TRP A 11 3.942 -12.599 -11.394 1.00 0.00 H new ATOM 0 HD1 TRP A 11 5.505 -9.573 -9.871 1.00 0.00 H new ATOM 0 HE1 TRP A 11 4.445 -8.930 -7.543 1.00 0.00 H new ATOM 0 HE3 TRP A 11 3.000 -13.959 -9.124 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 2.662 -10.246 -5.784 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 1.573 -14.185 -7.109 1.00 0.00 H new ATOM 0 HH2 TRP A 11 1.393 -12.352 -5.473 1.00 0.00 H new ATOM 153 N ARG A 12 6.036 -15.363 -12.336 1.00 0.00 N ATOM 154 CA ARG A 12 6.099 -16.048 -13.659 1.00 0.00 C ATOM 155 C ARG A 12 4.687 -16.327 -14.256 1.00 0.00 C ATOM 156 O ARG A 12 3.832 -16.926 -13.602 1.00 0.00 O ATOM 157 CB ARG A 12 6.996 -17.305 -13.569 1.00 0.00 C ATOM 158 CG ARG A 12 6.944 -18.268 -14.768 1.00 0.00 C ATOM 159 CD ARG A 12 8.016 -19.351 -14.731 1.00 0.00 C ATOM 160 NE ARG A 12 8.023 -20.154 -13.479 1.00 0.00 N ATOM 161 CZ ARG A 12 9.019 -20.211 -12.599 1.00 0.00 C ATOM 162 NH1 ARG A 12 10.184 -19.622 -12.752 1.00 0.00 N ATOM 163 NH2 ARG A 12 8.809 -20.876 -11.500 1.00 0.00 N ATOM 0 H ARG A 12 5.931 -15.995 -11.542 1.00 0.00 H new ATOM 0 HA ARG A 12 6.567 -15.371 -14.374 1.00 0.00 H new ATOM 0 HB2 ARG A 12 8.028 -16.980 -13.436 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.719 -17.860 -12.673 1.00 0.00 H new ATOM 0 HG2 ARG A 12 5.963 -18.741 -14.800 1.00 0.00 H new ATOM 0 HG3 ARG A 12 7.051 -17.694 -15.689 1.00 0.00 H new ATOM 0 HD2 ARG A 12 7.871 -20.020 -15.579 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.993 -18.885 -14.857 1.00 0.00 H new ATOM 0 HE ARG A 12 7.192 -20.709 -13.278 1.00 0.00 H new ATOM 0 HH11 ARG A 12 10.372 -19.075 -13.592 1.00 0.00 H new ATOM 0 HH12 ARG A 12 10.900 -19.712 -12.031 1.00 0.00 H new ATOM 0 HH21 ARG A 12 7.908 -21.328 -11.341 1.00 0.00 H new ATOM 0 HH22 ARG A 12 9.545 -20.946 -10.797 1.00 0.00 H new ATOM 177 N LEU A 13 4.505 -16.003 -15.551 1.00 0.00 N ATOM 178 CA LEU A 13 3.314 -16.426 -16.342 1.00 0.00 C ATOM 179 C LEU A 13 3.158 -17.981 -16.440 1.00 0.00 C ATOM 180 O LEU A 13 4.117 -18.690 -16.757 1.00 0.00 O ATOM 181 CB LEU A 13 3.460 -15.778 -17.752 1.00 0.00 C ATOM 182 CG LEU A 13 2.300 -15.993 -18.764 1.00 0.00 C ATOM 183 CD1 LEU A 13 0.990 -15.344 -18.292 1.00 0.00 C ATOM 184 CD2 LEU A 13 2.677 -15.436 -20.148 1.00 0.00 C ATOM 0 H LEU A 13 5.171 -15.444 -16.084 1.00 0.00 H new ATOM 0 HA LEU A 13 2.406 -16.090 -15.842 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.594 -14.705 -17.617 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.376 -16.159 -18.204 1.00 0.00 H new ATOM 0 HG LEU A 13 2.138 -17.069 -18.833 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.209 -15.521 -19.032 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.692 -15.779 -17.338 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.139 -14.271 -18.171 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.852 -15.596 -20.842 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.881 -14.368 -20.067 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.566 -15.948 -20.517 1.00 0.00 H new ATOM 196 N VAL A 14 1.954 -18.506 -16.170 1.00 0.00 N ATOM 197 CA VAL A 14 1.693 -19.982 -16.203 1.00 0.00 C ATOM 198 C VAL A 14 0.421 -20.338 -17.037 1.00 0.00 C ATOM 199 O VAL A 14 0.543 -21.054 -18.035 1.00 0.00 O ATOM 200 CB VAL A 14 1.798 -20.668 -14.792 1.00 0.00 C ATOM 201 CG1 VAL A 14 3.257 -20.703 -14.280 1.00 0.00 C ATOM 202 CG2 VAL A 14 0.899 -20.077 -13.680 1.00 0.00 C ATOM 0 H VAL A 14 1.138 -17.946 -15.925 1.00 0.00 H new ATOM 0 HA VAL A 14 2.514 -20.440 -16.755 1.00 0.00 H new ATOM 0 HB VAL A 14 1.424 -21.674 -14.985 1.00 0.00 H new ATOM 0 HG11 VAL A 14 3.288 -21.184 -13.303 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.875 -21.264 -14.981 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.637 -19.685 -14.195 1.00 0.00 H new ATOM 0 HG21 VAL A 14 1.056 -20.629 -12.753 1.00 0.00 H new ATOM 0 HG22 VAL A 14 1.153 -19.028 -13.525 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -0.147 -20.157 -13.977 1.00 0.00 H new ATOM 212 N ASP A 15 -0.776 -19.844 -16.668 1.00 0.00 N ATOM 213 CA ASP A 15 -2.019 -20.040 -17.465 1.00 0.00 C ATOM 214 C ASP A 15 -2.332 -18.728 -18.256 1.00 0.00 C ATOM 215 O ASP A 15 -2.764 -17.726 -17.678 1.00 0.00 O ATOM 216 CB ASP A 15 -3.120 -20.493 -16.471 1.00 0.00 C ATOM 217 CG ASP A 15 -4.493 -20.805 -17.058 1.00 0.00 C ATOM 218 OD1 ASP A 15 -5.097 -19.935 -17.727 1.00 0.00 O ATOM 219 OD2 ASP A 15 -5.041 -21.895 -16.797 1.00 0.00 O ATOM 0 H ASP A 15 -0.917 -19.300 -15.816 1.00 0.00 H new ATOM 0 HA ASP A 15 -1.933 -20.813 -18.228 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -2.763 -21.382 -15.951 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -3.241 -19.712 -15.720 1.00 0.00 H new ATOM 224 N SER A 16 -2.104 -18.738 -19.581 1.00 0.00 N ATOM 225 CA SER A 16 -2.389 -17.569 -20.464 1.00 0.00 C ATOM 226 C SER A 16 -3.626 -17.793 -21.395 1.00 0.00 C ATOM 227 O SER A 16 -3.482 -17.904 -22.620 1.00 0.00 O ATOM 228 CB SER A 16 -1.086 -17.220 -21.233 1.00 0.00 C ATOM 229 OG SER A 16 -0.835 -18.143 -22.294 1.00 0.00 O ATOM 0 H SER A 16 -1.721 -19.543 -20.076 1.00 0.00 H new ATOM 0 HA SER A 16 -2.681 -16.713 -19.856 1.00 0.00 H new ATOM 0 HB2 SER A 16 -1.162 -16.211 -21.639 1.00 0.00 H new ATOM 0 HB3 SER A 16 -0.244 -17.223 -20.541 1.00 0.00 H new ATOM 0 HG SER A 16 -1.684 -18.407 -22.706 1.00 0.00 H new ATOM 235 N LYS A 17 -4.844 -17.846 -20.824 1.00 0.00 N ATOM 236 CA LYS A 17 -6.084 -18.143 -21.600 1.00 0.00 C ATOM 237 C LYS A 17 -6.687 -16.886 -22.317 1.00 0.00 C ATOM 238 O LYS A 17 -6.859 -15.822 -21.712 1.00 0.00 O ATOM 239 CB LYS A 17 -7.096 -18.933 -20.727 1.00 0.00 C ATOM 240 CG LYS A 17 -7.656 -18.259 -19.447 1.00 0.00 C ATOM 241 CD LYS A 17 -8.834 -19.007 -18.781 1.00 0.00 C ATOM 242 CE LYS A 17 -8.605 -20.481 -18.388 1.00 0.00 C ATOM 243 NZ LYS A 17 -7.611 -20.617 -17.289 1.00 0.00 N ATOM 0 H LYS A 17 -5.006 -17.689 -19.829 1.00 0.00 H new ATOM 0 HA LYS A 17 -5.811 -18.796 -22.429 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -7.943 -19.198 -21.360 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -6.618 -19.866 -20.428 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -6.848 -18.163 -18.721 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -7.981 -17.249 -19.698 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -9.117 -18.459 -17.883 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -9.686 -18.967 -19.460 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -9.551 -20.925 -18.078 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -8.261 -21.039 -19.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -7.271 -21.599 -17.248 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -6.808 -19.980 -17.466 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -8.058 -20.367 -16.384 1.00 0.00 H new ATOM 257 N GLY A 18 -6.962 -17.016 -23.631 1.00 0.00 N ATOM 258 CA GLY A 18 -7.297 -15.852 -24.508 1.00 0.00 C ATOM 259 C GLY A 18 -6.142 -14.982 -25.082 1.00 0.00 C ATOM 260 O GLY A 18 -6.429 -13.989 -25.754 1.00 0.00 O ATOM 0 H GLY A 18 -6.961 -17.912 -24.118 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -7.874 -16.231 -25.352 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.955 -15.193 -23.942 1.00 0.00 H new ATOM 264 N PHE A 19 -4.858 -15.304 -24.824 1.00 0.00 N ATOM 265 CA PHE A 19 -3.719 -14.396 -25.140 1.00 0.00 C ATOM 266 C PHE A 19 -3.391 -14.215 -26.662 1.00 0.00 C ATOM 267 O PHE A 19 -3.335 -13.068 -27.110 1.00 0.00 O ATOM 268 CB PHE A 19 -2.502 -14.793 -24.252 1.00 0.00 C ATOM 269 CG PHE A 19 -1.257 -13.878 -24.330 1.00 0.00 C ATOM 270 CD1 PHE A 19 -1.383 -12.485 -24.249 1.00 0.00 C ATOM 271 CD2 PHE A 19 0.015 -14.435 -24.511 1.00 0.00 C ATOM 272 CE1 PHE A 19 -0.271 -11.664 -24.404 1.00 0.00 C ATOM 273 CE2 PHE A 19 1.133 -13.612 -24.638 1.00 0.00 C ATOM 274 CZ PHE A 19 0.986 -12.228 -24.593 1.00 0.00 C ATOM 0 H PHE A 19 -4.576 -16.186 -24.397 1.00 0.00 H new ATOM 0 HA PHE A 19 -4.026 -13.382 -24.884 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.835 -14.827 -23.215 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.199 -15.804 -24.523 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.352 -12.045 -24.065 1.00 0.00 H new ATOM 0 HD2 PHE A 19 0.130 -15.508 -24.552 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.384 -10.590 -24.378 1.00 0.00 H new ATOM 0 HE2 PHE A 19 2.112 -14.047 -24.771 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.851 -11.591 -24.705 1.00 0.00 H new ATOM 284 N ASP A 20 -3.208 -15.293 -27.454 1.00 0.00 N ATOM 285 CA ASP A 20 -3.104 -15.206 -28.948 1.00 0.00 C ATOM 286 C ASP A 20 -4.292 -14.477 -29.691 1.00 0.00 C ATOM 287 O ASP A 20 -4.051 -13.693 -30.614 1.00 0.00 O ATOM 288 CB ASP A 20 -2.789 -16.641 -29.452 1.00 0.00 C ATOM 289 CG ASP A 20 -2.618 -16.796 -30.963 1.00 0.00 C ATOM 290 OD1 ASP A 20 -1.789 -16.100 -31.589 1.00 0.00 O ATOM 291 OD2 ASP A 20 -3.394 -17.569 -31.565 1.00 0.00 O ATOM 0 H ASP A 20 -3.127 -16.243 -27.093 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.294 -14.525 -29.211 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -1.876 -16.984 -28.966 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.591 -17.304 -29.127 1.00 0.00 H new ATOM 296 N GLU A 21 -5.549 -14.690 -29.262 1.00 0.00 N ATOM 297 CA GLU A 21 -6.714 -13.827 -29.630 1.00 0.00 C ATOM 298 C GLU A 21 -6.556 -12.299 -29.292 1.00 0.00 C ATOM 299 O GLU A 21 -6.798 -11.455 -30.159 1.00 0.00 O ATOM 300 CB GLU A 21 -7.998 -14.427 -28.995 1.00 0.00 C ATOM 301 CG GLU A 21 -8.414 -15.841 -29.475 1.00 0.00 C ATOM 302 CD GLU A 21 -9.578 -16.422 -28.691 1.00 0.00 C ATOM 303 OE1 GLU A 21 -9.361 -16.860 -27.540 1.00 0.00 O ATOM 304 OE2 GLU A 21 -10.704 -16.459 -29.227 1.00 0.00 O ATOM 0 H GLU A 21 -5.799 -15.465 -28.648 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.780 -13.837 -30.718 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.860 -14.461 -27.914 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.825 -13.744 -29.189 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -8.683 -15.795 -30.530 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.559 -16.512 -29.393 1.00 0.00 H new ATOM 311 N TYR A 22 -6.118 -11.942 -28.066 1.00 0.00 N ATOM 312 CA TYR A 22 -5.748 -10.545 -27.693 1.00 0.00 C ATOM 313 C TYR A 22 -4.611 -9.906 -28.561 1.00 0.00 C ATOM 314 O TYR A 22 -4.824 -8.815 -29.089 1.00 0.00 O ATOM 315 CB TYR A 22 -5.488 -10.550 -26.158 1.00 0.00 C ATOM 316 CG TYR A 22 -4.978 -9.245 -25.514 1.00 0.00 C ATOM 317 CD1 TYR A 22 -5.782 -8.101 -25.463 1.00 0.00 C ATOM 318 CD2 TYR A 22 -3.704 -9.212 -24.933 1.00 0.00 C ATOM 319 CE1 TYR A 22 -5.313 -6.944 -24.844 1.00 0.00 C ATOM 320 CE2 TYR A 22 -3.260 -8.067 -24.277 1.00 0.00 C ATOM 321 CZ TYR A 22 -4.062 -6.933 -24.236 1.00 0.00 C ATOM 322 OH TYR A 22 -3.598 -5.801 -23.620 1.00 0.00 O ATOM 0 H TYR A 22 -6.008 -12.608 -27.302 1.00 0.00 H new ATOM 0 HA TYR A 22 -6.570 -9.868 -27.925 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -6.417 -10.828 -25.661 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -4.764 -11.336 -25.943 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -6.768 -8.115 -25.904 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -3.063 -10.079 -24.994 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -5.923 -6.053 -24.836 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -2.291 -8.060 -23.800 1.00 0.00 H new ATOM 0 HH TYR A 22 -4.031 -5.014 -24.012 1.00 0.00 H new ATOM 332 N MET A 23 -3.448 -10.556 -28.757 1.00 0.00 N ATOM 333 CA MET A 23 -2.417 -10.081 -29.735 1.00 0.00 C ATOM 334 C MET A 23 -2.792 -10.090 -31.266 1.00 0.00 C ATOM 335 O MET A 23 -2.279 -9.253 -32.017 1.00 0.00 O ATOM 336 CB MET A 23 -1.023 -10.648 -29.361 1.00 0.00 C ATOM 337 CG MET A 23 -0.842 -12.163 -29.288 1.00 0.00 C ATOM 338 SD MET A 23 0.883 -12.512 -28.926 1.00 0.00 S ATOM 339 CE MET A 23 0.690 -14.226 -28.444 1.00 0.00 C ATOM 0 H MET A 23 -3.188 -11.408 -28.260 1.00 0.00 H new ATOM 0 HA MET A 23 -2.375 -8.999 -29.613 1.00 0.00 H new ATOM 0 HB2 MET A 23 -0.305 -10.264 -30.086 1.00 0.00 H new ATOM 0 HB3 MET A 23 -0.748 -10.235 -28.390 1.00 0.00 H new ATOM 0 HG2 MET A 23 -1.484 -12.585 -28.515 1.00 0.00 H new ATOM 0 HG3 MET A 23 -1.133 -12.625 -30.231 1.00 0.00 H new ATOM 0 HE1 MET A 23 1.662 -14.640 -28.175 1.00 0.00 H new ATOM 0 HE2 MET A 23 0.019 -14.290 -27.587 1.00 0.00 H new ATOM 0 HE3 MET A 23 0.272 -14.793 -29.276 1.00 0.00 H new ATOM 349 N LYS A 24 -3.753 -10.917 -31.724 1.00 0.00 N ATOM 350 CA LYS A 24 -4.552 -10.629 -32.957 1.00 0.00 C ATOM 351 C LYS A 24 -5.390 -9.298 -32.925 1.00 0.00 C ATOM 352 O LYS A 24 -5.235 -8.499 -33.852 1.00 0.00 O ATOM 353 CB LYS A 24 -5.427 -11.869 -33.307 1.00 0.00 C ATOM 354 CG LYS A 24 -4.727 -12.939 -34.178 1.00 0.00 C ATOM 355 CD LYS A 24 -5.607 -14.183 -34.458 1.00 0.00 C ATOM 356 CE LYS A 24 -5.560 -15.279 -33.372 1.00 0.00 C ATOM 357 NZ LYS A 24 -4.291 -16.041 -33.477 1.00 0.00 N ATOM 0 H LYS A 24 -4.003 -11.793 -31.266 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.831 -10.446 -33.753 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.756 -12.336 -32.379 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -6.322 -11.528 -33.827 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.436 -12.489 -35.127 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -3.810 -13.257 -33.681 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -6.640 -13.858 -34.579 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -5.298 -14.621 -35.407 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -5.642 -14.827 -32.383 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -6.409 -15.953 -33.486 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -4.296 -16.820 -32.788 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -4.198 -16.429 -34.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -3.489 -15.409 -33.280 1.00 0.00 H new ATOM 371 N GLU A 25 -6.228 -9.029 -31.895 1.00 0.00 N ATOM 372 CA GLU A 25 -6.898 -7.697 -31.718 1.00 0.00 C ATOM 373 C GLU A 25 -5.929 -6.461 -31.572 1.00 0.00 C ATOM 374 O GLU A 25 -6.160 -5.433 -32.214 1.00 0.00 O ATOM 375 CB GLU A 25 -7.967 -7.805 -30.585 1.00 0.00 C ATOM 376 CG GLU A 25 -8.862 -6.543 -30.418 1.00 0.00 C ATOM 377 CD GLU A 25 -10.067 -6.656 -29.495 1.00 0.00 C ATOM 378 OE1 GLU A 25 -9.921 -6.592 -28.255 1.00 0.00 O ATOM 379 OE2 GLU A 25 -11.200 -6.731 -30.012 1.00 0.00 O ATOM 0 H GLU A 25 -6.462 -9.708 -31.171 1.00 0.00 H new ATOM 0 HA GLU A 25 -7.402 -7.466 -32.656 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -8.607 -8.664 -30.787 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -7.459 -8.002 -29.641 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -8.234 -5.730 -30.054 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -9.220 -6.251 -31.405 1.00 0.00 H new ATOM 386 N LEU A 26 -4.845 -6.557 -30.776 1.00 0.00 N ATOM 387 CA LEU A 26 -3.771 -5.516 -30.701 1.00 0.00 C ATOM 388 C LEU A 26 -3.049 -5.152 -32.048 1.00 0.00 C ATOM 389 O LEU A 26 -2.809 -3.969 -32.309 1.00 0.00 O ATOM 390 CB LEU A 26 -2.708 -5.947 -29.649 1.00 0.00 C ATOM 391 CG LEU A 26 -3.115 -6.079 -28.156 1.00 0.00 C ATOM 392 CD1 LEU A 26 -1.972 -6.754 -27.378 1.00 0.00 C ATOM 393 CD2 LEU A 26 -3.444 -4.724 -27.514 1.00 0.00 C ATOM 0 H LEU A 26 -4.679 -7.355 -30.162 1.00 0.00 H new ATOM 0 HA LEU A 26 -4.295 -4.604 -30.416 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -2.309 -6.911 -29.965 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.888 -5.230 -29.701 1.00 0.00 H new ATOM 0 HG LEU A 26 -4.020 -6.685 -28.113 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -2.252 -6.849 -26.329 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.783 -7.743 -27.794 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -1.069 -6.148 -27.459 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.722 -4.874 -26.471 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -2.570 -4.075 -27.567 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -4.274 -4.260 -28.048 1.00 0.00 H new ATOM 405 N GLY A 27 -2.677 -6.161 -32.856 1.00 0.00 N ATOM 406 CA GLY A 27 -2.008 -5.967 -34.173 1.00 0.00 C ATOM 407 C GLY A 27 -0.574 -6.527 -34.247 1.00 0.00 C ATOM 408 O GLY A 27 0.375 -5.770 -34.455 1.00 0.00 O ATOM 0 H GLY A 27 -2.829 -7.142 -32.621 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.611 -6.442 -34.947 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -1.981 -4.901 -34.400 1.00 0.00 H new ATOM 412 N VAL A 28 -0.430 -7.849 -34.076 1.00 0.00 N ATOM 413 CA VAL A 28 0.897 -8.498 -33.839 1.00 0.00 C ATOM 414 C VAL A 28 1.058 -9.669 -34.862 1.00 0.00 C ATOM 415 O VAL A 28 0.205 -10.562 -34.952 1.00 0.00 O ATOM 416 CB VAL A 28 1.013 -8.985 -32.351 1.00 0.00 C ATOM 417 CG1 VAL A 28 2.357 -9.675 -32.015 1.00 0.00 C ATOM 418 CG2 VAL A 28 0.820 -7.858 -31.306 1.00 0.00 C ATOM 0 H VAL A 28 -1.211 -8.504 -34.095 1.00 0.00 H new ATOM 0 HA VAL A 28 1.707 -7.785 -33.993 1.00 0.00 H new ATOM 0 HB VAL A 28 0.198 -9.705 -32.283 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.357 -9.981 -30.969 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.485 -10.552 -32.650 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.177 -8.978 -32.189 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.914 -8.272 -30.302 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.579 -7.090 -31.454 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.170 -7.417 -31.425 1.00 0.00 H new ATOM 428 N GLY A 29 2.181 -9.684 -35.604 1.00 0.00 N ATOM 429 CA GLY A 29 2.461 -10.729 -36.627 1.00 0.00 C ATOM 430 C GLY A 29 2.804 -12.154 -36.123 1.00 0.00 C ATOM 431 O GLY A 29 3.140 -12.376 -34.957 1.00 0.00 O ATOM 0 H GLY A 29 2.918 -8.983 -35.519 1.00 0.00 H new ATOM 0 HA2 GLY A 29 1.590 -10.804 -37.278 1.00 0.00 H new ATOM 0 HA3 GLY A 29 3.290 -10.382 -37.243 1.00 0.00 H new ATOM 435 N ILE A 30 2.739 -13.126 -37.049 1.00 0.00 N ATOM 436 CA ILE A 30 2.849 -14.591 -36.750 1.00 0.00 C ATOM 437 C ILE A 30 4.119 -15.038 -35.940 1.00 0.00 C ATOM 438 O ILE A 30 3.972 -15.764 -34.953 1.00 0.00 O ATOM 439 CB ILE A 30 2.633 -15.452 -38.054 1.00 0.00 C ATOM 440 CG1 ILE A 30 1.521 -14.964 -39.043 1.00 0.00 C ATOM 441 CG2 ILE A 30 2.347 -16.940 -37.711 1.00 0.00 C ATOM 442 CD1 ILE A 30 2.017 -14.030 -40.164 1.00 0.00 C ATOM 0 H ILE A 30 2.607 -12.930 -38.041 1.00 0.00 H new ATOM 0 HA ILE A 30 2.034 -14.791 -36.054 1.00 0.00 H new ATOM 0 HB ILE A 30 3.582 -15.326 -38.575 1.00 0.00 H new ATOM 0 HG12 ILE A 30 1.051 -15.836 -39.498 1.00 0.00 H new ATOM 0 HG13 ILE A 30 0.749 -14.446 -38.473 1.00 0.00 H new ATOM 0 HG21 ILE A 30 2.203 -17.505 -38.632 1.00 0.00 H new ATOM 0 HG22 ILE A 30 3.191 -17.355 -37.159 1.00 0.00 H new ATOM 0 HG23 ILE A 30 1.446 -17.006 -37.101 1.00 0.00 H new ATOM 0 HD11 ILE A 30 1.177 -13.745 -40.798 1.00 0.00 H new ATOM 0 HD12 ILE A 30 2.459 -13.136 -39.724 1.00 0.00 H new ATOM 0 HD13 ILE A 30 2.765 -14.547 -40.764 1.00 0.00 H new ATOM 454 N ALA A 31 5.334 -14.598 -36.325 1.00 0.00 N ATOM 455 CA ALA A 31 6.577 -14.844 -35.541 1.00 0.00 C ATOM 456 C ALA A 31 6.588 -14.321 -34.063 1.00 0.00 C ATOM 457 O ALA A 31 6.908 -15.095 -33.157 1.00 0.00 O ATOM 458 CB ALA A 31 7.747 -14.289 -36.376 1.00 0.00 C ATOM 0 H ALA A 31 5.489 -14.065 -37.181 1.00 0.00 H new ATOM 0 HA ALA A 31 6.662 -15.919 -35.384 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.683 -14.447 -35.840 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.786 -14.805 -37.335 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.600 -13.222 -36.544 1.00 0.00 H new ATOM 464 N LEU A 32 6.187 -13.058 -33.805 1.00 0.00 N ATOM 465 CA LEU A 32 5.953 -12.553 -32.418 1.00 0.00 C ATOM 466 C LEU A 32 4.794 -13.244 -31.626 1.00 0.00 C ATOM 467 O LEU A 32 4.971 -13.492 -30.431 1.00 0.00 O ATOM 468 CB LEU A 32 5.776 -11.010 -32.417 1.00 0.00 C ATOM 469 CG LEU A 32 7.025 -10.143 -32.724 1.00 0.00 C ATOM 470 CD1 LEU A 32 6.611 -8.664 -32.776 1.00 0.00 C ATOM 471 CD2 LEU A 32 8.139 -10.295 -31.668 1.00 0.00 C ATOM 0 H LEU A 32 6.016 -12.363 -34.532 1.00 0.00 H new ATOM 0 HA LEU A 32 6.856 -12.830 -31.873 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.006 -10.760 -33.147 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.396 -10.716 -31.439 1.00 0.00 H new ATOM 0 HG LEU A 32 7.422 -10.486 -33.679 1.00 0.00 H new ATOM 0 HD11 LEU A 32 7.485 -8.049 -32.991 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.865 -8.522 -33.558 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.189 -8.370 -31.815 1.00 0.00 H new ATOM 0 HD21 LEU A 32 8.985 -9.664 -31.939 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.759 -9.993 -30.692 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.461 -11.335 -31.626 1.00 0.00 H new ATOM 483 N ARG A 33 3.650 -13.593 -32.251 1.00 0.00 N ATOM 484 CA ARG A 33 2.621 -14.464 -31.607 1.00 0.00 C ATOM 485 C ARG A 33 3.108 -15.914 -31.261 1.00 0.00 C ATOM 486 O ARG A 33 2.926 -16.358 -30.124 1.00 0.00 O ATOM 487 CB ARG A 33 1.310 -14.514 -32.432 1.00 0.00 C ATOM 488 CG ARG A 33 0.604 -13.167 -32.745 1.00 0.00 C ATOM 489 CD ARG A 33 -0.873 -13.285 -33.176 1.00 0.00 C ATOM 490 NE ARG A 33 -1.074 -14.239 -34.306 1.00 0.00 N ATOM 491 CZ ARG A 33 -1.254 -13.921 -35.587 1.00 0.00 C ATOM 492 NH1 ARG A 33 -1.225 -12.698 -36.053 1.00 0.00 N ATOM 493 NH2 ARG A 33 -1.470 -14.889 -36.430 1.00 0.00 N ATOM 0 H ARG A 33 3.408 -13.292 -33.195 1.00 0.00 H new ATOM 0 HA ARG A 33 2.423 -13.982 -30.650 1.00 0.00 H new ATOM 0 HB2 ARG A 33 1.528 -15.007 -33.380 1.00 0.00 H new ATOM 0 HB3 ARG A 33 0.602 -15.148 -31.899 1.00 0.00 H new ATOM 0 HG2 ARG A 33 0.658 -12.532 -31.860 1.00 0.00 H new ATOM 0 HG3 ARG A 33 1.157 -12.660 -33.536 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -1.470 -13.609 -32.323 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -1.241 -12.301 -33.468 1.00 0.00 H new ATOM 0 HE ARG A 33 -1.073 -15.232 -34.075 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -1.056 -11.915 -35.421 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -1.371 -12.528 -37.048 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -1.497 -15.854 -36.102 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -1.612 -14.682 -37.419 1.00 0.00 H new ATOM 507 N LYS A 34 3.761 -16.632 -32.200 1.00 0.00 N ATOM 508 CA LYS A 34 4.482 -17.899 -31.908 1.00 0.00 C ATOM 509 C LYS A 34 5.597 -17.826 -30.806 1.00 0.00 C ATOM 510 O LYS A 34 5.655 -18.739 -29.977 1.00 0.00 O ATOM 511 CB LYS A 34 4.975 -18.442 -33.276 1.00 0.00 C ATOM 512 CG LYS A 34 5.741 -19.787 -33.289 1.00 0.00 C ATOM 513 CD LYS A 34 4.907 -21.087 -33.162 1.00 0.00 C ATOM 514 CE LYS A 34 4.162 -21.409 -31.846 1.00 0.00 C ATOM 515 NZ LYS A 34 5.047 -21.369 -30.646 1.00 0.00 N ATOM 0 H LYS A 34 3.806 -16.354 -33.180 1.00 0.00 H new ATOM 0 HA LYS A 34 3.793 -18.596 -31.431 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.107 -18.546 -33.927 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.620 -17.686 -33.723 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.309 -19.841 -34.218 1.00 0.00 H new ATOM 0 HG3 LYS A 34 6.464 -19.770 -32.473 1.00 0.00 H new ATOM 0 HD2 LYS A 34 4.163 -21.073 -33.959 1.00 0.00 H new ATOM 0 HD3 LYS A 34 5.577 -21.922 -33.366 1.00 0.00 H new ATOM 0 HE2 LYS A 34 3.348 -20.697 -31.713 1.00 0.00 H new ATOM 0 HE3 LYS A 34 3.711 -22.398 -31.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 4.675 -22.013 -29.919 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 6.007 -21.666 -30.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 5.077 -20.400 -30.269 1.00 0.00 H new ATOM 529 N MET A 35 6.437 -16.774 -30.773 1.00 0.00 N ATOM 530 CA MET A 35 7.293 -16.437 -29.598 1.00 0.00 C ATOM 531 C MET A 35 6.486 -16.179 -28.278 1.00 0.00 C ATOM 532 O MET A 35 6.685 -16.918 -27.313 1.00 0.00 O ATOM 533 CB MET A 35 8.208 -15.262 -30.047 1.00 0.00 C ATOM 534 CG MET A 35 9.315 -14.832 -29.063 1.00 0.00 C ATOM 535 SD MET A 35 8.668 -13.997 -27.592 1.00 0.00 S ATOM 536 CE MET A 35 8.219 -12.379 -28.254 1.00 0.00 C ATOM 0 H MET A 35 6.548 -16.129 -31.555 1.00 0.00 H new ATOM 0 HA MET A 35 7.907 -17.290 -29.310 1.00 0.00 H new ATOM 0 HB2 MET A 35 8.679 -15.539 -30.990 1.00 0.00 H new ATOM 0 HB3 MET A 35 7.577 -14.397 -30.248 1.00 0.00 H new ATOM 0 HG2 MET A 35 9.882 -15.711 -28.756 1.00 0.00 H new ATOM 0 HG3 MET A 35 10.011 -14.167 -29.575 1.00 0.00 H new ATOM 0 HE1 MET A 35 7.958 -11.710 -27.434 1.00 0.00 H new ATOM 0 HE2 MET A 35 9.063 -11.965 -28.806 1.00 0.00 H new ATOM 0 HE3 MET A 35 7.364 -12.484 -28.922 1.00 0.00 H new ATOM 546 N GLY A 36 5.567 -15.193 -28.236 1.00 0.00 N ATOM 547 CA GLY A 36 4.733 -14.887 -27.036 1.00 0.00 C ATOM 548 C GLY A 36 3.862 -16.001 -26.405 1.00 0.00 C ATOM 549 O GLY A 36 3.787 -16.079 -25.178 1.00 0.00 O ATOM 0 H GLY A 36 5.375 -14.581 -29.029 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.403 -14.517 -26.259 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.069 -14.065 -27.302 1.00 0.00 H new ATOM 553 N ALA A 37 3.223 -16.860 -27.216 1.00 0.00 N ATOM 554 CA ALA A 37 2.522 -18.075 -26.715 1.00 0.00 C ATOM 555 C ALA A 37 3.403 -19.168 -26.011 1.00 0.00 C ATOM 556 O ALA A 37 2.944 -19.761 -25.032 1.00 0.00 O ATOM 557 CB ALA A 37 1.730 -18.642 -27.910 1.00 0.00 C ATOM 0 H ALA A 37 3.172 -16.743 -28.228 1.00 0.00 H new ATOM 0 HA ALA A 37 1.879 -17.767 -25.891 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.194 -19.538 -27.599 1.00 0.00 H new ATOM 0 HB2 ALA A 37 1.017 -17.896 -28.261 1.00 0.00 H new ATOM 0 HB3 ALA A 37 2.419 -18.893 -28.717 1.00 0.00 H new ATOM 563 N MET A 38 4.643 -19.431 -26.475 1.00 0.00 N ATOM 564 CA MET A 38 5.636 -20.253 -25.709 1.00 0.00 C ATOM 565 C MET A 38 6.487 -19.508 -24.616 1.00 0.00 C ATOM 566 O MET A 38 6.892 -20.141 -23.636 1.00 0.00 O ATOM 567 CB MET A 38 6.499 -21.082 -26.702 1.00 0.00 C ATOM 568 CG MET A 38 7.528 -20.324 -27.551 1.00 0.00 C ATOM 569 SD MET A 38 8.330 -21.488 -28.663 1.00 0.00 S ATOM 570 CE MET A 38 9.079 -20.309 -29.787 1.00 0.00 C ATOM 0 H MET A 38 4.991 -19.092 -27.372 1.00 0.00 H new ATOM 0 HA MET A 38 5.042 -20.922 -25.087 1.00 0.00 H new ATOM 0 HB2 MET A 38 7.030 -21.844 -26.131 1.00 0.00 H new ATOM 0 HB3 MET A 38 5.824 -21.604 -27.379 1.00 0.00 H new ATOM 0 HG2 MET A 38 7.039 -19.534 -28.120 1.00 0.00 H new ATOM 0 HG3 MET A 38 8.267 -19.844 -26.909 1.00 0.00 H new ATOM 0 HE1 MET A 38 9.630 -20.843 -30.561 1.00 0.00 H new ATOM 0 HE2 MET A 38 8.301 -19.702 -30.249 1.00 0.00 H new ATOM 0 HE3 MET A 38 9.762 -19.664 -29.235 1.00 0.00 H new ATOM 580 N ALA A 39 6.771 -18.199 -24.767 1.00 0.00 N ATOM 581 CA ALA A 39 7.561 -17.405 -23.795 1.00 0.00 C ATOM 582 C ALA A 39 6.797 -17.118 -22.464 1.00 0.00 C ATOM 583 O ALA A 39 5.886 -16.285 -22.411 1.00 0.00 O ATOM 584 CB ALA A 39 7.956 -16.092 -24.502 1.00 0.00 C ATOM 0 H ALA A 39 6.458 -17.656 -25.572 1.00 0.00 H new ATOM 0 HA ALA A 39 8.439 -17.978 -23.496 1.00 0.00 H new ATOM 0 HB1 ALA A 39 8.541 -15.474 -23.821 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.550 -16.320 -25.387 1.00 0.00 H new ATOM 0 HB3 ALA A 39 7.056 -15.553 -24.798 1.00 0.00 H new ATOM 590 N LYS A 40 7.202 -17.801 -21.383 1.00 0.00 N ATOM 591 CA LYS A 40 6.655 -17.566 -20.019 1.00 0.00 C ATOM 592 C LYS A 40 7.686 -16.787 -19.123 1.00 0.00 C ATOM 593 O LYS A 40 8.527 -17.442 -18.498 1.00 0.00 O ATOM 594 CB LYS A 40 6.097 -18.888 -19.424 1.00 0.00 C ATOM 595 CG LYS A 40 6.998 -20.144 -19.317 1.00 0.00 C ATOM 596 CD LYS A 40 6.237 -21.310 -18.646 1.00 0.00 C ATOM 597 CE LYS A 40 7.064 -22.605 -18.566 1.00 0.00 C ATOM 598 NZ LYS A 40 6.265 -23.658 -17.881 1.00 0.00 N ATOM 0 H LYS A 40 7.914 -18.530 -21.419 1.00 0.00 H new ATOM 0 HA LYS A 40 5.794 -16.900 -20.066 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.739 -18.663 -18.420 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.227 -19.166 -20.018 1.00 0.00 H new ATOM 0 HG2 LYS A 40 7.330 -20.445 -20.311 1.00 0.00 H new ATOM 0 HG3 LYS A 40 7.892 -19.908 -18.740 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.942 -21.012 -17.640 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.320 -21.505 -19.202 1.00 0.00 H new ATOM 0 HE2 LYS A 40 7.341 -22.936 -19.567 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.991 -22.425 -18.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 6.821 -24.535 -17.825 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 6.023 -23.340 -16.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 5.392 -23.836 -18.418 1.00 0.00 H new ATOM 612 N PRO A 41 7.691 -15.419 -19.032 1.00 0.00 N ATOM 613 CA PRO A 41 8.777 -14.671 -18.339 1.00 0.00 C ATOM 614 C PRO A 41 8.676 -14.609 -16.784 1.00 0.00 C ATOM 615 O PRO A 41 7.582 -14.499 -16.227 1.00 0.00 O ATOM 616 CB PRO A 41 8.641 -13.267 -18.965 1.00 0.00 C ATOM 617 CG PRO A 41 7.160 -13.131 -19.323 1.00 0.00 C ATOM 618 CD PRO A 41 6.786 -14.532 -19.797 1.00 0.00 C ATOM 0 HA PRO A 41 9.741 -15.160 -18.477 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.950 -12.491 -18.264 1.00 0.00 H new ATOM 0 HB3 PRO A 41 9.271 -13.167 -19.849 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.564 -12.824 -18.463 1.00 0.00 H new ATOM 0 HG3 PRO A 41 7.001 -12.386 -20.103 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.739 -14.757 -19.593 1.00 0.00 H new ATOM 0 HD3 PRO A 41 6.932 -14.643 -20.871 1.00 0.00 H new ATOM 626 N ASP A 42 9.843 -14.577 -16.118 1.00 0.00 N ATOM 627 CA ASP A 42 9.953 -14.283 -14.659 1.00 0.00 C ATOM 628 C ASP A 42 9.919 -12.725 -14.442 1.00 0.00 C ATOM 629 O ASP A 42 10.910 -12.018 -14.656 1.00 0.00 O ATOM 630 CB ASP A 42 11.255 -14.951 -14.112 1.00 0.00 C ATOM 631 CG ASP A 42 11.144 -16.371 -13.529 1.00 0.00 C ATOM 632 OD1 ASP A 42 10.556 -17.273 -14.164 1.00 0.00 O ATOM 633 OD2 ASP A 42 11.673 -16.603 -12.417 1.00 0.00 O ATOM 0 H ASP A 42 10.742 -14.753 -16.566 1.00 0.00 H new ATOM 0 HA ASP A 42 9.113 -14.699 -14.102 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.983 -14.978 -14.923 1.00 0.00 H new ATOM 0 HB3 ASP A 42 11.664 -14.302 -13.337 1.00 0.00 H new ATOM 638 N CYS A 43 8.750 -12.181 -14.064 1.00 0.00 N ATOM 639 CA CYS A 43 8.476 -10.722 -14.086 1.00 0.00 C ATOM 640 C CYS A 43 8.568 -10.069 -12.677 1.00 0.00 C ATOM 641 O CYS A 43 7.715 -10.291 -11.812 1.00 0.00 O ATOM 642 CB CYS A 43 7.100 -10.547 -14.763 1.00 0.00 C ATOM 643 SG CYS A 43 6.712 -8.783 -15.002 1.00 0.00 S ATOM 0 H CYS A 43 7.962 -12.737 -13.732 1.00 0.00 H new ATOM 0 HA CYS A 43 9.240 -10.192 -14.654 1.00 0.00 H new ATOM 0 HB2 CYS A 43 7.096 -11.058 -15.726 1.00 0.00 H new ATOM 0 HB3 CYS A 43 6.328 -11.014 -14.152 1.00 0.00 H new ATOM 0 HG CYS A 43 5.551 -8.668 -15.575 1.00 0.00 H new ATOM 649 N ILE A 44 9.609 -9.251 -12.450 1.00 0.00 N ATOM 650 CA ILE A 44 9.942 -8.718 -11.097 1.00 0.00 C ATOM 651 C ILE A 44 9.344 -7.278 -10.968 1.00 0.00 C ATOM 652 O ILE A 44 9.875 -6.316 -11.532 1.00 0.00 O ATOM 653 CB ILE A 44 11.474 -8.823 -10.754 1.00 0.00 C ATOM 654 CG1 ILE A 44 12.151 -10.183 -11.119 1.00 0.00 C ATOM 655 CG2 ILE A 44 11.713 -8.543 -9.245 1.00 0.00 C ATOM 656 CD1 ILE A 44 13.685 -10.158 -11.212 1.00 0.00 C ATOM 0 H ILE A 44 10.244 -8.937 -13.184 1.00 0.00 H new ATOM 0 HA ILE A 44 9.478 -9.343 -10.334 1.00 0.00 H new ATOM 0 HB ILE A 44 11.943 -8.067 -11.384 1.00 0.00 H new ATOM 0 HG12 ILE A 44 11.862 -10.924 -10.373 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.752 -10.521 -12.075 1.00 0.00 H new ATOM 0 HG21 ILE A 44 12.778 -8.620 -9.025 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.363 -7.540 -9.001 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.166 -9.273 -8.648 1.00 0.00 H new ATOM 0 HD11 ILE A 44 14.050 -11.152 -11.470 1.00 0.00 H new ATOM 0 HD12 ILE A 44 13.991 -9.448 -11.980 1.00 0.00 H new ATOM 0 HD13 ILE A 44 14.103 -9.856 -10.252 1.00 0.00 H new ATOM 668 N ILE A 45 8.233 -7.145 -10.221 1.00 0.00 N ATOM 669 CA ILE A 45 7.565 -5.835 -9.955 1.00 0.00 C ATOM 670 C ILE A 45 8.261 -5.184 -8.716 1.00 0.00 C ATOM 671 O ILE A 45 8.031 -5.601 -7.578 1.00 0.00 O ATOM 672 CB ILE A 45 6.009 -6.030 -9.793 1.00 0.00 C ATOM 673 CG1 ILE A 45 5.339 -6.570 -11.095 1.00 0.00 C ATOM 674 CG2 ILE A 45 5.290 -4.730 -9.336 1.00 0.00 C ATOM 675 CD1 ILE A 45 3.853 -6.950 -10.989 1.00 0.00 C ATOM 0 H ILE A 45 7.764 -7.936 -9.780 1.00 0.00 H new ATOM 0 HA ILE A 45 7.676 -5.151 -10.796 1.00 0.00 H new ATOM 0 HB ILE A 45 5.893 -6.779 -9.009 1.00 0.00 H new ATOM 0 HG12 ILE A 45 5.444 -5.814 -11.873 1.00 0.00 H new ATOM 0 HG13 ILE A 45 5.894 -7.448 -11.427 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.221 -4.920 -9.240 1.00 0.00 H new ATOM 0 HG22 ILE A 45 5.690 -4.412 -8.373 1.00 0.00 H new ATOM 0 HG23 ILE A 45 5.454 -3.945 -10.074 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.500 -7.311 -11.955 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.730 -7.734 -10.242 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.274 -6.075 -10.695 1.00 0.00 H new ATOM 687 N THR A 46 9.097 -4.163 -8.957 1.00 0.00 N ATOM 688 CA THR A 46 9.873 -3.466 -7.884 1.00 0.00 C ATOM 689 C THR A 46 9.265 -2.052 -7.625 1.00 0.00 C ATOM 690 O THR A 46 9.247 -1.219 -8.533 1.00 0.00 O ATOM 691 CB THR A 46 11.394 -3.393 -8.227 1.00 0.00 C ATOM 692 OG1 THR A 46 11.639 -2.718 -9.458 1.00 0.00 O ATOM 693 CG2 THR A 46 12.100 -4.754 -8.313 1.00 0.00 C ATOM 0 H THR A 46 9.264 -3.788 -9.891 1.00 0.00 H new ATOM 0 HA THR A 46 9.794 -4.047 -6.965 1.00 0.00 H new ATOM 0 HB THR A 46 11.807 -2.840 -7.384 1.00 0.00 H new ATOM 0 HG1 THR A 46 11.125 -3.147 -10.174 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.152 -4.604 -8.556 1.00 0.00 H new ATOM 0 HG22 THR A 46 12.018 -5.267 -7.355 1.00 0.00 H new ATOM 0 HG23 THR A 46 11.632 -5.358 -9.090 1.00 0.00 H new ATOM 701 N CYS A 47 8.744 -1.772 -6.417 1.00 0.00 N ATOM 702 CA CYS A 47 8.015 -0.502 -6.130 1.00 0.00 C ATOM 703 C CYS A 47 8.761 0.418 -5.118 1.00 0.00 C ATOM 704 O CYS A 47 8.623 0.271 -3.899 1.00 0.00 O ATOM 705 CB CYS A 47 6.580 -0.858 -5.682 1.00 0.00 C ATOM 706 SG CYS A 47 5.615 0.656 -5.326 1.00 0.00 S ATOM 0 H CYS A 47 8.809 -2.402 -5.617 1.00 0.00 H new ATOM 0 HA CYS A 47 7.968 0.096 -7.040 1.00 0.00 H new ATOM 0 HB2 CYS A 47 6.084 -1.436 -6.462 1.00 0.00 H new ATOM 0 HB3 CYS A 47 6.618 -1.488 -4.793 1.00 0.00 H new ATOM 0 HG CYS A 47 6.192 1.679 -5.883 1.00 0.00 H new ATOM 712 N ASP A 48 9.465 1.448 -5.628 1.00 0.00 N ATOM 713 CA ASP A 48 9.976 2.572 -4.788 1.00 0.00 C ATOM 714 C ASP A 48 8.896 3.708 -4.630 1.00 0.00 C ATOM 715 O ASP A 48 9.051 4.833 -5.119 1.00 0.00 O ATOM 716 CB ASP A 48 11.322 3.002 -5.434 1.00 0.00 C ATOM 717 CG ASP A 48 12.147 4.001 -4.624 1.00 0.00 C ATOM 718 OD1 ASP A 48 12.394 3.754 -3.424 1.00 0.00 O ATOM 719 OD2 ASP A 48 12.565 5.032 -5.194 1.00 0.00 O ATOM 0 H ASP A 48 9.698 1.533 -6.617 1.00 0.00 H new ATOM 0 HA ASP A 48 10.166 2.283 -3.754 1.00 0.00 H new ATOM 0 HB2 ASP A 48 11.926 2.110 -5.603 1.00 0.00 H new ATOM 0 HB3 ASP A 48 11.114 3.436 -6.412 1.00 0.00 H new ATOM 724 N GLY A 49 7.766 3.386 -3.957 1.00 0.00 N ATOM 725 CA GLY A 49 6.619 4.320 -3.769 1.00 0.00 C ATOM 726 C GLY A 49 5.909 4.814 -5.054 1.00 0.00 C ATOM 727 O GLY A 49 4.943 4.214 -5.529 1.00 0.00 O ATOM 0 H GLY A 49 7.619 2.473 -3.527 1.00 0.00 H new ATOM 0 HA2 GLY A 49 5.879 3.828 -3.139 1.00 0.00 H new ATOM 0 HA3 GLY A 49 6.976 5.192 -3.220 1.00 0.00 H new ATOM 731 N LYS A 50 6.430 5.920 -5.596 1.00 0.00 N ATOM 732 CA LYS A 50 6.058 6.429 -6.947 1.00 0.00 C ATOM 733 C LYS A 50 6.781 5.756 -8.158 1.00 0.00 C ATOM 734 O LYS A 50 6.152 5.585 -9.202 1.00 0.00 O ATOM 735 CB LYS A 50 6.277 7.971 -6.959 1.00 0.00 C ATOM 736 CG LYS A 50 5.096 8.820 -6.421 1.00 0.00 C ATOM 737 CD LYS A 50 4.035 9.210 -7.476 1.00 0.00 C ATOM 738 CE LYS A 50 4.516 10.267 -8.494 1.00 0.00 C ATOM 739 NZ LYS A 50 3.426 10.587 -9.447 1.00 0.00 N ATOM 0 H LYS A 50 7.123 6.498 -5.120 1.00 0.00 H new ATOM 0 HA LYS A 50 5.012 6.162 -7.099 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.164 8.199 -6.367 1.00 0.00 H new ATOM 0 HB3 LYS A 50 6.488 8.282 -7.982 1.00 0.00 H new ATOM 0 HG2 LYS A 50 4.604 8.265 -5.622 1.00 0.00 H new ATOM 0 HG3 LYS A 50 5.497 9.731 -5.977 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.729 8.314 -8.016 1.00 0.00 H new ATOM 0 HD3 LYS A 50 3.152 9.591 -6.963 1.00 0.00 H new ATOM 0 HE2 LYS A 50 4.830 11.171 -7.971 1.00 0.00 H new ATOM 0 HE3 LYS A 50 5.385 9.893 -9.035 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 3.834 10.953 -10.331 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 2.878 9.727 -9.649 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 2.801 11.306 -9.030 1.00 0.00 H new ATOM 753 N ASN A 51 8.081 5.435 -8.077 1.00 0.00 N ATOM 754 CA ASN A 51 8.851 4.883 -9.227 1.00 0.00 C ATOM 755 C ASN A 51 8.771 3.326 -9.217 1.00 0.00 C ATOM 756 O ASN A 51 9.433 2.653 -8.421 1.00 0.00 O ATOM 757 CB ASN A 51 10.307 5.421 -9.166 1.00 0.00 C ATOM 758 CG ASN A 51 10.442 6.924 -9.443 1.00 0.00 C ATOM 759 OD1 ASN A 51 10.368 7.765 -8.554 1.00 0.00 O ATOM 760 ND2 ASN A 51 10.605 7.325 -10.679 1.00 0.00 N ATOM 0 H ASN A 51 8.633 5.545 -7.226 1.00 0.00 H new ATOM 0 HA ASN A 51 8.423 5.210 -10.175 1.00 0.00 H new ATOM 0 HB2 ASN A 51 10.719 5.208 -8.179 1.00 0.00 H new ATOM 0 HB3 ASN A 51 10.913 4.875 -9.889 1.00 0.00 H new ATOM 0 HD21 ASN A 51 10.668 8.321 -10.888 1.00 0.00 H new ATOM 0 HD22 ASN A 51 10.669 6.641 -11.433 1.00 0.00 H new ATOM 767 N LEU A 52 7.921 2.759 -10.090 1.00 0.00 N ATOM 768 CA LEU A 52 7.628 1.303 -10.108 1.00 0.00 C ATOM 769 C LEU A 52 8.285 0.667 -11.372 1.00 0.00 C ATOM 770 O LEU A 52 7.894 0.939 -12.511 1.00 0.00 O ATOM 771 CB LEU A 52 6.087 1.152 -9.951 1.00 0.00 C ATOM 772 CG LEU A 52 5.544 -0.293 -9.775 1.00 0.00 C ATOM 773 CD1 LEU A 52 4.249 -0.305 -8.944 1.00 0.00 C ATOM 774 CD2 LEU A 52 5.263 -0.955 -11.132 1.00 0.00 C ATOM 0 H LEU A 52 7.417 3.288 -10.802 1.00 0.00 H new ATOM 0 HA LEU A 52 8.067 0.741 -9.284 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.773 1.741 -9.089 1.00 0.00 H new ATOM 0 HB3 LEU A 52 5.611 1.591 -10.828 1.00 0.00 H new ATOM 0 HG LEU A 52 6.317 -0.856 -9.252 1.00 0.00 H new ATOM 0 HD11 LEU A 52 3.894 -1.330 -8.839 1.00 0.00 H new ATOM 0 HD12 LEU A 52 4.446 0.114 -7.957 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.489 0.292 -9.447 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.884 -1.965 -10.973 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.520 -0.370 -11.675 1.00 0.00 H new ATOM 0 HD23 LEU A 52 6.184 -1.000 -11.712 1.00 0.00 H new ATOM 786 N THR A 53 9.309 -0.171 -11.159 1.00 0.00 N ATOM 787 CA THR A 53 10.121 -0.774 -12.253 1.00 0.00 C ATOM 788 C THR A 53 9.744 -2.276 -12.420 1.00 0.00 C ATOM 789 O THR A 53 9.947 -3.096 -11.514 1.00 0.00 O ATOM 790 CB THR A 53 11.639 -0.503 -12.023 1.00 0.00 C ATOM 791 OG1 THR A 53 11.892 0.898 -12.076 1.00 0.00 O ATOM 792 CG2 THR A 53 12.579 -1.127 -13.070 1.00 0.00 C ATOM 0 H THR A 53 9.607 -0.457 -10.226 1.00 0.00 H new ATOM 0 HA THR A 53 9.891 -0.299 -13.207 1.00 0.00 H new ATOM 0 HB THR A 53 11.847 -0.956 -11.054 1.00 0.00 H new ATOM 0 HG1 THR A 53 12.847 1.064 -11.929 1.00 0.00 H new ATOM 0 HG21 THR A 53 13.612 -0.882 -12.823 1.00 0.00 H new ATOM 0 HG22 THR A 53 12.453 -2.210 -13.073 1.00 0.00 H new ATOM 0 HG23 THR A 53 12.338 -0.731 -14.057 1.00 0.00 H new ATOM 800 N ILE A 54 9.208 -2.618 -13.605 1.00 0.00 N ATOM 801 CA ILE A 54 8.773 -4.003 -13.945 1.00 0.00 C ATOM 802 C ILE A 54 9.894 -4.636 -14.832 1.00 0.00 C ATOM 803 O ILE A 54 10.118 -4.227 -15.978 1.00 0.00 O ATOM 804 CB ILE A 54 7.340 -4.034 -14.595 1.00 0.00 C ATOM 805 CG1 ILE A 54 6.264 -3.337 -13.702 1.00 0.00 C ATOM 806 CG2 ILE A 54 6.907 -5.489 -14.919 1.00 0.00 C ATOM 807 CD1 ILE A 54 4.822 -3.278 -14.232 1.00 0.00 C ATOM 0 H ILE A 54 9.060 -1.949 -14.360 1.00 0.00 H new ATOM 0 HA ILE A 54 8.655 -4.606 -13.045 1.00 0.00 H new ATOM 0 HB ILE A 54 7.408 -3.469 -15.525 1.00 0.00 H new ATOM 0 HG12 ILE A 54 6.246 -3.847 -12.739 1.00 0.00 H new ATOM 0 HG13 ILE A 54 6.594 -2.315 -13.515 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.913 -5.482 -15.367 1.00 0.00 H new ATOM 0 HG22 ILE A 54 7.617 -5.933 -15.617 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.886 -6.076 -14.001 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.189 -2.767 -13.507 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.804 -2.735 -15.177 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.450 -4.291 -14.388 1.00 0.00 H new ATOM 819 N LYS A 55 10.588 -5.643 -14.278 1.00 0.00 N ATOM 820 CA LYS A 55 11.678 -6.369 -14.977 1.00 0.00 C ATOM 821 C LYS A 55 11.176 -7.751 -15.507 1.00 0.00 C ATOM 822 O LYS A 55 11.202 -8.757 -14.793 1.00 0.00 O ATOM 823 CB LYS A 55 12.866 -6.423 -13.981 1.00 0.00 C ATOM 824 CG LYS A 55 14.080 -7.210 -14.505 1.00 0.00 C ATOM 825 CD LYS A 55 15.401 -7.015 -13.733 1.00 0.00 C ATOM 826 CE LYS A 55 16.552 -7.872 -14.306 1.00 0.00 C ATOM 827 NZ LYS A 55 16.904 -7.474 -15.695 1.00 0.00 N ATOM 0 H LYS A 55 10.414 -5.982 -13.332 1.00 0.00 H new ATOM 0 HA LYS A 55 12.017 -5.866 -15.883 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.178 -5.405 -13.747 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.526 -6.875 -13.049 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.831 -8.271 -14.496 1.00 0.00 H new ATOM 0 HG3 LYS A 55 14.246 -6.931 -15.545 1.00 0.00 H new ATOM 0 HD2 LYS A 55 15.685 -5.963 -13.765 1.00 0.00 H new ATOM 0 HD3 LYS A 55 15.247 -7.272 -12.685 1.00 0.00 H new ATOM 0 HE2 LYS A 55 17.430 -7.774 -13.667 1.00 0.00 H new ATOM 0 HE3 LYS A 55 16.263 -8.923 -14.292 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 17.783 -7.951 -15.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 16.136 -7.748 -16.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 17.040 -6.444 -15.737 1.00 0.00 H new ATOM 841 N THR A 56 10.743 -7.788 -16.774 1.00 0.00 N ATOM 842 CA THR A 56 10.158 -9.009 -17.406 1.00 0.00 C ATOM 843 C THR A 56 11.277 -9.886 -18.051 1.00 0.00 C ATOM 844 O THR A 56 11.761 -9.551 -19.135 1.00 0.00 O ATOM 845 CB THR A 56 9.043 -8.581 -18.408 1.00 0.00 C ATOM 846 OG1 THR A 56 8.051 -7.788 -17.763 1.00 0.00 O ATOM 847 CG2 THR A 56 8.279 -9.749 -19.043 1.00 0.00 C ATOM 0 H THR A 56 10.782 -6.983 -17.399 1.00 0.00 H new ATOM 0 HA THR A 56 9.689 -9.641 -16.651 1.00 0.00 H new ATOM 0 HB THR A 56 9.587 -8.037 -19.181 1.00 0.00 H new ATOM 0 HG1 THR A 56 7.754 -8.238 -16.944 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.523 -9.361 -19.726 1.00 0.00 H new ATOM 0 HG22 THR A 56 8.975 -10.382 -19.594 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.795 -10.335 -18.262 1.00 0.00 H new ATOM 855 N GLU A 57 11.674 -10.997 -17.399 1.00 0.00 N ATOM 856 CA GLU A 57 12.882 -11.776 -17.801 1.00 0.00 C ATOM 857 C GLU A 57 12.538 -13.051 -18.629 1.00 0.00 C ATOM 858 O GLU A 57 11.939 -14.008 -18.127 1.00 0.00 O ATOM 859 CB GLU A 57 13.732 -12.146 -16.551 1.00 0.00 C ATOM 860 CG GLU A 57 14.331 -10.969 -15.752 1.00 0.00 C ATOM 861 CD GLU A 57 15.365 -10.137 -16.481 1.00 0.00 C ATOM 862 OE1 GLU A 57 16.537 -10.550 -16.560 1.00 0.00 O ATOM 863 OE2 GLU A 57 15.054 -8.989 -16.861 1.00 0.00 O ATOM 0 H GLU A 57 11.183 -11.382 -16.592 1.00 0.00 H new ATOM 0 HA GLU A 57 13.467 -11.130 -18.456 1.00 0.00 H new ATOM 0 HB2 GLU A 57 13.109 -12.734 -15.877 1.00 0.00 H new ATOM 0 HB3 GLU A 57 14.550 -12.791 -16.873 1.00 0.00 H new ATOM 0 HG2 GLU A 57 13.517 -10.313 -15.442 1.00 0.00 H new ATOM 0 HG3 GLU A 57 14.785 -11.365 -14.844 1.00 0.00 H new ATOM 870 N SER A 58 12.976 -13.074 -19.898 1.00 0.00 N ATOM 871 CA SER A 58 12.958 -14.293 -20.752 1.00 0.00 C ATOM 872 C SER A 58 14.164 -14.294 -21.743 1.00 0.00 C ATOM 873 O SER A 58 14.504 -13.271 -22.352 1.00 0.00 O ATOM 874 CB SER A 58 11.610 -14.385 -21.509 1.00 0.00 C ATOM 875 OG SER A 58 11.540 -15.540 -22.348 1.00 0.00 O ATOM 0 H SER A 58 13.354 -12.253 -20.370 1.00 0.00 H new ATOM 0 HA SER A 58 13.057 -15.172 -20.115 1.00 0.00 H new ATOM 0 HB2 SER A 58 10.792 -14.411 -20.789 1.00 0.00 H new ATOM 0 HB3 SER A 58 11.473 -13.489 -22.115 1.00 0.00 H new ATOM 0 HG SER A 58 10.673 -15.560 -22.805 1.00 0.00 H new ATOM 881 N THR A 59 14.758 -15.481 -21.971 1.00 0.00 N ATOM 882 CA THR A 59 15.706 -15.720 -23.111 1.00 0.00 C ATOM 883 C THR A 59 15.135 -15.466 -24.552 1.00 0.00 C ATOM 884 O THR A 59 15.882 -15.013 -25.422 1.00 0.00 O ATOM 885 CB THR A 59 16.352 -17.139 -23.025 1.00 0.00 C ATOM 886 OG1 THR A 59 15.356 -18.158 -23.006 1.00 0.00 O ATOM 887 CG2 THR A 59 17.265 -17.372 -21.810 1.00 0.00 C ATOM 0 H THR A 59 14.606 -16.302 -21.385 1.00 0.00 H new ATOM 0 HA THR A 59 16.466 -14.951 -22.976 1.00 0.00 H new ATOM 0 HB THR A 59 16.972 -17.189 -23.920 1.00 0.00 H new ATOM 0 HG1 THR A 59 15.788 -19.036 -22.954 1.00 0.00 H new ATOM 0 HG21 THR A 59 17.663 -18.386 -21.843 1.00 0.00 H new ATOM 0 HG22 THR A 59 18.088 -16.658 -21.831 1.00 0.00 H new ATOM 0 HG23 THR A 59 16.692 -17.237 -20.893 1.00 0.00 H new ATOM 895 N LEU A 60 13.830 -15.706 -24.797 1.00 0.00 N ATOM 896 CA LEU A 60 13.135 -15.242 -26.033 1.00 0.00 C ATOM 897 C LEU A 60 12.959 -13.688 -26.138 1.00 0.00 C ATOM 898 O LEU A 60 13.274 -13.131 -27.194 1.00 0.00 O ATOM 899 CB LEU A 60 11.778 -15.991 -26.184 1.00 0.00 C ATOM 900 CG LEU A 60 11.841 -17.512 -26.495 1.00 0.00 C ATOM 901 CD1 LEU A 60 10.469 -18.172 -26.308 1.00 0.00 C ATOM 902 CD2 LEU A 60 12.324 -17.804 -27.929 1.00 0.00 C ATOM 0 H LEU A 60 13.227 -16.221 -24.156 1.00 0.00 H new ATOM 0 HA LEU A 60 13.787 -15.493 -26.870 1.00 0.00 H new ATOM 0 HB2 LEU A 60 11.213 -15.857 -25.261 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.210 -15.506 -26.978 1.00 0.00 H new ATOM 0 HG LEU A 60 12.561 -17.928 -25.790 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.543 -19.236 -26.533 1.00 0.00 H new ATOM 0 HD12 LEU A 60 10.140 -18.041 -25.277 1.00 0.00 H new ATOM 0 HD13 LEU A 60 9.748 -17.709 -26.981 1.00 0.00 H new ATOM 0 HD21 LEU A 60 12.349 -18.881 -28.092 1.00 0.00 H new ATOM 0 HD22 LEU A 60 11.641 -17.345 -28.644 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.324 -17.393 -28.067 1.00 0.00 H new ATOM 914 N LYS A 61 12.463 -12.979 -25.096 1.00 0.00 N ATOM 915 CA LYS A 61 12.412 -11.488 -25.103 1.00 0.00 C ATOM 916 C LYS A 61 12.380 -10.912 -23.648 1.00 0.00 C ATOM 917 O LYS A 61 11.355 -10.980 -22.965 1.00 0.00 O ATOM 918 CB LYS A 61 11.218 -10.965 -25.963 1.00 0.00 C ATOM 919 CG LYS A 61 11.437 -9.711 -26.850 1.00 0.00 C ATOM 920 CD LYS A 61 11.966 -8.429 -26.163 1.00 0.00 C ATOM 921 CE LYS A 61 13.489 -8.225 -26.308 1.00 0.00 C ATOM 922 NZ LYS A 61 13.911 -6.995 -25.590 1.00 0.00 N ATOM 0 H LYS A 61 12.095 -13.405 -24.246 1.00 0.00 H new ATOM 0 HA LYS A 61 13.328 -11.126 -25.571 1.00 0.00 H new ATOM 0 HB2 LYS A 61 10.897 -11.779 -26.613 1.00 0.00 H new ATOM 0 HB3 LYS A 61 10.391 -10.752 -25.286 1.00 0.00 H new ATOM 0 HG2 LYS A 61 12.135 -9.979 -27.643 1.00 0.00 H new ATOM 0 HG3 LYS A 61 10.488 -9.468 -27.328 1.00 0.00 H new ATOM 0 HD2 LYS A 61 11.452 -7.565 -26.583 1.00 0.00 H new ATOM 0 HD3 LYS A 61 11.713 -8.466 -25.103 1.00 0.00 H new ATOM 0 HE2 LYS A 61 14.019 -9.089 -25.907 1.00 0.00 H new ATOM 0 HE3 LYS A 61 13.755 -8.149 -27.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 14.750 -6.592 -26.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 13.138 -6.300 -25.608 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 14.141 -7.231 -24.604 1.00 0.00 H new ATOM 936 N THR A 62 13.490 -10.301 -23.198 1.00 0.00 N ATOM 937 CA THR A 62 13.553 -9.584 -21.880 1.00 0.00 C ATOM 938 C THR A 62 13.185 -8.067 -22.047 1.00 0.00 C ATOM 939 O THR A 62 13.761 -7.375 -22.896 1.00 0.00 O ATOM 940 CB THR A 62 14.947 -9.824 -21.214 1.00 0.00 C ATOM 941 OG1 THR A 62 15.091 -11.206 -20.889 1.00 0.00 O ATOM 942 CG2 THR A 62 15.192 -9.085 -19.881 1.00 0.00 C ATOM 0 H THR A 62 14.367 -10.281 -23.719 1.00 0.00 H new ATOM 0 HA THR A 62 12.804 -9.992 -21.201 1.00 0.00 H new ATOM 0 HB THR A 62 15.652 -9.449 -21.956 1.00 0.00 H new ATOM 0 HG1 THR A 62 14.844 -11.752 -21.664 1.00 0.00 H new ATOM 0 HG21 THR A 62 16.189 -9.324 -19.510 1.00 0.00 H new ATOM 0 HG22 THR A 62 15.113 -8.010 -20.041 1.00 0.00 H new ATOM 0 HG23 THR A 62 14.448 -9.398 -19.149 1.00 0.00 H new ATOM 950 N THR A 63 12.235 -7.547 -21.242 1.00 0.00 N ATOM 951 CA THR A 63 11.823 -6.104 -21.285 1.00 0.00 C ATOM 952 C THR A 63 11.793 -5.494 -19.849 1.00 0.00 C ATOM 953 O THR A 63 10.883 -5.790 -19.065 1.00 0.00 O ATOM 954 CB THR A 63 10.449 -5.846 -21.985 1.00 0.00 C ATOM 955 OG1 THR A 63 9.381 -6.452 -21.262 1.00 0.00 O ATOM 956 CG2 THR A 63 10.353 -6.304 -23.444 1.00 0.00 C ATOM 0 H THR A 63 11.730 -8.097 -20.547 1.00 0.00 H new ATOM 0 HA THR A 63 12.581 -5.611 -21.894 1.00 0.00 H new ATOM 0 HB THR A 63 10.367 -4.759 -21.989 1.00 0.00 H new ATOM 0 HG1 THR A 63 9.490 -6.271 -20.305 1.00 0.00 H new ATOM 0 HG21 THR A 63 9.360 -6.078 -23.832 1.00 0.00 H new ATOM 0 HG22 THR A 63 11.103 -5.782 -24.039 1.00 0.00 H new ATOM 0 HG23 THR A 63 10.528 -7.378 -23.500 1.00 0.00 H new ATOM 964 N GLN A 64 12.748 -4.605 -19.533 1.00 0.00 N ATOM 965 CA GLN A 64 12.783 -3.869 -18.239 1.00 0.00 C ATOM 966 C GLN A 64 12.337 -2.385 -18.432 1.00 0.00 C ATOM 967 O GLN A 64 12.979 -1.638 -19.177 1.00 0.00 O ATOM 968 CB GLN A 64 14.226 -4.014 -17.689 1.00 0.00 C ATOM 969 CG GLN A 64 14.448 -3.478 -16.252 1.00 0.00 C ATOM 970 CD GLN A 64 15.883 -3.673 -15.744 1.00 0.00 C ATOM 971 OE1 GLN A 64 16.506 -4.720 -15.907 1.00 0.00 O ATOM 972 NE2 GLN A 64 16.457 -2.689 -15.097 1.00 0.00 N ATOM 0 H GLN A 64 13.519 -4.370 -20.158 1.00 0.00 H new ATOM 0 HA GLN A 64 12.079 -4.280 -17.516 1.00 0.00 H new ATOM 0 HB2 GLN A 64 14.501 -5.069 -17.711 1.00 0.00 H new ATOM 0 HB3 GLN A 64 14.907 -3.493 -18.362 1.00 0.00 H new ATOM 0 HG2 GLN A 64 14.202 -2.416 -16.226 1.00 0.00 H new ATOM 0 HG3 GLN A 64 13.759 -3.981 -15.574 1.00 0.00 H new ATOM 0 HE21 GLN A 64 15.955 -1.813 -14.952 1.00 0.00 H new ATOM 0 HE22 GLN A 64 17.405 -2.799 -14.738 1.00 0.00 H new ATOM 981 N PHE A 65 11.258 -1.956 -17.750 1.00 0.00 N ATOM 982 CA PHE A 65 10.738 -0.559 -17.853 1.00 0.00 C ATOM 983 C PHE A 65 10.426 0.085 -16.464 1.00 0.00 C ATOM 984 O PHE A 65 9.912 -0.574 -15.556 1.00 0.00 O ATOM 985 CB PHE A 65 9.538 -0.493 -18.845 1.00 0.00 C ATOM 986 CG PHE A 65 8.221 -1.213 -18.482 1.00 0.00 C ATOM 987 CD1 PHE A 65 7.352 -0.668 -17.529 1.00 0.00 C ATOM 988 CD2 PHE A 65 7.841 -2.368 -19.172 1.00 0.00 C ATOM 989 CE1 PHE A 65 6.118 -1.261 -17.279 1.00 0.00 C ATOM 990 CE2 PHE A 65 6.602 -2.957 -18.927 1.00 0.00 C ATOM 991 CZ PHE A 65 5.742 -2.401 -17.984 1.00 0.00 C ATOM 0 H PHE A 65 10.721 -2.550 -17.118 1.00 0.00 H new ATOM 0 HA PHE A 65 11.536 0.058 -18.266 1.00 0.00 H new ATOM 0 HB2 PHE A 65 9.303 0.559 -19.007 1.00 0.00 H new ATOM 0 HB3 PHE A 65 9.879 -0.894 -19.800 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.641 0.219 -16.984 1.00 0.00 H new ATOM 0 HD2 PHE A 65 8.510 -2.806 -19.898 1.00 0.00 H new ATOM 0 HE1 PHE A 65 5.454 -0.838 -16.540 1.00 0.00 H new ATOM 0 HE2 PHE A 65 6.309 -3.844 -19.468 1.00 0.00 H new ATOM 0 HZ PHE A 65 4.780 -2.856 -17.799 1.00 0.00 H new ATOM 1001 N SER A 66 10.682 1.398 -16.338 1.00 0.00 N ATOM 1002 CA SER A 66 10.324 2.202 -15.137 1.00 0.00 C ATOM 1003 C SER A 66 9.044 3.060 -15.380 1.00 0.00 C ATOM 1004 O SER A 66 9.087 4.011 -16.171 1.00 0.00 O ATOM 1005 CB SER A 66 11.533 3.094 -14.764 1.00 0.00 C ATOM 1006 OG SER A 66 11.775 4.098 -15.754 1.00 0.00 O ATOM 0 H SER A 66 11.145 1.943 -17.065 1.00 0.00 H new ATOM 0 HA SER A 66 10.094 1.530 -14.310 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.351 3.570 -13.800 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.422 2.473 -14.650 1.00 0.00 H new ATOM 0 HG SER A 66 10.924 4.374 -16.155 1.00 0.00 H new ATOM 1012 N CYS A 67 7.937 2.756 -14.682 1.00 0.00 N ATOM 1013 CA CYS A 67 6.698 3.569 -14.742 1.00 0.00 C ATOM 1014 C CYS A 67 6.544 4.466 -13.474 1.00 0.00 C ATOM 1015 O CYS A 67 6.523 3.980 -12.337 1.00 0.00 O ATOM 1016 CB CYS A 67 5.513 2.605 -14.965 1.00 0.00 C ATOM 1017 SG CYS A 67 5.168 1.534 -13.531 1.00 0.00 S ATOM 0 H CYS A 67 7.869 1.948 -14.063 1.00 0.00 H new ATOM 0 HA CYS A 67 6.734 4.272 -15.575 1.00 0.00 H new ATOM 0 HB2 CYS A 67 4.621 3.186 -15.197 1.00 0.00 H new ATOM 0 HB3 CYS A 67 5.722 1.980 -15.833 1.00 0.00 H new ATOM 0 HG CYS A 67 6.273 0.981 -13.127 1.00 0.00 H new ATOM 1023 N THR A 68 6.409 5.788 -13.668 1.00 0.00 N ATOM 1024 CA THR A 68 6.110 6.742 -12.558 1.00 0.00 C ATOM 1025 C THR A 68 4.571 6.718 -12.263 1.00 0.00 C ATOM 1026 O THR A 68 3.744 6.971 -13.142 1.00 0.00 O ATOM 1027 CB THR A 68 6.641 8.163 -12.919 1.00 0.00 C ATOM 1028 OG1 THR A 68 8.033 8.126 -13.212 1.00 0.00 O ATOM 1029 CG2 THR A 68 6.501 9.194 -11.790 1.00 0.00 C ATOM 0 H THR A 68 6.500 6.233 -14.581 1.00 0.00 H new ATOM 0 HA THR A 68 6.623 6.443 -11.644 1.00 0.00 H new ATOM 0 HB THR A 68 6.029 8.460 -13.771 1.00 0.00 H new ATOM 0 HG1 THR A 68 8.344 9.028 -13.437 1.00 0.00 H new ATOM 0 HG21 THR A 68 6.894 10.154 -12.124 1.00 0.00 H new ATOM 0 HG22 THR A 68 5.449 9.304 -11.526 1.00 0.00 H new ATOM 0 HG23 THR A 68 7.061 8.856 -10.918 1.00 0.00 H new ATOM 1037 N LEU A 69 4.190 6.387 -11.021 1.00 0.00 N ATOM 1038 CA LEU A 69 2.797 6.007 -10.669 1.00 0.00 C ATOM 1039 C LEU A 69 1.801 7.217 -10.660 1.00 0.00 C ATOM 1040 O LEU A 69 2.095 8.278 -10.099 1.00 0.00 O ATOM 1041 CB LEU A 69 2.915 5.287 -9.296 1.00 0.00 C ATOM 1042 CG LEU A 69 1.731 4.391 -8.876 1.00 0.00 C ATOM 1043 CD1 LEU A 69 1.702 3.075 -9.674 1.00 0.00 C ATOM 1044 CD2 LEU A 69 1.831 4.098 -7.369 1.00 0.00 C ATOM 0 H LEU A 69 4.831 6.372 -10.227 1.00 0.00 H new ATOM 0 HA LEU A 69 2.360 5.353 -11.424 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.816 4.674 -9.310 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.057 6.045 -8.526 1.00 0.00 H new ATOM 0 HG LEU A 69 0.803 4.921 -9.091 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.854 2.471 -9.350 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.604 3.296 -10.737 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.627 2.524 -9.501 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.997 3.465 -7.065 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.770 3.586 -7.159 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.797 5.035 -6.813 1.00 0.00 H new ATOM 1056 N GLY A 70 0.655 7.083 -11.349 1.00 0.00 N ATOM 1057 CA GLY A 70 -0.159 8.259 -11.781 1.00 0.00 C ATOM 1058 C GLY A 70 0.167 8.863 -13.175 1.00 0.00 C ATOM 1059 O GLY A 70 -0.744 9.254 -13.906 1.00 0.00 O ATOM 0 H GLY A 70 0.263 6.182 -11.623 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -1.209 7.966 -11.775 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -0.043 9.045 -11.035 1.00 0.00 H new ATOM 1063 N GLU A 71 1.460 8.976 -13.509 1.00 0.00 N ATOM 1064 CA GLU A 71 1.960 9.563 -14.781 1.00 0.00 C ATOM 1065 C GLU A 71 2.106 8.506 -15.935 1.00 0.00 C ATOM 1066 O GLU A 71 1.899 7.291 -15.763 1.00 0.00 O ATOM 1067 CB GLU A 71 3.307 10.258 -14.405 1.00 0.00 C ATOM 1068 CG GLU A 71 3.169 11.598 -13.628 1.00 0.00 C ATOM 1069 CD GLU A 71 4.368 11.959 -12.767 1.00 0.00 C ATOM 1070 OE1 GLU A 71 5.422 12.339 -13.312 1.00 0.00 O ATOM 1071 OE2 GLU A 71 4.255 11.851 -11.527 1.00 0.00 O ATOM 0 H GLU A 71 2.211 8.658 -12.896 1.00 0.00 H new ATOM 0 HA GLU A 71 1.249 10.277 -15.196 1.00 0.00 H new ATOM 0 HB2 GLU A 71 3.898 9.567 -13.803 1.00 0.00 H new ATOM 0 HB3 GLU A 71 3.869 10.444 -15.320 1.00 0.00 H new ATOM 0 HG2 GLU A 71 2.998 12.402 -14.344 1.00 0.00 H new ATOM 0 HG3 GLU A 71 2.285 11.544 -12.992 1.00 0.00 H new ATOM 1078 N LYS A 72 2.418 9.014 -17.148 1.00 0.00 N ATOM 1079 CA LYS A 72 2.694 8.169 -18.345 1.00 0.00 C ATOM 1080 C LYS A 72 4.164 8.224 -18.881 1.00 0.00 C ATOM 1081 O LYS A 72 4.920 9.173 -18.656 1.00 0.00 O ATOM 1082 CB LYS A 72 1.647 8.376 -19.476 1.00 0.00 C ATOM 1083 CG LYS A 72 1.397 9.785 -20.054 1.00 0.00 C ATOM 1084 CD LYS A 72 0.807 9.809 -21.489 1.00 0.00 C ATOM 1085 CE LYS A 72 -0.344 8.839 -21.869 1.00 0.00 C ATOM 1086 NZ LYS A 72 -1.677 9.171 -21.307 1.00 0.00 N ATOM 0 H LYS A 72 2.487 10.015 -17.331 1.00 0.00 H new ATOM 0 HA LYS A 72 2.582 7.150 -17.975 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.937 7.733 -20.307 1.00 0.00 H new ATOM 0 HB3 LYS A 72 0.692 8.005 -19.104 1.00 0.00 H new ATOM 0 HG2 LYS A 72 0.718 10.319 -19.389 1.00 0.00 H new ATOM 0 HG3 LYS A 72 2.339 10.333 -20.055 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.453 10.823 -21.677 1.00 0.00 H new ATOM 0 HD3 LYS A 72 1.629 9.625 -22.181 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.425 8.809 -22.956 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.072 7.836 -21.542 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -2.406 9.030 -22.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -1.875 8.553 -20.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -1.686 10.164 -20.997 1.00 0.00 H new ATOM 1100 N PHE A 73 4.534 7.163 -19.617 1.00 0.00 N ATOM 1101 CA PHE A 73 5.903 6.949 -20.172 1.00 0.00 C ATOM 1102 C PHE A 73 5.856 6.292 -21.601 1.00 0.00 C ATOM 1103 O PHE A 73 4.854 5.688 -22.001 1.00 0.00 O ATOM 1104 CB PHE A 73 6.755 6.139 -19.136 1.00 0.00 C ATOM 1105 CG PHE A 73 6.432 4.636 -18.979 1.00 0.00 C ATOM 1106 CD1 PHE A 73 5.278 4.226 -18.303 1.00 0.00 C ATOM 1107 CD2 PHE A 73 7.225 3.677 -19.621 1.00 0.00 C ATOM 1108 CE1 PHE A 73 4.889 2.890 -18.323 1.00 0.00 C ATOM 1109 CE2 PHE A 73 6.845 2.338 -19.619 1.00 0.00 C ATOM 1110 CZ PHE A 73 5.667 1.949 -18.988 1.00 0.00 C ATOM 0 H PHE A 73 3.887 6.411 -19.853 1.00 0.00 H new ATOM 0 HA PHE A 73 6.393 7.911 -20.324 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.805 6.232 -19.415 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.642 6.613 -18.161 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.686 4.950 -17.763 1.00 0.00 H new ATOM 0 HD2 PHE A 73 8.135 3.977 -20.120 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.983 2.584 -17.822 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.465 1.600 -20.107 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.357 0.915 -19.015 1.00 0.00 H new ATOM 1120 N GLU A 74 6.974 6.350 -22.350 1.00 0.00 N ATOM 1121 CA GLU A 74 7.123 5.602 -23.633 1.00 0.00 C ATOM 1122 C GLU A 74 7.494 4.097 -23.388 1.00 0.00 C ATOM 1123 O GLU A 74 8.633 3.754 -23.057 1.00 0.00 O ATOM 1124 CB GLU A 74 8.152 6.371 -24.509 1.00 0.00 C ATOM 1125 CG GLU A 74 8.267 5.835 -25.956 1.00 0.00 C ATOM 1126 CD GLU A 74 9.147 6.653 -26.887 1.00 0.00 C ATOM 1127 OE1 GLU A 74 8.616 7.556 -27.561 1.00 0.00 O ATOM 1128 OE2 GLU A 74 10.335 6.306 -27.069 1.00 0.00 O ATOM 0 H GLU A 74 7.792 6.904 -22.097 1.00 0.00 H new ATOM 0 HA GLU A 74 6.175 5.558 -24.170 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.871 7.424 -24.543 1.00 0.00 H new ATOM 0 HB3 GLU A 74 9.131 6.318 -24.033 1.00 0.00 H new ATOM 0 HG2 GLU A 74 8.655 4.817 -25.918 1.00 0.00 H new ATOM 0 HG3 GLU A 74 7.267 5.779 -26.385 1.00 0.00 H new ATOM 1135 N GLU A 75 6.508 3.206 -23.574 1.00 0.00 N ATOM 1136 CA GLU A 75 6.677 1.738 -23.429 1.00 0.00 C ATOM 1137 C GLU A 75 6.864 1.089 -24.836 1.00 0.00 C ATOM 1138 O GLU A 75 5.937 1.084 -25.651 1.00 0.00 O ATOM 1139 CB GLU A 75 5.393 1.235 -22.715 1.00 0.00 C ATOM 1140 CG GLU A 75 5.358 -0.268 -22.332 1.00 0.00 C ATOM 1141 CD GLU A 75 4.039 -0.793 -21.770 1.00 0.00 C ATOM 1142 OE1 GLU A 75 2.958 -0.212 -22.034 1.00 0.00 O ATOM 1143 OE2 GLU A 75 4.073 -1.826 -21.069 1.00 0.00 O ATOM 0 H GLU A 75 5.560 3.479 -23.832 1.00 0.00 H new ATOM 0 HA GLU A 75 7.560 1.470 -22.849 1.00 0.00 H new ATOM 0 HB2 GLU A 75 5.255 1.822 -21.807 1.00 0.00 H new ATOM 0 HB3 GLU A 75 4.540 1.443 -23.361 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.609 -0.852 -23.217 1.00 0.00 H new ATOM 0 HG3 GLU A 75 6.141 -0.452 -21.596 1.00 0.00 H new ATOM 1150 N THR A 76 8.042 0.506 -25.125 1.00 0.00 N ATOM 1151 CA THR A 76 8.205 -0.394 -26.311 1.00 0.00 C ATOM 1152 C THR A 76 7.979 -1.865 -25.846 1.00 0.00 C ATOM 1153 O THR A 76 8.812 -2.442 -25.138 1.00 0.00 O ATOM 1154 CB THR A 76 9.571 -0.159 -27.021 1.00 0.00 C ATOM 1155 OG1 THR A 76 9.723 1.224 -27.321 1.00 0.00 O ATOM 1156 CG2 THR A 76 9.718 -0.932 -28.344 1.00 0.00 C ATOM 0 H THR A 76 8.890 0.631 -24.572 1.00 0.00 H new ATOM 0 HA THR A 76 7.458 -0.164 -27.071 1.00 0.00 H new ATOM 0 HB THR A 76 10.332 -0.518 -26.328 1.00 0.00 H new ATOM 0 HG1 THR A 76 10.584 1.369 -27.766 1.00 0.00 H new ATOM 0 HG21 THR A 76 10.693 -0.720 -28.783 1.00 0.00 H new ATOM 0 HG22 THR A 76 9.631 -2.001 -28.152 1.00 0.00 H new ATOM 0 HG23 THR A 76 8.934 -0.622 -29.035 1.00 0.00 H new ATOM 1164 N THR A 77 6.831 -2.455 -26.217 1.00 0.00 N ATOM 1165 CA THR A 77 6.384 -3.767 -25.662 1.00 0.00 C ATOM 1166 C THR A 77 7.126 -4.998 -26.288 1.00 0.00 C ATOM 1167 O THR A 77 7.607 -4.956 -27.427 1.00 0.00 O ATOM 1168 CB THR A 77 4.831 -3.922 -25.777 1.00 0.00 C ATOM 1169 OG1 THR A 77 4.416 -4.078 -27.134 1.00 0.00 O ATOM 1170 CG2 THR A 77 3.975 -2.807 -25.151 1.00 0.00 C ATOM 0 H THR A 77 6.187 -2.053 -26.899 1.00 0.00 H new ATOM 0 HA THR A 77 6.658 -3.760 -24.607 1.00 0.00 H new ATOM 0 HB THR A 77 4.648 -4.820 -25.186 1.00 0.00 H new ATOM 0 HG1 THR A 77 3.580 -4.589 -27.164 1.00 0.00 H new ATOM 0 HG21 THR A 77 2.919 -3.033 -25.298 1.00 0.00 H new ATOM 0 HG22 THR A 77 4.187 -2.742 -24.084 1.00 0.00 H new ATOM 0 HG23 THR A 77 4.212 -1.856 -25.627 1.00 0.00 H new ATOM 1178 N ALA A 78 7.157 -6.137 -25.565 1.00 0.00 N ATOM 1179 CA ALA A 78 7.613 -7.445 -26.133 1.00 0.00 C ATOM 1180 C ALA A 78 6.884 -7.969 -27.423 1.00 0.00 C ATOM 1181 O ALA A 78 7.523 -8.594 -28.274 1.00 0.00 O ATOM 1182 CB ALA A 78 7.546 -8.474 -24.988 1.00 0.00 C ATOM 0 H ALA A 78 6.874 -6.188 -24.586 1.00 0.00 H new ATOM 0 HA ALA A 78 8.624 -7.286 -26.509 1.00 0.00 H new ATOM 0 HB1 ALA A 78 7.870 -9.448 -25.355 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.199 -8.157 -24.175 1.00 0.00 H new ATOM 0 HB3 ALA A 78 6.521 -8.547 -24.623 1.00 0.00 H new ATOM 1188 N ASP A 79 5.584 -7.666 -27.584 1.00 0.00 N ATOM 1189 CA ASP A 79 4.847 -7.800 -28.872 1.00 0.00 C ATOM 1190 C ASP A 79 5.064 -6.696 -29.978 1.00 0.00 C ATOM 1191 O ASP A 79 4.364 -6.724 -30.995 1.00 0.00 O ATOM 1192 CB ASP A 79 3.356 -7.997 -28.469 1.00 0.00 C ATOM 1193 CG ASP A 79 2.562 -6.778 -27.971 1.00 0.00 C ATOM 1194 OD1 ASP A 79 3.045 -6.018 -27.105 1.00 0.00 O ATOM 1195 OD2 ASP A 79 1.432 -6.557 -28.441 1.00 0.00 O ATOM 0 H ASP A 79 5.002 -7.317 -26.822 1.00 0.00 H new ATOM 0 HA ASP A 79 5.264 -8.650 -29.413 1.00 0.00 H new ATOM 0 HB2 ASP A 79 2.830 -8.404 -29.333 1.00 0.00 H new ATOM 0 HB3 ASP A 79 3.322 -8.756 -27.688 1.00 0.00 H new ATOM 1200 N GLY A 80 6.045 -5.778 -29.849 1.00 0.00 N ATOM 1201 CA GLY A 80 6.411 -4.820 -30.929 1.00 0.00 C ATOM 1202 C GLY A 80 5.508 -3.587 -31.143 1.00 0.00 C ATOM 1203 O GLY A 80 5.205 -3.249 -32.289 1.00 0.00 O ATOM 0 H GLY A 80 6.605 -5.675 -29.003 1.00 0.00 H new ATOM 0 HA2 GLY A 80 7.421 -4.463 -30.730 1.00 0.00 H new ATOM 0 HA3 GLY A 80 6.448 -5.373 -31.867 1.00 0.00 H new ATOM 1207 N ARG A 81 5.120 -2.896 -30.062 1.00 0.00 N ATOM 1208 CA ARG A 81 4.257 -1.685 -30.136 1.00 0.00 C ATOM 1209 C ARG A 81 4.852 -0.571 -29.225 1.00 0.00 C ATOM 1210 O ARG A 81 5.133 -0.799 -28.043 1.00 0.00 O ATOM 1211 CB ARG A 81 2.804 -2.017 -29.699 1.00 0.00 C ATOM 1212 CG ARG A 81 2.019 -2.983 -30.627 1.00 0.00 C ATOM 1213 CD ARG A 81 0.577 -3.280 -30.167 1.00 0.00 C ATOM 1214 NE ARG A 81 0.582 -4.069 -28.902 1.00 0.00 N ATOM 1215 CZ ARG A 81 0.314 -3.611 -27.686 1.00 0.00 C ATOM 1216 NH1 ARG A 81 -0.265 -2.471 -27.439 1.00 0.00 N ATOM 1217 NH2 ARG A 81 0.639 -4.354 -26.676 1.00 0.00 N ATOM 0 H ARG A 81 5.388 -3.150 -29.111 1.00 0.00 H new ATOM 0 HA ARG A 81 4.227 -1.334 -31.168 1.00 0.00 H new ATOM 0 HB2 ARG A 81 2.836 -2.451 -28.700 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.246 -1.084 -29.623 1.00 0.00 H new ATOM 0 HG2 ARG A 81 1.987 -2.557 -31.630 1.00 0.00 H new ATOM 0 HG3 ARG A 81 2.566 -3.923 -30.697 1.00 0.00 H new ATOM 0 HD2 ARG A 81 0.038 -2.345 -30.017 1.00 0.00 H new ATOM 0 HD3 ARG A 81 0.048 -3.832 -30.944 1.00 0.00 H new ATOM 0 HE ARG A 81 0.815 -5.059 -28.979 1.00 0.00 H new ATOM 0 HH11 ARG A 81 -0.545 -1.864 -28.209 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -0.439 -2.185 -26.475 1.00 0.00 H new ATOM 0 HH21 ARG A 81 1.085 -5.258 -26.831 1.00 0.00 H new ATOM 0 HH22 ARG A 81 0.449 -4.035 -25.726 1.00 0.00 H new ATOM 1231 N LYS A 82 5.000 0.649 -29.769 1.00 0.00 N ATOM 1232 CA LYS A 82 5.383 1.841 -28.962 1.00 0.00 C ATOM 1233 C LYS A 82 4.106 2.554 -28.421 1.00 0.00 C ATOM 1234 O LYS A 82 3.310 3.103 -29.191 1.00 0.00 O ATOM 1235 CB LYS A 82 6.301 2.779 -29.789 1.00 0.00 C ATOM 1236 CG LYS A 82 7.727 2.207 -30.025 1.00 0.00 C ATOM 1237 CD LYS A 82 8.843 3.228 -30.343 1.00 0.00 C ATOM 1238 CE LYS A 82 9.116 4.201 -29.184 1.00 0.00 C ATOM 1239 NZ LYS A 82 10.315 5.050 -29.399 1.00 0.00 N ATOM 0 H LYS A 82 4.863 0.845 -30.761 1.00 0.00 H new ATOM 0 HA LYS A 82 5.961 1.528 -28.093 1.00 0.00 H new ATOM 0 HB2 LYS A 82 5.833 2.973 -30.754 1.00 0.00 H new ATOM 0 HB3 LYS A 82 6.384 3.737 -29.276 1.00 0.00 H new ATOM 0 HG2 LYS A 82 8.021 1.649 -29.136 1.00 0.00 H new ATOM 0 HG3 LYS A 82 7.675 1.493 -30.847 1.00 0.00 H new ATOM 0 HD2 LYS A 82 9.761 2.691 -30.583 1.00 0.00 H new ATOM 0 HD3 LYS A 82 8.565 3.797 -31.230 1.00 0.00 H new ATOM 0 HE2 LYS A 82 8.246 4.842 -29.045 1.00 0.00 H new ATOM 0 HE3 LYS A 82 9.243 3.632 -28.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 10.613 5.465 -28.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 11.087 4.469 -29.785 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 10.086 5.811 -30.070 1.00 0.00 H new ATOM 1253 N THR A 83 3.910 2.507 -27.095 1.00 0.00 N ATOM 1254 CA THR A 83 2.640 2.923 -26.439 1.00 0.00 C ATOM 1255 C THR A 83 2.939 3.993 -25.351 1.00 0.00 C ATOM 1256 O THR A 83 3.834 3.828 -24.515 1.00 0.00 O ATOM 1257 CB THR A 83 1.847 1.714 -25.840 1.00 0.00 C ATOM 1258 OG1 THR A 83 2.514 1.134 -24.724 1.00 0.00 O ATOM 1259 CG2 THR A 83 1.563 0.537 -26.783 1.00 0.00 C ATOM 0 H THR A 83 4.620 2.182 -26.439 1.00 0.00 H new ATOM 0 HA THR A 83 1.997 3.357 -27.205 1.00 0.00 H new ATOM 0 HB THR A 83 0.902 2.194 -25.585 1.00 0.00 H new ATOM 0 HG1 THR A 83 2.337 1.670 -23.923 1.00 0.00 H new ATOM 0 HG21 THR A 83 1.008 -0.233 -26.247 1.00 0.00 H new ATOM 0 HG22 THR A 83 0.973 0.885 -27.631 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.505 0.122 -27.141 1.00 0.00 H new ATOM 1267 N GLN A 84 2.146 5.073 -25.320 1.00 0.00 N ATOM 1268 CA GLN A 84 2.200 6.073 -24.221 1.00 0.00 C ATOM 1269 C GLN A 84 1.368 5.556 -23.006 1.00 0.00 C ATOM 1270 O GLN A 84 0.134 5.599 -23.003 1.00 0.00 O ATOM 1271 CB GLN A 84 1.719 7.440 -24.775 1.00 0.00 C ATOM 1272 CG GLN A 84 2.714 8.180 -25.709 1.00 0.00 C ATOM 1273 CD GLN A 84 3.982 8.701 -25.012 1.00 0.00 C ATOM 1274 OE1 GLN A 84 3.932 9.365 -23.982 1.00 0.00 O ATOM 1275 NE2 GLN A 84 5.150 8.426 -25.540 1.00 0.00 N ATOM 0 H GLN A 84 1.455 5.285 -26.040 1.00 0.00 H new ATOM 0 HA GLN A 84 3.216 6.215 -23.854 1.00 0.00 H new ATOM 0 HB2 GLN A 84 0.788 7.282 -25.320 1.00 0.00 H new ATOM 0 HB3 GLN A 84 1.489 8.091 -23.932 1.00 0.00 H new ATOM 0 HG2 GLN A 84 3.009 7.504 -26.512 1.00 0.00 H new ATOM 0 HG3 GLN A 84 2.199 9.021 -26.173 1.00 0.00 H new ATOM 0 HE21 GLN A 84 5.205 7.875 -26.396 1.00 0.00 H new ATOM 0 HE22 GLN A 84 6.003 8.763 -25.094 1.00 0.00 H new ATOM 1284 N THR A 85 2.058 5.002 -22.002 1.00 0.00 N ATOM 1285 CA THR A 85 1.437 4.082 -21.012 1.00 0.00 C ATOM 1286 C THR A 85 1.279 4.776 -19.629 1.00 0.00 C ATOM 1287 O THR A 85 2.279 5.023 -18.953 1.00 0.00 O ATOM 1288 CB THR A 85 2.276 2.765 -20.970 1.00 0.00 C ATOM 1289 OG1 THR A 85 2.220 2.070 -22.218 1.00 0.00 O ATOM 1290 CG2 THR A 85 1.782 1.760 -19.928 1.00 0.00 C ATOM 0 H THR A 85 3.052 5.169 -21.844 1.00 0.00 H new ATOM 0 HA THR A 85 0.422 3.818 -21.310 1.00 0.00 H new ATOM 0 HB THR A 85 3.283 3.101 -20.725 1.00 0.00 H new ATOM 0 HG1 THR A 85 2.150 1.106 -22.053 1.00 0.00 H new ATOM 0 HG21 THR A 85 2.411 0.870 -19.954 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.832 2.210 -18.936 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.751 1.483 -20.150 1.00 0.00 H new ATOM 1298 N VAL A 86 0.031 5.040 -19.188 1.00 0.00 N ATOM 1299 CA VAL A 86 -0.254 5.562 -17.814 1.00 0.00 C ATOM 1300 C VAL A 86 -0.450 4.393 -16.785 1.00 0.00 C ATOM 1301 O VAL A 86 -1.292 3.508 -16.987 1.00 0.00 O ATOM 1302 CB VAL A 86 -1.402 6.633 -17.856 1.00 0.00 C ATOM 1303 CG1 VAL A 86 -2.819 6.100 -18.095 1.00 0.00 C ATOM 1304 CG2 VAL A 86 -1.405 7.553 -16.619 1.00 0.00 C ATOM 0 H VAL A 86 -0.804 4.903 -19.757 1.00 0.00 H new ATOM 0 HA VAL A 86 0.616 6.100 -17.436 1.00 0.00 H new ATOM 0 HB VAL A 86 -1.143 7.206 -18.747 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.524 6.931 -18.103 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -2.856 5.583 -19.054 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.086 5.406 -17.298 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.219 8.273 -16.703 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.542 6.953 -15.720 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -0.455 8.085 -16.559 1.00 0.00 H new ATOM 1314 N CYS A 87 0.335 4.389 -15.686 1.00 0.00 N ATOM 1315 CA CYS A 87 0.252 3.318 -14.645 1.00 0.00 C ATOM 1316 C CYS A 87 -0.392 3.839 -13.326 1.00 0.00 C ATOM 1317 O CYS A 87 0.190 4.677 -12.633 1.00 0.00 O ATOM 1318 CB CYS A 87 1.662 2.740 -14.400 1.00 0.00 C ATOM 1319 SG CYS A 87 2.096 1.518 -15.685 1.00 0.00 S ATOM 0 H CYS A 87 1.032 5.107 -15.489 1.00 0.00 H new ATOM 0 HA CYS A 87 -0.400 2.524 -15.009 1.00 0.00 H new ATOM 0 HB2 CYS A 87 2.395 3.547 -14.397 1.00 0.00 H new ATOM 0 HB3 CYS A 87 1.701 2.270 -13.417 1.00 0.00 H new ATOM 0 HG CYS A 87 3.298 1.072 -15.471 1.00 0.00 H new ATOM 1325 N ASN A 88 -1.581 3.326 -12.967 1.00 0.00 N ATOM 1326 CA ASN A 88 -2.359 3.815 -11.788 1.00 0.00 C ATOM 1327 C ASN A 88 -2.672 2.640 -10.812 1.00 0.00 C ATOM 1328 O ASN A 88 -3.356 1.683 -11.186 1.00 0.00 O ATOM 1329 CB ASN A 88 -3.683 4.468 -12.280 1.00 0.00 C ATOM 1330 CG ASN A 88 -3.535 5.812 -12.999 1.00 0.00 C ATOM 1331 OD1 ASN A 88 -3.411 6.864 -12.385 1.00 0.00 O ATOM 1332 ND2 ASN A 88 -3.551 5.824 -14.308 1.00 0.00 N ATOM 0 H ASN A 88 -2.037 2.567 -13.473 1.00 0.00 H new ATOM 0 HA ASN A 88 -1.765 4.555 -11.252 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -4.182 3.770 -12.952 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -4.339 4.607 -11.421 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -3.460 6.707 -14.811 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -3.654 4.951 -14.825 1.00 0.00 H new ATOM 1339 N PHE A 89 -2.221 2.722 -9.546 1.00 0.00 N ATOM 1340 CA PHE A 89 -2.630 1.751 -8.494 1.00 0.00 C ATOM 1341 C PHE A 89 -3.927 2.218 -7.751 1.00 0.00 C ATOM 1342 O PHE A 89 -3.940 3.245 -7.066 1.00 0.00 O ATOM 1343 CB PHE A 89 -1.428 1.499 -7.540 1.00 0.00 C ATOM 1344 CG PHE A 89 -1.678 0.425 -6.465 1.00 0.00 C ATOM 1345 CD1 PHE A 89 -1.673 -0.935 -6.796 1.00 0.00 C ATOM 1346 CD2 PHE A 89 -1.995 0.811 -5.158 1.00 0.00 C ATOM 1347 CE1 PHE A 89 -1.992 -1.891 -5.835 1.00 0.00 C ATOM 1348 CE2 PHE A 89 -2.308 -0.148 -4.200 1.00 0.00 C ATOM 1349 CZ PHE A 89 -2.308 -1.498 -4.541 1.00 0.00 C ATOM 0 H PHE A 89 -1.577 3.443 -9.221 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.895 0.799 -8.954 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.564 1.204 -8.135 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.170 2.436 -7.046 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.421 -1.244 -7.800 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -1.997 1.858 -4.892 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.994 -2.939 -6.096 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.551 0.155 -3.192 1.00 0.00 H new ATOM 0 HZ PHE A 89 -2.554 -2.241 -3.797 1.00 0.00 H new ATOM 1359 N THR A 90 -4.985 1.400 -7.838 1.00 0.00 N ATOM 1360 CA THR A 90 -6.081 1.376 -6.821 1.00 0.00 C ATOM 1361 C THR A 90 -5.859 0.191 -5.821 1.00 0.00 C ATOM 1362 O THR A 90 -5.170 -0.780 -6.153 1.00 0.00 O ATOM 1363 CB THR A 90 -7.462 1.373 -7.550 1.00 0.00 C ATOM 1364 OG1 THR A 90 -8.510 1.563 -6.605 1.00 0.00 O ATOM 1365 CG2 THR A 90 -7.814 0.108 -8.353 1.00 0.00 C ATOM 0 H THR A 90 -5.118 0.737 -8.602 1.00 0.00 H new ATOM 0 HA THR A 90 -6.069 2.275 -6.205 1.00 0.00 H new ATOM 0 HB THR A 90 -7.367 2.185 -8.270 1.00 0.00 H new ATOM 0 HG1 THR A 90 -9.373 1.562 -7.069 1.00 0.00 H new ATOM 0 HG21 THR A 90 -8.796 0.229 -8.811 1.00 0.00 H new ATOM 0 HG22 THR A 90 -7.067 -0.048 -9.131 1.00 0.00 H new ATOM 0 HG23 THR A 90 -7.829 -0.754 -7.686 1.00 0.00 H new ATOM 1373 N ASP A 91 -6.421 0.258 -4.595 1.00 0.00 N ATOM 1374 CA ASP A 91 -6.101 -0.690 -3.496 1.00 0.00 C ATOM 1375 C ASP A 91 -6.421 -2.199 -3.816 1.00 0.00 C ATOM 1376 O ASP A 91 -7.556 -2.674 -3.719 1.00 0.00 O ATOM 1377 CB ASP A 91 -6.736 -0.144 -2.190 1.00 0.00 C ATOM 1378 CG ASP A 91 -6.150 -0.752 -0.914 1.00 0.00 C ATOM 1379 OD1 ASP A 91 -4.958 -0.512 -0.615 1.00 0.00 O ATOM 1380 OD2 ASP A 91 -6.868 -1.493 -0.215 1.00 0.00 O ATOM 0 H ASP A 91 -7.107 0.967 -4.336 1.00 0.00 H new ATOM 0 HA ASP A 91 -5.020 -0.732 -3.364 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -6.605 0.938 -2.159 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -7.809 -0.335 -2.212 1.00 0.00 H new ATOM 1385 N GLY A 92 -5.375 -2.910 -4.266 1.00 0.00 N ATOM 1386 CA GLY A 92 -5.489 -4.290 -4.813 1.00 0.00 C ATOM 1387 C GLY A 92 -5.171 -4.518 -6.316 1.00 0.00 C ATOM 1388 O GLY A 92 -5.000 -5.679 -6.698 1.00 0.00 O ATOM 0 H GLY A 92 -4.420 -2.552 -4.265 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.827 -4.933 -4.233 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -6.507 -4.635 -4.633 1.00 0.00 H new ATOM 1392 N ALA A 93 -5.118 -3.472 -7.168 1.00 0.00 N ATOM 1393 CA ALA A 93 -4.951 -3.610 -8.636 1.00 0.00 C ATOM 1394 C ALA A 93 -4.066 -2.481 -9.257 1.00 0.00 C ATOM 1395 O ALA A 93 -4.366 -1.288 -9.126 1.00 0.00 O ATOM 1396 CB ALA A 93 -6.362 -3.604 -9.258 1.00 0.00 C ATOM 0 H ALA A 93 -5.190 -2.503 -6.858 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.426 -4.541 -8.850 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.283 -3.704 -10.341 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -6.940 -4.437 -8.858 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -6.862 -2.666 -9.016 1.00 0.00 H new ATOM 1402 N LEU A 94 -3.009 -2.866 -9.999 1.00 0.00 N ATOM 1403 CA LEU A 94 -2.231 -1.920 -10.851 1.00 0.00 C ATOM 1404 C LEU A 94 -2.833 -1.878 -12.293 1.00 0.00 C ATOM 1405 O LEU A 94 -2.684 -2.820 -13.080 1.00 0.00 O ATOM 1406 CB LEU A 94 -0.732 -2.329 -10.798 1.00 0.00 C ATOM 1407 CG LEU A 94 0.275 -1.492 -11.633 1.00 0.00 C ATOM 1408 CD1 LEU A 94 0.379 -0.031 -11.160 1.00 0.00 C ATOM 1409 CD2 LEU A 94 1.672 -2.134 -11.577 1.00 0.00 C ATOM 0 H LEU A 94 -2.667 -3.826 -10.031 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.299 -0.898 -10.478 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.412 -2.297 -9.756 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.656 -3.367 -11.123 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.104 -1.484 -12.655 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.098 0.503 -11.782 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.597 0.448 -11.241 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.710 -0.007 -10.122 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.370 -1.539 -12.166 1.00 0.00 H new ATOM 0 HD22 LEU A 94 2.013 -2.174 -10.542 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.625 -3.144 -11.983 1.00 0.00 H new ATOM 1421 N VAL A 95 -3.509 -0.767 -12.627 1.00 0.00 N ATOM 1422 CA VAL A 95 -4.159 -0.558 -13.952 1.00 0.00 C ATOM 1423 C VAL A 95 -3.119 0.112 -14.908 1.00 0.00 C ATOM 1424 O VAL A 95 -2.816 1.307 -14.803 1.00 0.00 O ATOM 1425 CB VAL A 95 -5.484 0.272 -13.801 1.00 0.00 C ATOM 1426 CG1 VAL A 95 -6.188 0.559 -15.151 1.00 0.00 C ATOM 1427 CG2 VAL A 95 -6.544 -0.396 -12.891 1.00 0.00 C ATOM 0 H VAL A 95 -3.626 0.021 -11.990 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.460 -1.511 -14.388 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.131 1.198 -13.347 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.096 1.136 -14.973 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -5.518 1.127 -15.797 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.446 -0.383 -15.634 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.429 0.238 -12.837 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.818 -1.367 -13.304 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.132 -0.530 -11.891 1.00 0.00 H new ATOM 1437 N GLN A 96 -2.607 -0.674 -15.865 1.00 0.00 N ATOM 1438 CA GLN A 96 -1.774 -0.159 -16.977 1.00 0.00 C ATOM 1439 C GLN A 96 -2.689 0.198 -18.194 1.00 0.00 C ATOM 1440 O GLN A 96 -3.101 -0.678 -18.958 1.00 0.00 O ATOM 1441 CB GLN A 96 -0.690 -1.241 -17.240 1.00 0.00 C ATOM 1442 CG GLN A 96 0.224 -0.931 -18.445 1.00 0.00 C ATOM 1443 CD GLN A 96 1.426 -1.854 -18.657 1.00 0.00 C ATOM 1444 OE1 GLN A 96 2.241 -2.080 -17.767 1.00 0.00 O ATOM 1445 NE2 GLN A 96 1.601 -2.377 -19.844 1.00 0.00 N ATOM 0 H GLN A 96 -2.754 -1.683 -15.896 1.00 0.00 H new ATOM 0 HA GLN A 96 -1.259 0.775 -16.751 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -0.074 -1.348 -16.347 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -1.181 -2.200 -17.406 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -0.386 -0.955 -19.348 1.00 0.00 H new ATOM 0 HG3 GLN A 96 0.594 0.089 -18.337 1.00 0.00 H new ATOM 0 HE21 GLN A 96 0.927 -2.193 -20.587 1.00 0.00 H new ATOM 0 HE22 GLN A 96 2.411 -2.969 -20.026 1.00 0.00 H new ATOM 1454 N HIS A 97 -2.998 1.493 -18.374 1.00 0.00 N ATOM 1455 CA HIS A 97 -3.761 1.989 -19.554 1.00 0.00 C ATOM 1456 C HIS A 97 -2.748 2.441 -20.654 1.00 0.00 C ATOM 1457 O HIS A 97 -2.104 3.487 -20.526 1.00 0.00 O ATOM 1458 CB HIS A 97 -4.710 3.095 -19.019 1.00 0.00 C ATOM 1459 CG HIS A 97 -5.625 3.807 -20.018 1.00 0.00 C ATOM 1460 ND1 HIS A 97 -5.360 5.019 -20.637 1.00 0.00 N ATOM 1461 CD2 HIS A 97 -6.876 3.333 -20.425 1.00 0.00 C ATOM 1462 CE1 HIS A 97 -6.493 5.160 -21.400 1.00 0.00 C ATOM 1463 NE2 HIS A 97 -7.485 4.232 -21.273 1.00 0.00 N ATOM 0 H HIS A 97 -2.733 2.227 -17.718 1.00 0.00 H new ATOM 0 HA HIS A 97 -4.380 1.235 -20.041 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -5.340 2.650 -18.249 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -4.097 3.852 -18.530 1.00 0.00 H new ATOM 0 HD1 HIS A 97 -4.551 5.634 -20.550 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -7.306 2.391 -20.117 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -6.597 5.988 -22.086 1.00 0.00 H new ATOM 1472 N GLN A 98 -2.585 1.618 -21.703 1.00 0.00 N ATOM 1473 CA GLN A 98 -1.562 1.852 -22.769 1.00 0.00 C ATOM 1474 C GLN A 98 -2.175 2.394 -24.095 1.00 0.00 C ATOM 1475 O GLN A 98 -3.098 1.787 -24.641 1.00 0.00 O ATOM 1476 CB GLN A 98 -0.634 0.621 -22.941 1.00 0.00 C ATOM 1477 CG GLN A 98 -1.246 -0.742 -23.363 1.00 0.00 C ATOM 1478 CD GLN A 98 -0.277 -1.872 -23.753 1.00 0.00 C ATOM 1479 OE1 GLN A 98 -0.591 -2.696 -24.607 1.00 0.00 O ATOM 1480 NE2 GLN A 98 0.899 -2.008 -23.181 1.00 0.00 N ATOM 0 H GLN A 98 -3.145 0.778 -21.847 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.916 2.663 -22.433 1.00 0.00 H new ATOM 0 HB2 GLN A 98 0.123 0.883 -23.681 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -0.115 0.468 -21.995 1.00 0.00 H new ATOM 0 HG2 GLN A 98 -1.865 -1.100 -22.541 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -1.911 -0.564 -24.208 1.00 0.00 H new ATOM 0 HE21 GLN A 98 1.198 -1.345 -22.466 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.512 -2.777 -23.452 1.00 0.00 H new ATOM 1489 N GLU A 99 -1.666 3.541 -24.587 1.00 0.00 N ATOM 1490 CA GLU A 99 -2.332 4.355 -25.648 1.00 0.00 C ATOM 1491 C GLU A 99 -1.406 4.506 -26.907 1.00 0.00 C ATOM 1492 O GLU A 99 -0.246 4.918 -26.789 1.00 0.00 O ATOM 1493 CB GLU A 99 -2.650 5.747 -25.020 1.00 0.00 C ATOM 1494 CG GLU A 99 -3.701 5.776 -23.867 1.00 0.00 C ATOM 1495 CD GLU A 99 -3.407 6.757 -22.740 1.00 0.00 C ATOM 1496 OE1 GLU A 99 -3.374 7.983 -22.971 1.00 0.00 O ATOM 1497 OE2 GLU A 99 -3.219 6.319 -21.585 1.00 0.00 O ATOM 0 H GLU A 99 -0.782 3.937 -24.267 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.245 3.868 -25.989 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -1.719 6.169 -24.642 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -2.999 6.406 -25.815 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -4.675 6.018 -24.292 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -3.778 4.775 -23.443 1.00 0.00 H new ATOM 1504 N TRP A 100 -1.894 4.177 -28.121 1.00 0.00 N ATOM 1505 CA TRP A 100 -1.065 4.198 -29.369 1.00 0.00 C ATOM 1506 C TRP A 100 -1.930 4.426 -30.650 1.00 0.00 C ATOM 1507 O TRP A 100 -2.852 3.651 -30.904 1.00 0.00 O ATOM 1508 CB TRP A 100 -0.168 2.921 -29.475 1.00 0.00 C ATOM 1509 CG TRP A 100 -0.816 1.579 -29.878 1.00 0.00 C ATOM 1510 CD1 TRP A 100 -0.763 1.021 -31.175 1.00 0.00 C ATOM 1511 CD2 TRP A 100 -1.628 0.728 -29.145 1.00 0.00 C ATOM 1512 NE1 TRP A 100 -1.517 -0.166 -31.269 1.00 0.00 N ATOM 1513 CE2 TRP A 100 -2.068 -0.309 -30.009 1.00 0.00 C ATOM 1514 CE3 TRP A 100 -2.077 0.776 -27.801 1.00 0.00 C ATOM 1515 CZ2 TRP A 100 -2.986 -1.280 -29.544 1.00 0.00 C ATOM 1516 CZ3 TRP A 100 -2.977 -0.194 -27.365 1.00 0.00 C ATOM 1517 CH2 TRP A 100 -3.440 -1.194 -28.226 1.00 0.00 C ATOM 0 H TRP A 100 -2.861 3.891 -28.275 1.00 0.00 H new ATOM 0 HA TRP A 100 -0.396 5.056 -29.300 1.00 0.00 H new ATOM 0 HB2 TRP A 100 0.622 3.134 -30.195 1.00 0.00 H new ATOM 0 HB3 TRP A 100 0.313 2.776 -28.508 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -0.211 1.453 -31.996 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -1.630 -0.777 -32.078 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -1.729 1.547 -27.130 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -3.328 -2.071 -30.195 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -3.324 -0.173 -26.342 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -4.161 -1.912 -27.865 1.00 0.00 H new ATOM 1528 N ASP A 101 -1.619 5.438 -31.492 1.00 0.00 N ATOM 1529 CA ASP A 101 -2.245 5.618 -32.850 1.00 0.00 C ATOM 1530 C ASP A 101 -3.827 5.560 -32.916 1.00 0.00 C ATOM 1531 O ASP A 101 -4.418 4.781 -33.672 1.00 0.00 O ATOM 1532 CB ASP A 101 -1.468 4.667 -33.812 1.00 0.00 C ATOM 1533 CG ASP A 101 -1.757 4.825 -35.301 1.00 0.00 C ATOM 1534 OD1 ASP A 101 -1.396 5.867 -35.884 1.00 0.00 O ATOM 1535 OD2 ASP A 101 -2.343 3.891 -35.890 1.00 0.00 O ATOM 0 H ASP A 101 -0.932 6.157 -31.264 1.00 0.00 H new ATOM 0 HA ASP A 101 -2.131 6.651 -33.178 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -0.400 4.818 -33.653 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -1.690 3.638 -33.528 1.00 0.00 H new ATOM 1540 N GLY A 102 -4.518 6.340 -32.060 1.00 0.00 N ATOM 1541 CA GLY A 102 -5.991 6.173 -31.837 1.00 0.00 C ATOM 1542 C GLY A 102 -6.516 4.992 -30.966 1.00 0.00 C ATOM 1543 O GLY A 102 -7.692 4.996 -30.603 1.00 0.00 O ATOM 0 H GLY A 102 -4.095 7.088 -31.511 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -6.358 7.096 -31.388 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -6.460 6.087 -32.817 1.00 0.00 H new ATOM 1547 N LYS A 103 -5.686 3.984 -30.665 1.00 0.00 N ATOM 1548 CA LYS A 103 -6.085 2.731 -29.972 1.00 0.00 C ATOM 1549 C LYS A 103 -5.639 2.724 -28.476 1.00 0.00 C ATOM 1550 O LYS A 103 -4.614 3.311 -28.108 1.00 0.00 O ATOM 1551 CB LYS A 103 -5.403 1.539 -30.709 1.00 0.00 C ATOM 1552 CG LYS A 103 -5.706 1.357 -32.223 1.00 0.00 C ATOM 1553 CD LYS A 103 -4.443 1.484 -33.106 1.00 0.00 C ATOM 1554 CE LYS A 103 -4.777 1.560 -34.603 1.00 0.00 C ATOM 1555 NZ LYS A 103 -3.538 1.647 -35.421 1.00 0.00 N ATOM 0 H LYS A 103 -4.693 4.009 -30.898 1.00 0.00 H new ATOM 0 HA LYS A 103 -7.172 2.650 -29.993 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -4.324 1.646 -30.593 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -5.689 0.620 -30.197 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -6.159 0.379 -32.383 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.438 2.102 -32.535 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -3.888 2.376 -32.815 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -3.790 0.630 -32.926 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -5.350 0.681 -34.897 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -5.406 2.429 -34.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -3.637 1.048 -36.266 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -3.383 2.633 -35.712 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -2.727 1.320 -34.858 1.00 0.00 H new ATOM 1569 N GLU A 104 -6.377 1.994 -27.620 1.00 0.00 N ATOM 1570 CA GLU A 104 -6.005 1.820 -26.188 1.00 0.00 C ATOM 1571 C GLU A 104 -6.328 0.402 -25.615 1.00 0.00 C ATOM 1572 O GLU A 104 -7.274 -0.273 -26.034 1.00 0.00 O ATOM 1573 CB GLU A 104 -6.571 2.968 -25.307 1.00 0.00 C ATOM 1574 CG GLU A 104 -8.114 3.114 -25.251 1.00 0.00 C ATOM 1575 CD GLU A 104 -8.582 4.056 -24.161 1.00 0.00 C ATOM 1576 OE1 GLU A 104 -8.242 5.256 -24.194 1.00 0.00 O ATOM 1577 OE2 GLU A 104 -9.215 3.582 -23.193 1.00 0.00 O ATOM 0 H GLU A 104 -7.235 1.512 -27.887 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.918 1.888 -26.151 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.207 2.826 -24.290 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -6.154 3.909 -25.667 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -8.474 3.475 -26.214 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -8.560 2.133 -25.091 1.00 0.00 H new ATOM 1584 N SER A 105 -5.527 -0.031 -24.622 1.00 0.00 N ATOM 1585 CA SER A 105 -5.760 -1.299 -23.876 1.00 0.00 C ATOM 1586 C SER A 105 -5.542 -1.103 -22.344 1.00 0.00 C ATOM 1587 O SER A 105 -4.527 -0.548 -21.905 1.00 0.00 O ATOM 1588 CB SER A 105 -4.859 -2.419 -24.459 1.00 0.00 C ATOM 1589 OG SER A 105 -5.083 -3.680 -23.819 1.00 0.00 O ATOM 0 H SER A 105 -4.702 0.481 -24.310 1.00 0.00 H new ATOM 0 HA SER A 105 -6.800 -1.601 -24.001 1.00 0.00 H new ATOM 0 HB2 SER A 105 -5.049 -2.517 -25.528 1.00 0.00 H new ATOM 0 HB3 SER A 105 -3.812 -2.137 -24.346 1.00 0.00 H new ATOM 0 HG SER A 105 -5.877 -3.620 -23.248 1.00 0.00 H new ATOM 1595 N THR A 106 -6.494 -1.600 -21.530 1.00 0.00 N ATOM 1596 CA THR A 106 -6.320 -1.703 -20.050 1.00 0.00 C ATOM 1597 C THR A 106 -5.728 -3.095 -19.666 1.00 0.00 C ATOM 1598 O THR A 106 -6.217 -4.149 -20.087 1.00 0.00 O ATOM 1599 CB THR A 106 -7.632 -1.453 -19.242 1.00 0.00 C ATOM 1600 OG1 THR A 106 -8.697 -2.283 -19.679 1.00 0.00 O ATOM 1601 CG2 THR A 106 -8.158 -0.019 -19.275 1.00 0.00 C ATOM 0 H THR A 106 -7.396 -1.939 -21.864 1.00 0.00 H new ATOM 0 HA THR A 106 -5.627 -0.907 -19.777 1.00 0.00 H new ATOM 0 HB THR A 106 -7.326 -1.686 -18.222 1.00 0.00 H new ATOM 0 HG1 THR A 106 -9.498 -2.095 -19.146 1.00 0.00 H new ATOM 0 HG21 THR A 106 -9.071 0.047 -18.684 1.00 0.00 H new ATOM 0 HG22 THR A 106 -7.407 0.654 -18.860 1.00 0.00 H new ATOM 0 HG23 THR A 106 -8.371 0.267 -20.305 1.00 0.00 H new ATOM 1609 N ILE A 107 -4.669 -3.078 -18.844 1.00 0.00 N ATOM 1610 CA ILE A 107 -3.978 -4.312 -18.367 1.00 0.00 C ATOM 1611 C ILE A 107 -3.998 -4.232 -16.806 1.00 0.00 C ATOM 1612 O ILE A 107 -3.186 -3.530 -16.193 1.00 0.00 O ATOM 1613 CB ILE A 107 -2.571 -4.461 -19.057 1.00 0.00 C ATOM 1614 CG1 ILE A 107 -2.697 -4.601 -20.607 1.00 0.00 C ATOM 1615 CG2 ILE A 107 -1.755 -5.636 -18.459 1.00 0.00 C ATOM 1616 CD1 ILE A 107 -1.397 -4.672 -21.415 1.00 0.00 C ATOM 0 H ILE A 107 -4.258 -2.216 -18.485 1.00 0.00 H new ATOM 0 HA ILE A 107 -4.473 -5.240 -18.652 1.00 0.00 H new ATOM 0 HB ILE A 107 -2.023 -3.541 -18.851 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -3.275 -5.501 -20.818 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -3.277 -3.755 -20.976 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.791 -5.703 -18.963 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -1.596 -5.464 -17.394 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.303 -6.568 -18.598 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -1.632 -4.768 -22.475 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -0.818 -3.763 -21.253 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -0.815 -5.536 -21.093 1.00 0.00 H new ATOM 1628 N THR A 108 -4.961 -4.924 -16.168 1.00 0.00 N ATOM 1629 CA THR A 108 -5.238 -4.779 -14.709 1.00 0.00 C ATOM 1630 C THR A 108 -4.546 -5.929 -13.914 1.00 0.00 C ATOM 1631 O THR A 108 -5.041 -7.059 -13.863 1.00 0.00 O ATOM 1632 CB THR A 108 -6.781 -4.699 -14.499 1.00 0.00 C ATOM 1633 OG1 THR A 108 -7.319 -3.595 -15.222 1.00 0.00 O ATOM 1634 CG2 THR A 108 -7.215 -4.488 -13.042 1.00 0.00 C ATOM 0 H THR A 108 -5.569 -5.596 -16.636 1.00 0.00 H new ATOM 0 HA THR A 108 -4.813 -3.855 -14.316 1.00 0.00 H new ATOM 0 HB THR A 108 -7.150 -5.665 -14.844 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.288 -3.555 -15.085 1.00 0.00 H new ATOM 0 HG21 THR A 108 -8.303 -4.444 -12.989 1.00 0.00 H new ATOM 0 HG22 THR A 108 -6.855 -5.316 -12.432 1.00 0.00 H new ATOM 0 HG23 THR A 108 -6.796 -3.553 -12.669 1.00 0.00 H new ATOM 1642 N ARG A 109 -3.402 -5.628 -13.277 1.00 0.00 N ATOM 1643 CA ARG A 109 -2.618 -6.627 -12.500 1.00 0.00 C ATOM 1644 C ARG A 109 -3.130 -6.683 -11.023 1.00 0.00 C ATOM 1645 O ARG A 109 -2.766 -5.823 -10.212 1.00 0.00 O ATOM 1646 CB ARG A 109 -1.100 -6.284 -12.576 1.00 0.00 C ATOM 1647 CG ARG A 109 -0.446 -6.118 -13.972 1.00 0.00 C ATOM 1648 CD ARG A 109 1.090 -6.006 -13.876 1.00 0.00 C ATOM 1649 NE ARG A 109 1.733 -5.952 -15.221 1.00 0.00 N ATOM 1650 CZ ARG A 109 1.921 -4.844 -15.942 1.00 0.00 C ATOM 1651 NH1 ARG A 109 1.530 -3.656 -15.563 1.00 0.00 N ATOM 1652 NH2 ARG A 109 2.525 -4.937 -17.090 1.00 0.00 N ATOM 0 H ARG A 109 -2.990 -4.695 -13.280 1.00 0.00 H new ATOM 0 HA ARG A 109 -2.757 -7.618 -12.933 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -0.942 -5.357 -12.024 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -0.557 -7.067 -12.047 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -0.710 -6.969 -14.600 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -0.846 -5.227 -14.457 1.00 0.00 H new ATOM 0 HD2 ARG A 109 1.353 -5.111 -13.312 1.00 0.00 H new ATOM 0 HD3 ARG A 109 1.481 -6.859 -13.321 1.00 0.00 H new ATOM 0 HE ARG A 109 2.055 -6.833 -15.622 1.00 0.00 H new ATOM 0 HH11 ARG A 109 1.051 -3.537 -14.670 1.00 0.00 H new ATOM 0 HH12 ARG A 109 1.704 -2.847 -16.160 1.00 0.00 H new ATOM 0 HH21 ARG A 109 2.846 -5.845 -17.425 1.00 0.00 H new ATOM 0 HH22 ARG A 109 2.678 -4.102 -17.655 1.00 0.00 H new ATOM 1666 N LYS A 110 -3.997 -7.661 -10.684 1.00 0.00 N ATOM 1667 CA LYS A 110 -4.689 -7.710 -9.360 1.00 0.00 C ATOM 1668 C LYS A 110 -4.425 -9.023 -8.549 1.00 0.00 C ATOM 1669 O LYS A 110 -4.286 -10.113 -9.109 1.00 0.00 O ATOM 1670 CB LYS A 110 -6.199 -7.374 -9.542 1.00 0.00 C ATOM 1671 CG LYS A 110 -7.071 -8.373 -10.344 1.00 0.00 C ATOM 1672 CD LYS A 110 -8.599 -8.223 -10.148 1.00 0.00 C ATOM 1673 CE LYS A 110 -9.317 -7.110 -10.932 1.00 0.00 C ATOM 1674 NZ LYS A 110 -9.302 -5.814 -10.206 1.00 0.00 N ATOM 0 H LYS A 110 -4.241 -8.433 -11.305 1.00 0.00 H new ATOM 0 HA LYS A 110 -4.248 -6.940 -8.727 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -6.640 -7.266 -8.551 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -6.269 -6.402 -10.030 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -6.844 -8.258 -11.404 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -6.783 -9.387 -10.065 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -9.065 -9.172 -10.411 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -8.786 -8.059 -9.087 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -8.839 -6.986 -11.904 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -10.349 -7.408 -11.120 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -9.909 -5.131 -10.702 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -9.657 -5.954 -9.239 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -8.329 -5.449 -10.168 1.00 0.00 H new ATOM 1688 N LEU A 111 -4.363 -8.915 -7.210 1.00 0.00 N ATOM 1689 CA LEU A 111 -3.928 -10.036 -6.323 1.00 0.00 C ATOM 1690 C LEU A 111 -5.129 -10.911 -5.838 1.00 0.00 C ATOM 1691 O LEU A 111 -5.984 -10.438 -5.082 1.00 0.00 O ATOM 1692 CB LEU A 111 -3.110 -9.427 -5.138 1.00 0.00 C ATOM 1693 CG LEU A 111 -1.776 -10.110 -4.746 1.00 0.00 C ATOM 1694 CD1 LEU A 111 -1.936 -11.519 -4.155 1.00 0.00 C ATOM 1695 CD2 LEU A 111 -0.754 -10.144 -5.891 1.00 0.00 C ATOM 0 H LEU A 111 -4.608 -8.063 -6.706 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.294 -10.722 -6.884 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.893 -8.387 -5.382 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.753 -9.420 -4.258 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.390 -9.468 -3.954 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.954 -11.924 -3.908 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -2.545 -11.468 -3.252 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -2.423 -12.166 -4.884 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.158 -10.635 -5.551 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -1.170 -10.695 -6.734 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -0.523 -9.125 -6.203 1.00 0.00 H new ATOM 1707 N LYS A 112 -5.199 -12.182 -6.274 1.00 0.00 N ATOM 1708 CA LYS A 112 -6.308 -13.116 -5.907 1.00 0.00 C ATOM 1709 C LYS A 112 -5.702 -14.497 -5.501 1.00 0.00 C ATOM 1710 O LYS A 112 -5.094 -15.178 -6.331 1.00 0.00 O ATOM 1711 CB LYS A 112 -7.305 -13.236 -7.102 1.00 0.00 C ATOM 1712 CG LYS A 112 -8.254 -12.021 -7.295 1.00 0.00 C ATOM 1713 CD LYS A 112 -8.619 -11.672 -8.756 1.00 0.00 C ATOM 1714 CE LYS A 112 -9.793 -12.408 -9.433 1.00 0.00 C ATOM 1715 NZ LYS A 112 -9.443 -13.807 -9.789 1.00 0.00 N ATOM 0 H LYS A 112 -4.499 -12.600 -6.887 1.00 0.00 H new ATOM 0 HA LYS A 112 -6.866 -12.733 -5.053 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.733 -13.379 -8.019 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -7.911 -14.131 -6.961 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -9.176 -12.215 -6.747 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.790 -11.147 -6.838 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -8.835 -10.604 -8.794 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -7.731 -11.840 -9.365 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -10.654 -12.409 -8.765 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -10.089 -11.868 -10.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -9.388 -13.899 -10.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -8.523 -14.052 -9.370 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -10.173 -14.451 -9.423 1.00 0.00 H new ATOM 1729 N ASP A 113 -5.864 -14.898 -4.219 1.00 0.00 N ATOM 1730 CA ASP A 113 -5.322 -16.180 -3.658 1.00 0.00 C ATOM 1731 C ASP A 113 -3.763 -16.355 -3.775 1.00 0.00 C ATOM 1732 O ASP A 113 -3.272 -17.290 -4.415 1.00 0.00 O ATOM 1733 CB ASP A 113 -6.183 -17.372 -4.174 1.00 0.00 C ATOM 1734 CG ASP A 113 -5.882 -18.716 -3.512 1.00 0.00 C ATOM 1735 OD1 ASP A 113 -6.217 -18.885 -2.321 1.00 0.00 O ATOM 1736 OD2 ASP A 113 -5.290 -19.596 -4.176 1.00 0.00 O ATOM 0 H ASP A 113 -6.376 -14.345 -3.532 1.00 0.00 H new ATOM 0 HA ASP A 113 -5.430 -16.150 -2.574 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -7.236 -17.135 -4.019 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -6.033 -17.471 -5.249 1.00 0.00 H new ATOM 1741 N GLY A 114 -2.969 -15.425 -3.201 1.00 0.00 N ATOM 1742 CA GLY A 114 -1.482 -15.385 -3.407 1.00 0.00 C ATOM 1743 C GLY A 114 -0.930 -15.513 -4.858 1.00 0.00 C ATOM 1744 O GLY A 114 0.007 -16.276 -5.108 1.00 0.00 O ATOM 0 H GLY A 114 -3.321 -14.688 -2.590 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -1.115 -14.445 -2.994 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -1.043 -16.187 -2.813 1.00 0.00 H new ATOM 1748 N LYS A 115 -1.591 -14.839 -5.805 1.00 0.00 N ATOM 1749 CA LYS A 115 -1.452 -15.102 -7.261 1.00 0.00 C ATOM 1750 C LYS A 115 -1.792 -13.776 -8.001 1.00 0.00 C ATOM 1751 O LYS A 115 -2.849 -13.172 -7.763 1.00 0.00 O ATOM 1752 CB LYS A 115 -2.403 -16.266 -7.702 1.00 0.00 C ATOM 1753 CG LYS A 115 -1.778 -17.355 -8.602 1.00 0.00 C ATOM 1754 CD LYS A 115 -0.738 -18.293 -7.940 1.00 0.00 C ATOM 1755 CE LYS A 115 -1.273 -19.350 -6.944 1.00 0.00 C ATOM 1756 NZ LYS A 115 -1.364 -18.829 -5.553 1.00 0.00 N ATOM 0 H LYS A 115 -2.246 -14.087 -5.592 1.00 0.00 H new ATOM 0 HA LYS A 115 -0.438 -15.418 -7.507 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.795 -16.746 -6.805 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -3.253 -15.833 -8.229 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.584 -17.970 -9.002 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -1.301 -16.863 -9.450 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -0.202 -18.816 -8.732 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -0.009 -17.674 -7.417 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -2.259 -19.684 -7.268 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.620 -20.222 -6.960 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -1.173 -19.599 -4.881 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -0.664 -18.071 -5.420 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -2.319 -18.452 -5.385 1.00 0.00 H new ATOM 1770 N LEU A 116 -0.917 -13.323 -8.913 1.00 0.00 N ATOM 1771 CA LEU A 116 -1.170 -12.076 -9.683 1.00 0.00 C ATOM 1772 C LEU A 116 -1.993 -12.409 -10.967 1.00 0.00 C ATOM 1773 O LEU A 116 -1.496 -12.997 -11.933 1.00 0.00 O ATOM 1774 CB LEU A 116 0.174 -11.345 -9.924 1.00 0.00 C ATOM 1775 CG LEU A 116 0.073 -9.941 -10.577 1.00 0.00 C ATOM 1776 CD1 LEU A 116 -0.311 -8.875 -9.535 1.00 0.00 C ATOM 1777 CD2 LEU A 116 1.408 -9.575 -11.238 1.00 0.00 C ATOM 0 H LEU A 116 -0.038 -13.788 -9.139 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.789 -11.373 -9.125 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.687 -11.244 -8.968 1.00 0.00 H new ATOM 0 HB3 LEU A 116 0.800 -11.975 -10.556 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.708 -9.971 -11.337 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -0.375 -7.900 -10.018 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -1.276 -9.127 -9.096 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.446 -8.842 -8.752 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.330 -8.588 -11.694 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.196 -9.565 -10.485 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.648 -10.311 -12.005 1.00 0.00 H new ATOM 1789 N VAL A 117 -3.281 -12.045 -10.945 1.00 0.00 N ATOM 1790 CA VAL A 117 -4.232 -12.313 -12.056 1.00 0.00 C ATOM 1791 C VAL A 117 -4.259 -11.026 -12.940 1.00 0.00 C ATOM 1792 O VAL A 117 -4.762 -9.969 -12.538 1.00 0.00 O ATOM 1793 CB VAL A 117 -5.627 -12.743 -11.486 1.00 0.00 C ATOM 1794 CG1 VAL A 117 -6.670 -13.019 -12.593 1.00 0.00 C ATOM 1795 CG2 VAL A 117 -5.562 -14.014 -10.600 1.00 0.00 C ATOM 0 H VAL A 117 -3.705 -11.554 -10.158 1.00 0.00 H new ATOM 0 HA VAL A 117 -3.925 -13.151 -12.682 1.00 0.00 H new ATOM 0 HB VAL A 117 -5.932 -11.887 -10.884 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.616 -13.313 -12.137 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.818 -12.117 -13.187 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.313 -13.823 -13.237 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -6.561 -14.257 -10.238 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.176 -14.847 -11.187 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -4.903 -13.833 -9.751 1.00 0.00 H new ATOM 1805 N VAL A 118 -3.675 -11.132 -14.140 1.00 0.00 N ATOM 1806 CA VAL A 118 -3.512 -9.989 -15.077 1.00 0.00 C ATOM 1807 C VAL A 118 -4.716 -10.022 -16.070 1.00 0.00 C ATOM 1808 O VAL A 118 -4.750 -10.801 -17.031 1.00 0.00 O ATOM 1809 CB VAL A 118 -2.085 -10.028 -15.721 1.00 0.00 C ATOM 1810 CG1 VAL A 118 -1.874 -8.950 -16.806 1.00 0.00 C ATOM 1811 CG2 VAL A 118 -0.946 -9.888 -14.680 1.00 0.00 C ATOM 0 H VAL A 118 -3.298 -12.009 -14.499 1.00 0.00 H new ATOM 0 HA VAL A 118 -3.548 -9.019 -14.580 1.00 0.00 H new ATOM 0 HB VAL A 118 -2.037 -11.014 -16.182 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.865 -9.033 -17.210 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.599 -9.093 -17.607 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -2.009 -7.961 -16.368 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.018 -9.922 -15.188 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -1.046 -8.937 -14.156 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.007 -10.706 -13.962 1.00 0.00 H new ATOM 1821 N GLU A 119 -5.705 -9.160 -15.790 1.00 0.00 N ATOM 1822 CA GLU A 119 -6.982 -9.089 -16.545 1.00 0.00 C ATOM 1823 C GLU A 119 -6.823 -8.005 -17.656 1.00 0.00 C ATOM 1824 O GLU A 119 -6.810 -6.795 -17.395 1.00 0.00 O ATOM 1825 CB GLU A 119 -8.135 -8.816 -15.536 1.00 0.00 C ATOM 1826 CG GLU A 119 -8.416 -9.983 -14.543 1.00 0.00 C ATOM 1827 CD GLU A 119 -9.396 -9.755 -13.398 1.00 0.00 C ATOM 1828 OE1 GLU A 119 -10.110 -8.730 -13.363 1.00 0.00 O ATOM 1829 OE2 GLU A 119 -9.429 -10.617 -12.492 1.00 0.00 O ATOM 0 H GLU A 119 -5.648 -8.484 -15.029 1.00 0.00 H new ATOM 0 HA GLU A 119 -7.233 -10.022 -17.050 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -7.895 -7.919 -14.964 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -9.047 -8.604 -16.095 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.780 -10.830 -15.124 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -7.463 -10.281 -14.107 1.00 0.00 H new ATOM 1836 N CYS A 120 -6.586 -8.473 -18.890 1.00 0.00 N ATOM 1837 CA CYS A 120 -6.053 -7.641 -19.996 1.00 0.00 C ATOM 1838 C CYS A 120 -7.023 -7.599 -21.214 1.00 0.00 C ATOM 1839 O CYS A 120 -7.548 -8.623 -21.663 1.00 0.00 O ATOM 1840 CB CYS A 120 -4.631 -8.155 -20.315 1.00 0.00 C ATOM 1841 SG CYS A 120 -4.515 -9.958 -20.314 1.00 0.00 S ATOM 0 H CYS A 120 -6.757 -9.442 -19.157 1.00 0.00 H new ATOM 0 HA CYS A 120 -5.978 -6.594 -19.703 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -4.325 -7.777 -21.290 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -3.932 -7.751 -19.583 1.00 0.00 H new ATOM 0 HG CYS A 120 -4.541 -10.395 -21.538 1.00 0.00 H new ATOM 1846 N VAL A 121 -7.291 -6.383 -21.720 1.00 0.00 N ATOM 1847 CA VAL A 121 -8.417 -6.130 -22.675 1.00 0.00 C ATOM 1848 C VAL A 121 -8.084 -4.922 -23.605 1.00 0.00 C ATOM 1849 O VAL A 121 -7.506 -3.916 -23.175 1.00 0.00 O ATOM 1850 CB VAL A 121 -9.797 -5.995 -21.939 1.00 0.00 C ATOM 1851 CG1 VAL A 121 -9.918 -4.834 -20.930 1.00 0.00 C ATOM 1852 CG2 VAL A 121 -11.005 -5.922 -22.906 1.00 0.00 C ATOM 0 H VAL A 121 -6.750 -5.549 -21.491 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.526 -7.003 -23.319 1.00 0.00 H new ATOM 0 HB VAL A 121 -9.824 -6.923 -21.368 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -10.913 -4.841 -20.485 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -9.169 -4.953 -20.147 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -9.757 -3.887 -21.444 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -11.926 -5.830 -22.331 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -10.896 -5.056 -23.559 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -11.043 -6.829 -23.509 1.00 0.00 H new ATOM 1862 N MET A 122 -8.454 -5.029 -24.892 1.00 0.00 N ATOM 1863 CA MET A 122 -8.371 -3.893 -25.854 1.00 0.00 C ATOM 1864 C MET A 122 -9.790 -3.328 -26.157 1.00 0.00 C ATOM 1865 O MET A 122 -10.128 -2.241 -25.678 1.00 0.00 O ATOM 1866 CB MET A 122 -7.508 -4.308 -27.075 1.00 0.00 C ATOM 1867 CG MET A 122 -7.226 -3.154 -28.056 1.00 0.00 C ATOM 1868 SD MET A 122 -6.514 -3.820 -29.560 1.00 0.00 S ATOM 1869 CE MET A 122 -6.579 -2.366 -30.611 1.00 0.00 C ATOM 0 H MET A 122 -8.816 -5.890 -25.301 1.00 0.00 H new ATOM 0 HA MET A 122 -7.845 -3.040 -25.424 1.00 0.00 H new ATOM 0 HB2 MET A 122 -6.560 -4.710 -26.718 1.00 0.00 H new ATOM 0 HB3 MET A 122 -8.014 -5.112 -27.610 1.00 0.00 H new ATOM 0 HG2 MET A 122 -8.149 -2.619 -28.282 1.00 0.00 H new ATOM 0 HG3 MET A 122 -6.543 -2.435 -27.604 1.00 0.00 H new ATOM 0 HE1 MET A 122 -6.957 -2.645 -31.595 1.00 0.00 H new ATOM 0 HE2 MET A 122 -7.241 -1.624 -30.165 1.00 0.00 H new ATOM 0 HE3 MET A 122 -5.579 -1.945 -30.712 1.00 0.00 H new ATOM 1879 N ASN A 123 -10.607 -4.034 -26.953 1.00 0.00 N ATOM 1880 CA ASN A 123 -11.991 -3.598 -27.298 1.00 0.00 C ATOM 1881 C ASN A 123 -13.016 -4.747 -27.048 1.00 0.00 C ATOM 1882 O ASN A 123 -13.883 -4.625 -26.180 1.00 0.00 O ATOM 1883 CB ASN A 123 -12.044 -3.015 -28.746 1.00 0.00 C ATOM 1884 CG ASN A 123 -11.268 -1.739 -29.127 1.00 0.00 C ATOM 1885 OD1 ASN A 123 -11.001 -1.498 -30.299 1.00 0.00 O ATOM 1886 ND2 ASN A 123 -10.901 -0.861 -28.222 1.00 0.00 N ATOM 0 H ASN A 123 -10.339 -4.921 -27.380 1.00 0.00 H new ATOM 0 HA ASN A 123 -12.285 -2.785 -26.634 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -11.707 -3.804 -29.418 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -13.093 -2.828 -28.975 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -10.411 -0.012 -28.504 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -11.106 -1.028 -27.237 1.00 0.00 H new ATOM 1893 N ASN A 124 -12.915 -5.850 -27.802 1.00 0.00 N ATOM 1894 CA ASN A 124 -13.768 -7.061 -27.629 1.00 0.00 C ATOM 1895 C ASN A 124 -13.095 -8.148 -26.726 1.00 0.00 C ATOM 1896 O ASN A 124 -13.780 -8.758 -25.899 1.00 0.00 O ATOM 1897 CB ASN A 124 -14.138 -7.687 -29.011 1.00 0.00 C ATOM 1898 CG ASN A 124 -14.713 -6.768 -30.098 1.00 0.00 C ATOM 1899 OD1 ASN A 124 -15.915 -6.560 -30.216 1.00 0.00 O ATOM 1900 ND2 ASN A 124 -13.863 -6.210 -30.931 1.00 0.00 N ATOM 0 H ASN A 124 -12.237 -5.940 -28.559 1.00 0.00 H new ATOM 0 HA ASN A 124 -14.675 -6.725 -27.126 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -13.241 -8.157 -29.414 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -14.861 -8.483 -28.832 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -14.204 -5.603 -31.677 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -12.863 -6.384 -30.832 1.00 0.00 H new ATOM 1907 N VAL A 125 -11.794 -8.456 -26.922 1.00 0.00 N ATOM 1908 CA VAL A 125 -11.177 -9.714 -26.429 1.00 0.00 C ATOM 1909 C VAL A 125 -10.567 -9.498 -25.006 1.00 0.00 C ATOM 1910 O VAL A 125 -9.654 -8.688 -24.808 1.00 0.00 O ATOM 1911 CB VAL A 125 -10.130 -10.247 -27.465 1.00 0.00 C ATOM 1912 CG1 VAL A 125 -9.519 -11.592 -27.010 1.00 0.00 C ATOM 1913 CG2 VAL A 125 -10.680 -10.484 -28.895 1.00 0.00 C ATOM 0 H VAL A 125 -11.145 -7.848 -27.421 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.944 -10.483 -26.330 1.00 0.00 H new ATOM 0 HB VAL A 125 -9.393 -9.445 -27.504 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -8.797 -11.933 -27.752 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -9.018 -11.458 -26.051 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -10.310 -12.334 -26.906 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -9.879 -10.852 -29.536 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -11.483 -11.220 -28.859 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -11.065 -9.547 -29.297 1.00 0.00 H new ATOM 1923 N THR A 126 -11.058 -10.285 -24.037 1.00 0.00 N ATOM 1924 CA THR A 126 -10.522 -10.309 -22.646 1.00 0.00 C ATOM 1925 C THR A 126 -9.623 -11.569 -22.443 1.00 0.00 C ATOM 1926 O THR A 126 -10.093 -12.711 -22.472 1.00 0.00 O ATOM 1927 CB THR A 126 -11.663 -10.237 -21.584 1.00 0.00 C ATOM 1928 OG1 THR A 126 -12.650 -11.241 -21.785 1.00 0.00 O ATOM 1929 CG2 THR A 126 -12.395 -8.889 -21.551 1.00 0.00 C ATOM 0 H THR A 126 -11.837 -10.926 -24.184 1.00 0.00 H new ATOM 0 HA THR A 126 -9.908 -9.420 -22.500 1.00 0.00 H new ATOM 0 HB THR A 126 -11.143 -10.387 -20.638 1.00 0.00 H new ATOM 0 HG1 THR A 126 -12.223 -12.057 -22.121 1.00 0.00 H new ATOM 0 HG21 THR A 126 -13.173 -8.916 -20.788 1.00 0.00 H new ATOM 0 HG22 THR A 126 -11.685 -8.095 -21.317 1.00 0.00 H new ATOM 0 HG23 THR A 126 -12.847 -8.696 -22.524 1.00 0.00 H new ATOM 1937 N CYS A 127 -8.320 -11.347 -22.221 1.00 0.00 N ATOM 1938 CA CYS A 127 -7.362 -12.413 -21.836 1.00 0.00 C ATOM 1939 C CYS A 127 -7.113 -12.419 -20.295 1.00 0.00 C ATOM 1940 O CYS A 127 -6.887 -11.374 -19.673 1.00 0.00 O ATOM 1941 CB CYS A 127 -6.079 -12.219 -22.666 1.00 0.00 C ATOM 1942 SG CYS A 127 -5.505 -10.521 -22.677 1.00 0.00 S ATOM 0 H CYS A 127 -7.892 -10.425 -22.301 1.00 0.00 H new ATOM 0 HA CYS A 127 -7.769 -13.399 -22.058 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -5.293 -12.860 -22.266 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -6.263 -12.542 -23.691 1.00 0.00 H new ATOM 0 HG CYS A 127 -5.591 -10.026 -21.478 1.00 0.00 H new ATOM 1947 N THR A 128 -7.169 -13.610 -19.673 1.00 0.00 N ATOM 1948 CA THR A 128 -6.916 -13.769 -18.207 1.00 0.00 C ATOM 1949 C THR A 128 -5.557 -14.509 -18.016 1.00 0.00 C ATOM 1950 O THR A 128 -5.458 -15.721 -18.235 1.00 0.00 O ATOM 1951 CB THR A 128 -8.123 -14.490 -17.536 1.00 0.00 C ATOM 1952 OG1 THR A 128 -9.333 -13.796 -17.824 1.00 0.00 O ATOM 1953 CG2 THR A 128 -8.041 -14.563 -16.004 1.00 0.00 C ATOM 0 H THR A 128 -7.386 -14.484 -20.152 1.00 0.00 H new ATOM 0 HA THR A 128 -6.832 -12.802 -17.711 1.00 0.00 H new ATOM 0 HB THR A 128 -8.099 -15.500 -17.944 1.00 0.00 H new ATOM 0 HG1 THR A 128 -10.085 -14.259 -17.399 1.00 0.00 H new ATOM 0 HG21 THR A 128 -8.919 -15.080 -15.617 1.00 0.00 H new ATOM 0 HG22 THR A 128 -7.142 -15.107 -15.713 1.00 0.00 H new ATOM 0 HG23 THR A 128 -8.003 -13.554 -15.593 1.00 0.00 H new ATOM 1961 N ARG A 129 -4.509 -13.763 -17.626 1.00 0.00 N ATOM 1962 CA ARG A 129 -3.134 -14.313 -17.483 1.00 0.00 C ATOM 1963 C ARG A 129 -2.781 -14.533 -15.975 1.00 0.00 C ATOM 1964 O ARG A 129 -2.653 -13.576 -15.207 1.00 0.00 O ATOM 1965 CB ARG A 129 -2.151 -13.356 -18.214 1.00 0.00 C ATOM 1966 CG ARG A 129 -2.164 -13.445 -19.763 1.00 0.00 C ATOM 1967 CD ARG A 129 -1.067 -12.615 -20.461 1.00 0.00 C ATOM 1968 NE ARG A 129 -1.481 -11.190 -20.594 1.00 0.00 N ATOM 1969 CZ ARG A 129 -0.696 -10.187 -20.983 1.00 0.00 C ATOM 1970 NH1 ARG A 129 0.567 -10.336 -21.299 1.00 0.00 N ATOM 1971 NH2 ARG A 129 -1.209 -8.993 -21.056 1.00 0.00 N ATOM 0 H ARG A 129 -4.581 -12.771 -17.401 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.057 -15.297 -17.946 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -2.385 -12.332 -17.924 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -1.140 -13.564 -17.863 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -2.053 -14.489 -20.055 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -3.138 -13.115 -20.125 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -0.140 -12.677 -19.890 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -0.862 -13.032 -21.447 1.00 0.00 H new ATOM 0 HE ARG A 129 -2.449 -10.963 -20.368 1.00 0.00 H new ATOM 0 HH11 ARG A 129 0.999 -11.259 -21.254 1.00 0.00 H new ATOM 0 HH12 ARG A 129 1.118 -9.529 -21.590 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -2.190 -8.844 -20.818 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -0.630 -8.207 -21.351 1.00 0.00 H new ATOM 1985 N ILE A 130 -2.622 -15.799 -15.551 1.00 0.00 N ATOM 1986 CA ILE A 130 -2.357 -16.166 -14.124 1.00 0.00 C ATOM 1987 C ILE A 130 -0.813 -16.247 -13.887 1.00 0.00 C ATOM 1988 O ILE A 130 -0.094 -16.940 -14.621 1.00 0.00 O ATOM 1989 CB ILE A 130 -3.058 -17.515 -13.715 1.00 0.00 C ATOM 1990 CG1 ILE A 130 -4.540 -17.709 -14.162 1.00 0.00 C ATOM 1991 CG2 ILE A 130 -2.940 -17.819 -12.196 1.00 0.00 C ATOM 1992 CD1 ILE A 130 -5.550 -16.663 -13.664 1.00 0.00 C ATOM 0 H ILE A 130 -2.671 -16.604 -16.176 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.784 -15.389 -13.490 1.00 0.00 H new ATOM 0 HB ILE A 130 -2.482 -18.236 -14.295 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.569 -17.719 -15.252 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -4.872 -18.691 -13.825 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.442 -18.761 -11.973 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.888 -17.894 -11.921 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -3.407 -17.016 -11.627 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -6.543 -16.907 -14.041 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -5.566 -16.663 -12.574 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -5.258 -15.676 -14.023 1.00 0.00 H new ATOM 2004 N TYR A 131 -0.324 -15.571 -12.833 1.00 0.00 N ATOM 2005 CA TYR A 131 1.127 -15.525 -12.508 1.00 0.00 C ATOM 2006 C TYR A 131 1.439 -16.148 -11.100 1.00 0.00 C ATOM 2007 O TYR A 131 0.930 -15.689 -10.068 1.00 0.00 O ATOM 2008 CB TYR A 131 1.615 -14.054 -12.579 1.00 0.00 C ATOM 2009 CG TYR A 131 1.828 -13.409 -13.964 1.00 0.00 C ATOM 2010 CD1 TYR A 131 0.748 -13.053 -14.774 1.00 0.00 C ATOM 2011 CD2 TYR A 131 3.123 -13.101 -14.390 1.00 0.00 C ATOM 2012 CE1 TYR A 131 0.961 -12.428 -16.002 1.00 0.00 C ATOM 2013 CE2 TYR A 131 3.339 -12.474 -15.614 1.00 0.00 C ATOM 2014 CZ TYR A 131 2.257 -12.141 -16.420 1.00 0.00 C ATOM 2015 OH TYR A 131 2.461 -11.540 -17.633 1.00 0.00 O ATOM 0 H TYR A 131 -0.909 -15.044 -12.184 1.00 0.00 H new ATOM 0 HA TYR A 131 1.663 -16.129 -13.241 1.00 0.00 H new ATOM 0 HB2 TYR A 131 0.896 -13.441 -12.036 1.00 0.00 H new ATOM 0 HB3 TYR A 131 2.559 -13.993 -12.037 1.00 0.00 H new ATOM 0 HD1 TYR A 131 -0.260 -13.263 -14.447 1.00 0.00 H new ATOM 0 HD2 TYR A 131 3.965 -13.352 -13.763 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.121 -12.167 -16.628 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.345 -12.247 -15.936 1.00 0.00 H new ATOM 0 HH TYR A 131 3.422 -11.407 -17.775 1.00 0.00 H new ATOM 2025 N GLU A 132 2.344 -17.146 -11.076 1.00 0.00 N ATOM 2026 CA GLU A 132 2.938 -17.712 -9.824 1.00 0.00 C ATOM 2027 C GLU A 132 4.005 -16.773 -9.153 1.00 0.00 C ATOM 2028 O GLU A 132 4.876 -16.251 -9.854 1.00 0.00 O ATOM 2029 CB GLU A 132 3.544 -19.123 -10.149 1.00 0.00 C ATOM 2030 CG GLU A 132 4.795 -19.164 -11.081 1.00 0.00 C ATOM 2031 CD GLU A 132 5.595 -20.451 -11.209 1.00 0.00 C ATOM 2032 OE1 GLU A 132 6.256 -20.860 -10.236 1.00 0.00 O ATOM 2033 OE2 GLU A 132 5.730 -20.974 -12.335 1.00 0.00 O ATOM 0 H GLU A 132 2.693 -17.593 -11.924 1.00 0.00 H new ATOM 0 HA GLU A 132 2.140 -17.804 -9.087 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.809 -19.602 -9.207 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.762 -19.729 -10.606 1.00 0.00 H new ATOM 0 HG2 GLU A 132 4.465 -18.884 -12.082 1.00 0.00 H new ATOM 0 HG3 GLU A 132 5.480 -18.387 -10.742 1.00 0.00 H new ATOM 2040 N LYS A 133 4.003 -16.587 -7.813 1.00 0.00 N ATOM 2041 CA LYS A 133 5.111 -15.862 -7.105 1.00 0.00 C ATOM 2042 C LYS A 133 6.386 -16.768 -6.968 1.00 0.00 C ATOM 2043 O LYS A 133 6.328 -17.815 -6.316 1.00 0.00 O ATOM 2044 CB LYS A 133 4.634 -15.313 -5.726 1.00 0.00 C ATOM 2045 CG LYS A 133 5.358 -14.024 -5.236 1.00 0.00 C ATOM 2046 CD LYS A 133 4.904 -13.573 -3.817 1.00 0.00 C ATOM 2047 CE LYS A 133 4.901 -12.051 -3.533 1.00 0.00 C ATOM 2048 NZ LYS A 133 6.259 -11.452 -3.579 1.00 0.00 N ATOM 0 H LYS A 133 3.261 -16.920 -7.197 1.00 0.00 H new ATOM 0 HA LYS A 133 5.393 -15.002 -7.713 1.00 0.00 H new ATOM 0 HB2 LYS A 133 3.565 -15.109 -5.785 1.00 0.00 H new ATOM 0 HB3 LYS A 133 4.769 -16.093 -4.977 1.00 0.00 H new ATOM 0 HG2 LYS A 133 6.434 -14.199 -5.229 1.00 0.00 H new ATOM 0 HG3 LYS A 133 5.171 -13.217 -5.945 1.00 0.00 H new ATOM 0 HD2 LYS A 133 3.896 -13.952 -3.647 1.00 0.00 H new ATOM 0 HD3 LYS A 133 5.553 -14.053 -3.085 1.00 0.00 H new ATOM 0 HE2 LYS A 133 4.264 -11.552 -4.263 1.00 0.00 H new ATOM 0 HE3 LYS A 133 4.463 -11.871 -2.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 6.183 -10.416 -3.534 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 6.817 -11.794 -2.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 6.730 -11.726 -4.465 1.00 0.00 H new ATOM 2062 N VAL A 134 7.522 -16.395 -7.591 1.00 0.00 N ATOM 2063 CA VAL A 134 8.729 -17.289 -7.673 1.00 0.00 C ATOM 2064 C VAL A 134 9.713 -17.013 -6.475 1.00 0.00 C ATOM 2065 O VAL A 134 10.792 -16.428 -6.651 1.00 0.00 O ATOM 2066 CB VAL A 134 9.447 -17.196 -9.072 1.00 0.00 C ATOM 2067 CG1 VAL A 134 10.402 -18.387 -9.303 1.00 0.00 C ATOM 2068 CG2 VAL A 134 8.573 -17.065 -10.339 1.00 0.00 C ATOM 0 H VAL A 134 7.644 -15.490 -8.046 1.00 0.00 H new ATOM 0 HA VAL A 134 8.383 -18.319 -7.583 1.00 0.00 H new ATOM 0 HB VAL A 134 9.963 -16.242 -8.967 1.00 0.00 H new ATOM 0 HG11 VAL A 134 10.878 -18.287 -10.278 1.00 0.00 H new ATOM 0 HG12 VAL A 134 11.166 -18.397 -8.525 1.00 0.00 H new ATOM 0 HG13 VAL A 134 9.837 -19.318 -9.269 1.00 0.00 H new ATOM 0 HG21 VAL A 134 9.214 -17.012 -11.219 1.00 0.00 H new ATOM 0 HG22 VAL A 134 7.917 -17.931 -10.419 1.00 0.00 H new ATOM 0 HG23 VAL A 134 7.971 -16.159 -10.274 1.00 0.00 H new ATOM 2078 N GLU A 135 9.318 -17.387 -5.246 1.00 0.00 N ATOM 2079 CA GLU A 135 9.967 -16.895 -3.999 1.00 0.00 C ATOM 2080 C GLU A 135 9.866 -18.000 -2.914 1.00 0.00 C ATOM 2081 O GLU A 135 8.745 -18.338 -2.460 1.00 0.00 O ATOM 2082 CB GLU A 135 9.346 -15.540 -3.544 1.00 0.00 C ATOM 2083 CG GLU A 135 9.599 -14.316 -4.471 1.00 0.00 C ATOM 2084 CD GLU A 135 8.812 -13.055 -4.146 1.00 0.00 C ATOM 2085 OE1 GLU A 135 8.651 -12.690 -2.962 1.00 0.00 O ATOM 2086 OE2 GLU A 135 8.289 -12.424 -5.092 1.00 0.00 O ATOM 2087 OXT GLU A 135 10.925 -18.535 -2.511 1.00 0.00 O ATOM 0 H GLU A 135 8.547 -18.033 -5.080 1.00 0.00 H new ATOM 0 HA GLU A 135 11.023 -16.692 -4.180 1.00 0.00 H new ATOM 0 HB2 GLU A 135 8.269 -15.675 -3.443 1.00 0.00 H new ATOM 0 HB3 GLU A 135 9.732 -15.303 -2.553 1.00 0.00 H new ATOM 0 HG2 GLU A 135 10.662 -14.075 -4.438 1.00 0.00 H new ATOM 0 HG3 GLU A 135 9.370 -14.609 -5.496 1.00 0.00 H new