USER MOD reduce.3.24.130724 H: found=0, std=0, add=1046, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1045 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 120 CYS SG : rot -142:sc= -6.67! USER MOD Set 1.2: A 127 CYS SG : rot -35:sc= -4.68! USER MOD Set 2.1: A 22 TYR OH : rot -18:sc= 1.02 USER MOD Set 2.2: A 98 GLN : amide:sc= 2.06 K(o=5.2,f=-1.8!) USER MOD Set 2.3: A 105 SER OG : rot -110:sc= 2.13 USER MOD Set 3.1: A 67 CYS SG : rot 125:sc= -1.56 USER MOD Set 3.2: A 87 CYS SG : rot -159:sc= 0.451 USER MOD Set 4.1: A 83 THR OG1 : rot -124:sc= 0.589 USER MOD Set 4.2: A 85 THR OG1 : rot 70:sc= 1.18 USER MOD Set 5.1: A 76 THR OG1 : rot 148:sc= 0.93 USER MOD Set 5.2: A 82 LYS NZ :NH3+ 154:sc= 2.22 (180deg=0.712) USER MOD Set 6.1: A 53 THR OG1 : rot -106:sc= 1.2 USER MOD Set 6.2: A 64 GLN : amide:sc= 1.12 K(o=4.4,f=-1.1) USER MOD Set 6.3: A 66 SER OG : rot 56:sc= 2.05 USER MOD Set 7.1: A 43 CYS SG : rot 180:sc= -0.0323 USER MOD Set 7.2: A 56 THR OG1 : rot 180:sc= 0 USER MOD Set 8.1: A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 8.2: A 38 MET CE :methyl 168:sc=-0.00427 (180deg=-0.165) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 GLN : amide:sc= 0.401 K(o=0.4,f=-3.3!) USER MOD Single : A 16 SER OG : rot 31:sc= 1.03 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 MET CE :methyl -173:sc= 0 (180deg=-0.0389) USER MOD Single : A 24 LYS NZ :NH3+ 150:sc= 1.06 (180deg=-0.835!) USER MOD Single : A 35 MET CE :methyl 175:sc= 0 (180deg=-0.0132) USER MOD Single : A 40 LYS NZ :NH3+ 166:sc= 1.31 (180deg=1.18) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 CYS SG : rot 152:sc= 0.532 USER MOD Single : A 50 LYS NZ :NH3+ -161:sc= 1.17 (180deg=0.483) USER MOD Single : A 51 ASN : amide:sc= 0.413 K(o=0.41,f=-0.18) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 SER OG : rot 60:sc= 1.25 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 THR OG1 : rot 44:sc= 1.33 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 161:sc= 1.27 (180deg=0.857) USER MOD Single : A 77 THR OG1 : rot 157:sc= 1.29 USER MOD Single : A 84 GLN : amide:sc= -0.0188 K(o=-0.019,f=-0.65) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 THR OG1 : rot -102:sc= 0.959 USER MOD Single : A 96 GLN : amide:sc= 0.977 K(o=0.98,f=-7.6!) USER MOD Single : A 97 HIS : no HD1:sc= 1.01 K(o=1,f=-6.3!) USER MOD Single : A 103 LYS NZ :NH3+ 176:sc= 0.79 (180deg=0.784) USER MOD Single : A 106 THR OG1 : rot -29:sc= 1.01 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 160:sc= 1.26 (180deg=1.16) USER MOD Single : A 112 LYS NZ :NH3+ 170:sc= 1.26 (180deg=0.886) USER MOD Single : A 115 LYS NZ :NH3+ -131:sc= 1.45 (180deg=1.13) USER MOD Single : A 122 MET CE :methyl -160:sc= -0.133 (180deg=-0.434) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 THR OG1 : rot 39:sc= 0.0976 USER MOD Single : A 128 THR OG1 : rot -120:sc= 1.11 USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 165:sc= 1.56 (180deg=0.602) USER MOD ----------------------------------------------------------------- ATOM 14 N VAL A 4 0.242 -0.684 -2.754 1.00 0.00 N ATOM 15 CA VAL A 4 1.099 -1.151 -3.900 1.00 0.00 C ATOM 16 C VAL A 4 2.387 -1.959 -3.458 1.00 0.00 C ATOM 17 O VAL A 4 3.468 -1.855 -4.038 1.00 0.00 O ATOM 18 CB VAL A 4 1.313 0.067 -4.870 1.00 0.00 C ATOM 19 CG1 VAL A 4 2.250 1.181 -4.342 1.00 0.00 C ATOM 20 CG2 VAL A 4 1.779 -0.354 -6.282 1.00 0.00 C ATOM 0 HA VAL A 4 0.587 -1.926 -4.470 1.00 0.00 H new ATOM 0 HB VAL A 4 0.311 0.493 -4.928 1.00 0.00 H new ATOM 0 HG11 VAL A 4 2.329 1.973 -5.087 1.00 0.00 H new ATOM 0 HG12 VAL A 4 1.843 1.591 -3.418 1.00 0.00 H new ATOM 0 HG13 VAL A 4 3.238 0.764 -4.149 1.00 0.00 H new ATOM 0 HG21 VAL A 4 1.908 0.533 -6.902 1.00 0.00 H new ATOM 0 HG22 VAL A 4 2.727 -0.887 -6.208 1.00 0.00 H new ATOM 0 HG23 VAL A 4 1.031 -1.006 -6.733 1.00 0.00 H new ATOM 30 N GLN A 5 2.218 -2.806 -2.433 1.00 0.00 N ATOM 31 CA GLN A 5 3.281 -3.626 -1.798 1.00 0.00 C ATOM 32 C GLN A 5 3.056 -5.156 -2.039 1.00 0.00 C ATOM 33 O GLN A 5 3.989 -5.848 -2.444 1.00 0.00 O ATOM 34 CB GLN A 5 3.263 -3.266 -0.286 1.00 0.00 C ATOM 35 CG GLN A 5 3.784 -1.849 0.078 1.00 0.00 C ATOM 36 CD GLN A 5 3.657 -1.484 1.559 1.00 0.00 C ATOM 37 OE1 GLN A 5 4.625 -1.436 2.308 1.00 0.00 O ATOM 38 NE2 GLN A 5 2.464 -1.208 2.027 1.00 0.00 N ATOM 0 H GLN A 5 1.305 -2.950 -2.001 1.00 0.00 H new ATOM 0 HA GLN A 5 4.255 -3.409 -2.236 1.00 0.00 H new ATOM 0 HB2 GLN A 5 2.240 -3.361 0.079 1.00 0.00 H new ATOM 0 HB3 GLN A 5 3.862 -4.002 0.250 1.00 0.00 H new ATOM 0 HG2 GLN A 5 4.832 -1.776 -0.212 1.00 0.00 H new ATOM 0 HG3 GLN A 5 3.238 -1.113 -0.512 1.00 0.00 H new ATOM 0 HE21 GLN A 5 1.653 -1.246 1.410 1.00 0.00 H new ATOM 0 HE22 GLN A 5 2.347 -0.956 3.008 1.00 0.00 H new ATOM 47 N GLN A 6 1.833 -5.694 -1.837 1.00 0.00 N ATOM 48 CA GLN A 6 1.463 -7.091 -2.217 1.00 0.00 C ATOM 49 C GLN A 6 1.609 -7.474 -3.735 1.00 0.00 C ATOM 50 O GLN A 6 1.893 -8.635 -4.035 1.00 0.00 O ATOM 51 CB GLN A 6 0.024 -7.371 -1.706 1.00 0.00 C ATOM 52 CG GLN A 6 -0.146 -7.496 -0.169 1.00 0.00 C ATOM 53 CD GLN A 6 -0.322 -6.196 0.633 1.00 0.00 C ATOM 54 OE1 GLN A 6 -0.244 -5.069 0.149 1.00 0.00 O ATOM 55 NE2 GLN A 6 -0.567 -6.320 1.912 1.00 0.00 N ATOM 0 H GLN A 6 1.067 -5.177 -1.405 1.00 0.00 H new ATOM 0 HA GLN A 6 2.201 -7.734 -1.737 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -0.626 -6.570 -2.058 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -0.329 -8.294 -2.166 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -1.012 -8.130 0.023 1.00 0.00 H new ATOM 0 HG3 GLN A 6 0.726 -8.019 0.225 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -0.635 -7.248 2.331 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -0.690 -5.489 2.491 1.00 0.00 H new ATOM 64 N LEU A 7 1.460 -6.516 -4.672 1.00 0.00 N ATOM 65 CA LEU A 7 1.894 -6.691 -6.093 1.00 0.00 C ATOM 66 C LEU A 7 3.444 -6.815 -6.367 1.00 0.00 C ATOM 67 O LEU A 7 3.815 -7.177 -7.486 1.00 0.00 O ATOM 68 CB LEU A 7 1.348 -5.511 -6.955 1.00 0.00 C ATOM 69 CG LEU A 7 -0.159 -5.133 -6.939 1.00 0.00 C ATOM 70 CD1 LEU A 7 -0.396 -3.993 -7.938 1.00 0.00 C ATOM 71 CD2 LEU A 7 -1.107 -6.286 -7.294 1.00 0.00 C ATOM 0 H LEU A 7 1.042 -5.606 -4.479 1.00 0.00 H new ATOM 0 HA LEU A 7 1.477 -7.661 -6.366 1.00 0.00 H new ATOM 0 HB2 LEU A 7 1.903 -4.620 -6.662 1.00 0.00 H new ATOM 0 HB3 LEU A 7 1.612 -5.725 -7.991 1.00 0.00 H new ATOM 0 HG LEU A 7 -0.386 -4.844 -5.913 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -1.451 -3.720 -7.935 1.00 0.00 H new ATOM 0 HD12 LEU A 7 0.204 -3.129 -7.653 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -0.109 -4.320 -8.938 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -2.138 -5.934 -7.258 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.881 -6.647 -8.297 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.976 -7.098 -6.579 1.00 0.00 H new ATOM 83 N GLU A 8 4.340 -6.505 -5.409 1.00 0.00 N ATOM 84 CA GLU A 8 5.815 -6.577 -5.588 1.00 0.00 C ATOM 85 C GLU A 8 6.351 -8.046 -5.593 1.00 0.00 C ATOM 86 O GLU A 8 5.939 -8.877 -4.769 1.00 0.00 O ATOM 87 CB GLU A 8 6.432 -5.733 -4.434 1.00 0.00 C ATOM 88 CG GLU A 8 7.860 -5.177 -4.649 1.00 0.00 C ATOM 89 CD GLU A 8 9.029 -6.155 -4.642 1.00 0.00 C ATOM 90 OE1 GLU A 8 9.198 -6.880 -3.640 1.00 0.00 O ATOM 91 OE2 GLU A 8 9.802 -6.178 -5.621 1.00 0.00 O ATOM 0 H GLU A 8 4.063 -6.194 -4.478 1.00 0.00 H new ATOM 0 HA GLU A 8 6.102 -6.181 -6.562 1.00 0.00 H new ATOM 0 HB2 GLU A 8 5.768 -4.891 -4.239 1.00 0.00 H new ATOM 0 HB3 GLU A 8 6.441 -6.347 -3.534 1.00 0.00 H new ATOM 0 HG2 GLU A 8 7.872 -4.653 -5.605 1.00 0.00 H new ATOM 0 HG3 GLU A 8 8.046 -4.432 -3.875 1.00 0.00 H new ATOM 98 N GLY A 9 7.262 -8.365 -6.526 1.00 0.00 N ATOM 99 CA GLY A 9 7.899 -9.706 -6.564 1.00 0.00 C ATOM 100 C GLY A 9 8.320 -10.265 -7.932 1.00 0.00 C ATOM 101 O GLY A 9 8.115 -9.660 -8.986 1.00 0.00 O ATOM 0 H GLY A 9 7.576 -7.728 -7.258 1.00 0.00 H new ATOM 0 HA2 GLY A 9 8.785 -9.673 -5.930 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.208 -10.417 -6.111 1.00 0.00 H new ATOM 105 N ARG A 10 8.875 -11.485 -7.883 1.00 0.00 N ATOM 106 CA ARG A 10 9.153 -12.306 -9.093 1.00 0.00 C ATOM 107 C ARG A 10 7.943 -13.245 -9.397 1.00 0.00 C ATOM 108 O ARG A 10 7.614 -14.139 -8.611 1.00 0.00 O ATOM 109 CB ARG A 10 10.475 -13.082 -8.854 1.00 0.00 C ATOM 110 CG ARG A 10 10.944 -13.949 -10.053 1.00 0.00 C ATOM 111 CD ARG A 10 12.214 -14.777 -9.766 1.00 0.00 C ATOM 112 NE ARG A 10 13.453 -14.028 -10.113 1.00 0.00 N ATOM 113 CZ ARG A 10 14.185 -14.205 -11.217 1.00 0.00 C ATOM 114 NH1 ARG A 10 13.890 -15.040 -12.185 1.00 0.00 N ATOM 115 NH2 ARG A 10 15.270 -13.499 -11.351 1.00 0.00 N ATOM 0 H ARG A 10 9.147 -11.938 -7.011 1.00 0.00 H new ATOM 0 HA ARG A 10 9.278 -11.678 -9.975 1.00 0.00 H new ATOM 0 HB2 ARG A 10 11.261 -12.367 -8.611 1.00 0.00 H new ATOM 0 HB3 ARG A 10 10.350 -13.727 -7.984 1.00 0.00 H new ATOM 0 HG2 ARG A 10 10.138 -14.625 -10.337 1.00 0.00 H new ATOM 0 HG3 ARG A 10 11.131 -13.299 -10.908 1.00 0.00 H new ATOM 0 HD2 ARG A 10 12.238 -15.051 -8.711 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.179 -15.705 -10.336 1.00 0.00 H new ATOM 0 HE ARG A 10 13.770 -13.319 -9.452 1.00 0.00 H new ATOM 0 HH11 ARG A 10 13.048 -15.613 -12.126 1.00 0.00 H new ATOM 0 HH12 ARG A 10 14.503 -15.116 -12.997 1.00 0.00 H new ATOM 0 HH21 ARG A 10 15.539 -12.835 -10.625 1.00 0.00 H new ATOM 0 HH22 ARG A 10 15.851 -13.610 -12.182 1.00 0.00 H new ATOM 129 N TRP A 11 7.301 -13.039 -10.554 1.00 0.00 N ATOM 130 CA TRP A 11 5.974 -13.637 -10.856 1.00 0.00 C ATOM 131 C TRP A 11 6.053 -14.464 -12.174 1.00 0.00 C ATOM 132 O TRP A 11 6.154 -13.879 -13.253 1.00 0.00 O ATOM 133 CB TRP A 11 4.948 -12.474 -10.972 1.00 0.00 C ATOM 134 CG TRP A 11 4.708 -11.641 -9.712 1.00 0.00 C ATOM 135 CD1 TRP A 11 5.069 -10.289 -9.558 1.00 0.00 C ATOM 136 CD2 TRP A 11 4.018 -11.981 -8.565 1.00 0.00 C ATOM 137 NE1 TRP A 11 4.609 -9.770 -8.340 1.00 0.00 N ATOM 138 CE2 TRP A 11 3.963 -10.830 -7.742 1.00 0.00 C ATOM 139 CE3 TRP A 11 3.320 -13.162 -8.197 1.00 0.00 C ATOM 140 CZ2 TRP A 11 3.204 -10.841 -6.558 1.00 0.00 C ATOM 141 CZ3 TRP A 11 2.578 -13.149 -7.014 1.00 0.00 C ATOM 142 CH2 TRP A 11 2.523 -12.008 -6.206 1.00 0.00 C ATOM 0 H TRP A 11 7.674 -12.461 -11.307 1.00 0.00 H new ATOM 0 HA TRP A 11 5.661 -14.319 -10.066 1.00 0.00 H new ATOM 0 HB2 TRP A 11 5.282 -11.804 -11.764 1.00 0.00 H new ATOM 0 HB3 TRP A 11 3.993 -12.893 -11.290 1.00 0.00 H new ATOM 0 HD1 TRP A 11 5.630 -9.723 -10.287 1.00 0.00 H new ATOM 0 HE1 TRP A 11 4.726 -8.823 -7.979 1.00 0.00 H new ATOM 0 HE3 TRP A 11 3.362 -14.046 -8.815 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 3.149 -9.962 -5.932 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 2.037 -14.035 -6.718 1.00 0.00 H new ATOM 0 HH2 TRP A 11 1.944 -12.030 -5.295 1.00 0.00 H new ATOM 153 N ARG A 12 6.000 -15.806 -12.130 1.00 0.00 N ATOM 154 CA ARG A 12 6.157 -16.652 -13.346 1.00 0.00 C ATOM 155 C ARG A 12 4.811 -17.063 -14.012 1.00 0.00 C ATOM 156 O ARG A 12 3.953 -17.655 -13.353 1.00 0.00 O ATOM 157 CB ARG A 12 6.983 -17.888 -12.950 1.00 0.00 C ATOM 158 CG ARG A 12 7.356 -18.813 -14.139 1.00 0.00 C ATOM 159 CD ARG A 12 8.132 -20.063 -13.713 1.00 0.00 C ATOM 160 NE ARG A 12 9.480 -19.656 -13.244 1.00 0.00 N ATOM 161 CZ ARG A 12 10.002 -19.913 -12.052 1.00 0.00 C ATOM 162 NH1 ARG A 12 9.428 -20.656 -11.131 1.00 0.00 N ATOM 163 NH2 ARG A 12 11.142 -19.352 -11.779 1.00 0.00 N ATOM 0 H ARG A 12 5.850 -16.336 -11.272 1.00 0.00 H new ATOM 0 HA ARG A 12 6.668 -16.063 -14.108 1.00 0.00 H new ATOM 0 HB2 ARG A 12 7.899 -17.557 -12.461 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.421 -18.467 -12.217 1.00 0.00 H new ATOM 0 HG2 ARG A 12 6.445 -19.117 -14.654 1.00 0.00 H new ATOM 0 HG3 ARG A 12 7.954 -18.249 -14.855 1.00 0.00 H new ATOM 0 HD2 ARG A 12 7.599 -20.585 -12.919 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.218 -20.757 -14.549 1.00 0.00 H new ATOM 0 HE ARG A 12 10.059 -19.130 -13.899 1.00 0.00 H new ATOM 0 HH11 ARG A 12 8.518 -21.080 -11.312 1.00 0.00 H new ATOM 0 HH12 ARG A 12 9.893 -20.808 -10.236 1.00 0.00 H new ATOM 0 HH21 ARG A 12 11.591 -18.748 -12.467 1.00 0.00 H new ATOM 0 HH22 ARG A 12 11.588 -19.516 -10.876 1.00 0.00 H new ATOM 177 N LEU A 13 4.671 -16.858 -15.338 1.00 0.00 N ATOM 178 CA LEU A 13 3.436 -17.241 -16.085 1.00 0.00 C ATOM 179 C LEU A 13 3.156 -18.784 -16.100 1.00 0.00 C ATOM 180 O LEU A 13 3.994 -19.582 -16.530 1.00 0.00 O ATOM 181 CB LEU A 13 3.513 -16.641 -17.521 1.00 0.00 C ATOM 182 CG LEU A 13 2.272 -16.817 -18.442 1.00 0.00 C ATOM 183 CD1 LEU A 13 0.988 -16.247 -17.822 1.00 0.00 C ATOM 184 CD2 LEU A 13 2.482 -16.152 -19.814 1.00 0.00 C ATOM 0 H LEU A 13 5.391 -16.431 -15.920 1.00 0.00 H new ATOM 0 HA LEU A 13 2.580 -16.821 -15.557 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.714 -15.574 -17.429 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.371 -17.085 -18.025 1.00 0.00 H new ATOM 0 HG LEU A 13 2.157 -17.894 -18.565 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.155 -16.398 -18.508 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.780 -16.757 -16.882 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.116 -15.181 -17.635 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.593 -16.297 -20.428 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.659 -15.085 -19.678 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.342 -16.602 -20.309 1.00 0.00 H new ATOM 196 N VAL A 14 1.955 -19.178 -15.650 1.00 0.00 N ATOM 197 CA VAL A 14 1.494 -20.600 -15.637 1.00 0.00 C ATOM 198 C VAL A 14 0.308 -20.809 -16.639 1.00 0.00 C ATOM 199 O VAL A 14 0.505 -21.505 -17.641 1.00 0.00 O ATOM 200 CB VAL A 14 1.289 -21.168 -14.185 1.00 0.00 C ATOM 201 CG1 VAL A 14 2.633 -21.415 -13.461 1.00 0.00 C ATOM 202 CG2 VAL A 14 0.388 -20.340 -13.237 1.00 0.00 C ATOM 0 H VAL A 14 1.263 -18.526 -15.280 1.00 0.00 H new ATOM 0 HA VAL A 14 2.296 -21.232 -16.018 1.00 0.00 H new ATOM 0 HB VAL A 14 0.761 -22.100 -14.384 1.00 0.00 H new ATOM 0 HG11 VAL A 14 2.442 -21.807 -12.462 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.224 -22.136 -14.026 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.182 -20.477 -13.383 1.00 0.00 H new ATOM 0 HG21 VAL A 14 0.326 -20.836 -12.268 1.00 0.00 H new ATOM 0 HG22 VAL A 14 0.813 -19.345 -13.108 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -0.611 -20.256 -13.666 1.00 0.00 H new ATOM 212 N ASP A 15 -0.883 -20.211 -16.425 1.00 0.00 N ATOM 213 CA ASP A 15 -1.994 -20.225 -17.428 1.00 0.00 C ATOM 214 C ASP A 15 -2.079 -18.869 -18.212 1.00 0.00 C ATOM 215 O ASP A 15 -1.800 -17.791 -17.680 1.00 0.00 O ATOM 216 CB ASP A 15 -3.321 -20.621 -16.720 1.00 0.00 C ATOM 217 CG ASP A 15 -4.554 -20.757 -17.631 1.00 0.00 C ATOM 218 OD1 ASP A 15 -4.395 -21.123 -18.818 1.00 0.00 O ATOM 219 OD2 ASP A 15 -5.678 -20.463 -17.172 1.00 0.00 O ATOM 0 H ASP A 15 -1.110 -19.708 -15.567 1.00 0.00 H new ATOM 0 HA ASP A 15 -1.793 -20.979 -18.189 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -3.167 -21.570 -16.206 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -3.539 -19.875 -15.955 1.00 0.00 H new ATOM 224 N SER A 16 -2.506 -18.938 -19.483 1.00 0.00 N ATOM 225 CA SER A 16 -2.741 -17.730 -20.324 1.00 0.00 C ATOM 226 C SER A 16 -4.109 -17.836 -21.068 1.00 0.00 C ATOM 227 O SER A 16 -4.163 -18.251 -22.233 1.00 0.00 O ATOM 228 CB SER A 16 -1.517 -17.503 -21.250 1.00 0.00 C ATOM 229 OG SER A 16 -1.502 -18.408 -22.356 1.00 0.00 O ATOM 0 H SER A 16 -2.699 -19.818 -19.962 1.00 0.00 H new ATOM 0 HA SER A 16 -2.826 -16.838 -19.703 1.00 0.00 H new ATOM 0 HB2 SER A 16 -1.529 -16.478 -21.621 1.00 0.00 H new ATOM 0 HB3 SER A 16 -0.600 -17.622 -20.673 1.00 0.00 H new ATOM 0 HG SER A 16 -2.422 -18.636 -22.605 1.00 0.00 H new ATOM 235 N LYS A 17 -5.214 -17.475 -20.389 1.00 0.00 N ATOM 236 CA LYS A 17 -6.591 -17.790 -20.857 1.00 0.00 C ATOM 237 C LYS A 17 -7.149 -16.624 -21.738 1.00 0.00 C ATOM 238 O LYS A 17 -7.627 -15.607 -21.227 1.00 0.00 O ATOM 239 CB LYS A 17 -7.410 -18.126 -19.579 1.00 0.00 C ATOM 240 CG LYS A 17 -8.804 -18.748 -19.827 1.00 0.00 C ATOM 241 CD LYS A 17 -9.425 -19.307 -18.527 1.00 0.00 C ATOM 242 CE LYS A 17 -10.821 -19.923 -18.753 1.00 0.00 C ATOM 243 NZ LYS A 17 -11.319 -20.505 -17.478 1.00 0.00 N ATOM 0 H LYS A 17 -5.186 -16.961 -19.508 1.00 0.00 H new ATOM 0 HA LYS A 17 -6.640 -18.651 -21.523 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -6.828 -18.814 -18.966 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -7.537 -17.212 -18.999 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -9.467 -17.995 -20.251 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -8.719 -19.548 -20.562 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -8.762 -20.064 -18.108 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -9.500 -18.506 -17.791 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -11.513 -19.161 -19.112 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -10.770 -20.694 -19.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -12.260 -20.920 -17.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -10.663 -21.244 -17.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -11.383 -19.758 -16.757 1.00 0.00 H new ATOM 257 N GLY A 18 -7.031 -16.783 -23.070 1.00 0.00 N ATOM 258 CA GLY A 18 -7.300 -15.688 -24.053 1.00 0.00 C ATOM 259 C GLY A 18 -6.109 -14.841 -24.578 1.00 0.00 C ATOM 260 O GLY A 18 -6.350 -13.817 -25.222 1.00 0.00 O ATOM 0 H GLY A 18 -6.750 -17.662 -23.504 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -7.793 -16.134 -24.917 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.015 -15.004 -23.596 1.00 0.00 H new ATOM 264 N PHE A 19 -4.843 -15.226 -24.325 1.00 0.00 N ATOM 265 CA PHE A 19 -3.663 -14.359 -24.612 1.00 0.00 C ATOM 266 C PHE A 19 -3.298 -14.156 -26.119 1.00 0.00 C ATOM 267 O PHE A 19 -3.114 -13.004 -26.520 1.00 0.00 O ATOM 268 CB PHE A 19 -2.488 -14.846 -23.718 1.00 0.00 C ATOM 269 CG PHE A 19 -1.221 -13.965 -23.614 1.00 0.00 C ATOM 270 CD1 PHE A 19 -1.296 -12.566 -23.549 1.00 0.00 C ATOM 271 CD2 PHE A 19 0.034 -14.582 -23.527 1.00 0.00 C ATOM 272 CE1 PHE A 19 -0.138 -11.802 -23.447 1.00 0.00 C ATOM 273 CE2 PHE A 19 1.190 -13.815 -23.400 1.00 0.00 C ATOM 274 CZ PHE A 19 1.102 -12.426 -23.369 1.00 0.00 C ATOM 0 H PHE A 19 -4.602 -16.131 -23.922 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.929 -13.335 -24.349 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -2.876 -14.987 -22.709 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.180 -15.826 -24.081 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.259 -12.079 -23.578 1.00 0.00 H new ATOM 0 HD2 PHE A 19 0.106 -15.659 -23.559 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.202 -10.724 -23.428 1.00 0.00 H new ATOM 0 HE2 PHE A 19 2.153 -14.297 -23.326 1.00 0.00 H new ATOM 0 HZ PHE A 19 2.000 -11.831 -23.284 1.00 0.00 H new ATOM 284 N ASP A 20 -3.233 -15.220 -26.950 1.00 0.00 N ATOM 285 CA ASP A 20 -3.123 -15.079 -28.436 1.00 0.00 C ATOM 286 C ASP A 20 -4.261 -14.225 -29.109 1.00 0.00 C ATOM 287 O ASP A 20 -3.951 -13.339 -29.906 1.00 0.00 O ATOM 288 CB ASP A 20 -2.924 -16.487 -29.056 1.00 0.00 C ATOM 289 CG ASP A 20 -2.458 -16.468 -30.513 1.00 0.00 C ATOM 290 OD1 ASP A 20 -1.373 -15.923 -30.808 1.00 0.00 O ATOM 291 OD2 ASP A 20 -3.178 -16.975 -31.396 1.00 0.00 O ATOM 0 H ASP A 20 -3.254 -16.187 -26.627 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.243 -14.474 -28.654 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -2.195 -17.035 -28.460 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.864 -17.036 -28.993 1.00 0.00 H new ATOM 296 N GLU A 21 -5.541 -14.416 -28.729 1.00 0.00 N ATOM 297 CA GLU A 21 -6.671 -13.511 -29.088 1.00 0.00 C ATOM 298 C GLU A 21 -6.477 -11.993 -28.737 1.00 0.00 C ATOM 299 O GLU A 21 -6.696 -11.138 -29.600 1.00 0.00 O ATOM 300 CB GLU A 21 -7.973 -14.095 -28.459 1.00 0.00 C ATOM 301 CG GLU A 21 -8.342 -15.569 -28.785 1.00 0.00 C ATOM 302 CD GLU A 21 -8.452 -15.909 -30.263 1.00 0.00 C ATOM 303 OE1 GLU A 21 -9.367 -15.418 -30.953 1.00 0.00 O ATOM 304 OE2 GLU A 21 -7.583 -16.642 -30.778 1.00 0.00 O ATOM 0 H GLU A 21 -5.830 -15.210 -28.158 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.729 -13.493 -30.176 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.891 -14.003 -27.376 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.806 -13.465 -28.771 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -7.592 -16.220 -28.336 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -9.293 -15.801 -28.306 1.00 0.00 H new ATOM 311 N TYR A 22 -6.023 -11.652 -27.513 1.00 0.00 N ATOM 312 CA TYR A 22 -5.538 -10.282 -27.168 1.00 0.00 C ATOM 313 C TYR A 22 -4.422 -9.700 -28.113 1.00 0.00 C ATOM 314 O TYR A 22 -4.609 -8.605 -28.647 1.00 0.00 O ATOM 315 CB TYR A 22 -5.194 -10.302 -25.646 1.00 0.00 C ATOM 316 CG TYR A 22 -4.469 -9.058 -25.098 1.00 0.00 C ATOM 317 CD1 TYR A 22 -5.144 -7.842 -24.932 1.00 0.00 C ATOM 318 CD2 TYR A 22 -3.086 -9.112 -24.884 1.00 0.00 C ATOM 319 CE1 TYR A 22 -4.440 -6.694 -24.572 1.00 0.00 C ATOM 320 CE2 TYR A 22 -2.387 -7.961 -24.533 1.00 0.00 C ATOM 321 CZ TYR A 22 -3.061 -6.753 -24.395 1.00 0.00 C ATOM 322 OH TYR A 22 -2.349 -5.612 -24.162 1.00 0.00 O ATOM 0 H TYR A 22 -5.979 -12.309 -26.734 1.00 0.00 H new ATOM 0 HA TYR A 22 -6.326 -9.552 -27.355 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -6.120 -10.433 -25.087 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -4.574 -11.176 -25.446 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -6.212 -7.794 -25.083 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -2.561 -10.049 -24.992 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -4.964 -5.760 -24.431 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -1.321 -8.006 -24.368 1.00 0.00 H new ATOM 0 HH TYR A 22 -2.881 -4.834 -24.430 1.00 0.00 H new ATOM 332 N MET A 23 -3.288 -10.395 -28.327 1.00 0.00 N ATOM 333 CA MET A 23 -2.243 -9.953 -29.306 1.00 0.00 C ATOM 334 C MET A 23 -2.596 -10.023 -30.837 1.00 0.00 C ATOM 335 O MET A 23 -2.121 -9.180 -31.607 1.00 0.00 O ATOM 336 CB MET A 23 -0.869 -10.555 -28.915 1.00 0.00 C ATOM 337 CG MET A 23 -0.743 -12.083 -28.911 1.00 0.00 C ATOM 338 SD MET A 23 0.955 -12.522 -28.496 1.00 0.00 S ATOM 339 CE MET A 23 0.664 -13.648 -27.125 1.00 0.00 C ATOM 0 H MET A 23 -3.061 -11.264 -27.843 1.00 0.00 H new ATOM 0 HA MET A 23 -2.190 -8.869 -29.205 1.00 0.00 H new ATOM 0 HB2 MET A 23 -0.120 -10.157 -29.600 1.00 0.00 H new ATOM 0 HB3 MET A 23 -0.614 -10.194 -27.919 1.00 0.00 H new ATOM 0 HG2 MET A 23 -1.433 -12.517 -28.187 1.00 0.00 H new ATOM 0 HG3 MET A 23 -1.010 -12.487 -29.888 1.00 0.00 H new ATOM 0 HE1 MET A 23 1.616 -13.918 -26.668 1.00 0.00 H new ATOM 0 HE2 MET A 23 0.030 -13.162 -26.383 1.00 0.00 H new ATOM 0 HE3 MET A 23 0.170 -14.548 -27.492 1.00 0.00 H new ATOM 349 N LYS A 24 -3.496 -10.926 -31.276 1.00 0.00 N ATOM 350 CA LYS A 24 -4.299 -10.748 -32.524 1.00 0.00 C ATOM 351 C LYS A 24 -5.110 -9.397 -32.593 1.00 0.00 C ATOM 352 O LYS A 24 -4.950 -8.664 -33.572 1.00 0.00 O ATOM 353 CB LYS A 24 -5.244 -11.975 -32.696 1.00 0.00 C ATOM 354 CG LYS A 24 -4.581 -13.323 -33.083 1.00 0.00 C ATOM 355 CD LYS A 24 -5.450 -14.589 -32.883 1.00 0.00 C ATOM 356 CE LYS A 24 -6.842 -14.558 -33.542 1.00 0.00 C ATOM 357 NZ LYS A 24 -7.542 -15.841 -33.274 1.00 0.00 N ATOM 0 H LYS A 24 -3.693 -11.798 -30.785 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.591 -10.687 -33.350 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.786 -12.120 -31.761 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.983 -11.729 -33.458 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -4.285 -13.272 -34.131 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -3.668 -13.437 -32.499 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -4.903 -15.447 -33.273 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -5.579 -14.753 -31.813 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.424 -13.724 -33.150 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -6.745 -14.401 -34.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -8.568 -15.676 -33.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -7.325 -16.520 -34.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -7.223 -16.227 -32.362 1.00 0.00 H new ATOM 371 N GLU A 25 -5.920 -9.050 -31.565 1.00 0.00 N ATOM 372 CA GLU A 25 -6.596 -7.717 -31.448 1.00 0.00 C ATOM 373 C GLU A 25 -5.648 -6.462 -31.367 1.00 0.00 C ATOM 374 O GLU A 25 -5.930 -5.446 -32.010 1.00 0.00 O ATOM 375 CB GLU A 25 -7.612 -7.807 -30.269 1.00 0.00 C ATOM 376 CG GLU A 25 -8.706 -6.702 -30.215 1.00 0.00 C ATOM 377 CD GLU A 25 -9.755 -6.736 -31.323 1.00 0.00 C ATOM 378 OE1 GLU A 25 -10.434 -7.769 -31.495 1.00 0.00 O ATOM 379 OE2 GLU A 25 -9.917 -5.708 -32.011 1.00 0.00 O ATOM 0 H GLU A 25 -6.129 -9.679 -30.790 1.00 0.00 H new ATOM 0 HA GLU A 25 -7.113 -7.524 -32.388 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -8.107 -8.777 -30.318 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -7.053 -7.781 -29.333 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -9.219 -6.774 -29.256 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -8.213 -5.730 -30.240 1.00 0.00 H new ATOM 386 N LEU A 26 -4.496 -6.521 -30.659 1.00 0.00 N ATOM 387 CA LEU A 26 -3.392 -5.519 -30.815 1.00 0.00 C ATOM 388 C LEU A 26 -2.900 -5.289 -32.293 1.00 0.00 C ATOM 389 O LEU A 26 -2.801 -4.139 -32.746 1.00 0.00 O ATOM 390 CB LEU A 26 -2.172 -5.894 -29.913 1.00 0.00 C ATOM 391 CG LEU A 26 -2.321 -5.953 -28.371 1.00 0.00 C ATOM 392 CD1 LEU A 26 -0.998 -6.443 -27.750 1.00 0.00 C ATOM 393 CD2 LEU A 26 -2.657 -4.593 -27.749 1.00 0.00 C ATOM 0 H LEU A 26 -4.298 -7.248 -29.972 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.834 -4.575 -30.496 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -1.819 -6.872 -30.240 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.378 -5.180 -30.132 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.146 -6.634 -28.162 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.099 -6.486 -26.666 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.763 -7.436 -28.132 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.195 -5.754 -28.013 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.748 -4.700 -26.668 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.863 -3.882 -27.978 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.599 -4.228 -28.158 1.00 0.00 H new ATOM 405 N GLY A 27 -2.551 -6.380 -33.001 1.00 0.00 N ATOM 406 CA GLY A 27 -1.856 -6.342 -34.313 1.00 0.00 C ATOM 407 C GLY A 27 -0.375 -6.761 -34.208 1.00 0.00 C ATOM 408 O GLY A 27 0.517 -5.915 -34.330 1.00 0.00 O ATOM 0 H GLY A 27 -2.744 -7.328 -32.678 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.369 -7.003 -35.012 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -1.917 -5.334 -34.724 1.00 0.00 H new ATOM 412 N VAL A 28 -0.137 -8.052 -33.940 1.00 0.00 N ATOM 413 CA VAL A 28 1.222 -8.611 -33.660 1.00 0.00 C ATOM 414 C VAL A 28 1.443 -9.830 -34.621 1.00 0.00 C ATOM 415 O VAL A 28 0.601 -10.732 -34.714 1.00 0.00 O ATOM 416 CB VAL A 28 1.353 -8.982 -32.137 1.00 0.00 C ATOM 417 CG1 VAL A 28 2.686 -9.669 -31.759 1.00 0.00 C ATOM 418 CG2 VAL A 28 1.205 -7.766 -31.189 1.00 0.00 C ATOM 0 H VAL A 28 -0.876 -8.754 -33.908 1.00 0.00 H new ATOM 0 HA VAL A 28 2.006 -7.878 -33.853 1.00 0.00 H new ATOM 0 HB VAL A 28 0.527 -9.680 -32.002 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.692 -9.890 -30.692 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.790 -10.597 -32.322 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.517 -9.006 -31.997 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.306 -8.096 -30.155 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.980 -7.033 -31.414 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.224 -7.312 -31.330 1.00 0.00 H new ATOM 428 N GLY A 29 2.593 -9.871 -35.322 1.00 0.00 N ATOM 429 CA GLY A 29 2.897 -10.953 -36.303 1.00 0.00 C ATOM 430 C GLY A 29 3.150 -12.376 -35.741 1.00 0.00 C ATOM 431 O GLY A 29 3.402 -12.570 -34.550 1.00 0.00 O ATOM 0 H GLY A 29 3.331 -9.173 -35.233 1.00 0.00 H new ATOM 0 HA2 GLY A 29 2.067 -11.012 -37.007 1.00 0.00 H new ATOM 0 HA3 GLY A 29 3.777 -10.654 -36.872 1.00 0.00 H new ATOM 435 N ILE A 30 3.098 -13.379 -36.630 1.00 0.00 N ATOM 436 CA ILE A 30 3.164 -14.833 -36.253 1.00 0.00 C ATOM 437 C ILE A 30 4.411 -15.313 -35.429 1.00 0.00 C ATOM 438 O ILE A 30 4.233 -15.991 -34.414 1.00 0.00 O ATOM 439 CB ILE A 30 2.882 -15.770 -37.484 1.00 0.00 C ATOM 440 CG1 ILE A 30 3.797 -15.541 -38.725 1.00 0.00 C ATOM 441 CG2 ILE A 30 1.388 -15.761 -37.895 1.00 0.00 C ATOM 442 CD1 ILE A 30 4.001 -16.780 -39.609 1.00 0.00 C ATOM 0 H ILE A 30 3.009 -13.224 -37.634 1.00 0.00 H new ATOM 0 HA ILE A 30 2.353 -14.926 -35.531 1.00 0.00 H new ATOM 0 HB ILE A 30 3.144 -16.762 -37.115 1.00 0.00 H new ATOM 0 HG12 ILE A 30 3.369 -14.744 -39.333 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.771 -15.192 -38.382 1.00 0.00 H new ATOM 0 HG21 ILE A 30 1.242 -16.422 -38.749 1.00 0.00 H new ATOM 0 HG22 ILE A 30 0.779 -16.107 -37.060 1.00 0.00 H new ATOM 0 HG23 ILE A 30 1.091 -14.748 -38.166 1.00 0.00 H new ATOM 0 HD11 ILE A 30 4.650 -16.526 -40.447 1.00 0.00 H new ATOM 0 HD12 ILE A 30 4.461 -17.575 -39.021 1.00 0.00 H new ATOM 0 HD13 ILE A 30 3.037 -17.120 -39.987 1.00 0.00 H new ATOM 454 N ALA A 31 5.647 -14.951 -35.821 1.00 0.00 N ATOM 455 CA ALA A 31 6.864 -15.175 -34.987 1.00 0.00 C ATOM 456 C ALA A 31 6.893 -14.467 -33.589 1.00 0.00 C ATOM 457 O ALA A 31 7.290 -15.085 -32.598 1.00 0.00 O ATOM 458 CB ALA A 31 8.073 -14.784 -35.858 1.00 0.00 C ATOM 0 H ALA A 31 5.839 -14.498 -36.715 1.00 0.00 H new ATOM 0 HA ALA A 31 6.879 -16.227 -34.701 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.992 -14.930 -35.291 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.095 -15.408 -36.752 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.989 -13.737 -36.148 1.00 0.00 H new ATOM 464 N LEU A 32 6.432 -13.208 -33.504 1.00 0.00 N ATOM 465 CA LEU A 32 6.203 -12.500 -32.207 1.00 0.00 C ATOM 466 C LEU A 32 5.039 -13.081 -31.324 1.00 0.00 C ATOM 467 O LEU A 32 5.211 -13.207 -30.111 1.00 0.00 O ATOM 468 CB LEU A 32 6.026 -10.984 -32.508 1.00 0.00 C ATOM 469 CG LEU A 32 7.297 -10.223 -32.985 1.00 0.00 C ATOM 470 CD1 LEU A 32 6.911 -8.939 -33.737 1.00 0.00 C ATOM 471 CD2 LEU A 32 8.230 -9.884 -31.808 1.00 0.00 C ATOM 0 H LEU A 32 6.204 -12.643 -34.322 1.00 0.00 H new ATOM 0 HA LEU A 32 7.081 -12.665 -31.582 1.00 0.00 H new ATOM 0 HB2 LEU A 32 5.255 -10.874 -33.271 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.654 -10.497 -31.606 1.00 0.00 H new ATOM 0 HG LEU A 32 7.836 -10.884 -33.664 1.00 0.00 H new ATOM 0 HD11 LEU A 32 7.814 -8.422 -34.062 1.00 0.00 H new ATOM 0 HD12 LEU A 32 6.306 -9.195 -34.607 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.338 -8.288 -33.076 1.00 0.00 H new ATOM 0 HD21 LEU A 32 9.106 -9.353 -32.180 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.700 -9.254 -31.093 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.545 -10.805 -31.316 1.00 0.00 H new ATOM 483 N ARG A 33 3.896 -13.488 -31.914 1.00 0.00 N ATOM 484 CA ARG A 33 2.890 -14.374 -31.250 1.00 0.00 C ATOM 485 C ARG A 33 3.424 -15.756 -30.744 1.00 0.00 C ATOM 486 O ARG A 33 3.156 -16.121 -29.597 1.00 0.00 O ATOM 487 CB ARG A 33 1.683 -14.569 -32.212 1.00 0.00 C ATOM 488 CG ARG A 33 0.742 -13.347 -32.352 1.00 0.00 C ATOM 489 CD ARG A 33 -0.407 -13.457 -33.375 1.00 0.00 C ATOM 490 NE ARG A 33 -1.232 -14.690 -33.198 1.00 0.00 N ATOM 491 CZ ARG A 33 -1.765 -15.416 -34.179 1.00 0.00 C ATOM 492 NH1 ARG A 33 -1.740 -15.058 -35.439 1.00 0.00 N ATOM 493 NH2 ARG A 33 -2.358 -16.531 -33.872 1.00 0.00 N ATOM 0 H ARG A 33 3.635 -13.218 -32.862 1.00 0.00 H new ATOM 0 HA ARG A 33 2.596 -13.859 -30.335 1.00 0.00 H new ATOM 0 HB2 ARG A 33 2.065 -14.827 -33.200 1.00 0.00 H new ATOM 0 HB3 ARG A 33 1.097 -15.420 -31.865 1.00 0.00 H new ATOM 0 HG2 ARG A 33 0.306 -13.143 -31.374 1.00 0.00 H new ATOM 0 HG3 ARG A 33 1.349 -12.481 -32.617 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -1.050 -12.581 -33.286 1.00 0.00 H new ATOM 0 HD3 ARG A 33 0.009 -13.447 -34.382 1.00 0.00 H new ATOM 0 HE ARG A 33 -1.402 -15.003 -32.242 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -1.295 -14.181 -35.711 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -2.165 -15.656 -36.148 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -2.407 -16.831 -32.898 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -2.774 -17.106 -34.605 1.00 0.00 H new ATOM 507 N LYS A 34 4.199 -16.505 -31.555 1.00 0.00 N ATOM 508 CA LYS A 34 4.971 -17.689 -31.092 1.00 0.00 C ATOM 509 C LYS A 34 5.962 -17.405 -29.905 1.00 0.00 C ATOM 510 O LYS A 34 5.886 -18.091 -28.882 1.00 0.00 O ATOM 511 CB LYS A 34 5.649 -18.262 -32.366 1.00 0.00 C ATOM 512 CG LYS A 34 6.190 -19.702 -32.273 1.00 0.00 C ATOM 513 CD LYS A 34 5.103 -20.788 -32.444 1.00 0.00 C ATOM 514 CE LYS A 34 5.708 -22.189 -32.659 1.00 0.00 C ATOM 515 NZ LYS A 34 4.626 -23.178 -32.924 1.00 0.00 N ATOM 0 H LYS A 34 4.311 -16.311 -32.550 1.00 0.00 H new ATOM 0 HA LYS A 34 4.308 -18.424 -30.636 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.928 -18.221 -33.183 1.00 0.00 H new ATOM 0 HB3 LYS A 34 6.475 -17.605 -32.637 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.955 -19.843 -33.037 1.00 0.00 H new ATOM 0 HG3 LYS A 34 6.676 -19.836 -31.307 1.00 0.00 H new ATOM 0 HD2 LYS A 34 4.464 -20.802 -31.561 1.00 0.00 H new ATOM 0 HD3 LYS A 34 4.469 -20.534 -33.293 1.00 0.00 H new ATOM 0 HE2 LYS A 34 6.405 -22.168 -33.496 1.00 0.00 H new ATOM 0 HE3 LYS A 34 6.277 -22.487 -31.778 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 5.044 -24.119 -33.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 3.976 -23.208 -32.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 4.101 -22.898 -33.777 1.00 0.00 H new ATOM 529 N MET A 35 6.796 -16.346 -29.984 1.00 0.00 N ATOM 530 CA MET A 35 7.553 -15.789 -28.817 1.00 0.00 C ATOM 531 C MET A 35 6.679 -14.975 -27.778 1.00 0.00 C ATOM 532 O MET A 35 7.011 -13.860 -27.361 1.00 0.00 O ATOM 533 CB MET A 35 8.680 -14.900 -29.424 1.00 0.00 C ATOM 534 CG MET A 35 9.822 -15.575 -30.217 1.00 0.00 C ATOM 535 SD MET A 35 10.513 -14.438 -31.448 1.00 0.00 S ATOM 536 CE MET A 35 11.096 -13.045 -30.455 1.00 0.00 C ATOM 0 H MET A 35 6.971 -15.845 -30.855 1.00 0.00 H new ATOM 0 HA MET A 35 7.941 -16.616 -28.223 1.00 0.00 H new ATOM 0 HB2 MET A 35 8.206 -14.173 -30.084 1.00 0.00 H new ATOM 0 HB3 MET A 35 9.134 -14.340 -28.606 1.00 0.00 H new ATOM 0 HG2 MET A 35 10.606 -15.896 -29.531 1.00 0.00 H new ATOM 0 HG3 MET A 35 9.446 -16.470 -30.713 1.00 0.00 H new ATOM 0 HE1 MET A 35 11.615 -12.333 -31.096 1.00 0.00 H new ATOM 0 HE2 MET A 35 10.245 -12.554 -29.982 1.00 0.00 H new ATOM 0 HE3 MET A 35 11.779 -13.407 -29.687 1.00 0.00 H new ATOM 546 N GLY A 36 5.578 -15.582 -27.322 1.00 0.00 N ATOM 547 CA GLY A 36 4.541 -14.912 -26.497 1.00 0.00 C ATOM 548 C GLY A 36 3.519 -15.923 -25.937 1.00 0.00 C ATOM 549 O GLY A 36 3.426 -16.099 -24.722 1.00 0.00 O ATOM 0 H GLY A 36 5.370 -16.562 -27.512 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.018 -14.382 -25.673 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.023 -14.166 -27.099 1.00 0.00 H new ATOM 553 N ALA A 37 2.790 -16.624 -26.825 1.00 0.00 N ATOM 554 CA ALA A 37 1.963 -17.806 -26.460 1.00 0.00 C ATOM 555 C ALA A 37 2.714 -18.998 -25.768 1.00 0.00 C ATOM 556 O ALA A 37 2.243 -19.478 -24.733 1.00 0.00 O ATOM 557 CB ALA A 37 1.248 -18.232 -27.759 1.00 0.00 C ATOM 0 H ALA A 37 2.753 -16.393 -27.818 1.00 0.00 H new ATOM 0 HA ALA A 37 1.268 -17.512 -25.673 1.00 0.00 H new ATOM 0 HB1 ALA A 37 0.620 -19.101 -27.561 1.00 0.00 H new ATOM 0 HB2 ALA A 37 0.628 -17.411 -28.119 1.00 0.00 H new ATOM 0 HB3 ALA A 37 1.990 -18.486 -28.516 1.00 0.00 H new ATOM 563 N MET A 38 3.869 -19.454 -26.300 1.00 0.00 N ATOM 564 CA MET A 38 4.763 -20.423 -25.586 1.00 0.00 C ATOM 565 C MET A 38 5.960 -19.824 -24.763 1.00 0.00 C ATOM 566 O MET A 38 6.601 -20.570 -24.018 1.00 0.00 O ATOM 567 CB MET A 38 5.177 -21.568 -26.551 1.00 0.00 C ATOM 568 CG MET A 38 5.994 -21.209 -27.812 1.00 0.00 C ATOM 569 SD MET A 38 6.576 -22.703 -28.648 1.00 0.00 S ATOM 570 CE MET A 38 5.034 -23.411 -29.266 1.00 0.00 C ATOM 0 H MET A 38 4.213 -19.174 -27.218 1.00 0.00 H new ATOM 0 HA MET A 38 4.155 -20.832 -24.779 1.00 0.00 H new ATOM 0 HB2 MET A 38 5.754 -22.293 -25.977 1.00 0.00 H new ATOM 0 HB3 MET A 38 4.267 -22.072 -26.878 1.00 0.00 H new ATOM 0 HG2 MET A 38 5.379 -20.622 -28.494 1.00 0.00 H new ATOM 0 HG3 MET A 38 6.845 -20.587 -27.534 1.00 0.00 H new ATOM 0 HE1 MET A 38 5.258 -24.209 -29.974 1.00 0.00 H new ATOM 0 HE2 MET A 38 4.460 -23.816 -28.433 1.00 0.00 H new ATOM 0 HE3 MET A 38 4.452 -22.636 -29.765 1.00 0.00 H new ATOM 580 N ALA A 39 6.238 -18.505 -24.825 1.00 0.00 N ATOM 581 CA ALA A 39 7.176 -17.832 -23.893 1.00 0.00 C ATOM 582 C ALA A 39 6.481 -17.509 -22.536 1.00 0.00 C ATOM 583 O ALA A 39 5.581 -16.664 -22.476 1.00 0.00 O ATOM 584 CB ALA A 39 7.679 -16.556 -24.594 1.00 0.00 C ATOM 0 H ALA A 39 5.824 -17.878 -25.515 1.00 0.00 H new ATOM 0 HA ALA A 39 8.017 -18.483 -23.655 1.00 0.00 H new ATOM 0 HB1 ALA A 39 8.374 -16.031 -23.939 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.187 -16.826 -25.520 1.00 0.00 H new ATOM 0 HB3 ALA A 39 6.833 -15.907 -24.820 1.00 0.00 H new ATOM 590 N LYS A 40 6.882 -18.197 -21.454 1.00 0.00 N ATOM 591 CA LYS A 40 6.249 -18.023 -20.116 1.00 0.00 C ATOM 592 C LYS A 40 7.250 -17.305 -19.141 1.00 0.00 C ATOM 593 O LYS A 40 8.074 -18.001 -18.537 1.00 0.00 O ATOM 594 CB LYS A 40 5.677 -19.378 -19.614 1.00 0.00 C ATOM 595 CG LYS A 40 4.521 -19.950 -20.481 1.00 0.00 C ATOM 596 CD LYS A 40 3.685 -21.020 -19.753 1.00 0.00 C ATOM 597 CE LYS A 40 2.561 -21.585 -20.641 1.00 0.00 C ATOM 598 NZ LYS A 40 1.739 -22.532 -19.840 1.00 0.00 N ATOM 0 H LYS A 40 7.639 -18.880 -21.469 1.00 0.00 H new ATOM 0 HA LYS A 40 5.385 -17.361 -20.173 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.485 -20.109 -19.580 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.319 -19.251 -18.592 1.00 0.00 H new ATOM 0 HG2 LYS A 40 3.867 -19.133 -20.786 1.00 0.00 H new ATOM 0 HG3 LYS A 40 4.938 -20.382 -21.391 1.00 0.00 H new ATOM 0 HD2 LYS A 40 4.337 -21.833 -19.434 1.00 0.00 H new ATOM 0 HD3 LYS A 40 3.251 -20.588 -18.852 1.00 0.00 H new ATOM 0 HE2 LYS A 40 1.939 -20.775 -21.021 1.00 0.00 H new ATOM 0 HE3 LYS A 40 2.985 -22.094 -21.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 0.852 -22.735 -20.345 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 2.267 -23.417 -19.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 1.522 -22.107 -18.916 1.00 0.00 H new ATOM 612 N PRO A 41 7.251 -15.943 -18.974 1.00 0.00 N ATOM 613 CA PRO A 41 8.356 -15.226 -18.278 1.00 0.00 C ATOM 614 C PRO A 41 8.282 -15.161 -16.727 1.00 0.00 C ATOM 615 O PRO A 41 7.198 -15.153 -16.134 1.00 0.00 O ATOM 616 CB PRO A 41 8.253 -13.812 -18.890 1.00 0.00 C ATOM 617 CG PRO A 41 6.777 -13.636 -19.241 1.00 0.00 C ATOM 618 CD PRO A 41 6.364 -15.022 -19.718 1.00 0.00 C ATOM 0 HA PRO A 41 9.300 -15.751 -18.426 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.583 -13.051 -18.183 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.882 -13.719 -19.775 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.193 -13.317 -18.378 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.635 -12.884 -20.017 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.314 -15.220 -19.503 1.00 0.00 H new ATOM 0 HD3 PRO A 41 6.494 -15.127 -20.795 1.00 0.00 H new ATOM 626 N ASP A 42 9.465 -14.975 -16.118 1.00 0.00 N ATOM 627 CA ASP A 42 9.597 -14.500 -14.714 1.00 0.00 C ATOM 628 C ASP A 42 9.467 -12.934 -14.698 1.00 0.00 C ATOM 629 O ASP A 42 10.417 -12.194 -14.977 1.00 0.00 O ATOM 630 CB ASP A 42 10.953 -14.991 -14.123 1.00 0.00 C ATOM 631 CG ASP A 42 11.038 -16.421 -13.572 1.00 0.00 C ATOM 632 OD1 ASP A 42 10.521 -17.379 -14.180 1.00 0.00 O ATOM 633 OD2 ASP A 42 11.680 -16.607 -12.514 1.00 0.00 O ATOM 0 H ASP A 42 10.360 -15.147 -16.576 1.00 0.00 H new ATOM 0 HA ASP A 42 8.806 -14.910 -14.086 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.709 -14.890 -14.901 1.00 0.00 H new ATOM 0 HB3 ASP A 42 11.230 -14.309 -13.319 1.00 0.00 H new ATOM 638 N CYS A 43 8.259 -12.430 -14.402 1.00 0.00 N ATOM 639 CA CYS A 43 7.952 -10.980 -14.382 1.00 0.00 C ATOM 640 C CYS A 43 8.282 -10.334 -13.002 1.00 0.00 C ATOM 641 O CYS A 43 7.579 -10.546 -12.009 1.00 0.00 O ATOM 642 CB CYS A 43 6.475 -10.832 -14.807 1.00 0.00 C ATOM 643 SG CYS A 43 6.020 -9.071 -14.950 1.00 0.00 S ATOM 0 H CYS A 43 7.458 -13.016 -14.167 1.00 0.00 H new ATOM 0 HA CYS A 43 8.583 -10.431 -15.081 1.00 0.00 H new ATOM 0 HB2 CYS A 43 6.314 -11.333 -15.761 1.00 0.00 H new ATOM 0 HB3 CYS A 43 5.830 -11.321 -14.077 1.00 0.00 H new ATOM 0 HG CYS A 43 4.775 -8.972 -15.310 1.00 0.00 H new ATOM 649 N ILE A 44 9.362 -9.540 -12.949 1.00 0.00 N ATOM 650 CA ILE A 44 9.852 -8.900 -11.693 1.00 0.00 C ATOM 651 C ILE A 44 9.186 -7.489 -11.583 1.00 0.00 C ATOM 652 O ILE A 44 9.575 -6.567 -12.306 1.00 0.00 O ATOM 653 CB ILE A 44 11.424 -8.854 -11.640 1.00 0.00 C ATOM 654 CG1 ILE A 44 12.130 -10.236 -11.808 1.00 0.00 C ATOM 655 CG2 ILE A 44 11.941 -8.193 -10.330 1.00 0.00 C ATOM 656 CD1 ILE A 44 13.578 -10.136 -12.323 1.00 0.00 C ATOM 0 H ILE A 44 9.928 -9.316 -13.768 1.00 0.00 H new ATOM 0 HA ILE A 44 9.564 -9.492 -10.824 1.00 0.00 H new ATOM 0 HB ILE A 44 11.689 -8.248 -12.507 1.00 0.00 H new ATOM 0 HG12 ILE A 44 12.131 -10.752 -10.848 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.550 -10.848 -12.499 1.00 0.00 H new ATOM 0 HG21 ILE A 44 13.031 -8.181 -10.334 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.567 -7.171 -10.266 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.587 -8.763 -9.471 1.00 0.00 H new ATOM 0 HD11 ILE A 44 14.002 -11.136 -12.414 1.00 0.00 H new ATOM 0 HD12 ILE A 44 13.585 -9.649 -13.298 1.00 0.00 H new ATOM 0 HD13 ILE A 44 14.174 -9.552 -11.622 1.00 0.00 H new ATOM 668 N ILE A 45 8.208 -7.325 -10.674 1.00 0.00 N ATOM 669 CA ILE A 45 7.602 -5.992 -10.361 1.00 0.00 C ATOM 670 C ILE A 45 8.335 -5.446 -9.096 1.00 0.00 C ATOM 671 O ILE A 45 8.110 -5.959 -7.999 1.00 0.00 O ATOM 672 CB ILE A 45 6.038 -6.067 -10.163 1.00 0.00 C ATOM 673 CG1 ILE A 45 5.290 -6.631 -11.408 1.00 0.00 C ATOM 674 CG2 ILE A 45 5.433 -4.686 -9.774 1.00 0.00 C ATOM 675 CD1 ILE A 45 3.788 -6.912 -11.229 1.00 0.00 C ATOM 0 H ILE A 45 7.811 -8.094 -10.135 1.00 0.00 H new ATOM 0 HA ILE A 45 7.737 -5.312 -11.202 1.00 0.00 H new ATOM 0 HB ILE A 45 5.889 -6.766 -9.340 1.00 0.00 H new ATOM 0 HG12 ILE A 45 5.411 -5.925 -12.229 1.00 0.00 H new ATOM 0 HG13 ILE A 45 5.778 -7.558 -11.710 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.355 -4.784 -9.648 1.00 0.00 H new ATOM 0 HG22 ILE A 45 5.878 -4.344 -8.840 1.00 0.00 H new ATOM 0 HG23 ILE A 45 5.642 -3.962 -10.562 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.377 -7.301 -12.161 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.647 -7.647 -10.436 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.274 -5.988 -10.963 1.00 0.00 H new ATOM 687 N THR A 46 9.157 -4.393 -9.244 1.00 0.00 N ATOM 688 CA THR A 46 9.768 -3.671 -8.085 1.00 0.00 C ATOM 689 C THR A 46 9.148 -2.242 -7.948 1.00 0.00 C ATOM 690 O THR A 46 9.152 -1.457 -8.901 1.00 0.00 O ATOM 691 CB THR A 46 11.323 -3.715 -8.139 1.00 0.00 C ATOM 692 OG1 THR A 46 11.843 -3.120 -6.958 1.00 0.00 O ATOM 693 CG2 THR A 46 12.015 -3.023 -9.324 1.00 0.00 C ATOM 0 H THR A 46 9.422 -4.012 -10.153 1.00 0.00 H new ATOM 0 HA THR A 46 9.519 -4.188 -7.158 1.00 0.00 H new ATOM 0 HB THR A 46 11.539 -4.777 -8.251 1.00 0.00 H new ATOM 0 HG1 THR A 46 12.822 -3.145 -6.983 1.00 0.00 H new ATOM 0 HG21 THR A 46 13.095 -3.134 -9.230 1.00 0.00 H new ATOM 0 HG22 THR A 46 11.683 -3.480 -10.256 1.00 0.00 H new ATOM 0 HG23 THR A 46 11.758 -1.964 -9.327 1.00 0.00 H new ATOM 701 N CYS A 47 8.585 -1.922 -6.769 1.00 0.00 N ATOM 702 CA CYS A 47 7.791 -0.684 -6.546 1.00 0.00 C ATOM 703 C CYS A 47 8.449 0.269 -5.500 1.00 0.00 C ATOM 704 O CYS A 47 8.215 0.155 -4.292 1.00 0.00 O ATOM 705 CB CYS A 47 6.360 -1.140 -6.174 1.00 0.00 C ATOM 706 SG CYS A 47 6.339 -2.160 -4.657 1.00 0.00 S ATOM 0 H CYS A 47 8.663 -2.510 -5.939 1.00 0.00 H new ATOM 0 HA CYS A 47 7.755 -0.072 -7.447 1.00 0.00 H new ATOM 0 HB2 CYS A 47 5.726 -0.265 -6.031 1.00 0.00 H new ATOM 0 HB3 CYS A 47 5.935 -1.710 -7.000 1.00 0.00 H new ATOM 0 HG CYS A 47 5.189 -2.032 -4.064 1.00 0.00 H new ATOM 712 N ASP A 48 9.246 1.251 -5.963 1.00 0.00 N ATOM 713 CA ASP A 48 9.865 2.277 -5.075 1.00 0.00 C ATOM 714 C ASP A 48 8.935 3.537 -4.950 1.00 0.00 C ATOM 715 O ASP A 48 9.167 4.592 -5.552 1.00 0.00 O ATOM 716 CB ASP A 48 11.285 2.511 -5.654 1.00 0.00 C ATOM 717 CG ASP A 48 12.182 3.488 -4.899 1.00 0.00 C ATOM 718 OD1 ASP A 48 12.213 3.452 -3.650 1.00 0.00 O ATOM 719 OD2 ASP A 48 12.876 4.287 -5.566 1.00 0.00 O ATOM 0 H ASP A 48 9.482 1.363 -6.949 1.00 0.00 H new ATOM 0 HA ASP A 48 9.972 1.967 -4.035 1.00 0.00 H new ATOM 0 HB2 ASP A 48 11.795 1.549 -5.702 1.00 0.00 H new ATOM 0 HB3 ASP A 48 11.180 2.868 -6.678 1.00 0.00 H new ATOM 724 N GLY A 49 7.839 3.397 -4.173 1.00 0.00 N ATOM 725 CA GLY A 49 6.843 4.484 -3.956 1.00 0.00 C ATOM 726 C GLY A 49 6.003 4.905 -5.185 1.00 0.00 C ATOM 727 O GLY A 49 4.877 4.441 -5.378 1.00 0.00 O ATOM 0 H GLY A 49 7.615 2.534 -3.678 1.00 0.00 H new ATOM 0 HA2 GLY A 49 6.160 4.168 -3.168 1.00 0.00 H new ATOM 0 HA3 GLY A 49 7.372 5.363 -3.587 1.00 0.00 H new ATOM 731 N LYS A 50 6.583 5.801 -5.995 1.00 0.00 N ATOM 732 CA LYS A 50 6.031 6.174 -7.331 1.00 0.00 C ATOM 733 C LYS A 50 6.752 5.496 -8.542 1.00 0.00 C ATOM 734 O LYS A 50 6.074 5.037 -9.465 1.00 0.00 O ATOM 735 CB LYS A 50 6.002 7.717 -7.499 1.00 0.00 C ATOM 736 CG LYS A 50 4.966 8.474 -6.630 1.00 0.00 C ATOM 737 CD LYS A 50 4.678 9.914 -7.118 1.00 0.00 C ATOM 738 CE LYS A 50 3.773 9.944 -8.366 1.00 0.00 C ATOM 739 NZ LYS A 50 3.559 11.321 -8.866 1.00 0.00 N ATOM 0 H LYS A 50 7.444 6.293 -5.756 1.00 0.00 H new ATOM 0 HA LYS A 50 5.013 5.785 -7.347 1.00 0.00 H new ATOM 0 HB2 LYS A 50 6.994 8.107 -7.269 1.00 0.00 H new ATOM 0 HB3 LYS A 50 5.805 7.945 -8.546 1.00 0.00 H new ATOM 0 HG2 LYS A 50 4.033 7.910 -6.619 1.00 0.00 H new ATOM 0 HG3 LYS A 50 5.327 8.514 -5.602 1.00 0.00 H new ATOM 0 HD2 LYS A 50 4.203 10.478 -6.315 1.00 0.00 H new ATOM 0 HD3 LYS A 50 5.620 10.413 -7.344 1.00 0.00 H new ATOM 0 HE2 LYS A 50 4.222 9.339 -9.153 1.00 0.00 H new ATOM 0 HE3 LYS A 50 2.810 9.492 -8.126 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 2.719 11.341 -9.479 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 3.416 11.964 -8.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 4.391 11.626 -9.410 1.00 0.00 H new ATOM 753 N ASN A 51 8.097 5.481 -8.581 1.00 0.00 N ATOM 754 CA ASN A 51 8.883 4.872 -9.691 1.00 0.00 C ATOM 755 C ASN A 51 8.912 3.307 -9.601 1.00 0.00 C ATOM 756 O ASN A 51 9.396 2.724 -8.628 1.00 0.00 O ATOM 757 CB ASN A 51 10.284 5.543 -9.800 1.00 0.00 C ATOM 758 CG ASN A 51 11.161 5.642 -8.539 1.00 0.00 C ATOM 759 OD1 ASN A 51 10.997 6.548 -7.729 1.00 0.00 O ATOM 760 ND2 ASN A 51 12.100 4.752 -8.337 1.00 0.00 N ATOM 0 H ASN A 51 8.678 5.888 -7.848 1.00 0.00 H new ATOM 0 HA ASN A 51 8.379 5.077 -10.636 1.00 0.00 H new ATOM 0 HB2 ASN A 51 10.852 4.999 -10.555 1.00 0.00 H new ATOM 0 HB3 ASN A 51 10.137 6.554 -10.179 1.00 0.00 H new ATOM 0 HD21 ASN A 51 12.692 4.814 -7.508 1.00 0.00 H new ATOM 0 HD22 ASN A 51 12.240 3.997 -9.008 1.00 0.00 H new ATOM 767 N LEU A 52 8.326 2.639 -10.608 1.00 0.00 N ATOM 768 CA LEU A 52 7.910 1.213 -10.515 1.00 0.00 C ATOM 769 C LEU A 52 8.411 0.439 -11.774 1.00 0.00 C ATOM 770 O LEU A 52 7.956 0.686 -12.891 1.00 0.00 O ATOM 771 CB LEU A 52 6.366 1.238 -10.294 1.00 0.00 C ATOM 772 CG LEU A 52 5.647 -0.119 -10.060 1.00 0.00 C ATOM 773 CD1 LEU A 52 4.393 0.081 -9.187 1.00 0.00 C ATOM 774 CD2 LEU A 52 5.227 -0.787 -11.378 1.00 0.00 C ATOM 0 H LEU A 52 8.123 3.064 -11.513 1.00 0.00 H new ATOM 0 HA LEU A 52 8.355 0.667 -9.683 1.00 0.00 H new ATOM 0 HB2 LEU A 52 6.161 1.878 -9.436 1.00 0.00 H new ATOM 0 HB3 LEU A 52 5.911 1.713 -11.163 1.00 0.00 H new ATOM 0 HG LEU A 52 6.361 -0.769 -9.554 1.00 0.00 H new ATOM 0 HD11 LEU A 52 3.900 -0.879 -9.032 1.00 0.00 H new ATOM 0 HD12 LEU A 52 4.684 0.499 -8.223 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.707 0.764 -9.687 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.728 -1.732 -11.164 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.544 -0.131 -11.917 1.00 0.00 H new ATOM 0 HD23 LEU A 52 6.110 -0.973 -11.989 1.00 0.00 H new ATOM 786 N THR A 53 9.356 -0.499 -11.614 1.00 0.00 N ATOM 787 CA THR A 53 10.019 -1.185 -12.768 1.00 0.00 C ATOM 788 C THR A 53 9.481 -2.637 -12.951 1.00 0.00 C ATOM 789 O THR A 53 9.498 -3.449 -12.020 1.00 0.00 O ATOM 790 CB THR A 53 11.570 -1.054 -12.670 1.00 0.00 C ATOM 791 OG1 THR A 53 11.954 0.314 -12.783 1.00 0.00 O ATOM 792 CG2 THR A 53 12.355 -1.774 -13.776 1.00 0.00 C ATOM 0 H THR A 53 9.689 -0.811 -10.702 1.00 0.00 H new ATOM 0 HA THR A 53 9.751 -0.681 -13.696 1.00 0.00 H new ATOM 0 HB THR A 53 11.809 -1.508 -11.708 1.00 0.00 H new ATOM 0 HG1 THR A 53 12.349 0.471 -13.666 1.00 0.00 H new ATOM 0 HG21 THR A 53 13.423 -1.624 -13.621 1.00 0.00 H new ATOM 0 HG22 THR A 53 12.130 -2.840 -13.747 1.00 0.00 H new ATOM 0 HG23 THR A 53 12.069 -1.370 -14.747 1.00 0.00 H new ATOM 800 N ILE A 54 9.017 -2.946 -14.178 1.00 0.00 N ATOM 801 CA ILE A 54 8.444 -4.278 -14.532 1.00 0.00 C ATOM 802 C ILE A 54 9.435 -4.935 -15.556 1.00 0.00 C ATOM 803 O ILE A 54 9.455 -4.597 -16.745 1.00 0.00 O ATOM 804 CB ILE A 54 6.941 -4.164 -14.988 1.00 0.00 C ATOM 805 CG1 ILE A 54 6.051 -3.465 -13.902 1.00 0.00 C ATOM 806 CG2 ILE A 54 6.363 -5.553 -15.371 1.00 0.00 C ATOM 807 CD1 ILE A 54 4.527 -3.416 -14.118 1.00 0.00 C ATOM 0 H ILE A 54 9.025 -2.287 -14.956 1.00 0.00 H new ATOM 0 HA ILE A 54 8.370 -4.944 -13.672 1.00 0.00 H new ATOM 0 HB ILE A 54 6.923 -3.534 -15.877 1.00 0.00 H new ATOM 0 HG12 ILE A 54 6.235 -3.965 -12.951 1.00 0.00 H new ATOM 0 HG13 ILE A 54 6.403 -2.439 -13.795 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.324 -5.442 -15.681 1.00 0.00 H new ATOM 0 HG22 ILE A 54 6.944 -5.975 -16.191 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.415 -6.219 -14.510 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.057 -2.901 -13.280 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.308 -2.881 -15.042 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.136 -4.431 -14.185 1.00 0.00 H new ATOM 819 N LYS A 55 10.269 -5.867 -15.060 1.00 0.00 N ATOM 820 CA LYS A 55 11.322 -6.557 -15.857 1.00 0.00 C ATOM 821 C LYS A 55 10.854 -8.010 -16.199 1.00 0.00 C ATOM 822 O LYS A 55 10.809 -8.890 -15.336 1.00 0.00 O ATOM 823 CB LYS A 55 12.631 -6.449 -15.027 1.00 0.00 C ATOM 824 CG LYS A 55 13.870 -7.150 -15.626 1.00 0.00 C ATOM 825 CD LYS A 55 15.163 -6.888 -14.820 1.00 0.00 C ATOM 826 CE LYS A 55 16.266 -7.890 -15.202 1.00 0.00 C ATOM 827 NZ LYS A 55 17.577 -7.527 -14.604 1.00 0.00 N ATOM 0 H LYS A 55 10.238 -6.171 -14.087 1.00 0.00 H new ATOM 0 HA LYS A 55 11.509 -6.104 -16.830 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.866 -5.393 -14.890 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.446 -6.865 -14.037 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.687 -8.224 -15.669 1.00 0.00 H new ATOM 0 HG3 LYS A 55 14.013 -6.809 -16.651 1.00 0.00 H new ATOM 0 HD2 LYS A 55 15.511 -5.872 -15.005 1.00 0.00 H new ATOM 0 HD3 LYS A 55 14.952 -6.964 -13.753 1.00 0.00 H new ATOM 0 HE2 LYS A 55 15.980 -8.888 -14.871 1.00 0.00 H new ATOM 0 HE3 LYS A 55 16.361 -7.929 -16.287 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 18.293 -8.227 -14.886 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 17.863 -6.585 -14.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 17.494 -7.514 -13.567 1.00 0.00 H new ATOM 841 N THR A 56 10.469 -8.240 -17.463 1.00 0.00 N ATOM 842 CA THR A 56 9.818 -9.503 -17.916 1.00 0.00 C ATOM 843 C THR A 56 10.865 -10.468 -18.553 1.00 0.00 C ATOM 844 O THR A 56 11.324 -10.237 -19.676 1.00 0.00 O ATOM 845 CB THR A 56 8.650 -9.112 -18.874 1.00 0.00 C ATOM 846 OG1 THR A 56 7.754 -8.216 -18.219 1.00 0.00 O ATOM 847 CG2 THR A 56 7.800 -10.300 -19.336 1.00 0.00 C ATOM 0 H THR A 56 10.596 -7.559 -18.212 1.00 0.00 H new ATOM 0 HA THR A 56 9.399 -10.061 -17.079 1.00 0.00 H new ATOM 0 HB THR A 56 9.138 -8.665 -19.740 1.00 0.00 H new ATOM 0 HG1 THR A 56 7.026 -7.976 -18.830 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.010 -9.946 -19.998 1.00 0.00 H new ATOM 0 HG22 THR A 56 8.429 -11.012 -19.870 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.355 -10.788 -18.469 1.00 0.00 H new ATOM 855 N GLU A 57 11.225 -11.544 -17.831 1.00 0.00 N ATOM 856 CA GLU A 57 12.400 -12.393 -18.174 1.00 0.00 C ATOM 857 C GLU A 57 11.950 -13.751 -18.812 1.00 0.00 C ATOM 858 O GLU A 57 11.598 -14.698 -18.101 1.00 0.00 O ATOM 859 CB GLU A 57 13.238 -12.612 -16.875 1.00 0.00 C ATOM 860 CG GLU A 57 13.786 -11.363 -16.131 1.00 0.00 C ATOM 861 CD GLU A 57 15.062 -10.734 -16.654 1.00 0.00 C ATOM 862 OE1 GLU A 57 14.982 -9.794 -17.470 1.00 0.00 O ATOM 863 OE2 GLU A 57 16.149 -11.084 -16.148 1.00 0.00 O ATOM 0 H GLU A 57 10.721 -11.855 -17.000 1.00 0.00 H new ATOM 0 HA GLU A 57 13.016 -11.894 -18.922 1.00 0.00 H new ATOM 0 HB2 GLU A 57 12.622 -13.173 -16.173 1.00 0.00 H new ATOM 0 HB3 GLU A 57 14.087 -13.246 -17.130 1.00 0.00 H new ATOM 0 HG2 GLU A 57 13.008 -10.600 -16.140 1.00 0.00 H new ATOM 0 HG3 GLU A 57 13.951 -11.639 -15.089 1.00 0.00 H new ATOM 870 N SER A 58 11.981 -13.859 -20.153 1.00 0.00 N ATOM 871 CA SER A 58 11.862 -15.168 -20.871 1.00 0.00 C ATOM 872 C SER A 58 13.015 -15.364 -21.907 1.00 0.00 C ATOM 873 O SER A 58 13.464 -14.424 -22.573 1.00 0.00 O ATOM 874 CB SER A 58 10.460 -15.430 -21.498 1.00 0.00 C ATOM 875 OG SER A 58 9.801 -14.294 -22.062 1.00 0.00 O ATOM 0 H SER A 58 12.088 -13.058 -20.775 1.00 0.00 H new ATOM 0 HA SER A 58 11.970 -15.931 -20.100 1.00 0.00 H new ATOM 0 HB2 SER A 58 10.568 -16.185 -22.276 1.00 0.00 H new ATOM 0 HB3 SER A 58 9.814 -15.855 -20.729 1.00 0.00 H new ATOM 0 HG SER A 58 10.355 -13.916 -22.776 1.00 0.00 H new ATOM 881 N THR A 59 13.470 -16.622 -22.061 1.00 0.00 N ATOM 882 CA THR A 59 14.548 -17.007 -23.031 1.00 0.00 C ATOM 883 C THR A 59 14.218 -16.766 -24.541 1.00 0.00 C ATOM 884 O THR A 59 15.047 -16.206 -25.261 1.00 0.00 O ATOM 885 CB THR A 59 15.017 -18.478 -22.798 1.00 0.00 C ATOM 886 OG1 THR A 59 13.925 -19.389 -22.899 1.00 0.00 O ATOM 887 CG2 THR A 59 15.705 -18.739 -21.448 1.00 0.00 C ATOM 0 H THR A 59 13.110 -17.410 -21.523 1.00 0.00 H new ATOM 0 HA THR A 59 15.364 -16.318 -22.811 1.00 0.00 H new ATOM 0 HB THR A 59 15.756 -18.637 -23.583 1.00 0.00 H new ATOM 0 HG1 THR A 59 14.247 -20.303 -22.751 1.00 0.00 H new ATOM 0 HG21 THR A 59 15.993 -19.788 -21.383 1.00 0.00 H new ATOM 0 HG22 THR A 59 16.594 -18.113 -21.366 1.00 0.00 H new ATOM 0 HG23 THR A 59 15.017 -18.501 -20.637 1.00 0.00 H new ATOM 895 N LEU A 60 13.007 -17.131 -25.008 1.00 0.00 N ATOM 896 CA LEU A 60 12.473 -16.681 -26.330 1.00 0.00 C ATOM 897 C LEU A 60 12.388 -15.126 -26.532 1.00 0.00 C ATOM 898 O LEU A 60 12.743 -14.642 -27.609 1.00 0.00 O ATOM 899 CB LEU A 60 11.085 -17.346 -26.575 1.00 0.00 C ATOM 900 CG LEU A 60 11.067 -18.861 -26.912 1.00 0.00 C ATOM 901 CD1 LEU A 60 9.631 -19.410 -26.826 1.00 0.00 C ATOM 902 CD2 LEU A 60 11.623 -19.158 -28.317 1.00 0.00 C ATOM 0 H LEU A 60 12.370 -17.739 -24.494 1.00 0.00 H new ATOM 0 HA LEU A 60 13.202 -17.007 -27.072 1.00 0.00 H new ATOM 0 HB2 LEU A 60 10.476 -17.192 -25.684 1.00 0.00 H new ATOM 0 HB3 LEU A 60 10.596 -16.814 -27.391 1.00 0.00 H new ATOM 0 HG LEU A 60 11.709 -19.350 -26.179 1.00 0.00 H new ATOM 0 HD11 LEU A 60 9.633 -20.474 -27.065 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.246 -19.265 -25.817 1.00 0.00 H new ATOM 0 HD13 LEU A 60 8.996 -18.880 -27.536 1.00 0.00 H new ATOM 0 HD21 LEU A 60 11.588 -20.232 -28.503 1.00 0.00 H new ATOM 0 HD22 LEU A 60 11.020 -18.641 -29.064 1.00 0.00 H new ATOM 0 HD23 LEU A 60 12.655 -18.812 -28.381 1.00 0.00 H new ATOM 914 N LYS A 61 11.915 -14.353 -25.530 1.00 0.00 N ATOM 915 CA LYS A 61 11.908 -12.866 -25.591 1.00 0.00 C ATOM 916 C LYS A 61 11.912 -12.246 -24.155 1.00 0.00 C ATOM 917 O LYS A 61 11.043 -12.546 -23.332 1.00 0.00 O ATOM 918 CB LYS A 61 10.695 -12.396 -26.442 1.00 0.00 C ATOM 919 CG LYS A 61 10.633 -10.896 -26.805 1.00 0.00 C ATOM 920 CD LYS A 61 11.817 -10.369 -27.652 1.00 0.00 C ATOM 921 CE LYS A 61 11.545 -8.942 -28.155 1.00 0.00 C ATOM 922 NZ LYS A 61 12.670 -8.399 -28.958 1.00 0.00 N ATOM 0 H LYS A 61 11.531 -14.731 -24.664 1.00 0.00 H new ATOM 0 HA LYS A 61 12.818 -12.512 -26.076 1.00 0.00 H new ATOM 0 HB2 LYS A 61 10.689 -12.969 -27.369 1.00 0.00 H new ATOM 0 HB3 LYS A 61 9.783 -12.652 -25.903 1.00 0.00 H new ATOM 0 HG2 LYS A 61 9.707 -10.709 -27.349 1.00 0.00 H new ATOM 0 HG3 LYS A 61 10.583 -10.318 -25.882 1.00 0.00 H new ATOM 0 HD2 LYS A 61 12.729 -10.380 -27.055 1.00 0.00 H new ATOM 0 HD3 LYS A 61 11.984 -11.032 -28.501 1.00 0.00 H new ATOM 0 HE2 LYS A 61 10.637 -8.940 -28.759 1.00 0.00 H new ATOM 0 HE3 LYS A 61 11.362 -8.288 -27.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 12.438 -7.436 -29.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 13.532 -8.375 -28.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 12.829 -9.006 -29.787 1.00 0.00 H new ATOM 936 N THR A 62 12.882 -11.364 -23.866 1.00 0.00 N ATOM 937 CA THR A 62 12.938 -10.575 -22.594 1.00 0.00 C ATOM 938 C THR A 62 12.679 -9.054 -22.886 1.00 0.00 C ATOM 939 O THR A 62 13.137 -8.509 -23.898 1.00 0.00 O ATOM 940 CB THR A 62 14.302 -10.887 -21.897 1.00 0.00 C ATOM 941 OG1 THR A 62 14.297 -12.228 -21.412 1.00 0.00 O ATOM 942 CG2 THR A 62 14.657 -10.026 -20.671 1.00 0.00 C ATOM 0 H THR A 62 13.657 -11.167 -24.499 1.00 0.00 H new ATOM 0 HA THR A 62 12.148 -10.861 -21.899 1.00 0.00 H new ATOM 0 HB THR A 62 15.033 -10.681 -22.679 1.00 0.00 H new ATOM 0 HG1 THR A 62 13.915 -12.821 -22.093 1.00 0.00 H new ATOM 0 HG21 THR A 62 15.624 -10.337 -20.276 1.00 0.00 H new ATOM 0 HG22 THR A 62 14.705 -8.977 -20.964 1.00 0.00 H new ATOM 0 HG23 THR A 62 13.894 -10.154 -19.903 1.00 0.00 H new ATOM 950 N THR A 63 11.945 -8.366 -21.988 1.00 0.00 N ATOM 951 CA THR A 63 11.703 -6.888 -22.083 1.00 0.00 C ATOM 952 C THR A 63 11.650 -6.194 -20.675 1.00 0.00 C ATOM 953 O THR A 63 11.401 -6.828 -19.646 1.00 0.00 O ATOM 954 CB THR A 63 10.475 -6.570 -22.999 1.00 0.00 C ATOM 955 OG1 THR A 63 10.461 -5.179 -23.302 1.00 0.00 O ATOM 956 CG2 THR A 63 9.086 -6.930 -22.443 1.00 0.00 C ATOM 0 H THR A 63 11.502 -8.802 -21.179 1.00 0.00 H new ATOM 0 HA THR A 63 12.567 -6.441 -22.575 1.00 0.00 H new ATOM 0 HB THR A 63 10.626 -7.210 -23.869 1.00 0.00 H new ATOM 0 HG1 THR A 63 9.694 -4.977 -23.877 1.00 0.00 H new ATOM 0 HG21 THR A 63 8.321 -6.660 -23.172 1.00 0.00 H new ATOM 0 HG22 THR A 63 9.039 -8.001 -22.247 1.00 0.00 H new ATOM 0 HG23 THR A 63 8.912 -6.384 -21.516 1.00 0.00 H new ATOM 964 N GLN A 64 11.883 -4.870 -20.626 1.00 0.00 N ATOM 965 CA GLN A 64 11.827 -4.072 -19.366 1.00 0.00 C ATOM 966 C GLN A 64 11.210 -2.669 -19.650 1.00 0.00 C ATOM 967 O GLN A 64 11.728 -1.917 -20.482 1.00 0.00 O ATOM 968 CB GLN A 64 13.260 -4.015 -18.753 1.00 0.00 C ATOM 969 CG GLN A 64 13.445 -3.230 -17.419 1.00 0.00 C ATOM 970 CD GLN A 64 13.675 -1.712 -17.525 1.00 0.00 C ATOM 971 OE1 GLN A 64 12.854 -0.887 -17.137 1.00 0.00 O ATOM 972 NE2 GLN A 64 14.813 -1.281 -18.014 1.00 0.00 N ATOM 0 H GLN A 64 12.115 -4.315 -21.450 1.00 0.00 H new ATOM 0 HA GLN A 64 11.175 -4.540 -18.629 1.00 0.00 H new ATOM 0 HB2 GLN A 64 13.596 -5.039 -18.589 1.00 0.00 H new ATOM 0 HB3 GLN A 64 13.926 -3.576 -19.496 1.00 0.00 H new ATOM 0 HG2 GLN A 64 12.561 -3.396 -16.803 1.00 0.00 H new ATOM 0 HG3 GLN A 64 14.291 -3.664 -16.886 1.00 0.00 H new ATOM 0 HE21 GLN A 64 15.512 -1.947 -18.343 1.00 0.00 H new ATOM 0 HE22 GLN A 64 14.999 -0.279 -18.065 1.00 0.00 H new ATOM 981 N PHE A 65 10.147 -2.295 -18.911 1.00 0.00 N ATOM 982 CA PHE A 65 9.696 -0.875 -18.821 1.00 0.00 C ATOM 983 C PHE A 65 9.777 -0.350 -17.350 1.00 0.00 C ATOM 984 O PHE A 65 9.480 -1.071 -16.388 1.00 0.00 O ATOM 985 CB PHE A 65 8.317 -0.661 -19.514 1.00 0.00 C ATOM 986 CG PHE A 65 7.043 -1.250 -18.871 1.00 0.00 C ATOM 987 CD1 PHE A 65 6.483 -0.659 -17.732 1.00 0.00 C ATOM 988 CD2 PHE A 65 6.388 -2.331 -19.471 1.00 0.00 C ATOM 989 CE1 PHE A 65 5.298 -1.150 -17.192 1.00 0.00 C ATOM 990 CE2 PHE A 65 5.196 -2.814 -18.937 1.00 0.00 C ATOM 991 CZ PHE A 65 4.657 -2.226 -17.796 1.00 0.00 C ATOM 0 H PHE A 65 9.581 -2.946 -18.367 1.00 0.00 H new ATOM 0 HA PHE A 65 10.388 -0.252 -19.388 1.00 0.00 H new ATOM 0 HB2 PHE A 65 8.165 0.414 -19.614 1.00 0.00 H new ATOM 0 HB3 PHE A 65 8.392 -1.068 -20.522 1.00 0.00 H new ATOM 0 HD1 PHE A 65 6.974 0.184 -17.269 1.00 0.00 H new ATOM 0 HD2 PHE A 65 6.809 -2.793 -20.352 1.00 0.00 H new ATOM 0 HE1 PHE A 65 4.878 -0.697 -16.306 1.00 0.00 H new ATOM 0 HE2 PHE A 65 4.690 -3.644 -19.408 1.00 0.00 H new ATOM 0 HZ PHE A 65 3.737 -2.607 -17.378 1.00 0.00 H new ATOM 1001 N SER A 66 10.156 0.930 -17.185 1.00 0.00 N ATOM 1002 CA SER A 66 10.162 1.605 -15.861 1.00 0.00 C ATOM 1003 C SER A 66 9.069 2.716 -15.824 1.00 0.00 C ATOM 1004 O SER A 66 9.140 3.730 -16.525 1.00 0.00 O ATOM 1005 CB SER A 66 11.592 2.067 -15.509 1.00 0.00 C ATOM 1006 OG SER A 66 12.468 0.951 -15.333 1.00 0.00 O ATOM 0 H SER A 66 10.465 1.526 -17.953 1.00 0.00 H new ATOM 0 HA SER A 66 9.887 0.911 -15.066 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.974 2.711 -16.301 1.00 0.00 H new ATOM 0 HB3 SER A 66 11.570 2.663 -14.596 1.00 0.00 H new ATOM 0 HG SER A 66 12.453 0.393 -16.139 1.00 0.00 H new ATOM 1012 N CYS A 67 8.030 2.468 -15.016 1.00 0.00 N ATOM 1013 CA CYS A 67 6.830 3.324 -14.895 1.00 0.00 C ATOM 1014 C CYS A 67 6.952 4.438 -13.812 1.00 0.00 C ATOM 1015 O CYS A 67 7.714 4.330 -12.849 1.00 0.00 O ATOM 1016 CB CYS A 67 5.700 2.319 -14.560 1.00 0.00 C ATOM 1017 SG CYS A 67 4.113 3.150 -14.249 1.00 0.00 S ATOM 0 H CYS A 67 7.994 1.648 -14.411 1.00 0.00 H new ATOM 0 HA CYS A 67 6.653 3.890 -15.810 1.00 0.00 H new ATOM 0 HB2 CYS A 67 5.585 1.616 -15.385 1.00 0.00 H new ATOM 0 HB3 CYS A 67 5.982 1.737 -13.682 1.00 0.00 H new ATOM 0 HG CYS A 67 3.202 2.654 -15.033 1.00 0.00 H new ATOM 1023 N THR A 68 6.142 5.499 -13.947 1.00 0.00 N ATOM 1024 CA THR A 68 5.812 6.404 -12.806 1.00 0.00 C ATOM 1025 C THR A 68 4.289 6.247 -12.496 1.00 0.00 C ATOM 1026 O THR A 68 3.431 6.505 -13.346 1.00 0.00 O ATOM 1027 CB THR A 68 6.235 7.862 -13.138 1.00 0.00 C ATOM 1028 OG1 THR A 68 7.620 7.902 -13.468 1.00 0.00 O ATOM 1029 CG2 THR A 68 6.049 8.841 -11.968 1.00 0.00 C ATOM 0 H THR A 68 5.698 5.761 -14.827 1.00 0.00 H new ATOM 0 HA THR A 68 6.368 6.137 -11.907 1.00 0.00 H new ATOM 0 HB THR A 68 5.592 8.165 -13.964 1.00 0.00 H new ATOM 0 HG1 THR A 68 7.880 8.823 -13.678 1.00 0.00 H new ATOM 0 HG21 THR A 68 6.365 9.838 -12.274 1.00 0.00 H new ATOM 0 HG22 THR A 68 4.999 8.866 -11.678 1.00 0.00 H new ATOM 0 HG23 THR A 68 6.651 8.514 -11.121 1.00 0.00 H new ATOM 1037 N LEU A 69 3.962 5.819 -11.267 1.00 0.00 N ATOM 1038 CA LEU A 69 2.562 5.616 -10.805 1.00 0.00 C ATOM 1039 C LEU A 69 1.785 6.963 -10.607 1.00 0.00 C ATOM 1040 O LEU A 69 2.317 7.902 -10.011 1.00 0.00 O ATOM 1041 CB LEU A 69 2.706 4.804 -9.486 1.00 0.00 C ATOM 1042 CG LEU A 69 1.411 4.208 -8.891 1.00 0.00 C ATOM 1043 CD1 LEU A 69 0.829 3.092 -9.768 1.00 0.00 C ATOM 1044 CD2 LEU A 69 1.679 3.663 -7.480 1.00 0.00 C ATOM 0 H LEU A 69 4.658 5.600 -10.555 1.00 0.00 H new ATOM 0 HA LEU A 69 1.962 5.087 -11.546 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.405 3.987 -9.664 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.158 5.452 -8.735 1.00 0.00 H new ATOM 0 HG LEU A 69 0.678 5.014 -8.847 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -0.080 2.705 -9.308 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.595 3.490 -10.756 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.558 2.287 -9.864 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.759 3.245 -7.070 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.441 2.885 -7.529 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.028 4.472 -6.838 1.00 0.00 H new ATOM 1056 N GLY A 70 0.553 7.081 -11.135 1.00 0.00 N ATOM 1057 CA GLY A 70 -0.091 8.405 -11.366 1.00 0.00 C ATOM 1058 C GLY A 70 0.062 8.950 -12.804 1.00 0.00 C ATOM 1059 O GLY A 70 -0.925 9.334 -13.437 1.00 0.00 O ATOM 0 H GLY A 70 -0.021 6.285 -11.411 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -1.153 8.324 -11.133 1.00 0.00 H new ATOM 0 HA3 GLY A 70 0.334 9.128 -10.670 1.00 0.00 H new ATOM 1063 N GLU A 71 1.308 9.014 -13.291 1.00 0.00 N ATOM 1064 CA GLU A 71 1.669 9.710 -14.543 1.00 0.00 C ATOM 1065 C GLU A 71 1.576 8.812 -15.826 1.00 0.00 C ATOM 1066 O GLU A 71 1.509 7.572 -15.803 1.00 0.00 O ATOM 1067 CB GLU A 71 3.088 10.330 -14.332 1.00 0.00 C ATOM 1068 CG GLU A 71 3.155 11.645 -13.501 1.00 0.00 C ATOM 1069 CD GLU A 71 3.355 11.510 -11.999 1.00 0.00 C ATOM 1070 OE1 GLU A 71 2.385 11.259 -11.250 1.00 0.00 O ATOM 1071 OE2 GLU A 71 4.493 11.705 -11.524 1.00 0.00 O ATOM 0 H GLU A 71 2.106 8.581 -12.825 1.00 0.00 H new ATOM 0 HA GLU A 71 0.937 10.493 -14.742 1.00 0.00 H new ATOM 0 HB2 GLU A 71 3.716 9.585 -13.844 1.00 0.00 H new ATOM 0 HB3 GLU A 71 3.525 10.523 -15.312 1.00 0.00 H new ATOM 0 HG2 GLU A 71 3.968 12.253 -13.897 1.00 0.00 H new ATOM 0 HG3 GLU A 71 2.232 12.199 -13.670 1.00 0.00 H new ATOM 1078 N LYS A 72 1.559 9.537 -16.961 1.00 0.00 N ATOM 1079 CA LYS A 72 1.709 8.972 -18.325 1.00 0.00 C ATOM 1080 C LYS A 72 3.221 8.910 -18.719 1.00 0.00 C ATOM 1081 O LYS A 72 3.845 9.943 -18.981 1.00 0.00 O ATOM 1082 CB LYS A 72 0.854 9.857 -19.278 1.00 0.00 C ATOM 1083 CG LYS A 72 0.854 9.424 -20.767 1.00 0.00 C ATOM 1084 CD LYS A 72 0.009 10.337 -21.691 1.00 0.00 C ATOM 1085 CE LYS A 72 -1.488 9.987 -21.814 1.00 0.00 C ATOM 1086 NZ LYS A 72 -1.741 8.735 -22.585 1.00 0.00 N ATOM 0 H LYS A 72 1.439 10.550 -16.961 1.00 0.00 H new ATOM 0 HA LYS A 72 1.351 7.944 -18.387 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -0.175 9.860 -18.918 1.00 0.00 H new ATOM 0 HB3 LYS A 72 1.216 10.883 -19.216 1.00 0.00 H new ATOM 0 HG2 LYS A 72 1.882 9.409 -21.130 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.476 8.404 -20.838 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.092 11.362 -21.328 1.00 0.00 H new ATOM 0 HD3 LYS A 72 0.448 10.315 -22.688 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.913 9.882 -20.816 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -2.009 10.814 -22.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -2.694 8.381 -22.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -1.669 8.934 -23.603 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -1.037 8.017 -22.321 1.00 0.00 H new ATOM 1100 N PHE A 73 3.790 7.697 -18.776 1.00 0.00 N ATOM 1101 CA PHE A 73 5.192 7.467 -19.245 1.00 0.00 C ATOM 1102 C PHE A 73 5.256 6.893 -20.707 1.00 0.00 C ATOM 1103 O PHE A 73 4.237 6.571 -21.326 1.00 0.00 O ATOM 1104 CB PHE A 73 5.937 6.618 -18.162 1.00 0.00 C ATOM 1105 CG PHE A 73 5.583 5.119 -18.094 1.00 0.00 C ATOM 1106 CD1 PHE A 73 4.423 4.704 -17.434 1.00 0.00 C ATOM 1107 CD2 PHE A 73 6.363 4.174 -18.770 1.00 0.00 C ATOM 1108 CE1 PHE A 73 4.019 3.374 -17.500 1.00 0.00 C ATOM 1109 CE2 PHE A 73 5.955 2.845 -18.836 1.00 0.00 C ATOM 1110 CZ PHE A 73 4.778 2.448 -18.208 1.00 0.00 C ATOM 0 H PHE A 73 3.306 6.842 -18.503 1.00 0.00 H new ATOM 0 HA PHE A 73 5.721 8.415 -19.340 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.009 6.707 -18.338 1.00 0.00 H new ATOM 0 HB3 PHE A 73 5.736 7.060 -17.186 1.00 0.00 H new ATOM 0 HD1 PHE A 73 3.839 5.417 -16.871 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.286 4.477 -19.243 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.114 3.060 -17.001 1.00 0.00 H new ATOM 0 HE2 PHE A 73 6.551 2.123 -19.374 1.00 0.00 H new ATOM 0 HZ PHE A 73 4.454 1.420 -18.271 1.00 0.00 H new ATOM 1120 N GLU A 74 6.473 6.730 -21.255 1.00 0.00 N ATOM 1121 CA GLU A 74 6.682 6.010 -22.540 1.00 0.00 C ATOM 1122 C GLU A 74 6.982 4.490 -22.300 1.00 0.00 C ATOM 1123 O GLU A 74 8.087 4.110 -21.898 1.00 0.00 O ATOM 1124 CB GLU A 74 7.814 6.739 -23.313 1.00 0.00 C ATOM 1125 CG GLU A 74 7.929 6.285 -24.790 1.00 0.00 C ATOM 1126 CD GLU A 74 9.187 6.724 -25.511 1.00 0.00 C ATOM 1127 OE1 GLU A 74 10.250 6.109 -25.276 1.00 0.00 O ATOM 1128 OE2 GLU A 74 9.106 7.579 -26.413 1.00 0.00 O ATOM 0 H GLU A 74 7.332 7.084 -20.834 1.00 0.00 H new ATOM 0 HA GLU A 74 5.775 6.029 -23.144 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.634 7.814 -23.282 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.764 6.561 -22.809 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.873 5.197 -24.823 1.00 0.00 H new ATOM 0 HG3 GLU A 74 7.066 6.665 -25.337 1.00 0.00 H new ATOM 1135 N GLU A 75 6.010 3.611 -22.604 1.00 0.00 N ATOM 1136 CA GLU A 75 6.265 2.154 -22.758 1.00 0.00 C ATOM 1137 C GLU A 75 6.888 1.863 -24.163 1.00 0.00 C ATOM 1138 O GLU A 75 6.341 2.260 -25.198 1.00 0.00 O ATOM 1139 CB GLU A 75 4.920 1.406 -22.562 1.00 0.00 C ATOM 1140 CG GLU A 75 4.966 -0.141 -22.707 1.00 0.00 C ATOM 1141 CD GLU A 75 3.618 -0.828 -22.839 1.00 0.00 C ATOM 1142 OE1 GLU A 75 2.894 -0.564 -23.826 1.00 0.00 O ATOM 1143 OE2 GLU A 75 3.289 -1.674 -21.985 1.00 0.00 O ATOM 0 H GLU A 75 5.036 3.878 -22.750 1.00 0.00 H new ATOM 0 HA GLU A 75 6.980 1.806 -22.012 1.00 0.00 H new ATOM 0 HB2 GLU A 75 4.536 1.646 -21.570 1.00 0.00 H new ATOM 0 HB3 GLU A 75 4.203 1.796 -23.284 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.567 -0.388 -23.582 1.00 0.00 H new ATOM 0 HG3 GLU A 75 5.481 -0.554 -21.840 1.00 0.00 H new ATOM 1150 N THR A 76 8.008 1.126 -24.189 1.00 0.00 N ATOM 1151 CA THR A 76 8.533 0.510 -25.444 1.00 0.00 C ATOM 1152 C THR A 76 8.289 -1.034 -25.380 1.00 0.00 C ATOM 1153 O THR A 76 8.906 -1.728 -24.564 1.00 0.00 O ATOM 1154 CB THR A 76 10.018 0.920 -25.671 1.00 0.00 C ATOM 1155 OG1 THR A 76 10.141 2.340 -25.615 1.00 0.00 O ATOM 1156 CG2 THR A 76 10.560 0.497 -27.046 1.00 0.00 C ATOM 0 H THR A 76 8.576 0.935 -23.364 1.00 0.00 H new ATOM 0 HA THR A 76 8.001 0.881 -26.320 1.00 0.00 H new ATOM 0 HB THR A 76 10.586 0.416 -24.889 1.00 0.00 H new ATOM 0 HG1 THR A 76 11.019 2.578 -25.251 1.00 0.00 H new ATOM 0 HG21 THR A 76 11.599 0.813 -27.140 1.00 0.00 H new ATOM 0 HG22 THR A 76 10.500 -0.587 -27.143 1.00 0.00 H new ATOM 0 HG23 THR A 76 9.966 0.965 -27.831 1.00 0.00 H new ATOM 1164 N THR A 77 7.380 -1.574 -26.217 1.00 0.00 N ATOM 1165 CA THR A 77 7.007 -3.026 -26.171 1.00 0.00 C ATOM 1166 C THR A 77 8.119 -3.983 -26.735 1.00 0.00 C ATOM 1167 O THR A 77 9.000 -3.576 -27.500 1.00 0.00 O ATOM 1168 CB THR A 77 5.632 -3.320 -26.864 1.00 0.00 C ATOM 1169 OG1 THR A 77 5.721 -3.181 -28.281 1.00 0.00 O ATOM 1170 CG2 THR A 77 4.416 -2.510 -26.386 1.00 0.00 C ATOM 0 H THR A 77 6.887 -1.041 -26.933 1.00 0.00 H new ATOM 0 HA THR A 77 6.906 -3.245 -25.108 1.00 0.00 H new ATOM 0 HB THR A 77 5.444 -4.349 -26.559 1.00 0.00 H new ATOM 0 HG1 THR A 77 5.006 -3.699 -28.706 1.00 0.00 H new ATOM 0 HG21 THR A 77 3.533 -2.814 -26.948 1.00 0.00 H new ATOM 0 HG22 THR A 77 4.251 -2.693 -25.324 1.00 0.00 H new ATOM 0 HG23 THR A 77 4.601 -1.448 -26.546 1.00 0.00 H new ATOM 1178 N ALA A 78 8.034 -5.290 -26.403 1.00 0.00 N ATOM 1179 CA ALA A 78 8.848 -6.356 -27.064 1.00 0.00 C ATOM 1180 C ALA A 78 8.848 -6.410 -28.635 1.00 0.00 C ATOM 1181 O ALA A 78 9.909 -6.577 -29.244 1.00 0.00 O ATOM 1182 CB ALA A 78 8.374 -7.696 -26.462 1.00 0.00 C ATOM 0 H ALA A 78 7.409 -5.642 -25.678 1.00 0.00 H new ATOM 0 HA ALA A 78 9.893 -6.123 -26.859 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.937 -8.515 -26.910 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.538 -7.689 -25.384 1.00 0.00 H new ATOM 0 HB3 ALA A 78 7.312 -7.831 -26.666 1.00 0.00 H new ATOM 1188 N ASP A 79 7.676 -6.263 -29.269 1.00 0.00 N ATOM 1189 CA ASP A 79 7.537 -6.060 -30.740 1.00 0.00 C ATOM 1190 C ASP A 79 8.116 -4.733 -31.355 1.00 0.00 C ATOM 1191 O ASP A 79 8.613 -4.757 -32.484 1.00 0.00 O ATOM 1192 CB ASP A 79 6.029 -6.266 -31.064 1.00 0.00 C ATOM 1193 CG ASP A 79 5.066 -5.218 -30.500 1.00 0.00 C ATOM 1194 OD1 ASP A 79 4.844 -5.166 -29.271 1.00 0.00 O ATOM 1195 OD2 ASP A 79 4.576 -4.388 -31.285 1.00 0.00 O ATOM 0 H ASP A 79 6.781 -6.280 -28.780 1.00 0.00 H new ATOM 0 HA ASP A 79 8.181 -6.789 -31.231 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.912 -6.291 -32.147 1.00 0.00 H new ATOM 0 HB3 ASP A 79 5.729 -7.244 -30.689 1.00 0.00 H new ATOM 1200 N GLY A 80 8.025 -3.599 -30.636 1.00 0.00 N ATOM 1201 CA GLY A 80 8.464 -2.264 -31.129 1.00 0.00 C ATOM 1202 C GLY A 80 7.427 -1.111 -31.136 1.00 0.00 C ATOM 1203 O GLY A 80 7.591 -0.175 -31.921 1.00 0.00 O ATOM 0 H GLY A 80 7.644 -3.574 -29.690 1.00 0.00 H new ATOM 0 HA2 GLY A 80 9.312 -1.946 -30.522 1.00 0.00 H new ATOM 0 HA3 GLY A 80 8.831 -2.389 -32.148 1.00 0.00 H new ATOM 1207 N ARG A 81 6.406 -1.120 -30.264 1.00 0.00 N ATOM 1208 CA ARG A 81 5.424 -0.008 -30.140 1.00 0.00 C ATOM 1209 C ARG A 81 5.893 1.032 -29.085 1.00 0.00 C ATOM 1210 O ARG A 81 6.345 0.670 -27.994 1.00 0.00 O ATOM 1211 CB ARG A 81 4.058 -0.578 -29.678 1.00 0.00 C ATOM 1212 CG ARG A 81 3.291 -1.460 -30.685 1.00 0.00 C ATOM 1213 CD ARG A 81 2.362 -2.465 -29.966 1.00 0.00 C ATOM 1214 NE ARG A 81 1.185 -2.868 -30.774 1.00 0.00 N ATOM 1215 CZ ARG A 81 1.195 -3.605 -31.885 1.00 0.00 C ATOM 1216 NH1 ARG A 81 2.234 -4.219 -32.381 1.00 0.00 N ATOM 1217 NH2 ARG A 81 0.093 -3.735 -32.543 1.00 0.00 N ATOM 0 H ARG A 81 6.230 -1.893 -29.622 1.00 0.00 H new ATOM 0 HA ARG A 81 5.336 0.477 -31.112 1.00 0.00 H new ATOM 0 HB2 ARG A 81 4.223 -1.162 -28.773 1.00 0.00 H new ATOM 0 HB3 ARG A 81 3.417 0.260 -29.404 1.00 0.00 H new ATOM 0 HG2 ARG A 81 2.701 -0.828 -31.348 1.00 0.00 H new ATOM 0 HG3 ARG A 81 4.001 -2.002 -31.310 1.00 0.00 H new ATOM 0 HD2 ARG A 81 2.935 -3.355 -29.705 1.00 0.00 H new ATOM 0 HD3 ARG A 81 2.017 -2.023 -29.031 1.00 0.00 H new ATOM 0 HE ARG A 81 0.274 -2.548 -30.446 1.00 0.00 H new ATOM 0 HH11 ARG A 81 3.136 -4.156 -31.910 1.00 0.00 H new ATOM 0 HH12 ARG A 81 2.144 -4.762 -33.240 1.00 0.00 H new ATOM 0 HH21 ARG A 81 -0.757 -3.280 -32.210 1.00 0.00 H new ATOM 0 HH22 ARG A 81 0.071 -4.293 -33.397 1.00 0.00 H new ATOM 1231 N LYS A 82 5.680 2.321 -29.382 1.00 0.00 N ATOM 1232 CA LYS A 82 5.715 3.391 -28.352 1.00 0.00 C ATOM 1233 C LYS A 82 4.269 3.633 -27.819 1.00 0.00 C ATOM 1234 O LYS A 82 3.430 4.159 -28.559 1.00 0.00 O ATOM 1235 CB LYS A 82 6.318 4.685 -28.971 1.00 0.00 C ATOM 1236 CG LYS A 82 7.813 4.661 -29.376 1.00 0.00 C ATOM 1237 CD LYS A 82 8.752 4.353 -28.193 1.00 0.00 C ATOM 1238 CE LYS A 82 10.202 4.784 -28.449 1.00 0.00 C ATOM 1239 NZ LYS A 82 10.991 4.544 -27.213 1.00 0.00 N ATOM 0 H LYS A 82 5.481 2.657 -30.324 1.00 0.00 H new ATOM 0 HA LYS A 82 6.345 3.093 -27.514 1.00 0.00 H new ATOM 0 HB2 LYS A 82 5.735 4.936 -29.857 1.00 0.00 H new ATOM 0 HB3 LYS A 82 6.177 5.496 -28.256 1.00 0.00 H new ATOM 0 HG2 LYS A 82 7.961 3.913 -30.155 1.00 0.00 H new ATOM 0 HG3 LYS A 82 8.083 5.626 -29.806 1.00 0.00 H new ATOM 0 HD2 LYS A 82 8.381 4.858 -27.301 1.00 0.00 H new ATOM 0 HD3 LYS A 82 8.728 3.283 -27.987 1.00 0.00 H new ATOM 0 HE2 LYS A 82 10.623 4.221 -29.282 1.00 0.00 H new ATOM 0 HE3 LYS A 82 10.241 5.838 -28.724 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 11.991 4.400 -27.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 10.906 5.366 -26.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 10.629 3.697 -26.729 1.00 0.00 H new ATOM 1253 N THR A 83 3.967 3.241 -26.564 1.00 0.00 N ATOM 1254 CA THR A 83 2.601 3.415 -25.976 1.00 0.00 C ATOM 1255 C THR A 83 2.643 4.434 -24.798 1.00 0.00 C ATOM 1256 O THR A 83 3.323 4.223 -23.785 1.00 0.00 O ATOM 1257 CB THR A 83 1.820 2.093 -25.649 1.00 0.00 C ATOM 1258 OG1 THR A 83 2.032 1.644 -24.318 1.00 0.00 O ATOM 1259 CG2 THR A 83 2.031 0.895 -26.584 1.00 0.00 C ATOM 0 H THR A 83 4.638 2.803 -25.933 1.00 0.00 H new ATOM 0 HA THR A 83 1.987 3.838 -26.771 1.00 0.00 H new ATOM 0 HB THR A 83 0.794 2.426 -25.805 1.00 0.00 H new ATOM 0 HG1 THR A 83 2.367 0.723 -24.333 1.00 0.00 H new ATOM 0 HG21 THR A 83 1.431 0.053 -26.238 1.00 0.00 H new ATOM 0 HG22 THR A 83 1.728 1.165 -27.596 1.00 0.00 H new ATOM 0 HG23 THR A 83 3.084 0.614 -26.584 1.00 0.00 H new ATOM 1267 N GLN A 84 1.887 5.543 -24.913 1.00 0.00 N ATOM 1268 CA GLN A 84 1.787 6.568 -23.844 1.00 0.00 C ATOM 1269 C GLN A 84 0.927 6.040 -22.653 1.00 0.00 C ATOM 1270 O GLN A 84 -0.306 6.006 -22.699 1.00 0.00 O ATOM 1271 CB GLN A 84 1.202 7.863 -24.468 1.00 0.00 C ATOM 1272 CG GLN A 84 2.161 8.762 -25.285 1.00 0.00 C ATOM 1273 CD GLN A 84 3.326 9.355 -24.479 1.00 0.00 C ATOM 1274 OE1 GLN A 84 3.140 10.175 -23.587 1.00 0.00 O ATOM 1275 NE2 GLN A 84 4.548 8.955 -24.744 1.00 0.00 N ATOM 0 H GLN A 84 1.331 5.757 -25.741 1.00 0.00 H new ATOM 0 HA GLN A 84 2.772 6.790 -23.433 1.00 0.00 H new ATOM 0 HB2 GLN A 84 0.374 7.579 -25.117 1.00 0.00 H new ATOM 0 HB3 GLN A 84 0.783 8.465 -23.662 1.00 0.00 H new ATOM 0 HG2 GLN A 84 2.568 8.179 -26.111 1.00 0.00 H new ATOM 0 HG3 GLN A 84 1.587 9.579 -25.723 1.00 0.00 H new ATOM 0 HE21 GLN A 84 4.712 8.273 -25.484 1.00 0.00 H new ATOM 0 HE22 GLN A 84 5.333 9.326 -24.209 1.00 0.00 H new ATOM 1284 N THR A 85 1.593 5.574 -21.593 1.00 0.00 N ATOM 1285 CA THR A 85 1.000 4.598 -20.646 1.00 0.00 C ATOM 1286 C THR A 85 0.726 5.286 -19.282 1.00 0.00 C ATOM 1287 O THR A 85 1.663 5.555 -18.527 1.00 0.00 O ATOM 1288 CB THR A 85 1.925 3.353 -20.563 1.00 0.00 C ATOM 1289 OG1 THR A 85 2.074 2.758 -21.846 1.00 0.00 O ATOM 1290 CG2 THR A 85 1.362 2.224 -19.693 1.00 0.00 C ATOM 0 H THR A 85 2.546 5.852 -21.360 1.00 0.00 H new ATOM 0 HA THR A 85 0.030 4.243 -20.994 1.00 0.00 H new ATOM 0 HB THR A 85 2.855 3.736 -20.143 1.00 0.00 H new ATOM 0 HG1 THR A 85 2.616 3.342 -22.417 1.00 0.00 H new ATOM 0 HG21 THR A 85 2.062 1.389 -19.683 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.215 2.587 -18.676 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.407 1.892 -20.101 1.00 0.00 H new ATOM 1298 N VAL A 86 -0.552 5.562 -18.955 1.00 0.00 N ATOM 1299 CA VAL A 86 -0.930 6.097 -17.609 1.00 0.00 C ATOM 1300 C VAL A 86 -1.209 4.929 -16.608 1.00 0.00 C ATOM 1301 O VAL A 86 -2.097 4.098 -16.839 1.00 0.00 O ATOM 1302 CB VAL A 86 -2.009 7.229 -17.693 1.00 0.00 C ATOM 1303 CG1 VAL A 86 -3.418 6.784 -18.120 1.00 0.00 C ATOM 1304 CG2 VAL A 86 -2.134 8.022 -16.372 1.00 0.00 C ATOM 0 H VAL A 86 -1.340 5.429 -19.589 1.00 0.00 H new ATOM 0 HA VAL A 86 -0.080 6.625 -17.177 1.00 0.00 H new ATOM 0 HB VAL A 86 -1.619 7.861 -18.491 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -4.081 7.649 -18.144 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.373 6.334 -19.112 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.800 6.053 -17.407 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.895 8.795 -16.482 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -2.419 7.345 -15.567 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -1.177 8.486 -16.134 1.00 0.00 H new ATOM 1314 N CYS A 87 -0.420 4.853 -15.518 1.00 0.00 N ATOM 1315 CA CYS A 87 -0.552 3.754 -14.514 1.00 0.00 C ATOM 1316 C CYS A 87 -1.211 4.233 -13.191 1.00 0.00 C ATOM 1317 O CYS A 87 -0.683 5.132 -12.540 1.00 0.00 O ATOM 1318 CB CYS A 87 0.850 3.165 -14.251 1.00 0.00 C ATOM 1319 SG CYS A 87 1.255 1.881 -15.478 1.00 0.00 S ATOM 0 H CYS A 87 0.313 5.529 -15.302 1.00 0.00 H new ATOM 0 HA CYS A 87 -1.214 2.989 -14.919 1.00 0.00 H new ATOM 0 HB2 CYS A 87 1.596 3.959 -14.290 1.00 0.00 H new ATOM 0 HB3 CYS A 87 0.888 2.740 -13.248 1.00 0.00 H new ATOM 0 HG CYS A 87 2.191 1.111 -15.008 1.00 0.00 H new ATOM 1325 N ASN A 88 -2.319 3.607 -12.755 1.00 0.00 N ATOM 1326 CA ASN A 88 -2.986 3.953 -11.461 1.00 0.00 C ATOM 1327 C ASN A 88 -3.294 2.673 -10.620 1.00 0.00 C ATOM 1328 O ASN A 88 -3.893 1.713 -11.114 1.00 0.00 O ATOM 1329 CB ASN A 88 -4.286 4.762 -11.728 1.00 0.00 C ATOM 1330 CG ASN A 88 -4.060 6.217 -12.157 1.00 0.00 C ATOM 1331 OD1 ASN A 88 -3.572 7.046 -11.398 1.00 0.00 O ATOM 1332 ND2 ASN A 88 -4.411 6.581 -13.366 1.00 0.00 N ATOM 0 H ASN A 88 -2.780 2.858 -13.271 1.00 0.00 H new ATOM 0 HA ASN A 88 -2.301 4.571 -10.880 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -4.861 4.254 -12.503 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -4.894 4.755 -10.824 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.277 7.546 -13.667 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -4.818 5.899 -14.006 1.00 0.00 H new ATOM 1339 N PHE A 89 -2.925 2.678 -9.327 1.00 0.00 N ATOM 1340 CA PHE A 89 -3.318 1.605 -8.372 1.00 0.00 C ATOM 1341 C PHE A 89 -4.729 1.868 -7.737 1.00 0.00 C ATOM 1342 O PHE A 89 -4.994 2.955 -7.215 1.00 0.00 O ATOM 1343 CB PHE A 89 -2.176 1.478 -7.320 1.00 0.00 C ATOM 1344 CG PHE A 89 -2.420 0.413 -6.236 1.00 0.00 C ATOM 1345 CD1 PHE A 89 -2.148 -0.936 -6.481 1.00 0.00 C ATOM 1346 CD2 PHE A 89 -3.030 0.785 -5.033 1.00 0.00 C ATOM 1347 CE1 PHE A 89 -2.487 -1.900 -5.534 1.00 0.00 C ATOM 1348 CE2 PHE A 89 -3.388 -0.182 -4.099 1.00 0.00 C ATOM 1349 CZ PHE A 89 -3.117 -1.522 -4.351 1.00 0.00 C ATOM 0 H PHE A 89 -2.353 3.412 -8.910 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.434 0.653 -8.890 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -1.246 1.244 -7.839 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -2.036 2.445 -6.836 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.674 -1.231 -7.406 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -3.224 1.828 -4.829 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.261 -2.940 -5.717 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.876 0.108 -3.180 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.396 -2.273 -3.627 1.00 0.00 H new ATOM 1359 N THR A 90 -5.583 0.830 -7.701 1.00 0.00 N ATOM 1360 CA THR A 90 -6.811 0.812 -6.848 1.00 0.00 C ATOM 1361 C THR A 90 -6.910 -0.536 -6.068 1.00 0.00 C ATOM 1362 O THR A 90 -6.808 -1.613 -6.663 1.00 0.00 O ATOM 1363 CB THR A 90 -8.090 1.156 -7.674 1.00 0.00 C ATOM 1364 OG1 THR A 90 -9.175 1.457 -6.794 1.00 0.00 O ATOM 1365 CG2 THR A 90 -8.586 0.107 -8.687 1.00 0.00 C ATOM 0 H THR A 90 -5.454 -0.018 -8.252 1.00 0.00 H new ATOM 0 HA THR A 90 -6.734 1.600 -6.099 1.00 0.00 H new ATOM 0 HB THR A 90 -7.767 2.007 -8.274 1.00 0.00 H new ATOM 0 HG1 THR A 90 -9.775 0.684 -6.738 1.00 0.00 H new ATOM 0 HG21 THR A 90 -9.480 0.479 -9.187 1.00 0.00 H new ATOM 0 HG22 THR A 90 -7.808 -0.081 -9.427 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.822 -0.820 -8.165 1.00 0.00 H new ATOM 1373 N ASP A 91 -7.158 -0.478 -4.743 1.00 0.00 N ATOM 1374 CA ASP A 91 -7.676 -1.637 -3.944 1.00 0.00 C ATOM 1375 C ASP A 91 -6.610 -2.772 -3.726 1.00 0.00 C ATOM 1376 O ASP A 91 -5.868 -2.769 -2.740 1.00 0.00 O ATOM 1377 CB ASP A 91 -9.085 -2.130 -4.424 1.00 0.00 C ATOM 1378 CG ASP A 91 -10.164 -1.067 -4.621 1.00 0.00 C ATOM 1379 OD1 ASP A 91 -10.177 -0.424 -5.697 1.00 0.00 O ATOM 1380 OD2 ASP A 91 -10.991 -0.868 -3.709 1.00 0.00 O ATOM 0 H ASP A 91 -7.010 0.364 -4.187 1.00 0.00 H new ATOM 0 HA ASP A 91 -7.855 -1.258 -2.938 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -8.955 -2.659 -5.368 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -9.454 -2.856 -3.700 1.00 0.00 H new ATOM 1385 N GLY A 92 -6.515 -3.705 -4.684 1.00 0.00 N ATOM 1386 CA GLY A 92 -5.324 -4.581 -4.861 1.00 0.00 C ATOM 1387 C GLY A 92 -4.998 -4.866 -6.346 1.00 0.00 C ATOM 1388 O GLY A 92 -4.882 -6.032 -6.733 1.00 0.00 O ATOM 0 H GLY A 92 -7.255 -3.882 -5.363 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -4.461 -4.111 -4.389 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -5.495 -5.526 -4.345 1.00 0.00 H new ATOM 1392 N ALA A 93 -4.881 -3.803 -7.165 1.00 0.00 N ATOM 1393 CA ALA A 93 -4.900 -3.893 -8.644 1.00 0.00 C ATOM 1394 C ALA A 93 -4.170 -2.677 -9.289 1.00 0.00 C ATOM 1395 O ALA A 93 -4.542 -1.522 -9.057 1.00 0.00 O ATOM 1396 CB ALA A 93 -6.376 -3.924 -9.104 1.00 0.00 C ATOM 0 H ALA A 93 -4.770 -2.850 -6.820 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.379 -4.797 -8.960 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.417 -3.990 -10.191 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -6.875 -4.790 -8.669 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -6.878 -3.014 -8.777 1.00 0.00 H new ATOM 1402 N LEU A 94 -3.160 -2.934 -10.136 1.00 0.00 N ATOM 1403 CA LEU A 94 -2.489 -1.872 -10.938 1.00 0.00 C ATOM 1404 C LEU A 94 -3.120 -1.793 -12.363 1.00 0.00 C ATOM 1405 O LEU A 94 -2.950 -2.699 -13.187 1.00 0.00 O ATOM 1406 CB LEU A 94 -0.960 -2.141 -10.904 1.00 0.00 C ATOM 1407 CG LEU A 94 -0.030 -1.229 -11.743 1.00 0.00 C ATOM 1408 CD1 LEU A 94 -0.181 0.254 -11.376 1.00 0.00 C ATOM 1409 CD2 LEU A 94 1.438 -1.657 -11.555 1.00 0.00 C ATOM 0 H LEU A 94 -2.782 -3.869 -10.290 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.644 -0.878 -10.518 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.636 -2.079 -9.865 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.797 -3.169 -11.228 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.324 -1.344 -12.786 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.492 0.851 -11.991 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -1.210 0.569 -11.551 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.068 0.396 -10.324 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.084 -1.010 -12.148 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.709 -1.574 -10.503 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.560 -2.690 -11.881 1.00 0.00 H new ATOM 1421 N VAL A 95 -3.842 -0.693 -12.635 1.00 0.00 N ATOM 1422 CA VAL A 95 -4.528 -0.446 -13.935 1.00 0.00 C ATOM 1423 C VAL A 95 -3.550 0.352 -14.864 1.00 0.00 C ATOM 1424 O VAL A 95 -3.314 1.553 -14.689 1.00 0.00 O ATOM 1425 CB VAL A 95 -5.903 0.275 -13.699 1.00 0.00 C ATOM 1426 CG1 VAL A 95 -6.666 0.590 -15.009 1.00 0.00 C ATOM 1427 CG2 VAL A 95 -6.888 -0.519 -12.804 1.00 0.00 C ATOM 0 H VAL A 95 -3.973 0.061 -11.961 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.772 -1.383 -14.436 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.600 1.194 -13.198 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -7.606 1.088 -14.772 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -6.058 1.242 -15.636 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -6.871 -0.338 -15.543 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.813 0.047 -12.690 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -7.106 -1.481 -13.267 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.439 -0.682 -11.824 1.00 0.00 H new ATOM 1437 N GLN A 96 -2.994 -0.349 -15.858 1.00 0.00 N ATOM 1438 CA GLN A 96 -2.033 0.212 -16.843 1.00 0.00 C ATOM 1439 C GLN A 96 -2.785 0.543 -18.175 1.00 0.00 C ATOM 1440 O GLN A 96 -3.144 -0.370 -18.926 1.00 0.00 O ATOM 1441 CB GLN A 96 -0.945 -0.890 -16.986 1.00 0.00 C ATOM 1442 CG GLN A 96 0.192 -0.615 -18.000 1.00 0.00 C ATOM 1443 CD GLN A 96 1.016 -1.840 -18.427 1.00 0.00 C ATOM 1444 OE1 GLN A 96 1.149 -2.854 -17.741 1.00 0.00 O ATOM 1445 NE2 GLN A 96 1.617 -1.767 -19.588 1.00 0.00 N ATOM 0 H GLN A 96 -3.195 -1.337 -16.012 1.00 0.00 H new ATOM 0 HA GLN A 96 -1.573 1.153 -16.541 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -0.496 -1.054 -16.007 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -1.437 -1.820 -17.270 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -0.243 -0.164 -18.892 1.00 0.00 H new ATOM 0 HG3 GLN A 96 0.869 0.122 -17.568 1.00 0.00 H new ATOM 0 HE21 GLN A 96 1.514 -0.932 -20.164 1.00 0.00 H new ATOM 0 HE22 GLN A 96 2.189 -2.545 -19.916 1.00 0.00 H new ATOM 1454 N HIS A 97 -3.015 1.834 -18.478 1.00 0.00 N ATOM 1455 CA HIS A 97 -3.711 2.255 -19.730 1.00 0.00 C ATOM 1456 C HIS A 97 -2.689 2.662 -20.840 1.00 0.00 C ATOM 1457 O HIS A 97 -2.196 3.793 -20.858 1.00 0.00 O ATOM 1458 CB HIS A 97 -4.695 3.395 -19.354 1.00 0.00 C ATOM 1459 CG HIS A 97 -5.514 3.967 -20.517 1.00 0.00 C ATOM 1460 ND1 HIS A 97 -5.063 4.961 -21.378 1.00 0.00 N ATOM 1461 CD2 HIS A 97 -6.717 3.433 -20.994 1.00 0.00 C ATOM 1462 CE1 HIS A 97 -6.051 4.932 -22.337 1.00 0.00 C ATOM 1463 NE2 HIS A 97 -7.110 4.088 -22.145 1.00 0.00 N ATOM 0 H HIS A 97 -2.733 2.611 -17.880 1.00 0.00 H new ATOM 0 HA HIS A 97 -4.275 1.428 -20.160 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -5.384 3.022 -18.596 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -4.127 4.206 -18.898 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -7.260 2.624 -20.528 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -5.991 5.558 -23.215 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -7.958 3.974 -22.700 1.00 0.00 H new ATOM 1472 N GLN A 98 -2.468 1.759 -21.800 1.00 0.00 N ATOM 1473 CA GLN A 98 -1.558 1.960 -22.962 1.00 0.00 C ATOM 1474 C GLN A 98 -2.277 2.736 -24.115 1.00 0.00 C ATOM 1475 O GLN A 98 -3.344 2.300 -24.558 1.00 0.00 O ATOM 1476 CB GLN A 98 -1.170 0.541 -23.471 1.00 0.00 C ATOM 1477 CG GLN A 98 -0.475 -0.422 -22.473 1.00 0.00 C ATOM 1478 CD GLN A 98 -0.415 -1.866 -22.976 1.00 0.00 C ATOM 1479 OE1 GLN A 98 -1.369 -2.629 -22.837 1.00 0.00 O ATOM 1480 NE2 GLN A 98 0.663 -2.295 -23.582 1.00 0.00 N ATOM 0 H GLN A 98 -2.920 0.845 -21.803 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.688 2.543 -22.661 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -2.077 0.054 -23.829 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -0.512 0.662 -24.332 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.538 -0.068 -22.281 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -1.007 -0.396 -21.522 1.00 0.00 H new ATOM 0 HE21 GLN A 98 1.462 -1.672 -23.704 1.00 0.00 H new ATOM 0 HE22 GLN A 98 0.704 -3.252 -23.932 1.00 0.00 H new ATOM 1489 N GLU A 99 -1.719 3.859 -24.606 1.00 0.00 N ATOM 1490 CA GLU A 99 -2.399 4.734 -25.609 1.00 0.00 C ATOM 1491 C GLU A 99 -1.463 5.010 -26.843 1.00 0.00 C ATOM 1492 O GLU A 99 -0.360 5.549 -26.698 1.00 0.00 O ATOM 1493 CB GLU A 99 -2.835 5.965 -24.764 1.00 0.00 C ATOM 1494 CG GLU A 99 -3.609 7.101 -25.458 1.00 0.00 C ATOM 1495 CD GLU A 99 -2.726 8.225 -25.988 1.00 0.00 C ATOM 1496 OE1 GLU A 99 -2.120 8.938 -25.153 1.00 0.00 O ATOM 1497 OE2 GLU A 99 -2.651 8.413 -27.216 1.00 0.00 O ATOM 0 H GLU A 99 -0.795 4.192 -24.329 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.272 4.301 -26.097 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -3.450 5.600 -23.941 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -1.937 6.398 -24.323 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -4.182 6.683 -26.286 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -4.327 7.520 -24.753 1.00 0.00 H new ATOM 1504 N TRP A 100 -1.873 4.565 -28.053 1.00 0.00 N ATOM 1505 CA TRP A 100 -1.018 4.592 -29.288 1.00 0.00 C ATOM 1506 C TRP A 100 -1.853 4.374 -30.595 1.00 0.00 C ATOM 1507 O TRP A 100 -2.794 3.587 -30.569 1.00 0.00 O ATOM 1508 CB TRP A 100 0.149 3.551 -29.203 1.00 0.00 C ATOM 1509 CG TRP A 100 -0.129 2.063 -29.497 1.00 0.00 C ATOM 1510 CD1 TRP A 100 0.345 1.378 -30.631 1.00 0.00 C ATOM 1511 CD2 TRP A 100 -0.891 1.141 -28.801 1.00 0.00 C ATOM 1512 NE1 TRP A 100 -0.111 0.048 -30.672 1.00 0.00 N ATOM 1513 CE2 TRP A 100 -0.895 -0.071 -29.536 1.00 0.00 C ATOM 1514 CE3 TRP A 100 -1.619 1.243 -27.591 1.00 0.00 C ATOM 1515 CZ2 TRP A 100 -1.677 -1.167 -29.093 1.00 0.00 C ATOM 1516 CZ3 TRP A 100 -2.374 0.154 -27.172 1.00 0.00 C ATOM 1517 CH2 TRP A 100 -2.418 -1.027 -27.917 1.00 0.00 C ATOM 0 H TRP A 100 -2.802 4.176 -28.213 1.00 0.00 H new ATOM 0 HA TRP A 100 -0.584 5.591 -29.339 1.00 0.00 H new ATOM 0 HB2 TRP A 100 0.928 3.879 -29.892 1.00 0.00 H new ATOM 0 HB3 TRP A 100 0.566 3.611 -28.198 1.00 0.00 H new ATOM 0 HD1 TRP A 100 0.983 1.821 -31.381 1.00 0.00 H new ATOM 0 HE1 TRP A 100 0.089 -0.664 -31.375 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -1.588 2.150 -27.005 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -1.700 -2.090 -29.653 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -2.937 0.222 -26.253 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -3.035 -1.846 -27.578 1.00 0.00 H new ATOM 1528 N ASP A 101 -1.467 4.946 -31.759 1.00 0.00 N ATOM 1529 CA ASP A 101 -1.904 4.451 -33.119 1.00 0.00 C ATOM 1530 C ASP A 101 -3.445 4.167 -33.366 1.00 0.00 C ATOM 1531 O ASP A 101 -3.833 3.154 -33.958 1.00 0.00 O ATOM 1532 CB ASP A 101 -0.935 3.277 -33.476 1.00 0.00 C ATOM 1533 CG ASP A 101 -0.886 2.819 -34.933 1.00 0.00 C ATOM 1534 OD1 ASP A 101 -0.654 3.660 -35.826 1.00 0.00 O ATOM 1535 OD2 ASP A 101 -1.064 1.603 -35.180 1.00 0.00 O ATOM 0 H ASP A 101 -0.850 5.757 -31.801 1.00 0.00 H new ATOM 0 HA ASP A 101 -1.818 5.277 -33.825 1.00 0.00 H new ATOM 0 HB2 ASP A 101 0.072 3.572 -33.182 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -1.207 2.418 -32.863 1.00 0.00 H new ATOM 1540 N GLY A 102 -4.339 5.050 -32.873 1.00 0.00 N ATOM 1541 CA GLY A 102 -5.805 4.749 -32.775 1.00 0.00 C ATOM 1542 C GLY A 102 -6.288 3.553 -31.897 1.00 0.00 C ATOM 1543 O GLY A 102 -7.309 2.940 -32.212 1.00 0.00 O ATOM 0 H GLY A 102 -4.084 5.978 -32.534 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -6.298 5.647 -32.403 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -6.172 4.580 -33.787 1.00 0.00 H new ATOM 1547 N LYS A 103 -5.560 3.218 -30.823 1.00 0.00 N ATOM 1548 CA LYS A 103 -5.716 1.947 -30.063 1.00 0.00 C ATOM 1549 C LYS A 103 -5.526 2.228 -28.537 1.00 0.00 C ATOM 1550 O LYS A 103 -4.593 2.935 -28.129 1.00 0.00 O ATOM 1551 CB LYS A 103 -4.622 0.927 -30.505 1.00 0.00 C ATOM 1552 CG LYS A 103 -4.663 0.422 -31.966 1.00 0.00 C ATOM 1553 CD LYS A 103 -3.315 -0.214 -32.377 1.00 0.00 C ATOM 1554 CE LYS A 103 -3.185 -0.564 -33.868 1.00 0.00 C ATOM 1555 NZ LYS A 103 -3.925 -1.822 -34.177 1.00 0.00 N ATOM 0 H LYS A 103 -4.833 3.824 -30.443 1.00 0.00 H new ATOM 0 HA LYS A 103 -6.709 1.541 -30.258 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -3.647 1.385 -30.335 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -4.686 0.060 -29.848 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -5.463 -0.310 -32.078 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -4.895 1.252 -32.634 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -2.511 0.472 -32.110 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -3.167 -1.122 -31.793 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -3.576 0.253 -34.475 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -2.133 -0.680 -34.130 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -3.883 -2.007 -35.200 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -3.491 -2.615 -33.664 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -4.918 -1.722 -33.884 1.00 0.00 H new ATOM 1569 N GLU A 104 -6.368 1.607 -27.689 1.00 0.00 N ATOM 1570 CA GLU A 104 -6.184 1.637 -26.212 1.00 0.00 C ATOM 1571 C GLU A 104 -6.253 0.204 -25.590 1.00 0.00 C ATOM 1572 O GLU A 104 -7.209 -0.547 -25.805 1.00 0.00 O ATOM 1573 CB GLU A 104 -7.107 2.681 -25.532 1.00 0.00 C ATOM 1574 CG GLU A 104 -8.620 2.362 -25.435 1.00 0.00 C ATOM 1575 CD GLU A 104 -9.436 3.430 -24.727 1.00 0.00 C ATOM 1576 OE1 GLU A 104 -9.274 3.585 -23.498 1.00 0.00 O ATOM 1577 OE2 GLU A 104 -10.232 4.123 -25.389 1.00 0.00 O ATOM 0 H GLU A 104 -7.184 1.077 -27.994 1.00 0.00 H new ATOM 0 HA GLU A 104 -5.172 1.986 -26.005 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.735 2.847 -24.521 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -6.998 3.623 -26.070 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -9.016 2.225 -26.441 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -8.748 1.415 -24.910 1.00 0.00 H new ATOM 1584 N SER A 105 -5.219 -0.157 -24.814 1.00 0.00 N ATOM 1585 CA SER A 105 -5.125 -1.466 -24.111 1.00 0.00 C ATOM 1586 C SER A 105 -5.009 -1.227 -22.577 1.00 0.00 C ATOM 1587 O SER A 105 -4.052 -0.621 -22.082 1.00 0.00 O ATOM 1588 CB SER A 105 -3.947 -2.284 -24.698 1.00 0.00 C ATOM 1589 OG SER A 105 -3.567 -3.375 -23.859 1.00 0.00 O ATOM 0 H SER A 105 -4.415 0.448 -24.649 1.00 0.00 H new ATOM 0 HA SER A 105 -6.028 -2.057 -24.268 1.00 0.00 H new ATOM 0 HB2 SER A 105 -4.227 -2.665 -25.680 1.00 0.00 H new ATOM 0 HB3 SER A 105 -3.090 -1.627 -24.844 1.00 0.00 H new ATOM 0 HG SER A 105 -2.693 -3.189 -23.457 1.00 0.00 H new ATOM 1595 N THR A 106 -5.989 -1.744 -21.826 1.00 0.00 N ATOM 1596 CA THR A 106 -5.952 -1.762 -20.336 1.00 0.00 C ATOM 1597 C THR A 106 -5.346 -3.103 -19.828 1.00 0.00 C ATOM 1598 O THR A 106 -5.822 -4.177 -20.207 1.00 0.00 O ATOM 1599 CB THR A 106 -7.367 -1.548 -19.715 1.00 0.00 C ATOM 1600 OG1 THR A 106 -8.305 -2.527 -20.152 1.00 0.00 O ATOM 1601 CG2 THR A 106 -7.977 -0.163 -19.958 1.00 0.00 C ATOM 0 H THR A 106 -6.832 -2.163 -22.220 1.00 0.00 H new ATOM 0 HA THR A 106 -5.321 -0.933 -20.016 1.00 0.00 H new ATOM 0 HB THR A 106 -7.182 -1.646 -18.645 1.00 0.00 H new ATOM 0 HG1 THR A 106 -8.057 -2.841 -21.046 1.00 0.00 H new ATOM 0 HG21 THR A 106 -8.959 -0.111 -19.489 1.00 0.00 H new ATOM 0 HG22 THR A 106 -7.329 0.601 -19.528 1.00 0.00 H new ATOM 0 HG23 THR A 106 -8.077 0.007 -21.030 1.00 0.00 H new ATOM 1609 N ILE A 107 -4.336 -3.047 -18.944 1.00 0.00 N ATOM 1610 CA ILE A 107 -3.839 -4.252 -18.210 1.00 0.00 C ATOM 1611 C ILE A 107 -4.184 -4.061 -16.695 1.00 0.00 C ATOM 1612 O ILE A 107 -3.640 -3.155 -16.055 1.00 0.00 O ATOM 1613 CB ILE A 107 -2.306 -4.540 -18.417 1.00 0.00 C ATOM 1614 CG1 ILE A 107 -1.708 -4.350 -19.840 1.00 0.00 C ATOM 1615 CG2 ILE A 107 -1.928 -5.937 -17.876 1.00 0.00 C ATOM 1616 CD1 ILE A 107 -2.284 -5.240 -20.951 1.00 0.00 C ATOM 0 H ILE A 107 -3.840 -2.187 -18.712 1.00 0.00 H new ATOM 0 HA ILE A 107 -4.337 -5.131 -18.618 1.00 0.00 H new ATOM 0 HB ILE A 107 -1.845 -3.740 -17.838 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -1.846 -3.309 -20.131 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -0.634 -4.526 -19.785 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.863 -6.111 -18.031 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -2.152 -5.988 -16.811 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -2.501 -6.699 -18.404 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -1.786 -5.013 -21.894 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -2.122 -6.288 -20.698 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -3.353 -5.052 -21.051 1.00 0.00 H new ATOM 1628 N THR A 108 -5.037 -4.924 -16.106 1.00 0.00 N ATOM 1629 CA THR A 108 -5.339 -4.882 -14.641 1.00 0.00 C ATOM 1630 C THR A 108 -4.496 -5.979 -13.915 1.00 0.00 C ATOM 1631 O THR A 108 -4.855 -7.160 -13.903 1.00 0.00 O ATOM 1632 CB THR A 108 -6.874 -5.011 -14.400 1.00 0.00 C ATOM 1633 OG1 THR A 108 -7.588 -4.042 -15.163 1.00 0.00 O ATOM 1634 CG2 THR A 108 -7.309 -4.792 -12.944 1.00 0.00 C ATOM 0 H THR A 108 -5.532 -5.659 -16.611 1.00 0.00 H new ATOM 0 HA THR A 108 -5.051 -3.921 -14.215 1.00 0.00 H new ATOM 0 HB THR A 108 -7.101 -6.036 -14.693 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.549 -4.140 -14.999 1.00 0.00 H new ATOM 0 HG21 THR A 108 -8.391 -4.900 -12.867 1.00 0.00 H new ATOM 0 HG22 THR A 108 -6.824 -5.530 -12.305 1.00 0.00 H new ATOM 0 HG23 THR A 108 -7.021 -3.790 -12.625 1.00 0.00 H new ATOM 1642 N ARG A 109 -3.360 -5.590 -13.315 1.00 0.00 N ATOM 1643 CA ARG A 109 -2.416 -6.540 -12.658 1.00 0.00 C ATOM 1644 C ARG A 109 -2.800 -6.696 -11.153 1.00 0.00 C ATOM 1645 O ARG A 109 -2.486 -5.802 -10.357 1.00 0.00 O ATOM 1646 CB ARG A 109 -0.965 -6.003 -12.826 1.00 0.00 C ATOM 1647 CG ARG A 109 -0.434 -5.792 -14.265 1.00 0.00 C ATOM 1648 CD ARG A 109 0.938 -5.094 -14.277 1.00 0.00 C ATOM 1649 NE ARG A 109 1.428 -4.908 -15.672 1.00 0.00 N ATOM 1650 CZ ARG A 109 2.185 -5.762 -16.359 1.00 0.00 C ATOM 1651 NH1 ARG A 109 2.598 -6.914 -15.890 1.00 0.00 N ATOM 1652 NH2 ARG A 109 2.522 -5.424 -17.568 1.00 0.00 N ATOM 0 H ARG A 109 -3.061 -4.616 -13.265 1.00 0.00 H new ATOM 0 HA ARG A 109 -2.476 -7.524 -13.122 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -0.898 -5.050 -12.301 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -0.292 -6.694 -12.319 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -0.355 -6.756 -14.767 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -1.149 -5.196 -14.831 1.00 0.00 H new ATOM 0 HD2 ARG A 109 0.862 -4.126 -13.782 1.00 0.00 H new ATOM 0 HD3 ARG A 109 1.657 -5.686 -13.711 1.00 0.00 H new ATOM 0 HE ARG A 109 1.158 -4.046 -16.145 1.00 0.00 H new ATOM 0 HH11 ARG A 109 2.341 -7.202 -14.946 1.00 0.00 H new ATOM 0 HH12 ARG A 109 3.176 -7.523 -16.469 1.00 0.00 H new ATOM 0 HH21 ARG A 109 2.208 -4.534 -17.955 1.00 0.00 H new ATOM 0 HH22 ARG A 109 3.101 -6.048 -18.129 1.00 0.00 H new ATOM 1666 N LYS A 110 -3.525 -7.769 -10.763 1.00 0.00 N ATOM 1667 CA LYS A 110 -4.229 -7.802 -9.446 1.00 0.00 C ATOM 1668 C LYS A 110 -3.917 -9.067 -8.590 1.00 0.00 C ATOM 1669 O LYS A 110 -3.728 -10.168 -9.112 1.00 0.00 O ATOM 1670 CB LYS A 110 -5.736 -7.455 -9.679 1.00 0.00 C ATOM 1671 CG LYS A 110 -6.802 -8.572 -9.836 1.00 0.00 C ATOM 1672 CD LYS A 110 -7.285 -9.253 -8.529 1.00 0.00 C ATOM 1673 CE LYS A 110 -7.941 -8.327 -7.476 1.00 0.00 C ATOM 1674 NZ LYS A 110 -8.131 -9.050 -6.189 1.00 0.00 N ATOM 0 H LYS A 110 -3.641 -8.612 -11.325 1.00 0.00 H new ATOM 0 HA LYS A 110 -3.831 -7.028 -8.789 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -6.051 -6.829 -8.844 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -5.786 -6.839 -10.577 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -7.670 -8.148 -10.341 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -6.396 -9.342 -10.492 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -8.000 -10.032 -8.793 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -6.432 -9.748 -8.065 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -7.316 -7.448 -7.317 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -8.903 -7.972 -7.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -8.245 -8.362 -5.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -8.981 -9.647 -6.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -7.301 -9.647 -6.001 1.00 0.00 H new ATOM 1688 N LEU A 111 -3.910 -8.919 -7.252 1.00 0.00 N ATOM 1689 CA LEU A 111 -3.573 -10.035 -6.324 1.00 0.00 C ATOM 1690 C LEU A 111 -4.825 -10.881 -5.920 1.00 0.00 C ATOM 1691 O LEU A 111 -5.799 -10.354 -5.367 1.00 0.00 O ATOM 1692 CB LEU A 111 -2.780 -9.472 -5.097 1.00 0.00 C ATOM 1693 CG LEU A 111 -1.378 -10.082 -4.830 1.00 0.00 C ATOM 1694 CD1 LEU A 111 -1.462 -11.512 -4.273 1.00 0.00 C ATOM 1695 CD2 LEU A 111 -0.438 -10.037 -6.050 1.00 0.00 C ATOM 0 H LEU A 111 -4.132 -8.042 -6.782 1.00 0.00 H new ATOM 0 HA LEU A 111 -2.926 -10.741 -6.845 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.662 -8.397 -5.233 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.389 -9.616 -4.204 1.00 0.00 H new ATOM 0 HG LEU A 111 -0.938 -9.438 -4.068 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.456 -11.896 -4.103 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -2.012 -11.504 -3.332 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -1.978 -12.152 -4.989 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.522 -10.481 -5.786 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -0.883 -10.597 -6.873 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -0.287 -9.002 -6.355 1.00 0.00 H new ATOM 1707 N LYS A 112 -4.793 -12.194 -6.207 1.00 0.00 N ATOM 1708 CA LYS A 112 -5.799 -13.172 -5.691 1.00 0.00 C ATOM 1709 C LYS A 112 -5.159 -14.052 -4.567 1.00 0.00 C ATOM 1710 O LYS A 112 -4.843 -13.532 -3.493 1.00 0.00 O ATOM 1711 CB LYS A 112 -6.545 -13.820 -6.905 1.00 0.00 C ATOM 1712 CG LYS A 112 -7.759 -13.007 -7.448 1.00 0.00 C ATOM 1713 CD LYS A 112 -8.028 -13.212 -8.959 1.00 0.00 C ATOM 1714 CE LYS A 112 -9.417 -12.744 -9.440 1.00 0.00 C ATOM 1715 NZ LYS A 112 -9.603 -12.951 -10.908 1.00 0.00 N ATOM 0 H LYS A 112 -4.078 -12.617 -6.799 1.00 0.00 H new ATOM 0 HA LYS A 112 -6.629 -12.730 -5.140 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -5.831 -13.962 -7.716 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -6.893 -14.810 -6.611 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.651 -13.289 -6.889 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.587 -11.947 -7.260 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -7.265 -12.678 -9.525 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -7.916 -14.271 -9.193 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -10.190 -13.287 -8.897 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -9.545 -11.687 -9.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -10.598 -12.784 -11.159 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -8.998 -12.287 -11.432 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -9.342 -13.927 -11.157 1.00 0.00 H new ATOM 1729 N ASP A 113 -4.980 -15.359 -4.770 1.00 0.00 N ATOM 1730 CA ASP A 113 -4.607 -16.326 -3.681 1.00 0.00 C ATOM 1731 C ASP A 113 -3.063 -16.442 -3.366 1.00 0.00 C ATOM 1732 O ASP A 113 -2.467 -17.524 -3.364 1.00 0.00 O ATOM 1733 CB ASP A 113 -5.332 -17.664 -4.019 1.00 0.00 C ATOM 1734 CG ASP A 113 -4.817 -18.422 -5.246 1.00 0.00 C ATOM 1735 OD1 ASP A 113 -5.129 -18.008 -6.384 1.00 0.00 O ATOM 1736 OD2 ASP A 113 -4.038 -19.387 -5.074 1.00 0.00 O ATOM 0 H ASP A 113 -5.084 -15.798 -5.685 1.00 0.00 H new ATOM 0 HA ASP A 113 -4.950 -15.951 -2.717 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -5.257 -18.322 -3.153 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -6.391 -17.452 -4.167 1.00 0.00 H new ATOM 1741 N GLY A 114 -2.389 -15.301 -3.128 1.00 0.00 N ATOM 1742 CA GLY A 114 -0.907 -15.198 -3.330 1.00 0.00 C ATOM 1743 C GLY A 114 -0.370 -15.303 -4.790 1.00 0.00 C ATOM 1744 O GLY A 114 0.732 -15.806 -5.015 1.00 0.00 O ATOM 0 H GLY A 114 -2.828 -14.441 -2.800 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -0.577 -14.244 -2.918 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -0.432 -15.982 -2.740 1.00 0.00 H new ATOM 1748 N LYS A 115 -1.165 -14.834 -5.762 1.00 0.00 N ATOM 1749 CA LYS A 115 -0.932 -15.040 -7.214 1.00 0.00 C ATOM 1750 C LYS A 115 -1.220 -13.689 -7.933 1.00 0.00 C ATOM 1751 O LYS A 115 -2.254 -13.046 -7.693 1.00 0.00 O ATOM 1752 CB LYS A 115 -1.889 -16.128 -7.795 1.00 0.00 C ATOM 1753 CG LYS A 115 -1.978 -17.514 -7.119 1.00 0.00 C ATOM 1754 CD LYS A 115 -0.713 -18.403 -7.093 1.00 0.00 C ATOM 1755 CE LYS A 115 -0.961 -19.782 -6.430 1.00 0.00 C ATOM 1756 NZ LYS A 115 -1.399 -19.686 -5.001 1.00 0.00 N ATOM 0 H LYS A 115 -2.005 -14.290 -5.566 1.00 0.00 H new ATOM 0 HA LYS A 115 0.094 -15.373 -7.369 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.894 -15.706 -7.804 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.603 -16.291 -8.834 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -2.297 -17.360 -6.088 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -2.768 -18.076 -7.617 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -0.360 -18.554 -8.113 1.00 0.00 H new ATOM 0 HD3 LYS A 115 0.080 -17.883 -6.555 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -1.720 -20.319 -6.999 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -0.046 -20.372 -6.483 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -0.824 -20.327 -4.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -1.276 -18.709 -4.665 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -2.401 -19.954 -4.926 1.00 0.00 H new ATOM 1770 N LEU A 116 -0.339 -13.285 -8.861 1.00 0.00 N ATOM 1771 CA LEU A 116 -0.578 -12.083 -9.702 1.00 0.00 C ATOM 1772 C LEU A 116 -1.424 -12.494 -10.943 1.00 0.00 C ATOM 1773 O LEU A 116 -0.946 -13.123 -11.891 1.00 0.00 O ATOM 1774 CB LEU A 116 0.777 -11.429 -10.055 1.00 0.00 C ATOM 1775 CG LEU A 116 0.694 -10.092 -10.839 1.00 0.00 C ATOM 1776 CD1 LEU A 116 0.565 -8.896 -9.878 1.00 0.00 C ATOM 1777 CD2 LEU A 116 1.911 -9.935 -11.763 1.00 0.00 C ATOM 0 H LEU A 116 0.541 -13.763 -9.054 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.153 -11.327 -9.167 1.00 0.00 H new ATOM 0 HB2 LEU A 116 1.327 -11.253 -9.130 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.360 -12.138 -10.643 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.202 -10.113 -11.460 1.00 0.00 H new ATOM 0 HD11 LEU A 116 0.509 -7.972 -10.453 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -0.339 -9.006 -9.279 1.00 0.00 H new ATOM 0 HD13 LEU A 116 1.434 -8.862 -9.221 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.837 -8.992 -12.305 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.824 -9.940 -11.167 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.937 -10.761 -12.474 1.00 0.00 H new ATOM 1789 N VAL A 117 -2.707 -12.136 -10.892 1.00 0.00 N ATOM 1790 CA VAL A 117 -3.705 -12.481 -11.933 1.00 0.00 C ATOM 1791 C VAL A 117 -3.860 -11.206 -12.823 1.00 0.00 C ATOM 1792 O VAL A 117 -4.371 -10.167 -12.388 1.00 0.00 O ATOM 1793 CB VAL A 117 -5.017 -12.966 -11.234 1.00 0.00 C ATOM 1794 CG1 VAL A 117 -6.134 -13.294 -12.239 1.00 0.00 C ATOM 1795 CG2 VAL A 117 -4.835 -14.227 -10.350 1.00 0.00 C ATOM 0 H VAL A 117 -3.098 -11.592 -10.123 1.00 0.00 H new ATOM 0 HA VAL A 117 -3.409 -13.306 -12.581 1.00 0.00 H new ATOM 0 HB VAL A 117 -5.289 -12.118 -10.606 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.022 -13.626 -11.701 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.374 -12.404 -12.820 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -5.799 -14.086 -12.909 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -5.791 -14.498 -9.902 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -4.475 -15.053 -10.964 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -4.111 -14.018 -9.562 1.00 0.00 H new ATOM 1805 N VAL A 118 -3.355 -11.286 -14.060 1.00 0.00 N ATOM 1806 CA VAL A 118 -3.190 -10.105 -14.954 1.00 0.00 C ATOM 1807 C VAL A 118 -4.343 -10.150 -15.999 1.00 0.00 C ATOM 1808 O VAL A 118 -4.349 -10.996 -16.903 1.00 0.00 O ATOM 1809 CB VAL A 118 -1.744 -10.139 -15.550 1.00 0.00 C ATOM 1810 CG1 VAL A 118 -1.481 -9.123 -16.676 1.00 0.00 C ATOM 1811 CG2 VAL A 118 -0.630 -9.940 -14.491 1.00 0.00 C ATOM 0 H VAL A 118 -3.046 -12.163 -14.480 1.00 0.00 H new ATOM 0 HA VAL A 118 -3.273 -9.147 -14.440 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.701 -11.146 -15.964 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.453 -9.223 -17.024 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.164 -9.312 -17.504 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -1.639 -8.113 -16.299 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.345 -9.975 -14.977 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -0.758 -8.973 -14.005 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -0.692 -10.732 -13.744 1.00 0.00 H new ATOM 1821 N GLU A 119 -5.326 -9.252 -15.836 1.00 0.00 N ATOM 1822 CA GLU A 119 -6.642 -9.358 -16.522 1.00 0.00 C ATOM 1823 C GLU A 119 -6.795 -8.134 -17.464 1.00 0.00 C ATOM 1824 O GLU A 119 -7.084 -7.011 -17.033 1.00 0.00 O ATOM 1825 CB GLU A 119 -7.798 -9.547 -15.495 1.00 0.00 C ATOM 1826 CG GLU A 119 -7.580 -10.746 -14.533 1.00 0.00 C ATOM 1827 CD GLU A 119 -8.777 -11.361 -13.839 1.00 0.00 C ATOM 1828 OE1 GLU A 119 -9.443 -12.218 -14.459 1.00 0.00 O ATOM 1829 OE2 GLU A 119 -8.983 -11.097 -12.633 1.00 0.00 O ATOM 0 H GLU A 119 -5.242 -8.434 -15.232 1.00 0.00 H new ATOM 0 HA GLU A 119 -6.695 -10.252 -17.143 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -7.905 -8.635 -14.908 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.734 -9.690 -16.035 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -7.087 -11.536 -15.099 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -6.882 -10.424 -13.760 1.00 0.00 H new ATOM 1836 N CYS A 120 -6.516 -8.349 -18.758 1.00 0.00 N ATOM 1837 CA CYS A 120 -6.501 -7.260 -19.762 1.00 0.00 C ATOM 1838 C CYS A 120 -7.859 -7.077 -20.506 1.00 0.00 C ATOM 1839 O CYS A 120 -8.624 -8.032 -20.675 1.00 0.00 O ATOM 1840 CB CYS A 120 -5.353 -7.560 -20.752 1.00 0.00 C ATOM 1841 SG CYS A 120 -5.905 -8.680 -22.045 1.00 0.00 S ATOM 0 H CYS A 120 -6.296 -9.269 -19.141 1.00 0.00 H new ATOM 0 HA CYS A 120 -6.340 -6.312 -19.248 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -4.997 -6.630 -21.197 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -4.511 -8.000 -20.218 1.00 0.00 H new ATOM 0 HG CYS A 120 -4.947 -9.508 -22.340 1.00 0.00 H new ATOM 1846 N VAL A 121 -8.094 -5.875 -21.056 1.00 0.00 N ATOM 1847 CA VAL A 121 -9.074 -5.682 -22.166 1.00 0.00 C ATOM 1848 C VAL A 121 -8.569 -4.563 -23.137 1.00 0.00 C ATOM 1849 O VAL A 121 -8.213 -3.456 -22.706 1.00 0.00 O ATOM 1850 CB VAL A 121 -10.548 -5.504 -21.660 1.00 0.00 C ATOM 1851 CG1 VAL A 121 -10.865 -4.206 -20.889 1.00 0.00 C ATOM 1852 CG2 VAL A 121 -11.577 -5.672 -22.802 1.00 0.00 C ATOM 0 H VAL A 121 -7.627 -5.018 -20.760 1.00 0.00 H new ATOM 0 HA VAL A 121 -9.125 -6.600 -22.751 1.00 0.00 H new ATOM 0 HB VAL A 121 -10.637 -6.309 -20.930 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -11.915 -4.205 -20.595 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -10.238 -4.149 -19.999 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -10.666 -3.346 -21.528 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -12.584 -5.541 -22.406 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -11.390 -4.925 -23.573 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -11.483 -6.669 -23.232 1.00 0.00 H new ATOM 1862 N MET A 122 -8.570 -4.857 -24.453 1.00 0.00 N ATOM 1863 CA MET A 122 -8.371 -3.822 -25.509 1.00 0.00 C ATOM 1864 C MET A 122 -9.753 -3.470 -26.155 1.00 0.00 C ATOM 1865 O MET A 122 -10.537 -2.732 -25.553 1.00 0.00 O ATOM 1866 CB MET A 122 -7.227 -4.293 -26.460 1.00 0.00 C ATOM 1867 CG MET A 122 -6.795 -3.243 -27.508 1.00 0.00 C ATOM 1868 SD MET A 122 -6.180 -4.057 -28.989 1.00 0.00 S ATOM 1869 CE MET A 122 -5.678 -2.607 -29.930 1.00 0.00 C ATOM 0 H MET A 122 -8.706 -5.800 -24.818 1.00 0.00 H new ATOM 0 HA MET A 122 -8.020 -2.866 -25.119 1.00 0.00 H new ATOM 0 HB2 MET A 122 -6.360 -4.566 -25.858 1.00 0.00 H new ATOM 0 HB3 MET A 122 -7.551 -5.195 -26.979 1.00 0.00 H new ATOM 0 HG2 MET A 122 -7.640 -2.603 -27.761 1.00 0.00 H new ATOM 0 HG3 MET A 122 -6.021 -2.599 -27.090 1.00 0.00 H new ATOM 0 HE1 MET A 122 -5.607 -2.866 -30.986 1.00 0.00 H new ATOM 0 HE2 MET A 122 -6.416 -1.815 -29.799 1.00 0.00 H new ATOM 0 HE3 MET A 122 -4.707 -2.261 -29.575 1.00 0.00 H new ATOM 1879 N ASN A 123 -10.064 -3.982 -27.360 1.00 0.00 N ATOM 1880 CA ASN A 123 -11.314 -3.647 -28.093 1.00 0.00 C ATOM 1881 C ASN A 123 -12.269 -4.874 -28.011 1.00 0.00 C ATOM 1882 O ASN A 123 -12.250 -5.753 -28.876 1.00 0.00 O ATOM 1883 CB ASN A 123 -10.959 -3.205 -29.546 1.00 0.00 C ATOM 1884 CG ASN A 123 -10.012 -2.008 -29.766 1.00 0.00 C ATOM 1885 OD1 ASN A 123 -9.118 -2.035 -30.604 1.00 0.00 O ATOM 1886 ND2 ASN A 123 -10.152 -0.913 -29.057 1.00 0.00 N ATOM 0 H ASN A 123 -9.462 -4.638 -27.858 1.00 0.00 H new ATOM 0 HA ASN A 123 -11.840 -2.803 -27.647 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -10.520 -4.066 -30.051 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -11.895 -2.979 -30.056 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -9.528 -0.121 -29.213 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -10.885 -0.853 -28.350 1.00 0.00 H new ATOM 1893 N ASN A 124 -13.052 -4.974 -26.915 1.00 0.00 N ATOM 1894 CA ASN A 124 -13.857 -6.196 -26.564 1.00 0.00 C ATOM 1895 C ASN A 124 -13.047 -7.408 -25.981 1.00 0.00 C ATOM 1896 O ASN A 124 -13.518 -8.062 -25.047 1.00 0.00 O ATOM 1897 CB ASN A 124 -14.855 -6.686 -27.659 1.00 0.00 C ATOM 1898 CG ASN A 124 -15.868 -5.649 -28.155 1.00 0.00 C ATOM 1899 OD1 ASN A 124 -16.841 -5.323 -27.486 1.00 0.00 O ATOM 1900 ND2 ASN A 124 -15.680 -5.103 -29.333 1.00 0.00 N ATOM 0 H ASN A 124 -13.153 -4.217 -26.239 1.00 0.00 H new ATOM 0 HA ASN A 124 -14.455 -5.798 -25.744 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -14.280 -7.041 -28.514 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -15.404 -7.542 -27.266 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -16.342 -4.412 -29.686 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -14.872 -5.370 -29.896 1.00 0.00 H new ATOM 1907 N VAL A 125 -11.876 -7.746 -26.550 1.00 0.00 N ATOM 1908 CA VAL A 125 -11.199 -9.057 -26.337 1.00 0.00 C ATOM 1909 C VAL A 125 -10.376 -9.060 -25.001 1.00 0.00 C ATOM 1910 O VAL A 125 -9.488 -8.226 -24.781 1.00 0.00 O ATOM 1911 CB VAL A 125 -10.345 -9.401 -27.607 1.00 0.00 C ATOM 1912 CG1 VAL A 125 -9.575 -10.734 -27.490 1.00 0.00 C ATOM 1913 CG2 VAL A 125 -11.171 -9.503 -28.915 1.00 0.00 C ATOM 0 H VAL A 125 -11.364 -7.122 -27.174 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.938 -9.849 -26.215 1.00 0.00 H new ATOM 0 HB VAL A 125 -9.657 -8.557 -27.657 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -9.007 -10.907 -28.404 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -8.892 -10.687 -26.642 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -10.282 -11.551 -27.342 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -10.508 -9.743 -29.746 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -11.922 -10.286 -28.811 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -11.665 -8.551 -29.109 1.00 0.00 H new ATOM 1923 N THR A 126 -10.694 -10.028 -24.126 1.00 0.00 N ATOM 1924 CA THR A 126 -10.145 -10.107 -22.740 1.00 0.00 C ATOM 1925 C THR A 126 -9.146 -11.292 -22.559 1.00 0.00 C ATOM 1926 O THR A 126 -9.449 -12.415 -22.982 1.00 0.00 O ATOM 1927 CB THR A 126 -11.301 -10.287 -21.704 1.00 0.00 C ATOM 1928 OG1 THR A 126 -12.018 -11.498 -21.947 1.00 0.00 O ATOM 1929 CG2 THR A 126 -12.321 -9.142 -21.639 1.00 0.00 C ATOM 0 H THR A 126 -11.340 -10.785 -24.349 1.00 0.00 H new ATOM 0 HA THR A 126 -9.613 -9.171 -22.570 1.00 0.00 H new ATOM 0 HB THR A 126 -10.783 -10.303 -20.745 1.00 0.00 H new ATOM 0 HG1 THR A 126 -11.389 -12.205 -22.201 1.00 0.00 H new ATOM 0 HG21 THR A 126 -13.078 -9.371 -20.889 1.00 0.00 H new ATOM 0 HG22 THR A 126 -11.812 -8.216 -21.371 1.00 0.00 H new ATOM 0 HG23 THR A 126 -12.799 -9.025 -22.612 1.00 0.00 H new ATOM 1937 N CYS A 127 -8.028 -11.080 -21.834 1.00 0.00 N ATOM 1938 CA CYS A 127 -7.134 -12.193 -21.402 1.00 0.00 C ATOM 1939 C CYS A 127 -6.856 -12.173 -19.867 1.00 0.00 C ATOM 1940 O CYS A 127 -6.232 -11.239 -19.352 1.00 0.00 O ATOM 1941 CB CYS A 127 -5.837 -12.198 -22.239 1.00 0.00 C ATOM 1942 SG CYS A 127 -4.641 -10.960 -21.717 1.00 0.00 S ATOM 0 H CYS A 127 -7.717 -10.156 -21.533 1.00 0.00 H new ATOM 0 HA CYS A 127 -7.655 -13.132 -21.591 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -5.378 -13.184 -22.177 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -6.089 -12.029 -23.286 1.00 0.00 H new ATOM 0 HG CYS A 127 -5.267 -9.896 -21.310 1.00 0.00 H new ATOM 1947 N THR A 128 -7.279 -13.232 -19.155 1.00 0.00 N ATOM 1948 CA THR A 128 -6.883 -13.479 -17.735 1.00 0.00 C ATOM 1949 C THR A 128 -5.640 -14.424 -17.745 1.00 0.00 C ATOM 1950 O THR A 128 -5.766 -15.623 -18.019 1.00 0.00 O ATOM 1951 CB THR A 128 -8.103 -14.045 -16.938 1.00 0.00 C ATOM 1952 OG1 THR A 128 -9.101 -13.035 -16.766 1.00 0.00 O ATOM 1953 CG2 THR A 128 -7.803 -14.595 -15.535 1.00 0.00 C ATOM 0 H THR A 128 -7.902 -13.945 -19.535 1.00 0.00 H new ATOM 0 HA THR A 128 -6.597 -12.560 -17.223 1.00 0.00 H new ATOM 0 HB THR A 128 -8.430 -14.882 -17.555 1.00 0.00 H new ATOM 0 HG1 THR A 128 -9.245 -12.877 -15.810 1.00 0.00 H new ATOM 0 HG21 THR A 128 -8.725 -14.958 -15.082 1.00 0.00 H new ATOM 0 HG22 THR A 128 -7.088 -15.415 -15.611 1.00 0.00 H new ATOM 0 HG23 THR A 128 -7.382 -13.803 -14.916 1.00 0.00 H new ATOM 1961 N ARG A 129 -4.441 -13.887 -17.456 1.00 0.00 N ATOM 1962 CA ARG A 129 -3.184 -14.687 -17.441 1.00 0.00 C ATOM 1963 C ARG A 129 -2.539 -14.735 -16.010 1.00 0.00 C ATOM 1964 O ARG A 129 -2.402 -13.720 -15.318 1.00 0.00 O ATOM 1965 CB ARG A 129 -2.290 -14.259 -18.640 1.00 0.00 C ATOM 1966 CG ARG A 129 -1.522 -12.925 -18.588 1.00 0.00 C ATOM 1967 CD ARG A 129 -1.964 -11.886 -19.634 1.00 0.00 C ATOM 1968 NE ARG A 129 -0.814 -10.978 -19.883 1.00 0.00 N ATOM 1969 CZ ARG A 129 -0.872 -9.796 -20.495 1.00 0.00 C ATOM 1970 NH1 ARG A 129 -1.985 -9.254 -20.919 1.00 0.00 N ATOM 1971 NH2 ARG A 129 0.237 -9.146 -20.687 1.00 0.00 N ATOM 0 H ARG A 129 -4.307 -12.902 -17.228 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.376 -15.745 -17.618 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -1.556 -15.050 -18.796 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -2.925 -14.234 -19.526 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.639 -12.493 -17.594 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -0.460 -13.128 -18.724 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -2.269 -12.379 -20.557 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -2.825 -11.323 -19.274 1.00 0.00 H new ATOM 0 HE ARG A 129 0.101 -11.287 -19.556 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -2.872 -9.741 -20.787 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.966 -8.345 -21.381 1.00 0.00 H new ATOM 0 HH21 ARG A 129 1.122 -9.543 -20.372 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.222 -8.239 -21.153 1.00 0.00 H new ATOM 1985 N ILE A 130 -2.210 -15.952 -15.547 1.00 0.00 N ATOM 1986 CA ILE A 130 -2.002 -16.275 -14.103 1.00 0.00 C ATOM 1987 C ILE A 130 -0.472 -16.408 -13.819 1.00 0.00 C ATOM 1988 O ILE A 130 0.204 -17.214 -14.467 1.00 0.00 O ATOM 1989 CB ILE A 130 -2.760 -17.608 -13.725 1.00 0.00 C ATOM 1990 CG1 ILE A 130 -4.240 -17.755 -14.199 1.00 0.00 C ATOM 1991 CG2 ILE A 130 -2.670 -17.933 -12.209 1.00 0.00 C ATOM 1992 CD1 ILE A 130 -5.235 -16.697 -13.710 1.00 0.00 C ATOM 0 H ILE A 130 -2.077 -16.756 -16.161 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.408 -15.472 -13.489 1.00 0.00 H new ATOM 0 HB ILE A 130 -2.205 -18.340 -14.311 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.249 -17.750 -15.289 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -4.602 -18.733 -13.882 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.207 -18.859 -12.003 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.625 -18.049 -11.923 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -3.115 -17.120 -11.636 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -6.225 -16.915 -14.111 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -5.274 -16.710 -12.621 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -4.915 -15.712 -14.050 1.00 0.00 H new ATOM 2004 N TYR A 131 0.064 -15.672 -12.827 1.00 0.00 N ATOM 2005 CA TYR A 131 1.521 -15.687 -12.516 1.00 0.00 C ATOM 2006 C TYR A 131 1.806 -16.096 -11.020 1.00 0.00 C ATOM 2007 O TYR A 131 1.288 -15.478 -10.081 1.00 0.00 O ATOM 2008 CB TYR A 131 2.164 -14.310 -12.847 1.00 0.00 C ATOM 2009 CG TYR A 131 2.173 -13.756 -14.291 1.00 0.00 C ATOM 2010 CD1 TYR A 131 1.031 -13.168 -14.836 1.00 0.00 C ATOM 2011 CD2 TYR A 131 3.371 -13.703 -15.018 1.00 0.00 C ATOM 2012 CE1 TYR A 131 1.079 -12.557 -16.088 1.00 0.00 C ATOM 2013 CE2 TYR A 131 3.419 -13.079 -16.263 1.00 0.00 C ATOM 2014 CZ TYR A 131 2.273 -12.514 -16.801 1.00 0.00 C ATOM 2015 OH TYR A 131 2.299 -11.916 -18.036 1.00 0.00 O ATOM 0 H TYR A 131 -0.483 -15.058 -12.223 1.00 0.00 H new ATOM 0 HA TYR A 131 1.980 -16.448 -13.147 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.664 -13.568 -12.225 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.202 -14.356 -12.517 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.103 -13.186 -14.284 1.00 0.00 H new ATOM 0 HD2 TYR A 131 4.265 -14.150 -14.609 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.186 -12.116 -16.506 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.350 -13.035 -16.809 1.00 0.00 H new ATOM 0 HH TYR A 131 3.206 -11.967 -18.405 1.00 0.00 H new ATOM 2025 N GLU A 132 2.663 -17.118 -10.807 1.00 0.00 N ATOM 2026 CA GLU A 132 3.047 -17.630 -9.452 1.00 0.00 C ATOM 2027 C GLU A 132 4.260 -16.890 -8.792 1.00 0.00 C ATOM 2028 O GLU A 132 5.235 -16.557 -9.472 1.00 0.00 O ATOM 2029 CB GLU A 132 3.243 -19.177 -9.538 1.00 0.00 C ATOM 2030 CG GLU A 132 4.353 -19.793 -10.452 1.00 0.00 C ATOM 2031 CD GLU A 132 5.787 -19.971 -9.937 1.00 0.00 C ATOM 2032 OE1 GLU A 132 6.097 -19.616 -8.784 1.00 0.00 O ATOM 2033 OE2 GLU A 132 6.621 -20.498 -10.712 1.00 0.00 O ATOM 0 H GLU A 132 3.117 -17.622 -11.569 1.00 0.00 H new ATOM 0 HA GLU A 132 2.229 -17.405 -8.768 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.428 -19.533 -8.525 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.292 -19.603 -9.857 1.00 0.00 H new ATOM 0 HG2 GLU A 132 4.001 -20.776 -10.765 1.00 0.00 H new ATOM 0 HG3 GLU A 132 4.409 -19.175 -11.348 1.00 0.00 H new ATOM 2040 N LYS A 133 4.210 -16.627 -7.464 1.00 0.00 N ATOM 2041 CA LYS A 133 5.328 -15.950 -6.737 1.00 0.00 C ATOM 2042 C LYS A 133 6.544 -16.903 -6.509 1.00 0.00 C ATOM 2043 O LYS A 133 6.432 -17.906 -5.797 1.00 0.00 O ATOM 2044 CB LYS A 133 4.836 -15.361 -5.378 1.00 0.00 C ATOM 2045 CG LYS A 133 5.593 -14.077 -4.945 1.00 0.00 C ATOM 2046 CD LYS A 133 5.194 -13.551 -3.539 1.00 0.00 C ATOM 2047 CE LYS A 133 5.128 -12.014 -3.365 1.00 0.00 C ATOM 2048 NZ LYS A 133 6.432 -11.338 -3.588 1.00 0.00 N ATOM 0 H LYS A 133 3.416 -16.869 -6.871 1.00 0.00 H new ATOM 0 HA LYS A 133 5.667 -15.131 -7.371 1.00 0.00 H new ATOM 0 HB2 LYS A 133 3.772 -15.137 -5.453 1.00 0.00 H new ATOM 0 HB3 LYS A 133 4.949 -16.118 -4.602 1.00 0.00 H new ATOM 0 HG2 LYS A 133 6.664 -14.278 -4.956 1.00 0.00 H new ATOM 0 HG3 LYS A 133 5.409 -13.294 -5.680 1.00 0.00 H new ATOM 0 HD2 LYS A 133 4.218 -13.964 -3.285 1.00 0.00 H new ATOM 0 HD3 LYS A 133 5.906 -13.945 -2.814 1.00 0.00 H new ATOM 0 HE2 LYS A 133 4.393 -11.608 -4.061 1.00 0.00 H new ATOM 0 HE3 LYS A 133 4.776 -11.785 -2.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 6.277 -10.317 -3.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 7.052 -11.500 -2.768 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 6.881 -11.724 -4.443 1.00 0.00 H new ATOM 2062 N VAL A 134 7.715 -16.562 -7.071 1.00 0.00 N ATOM 2063 CA VAL A 134 8.934 -17.431 -6.993 1.00 0.00 C ATOM 2064 C VAL A 134 9.776 -17.070 -5.710 1.00 0.00 C ATOM 2065 O VAL A 134 10.913 -16.590 -5.804 1.00 0.00 O ATOM 2066 CB VAL A 134 9.745 -17.302 -8.337 1.00 0.00 C ATOM 2067 CG1 VAL A 134 10.929 -18.296 -8.425 1.00 0.00 C ATOM 2068 CG2 VAL A 134 8.927 -17.444 -9.646 1.00 0.00 C ATOM 0 H VAL A 134 7.858 -15.694 -7.587 1.00 0.00 H new ATOM 0 HA VAL A 134 8.656 -18.480 -6.885 1.00 0.00 H new ATOM 0 HB VAL A 134 10.096 -16.272 -8.276 1.00 0.00 H new ATOM 0 HG11 VAL A 134 11.449 -18.159 -9.373 1.00 0.00 H new ATOM 0 HG12 VAL A 134 11.620 -18.113 -7.602 1.00 0.00 H new ATOM 0 HG13 VAL A 134 10.552 -19.317 -8.362 1.00 0.00 H new ATOM 0 HG21 VAL A 134 9.591 -17.337 -10.504 1.00 0.00 H new ATOM 0 HG22 VAL A 134 8.453 -18.425 -9.674 1.00 0.00 H new ATOM 0 HG23 VAL A 134 8.161 -16.670 -9.682 1.00 0.00 H new ATOM 2078 N GLU A 135 9.187 -17.228 -4.511 1.00 0.00 N ATOM 2079 CA GLU A 135 9.642 -16.517 -3.284 1.00 0.00 C ATOM 2080 C GLU A 135 9.162 -17.303 -2.037 1.00 0.00 C ATOM 2081 O GLU A 135 7.933 -17.446 -1.817 1.00 0.00 O ATOM 2082 CB GLU A 135 9.121 -15.052 -3.235 1.00 0.00 C ATOM 2083 CG GLU A 135 9.712 -14.058 -4.269 1.00 0.00 C ATOM 2084 CD GLU A 135 9.037 -12.706 -4.257 1.00 0.00 C ATOM 2085 OE1 GLU A 135 9.126 -11.973 -3.251 1.00 0.00 O ATOM 2086 OE2 GLU A 135 8.328 -12.383 -5.234 1.00 0.00 O ATOM 2087 OXT GLU A 135 10.025 -17.764 -1.256 1.00 0.00 O ATOM 0 H GLU A 135 8.389 -17.844 -4.357 1.00 0.00 H new ATOM 0 HA GLU A 135 10.731 -16.468 -3.298 1.00 0.00 H new ATOM 0 HB2 GLU A 135 8.039 -15.073 -3.366 1.00 0.00 H new ATOM 0 HB3 GLU A 135 9.314 -14.657 -2.237 1.00 0.00 H new ATOM 0 HG2 GLU A 135 10.775 -13.927 -4.069 1.00 0.00 H new ATOM 0 HG3 GLU A 135 9.627 -14.489 -5.266 1.00 0.00 H new