USER MOD reduce.3.24.130724 H: found=0, std=0, add=1046, rem=0, adj=45 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 -76:sc= -7.88! USER MOD Set 1.2: A 127 CYS SG : rot -105:sc= -6.58! USER MOD Set 2.1: A 22 TYR OH : rot 180:sc= 0.552 USER MOD Set 2.2: A 105 SER OG : rot -115:sc= 1.55 USER MOD Set 3.1: A 83 THR OG1 : rot 83:sc= -0.279 USER MOD Set 3.2: A 85 THR OG1 : rot -163:sc= 0.697 USER MOD Set 3.3: A 98 GLN : amide:sc= 0 X(o=0.42,f=0.3) USER MOD Set 4.1: A 67 CYS SG : rot -122:sc= 0.911 USER MOD Set 4.2: A 87 CYS SG : rot 168:sc= -1.57! USER MOD Set 5.1: A 76 THR OG1 : rot 150:sc= 1.04 USER MOD Set 5.2: A 82 LYS NZ :NH3+ 155:sc= 2.32 (180deg=0.823) USER MOD Set 6.1: A 55 LYS NZ :NH3+ -169:sc= 1.19 (180deg=0) USER MOD Set 6.2: A 64 GLN : amide:sc= 1.02 K(o=2.2,f=-5.7) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 GLN : amide:sc= 0.2 K(o=0.2,f=-3.9!) USER MOD Single : A 16 SER OG : rot 49:sc= 0.0528 USER MOD Single : A 17 LYS NZ :NH3+ 142:sc= 0.533 (180deg=0.0586) USER MOD Single : A 23 MET CE :methyl -170:sc= 0 (180deg=-0.0854) USER MOD Single : A 24 LYS NZ :NH3+ -161:sc= 1.09 (180deg=-0.242!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 MET CE :methyl 161:sc= -0.0232 (180deg=-0.248) USER MOD Single : A 38 MET CE :methyl 160:sc=-0.00525 (180deg=-0.514) USER MOD Single : A 40 LYS NZ :NH3+ 171:sc= 0.00341 (180deg=0.00103) USER MOD Single : A 43 CYS SG : rot 160:sc= -0.189 USER MOD Single : A 46 THR OG1 : rot -1:sc= 0.531 USER MOD Single : A 47 CYS SG : rot -53:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 176:sc= 1.23 (180deg=1.18) USER MOD Single : A 51 ASN : amide:sc= 0.0174 X(o=0.017,f=0) USER MOD Single : A 53 THR OG1 : rot 148:sc= 1.12 USER MOD Single : A 56 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ 170:sc= 0.0198 (180deg=0.0106) USER MOD Single : A 62 THR OG1 : rot 46:sc= 1.69 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 27:sc= 0.731 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 176:sc= 1.14 (180deg=1.14) USER MOD Single : A 77 THR OG1 : rot -70:sc= 1 USER MOD Single : A 84 GLN : amide:sc=-0.000865 K(o=-0.00087,f=-1.3) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 THR OG1 : rot -54:sc= 0.401 USER MOD Single : A 96 GLN : amide:sc= 2.14 K(o=2.1,f=-7.1!) USER MOD Single : A 97 HIS : +bothHN:sc= 1.36 K(o=1.4,f=-7.7!) USER MOD Single : A 103 LYS NZ :NH3+ -169:sc= 2.41 (180deg=1.94) USER MOD Single : A 106 THR OG1 : rot -12:sc= 1.03 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ 175:sc= 1.16 (180deg=0.771) USER MOD Single : A 112 LYS NZ :NH3+ 172:sc= 1.09 (180deg=1.01) USER MOD Single : A 115 LYS NZ :NH3+ 171:sc= 1.26 (180deg=0.824) USER MOD Single : A 122 MET CE :methyl 180:sc= 0 (180deg=0) 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 44:sc= 0.797 USER MOD Single : A 128 THR OG1 : rot 180:sc= -0.031 USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 173:sc= 1.05 (180deg=0.332) USER MOD ----------------------------------------------------------------- ATOM 14 N VAL A 4 -0.299 -2.254 -2.534 1.00 0.00 N ATOM 15 CA VAL A 4 1.063 -2.221 -3.170 1.00 0.00 C ATOM 16 C VAL A 4 2.141 -3.263 -2.692 1.00 0.00 C ATOM 17 O VAL A 4 2.761 -3.933 -3.520 1.00 0.00 O ATOM 18 CB VAL A 4 1.563 -0.767 -3.496 1.00 0.00 C ATOM 19 CG1 VAL A 4 2.117 0.022 -2.290 1.00 0.00 C ATOM 20 CG2 VAL A 4 2.618 -0.736 -4.627 1.00 0.00 C ATOM 0 HA VAL A 4 0.880 -2.673 -4.145 1.00 0.00 H new ATOM 0 HB VAL A 4 0.650 -0.269 -3.821 1.00 0.00 H new ATOM 0 HG11 VAL A 4 2.436 1.011 -2.618 1.00 0.00 H new ATOM 0 HG12 VAL A 4 1.339 0.124 -1.533 1.00 0.00 H new ATOM 0 HG13 VAL A 4 2.968 -0.511 -1.866 1.00 0.00 H new ATOM 0 HG21 VAL A 4 2.926 0.294 -4.809 1.00 0.00 H new ATOM 0 HG22 VAL A 4 3.485 -1.328 -4.332 1.00 0.00 H new ATOM 0 HG23 VAL A 4 2.187 -1.152 -5.538 1.00 0.00 H new ATOM 30 N GLN A 5 2.342 -3.419 -1.377 1.00 0.00 N ATOM 31 CA GLN A 5 3.344 -4.336 -0.764 1.00 0.00 C ATOM 32 C GLN A 5 3.198 -5.854 -1.121 1.00 0.00 C ATOM 33 O GLN A 5 4.180 -6.479 -1.528 1.00 0.00 O ATOM 34 CB GLN A 5 3.286 -4.077 0.768 1.00 0.00 C ATOM 35 CG GLN A 5 3.835 -2.703 1.246 1.00 0.00 C ATOM 36 CD GLN A 5 3.720 -2.460 2.753 1.00 0.00 C ATOM 37 OE1 GLN A 5 4.690 -2.494 3.501 1.00 0.00 O ATOM 38 NE2 GLN A 5 2.532 -2.199 3.244 1.00 0.00 N ATOM 0 H GLN A 5 1.804 -2.902 -0.681 1.00 0.00 H new ATOM 0 HA GLN A 5 4.323 -4.108 -1.186 1.00 0.00 H new ATOM 0 HB2 GLN A 5 2.249 -4.165 1.093 1.00 0.00 H new ATOM 0 HB3 GLN A 5 3.846 -4.865 1.272 1.00 0.00 H new ATOM 0 HG2 GLN A 5 4.883 -2.625 0.958 1.00 0.00 H new ATOM 0 HG3 GLN A 5 3.301 -1.911 0.722 1.00 0.00 H new ATOM 0 HE21 GLN A 5 1.720 -2.169 2.627 1.00 0.00 H new ATOM 0 HE22 GLN A 5 2.420 -2.026 4.243 1.00 0.00 H new ATOM 47 N GLN A 6 1.988 -6.439 -1.037 1.00 0.00 N ATOM 48 CA GLN A 6 1.714 -7.825 -1.526 1.00 0.00 C ATOM 49 C GLN A 6 1.846 -8.077 -3.075 1.00 0.00 C ATOM 50 O GLN A 6 1.982 -9.236 -3.478 1.00 0.00 O ATOM 51 CB GLN A 6 0.334 -8.290 -0.979 1.00 0.00 C ATOM 52 CG GLN A 6 0.222 -8.475 0.564 1.00 0.00 C ATOM 53 CD GLN A 6 -0.237 -7.248 1.374 1.00 0.00 C ATOM 54 OE1 GLN A 6 0.340 -6.166 1.328 1.00 0.00 O ATOM 55 NE2 GLN A 6 -1.280 -7.367 2.160 1.00 0.00 N ATOM 0 H GLN A 6 1.172 -5.978 -0.634 1.00 0.00 H new ATOM 0 HA GLN A 6 2.524 -8.436 -1.128 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -0.418 -7.565 -1.291 1.00 0.00 H new ATOM 0 HB3 GLN A 6 0.080 -9.237 -1.455 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -0.473 -9.292 0.760 1.00 0.00 H new ATOM 0 HG3 GLN A 6 1.196 -8.788 0.941 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -1.777 -8.256 2.216 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -1.594 -6.571 2.715 1.00 0.00 H new ATOM 64 N LEU A 7 1.872 -7.034 -3.931 1.00 0.00 N ATOM 65 CA LEU A 7 2.346 -7.154 -5.344 1.00 0.00 C ATOM 66 C LEU A 7 3.897 -7.352 -5.556 1.00 0.00 C ATOM 67 O LEU A 7 4.296 -7.648 -6.683 1.00 0.00 O ATOM 68 CB LEU A 7 1.897 -5.903 -6.168 1.00 0.00 C ATOM 69 CG LEU A 7 0.424 -5.408 -6.142 1.00 0.00 C ATOM 70 CD1 LEU A 7 0.252 -4.238 -7.125 1.00 0.00 C ATOM 71 CD2 LEU A 7 -0.603 -6.496 -6.486 1.00 0.00 C ATOM 0 H LEU A 7 1.571 -6.093 -3.676 1.00 0.00 H new ATOM 0 HA LEU A 7 1.882 -8.077 -5.691 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.519 -5.069 -5.844 1.00 0.00 H new ATOM 0 HB3 LEU A 7 2.148 -6.102 -7.210 1.00 0.00 H new ATOM 0 HG LEU A 7 0.229 -5.097 -5.116 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -0.782 -3.894 -7.104 1.00 0.00 H new ATOM 0 HD12 LEU A 7 0.913 -3.420 -6.837 1.00 0.00 H new ATOM 0 HD13 LEU A 7 0.503 -4.569 -8.133 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -1.607 -6.074 -6.447 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.408 -6.876 -7.489 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.524 -7.311 -5.767 1.00 0.00 H new ATOM 83 N GLU A 8 4.772 -7.178 -4.546 1.00 0.00 N ATOM 84 CA GLU A 8 6.243 -7.052 -4.751 1.00 0.00 C ATOM 85 C GLU A 8 6.966 -8.431 -4.862 1.00 0.00 C ATOM 86 O GLU A 8 6.875 -9.281 -3.967 1.00 0.00 O ATOM 87 CB GLU A 8 6.848 -6.224 -3.581 1.00 0.00 C ATOM 88 CG GLU A 8 6.374 -4.754 -3.458 1.00 0.00 C ATOM 89 CD GLU A 8 6.855 -3.822 -4.550 1.00 0.00 C ATOM 90 OE1 GLU A 8 6.204 -3.733 -5.609 1.00 0.00 O ATOM 91 OE2 GLU A 8 7.885 -3.149 -4.346 1.00 0.00 O ATOM 0 H GLU A 8 4.489 -7.120 -3.568 1.00 0.00 H new ATOM 0 HA GLU A 8 6.400 -6.545 -5.703 1.00 0.00 H new ATOM 0 HB2 GLU A 8 6.619 -6.736 -2.646 1.00 0.00 H new ATOM 0 HB3 GLU A 8 7.933 -6.225 -3.687 1.00 0.00 H new ATOM 0 HG2 GLU A 8 5.284 -4.741 -3.447 1.00 0.00 H new ATOM 0 HG3 GLU A 8 6.707 -4.362 -2.497 1.00 0.00 H new ATOM 98 N GLY A 9 7.715 -8.632 -5.957 1.00 0.00 N ATOM 99 CA GLY A 9 8.514 -9.871 -6.164 1.00 0.00 C ATOM 100 C GLY A 9 8.629 -10.362 -7.623 1.00 0.00 C ATOM 101 O GLY A 9 8.247 -9.682 -8.577 1.00 0.00 O ATOM 0 H GLY A 9 7.790 -7.958 -6.719 1.00 0.00 H new ATOM 0 HA2 GLY A 9 9.519 -9.701 -5.778 1.00 0.00 H new ATOM 0 HA3 GLY A 9 8.073 -10.669 -5.566 1.00 0.00 H new ATOM 105 N ARG A 10 9.179 -11.576 -7.775 1.00 0.00 N ATOM 106 CA ARG A 10 9.313 -12.260 -9.092 1.00 0.00 C ATOM 107 C ARG A 10 8.058 -13.143 -9.392 1.00 0.00 C ATOM 108 O ARG A 10 7.732 -14.035 -8.606 1.00 0.00 O ATOM 109 CB ARG A 10 10.642 -13.067 -9.031 1.00 0.00 C ATOM 110 CG ARG A 10 11.013 -13.800 -10.343 1.00 0.00 C ATOM 111 CD ARG A 10 12.387 -14.502 -10.354 1.00 0.00 C ATOM 112 NE ARG A 10 13.504 -13.540 -10.581 1.00 0.00 N ATOM 113 CZ ARG A 10 14.137 -13.331 -11.741 1.00 0.00 C ATOM 114 NH1 ARG A 10 13.865 -13.928 -12.876 1.00 0.00 N ATOM 115 NH2 ARG A 10 15.097 -12.454 -11.777 1.00 0.00 N ATOM 0 H ARG A 10 9.547 -12.120 -6.995 1.00 0.00 H new ATOM 0 HA ARG A 10 9.357 -11.553 -9.920 1.00 0.00 H new ATOM 0 HB2 ARG A 10 11.453 -12.387 -8.769 1.00 0.00 H new ATOM 0 HB3 ARG A 10 10.569 -13.801 -8.228 1.00 0.00 H new ATOM 0 HG2 ARG A 10 10.244 -14.544 -10.551 1.00 0.00 H new ATOM 0 HG3 ARG A 10 10.988 -13.079 -11.160 1.00 0.00 H new ATOM 0 HD2 ARG A 10 12.539 -15.017 -9.405 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.399 -15.263 -11.135 1.00 0.00 H new ATOM 0 HE ARG A 10 13.814 -12.991 -9.779 1.00 0.00 H new ATOM 0 HH11 ARG A 10 13.115 -14.617 -12.923 1.00 0.00 H new ATOM 0 HH12 ARG A 10 14.404 -13.703 -13.712 1.00 0.00 H new ATOM 0 HH21 ARG A 10 15.353 -11.943 -10.932 1.00 0.00 H new ATOM 0 HH22 ARG A 10 15.594 -12.278 -12.650 1.00 0.00 H new ATOM 129 N TRP A 11 7.360 -12.905 -10.518 1.00 0.00 N ATOM 130 CA TRP A 11 6.059 -13.579 -10.810 1.00 0.00 C ATOM 131 C TRP A 11 6.118 -14.334 -12.177 1.00 0.00 C ATOM 132 O TRP A 11 6.155 -13.686 -13.225 1.00 0.00 O ATOM 133 CB TRP A 11 4.919 -12.518 -10.798 1.00 0.00 C ATOM 134 CG TRP A 11 4.653 -11.803 -9.470 1.00 0.00 C ATOM 135 CD1 TRP A 11 5.181 -10.555 -9.087 1.00 0.00 C ATOM 136 CD2 TRP A 11 3.833 -12.193 -8.430 1.00 0.00 C ATOM 137 NE1 TRP A 11 4.724 -10.166 -7.818 1.00 0.00 N ATOM 138 CE2 TRP A 11 3.886 -11.191 -7.433 1.00 0.00 C ATOM 139 CE3 TRP A 11 3.001 -13.327 -8.264 1.00 0.00 C ATOM 140 CZ2 TRP A 11 3.114 -11.316 -6.258 1.00 0.00 C ATOM 141 CZ3 TRP A 11 2.251 -13.434 -7.093 1.00 0.00 C ATOM 142 CH2 TRP A 11 2.313 -12.449 -6.101 1.00 0.00 C ATOM 0 H TRP A 11 7.664 -12.256 -11.244 1.00 0.00 H new ATOM 0 HA TRP A 11 5.857 -14.323 -10.040 1.00 0.00 H new ATOM 0 HB2 TRP A 11 5.150 -11.763 -11.550 1.00 0.00 H new ATOM 0 HB3 TRP A 11 3.997 -13.007 -11.111 1.00 0.00 H new ATOM 0 HD1 TRP A 11 5.855 -9.969 -9.695 1.00 0.00 H new ATOM 0 HE1 TRP A 11 4.958 -9.319 -7.300 1.00 0.00 H new ATOM 0 HE3 TRP A 11 2.949 -14.091 -9.026 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 3.142 -10.551 -5.496 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 1.611 -14.292 -6.949 1.00 0.00 H new ATOM 0 HH2 TRP A 11 1.731 -12.567 -5.199 1.00 0.00 H new ATOM 153 N ARG A 12 6.100 -15.683 -12.204 1.00 0.00 N ATOM 154 CA ARG A 12 6.181 -16.469 -13.466 1.00 0.00 C ATOM 155 C ARG A 12 4.785 -16.778 -14.094 1.00 0.00 C ATOM 156 O ARG A 12 3.914 -17.348 -13.430 1.00 0.00 O ATOM 157 CB ARG A 12 6.970 -17.770 -13.172 1.00 0.00 C ATOM 158 CG ARG A 12 7.257 -18.606 -14.445 1.00 0.00 C ATOM 159 CD ARG A 12 8.191 -19.823 -14.281 1.00 0.00 C ATOM 160 NE ARG A 12 9.524 -19.604 -13.645 1.00 0.00 N ATOM 161 CZ ARG A 12 10.409 -18.666 -13.984 1.00 0.00 C ATOM 162 NH1 ARG A 12 10.378 -17.989 -15.105 1.00 0.00 N ATOM 163 NH2 ARG A 12 11.345 -18.373 -13.134 1.00 0.00 N ATOM 0 H ARG A 12 6.030 -16.259 -11.365 1.00 0.00 H new ATOM 0 HA ARG A 12 6.698 -15.869 -14.214 1.00 0.00 H new ATOM 0 HB2 ARG A 12 7.914 -17.515 -12.691 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.406 -18.378 -12.464 1.00 0.00 H new ATOM 0 HG2 ARG A 12 6.305 -18.959 -14.841 1.00 0.00 H new ATOM 0 HG3 ARG A 12 7.689 -17.944 -15.196 1.00 0.00 H new ATOM 0 HD2 ARG A 12 7.661 -20.574 -13.695 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.359 -20.250 -15.270 1.00 0.00 H new ATOM 0 HE ARG A 12 9.781 -20.229 -12.881 1.00 0.00 H new ATOM 0 HH11 ARG A 12 9.641 -18.166 -15.787 1.00 0.00 H new ATOM 0 HH12 ARG A 12 11.091 -17.285 -15.295 1.00 0.00 H new ATOM 0 HH21 ARG A 12 11.388 -18.856 -12.237 1.00 0.00 H new ATOM 0 HH22 ARG A 12 12.037 -17.660 -13.363 1.00 0.00 H new ATOM 177 N LEU A 13 4.619 -16.512 -15.405 1.00 0.00 N ATOM 178 CA LEU A 13 3.385 -16.886 -16.161 1.00 0.00 C ATOM 179 C LEU A 13 3.161 -18.431 -16.276 1.00 0.00 C ATOM 180 O LEU A 13 4.050 -19.170 -16.714 1.00 0.00 O ATOM 181 CB LEU A 13 3.456 -16.230 -17.570 1.00 0.00 C ATOM 182 CG LEU A 13 2.216 -16.378 -18.497 1.00 0.00 C ATOM 183 CD1 LEU A 13 0.972 -15.704 -17.906 1.00 0.00 C ATOM 184 CD2 LEU A 13 2.494 -15.789 -19.891 1.00 0.00 C ATOM 0 H LEU A 13 5.321 -16.038 -15.973 1.00 0.00 H new ATOM 0 HA LEU A 13 2.526 -16.514 -15.603 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.650 -15.166 -17.436 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.317 -16.647 -18.092 1.00 0.00 H new ATOM 0 HG LEU A 13 2.022 -17.447 -18.585 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.131 -15.832 -18.587 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.734 -16.159 -16.945 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.166 -14.641 -17.766 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.610 -15.906 -20.518 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.735 -14.730 -19.797 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.334 -16.313 -20.346 1.00 0.00 H new ATOM 196 N VAL A 14 1.952 -18.886 -15.911 1.00 0.00 N ATOM 197 CA VAL A 14 1.563 -20.331 -15.958 1.00 0.00 C ATOM 198 C VAL A 14 0.316 -20.577 -16.874 1.00 0.00 C ATOM 199 O VAL A 14 0.457 -21.286 -17.875 1.00 0.00 O ATOM 200 CB VAL A 14 1.508 -20.991 -14.534 1.00 0.00 C ATOM 201 CG1 VAL A 14 2.925 -21.215 -13.960 1.00 0.00 C ATOM 202 CG2 VAL A 14 0.665 -20.257 -13.461 1.00 0.00 C ATOM 0 H VAL A 14 1.208 -18.275 -15.574 1.00 0.00 H new ATOM 0 HA VAL A 14 2.366 -20.876 -16.455 1.00 0.00 H new ATOM 0 HB VAL A 14 0.995 -21.932 -14.732 1.00 0.00 H new ATOM 0 HG11 VAL A 14 2.850 -21.673 -12.974 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.487 -21.872 -14.624 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.439 -20.258 -13.877 1.00 0.00 H new ATOM 0 HG21 VAL A 14 0.707 -20.811 -12.523 1.00 0.00 H new ATOM 0 HG22 VAL A 14 1.064 -19.254 -13.308 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -0.370 -20.188 -13.796 1.00 0.00 H new ATOM 212 N ASP A 15 -0.870 -20.000 -16.586 1.00 0.00 N ATOM 213 CA ASP A 15 -2.009 -19.970 -17.556 1.00 0.00 C ATOM 214 C ASP A 15 -2.051 -18.617 -18.348 1.00 0.00 C ATOM 215 O ASP A 15 -1.685 -17.548 -17.847 1.00 0.00 O ATOM 216 CB ASP A 15 -3.331 -20.286 -16.802 1.00 0.00 C ATOM 217 CG ASP A 15 -4.612 -20.320 -17.650 1.00 0.00 C ATOM 218 OD1 ASP A 15 -4.545 -20.667 -18.852 1.00 0.00 O ATOM 219 OD2 ASP A 15 -5.683 -19.949 -17.127 1.00 0.00 O ATOM 0 H ASP A 15 -1.073 -19.547 -15.695 1.00 0.00 H new ATOM 0 HA ASP A 15 -1.869 -20.741 -18.314 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -3.221 -21.253 -16.311 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -3.462 -19.542 -16.016 1.00 0.00 H new ATOM 224 N SER A 16 -2.547 -18.689 -19.596 1.00 0.00 N ATOM 225 CA SER A 16 -2.790 -17.486 -20.444 1.00 0.00 C ATOM 226 C SER A 16 -4.042 -17.657 -21.366 1.00 0.00 C ATOM 227 O SER A 16 -3.937 -17.665 -22.599 1.00 0.00 O ATOM 228 CB SER A 16 -1.475 -17.120 -21.187 1.00 0.00 C ATOM 229 OG SER A 16 -1.042 -18.155 -22.068 1.00 0.00 O ATOM 0 H SER A 16 -2.792 -19.569 -20.051 1.00 0.00 H new ATOM 0 HA SER A 16 -3.052 -16.633 -19.818 1.00 0.00 H new ATOM 0 HB2 SER A 16 -1.625 -16.202 -21.755 1.00 0.00 H new ATOM 0 HB3 SER A 16 -0.692 -16.918 -20.456 1.00 0.00 H new ATOM 0 HG SER A 16 -1.794 -18.448 -22.623 1.00 0.00 H new ATOM 235 N LYS A 17 -5.255 -17.753 -20.775 1.00 0.00 N ATOM 236 CA LYS A 17 -6.506 -18.025 -21.544 1.00 0.00 C ATOM 237 C LYS A 17 -6.907 -16.830 -22.472 1.00 0.00 C ATOM 238 O LYS A 17 -6.994 -15.685 -22.014 1.00 0.00 O ATOM 239 CB LYS A 17 -7.637 -18.511 -20.581 1.00 0.00 C ATOM 240 CG LYS A 17 -8.462 -17.446 -19.806 1.00 0.00 C ATOM 241 CD LYS A 17 -9.682 -16.895 -20.592 1.00 0.00 C ATOM 242 CE LYS A 17 -10.319 -15.662 -19.926 1.00 0.00 C ATOM 243 NZ LYS A 17 -11.258 -14.982 -20.861 1.00 0.00 N ATOM 0 H LYS A 17 -5.401 -17.647 -19.771 1.00 0.00 H new ATOM 0 HA LYS A 17 -6.322 -18.844 -22.239 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -8.335 -19.110 -21.166 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -7.183 -19.177 -19.847 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -8.813 -17.883 -18.871 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -7.807 -16.615 -19.543 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -9.368 -16.634 -21.603 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -10.433 -17.680 -20.684 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -10.852 -15.965 -19.024 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -9.539 -14.966 -19.617 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -12.086 -14.639 -20.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -10.777 -14.177 -21.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -11.567 -15.654 -21.592 1.00 0.00 H new ATOM 257 N GLY A 18 -7.125 -17.092 -23.773 1.00 0.00 N ATOM 258 CA GLY A 18 -7.340 -16.009 -24.782 1.00 0.00 C ATOM 259 C GLY A 18 -6.210 -14.974 -25.037 1.00 0.00 C ATOM 260 O GLY A 18 -6.491 -13.875 -25.519 1.00 0.00 O ATOM 0 H GLY A 18 -7.159 -18.035 -24.161 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -7.566 -16.488 -25.734 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.230 -15.455 -24.484 1.00 0.00 H new ATOM 264 N PHE A 19 -4.942 -15.306 -24.737 1.00 0.00 N ATOM 265 CA PHE A 19 -3.798 -14.374 -24.926 1.00 0.00 C ATOM 266 C PHE A 19 -3.352 -14.190 -26.413 1.00 0.00 C ATOM 267 O PHE A 19 -3.227 -13.044 -26.845 1.00 0.00 O ATOM 268 CB PHE A 19 -2.676 -14.782 -23.933 1.00 0.00 C ATOM 269 CG PHE A 19 -1.403 -13.910 -23.904 1.00 0.00 C ATOM 270 CD1 PHE A 19 -1.476 -12.511 -23.870 1.00 0.00 C ATOM 271 CD2 PHE A 19 -0.146 -14.527 -23.927 1.00 0.00 C ATOM 272 CE1 PHE A 19 -0.315 -11.745 -23.906 1.00 0.00 C ATOM 273 CE2 PHE A 19 1.015 -13.759 -23.943 1.00 0.00 C ATOM 274 CZ PHE A 19 0.929 -12.369 -23.940 1.00 0.00 C ATOM 0 H PHE A 19 -4.675 -16.216 -24.360 1.00 0.00 H new ATOM 0 HA PHE A 19 -4.112 -13.359 -24.683 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -3.101 -14.791 -22.929 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.378 -15.805 -24.163 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.439 -12.025 -23.816 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.077 -15.605 -23.932 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.379 -10.667 -23.908 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.982 -14.241 -23.958 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.830 -11.774 -23.964 1.00 0.00 H new ATOM 284 N ASP A 20 -3.187 -15.266 -27.208 1.00 0.00 N ATOM 285 CA ASP A 20 -3.120 -15.168 -28.698 1.00 0.00 C ATOM 286 C ASP A 20 -4.296 -14.378 -29.387 1.00 0.00 C ATOM 287 O ASP A 20 -4.026 -13.525 -30.237 1.00 0.00 O ATOM 288 CB ASP A 20 -2.933 -16.613 -29.230 1.00 0.00 C ATOM 289 CG ASP A 20 -2.704 -16.696 -30.734 1.00 0.00 C ATOM 290 OD1 ASP A 20 -1.740 -16.086 -31.236 1.00 0.00 O ATOM 291 OD2 ASP A 20 -3.513 -17.318 -31.450 1.00 0.00 O ATOM 0 H ASP A 20 -3.097 -16.218 -26.852 1.00 0.00 H new ATOM 0 HA ASP A 20 -2.272 -14.541 -28.972 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -2.086 -17.071 -28.718 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -3.815 -17.200 -28.974 1.00 0.00 H new ATOM 296 N GLU A 21 -5.564 -14.602 -28.981 1.00 0.00 N ATOM 297 CA GLU A 21 -6.717 -13.722 -29.346 1.00 0.00 C ATOM 298 C GLU A 21 -6.518 -12.197 -29.034 1.00 0.00 C ATOM 299 O GLU A 21 -6.744 -11.358 -29.909 1.00 0.00 O ATOM 300 CB GLU A 21 -8.021 -14.225 -28.663 1.00 0.00 C ATOM 301 CG GLU A 21 -8.503 -15.661 -28.980 1.00 0.00 C ATOM 302 CD GLU A 21 -9.751 -16.037 -28.197 1.00 0.00 C ATOM 303 OE1 GLU A 21 -10.863 -15.696 -28.651 1.00 0.00 O ATOM 304 OE2 GLU A 21 -9.623 -16.671 -27.129 1.00 0.00 O ATOM 0 H GLU A 21 -5.827 -15.393 -28.393 1.00 0.00 H new ATOM 0 HA GLU A 21 -6.790 -13.796 -30.431 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -7.883 -14.150 -27.584 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -8.824 -13.537 -28.930 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -8.707 -15.746 -30.047 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -7.706 -16.368 -28.751 1.00 0.00 H new ATOM 311 N TYR A 22 -6.070 -11.831 -27.818 1.00 0.00 N ATOM 312 CA TYR A 22 -5.600 -10.454 -27.505 1.00 0.00 C ATOM 313 C TYR A 22 -4.397 -9.943 -28.382 1.00 0.00 C ATOM 314 O TYR A 22 -4.484 -8.840 -28.931 1.00 0.00 O ATOM 315 CB TYR A 22 -5.372 -10.414 -25.963 1.00 0.00 C ATOM 316 CG TYR A 22 -4.749 -9.116 -25.432 1.00 0.00 C ATOM 317 CD1 TYR A 22 -5.520 -7.960 -25.272 1.00 0.00 C ATOM 318 CD2 TYR A 22 -3.366 -9.059 -25.224 1.00 0.00 C ATOM 319 CE1 TYR A 22 -4.905 -6.752 -24.948 1.00 0.00 C ATOM 320 CE2 TYR A 22 -2.759 -7.854 -24.888 1.00 0.00 C ATOM 321 CZ TYR A 22 -3.525 -6.701 -24.774 1.00 0.00 C ATOM 322 OH TYR A 22 -2.905 -5.503 -24.580 1.00 0.00 O ATOM 0 H TYR A 22 -6.021 -12.471 -27.025 1.00 0.00 H new ATOM 0 HA TYR A 22 -6.357 -9.722 -27.787 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -6.329 -10.570 -25.465 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -4.728 -11.248 -25.684 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -6.592 -8.003 -25.399 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -2.769 -9.953 -25.325 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -5.498 -5.857 -24.832 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -1.694 -7.815 -24.716 1.00 0.00 H new ATOM 0 HH TYR A 22 -1.941 -5.647 -24.475 1.00 0.00 H new ATOM 332 N MET A 23 -3.288 -10.702 -28.507 1.00 0.00 N ATOM 333 CA MET A 23 -2.099 -10.256 -29.291 1.00 0.00 C ATOM 334 C MET A 23 -2.330 -10.172 -30.840 1.00 0.00 C ATOM 335 O MET A 23 -1.933 -9.168 -31.439 1.00 0.00 O ATOM 336 CB MET A 23 -0.802 -11.035 -28.936 1.00 0.00 C ATOM 337 CG MET A 23 -0.416 -11.215 -27.456 1.00 0.00 C ATOM 338 SD MET A 23 1.134 -12.137 -27.332 1.00 0.00 S ATOM 339 CE MET A 23 0.571 -13.826 -27.636 1.00 0.00 C ATOM 0 H MET A 23 -3.184 -11.623 -28.081 1.00 0.00 H new ATOM 0 HA MET A 23 -1.948 -9.226 -28.968 1.00 0.00 H new ATOM 0 HB2 MET A 23 -0.885 -12.028 -29.377 1.00 0.00 H new ATOM 0 HB3 MET A 23 0.028 -10.534 -29.433 1.00 0.00 H new ATOM 0 HG2 MET A 23 -0.309 -10.241 -26.978 1.00 0.00 H new ATOM 0 HG3 MET A 23 -1.208 -11.745 -26.927 1.00 0.00 H new ATOM 0 HE1 MET A 23 1.379 -14.524 -27.417 1.00 0.00 H new ATOM 0 HE2 MET A 23 -0.282 -14.046 -26.995 1.00 0.00 H new ATOM 0 HE3 MET A 23 0.276 -13.929 -28.680 1.00 0.00 H new ATOM 349 N LYS A 24 -3.007 -11.137 -31.506 1.00 0.00 N ATOM 350 CA LYS A 24 -3.536 -10.926 -32.897 1.00 0.00 C ATOM 351 C LYS A 24 -4.362 -9.607 -33.134 1.00 0.00 C ATOM 352 O LYS A 24 -4.216 -8.978 -34.185 1.00 0.00 O ATOM 353 CB LYS A 24 -4.233 -12.223 -33.414 1.00 0.00 C ATOM 354 CG LYS A 24 -5.640 -12.610 -32.898 1.00 0.00 C ATOM 355 CD LYS A 24 -6.825 -11.943 -33.645 1.00 0.00 C ATOM 356 CE LYS A 24 -8.185 -12.125 -32.943 1.00 0.00 C ATOM 357 NZ LYS A 24 -9.216 -11.271 -33.593 1.00 0.00 N ATOM 0 H LYS A 24 -3.204 -12.060 -31.119 1.00 0.00 H new ATOM 0 HA LYS A 24 -2.663 -10.738 -33.522 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -4.297 -12.145 -34.499 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -3.567 -13.057 -33.194 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -5.750 -13.692 -32.968 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -5.706 -12.351 -31.841 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -6.621 -10.877 -33.752 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -6.888 -12.358 -34.651 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -8.488 -13.171 -32.987 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -8.097 -11.863 -31.889 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -10.021 -11.145 -32.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -8.805 -10.343 -33.819 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -9.543 -11.727 -34.468 1.00 0.00 H new ATOM 371 N GLU A 25 -5.173 -9.182 -32.145 1.00 0.00 N ATOM 372 CA GLU A 25 -5.870 -7.867 -32.146 1.00 0.00 C ATOM 373 C GLU A 25 -4.953 -6.602 -31.965 1.00 0.00 C ATOM 374 O GLU A 25 -5.159 -5.600 -32.654 1.00 0.00 O ATOM 375 CB GLU A 25 -7.020 -7.954 -31.093 1.00 0.00 C ATOM 376 CG GLU A 25 -8.372 -7.376 -31.578 1.00 0.00 C ATOM 377 CD GLU A 25 -9.163 -8.315 -32.488 1.00 0.00 C ATOM 378 OE1 GLU A 25 -8.672 -8.686 -33.576 1.00 0.00 O ATOM 379 OE2 GLU A 25 -10.262 -8.756 -32.101 1.00 0.00 O ATOM 0 H GLU A 25 -5.368 -9.741 -31.314 1.00 0.00 H new ATOM 0 HA GLU A 25 -6.269 -7.696 -33.146 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -7.163 -8.998 -30.814 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -6.713 -7.423 -30.192 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -8.982 -7.131 -30.709 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -8.186 -6.443 -32.110 1.00 0.00 H new ATOM 386 N LEU A 26 -3.917 -6.647 -31.096 1.00 0.00 N ATOM 387 CA LEU A 26 -2.774 -5.670 -31.122 1.00 0.00 C ATOM 388 C LEU A 26 -2.054 -5.447 -32.501 1.00 0.00 C ATOM 389 O LEU A 26 -1.716 -4.308 -32.836 1.00 0.00 O ATOM 390 CB LEU A 26 -1.662 -6.082 -30.104 1.00 0.00 C ATOM 391 CG LEU A 26 -1.946 -6.045 -28.587 1.00 0.00 C ATOM 392 CD1 LEU A 26 -0.735 -6.635 -27.840 1.00 0.00 C ATOM 393 CD2 LEU A 26 -2.195 -4.608 -28.105 1.00 0.00 C ATOM 0 H LEU A 26 -3.838 -7.349 -30.360 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.271 -4.734 -30.869 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -1.358 -7.099 -30.351 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -0.801 -5.439 -30.288 1.00 0.00 H new ATOM 0 HG LEU A 26 -2.842 -6.631 -28.383 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -0.924 -6.614 -26.767 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -0.576 -7.665 -28.161 1.00 0.00 H new ATOM 0 HD13 LEU A 26 0.153 -6.044 -28.063 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -2.392 -4.613 -27.033 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.315 -3.998 -28.309 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.055 -4.192 -28.630 1.00 0.00 H new ATOM 405 N GLY A 27 -1.751 -6.536 -33.230 1.00 0.00 N ATOM 406 CA GLY A 27 -0.930 -6.494 -34.470 1.00 0.00 C ATOM 407 C GLY A 27 0.510 -7.046 -34.380 1.00 0.00 C ATOM 408 O GLY A 27 1.434 -6.432 -34.913 1.00 0.00 O ATOM 0 H GLY A 27 -2.065 -7.474 -32.982 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -1.458 -7.051 -35.244 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -0.875 -5.458 -34.804 1.00 0.00 H new ATOM 412 N VAL A 28 0.679 -8.229 -33.778 1.00 0.00 N ATOM 413 CA VAL A 28 1.927 -9.038 -33.843 1.00 0.00 C ATOM 414 C VAL A 28 1.868 -10.052 -35.038 1.00 0.00 C ATOM 415 O VAL A 28 0.838 -10.689 -35.295 1.00 0.00 O ATOM 416 CB VAL A 28 2.161 -9.824 -32.503 1.00 0.00 C ATOM 417 CG1 VAL A 28 2.777 -8.989 -31.365 1.00 0.00 C ATOM 418 CG2 VAL A 28 0.950 -10.561 -31.914 1.00 0.00 C ATOM 0 H VAL A 28 -0.053 -8.669 -33.220 1.00 0.00 H new ATOM 0 HA VAL A 28 2.757 -8.349 -33.997 1.00 0.00 H new ATOM 0 HB VAL A 28 2.873 -10.568 -32.860 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.902 -9.615 -30.481 1.00 0.00 H new ATOM 0 HG12 VAL A 28 3.748 -8.607 -31.679 1.00 0.00 H new ATOM 0 HG13 VAL A 28 2.118 -8.154 -31.128 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.243 -11.063 -30.992 1.00 0.00 H new ATOM 0 HG22 VAL A 28 0.156 -9.845 -31.701 1.00 0.00 H new ATOM 0 HG23 VAL A 28 0.590 -11.300 -32.630 1.00 0.00 H new ATOM 428 N GLY A 29 3.013 -10.278 -35.708 1.00 0.00 N ATOM 429 CA GLY A 29 3.140 -11.374 -36.710 1.00 0.00 C ATOM 430 C GLY A 29 3.175 -12.824 -36.154 1.00 0.00 C ATOM 431 O GLY A 29 3.223 -13.062 -34.943 1.00 0.00 O ATOM 0 H GLY A 29 3.862 -9.726 -35.582 1.00 0.00 H new ATOM 0 HA2 GLY A 29 2.306 -11.297 -37.407 1.00 0.00 H new ATOM 0 HA3 GLY A 29 4.052 -11.207 -37.284 1.00 0.00 H new ATOM 435 N ILE A 30 3.174 -13.807 -37.069 1.00 0.00 N ATOM 436 CA ILE A 30 3.148 -15.271 -36.716 1.00 0.00 C ATOM 437 C ILE A 30 4.283 -15.797 -35.769 1.00 0.00 C ATOM 438 O ILE A 30 3.996 -16.507 -34.801 1.00 0.00 O ATOM 439 CB ILE A 30 2.942 -16.181 -37.983 1.00 0.00 C ATOM 440 CG1 ILE A 30 3.997 -16.055 -39.131 1.00 0.00 C ATOM 441 CG2 ILE A 30 1.511 -16.041 -38.563 1.00 0.00 C ATOM 442 CD1 ILE A 30 5.131 -17.094 -39.087 1.00 0.00 C ATOM 0 H ILE A 30 3.191 -13.631 -38.074 1.00 0.00 H new ATOM 0 HA ILE A 30 2.264 -15.356 -36.084 1.00 0.00 H new ATOM 0 HB ILE A 30 3.099 -17.181 -37.579 1.00 0.00 H new ATOM 0 HG12 ILE A 30 3.483 -16.141 -40.088 1.00 0.00 H new ATOM 0 HG13 ILE A 30 4.436 -15.058 -39.093 1.00 0.00 H new ATOM 0 HG21 ILE A 30 1.408 -16.685 -39.437 1.00 0.00 H new ATOM 0 HG22 ILE A 30 0.782 -16.335 -37.808 1.00 0.00 H new ATOM 0 HG23 ILE A 30 1.336 -15.005 -38.853 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.811 -16.926 -39.922 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.677 -16.997 -38.149 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.709 -18.096 -39.159 1.00 0.00 H new ATOM 454 N ALA A 31 5.545 -15.409 -36.012 1.00 0.00 N ATOM 455 CA ALA A 31 6.667 -15.614 -35.055 1.00 0.00 C ATOM 456 C ALA A 31 6.492 -14.986 -33.628 1.00 0.00 C ATOM 457 O ALA A 31 6.720 -15.681 -32.637 1.00 0.00 O ATOM 458 CB ALA A 31 7.946 -15.123 -35.763 1.00 0.00 C ATOM 0 H ALA A 31 5.826 -14.943 -36.875 1.00 0.00 H new ATOM 0 HA ALA A 31 6.711 -16.677 -34.816 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.801 -15.252 -35.100 1.00 0.00 H new ATOM 0 HB2 ALA A 31 8.102 -15.701 -36.674 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.840 -14.068 -36.016 1.00 0.00 H new ATOM 464 N LEU A 32 6.052 -13.718 -33.525 1.00 0.00 N ATOM 465 CA LEU A 32 5.672 -13.069 -32.232 1.00 0.00 C ATOM 466 C LEU A 32 4.428 -13.683 -31.498 1.00 0.00 C ATOM 467 O LEU A 32 4.510 -13.903 -30.286 1.00 0.00 O ATOM 468 CB LEU A 32 5.521 -11.542 -32.492 1.00 0.00 C ATOM 469 CG LEU A 32 6.843 -10.739 -32.645 1.00 0.00 C ATOM 470 CD1 LEU A 32 6.624 -9.461 -33.473 1.00 0.00 C ATOM 471 CD2 LEU A 32 7.446 -10.372 -31.276 1.00 0.00 C ATOM 0 H LEU A 32 5.946 -13.103 -34.332 1.00 0.00 H new ATOM 0 HA LEU A 32 6.474 -13.266 -31.521 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.930 -11.405 -33.398 1.00 0.00 H new ATOM 0 HB3 LEU A 32 4.950 -11.109 -31.671 1.00 0.00 H new ATOM 0 HG LEU A 32 7.546 -11.385 -33.170 1.00 0.00 H new ATOM 0 HD11 LEU A 32 7.566 -8.920 -33.563 1.00 0.00 H new ATOM 0 HD12 LEU A 32 6.263 -9.728 -34.466 1.00 0.00 H new ATOM 0 HD13 LEU A 32 5.888 -8.828 -32.977 1.00 0.00 H new ATOM 0 HD21 LEU A 32 8.369 -9.811 -31.424 1.00 0.00 H new ATOM 0 HD22 LEU A 32 6.736 -9.762 -30.718 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.660 -11.283 -30.717 1.00 0.00 H new ATOM 483 N ARG A 33 3.321 -14.017 -32.199 1.00 0.00 N ATOM 484 CA ARG A 33 2.236 -14.899 -31.655 1.00 0.00 C ATOM 485 C ARG A 33 2.727 -16.274 -31.079 1.00 0.00 C ATOM 486 O ARG A 33 2.470 -16.578 -29.911 1.00 0.00 O ATOM 487 CB ARG A 33 1.145 -15.119 -32.747 1.00 0.00 C ATOM 488 CG ARG A 33 0.240 -13.901 -33.056 1.00 0.00 C ATOM 489 CD ARG A 33 -0.832 -14.129 -34.142 1.00 0.00 C ATOM 490 NE ARG A 33 -1.869 -15.113 -33.707 1.00 0.00 N ATOM 491 CZ ARG A 33 -2.815 -15.639 -34.481 1.00 0.00 C ATOM 492 NH1 ARG A 33 -2.967 -15.328 -35.743 1.00 0.00 N ATOM 493 NH2 ARG A 33 -3.637 -16.502 -33.961 1.00 0.00 N ATOM 0 H ARG A 33 3.145 -13.692 -33.150 1.00 0.00 H new ATOM 0 HA ARG A 33 1.821 -14.370 -30.797 1.00 0.00 H new ATOM 0 HB2 ARG A 33 1.639 -15.423 -33.670 1.00 0.00 H new ATOM 0 HB3 ARG A 33 0.510 -15.949 -32.437 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -0.259 -13.598 -32.135 1.00 0.00 H new ATOM 0 HG3 ARG A 33 0.873 -13.069 -33.364 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -1.311 -13.180 -34.383 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.354 -14.486 -35.054 1.00 0.00 H new ATOM 0 HE ARG A 33 -1.850 -15.407 -32.731 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -2.342 -14.651 -36.180 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -3.710 -15.763 -36.289 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -3.549 -16.763 -32.979 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -4.370 -16.918 -34.535 1.00 0.00 H new ATOM 507 N LYS A 34 3.466 -17.069 -31.877 1.00 0.00 N ATOM 508 CA LYS A 34 4.092 -18.343 -31.430 1.00 0.00 C ATOM 509 C LYS A 34 5.111 -18.212 -30.242 1.00 0.00 C ATOM 510 O LYS A 34 4.949 -18.907 -29.236 1.00 0.00 O ATOM 511 CB LYS A 34 4.653 -18.986 -32.725 1.00 0.00 C ATOM 512 CG LYS A 34 5.225 -20.411 -32.562 1.00 0.00 C ATOM 513 CD LYS A 34 5.544 -21.125 -33.896 1.00 0.00 C ATOM 514 CE LYS A 34 6.670 -20.527 -34.769 1.00 0.00 C ATOM 515 NZ LYS A 34 8.002 -20.668 -34.115 1.00 0.00 N ATOM 0 H LYS A 34 3.650 -16.850 -32.856 1.00 0.00 H new ATOM 0 HA LYS A 34 3.358 -18.996 -30.958 1.00 0.00 H new ATOM 0 HB2 LYS A 34 3.858 -19.015 -33.470 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.437 -18.341 -33.121 1.00 0.00 H new ATOM 0 HG2 LYS A 34 6.135 -20.358 -31.965 1.00 0.00 H new ATOM 0 HG3 LYS A 34 4.511 -21.015 -32.002 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.805 -22.159 -33.671 1.00 0.00 H new ATOM 0 HD3 LYS A 34 4.632 -21.149 -34.492 1.00 0.00 H new ATOM 0 HE2 LYS A 34 6.685 -21.026 -35.738 1.00 0.00 H new ATOM 0 HE3 LYS A 34 6.465 -19.473 -34.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.735 -20.256 -34.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 7.995 -20.171 -33.202 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 8.207 -21.676 -33.959 1.00 0.00 H new ATOM 529 N MET A 35 6.116 -17.318 -30.339 1.00 0.00 N ATOM 530 CA MET A 35 7.044 -16.980 -29.217 1.00 0.00 C ATOM 531 C MET A 35 6.364 -16.480 -27.894 1.00 0.00 C ATOM 532 O MET A 35 6.669 -17.017 -26.827 1.00 0.00 O ATOM 533 CB MET A 35 8.076 -15.970 -29.794 1.00 0.00 C ATOM 534 CG MET A 35 9.290 -15.676 -28.895 1.00 0.00 C ATOM 535 SD MET A 35 10.537 -14.684 -29.750 1.00 0.00 S ATOM 536 CE MET A 35 9.690 -13.107 -29.964 1.00 0.00 C ATOM 0 H MET A 35 6.316 -16.803 -31.197 1.00 0.00 H new ATOM 0 HA MET A 35 7.526 -17.895 -28.873 1.00 0.00 H new ATOM 0 HB2 MET A 35 8.437 -16.352 -30.749 1.00 0.00 H new ATOM 0 HB3 MET A 35 7.563 -15.031 -30.000 1.00 0.00 H new ATOM 0 HG2 MET A 35 8.960 -15.150 -27.999 1.00 0.00 H new ATOM 0 HG3 MET A 35 9.735 -16.615 -28.567 1.00 0.00 H new ATOM 0 HE1 MET A 35 10.423 -12.324 -30.158 1.00 0.00 H new ATOM 0 HE2 MET A 35 9.001 -13.175 -30.806 1.00 0.00 H new ATOM 0 HE3 MET A 35 9.133 -12.867 -29.058 1.00 0.00 H new ATOM 546 N GLY A 36 5.443 -15.496 -27.959 1.00 0.00 N ATOM 547 CA GLY A 36 4.623 -15.074 -26.788 1.00 0.00 C ATOM 548 C GLY A 36 3.698 -16.125 -26.124 1.00 0.00 C ATOM 549 O GLY A 36 3.677 -16.211 -24.895 1.00 0.00 O ATOM 0 H GLY A 36 5.243 -14.972 -28.811 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.303 -14.699 -26.023 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.002 -14.235 -27.102 1.00 0.00 H new ATOM 553 N ALA A 37 2.952 -16.914 -26.916 1.00 0.00 N ATOM 554 CA ALA A 37 2.102 -18.019 -26.394 1.00 0.00 C ATOM 555 C ALA A 37 2.836 -19.209 -25.684 1.00 0.00 C ATOM 556 O ALA A 37 2.368 -19.644 -24.629 1.00 0.00 O ATOM 557 CB ALA A 37 1.221 -18.484 -27.570 1.00 0.00 C ATOM 0 H ALA A 37 2.915 -16.812 -27.930 1.00 0.00 H new ATOM 0 HA ALA A 37 1.516 -17.620 -25.566 1.00 0.00 H new ATOM 0 HB1 ALA A 37 0.575 -19.298 -27.241 1.00 0.00 H new ATOM 0 HB2 ALA A 37 0.609 -17.652 -27.917 1.00 0.00 H new ATOM 0 HB3 ALA A 37 1.856 -18.832 -28.385 1.00 0.00 H new ATOM 563 N MET A 38 3.967 -19.728 -26.213 1.00 0.00 N ATOM 564 CA MET A 38 4.786 -20.762 -25.498 1.00 0.00 C ATOM 565 C MET A 38 5.713 -20.289 -24.319 1.00 0.00 C ATOM 566 O MET A 38 6.163 -21.135 -23.537 1.00 0.00 O ATOM 567 CB MET A 38 5.542 -21.639 -26.535 1.00 0.00 C ATOM 568 CG MET A 38 6.792 -21.031 -27.214 1.00 0.00 C ATOM 569 SD MET A 38 7.611 -22.235 -28.286 1.00 0.00 S ATOM 570 CE MET A 38 6.425 -22.385 -29.635 1.00 0.00 C ATOM 0 H MET A 38 4.340 -19.458 -27.123 1.00 0.00 H new ATOM 0 HA MET A 38 4.051 -21.353 -24.951 1.00 0.00 H new ATOM 0 HB2 MET A 38 5.845 -22.561 -26.038 1.00 0.00 H new ATOM 0 HB3 MET A 38 4.836 -21.916 -27.318 1.00 0.00 H new ATOM 0 HG2 MET A 38 6.502 -20.158 -27.799 1.00 0.00 H new ATOM 0 HG3 MET A 38 7.490 -20.686 -26.452 1.00 0.00 H new ATOM 0 HE1 MET A 38 6.924 -22.794 -30.514 1.00 0.00 H new ATOM 0 HE2 MET A 38 5.615 -23.050 -29.335 1.00 0.00 H new ATOM 0 HE3 MET A 38 6.018 -21.402 -29.873 1.00 0.00 H new ATOM 580 N ALA A 39 6.020 -18.983 -24.190 1.00 0.00 N ATOM 581 CA ALA A 39 6.902 -18.446 -23.126 1.00 0.00 C ATOM 582 C ALA A 39 6.272 -18.411 -21.696 1.00 0.00 C ATOM 583 O ALA A 39 5.084 -18.132 -21.514 1.00 0.00 O ATOM 584 CB ALA A 39 7.300 -17.027 -23.580 1.00 0.00 C ATOM 0 H ALA A 39 5.664 -18.266 -24.821 1.00 0.00 H new ATOM 0 HA ALA A 39 7.755 -19.115 -23.014 1.00 0.00 H new ATOM 0 HB1 ALA A 39 7.954 -16.576 -22.833 1.00 0.00 H new ATOM 0 HB2 ALA A 39 7.824 -17.084 -24.534 1.00 0.00 H new ATOM 0 HB3 ALA A 39 6.404 -16.417 -23.694 1.00 0.00 H new ATOM 590 N LYS A 40 7.113 -18.642 -20.673 1.00 0.00 N ATOM 591 CA LYS A 40 6.729 -18.460 -19.241 1.00 0.00 C ATOM 592 C LYS A 40 7.592 -17.321 -18.575 1.00 0.00 C ATOM 593 O LYS A 40 8.470 -17.642 -17.763 1.00 0.00 O ATOM 594 CB LYS A 40 6.697 -19.829 -18.491 1.00 0.00 C ATOM 595 CG LYS A 40 7.914 -20.797 -18.604 1.00 0.00 C ATOM 596 CD LYS A 40 7.618 -22.148 -19.306 1.00 0.00 C ATOM 597 CE LYS A 40 7.270 -22.011 -20.801 1.00 0.00 C ATOM 598 NZ LYS A 40 6.952 -23.320 -21.426 1.00 0.00 N ATOM 0 H LYS A 40 8.074 -18.958 -20.802 1.00 0.00 H new ATOM 0 HA LYS A 40 5.703 -18.099 -19.168 1.00 0.00 H new ATOM 0 HB2 LYS A 40 6.545 -19.618 -17.432 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.816 -20.370 -18.837 1.00 0.00 H new ATOM 0 HG2 LYS A 40 8.712 -20.290 -19.147 1.00 0.00 H new ATOM 0 HG3 LYS A 40 8.290 -21.001 -17.602 1.00 0.00 H new ATOM 0 HD2 LYS A 40 8.487 -22.798 -19.203 1.00 0.00 H new ATOM 0 HD3 LYS A 40 6.791 -22.639 -18.794 1.00 0.00 H new ATOM 0 HE2 LYS A 40 6.418 -21.340 -20.914 1.00 0.00 H new ATOM 0 HE3 LYS A 40 8.108 -21.553 -21.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 6.578 -23.166 -22.384 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 7.815 -23.898 -21.480 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 6.240 -23.815 -20.852 1.00 0.00 H new ATOM 612 N PRO A 41 7.385 -15.993 -18.866 1.00 0.00 N ATOM 613 CA PRO A 41 8.232 -14.899 -18.319 1.00 0.00 C ATOM 614 C PRO A 41 8.077 -14.612 -16.797 1.00 0.00 C ATOM 615 O PRO A 41 6.976 -14.674 -16.238 1.00 0.00 O ATOM 616 CB PRO A 41 7.783 -13.677 -19.156 1.00 0.00 C ATOM 617 CG PRO A 41 6.360 -13.999 -19.608 1.00 0.00 C ATOM 618 CD PRO A 41 6.432 -15.496 -19.883 1.00 0.00 C ATOM 0 HA PRO A 41 9.287 -15.162 -18.395 1.00 0.00 H new ATOM 0 HB2 PRO A 41 7.810 -12.763 -18.563 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.442 -13.522 -20.011 1.00 0.00 H new ATOM 0 HG2 PRO A 41 5.626 -13.763 -18.837 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.080 -13.436 -20.498 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.455 -15.969 -19.782 1.00 0.00 H new ATOM 0 HD3 PRO A 41 6.782 -15.701 -20.895 1.00 0.00 H new ATOM 626 N ASP A 42 9.196 -14.206 -16.179 1.00 0.00 N ATOM 627 CA ASP A 42 9.192 -13.589 -14.828 1.00 0.00 C ATOM 628 C ASP A 42 8.871 -12.063 -14.908 1.00 0.00 C ATOM 629 O ASP A 42 9.749 -11.242 -15.189 1.00 0.00 O ATOM 630 CB ASP A 42 10.573 -13.826 -14.164 1.00 0.00 C ATOM 631 CG ASP A 42 10.783 -15.179 -13.510 1.00 0.00 C ATOM 632 OD1 ASP A 42 9.879 -15.679 -12.815 1.00 0.00 O ATOM 633 OD2 ASP A 42 11.887 -15.754 -13.653 1.00 0.00 O ATOM 0 H ASP A 42 10.126 -14.291 -16.590 1.00 0.00 H new ATOM 0 HA ASP A 42 8.412 -14.053 -14.224 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.345 -13.689 -14.922 1.00 0.00 H new ATOM 0 HB3 ASP A 42 10.727 -13.054 -13.410 1.00 0.00 H new ATOM 638 N CYS A 43 7.618 -11.683 -14.613 1.00 0.00 N ATOM 639 CA CYS A 43 7.233 -10.268 -14.387 1.00 0.00 C ATOM 640 C CYS A 43 7.635 -9.814 -12.949 1.00 0.00 C ATOM 641 O CYS A 43 6.989 -10.154 -11.955 1.00 0.00 O ATOM 642 CB CYS A 43 5.719 -10.163 -14.661 1.00 0.00 C ATOM 643 SG CYS A 43 5.132 -8.447 -14.456 1.00 0.00 S ATOM 0 H CYS A 43 6.842 -12.339 -14.523 1.00 0.00 H new ATOM 0 HA CYS A 43 7.761 -9.592 -15.059 1.00 0.00 H new ATOM 0 HB2 CYS A 43 5.505 -10.505 -15.673 1.00 0.00 H new ATOM 0 HB3 CYS A 43 5.177 -10.820 -13.981 1.00 0.00 H new ATOM 0 HG CYS A 43 4.003 -8.297 -15.083 1.00 0.00 H new ATOM 649 N ILE A 44 8.741 -9.068 -12.851 1.00 0.00 N ATOM 650 CA ILE A 44 9.369 -8.701 -11.548 1.00 0.00 C ATOM 651 C ILE A 44 8.853 -7.284 -11.160 1.00 0.00 C ATOM 652 O ILE A 44 9.268 -6.287 -11.758 1.00 0.00 O ATOM 653 CB ILE A 44 10.933 -8.799 -11.633 1.00 0.00 C ATOM 654 CG1 ILE A 44 11.469 -10.198 -12.067 1.00 0.00 C ATOM 655 CG2 ILE A 44 11.639 -8.394 -10.311 1.00 0.00 C ATOM 656 CD1 ILE A 44 12.714 -10.115 -12.958 1.00 0.00 C ATOM 0 H ILE A 44 9.235 -8.696 -13.662 1.00 0.00 H new ATOM 0 HA ILE A 44 9.085 -9.399 -10.761 1.00 0.00 H new ATOM 0 HB ILE A 44 11.180 -8.083 -12.416 1.00 0.00 H new ATOM 0 HG12 ILE A 44 11.704 -10.782 -11.177 1.00 0.00 H new ATOM 0 HG13 ILE A 44 10.683 -10.732 -12.600 1.00 0.00 H new ATOM 0 HG21 ILE A 44 12.719 -8.483 -10.433 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.385 -7.363 -10.064 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.310 -9.052 -9.506 1.00 0.00 H new ATOM 0 HD11 ILE A 44 13.038 -11.121 -13.226 1.00 0.00 H new ATOM 0 HD12 ILE A 44 12.477 -9.557 -13.864 1.00 0.00 H new ATOM 0 HD13 ILE A 44 13.514 -9.608 -12.419 1.00 0.00 H new ATOM 668 N ILE A 45 7.952 -7.211 -10.167 1.00 0.00 N ATOM 669 CA ILE A 45 7.343 -5.926 -9.708 1.00 0.00 C ATOM 670 C ILE A 45 8.195 -5.378 -8.515 1.00 0.00 C ATOM 671 O ILE A 45 8.468 -6.084 -7.535 1.00 0.00 O ATOM 672 CB ILE A 45 5.823 -6.108 -9.338 1.00 0.00 C ATOM 673 CG1 ILE A 45 4.959 -6.692 -10.499 1.00 0.00 C ATOM 674 CG2 ILE A 45 5.174 -4.784 -8.843 1.00 0.00 C ATOM 675 CD1 ILE A 45 3.539 -7.142 -10.118 1.00 0.00 C ATOM 0 H ILE A 45 7.619 -8.028 -9.655 1.00 0.00 H new ATOM 0 HA ILE A 45 7.358 -5.194 -10.516 1.00 0.00 H new ATOM 0 HB ILE A 45 5.830 -6.836 -8.527 1.00 0.00 H new ATOM 0 HG12 ILE A 45 4.883 -5.939 -11.283 1.00 0.00 H new ATOM 0 HG13 ILE A 45 5.487 -7.545 -10.926 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.126 -4.961 -8.600 1.00 0.00 H new ATOM 0 HG22 ILE A 45 5.698 -4.432 -7.954 1.00 0.00 H new ATOM 0 HG23 ILE A 45 5.243 -4.030 -9.627 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.031 -7.530 -11.001 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.596 -7.923 -9.360 1.00 0.00 H new ATOM 0 HD13 ILE A 45 2.982 -6.293 -9.723 1.00 0.00 H new ATOM 687 N THR A 46 8.611 -4.105 -8.597 1.00 0.00 N ATOM 688 CA THR A 46 9.257 -3.392 -7.457 1.00 0.00 C ATOM 689 C THR A 46 8.851 -1.886 -7.510 1.00 0.00 C ATOM 690 O THR A 46 9.227 -1.161 -8.433 1.00 0.00 O ATOM 691 CB THR A 46 10.792 -3.664 -7.458 1.00 0.00 C ATOM 692 OG1 THR A 46 11.020 -5.066 -7.314 1.00 0.00 O ATOM 693 CG2 THR A 46 11.556 -2.987 -6.313 1.00 0.00 C ATOM 0 H THR A 46 8.516 -3.537 -9.439 1.00 0.00 H new ATOM 0 HA THR A 46 8.906 -3.768 -6.496 1.00 0.00 H new ATOM 0 HB THR A 46 11.156 -3.257 -8.401 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.161 -5.530 -7.231 1.00 0.00 H new ATOM 0 HG21 THR A 46 12.616 -3.229 -6.390 1.00 0.00 H new ATOM 0 HG22 THR A 46 11.425 -1.907 -6.377 1.00 0.00 H new ATOM 0 HG23 THR A 46 11.171 -3.344 -5.358 1.00 0.00 H new ATOM 701 N CYS A 47 8.074 -1.412 -6.524 1.00 0.00 N ATOM 702 CA CYS A 47 7.636 0.003 -6.435 1.00 0.00 C ATOM 703 C CYS A 47 8.634 0.846 -5.584 1.00 0.00 C ATOM 704 O CYS A 47 8.554 0.904 -4.351 1.00 0.00 O ATOM 705 CB CYS A 47 6.189 -0.016 -5.898 1.00 0.00 C ATOM 706 SG CYS A 47 5.479 1.666 -5.912 1.00 0.00 S ATOM 0 H CYS A 47 7.727 -1.994 -5.761 1.00 0.00 H new ATOM 0 HA CYS A 47 7.639 0.498 -7.406 1.00 0.00 H new ATOM 0 HB2 CYS A 47 5.577 -0.680 -6.508 1.00 0.00 H new ATOM 0 HB3 CYS A 47 6.177 -0.414 -4.883 1.00 0.00 H new ATOM 0 HG CYS A 47 6.271 2.477 -5.276 1.00 0.00 H new ATOM 712 N ASP A 48 9.578 1.523 -6.260 1.00 0.00 N ATOM 713 CA ASP A 48 10.716 2.223 -5.602 1.00 0.00 C ATOM 714 C ASP A 48 10.279 3.671 -5.164 1.00 0.00 C ATOM 715 O ASP A 48 10.551 4.678 -5.834 1.00 0.00 O ATOM 716 CB ASP A 48 11.958 2.194 -6.547 1.00 0.00 C ATOM 717 CG ASP A 48 12.387 0.854 -7.166 1.00 0.00 C ATOM 718 OD1 ASP A 48 13.129 0.104 -6.500 1.00 0.00 O ATOM 719 OD2 ASP A 48 11.994 0.558 -8.323 1.00 0.00 O ATOM 0 H ASP A 48 9.582 1.606 -7.277 1.00 0.00 H new ATOM 0 HA ASP A 48 11.009 1.710 -4.686 1.00 0.00 H new ATOM 0 HB2 ASP A 48 11.767 2.889 -7.365 1.00 0.00 H new ATOM 0 HB3 ASP A 48 12.807 2.586 -5.988 1.00 0.00 H new ATOM 724 N GLY A 49 9.514 3.756 -4.055 1.00 0.00 N ATOM 725 CA GLY A 49 8.800 5.002 -3.651 1.00 0.00 C ATOM 726 C GLY A 49 7.509 5.267 -4.460 1.00 0.00 C ATOM 727 O GLY A 49 6.482 4.629 -4.223 1.00 0.00 O ATOM 0 H GLY A 49 9.370 2.975 -3.415 1.00 0.00 H new ATOM 0 HA2 GLY A 49 8.549 4.939 -2.592 1.00 0.00 H new ATOM 0 HA3 GLY A 49 9.473 5.851 -3.769 1.00 0.00 H new ATOM 731 N LYS A 50 7.582 6.174 -5.446 1.00 0.00 N ATOM 732 CA LYS A 50 6.637 6.162 -6.607 1.00 0.00 C ATOM 733 C LYS A 50 7.152 5.411 -7.888 1.00 0.00 C ATOM 734 O LYS A 50 6.353 5.228 -8.809 1.00 0.00 O ATOM 735 CB LYS A 50 6.243 7.617 -6.999 1.00 0.00 C ATOM 736 CG LYS A 50 5.210 8.335 -6.095 1.00 0.00 C ATOM 737 CD LYS A 50 4.664 9.644 -6.725 1.00 0.00 C ATOM 738 CE LYS A 50 3.581 9.397 -7.800 1.00 0.00 C ATOM 739 NZ LYS A 50 3.278 10.616 -8.597 1.00 0.00 N ATOM 0 H LYS A 50 8.273 6.924 -5.476 1.00 0.00 H new ATOM 0 HA LYS A 50 5.776 5.596 -6.252 1.00 0.00 H new ATOM 0 HB2 LYS A 50 7.151 8.220 -7.020 1.00 0.00 H new ATOM 0 HB3 LYS A 50 5.849 7.599 -8.015 1.00 0.00 H new ATOM 0 HG2 LYS A 50 4.378 7.660 -5.895 1.00 0.00 H new ATOM 0 HG3 LYS A 50 5.672 8.565 -5.135 1.00 0.00 H new ATOM 0 HD2 LYS A 50 4.248 10.273 -5.938 1.00 0.00 H new ATOM 0 HD3 LYS A 50 5.490 10.197 -7.171 1.00 0.00 H new ATOM 0 HE2 LYS A 50 3.913 8.603 -8.469 1.00 0.00 H new ATOM 0 HE3 LYS A 50 2.669 9.047 -7.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 2.597 10.380 -9.346 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 2.871 11.345 -7.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 4.154 10.977 -9.026 1.00 0.00 H new ATOM 753 N ASN A 51 8.436 5.027 -8.023 1.00 0.00 N ATOM 754 CA ASN A 51 9.005 4.557 -9.318 1.00 0.00 C ATOM 755 C ASN A 51 8.718 3.039 -9.523 1.00 0.00 C ATOM 756 O ASN A 51 9.428 2.169 -9.018 1.00 0.00 O ATOM 757 CB ASN A 51 10.518 4.894 -9.389 1.00 0.00 C ATOM 758 CG ASN A 51 10.896 6.376 -9.286 1.00 0.00 C ATOM 759 OD1 ASN A 51 10.766 7.150 -10.227 1.00 0.00 O ATOM 760 ND2 ASN A 51 11.363 6.816 -8.140 1.00 0.00 N ATOM 0 H ASN A 51 9.106 5.030 -7.254 1.00 0.00 H new ATOM 0 HA ASN A 51 8.519 5.082 -10.140 1.00 0.00 H new ATOM 0 HB2 ASN A 51 11.025 4.357 -8.588 1.00 0.00 H new ATOM 0 HB3 ASN A 51 10.910 4.507 -10.330 1.00 0.00 H new ATOM 0 HD21 ASN A 51 11.616 7.799 -8.036 1.00 0.00 H new ATOM 0 HD22 ASN A 51 11.473 6.175 -7.354 1.00 0.00 H new ATOM 767 N LEU A 52 7.650 2.722 -10.267 1.00 0.00 N ATOM 768 CA LEU A 52 7.251 1.331 -10.571 1.00 0.00 C ATOM 769 C LEU A 52 8.205 0.666 -11.608 1.00 0.00 C ATOM 770 O LEU A 52 8.181 0.968 -12.806 1.00 0.00 O ATOM 771 CB LEU A 52 5.779 1.365 -11.053 1.00 0.00 C ATOM 772 CG LEU A 52 5.144 -0.025 -11.310 1.00 0.00 C ATOM 773 CD1 LEU A 52 4.793 -0.754 -10.001 1.00 0.00 C ATOM 774 CD2 LEU A 52 3.917 0.132 -12.217 1.00 0.00 C ATOM 0 H LEU A 52 7.033 3.422 -10.679 1.00 0.00 H new ATOM 0 HA LEU A 52 7.330 0.711 -9.678 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.180 1.890 -10.308 1.00 0.00 H new ATOM 0 HB3 LEU A 52 5.726 1.948 -11.973 1.00 0.00 H new ATOM 0 HG LEU A 52 5.880 -0.650 -11.816 1.00 0.00 H new ATOM 0 HD11 LEU A 52 4.351 -1.723 -10.232 1.00 0.00 H new ATOM 0 HD12 LEU A 52 5.698 -0.899 -9.411 1.00 0.00 H new ATOM 0 HD13 LEU A 52 4.081 -0.157 -9.432 1.00 0.00 H new ATOM 0 HD21 LEU A 52 3.471 -0.846 -12.398 1.00 0.00 H new ATOM 0 HD22 LEU A 52 3.187 0.780 -11.732 1.00 0.00 H new ATOM 0 HD23 LEU A 52 4.220 0.573 -13.166 1.00 0.00 H new ATOM 786 N THR A 53 9.004 -0.275 -11.106 1.00 0.00 N ATOM 787 CA THR A 53 9.973 -1.053 -11.910 1.00 0.00 C ATOM 788 C THR A 53 9.302 -2.421 -12.245 1.00 0.00 C ATOM 789 O THR A 53 9.172 -3.289 -11.375 1.00 0.00 O ATOM 790 CB THR A 53 11.326 -1.174 -11.137 1.00 0.00 C ATOM 791 OG1 THR A 53 11.802 0.119 -10.735 1.00 0.00 O ATOM 792 CG2 THR A 53 12.436 -1.778 -12.018 1.00 0.00 C ATOM 0 H THR A 53 9.004 -0.529 -10.118 1.00 0.00 H new ATOM 0 HA THR A 53 10.223 -0.563 -12.851 1.00 0.00 H new ATOM 0 HB THR A 53 11.122 -1.814 -10.278 1.00 0.00 H new ATOM 0 HG1 THR A 53 12.289 0.040 -9.888 1.00 0.00 H new ATOM 0 HG21 THR A 53 13.360 -1.845 -11.444 1.00 0.00 H new ATOM 0 HG22 THR A 53 12.139 -2.774 -12.345 1.00 0.00 H new ATOM 0 HG23 THR A 53 12.595 -1.142 -12.889 1.00 0.00 H new ATOM 800 N ILE A 54 8.857 -2.601 -13.502 1.00 0.00 N ATOM 801 CA ILE A 54 8.339 -3.914 -13.997 1.00 0.00 C ATOM 802 C ILE A 54 9.383 -4.452 -15.027 1.00 0.00 C ATOM 803 O ILE A 54 9.448 -4.005 -16.178 1.00 0.00 O ATOM 804 CB ILE A 54 6.843 -3.831 -14.473 1.00 0.00 C ATOM 805 CG1 ILE A 54 5.893 -3.640 -13.247 1.00 0.00 C ATOM 806 CG2 ILE A 54 6.392 -5.077 -15.284 1.00 0.00 C ATOM 807 CD1 ILE A 54 4.395 -3.419 -13.520 1.00 0.00 C ATOM 0 H ILE A 54 8.841 -1.860 -14.203 1.00 0.00 H new ATOM 0 HA ILE A 54 8.259 -4.654 -13.200 1.00 0.00 H new ATOM 0 HB ILE A 54 6.780 -2.969 -15.138 1.00 0.00 H new ATOM 0 HG12 ILE A 54 5.990 -4.519 -12.610 1.00 0.00 H new ATOM 0 HG13 ILE A 54 6.257 -2.788 -12.673 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.351 -4.959 -15.584 1.00 0.00 H new ATOM 0 HG22 ILE A 54 7.016 -5.178 -16.172 1.00 0.00 H new ATOM 0 HG23 ILE A 54 6.493 -5.969 -14.666 1.00 0.00 H new ATOM 0 HD11 ILE A 54 3.866 -3.303 -12.574 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.264 -2.520 -14.122 1.00 0.00 H new ATOM 0 HD13 ILE A 54 3.993 -4.277 -14.058 1.00 0.00 H new ATOM 819 N LYS A 55 10.193 -5.431 -14.589 1.00 0.00 N ATOM 820 CA LYS A 55 11.195 -6.115 -15.448 1.00 0.00 C ATOM 821 C LYS A 55 10.658 -7.519 -15.866 1.00 0.00 C ATOM 822 O LYS A 55 10.450 -8.388 -15.019 1.00 0.00 O ATOM 823 CB LYS A 55 12.530 -6.157 -14.656 1.00 0.00 C ATOM 824 CG LYS A 55 13.742 -6.723 -15.432 1.00 0.00 C ATOM 825 CD LYS A 55 14.958 -6.957 -14.510 1.00 0.00 C ATOM 826 CE LYS A 55 16.191 -7.538 -15.227 1.00 0.00 C ATOM 827 NZ LYS A 55 16.976 -6.479 -15.920 1.00 0.00 N ATOM 0 H LYS A 55 10.177 -5.776 -13.629 1.00 0.00 H new ATOM 0 HA LYS A 55 11.376 -5.583 -16.382 1.00 0.00 H new ATOM 0 HB2 LYS A 55 12.770 -5.146 -14.327 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.382 -6.757 -13.758 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.461 -7.662 -15.908 1.00 0.00 H new ATOM 0 HG3 LYS A 55 14.018 -6.032 -16.228 1.00 0.00 H new ATOM 0 HD2 LYS A 55 15.234 -6.011 -14.045 1.00 0.00 H new ATOM 0 HD3 LYS A 55 14.666 -7.634 -13.707 1.00 0.00 H new ATOM 0 HE2 LYS A 55 16.827 -8.047 -14.503 1.00 0.00 H new ATOM 0 HE3 LYS A 55 15.871 -8.287 -15.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 17.684 -6.921 -16.540 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 16.336 -5.890 -16.490 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 17.457 -5.885 -15.214 1.00 0.00 H new ATOM 841 N THR A 56 10.426 -7.743 -17.167 1.00 0.00 N ATOM 842 CA THR A 56 9.867 -9.023 -17.695 1.00 0.00 C ATOM 843 C THR A 56 11.022 -9.903 -18.275 1.00 0.00 C ATOM 844 O THR A 56 11.449 -9.702 -19.418 1.00 0.00 O ATOM 845 CB THR A 56 8.747 -8.666 -18.721 1.00 0.00 C ATOM 846 OG1 THR A 56 7.775 -7.822 -18.108 1.00 0.00 O ATOM 847 CG2 THR A 56 7.968 -9.870 -19.265 1.00 0.00 C ATOM 0 H THR A 56 10.616 -7.051 -17.892 1.00 0.00 H new ATOM 0 HA THR A 56 9.409 -9.629 -16.913 1.00 0.00 H new ATOM 0 HB THR A 56 9.278 -8.191 -19.546 1.00 0.00 H new ATOM 0 HG1 THR A 56 7.076 -7.601 -18.759 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.211 -9.525 -19.970 1.00 0.00 H new ATOM 0 HG22 THR A 56 8.654 -10.548 -19.772 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.484 -10.393 -18.440 1.00 0.00 H new ATOM 855 N GLU A 57 11.532 -10.865 -17.481 1.00 0.00 N ATOM 856 CA GLU A 57 12.667 -11.743 -17.888 1.00 0.00 C ATOM 857 C GLU A 57 12.183 -13.039 -18.619 1.00 0.00 C ATOM 858 O GLU A 57 11.475 -13.881 -18.055 1.00 0.00 O ATOM 859 CB GLU A 57 13.537 -12.108 -16.652 1.00 0.00 C ATOM 860 CG GLU A 57 14.508 -11.008 -16.152 1.00 0.00 C ATOM 861 CD GLU A 57 15.337 -11.351 -14.916 1.00 0.00 C ATOM 862 OE1 GLU A 57 15.480 -12.538 -14.546 1.00 0.00 O ATOM 863 OE2 GLU A 57 15.824 -10.409 -14.262 1.00 0.00 O ATOM 0 H GLU A 57 11.178 -11.061 -16.545 1.00 0.00 H new ATOM 0 HA GLU A 57 13.272 -11.181 -18.599 1.00 0.00 H new ATOM 0 HB2 GLU A 57 12.872 -12.377 -15.832 1.00 0.00 H new ATOM 0 HB3 GLU A 57 14.120 -12.997 -16.894 1.00 0.00 H new ATOM 0 HG2 GLU A 57 15.191 -10.759 -16.964 1.00 0.00 H new ATOM 0 HG3 GLU A 57 13.928 -10.111 -15.937 1.00 0.00 H new ATOM 870 N SER A 58 12.626 -13.203 -19.876 1.00 0.00 N ATOM 871 CA SER A 58 12.479 -14.469 -20.644 1.00 0.00 C ATOM 872 C SER A 58 13.648 -14.614 -21.664 1.00 0.00 C ATOM 873 O SER A 58 13.959 -13.685 -22.423 1.00 0.00 O ATOM 874 CB SER A 58 11.106 -14.509 -21.354 1.00 0.00 C ATOM 875 OG SER A 58 10.938 -15.698 -22.129 1.00 0.00 O ATOM 0 H SER A 58 13.099 -12.465 -20.397 1.00 0.00 H new ATOM 0 HA SER A 58 12.524 -15.313 -19.955 1.00 0.00 H new ATOM 0 HB2 SER A 58 10.311 -14.446 -20.610 1.00 0.00 H new ATOM 0 HB3 SER A 58 11.007 -13.638 -22.001 1.00 0.00 H new ATOM 0 HG SER A 58 10.058 -15.686 -22.560 1.00 0.00 H new ATOM 881 N THR A 59 14.246 -15.816 -21.738 1.00 0.00 N ATOM 882 CA THR A 59 15.186 -16.195 -22.845 1.00 0.00 C ATOM 883 C THR A 59 14.597 -16.140 -24.300 1.00 0.00 C ATOM 884 O THR A 59 15.323 -15.781 -25.230 1.00 0.00 O ATOM 885 CB THR A 59 15.849 -17.583 -22.578 1.00 0.00 C ATOM 886 OG1 THR A 59 14.867 -18.598 -22.394 1.00 0.00 O ATOM 887 CG2 THR A 59 16.790 -17.635 -21.364 1.00 0.00 C ATOM 0 H THR A 59 14.104 -16.554 -21.049 1.00 0.00 H new ATOM 0 HA THR A 59 15.940 -15.408 -22.822 1.00 0.00 H new ATOM 0 HB THR A 59 16.449 -17.753 -23.472 1.00 0.00 H new ATOM 0 HG1 THR A 59 15.311 -19.456 -22.230 1.00 0.00 H new ATOM 0 HG21 THR A 59 17.199 -18.640 -21.264 1.00 0.00 H new ATOM 0 HG22 THR A 59 17.604 -16.924 -21.504 1.00 0.00 H new ATOM 0 HG23 THR A 59 16.235 -17.378 -20.462 1.00 0.00 H new ATOM 895 N LEU A 60 13.298 -16.440 -24.495 1.00 0.00 N ATOM 896 CA LEU A 60 12.574 -16.134 -25.762 1.00 0.00 C ATOM 897 C LEU A 60 12.393 -14.605 -26.073 1.00 0.00 C ATOM 898 O LEU A 60 12.644 -14.200 -27.212 1.00 0.00 O ATOM 899 CB LEU A 60 11.209 -16.888 -25.767 1.00 0.00 C ATOM 900 CG LEU A 60 11.238 -18.437 -25.889 1.00 0.00 C ATOM 901 CD1 LEU A 60 9.836 -19.019 -25.650 1.00 0.00 C ATOM 902 CD2 LEU A 60 11.747 -18.919 -27.260 1.00 0.00 C ATOM 0 H LEU A 60 12.718 -16.897 -23.791 1.00 0.00 H new ATOM 0 HA LEU A 60 13.207 -16.491 -26.575 1.00 0.00 H new ATOM 0 HB2 LEU A 60 10.683 -16.634 -24.847 1.00 0.00 H new ATOM 0 HB3 LEU A 60 10.614 -16.498 -26.593 1.00 0.00 H new ATOM 0 HG LEU A 60 11.934 -18.791 -25.128 1.00 0.00 H new ATOM 0 HD11 LEU A 60 9.873 -20.105 -25.739 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.495 -18.748 -24.651 1.00 0.00 H new ATOM 0 HD13 LEU A 60 9.144 -18.618 -26.391 1.00 0.00 H new ATOM 0 HD21 LEU A 60 11.745 -20.009 -27.286 1.00 0.00 H new ATOM 0 HD22 LEU A 60 11.095 -18.536 -28.045 1.00 0.00 H new ATOM 0 HD23 LEU A 60 12.761 -18.554 -27.420 1.00 0.00 H new ATOM 914 N LYS A 61 11.940 -13.765 -25.113 1.00 0.00 N ATOM 915 CA LYS A 61 11.789 -12.295 -25.330 1.00 0.00 C ATOM 916 C LYS A 61 11.787 -11.520 -23.970 1.00 0.00 C ATOM 917 O LYS A 61 10.782 -11.506 -23.253 1.00 0.00 O ATOM 918 CB LYS A 61 10.505 -12.023 -26.169 1.00 0.00 C ATOM 919 CG LYS A 61 10.280 -10.575 -26.664 1.00 0.00 C ATOM 920 CD LYS A 61 11.265 -10.117 -27.766 1.00 0.00 C ATOM 921 CE LYS A 61 10.852 -8.756 -28.350 1.00 0.00 C ATOM 922 NZ LYS A 61 11.717 -8.346 -29.486 1.00 0.00 N ATOM 0 H LYS A 61 11.671 -14.074 -24.179 1.00 0.00 H new ATOM 0 HA LYS A 61 12.646 -11.923 -25.892 1.00 0.00 H new ATOM 0 HB2 LYS A 61 10.525 -12.679 -27.039 1.00 0.00 H new ATOM 0 HB3 LYS A 61 9.642 -12.314 -25.570 1.00 0.00 H new ATOM 0 HG2 LYS A 61 9.262 -10.488 -27.044 1.00 0.00 H new ATOM 0 HG3 LYS A 61 10.362 -9.897 -25.815 1.00 0.00 H new ATOM 0 HD2 LYS A 61 12.271 -10.048 -27.352 1.00 0.00 H new ATOM 0 HD3 LYS A 61 11.298 -10.862 -28.561 1.00 0.00 H new ATOM 0 HE2 LYS A 61 9.816 -8.806 -28.684 1.00 0.00 H new ATOM 0 HE3 LYS A 61 10.899 -7.998 -27.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 11.304 -7.514 -29.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 12.666 -8.109 -29.132 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 11.788 -9.128 -30.168 1.00 0.00 H new ATOM 936 N THR A 62 12.899 -10.838 -23.642 1.00 0.00 N ATOM 937 CA THR A 62 12.997 -9.968 -22.426 1.00 0.00 C ATOM 938 C THR A 62 12.622 -8.478 -22.751 1.00 0.00 C ATOM 939 O THR A 62 13.060 -7.911 -23.758 1.00 0.00 O ATOM 940 CB THR A 62 14.426 -10.130 -21.812 1.00 0.00 C ATOM 941 OG1 THR A 62 14.586 -11.449 -21.295 1.00 0.00 O ATOM 942 CG2 THR A 62 14.763 -9.207 -20.627 1.00 0.00 C ATOM 0 H THR A 62 13.754 -10.864 -24.197 1.00 0.00 H new ATOM 0 HA THR A 62 12.269 -10.284 -21.679 1.00 0.00 H new ATOM 0 HB THR A 62 15.082 -9.880 -22.645 1.00 0.00 H new ATOM 0 HG1 THR A 62 14.255 -12.099 -21.949 1.00 0.00 H new ATOM 0 HG21 THR A 62 15.778 -9.409 -20.285 1.00 0.00 H new ATOM 0 HG22 THR A 62 14.687 -8.167 -20.943 1.00 0.00 H new ATOM 0 HG23 THR A 62 14.063 -9.391 -19.812 1.00 0.00 H new ATOM 950 N THR A 63 11.846 -7.833 -21.858 1.00 0.00 N ATOM 951 CA THR A 63 11.599 -6.353 -21.894 1.00 0.00 C ATOM 952 C THR A 63 11.494 -5.746 -20.447 1.00 0.00 C ATOM 953 O THR A 63 11.340 -6.470 -19.460 1.00 0.00 O ATOM 954 CB THR A 63 10.404 -6.001 -22.839 1.00 0.00 C ATOM 955 OG1 THR A 63 10.386 -4.596 -23.067 1.00 0.00 O ATOM 956 CG2 THR A 63 8.998 -6.401 -22.359 1.00 0.00 C ATOM 0 H THR A 63 11.369 -8.307 -21.091 1.00 0.00 H new ATOM 0 HA THR A 63 12.467 -5.865 -22.337 1.00 0.00 H new ATOM 0 HB THR A 63 10.596 -6.594 -23.733 1.00 0.00 H new ATOM 0 HG1 THR A 63 9.639 -4.370 -23.660 1.00 0.00 H new ATOM 0 HG21 THR A 63 8.260 -6.101 -23.103 1.00 0.00 H new ATOM 0 HG22 THR A 63 8.955 -7.481 -22.220 1.00 0.00 H new ATOM 0 HG23 THR A 63 8.781 -5.904 -21.413 1.00 0.00 H new ATOM 964 N GLN A 64 11.591 -4.410 -20.292 1.00 0.00 N ATOM 965 CA GLN A 64 11.462 -3.740 -18.959 1.00 0.00 C ATOM 966 C GLN A 64 10.982 -2.256 -19.030 1.00 0.00 C ATOM 967 O GLN A 64 11.295 -1.533 -19.981 1.00 0.00 O ATOM 968 CB GLN A 64 12.763 -3.898 -18.113 1.00 0.00 C ATOM 969 CG GLN A 64 14.066 -3.243 -18.638 1.00 0.00 C ATOM 970 CD GLN A 64 15.240 -3.388 -17.661 1.00 0.00 C ATOM 971 OE1 GLN A 64 15.769 -4.472 -17.424 1.00 0.00 O ATOM 972 NE2 GLN A 64 15.676 -2.314 -17.047 1.00 0.00 N ATOM 0 H GLN A 64 11.758 -3.765 -21.065 1.00 0.00 H new ATOM 0 HA GLN A 64 10.659 -4.267 -18.443 1.00 0.00 H new ATOM 0 HB2 GLN A 64 12.565 -3.494 -17.120 1.00 0.00 H new ATOM 0 HB3 GLN A 64 12.953 -4.964 -17.991 1.00 0.00 H new ATOM 0 HG2 GLN A 64 14.336 -3.695 -19.592 1.00 0.00 H new ATOM 0 HG3 GLN A 64 13.885 -2.185 -18.827 1.00 0.00 H new ATOM 0 HE21 GLN A 64 15.245 -1.409 -17.235 1.00 0.00 H new ATOM 0 HE22 GLN A 64 16.446 -2.384 -16.381 1.00 0.00 H new ATOM 981 N PHE A 65 10.262 -1.791 -17.985 1.00 0.00 N ATOM 982 CA PHE A 65 9.860 -0.361 -17.846 1.00 0.00 C ATOM 983 C PHE A 65 10.004 0.152 -16.372 1.00 0.00 C ATOM 984 O PHE A 65 9.689 -0.556 -15.410 1.00 0.00 O ATOM 985 CB PHE A 65 8.456 -0.097 -18.468 1.00 0.00 C ATOM 986 CG PHE A 65 7.206 -0.680 -17.777 1.00 0.00 C ATOM 987 CD1 PHE A 65 6.575 0.030 -16.750 1.00 0.00 C ATOM 988 CD2 PHE A 65 6.628 -1.864 -18.245 1.00 0.00 C ATOM 989 CE1 PHE A 65 5.364 -0.416 -16.228 1.00 0.00 C ATOM 990 CE2 PHE A 65 5.418 -2.311 -17.719 1.00 0.00 C ATOM 991 CZ PHE A 65 4.778 -1.577 -16.724 1.00 0.00 C ATOM 0 H PHE A 65 9.943 -2.384 -17.219 1.00 0.00 H new ATOM 0 HA PHE A 65 10.561 0.238 -18.428 1.00 0.00 H new ATOM 0 HB2 PHE A 65 8.323 0.983 -18.531 1.00 0.00 H new ATOM 0 HB3 PHE A 65 8.473 -0.476 -19.490 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.030 0.929 -16.360 1.00 0.00 H new ATOM 0 HD2 PHE A 65 7.122 -2.435 -19.018 1.00 0.00 H new ATOM 0 HE1 PHE A 65 4.879 0.139 -15.438 1.00 0.00 H new ATOM 0 HE2 PHE A 65 4.976 -3.227 -18.083 1.00 0.00 H new ATOM 0 HZ PHE A 65 3.826 -1.909 -16.337 1.00 0.00 H new ATOM 1001 N SER A 66 10.460 1.407 -16.216 1.00 0.00 N ATOM 1002 CA SER A 66 10.604 2.078 -14.892 1.00 0.00 C ATOM 1003 C SER A 66 9.852 3.444 -14.904 1.00 0.00 C ATOM 1004 O SER A 66 10.330 4.397 -15.532 1.00 0.00 O ATOM 1005 CB SER A 66 12.107 2.241 -14.560 1.00 0.00 C ATOM 1006 OG SER A 66 12.752 3.165 -15.441 1.00 0.00 O ATOM 0 H SER A 66 10.742 1.994 -17.001 1.00 0.00 H new ATOM 0 HA SER A 66 10.153 1.467 -14.110 1.00 0.00 H new ATOM 0 HB2 SER A 66 12.216 2.584 -13.531 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.600 1.271 -14.627 1.00 0.00 H new ATOM 0 HG SER A 66 12.095 3.811 -15.776 1.00 0.00 H new ATOM 1012 N CYS A 67 8.681 3.529 -14.248 1.00 0.00 N ATOM 1013 CA CYS A 67 7.737 4.667 -14.435 1.00 0.00 C ATOM 1014 C CYS A 67 7.112 5.219 -13.119 1.00 0.00 C ATOM 1015 O CYS A 67 6.723 4.462 -12.228 1.00 0.00 O ATOM 1016 CB CYS A 67 6.631 4.174 -15.387 1.00 0.00 C ATOM 1017 SG CYS A 67 5.706 2.754 -14.700 1.00 0.00 S ATOM 0 H CYS A 67 8.358 2.828 -13.582 1.00 0.00 H new ATOM 0 HA CYS A 67 8.298 5.509 -14.841 1.00 0.00 H new ATOM 0 HB2 CYS A 67 5.939 4.991 -15.591 1.00 0.00 H new ATOM 0 HB3 CYS A 67 7.076 3.888 -16.340 1.00 0.00 H new ATOM 0 HG CYS A 67 5.784 1.748 -15.520 1.00 0.00 H new ATOM 1023 N THR A 68 6.932 6.546 -13.015 1.00 0.00 N ATOM 1024 CA THR A 68 6.359 7.195 -11.798 1.00 0.00 C ATOM 1025 C THR A 68 4.817 6.914 -11.658 1.00 0.00 C ATOM 1026 O THR A 68 4.021 7.258 -12.536 1.00 0.00 O ATOM 1027 CB THR A 68 6.706 8.718 -11.803 1.00 0.00 C ATOM 1028 OG1 THR A 68 8.068 8.952 -12.153 1.00 0.00 O ATOM 1029 CG2 THR A 68 6.542 9.386 -10.433 1.00 0.00 C ATOM 0 H THR A 68 7.173 7.203 -13.757 1.00 0.00 H new ATOM 0 HA THR A 68 6.814 6.755 -10.911 1.00 0.00 H new ATOM 0 HB THR A 68 6.008 9.136 -12.529 1.00 0.00 H new ATOM 0 HG1 THR A 68 8.246 9.916 -12.147 1.00 0.00 H new ATOM 0 HG21 THR A 68 6.800 10.442 -10.510 1.00 0.00 H new ATOM 0 HG22 THR A 68 5.508 9.288 -10.102 1.00 0.00 H new ATOM 0 HG23 THR A 68 7.201 8.903 -9.712 1.00 0.00 H new ATOM 1037 N LEU A 69 4.410 6.256 -10.559 1.00 0.00 N ATOM 1038 CA LEU A 69 3.053 5.659 -10.404 1.00 0.00 C ATOM 1039 C LEU A 69 1.894 6.704 -10.272 1.00 0.00 C ATOM 1040 O LEU A 69 1.899 7.553 -9.378 1.00 0.00 O ATOM 1041 CB LEU A 69 3.164 4.728 -9.162 1.00 0.00 C ATOM 1042 CG LEU A 69 1.939 3.838 -8.842 1.00 0.00 C ATOM 1043 CD1 LEU A 69 1.755 2.716 -9.878 1.00 0.00 C ATOM 1044 CD2 LEU A 69 2.091 3.232 -7.438 1.00 0.00 C ATOM 0 H LEU A 69 5.008 6.117 -9.745 1.00 0.00 H new ATOM 0 HA LEU A 69 2.773 5.115 -11.306 1.00 0.00 H new ATOM 0 HB2 LEU A 69 4.028 4.078 -9.301 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.369 5.349 -8.290 1.00 0.00 H new ATOM 0 HG LEU A 69 1.052 4.470 -8.880 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.884 2.116 -9.614 1.00 0.00 H new ATOM 0 HD12 LEU A 69 1.609 3.153 -10.866 1.00 0.00 H new ATOM 0 HD13 LEU A 69 2.642 2.082 -9.889 1.00 0.00 H new ATOM 0 HD21 LEU A 69 1.227 2.606 -7.216 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.997 2.627 -7.399 1.00 0.00 H new ATOM 0 HD23 LEU A 69 2.158 4.033 -6.701 1.00 0.00 H new ATOM 1056 N GLY A 70 0.898 6.632 -11.165 1.00 0.00 N ATOM 1057 CA GLY A 70 0.002 7.787 -11.458 1.00 0.00 C ATOM 1058 C GLY A 70 0.152 8.418 -12.864 1.00 0.00 C ATOM 1059 O GLY A 70 -0.850 8.845 -13.442 1.00 0.00 O ATOM 0 H GLY A 70 0.683 5.792 -11.703 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -1.031 7.461 -11.335 1.00 0.00 H new ATOM 0 HA3 GLY A 70 0.183 8.561 -10.712 1.00 0.00 H new ATOM 1063 N GLU A 71 1.384 8.518 -13.390 1.00 0.00 N ATOM 1064 CA GLU A 71 1.715 9.337 -14.577 1.00 0.00 C ATOM 1065 C GLU A 71 1.806 8.501 -15.908 1.00 0.00 C ATOM 1066 O GLU A 71 1.848 7.258 -15.937 1.00 0.00 O ATOM 1067 CB GLU A 71 3.021 10.126 -14.234 1.00 0.00 C ATOM 1068 CG GLU A 71 2.893 11.289 -13.202 1.00 0.00 C ATOM 1069 CD GLU A 71 3.098 10.963 -11.724 1.00 0.00 C ATOM 1070 OE1 GLU A 71 2.161 10.489 -11.043 1.00 0.00 O ATOM 1071 OE2 GLU A 71 4.192 11.246 -11.191 1.00 0.00 O ATOM 0 H GLU A 71 2.190 8.028 -13.001 1.00 0.00 H new ATOM 0 HA GLU A 71 0.907 10.037 -14.790 1.00 0.00 H new ATOM 0 HB2 GLU A 71 3.757 9.416 -13.856 1.00 0.00 H new ATOM 0 HB3 GLU A 71 3.422 10.537 -15.160 1.00 0.00 H new ATOM 0 HG2 GLU A 71 3.613 12.060 -13.477 1.00 0.00 H new ATOM 0 HG3 GLU A 71 1.901 11.726 -13.313 1.00 0.00 H new ATOM 1078 N LYS A 72 1.775 9.259 -17.027 1.00 0.00 N ATOM 1079 CA LYS A 72 1.794 8.711 -18.411 1.00 0.00 C ATOM 1080 C LYS A 72 3.196 8.854 -19.091 1.00 0.00 C ATOM 1081 O LYS A 72 3.750 9.954 -19.171 1.00 0.00 O ATOM 1082 CB LYS A 72 0.629 9.346 -19.227 1.00 0.00 C ATOM 1083 CG LYS A 72 0.303 8.611 -20.557 1.00 0.00 C ATOM 1084 CD LYS A 72 -1.164 8.692 -21.037 1.00 0.00 C ATOM 1085 CE LYS A 72 -1.559 10.017 -21.708 1.00 0.00 C ATOM 1086 NZ LYS A 72 -3.020 9.985 -21.993 1.00 0.00 N ATOM 0 H LYS A 72 1.736 10.278 -17.000 1.00 0.00 H new ATOM 0 HA LYS A 72 1.626 7.635 -18.375 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -0.267 9.363 -18.606 1.00 0.00 H new ATOM 0 HB3 LYS A 72 0.881 10.383 -19.451 1.00 0.00 H new ATOM 0 HG2 LYS A 72 0.943 9.018 -21.340 1.00 0.00 H new ATOM 0 HG3 LYS A 72 0.569 7.560 -20.442 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -1.345 7.879 -21.740 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -1.819 8.526 -20.182 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -1.318 10.858 -21.057 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.996 10.157 -22.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -3.317 10.901 -22.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -3.223 9.231 -22.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -3.542 9.800 -21.112 1.00 0.00 H new ATOM 1100 N PHE A 73 3.755 7.734 -19.587 1.00 0.00 N ATOM 1101 CA PHE A 73 5.139 7.671 -20.154 1.00 0.00 C ATOM 1102 C PHE A 73 5.188 7.100 -21.615 1.00 0.00 C ATOM 1103 O PHE A 73 4.249 6.442 -22.079 1.00 0.00 O ATOM 1104 CB PHE A 73 6.051 6.882 -19.155 1.00 0.00 C ATOM 1105 CG PHE A 73 5.825 5.359 -19.020 1.00 0.00 C ATOM 1106 CD1 PHE A 73 4.815 4.883 -18.183 1.00 0.00 C ATOM 1107 CD2 PHE A 73 6.598 4.445 -19.747 1.00 0.00 C ATOM 1108 CE1 PHE A 73 4.571 3.519 -18.083 1.00 0.00 C ATOM 1109 CE2 PHE A 73 6.345 3.077 -19.652 1.00 0.00 C ATOM 1110 CZ PHE A 73 5.328 2.615 -18.823 1.00 0.00 C ATOM 0 H PHE A 73 3.268 6.838 -19.611 1.00 0.00 H new ATOM 0 HA PHE A 73 5.521 8.686 -20.259 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.088 7.042 -19.451 1.00 0.00 H new ATOM 0 HB3 PHE A 73 5.929 7.327 -18.168 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.220 5.579 -17.610 1.00 0.00 H new ATOM 0 HD2 PHE A 73 7.394 4.801 -20.384 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.791 3.159 -17.429 1.00 0.00 H new ATOM 0 HE2 PHE A 73 6.938 2.377 -20.222 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.126 1.556 -18.754 1.00 0.00 H new ATOM 1120 N GLU A 74 6.324 7.296 -22.321 1.00 0.00 N ATOM 1121 CA GLU A 74 6.603 6.570 -23.595 1.00 0.00 C ATOM 1122 C GLU A 74 7.049 5.090 -23.328 1.00 0.00 C ATOM 1123 O GLU A 74 8.182 4.795 -22.932 1.00 0.00 O ATOM 1124 CB GLU A 74 7.654 7.337 -24.444 1.00 0.00 C ATOM 1125 CG GLU A 74 7.732 6.829 -25.913 1.00 0.00 C ATOM 1126 CD GLU A 74 9.058 7.029 -26.624 1.00 0.00 C ATOM 1127 OE1 GLU A 74 10.048 6.359 -26.257 1.00 0.00 O ATOM 1128 OE2 GLU A 74 9.095 7.747 -27.642 1.00 0.00 O ATOM 0 H GLU A 74 7.060 7.943 -22.039 1.00 0.00 H new ATOM 0 HA GLU A 74 5.676 6.526 -24.167 1.00 0.00 H new ATOM 0 HB2 GLU A 74 7.408 8.399 -24.445 1.00 0.00 H new ATOM 0 HB3 GLU A 74 8.634 7.237 -23.977 1.00 0.00 H new ATOM 0 HG2 GLU A 74 7.497 5.765 -25.920 1.00 0.00 H new ATOM 0 HG3 GLU A 74 6.955 7.331 -26.490 1.00 0.00 H new ATOM 1135 N GLU A 75 6.122 4.167 -23.586 1.00 0.00 N ATOM 1136 CA GLU A 75 6.356 2.707 -23.508 1.00 0.00 C ATOM 1137 C GLU A 75 6.846 2.188 -24.893 1.00 0.00 C ATOM 1138 O GLU A 75 6.115 2.229 -25.889 1.00 0.00 O ATOM 1139 CB GLU A 75 5.001 2.103 -23.053 1.00 0.00 C ATOM 1140 CG GLU A 75 4.897 0.555 -22.956 1.00 0.00 C ATOM 1141 CD GLU A 75 4.496 -0.012 -21.610 1.00 0.00 C ATOM 1142 OE1 GLU A 75 3.297 0.069 -21.259 1.00 0.00 O ATOM 1143 OE2 GLU A 75 5.362 -0.562 -20.904 1.00 0.00 O ATOM 0 H GLU A 75 5.169 4.407 -23.860 1.00 0.00 H new ATOM 0 HA GLU A 75 7.136 2.420 -22.803 1.00 0.00 H new ATOM 0 HB2 GLU A 75 4.761 2.517 -22.074 1.00 0.00 H new ATOM 0 HB3 GLU A 75 4.231 2.448 -23.743 1.00 0.00 H new ATOM 0 HG2 GLU A 75 4.175 0.214 -23.698 1.00 0.00 H new ATOM 0 HG3 GLU A 75 5.862 0.130 -23.231 1.00 0.00 H new ATOM 1150 N THR A 76 8.088 1.678 -24.953 1.00 0.00 N ATOM 1151 CA THR A 76 8.585 0.960 -26.163 1.00 0.00 C ATOM 1152 C THR A 76 8.254 -0.555 -26.012 1.00 0.00 C ATOM 1153 O THR A 76 8.964 -1.314 -25.345 1.00 0.00 O ATOM 1154 CB THR A 76 10.087 1.264 -26.426 1.00 0.00 C ATOM 1155 OG1 THR A 76 10.306 2.671 -26.396 1.00 0.00 O ATOM 1156 CG2 THR A 76 10.550 0.767 -27.808 1.00 0.00 C ATOM 0 H THR A 76 8.766 1.742 -24.194 1.00 0.00 H new ATOM 0 HA THR A 76 8.076 1.318 -27.058 1.00 0.00 H new ATOM 0 HB THR A 76 10.650 0.748 -25.648 1.00 0.00 H new ATOM 0 HG1 THR A 76 11.217 2.854 -26.084 1.00 0.00 H new ATOM 0 HG21 THR A 76 11.605 1.003 -27.945 1.00 0.00 H new ATOM 0 HG22 THR A 76 10.408 -0.312 -27.873 1.00 0.00 H new ATOM 0 HG23 THR A 76 9.965 1.258 -28.586 1.00 0.00 H new ATOM 1164 N THR A 77 7.139 -0.970 -26.628 1.00 0.00 N ATOM 1165 CA THR A 77 6.617 -2.365 -26.518 1.00 0.00 C ATOM 1166 C THR A 77 7.497 -3.410 -27.282 1.00 0.00 C ATOM 1167 O THR A 77 8.074 -3.108 -28.331 1.00 0.00 O ATOM 1168 CB THR A 77 5.127 -2.433 -26.983 1.00 0.00 C ATOM 1169 OG1 THR A 77 4.986 -2.007 -28.333 1.00 0.00 O ATOM 1170 CG2 THR A 77 4.139 -1.616 -26.135 1.00 0.00 C ATOM 0 H THR A 77 6.567 -0.363 -27.216 1.00 0.00 H new ATOM 0 HA THR A 77 6.668 -2.638 -25.464 1.00 0.00 H new ATOM 0 HB THR A 77 4.872 -3.486 -26.863 1.00 0.00 H new ATOM 0 HG1 THR A 77 5.149 -1.042 -28.390 1.00 0.00 H new ATOM 0 HG21 THR A 77 3.133 -1.729 -26.539 1.00 0.00 H new ATOM 0 HG22 THR A 77 4.159 -1.975 -25.106 1.00 0.00 H new ATOM 0 HG23 THR A 77 4.423 -0.564 -26.158 1.00 0.00 H new ATOM 1178 N ALA A 78 7.568 -4.654 -26.765 1.00 0.00 N ATOM 1179 CA ALA A 78 8.387 -5.759 -27.356 1.00 0.00 C ATOM 1180 C ALA A 78 8.320 -6.030 -28.904 1.00 0.00 C ATOM 1181 O ALA A 78 9.339 -6.347 -29.525 1.00 0.00 O ATOM 1182 CB ALA A 78 8.008 -7.018 -26.546 1.00 0.00 C ATOM 0 H ALA A 78 7.062 -4.932 -25.924 1.00 0.00 H new ATOM 0 HA ALA A 78 9.429 -5.448 -27.275 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.569 -7.874 -26.921 1.00 0.00 H new ATOM 0 HB2 ALA A 78 8.247 -6.860 -25.494 1.00 0.00 H new ATOM 0 HB3 ALA A 78 6.940 -7.210 -26.650 1.00 0.00 H new ATOM 1188 N ASP A 79 7.130 -5.879 -29.501 1.00 0.00 N ATOM 1189 CA ASP A 79 6.929 -5.810 -30.974 1.00 0.00 C ATOM 1190 C ASP A 79 7.557 -4.562 -31.699 1.00 0.00 C ATOM 1191 O ASP A 79 8.238 -4.723 -32.714 1.00 0.00 O ATOM 1192 CB ASP A 79 5.384 -5.917 -31.110 1.00 0.00 C ATOM 1193 CG ASP A 79 4.759 -6.056 -32.495 1.00 0.00 C ATOM 1194 OD1 ASP A 79 5.460 -6.153 -33.519 1.00 0.00 O ATOM 1195 OD2 ASP A 79 3.508 -6.083 -32.536 1.00 0.00 O ATOM 0 H ASP A 79 6.260 -5.799 -28.975 1.00 0.00 H new ATOM 0 HA ASP A 79 7.468 -6.604 -31.491 1.00 0.00 H new ATOM 0 HB2 ASP A 79 5.063 -6.775 -30.519 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.953 -5.030 -30.645 1.00 0.00 H new ATOM 1200 N GLY A 80 7.324 -3.335 -31.196 1.00 0.00 N ATOM 1201 CA GLY A 80 7.745 -2.085 -31.893 1.00 0.00 C ATOM 1202 C GLY A 80 6.882 -0.810 -31.710 1.00 0.00 C ATOM 1203 O GLY A 80 7.358 0.271 -32.060 1.00 0.00 O ATOM 0 H GLY A 80 6.847 -3.173 -30.309 1.00 0.00 H new ATOM 0 HA2 GLY A 80 8.758 -1.849 -31.568 1.00 0.00 H new ATOM 0 HA3 GLY A 80 7.795 -2.301 -32.960 1.00 0.00 H new ATOM 1207 N ARG A 81 5.643 -0.895 -31.186 1.00 0.00 N ATOM 1208 CA ARG A 81 4.787 0.298 -30.924 1.00 0.00 C ATOM 1209 C ARG A 81 5.322 1.183 -29.752 1.00 0.00 C ATOM 1210 O ARG A 81 5.606 0.690 -28.652 1.00 0.00 O ATOM 1211 CB ARG A 81 3.331 -0.132 -30.588 1.00 0.00 C ATOM 1212 CG ARG A 81 2.481 -0.682 -31.756 1.00 0.00 C ATOM 1213 CD ARG A 81 1.173 -1.355 -31.271 1.00 0.00 C ATOM 1214 NE ARG A 81 1.394 -2.663 -30.597 1.00 0.00 N ATOM 1215 CZ ARG A 81 1.758 -3.792 -31.212 1.00 0.00 C ATOM 1216 NH1 ARG A 81 1.811 -3.946 -32.512 1.00 0.00 N ATOM 1217 NH2 ARG A 81 2.118 -4.806 -30.490 1.00 0.00 N ATOM 0 H ARG A 81 5.203 -1.780 -30.932 1.00 0.00 H new ATOM 0 HA ARG A 81 4.810 0.889 -31.840 1.00 0.00 H new ATOM 0 HB2 ARG A 81 3.373 -0.894 -29.810 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.812 0.728 -30.165 1.00 0.00 H new ATOM 0 HG2 ARG A 81 2.236 0.132 -32.438 1.00 0.00 H new ATOM 0 HG3 ARG A 81 3.070 -1.405 -32.321 1.00 0.00 H new ATOM 0 HD2 ARG A 81 0.661 -0.682 -30.583 1.00 0.00 H new ATOM 0 HD3 ARG A 81 0.511 -1.502 -32.124 1.00 0.00 H new ATOM 0 HE ARG A 81 1.257 -2.701 -29.587 1.00 0.00 H new ATOM 0 HH11 ARG A 81 1.564 -3.171 -33.128 1.00 0.00 H new ATOM 0 HH12 ARG A 81 2.099 -4.841 -32.908 1.00 0.00 H new ATOM 0 HH21 ARG A 81 2.120 -4.733 -29.473 1.00 0.00 H new ATOM 0 HH22 ARG A 81 2.400 -5.677 -30.939 1.00 0.00 H new ATOM 1231 N LYS A 82 5.361 2.499 -30.008 1.00 0.00 N ATOM 1232 CA LYS A 82 5.538 3.532 -28.957 1.00 0.00 C ATOM 1233 C LYS A 82 4.138 3.904 -28.365 1.00 0.00 C ATOM 1234 O LYS A 82 3.365 4.625 -29.007 1.00 0.00 O ATOM 1235 CB LYS A 82 6.225 4.772 -29.600 1.00 0.00 C ATOM 1236 CG LYS A 82 7.680 4.619 -30.113 1.00 0.00 C ATOM 1237 CD LYS A 82 8.702 4.361 -28.986 1.00 0.00 C ATOM 1238 CE LYS A 82 10.125 4.835 -29.334 1.00 0.00 C ATOM 1239 NZ LYS A 82 10.961 4.764 -28.108 1.00 0.00 N ATOM 0 H LYS A 82 5.271 2.885 -30.948 1.00 0.00 H new ATOM 0 HA LYS A 82 6.164 3.162 -28.145 1.00 0.00 H new ATOM 0 HB2 LYS A 82 5.609 5.097 -30.438 1.00 0.00 H new ATOM 0 HB3 LYS A 82 6.214 5.577 -28.865 1.00 0.00 H new ATOM 0 HG2 LYS A 82 7.721 3.796 -30.827 1.00 0.00 H new ATOM 0 HG3 LYS A 82 7.965 5.523 -30.652 1.00 0.00 H new ATOM 0 HD2 LYS A 82 8.369 4.868 -28.080 1.00 0.00 H new ATOM 0 HD3 LYS A 82 8.726 3.294 -28.764 1.00 0.00 H new ATOM 0 HE2 LYS A 82 10.551 4.210 -30.119 1.00 0.00 H new ATOM 0 HE3 LYS A 82 10.101 5.855 -29.717 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 11.961 4.661 -28.375 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 10.839 5.635 -27.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 10.670 3.946 -27.536 1.00 0.00 H new ATOM 1253 N THR A 83 3.790 3.387 -27.174 1.00 0.00 N ATOM 1254 CA THR A 83 2.445 3.619 -26.556 1.00 0.00 C ATOM 1255 C THR A 83 2.545 4.660 -25.400 1.00 0.00 C ATOM 1256 O THR A 83 3.492 4.653 -24.609 1.00 0.00 O ATOM 1257 CB THR A 83 1.716 2.307 -26.104 1.00 0.00 C ATOM 1258 OG1 THR A 83 2.298 1.714 -24.948 1.00 0.00 O ATOM 1259 CG2 THR A 83 1.643 1.181 -27.149 1.00 0.00 C ATOM 0 H THR A 83 4.410 2.805 -26.611 1.00 0.00 H new ATOM 0 HA THR A 83 1.813 4.032 -27.342 1.00 0.00 H new ATOM 0 HB THR A 83 0.712 2.686 -25.915 1.00 0.00 H new ATOM 0 HG1 THR A 83 1.951 2.155 -24.144 1.00 0.00 H new ATOM 0 HG21 THR A 83 1.118 0.325 -26.725 1.00 0.00 H new ATOM 0 HG22 THR A 83 1.107 1.536 -28.030 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.652 0.883 -27.434 1.00 0.00 H new ATOM 1267 N GLN A 84 1.533 5.526 -25.242 1.00 0.00 N ATOM 1268 CA GLN A 84 1.378 6.356 -24.016 1.00 0.00 C ATOM 1269 C GLN A 84 0.755 5.513 -22.861 1.00 0.00 C ATOM 1270 O GLN A 84 -0.467 5.365 -22.770 1.00 0.00 O ATOM 1271 CB GLN A 84 0.516 7.599 -24.368 1.00 0.00 C ATOM 1272 CG GLN A 84 1.245 8.820 -24.969 1.00 0.00 C ATOM 1273 CD GLN A 84 2.057 9.662 -23.978 1.00 0.00 C ATOM 1274 OE1 GLN A 84 1.530 10.541 -23.304 1.00 0.00 O ATOM 1275 NE2 GLN A 84 3.341 9.436 -23.842 1.00 0.00 N ATOM 0 H GLN A 84 0.806 5.677 -25.941 1.00 0.00 H new ATOM 0 HA GLN A 84 2.351 6.697 -23.662 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -0.255 7.286 -25.072 1.00 0.00 H new ATOM 0 HB3 GLN A 84 0.006 7.924 -23.461 1.00 0.00 H new ATOM 0 HG2 GLN A 84 1.915 8.470 -25.755 1.00 0.00 H new ATOM 0 HG3 GLN A 84 0.505 9.464 -25.444 1.00 0.00 H new ATOM 0 HE21 GLN A 84 3.792 8.708 -24.396 1.00 0.00 H new ATOM 0 HE22 GLN A 84 3.889 9.988 -23.182 1.00 0.00 H new ATOM 1284 N THR A 85 1.592 4.951 -21.978 1.00 0.00 N ATOM 1285 CA THR A 85 1.106 4.121 -20.842 1.00 0.00 C ATOM 1286 C THR A 85 0.910 5.000 -19.587 1.00 0.00 C ATOM 1287 O THR A 85 1.897 5.491 -19.036 1.00 0.00 O ATOM 1288 CB THR A 85 2.057 2.934 -20.568 1.00 0.00 C ATOM 1289 OG1 THR A 85 2.111 2.108 -21.727 1.00 0.00 O ATOM 1290 CG2 THR A 85 1.621 2.025 -19.401 1.00 0.00 C ATOM 0 H THR A 85 2.606 5.049 -22.019 1.00 0.00 H new ATOM 0 HA THR A 85 0.139 3.696 -21.111 1.00 0.00 H new ATOM 0 HB THR A 85 3.016 3.381 -20.307 1.00 0.00 H new ATOM 0 HG1 THR A 85 2.483 1.233 -21.488 1.00 0.00 H new ATOM 0 HG21 THR A 85 2.344 1.219 -19.278 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.571 2.610 -18.483 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.639 1.603 -19.616 1.00 0.00 H new ATOM 1298 N VAL A 86 -0.332 5.126 -19.085 1.00 0.00 N ATOM 1299 CA VAL A 86 -0.557 5.568 -17.676 1.00 0.00 C ATOM 1300 C VAL A 86 -0.544 4.330 -16.722 1.00 0.00 C ATOM 1301 O VAL A 86 -1.463 3.501 -16.749 1.00 0.00 O ATOM 1302 CB VAL A 86 -1.728 6.594 -17.521 1.00 0.00 C ATOM 1303 CG1 VAL A 86 -3.140 6.138 -17.923 1.00 0.00 C ATOM 1304 CG2 VAL A 86 -1.803 7.181 -16.097 1.00 0.00 C ATOM 0 H VAL A 86 -1.185 4.935 -19.612 1.00 0.00 H new ATOM 0 HA VAL A 86 0.280 6.182 -17.344 1.00 0.00 H new ATOM 0 HB VAL A 86 -1.441 7.343 -18.259 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.845 6.953 -17.761 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -3.146 5.857 -18.976 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -3.432 5.280 -17.317 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.631 7.888 -16.038 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.961 6.376 -15.379 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -0.870 7.695 -15.866 1.00 0.00 H new ATOM 1314 N CYS A 87 0.517 4.206 -15.892 1.00 0.00 N ATOM 1315 CA CYS A 87 0.601 3.116 -14.876 1.00 0.00 C ATOM 1316 C CYS A 87 0.017 3.598 -13.522 1.00 0.00 C ATOM 1317 O CYS A 87 0.604 4.454 -12.856 1.00 0.00 O ATOM 1318 CB CYS A 87 2.053 2.626 -14.710 1.00 0.00 C ATOM 1319 SG CYS A 87 2.547 1.590 -16.123 1.00 0.00 S ATOM 0 H CYS A 87 1.320 4.835 -15.900 1.00 0.00 H new ATOM 0 HA CYS A 87 0.007 2.272 -15.226 1.00 0.00 H new ATOM 0 HB2 CYS A 87 2.724 3.481 -14.628 1.00 0.00 H new ATOM 0 HB3 CYS A 87 2.147 2.057 -13.785 1.00 0.00 H new ATOM 0 HG CYS A 87 3.832 1.394 -16.089 1.00 0.00 H new ATOM 1325 N ASN A 88 -1.143 3.054 -13.128 1.00 0.00 N ATOM 1326 CA ASN A 88 -1.936 3.577 -11.982 1.00 0.00 C ATOM 1327 C ASN A 88 -2.404 2.428 -11.034 1.00 0.00 C ATOM 1328 O ASN A 88 -3.039 1.461 -11.467 1.00 0.00 O ATOM 1329 CB ASN A 88 -3.094 4.472 -12.520 1.00 0.00 C ATOM 1330 CG ASN A 88 -4.183 3.823 -13.392 1.00 0.00 C ATOM 1331 OD1 ASN A 88 -5.221 3.385 -12.911 1.00 0.00 O ATOM 1332 ND2 ASN A 88 -4.006 3.745 -14.690 1.00 0.00 N ATOM 0 H ASN A 88 -1.564 2.245 -13.584 1.00 0.00 H new ATOM 0 HA ASN A 88 -1.307 4.210 -11.356 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -3.586 4.928 -11.661 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -2.646 5.281 -13.097 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.726 3.326 -15.279 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -3.149 4.104 -15.110 1.00 0.00 H new ATOM 1339 N PHE A 89 -2.109 2.548 -9.728 1.00 0.00 N ATOM 1340 CA PHE A 89 -2.670 1.643 -8.689 1.00 0.00 C ATOM 1341 C PHE A 89 -4.010 2.225 -8.134 1.00 0.00 C ATOM 1342 O PHE A 89 -4.010 3.260 -7.462 1.00 0.00 O ATOM 1343 CB PHE A 89 -1.576 1.432 -7.603 1.00 0.00 C ATOM 1344 CG PHE A 89 -1.961 0.470 -6.469 1.00 0.00 C ATOM 1345 CD1 PHE A 89 -2.117 -0.901 -6.708 1.00 0.00 C ATOM 1346 CD2 PHE A 89 -2.200 0.975 -5.188 1.00 0.00 C ATOM 1347 CE1 PHE A 89 -2.513 -1.752 -5.679 1.00 0.00 C ATOM 1348 CE2 PHE A 89 -2.590 0.124 -4.162 1.00 0.00 C ATOM 1349 CZ PHE A 89 -2.752 -1.237 -4.408 1.00 0.00 C ATOM 0 H PHE A 89 -1.483 3.264 -9.358 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.927 0.666 -9.099 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.674 1.057 -8.086 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.326 2.400 -7.168 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.930 -1.300 -7.694 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.081 2.031 -4.995 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.634 -2.809 -5.867 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.768 0.518 -3.172 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.064 -1.895 -3.610 1.00 0.00 H new ATOM 1359 N THR A 90 -5.139 1.542 -8.394 1.00 0.00 N ATOM 1360 CA THR A 90 -6.476 1.954 -7.859 1.00 0.00 C ATOM 1361 C THR A 90 -6.889 1.180 -6.560 1.00 0.00 C ATOM 1362 O THR A 90 -7.950 0.547 -6.520 1.00 0.00 O ATOM 1363 CB THR A 90 -7.531 1.926 -9.015 1.00 0.00 C ATOM 1364 OG1 THR A 90 -8.797 2.305 -8.491 1.00 0.00 O ATOM 1365 CG2 THR A 90 -7.753 0.586 -9.743 1.00 0.00 C ATOM 0 H THR A 90 -5.166 0.701 -8.970 1.00 0.00 H new ATOM 0 HA THR A 90 -6.417 2.985 -7.509 1.00 0.00 H new ATOM 0 HB THR A 90 -7.111 2.608 -9.755 1.00 0.00 H new ATOM 0 HG1 THR A 90 -9.016 1.738 -7.722 1.00 0.00 H new ATOM 0 HG21 THR A 90 -8.509 0.714 -10.518 1.00 0.00 H new ATOM 0 HG22 THR A 90 -6.818 0.260 -10.199 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.089 -0.165 -9.028 1.00 0.00 H new ATOM 1373 N ASP A 91 -6.059 1.263 -5.498 1.00 0.00 N ATOM 1374 CA ASP A 91 -6.296 0.611 -4.167 1.00 0.00 C ATOM 1375 C ASP A 91 -6.767 -0.891 -4.191 1.00 0.00 C ATOM 1376 O ASP A 91 -7.822 -1.269 -3.673 1.00 0.00 O ATOM 1377 CB ASP A 91 -7.098 1.563 -3.237 1.00 0.00 C ATOM 1378 CG ASP A 91 -6.346 2.836 -2.832 1.00 0.00 C ATOM 1379 OD1 ASP A 91 -5.315 2.726 -2.134 1.00 0.00 O ATOM 1380 OD2 ASP A 91 -6.776 3.942 -3.221 1.00 0.00 O ATOM 0 H ASP A 91 -5.187 1.791 -5.530 1.00 0.00 H new ATOM 0 HA ASP A 91 -5.314 0.472 -3.714 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -8.023 1.846 -3.739 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -7.378 1.019 -2.335 1.00 0.00 H new ATOM 1385 N GLY A 92 -5.947 -1.739 -4.831 1.00 0.00 N ATOM 1386 CA GLY A 92 -6.307 -3.145 -5.148 1.00 0.00 C ATOM 1387 C GLY A 92 -5.711 -3.657 -6.477 1.00 0.00 C ATOM 1388 O GLY A 92 -4.956 -4.632 -6.479 1.00 0.00 O ATOM 0 H GLY A 92 -5.013 -1.477 -5.147 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -5.968 -3.789 -4.337 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -7.393 -3.231 -5.190 1.00 0.00 H new ATOM 1392 N ALA A 93 -6.073 -3.016 -7.603 1.00 0.00 N ATOM 1393 CA ALA A 93 -5.584 -3.402 -8.951 1.00 0.00 C ATOM 1394 C ALA A 93 -4.552 -2.386 -9.536 1.00 0.00 C ATOM 1395 O ALA A 93 -4.762 -1.168 -9.532 1.00 0.00 O ATOM 1396 CB ALA A 93 -6.822 -3.532 -9.856 1.00 0.00 C ATOM 0 H ALA A 93 -6.709 -2.219 -7.611 1.00 0.00 H new ATOM 0 HA ALA A 93 -5.043 -4.346 -8.888 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.510 -3.815 -10.861 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -7.488 -4.296 -9.454 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -7.346 -2.577 -9.895 1.00 0.00 H new ATOM 1402 N LEU A 94 -3.446 -2.913 -10.083 1.00 0.00 N ATOM 1403 CA LEU A 94 -2.425 -2.115 -10.811 1.00 0.00 C ATOM 1404 C LEU A 94 -2.696 -2.145 -12.351 1.00 0.00 C ATOM 1405 O LEU A 94 -2.484 -3.163 -13.020 1.00 0.00 O ATOM 1406 CB LEU A 94 -1.041 -2.671 -10.374 1.00 0.00 C ATOM 1407 CG LEU A 94 0.214 -2.048 -11.031 1.00 0.00 C ATOM 1408 CD1 LEU A 94 0.346 -0.546 -10.737 1.00 0.00 C ATOM 1409 CD2 LEU A 94 1.475 -2.779 -10.541 1.00 0.00 C ATOM 0 H LEU A 94 -3.226 -3.908 -10.037 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.460 -1.054 -10.563 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.953 -2.547 -9.295 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -1.030 -3.742 -10.574 1.00 0.00 H new ATOM 0 HG LEU A 94 0.104 -2.163 -12.109 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.242 -0.158 -11.221 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.529 -0.022 -11.121 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.419 -0.391 -9.661 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.356 -2.337 -11.006 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.552 -2.686 -9.458 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.413 -3.833 -10.811 1.00 0.00 H new ATOM 1421 N VAL A 95 -3.169 -1.016 -12.903 1.00 0.00 N ATOM 1422 CA VAL A 95 -3.622 -0.918 -14.321 1.00 0.00 C ATOM 1423 C VAL A 95 -2.498 -0.234 -15.170 1.00 0.00 C ATOM 1424 O VAL A 95 -2.203 0.957 -15.013 1.00 0.00 O ATOM 1425 CB VAL A 95 -5.005 -0.177 -14.410 1.00 0.00 C ATOM 1426 CG1 VAL A 95 -5.539 -0.044 -15.858 1.00 0.00 C ATOM 1427 CG2 VAL A 95 -6.138 -0.850 -13.596 1.00 0.00 C ATOM 0 H VAL A 95 -3.253 -0.139 -12.388 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.789 -1.912 -14.736 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.771 0.801 -13.990 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -6.496 0.477 -15.846 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.826 0.521 -16.458 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -5.671 -1.036 -16.290 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.058 -0.277 -13.711 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.295 -1.865 -13.961 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -5.860 -0.882 -12.543 1.00 0.00 H new ATOM 1437 N GLN A 96 -1.919 -0.989 -16.117 1.00 0.00 N ATOM 1438 CA GLN A 96 -1.056 -0.432 -17.197 1.00 0.00 C ATOM 1439 C GLN A 96 -1.958 -0.051 -18.419 1.00 0.00 C ATOM 1440 O GLN A 96 -2.348 -0.919 -19.209 1.00 0.00 O ATOM 1441 CB GLN A 96 0.004 -1.531 -17.481 1.00 0.00 C ATOM 1442 CG GLN A 96 1.062 -1.269 -18.582 1.00 0.00 C ATOM 1443 CD GLN A 96 1.883 -2.489 -19.033 1.00 0.00 C ATOM 1444 OE1 GLN A 96 1.809 -3.594 -18.494 1.00 0.00 O ATOM 1445 NE2 GLN A 96 2.701 -2.332 -20.044 1.00 0.00 N ATOM 0 H GLN A 96 -2.029 -2.002 -16.165 1.00 0.00 H new ATOM 0 HA GLN A 96 -0.536 0.490 -16.935 1.00 0.00 H new ATOM 0 HB2 GLN A 96 0.536 -1.727 -16.550 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -0.528 -2.445 -17.743 1.00 0.00 H new ATOM 0 HG2 GLN A 96 0.555 -0.855 -19.454 1.00 0.00 H new ATOM 0 HG3 GLN A 96 1.751 -0.506 -18.221 1.00 0.00 H new ATOM 0 HE21 GLN A 96 2.776 -1.424 -20.503 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.263 -3.117 -20.372 1.00 0.00 H new ATOM 1454 N HIS A 97 -2.323 1.240 -18.544 1.00 0.00 N ATOM 1455 CA HIS A 97 -3.261 1.714 -19.601 1.00 0.00 C ATOM 1456 C HIS A 97 -2.490 2.255 -20.843 1.00 0.00 C ATOM 1457 O HIS A 97 -2.143 3.436 -20.911 1.00 0.00 O ATOM 1458 CB HIS A 97 -4.182 2.769 -18.937 1.00 0.00 C ATOM 1459 CG HIS A 97 -5.389 3.207 -19.764 1.00 0.00 C ATOM 1460 ND1 HIS A 97 -5.464 4.337 -20.563 1.00 0.00 N ATOM 1461 CD2 HIS A 97 -6.528 2.416 -19.952 1.00 0.00 C ATOM 1462 CE1 HIS A 97 -6.641 4.098 -21.222 1.00 0.00 C ATOM 1463 NE2 HIS A 97 -7.373 2.995 -20.881 1.00 0.00 N ATOM 0 H HIS A 97 -1.986 1.980 -17.929 1.00 0.00 H new ATOM 0 HA HIS A 97 -3.869 0.899 -19.992 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.540 2.367 -17.989 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -3.585 3.651 -18.704 1.00 0.00 H new ATOM 0 HD1 HIS A 97 -4.822 5.126 -20.639 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -6.720 1.483 -19.443 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -6.984 4.768 -21.996 1.00 0.00 H new ATOM 0 HE2 HIS A 97 -8.285 2.686 -21.217 1.00 0.00 H new ATOM 1472 N GLN A 98 -2.252 1.366 -21.813 1.00 0.00 N ATOM 1473 CA GLN A 98 -1.444 1.654 -23.032 1.00 0.00 C ATOM 1474 C GLN A 98 -2.302 2.356 -24.131 1.00 0.00 C ATOM 1475 O GLN A 98 -3.324 1.808 -24.546 1.00 0.00 O ATOM 1476 CB GLN A 98 -0.878 0.315 -23.590 1.00 0.00 C ATOM 1477 CG GLN A 98 0.008 -0.525 -22.634 1.00 0.00 C ATOM 1478 CD GLN A 98 0.671 -1.740 -23.288 1.00 0.00 C ATOM 1479 OE1 GLN A 98 1.774 -1.687 -23.815 1.00 0.00 O ATOM 1480 NE2 GLN A 98 0.023 -2.879 -23.284 1.00 0.00 N ATOM 0 H GLN A 98 -2.613 0.412 -21.786 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.631 2.327 -22.759 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -1.719 -0.304 -23.905 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -0.295 0.539 -24.483 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.785 0.118 -22.220 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.603 -0.866 -21.798 1.00 0.00 H new ATOM 0 HE21 GLN A 98 -0.898 -2.941 -22.849 1.00 0.00 H new ATOM 0 HE22 GLN A 98 0.439 -3.704 -23.716 1.00 0.00 H new ATOM 1489 N GLU A 99 -1.891 3.544 -24.599 1.00 0.00 N ATOM 1490 CA GLU A 99 -2.700 4.370 -25.548 1.00 0.00 C ATOM 1491 C GLU A 99 -1.885 4.675 -26.844 1.00 0.00 C ATOM 1492 O GLU A 99 -0.805 5.275 -26.786 1.00 0.00 O ATOM 1493 CB GLU A 99 -3.091 5.693 -24.833 1.00 0.00 C ATOM 1494 CG GLU A 99 -4.081 5.553 -23.647 1.00 0.00 C ATOM 1495 CD GLU A 99 -4.068 6.716 -22.668 1.00 0.00 C ATOM 1496 OE1 GLU A 99 -4.065 7.891 -23.094 1.00 0.00 O ATOM 1497 OE2 GLU A 99 -4.053 6.459 -21.445 1.00 0.00 O ATOM 0 H GLU A 99 -1.000 3.968 -24.342 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.597 3.823 -25.840 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -2.181 6.169 -24.468 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -3.529 6.366 -25.570 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -5.090 5.442 -24.045 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -3.849 4.636 -23.104 1.00 0.00 H new ATOM 1504 N TRP A 100 -2.390 4.284 -28.028 1.00 0.00 N ATOM 1505 CA TRP A 100 -1.688 4.538 -29.321 1.00 0.00 C ATOM 1506 C TRP A 100 -2.696 4.694 -30.501 1.00 0.00 C ATOM 1507 O TRP A 100 -3.498 3.790 -30.751 1.00 0.00 O ATOM 1508 CB TRP A 100 -0.585 3.463 -29.598 1.00 0.00 C ATOM 1509 CG TRP A 100 -1.040 2.054 -30.030 1.00 0.00 C ATOM 1510 CD1 TRP A 100 -1.112 1.601 -31.366 1.00 0.00 C ATOM 1511 CD2 TRP A 100 -1.610 1.050 -29.268 1.00 0.00 C ATOM 1512 NE1 TRP A 100 -1.759 0.352 -31.463 1.00 0.00 N ATOM 1513 CE2 TRP A 100 -2.059 0.033 -30.149 1.00 0.00 C ATOM 1514 CE3 TRP A 100 -1.838 0.940 -27.872 1.00 0.00 C ATOM 1515 CZ2 TRP A 100 -2.752 -1.090 -29.641 1.00 0.00 C ATOM 1516 CZ3 TRP A 100 -2.529 -0.167 -27.398 1.00 0.00 C ATOM 1517 CH2 TRP A 100 -2.993 -1.162 -28.266 1.00 0.00 C ATOM 0 H TRP A 100 -3.278 3.792 -28.127 1.00 0.00 H new ATOM 0 HA TRP A 100 -1.169 5.493 -29.236 1.00 0.00 H new ATOM 0 HB2 TRP A 100 0.075 3.853 -30.373 1.00 0.00 H new ATOM 0 HB3 TRP A 100 0.014 3.358 -28.693 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -0.719 2.146 -32.212 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -1.959 -0.190 -32.304 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -1.482 1.701 -27.193 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -3.088 -1.876 -30.302 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -2.712 -0.262 -26.338 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -3.546 -1.999 -27.867 1.00 0.00 H new ATOM 1528 N ASP A 101 -2.612 5.794 -31.284 1.00 0.00 N ATOM 1529 CA ASP A 101 -3.254 5.890 -32.641 1.00 0.00 C ATOM 1530 C ASP A 101 -4.798 5.545 -32.699 1.00 0.00 C ATOM 1531 O ASP A 101 -5.250 4.698 -33.479 1.00 0.00 O ATOM 1532 CB ASP A 101 -2.261 5.148 -33.596 1.00 0.00 C ATOM 1533 CG ASP A 101 -2.642 4.939 -35.061 1.00 0.00 C ATOM 1534 OD1 ASP A 101 -3.058 5.900 -35.733 1.00 0.00 O ATOM 1535 OD2 ASP A 101 -2.566 3.778 -35.532 1.00 0.00 O ATOM 0 H ASP A 101 -2.107 6.637 -31.009 1.00 0.00 H new ATOM 0 HA ASP A 101 -3.371 6.917 -32.988 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -1.319 5.696 -33.578 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -2.066 4.166 -33.166 1.00 0.00 H new ATOM 1540 N GLY A 102 -5.600 6.155 -31.798 1.00 0.00 N ATOM 1541 CA GLY A 102 -7.024 5.745 -31.582 1.00 0.00 C ATOM 1542 C GLY A 102 -7.352 4.371 -30.918 1.00 0.00 C ATOM 1543 O GLY A 102 -8.531 4.049 -30.771 1.00 0.00 O ATOM 0 H GLY A 102 -5.297 6.929 -31.207 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -7.495 6.518 -30.975 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -7.516 5.760 -32.555 1.00 0.00 H new ATOM 1547 N LYS A 103 -6.344 3.565 -30.543 1.00 0.00 N ATOM 1548 CA LYS A 103 -6.502 2.176 -30.030 1.00 0.00 C ATOM 1549 C LYS A 103 -5.841 2.053 -28.615 1.00 0.00 C ATOM 1550 O LYS A 103 -4.802 2.671 -28.346 1.00 0.00 O ATOM 1551 CB LYS A 103 -5.814 1.199 -31.034 1.00 0.00 C ATOM 1552 CG LYS A 103 -6.423 1.152 -32.464 1.00 0.00 C ATOM 1553 CD LYS A 103 -5.608 0.409 -33.524 1.00 0.00 C ATOM 1554 CE LYS A 103 -4.381 1.179 -34.023 1.00 0.00 C ATOM 1555 NZ LYS A 103 -4.678 2.368 -34.879 1.00 0.00 N ATOM 0 H LYS A 103 -5.369 3.861 -30.586 1.00 0.00 H new ATOM 0 HA LYS A 103 -7.559 1.927 -29.938 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -4.763 1.475 -31.117 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -5.847 0.194 -30.613 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -7.407 0.688 -32.402 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.575 2.176 -32.805 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -5.282 -0.546 -33.112 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -6.254 0.186 -34.373 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -3.803 1.509 -33.159 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -3.748 0.495 -34.587 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -3.798 2.709 -35.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -5.354 2.100 -35.623 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -5.089 3.123 -34.294 1.00 0.00 H new ATOM 1569 N GLU A 104 -6.414 1.237 -27.706 1.00 0.00 N ATOM 1570 CA GLU A 104 -5.882 1.094 -26.319 1.00 0.00 C ATOM 1571 C GLU A 104 -5.745 -0.377 -25.801 1.00 0.00 C ATOM 1572 O GLU A 104 -6.173 -1.356 -26.421 1.00 0.00 O ATOM 1573 CB GLU A 104 -6.635 2.057 -25.354 1.00 0.00 C ATOM 1574 CG GLU A 104 -8.101 1.699 -24.985 1.00 0.00 C ATOM 1575 CD GLU A 104 -8.591 2.401 -23.732 1.00 0.00 C ATOM 1576 OE1 GLU A 104 -8.656 3.647 -23.711 1.00 0.00 O ATOM 1577 OE2 GLU A 104 -8.832 1.718 -22.714 1.00 0.00 O ATOM 0 H GLU A 104 -7.239 0.668 -27.897 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.838 1.407 -26.348 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.062 2.123 -24.429 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -6.634 3.051 -25.802 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -8.753 1.961 -25.819 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -8.180 0.621 -24.844 1.00 0.00 H new ATOM 1584 N SER A 105 -5.074 -0.534 -24.647 1.00 0.00 N ATOM 1585 CA SER A 105 -4.893 -1.847 -23.979 1.00 0.00 C ATOM 1586 C SER A 105 -4.687 -1.686 -22.449 1.00 0.00 C ATOM 1587 O SER A 105 -3.745 -1.032 -21.991 1.00 0.00 O ATOM 1588 CB SER A 105 -3.750 -2.640 -24.654 1.00 0.00 C ATOM 1589 OG SER A 105 -4.318 -3.525 -25.614 1.00 0.00 O ATOM 0 H SER A 105 -4.640 0.241 -24.146 1.00 0.00 H new ATOM 0 HA SER A 105 -5.808 -2.427 -24.100 1.00 0.00 H new ATOM 0 HB2 SER A 105 -3.049 -1.958 -25.136 1.00 0.00 H new ATOM 0 HB3 SER A 105 -3.187 -3.201 -23.908 1.00 0.00 H new ATOM 0 HG SER A 105 -4.153 -4.452 -25.342 1.00 0.00 H new ATOM 1595 N THR A 106 -5.573 -2.311 -21.661 1.00 0.00 N ATOM 1596 CA THR A 106 -5.622 -2.125 -20.181 1.00 0.00 C ATOM 1597 C THR A 106 -5.126 -3.440 -19.509 1.00 0.00 C ATOM 1598 O THR A 106 -5.893 -4.411 -19.462 1.00 0.00 O ATOM 1599 CB THR A 106 -7.029 -1.654 -19.650 1.00 0.00 C ATOM 1600 OG1 THR A 106 -7.841 -2.745 -19.228 1.00 0.00 O ATOM 1601 CG2 THR A 106 -7.922 -0.827 -20.597 1.00 0.00 C ATOM 0 H THR A 106 -6.277 -2.958 -22.016 1.00 0.00 H new ATOM 0 HA THR A 106 -4.959 -1.305 -19.907 1.00 0.00 H new ATOM 0 HB THR A 106 -6.711 -0.999 -18.839 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.443 -3.587 -19.535 1.00 0.00 H new ATOM 0 HG21 THR A 106 -8.855 -0.578 -20.092 1.00 0.00 H new ATOM 0 HG22 THR A 106 -7.404 0.091 -20.877 1.00 0.00 H new ATOM 0 HG23 THR A 106 -8.139 -1.409 -21.493 1.00 0.00 H new ATOM 1609 N ILE A 107 -3.883 -3.480 -18.993 1.00 0.00 N ATOM 1610 CA ILE A 107 -3.318 -4.713 -18.359 1.00 0.00 C ATOM 1611 C ILE A 107 -3.544 -4.609 -16.810 1.00 0.00 C ATOM 1612 O ILE A 107 -2.805 -3.902 -16.113 1.00 0.00 O ATOM 1613 CB ILE A 107 -1.812 -4.981 -18.742 1.00 0.00 C ATOM 1614 CG1 ILE A 107 -1.336 -4.622 -20.184 1.00 0.00 C ATOM 1615 CG2 ILE A 107 -1.369 -6.415 -18.369 1.00 0.00 C ATOM 1616 CD1 ILE A 107 -2.022 -5.358 -21.346 1.00 0.00 C ATOM 0 H ILE A 107 -3.245 -2.684 -18.996 1.00 0.00 H new ATOM 0 HA ILE A 107 -3.843 -5.585 -18.748 1.00 0.00 H new ATOM 0 HB ILE A 107 -1.302 -4.241 -18.125 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -1.476 -3.551 -20.331 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -0.265 -4.815 -20.246 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -0.326 -6.558 -18.650 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -1.479 -6.562 -17.295 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -1.990 -7.137 -18.899 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -1.600 -5.018 -22.292 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -1.861 -6.431 -21.242 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -3.091 -5.148 -21.329 1.00 0.00 H new ATOM 1628 N THR A 108 -4.576 -5.296 -16.289 1.00 0.00 N ATOM 1629 CA THR A 108 -5.069 -5.101 -14.892 1.00 0.00 C ATOM 1630 C THR A 108 -4.499 -6.215 -13.957 1.00 0.00 C ATOM 1631 O THR A 108 -4.994 -7.344 -13.929 1.00 0.00 O ATOM 1632 CB THR A 108 -6.630 -5.044 -14.930 1.00 0.00 C ATOM 1633 OG1 THR A 108 -7.065 -3.947 -15.731 1.00 0.00 O ATOM 1634 CG2 THR A 108 -7.315 -4.851 -13.569 1.00 0.00 C ATOM 0 H THR A 108 -5.097 -6.000 -16.812 1.00 0.00 H new ATOM 0 HA THR A 108 -4.714 -4.160 -14.471 1.00 0.00 H new ATOM 0 HB THR A 108 -6.912 -6.019 -15.326 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.045 -3.923 -15.748 1.00 0.00 H new ATOM 0 HG21 THR A 108 -8.396 -4.825 -13.706 1.00 0.00 H new ATOM 0 HG22 THR A 108 -7.053 -5.678 -12.909 1.00 0.00 H new ATOM 0 HG23 THR A 108 -6.983 -3.913 -13.124 1.00 0.00 H new ATOM 1642 N ARG A 109 -3.459 -5.880 -13.179 1.00 0.00 N ATOM 1643 CA ARG A 109 -2.768 -6.833 -12.267 1.00 0.00 C ATOM 1644 C ARG A 109 -3.376 -6.765 -10.830 1.00 0.00 C ATOM 1645 O ARG A 109 -3.160 -5.774 -10.122 1.00 0.00 O ATOM 1646 CB ARG A 109 -1.257 -6.448 -12.243 1.00 0.00 C ATOM 1647 CG ARG A 109 -0.439 -6.690 -13.535 1.00 0.00 C ATOM 1648 CD ARG A 109 0.982 -6.096 -13.453 1.00 0.00 C ATOM 1649 NE ARG A 109 1.779 -6.373 -14.686 1.00 0.00 N ATOM 1650 CZ ARG A 109 1.766 -5.629 -15.794 1.00 0.00 C ATOM 1651 NH1 ARG A 109 0.938 -4.638 -15.992 1.00 0.00 N ATOM 1652 NH2 ARG A 109 2.615 -5.894 -16.743 1.00 0.00 N ATOM 0 H ARG A 109 -3.064 -4.940 -13.157 1.00 0.00 H new ATOM 0 HA ARG A 109 -2.895 -7.856 -12.622 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -1.183 -5.390 -11.991 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -0.781 -7.003 -11.434 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -0.371 -7.761 -13.723 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -0.965 -6.250 -14.382 1.00 0.00 H new ATOM 0 HD2 ARG A 109 0.916 -5.019 -13.299 1.00 0.00 H new ATOM 0 HD3 ARG A 109 1.498 -6.511 -12.587 1.00 0.00 H new ATOM 0 HE ARG A 109 2.381 -7.196 -14.681 1.00 0.00 H new ATOM 0 HH11 ARG A 109 0.252 -4.396 -15.277 1.00 0.00 H new ATOM 0 HH12 ARG A 109 0.978 -4.106 -16.861 1.00 0.00 H new ATOM 0 HH21 ARG A 109 3.278 -6.661 -16.634 1.00 0.00 H new ATOM 0 HH22 ARG A 109 2.618 -5.335 -17.596 1.00 0.00 H new ATOM 1666 N LYS A 110 -4.108 -7.801 -10.376 1.00 0.00 N ATOM 1667 CA LYS A 110 -4.636 -7.859 -8.978 1.00 0.00 C ATOM 1668 C LYS A 110 -4.212 -9.161 -8.225 1.00 0.00 C ATOM 1669 O LYS A 110 -4.134 -10.250 -8.802 1.00 0.00 O ATOM 1670 CB LYS A 110 -6.164 -7.575 -8.931 1.00 0.00 C ATOM 1671 CG LYS A 110 -7.133 -8.613 -9.554 1.00 0.00 C ATOM 1672 CD LYS A 110 -8.593 -8.363 -9.101 1.00 0.00 C ATOM 1673 CE LYS A 110 -9.635 -9.343 -9.677 1.00 0.00 C ATOM 1674 NZ LYS A 110 -10.023 -8.952 -11.057 1.00 0.00 N ATOM 0 H LYS A 110 -4.352 -8.611 -10.946 1.00 0.00 H new ATOM 0 HA LYS A 110 -4.163 -7.051 -8.420 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -6.444 -7.447 -7.886 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -6.338 -6.620 -9.427 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -7.074 -8.562 -10.641 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -6.827 -9.618 -9.265 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -8.633 -8.413 -8.013 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -8.876 -7.349 -9.384 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -9.226 -10.353 -9.682 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -10.517 -9.359 -9.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -10.660 -9.671 -11.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -10.510 -8.033 -11.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -9.171 -8.877 -11.649 1.00 0.00 H new ATOM 1688 N LEU A 111 -3.955 -9.046 -6.910 1.00 0.00 N ATOM 1689 CA LEU A 111 -3.572 -10.203 -6.055 1.00 0.00 C ATOM 1690 C LEU A 111 -4.834 -10.989 -5.589 1.00 0.00 C ATOM 1691 O LEU A 111 -5.740 -10.408 -4.980 1.00 0.00 O ATOM 1692 CB LEU A 111 -2.724 -9.694 -4.846 1.00 0.00 C ATOM 1693 CG LEU A 111 -1.418 -10.462 -4.515 1.00 0.00 C ATOM 1694 CD1 LEU A 111 -1.639 -11.925 -4.093 1.00 0.00 C ATOM 1695 CD2 LEU A 111 -0.403 -10.385 -5.664 1.00 0.00 C ATOM 0 H LEU A 111 -4.004 -8.161 -6.406 1.00 0.00 H new ATOM 0 HA LEU A 111 -2.963 -10.898 -6.634 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.464 -8.652 -5.032 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.358 -9.710 -3.960 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.007 -9.949 -3.645 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.677 -12.391 -3.879 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -2.264 -11.956 -3.200 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -2.133 -12.466 -4.900 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.497 -10.936 -5.392 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -0.837 -10.822 -6.563 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -0.147 -9.343 -5.854 1.00 0.00 H new ATOM 1707 N LYS A 112 -4.901 -12.296 -5.890 1.00 0.00 N ATOM 1708 CA LYS A 112 -6.078 -13.134 -5.528 1.00 0.00 C ATOM 1709 C LYS A 112 -5.617 -14.366 -4.693 1.00 0.00 C ATOM 1710 O LYS A 112 -5.077 -14.192 -3.596 1.00 0.00 O ATOM 1711 CB LYS A 112 -6.919 -13.314 -6.828 1.00 0.00 C ATOM 1712 CG LYS A 112 -8.349 -13.863 -6.631 1.00 0.00 C ATOM 1713 CD LYS A 112 -9.086 -13.977 -7.983 1.00 0.00 C ATOM 1714 CE LYS A 112 -10.355 -14.844 -7.972 1.00 0.00 C ATOM 1715 NZ LYS A 112 -10.022 -16.297 -7.942 1.00 0.00 N ATOM 0 H LYS A 112 -4.163 -12.802 -6.380 1.00 0.00 H new ATOM 0 HA LYS A 112 -6.785 -12.689 -4.828 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -6.986 -12.350 -7.331 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -6.381 -13.986 -7.497 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -8.305 -14.841 -6.153 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -8.906 -13.206 -5.963 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -9.354 -12.975 -8.317 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -8.395 -14.384 -8.721 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -10.963 -14.591 -7.103 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -10.955 -14.625 -8.855 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -10.891 -16.850 -7.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -9.582 -16.571 -8.844 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -9.360 -16.485 -7.162 1.00 0.00 H new ATOM 1729 N ASP A 113 -5.842 -15.596 -5.173 1.00 0.00 N ATOM 1730 CA ASP A 113 -5.715 -16.831 -4.338 1.00 0.00 C ATOM 1731 C ASP A 113 -4.240 -17.356 -4.257 1.00 0.00 C ATOM 1732 O ASP A 113 -3.876 -18.389 -4.831 1.00 0.00 O ATOM 1733 CB ASP A 113 -6.719 -17.888 -4.880 1.00 0.00 C ATOM 1734 CG ASP A 113 -8.199 -17.505 -4.818 1.00 0.00 C ATOM 1735 OD1 ASP A 113 -8.765 -17.435 -3.711 1.00 0.00 O ATOM 1736 OD2 ASP A 113 -8.789 -17.241 -5.889 1.00 0.00 O ATOM 0 H ASP A 113 -6.115 -15.779 -6.139 1.00 0.00 H new ATOM 0 HA ASP A 113 -5.970 -16.602 -3.303 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -6.464 -18.103 -5.918 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -6.580 -18.812 -4.319 1.00 0.00 H new ATOM 1741 N GLY A 114 -3.365 -16.588 -3.579 1.00 0.00 N ATOM 1742 CA GLY A 114 -1.888 -16.800 -3.663 1.00 0.00 C ATOM 1743 C GLY A 114 -1.122 -16.353 -4.941 1.00 0.00 C ATOM 1744 O GLY A 114 0.110 -16.332 -4.922 1.00 0.00 O ATOM 0 H GLY A 114 -3.642 -15.819 -2.969 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -1.435 -16.287 -2.815 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -1.703 -17.865 -3.527 1.00 0.00 H new ATOM 1748 N LYS A 115 -1.820 -16.043 -6.046 1.00 0.00 N ATOM 1749 CA LYS A 115 -1.203 -15.730 -7.363 1.00 0.00 C ATOM 1750 C LYS A 115 -1.693 -14.332 -7.874 1.00 0.00 C ATOM 1751 O LYS A 115 -2.746 -13.806 -7.483 1.00 0.00 O ATOM 1752 CB LYS A 115 -1.494 -16.890 -8.368 1.00 0.00 C ATOM 1753 CG LYS A 115 -0.865 -18.266 -8.013 1.00 0.00 C ATOM 1754 CD LYS A 115 -1.048 -19.326 -9.126 1.00 0.00 C ATOM 1755 CE LYS A 115 -0.789 -20.796 -8.722 1.00 0.00 C ATOM 1756 NZ LYS A 115 0.626 -21.113 -8.383 1.00 0.00 N ATOM 0 H LYS A 115 -2.839 -16.000 -6.059 1.00 0.00 H new ATOM 0 HA LYS A 115 -0.120 -15.658 -7.263 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.574 -17.015 -8.447 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -1.135 -16.591 -9.353 1.00 0.00 H new ATOM 0 HG2 LYS A 115 0.199 -18.132 -7.819 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -1.313 -18.636 -7.091 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -2.067 -19.250 -9.506 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -0.380 -19.075 -9.950 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -1.416 -21.037 -7.864 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -1.105 -21.443 -9.540 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 0.680 -22.070 -7.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 1.208 -21.065 -9.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 0.979 -20.425 -7.688 1.00 0.00 H new ATOM 1770 N LEU A 116 -0.907 -13.727 -8.779 1.00 0.00 N ATOM 1771 CA LEU A 116 -1.273 -12.456 -9.452 1.00 0.00 C ATOM 1772 C LEU A 116 -2.178 -12.759 -10.693 1.00 0.00 C ATOM 1773 O LEU A 116 -1.731 -13.341 -11.689 1.00 0.00 O ATOM 1774 CB LEU A 116 0.064 -11.748 -9.799 1.00 0.00 C ATOM 1775 CG LEU A 116 -0.034 -10.300 -10.341 1.00 0.00 C ATOM 1776 CD1 LEU A 116 -0.296 -9.281 -9.218 1.00 0.00 C ATOM 1777 CD2 LEU A 116 1.261 -9.926 -11.079 1.00 0.00 C ATOM 0 H LEU A 116 -0.002 -14.098 -9.069 1.00 0.00 H new ATOM 0 HA LEU A 116 -1.866 -11.792 -8.823 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.684 -11.734 -8.903 1.00 0.00 H new ATOM 0 HB3 LEU A 116 0.587 -12.353 -10.539 1.00 0.00 H new ATOM 0 HG LEU A 116 -0.879 -10.267 -11.029 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -0.357 -8.279 -9.643 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -1.235 -9.522 -8.720 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.519 -9.319 -8.495 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.183 -8.906 -11.457 1.00 0.00 H new ATOM 0 HD22 LEU A 116 2.104 -9.995 -10.392 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.415 -10.611 -11.913 1.00 0.00 H new ATOM 1789 N VAL A 117 -3.461 -12.371 -10.608 1.00 0.00 N ATOM 1790 CA VAL A 117 -4.449 -12.553 -11.713 1.00 0.00 C ATOM 1791 C VAL A 117 -4.396 -11.273 -12.609 1.00 0.00 C ATOM 1792 O VAL A 117 -4.705 -10.160 -12.166 1.00 0.00 O ATOM 1793 CB VAL A 117 -5.868 -12.908 -11.142 1.00 0.00 C ATOM 1794 CG1 VAL A 117 -6.978 -12.970 -12.218 1.00 0.00 C ATOM 1795 CG2 VAL A 117 -5.870 -14.276 -10.415 1.00 0.00 C ATOM 0 H VAL A 117 -3.853 -11.923 -9.780 1.00 0.00 H new ATOM 0 HA VAL A 117 -4.201 -13.405 -12.346 1.00 0.00 H new ATOM 0 HB VAL A 117 -6.084 -12.092 -10.452 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -7.928 -13.220 -11.746 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -7.062 -12.001 -12.711 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.727 -13.732 -12.956 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -6.870 -14.484 -10.035 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -5.577 -15.060 -11.114 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -5.165 -14.248 -9.584 1.00 0.00 H new ATOM 1805 N VAL A 118 -3.948 -11.454 -13.861 1.00 0.00 N ATOM 1806 CA VAL A 118 -3.566 -10.333 -14.764 1.00 0.00 C ATOM 1807 C VAL A 118 -4.544 -10.328 -15.977 1.00 0.00 C ATOM 1808 O VAL A 118 -4.395 -11.094 -16.936 1.00 0.00 O ATOM 1809 CB VAL A 118 -2.054 -10.441 -15.160 1.00 0.00 C ATOM 1810 CG1 VAL A 118 -1.598 -9.310 -16.108 1.00 0.00 C ATOM 1811 CG2 VAL A 118 -1.103 -10.454 -13.943 1.00 0.00 C ATOM 0 H VAL A 118 -3.837 -12.375 -14.284 1.00 0.00 H new ATOM 0 HA VAL A 118 -3.661 -9.369 -14.264 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.989 -11.399 -15.676 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.542 -9.439 -16.347 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.184 -9.346 -17.026 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -1.745 -8.346 -15.621 1.00 0.00 H new ATOM 0 HG21 VAL A 118 -0.072 -10.530 -14.288 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -1.228 -9.533 -13.374 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.337 -11.308 -13.307 1.00 0.00 H new ATOM 1821 N GLU A 119 -5.544 -9.444 -15.923 1.00 0.00 N ATOM 1822 CA GLU A 119 -6.667 -9.421 -16.891 1.00 0.00 C ATOM 1823 C GLU A 119 -6.399 -8.323 -17.964 1.00 0.00 C ATOM 1824 O GLU A 119 -6.433 -7.123 -17.665 1.00 0.00 O ATOM 1825 CB GLU A 119 -7.968 -9.205 -16.070 1.00 0.00 C ATOM 1826 CG GLU A 119 -8.339 -10.385 -15.124 1.00 0.00 C ATOM 1827 CD GLU A 119 -8.981 -9.985 -13.812 1.00 0.00 C ATOM 1828 OE1 GLU A 119 -8.289 -9.390 -12.957 1.00 0.00 O ATOM 1829 OE2 GLU A 119 -10.171 -10.284 -13.586 1.00 0.00 O ATOM 0 H GLU A 119 -5.607 -8.719 -15.209 1.00 0.00 H new ATOM 0 HA GLU A 119 -6.770 -10.353 -17.446 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -7.860 -8.299 -15.474 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.794 -9.036 -16.760 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -9.018 -11.053 -15.653 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -7.435 -10.954 -14.909 1.00 0.00 H new ATOM 1836 N CYS A 120 -6.082 -8.734 -19.206 1.00 0.00 N ATOM 1837 CA CYS A 120 -5.765 -7.778 -20.300 1.00 0.00 C ATOM 1838 C CYS A 120 -6.946 -7.628 -21.301 1.00 0.00 C ATOM 1839 O CYS A 120 -7.393 -8.615 -21.896 1.00 0.00 O ATOM 1840 CB CYS A 120 -4.430 -8.167 -20.969 1.00 0.00 C ATOM 1841 SG CYS A 120 -4.616 -9.393 -22.262 1.00 0.00 S ATOM 0 H CYS A 120 -6.037 -9.715 -19.483 1.00 0.00 H new ATOM 0 HA CYS A 120 -5.631 -6.783 -19.875 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -3.968 -7.273 -21.389 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -3.749 -8.551 -20.209 1.00 0.00 H new ATOM 0 HG CYS A 120 -4.794 -10.564 -21.727 1.00 0.00 H new ATOM 1846 N VAL A 121 -7.439 -6.393 -21.490 1.00 0.00 N ATOM 1847 CA VAL A 121 -8.514 -6.092 -22.484 1.00 0.00 C ATOM 1848 C VAL A 121 -8.047 -4.998 -23.496 1.00 0.00 C ATOM 1849 O VAL A 121 -7.475 -3.971 -23.115 1.00 0.00 O ATOM 1850 CB VAL A 121 -9.886 -5.799 -21.785 1.00 0.00 C ATOM 1851 CG1 VAL A 121 -9.935 -4.543 -20.890 1.00 0.00 C ATOM 1852 CG2 VAL A 121 -11.064 -5.731 -22.785 1.00 0.00 C ATOM 0 H VAL A 121 -7.117 -5.576 -20.971 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.699 -6.982 -23.085 1.00 0.00 H new ATOM 0 HB VAL A 121 -9.991 -6.661 -21.127 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -10.931 -4.441 -20.460 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -9.202 -4.638 -20.089 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -9.706 -3.661 -21.488 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -11.988 -5.526 -22.245 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -10.882 -4.936 -23.508 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -11.153 -6.683 -23.308 1.00 0.00 H new ATOM 1862 N MET A 122 -8.338 -5.220 -24.792 1.00 0.00 N ATOM 1863 CA MET A 122 -8.201 -4.168 -25.841 1.00 0.00 C ATOM 1864 C MET A 122 -9.495 -3.292 -25.925 1.00 0.00 C ATOM 1865 O MET A 122 -9.509 -2.167 -25.424 1.00 0.00 O ATOM 1866 CB MET A 122 -7.699 -4.846 -27.152 1.00 0.00 C ATOM 1867 CG MET A 122 -7.503 -3.877 -28.335 1.00 0.00 C ATOM 1868 SD MET A 122 -6.404 -4.580 -29.577 1.00 0.00 S ATOM 1869 CE MET A 122 -5.922 -3.059 -30.419 1.00 0.00 C ATOM 0 H MET A 122 -8.670 -6.117 -25.147 1.00 0.00 H new ATOM 0 HA MET A 122 -7.439 -3.427 -25.597 1.00 0.00 H new ATOM 0 HB2 MET A 122 -6.753 -5.347 -26.948 1.00 0.00 H new ATOM 0 HB3 MET A 122 -8.412 -5.617 -27.444 1.00 0.00 H new ATOM 0 HG2 MET A 122 -8.469 -3.650 -28.787 1.00 0.00 H new ATOM 0 HG3 MET A 122 -7.091 -2.935 -27.973 1.00 0.00 H new ATOM 0 HE1 MET A 122 -5.233 -3.295 -31.230 1.00 0.00 H new ATOM 0 HE2 MET A 122 -6.808 -2.571 -30.825 1.00 0.00 H new ATOM 0 HE3 MET A 122 -5.433 -2.390 -29.711 1.00 0.00 H new ATOM 1879 N ASN A 123 -10.572 -3.816 -26.532 1.00 0.00 N ATOM 1880 CA ASN A 123 -11.940 -3.226 -26.436 1.00 0.00 C ATOM 1881 C ASN A 123 -12.928 -4.342 -25.965 1.00 0.00 C ATOM 1882 O ASN A 123 -13.335 -4.348 -24.802 1.00 0.00 O ATOM 1883 CB ASN A 123 -12.330 -2.509 -27.764 1.00 0.00 C ATOM 1884 CG ASN A 123 -11.743 -1.106 -27.962 1.00 0.00 C ATOM 1885 OD1 ASN A 123 -12.381 -0.096 -27.691 1.00 0.00 O ATOM 1886 ND2 ASN A 123 -10.534 -0.985 -28.453 1.00 0.00 N ATOM 0 H ASN A 123 -10.531 -4.659 -27.105 1.00 0.00 H new ATOM 0 HA ASN A 123 -11.982 -2.435 -25.687 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -12.015 -3.135 -28.599 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -13.417 -2.438 -27.811 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -10.136 -0.058 -28.605 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -9.991 -1.817 -28.683 1.00 0.00 H new ATOM 1893 N ASN A 124 -13.270 -5.306 -26.839 1.00 0.00 N ATOM 1894 CA ASN A 124 -14.065 -6.517 -26.458 1.00 0.00 C ATOM 1895 C ASN A 124 -13.226 -7.761 -25.988 1.00 0.00 C ATOM 1896 O ASN A 124 -13.735 -8.569 -25.208 1.00 0.00 O ATOM 1897 CB ASN A 124 -14.992 -6.903 -27.646 1.00 0.00 C ATOM 1898 CG ASN A 124 -16.119 -5.907 -27.954 1.00 0.00 C ATOM 1899 OD1 ASN A 124 -17.020 -5.681 -27.155 1.00 0.00 O ATOM 1900 ND2 ASN A 124 -16.120 -5.286 -29.110 1.00 0.00 N ATOM 0 H ASN A 124 -13.012 -5.281 -27.825 1.00 0.00 H new ATOM 0 HA ASN A 124 -14.639 -6.234 -25.576 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -14.379 -7.019 -28.540 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -15.437 -7.875 -27.436 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -16.864 -4.625 -29.333 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -15.376 -5.464 -29.785 1.00 0.00 H new ATOM 1907 N VAL A 125 -11.986 -7.961 -26.480 1.00 0.00 N ATOM 1908 CA VAL A 125 -11.232 -9.241 -26.321 1.00 0.00 C ATOM 1909 C VAL A 125 -10.474 -9.266 -24.949 1.00 0.00 C ATOM 1910 O VAL A 125 -9.462 -8.580 -24.769 1.00 0.00 O ATOM 1911 CB VAL A 125 -10.302 -9.449 -27.567 1.00 0.00 C ATOM 1912 CG1 VAL A 125 -9.443 -10.729 -27.484 1.00 0.00 C ATOM 1913 CG2 VAL A 125 -11.057 -9.534 -28.917 1.00 0.00 C ATOM 0 H VAL A 125 -11.473 -7.248 -26.998 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.916 -10.089 -26.290 1.00 0.00 H new ATOM 0 HB VAL A 125 -9.679 -8.555 -27.539 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -8.824 -10.811 -28.378 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -8.803 -10.681 -26.603 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -10.094 -11.600 -27.413 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -10.341 -9.678 -29.726 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -11.751 -10.374 -28.893 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -11.611 -8.610 -29.083 1.00 0.00 H new ATOM 1923 N THR A 126 -10.979 -10.077 -24.002 1.00 0.00 N ATOM 1924 CA THR A 126 -10.445 -10.152 -22.609 1.00 0.00 C ATOM 1925 C THR A 126 -9.614 -11.460 -22.387 1.00 0.00 C ATOM 1926 O THR A 126 -10.190 -12.560 -22.327 1.00 0.00 O ATOM 1927 CB THR A 126 -11.604 -10.106 -21.561 1.00 0.00 C ATOM 1928 OG1 THR A 126 -12.469 -11.228 -21.728 1.00 0.00 O ATOM 1929 CG2 THR A 126 -12.479 -8.844 -21.566 1.00 0.00 C ATOM 0 H THR A 126 -11.767 -10.702 -24.169 1.00 0.00 H new ATOM 0 HA THR A 126 -9.795 -9.288 -22.471 1.00 0.00 H new ATOM 0 HB THR A 126 -11.079 -10.113 -20.606 1.00 0.00 H new ATOM 0 HG1 THR A 126 -11.933 -12.038 -21.858 1.00 0.00 H new ATOM 0 HG21 THR A 126 -13.246 -8.930 -20.797 1.00 0.00 H new ATOM 0 HG22 THR A 126 -11.859 -7.971 -21.364 1.00 0.00 H new ATOM 0 HG23 THR A 126 -12.954 -8.734 -22.541 1.00 0.00 H new ATOM 1937 N CYS A 127 -8.292 -11.334 -22.176 1.00 0.00 N ATOM 1938 CA CYS A 127 -7.452 -12.457 -21.671 1.00 0.00 C ATOM 1939 C CYS A 127 -7.425 -12.524 -20.109 1.00 0.00 C ATOM 1940 O CYS A 127 -7.601 -11.510 -19.422 1.00 0.00 O ATOM 1941 CB CYS A 127 -6.026 -12.374 -22.277 1.00 0.00 C ATOM 1942 SG CYS A 127 -4.799 -11.738 -21.108 1.00 0.00 S ATOM 0 H CYS A 127 -7.774 -10.471 -22.344 1.00 0.00 H new ATOM 0 HA CYS A 127 -7.908 -13.391 -22.000 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -5.721 -13.365 -22.612 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -6.048 -11.732 -23.158 1.00 0.00 H new ATOM 0 HG CYS A 127 -4.499 -10.512 -21.419 1.00 0.00 H new ATOM 1947 N THR A 128 -7.121 -13.706 -19.547 1.00 0.00 N ATOM 1948 CA THR A 128 -6.769 -13.833 -18.099 1.00 0.00 C ATOM 1949 C THR A 128 -5.421 -14.606 -17.998 1.00 0.00 C ATOM 1950 O THR A 128 -5.350 -15.811 -18.259 1.00 0.00 O ATOM 1951 CB THR A 128 -7.915 -14.461 -17.249 1.00 0.00 C ATOM 1952 OG1 THR A 128 -9.137 -13.756 -17.452 1.00 0.00 O ATOM 1953 CG2 THR A 128 -7.651 -14.423 -15.736 1.00 0.00 C ATOM 0 H THR A 128 -7.108 -14.588 -20.058 1.00 0.00 H new ATOM 0 HA THR A 128 -6.641 -12.842 -17.663 1.00 0.00 H new ATOM 0 HB THR A 128 -7.971 -15.497 -17.583 1.00 0.00 H new ATOM 0 HG1 THR A 128 -9.845 -14.166 -16.912 1.00 0.00 H new ATOM 0 HG21 THR A 128 -8.490 -14.877 -15.209 1.00 0.00 H new ATOM 0 HG22 THR A 128 -6.739 -14.977 -15.512 1.00 0.00 H new ATOM 0 HG23 THR A 128 -7.536 -13.388 -15.413 1.00 0.00 H new ATOM 1961 N ARG A 129 -4.356 -13.886 -17.618 1.00 0.00 N ATOM 1962 CA ARG A 129 -3.014 -14.470 -17.385 1.00 0.00 C ATOM 1963 C ARG A 129 -2.781 -14.722 -15.865 1.00 0.00 C ATOM 1964 O ARG A 129 -2.862 -13.803 -15.045 1.00 0.00 O ATOM 1965 CB ARG A 129 -1.947 -13.508 -17.971 1.00 0.00 C ATOM 1966 CG ARG A 129 -1.824 -13.522 -19.512 1.00 0.00 C ATOM 1967 CD ARG A 129 -0.610 -12.761 -20.073 1.00 0.00 C ATOM 1968 NE ARG A 129 -0.861 -11.293 -20.110 1.00 0.00 N ATOM 1969 CZ ARG A 129 0.003 -10.382 -20.558 1.00 0.00 C ATOM 1970 NH1 ARG A 129 1.239 -10.660 -20.896 1.00 0.00 N ATOM 1971 NH2 ARG A 129 -0.397 -9.150 -20.667 1.00 0.00 N ATOM 0 H ARG A 129 -4.394 -12.879 -17.461 1.00 0.00 H new ATOM 0 HA ARG A 129 -2.937 -15.436 -17.884 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -2.181 -12.493 -17.650 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -0.977 -13.762 -17.543 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.772 -14.558 -19.848 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -2.731 -13.094 -19.938 1.00 0.00 H new ATOM 0 HD2 ARG A 129 0.266 -12.967 -19.459 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -0.386 -13.119 -21.078 1.00 0.00 H new ATOM 0 HE ARG A 129 -1.762 -10.960 -19.767 1.00 0.00 H new ATOM 0 HH11 ARG A 129 1.585 -11.617 -20.822 1.00 0.00 H new ATOM 0 HH12 ARG A 129 1.854 -9.920 -21.233 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -1.352 -8.900 -20.412 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.245 -8.434 -21.007 1.00 0.00 H new ATOM 1985 N ILE A 130 -2.462 -15.969 -15.493 1.00 0.00 N ATOM 1986 CA ILE A 130 -2.206 -16.349 -14.071 1.00 0.00 C ATOM 1987 C ILE A 130 -0.657 -16.379 -13.867 1.00 0.00 C ATOM 1988 O ILE A 130 0.039 -17.196 -14.482 1.00 0.00 O ATOM 1989 CB ILE A 130 -2.913 -17.705 -13.706 1.00 0.00 C ATOM 1990 CG1 ILE A 130 -4.438 -17.792 -14.034 1.00 0.00 C ATOM 1991 CG2 ILE A 130 -2.676 -18.135 -12.236 1.00 0.00 C ATOM 1992 CD1 ILE A 130 -5.370 -16.794 -13.326 1.00 0.00 C ATOM 0 H ILE A 130 -2.371 -16.744 -16.150 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.637 -15.619 -13.386 1.00 0.00 H new ATOM 0 HB ILE A 130 -2.418 -18.407 -14.377 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.560 -17.662 -15.109 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -4.778 -18.799 -13.794 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.189 -19.078 -12.045 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.608 -18.262 -12.062 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -3.065 -17.368 -11.566 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -6.398 -16.966 -13.645 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -5.298 -16.931 -12.247 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -5.076 -15.776 -13.583 1.00 0.00 H new ATOM 2004 N TYR A 131 -0.128 -15.497 -13.001 1.00 0.00 N ATOM 2005 CA TYR A 131 1.326 -15.444 -12.690 1.00 0.00 C ATOM 2006 C TYR A 131 1.591 -15.836 -11.195 1.00 0.00 C ATOM 2007 O TYR A 131 0.969 -15.287 -10.279 1.00 0.00 O ATOM 2008 CB TYR A 131 1.887 -14.022 -12.969 1.00 0.00 C ATOM 2009 CG TYR A 131 2.007 -13.490 -14.411 1.00 0.00 C ATOM 2010 CD1 TYR A 131 0.897 -12.969 -15.074 1.00 0.00 C ATOM 2011 CD2 TYR A 131 3.274 -13.345 -14.994 1.00 0.00 C ATOM 2012 CE1 TYR A 131 1.046 -12.278 -16.277 1.00 0.00 C ATOM 2013 CE2 TYR A 131 3.421 -12.678 -16.208 1.00 0.00 C ATOM 2014 CZ TYR A 131 2.313 -12.138 -16.843 1.00 0.00 C ATOM 2015 OH TYR A 131 2.456 -11.456 -18.020 1.00 0.00 O ATOM 0 H TYR A 131 -0.683 -14.805 -12.498 1.00 0.00 H new ATOM 0 HA TYR A 131 1.836 -16.161 -13.333 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.263 -13.318 -12.419 1.00 0.00 H new ATOM 0 HB3 TYR A 131 2.883 -13.978 -12.527 1.00 0.00 H new ATOM 0 HD1 TYR A 131 -0.088 -13.102 -14.652 1.00 0.00 H new ATOM 0 HD2 TYR A 131 4.142 -13.753 -14.498 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.183 -11.853 -16.768 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.399 -12.581 -16.655 1.00 0.00 H new ATOM 0 HH TYR A 131 3.401 -11.447 -18.280 1.00 0.00 H new ATOM 2025 N GLU A 132 2.542 -16.751 -10.941 1.00 0.00 N ATOM 2026 CA GLU A 132 2.847 -17.269 -9.572 1.00 0.00 C ATOM 2027 C GLU A 132 4.192 -16.769 -8.958 1.00 0.00 C ATOM 2028 O GLU A 132 5.197 -16.614 -9.657 1.00 0.00 O ATOM 2029 CB GLU A 132 2.758 -18.810 -9.589 1.00 0.00 C ATOM 2030 CG GLU A 132 3.752 -19.623 -10.459 1.00 0.00 C ATOM 2031 CD GLU A 132 3.539 -21.129 -10.396 1.00 0.00 C ATOM 2032 OE1 GLU A 132 2.377 -21.579 -10.259 1.00 0.00 O ATOM 2033 OE2 GLU A 132 4.535 -21.871 -10.493 1.00 0.00 O ATOM 0 H GLU A 132 3.127 -17.160 -11.670 1.00 0.00 H new ATOM 0 HA GLU A 132 2.094 -16.853 -8.903 1.00 0.00 H new ATOM 0 HB2 GLU A 132 2.866 -19.155 -8.561 1.00 0.00 H new ATOM 0 HB3 GLU A 132 1.751 -19.075 -9.910 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.664 -19.297 -11.495 1.00 0.00 H new ATOM 0 HG3 GLU A 132 4.769 -19.396 -10.139 1.00 0.00 H new ATOM 2040 N LYS A 133 4.211 -16.537 -7.629 1.00 0.00 N ATOM 2041 CA LYS A 133 5.372 -15.912 -6.933 1.00 0.00 C ATOM 2042 C LYS A 133 6.583 -16.891 -6.780 1.00 0.00 C ATOM 2043 O LYS A 133 6.478 -17.935 -6.129 1.00 0.00 O ATOM 2044 CB LYS A 133 4.898 -15.350 -5.558 1.00 0.00 C ATOM 2045 CG LYS A 133 5.654 -14.078 -5.101 1.00 0.00 C ATOM 2046 CD LYS A 133 5.138 -13.535 -3.744 1.00 0.00 C ATOM 2047 CE LYS A 133 5.638 -12.129 -3.346 1.00 0.00 C ATOM 2048 NZ LYS A 133 7.082 -12.141 -2.999 1.00 0.00 N ATOM 0 H LYS A 133 3.436 -16.771 -7.008 1.00 0.00 H new ATOM 0 HA LYS A 133 5.742 -15.092 -7.548 1.00 0.00 H new ATOM 0 HB2 LYS A 133 3.833 -15.125 -5.617 1.00 0.00 H new ATOM 0 HB3 LYS A 133 5.019 -16.124 -4.800 1.00 0.00 H new ATOM 0 HG2 LYS A 133 6.718 -14.302 -5.018 1.00 0.00 H new ATOM 0 HG3 LYS A 133 5.549 -13.304 -5.862 1.00 0.00 H new ATOM 0 HD2 LYS A 133 4.049 -13.517 -3.772 1.00 0.00 H new ATOM 0 HD3 LYS A 133 5.425 -14.237 -2.961 1.00 0.00 H new ATOM 0 HE2 LYS A 133 5.467 -11.435 -4.169 1.00 0.00 H new ATOM 0 HE3 LYS A 133 5.062 -11.764 -2.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 7.412 -11.166 -2.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 7.225 -12.690 -2.127 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 7.622 -12.576 -3.774 1.00 0.00 H new ATOM 2062 N VAL A 134 7.728 -16.539 -7.382 1.00 0.00 N ATOM 2063 CA VAL A 134 8.963 -17.378 -7.358 1.00 0.00 C ATOM 2064 C VAL A 134 9.806 -16.960 -6.106 1.00 0.00 C ATOM 2065 O VAL A 134 10.565 -15.985 -6.157 1.00 0.00 O ATOM 2066 CB VAL A 134 9.742 -17.242 -8.716 1.00 0.00 C ATOM 2067 CG1 VAL A 134 11.019 -18.114 -8.770 1.00 0.00 C ATOM 2068 CG2 VAL A 134 8.913 -17.576 -9.980 1.00 0.00 C ATOM 0 H VAL A 134 7.837 -15.668 -7.902 1.00 0.00 H new ATOM 0 HA VAL A 134 8.724 -18.437 -7.264 1.00 0.00 H new ATOM 0 HB VAL A 134 9.994 -16.182 -8.732 1.00 0.00 H new ATOM 0 HG11 VAL A 134 11.513 -17.977 -9.732 1.00 0.00 H new ATOM 0 HG12 VAL A 134 11.696 -17.818 -7.969 1.00 0.00 H new ATOM 0 HG13 VAL A 134 10.749 -19.163 -8.647 1.00 0.00 H new ATOM 0 HG21 VAL A 134 9.536 -17.453 -10.866 1.00 0.00 H new ATOM 0 HG22 VAL A 134 8.562 -18.606 -9.923 1.00 0.00 H new ATOM 0 HG23 VAL A 134 8.057 -16.904 -10.042 1.00 0.00 H new ATOM 2078 N GLU A 135 9.640 -17.702 -4.999 1.00 0.00 N ATOM 2079 CA GLU A 135 10.266 -17.371 -3.690 1.00 0.00 C ATOM 2080 C GLU A 135 11.373 -18.406 -3.361 1.00 0.00 C ATOM 2081 O GLU A 135 12.556 -18.004 -3.264 1.00 0.00 O ATOM 2082 CB GLU A 135 9.195 -17.328 -2.564 1.00 0.00 C ATOM 2083 CG GLU A 135 8.002 -16.349 -2.718 1.00 0.00 C ATOM 2084 CD GLU A 135 8.316 -14.861 -2.608 1.00 0.00 C ATOM 2085 OE1 GLU A 135 8.787 -14.254 -3.596 1.00 0.00 O ATOM 2086 OE2 GLU A 135 7.961 -14.237 -1.582 1.00 0.00 O ATOM 2087 OXT GLU A 135 11.075 -19.613 -3.183 1.00 0.00 O ATOM 0 H GLU A 135 9.071 -18.548 -4.977 1.00 0.00 H new ATOM 0 HA GLU A 135 10.720 -16.382 -3.755 1.00 0.00 H new ATOM 0 HB2 GLU A 135 8.788 -18.333 -2.455 1.00 0.00 H new ATOM 0 HB3 GLU A 135 9.704 -17.087 -1.631 1.00 0.00 H new ATOM 0 HG2 GLU A 135 7.539 -16.528 -3.688 1.00 0.00 H new ATOM 0 HG3 GLU A 135 7.259 -16.597 -1.960 1.00 0.00 H new