USER MOD reduce.3.24.130724 H: found=0, std=0, add=1053, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1051 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 58:sc= -5.91! USER MOD Set 1.2: A 127 CYS SG : rot 102:sc= -10! USER MOD Set 2.1: A 67 CYS SG : rot -61:sc= -0.622 USER MOD Set 2.2: A 87 CYS SG : rot 83:sc= -0.5 USER MOD Set 2.3: A 96 GLN : amide:sc= 0 K(o=-1.1,f=-3.5) USER MOD Set 3.1: A 83 THR OG1 : rot 94:sc= 0.283 USER MOD Set 3.2: A 85 THR OG1 : rot -167:sc= 1.4 USER MOD Set 4.1: A 43 CYS SG : rot -79:sc= 0.0767 USER MOD Set 4.2: A 56 THR OG1 : rot 180:sc= 0 USER MOD Set 5.1: A 22 TYR OH : rot 180:sc= 0.878 USER MOD Set 5.2: A 105 SER OG : rot 165:sc= 1.48 USER MOD Set 6.1: A 17 LYS NZ :NH3+ 178:sc= 0.322 (180deg=-0.0985) USER MOD Set 6.2: A 128 THR OG1 : rot -138:sc= 0.455 USER MOD Set 7.1: A 5 GLN : amide:sc= 0.385 K(o=0.75,f=0.0062) USER MOD Set 7.2: A 6 GLN : amide:sc= 0.364 K(o=0.75,f=0.0062) USER MOD Single : A 3 THR OG1 : rot 38:sc= 0.103 USER MOD Single : A 16 SER OG : rot -1:sc= 0.649 USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 LYS NZ :NH3+ 141:sc= 1.19 (180deg=-0.453!) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot -4:sc= 0.496 USER MOD Single : A 47 CYS SG : rot -101:sc= 0.0676 USER MOD Single : A 50 LYS NZ :NH3+ 177:sc= 0.00138 (180deg=0.00108) USER MOD Single : A 51 ASN : amide:sc= 1.04 K(o=1,f=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ -157:sc= 1.25 (180deg=1.04) 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+ -136:sc= 2.08 (180deg=0.634) USER MOD Single : A 62 THR OG1 : rot 70:sc= 1.72 USER MOD Single : A 63 THR OG1 : rot -14:sc= 0.966 USER MOD Single : A 64 GLN : amide:sc= 0 K(o=0,f=-2.3!) USER MOD Single : A 66 SER OG : rot 27:sc= 0.758 USER MOD Single : A 68 THR OG1 : rot 72:sc= 0.862 USER MOD Single : A 72 LYS NZ :NH3+ 145:sc= 1.14 (180deg=0.355) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot -93:sc= 1.24 USER MOD Single : A 82 LYS NZ :NH3+ 131:sc= 1.19 (180deg=0.708) USER MOD Single : A 84 GLN : amide:sc= 0.0368 K(o=0.037,f=-0.83) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 THR OG1 : rot -64:sc= 0.911 USER MOD Single : A 97 HIS : no HE2:sc= -0.63 C(o=0.48!,f=-8.6!) USER MOD Single : A 98 GLN : amide:sc= -0.0887 K(o=-0.089,f=-1.8!) USER MOD Single : A 103 LYS NZ :NH3+ 170:sc= 1.14 (180deg=1.01) USER MOD Single : A 106 THR OG1 : rot 180:sc= -0.0125 USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 LYS NZ :NH3+ -169:sc= 1.1 (180deg=0.779) USER MOD Single : A 112 LYS NZ :NH3+ -155:sc= 1.14 (180deg=0.97) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 MET CE :methyl -175:sc= 0 (180deg=-0.0305) USER MOD Single : A 123 ASN : amide:sc= 0.617 K(o=0.62,f=-3.6!) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 THR OG1 : rot 34:sc= 0.896 USER MOD Single : A 131 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 LYS NZ :NH3+ 178:sc= 1.13 (180deg=1.09) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 3 -2.348 -3.043 -0.334 1.00 0.00 N ATOM 2 CA THR A 3 -2.093 -1.912 -1.271 1.00 0.00 C ATOM 3 C THR A 3 -0.628 -1.912 -1.790 1.00 0.00 C ATOM 4 O THR A 3 0.303 -1.837 -0.984 1.00 0.00 O ATOM 5 CB THR A 3 -2.419 -0.521 -0.660 1.00 0.00 C ATOM 6 OG1 THR A 3 -1.762 -0.342 0.588 1.00 0.00 O ATOM 7 CG2 THR A 3 -3.911 -0.249 -0.425 1.00 0.00 C ATOM 0 HA THR A 3 -2.774 -2.078 -2.105 1.00 0.00 H new ATOM 0 HB THR A 3 -2.063 0.180 -1.415 1.00 0.00 H new ATOM 0 HG1 THR A 3 -0.871 -0.749 0.550 1.00 0.00 H new ATOM 0 HG21 THR A 3 -4.037 0.745 0.003 1.00 0.00 H new ATOM 0 HG22 THR A 3 -4.445 -0.306 -1.374 1.00 0.00 H new ATOM 0 HG23 THR A 3 -4.313 -0.993 0.263 1.00 0.00 H new ATOM 14 N VAL A 4 -0.453 -1.939 -3.128 1.00 0.00 N ATOM 15 CA VAL A 4 0.869 -1.863 -3.847 1.00 0.00 C ATOM 16 C VAL A 4 2.000 -2.887 -3.460 1.00 0.00 C ATOM 17 O VAL A 4 2.417 -3.697 -4.290 1.00 0.00 O ATOM 18 CB VAL A 4 1.324 -0.384 -4.132 1.00 0.00 C ATOM 19 CG1 VAL A 4 1.877 0.385 -2.910 1.00 0.00 C ATOM 20 CG2 VAL A 4 2.365 -0.283 -5.272 1.00 0.00 C ATOM 0 H VAL A 4 -1.241 -2.016 -3.771 1.00 0.00 H new ATOM 0 HA VAL A 4 0.635 -2.293 -4.821 1.00 0.00 H new ATOM 0 HB VAL A 4 0.389 0.092 -4.428 1.00 0.00 H new ATOM 0 HG11 VAL A 4 2.162 1.393 -3.213 1.00 0.00 H new ATOM 0 HG12 VAL A 4 1.110 0.441 -2.138 1.00 0.00 H new ATOM 0 HG13 VAL A 4 2.750 -0.136 -2.517 1.00 0.00 H new ATOM 0 HG21 VAL A 4 2.640 0.761 -5.422 1.00 0.00 H new ATOM 0 HG22 VAL A 4 3.252 -0.858 -5.006 1.00 0.00 H new ATOM 0 HG23 VAL A 4 1.937 -0.681 -6.192 1.00 0.00 H new ATOM 30 N GLN A 5 2.465 -2.854 -2.205 1.00 0.00 N ATOM 31 CA GLN A 5 3.494 -3.774 -1.639 1.00 0.00 C ATOM 32 C GLN A 5 3.248 -5.312 -1.807 1.00 0.00 C ATOM 33 O GLN A 5 4.177 -6.043 -2.156 1.00 0.00 O ATOM 34 CB GLN A 5 3.638 -3.336 -0.156 1.00 0.00 C ATOM 35 CG GLN A 5 4.798 -3.998 0.632 1.00 0.00 C ATOM 36 CD GLN A 5 4.759 -3.721 2.137 1.00 0.00 C ATOM 37 OE1 GLN A 5 5.486 -2.892 2.673 1.00 0.00 O ATOM 38 NE2 GLN A 5 3.908 -4.401 2.871 1.00 0.00 N ATOM 0 H GLN A 5 2.134 -2.170 -1.524 1.00 0.00 H new ATOM 0 HA GLN A 5 4.416 -3.672 -2.212 1.00 0.00 H new ATOM 0 HB2 GLN A 5 3.775 -2.255 -0.127 1.00 0.00 H new ATOM 0 HB3 GLN A 5 2.703 -3.553 0.360 1.00 0.00 H new ATOM 0 HG2 GLN A 5 4.767 -5.075 0.469 1.00 0.00 H new ATOM 0 HG3 GLN A 5 5.747 -3.642 0.231 1.00 0.00 H new ATOM 0 HE21 GLN A 5 3.298 -5.093 2.436 1.00 0.00 H new ATOM 0 HE22 GLN A 5 3.857 -4.237 3.876 1.00 0.00 H new ATOM 47 N GLN A 6 2.015 -5.809 -1.602 1.00 0.00 N ATOM 48 CA GLN A 6 1.661 -7.230 -1.906 1.00 0.00 C ATOM 49 C GLN A 6 1.651 -7.644 -3.423 1.00 0.00 C ATOM 50 O GLN A 6 1.791 -8.836 -3.709 1.00 0.00 O ATOM 51 CB GLN A 6 0.351 -7.606 -1.163 1.00 0.00 C ATOM 52 CG GLN A 6 0.508 -7.862 0.364 1.00 0.00 C ATOM 53 CD GLN A 6 0.684 -6.635 1.272 1.00 0.00 C ATOM 54 OE1 GLN A 6 1.787 -6.233 1.631 1.00 0.00 O ATOM 55 NE2 GLN A 6 -0.389 -6.007 1.690 1.00 0.00 N ATOM 0 H GLN A 6 1.241 -5.259 -1.229 1.00 0.00 H new ATOM 0 HA GLN A 6 2.488 -7.829 -1.525 1.00 0.00 H new ATOM 0 HB2 GLN A 6 -0.374 -6.805 -1.309 1.00 0.00 H new ATOM 0 HB3 GLN A 6 -0.066 -8.501 -1.625 1.00 0.00 H new ATOM 0 HG2 GLN A 6 -0.370 -8.411 0.706 1.00 0.00 H new ATOM 0 HG3 GLN A 6 1.369 -8.515 0.509 1.00 0.00 H new ATOM 0 HE21 GLN A 6 -1.313 -6.328 1.401 1.00 0.00 H new ATOM 0 HE22 GLN A 6 -0.299 -5.197 2.304 1.00 0.00 H new ATOM 64 N LEU A 7 1.573 -6.701 -4.385 1.00 0.00 N ATOM 65 CA LEU A 7 1.970 -6.958 -5.803 1.00 0.00 C ATOM 66 C LEU A 7 3.514 -7.111 -6.085 1.00 0.00 C ATOM 67 O LEU A 7 3.865 -7.459 -7.213 1.00 0.00 O ATOM 68 CB LEU A 7 1.454 -5.796 -6.711 1.00 0.00 C ATOM 69 CG LEU A 7 -0.021 -5.314 -6.658 1.00 0.00 C ATOM 70 CD1 LEU A 7 -0.166 -4.086 -7.569 1.00 0.00 C ATOM 71 CD2 LEU A 7 -1.039 -6.371 -7.106 1.00 0.00 C ATOM 0 H LEU A 7 1.240 -5.752 -4.215 1.00 0.00 H new ATOM 0 HA LEU A 7 1.518 -7.924 -6.026 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.078 -4.928 -6.498 1.00 0.00 H new ATOM 0 HB3 LEU A 7 1.654 -6.088 -7.742 1.00 0.00 H new ATOM 0 HG LEU A 7 -0.239 -5.087 -5.614 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -1.197 -3.734 -7.544 1.00 0.00 H new ATOM 0 HD12 LEU A 7 0.497 -3.294 -7.220 1.00 0.00 H new ATOM 0 HD13 LEU A 7 0.100 -4.357 -8.591 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -2.045 -5.958 -7.040 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -0.832 -6.661 -8.136 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -0.963 -7.246 -6.460 1.00 0.00 H new ATOM 83 N GLU A 8 4.435 -6.826 -5.142 1.00 0.00 N ATOM 84 CA GLU A 8 5.898 -6.777 -5.415 1.00 0.00 C ATOM 85 C GLU A 8 6.593 -8.173 -5.271 1.00 0.00 C ATOM 86 O GLU A 8 6.285 -8.976 -4.380 1.00 0.00 O ATOM 87 CB GLU A 8 6.559 -5.703 -4.508 1.00 0.00 C ATOM 88 CG GLU A 8 6.116 -4.239 -4.780 1.00 0.00 C ATOM 89 CD GLU A 8 6.891 -3.186 -4.010 1.00 0.00 C ATOM 90 OE1 GLU A 8 8.119 -3.081 -4.213 1.00 0.00 O ATOM 91 OE2 GLU A 8 6.272 -2.415 -3.251 1.00 0.00 O ATOM 0 H GLU A 8 4.194 -6.623 -4.172 1.00 0.00 H new ATOM 0 HA GLU A 8 6.035 -6.494 -6.459 1.00 0.00 H new ATOM 0 HB2 GLU A 8 6.339 -5.944 -3.468 1.00 0.00 H new ATOM 0 HB3 GLU A 8 7.641 -5.766 -4.628 1.00 0.00 H new ATOM 0 HG2 GLU A 8 6.216 -4.036 -5.846 1.00 0.00 H new ATOM 0 HG3 GLU A 8 5.058 -4.143 -4.535 1.00 0.00 H new ATOM 98 N GLY A 9 7.540 -8.453 -6.179 1.00 0.00 N ATOM 99 CA GLY A 9 8.237 -9.766 -6.254 1.00 0.00 C ATOM 100 C GLY A 9 8.587 -10.228 -7.687 1.00 0.00 C ATOM 101 O GLY A 9 8.319 -9.547 -8.680 1.00 0.00 O ATOM 0 H GLY A 9 7.850 -7.785 -6.884 1.00 0.00 H new ATOM 0 HA2 GLY A 9 9.156 -9.709 -5.670 1.00 0.00 H new ATOM 0 HA3 GLY A 9 7.609 -10.523 -5.786 1.00 0.00 H new ATOM 105 N ARG A 10 9.175 -11.429 -7.787 1.00 0.00 N ATOM 106 CA ARG A 10 9.380 -12.128 -9.089 1.00 0.00 C ATOM 107 C ARG A 10 8.124 -12.990 -9.439 1.00 0.00 C ATOM 108 O ARG A 10 7.732 -13.871 -8.671 1.00 0.00 O ATOM 109 CB ARG A 10 10.699 -12.939 -8.970 1.00 0.00 C ATOM 110 CG ARG A 10 11.120 -13.733 -10.235 1.00 0.00 C ATOM 111 CD ARG A 10 12.464 -14.480 -10.077 1.00 0.00 C ATOM 112 NE ARG A 10 13.633 -13.608 -10.390 1.00 0.00 N ATOM 113 CZ ARG A 10 14.182 -13.459 -11.599 1.00 0.00 C ATOM 114 NH1 ARG A 10 13.825 -14.116 -12.673 1.00 0.00 N ATOM 115 NH2 ARG A 10 15.135 -12.589 -11.748 1.00 0.00 N ATOM 0 H ARG A 10 9.523 -11.950 -6.982 1.00 0.00 H new ATOM 0 HA ARG A 10 9.485 -11.433 -9.922 1.00 0.00 H new ATOM 0 HB2 ARG A 10 11.504 -12.251 -8.711 1.00 0.00 H new ATOM 0 HB3 ARG A 10 10.599 -13.640 -8.141 1.00 0.00 H new ATOM 0 HG2 ARG A 10 10.339 -14.454 -10.478 1.00 0.00 H new ATOM 0 HG3 ARG A 10 11.193 -13.046 -11.078 1.00 0.00 H new ATOM 0 HD2 ARG A 10 12.553 -14.852 -9.056 1.00 0.00 H new ATOM 0 HD3 ARG A 10 12.474 -15.349 -10.735 1.00 0.00 H new ATOM 0 HE ARG A 10 14.046 -13.083 -9.619 1.00 0.00 H new ATOM 0 HH11 ARG A 10 13.073 -14.804 -12.624 1.00 0.00 H new ATOM 0 HH12 ARG A 10 14.298 -13.940 -13.559 1.00 0.00 H new ATOM 0 HH21 ARG A 10 15.450 -12.036 -10.951 1.00 0.00 H new ATOM 0 HH22 ARG A 10 15.568 -12.459 -12.662 1.00 0.00 H new ATOM 129 N TRP A 11 7.488 -12.721 -10.589 1.00 0.00 N ATOM 130 CA TRP A 11 6.160 -13.306 -10.931 1.00 0.00 C ATOM 131 C TRP A 11 6.235 -14.039 -12.300 1.00 0.00 C ATOM 132 O TRP A 11 6.355 -13.384 -13.336 1.00 0.00 O ATOM 133 CB TRP A 11 5.105 -12.166 -10.954 1.00 0.00 C ATOM 134 CG TRP A 11 4.763 -11.576 -9.587 1.00 0.00 C ATOM 135 CD1 TRP A 11 5.255 -10.357 -9.096 1.00 0.00 C ATOM 136 CD2 TRP A 11 3.894 -12.046 -8.621 1.00 0.00 C ATOM 137 NE1 TRP A 11 4.724 -10.055 -7.833 1.00 0.00 N ATOM 138 CE2 TRP A 11 3.864 -11.099 -7.570 1.00 0.00 C ATOM 139 CE3 TRP A 11 3.066 -13.196 -8.574 1.00 0.00 C ATOM 140 CZ2 TRP A 11 2.977 -11.267 -6.486 1.00 0.00 C ATOM 141 CZ3 TRP A 11 2.208 -13.351 -7.485 1.00 0.00 C ATOM 142 CH2 TRP A 11 2.154 -12.395 -6.462 1.00 0.00 C ATOM 0 H TRP A 11 7.864 -12.102 -11.307 1.00 0.00 H new ATOM 0 HA TRP A 11 5.868 -14.042 -10.182 1.00 0.00 H new ATOM 0 HB2 TRP A 11 5.471 -11.366 -11.597 1.00 0.00 H new ATOM 0 HB3 TRP A 11 4.190 -12.547 -11.408 1.00 0.00 H new ATOM 0 HD1 TRP A 11 5.956 -9.729 -9.625 1.00 0.00 H new ATOM 0 HE1 TRP A 11 4.928 -9.247 -7.244 1.00 0.00 H new ATOM 0 HE3 TRP A 11 3.099 -13.934 -9.362 1.00 0.00 H new ATOM 0 HZ2 TRP A 11 2.935 -10.538 -5.690 1.00 0.00 H new ATOM 0 HZ3 TRP A 11 1.574 -14.224 -7.429 1.00 0.00 H new ATOM 0 HH2 TRP A 11 1.465 -12.533 -5.642 1.00 0.00 H new ATOM 153 N ARG A 12 6.146 -15.380 -12.339 1.00 0.00 N ATOM 154 CA ARG A 12 6.252 -16.151 -13.609 1.00 0.00 C ATOM 155 C ARG A 12 4.868 -16.553 -14.202 1.00 0.00 C ATOM 156 O ARG A 12 4.008 -17.084 -13.498 1.00 0.00 O ATOM 157 CB ARG A 12 7.157 -17.368 -13.340 1.00 0.00 C ATOM 158 CG ARG A 12 7.471 -18.240 -14.584 1.00 0.00 C ATOM 159 CD ARG A 12 8.246 -19.518 -14.242 1.00 0.00 C ATOM 160 NE ARG A 12 9.597 -19.152 -13.743 1.00 0.00 N ATOM 161 CZ ARG A 12 10.080 -19.419 -12.534 1.00 0.00 C ATOM 162 NH1 ARG A 12 9.519 -20.239 -11.672 1.00 0.00 N ATOM 163 NH2 ARG A 12 11.166 -18.795 -12.178 1.00 0.00 N ATOM 0 H ARG A 12 6.001 -15.959 -11.512 1.00 0.00 H new ATOM 0 HA ARG A 12 6.695 -15.519 -14.379 1.00 0.00 H new ATOM 0 HB2 ARG A 12 8.097 -17.016 -12.915 1.00 0.00 H new ATOM 0 HB3 ARG A 12 6.682 -17.995 -12.586 1.00 0.00 H new ATOM 0 HG2 ARG A 12 6.537 -18.510 -15.077 1.00 0.00 H new ATOM 0 HG3 ARG A 12 8.049 -17.651 -15.297 1.00 0.00 H new ATOM 0 HD2 ARG A 12 7.709 -20.092 -13.486 1.00 0.00 H new ATOM 0 HD3 ARG A 12 8.331 -20.153 -15.124 1.00 0.00 H new ATOM 0 HE ARG A 12 10.209 -18.650 -14.387 1.00 0.00 H new ATOM 0 HH11 ARG A 12 8.653 -20.720 -11.915 1.00 0.00 H new ATOM 0 HH12 ARG A 12 9.950 -20.394 -10.761 1.00 0.00 H new ATOM 0 HH21 ARG A 12 11.608 -18.135 -12.818 1.00 0.00 H new ATOM 0 HH22 ARG A 12 11.575 -18.967 -11.259 1.00 0.00 H new ATOM 177 N LEU A 13 4.679 -16.370 -15.519 1.00 0.00 N ATOM 178 CA LEU A 13 3.399 -16.710 -16.206 1.00 0.00 C ATOM 179 C LEU A 13 3.054 -18.243 -16.233 1.00 0.00 C ATOM 180 O LEU A 13 3.896 -19.080 -16.577 1.00 0.00 O ATOM 181 CB LEU A 13 3.490 -16.093 -17.631 1.00 0.00 C ATOM 182 CG LEU A 13 2.219 -16.163 -18.518 1.00 0.00 C ATOM 183 CD1 LEU A 13 1.063 -15.364 -17.904 1.00 0.00 C ATOM 184 CD2 LEU A 13 2.509 -15.632 -19.934 1.00 0.00 C ATOM 0 H LEU A 13 5.392 -15.988 -16.140 1.00 0.00 H new ATOM 0 HA LEU A 13 2.566 -16.291 -15.641 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.772 -15.045 -17.528 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.301 -16.591 -18.163 1.00 0.00 H new ATOM 0 HG LEU A 13 1.927 -17.211 -18.578 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.188 -15.434 -18.551 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.822 -15.770 -16.922 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.356 -14.319 -17.803 1.00 0.00 H new ATOM 0 HD21 LEU A 13 1.603 -15.691 -20.537 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.838 -14.594 -19.873 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.292 -16.234 -20.395 1.00 0.00 H new ATOM 196 N VAL A 14 1.799 -18.587 -15.891 1.00 0.00 N ATOM 197 CA VAL A 14 1.292 -19.999 -15.895 1.00 0.00 C ATOM 198 C VAL A 14 0.009 -20.169 -16.787 1.00 0.00 C ATOM 199 O VAL A 14 0.059 -20.932 -17.755 1.00 0.00 O ATOM 200 CB VAL A 14 1.206 -20.633 -14.457 1.00 0.00 C ATOM 201 CG1 VAL A 14 2.600 -20.841 -13.816 1.00 0.00 C ATOM 202 CG2 VAL A 14 0.310 -19.898 -13.432 1.00 0.00 C ATOM 0 H VAL A 14 1.097 -17.905 -15.602 1.00 0.00 H new ATOM 0 HA VAL A 14 2.048 -20.609 -16.390 1.00 0.00 H new ATOM 0 HB VAL A 14 0.723 -21.588 -14.666 1.00 0.00 H new ATOM 0 HG11 VAL A 14 2.483 -21.281 -12.825 1.00 0.00 H new ATOM 0 HG12 VAL A 14 3.192 -21.509 -14.442 1.00 0.00 H new ATOM 0 HG13 VAL A 14 3.107 -19.880 -13.729 1.00 0.00 H new ATOM 0 HG21 VAL A 14 0.333 -20.430 -12.481 1.00 0.00 H new ATOM 0 HG22 VAL A 14 0.679 -18.883 -13.288 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -0.714 -19.862 -13.804 1.00 0.00 H new ATOM 212 N ASP A 15 -1.115 -19.477 -16.504 1.00 0.00 N ATOM 213 CA ASP A 15 -2.306 -19.436 -17.412 1.00 0.00 C ATOM 214 C ASP A 15 -2.199 -18.257 -18.438 1.00 0.00 C ATOM 215 O ASP A 15 -1.649 -17.186 -18.148 1.00 0.00 O ATOM 216 CB ASP A 15 -3.574 -19.315 -16.519 1.00 0.00 C ATOM 217 CG ASP A 15 -4.964 -19.241 -17.172 1.00 0.00 C ATOM 218 OD1 ASP A 15 -5.119 -19.643 -18.348 1.00 0.00 O ATOM 219 OD2 ASP A 15 -5.909 -18.752 -16.515 1.00 0.00 O ATOM 0 H ASP A 15 -1.233 -18.932 -15.650 1.00 0.00 H new ATOM 0 HA ASP A 15 -2.361 -20.347 -18.008 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -3.578 -20.169 -15.842 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -3.455 -18.422 -15.905 1.00 0.00 H new ATOM 224 N SER A 16 -2.760 -18.451 -19.643 1.00 0.00 N ATOM 225 CA SER A 16 -3.028 -17.344 -20.605 1.00 0.00 C ATOM 226 C SER A 16 -4.285 -17.597 -21.502 1.00 0.00 C ATOM 227 O SER A 16 -4.233 -17.555 -22.736 1.00 0.00 O ATOM 228 CB SER A 16 -1.728 -17.063 -21.391 1.00 0.00 C ATOM 229 OG SER A 16 -0.778 -16.437 -20.536 1.00 0.00 O ATOM 0 H SER A 16 -3.043 -19.369 -19.986 1.00 0.00 H new ATOM 0 HA SER A 16 -3.301 -16.441 -20.059 1.00 0.00 H new ATOM 0 HB2 SER A 16 -1.320 -17.994 -21.784 1.00 0.00 H new ATOM 0 HB3 SER A 16 -1.940 -16.422 -22.247 1.00 0.00 H new ATOM 0 HG SER A 16 -1.174 -16.304 -19.649 1.00 0.00 H new ATOM 235 N LYS A 17 -5.450 -17.789 -20.858 1.00 0.00 N ATOM 236 CA LYS A 17 -6.747 -18.030 -21.552 1.00 0.00 C ATOM 237 C LYS A 17 -7.324 -16.745 -22.240 1.00 0.00 C ATOM 238 O LYS A 17 -7.490 -15.701 -21.599 1.00 0.00 O ATOM 239 CB LYS A 17 -7.732 -18.717 -20.562 1.00 0.00 C ATOM 240 CG LYS A 17 -8.122 -17.928 -19.287 1.00 0.00 C ATOM 241 CD LYS A 17 -9.057 -18.718 -18.348 1.00 0.00 C ATOM 242 CE LYS A 17 -9.331 -18.039 -16.992 1.00 0.00 C ATOM 243 NZ LYS A 17 -10.190 -16.827 -17.128 1.00 0.00 N ATOM 0 H LYS A 17 -5.529 -17.783 -19.841 1.00 0.00 H new ATOM 0 HA LYS A 17 -6.582 -18.711 -22.387 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -8.647 -18.953 -21.106 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -7.292 -19.665 -20.251 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -7.217 -17.656 -18.744 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -8.610 -16.998 -19.578 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -10.007 -18.880 -18.856 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -8.621 -19.700 -18.166 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -9.815 -18.751 -16.323 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -8.384 -17.760 -16.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -10.374 -16.425 -16.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -9.704 -16.121 -17.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -11.092 -17.089 -17.575 1.00 0.00 H new ATOM 257 N GLY A 18 -7.578 -16.824 -23.560 1.00 0.00 N ATOM 258 CA GLY A 18 -7.858 -15.621 -24.403 1.00 0.00 C ATOM 259 C GLY A 18 -6.663 -14.861 -25.047 1.00 0.00 C ATOM 260 O GLY A 18 -6.896 -13.838 -25.695 1.00 0.00 O ATOM 0 H GLY A 18 -7.598 -17.704 -24.076 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.524 -15.930 -25.208 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -8.409 -14.909 -23.789 1.00 0.00 H new ATOM 264 N PHE A 19 -5.401 -15.313 -24.889 1.00 0.00 N ATOM 265 CA PHE A 19 -4.205 -14.554 -25.360 1.00 0.00 C ATOM 266 C PHE A 19 -3.972 -14.501 -26.904 1.00 0.00 C ATOM 267 O PHE A 19 -3.674 -13.411 -27.398 1.00 0.00 O ATOM 268 CB PHE A 19 -2.971 -14.981 -24.518 1.00 0.00 C ATOM 269 CG PHE A 19 -1.709 -14.115 -24.711 1.00 0.00 C ATOM 270 CD1 PHE A 19 -1.720 -12.752 -24.385 1.00 0.00 C ATOM 271 CD2 PHE A 19 -0.557 -14.673 -25.275 1.00 0.00 C ATOM 272 CE1 PHE A 19 -0.608 -11.957 -24.650 1.00 0.00 C ATOM 273 CE2 PHE A 19 0.557 -13.877 -25.530 1.00 0.00 C ATOM 274 CZ PHE A 19 0.529 -12.519 -25.224 1.00 0.00 C ATOM 0 H PHE A 19 -5.176 -16.200 -24.439 1.00 0.00 H new ATOM 0 HA PHE A 19 -4.405 -13.499 -25.176 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -3.247 -14.962 -23.464 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.724 -16.014 -24.764 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -2.595 -12.316 -23.926 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -0.531 -15.726 -25.514 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -0.628 -10.904 -24.410 1.00 0.00 H new ATOM 0 HE2 PHE A 19 1.444 -14.314 -25.966 1.00 0.00 H new ATOM 0 HZ PHE A 19 1.390 -11.901 -25.432 1.00 0.00 H new ATOM 284 N ASP A 20 -4.137 -15.600 -27.669 1.00 0.00 N ATOM 285 CA ASP A 20 -4.118 -15.553 -29.165 1.00 0.00 C ATOM 286 C ASP A 20 -5.173 -14.568 -29.804 1.00 0.00 C ATOM 287 O ASP A 20 -4.793 -13.682 -30.579 1.00 0.00 O ATOM 288 CB ASP A 20 -4.153 -17.012 -29.698 1.00 0.00 C ATOM 289 CG ASP A 20 -3.673 -17.141 -31.142 1.00 0.00 C ATOM 290 OD1 ASP A 20 -2.456 -17.270 -31.386 1.00 0.00 O ATOM 291 OD2 ASP A 20 -4.496 -16.992 -32.070 1.00 0.00 O ATOM 0 H ASP A 20 -4.285 -16.534 -27.286 1.00 0.00 H new ATOM 0 HA ASP A 20 -3.187 -15.095 -29.498 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -3.532 -17.640 -29.059 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -5.172 -17.393 -29.626 1.00 0.00 H new ATOM 296 N GLU A 21 -6.459 -14.634 -29.399 1.00 0.00 N ATOM 297 CA GLU A 21 -7.468 -13.559 -29.665 1.00 0.00 C ATOM 298 C GLU A 21 -7.033 -12.095 -29.302 1.00 0.00 C ATOM 299 O GLU A 21 -7.218 -11.186 -30.114 1.00 0.00 O ATOM 300 CB GLU A 21 -8.801 -13.906 -28.949 1.00 0.00 C ATOM 301 CG GLU A 21 -9.546 -15.165 -29.457 1.00 0.00 C ATOM 302 CD GLU A 21 -10.818 -15.457 -28.681 1.00 0.00 C ATOM 303 OE1 GLU A 21 -10.722 -16.027 -27.573 1.00 0.00 O ATOM 304 OE2 GLU A 21 -11.913 -15.122 -29.178 1.00 0.00 O ATOM 0 H GLU A 21 -6.837 -15.426 -28.880 1.00 0.00 H new ATOM 0 HA GLU A 21 -7.583 -13.548 -30.749 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -8.595 -14.036 -27.887 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -9.471 -13.051 -29.041 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -9.792 -15.034 -30.511 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -8.881 -16.026 -29.390 1.00 0.00 H new ATOM 311 N TYR A 22 -6.420 -11.860 -28.128 1.00 0.00 N ATOM 312 CA TYR A 22 -5.789 -10.553 -27.789 1.00 0.00 C ATOM 313 C TYR A 22 -4.636 -10.099 -28.756 1.00 0.00 C ATOM 314 O TYR A 22 -4.714 -8.987 -29.280 1.00 0.00 O ATOM 315 CB TYR A 22 -5.413 -10.630 -26.285 1.00 0.00 C ATOM 316 CG TYR A 22 -4.866 -9.342 -25.654 1.00 0.00 C ATOM 317 CD1 TYR A 22 -5.721 -8.289 -25.312 1.00 0.00 C ATOM 318 CD2 TYR A 22 -3.505 -9.252 -25.345 1.00 0.00 C ATOM 319 CE1 TYR A 22 -5.212 -7.152 -24.688 1.00 0.00 C ATOM 320 CE2 TYR A 22 -3.008 -8.129 -24.691 1.00 0.00 C ATOM 321 CZ TYR A 22 -3.857 -7.072 -24.382 1.00 0.00 C ATOM 322 OH TYR A 22 -3.344 -5.935 -23.817 1.00 0.00 O ATOM 0 H TYR A 22 -6.343 -12.558 -27.388 1.00 0.00 H new ATOM 0 HA TYR A 22 -6.495 -9.738 -27.950 1.00 0.00 H new ATOM 0 HB2 TYR A 22 -6.298 -10.936 -25.726 1.00 0.00 H new ATOM 0 HB3 TYR A 22 -4.669 -11.416 -26.158 1.00 0.00 H new ATOM 0 HD1 TYR A 22 -6.776 -8.357 -25.532 1.00 0.00 H new ATOM 0 HD2 TYR A 22 -2.837 -10.057 -25.615 1.00 0.00 H new ATOM 0 HE1 TYR A 22 -5.870 -6.332 -24.442 1.00 0.00 H new ATOM 0 HE2 TYR A 22 -1.963 -8.078 -24.423 1.00 0.00 H new ATOM 0 HH TYR A 22 -2.382 -6.049 -23.668 1.00 0.00 H new ATOM 332 N MET A 23 -3.608 -10.925 -29.033 1.00 0.00 N ATOM 333 CA MET A 23 -2.504 -10.562 -29.980 1.00 0.00 C ATOM 334 C MET A 23 -2.825 -10.479 -31.512 1.00 0.00 C ATOM 335 O MET A 23 -2.162 -9.704 -32.207 1.00 0.00 O ATOM 336 CB MET A 23 -1.216 -11.352 -29.632 1.00 0.00 C ATOM 337 CG MET A 23 -1.251 -12.873 -29.765 1.00 0.00 C ATOM 338 SD MET A 23 0.312 -13.513 -29.158 1.00 0.00 S ATOM 339 CE MET A 23 -0.182 -15.224 -29.008 1.00 0.00 C ATOM 0 H MET A 23 -3.508 -11.852 -28.620 1.00 0.00 H new ATOM 0 HA MET A 23 -2.336 -9.501 -29.796 1.00 0.00 H new ATOM 0 HB2 MET A 23 -0.413 -10.979 -30.268 1.00 0.00 H new ATOM 0 HB3 MET A 23 -0.945 -11.113 -28.604 1.00 0.00 H new ATOM 0 HG2 MET A 23 -2.081 -13.287 -29.193 1.00 0.00 H new ATOM 0 HG3 MET A 23 -1.404 -13.162 -30.805 1.00 0.00 H new ATOM 0 HE1 MET A 23 0.657 -15.814 -28.638 1.00 0.00 H new ATOM 0 HE2 MET A 23 -1.016 -15.302 -28.311 1.00 0.00 H new ATOM 0 HE3 MET A 23 -0.489 -15.601 -29.984 1.00 0.00 H new ATOM 349 N LYS A 24 -3.859 -11.161 -32.056 1.00 0.00 N ATOM 350 CA LYS A 24 -4.513 -10.689 -33.327 1.00 0.00 C ATOM 351 C LYS A 24 -5.216 -9.284 -33.240 1.00 0.00 C ATOM 352 O LYS A 24 -5.105 -8.511 -34.194 1.00 0.00 O ATOM 353 CB LYS A 24 -5.410 -11.763 -34.019 1.00 0.00 C ATOM 354 CG LYS A 24 -6.539 -12.464 -33.217 1.00 0.00 C ATOM 355 CD LYS A 24 -8.000 -12.175 -33.639 1.00 0.00 C ATOM 356 CE LYS A 24 -8.499 -10.774 -33.244 1.00 0.00 C ATOM 357 NZ LYS A 24 -9.968 -10.618 -33.398 1.00 0.00 N ATOM 0 H LYS A 24 -4.258 -12.013 -31.661 1.00 0.00 H new ATOM 0 HA LYS A 24 -3.662 -10.531 -33.989 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -5.873 -11.290 -34.885 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -4.749 -12.543 -34.397 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -6.377 -13.540 -33.279 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -6.430 -12.185 -32.169 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -8.085 -12.288 -34.720 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -8.652 -12.923 -33.188 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -8.224 -10.575 -32.208 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.993 -10.028 -33.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -10.342 -10.055 -32.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -10.174 -10.135 -34.296 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -10.418 -11.555 -33.399 1.00 0.00 H new ATOM 371 N GLU A 25 -5.915 -8.945 -32.136 1.00 0.00 N ATOM 372 CA GLU A 25 -6.576 -7.614 -31.958 1.00 0.00 C ATOM 373 C GLU A 25 -5.619 -6.400 -31.692 1.00 0.00 C ATOM 374 O GLU A 25 -5.823 -5.316 -32.245 1.00 0.00 O ATOM 375 CB GLU A 25 -7.674 -7.749 -30.856 1.00 0.00 C ATOM 376 CG GLU A 25 -8.992 -6.994 -31.162 1.00 0.00 C ATOM 377 CD GLU A 25 -9.845 -7.650 -32.244 1.00 0.00 C ATOM 378 OE1 GLU A 25 -10.655 -8.546 -31.922 1.00 0.00 O ATOM 379 OE2 GLU A 25 -9.656 -7.346 -33.437 1.00 0.00 O ATOM 0 H GLU A 25 -6.042 -9.574 -31.343 1.00 0.00 H new ATOM 0 HA GLU A 25 -7.019 -7.357 -32.920 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -7.901 -8.806 -30.715 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -7.270 -7.381 -29.913 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -9.578 -6.921 -30.246 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -8.753 -5.976 -31.469 1.00 0.00 H new ATOM 386 N LEU A 26 -4.561 -6.585 -30.878 1.00 0.00 N ATOM 387 CA LEU A 26 -3.440 -5.611 -30.720 1.00 0.00 C ATOM 388 C LEU A 26 -2.746 -5.066 -32.023 1.00 0.00 C ATOM 389 O LEU A 26 -2.379 -3.887 -32.069 1.00 0.00 O ATOM 390 CB LEU A 26 -2.344 -6.281 -29.834 1.00 0.00 C ATOM 391 CG LEU A 26 -2.599 -6.536 -28.326 1.00 0.00 C ATOM 392 CD1 LEU A 26 -1.385 -7.287 -27.744 1.00 0.00 C ATOM 393 CD2 LEU A 26 -2.851 -5.240 -27.543 1.00 0.00 C ATOM 0 H LEU A 26 -4.451 -7.420 -30.302 1.00 0.00 H new ATOM 0 HA LEU A 26 -3.910 -4.731 -30.282 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -2.108 -7.244 -30.288 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.448 -5.665 -29.909 1.00 0.00 H new ATOM 0 HG LEU A 26 -3.504 -7.135 -28.228 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -1.548 -7.475 -26.683 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -1.260 -8.236 -28.265 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -0.487 -6.682 -27.872 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -3.024 -5.477 -26.493 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.982 -4.588 -27.630 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -3.727 -4.734 -27.949 1.00 0.00 H new ATOM 405 N GLY A 27 -2.495 -5.938 -33.018 1.00 0.00 N ATOM 406 CA GLY A 27 -1.633 -5.620 -34.190 1.00 0.00 C ATOM 407 C GLY A 27 -0.207 -6.200 -34.085 1.00 0.00 C ATOM 408 O GLY A 27 0.765 -5.450 -33.968 1.00 0.00 O ATOM 0 H GLY A 27 -2.879 -6.883 -33.039 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -2.107 -6.004 -35.093 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -1.569 -4.537 -34.300 1.00 0.00 H new ATOM 412 N VAL A 28 -0.102 -7.537 -34.116 1.00 0.00 N ATOM 413 CA VAL A 28 1.174 -8.273 -33.851 1.00 0.00 C ATOM 414 C VAL A 28 1.415 -9.279 -35.027 1.00 0.00 C ATOM 415 O VAL A 28 0.517 -10.036 -35.413 1.00 0.00 O ATOM 416 CB VAL A 28 1.120 -8.983 -32.448 1.00 0.00 C ATOM 417 CG1 VAL A 28 2.396 -9.777 -32.092 1.00 0.00 C ATOM 418 CG2 VAL A 28 0.881 -8.018 -31.264 1.00 0.00 C ATOM 0 H VAL A 28 -0.890 -8.151 -34.324 1.00 0.00 H new ATOM 0 HA VAL A 28 2.016 -7.582 -33.809 1.00 0.00 H new ATOM 0 HB VAL A 28 0.273 -9.657 -32.574 1.00 0.00 H new ATOM 0 HG11 VAL A 28 2.277 -10.235 -31.110 1.00 0.00 H new ATOM 0 HG12 VAL A 28 2.561 -10.555 -32.838 1.00 0.00 H new ATOM 0 HG13 VAL A 28 3.252 -9.102 -32.076 1.00 0.00 H new ATOM 0 HG21 VAL A 28 0.857 -8.584 -30.333 1.00 0.00 H new ATOM 0 HG22 VAL A 28 1.687 -7.286 -31.223 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -0.070 -7.503 -31.401 1.00 0.00 H new ATOM 428 N GLY A 29 2.646 -9.325 -35.570 1.00 0.00 N ATOM 429 CA GLY A 29 3.008 -10.286 -36.652 1.00 0.00 C ATOM 430 C GLY A 29 3.120 -11.778 -36.243 1.00 0.00 C ATOM 431 O GLY A 29 3.394 -12.108 -35.087 1.00 0.00 O ATOM 0 H GLY A 29 3.411 -8.714 -35.284 1.00 0.00 H new ATOM 0 HA2 GLY A 29 2.264 -10.204 -37.444 1.00 0.00 H new ATOM 0 HA3 GLY A 29 3.962 -9.976 -37.078 1.00 0.00 H new ATOM 435 N ILE A 30 2.934 -12.686 -37.215 1.00 0.00 N ATOM 436 CA ILE A 30 2.868 -14.171 -36.969 1.00 0.00 C ATOM 437 C ILE A 30 4.059 -14.841 -36.199 1.00 0.00 C ATOM 438 O ILE A 30 3.826 -15.629 -35.276 1.00 0.00 O ATOM 439 CB ILE A 30 2.465 -14.964 -38.266 1.00 0.00 C ATOM 440 CG1 ILE A 30 3.387 -14.800 -39.519 1.00 0.00 C ATOM 441 CG2 ILE A 30 0.987 -14.706 -38.659 1.00 0.00 C ATOM 442 CD1 ILE A 30 4.483 -15.872 -39.667 1.00 0.00 C ATOM 0 H ILE A 30 2.823 -12.432 -38.197 1.00 0.00 H new ATOM 0 HA ILE A 30 2.064 -14.251 -36.238 1.00 0.00 H new ATOM 0 HB ILE A 30 2.608 -16.000 -37.959 1.00 0.00 H new ATOM 0 HG12 ILE A 30 2.764 -14.813 -40.414 1.00 0.00 H new ATOM 0 HG13 ILE A 30 3.862 -13.820 -39.476 1.00 0.00 H new ATOM 0 HG21 ILE A 30 0.746 -15.271 -39.560 1.00 0.00 H new ATOM 0 HG22 ILE A 30 0.334 -15.023 -37.846 1.00 0.00 H new ATOM 0 HG23 ILE A 30 0.841 -13.642 -38.848 1.00 0.00 H new ATOM 0 HD11 ILE A 30 5.069 -15.672 -40.564 1.00 0.00 H new ATOM 0 HD12 ILE A 30 5.136 -15.848 -38.795 1.00 0.00 H new ATOM 0 HD13 ILE A 30 4.021 -16.856 -39.747 1.00 0.00 H new ATOM 454 N ALA A 31 5.314 -14.496 -36.533 1.00 0.00 N ATOM 455 CA ALA A 31 6.508 -14.858 -35.718 1.00 0.00 C ATOM 456 C ALA A 31 6.513 -14.346 -34.237 1.00 0.00 C ATOM 457 O ALA A 31 6.769 -15.142 -33.330 1.00 0.00 O ATOM 458 CB ALA A 31 7.748 -14.396 -36.508 1.00 0.00 C ATOM 0 H ALA A 31 5.539 -13.960 -37.371 1.00 0.00 H new ATOM 0 HA ALA A 31 6.500 -15.939 -35.576 1.00 0.00 H new ATOM 0 HB1 ALA A 31 8.649 -14.642 -35.947 1.00 0.00 H new ATOM 0 HB2 ALA A 31 7.773 -14.901 -37.474 1.00 0.00 H new ATOM 0 HB3 ALA A 31 7.700 -13.318 -36.663 1.00 0.00 H new ATOM 464 N LEU A 32 6.171 -13.066 -33.987 1.00 0.00 N ATOM 465 CA LEU A 32 5.876 -12.553 -32.616 1.00 0.00 C ATOM 466 C LEU A 32 4.665 -13.224 -31.884 1.00 0.00 C ATOM 467 O LEU A 32 4.793 -13.526 -30.696 1.00 0.00 O ATOM 468 CB LEU A 32 5.689 -11.012 -32.645 1.00 0.00 C ATOM 469 CG LEU A 32 6.893 -10.113 -33.020 1.00 0.00 C ATOM 470 CD1 LEU A 32 6.430 -8.645 -33.001 1.00 0.00 C ATOM 471 CD2 LEU A 32 8.085 -10.280 -32.061 1.00 0.00 C ATOM 0 H LEU A 32 6.089 -12.357 -34.716 1.00 0.00 H new ATOM 0 HA LEU A 32 6.750 -12.830 -32.027 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.884 -10.792 -33.346 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.344 -10.704 -31.658 1.00 0.00 H new ATOM 0 HG LEU A 32 7.236 -10.412 -34.011 1.00 0.00 H new ATOM 0 HD11 LEU A 32 7.266 -7.996 -33.263 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.625 -8.508 -33.723 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.071 -8.390 -32.004 1.00 0.00 H new ATOM 0 HD21 LEU A 32 8.898 -9.625 -32.374 1.00 0.00 H new ATOM 0 HD22 LEU A 32 7.777 -10.018 -31.049 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.425 -11.315 -32.080 1.00 0.00 H new ATOM 483 N ARG A 33 3.524 -13.491 -32.556 1.00 0.00 N ATOM 484 CA ARG A 33 2.412 -14.307 -31.977 1.00 0.00 C ATOM 485 C ARG A 33 2.821 -15.772 -31.578 1.00 0.00 C ATOM 486 O ARG A 33 2.540 -16.196 -30.455 1.00 0.00 O ATOM 487 CB ARG A 33 1.161 -14.310 -32.904 1.00 0.00 C ATOM 488 CG ARG A 33 0.529 -12.946 -33.282 1.00 0.00 C ATOM 489 CD ARG A 33 -0.649 -13.021 -34.281 1.00 0.00 C ATOM 490 NE ARG A 33 -1.954 -13.344 -33.655 1.00 0.00 N ATOM 491 CZ ARG A 33 -2.466 -14.556 -33.459 1.00 0.00 C ATOM 492 NH1 ARG A 33 -1.849 -15.677 -33.709 1.00 0.00 N ATOM 493 NH2 ARG A 33 -3.649 -14.634 -32.953 1.00 0.00 N ATOM 0 H ARG A 33 3.340 -13.157 -33.502 1.00 0.00 H new ATOM 0 HA ARG A 33 2.155 -13.809 -31.042 1.00 0.00 H new ATOM 0 HB2 ARG A 33 1.432 -14.819 -33.829 1.00 0.00 H new ATOM 0 HB3 ARG A 33 0.391 -14.912 -32.423 1.00 0.00 H new ATOM 0 HG2 ARG A 33 0.181 -12.460 -32.371 1.00 0.00 H new ATOM 0 HG3 ARG A 33 1.305 -12.309 -33.707 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -0.733 -12.066 -34.799 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -0.424 -13.774 -35.036 1.00 0.00 H new ATOM 0 HE ARG A 33 -2.518 -12.554 -33.342 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -0.901 -15.664 -34.084 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -2.315 -16.567 -33.530 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -4.160 -13.783 -32.717 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -4.074 -15.546 -32.788 1.00 0.00 H new ATOM 507 N LYS A 34 3.524 -16.522 -32.453 1.00 0.00 N ATOM 508 CA LYS A 34 4.153 -17.825 -32.096 1.00 0.00 C ATOM 509 C LYS A 34 5.231 -17.771 -30.952 1.00 0.00 C ATOM 510 O LYS A 34 5.157 -18.582 -30.026 1.00 0.00 O ATOM 511 CB LYS A 34 4.665 -18.440 -33.424 1.00 0.00 C ATOM 512 CG LYS A 34 5.098 -19.918 -33.298 1.00 0.00 C ATOM 513 CD LYS A 34 5.504 -20.591 -34.624 1.00 0.00 C ATOM 514 CE LYS A 34 6.875 -20.142 -35.166 1.00 0.00 C ATOM 515 NZ LYS A 34 7.208 -20.913 -36.396 1.00 0.00 N ATOM 0 H LYS A 34 3.675 -16.249 -33.424 1.00 0.00 H new ATOM 0 HA LYS A 34 3.406 -18.469 -31.632 1.00 0.00 H new ATOM 0 HB2 LYS A 34 3.880 -18.364 -34.176 1.00 0.00 H new ATOM 0 HB3 LYS A 34 5.510 -17.853 -33.784 1.00 0.00 H new ATOM 0 HG2 LYS A 34 5.937 -19.978 -32.605 1.00 0.00 H new ATOM 0 HG3 LYS A 34 4.279 -20.485 -32.856 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.519 -21.671 -34.481 1.00 0.00 H new ATOM 0 HD3 LYS A 34 4.742 -20.379 -35.374 1.00 0.00 H new ATOM 0 HE2 LYS A 34 6.857 -19.075 -35.388 1.00 0.00 H new ATOM 0 HE3 LYS A 34 7.644 -20.297 -34.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 8.134 -20.607 -36.758 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 7.243 -21.928 -36.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 6.480 -20.744 -37.119 1.00 0.00 H new ATOM 529 N MET A 35 6.186 -16.817 -30.989 1.00 0.00 N ATOM 530 CA MET A 35 7.061 -16.472 -29.827 1.00 0.00 C ATOM 531 C MET A 35 6.291 -16.154 -28.493 1.00 0.00 C ATOM 532 O MET A 35 6.547 -16.817 -27.488 1.00 0.00 O ATOM 533 CB MET A 35 7.973 -15.305 -30.298 1.00 0.00 C ATOM 534 CG MET A 35 9.102 -14.906 -29.331 1.00 0.00 C ATOM 535 SD MET A 35 9.802 -13.312 -29.808 1.00 0.00 S ATOM 536 CE MET A 35 8.661 -12.191 -28.972 1.00 0.00 C ATOM 0 H MET A 35 6.379 -16.259 -31.821 1.00 0.00 H new ATOM 0 HA MET A 35 7.651 -17.345 -29.547 1.00 0.00 H new ATOM 0 HB2 MET A 35 8.419 -15.580 -31.254 1.00 0.00 H new ATOM 0 HB3 MET A 35 7.348 -14.430 -30.478 1.00 0.00 H new ATOM 0 HG2 MET A 35 8.716 -14.851 -28.313 1.00 0.00 H new ATOM 0 HG3 MET A 35 9.881 -15.669 -29.336 1.00 0.00 H new ATOM 0 HE1 MET A 35 8.956 -11.160 -29.167 1.00 0.00 H new ATOM 0 HE2 MET A 35 7.650 -12.356 -29.345 1.00 0.00 H new ATOM 0 HE3 MET A 35 8.687 -12.379 -27.899 1.00 0.00 H new ATOM 546 N GLY A 36 5.340 -15.196 -28.491 1.00 0.00 N ATOM 547 CA GLY A 36 4.454 -14.915 -27.325 1.00 0.00 C ATOM 548 C GLY A 36 3.602 -16.062 -26.729 1.00 0.00 C ATOM 549 O GLY A 36 3.470 -16.133 -25.506 1.00 0.00 O ATOM 0 H GLY A 36 5.159 -14.592 -29.293 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.081 -14.522 -26.524 1.00 0.00 H new ATOM 0 HA3 GLY A 36 3.771 -14.117 -27.617 1.00 0.00 H new ATOM 553 N ALA A 37 3.040 -16.951 -27.565 1.00 0.00 N ATOM 554 CA ALA A 37 2.391 -18.209 -27.099 1.00 0.00 C ATOM 555 C ALA A 37 3.300 -19.215 -26.312 1.00 0.00 C ATOM 556 O ALA A 37 2.880 -19.707 -25.261 1.00 0.00 O ATOM 557 CB ALA A 37 1.748 -18.855 -28.342 1.00 0.00 C ATOM 0 H ALA A 37 3.017 -16.829 -28.577 1.00 0.00 H new ATOM 0 HA ALA A 37 1.655 -17.943 -26.340 1.00 0.00 H new ATOM 0 HB1 ALA A 37 1.256 -19.785 -28.056 1.00 0.00 H new ATOM 0 HB2 ALA A 37 1.013 -18.172 -28.768 1.00 0.00 H new ATOM 0 HB3 ALA A 37 2.519 -19.066 -29.083 1.00 0.00 H new ATOM 563 N MET A 38 4.528 -19.508 -26.786 1.00 0.00 N ATOM 564 CA MET A 38 5.536 -20.287 -26.001 1.00 0.00 C ATOM 565 C MET A 38 6.306 -19.531 -24.856 1.00 0.00 C ATOM 566 O MET A 38 6.735 -20.176 -23.894 1.00 0.00 O ATOM 567 CB MET A 38 6.475 -21.039 -26.985 1.00 0.00 C ATOM 568 CG MET A 38 7.464 -20.183 -27.804 1.00 0.00 C ATOM 569 SD MET A 38 8.520 -21.239 -28.816 1.00 0.00 S ATOM 570 CE MET A 38 7.725 -21.058 -30.422 1.00 0.00 C ATOM 0 H MET A 38 4.856 -19.221 -27.708 1.00 0.00 H new ATOM 0 HA MET A 38 4.959 -20.998 -25.410 1.00 0.00 H new ATOM 0 HB2 MET A 38 7.050 -21.768 -26.414 1.00 0.00 H new ATOM 0 HB3 MET A 38 5.854 -21.600 -27.683 1.00 0.00 H new ATOM 0 HG2 MET A 38 6.914 -19.490 -28.441 1.00 0.00 H new ATOM 0 HG3 MET A 38 8.077 -19.581 -27.133 1.00 0.00 H new ATOM 0 HE1 MET A 38 8.261 -21.652 -31.162 1.00 0.00 H new ATOM 0 HE2 MET A 38 6.693 -21.402 -30.358 1.00 0.00 H new ATOM 0 HE3 MET A 38 7.740 -20.009 -30.719 1.00 0.00 H new ATOM 580 N ALA A 39 6.493 -18.198 -24.938 1.00 0.00 N ATOM 581 CA ALA A 39 7.208 -17.402 -23.911 1.00 0.00 C ATOM 582 C ALA A 39 6.404 -17.222 -22.582 1.00 0.00 C ATOM 583 O ALA A 39 5.435 -16.457 -22.521 1.00 0.00 O ATOM 584 CB ALA A 39 7.527 -16.031 -24.545 1.00 0.00 C ATOM 0 H ALA A 39 6.152 -17.638 -25.720 1.00 0.00 H new ATOM 0 HA ALA A 39 8.113 -17.936 -23.621 1.00 0.00 H new ATOM 0 HB1 ALA A 39 8.055 -15.410 -23.822 1.00 0.00 H new ATOM 0 HB2 ALA A 39 8.153 -16.174 -25.426 1.00 0.00 H new ATOM 0 HB3 ALA A 39 6.598 -15.540 -24.836 1.00 0.00 H new ATOM 590 N LYS A 40 6.848 -17.891 -21.503 1.00 0.00 N ATOM 591 CA LYS A 40 6.347 -17.624 -20.126 1.00 0.00 C ATOM 592 C LYS A 40 7.385 -16.762 -19.315 1.00 0.00 C ATOM 593 O LYS A 40 8.310 -17.348 -18.743 1.00 0.00 O ATOM 594 CB LYS A 40 5.850 -18.929 -19.440 1.00 0.00 C ATOM 595 CG LYS A 40 6.822 -20.120 -19.235 1.00 0.00 C ATOM 596 CD LYS A 40 6.165 -21.230 -18.383 1.00 0.00 C ATOM 597 CE LYS A 40 7.049 -22.480 -18.205 1.00 0.00 C ATOM 598 NZ LYS A 40 6.357 -23.432 -17.293 1.00 0.00 N ATOM 0 H LYS A 40 7.555 -18.625 -21.550 1.00 0.00 H new ATOM 0 HA LYS A 40 5.453 -17.002 -20.168 1.00 0.00 H new ATOM 0 HB2 LYS A 40 5.466 -18.652 -18.458 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.004 -19.298 -20.021 1.00 0.00 H new ATOM 0 HG2 LYS A 40 7.116 -20.525 -20.203 1.00 0.00 H new ATOM 0 HG3 LYS A 40 7.732 -19.772 -18.746 1.00 0.00 H new ATOM 0 HD2 LYS A 40 5.921 -20.825 -17.401 1.00 0.00 H new ATOM 0 HD3 LYS A 40 5.224 -21.524 -18.849 1.00 0.00 H new ATOM 0 HE2 LYS A 40 7.236 -22.951 -19.170 1.00 0.00 H new ATOM 0 HE3 LYS A 40 8.019 -22.201 -17.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 6.945 -24.280 -17.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 6.200 -22.978 -16.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 5.442 -23.704 -17.705 1.00 0.00 H new ATOM 612 N PRO A 41 7.313 -15.393 -19.244 1.00 0.00 N ATOM 613 CA PRO A 41 8.377 -14.568 -18.606 1.00 0.00 C ATOM 614 C PRO A 41 8.347 -14.518 -17.047 1.00 0.00 C ATOM 615 O PRO A 41 7.281 -14.595 -16.427 1.00 0.00 O ATOM 616 CB PRO A 41 8.103 -13.180 -19.225 1.00 0.00 C ATOM 617 CG PRO A 41 6.600 -13.145 -19.497 1.00 0.00 C ATOM 618 CD PRO A 41 6.292 -14.575 -19.934 1.00 0.00 C ATOM 0 HA PRO A 41 9.369 -14.979 -18.791 1.00 0.00 H new ATOM 0 HB2 PRO A 41 8.397 -12.381 -18.544 1.00 0.00 H new ATOM 0 HB3 PRO A 41 8.672 -13.041 -20.144 1.00 0.00 H new ATOM 0 HG2 PRO A 41 6.036 -12.865 -18.607 1.00 0.00 H new ATOM 0 HG3 PRO A 41 6.348 -12.423 -20.274 1.00 0.00 H new ATOM 0 HD2 PRO A 41 5.283 -14.871 -19.646 1.00 0.00 H new ATOM 0 HD3 PRO A 41 6.359 -14.684 -21.016 1.00 0.00 H new ATOM 626 N ASP A 42 9.527 -14.287 -16.446 1.00 0.00 N ATOM 627 CA ASP A 42 9.645 -13.893 -15.015 1.00 0.00 C ATOM 628 C ASP A 42 9.544 -12.333 -14.897 1.00 0.00 C ATOM 629 O ASP A 42 10.476 -11.597 -15.231 1.00 0.00 O ATOM 630 CB ASP A 42 10.990 -14.407 -14.432 1.00 0.00 C ATOM 631 CG ASP A 42 11.082 -15.856 -13.953 1.00 0.00 C ATOM 632 OD1 ASP A 42 10.531 -16.784 -14.579 1.00 0.00 O ATOM 633 OD2 ASP A 42 11.769 -16.089 -12.933 1.00 0.00 O ATOM 0 H ASP A 42 10.424 -14.365 -16.926 1.00 0.00 H new ATOM 0 HA ASP A 42 8.834 -14.342 -14.442 1.00 0.00 H new ATOM 0 HB2 ASP A 42 11.756 -14.263 -15.194 1.00 0.00 H new ATOM 0 HB3 ASP A 42 11.252 -13.765 -13.591 1.00 0.00 H new ATOM 638 N CYS A 43 8.401 -11.823 -14.424 1.00 0.00 N ATOM 639 CA CYS A 43 8.151 -10.370 -14.285 1.00 0.00 C ATOM 640 C CYS A 43 8.476 -9.863 -12.846 1.00 0.00 C ATOM 641 O CYS A 43 7.764 -10.161 -11.883 1.00 0.00 O ATOM 642 CB CYS A 43 6.688 -10.131 -14.705 1.00 0.00 C ATOM 643 SG CYS A 43 6.384 -8.342 -14.834 1.00 0.00 S ATOM 0 H CYS A 43 7.617 -12.402 -14.124 1.00 0.00 H new ATOM 0 HA CYS A 43 8.813 -9.790 -14.928 1.00 0.00 H new ATOM 0 HB2 CYS A 43 6.488 -10.615 -15.661 1.00 0.00 H new ATOM 0 HB3 CYS A 43 6.011 -10.575 -13.975 1.00 0.00 H new ATOM 0 HG CYS A 43 6.203 -7.846 -13.646 1.00 0.00 H new ATOM 649 N ILE A 44 9.546 -9.066 -12.708 1.00 0.00 N ATOM 650 CA ILE A 44 9.999 -8.521 -11.397 1.00 0.00 C ATOM 651 C ILE A 44 9.272 -7.158 -11.164 1.00 0.00 C ATOM 652 O ILE A 44 9.607 -6.159 -11.806 1.00 0.00 O ATOM 653 CB ILE A 44 11.563 -8.440 -11.281 1.00 0.00 C ATOM 654 CG1 ILE A 44 12.299 -9.795 -11.528 1.00 0.00 C ATOM 655 CG2 ILE A 44 11.996 -7.912 -9.885 1.00 0.00 C ATOM 656 CD1 ILE A 44 12.686 -10.057 -12.993 1.00 0.00 C ATOM 0 H ILE A 44 10.128 -8.775 -13.494 1.00 0.00 H new ATOM 0 HA ILE A 44 9.722 -9.204 -10.594 1.00 0.00 H new ATOM 0 HB ILE A 44 11.856 -7.751 -12.073 1.00 0.00 H new ATOM 0 HG12 ILE A 44 13.202 -9.819 -10.918 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.660 -10.608 -11.184 1.00 0.00 H new ATOM 0 HG21 ILE A 44 13.084 -7.867 -9.834 1.00 0.00 H new ATOM 0 HG22 ILE A 44 11.584 -6.915 -9.729 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.624 -8.583 -9.111 1.00 0.00 H new ATOM 0 HD11 ILE A 44 13.192 -11.020 -13.069 1.00 0.00 H new ATOM 0 HD12 ILE A 44 11.788 -10.069 -13.610 1.00 0.00 H new ATOM 0 HD13 ILE A 44 13.353 -9.268 -13.340 1.00 0.00 H new ATOM 668 N ILE A 45 8.291 -7.131 -10.246 1.00 0.00 N ATOM 669 CA ILE A 45 7.552 -5.889 -9.859 1.00 0.00 C ATOM 670 C ILE A 45 8.242 -5.309 -8.577 1.00 0.00 C ATOM 671 O ILE A 45 8.433 -6.020 -7.582 1.00 0.00 O ATOM 672 CB ILE A 45 6.013 -6.178 -9.656 1.00 0.00 C ATOM 673 CG1 ILE A 45 5.319 -6.822 -10.898 1.00 0.00 C ATOM 674 CG2 ILE A 45 5.229 -4.900 -9.241 1.00 0.00 C ATOM 675 CD1 ILE A 45 3.882 -7.337 -10.686 1.00 0.00 C ATOM 0 H ILE A 45 7.979 -7.962 -9.744 1.00 0.00 H new ATOM 0 HA ILE A 45 7.599 -5.145 -10.655 1.00 0.00 H new ATOM 0 HB ILE A 45 5.981 -6.907 -8.847 1.00 0.00 H new ATOM 0 HG12 ILE A 45 5.304 -6.086 -11.701 1.00 0.00 H new ATOM 0 HG13 ILE A 45 5.934 -7.654 -11.240 1.00 0.00 H new ATOM 0 HG21 ILE A 45 4.175 -5.146 -9.112 1.00 0.00 H new ATOM 0 HG22 ILE A 45 5.629 -4.516 -8.303 1.00 0.00 H new ATOM 0 HG23 ILE A 45 5.333 -4.141 -10.017 1.00 0.00 H new ATOM 0 HD11 ILE A 45 3.507 -7.762 -11.617 1.00 0.00 H new ATOM 0 HD12 ILE A 45 3.881 -8.104 -9.911 1.00 0.00 H new ATOM 0 HD13 ILE A 45 3.241 -6.511 -10.380 1.00 0.00 H new ATOM 687 N THR A 46 8.636 -4.022 -8.586 1.00 0.00 N ATOM 688 CA THR A 46 9.237 -3.355 -7.388 1.00 0.00 C ATOM 689 C THR A 46 8.912 -1.826 -7.413 1.00 0.00 C ATOM 690 O THR A 46 9.148 -1.146 -8.416 1.00 0.00 O ATOM 691 CB THR A 46 10.765 -3.668 -7.287 1.00 0.00 C ATOM 692 OG1 THR A 46 10.966 -5.080 -7.233 1.00 0.00 O ATOM 693 CG2 THR A 46 11.450 -3.105 -6.031 1.00 0.00 C ATOM 0 H THR A 46 8.554 -3.414 -9.401 1.00 0.00 H new ATOM 0 HA THR A 46 8.791 -3.757 -6.478 1.00 0.00 H new ATOM 0 HB THR A 46 11.201 -3.197 -8.168 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.098 -5.533 -7.203 1.00 0.00 H new ATOM 0 HG21 THR A 46 12.507 -3.370 -6.044 1.00 0.00 H new ATOM 0 HG22 THR A 46 11.348 -2.020 -6.016 1.00 0.00 H new ATOM 0 HG23 THR A 46 10.981 -3.526 -5.141 1.00 0.00 H new ATOM 701 N CYS A 47 8.378 -1.285 -6.303 1.00 0.00 N ATOM 702 CA CYS A 47 7.995 0.144 -6.190 1.00 0.00 C ATOM 703 C CYS A 47 8.759 0.865 -5.036 1.00 0.00 C ATOM 704 O CYS A 47 8.530 0.618 -3.847 1.00 0.00 O ATOM 705 CB CYS A 47 6.464 0.217 -6.015 1.00 0.00 C ATOM 706 SG CYS A 47 5.934 1.962 -6.087 1.00 0.00 S ATOM 0 H CYS A 47 8.198 -1.823 -5.455 1.00 0.00 H new ATOM 0 HA CYS A 47 8.281 0.675 -7.098 1.00 0.00 H new ATOM 0 HB2 CYS A 47 5.969 -0.358 -6.797 1.00 0.00 H new ATOM 0 HB3 CYS A 47 6.173 -0.225 -5.062 1.00 0.00 H new ATOM 0 HG CYS A 47 5.719 2.400 -4.882 1.00 0.00 H new ATOM 712 N ASP A 48 9.619 1.833 -5.395 1.00 0.00 N ATOM 713 CA ASP A 48 10.224 2.795 -4.429 1.00 0.00 C ATOM 714 C ASP A 48 9.206 3.948 -4.090 1.00 0.00 C ATOM 715 O ASP A 48 9.286 5.068 -4.609 1.00 0.00 O ATOM 716 CB ASP A 48 11.587 3.189 -5.068 1.00 0.00 C ATOM 717 CG ASP A 48 12.333 4.360 -4.435 1.00 0.00 C ATOM 718 OD1 ASP A 48 12.815 4.227 -3.292 1.00 0.00 O ATOM 719 OD2 ASP A 48 12.431 5.423 -5.091 1.00 0.00 O ATOM 0 H ASP A 48 9.920 1.979 -6.358 1.00 0.00 H new ATOM 0 HA ASP A 48 10.431 2.394 -3.437 1.00 0.00 H new ATOM 0 HB2 ASP A 48 12.240 2.316 -5.041 1.00 0.00 H new ATOM 0 HB3 ASP A 48 11.414 3.425 -6.118 1.00 0.00 H new ATOM 724 N GLY A 49 8.200 3.633 -3.243 1.00 0.00 N ATOM 725 CA GLY A 49 7.104 4.576 -2.875 1.00 0.00 C ATOM 726 C GLY A 49 6.142 4.989 -4.015 1.00 0.00 C ATOM 727 O GLY A 49 5.049 4.442 -4.174 1.00 0.00 O ATOM 0 H GLY A 49 8.119 2.721 -2.793 1.00 0.00 H new ATOM 0 HA2 GLY A 49 6.515 4.122 -2.078 1.00 0.00 H new ATOM 0 HA3 GLY A 49 7.554 5.479 -2.463 1.00 0.00 H new ATOM 731 N LYS A 50 6.593 5.975 -4.793 1.00 0.00 N ATOM 732 CA LYS A 50 5.972 6.350 -6.098 1.00 0.00 C ATOM 733 C LYS A 50 6.754 5.911 -7.386 1.00 0.00 C ATOM 734 O LYS A 50 6.150 5.933 -8.462 1.00 0.00 O ATOM 735 CB LYS A 50 5.739 7.890 -6.081 1.00 0.00 C ATOM 736 CG LYS A 50 4.604 8.410 -5.154 1.00 0.00 C ATOM 737 CD LYS A 50 3.166 7.936 -5.471 1.00 0.00 C ATOM 738 CE LYS A 50 2.627 8.283 -6.871 1.00 0.00 C ATOM 739 NZ LYS A 50 2.222 9.706 -7.015 1.00 0.00 N ATOM 0 H LYS A 50 7.401 6.547 -4.549 1.00 0.00 H new ATOM 0 HA LYS A 50 5.039 5.791 -6.176 1.00 0.00 H new ATOM 0 HB2 LYS A 50 6.670 8.373 -5.784 1.00 0.00 H new ATOM 0 HB3 LYS A 50 5.523 8.214 -7.099 1.00 0.00 H new ATOM 0 HG2 LYS A 50 4.840 8.115 -4.131 1.00 0.00 H new ATOM 0 HG3 LYS A 50 4.616 9.500 -5.183 1.00 0.00 H new ATOM 0 HD2 LYS A 50 3.128 6.854 -5.348 1.00 0.00 H new ATOM 0 HD3 LYS A 50 2.493 8.365 -4.729 1.00 0.00 H new ATOM 0 HE2 LYS A 50 3.392 8.054 -7.613 1.00 0.00 H new ATOM 0 HE3 LYS A 50 1.770 7.646 -7.090 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 1.917 9.883 -7.993 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 1.436 9.911 -6.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 3.029 10.321 -6.787 1.00 0.00 H new ATOM 753 N ASN A 51 8.047 5.538 -7.319 1.00 0.00 N ATOM 754 CA ASN A 51 8.870 5.186 -8.511 1.00 0.00 C ATOM 755 C ASN A 51 8.728 3.662 -8.824 1.00 0.00 C ATOM 756 O ASN A 51 9.253 2.814 -8.094 1.00 0.00 O ATOM 757 CB ASN A 51 10.352 5.559 -8.223 1.00 0.00 C ATOM 758 CG ASN A 51 10.662 7.037 -7.957 1.00 0.00 C ATOM 759 OD1 ASN A 51 10.296 7.924 -8.720 1.00 0.00 O ATOM 760 ND2 ASN A 51 11.342 7.356 -6.878 1.00 0.00 N ATOM 0 H ASN A 51 8.558 5.470 -6.439 1.00 0.00 H new ATOM 0 HA ASN A 51 8.525 5.741 -9.383 1.00 0.00 H new ATOM 0 HB2 ASN A 51 10.684 4.983 -7.359 1.00 0.00 H new ATOM 0 HB3 ASN A 51 10.953 5.235 -9.072 1.00 0.00 H new ATOM 0 HD21 ASN A 51 11.560 8.333 -6.683 1.00 0.00 H new ATOM 0 HD22 ASN A 51 11.652 6.626 -6.236 1.00 0.00 H new ATOM 767 N LEU A 52 7.986 3.306 -9.884 1.00 0.00 N ATOM 768 CA LEU A 52 7.573 1.902 -10.152 1.00 0.00 C ATOM 769 C LEU A 52 8.429 1.266 -11.289 1.00 0.00 C ATOM 770 O LEU A 52 8.376 1.688 -12.450 1.00 0.00 O ATOM 771 CB LEU A 52 6.042 1.927 -10.412 1.00 0.00 C ATOM 772 CG LEU A 52 5.343 0.540 -10.479 1.00 0.00 C ATOM 773 CD1 LEU A 52 3.916 0.634 -9.918 1.00 0.00 C ATOM 774 CD2 LEU A 52 5.285 -0.005 -11.915 1.00 0.00 C ATOM 0 H LEU A 52 7.652 3.972 -10.581 1.00 0.00 H new ATOM 0 HA LEU A 52 7.762 1.247 -9.301 1.00 0.00 H new ATOM 0 HB2 LEU A 52 5.569 2.513 -9.624 1.00 0.00 H new ATOM 0 HB3 LEU A 52 5.861 2.450 -11.351 1.00 0.00 H new ATOM 0 HG LEU A 52 5.936 -0.147 -9.876 1.00 0.00 H new ATOM 0 HD11 LEU A 52 3.439 -0.345 -9.971 1.00 0.00 H new ATOM 0 HD12 LEU A 52 3.954 0.963 -8.880 1.00 0.00 H new ATOM 0 HD13 LEU A 52 3.341 1.350 -10.505 1.00 0.00 H new ATOM 0 HD21 LEU A 52 4.789 -0.976 -11.916 1.00 0.00 H new ATOM 0 HD22 LEU A 52 4.728 0.688 -12.545 1.00 0.00 H new ATOM 0 HD23 LEU A 52 6.297 -0.115 -12.304 1.00 0.00 H new ATOM 786 N THR A 53 9.196 0.224 -10.934 1.00 0.00 N ATOM 787 CA THR A 53 10.098 -0.504 -11.869 1.00 0.00 C ATOM 788 C THR A 53 9.504 -1.915 -12.173 1.00 0.00 C ATOM 789 O THR A 53 9.184 -2.692 -11.263 1.00 0.00 O ATOM 790 CB THR A 53 11.537 -0.561 -11.270 1.00 0.00 C ATOM 791 OG1 THR A 53 12.034 0.761 -11.077 1.00 0.00 O ATOM 792 CG2 THR A 53 12.583 -1.257 -12.160 1.00 0.00 C ATOM 0 H THR A 53 9.215 -0.148 -9.984 1.00 0.00 H new ATOM 0 HA THR A 53 10.172 0.022 -12.821 1.00 0.00 H new ATOM 0 HB THR A 53 11.420 -1.132 -10.349 1.00 0.00 H new ATOM 0 HG1 THR A 53 12.937 0.719 -10.699 1.00 0.00 H new ATOM 0 HG21 THR A 53 13.551 -1.247 -11.659 1.00 0.00 H new ATOM 0 HG22 THR A 53 12.279 -2.288 -12.341 1.00 0.00 H new ATOM 0 HG23 THR A 53 12.661 -0.729 -13.111 1.00 0.00 H new ATOM 800 N ILE A 54 9.385 -2.250 -13.471 1.00 0.00 N ATOM 801 CA ILE A 54 8.990 -3.615 -13.929 1.00 0.00 C ATOM 802 C ILE A 54 10.099 -4.130 -14.905 1.00 0.00 C ATOM 803 O ILE A 54 10.353 -3.528 -15.955 1.00 0.00 O ATOM 804 CB ILE A 54 7.523 -3.639 -14.496 1.00 0.00 C ATOM 805 CG1 ILE A 54 6.471 -3.479 -13.352 1.00 0.00 C ATOM 806 CG2 ILE A 54 7.196 -4.919 -15.315 1.00 0.00 C ATOM 807 CD1 ILE A 54 5.033 -3.150 -13.787 1.00 0.00 C ATOM 0 H ILE A 54 9.556 -1.595 -14.234 1.00 0.00 H new ATOM 0 HA ILE A 54 8.940 -4.316 -13.096 1.00 0.00 H new ATOM 0 HB ILE A 54 7.464 -2.790 -15.177 1.00 0.00 H new ATOM 0 HG12 ILE A 54 6.450 -4.404 -12.775 1.00 0.00 H new ATOM 0 HG13 ILE A 54 6.813 -2.692 -12.680 1.00 0.00 H new ATOM 0 HG21 ILE A 54 6.169 -4.868 -15.675 1.00 0.00 H new ATOM 0 HG22 ILE A 54 7.875 -4.991 -16.165 1.00 0.00 H new ATOM 0 HG23 ILE A 54 7.315 -5.797 -14.680 1.00 0.00 H new ATOM 0 HD11 ILE A 54 4.397 -3.064 -12.906 1.00 0.00 H new ATOM 0 HD12 ILE A 54 5.025 -2.207 -14.334 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.656 -3.946 -14.430 1.00 0.00 H new ATOM 819 N LYS A 55 10.706 -5.285 -14.575 1.00 0.00 N ATOM 820 CA LYS A 55 11.589 -6.034 -15.510 1.00 0.00 C ATOM 821 C LYS A 55 10.894 -7.357 -15.959 1.00 0.00 C ATOM 822 O LYS A 55 10.756 -8.294 -15.171 1.00 0.00 O ATOM 823 CB LYS A 55 12.950 -6.286 -14.811 1.00 0.00 C ATOM 824 CG LYS A 55 14.036 -6.865 -15.747 1.00 0.00 C ATOM 825 CD LYS A 55 15.327 -7.247 -14.999 1.00 0.00 C ATOM 826 CE LYS A 55 16.426 -7.740 -15.959 1.00 0.00 C ATOM 827 NZ LYS A 55 17.401 -8.564 -15.199 1.00 0.00 N ATOM 0 H LYS A 55 10.604 -5.729 -13.662 1.00 0.00 H new ATOM 0 HA LYS A 55 11.773 -5.454 -16.415 1.00 0.00 H new ATOM 0 HB2 LYS A 55 13.310 -5.348 -14.389 1.00 0.00 H new ATOM 0 HB3 LYS A 55 12.798 -6.972 -13.978 1.00 0.00 H new ATOM 0 HG2 LYS A 55 13.641 -7.746 -16.253 1.00 0.00 H new ATOM 0 HG3 LYS A 55 14.272 -6.133 -16.519 1.00 0.00 H new ATOM 0 HD2 LYS A 55 15.692 -6.384 -14.442 1.00 0.00 H new ATOM 0 HD3 LYS A 55 15.106 -8.026 -14.270 1.00 0.00 H new ATOM 0 HE2 LYS A 55 15.986 -8.327 -16.765 1.00 0.00 H new ATOM 0 HE3 LYS A 55 16.930 -6.891 -16.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 18.312 -8.575 -15.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 17.533 -8.158 -14.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 17.041 -9.536 -15.113 1.00 0.00 H new ATOM 841 N THR A 56 10.515 -7.458 -17.238 1.00 0.00 N ATOM 842 CA THR A 56 9.999 -8.718 -17.848 1.00 0.00 C ATOM 843 C THR A 56 11.209 -9.554 -18.386 1.00 0.00 C ATOM 844 O THR A 56 11.729 -9.266 -19.469 1.00 0.00 O ATOM 845 CB THR A 56 8.945 -8.332 -18.938 1.00 0.00 C ATOM 846 OG1 THR A 56 7.869 -7.593 -18.363 1.00 0.00 O ATOM 847 CG2 THR A 56 8.279 -9.515 -19.654 1.00 0.00 C ATOM 0 H THR A 56 10.552 -6.675 -17.891 1.00 0.00 H new ATOM 0 HA THR A 56 9.490 -9.356 -17.125 1.00 0.00 H new ATOM 0 HB THR A 56 9.531 -7.763 -19.660 1.00 0.00 H new ATOM 0 HG1 THR A 56 7.222 -7.360 -19.061 1.00 0.00 H new ATOM 0 HG21 THR A 56 7.566 -9.141 -20.389 1.00 0.00 H new ATOM 0 HG22 THR A 56 9.040 -10.111 -20.157 1.00 0.00 H new ATOM 0 HG23 THR A 56 7.757 -10.134 -18.925 1.00 0.00 H new ATOM 855 N GLU A 57 11.664 -10.572 -17.627 1.00 0.00 N ATOM 856 CA GLU A 57 12.788 -11.463 -18.035 1.00 0.00 C ATOM 857 C GLU A 57 12.287 -12.656 -18.914 1.00 0.00 C ATOM 858 O GLU A 57 11.532 -13.529 -18.470 1.00 0.00 O ATOM 859 CB GLU A 57 13.559 -11.984 -16.786 1.00 0.00 C ATOM 860 CG GLU A 57 14.582 -11.002 -16.160 1.00 0.00 C ATOM 861 CD GLU A 57 15.373 -11.505 -14.954 1.00 0.00 C ATOM 862 OE1 GLU A 57 15.223 -12.666 -14.515 1.00 0.00 O ATOM 863 OE2 GLU A 57 16.148 -10.699 -14.396 1.00 0.00 O ATOM 0 H GLU A 57 11.269 -10.805 -16.716 1.00 0.00 H new ATOM 0 HA GLU A 57 13.473 -10.872 -18.643 1.00 0.00 H new ATOM 0 HB2 GLU A 57 12.831 -12.255 -16.021 1.00 0.00 H new ATOM 0 HB3 GLU A 57 14.085 -12.897 -17.063 1.00 0.00 H new ATOM 0 HG2 GLU A 57 15.292 -10.712 -16.935 1.00 0.00 H new ATOM 0 HG3 GLU A 57 14.048 -10.099 -15.863 1.00 0.00 H new ATOM 870 N SER A 58 12.759 -12.696 -20.168 1.00 0.00 N ATOM 871 CA SER A 58 12.593 -13.860 -21.079 1.00 0.00 C ATOM 872 C SER A 58 13.834 -13.978 -22.015 1.00 0.00 C ATOM 873 O SER A 58 14.262 -12.996 -22.637 1.00 0.00 O ATOM 874 CB SER A 58 11.297 -13.699 -21.911 1.00 0.00 C ATOM 875 OG SER A 58 11.075 -14.816 -22.776 1.00 0.00 O ATOM 0 H SER A 58 13.271 -11.922 -20.591 1.00 0.00 H new ATOM 0 HA SER A 58 12.513 -14.772 -20.488 1.00 0.00 H new ATOM 0 HB2 SER A 58 10.446 -13.586 -21.239 1.00 0.00 H new ATOM 0 HB3 SER A 58 11.358 -12.787 -22.505 1.00 0.00 H new ATOM 0 HG SER A 58 10.248 -14.678 -23.283 1.00 0.00 H new ATOM 881 N THR A 59 14.364 -15.202 -22.188 1.00 0.00 N ATOM 882 CA THR A 59 15.347 -15.511 -23.282 1.00 0.00 C ATOM 883 C THR A 59 14.850 -15.263 -24.753 1.00 0.00 C ATOM 884 O THR A 59 15.662 -14.910 -25.611 1.00 0.00 O ATOM 885 CB THR A 59 15.926 -16.955 -23.140 1.00 0.00 C ATOM 886 OG1 THR A 59 14.889 -17.930 -23.134 1.00 0.00 O ATOM 887 CG2 THR A 59 16.785 -17.197 -21.888 1.00 0.00 C ATOM 0 H THR A 59 14.139 -16.001 -21.595 1.00 0.00 H new ATOM 0 HA THR A 59 16.135 -14.774 -23.129 1.00 0.00 H new ATOM 0 HB THR A 59 16.573 -17.053 -24.011 1.00 0.00 H new ATOM 0 HG1 THR A 59 15.281 -18.824 -23.046 1.00 0.00 H new ATOM 0 HG21 THR A 59 17.139 -18.228 -21.883 1.00 0.00 H new ATOM 0 HG22 THR A 59 17.640 -16.520 -21.897 1.00 0.00 H new ATOM 0 HG23 THR A 59 16.187 -17.014 -20.995 1.00 0.00 H new ATOM 895 N LEU A 60 13.540 -15.407 -25.034 1.00 0.00 N ATOM 896 CA LEU A 60 12.928 -14.998 -26.330 1.00 0.00 C ATOM 897 C LEU A 60 12.823 -13.447 -26.532 1.00 0.00 C ATOM 898 O LEU A 60 13.284 -12.953 -27.564 1.00 0.00 O ATOM 899 CB LEU A 60 11.549 -15.708 -26.483 1.00 0.00 C ATOM 900 CG LEU A 60 11.563 -17.252 -26.659 1.00 0.00 C ATOM 901 CD1 LEU A 60 10.167 -17.845 -26.441 1.00 0.00 C ATOM 902 CD2 LEU A 60 12.064 -17.691 -28.048 1.00 0.00 C ATOM 0 H LEU A 60 12.871 -15.808 -24.376 1.00 0.00 H new ATOM 0 HA LEU A 60 13.599 -15.320 -27.127 1.00 0.00 H new ATOM 0 HB2 LEU A 60 10.948 -15.473 -25.604 1.00 0.00 H new ATOM 0 HB3 LEU A 60 11.039 -15.274 -27.343 1.00 0.00 H new ATOM 0 HG LEU A 60 12.256 -17.627 -25.906 1.00 0.00 H new ATOM 0 HD11 LEU A 60 10.207 -18.927 -26.570 1.00 0.00 H new ATOM 0 HD12 LEU A 60 9.826 -17.613 -25.432 1.00 0.00 H new ATOM 0 HD13 LEU A 60 9.473 -17.418 -27.165 1.00 0.00 H new ATOM 0 HD21 LEU A 60 12.052 -18.779 -28.112 1.00 0.00 H new ATOM 0 HD22 LEU A 60 11.414 -17.275 -28.818 1.00 0.00 H new ATOM 0 HD23 LEU A 60 13.081 -17.330 -28.199 1.00 0.00 H new ATOM 914 N LYS A 61 12.227 -12.675 -25.593 1.00 0.00 N ATOM 915 CA LYS A 61 12.228 -11.184 -25.669 1.00 0.00 C ATOM 916 C LYS A 61 12.115 -10.561 -24.241 1.00 0.00 C ATOM 917 O LYS A 61 11.025 -10.441 -23.674 1.00 0.00 O ATOM 918 CB LYS A 61 11.122 -10.675 -26.643 1.00 0.00 C ATOM 919 CG LYS A 61 11.413 -9.367 -27.417 1.00 0.00 C ATOM 920 CD LYS A 61 11.547 -8.094 -26.548 1.00 0.00 C ATOM 921 CE LYS A 61 11.588 -6.770 -27.339 1.00 0.00 C ATOM 922 NZ LYS A 61 10.241 -6.457 -27.890 1.00 0.00 N ATOM 0 H LYS A 61 11.742 -13.050 -24.778 1.00 0.00 H new ATOM 0 HA LYS A 61 13.180 -10.851 -26.083 1.00 0.00 H new ATOM 0 HB2 LYS A 61 10.924 -11.462 -27.371 1.00 0.00 H new ATOM 0 HB3 LYS A 61 10.206 -10.532 -26.070 1.00 0.00 H new ATOM 0 HG2 LYS A 61 12.335 -9.498 -27.983 1.00 0.00 H new ATOM 0 HG3 LYS A 61 10.614 -9.209 -28.141 1.00 0.00 H new ATOM 0 HD2 LYS A 61 10.710 -8.058 -25.850 1.00 0.00 H new ATOM 0 HD3 LYS A 61 12.456 -8.173 -25.952 1.00 0.00 H new ATOM 0 HE2 LYS A 61 11.920 -5.960 -26.689 1.00 0.00 H new ATOM 0 HE3 LYS A 61 12.312 -6.845 -28.150 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 10.335 -6.138 -28.875 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 9.646 -7.309 -27.857 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 9.800 -5.705 -27.323 1.00 0.00 H new ATOM 936 N THR A 62 13.256 -10.125 -23.682 1.00 0.00 N ATOM 937 CA THR A 62 13.297 -9.347 -22.403 1.00 0.00 C ATOM 938 C THR A 62 12.902 -7.843 -22.626 1.00 0.00 C ATOM 939 O THR A 62 13.151 -7.249 -23.683 1.00 0.00 O ATOM 940 CB THR A 62 14.702 -9.549 -21.748 1.00 0.00 C ATOM 941 OG1 THR A 62 14.844 -10.896 -21.305 1.00 0.00 O ATOM 942 CG2 THR A 62 15.006 -8.708 -20.495 1.00 0.00 C ATOM 0 H THR A 62 14.176 -10.293 -24.089 1.00 0.00 H new ATOM 0 HA THR A 62 12.547 -9.720 -21.705 1.00 0.00 H new ATOM 0 HB THR A 62 15.381 -9.245 -22.545 1.00 0.00 H new ATOM 0 HG1 THR A 62 14.907 -11.491 -22.081 1.00 0.00 H new ATOM 0 HG21 THR A 62 16.009 -8.939 -20.136 1.00 0.00 H new ATOM 0 HG22 THR A 62 14.945 -7.649 -20.744 1.00 0.00 H new ATOM 0 HG23 THR A 62 14.280 -8.940 -19.716 1.00 0.00 H new ATOM 950 N THR A 63 12.235 -7.215 -21.640 1.00 0.00 N ATOM 951 CA THR A 63 11.829 -5.774 -21.718 1.00 0.00 C ATOM 952 C THR A 63 11.742 -5.168 -20.279 1.00 0.00 C ATOM 953 O THR A 63 11.176 -5.766 -19.362 1.00 0.00 O ATOM 954 CB THR A 63 10.514 -5.619 -22.544 1.00 0.00 C ATOM 955 OG1 THR A 63 10.703 -6.159 -23.851 1.00 0.00 O ATOM 956 CG2 THR A 63 10.032 -4.178 -22.761 1.00 0.00 C ATOM 0 H THR A 63 11.959 -7.673 -20.772 1.00 0.00 H new ATOM 0 HA THR A 63 12.587 -5.201 -22.253 1.00 0.00 H new ATOM 0 HB THR A 63 9.766 -6.141 -21.947 1.00 0.00 H new ATOM 0 HG1 THR A 63 11.660 -6.296 -24.013 1.00 0.00 H new ATOM 0 HG21 THR A 63 9.112 -4.186 -23.346 1.00 0.00 H new ATOM 0 HG22 THR A 63 9.844 -3.708 -21.796 1.00 0.00 H new ATOM 0 HG23 THR A 63 10.797 -3.615 -23.296 1.00 0.00 H new ATOM 964 N GLN A 64 12.312 -3.968 -20.084 1.00 0.00 N ATOM 965 CA GLN A 64 12.413 -3.313 -18.746 1.00 0.00 C ATOM 966 C GLN A 64 11.938 -1.827 -18.797 1.00 0.00 C ATOM 967 O GLN A 64 12.285 -1.082 -19.720 1.00 0.00 O ATOM 968 CB GLN A 64 13.885 -3.451 -18.264 1.00 0.00 C ATOM 969 CG GLN A 64 14.150 -3.007 -16.800 1.00 0.00 C ATOM 970 CD GLN A 64 15.602 -3.197 -16.344 1.00 0.00 C ATOM 971 OE1 GLN A 64 16.115 -4.306 -16.239 1.00 0.00 O ATOM 972 NE2 GLN A 64 16.315 -2.139 -16.041 1.00 0.00 N ATOM 0 H GLN A 64 12.718 -3.416 -20.840 1.00 0.00 H new ATOM 0 HA GLN A 64 11.750 -3.803 -18.032 1.00 0.00 H new ATOM 0 HB2 GLN A 64 14.188 -4.492 -18.371 1.00 0.00 H new ATOM 0 HB3 GLN A 64 14.523 -2.864 -18.925 1.00 0.00 H new ATOM 0 HG2 GLN A 64 13.882 -1.956 -16.696 1.00 0.00 H new ATOM 0 HG3 GLN A 64 13.495 -3.571 -16.136 1.00 0.00 H new ATOM 0 HE21 GLN A 64 15.906 -1.208 -16.122 1.00 0.00 H new ATOM 0 HE22 GLN A 64 17.279 -2.247 -15.724 1.00 0.00 H new ATOM 981 N PHE A 65 11.188 -1.383 -17.770 1.00 0.00 N ATOM 982 CA PHE A 65 10.764 0.040 -17.630 1.00 0.00 C ATOM 983 C PHE A 65 10.780 0.554 -16.153 1.00 0.00 C ATOM 984 O PHE A 65 10.576 -0.206 -15.201 1.00 0.00 O ATOM 985 CB PHE A 65 9.401 0.269 -18.343 1.00 0.00 C ATOM 986 CG PHE A 65 8.145 -0.458 -17.814 1.00 0.00 C ATOM 987 CD1 PHE A 65 7.451 0.044 -16.707 1.00 0.00 C ATOM 988 CD2 PHE A 65 7.614 -1.541 -18.522 1.00 0.00 C ATOM 989 CE1 PHE A 65 6.234 -0.515 -16.328 1.00 0.00 C ATOM 990 CE2 PHE A 65 6.395 -2.100 -18.143 1.00 0.00 C ATOM 991 CZ PHE A 65 5.702 -1.582 -17.052 1.00 0.00 C ATOM 0 H PHE A 65 10.857 -1.986 -17.017 1.00 0.00 H new ATOM 0 HA PHE A 65 11.511 0.654 -18.133 1.00 0.00 H new ATOM 0 HB2 PHE A 65 9.195 1.339 -18.322 1.00 0.00 H new ATOM 0 HB3 PHE A 65 9.526 -0.011 -19.389 1.00 0.00 H new ATOM 0 HD1 PHE A 65 7.862 0.869 -16.144 1.00 0.00 H new ATOM 0 HD2 PHE A 65 8.151 -1.946 -19.367 1.00 0.00 H new ATOM 0 HE1 PHE A 65 5.702 -0.123 -15.474 1.00 0.00 H new ATOM 0 HE2 PHE A 65 5.988 -2.934 -18.695 1.00 0.00 H new ATOM 0 HZ PHE A 65 4.751 -2.007 -16.766 1.00 0.00 H new ATOM 1001 N SER A 66 10.976 1.876 -15.987 1.00 0.00 N ATOM 1002 CA SER A 66 10.882 2.572 -14.673 1.00 0.00 C ATOM 1003 C SER A 66 10.081 3.903 -14.829 1.00 0.00 C ATOM 1004 O SER A 66 10.587 4.849 -15.446 1.00 0.00 O ATOM 1005 CB SER A 66 12.303 2.816 -14.109 1.00 0.00 C ATOM 1006 OG SER A 66 13.032 3.758 -14.902 1.00 0.00 O ATOM 0 H SER A 66 11.206 2.501 -16.760 1.00 0.00 H new ATOM 0 HA SER A 66 10.343 1.946 -13.962 1.00 0.00 H new ATOM 0 HB2 SER A 66 12.230 3.182 -13.085 1.00 0.00 H new ATOM 0 HB3 SER A 66 12.847 1.872 -14.073 1.00 0.00 H new ATOM 0 HG SER A 66 12.405 4.363 -15.350 1.00 0.00 H new ATOM 1012 N CYS A 67 8.853 3.973 -14.286 1.00 0.00 N ATOM 1013 CA CYS A 67 7.960 5.163 -14.415 1.00 0.00 C ATOM 1014 C CYS A 67 7.296 5.553 -13.058 1.00 0.00 C ATOM 1015 O CYS A 67 7.077 4.713 -12.179 1.00 0.00 O ATOM 1016 CB CYS A 67 6.908 4.811 -15.491 1.00 0.00 C ATOM 1017 SG CYS A 67 5.775 6.210 -15.812 1.00 0.00 S ATOM 0 H CYS A 67 8.442 3.213 -13.744 1.00 0.00 H new ATOM 0 HA CYS A 67 8.536 6.040 -14.709 1.00 0.00 H new ATOM 0 HB2 CYS A 67 7.413 4.532 -16.416 1.00 0.00 H new ATOM 0 HB3 CYS A 67 6.333 3.944 -15.167 1.00 0.00 H new ATOM 0 HG CYS A 67 5.139 6.512 -14.720 1.00 0.00 H new ATOM 1023 N THR A 68 6.922 6.834 -12.885 1.00 0.00 N ATOM 1024 CA THR A 68 6.199 7.309 -11.669 1.00 0.00 C ATOM 1025 C THR A 68 4.714 6.811 -11.681 1.00 0.00 C ATOM 1026 O THR A 68 4.021 6.826 -12.703 1.00 0.00 O ATOM 1027 CB THR A 68 6.255 8.869 -11.515 1.00 0.00 C ATOM 1028 OG1 THR A 68 7.469 9.433 -12.011 1.00 0.00 O ATOM 1029 CG2 THR A 68 6.108 9.348 -10.061 1.00 0.00 C ATOM 0 H THR A 68 7.105 7.568 -13.569 1.00 0.00 H new ATOM 0 HA THR A 68 6.709 6.882 -10.806 1.00 0.00 H new ATOM 0 HB THR A 68 5.405 9.209 -12.106 1.00 0.00 H new ATOM 0 HG1 THR A 68 7.475 9.387 -12.990 1.00 0.00 H new ATOM 0 HG21 THR A 68 6.156 10.436 -10.030 1.00 0.00 H new ATOM 0 HG22 THR A 68 5.149 9.016 -9.664 1.00 0.00 H new ATOM 0 HG23 THR A 68 6.915 8.932 -9.458 1.00 0.00 H new ATOM 1037 N LEU A 69 4.203 6.405 -10.518 1.00 0.00 N ATOM 1038 CA LEU A 69 2.774 6.025 -10.351 1.00 0.00 C ATOM 1039 C LEU A 69 1.824 7.280 -10.480 1.00 0.00 C ATOM 1040 O LEU A 69 1.967 8.267 -9.750 1.00 0.00 O ATOM 1041 CB LEU A 69 2.736 5.249 -9.005 1.00 0.00 C ATOM 1042 CG LEU A 69 1.375 4.655 -8.584 1.00 0.00 C ATOM 1043 CD1 LEU A 69 1.008 3.438 -9.448 1.00 0.00 C ATOM 1044 CD2 LEU A 69 1.411 4.254 -7.098 1.00 0.00 C ATOM 0 H LEU A 69 4.753 6.326 -9.662 1.00 0.00 H new ATOM 0 HA LEU A 69 2.383 5.380 -11.138 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.459 4.435 -9.061 1.00 0.00 H new ATOM 0 HB3 LEU A 69 3.073 5.921 -8.216 1.00 0.00 H new ATOM 0 HG LEU A 69 0.612 5.419 -8.733 1.00 0.00 H new ATOM 0 HD11 LEU A 69 0.045 3.042 -9.128 1.00 0.00 H new ATOM 0 HD12 LEU A 69 0.947 3.739 -10.494 1.00 0.00 H new ATOM 0 HD13 LEU A 69 1.772 2.669 -9.336 1.00 0.00 H new ATOM 0 HD21 LEU A 69 0.446 3.836 -6.810 1.00 0.00 H new ATOM 0 HD22 LEU A 69 2.191 3.509 -6.941 1.00 0.00 H new ATOM 0 HD23 LEU A 69 1.622 5.133 -6.489 1.00 0.00 H new ATOM 1056 N GLY A 70 0.913 7.273 -11.470 1.00 0.00 N ATOM 1057 CA GLY A 70 0.298 8.521 -12.022 1.00 0.00 C ATOM 1058 C GLY A 70 0.756 8.966 -13.441 1.00 0.00 C ATOM 1059 O GLY A 70 -0.060 9.445 -14.229 1.00 0.00 O ATOM 0 H GLY A 70 0.577 6.418 -11.914 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -0.783 8.386 -12.042 1.00 0.00 H new ATOM 0 HA3 GLY A 70 0.504 9.336 -11.328 1.00 0.00 H new ATOM 1063 N GLU A 71 2.058 8.857 -13.737 1.00 0.00 N ATOM 1064 CA GLU A 71 2.689 9.305 -15.008 1.00 0.00 C ATOM 1065 C GLU A 71 2.555 8.262 -16.172 1.00 0.00 C ATOM 1066 O GLU A 71 2.419 7.048 -15.957 1.00 0.00 O ATOM 1067 CB GLU A 71 4.162 9.573 -14.581 1.00 0.00 C ATOM 1068 CG GLU A 71 5.183 10.129 -15.602 1.00 0.00 C ATOM 1069 CD GLU A 71 6.558 10.378 -14.981 1.00 0.00 C ATOM 1070 OE1 GLU A 71 7.154 9.439 -14.399 1.00 0.00 O ATOM 1071 OE2 GLU A 71 7.041 11.523 -15.055 1.00 0.00 O ATOM 0 H GLU A 71 2.729 8.445 -13.088 1.00 0.00 H new ATOM 0 HA GLU A 71 2.206 10.183 -15.436 1.00 0.00 H new ATOM 0 HB2 GLU A 71 4.133 10.269 -13.742 1.00 0.00 H new ATOM 0 HB3 GLU A 71 4.564 8.633 -14.202 1.00 0.00 H new ATOM 0 HG2 GLU A 71 5.284 9.426 -16.429 1.00 0.00 H new ATOM 0 HG3 GLU A 71 4.803 11.061 -16.020 1.00 0.00 H new ATOM 1078 N LYS A 72 2.608 8.762 -17.423 1.00 0.00 N ATOM 1079 CA LYS A 72 2.782 7.899 -18.630 1.00 0.00 C ATOM 1080 C LYS A 72 4.221 7.916 -19.235 1.00 0.00 C ATOM 1081 O LYS A 72 4.970 8.891 -19.122 1.00 0.00 O ATOM 1082 CB LYS A 72 1.690 8.116 -19.711 1.00 0.00 C ATOM 1083 CG LYS A 72 1.545 9.495 -20.389 1.00 0.00 C ATOM 1084 CD LYS A 72 0.963 9.471 -21.827 1.00 0.00 C ATOM 1085 CE LYS A 72 -0.242 8.554 -22.162 1.00 0.00 C ATOM 1086 NZ LYS A 72 -1.538 9.016 -21.605 1.00 0.00 N ATOM 0 H LYS A 72 2.534 9.757 -17.634 1.00 0.00 H new ATOM 0 HA LYS A 72 2.641 6.888 -18.247 1.00 0.00 H new ATOM 0 HB2 LYS A 72 1.862 7.383 -20.499 1.00 0.00 H new ATOM 0 HB3 LYS A 72 0.729 7.875 -19.256 1.00 0.00 H new ATOM 0 HG2 LYS A 72 0.906 10.122 -19.767 1.00 0.00 H new ATOM 0 HG3 LYS A 72 2.525 9.971 -20.420 1.00 0.00 H new ATOM 0 HD2 LYS A 72 0.672 10.492 -22.076 1.00 0.00 H new ATOM 0 HD3 LYS A 72 1.775 9.198 -22.501 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -0.333 8.476 -23.245 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -0.036 7.552 -21.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -2.304 8.786 -22.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -1.714 8.542 -20.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -1.505 10.045 -21.458 1.00 0.00 H new ATOM 1100 N PHE A 73 4.577 6.803 -19.897 1.00 0.00 N ATOM 1101 CA PHE A 73 5.946 6.564 -20.442 1.00 0.00 C ATOM 1102 C PHE A 73 5.926 5.909 -21.869 1.00 0.00 C ATOM 1103 O PHE A 73 4.945 5.278 -22.278 1.00 0.00 O ATOM 1104 CB PHE A 73 6.776 5.755 -19.390 1.00 0.00 C ATOM 1105 CG PHE A 73 6.439 4.256 -19.227 1.00 0.00 C ATOM 1106 CD1 PHE A 73 5.310 3.843 -18.511 1.00 0.00 C ATOM 1107 CD2 PHE A 73 7.206 3.302 -19.902 1.00 0.00 C ATOM 1108 CE1 PHE A 73 4.918 2.507 -18.527 1.00 0.00 C ATOM 1109 CE2 PHE A 73 6.811 1.970 -19.918 1.00 0.00 C ATOM 1110 CZ PHE A 73 5.656 1.577 -19.248 1.00 0.00 C ATOM 0 H PHE A 73 3.930 6.035 -20.076 1.00 0.00 H new ATOM 0 HA PHE A 73 6.441 7.522 -20.601 1.00 0.00 H new ATOM 0 HB2 PHE A 73 7.830 5.837 -19.655 1.00 0.00 H new ATOM 0 HB3 PHE A 73 6.653 6.236 -18.420 1.00 0.00 H new ATOM 0 HD1 PHE A 73 4.740 4.564 -17.943 1.00 0.00 H new ATOM 0 HD2 PHE A 73 8.109 3.601 -20.413 1.00 0.00 H new ATOM 0 HE1 PHE A 73 4.041 2.194 -17.979 1.00 0.00 H new ATOM 0 HE2 PHE A 73 7.401 1.239 -20.451 1.00 0.00 H new ATOM 0 HZ PHE A 73 5.333 0.547 -19.289 1.00 0.00 H new ATOM 1120 N GLU A 74 7.064 5.988 -22.587 1.00 0.00 N ATOM 1121 CA GLU A 74 7.307 5.180 -23.819 1.00 0.00 C ATOM 1122 C GLU A 74 7.572 3.675 -23.476 1.00 0.00 C ATOM 1123 O GLU A 74 8.684 3.274 -23.112 1.00 0.00 O ATOM 1124 CB GLU A 74 8.503 5.824 -24.581 1.00 0.00 C ATOM 1125 CG GLU A 74 8.863 5.176 -25.951 1.00 0.00 C ATOM 1126 CD GLU A 74 8.397 5.892 -27.204 1.00 0.00 C ATOM 1127 OE1 GLU A 74 7.181 6.118 -27.370 1.00 0.00 O ATOM 1128 OE2 GLU A 74 9.255 6.154 -28.078 1.00 0.00 O ATOM 0 H GLU A 74 7.839 6.604 -22.341 1.00 0.00 H new ATOM 0 HA GLU A 74 6.421 5.187 -24.454 1.00 0.00 H new ATOM 0 HB2 GLU A 74 8.278 6.878 -24.747 1.00 0.00 H new ATOM 0 HB3 GLU A 74 9.383 5.783 -23.939 1.00 0.00 H new ATOM 0 HG2 GLU A 74 9.947 5.077 -26.003 1.00 0.00 H new ATOM 0 HG3 GLU A 74 8.450 4.167 -25.966 1.00 0.00 H new ATOM 1135 N GLU A 75 6.540 2.838 -23.643 1.00 0.00 N ATOM 1136 CA GLU A 75 6.667 1.370 -23.547 1.00 0.00 C ATOM 1137 C GLU A 75 6.929 0.796 -24.970 1.00 0.00 C ATOM 1138 O GLU A 75 6.001 0.563 -25.752 1.00 0.00 O ATOM 1139 CB GLU A 75 5.359 0.845 -22.903 1.00 0.00 C ATOM 1140 CG GLU A 75 5.372 -0.662 -22.538 1.00 0.00 C ATOM 1141 CD GLU A 75 4.055 -1.292 -22.103 1.00 0.00 C ATOM 1142 OE1 GLU A 75 2.988 -0.639 -22.129 1.00 0.00 O ATOM 1143 OE2 GLU A 75 4.073 -2.496 -21.782 1.00 0.00 O ATOM 0 H GLU A 75 5.592 3.155 -23.848 1.00 0.00 H new ATOM 0 HA GLU A 75 7.506 1.054 -22.926 1.00 0.00 H new ATOM 0 HB2 GLU A 75 5.159 1.421 -22.000 1.00 0.00 H new ATOM 0 HB3 GLU A 75 4.533 1.031 -23.589 1.00 0.00 H new ATOM 0 HG2 GLU A 75 5.740 -1.214 -23.403 1.00 0.00 H new ATOM 0 HG3 GLU A 75 6.096 -0.808 -21.736 1.00 0.00 H new ATOM 1150 N THR A 76 8.202 0.519 -25.306 1.00 0.00 N ATOM 1151 CA THR A 76 8.525 -0.357 -26.472 1.00 0.00 C ATOM 1152 C THR A 76 8.346 -1.841 -26.017 1.00 0.00 C ATOM 1153 O THR A 76 9.211 -2.432 -25.367 1.00 0.00 O ATOM 1154 CB THR A 76 9.910 0.006 -27.069 1.00 0.00 C ATOM 1155 OG1 THR A 76 9.928 1.386 -27.424 1.00 0.00 O ATOM 1156 CG2 THR A 76 10.249 -0.779 -28.346 1.00 0.00 C ATOM 0 H THR A 76 9.016 0.875 -24.805 1.00 0.00 H new ATOM 0 HA THR A 76 7.842 -0.200 -27.307 1.00 0.00 H new ATOM 0 HB THR A 76 10.641 -0.242 -26.299 1.00 0.00 H new ATOM 0 HG1 THR A 76 10.804 1.616 -27.800 1.00 0.00 H new ATOM 0 HG21 THR A 76 11.231 -0.476 -28.710 1.00 0.00 H new ATOM 0 HG22 THR A 76 10.258 -1.846 -28.125 1.00 0.00 H new ATOM 0 HG23 THR A 76 9.499 -0.572 -29.110 1.00 0.00 H new ATOM 1164 N THR A 77 7.153 -2.377 -26.312 1.00 0.00 N ATOM 1165 CA THR A 77 6.578 -3.586 -25.651 1.00 0.00 C ATOM 1166 C THR A 77 7.387 -4.915 -25.815 1.00 0.00 C ATOM 1167 O THR A 77 8.310 -5.019 -26.630 1.00 0.00 O ATOM 1168 CB THR A 77 5.099 -3.751 -26.160 1.00 0.00 C ATOM 1169 OG1 THR A 77 5.034 -3.808 -27.582 1.00 0.00 O ATOM 1170 CG2 THR A 77 4.125 -2.654 -25.702 1.00 0.00 C ATOM 0 H THR A 77 6.540 -1.985 -27.027 1.00 0.00 H new ATOM 0 HA THR A 77 6.625 -3.408 -24.577 1.00 0.00 H new ATOM 0 HB THR A 77 4.784 -4.690 -25.706 1.00 0.00 H new ATOM 0 HG1 THR A 77 4.871 -2.910 -27.938 1.00 0.00 H new ATOM 0 HG21 THR A 77 3.133 -2.857 -26.104 1.00 0.00 H new ATOM 0 HG22 THR A 77 4.079 -2.640 -24.613 1.00 0.00 H new ATOM 0 HG23 THR A 77 4.472 -1.686 -26.063 1.00 0.00 H new ATOM 1178 N ALA A 78 6.994 -5.969 -25.071 1.00 0.00 N ATOM 1179 CA ALA A 78 7.437 -7.368 -25.344 1.00 0.00 C ATOM 1180 C ALA A 78 7.268 -7.890 -26.817 1.00 0.00 C ATOM 1181 O ALA A 78 8.218 -8.453 -27.370 1.00 0.00 O ATOM 1182 CB ALA A 78 6.723 -8.258 -24.310 1.00 0.00 C ATOM 0 H ALA A 78 6.367 -5.885 -24.270 1.00 0.00 H new ATOM 0 HA ALA A 78 8.522 -7.402 -25.241 1.00 0.00 H new ATOM 0 HB1 ALA A 78 7.012 -9.298 -24.464 1.00 0.00 H new ATOM 0 HB2 ALA A 78 7.007 -7.947 -23.305 1.00 0.00 H new ATOM 0 HB3 ALA A 78 5.644 -8.160 -24.429 1.00 0.00 H new ATOM 1188 N ASP A 79 6.141 -7.575 -27.486 1.00 0.00 N ATOM 1189 CA ASP A 79 6.007 -7.607 -28.975 1.00 0.00 C ATOM 1190 C ASP A 79 7.140 -6.840 -29.753 1.00 0.00 C ATOM 1191 O ASP A 79 7.890 -7.427 -30.532 1.00 0.00 O ATOM 1192 CB ASP A 79 4.600 -7.053 -29.378 1.00 0.00 C ATOM 1193 CG ASP A 79 3.344 -7.668 -28.759 1.00 0.00 C ATOM 1194 OD1 ASP A 79 3.176 -8.902 -28.810 1.00 0.00 O ATOM 1195 OD2 ASP A 79 2.500 -6.899 -28.243 1.00 0.00 O ATOM 0 H ASP A 79 5.284 -7.287 -27.013 1.00 0.00 H new ATOM 0 HA ASP A 79 6.115 -8.651 -29.270 1.00 0.00 H new ATOM 0 HB2 ASP A 79 4.590 -5.988 -29.147 1.00 0.00 H new ATOM 0 HB3 ASP A 79 4.510 -7.146 -30.460 1.00 0.00 H new ATOM 1200 N GLY A 80 7.272 -5.525 -29.541 1.00 0.00 N ATOM 1201 CA GLY A 80 7.807 -4.598 -30.582 1.00 0.00 C ATOM 1202 C GLY A 80 7.003 -3.296 -30.820 1.00 0.00 C ATOM 1203 O GLY A 80 7.599 -2.282 -31.185 1.00 0.00 O ATOM 0 H GLY A 80 7.020 -5.067 -28.665 1.00 0.00 H new ATOM 0 HA2 GLY A 80 8.826 -4.325 -30.306 1.00 0.00 H new ATOM 0 HA3 GLY A 80 7.866 -5.141 -31.525 1.00 0.00 H new ATOM 1207 N ARG A 81 5.671 -3.313 -30.622 1.00 0.00 N ATOM 1208 CA ARG A 81 4.805 -2.101 -30.677 1.00 0.00 C ATOM 1209 C ARG A 81 5.204 -1.028 -29.613 1.00 0.00 C ATOM 1210 O ARG A 81 5.385 -1.364 -28.435 1.00 0.00 O ATOM 1211 CB ARG A 81 3.330 -2.501 -30.377 1.00 0.00 C ATOM 1212 CG ARG A 81 2.642 -3.594 -31.238 1.00 0.00 C ATOM 1213 CD ARG A 81 1.234 -3.980 -30.728 1.00 0.00 C ATOM 1214 NE ARG A 81 1.298 -4.653 -29.393 1.00 0.00 N ATOM 1215 CZ ARG A 81 0.894 -4.141 -28.231 1.00 0.00 C ATOM 1216 NH1 ARG A 81 0.250 -3.012 -28.099 1.00 0.00 N ATOM 1217 NH2 ARG A 81 1.158 -4.820 -27.160 1.00 0.00 N ATOM 0 H ARG A 81 5.155 -4.169 -30.418 1.00 0.00 H new ATOM 0 HA ARG A 81 4.927 -1.681 -31.675 1.00 0.00 H new ATOM 0 HB2 ARG A 81 3.286 -2.828 -29.338 1.00 0.00 H new ATOM 0 HB3 ARG A 81 2.725 -1.597 -30.453 1.00 0.00 H new ATOM 0 HG2 ARG A 81 2.564 -3.241 -32.266 1.00 0.00 H new ATOM 0 HG3 ARG A 81 3.271 -4.484 -31.254 1.00 0.00 H new ATOM 0 HD2 ARG A 81 0.614 -3.086 -30.656 1.00 0.00 H new ATOM 0 HD3 ARG A 81 0.755 -4.643 -31.448 1.00 0.00 H new ATOM 0 HE ARG A 81 1.689 -5.595 -29.370 1.00 0.00 H new ATOM 0 HH11 ARG A 81 0.023 -2.455 -28.923 1.00 0.00 H new ATOM 0 HH12 ARG A 81 -0.025 -2.687 -27.172 1.00 0.00 H new ATOM 0 HH21 ARG A 81 1.656 -5.708 -27.229 1.00 0.00 H new ATOM 0 HH22 ARG A 81 0.868 -4.467 -26.248 1.00 0.00 H new ATOM 1231 N LYS A 82 5.274 0.251 -30.008 1.00 0.00 N ATOM 1232 CA LYS A 82 5.405 1.366 -29.035 1.00 0.00 C ATOM 1233 C LYS A 82 4.010 1.822 -28.509 1.00 0.00 C ATOM 1234 O LYS A 82 3.090 2.103 -29.286 1.00 0.00 O ATOM 1235 CB LYS A 82 6.176 2.562 -29.636 1.00 0.00 C ATOM 1236 CG LYS A 82 7.649 2.292 -30.037 1.00 0.00 C ATOM 1237 CD LYS A 82 8.461 3.581 -29.866 1.00 0.00 C ATOM 1238 CE LYS A 82 9.945 3.501 -30.232 1.00 0.00 C ATOM 1239 NZ LYS A 82 10.528 4.843 -29.942 1.00 0.00 N ATOM 0 H LYS A 82 5.243 0.547 -30.984 1.00 0.00 H new ATOM 0 HA LYS A 82 5.983 0.988 -28.191 1.00 0.00 H new ATOM 0 HB2 LYS A 82 5.638 2.908 -30.519 1.00 0.00 H new ATOM 0 HB3 LYS A 82 6.161 3.378 -28.913 1.00 0.00 H new ATOM 0 HG2 LYS A 82 8.068 1.499 -29.417 1.00 0.00 H new ATOM 0 HG3 LYS A 82 7.700 1.950 -31.071 1.00 0.00 H new ATOM 0 HD2 LYS A 82 8.000 4.359 -30.474 1.00 0.00 H new ATOM 0 HD3 LYS A 82 8.382 3.900 -28.827 1.00 0.00 H new ATOM 0 HE2 LYS A 82 10.446 2.727 -29.651 1.00 0.00 H new ATOM 0 HE3 LYS A 82 10.071 3.243 -31.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 11.398 4.730 -29.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 10.751 5.325 -30.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 9.842 5.411 -29.404 1.00 0.00 H new ATOM 1253 N THR A 83 3.881 1.903 -27.179 1.00 0.00 N ATOM 1254 CA THR A 83 2.622 2.315 -26.500 1.00 0.00 C ATOM 1255 C THR A 83 2.943 3.423 -25.453 1.00 0.00 C ATOM 1256 O THR A 83 3.917 3.339 -24.697 1.00 0.00 O ATOM 1257 CB THR A 83 1.856 1.108 -25.864 1.00 0.00 C ATOM 1258 OG1 THR A 83 2.625 0.497 -24.840 1.00 0.00 O ATOM 1259 CG2 THR A 83 1.487 -0.032 -26.822 1.00 0.00 C ATOM 0 H THR A 83 4.640 1.687 -26.533 1.00 0.00 H new ATOM 0 HA THR A 83 1.944 2.721 -27.251 1.00 0.00 H new ATOM 0 HB THR A 83 0.939 1.575 -25.505 1.00 0.00 H new ATOM 0 HG1 THR A 83 2.380 0.882 -23.973 1.00 0.00 H new ATOM 0 HG21 THR A 83 0.960 -0.813 -26.273 1.00 0.00 H new ATOM 0 HG22 THR A 83 0.844 0.352 -27.614 1.00 0.00 H new ATOM 0 HG23 THR A 83 2.395 -0.446 -27.261 1.00 0.00 H new ATOM 1267 N GLN A 84 2.112 4.476 -25.386 1.00 0.00 N ATOM 1268 CA GLN A 84 2.229 5.512 -24.326 1.00 0.00 C ATOM 1269 C GLN A 84 1.402 5.059 -23.080 1.00 0.00 C ATOM 1270 O GLN A 84 0.178 5.209 -23.035 1.00 0.00 O ATOM 1271 CB GLN A 84 1.827 6.888 -24.923 1.00 0.00 C ATOM 1272 CG GLN A 84 2.890 7.564 -25.836 1.00 0.00 C ATOM 1273 CD GLN A 84 4.142 8.063 -25.093 1.00 0.00 C ATOM 1274 OE1 GLN A 84 4.055 8.765 -24.090 1.00 0.00 O ATOM 1275 NE2 GLN A 84 5.337 7.747 -25.532 1.00 0.00 N ATOM 0 H GLN A 84 1.352 4.639 -26.047 1.00 0.00 H new ATOM 0 HA GLN A 84 3.253 5.631 -23.972 1.00 0.00 H new ATOM 0 HB2 GLN A 84 0.910 6.760 -25.498 1.00 0.00 H new ATOM 0 HB3 GLN A 84 1.596 7.566 -24.102 1.00 0.00 H new ATOM 0 HG2 GLN A 84 3.197 6.853 -26.603 1.00 0.00 H new ATOM 0 HG3 GLN A 84 2.427 8.407 -26.349 1.00 0.00 H new ATOM 0 HE21 GLN A 84 5.437 7.165 -26.363 1.00 0.00 H new ATOM 0 HE22 GLN A 84 6.166 8.083 -25.042 1.00 0.00 H new ATOM 1284 N THR A 85 2.072 4.436 -22.097 1.00 0.00 N ATOM 1285 CA THR A 85 1.391 3.605 -21.060 1.00 0.00 C ATOM 1286 C THR A 85 1.301 4.377 -19.709 1.00 0.00 C ATOM 1287 O THR A 85 2.335 4.655 -19.096 1.00 0.00 O ATOM 1288 CB THR A 85 2.108 2.222 -20.960 1.00 0.00 C ATOM 1289 OG1 THR A 85 2.008 1.532 -22.204 1.00 0.00 O ATOM 1290 CG2 THR A 85 1.530 1.259 -19.911 1.00 0.00 C ATOM 0 H THR A 85 3.085 4.485 -21.989 1.00 0.00 H new ATOM 0 HA THR A 85 0.358 3.405 -21.345 1.00 0.00 H new ATOM 0 HB THR A 85 3.129 2.475 -20.674 1.00 0.00 H new ATOM 0 HG1 THR A 85 2.277 0.598 -22.082 1.00 0.00 H new ATOM 0 HG21 THR A 85 2.097 0.328 -19.920 1.00 0.00 H new ATOM 0 HG22 THR A 85 1.597 1.715 -18.923 1.00 0.00 H new ATOM 0 HG23 THR A 85 0.486 1.050 -20.145 1.00 0.00 H new ATOM 1298 N VAL A 86 0.080 4.704 -19.228 1.00 0.00 N ATOM 1299 CA VAL A 86 -0.118 5.316 -17.872 1.00 0.00 C ATOM 1300 C VAL A 86 -0.208 4.229 -16.743 1.00 0.00 C ATOM 1301 O VAL A 86 -1.048 3.321 -16.793 1.00 0.00 O ATOM 1302 CB VAL A 86 -1.264 6.389 -17.857 1.00 0.00 C ATOM 1303 CG1 VAL A 86 -2.695 5.881 -18.077 1.00 0.00 C ATOM 1304 CG2 VAL A 86 -1.236 7.261 -16.582 1.00 0.00 C ATOM 0 H VAL A 86 -0.786 4.560 -19.747 1.00 0.00 H new ATOM 0 HA VAL A 86 0.779 5.887 -17.633 1.00 0.00 H new ATOM 0 HB VAL A 86 -1.022 6.980 -18.740 1.00 0.00 H new ATOM 0 HG11 VAL A 86 -3.389 6.721 -18.043 1.00 0.00 H new ATOM 0 HG12 VAL A 86 -2.763 5.394 -19.050 1.00 0.00 H new ATOM 0 HG13 VAL A 86 -2.952 5.167 -17.295 1.00 0.00 H new ATOM 0 HG21 VAL A 86 -2.048 7.987 -16.620 1.00 0.00 H new ATOM 0 HG22 VAL A 86 -1.358 6.626 -15.704 1.00 0.00 H new ATOM 0 HG23 VAL A 86 -0.283 7.786 -16.521 1.00 0.00 H new ATOM 1314 N CYS A 87 0.661 4.349 -15.719 1.00 0.00 N ATOM 1315 CA CYS A 87 0.706 3.407 -14.570 1.00 0.00 C ATOM 1316 C CYS A 87 -0.155 3.924 -13.376 1.00 0.00 C ATOM 1317 O CYS A 87 0.200 4.937 -12.768 1.00 0.00 O ATOM 1318 CB CYS A 87 2.195 3.280 -14.161 1.00 0.00 C ATOM 1319 SG CYS A 87 3.296 2.875 -15.563 1.00 0.00 S ATOM 0 H CYS A 87 1.351 5.097 -15.660 1.00 0.00 H new ATOM 0 HA CYS A 87 0.291 2.439 -14.851 1.00 0.00 H new ATOM 0 HB2 CYS A 87 2.522 4.217 -13.710 1.00 0.00 H new ATOM 0 HB3 CYS A 87 2.291 2.508 -13.398 1.00 0.00 H new ATOM 0 HG CYS A 87 3.591 3.963 -16.211 1.00 0.00 H new ATOM 1325 N ASN A 88 -1.281 3.269 -13.028 1.00 0.00 N ATOM 1326 CA ASN A 88 -2.229 3.800 -11.996 1.00 0.00 C ATOM 1327 C ASN A 88 -2.792 2.682 -11.055 1.00 0.00 C ATOM 1328 O ASN A 88 -3.363 1.696 -11.525 1.00 0.00 O ATOM 1329 CB ASN A 88 -3.320 4.683 -12.675 1.00 0.00 C ATOM 1330 CG ASN A 88 -4.335 4.014 -13.613 1.00 0.00 C ATOM 1331 OD1 ASN A 88 -5.443 3.664 -13.225 1.00 0.00 O ATOM 1332 ND2 ASN A 88 -4.014 3.829 -14.870 1.00 0.00 N ATOM 0 H ASN A 88 -1.565 2.378 -13.436 1.00 0.00 H new ATOM 0 HA ASN A 88 -1.676 4.450 -11.318 1.00 0.00 H new ATOM 0 HB2 ASN A 88 -3.880 5.182 -11.884 1.00 0.00 H new ATOM 0 HB3 ASN A 88 -2.809 5.461 -13.242 1.00 0.00 H new ATOM 0 HD21 ASN A 88 -4.683 3.399 -15.509 1.00 0.00 H new ATOM 0 HD22 ASN A 88 -3.095 4.115 -15.209 1.00 0.00 H new ATOM 1339 N PHE A 89 -2.638 2.830 -9.722 1.00 0.00 N ATOM 1340 CA PHE A 89 -3.149 1.839 -8.731 1.00 0.00 C ATOM 1341 C PHE A 89 -4.558 2.243 -8.182 1.00 0.00 C ATOM 1342 O PHE A 89 -4.750 3.363 -7.699 1.00 0.00 O ATOM 1343 CB PHE A 89 -2.088 1.665 -7.601 1.00 0.00 C ATOM 1344 CG PHE A 89 -2.430 0.574 -6.567 1.00 0.00 C ATOM 1345 CD1 PHE A 89 -2.298 -0.780 -6.894 1.00 0.00 C ATOM 1346 CD2 PHE A 89 -3.013 0.930 -5.346 1.00 0.00 C ATOM 1347 CE1 PHE A 89 -2.788 -1.760 -6.034 1.00 0.00 C ATOM 1348 CE2 PHE A 89 -3.498 -0.053 -4.488 1.00 0.00 C ATOM 1349 CZ PHE A 89 -3.398 -1.395 -4.840 1.00 0.00 C ATOM 0 H PHE A 89 -2.163 3.627 -9.299 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.295 0.875 -9.219 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -1.126 1.428 -8.056 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.969 2.616 -7.082 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.815 -1.066 -7.816 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -3.087 1.971 -5.068 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -2.694 -2.804 -6.295 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -3.952 0.226 -3.549 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.795 -2.155 -4.184 1.00 0.00 H new ATOM 1359 N THR A 90 -5.511 1.295 -8.197 1.00 0.00 N ATOM 1360 CA THR A 90 -6.838 1.458 -7.531 1.00 0.00 C ATOM 1361 C THR A 90 -7.352 0.078 -7.010 1.00 0.00 C ATOM 1362 O THR A 90 -7.302 -0.927 -7.725 1.00 0.00 O ATOM 1363 CB THR A 90 -7.856 2.192 -8.462 1.00 0.00 C ATOM 1364 OG1 THR A 90 -8.969 2.670 -7.703 1.00 0.00 O ATOM 1365 CG2 THR A 90 -8.391 1.401 -9.669 1.00 0.00 C ATOM 0 H THR A 90 -5.396 0.396 -8.665 1.00 0.00 H new ATOM 0 HA THR A 90 -6.725 2.102 -6.659 1.00 0.00 H new ATOM 0 HB THR A 90 -7.264 3.002 -8.889 1.00 0.00 H new ATOM 0 HG1 THR A 90 -9.454 1.910 -7.320 1.00 0.00 H new ATOM 0 HG21 THR A 90 -9.087 2.023 -10.232 1.00 0.00 H new ATOM 0 HG22 THR A 90 -7.560 1.113 -10.312 1.00 0.00 H new ATOM 0 HG23 THR A 90 -8.906 0.506 -9.319 1.00 0.00 H new ATOM 1373 N ASP A 91 -7.894 0.028 -5.778 1.00 0.00 N ATOM 1374 CA ASP A 91 -8.798 -1.092 -5.330 1.00 0.00 C ATOM 1375 C ASP A 91 -8.180 -2.547 -5.281 1.00 0.00 C ATOM 1376 O ASP A 91 -8.860 -3.542 -5.557 1.00 0.00 O ATOM 1377 CB ASP A 91 -10.153 -1.050 -6.111 1.00 0.00 C ATOM 1378 CG ASP A 91 -10.881 0.291 -6.160 1.00 0.00 C ATOM 1379 OD1 ASP A 91 -11.667 0.591 -5.239 1.00 0.00 O ATOM 1380 OD2 ASP A 91 -10.634 1.063 -7.115 1.00 0.00 O ATOM 0 H ASP A 91 -7.733 0.739 -5.065 1.00 0.00 H new ATOM 0 HA ASP A 91 -8.970 -0.885 -4.274 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -9.964 -1.371 -7.135 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -10.824 -1.784 -5.665 1.00 0.00 H new ATOM 1385 N GLY A 92 -6.881 -2.683 -4.952 1.00 0.00 N ATOM 1386 CA GLY A 92 -6.128 -3.951 -5.206 1.00 0.00 C ATOM 1387 C GLY A 92 -5.469 -4.172 -6.598 1.00 0.00 C ATOM 1388 O GLY A 92 -4.656 -5.092 -6.721 1.00 0.00 O ATOM 0 H GLY A 92 -6.327 -1.947 -4.515 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -5.342 -4.023 -4.455 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -6.813 -4.781 -5.031 1.00 0.00 H new ATOM 1392 N ALA A 93 -5.807 -3.377 -7.627 1.00 0.00 N ATOM 1393 CA ALA A 93 -5.313 -3.541 -9.013 1.00 0.00 C ATOM 1394 C ALA A 93 -4.321 -2.418 -9.448 1.00 0.00 C ATOM 1395 O ALA A 93 -4.634 -1.224 -9.386 1.00 0.00 O ATOM 1396 CB ALA A 93 -6.563 -3.527 -9.915 1.00 0.00 C ATOM 0 H ALA A 93 -6.443 -2.586 -7.521 1.00 0.00 H new ATOM 0 HA ALA A 93 -4.750 -4.471 -9.093 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.262 -3.645 -10.956 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -7.224 -4.347 -9.633 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -7.088 -2.580 -9.794 1.00 0.00 H new ATOM 1402 N LEU A 94 -3.148 -2.808 -9.974 1.00 0.00 N ATOM 1403 CA LEU A 94 -2.290 -1.897 -10.781 1.00 0.00 C ATOM 1404 C LEU A 94 -2.735 -1.945 -12.276 1.00 0.00 C ATOM 1405 O LEU A 94 -2.515 -2.938 -12.979 1.00 0.00 O ATOM 1406 CB LEU A 94 -0.806 -2.288 -10.545 1.00 0.00 C ATOM 1407 CG LEU A 94 0.276 -1.527 -11.353 1.00 0.00 C ATOM 1408 CD1 LEU A 94 0.353 -0.034 -10.986 1.00 0.00 C ATOM 1409 CD2 LEU A 94 1.647 -2.192 -11.147 1.00 0.00 C ATOM 0 H LEU A 94 -2.764 -3.746 -9.860 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.400 -0.857 -10.474 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -0.589 -2.155 -9.485 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.701 -3.351 -10.761 1.00 0.00 H new ATOM 0 HG LEU A 94 -0.010 -1.582 -12.403 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.127 0.448 -11.583 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -0.608 0.440 -11.187 1.00 0.00 H new ATOM 0 HD13 LEU A 94 0.594 0.069 -9.928 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.403 -1.652 -11.718 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.907 -2.170 -10.089 1.00 0.00 H new ATOM 0 HD23 LEU A 94 1.605 -3.226 -11.488 1.00 0.00 H new ATOM 1421 N VAL A 95 -3.362 -0.859 -12.749 1.00 0.00 N ATOM 1422 CA VAL A 95 -3.830 -0.730 -14.155 1.00 0.00 C ATOM 1423 C VAL A 95 -2.691 -0.057 -14.988 1.00 0.00 C ATOM 1424 O VAL A 95 -2.394 1.134 -14.836 1.00 0.00 O ATOM 1425 CB VAL A 95 -5.194 0.043 -14.214 1.00 0.00 C ATOM 1426 CG1 VAL A 95 -5.703 0.262 -15.659 1.00 0.00 C ATOM 1427 CG2 VAL A 95 -6.340 -0.660 -13.446 1.00 0.00 C ATOM 0 H VAL A 95 -3.564 -0.040 -12.176 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.033 -1.707 -14.593 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.958 0.996 -13.741 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -6.650 0.802 -15.633 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -4.970 0.842 -16.219 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -5.849 -0.703 -16.144 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -7.251 -0.068 -13.531 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -6.509 -1.650 -13.871 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -6.067 -0.758 -12.395 1.00 0.00 H new ATOM 1437 N GLN A 96 -2.096 -0.829 -15.909 1.00 0.00 N ATOM 1438 CA GLN A 96 -1.157 -0.294 -16.932 1.00 0.00 C ATOM 1439 C GLN A 96 -1.966 -0.029 -18.241 1.00 0.00 C ATOM 1440 O GLN A 96 -2.264 -0.959 -18.998 1.00 0.00 O ATOM 1441 CB GLN A 96 0.034 -1.296 -17.094 1.00 0.00 C ATOM 1442 CG GLN A 96 1.429 -0.773 -16.670 1.00 0.00 C ATOM 1443 CD GLN A 96 1.635 -0.443 -15.184 1.00 0.00 C ATOM 1444 OE1 GLN A 96 0.730 -0.156 -14.411 1.00 0.00 O ATOM 1445 NE2 GLN A 96 2.863 -0.392 -14.741 1.00 0.00 N ATOM 0 H GLN A 96 -2.244 -1.836 -15.974 1.00 0.00 H new ATOM 0 HA GLN A 96 -0.712 0.657 -16.640 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -0.189 -2.190 -16.511 1.00 0.00 H new ATOM 0 HB3 GLN A 96 0.085 -1.601 -18.139 1.00 0.00 H new ATOM 0 HG2 GLN A 96 2.170 -1.519 -16.956 1.00 0.00 H new ATOM 0 HG3 GLN A 96 1.642 0.126 -17.248 1.00 0.00 H new ATOM 0 HE21 GLN A 96 3.639 -0.625 -15.361 1.00 0.00 H new ATOM 0 HE22 GLN A 96 3.046 -0.119 -13.775 1.00 0.00 H new ATOM 1454 N HIS A 97 -2.371 1.232 -18.488 1.00 0.00 N ATOM 1455 CA HIS A 97 -3.225 1.575 -19.659 1.00 0.00 C ATOM 1456 C HIS A 97 -2.361 1.958 -20.899 1.00 0.00 C ATOM 1457 O HIS A 97 -1.913 3.099 -21.026 1.00 0.00 O ATOM 1458 CB HIS A 97 -4.238 2.664 -19.225 1.00 0.00 C ATOM 1459 CG HIS A 97 -5.254 3.124 -20.277 1.00 0.00 C ATOM 1460 ND1 HIS A 97 -5.409 4.437 -20.702 1.00 0.00 N ATOM 1461 CD2 HIS A 97 -6.169 2.293 -20.947 1.00 0.00 C ATOM 1462 CE1 HIS A 97 -6.433 4.283 -21.601 1.00 0.00 C ATOM 1463 NE2 HIS A 97 -6.980 3.048 -21.764 1.00 0.00 N ATOM 0 H HIS A 97 -2.127 2.030 -17.901 1.00 0.00 H new ATOM 0 HA HIS A 97 -3.797 0.707 -19.986 1.00 0.00 H new ATOM 0 HB2 HIS A 97 -4.789 2.290 -18.362 1.00 0.00 H new ATOM 0 HB3 HIS A 97 -3.676 3.536 -18.891 1.00 0.00 H new ATOM 0 HD1 HIS A 97 -4.904 5.278 -20.424 1.00 0.00 H new ATOM 0 HD2 HIS A 97 -6.227 1.220 -20.837 1.00 0.00 H new ATOM 0 HE1 HIS A 97 -6.798 5.126 -22.169 1.00 0.00 H new ATOM 1472 N GLN A 98 -2.186 0.993 -21.815 1.00 0.00 N ATOM 1473 CA GLN A 98 -1.484 1.198 -23.112 1.00 0.00 C ATOM 1474 C GLN A 98 -2.308 2.093 -24.089 1.00 0.00 C ATOM 1475 O GLN A 98 -3.462 1.767 -24.379 1.00 0.00 O ATOM 1476 CB GLN A 98 -1.236 -0.192 -23.773 1.00 0.00 C ATOM 1477 CG GLN A 98 -0.299 -1.164 -23.013 1.00 0.00 C ATOM 1478 CD GLN A 98 0.235 -2.358 -23.826 1.00 0.00 C ATOM 1479 OE1 GLN A 98 -0.348 -2.859 -24.789 1.00 0.00 O ATOM 1480 NE2 GLN A 98 1.401 -2.845 -23.483 1.00 0.00 N ATOM 0 H GLN A 98 -2.526 0.040 -21.685 1.00 0.00 H new ATOM 0 HA GLN A 98 -0.542 1.709 -22.911 1.00 0.00 H new ATOM 0 HB2 GLN A 98 -2.200 -0.683 -23.906 1.00 0.00 H new ATOM 0 HB3 GLN A 98 -0.822 -0.027 -24.768 1.00 0.00 H new ATOM 0 HG2 GLN A 98 0.552 -0.597 -22.636 1.00 0.00 H new ATOM 0 HG3 GLN A 98 -0.834 -1.550 -22.146 1.00 0.00 H new ATOM 0 HE21 GLN A 98 1.906 -2.449 -22.690 1.00 0.00 H new ATOM 0 HE22 GLN A 98 1.805 -3.620 -24.009 1.00 0.00 H new ATOM 1489 N GLU A 99 -1.718 3.188 -24.599 1.00 0.00 N ATOM 1490 CA GLU A 99 -2.399 4.105 -25.565 1.00 0.00 C ATOM 1491 C GLU A 99 -1.517 4.231 -26.855 1.00 0.00 C ATOM 1492 O GLU A 99 -0.371 4.692 -26.785 1.00 0.00 O ATOM 1493 CB GLU A 99 -2.643 5.479 -24.866 1.00 0.00 C ATOM 1494 CG GLU A 99 -3.683 5.485 -23.704 1.00 0.00 C ATOM 1495 CD GLU A 99 -3.552 6.595 -22.662 1.00 0.00 C ATOM 1496 OE1 GLU A 99 -3.375 7.780 -23.017 1.00 0.00 O ATOM 1497 OE2 GLU A 99 -3.618 6.286 -21.453 1.00 0.00 O ATOM 0 H GLU A 99 -0.767 3.471 -24.364 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.369 3.713 -25.870 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -1.691 5.839 -24.476 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -2.969 6.195 -25.621 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -4.679 5.547 -24.141 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -3.620 4.527 -23.188 1.00 0.00 H new ATOM 1504 N TRP A 100 -2.016 3.799 -28.035 1.00 0.00 N ATOM 1505 CA TRP A 100 -1.220 3.801 -29.302 1.00 0.00 C ATOM 1506 C TRP A 100 -2.111 3.988 -30.572 1.00 0.00 C ATOM 1507 O TRP A 100 -2.967 3.149 -30.863 1.00 0.00 O ATOM 1508 CB TRP A 100 -0.293 2.549 -29.401 1.00 0.00 C ATOM 1509 CG TRP A 100 -0.909 1.183 -29.759 1.00 0.00 C ATOM 1510 CD1 TRP A 100 -0.886 0.593 -31.041 1.00 0.00 C ATOM 1511 CD2 TRP A 100 -1.630 0.311 -28.964 1.00 0.00 C ATOM 1512 NE1 TRP A 100 -1.565 -0.645 -31.063 1.00 0.00 N ATOM 1513 CE2 TRP A 100 -2.037 -0.782 -29.770 1.00 0.00 C ATOM 1514 CE3 TRP A 100 -2.008 0.376 -27.599 1.00 0.00 C ATOM 1515 CZ2 TRP A 100 -2.851 -1.798 -29.224 1.00 0.00 C ATOM 1516 CZ3 TRP A 100 -2.809 -0.642 -27.084 1.00 0.00 C ATOM 1517 CH2 TRP A 100 -3.234 -1.706 -27.884 1.00 0.00 C ATOM 0 H TRP A 100 -2.965 3.443 -28.145 1.00 0.00 H new ATOM 0 HA TRP A 100 -0.570 4.675 -29.264 1.00 0.00 H new ATOM 0 HB2 TRP A 100 0.475 2.767 -30.143 1.00 0.00 H new ATOM 0 HB3 TRP A 100 0.213 2.439 -28.442 1.00 0.00 H new ATOM 0 HD1 TRP A 100 -0.407 1.035 -31.902 1.00 0.00 H new ATOM 0 HE1 TRP A 100 -1.680 -1.287 -31.847 1.00 0.00 H new ATOM 0 HE3 TRP A 100 -1.683 1.194 -26.973 1.00 0.00 H new ATOM 0 HZ2 TRP A 100 -3.172 -2.631 -29.831 1.00 0.00 H new ATOM 0 HZ3 TRP A 100 -3.107 -0.608 -26.046 1.00 0.00 H new ATOM 0 HH2 TRP A 100 -3.869 -2.470 -27.459 1.00 0.00 H new ATOM 1528 N ASP A 101 -1.875 5.050 -31.372 1.00 0.00 N ATOM 1529 CA ASP A 101 -2.515 5.239 -32.720 1.00 0.00 C ATOM 1530 C ASP A 101 -4.092 5.092 -32.787 1.00 0.00 C ATOM 1531 O ASP A 101 -4.633 4.405 -33.656 1.00 0.00 O ATOM 1532 CB ASP A 101 -1.662 4.365 -33.697 1.00 0.00 C ATOM 1533 CG ASP A 101 -1.958 4.467 -35.191 1.00 0.00 C ATOM 1534 OD1 ASP A 101 -1.883 5.577 -35.752 1.00 0.00 O ATOM 1535 OD2 ASP A 101 -2.247 3.416 -35.808 1.00 0.00 O ATOM 0 H ASP A 101 -1.240 5.806 -31.115 1.00 0.00 H new ATOM 0 HA ASP A 101 -2.483 6.284 -33.028 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -0.613 4.621 -33.546 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -1.781 3.322 -33.403 1.00 0.00 H new ATOM 1540 N GLY A 102 -4.839 5.682 -31.829 1.00 0.00 N ATOM 1541 CA GLY A 102 -6.291 5.362 -31.637 1.00 0.00 C ATOM 1542 C GLY A 102 -6.685 4.094 -30.823 1.00 0.00 C ATOM 1543 O GLY A 102 -7.755 4.069 -30.215 1.00 0.00 O ATOM 0 H GLY A 102 -4.475 6.377 -31.177 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -6.756 6.221 -31.153 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -6.741 5.271 -32.626 1.00 0.00 H new ATOM 1547 N LYS A 103 -5.858 3.039 -30.842 1.00 0.00 N ATOM 1548 CA LYS A 103 -6.084 1.772 -30.095 1.00 0.00 C ATOM 1549 C LYS A 103 -5.603 1.851 -28.608 1.00 0.00 C ATOM 1550 O LYS A 103 -4.579 2.471 -28.294 1.00 0.00 O ATOM 1551 CB LYS A 103 -5.311 0.654 -30.856 1.00 0.00 C ATOM 1552 CG LYS A 103 -5.864 0.273 -32.259 1.00 0.00 C ATOM 1553 CD LYS A 103 -4.794 0.048 -33.353 1.00 0.00 C ATOM 1554 CE LYS A 103 -4.184 1.374 -33.847 1.00 0.00 C ATOM 1555 NZ LYS A 103 -3.239 1.178 -34.975 1.00 0.00 N ATOM 0 H LYS A 103 -4.994 3.032 -31.384 1.00 0.00 H new ATOM 0 HA LYS A 103 -7.153 1.566 -30.050 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -4.274 0.971 -30.970 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -5.304 -0.242 -30.235 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -6.458 -0.636 -32.163 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -6.539 1.061 -32.591 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -4.003 -0.591 -32.960 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -5.242 -0.481 -34.195 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -4.984 2.044 -34.160 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -3.664 1.861 -33.022 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -2.987 2.102 -35.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -2.379 0.705 -34.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -3.688 0.590 -35.706 1.00 0.00 H new ATOM 1569 N GLU A 104 -6.332 1.179 -27.699 1.00 0.00 N ATOM 1570 CA GLU A 104 -5.972 1.122 -26.254 1.00 0.00 C ATOM 1571 C GLU A 104 -6.207 -0.281 -25.592 1.00 0.00 C ATOM 1572 O GLU A 104 -7.009 -1.098 -26.054 1.00 0.00 O ATOM 1573 CB GLU A 104 -6.639 2.287 -25.466 1.00 0.00 C ATOM 1574 CG GLU A 104 -8.192 2.330 -25.430 1.00 0.00 C ATOM 1575 CD GLU A 104 -8.738 3.229 -24.336 1.00 0.00 C ATOM 1576 OE1 GLU A 104 -8.688 4.468 -24.464 1.00 0.00 O ATOM 1577 OE2 GLU A 104 -9.124 2.686 -23.279 1.00 0.00 O ATOM 0 H GLU A 104 -7.180 0.662 -27.933 1.00 0.00 H new ATOM 0 HA GLU A 104 -4.893 1.264 -26.199 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -6.279 2.247 -24.438 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -6.286 3.227 -25.891 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -8.562 2.676 -26.395 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -8.574 1.319 -25.286 1.00 0.00 H new ATOM 1584 N SER A 105 -5.485 -0.547 -24.485 1.00 0.00 N ATOM 1585 CA SER A 105 -5.686 -1.763 -23.645 1.00 0.00 C ATOM 1586 C SER A 105 -5.404 -1.474 -22.134 1.00 0.00 C ATOM 1587 O SER A 105 -4.466 -0.747 -21.791 1.00 0.00 O ATOM 1588 CB SER A 105 -4.789 -2.912 -24.165 1.00 0.00 C ATOM 1589 OG SER A 105 -5.034 -4.099 -23.412 1.00 0.00 O ATOM 0 H SER A 105 -4.747 0.068 -24.142 1.00 0.00 H new ATOM 0 HA SER A 105 -6.731 -2.064 -23.723 1.00 0.00 H new ATOM 0 HB2 SER A 105 -4.990 -3.093 -25.221 1.00 0.00 H new ATOM 0 HB3 SER A 105 -3.739 -2.630 -24.085 1.00 0.00 H new ATOM 0 HG SER A 105 -4.652 -4.869 -23.882 1.00 0.00 H new ATOM 1595 N THR A 106 -6.194 -2.072 -21.223 1.00 0.00 N ATOM 1596 CA THR A 106 -5.930 -2.009 -19.749 1.00 0.00 C ATOM 1597 C THR A 106 -5.289 -3.338 -19.242 1.00 0.00 C ATOM 1598 O THR A 106 -5.940 -4.387 -19.208 1.00 0.00 O ATOM 1599 CB THR A 106 -7.197 -1.652 -18.910 1.00 0.00 C ATOM 1600 OG1 THR A 106 -8.299 -2.483 -19.238 1.00 0.00 O ATOM 1601 CG2 THR A 106 -7.676 -0.205 -19.049 1.00 0.00 C ATOM 0 H THR A 106 -7.026 -2.609 -21.470 1.00 0.00 H new ATOM 0 HA THR A 106 -5.222 -1.193 -19.601 1.00 0.00 H new ATOM 0 HB THR A 106 -6.865 -1.808 -17.884 1.00 0.00 H new ATOM 0 HG1 THR A 106 -9.073 -2.231 -18.692 1.00 0.00 H new ATOM 0 HG21 THR A 106 -8.560 -0.053 -18.430 1.00 0.00 H new ATOM 0 HG22 THR A 106 -6.886 0.473 -18.726 1.00 0.00 H new ATOM 0 HG23 THR A 106 -7.924 -0.002 -20.091 1.00 0.00 H new ATOM 1609 N ILE A 107 -4.021 -3.276 -18.796 1.00 0.00 N ATOM 1610 CA ILE A 107 -3.314 -4.433 -18.169 1.00 0.00 C ATOM 1611 C ILE A 107 -3.619 -4.404 -16.631 1.00 0.00 C ATOM 1612 O ILE A 107 -2.967 -3.672 -15.879 1.00 0.00 O ATOM 1613 CB ILE A 107 -1.775 -4.416 -18.502 1.00 0.00 C ATOM 1614 CG1 ILE A 107 -1.349 -4.132 -19.977 1.00 0.00 C ATOM 1615 CG2 ILE A 107 -1.053 -5.688 -17.993 1.00 0.00 C ATOM 1616 CD1 ILE A 107 -1.871 -5.092 -21.057 1.00 0.00 C ATOM 0 H ILE A 107 -3.451 -2.432 -18.855 1.00 0.00 H new ATOM 0 HA ILE A 107 -3.677 -5.376 -18.579 1.00 0.00 H new ATOM 0 HB ILE A 107 -1.451 -3.532 -17.952 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -1.675 -3.124 -20.235 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -0.260 -4.135 -20.020 1.00 0.00 H new ATOM 0 HG21 ILE A 107 0.006 -5.631 -18.246 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -1.165 -5.761 -16.911 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -1.491 -6.568 -18.463 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -1.500 -4.779 -22.033 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -1.523 -6.103 -20.844 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -2.961 -5.077 -21.062 1.00 0.00 H new ATOM 1628 N THR A 108 -4.629 -5.166 -16.171 1.00 0.00 N ATOM 1629 CA THR A 108 -5.193 -5.015 -14.794 1.00 0.00 C ATOM 1630 C THR A 108 -4.550 -6.056 -13.821 1.00 0.00 C ATOM 1631 O THR A 108 -5.033 -7.187 -13.693 1.00 0.00 O ATOM 1632 CB THR A 108 -6.751 -5.109 -14.874 1.00 0.00 C ATOM 1633 OG1 THR A 108 -7.274 -4.168 -15.812 1.00 0.00 O ATOM 1634 CG2 THR A 108 -7.477 -4.821 -13.549 1.00 0.00 C ATOM 0 H THR A 108 -5.079 -5.895 -16.724 1.00 0.00 H new ATOM 0 HA THR A 108 -4.946 -4.037 -14.381 1.00 0.00 H new ATOM 0 HB THR A 108 -6.932 -6.143 -15.166 1.00 0.00 H new ATOM 0 HG1 THR A 108 -8.250 -4.247 -15.845 1.00 0.00 H new ATOM 0 HG21 THR A 108 -8.553 -4.909 -13.697 1.00 0.00 H new ATOM 0 HG22 THR A 108 -7.155 -5.539 -12.794 1.00 0.00 H new ATOM 0 HG23 THR A 108 -7.238 -3.811 -13.215 1.00 0.00 H new ATOM 1642 N ARG A 109 -3.460 -5.664 -13.134 1.00 0.00 N ATOM 1643 CA ARG A 109 -2.666 -6.580 -12.267 1.00 0.00 C ATOM 1644 C ARG A 109 -3.189 -6.578 -10.793 1.00 0.00 C ATOM 1645 O ARG A 109 -2.835 -5.694 -10.007 1.00 0.00 O ATOM 1646 CB ARG A 109 -1.162 -6.172 -12.334 1.00 0.00 C ATOM 1647 CG ARG A 109 -0.459 -6.276 -13.711 1.00 0.00 C ATOM 1648 CD ARG A 109 1.078 -6.233 -13.613 1.00 0.00 C ATOM 1649 NE ARG A 109 1.685 -6.737 -14.879 1.00 0.00 N ATOM 1650 CZ ARG A 109 2.989 -6.897 -15.093 1.00 0.00 C ATOM 1651 NH1 ARG A 109 3.906 -6.547 -14.231 1.00 0.00 N ATOM 1652 NH2 ARG A 109 3.376 -7.429 -16.216 1.00 0.00 N ATOM 0 H ARG A 109 -3.100 -4.710 -13.158 1.00 0.00 H new ATOM 0 HA ARG A 109 -2.779 -7.599 -12.636 1.00 0.00 H new ATOM 0 HB2 ARG A 109 -1.076 -5.142 -11.988 1.00 0.00 H new ATOM 0 HB3 ARG A 109 -0.612 -6.793 -11.627 1.00 0.00 H new ATOM 0 HG2 ARG A 109 -0.760 -7.205 -14.196 1.00 0.00 H new ATOM 0 HG3 ARG A 109 -0.799 -5.459 -14.348 1.00 0.00 H new ATOM 0 HD2 ARG A 109 1.410 -5.212 -13.422 1.00 0.00 H new ATOM 0 HD3 ARG A 109 1.414 -6.840 -12.772 1.00 0.00 H new ATOM 0 HE ARG A 109 1.051 -6.978 -15.641 1.00 0.00 H new ATOM 0 HH11 ARG A 109 3.636 -6.128 -13.341 1.00 0.00 H new ATOM 0 HH12 ARG A 109 4.892 -6.693 -14.448 1.00 0.00 H new ATOM 0 HH21 ARG A 109 2.685 -7.714 -16.910 1.00 0.00 H new ATOM 0 HH22 ARG A 109 4.370 -7.561 -16.402 1.00 0.00 H new ATOM 1666 N LYS A 110 -4.022 -7.565 -10.419 1.00 0.00 N ATOM 1667 CA LYS A 110 -4.649 -7.653 -9.066 1.00 0.00 C ATOM 1668 C LYS A 110 -4.249 -8.952 -8.299 1.00 0.00 C ATOM 1669 O LYS A 110 -4.222 -10.050 -8.865 1.00 0.00 O ATOM 1670 CB LYS A 110 -6.190 -7.455 -9.157 1.00 0.00 C ATOM 1671 CG LYS A 110 -7.009 -8.414 -10.059 1.00 0.00 C ATOM 1672 CD LYS A 110 -8.533 -8.170 -9.940 1.00 0.00 C ATOM 1673 CE LYS A 110 -9.385 -8.877 -11.015 1.00 0.00 C ATOM 1674 NZ LYS A 110 -9.385 -8.088 -12.277 1.00 0.00 N ATOM 0 H LYS A 110 -4.287 -8.330 -11.039 1.00 0.00 H new ATOM 0 HA LYS A 110 -4.251 -6.834 -8.467 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -6.593 -7.526 -8.147 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -6.373 -6.438 -9.503 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -6.702 -8.285 -11.097 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -6.786 -9.446 -9.787 1.00 0.00 H new ATOM 0 HD2 LYS A 110 -8.865 -8.502 -8.956 1.00 0.00 H new ATOM 0 HD3 LYS A 110 -8.721 -7.098 -9.994 1.00 0.00 H new ATOM 0 HE2 LYS A 110 -8.990 -9.876 -11.203 1.00 0.00 H new ATOM 0 HE3 LYS A 110 -10.407 -9.001 -10.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 -10.103 -8.470 -12.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -9.604 -7.094 -12.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 -8.448 -8.148 -12.724 1.00 0.00 H new ATOM 1688 N LEU A 111 -3.948 -8.832 -6.992 1.00 0.00 N ATOM 1689 CA LEU A 111 -3.528 -9.986 -6.150 1.00 0.00 C ATOM 1690 C LEU A 111 -4.743 -10.869 -5.740 1.00 0.00 C ATOM 1691 O LEU A 111 -5.707 -10.385 -5.138 1.00 0.00 O ATOM 1692 CB LEU A 111 -2.726 -9.476 -4.913 1.00 0.00 C ATOM 1693 CG LEU A 111 -1.468 -10.283 -4.500 1.00 0.00 C ATOM 1694 CD1 LEU A 111 -1.735 -11.738 -4.077 1.00 0.00 C ATOM 1695 CD2 LEU A 111 -0.394 -10.266 -5.594 1.00 0.00 C ATOM 0 H LEU A 111 -3.986 -7.946 -6.488 1.00 0.00 H new ATOM 0 HA LEU A 111 -2.871 -10.627 -6.738 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -2.418 -8.449 -5.110 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -3.404 -9.447 -4.060 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.110 -9.762 -3.612 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.794 -12.217 -3.807 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -2.407 -11.750 -3.219 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -2.193 -12.279 -4.905 1.00 0.00 H new ATOM 0 HD21 LEU A 111 0.470 -10.843 -5.264 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -0.797 -10.705 -6.506 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -0.091 -9.238 -5.790 1.00 0.00 H new ATOM 1707 N LYS A 112 -4.700 -12.157 -6.105 1.00 0.00 N ATOM 1708 CA LYS A 112 -5.850 -13.076 -5.951 1.00 0.00 C ATOM 1709 C LYS A 112 -5.599 -14.140 -4.836 1.00 0.00 C ATOM 1710 O LYS A 112 -4.994 -13.850 -3.798 1.00 0.00 O ATOM 1711 CB LYS A 112 -6.156 -13.561 -7.395 1.00 0.00 C ATOM 1712 CG LYS A 112 -7.611 -14.025 -7.602 1.00 0.00 C ATOM 1713 CD LYS A 112 -8.640 -12.885 -7.801 1.00 0.00 C ATOM 1714 CE LYS A 112 -9.685 -12.727 -6.676 1.00 0.00 C ATOM 1715 NZ LYS A 112 -10.476 -13.963 -6.378 1.00 0.00 N ATOM 0 H LYS A 112 -3.875 -12.596 -6.514 1.00 0.00 H new ATOM 0 HA LYS A 112 -6.759 -12.619 -5.559 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -5.940 -12.752 -8.093 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -5.484 -14.383 -7.642 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -7.647 -14.682 -8.471 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -7.913 -14.620 -6.740 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -8.098 -11.945 -7.904 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -9.166 -13.055 -8.740 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -9.174 -12.411 -5.766 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -10.374 -11.928 -6.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -11.389 -13.698 -5.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -10.641 -14.490 -7.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -9.948 -14.561 -5.711 1.00 0.00 H new ATOM 1729 N ASP A 113 -6.096 -15.371 -5.024 1.00 0.00 N ATOM 1730 CA ASP A 113 -6.179 -16.396 -3.951 1.00 0.00 C ATOM 1731 C ASP A 113 -4.835 -17.207 -3.879 1.00 0.00 C ATOM 1732 O ASP A 113 -4.761 -18.394 -4.213 1.00 0.00 O ATOM 1733 CB ASP A 113 -7.465 -17.234 -4.228 1.00 0.00 C ATOM 1734 CG ASP A 113 -8.798 -16.461 -4.258 1.00 0.00 C ATOM 1735 OD1 ASP A 113 -9.392 -16.231 -3.187 1.00 0.00 O ATOM 1736 OD2 ASP A 113 -9.237 -16.044 -5.356 1.00 0.00 O ATOM 0 H ASP A 113 -6.455 -15.693 -5.923 1.00 0.00 H new ATOM 0 HA ASP A 113 -6.280 -15.971 -2.953 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -7.343 -17.740 -5.186 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -7.538 -18.009 -3.465 1.00 0.00 H new ATOM 1741 N GLY A 114 -3.749 -16.507 -3.491 1.00 0.00 N ATOM 1742 CA GLY A 114 -2.358 -17.035 -3.606 1.00 0.00 C ATOM 1743 C GLY A 114 -1.484 -16.643 -4.833 1.00 0.00 C ATOM 1744 O GLY A 114 -0.270 -16.842 -4.766 1.00 0.00 O ATOM 0 H GLY A 114 -3.801 -15.570 -3.092 1.00 0.00 H new ATOM 0 HA2 GLY A 114 -1.818 -16.728 -2.710 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -2.420 -18.123 -3.584 1.00 0.00 H new ATOM 1748 N LYS A 115 -2.052 -16.150 -5.951 1.00 0.00 N ATOM 1749 CA LYS A 115 -1.286 -15.795 -7.188 1.00 0.00 C ATOM 1750 C LYS A 115 -1.828 -14.463 -7.823 1.00 0.00 C ATOM 1751 O LYS A 115 -2.895 -13.959 -7.459 1.00 0.00 O ATOM 1752 CB LYS A 115 -1.293 -17.007 -8.179 1.00 0.00 C ATOM 1753 CG LYS A 115 -0.398 -18.203 -7.755 1.00 0.00 C ATOM 1754 CD LYS A 115 -0.206 -19.274 -8.857 1.00 0.00 C ATOM 1755 CE LYS A 115 0.736 -20.442 -8.473 1.00 0.00 C ATOM 1756 NZ LYS A 115 0.073 -21.376 -7.521 1.00 0.00 N ATOM 0 H LYS A 115 -3.055 -15.982 -6.034 1.00 0.00 H new ATOM 0 HA LYS A 115 -0.245 -15.597 -6.933 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -2.318 -17.361 -8.290 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -0.968 -16.658 -9.159 1.00 0.00 H new ATOM 0 HG2 LYS A 115 0.580 -17.823 -7.459 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -0.836 -18.676 -6.876 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -1.181 -19.684 -9.119 1.00 0.00 H new ATOM 0 HD3 LYS A 115 0.186 -18.789 -9.751 1.00 0.00 H new ATOM 0 HE2 LYS A 115 1.033 -20.984 -9.371 1.00 0.00 H new ATOM 0 HE3 LYS A 115 1.647 -20.046 -8.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 0.726 -22.149 -7.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -0.188 -20.862 -6.656 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -0.783 -21.771 -7.961 1.00 0.00 H new ATOM 1770 N LEU A 116 -1.085 -13.859 -8.770 1.00 0.00 N ATOM 1771 CA LEU A 116 -1.486 -12.567 -9.408 1.00 0.00 C ATOM 1772 C LEU A 116 -2.418 -12.807 -10.642 1.00 0.00 C ATOM 1773 O LEU A 116 -2.012 -13.453 -11.614 1.00 0.00 O ATOM 1774 CB LEU A 116 -0.168 -11.821 -9.759 1.00 0.00 C ATOM 1775 CG LEU A 116 -0.263 -10.403 -10.381 1.00 0.00 C ATOM 1776 CD1 LEU A 116 -0.615 -9.343 -9.327 1.00 0.00 C ATOM 1777 CD2 LEU A 116 1.072 -10.020 -11.046 1.00 0.00 C ATOM 0 H LEU A 116 -0.203 -14.236 -9.117 1.00 0.00 H new ATOM 0 HA LEU A 116 -2.082 -11.951 -8.735 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.422 -11.744 -8.846 1.00 0.00 H new ATOM 0 HB3 LEU A 116 0.394 -12.449 -10.450 1.00 0.00 H new ATOM 0 HG LEU A 116 -1.058 -10.431 -11.126 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -0.672 -8.363 -9.801 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -1.577 -9.584 -8.875 1.00 0.00 H new ATOM 0 HD13 LEU A 116 0.154 -9.328 -8.555 1.00 0.00 H new ATOM 0 HD21 LEU A 116 0.990 -9.023 -11.478 1.00 0.00 H new ATOM 0 HD22 LEU A 116 1.866 -10.028 -10.299 1.00 0.00 H new ATOM 0 HD23 LEU A 116 1.306 -10.738 -11.832 1.00 0.00 H new ATOM 1789 N VAL A 117 -3.648 -12.254 -10.614 1.00 0.00 N ATOM 1790 CA VAL A 117 -4.554 -12.228 -11.802 1.00 0.00 C ATOM 1791 C VAL A 117 -4.217 -10.951 -12.635 1.00 0.00 C ATOM 1792 O VAL A 117 -4.448 -9.822 -12.187 1.00 0.00 O ATOM 1793 CB VAL A 117 -6.071 -12.295 -11.387 1.00 0.00 C ATOM 1794 CG1 VAL A 117 -7.053 -12.014 -12.546 1.00 0.00 C ATOM 1795 CG2 VAL A 117 -6.510 -13.649 -10.812 1.00 0.00 C ATOM 0 H VAL A 117 -4.046 -11.816 -9.783 1.00 0.00 H new ATOM 0 HA VAL A 117 -4.389 -13.114 -12.416 1.00 0.00 H new ATOM 0 HB VAL A 117 -6.121 -11.514 -10.628 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -8.077 -12.079 -12.179 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -6.872 -11.015 -12.942 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -6.903 -12.750 -13.336 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -7.568 -13.608 -10.552 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -6.349 -14.430 -11.555 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -5.926 -13.872 -9.919 1.00 0.00 H new ATOM 1805 N VAL A 118 -3.725 -11.144 -13.866 1.00 0.00 N ATOM 1806 CA VAL A 118 -3.464 -10.029 -14.818 1.00 0.00 C ATOM 1807 C VAL A 118 -4.528 -10.122 -15.953 1.00 0.00 C ATOM 1808 O VAL A 118 -4.332 -10.808 -16.962 1.00 0.00 O ATOM 1809 CB VAL A 118 -1.978 -10.032 -15.312 1.00 0.00 C ATOM 1810 CG1 VAL A 118 -1.679 -8.892 -16.313 1.00 0.00 C ATOM 1811 CG2 VAL A 118 -0.953 -9.969 -14.154 1.00 0.00 C ATOM 0 H VAL A 118 -3.495 -12.065 -14.238 1.00 0.00 H new ATOM 0 HA VAL A 118 -3.573 -9.059 -14.334 1.00 0.00 H new ATOM 0 HB VAL A 118 -1.864 -10.988 -15.822 1.00 0.00 H new ATOM 0 HG11 VAL A 118 -0.635 -8.943 -16.621 1.00 0.00 H new ATOM 0 HG12 VAL A 118 -2.321 -8.998 -17.187 1.00 0.00 H new ATOM 0 HG13 VAL A 118 -1.870 -7.930 -15.837 1.00 0.00 H new ATOM 0 HG21 VAL A 118 0.058 -9.974 -14.562 1.00 0.00 H new ATOM 0 HG22 VAL A 118 -1.108 -9.055 -13.580 1.00 0.00 H new ATOM 0 HG23 VAL A 118 -1.086 -10.833 -13.503 1.00 0.00 H new ATOM 1821 N GLU A 119 -5.648 -9.398 -15.793 1.00 0.00 N ATOM 1822 CA GLU A 119 -6.688 -9.277 -16.846 1.00 0.00 C ATOM 1823 C GLU A 119 -6.298 -8.141 -17.837 1.00 0.00 C ATOM 1824 O GLU A 119 -6.530 -6.947 -17.615 1.00 0.00 O ATOM 1825 CB GLU A 119 -8.066 -9.088 -16.164 1.00 0.00 C ATOM 1826 CG GLU A 119 -8.623 -10.399 -15.548 1.00 0.00 C ATOM 1827 CD GLU A 119 -9.780 -10.300 -14.568 1.00 0.00 C ATOM 1828 OE1 GLU A 119 -10.376 -9.214 -14.396 1.00 0.00 O ATOM 1829 OE2 GLU A 119 -10.038 -11.302 -13.877 1.00 0.00 O ATOM 0 H GLU A 119 -5.864 -8.882 -14.940 1.00 0.00 H new ATOM 0 HA GLU A 119 -6.760 -10.182 -17.449 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -7.978 -8.334 -15.381 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.778 -8.706 -16.896 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.937 -11.045 -16.368 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -7.801 -10.904 -15.041 1.00 0.00 H new ATOM 1836 N CYS A 120 -5.650 -8.559 -18.930 1.00 0.00 N ATOM 1837 CA CYS A 120 -5.253 -7.670 -20.039 1.00 0.00 C ATOM 1838 C CYS A 120 -6.403 -7.599 -21.090 1.00 0.00 C ATOM 1839 O CYS A 120 -6.614 -8.519 -21.884 1.00 0.00 O ATOM 1840 CB CYS A 120 -3.863 -8.140 -20.531 1.00 0.00 C ATOM 1841 SG CYS A 120 -3.644 -9.937 -20.518 1.00 0.00 S ATOM 0 H CYS A 120 -5.382 -9.532 -19.076 1.00 0.00 H new ATOM 0 HA CYS A 120 -5.122 -6.628 -19.748 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -3.705 -7.773 -21.545 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -3.095 -7.686 -19.904 1.00 0.00 H new ATOM 0 HG CYS A 120 -4.552 -10.490 -21.266 1.00 0.00 H new ATOM 1846 N VAL A 121 -7.196 -6.515 -21.024 1.00 0.00 N ATOM 1847 CA VAL A 121 -8.434 -6.353 -21.841 1.00 0.00 C ATOM 1848 C VAL A 121 -8.265 -5.188 -22.866 1.00 0.00 C ATOM 1849 O VAL A 121 -7.970 -4.043 -22.504 1.00 0.00 O ATOM 1850 CB VAL A 121 -9.715 -6.274 -20.939 1.00 0.00 C ATOM 1851 CG1 VAL A 121 -9.780 -5.105 -19.935 1.00 0.00 C ATOM 1852 CG2 VAL A 121 -11.022 -6.258 -21.766 1.00 0.00 C ATOM 0 H VAL A 121 -7.007 -5.724 -20.409 1.00 0.00 H new ATOM 0 HA VAL A 121 -8.592 -7.246 -22.446 1.00 0.00 H new ATOM 0 HB VAL A 121 -9.625 -7.189 -20.354 1.00 0.00 H new ATOM 0 HG11 VAL A 121 -10.712 -5.160 -19.372 1.00 0.00 H new ATOM 0 HG12 VAL A 121 -8.936 -5.168 -19.248 1.00 0.00 H new ATOM 0 HG13 VAL A 121 -9.738 -4.159 -20.475 1.00 0.00 H new ATOM 0 HG21 VAL A 121 -11.878 -6.203 -21.093 1.00 0.00 H new ATOM 0 HG22 VAL A 121 -11.024 -5.391 -22.427 1.00 0.00 H new ATOM 0 HG23 VAL A 121 -11.087 -7.169 -22.361 1.00 0.00 H new ATOM 1862 N MET A 122 -8.510 -5.505 -24.149 1.00 0.00 N ATOM 1863 CA MET A 122 -8.537 -4.499 -25.251 1.00 0.00 C ATOM 1864 C MET A 122 -9.822 -3.600 -25.214 1.00 0.00 C ATOM 1865 O MET A 122 -9.736 -2.380 -25.063 1.00 0.00 O ATOM 1866 CB MET A 122 -8.332 -5.305 -26.569 1.00 0.00 C ATOM 1867 CG MET A 122 -8.172 -4.474 -27.854 1.00 0.00 C ATOM 1868 SD MET A 122 -6.582 -3.626 -27.867 1.00 0.00 S ATOM 1869 CE MET A 122 -6.609 -2.992 -29.553 1.00 0.00 C ATOM 0 H MET A 122 -8.695 -6.458 -24.461 1.00 0.00 H new ATOM 0 HA MET A 122 -7.740 -3.763 -25.151 1.00 0.00 H new ATOM 0 HB2 MET A 122 -7.448 -5.932 -26.454 1.00 0.00 H new ATOM 0 HB3 MET A 122 -9.183 -5.974 -26.697 1.00 0.00 H new ATOM 0 HG2 MET A 122 -8.251 -5.124 -28.726 1.00 0.00 H new ATOM 0 HG3 MET A 122 -8.979 -3.745 -27.925 1.00 0.00 H new ATOM 0 HE1 MET A 122 -5.657 -2.509 -29.775 1.00 0.00 H new ATOM 0 HE2 MET A 122 -6.769 -3.815 -30.249 1.00 0.00 H new ATOM 0 HE3 MET A 122 -7.417 -2.267 -29.656 1.00 0.00 H new ATOM 1879 N ASN A 123 -11.004 -4.222 -25.339 1.00 0.00 N ATOM 1880 CA ASN A 123 -12.327 -3.558 -25.163 1.00 0.00 C ATOM 1881 C ASN A 123 -13.345 -4.657 -24.717 1.00 0.00 C ATOM 1882 O ASN A 123 -13.576 -4.831 -23.518 1.00 0.00 O ATOM 1883 CB ASN A 123 -12.717 -2.638 -26.365 1.00 0.00 C ATOM 1884 CG ASN A 123 -12.673 -3.241 -27.780 1.00 0.00 C ATOM 1885 OD1 ASN A 123 -13.492 -4.073 -28.153 1.00 0.00 O ATOM 1886 ND2 ASN A 123 -11.718 -2.870 -28.599 1.00 0.00 N ATOM 0 H ASN A 123 -11.081 -5.213 -25.568 1.00 0.00 H new ATOM 0 HA ASN A 123 -12.309 -2.816 -24.365 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -13.728 -2.271 -26.190 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -12.056 -1.771 -26.351 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -11.663 -3.273 -29.534 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -11.030 -2.178 -28.301 1.00 0.00 H new ATOM 1893 N ASN A 124 -13.868 -5.461 -25.656 1.00 0.00 N ATOM 1894 CA ASN A 124 -14.473 -6.791 -25.353 1.00 0.00 C ATOM 1895 C ASN A 124 -13.439 -7.962 -25.147 1.00 0.00 C ATOM 1896 O ASN A 124 -13.726 -8.886 -24.383 1.00 0.00 O ATOM 1897 CB ASN A 124 -15.489 -7.071 -26.495 1.00 0.00 C ATOM 1898 CG ASN A 124 -16.464 -8.223 -26.227 1.00 0.00 C ATOM 1899 OD1 ASN A 124 -17.426 -8.092 -25.480 1.00 0.00 O ATOM 1900 ND2 ASN A 124 -16.263 -9.377 -26.816 1.00 0.00 N ATOM 0 H ASN A 124 -13.889 -5.219 -26.647 1.00 0.00 H new ATOM 0 HA ASN A 124 -14.964 -6.752 -24.381 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -16.064 -6.164 -26.680 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -14.935 -7.289 -27.408 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -16.904 -10.153 -26.650 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -15.466 -9.499 -27.440 1.00 0.00 H new ATOM 1907 N VAL A 125 -12.278 -7.968 -25.838 1.00 0.00 N ATOM 1908 CA VAL A 125 -11.354 -9.141 -25.885 1.00 0.00 C ATOM 1909 C VAL A 125 -10.452 -9.186 -24.600 1.00 0.00 C ATOM 1910 O VAL A 125 -9.515 -8.393 -24.444 1.00 0.00 O ATOM 1911 CB VAL A 125 -10.549 -9.120 -27.233 1.00 0.00 C ATOM 1912 CG1 VAL A 125 -9.532 -10.276 -27.357 1.00 0.00 C ATOM 1913 CG2 VAL A 125 -11.434 -9.196 -28.503 1.00 0.00 C ATOM 0 H VAL A 125 -11.949 -7.168 -26.379 1.00 0.00 H new ATOM 0 HA VAL A 125 -11.921 -10.072 -25.874 1.00 0.00 H new ATOM 0 HB VAL A 125 -10.043 -8.156 -27.184 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -9.011 -10.201 -28.311 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -8.810 -10.214 -26.543 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -10.057 -11.230 -27.304 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -10.800 -9.176 -29.390 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -12.011 -10.121 -28.490 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -12.114 -8.345 -28.524 1.00 0.00 H new ATOM 1923 N THR A 126 -10.758 -10.139 -23.704 1.00 0.00 N ATOM 1924 CA THR A 126 -10.049 -10.325 -22.404 1.00 0.00 C ATOM 1925 C THR A 126 -9.043 -11.517 -22.472 1.00 0.00 C ATOM 1926 O THR A 126 -9.470 -12.667 -22.644 1.00 0.00 O ATOM 1927 CB THR A 126 -11.065 -10.630 -21.253 1.00 0.00 C ATOM 1928 OG1 THR A 126 -11.787 -11.833 -21.523 1.00 0.00 O ATOM 1929 CG2 THR A 126 -12.094 -9.537 -20.938 1.00 0.00 C ATOM 0 H THR A 126 -11.509 -10.813 -23.852 1.00 0.00 H new ATOM 0 HA THR A 126 -9.515 -9.396 -22.204 1.00 0.00 H new ATOM 0 HB THR A 126 -10.422 -10.710 -20.376 1.00 0.00 H new ATOM 0 HG1 THR A 126 -11.207 -12.462 -22.002 1.00 0.00 H new ATOM 0 HG21 THR A 126 -12.739 -9.868 -20.124 1.00 0.00 H new ATOM 0 HG22 THR A 126 -11.576 -8.624 -20.643 1.00 0.00 H new ATOM 0 HG23 THR A 126 -12.699 -9.341 -21.823 1.00 0.00 H new ATOM 1937 N CYS A 127 -7.749 -11.270 -22.216 1.00 0.00 N ATOM 1938 CA CYS A 127 -6.786 -12.350 -21.875 1.00 0.00 C ATOM 1939 C CYS A 127 -6.528 -12.405 -20.338 1.00 0.00 C ATOM 1940 O CYS A 127 -6.020 -11.448 -19.742 1.00 0.00 O ATOM 1941 CB CYS A 127 -5.509 -12.183 -22.718 1.00 0.00 C ATOM 1942 SG CYS A 127 -4.876 -10.514 -22.746 1.00 0.00 S ATOM 0 H CYS A 127 -7.338 -10.337 -22.236 1.00 0.00 H new ATOM 0 HA CYS A 127 -7.208 -13.322 -22.129 1.00 0.00 H new ATOM 0 HB2 CYS A 127 -4.738 -12.847 -22.328 1.00 0.00 H new ATOM 0 HB3 CYS A 127 -5.716 -12.500 -23.740 1.00 0.00 H new ATOM 0 HG CYS A 127 -3.868 -10.419 -21.931 1.00 0.00 H new ATOM 1947 N THR A 128 -6.888 -13.531 -19.689 1.00 0.00 N ATOM 1948 CA THR A 128 -6.614 -13.736 -18.233 1.00 0.00 C ATOM 1949 C THR A 128 -5.213 -14.396 -18.064 1.00 0.00 C ATOM 1950 O THR A 128 -5.036 -15.582 -18.361 1.00 0.00 O ATOM 1951 CB THR A 128 -7.715 -14.596 -17.538 1.00 0.00 C ATOM 1952 OG1 THR A 128 -9.022 -14.262 -17.993 1.00 0.00 O ATOM 1953 CG2 THR A 128 -7.723 -14.447 -16.006 1.00 0.00 C ATOM 0 H THR A 128 -7.366 -14.313 -20.137 1.00 0.00 H new ATOM 0 HA THR A 128 -6.626 -12.761 -17.745 1.00 0.00 H new ATOM 0 HB THR A 128 -7.462 -15.622 -17.806 1.00 0.00 H new ATOM 0 HG1 THR A 128 -9.637 -14.237 -17.231 1.00 0.00 H new ATOM 0 HG21 THR A 128 -8.511 -15.070 -15.584 1.00 0.00 H new ATOM 0 HG22 THR A 128 -6.759 -14.760 -15.605 1.00 0.00 H new ATOM 0 HG23 THR A 128 -7.904 -13.405 -15.743 1.00 0.00 H new ATOM 1961 N ARG A 129 -4.223 -13.622 -17.601 1.00 0.00 N ATOM 1962 CA ARG A 129 -2.833 -14.114 -17.440 1.00 0.00 C ATOM 1963 C ARG A 129 -2.521 -14.316 -15.927 1.00 0.00 C ATOM 1964 O ARG A 129 -2.373 -13.345 -15.180 1.00 0.00 O ATOM 1965 CB ARG A 129 -1.871 -13.155 -18.197 1.00 0.00 C ATOM 1966 CG ARG A 129 -1.982 -13.236 -19.748 1.00 0.00 C ATOM 1967 CD ARG A 129 -0.691 -12.970 -20.544 1.00 0.00 C ATOM 1968 NE ARG A 129 -0.309 -11.531 -20.559 1.00 0.00 N ATOM 1969 CZ ARG A 129 0.757 -11.035 -21.193 1.00 0.00 C ATOM 1970 NH1 ARG A 129 1.647 -11.778 -21.806 1.00 0.00 N ATOM 1971 NH2 ARG A 129 0.924 -9.744 -21.205 1.00 0.00 N ATOM 0 H ARG A 129 -4.352 -12.648 -17.328 1.00 0.00 H new ATOM 0 HA ARG A 129 -2.691 -15.096 -17.891 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -2.074 -12.131 -17.882 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -0.846 -13.381 -17.905 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -2.348 -14.228 -20.013 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -2.737 -12.521 -20.074 1.00 0.00 H new ATOM 0 HD2 ARG A 129 0.123 -13.553 -20.113 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -0.823 -13.317 -21.569 1.00 0.00 H new ATOM 0 HE ARG A 129 -0.903 -10.878 -20.049 1.00 0.00 H new ATOM 0 HH11 ARG A 129 1.545 -12.793 -21.815 1.00 0.00 H new ATOM 0 HH12 ARG A 129 2.441 -11.341 -22.274 1.00 0.00 H new ATOM 0 HH21 ARG A 129 0.250 -9.138 -20.738 1.00 0.00 H new ATOM 0 HH22 ARG A 129 1.729 -9.338 -21.682 1.00 0.00 H new ATOM 1985 N ILE A 130 -2.447 -15.579 -15.462 1.00 0.00 N ATOM 1986 CA ILE A 130 -2.189 -15.889 -14.013 1.00 0.00 C ATOM 1987 C ILE A 130 -0.645 -16.035 -13.803 1.00 0.00 C ATOM 1988 O ILE A 130 0.019 -16.758 -14.553 1.00 0.00 O ATOM 1989 CB ILE A 130 -2.966 -17.157 -13.499 1.00 0.00 C ATOM 1990 CG1 ILE A 130 -4.504 -17.156 -13.765 1.00 0.00 C ATOM 1991 CG2 ILE A 130 -2.705 -17.495 -12.004 1.00 0.00 C ATOM 1992 CD1 ILE A 130 -5.326 -16.072 -13.066 1.00 0.00 C ATOM 0 H ILE A 130 -2.559 -16.404 -16.051 1.00 0.00 H new ATOM 0 HA ILE A 130 -2.572 -15.063 -13.414 1.00 0.00 H new ATOM 0 HB ILE A 130 -2.534 -17.943 -14.119 1.00 0.00 H new ATOM 0 HG12 ILE A 130 -4.662 -17.062 -14.839 1.00 0.00 H new ATOM 0 HG13 ILE A 130 -4.900 -18.127 -13.468 1.00 0.00 H new ATOM 0 HG21 ILE A 130 -3.276 -18.381 -11.726 1.00 0.00 H new ATOM 0 HG22 ILE A 130 -1.642 -17.686 -11.854 1.00 0.00 H new ATOM 0 HG23 ILE A 130 -3.013 -16.655 -11.382 1.00 0.00 H new ATOM 0 HD11 ILE A 130 -6.377 -16.183 -13.334 1.00 0.00 H new ATOM 0 HD12 ILE A 130 -5.215 -16.171 -11.986 1.00 0.00 H new ATOM 0 HD13 ILE A 130 -4.973 -15.089 -13.379 1.00 0.00 H new ATOM 2004 N TYR A 131 -0.086 -15.384 -12.766 1.00 0.00 N ATOM 2005 CA TYR A 131 1.378 -15.425 -12.487 1.00 0.00 C ATOM 2006 C TYR A 131 1.692 -16.005 -11.060 1.00 0.00 C ATOM 2007 O TYR A 131 1.128 -15.566 -10.050 1.00 0.00 O ATOM 2008 CB TYR A 131 1.999 -14.012 -12.668 1.00 0.00 C ATOM 2009 CG TYR A 131 2.096 -13.397 -14.084 1.00 0.00 C ATOM 2010 CD1 TYR A 131 0.974 -12.855 -14.711 1.00 0.00 C ATOM 2011 CD2 TYR A 131 3.342 -13.273 -14.708 1.00 0.00 C ATOM 2012 CE1 TYR A 131 1.092 -12.197 -15.935 1.00 0.00 C ATOM 2013 CE2 TYR A 131 3.465 -12.611 -15.928 1.00 0.00 C ATOM 2014 CZ TYR A 131 2.342 -12.070 -16.537 1.00 0.00 C ATOM 2015 OH TYR A 131 2.451 -11.445 -17.752 1.00 0.00 O ATOM 0 H TYR A 131 -0.618 -14.821 -12.103 1.00 0.00 H new ATOM 0 HA TYR A 131 1.835 -16.103 -13.208 1.00 0.00 H new ATOM 0 HB2 TYR A 131 1.424 -13.321 -12.051 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.008 -14.044 -12.256 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.004 -12.946 -14.244 1.00 0.00 H new ATOM 0 HD2 TYR A 131 4.218 -13.695 -14.239 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.216 -11.787 -16.415 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.433 -12.519 -16.399 1.00 0.00 H new ATOM 0 HH TYR A 131 3.390 -11.438 -18.033 1.00 0.00 H new ATOM 2025 N GLU A 132 2.641 -16.960 -10.987 1.00 0.00 N ATOM 2026 CA GLU A 132 3.162 -17.538 -9.712 1.00 0.00 C ATOM 2027 C GLU A 132 4.254 -16.660 -9.014 1.00 0.00 C ATOM 2028 O GLU A 132 5.205 -16.220 -9.666 1.00 0.00 O ATOM 2029 CB GLU A 132 3.679 -18.990 -9.978 1.00 0.00 C ATOM 2030 CG GLU A 132 4.936 -19.162 -10.881 1.00 0.00 C ATOM 2031 CD GLU A 132 5.515 -20.557 -11.084 1.00 0.00 C ATOM 2032 OE1 GLU A 132 4.772 -21.557 -11.001 1.00 0.00 O ATOM 2033 OE2 GLU A 132 6.733 -20.646 -11.373 1.00 0.00 O ATOM 0 H GLU A 132 3.078 -17.362 -11.816 1.00 0.00 H new ATOM 0 HA GLU A 132 2.332 -17.562 -9.006 1.00 0.00 H new ATOM 0 HB2 GLU A 132 3.895 -19.450 -9.014 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.864 -19.558 -10.427 1.00 0.00 H new ATOM 0 HG2 GLU A 132 4.692 -18.761 -11.865 1.00 0.00 H new ATOM 0 HG3 GLU A 132 5.726 -18.535 -10.468 1.00 0.00 H new ATOM 2040 N LYS A 133 4.156 -16.444 -7.684 1.00 0.00 N ATOM 2041 CA LYS A 133 5.215 -15.729 -6.908 1.00 0.00 C ATOM 2042 C LYS A 133 6.467 -16.637 -6.669 1.00 0.00 C ATOM 2043 O LYS A 133 6.385 -17.683 -6.018 1.00 0.00 O ATOM 2044 CB LYS A 133 4.636 -15.182 -5.569 1.00 0.00 C ATOM 2045 CG LYS A 133 5.402 -13.954 -5.011 1.00 0.00 C ATOM 2046 CD LYS A 133 4.780 -13.376 -3.715 1.00 0.00 C ATOM 2047 CE LYS A 133 5.342 -12.008 -3.262 1.00 0.00 C ATOM 2048 NZ LYS A 133 6.719 -12.134 -2.717 1.00 0.00 N ATOM 0 H LYS A 133 3.363 -16.749 -7.120 1.00 0.00 H new ATOM 0 HA LYS A 133 5.552 -14.879 -7.501 1.00 0.00 H new ATOM 0 HB2 LYS A 133 3.592 -14.909 -5.720 1.00 0.00 H new ATOM 0 HB3 LYS A 133 4.653 -15.978 -4.825 1.00 0.00 H new ATOM 0 HG2 LYS A 133 6.435 -14.239 -4.813 1.00 0.00 H new ATOM 0 HG3 LYS A 133 5.427 -13.174 -5.772 1.00 0.00 H new ATOM 0 HD2 LYS A 133 3.704 -13.277 -3.861 1.00 0.00 H new ATOM 0 HD3 LYS A 133 4.928 -14.095 -2.909 1.00 0.00 H new ATOM 0 HE2 LYS A 133 5.346 -11.318 -4.106 1.00 0.00 H new ATOM 0 HE3 LYS A 133 4.688 -11.579 -2.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 7.076 -11.193 -2.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 6.705 -12.746 -1.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 7.341 -12.552 -3.438 1.00 0.00 H new ATOM 2062 N VAL A 134 7.617 -16.225 -7.216 1.00 0.00 N ATOM 2063 CA VAL A 134 8.884 -17.010 -7.179 1.00 0.00 C ATOM 2064 C VAL A 134 9.718 -16.497 -5.959 1.00 0.00 C ATOM 2065 O VAL A 134 10.277 -15.394 -6.004 1.00 0.00 O ATOM 2066 CB VAL A 134 9.644 -16.869 -8.545 1.00 0.00 C ATOM 2067 CG1 VAL A 134 10.944 -17.704 -8.598 1.00 0.00 C ATOM 2068 CG2 VAL A 134 8.816 -17.216 -9.807 1.00 0.00 C ATOM 0 H VAL A 134 7.708 -15.333 -7.703 1.00 0.00 H new ATOM 0 HA VAL A 134 8.695 -18.076 -7.049 1.00 0.00 H new ATOM 0 HB VAL A 134 9.866 -15.802 -8.571 1.00 0.00 H new ATOM 0 HG11 VAL A 134 11.426 -17.566 -9.566 1.00 0.00 H new ATOM 0 HG12 VAL A 134 11.619 -17.377 -7.807 1.00 0.00 H new ATOM 0 HG13 VAL A 134 10.705 -18.758 -8.458 1.00 0.00 H new ATOM 0 HG21 VAL A 134 9.434 -17.086 -10.695 1.00 0.00 H new ATOM 0 HG22 VAL A 134 8.479 -18.251 -9.748 1.00 0.00 H new ATOM 0 HG23 VAL A 134 7.951 -16.556 -9.867 1.00 0.00 H new ATOM 2078 N GLU A 135 9.776 -17.303 -4.887 1.00 0.00 N ATOM 2079 CA GLU A 135 10.357 -16.884 -3.582 1.00 0.00 C ATOM 2080 C GLU A 135 11.674 -17.659 -3.306 1.00 0.00 C ATOM 2081 O GLU A 135 11.661 -18.912 -3.229 1.00 0.00 O ATOM 2082 CB GLU A 135 9.325 -17.107 -2.441 1.00 0.00 C ATOM 2083 CG GLU A 135 7.950 -16.392 -2.549 1.00 0.00 C ATOM 2084 CD GLU A 135 7.957 -14.876 -2.390 1.00 0.00 C ATOM 2085 OE1 GLU A 135 8.419 -14.156 -3.304 1.00 0.00 O ATOM 2086 OE2 GLU A 135 7.398 -14.366 -1.392 1.00 0.00 O ATOM 2087 OXT GLU A 135 12.732 -17.005 -3.157 1.00 0.00 O ATOM 0 H GLU A 135 9.426 -18.261 -4.890 1.00 0.00 H new ATOM 0 HA GLU A 135 10.594 -15.821 -3.622 1.00 0.00 H new ATOM 0 HB2 GLU A 135 9.139 -18.178 -2.364 1.00 0.00 H new ATOM 0 HB3 GLU A 135 9.790 -16.796 -1.505 1.00 0.00 H new ATOM 0 HG2 GLU A 135 7.517 -16.631 -3.520 1.00 0.00 H new ATOM 0 HG3 GLU A 135 7.287 -16.811 -1.792 1.00 0.00 H new TER 2094 GLU A 135