USER MOD reduce.3.24.130724 H: found=0, std=0, add=1021, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 1024 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 16 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.805) USER MOD Set 1.2: A 32 SER OG : rot 140:sc= -0.831 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= -0.94 K(o=-0.94,f=-6.4!) USER MOD Single : A 25 LYS NZ :NH3+ -152:sc= -0.365 (180deg=-1.5!) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot -178:sc= -2.44 USER MOD Single : A 33 THR OG1 : rot 11:sc= 0.703 USER MOD Single : A 35 ASN : amide:sc= -0.231 K(o=-0.23,f=-1.2) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 TYR OH : rot 180:sc= -0.123 USER MOD Single : A 40 LYS NZ :NH3+ -179:sc= -0.0369 (180deg=-0.0383) USER MOD Single : A 42 TYR OH : rot -61:sc= 0.214 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 THR OG1 : rot 180:sc= 0.0968 USER MOD Single : A 62 TYR OH : rot -95:sc= -1.38 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -0.134 K(o=-0.13,f=-3.1!) USER MOD Single : A 79 TYR OH : rot -127:sc= 0.0163 USER MOD Single : A 84 MET CE :methyl 176:sc= -1.81 (180deg=-1.95) USER MOD Single : A 97 ASN : amide:sc= -2.72 K(o=-2.7,f=-4.8!) USER MOD Single : A 100 TYR OH : rot -141:sc= 0.393 USER MOD Single : A 101 ASN : amide:sc= -0.144 K(o=-0.14,f=-0.81) USER MOD Single : A 106 SER OG : rot 96:sc= 0.308 USER MOD Single : A 111 THR OG1 : rot 74:sc= 0.992 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 115 GLN : amide:sc= -0.115 X(o=-0.12,f=-0.61) USER MOD Single : A 119 GLN : amide:sc= -0.908 K(o=-0.91,f=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 8 5.794 -7.681 -26.589 1.00 0.00 N ATOM 2 CA LYS A 8 5.177 -6.667 -25.695 1.00 0.00 C ATOM 3 C LYS A 8 4.795 -7.276 -24.350 1.00 0.00 C ATOM 4 O LYS A 8 3.731 -7.877 -24.209 1.00 0.00 O ATOM 5 CB LYS A 8 3.937 -6.099 -26.388 1.00 0.00 C ATOM 6 CG LYS A 8 3.447 -4.793 -25.784 1.00 0.00 C ATOM 7 CD LYS A 8 2.019 -4.485 -26.204 1.00 0.00 C ATOM 8 CE LYS A 8 1.622 -3.066 -25.832 1.00 0.00 C ATOM 9 NZ LYS A 8 1.314 -2.938 -24.380 1.00 0.00 N ATOM 0 HA LYS A 8 5.899 -5.873 -25.502 1.00 0.00 H new ATOM 0 HB2 LYS A 8 4.161 -5.940 -27.443 1.00 0.00 H new ATOM 0 HB3 LYS A 8 3.135 -6.835 -26.340 1.00 0.00 H new ATOM 0 HG2 LYS A 8 3.503 -4.850 -24.697 1.00 0.00 H new ATOM 0 HG3 LYS A 8 4.102 -3.979 -26.095 1.00 0.00 H new ATOM 0 HD2 LYS A 8 1.918 -4.622 -27.281 1.00 0.00 H new ATOM 0 HD3 LYS A 8 1.338 -5.191 -25.728 1.00 0.00 H new ATOM 0 HE2 LYS A 8 2.430 -2.383 -26.093 1.00 0.00 H new ATOM 0 HE3 LYS A 8 0.751 -2.768 -26.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 1.048 -1.956 -24.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 0.526 -3.571 -24.135 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 2.153 -3.198 -23.823 1.00 0.00 H new ATOM 25 N MET A 9 5.672 -7.116 -23.364 1.00 0.00 N ATOM 26 CA MET A 9 5.427 -7.650 -22.030 1.00 0.00 C ATOM 27 C MET A 9 4.840 -6.580 -21.116 1.00 0.00 C ATOM 28 O MET A 9 5.391 -5.486 -20.990 1.00 0.00 O ATOM 29 CB MET A 9 6.724 -8.195 -21.429 1.00 0.00 C ATOM 30 CG MET A 9 7.200 -9.484 -22.078 1.00 0.00 C ATOM 31 SD MET A 9 7.726 -10.719 -20.874 1.00 0.00 S ATOM 32 CE MET A 9 9.452 -10.283 -20.676 1.00 0.00 C ATOM 0 H MET A 9 6.558 -6.621 -23.464 1.00 0.00 H new ATOM 0 HA MET A 9 4.706 -8.463 -22.118 1.00 0.00 H new ATOM 0 HB2 MET A 9 7.504 -7.440 -21.525 1.00 0.00 H new ATOM 0 HB3 MET A 9 6.576 -8.368 -20.363 1.00 0.00 H new ATOM 0 HG2 MET A 9 6.396 -9.897 -22.688 1.00 0.00 H new ATOM 0 HG3 MET A 9 8.029 -9.263 -22.750 1.00 0.00 H new ATOM 0 HE1 MET A 9 9.918 -10.959 -19.959 1.00 0.00 H new ATOM 0 HE2 MET A 9 9.961 -10.366 -21.636 1.00 0.00 H new ATOM 0 HE3 MET A 9 9.529 -9.259 -20.312 1.00 0.00 H new ATOM 42 N SER A 10 3.719 -6.902 -20.478 1.00 0.00 N ATOM 43 CA SER A 10 3.058 -5.968 -19.573 1.00 0.00 C ATOM 44 C SER A 10 2.636 -6.665 -18.285 1.00 0.00 C ATOM 45 O SER A 10 1.931 -7.674 -18.315 1.00 0.00 O ATOM 46 CB SER A 10 1.838 -5.344 -20.254 1.00 0.00 C ATOM 47 OG SER A 10 2.178 -4.130 -20.900 1.00 0.00 O ATOM 0 H SER A 10 3.249 -7.803 -20.571 1.00 0.00 H new ATOM 0 HA SER A 10 3.768 -5.180 -19.321 1.00 0.00 H new ATOM 0 HB2 SER A 10 1.427 -6.044 -20.982 1.00 0.00 H new ATOM 0 HB3 SER A 10 1.059 -5.160 -19.514 1.00 0.00 H new ATOM 0 HG SER A 10 1.381 -3.753 -21.328 1.00 0.00 H new ATOM 53 N GLU A 11 3.071 -6.120 -17.153 1.00 0.00 N ATOM 54 CA GLU A 11 2.737 -6.689 -15.853 1.00 0.00 C ATOM 55 C GLU A 11 2.015 -5.666 -14.982 1.00 0.00 C ATOM 56 O GLU A 11 2.632 -4.748 -14.443 1.00 0.00 O ATOM 57 CB GLU A 11 4.004 -7.175 -15.146 1.00 0.00 C ATOM 58 CG GLU A 11 4.473 -8.544 -15.613 1.00 0.00 C ATOM 59 CD GLU A 11 5.002 -9.398 -14.478 1.00 0.00 C ATOM 60 OE1 GLU A 11 6.041 -9.030 -13.893 1.00 0.00 O ATOM 61 OE2 GLU A 11 4.376 -10.436 -14.175 1.00 0.00 O ATOM 0 H GLU A 11 3.655 -5.285 -17.110 1.00 0.00 H new ATOM 0 HA GLU A 11 2.071 -7.537 -16.014 1.00 0.00 H new ATOM 0 HB2 GLU A 11 4.802 -6.451 -15.310 1.00 0.00 H new ATOM 0 HB3 GLU A 11 3.821 -7.210 -14.072 1.00 0.00 H new ATOM 0 HG2 GLU A 11 3.645 -9.062 -16.097 1.00 0.00 H new ATOM 0 HG3 GLU A 11 5.254 -8.420 -16.364 1.00 0.00 H new ATOM 68 N LYS A 12 0.703 -5.831 -14.850 1.00 0.00 N ATOM 69 CA LYS A 12 -0.105 -4.921 -14.046 1.00 0.00 C ATOM 70 C LYS A 12 -1.213 -5.674 -13.315 1.00 0.00 C ATOM 71 O LYS A 12 -2.043 -6.335 -13.938 1.00 0.00 O ATOM 72 CB LYS A 12 -0.711 -3.828 -14.930 1.00 0.00 C ATOM 73 CG LYS A 12 0.050 -2.513 -14.883 1.00 0.00 C ATOM 74 CD LYS A 12 -0.604 -1.458 -15.759 1.00 0.00 C ATOM 75 CE LYS A 12 -0.396 -0.060 -15.199 1.00 0.00 C ATOM 76 NZ LYS A 12 -0.888 0.992 -16.132 1.00 0.00 N ATOM 0 H LYS A 12 0.177 -6.586 -15.289 1.00 0.00 H new ATOM 0 HA LYS A 12 0.545 -4.459 -13.303 1.00 0.00 H new ATOM 0 HB2 LYS A 12 -0.743 -4.182 -15.960 1.00 0.00 H new ATOM 0 HB3 LYS A 12 -1.741 -3.653 -14.621 1.00 0.00 H new ATOM 0 HG2 LYS A 12 0.096 -2.155 -13.854 1.00 0.00 H new ATOM 0 HG3 LYS A 12 1.077 -2.674 -15.211 1.00 0.00 H new ATOM 0 HD2 LYS A 12 -0.190 -1.513 -16.766 1.00 0.00 H new ATOM 0 HD3 LYS A 12 -1.671 -1.663 -15.841 1.00 0.00 H new ATOM 0 HE2 LYS A 12 -0.915 0.030 -14.245 1.00 0.00 H new ATOM 0 HE3 LYS A 12 0.664 0.098 -15.001 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 -0.728 1.930 -15.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 -0.375 0.923 -17.034 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 -1.905 0.858 -16.301 1.00 0.00 H new ATOM 90 N LEU A 13 -1.219 -5.567 -11.989 1.00 0.00 N ATOM 91 CA LEU A 13 -2.227 -6.234 -11.172 1.00 0.00 C ATOM 92 C LEU A 13 -3.455 -5.347 -10.998 1.00 0.00 C ATOM 93 O LEU A 13 -3.341 -4.126 -10.893 1.00 0.00 O ATOM 94 CB LEU A 13 -1.647 -6.597 -9.803 1.00 0.00 C ATOM 95 CG LEU A 13 -2.639 -7.219 -8.818 1.00 0.00 C ATOM 96 CD1 LEU A 13 -2.721 -8.723 -9.023 1.00 0.00 C ATOM 97 CD2 LEU A 13 -2.244 -6.891 -7.384 1.00 0.00 C ATOM 0 H LEU A 13 -0.537 -5.025 -11.458 1.00 0.00 H new ATOM 0 HA LEU A 13 -2.529 -7.148 -11.683 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -0.821 -7.293 -9.949 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -1.229 -5.696 -9.353 1.00 0.00 H new ATOM 0 HG LEU A 13 -3.625 -6.794 -9.006 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -3.431 -9.149 -8.314 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -3.053 -8.934 -10.040 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -1.738 -9.166 -8.863 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -2.961 -7.341 -6.697 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -1.249 -7.287 -7.181 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -2.240 -5.810 -7.246 1.00 0.00 H new ATOM 109 N ARG A 14 -4.630 -5.966 -10.972 1.00 0.00 N ATOM 110 CA ARG A 14 -5.874 -5.225 -10.812 1.00 0.00 C ATOM 111 C ARG A 14 -5.970 -4.613 -9.419 1.00 0.00 C ATOM 112 O ARG A 14 -6.275 -5.299 -8.444 1.00 0.00 O ATOM 113 CB ARG A 14 -7.076 -6.134 -11.060 1.00 0.00 C ATOM 114 CG ARG A 14 -7.272 -6.501 -12.522 1.00 0.00 C ATOM 115 CD ARG A 14 -8.613 -7.177 -12.753 1.00 0.00 C ATOM 116 NE ARG A 14 -8.570 -8.604 -12.434 1.00 0.00 N ATOM 117 CZ ARG A 14 -7.863 -9.496 -13.124 1.00 0.00 C ATOM 118 NH1 ARG A 14 -7.141 -9.115 -14.171 1.00 0.00 N ATOM 119 NH2 ARG A 14 -7.877 -10.772 -12.766 1.00 0.00 N ATOM 0 H ARG A 14 -4.746 -6.976 -11.059 1.00 0.00 H new ATOM 0 HA ARG A 14 -5.879 -4.420 -11.547 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -6.956 -7.048 -10.478 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -7.976 -5.639 -10.695 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -7.206 -5.602 -13.135 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -6.469 -7.165 -12.842 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -9.374 -6.692 -12.141 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -8.910 -7.047 -13.794 1.00 0.00 H new ATOM 0 HE ARG A 14 -9.113 -8.935 -11.637 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -7.126 -8.134 -14.450 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -6.601 -9.803 -14.696 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -8.429 -11.070 -11.962 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -7.335 -11.456 -13.294 1.00 0.00 H new ATOM 133 N ILE A 15 -5.703 -3.317 -9.339 1.00 0.00 N ATOM 134 CA ILE A 15 -5.752 -2.598 -8.076 1.00 0.00 C ATOM 135 C ILE A 15 -6.350 -1.207 -8.271 1.00 0.00 C ATOM 136 O ILE A 15 -5.766 -0.360 -8.946 1.00 0.00 O ATOM 137 CB ILE A 15 -4.346 -2.463 -7.464 1.00 0.00 C ATOM 138 CG1 ILE A 15 -3.677 -3.835 -7.363 1.00 0.00 C ATOM 139 CG2 ILE A 15 -4.419 -1.798 -6.096 1.00 0.00 C ATOM 140 CD1 ILE A 15 -2.233 -3.776 -6.912 1.00 0.00 C ATOM 0 H ILE A 15 -5.449 -2.740 -10.140 1.00 0.00 H new ATOM 0 HA ILE A 15 -6.383 -3.171 -7.396 1.00 0.00 H new ATOM 0 HB ILE A 15 -3.743 -1.832 -8.117 1.00 0.00 H new ATOM 0 HG12 ILE A 15 -4.241 -4.454 -6.666 1.00 0.00 H new ATOM 0 HG13 ILE A 15 -3.725 -4.325 -8.335 1.00 0.00 H new ATOM 0 HG21 ILE A 15 -3.415 -1.711 -5.680 1.00 0.00 H new ATOM 0 HG22 ILE A 15 -4.857 -0.805 -6.197 1.00 0.00 H new ATOM 0 HG23 ILE A 15 -5.037 -2.401 -5.431 1.00 0.00 H new ATOM 0 HD11 ILE A 15 -1.825 -4.786 -6.864 1.00 0.00 H new ATOM 0 HD12 ILE A 15 -1.654 -3.184 -7.621 1.00 0.00 H new ATOM 0 HD13 ILE A 15 -2.178 -3.315 -5.926 1.00 0.00 H new ATOM 152 N LYS A 16 -7.518 -0.978 -7.677 1.00 0.00 N ATOM 153 CA LYS A 16 -8.190 0.310 -7.792 1.00 0.00 C ATOM 154 C LYS A 16 -8.727 0.762 -6.439 1.00 0.00 C ATOM 155 O LYS A 16 -9.301 -0.031 -5.693 1.00 0.00 O ATOM 156 CB LYS A 16 -9.333 0.227 -8.806 1.00 0.00 C ATOM 157 CG LYS A 16 -10.213 -0.999 -8.630 1.00 0.00 C ATOM 158 CD LYS A 16 -11.602 -0.776 -9.207 1.00 0.00 C ATOM 159 CE LYS A 16 -12.441 -2.043 -9.146 1.00 0.00 C ATOM 160 NZ LYS A 16 -13.401 -2.018 -8.009 1.00 0.00 N ATOM 0 H LYS A 16 -8.016 -1.666 -7.113 1.00 0.00 H new ATOM 0 HA LYS A 16 -7.461 1.043 -8.139 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -9.949 1.122 -8.720 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -8.915 0.223 -9.813 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -9.748 -1.855 -9.119 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -10.293 -1.242 -7.570 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -12.103 0.020 -8.656 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -11.518 -0.443 -10.242 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -12.989 -2.161 -10.081 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -11.785 -2.908 -9.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -13.508 -2.978 -7.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -13.042 -1.385 -7.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -14.324 -1.673 -8.342 1.00 0.00 H new ATOM 174 N VAL A 17 -8.534 2.037 -6.126 1.00 0.00 N ATOM 175 CA VAL A 17 -8.998 2.588 -4.858 1.00 0.00 C ATOM 176 C VAL A 17 -10.036 3.682 -5.083 1.00 0.00 C ATOM 177 O VAL A 17 -9.735 4.731 -5.653 1.00 0.00 O ATOM 178 CB VAL A 17 -7.835 3.165 -4.023 1.00 0.00 C ATOM 179 CG1 VAL A 17 -8.125 3.013 -2.539 1.00 0.00 C ATOM 180 CG2 VAL A 17 -6.517 2.490 -4.381 1.00 0.00 C ATOM 0 H VAL A 17 -8.061 2.708 -6.731 1.00 0.00 H new ATOM 0 HA VAL A 17 -9.450 1.763 -4.307 1.00 0.00 H new ATOM 0 HB VAL A 17 -7.743 4.226 -4.255 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -7.296 3.424 -1.962 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -9.041 3.549 -2.291 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -8.246 1.957 -2.298 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -5.715 2.915 -3.778 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -6.591 1.420 -4.184 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -6.301 2.650 -5.437 1.00 0.00 H new ATOM 190 N ASP A 18 -11.260 3.430 -4.632 1.00 0.00 N ATOM 191 CA ASP A 18 -12.343 4.394 -4.784 1.00 0.00 C ATOM 192 C ASP A 18 -13.207 4.450 -3.527 1.00 0.00 C ATOM 193 O ASP A 18 -14.391 4.781 -3.591 1.00 0.00 O ATOM 194 CB ASP A 18 -13.204 4.036 -5.998 1.00 0.00 C ATOM 195 CG ASP A 18 -13.121 5.080 -7.094 1.00 0.00 C ATOM 196 OD1 ASP A 18 -12.002 5.564 -7.368 1.00 0.00 O ATOM 197 OD2 ASP A 18 -14.173 5.414 -7.677 1.00 0.00 O ATOM 0 H ASP A 18 -11.527 2.567 -4.159 1.00 0.00 H new ATOM 0 HA ASP A 18 -11.901 5.378 -4.938 1.00 0.00 H new ATOM 0 HB2 ASP A 18 -12.886 3.072 -6.394 1.00 0.00 H new ATOM 0 HB3 ASP A 18 -14.242 3.925 -5.684 1.00 0.00 H new ATOM 202 N ASP A 19 -12.608 4.129 -2.384 1.00 0.00 N ATOM 203 CA ASP A 19 -13.325 4.147 -1.115 1.00 0.00 C ATOM 204 C ASP A 19 -12.448 4.713 -0.004 1.00 0.00 C ATOM 205 O ASP A 19 -11.254 4.421 0.066 1.00 0.00 O ATOM 206 CB ASP A 19 -13.791 2.736 -0.748 1.00 0.00 C ATOM 207 CG ASP A 19 -15.244 2.700 -0.320 1.00 0.00 C ATOM 208 OD1 ASP A 19 -15.710 3.689 0.286 1.00 0.00 O ATOM 209 OD2 ASP A 19 -15.918 1.683 -0.589 1.00 0.00 O ATOM 0 H ASP A 19 -11.629 3.854 -2.311 1.00 0.00 H new ATOM 0 HA ASP A 19 -14.197 4.791 -1.227 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -13.651 2.076 -1.604 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -13.168 2.349 0.058 1.00 0.00 H new ATOM 214 N VAL A 20 -13.045 5.526 0.861 1.00 0.00 N ATOM 215 CA VAL A 20 -12.314 6.133 1.967 1.00 0.00 C ATOM 216 C VAL A 20 -13.226 6.377 3.163 1.00 0.00 C ATOM 217 O VAL A 20 -14.188 7.140 3.079 1.00 0.00 O ATOM 218 CB VAL A 20 -11.668 7.466 1.548 1.00 0.00 C ATOM 219 CG1 VAL A 20 -10.746 7.981 2.643 1.00 0.00 C ATOM 220 CG2 VAL A 20 -10.913 7.306 0.237 1.00 0.00 C ATOM 0 H VAL A 20 -14.032 5.780 0.818 1.00 0.00 H new ATOM 0 HA VAL A 20 -11.530 5.430 2.250 1.00 0.00 H new ATOM 0 HB VAL A 20 -12.460 8.200 1.397 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -10.299 8.924 2.328 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -11.319 8.138 3.557 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -9.959 7.250 2.829 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -10.463 8.259 -0.043 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -10.130 6.557 0.357 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -11.603 6.988 -0.544 1.00 0.00 H new ATOM 230 N LYS A 21 -12.914 5.726 4.279 1.00 0.00 N ATOM 231 CA LYS A 21 -13.702 5.873 5.497 1.00 0.00 C ATOM 232 C LYS A 21 -13.017 6.825 6.472 1.00 0.00 C ATOM 233 O LYS A 21 -12.027 6.469 7.110 1.00 0.00 O ATOM 234 CB LYS A 21 -13.913 4.512 6.161 1.00 0.00 C ATOM 235 CG LYS A 21 -15.183 3.807 5.713 1.00 0.00 C ATOM 236 CD LYS A 21 -15.105 2.309 5.954 1.00 0.00 C ATOM 237 CE LYS A 21 -15.798 1.915 7.248 1.00 0.00 C ATOM 238 NZ LYS A 21 -17.234 1.582 7.031 1.00 0.00 N ATOM 0 H LYS A 21 -12.120 5.091 4.365 1.00 0.00 H new ATOM 0 HA LYS A 21 -14.672 6.291 5.226 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -13.057 3.874 5.943 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -13.944 4.645 7.242 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -16.037 4.219 6.250 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -15.351 3.997 4.653 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -15.565 1.781 5.119 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -14.061 1.999 5.991 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -15.289 1.057 7.686 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -15.719 2.732 7.965 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -17.670 1.319 7.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -17.726 2.409 6.637 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -17.309 0.786 6.366 1.00 0.00 H new ATOM 252 N ILE A 22 -13.549 8.038 6.580 1.00 0.00 N ATOM 253 CA ILE A 22 -12.988 9.040 7.475 1.00 0.00 C ATOM 254 C ILE A 22 -13.356 8.748 8.926 1.00 0.00 C ATOM 255 O ILE A 22 -14.444 9.099 9.382 1.00 0.00 O ATOM 256 CB ILE A 22 -13.477 10.454 7.112 1.00 0.00 C ATOM 257 CG1 ILE A 22 -13.340 10.700 5.605 1.00 0.00 C ATOM 258 CG2 ILE A 22 -12.703 11.498 7.899 1.00 0.00 C ATOM 259 CD1 ILE A 22 -11.909 10.876 5.145 1.00 0.00 C ATOM 0 H ILE A 22 -14.368 8.350 6.058 1.00 0.00 H new ATOM 0 HA ILE A 22 -11.905 8.996 7.359 1.00 0.00 H new ATOM 0 HB ILE A 22 -14.531 10.536 7.376 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -13.785 9.863 5.067 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -13.910 11.590 5.338 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -13.059 12.493 7.632 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -12.852 11.333 8.966 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -11.642 11.418 7.664 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -11.891 11.046 4.068 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -11.466 11.731 5.655 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -11.338 9.978 5.380 1.00 0.00 H new ATOM 271 N ASN A 23 -12.442 8.108 9.648 1.00 0.00 N ATOM 272 CA ASN A 23 -12.674 7.775 11.048 1.00 0.00 C ATOM 273 C ASN A 23 -12.103 8.859 11.961 1.00 0.00 C ATOM 274 O ASN A 23 -11.065 9.449 11.662 1.00 0.00 O ATOM 275 CB ASN A 23 -12.050 6.417 11.383 1.00 0.00 C ATOM 276 CG ASN A 23 -13.092 5.378 11.755 1.00 0.00 C ATOM 277 OD1 ASN A 23 -13.864 5.566 12.694 1.00 0.00 O ATOM 278 ND2 ASN A 23 -13.117 4.275 11.016 1.00 0.00 N ATOM 0 H ASN A 23 -11.536 7.810 9.287 1.00 0.00 H new ATOM 0 HA ASN A 23 -13.750 7.716 11.213 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -11.477 6.062 10.526 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -11.349 6.536 12.209 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -13.796 3.541 11.218 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -12.457 4.162 10.246 1.00 0.00 H new ATOM 285 N PRO A 24 -12.779 9.140 13.090 1.00 0.00 N ATOM 286 CA PRO A 24 -12.333 10.164 14.043 1.00 0.00 C ATOM 287 C PRO A 24 -10.898 9.948 14.512 1.00 0.00 C ATOM 288 O PRO A 24 -10.240 10.881 14.973 1.00 0.00 O ATOM 289 CB PRO A 24 -13.304 10.009 15.217 1.00 0.00 C ATOM 290 CG PRO A 24 -14.518 9.379 14.631 1.00 0.00 C ATOM 291 CD PRO A 24 -14.029 8.489 13.524 1.00 0.00 C ATOM 0 HA PRO A 24 -12.336 11.157 13.594 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -12.877 9.387 16.003 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -13.538 10.974 15.666 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -15.061 8.805 15.382 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -15.204 10.135 14.250 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -13.852 7.472 13.874 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -14.752 8.425 12.711 1.00 0.00 H new ATOM 299 N LYS A 25 -10.417 8.713 14.399 1.00 0.00 N ATOM 300 CA LYS A 25 -9.061 8.385 14.823 1.00 0.00 C ATOM 301 C LYS A 25 -8.094 8.379 13.642 1.00 0.00 C ATOM 302 O LYS A 25 -6.905 8.649 13.805 1.00 0.00 O ATOM 303 CB LYS A 25 -9.041 7.022 15.518 1.00 0.00 C ATOM 304 CG LYS A 25 -9.599 7.052 16.932 1.00 0.00 C ATOM 305 CD LYS A 25 -8.497 7.226 17.964 1.00 0.00 C ATOM 306 CE LYS A 25 -8.168 5.912 18.655 1.00 0.00 C ATOM 307 NZ LYS A 25 -9.389 5.237 19.175 1.00 0.00 N ATOM 0 H LYS A 25 -10.944 7.927 14.019 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.736 9.154 15.524 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.617 6.312 14.924 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -8.015 6.654 15.549 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -10.316 7.868 17.024 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.141 6.127 17.130 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -7.602 7.618 17.480 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -8.806 7.962 18.707 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -7.658 5.251 17.954 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -7.477 6.097 19.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -9.139 4.654 19.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -10.088 5.953 19.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -9.794 4.632 18.432 1.00 0.00 H new ATOM 321 N TYR A 26 -8.607 8.067 12.456 1.00 0.00 N ATOM 322 CA TYR A 26 -7.776 8.025 11.257 1.00 0.00 C ATOM 323 C TYR A 26 -8.621 7.801 10.008 1.00 0.00 C ATOM 324 O TYR A 26 -9.764 7.353 10.090 1.00 0.00 O ATOM 325 CB TYR A 26 -6.725 6.919 11.379 1.00 0.00 C ATOM 326 CG TYR A 26 -7.264 5.632 11.964 1.00 0.00 C ATOM 327 CD1 TYR A 26 -8.051 4.777 11.203 1.00 0.00 C ATOM 328 CD2 TYR A 26 -6.987 5.274 13.277 1.00 0.00 C ATOM 329 CE1 TYR A 26 -8.546 3.601 11.734 1.00 0.00 C ATOM 330 CE2 TYR A 26 -7.478 4.100 13.815 1.00 0.00 C ATOM 331 CZ TYR A 26 -8.257 3.268 13.040 1.00 0.00 C ATOM 332 OH TYR A 26 -8.748 2.098 13.572 1.00 0.00 O ATOM 0 H TYR A 26 -9.589 7.841 12.299 1.00 0.00 H new ATOM 0 HA TYR A 26 -7.275 8.989 11.163 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -6.310 6.714 10.392 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -5.905 7.276 12.002 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -8.280 5.035 10.180 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -6.378 5.924 13.888 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -9.156 2.946 11.129 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -7.253 3.836 14.838 1.00 0.00 H new ATOM 0 HH TYR A 26 -8.452 2.012 14.502 1.00 0.00 H new ATOM 342 N VAL A 27 -8.048 8.116 8.850 1.00 0.00 N ATOM 343 CA VAL A 27 -8.743 7.950 7.579 1.00 0.00 C ATOM 344 C VAL A 27 -8.322 6.655 6.891 1.00 0.00 C ATOM 345 O VAL A 27 -7.149 6.465 6.570 1.00 0.00 O ATOM 346 CB VAL A 27 -8.472 9.137 6.634 1.00 0.00 C ATOM 347 CG1 VAL A 27 -9.333 9.036 5.383 1.00 0.00 C ATOM 348 CG2 VAL A 27 -8.713 10.458 7.352 1.00 0.00 C ATOM 0 H VAL A 27 -7.102 8.488 8.766 1.00 0.00 H new ATOM 0 HA VAL A 27 -9.810 7.910 7.800 1.00 0.00 H new ATOM 0 HB VAL A 27 -7.426 9.101 6.329 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -9.126 9.884 4.730 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -9.104 8.109 4.858 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -10.386 9.043 5.664 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -8.517 11.284 6.669 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -9.748 10.505 7.690 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -8.047 10.532 8.212 1.00 0.00 H new ATOM 358 N LEU A 28 -9.285 5.766 6.673 1.00 0.00 N ATOM 359 CA LEU A 28 -9.015 4.486 6.027 1.00 0.00 C ATOM 360 C LEU A 28 -9.163 4.589 4.513 1.00 0.00 C ATOM 361 O LEU A 28 -9.815 5.500 4.002 1.00 0.00 O ATOM 362 CB LEU A 28 -9.956 3.408 6.571 1.00 0.00 C ATOM 363 CG LEU A 28 -9.855 3.162 8.077 1.00 0.00 C ATOM 364 CD1 LEU A 28 -10.749 2.003 8.490 1.00 0.00 C ATOM 365 CD2 LEU A 28 -8.413 2.892 8.477 1.00 0.00 C ATOM 0 H LEU A 28 -10.261 5.908 6.934 1.00 0.00 H new ATOM 0 HA LEU A 28 -7.985 4.209 6.251 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -10.982 3.688 6.332 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -9.752 2.472 6.051 1.00 0.00 H new ATOM 0 HG LEU A 28 -10.194 4.059 8.595 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -10.664 1.843 9.565 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -11.784 2.234 8.238 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -10.441 1.100 7.963 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -8.360 2.719 9.552 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -8.048 2.011 7.949 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -7.796 3.752 8.217 1.00 0.00 H new ATOM 377 N TYR A 29 -8.552 3.647 3.800 1.00 0.00 N ATOM 378 CA TYR A 29 -8.613 3.628 2.343 1.00 0.00 C ATOM 379 C TYR A 29 -9.056 2.258 1.838 1.00 0.00 C ATOM 380 O TYR A 29 -8.433 1.243 2.145 1.00 0.00 O ATOM 381 CB TYR A 29 -7.249 3.984 1.750 1.00 0.00 C ATOM 382 CG TYR A 29 -7.003 5.472 1.647 1.00 0.00 C ATOM 383 CD1 TYR A 29 -6.525 6.192 2.735 1.00 0.00 C ATOM 384 CD2 TYR A 29 -7.247 6.156 0.462 1.00 0.00 C ATOM 385 CE1 TYR A 29 -6.299 7.553 2.645 1.00 0.00 C ATOM 386 CE2 TYR A 29 -7.022 7.515 0.364 1.00 0.00 C ATOM 387 CZ TYR A 29 -6.548 8.210 1.458 1.00 0.00 C ATOM 388 OH TYR A 29 -6.322 9.565 1.366 1.00 0.00 O ATOM 0 H TYR A 29 -8.009 2.887 4.209 1.00 0.00 H new ATOM 0 HA TYR A 29 -9.345 4.370 2.024 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -6.467 3.537 2.364 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -7.167 3.541 0.757 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -6.327 5.681 3.665 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -7.619 5.616 -0.396 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -5.929 8.099 3.500 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -7.216 8.031 -0.564 1.00 0.00 H new ATOM 0 HH TYR A 29 -6.576 9.879 0.473 1.00 0.00 H new ATOM 398 N GLY A 30 -10.134 2.238 1.062 1.00 0.00 N ATOM 399 CA GLY A 30 -10.639 0.986 0.530 1.00 0.00 C ATOM 400 C GLY A 30 -10.001 0.621 -0.795 1.00 0.00 C ATOM 401 O GLY A 30 -10.436 1.085 -1.849 1.00 0.00 O ATOM 0 H GLY A 30 -10.667 3.065 0.792 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -10.456 0.188 1.250 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -11.719 1.058 0.402 1.00 0.00 H new ATOM 405 N VAL A 31 -8.967 -0.213 -0.743 1.00 0.00 N ATOM 406 CA VAL A 31 -8.268 -0.641 -1.948 1.00 0.00 C ATOM 407 C VAL A 31 -8.935 -1.865 -2.561 1.00 0.00 C ATOM 408 O VAL A 31 -8.910 -2.953 -1.987 1.00 0.00 O ATOM 409 CB VAL A 31 -6.791 -0.966 -1.657 1.00 0.00 C ATOM 410 CG1 VAL A 31 -6.033 -1.215 -2.953 1.00 0.00 C ATOM 411 CG2 VAL A 31 -6.144 0.157 -0.860 1.00 0.00 C ATOM 0 H VAL A 31 -8.595 -0.606 0.122 1.00 0.00 H new ATOM 0 HA VAL A 31 -8.316 0.189 -2.653 1.00 0.00 H new ATOM 0 HB VAL A 31 -6.750 -1.876 -1.058 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.991 -1.443 -2.727 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -6.482 -2.056 -3.481 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -6.082 -0.325 -3.580 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.101 -0.090 -0.664 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -6.196 1.085 -1.430 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -6.671 0.282 0.086 1.00 0.00 H new ATOM 421 N SER A 32 -9.534 -1.677 -3.732 1.00 0.00 N ATOM 422 CA SER A 32 -10.214 -2.764 -4.426 1.00 0.00 C ATOM 423 C SER A 32 -9.221 -3.623 -5.202 1.00 0.00 C ATOM 424 O SER A 32 -8.390 -3.109 -5.950 1.00 0.00 O ATOM 425 CB SER A 32 -11.279 -2.205 -5.373 1.00 0.00 C ATOM 426 OG SER A 32 -12.580 -2.586 -4.960 1.00 0.00 O ATOM 0 H SER A 32 -9.562 -0.782 -4.220 1.00 0.00 H new ATOM 0 HA SER A 32 -10.698 -3.392 -3.678 1.00 0.00 H new ATOM 0 HB2 SER A 32 -11.208 -1.118 -5.404 1.00 0.00 H new ATOM 0 HB3 SER A 32 -11.095 -2.565 -6.385 1.00 0.00 H new ATOM 0 HG SER A 32 -13.195 -1.832 -5.080 1.00 0.00 H new ATOM 432 N THR A 33 -9.314 -4.936 -5.015 1.00 0.00 N ATOM 433 CA THR A 33 -8.424 -5.871 -5.694 1.00 0.00 C ATOM 434 C THR A 33 -9.178 -7.135 -6.101 1.00 0.00 C ATOM 435 O THR A 33 -10.277 -7.394 -5.608 1.00 0.00 O ATOM 436 CB THR A 33 -7.249 -6.227 -4.784 1.00 0.00 C ATOM 437 OG1 THR A 33 -7.690 -6.429 -3.453 1.00 0.00 O ATOM 438 CG2 THR A 33 -6.176 -5.160 -4.754 1.00 0.00 C ATOM 0 H THR A 33 -9.997 -5.376 -4.399 1.00 0.00 H new ATOM 0 HA THR A 33 -8.043 -5.394 -6.597 1.00 0.00 H new ATOM 0 HB THR A 33 -6.823 -7.139 -5.201 1.00 0.00 H new ATOM 0 HG1 THR A 33 -8.669 -6.462 -3.434 1.00 0.00 H new ATOM 0 HG21 THR A 33 -5.370 -5.473 -4.090 1.00 0.00 H new ATOM 0 HG22 THR A 33 -5.781 -5.012 -5.759 1.00 0.00 H new ATOM 0 HG23 THR A 33 -6.603 -4.225 -4.391 1.00 0.00 H new ATOM 446 N PRO A 34 -8.600 -7.944 -7.008 1.00 0.00 N ATOM 447 CA PRO A 34 -9.217 -9.185 -7.480 1.00 0.00 C ATOM 448 C PRO A 34 -9.852 -9.983 -6.347 1.00 0.00 C ATOM 449 O PRO A 34 -10.839 -10.691 -6.550 1.00 0.00 O ATOM 450 CB PRO A 34 -8.047 -9.964 -8.107 1.00 0.00 C ATOM 451 CG PRO A 34 -6.823 -9.130 -7.880 1.00 0.00 C ATOM 452 CD PRO A 34 -7.302 -7.726 -7.650 1.00 0.00 C ATOM 0 HA PRO A 34 -10.030 -8.992 -8.180 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -7.941 -10.946 -7.645 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -8.214 -10.129 -9.171 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -6.260 -9.494 -7.021 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -6.156 -9.177 -8.741 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -6.621 -7.163 -7.011 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -7.397 -7.170 -8.583 1.00 0.00 H new ATOM 460 N ASN A 35 -9.286 -9.858 -5.153 1.00 0.00 N ATOM 461 CA ASN A 35 -9.804 -10.559 -3.986 1.00 0.00 C ATOM 462 C ASN A 35 -10.982 -9.799 -3.387 1.00 0.00 C ATOM 463 O ASN A 35 -12.058 -10.361 -3.185 1.00 0.00 O ATOM 464 CB ASN A 35 -8.703 -10.732 -2.936 1.00 0.00 C ATOM 465 CG ASN A 35 -9.022 -11.830 -1.939 1.00 0.00 C ATOM 466 OD1 ASN A 35 -9.376 -11.558 -0.792 1.00 0.00 O ATOM 467 ND2 ASN A 35 -8.898 -13.079 -2.373 1.00 0.00 N ATOM 0 H ASN A 35 -8.468 -9.277 -4.968 1.00 0.00 H new ATOM 0 HA ASN A 35 -10.147 -11.544 -4.301 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -7.761 -10.961 -3.435 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -8.561 -9.791 -2.404 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -9.099 -13.859 -1.747 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -8.602 -13.258 -3.332 1.00 0.00 H new ATOM 474 N LYS A 36 -10.770 -8.513 -3.112 1.00 0.00 N ATOM 475 CA LYS A 36 -11.812 -7.661 -2.541 1.00 0.00 C ATOM 476 C LYS A 36 -11.230 -6.329 -2.077 1.00 0.00 C ATOM 477 O LYS A 36 -10.041 -6.062 -2.257 1.00 0.00 O ATOM 478 CB LYS A 36 -12.503 -8.362 -1.367 1.00 0.00 C ATOM 479 CG LYS A 36 -11.539 -9.064 -0.425 1.00 0.00 C ATOM 480 CD LYS A 36 -12.173 -9.319 0.933 1.00 0.00 C ATOM 481 CE LYS A 36 -12.320 -8.033 1.730 1.00 0.00 C ATOM 482 NZ LYS A 36 -12.971 -8.268 3.049 1.00 0.00 N ATOM 0 H LYS A 36 -9.883 -8.037 -3.276 1.00 0.00 H new ATOM 0 HA LYS A 36 -12.549 -7.469 -3.321 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -13.078 -7.627 -0.804 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -13.213 -9.091 -1.757 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -11.224 -10.011 -0.864 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -10.643 -8.456 -0.301 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -13.152 -9.778 0.798 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -11.563 -10.028 1.493 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -11.337 -7.587 1.884 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -12.909 -7.316 1.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -13.053 -7.367 3.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -13.919 -8.670 2.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -12.397 -8.932 3.606 1.00 0.00 H new ATOM 496 N ARG A 37 -12.077 -5.494 -1.482 1.00 0.00 N ATOM 497 CA ARG A 37 -11.647 -4.189 -0.994 1.00 0.00 C ATOM 498 C ARG A 37 -10.961 -4.314 0.363 1.00 0.00 C ATOM 499 O ARG A 37 -11.530 -4.857 1.310 1.00 0.00 O ATOM 500 CB ARG A 37 -12.845 -3.240 -0.894 1.00 0.00 C ATOM 501 CG ARG A 37 -12.698 -1.986 -1.740 1.00 0.00 C ATOM 502 CD ARG A 37 -13.549 -0.847 -1.200 1.00 0.00 C ATOM 503 NE ARG A 37 -14.969 -1.185 -1.184 1.00 0.00 N ATOM 504 CZ ARG A 37 -15.746 -1.179 -2.265 1.00 0.00 C ATOM 505 NH1 ARG A 37 -15.243 -0.852 -3.450 1.00 0.00 N ATOM 506 NH2 ARG A 37 -17.028 -1.499 -2.162 1.00 0.00 N ATOM 0 H ARG A 37 -13.064 -5.698 -1.327 1.00 0.00 H new ATOM 0 HA ARG A 37 -10.928 -3.780 -1.704 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -13.746 -3.772 -1.200 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -12.984 -2.951 0.148 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -11.652 -1.681 -1.762 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -12.988 -2.203 -2.768 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -13.224 -0.599 -0.190 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -13.395 0.042 -1.811 1.00 0.00 H new ATOM 0 HE ARG A 37 -15.391 -1.441 -0.291 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -14.257 -0.604 -3.535 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -15.842 -0.849 -4.275 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -17.420 -1.750 -1.254 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -17.623 -1.494 -2.990 1.00 0.00 H new ATOM 520 N LEU A 38 -9.735 -3.809 0.448 1.00 0.00 N ATOM 521 CA LEU A 38 -8.968 -3.865 1.687 1.00 0.00 C ATOM 522 C LEU A 38 -8.823 -2.476 2.302 1.00 0.00 C ATOM 523 O LEU A 38 -8.430 -1.525 1.627 1.00 0.00 O ATOM 524 CB LEU A 38 -7.586 -4.471 1.426 1.00 0.00 C ATOM 525 CG LEU A 38 -7.354 -5.847 2.055 1.00 0.00 C ATOM 526 CD1 LEU A 38 -6.541 -6.732 1.123 1.00 0.00 C ATOM 527 CD2 LEU A 38 -6.660 -5.705 3.401 1.00 0.00 C ATOM 0 H LEU A 38 -9.251 -3.356 -0.327 1.00 0.00 H new ATOM 0 HA LEU A 38 -9.507 -4.497 2.393 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.438 -4.551 0.349 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -6.828 -3.784 1.802 1.00 0.00 H new ATOM 0 HG LEU A 38 -8.323 -6.321 2.215 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.387 -7.706 1.588 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -7.077 -6.860 0.183 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -5.575 -6.266 0.929 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.502 -6.692 3.835 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -5.698 -5.211 3.264 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -7.282 -5.110 4.070 1.00 0.00 H new ATOM 539 N TYR A 39 -9.143 -2.368 3.589 1.00 0.00 N ATOM 540 CA TYR A 39 -9.048 -1.097 4.297 1.00 0.00 C ATOM 541 C TYR A 39 -7.678 -0.940 4.950 1.00 0.00 C ATOM 542 O TYR A 39 -7.157 -1.879 5.553 1.00 0.00 O ATOM 543 CB TYR A 39 -10.145 -0.996 5.358 1.00 0.00 C ATOM 544 CG TYR A 39 -11.507 -0.665 4.791 1.00 0.00 C ATOM 545 CD1 TYR A 39 -11.701 0.469 4.013 1.00 0.00 C ATOM 546 CD2 TYR A 39 -12.602 -1.487 5.037 1.00 0.00 C ATOM 547 CE1 TYR A 39 -12.945 0.774 3.494 1.00 0.00 C ATOM 548 CE2 TYR A 39 -13.848 -1.188 4.521 1.00 0.00 C ATOM 549 CZ TYR A 39 -14.014 -0.057 3.751 1.00 0.00 C ATOM 550 OH TYR A 39 -15.254 0.244 3.236 1.00 0.00 O ATOM 0 H TYR A 39 -9.470 -3.146 4.162 1.00 0.00 H new ATOM 0 HA TYR A 39 -9.180 -0.295 3.571 1.00 0.00 H new ATOM 0 HB2 TYR A 39 -10.205 -1.941 5.897 1.00 0.00 H new ATOM 0 HB3 TYR A 39 -9.867 -0.232 6.084 1.00 0.00 H new ATOM 0 HD1 TYR A 39 -10.866 1.123 3.810 1.00 0.00 H new ATOM 0 HD2 TYR A 39 -12.476 -2.373 5.641 1.00 0.00 H new ATOM 0 HE1 TYR A 39 -13.079 1.659 2.890 1.00 0.00 H new ATOM 0 HE2 TYR A 39 -14.688 -1.837 4.720 1.00 0.00 H new ATOM 0 HH TYR A 39 -15.897 -0.443 3.509 1.00 0.00 H new ATOM 560 N LYS A 40 -7.101 0.250 4.825 1.00 0.00 N ATOM 561 CA LYS A 40 -5.792 0.529 5.403 1.00 0.00 C ATOM 562 C LYS A 40 -5.645 2.014 5.722 1.00 0.00 C ATOM 563 O LYS A 40 -6.489 2.826 5.345 1.00 0.00 O ATOM 564 CB LYS A 40 -4.684 0.087 4.444 1.00 0.00 C ATOM 565 CG LYS A 40 -4.131 -1.296 4.750 1.00 0.00 C ATOM 566 CD LYS A 40 -4.336 -2.252 3.585 1.00 0.00 C ATOM 567 CE LYS A 40 -3.518 -1.838 2.372 1.00 0.00 C ATOM 568 NZ LYS A 40 -4.313 -1.905 1.115 1.00 0.00 N ATOM 0 H LYS A 40 -7.519 1.037 4.329 1.00 0.00 H new ATOM 0 HA LYS A 40 -5.703 -0.034 6.332 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -5.071 0.097 3.425 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -3.871 0.811 4.483 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -3.068 -1.221 4.977 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -4.619 -1.695 5.639 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -4.055 -3.261 3.887 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -5.393 -2.282 3.319 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -3.148 -0.823 2.513 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -2.646 -2.486 2.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -3.714 -1.631 0.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -4.659 -2.876 0.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -5.122 -1.255 1.181 1.00 0.00 H new ATOM 582 N ARG A 41 -4.568 2.359 6.419 1.00 0.00 N ATOM 583 CA ARG A 41 -4.310 3.747 6.790 1.00 0.00 C ATOM 584 C ARG A 41 -3.104 4.294 6.033 1.00 0.00 C ATOM 585 O ARG A 41 -2.280 3.534 5.526 1.00 0.00 O ATOM 586 CB ARG A 41 -4.072 3.858 8.297 1.00 0.00 C ATOM 587 CG ARG A 41 -5.085 3.092 9.134 1.00 0.00 C ATOM 588 CD ARG A 41 -4.470 2.592 10.432 1.00 0.00 C ATOM 589 NE ARG A 41 -4.959 1.265 10.794 1.00 0.00 N ATOM 590 CZ ARG A 41 -4.338 0.452 11.647 1.00 0.00 C ATOM 591 NH1 ARG A 41 -3.205 0.828 12.228 1.00 0.00 N ATOM 592 NH2 ARG A 41 -4.851 -0.740 11.919 1.00 0.00 N ATOM 0 H ARG A 41 -3.860 1.698 6.739 1.00 0.00 H new ATOM 0 HA ARG A 41 -5.186 4.338 6.523 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -3.072 3.490 8.526 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -4.098 4.909 8.584 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -5.936 3.736 9.357 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -5.467 2.247 8.562 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -3.385 2.563 10.332 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -4.697 3.293 11.235 1.00 0.00 H new ATOM 0 HE ARG A 41 -5.828 0.941 10.369 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -2.806 1.744 12.022 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -2.734 0.201 12.880 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -5.721 -1.034 11.475 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -4.376 -1.363 12.572 1.00 0.00 H new ATOM 606 N TYR A 42 -3.006 5.618 5.962 1.00 0.00 N ATOM 607 CA TYR A 42 -1.898 6.264 5.269 1.00 0.00 C ATOM 608 C TYR A 42 -0.570 5.914 5.932 1.00 0.00 C ATOM 609 O TYR A 42 0.367 5.463 5.273 1.00 0.00 O ATOM 610 CB TYR A 42 -2.091 7.781 5.253 1.00 0.00 C ATOM 611 CG TYR A 42 -1.084 8.512 4.392 1.00 0.00 C ATOM 612 CD1 TYR A 42 -0.675 7.991 3.171 1.00 0.00 C ATOM 613 CD2 TYR A 42 -0.544 9.725 4.801 1.00 0.00 C ATOM 614 CE1 TYR A 42 0.244 8.657 2.383 1.00 0.00 C ATOM 615 CE2 TYR A 42 0.376 10.397 4.018 1.00 0.00 C ATOM 616 CZ TYR A 42 0.766 9.858 2.809 1.00 0.00 C ATOM 617 OH TYR A 42 1.681 10.524 2.027 1.00 0.00 O ATOM 0 H TYR A 42 -3.679 6.263 6.375 1.00 0.00 H new ATOM 0 HA TYR A 42 -1.880 5.899 4.242 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -3.095 8.007 4.894 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -2.025 8.158 6.274 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -1.082 7.050 2.832 1.00 0.00 H new ATOM 0 HD2 TYR A 42 -0.848 10.150 5.746 1.00 0.00 H new ATOM 0 HE1 TYR A 42 0.552 8.237 1.437 1.00 0.00 H new ATOM 0 HE2 TYR A 42 0.787 11.339 4.351 1.00 0.00 H new ATOM 0 HH TYR A 42 2.474 9.962 1.901 1.00 0.00 H new ATOM 627 N SER A 43 -0.500 6.121 7.244 1.00 0.00 N ATOM 628 CA SER A 43 0.711 5.824 8.000 1.00 0.00 C ATOM 629 C SER A 43 1.079 4.348 7.877 1.00 0.00 C ATOM 630 O SER A 43 2.246 3.978 8.002 1.00 0.00 O ATOM 631 CB SER A 43 0.522 6.195 9.472 1.00 0.00 C ATOM 632 OG SER A 43 0.956 7.519 9.724 1.00 0.00 O ATOM 0 H SER A 43 -1.267 6.493 7.804 1.00 0.00 H new ATOM 0 HA SER A 43 1.525 6.419 7.585 1.00 0.00 H new ATOM 0 HB2 SER A 43 -0.529 6.096 9.743 1.00 0.00 H new ATOM 0 HB3 SER A 43 1.080 5.500 10.100 1.00 0.00 H new ATOM 0 HG SER A 43 0.823 7.732 10.671 1.00 0.00 H new ATOM 638 N GLU A 44 0.076 3.511 7.629 1.00 0.00 N ATOM 639 CA GLU A 44 0.296 2.076 7.487 1.00 0.00 C ATOM 640 C GLU A 44 1.171 1.782 6.274 1.00 0.00 C ATOM 641 O GLU A 44 2.084 0.957 6.339 1.00 0.00 O ATOM 642 CB GLU A 44 -1.042 1.343 7.362 1.00 0.00 C ATOM 643 CG GLU A 44 -1.443 0.591 8.620 1.00 0.00 C ATOM 644 CD GLU A 44 -0.833 -0.794 8.690 1.00 0.00 C ATOM 645 OE1 GLU A 44 0.321 -0.959 8.239 1.00 0.00 O ATOM 646 OE2 GLU A 44 -1.507 -1.716 9.195 1.00 0.00 O ATOM 0 H GLU A 44 -0.896 3.802 7.522 1.00 0.00 H new ATOM 0 HA GLU A 44 0.811 1.719 8.379 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -1.821 2.065 7.116 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -0.985 0.640 6.531 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -1.136 1.164 9.495 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -2.529 0.508 8.659 1.00 0.00 H new ATOM 653 N PHE A 45 0.890 2.463 5.168 1.00 0.00 N ATOM 654 CA PHE A 45 1.653 2.276 3.941 1.00 0.00 C ATOM 655 C PHE A 45 3.120 2.630 4.162 1.00 0.00 C ATOM 656 O PHE A 45 4.015 1.864 3.805 1.00 0.00 O ATOM 657 CB PHE A 45 1.068 3.129 2.813 1.00 0.00 C ATOM 658 CG PHE A 45 0.628 2.326 1.622 1.00 0.00 C ATOM 659 CD1 PHE A 45 -0.652 1.797 1.561 1.00 0.00 C ATOM 660 CD2 PHE A 45 1.494 2.099 0.564 1.00 0.00 C ATOM 661 CE1 PHE A 45 -1.060 1.058 0.467 1.00 0.00 C ATOM 662 CE2 PHE A 45 1.091 1.361 -0.532 1.00 0.00 C ATOM 663 CZ PHE A 45 -0.188 0.839 -0.581 1.00 0.00 C ATOM 0 H PHE A 45 0.139 3.150 5.097 1.00 0.00 H new ATOM 0 HA PHE A 45 1.589 1.226 3.655 1.00 0.00 H new ATOM 0 HB2 PHE A 45 0.217 3.691 3.197 1.00 0.00 H new ATOM 0 HB3 PHE A 45 1.814 3.858 2.495 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.338 1.964 2.378 1.00 0.00 H new ATOM 0 HD2 PHE A 45 2.495 2.504 0.597 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -2.060 0.652 0.432 1.00 0.00 H new ATOM 0 HE2 PHE A 45 1.775 1.192 -1.350 1.00 0.00 H new ATOM 0 HZ PHE A 45 -0.504 0.261 -1.437 1.00 0.00 H new ATOM 673 N TRP A 46 3.359 3.793 4.761 1.00 0.00 N ATOM 674 CA TRP A 46 4.719 4.242 5.036 1.00 0.00 C ATOM 675 C TRP A 46 5.432 3.251 5.951 1.00 0.00 C ATOM 676 O TRP A 46 6.627 2.998 5.800 1.00 0.00 O ATOM 677 CB TRP A 46 4.702 5.632 5.677 1.00 0.00 C ATOM 678 CG TRP A 46 6.053 6.103 6.124 1.00 0.00 C ATOM 679 CD1 TRP A 46 6.486 6.246 7.410 1.00 0.00 C ATOM 680 CD2 TRP A 46 7.149 6.490 5.286 1.00 0.00 C ATOM 681 NE1 TRP A 46 7.783 6.699 7.425 1.00 0.00 N ATOM 682 CE2 TRP A 46 8.213 6.857 6.133 1.00 0.00 C ATOM 683 CE3 TRP A 46 7.335 6.562 3.902 1.00 0.00 C ATOM 684 CZ2 TRP A 46 9.442 7.288 5.642 1.00 0.00 C ATOM 685 CZ3 TRP A 46 8.556 6.991 3.416 1.00 0.00 C ATOM 686 CH2 TRP A 46 9.595 7.348 4.284 1.00 0.00 C ATOM 0 H TRP A 46 2.631 4.439 5.064 1.00 0.00 H new ATOM 0 HA TRP A 46 5.261 4.298 4.092 1.00 0.00 H new ATOM 0 HB2 TRP A 46 4.295 6.348 4.962 1.00 0.00 H new ATOM 0 HB3 TRP A 46 4.029 5.619 6.534 1.00 0.00 H new ATOM 0 HD1 TRP A 46 5.895 6.034 8.289 1.00 0.00 H new ATOM 0 HE1 TRP A 46 8.336 6.887 8.261 1.00 0.00 H new ATOM 0 HE3 TRP A 46 6.539 6.288 3.225 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 10.245 7.565 6.309 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 8.711 7.052 2.349 1.00 0.00 H new ATOM 0 HH2 TRP A 46 10.537 7.678 3.873 1.00 0.00 H new ATOM 697 N LYS A 47 4.686 2.690 6.899 1.00 0.00 N ATOM 698 CA LYS A 47 5.243 1.724 7.838 1.00 0.00 C ATOM 699 C LYS A 47 5.781 0.502 7.102 1.00 0.00 C ATOM 700 O LYS A 47 6.709 -0.156 7.571 1.00 0.00 O ATOM 701 CB LYS A 47 4.182 1.299 8.854 1.00 0.00 C ATOM 702 CG LYS A 47 4.213 2.107 10.141 1.00 0.00 C ATOM 703 CD LYS A 47 2.821 2.276 10.726 1.00 0.00 C ATOM 704 CE LYS A 47 2.863 2.382 12.242 1.00 0.00 C ATOM 705 NZ LYS A 47 2.954 3.796 12.698 1.00 0.00 N ATOM 0 H LYS A 47 3.695 2.888 7.036 1.00 0.00 H new ATOM 0 HA LYS A 47 6.069 2.200 8.366 1.00 0.00 H new ATOM 0 HB2 LYS A 47 3.196 1.394 8.399 1.00 0.00 H new ATOM 0 HB3 LYS A 47 4.322 0.245 9.093 1.00 0.00 H new ATOM 0 HG2 LYS A 47 4.856 1.611 10.868 1.00 0.00 H new ATOM 0 HG3 LYS A 47 4.648 3.087 9.946 1.00 0.00 H new ATOM 0 HD2 LYS A 47 2.357 3.170 10.310 1.00 0.00 H new ATOM 0 HD3 LYS A 47 2.198 1.430 10.436 1.00 0.00 H new ATOM 0 HE2 LYS A 47 1.969 1.922 12.663 1.00 0.00 H new ATOM 0 HE3 LYS A 47 3.718 1.823 12.621 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 2.980 3.825 13.737 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 3.820 4.228 12.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 2.125 4.324 12.358 1.00 0.00 H new ATOM 719 N LEU A 48 5.192 0.203 5.948 1.00 0.00 N ATOM 720 CA LEU A 48 5.613 -0.941 5.148 1.00 0.00 C ATOM 721 C LEU A 48 6.763 -0.560 4.220 1.00 0.00 C ATOM 722 O LEU A 48 7.651 -1.368 3.951 1.00 0.00 O ATOM 723 CB LEU A 48 4.434 -1.474 4.328 1.00 0.00 C ATOM 724 CG LEU A 48 4.784 -2.564 3.312 1.00 0.00 C ATOM 725 CD1 LEU A 48 5.176 -3.851 4.020 1.00 0.00 C ATOM 726 CD2 LEU A 48 3.616 -2.806 2.368 1.00 0.00 C ATOM 0 H LEU A 48 4.422 0.738 5.546 1.00 0.00 H new ATOM 0 HA LEU A 48 5.960 -1.722 5.825 1.00 0.00 H new ATOM 0 HB2 LEU A 48 3.684 -1.867 5.014 1.00 0.00 H new ATOM 0 HB3 LEU A 48 3.975 -0.640 3.798 1.00 0.00 H new ATOM 0 HG LEU A 48 5.637 -2.225 2.724 1.00 0.00 H new ATOM 0 HD11 LEU A 48 5.421 -4.613 3.280 1.00 0.00 H new ATOM 0 HD12 LEU A 48 6.044 -3.668 4.654 1.00 0.00 H new ATOM 0 HD13 LEU A 48 4.344 -4.196 4.635 1.00 0.00 H new ATOM 0 HD21 LEU A 48 3.882 -3.584 1.652 1.00 0.00 H new ATOM 0 HD22 LEU A 48 2.745 -3.123 2.941 1.00 0.00 H new ATOM 0 HD23 LEU A 48 3.383 -1.885 1.833 1.00 0.00 H new ATOM 738 N LYS A 49 6.740 0.677 3.734 1.00 0.00 N ATOM 739 CA LYS A 49 7.778 1.169 2.833 1.00 0.00 C ATOM 740 C LYS A 49 9.167 0.990 3.441 1.00 0.00 C ATOM 741 O LYS A 49 9.944 0.143 3.001 1.00 0.00 O ATOM 742 CB LYS A 49 7.536 2.644 2.507 1.00 0.00 C ATOM 743 CG LYS A 49 7.612 2.958 1.021 1.00 0.00 C ATOM 744 CD LYS A 49 9.040 3.243 0.584 1.00 0.00 C ATOM 745 CE LYS A 49 9.488 4.630 1.017 1.00 0.00 C ATOM 746 NZ LYS A 49 10.413 5.249 0.027 1.00 0.00 N ATOM 0 H LYS A 49 6.013 1.359 3.949 1.00 0.00 H new ATOM 0 HA LYS A 49 7.732 0.585 1.914 1.00 0.00 H new ATOM 0 HB2 LYS A 49 6.554 2.934 2.882 1.00 0.00 H new ATOM 0 HB3 LYS A 49 8.271 3.250 3.036 1.00 0.00 H new ATOM 0 HG2 LYS A 49 7.216 2.118 0.450 1.00 0.00 H new ATOM 0 HG3 LYS A 49 6.983 3.820 0.798 1.00 0.00 H new ATOM 0 HD2 LYS A 49 9.708 2.494 1.009 1.00 0.00 H new ATOM 0 HD3 LYS A 49 9.114 3.157 -0.500 1.00 0.00 H new ATOM 0 HE2 LYS A 49 8.615 5.269 1.147 1.00 0.00 H new ATOM 0 HE3 LYS A 49 9.983 4.566 1.986 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 10.695 6.193 0.359 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 11.258 4.652 -0.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 9.932 5.334 -0.891 1.00 0.00 H new ATOM 760 N THR A 50 9.472 1.801 4.449 1.00 0.00 N ATOM 761 CA THR A 50 10.769 1.741 5.118 1.00 0.00 C ATOM 762 C THR A 50 11.089 0.323 5.583 1.00 0.00 C ATOM 763 O THR A 50 12.245 -0.097 5.569 1.00 0.00 O ATOM 764 CB THR A 50 10.798 2.703 6.309 1.00 0.00 C ATOM 765 OG1 THR A 50 11.856 2.377 7.193 1.00 0.00 O ATOM 766 CG2 THR A 50 9.514 2.708 7.112 1.00 0.00 C ATOM 0 H THR A 50 8.839 2.508 4.822 1.00 0.00 H new ATOM 0 HA THR A 50 11.530 2.041 4.397 1.00 0.00 H new ATOM 0 HB THR A 50 10.937 3.692 5.873 1.00 0.00 H new ATOM 0 HG1 THR A 50 11.858 3.004 7.946 1.00 0.00 H new ATOM 0 HG21 THR A 50 9.605 3.411 7.940 1.00 0.00 H new ATOM 0 HG22 THR A 50 8.685 3.008 6.471 1.00 0.00 H new ATOM 0 HG23 THR A 50 9.326 1.709 7.504 1.00 0.00 H new ATOM 774 N ARG A 51 10.060 -0.414 5.990 1.00 0.00 N ATOM 775 CA ARG A 51 10.243 -1.786 6.455 1.00 0.00 C ATOM 776 C ARG A 51 10.944 -2.628 5.392 1.00 0.00 C ATOM 777 O ARG A 51 12.054 -3.116 5.606 1.00 0.00 O ATOM 778 CB ARG A 51 8.895 -2.410 6.813 1.00 0.00 C ATOM 779 CG ARG A 51 9.004 -3.558 7.802 1.00 0.00 C ATOM 780 CD ARG A 51 9.242 -3.055 9.217 1.00 0.00 C ATOM 781 NE ARG A 51 8.013 -3.052 10.010 1.00 0.00 N ATOM 782 CZ ARG A 51 7.942 -2.612 11.264 1.00 0.00 C ATOM 783 NH1 ARG A 51 9.023 -2.139 11.871 1.00 0.00 N ATOM 784 NH2 ARG A 51 6.786 -2.646 11.912 1.00 0.00 N ATOM 0 H ARG A 51 9.094 -0.086 6.008 1.00 0.00 H new ATOM 0 HA ARG A 51 10.869 -1.763 7.347 1.00 0.00 H new ATOM 0 HB2 ARG A 51 8.247 -1.640 7.232 1.00 0.00 H new ATOM 0 HB3 ARG A 51 8.416 -2.769 5.902 1.00 0.00 H new ATOM 0 HG2 ARG A 51 8.090 -4.151 7.775 1.00 0.00 H new ATOM 0 HG3 ARG A 51 9.820 -4.217 7.507 1.00 0.00 H new ATOM 0 HD2 ARG A 51 9.987 -3.683 9.705 1.00 0.00 H new ATOM 0 HD3 ARG A 51 9.652 -2.046 9.179 1.00 0.00 H new ATOM 0 HE ARG A 51 7.161 -3.408 9.577 1.00 0.00 H new ATOM 0 HH11 ARG A 51 9.915 -2.111 11.376 1.00 0.00 H new ATOM 0 HH12 ARG A 51 8.962 -1.803 12.832 1.00 0.00 H new ATOM 0 HH21 ARG A 51 5.953 -3.009 11.449 1.00 0.00 H new ATOM 0 HH22 ARG A 51 6.730 -2.309 12.873 1.00 0.00 H new ATOM 798 N LEU A 52 10.291 -2.787 4.243 1.00 0.00 N ATOM 799 CA LEU A 52 10.848 -3.562 3.137 1.00 0.00 C ATOM 800 C LEU A 52 12.309 -3.199 2.896 1.00 0.00 C ATOM 801 O LEU A 52 13.117 -4.046 2.512 1.00 0.00 O ATOM 802 CB LEU A 52 10.044 -3.313 1.858 1.00 0.00 C ATOM 803 CG LEU A 52 8.539 -3.563 1.970 1.00 0.00 C ATOM 804 CD1 LEU A 52 7.783 -2.758 0.925 1.00 0.00 C ATOM 805 CD2 LEU A 52 8.237 -5.043 1.822 1.00 0.00 C ATOM 0 H LEU A 52 9.372 -2.388 4.053 1.00 0.00 H new ATOM 0 HA LEU A 52 10.789 -4.617 3.405 1.00 0.00 H new ATOM 0 HB2 LEU A 52 10.201 -2.281 1.545 1.00 0.00 H new ATOM 0 HB3 LEU A 52 10.443 -3.950 1.068 1.00 0.00 H new ATOM 0 HG LEU A 52 8.208 -3.238 2.957 1.00 0.00 H new ATOM 0 HD11 LEU A 52 6.714 -2.950 1.021 1.00 0.00 H new ATOM 0 HD12 LEU A 52 7.976 -1.696 1.074 1.00 0.00 H new ATOM 0 HD13 LEU A 52 8.116 -3.051 -0.071 1.00 0.00 H new ATOM 0 HD21 LEU A 52 7.162 -5.205 1.904 1.00 0.00 H new ATOM 0 HD22 LEU A 52 8.583 -5.389 0.848 1.00 0.00 H new ATOM 0 HD23 LEU A 52 8.749 -5.599 2.608 1.00 0.00 H new ATOM 817 N GLU A 53 12.641 -1.931 3.122 1.00 0.00 N ATOM 818 CA GLU A 53 14.005 -1.452 2.926 1.00 0.00 C ATOM 819 C GLU A 53 14.948 -2.030 3.977 1.00 0.00 C ATOM 820 O GLU A 53 16.097 -2.358 3.680 1.00 0.00 O ATOM 821 CB GLU A 53 14.045 0.077 2.976 1.00 0.00 C ATOM 822 CG GLU A 53 13.222 0.743 1.885 1.00 0.00 C ATOM 823 CD GLU A 53 13.304 2.256 1.935 1.00 0.00 C ATOM 824 OE1 GLU A 53 13.218 2.819 3.047 1.00 0.00 O ATOM 825 OE2 GLU A 53 13.455 2.878 0.862 1.00 0.00 O ATOM 0 H GLU A 53 11.985 -1.218 3.441 1.00 0.00 H new ATOM 0 HA GLU A 53 14.339 -1.787 1.944 1.00 0.00 H new ATOM 0 HB2 GLU A 53 13.682 0.410 3.948 1.00 0.00 H new ATOM 0 HB3 GLU A 53 15.080 0.408 2.892 1.00 0.00 H new ATOM 0 HG2 GLU A 53 13.568 0.396 0.911 1.00 0.00 H new ATOM 0 HG3 GLU A 53 12.181 0.436 1.982 1.00 0.00 H new ATOM 832 N ARG A 54 14.457 -2.153 5.205 1.00 0.00 N ATOM 833 CA ARG A 54 15.259 -2.691 6.300 1.00 0.00 C ATOM 834 C ARG A 54 15.137 -4.211 6.376 1.00 0.00 C ATOM 835 O ARG A 54 16.010 -4.886 6.921 1.00 0.00 O ATOM 836 CB ARG A 54 14.832 -2.066 7.628 1.00 0.00 C ATOM 837 CG ARG A 54 14.777 -0.548 7.594 1.00 0.00 C ATOM 838 CD ARG A 54 14.728 0.043 8.995 1.00 0.00 C ATOM 839 NE ARG A 54 13.477 0.757 9.243 1.00 0.00 N ATOM 840 CZ ARG A 54 12.338 0.161 9.592 1.00 0.00 C ATOM 841 NH1 ARG A 54 12.287 -1.158 9.735 1.00 0.00 N ATOM 842 NH2 ARG A 54 11.248 0.886 9.797 1.00 0.00 N ATOM 0 H ARG A 54 13.508 -1.888 5.468 1.00 0.00 H new ATOM 0 HA ARG A 54 16.302 -2.441 6.106 1.00 0.00 H new ATOM 0 HB2 ARG A 54 13.850 -2.451 7.902 1.00 0.00 H new ATOM 0 HB3 ARG A 54 15.526 -2.379 8.408 1.00 0.00 H new ATOM 0 HG2 ARG A 54 15.650 -0.164 7.067 1.00 0.00 H new ATOM 0 HG3 ARG A 54 13.899 -0.228 7.033 1.00 0.00 H new ATOM 0 HD2 ARG A 54 14.842 -0.754 9.729 1.00 0.00 H new ATOM 0 HD3 ARG A 54 15.568 0.724 9.131 1.00 0.00 H new ATOM 0 HE ARG A 54 13.476 1.772 9.143 1.00 0.00 H new ATOM 0 HH11 ARG A 54 13.123 -1.721 9.577 1.00 0.00 H new ATOM 0 HH12 ARG A 54 11.412 -1.609 10.002 1.00 0.00 H new ATOM 0 HH21 ARG A 54 11.282 1.900 9.688 1.00 0.00 H new ATOM 0 HH22 ARG A 54 10.375 0.431 10.064 1.00 0.00 H new ATOM 856 N ASP A 55 14.050 -4.744 5.828 1.00 0.00 N ATOM 857 CA ASP A 55 13.816 -6.182 5.836 1.00 0.00 C ATOM 858 C ASP A 55 14.446 -6.838 4.614 1.00 0.00 C ATOM 859 O ASP A 55 15.022 -7.923 4.705 1.00 0.00 O ATOM 860 CB ASP A 55 12.316 -6.477 5.875 1.00 0.00 C ATOM 861 CG ASP A 55 11.970 -7.596 6.839 1.00 0.00 C ATOM 862 OD1 ASP A 55 11.921 -7.334 8.059 1.00 0.00 O ATOM 863 OD2 ASP A 55 11.748 -8.733 6.373 1.00 0.00 O ATOM 0 H ASP A 55 13.317 -4.200 5.372 1.00 0.00 H new ATOM 0 HA ASP A 55 14.281 -6.597 6.730 1.00 0.00 H new ATOM 0 HB2 ASP A 55 11.779 -5.574 6.164 1.00 0.00 H new ATOM 0 HB3 ASP A 55 11.975 -6.745 4.875 1.00 0.00 H new ATOM 868 N VAL A 56 14.336 -6.171 3.472 1.00 0.00 N ATOM 869 CA VAL A 56 14.896 -6.683 2.229 1.00 0.00 C ATOM 870 C VAL A 56 16.341 -6.235 2.058 1.00 0.00 C ATOM 871 O VAL A 56 17.158 -6.945 1.471 1.00 0.00 O ATOM 872 CB VAL A 56 14.080 -6.211 1.012 1.00 0.00 C ATOM 873 CG1 VAL A 56 14.564 -6.900 -0.254 1.00 0.00 C ATOM 874 CG2 VAL A 56 12.597 -6.462 1.234 1.00 0.00 C ATOM 0 H VAL A 56 13.863 -5.272 3.382 1.00 0.00 H new ATOM 0 HA VAL A 56 14.857 -7.771 2.285 1.00 0.00 H new ATOM 0 HB VAL A 56 14.227 -5.138 0.891 1.00 0.00 H new ATOM 0 HG11 VAL A 56 13.976 -6.554 -1.104 1.00 0.00 H new ATOM 0 HG12 VAL A 56 15.615 -6.662 -0.419 1.00 0.00 H new ATOM 0 HG13 VAL A 56 14.449 -7.979 -0.148 1.00 0.00 H new ATOM 0 HG21 VAL A 56 12.036 -6.122 0.363 1.00 0.00 H new ATOM 0 HG22 VAL A 56 12.427 -7.528 1.382 1.00 0.00 H new ATOM 0 HG23 VAL A 56 12.264 -5.916 2.116 1.00 0.00 H new ATOM 884 N GLY A 57 16.649 -5.051 2.574 1.00 0.00 N ATOM 885 CA GLY A 57 17.995 -4.522 2.467 1.00 0.00 C ATOM 886 C GLY A 57 18.286 -3.948 1.094 1.00 0.00 C ATOM 887 O GLY A 57 19.445 -3.804 0.708 1.00 0.00 O ATOM 0 H GLY A 57 15.990 -4.447 3.065 1.00 0.00 H new ATOM 0 HA2 GLY A 57 18.138 -3.746 3.219 1.00 0.00 H new ATOM 0 HA3 GLY A 57 18.712 -5.314 2.686 1.00 0.00 H new ATOM 891 N SER A 58 17.231 -3.619 0.354 1.00 0.00 N ATOM 892 CA SER A 58 17.380 -3.059 -0.983 1.00 0.00 C ATOM 893 C SER A 58 16.659 -1.720 -1.094 1.00 0.00 C ATOM 894 O SER A 58 15.836 -1.374 -0.246 1.00 0.00 O ATOM 895 CB SER A 58 16.839 -4.032 -2.031 1.00 0.00 C ATOM 896 OG SER A 58 17.433 -3.804 -3.296 1.00 0.00 O ATOM 0 H SER A 58 16.264 -3.731 0.659 1.00 0.00 H new ATOM 0 HA SER A 58 18.442 -2.896 -1.165 1.00 0.00 H new ATOM 0 HB2 SER A 58 17.033 -5.057 -1.714 1.00 0.00 H new ATOM 0 HB3 SER A 58 15.757 -3.922 -2.109 1.00 0.00 H new ATOM 0 HG SER A 58 17.071 -4.441 -3.947 1.00 0.00 H new ATOM 902 N THR A 59 16.972 -0.970 -2.146 1.00 0.00 N ATOM 903 CA THR A 59 16.352 0.331 -2.368 1.00 0.00 C ATOM 904 C THR A 59 15.027 0.180 -3.109 1.00 0.00 C ATOM 905 O THR A 59 14.969 -0.423 -4.180 1.00 0.00 O ATOM 906 CB THR A 59 17.293 1.244 -3.158 1.00 0.00 C ATOM 907 OG1 THR A 59 18.344 0.496 -3.744 1.00 0.00 O ATOM 908 CG2 THR A 59 17.920 2.330 -2.311 1.00 0.00 C ATOM 0 H THR A 59 17.651 -1.241 -2.857 1.00 0.00 H new ATOM 0 HA THR A 59 16.156 0.783 -1.396 1.00 0.00 H new ATOM 0 HB THR A 59 16.670 1.712 -3.920 1.00 0.00 H new ATOM 0 HG1 THR A 59 18.933 1.097 -4.246 1.00 0.00 H new ATOM 0 HG21 THR A 59 18.576 2.942 -2.931 1.00 0.00 H new ATOM 0 HG22 THR A 59 17.137 2.956 -1.883 1.00 0.00 H new ATOM 0 HG23 THR A 59 18.500 1.876 -1.508 1.00 0.00 H new ATOM 916 N ILE A 60 13.965 0.731 -2.530 1.00 0.00 N ATOM 917 CA ILE A 60 12.642 0.656 -3.136 1.00 0.00 C ATOM 918 C ILE A 60 12.462 1.745 -4.196 1.00 0.00 C ATOM 919 O ILE A 60 12.807 2.903 -3.964 1.00 0.00 O ATOM 920 CB ILE A 60 11.532 0.788 -2.071 1.00 0.00 C ATOM 921 CG1 ILE A 60 10.169 0.453 -2.678 1.00 0.00 C ATOM 922 CG2 ILE A 60 11.522 2.186 -1.468 1.00 0.00 C ATOM 923 CD1 ILE A 60 9.767 -0.995 -2.496 1.00 0.00 C ATOM 0 H ILE A 60 13.995 1.234 -1.643 1.00 0.00 H new ATOM 0 HA ILE A 60 12.560 -0.321 -3.612 1.00 0.00 H new ATOM 0 HB ILE A 60 11.739 0.077 -1.271 1.00 0.00 H new ATOM 0 HG12 ILE A 60 9.411 1.092 -2.225 1.00 0.00 H new ATOM 0 HG13 ILE A 60 10.187 0.686 -3.743 1.00 0.00 H new ATOM 0 HG21 ILE A 60 10.732 2.254 -0.721 1.00 0.00 H new ATOM 0 HG22 ILE A 60 12.485 2.386 -0.997 1.00 0.00 H new ATOM 0 HG23 ILE A 60 11.343 2.920 -2.254 1.00 0.00 H new ATOM 0 HD11 ILE A 60 8.790 -1.161 -2.951 1.00 0.00 H new ATOM 0 HD12 ILE A 60 10.504 -1.640 -2.974 1.00 0.00 H new ATOM 0 HD13 ILE A 60 9.716 -1.228 -1.432 1.00 0.00 H new ATOM 935 N PRO A 61 11.923 1.392 -5.382 1.00 0.00 N ATOM 936 CA PRO A 61 11.710 2.344 -6.468 1.00 0.00 C ATOM 937 C PRO A 61 10.382 3.091 -6.352 1.00 0.00 C ATOM 938 O PRO A 61 9.817 3.520 -7.358 1.00 0.00 O ATOM 939 CB PRO A 61 11.714 1.462 -7.728 1.00 0.00 C ATOM 940 CG PRO A 61 11.732 0.037 -7.257 1.00 0.00 C ATOM 941 CD PRO A 61 11.487 0.050 -5.771 1.00 0.00 C ATOM 0 HA PRO A 61 12.472 3.123 -6.469 1.00 0.00 H new ATOM 0 HB2 PRO A 61 10.833 1.656 -8.339 1.00 0.00 H new ATOM 0 HB3 PRO A 61 12.585 1.676 -8.347 1.00 0.00 H new ATOM 0 HG2 PRO A 61 10.965 -0.545 -7.767 1.00 0.00 H new ATOM 0 HG3 PRO A 61 12.690 -0.430 -7.484 1.00 0.00 H new ATOM 0 HD2 PRO A 61 10.437 -0.119 -5.533 1.00 0.00 H new ATOM 0 HD3 PRO A 61 12.058 -0.725 -5.260 1.00 0.00 H new ATOM 949 N TYR A 62 9.888 3.247 -5.128 1.00 0.00 N ATOM 950 CA TYR A 62 8.629 3.945 -4.900 1.00 0.00 C ATOM 951 C TYR A 62 8.864 5.281 -4.204 1.00 0.00 C ATOM 952 O TYR A 62 9.748 5.404 -3.355 1.00 0.00 O ATOM 953 CB TYR A 62 7.685 3.079 -4.065 1.00 0.00 C ATOM 954 CG TYR A 62 7.230 1.827 -4.780 1.00 0.00 C ATOM 955 CD1 TYR A 62 6.697 1.892 -6.061 1.00 0.00 C ATOM 956 CD2 TYR A 62 7.337 0.582 -4.176 1.00 0.00 C ATOM 957 CE1 TYR A 62 6.282 0.750 -6.720 1.00 0.00 C ATOM 958 CE2 TYR A 62 6.926 -0.565 -4.828 1.00 0.00 C ATOM 959 CZ TYR A 62 6.398 -0.476 -6.098 1.00 0.00 C ATOM 960 OH TYR A 62 5.987 -1.616 -6.749 1.00 0.00 O ATOM 0 H TYR A 62 10.339 2.900 -4.281 1.00 0.00 H new ATOM 0 HA TYR A 62 8.170 4.139 -5.869 1.00 0.00 H new ATOM 0 HB2 TYR A 62 8.186 2.798 -3.138 1.00 0.00 H new ATOM 0 HB3 TYR A 62 6.811 3.669 -3.789 1.00 0.00 H new ATOM 0 HD1 TYR A 62 6.605 2.851 -6.550 1.00 0.00 H new ATOM 0 HD2 TYR A 62 7.748 0.508 -3.180 1.00 0.00 H new ATOM 0 HE1 TYR A 62 5.869 0.817 -7.716 1.00 0.00 H new ATOM 0 HE2 TYR A 62 7.018 -1.526 -4.345 1.00 0.00 H new ATOM 0 HH TYR A 62 5.070 -1.833 -6.481 1.00 0.00 H new ATOM 970 N ASP A 63 8.070 6.280 -4.572 1.00 0.00 N ATOM 971 CA ASP A 63 8.192 7.611 -3.987 1.00 0.00 C ATOM 972 C ASP A 63 7.102 7.853 -2.947 1.00 0.00 C ATOM 973 O ASP A 63 5.912 7.781 -3.253 1.00 0.00 O ATOM 974 CB ASP A 63 8.114 8.678 -5.080 1.00 0.00 C ATOM 975 CG ASP A 63 6.848 8.565 -5.909 1.00 0.00 C ATOM 976 OD1 ASP A 63 6.571 7.459 -6.419 1.00 0.00 O ATOM 977 OD2 ASP A 63 6.136 9.581 -6.047 1.00 0.00 O ATOM 0 H ASP A 63 7.334 6.194 -5.273 1.00 0.00 H new ATOM 0 HA ASP A 63 9.161 7.675 -3.492 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.159 9.667 -4.623 1.00 0.00 H new ATOM 0 HB3 ASP A 63 8.982 8.589 -5.733 1.00 0.00 H new ATOM 982 N PHE A 64 7.517 8.140 -1.718 1.00 0.00 N ATOM 983 CA PHE A 64 6.574 8.394 -0.635 1.00 0.00 C ATOM 984 C PHE A 64 6.982 9.632 0.162 1.00 0.00 C ATOM 985 O PHE A 64 7.820 9.553 1.060 1.00 0.00 O ATOM 986 CB PHE A 64 6.494 7.182 0.295 1.00 0.00 C ATOM 987 CG PHE A 64 5.138 6.992 0.913 1.00 0.00 C ATOM 988 CD1 PHE A 64 4.672 7.873 1.875 1.00 0.00 C ATOM 989 CD2 PHE A 64 4.330 5.933 0.529 1.00 0.00 C ATOM 990 CE1 PHE A 64 3.424 7.703 2.444 1.00 0.00 C ATOM 991 CE2 PHE A 64 3.081 5.758 1.094 1.00 0.00 C ATOM 992 CZ PHE A 64 2.628 6.644 2.053 1.00 0.00 C ATOM 0 H PHE A 64 8.498 8.203 -1.447 1.00 0.00 H new ATOM 0 HA PHE A 64 5.593 8.572 -1.076 1.00 0.00 H new ATOM 0 HB2 PHE A 64 6.758 6.285 -0.266 1.00 0.00 H new ATOM 0 HB3 PHE A 64 7.234 7.292 1.088 1.00 0.00 H new ATOM 0 HD1 PHE A 64 5.291 8.702 2.184 1.00 0.00 H new ATOM 0 HD2 PHE A 64 4.680 5.238 -0.219 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.072 8.397 3.193 1.00 0.00 H new ATOM 0 HE2 PHE A 64 2.460 4.930 0.786 1.00 0.00 H new ATOM 0 HZ PHE A 64 1.653 6.509 2.496 1.00 0.00 H new ATOM 1002 N PRO A 65 6.392 10.799 -0.157 1.00 0.00 N ATOM 1003 CA PRO A 65 6.702 12.053 0.535 1.00 0.00 C ATOM 1004 C PRO A 65 6.117 12.099 1.943 1.00 0.00 C ATOM 1005 O PRO A 65 4.899 12.097 2.121 1.00 0.00 O ATOM 1006 CB PRO A 65 6.044 13.113 -0.350 1.00 0.00 C ATOM 1007 CG PRO A 65 4.916 12.402 -1.011 1.00 0.00 C ATOM 1008 CD PRO A 65 5.381 10.987 -1.217 1.00 0.00 C ATOM 0 HA PRO A 65 7.775 12.192 0.669 1.00 0.00 H new ATOM 0 HB2 PRO A 65 5.689 13.958 0.240 1.00 0.00 H new ATOM 0 HB3 PRO A 65 6.747 13.509 -1.083 1.00 0.00 H new ATOM 0 HG2 PRO A 65 4.020 12.432 -0.392 1.00 0.00 H new ATOM 0 HG3 PRO A 65 4.662 12.872 -1.961 1.00 0.00 H new ATOM 0 HD2 PRO A 65 4.560 10.276 -1.119 1.00 0.00 H new ATOM 0 HD3 PRO A 65 5.809 10.845 -2.209 1.00 0.00 H new ATOM 1016 N GLU A 66 6.994 12.143 2.941 1.00 0.00 N ATOM 1017 CA GLU A 66 6.565 12.192 4.333 1.00 0.00 C ATOM 1018 C GLU A 66 7.123 13.428 5.030 1.00 0.00 C ATOM 1019 O GLU A 66 8.057 14.061 4.537 1.00 0.00 O ATOM 1020 CB GLU A 66 7.010 10.927 5.072 1.00 0.00 C ATOM 1021 CG GLU A 66 5.935 9.856 5.139 1.00 0.00 C ATOM 1022 CD GLU A 66 5.454 9.596 6.554 1.00 0.00 C ATOM 1023 OE1 GLU A 66 5.624 10.488 7.411 1.00 0.00 O ATOM 1024 OE2 GLU A 66 4.908 8.502 6.804 1.00 0.00 O ATOM 0 H GLU A 66 8.006 12.146 2.811 1.00 0.00 H new ATOM 0 HA GLU A 66 5.477 12.248 4.351 1.00 0.00 H new ATOM 0 HB2 GLU A 66 7.890 10.517 4.577 1.00 0.00 H new ATOM 0 HB3 GLU A 66 7.310 11.194 6.085 1.00 0.00 H new ATOM 0 HG2 GLU A 66 5.089 10.158 4.522 1.00 0.00 H new ATOM 0 HG3 GLU A 66 6.324 8.930 4.716 1.00 0.00 H new ATOM 1031 N LYS A 67 6.545 13.766 6.177 1.00 0.00 N ATOM 1032 CA LYS A 67 6.984 14.928 6.940 1.00 0.00 C ATOM 1033 C LYS A 67 7.129 14.585 8.423 1.00 0.00 C ATOM 1034 O LYS A 67 6.208 14.040 9.032 1.00 0.00 O ATOM 1035 CB LYS A 67 5.992 16.080 6.768 1.00 0.00 C ATOM 1036 CG LYS A 67 4.553 15.692 7.064 1.00 0.00 C ATOM 1037 CD LYS A 67 3.584 16.371 6.109 1.00 0.00 C ATOM 1038 CE LYS A 67 3.789 15.896 4.679 1.00 0.00 C ATOM 1039 NZ LYS A 67 2.634 16.249 3.807 1.00 0.00 N ATOM 0 H LYS A 67 5.772 13.252 6.599 1.00 0.00 H new ATOM 0 HA LYS A 67 7.958 15.234 6.559 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.281 16.899 7.426 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.056 16.454 5.746 1.00 0.00 H new ATOM 0 HG2 LYS A 67 4.444 14.610 6.987 1.00 0.00 H new ATOM 0 HG3 LYS A 67 4.305 15.965 8.090 1.00 0.00 H new ATOM 0 HD2 LYS A 67 2.560 16.164 6.419 1.00 0.00 H new ATOM 0 HD3 LYS A 67 3.720 17.451 6.158 1.00 0.00 H new ATOM 0 HE2 LYS A 67 4.698 16.341 4.275 1.00 0.00 H new ATOM 0 HE3 LYS A 67 3.933 14.816 4.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 2.812 15.908 2.841 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 1.770 15.804 4.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 2.512 17.282 3.793 1.00 0.00 H new ATOM 1053 N PRO A 68 8.290 14.900 9.028 1.00 0.00 N ATOM 1054 CA PRO A 68 8.539 14.619 10.446 1.00 0.00 C ATOM 1055 C PRO A 68 7.455 15.195 11.350 1.00 0.00 C ATOM 1056 O PRO A 68 6.824 16.199 11.017 1.00 0.00 O ATOM 1057 CB PRO A 68 9.880 15.306 10.719 1.00 0.00 C ATOM 1058 CG PRO A 68 10.547 15.380 9.391 1.00 0.00 C ATOM 1059 CD PRO A 68 9.446 15.551 8.383 1.00 0.00 C ATOM 0 HA PRO A 68 8.544 13.549 10.651 1.00 0.00 H new ATOM 0 HB2 PRO A 68 9.736 16.299 11.145 1.00 0.00 H new ATOM 0 HB3 PRO A 68 10.478 14.737 11.431 1.00 0.00 H new ATOM 0 HG2 PRO A 68 11.245 16.216 9.351 1.00 0.00 H new ATOM 0 HG3 PRO A 68 11.121 14.475 9.192 1.00 0.00 H new ATOM 0 HD2 PRO A 68 9.251 16.603 8.175 1.00 0.00 H new ATOM 0 HD3 PRO A 68 9.694 15.079 7.432 1.00 0.00 H new ATOM 1067 N GLY A 69 7.244 14.555 12.496 1.00 0.00 N ATOM 1068 CA GLY A 69 6.236 15.020 13.430 1.00 0.00 C ATOM 1069 C GLY A 69 6.841 15.713 14.634 1.00 0.00 C ATOM 1070 O GLY A 69 6.685 15.255 15.767 1.00 0.00 O ATOM 0 H GLY A 69 7.753 13.723 12.794 1.00 0.00 H new ATOM 0 HA2 GLY A 69 5.561 15.707 12.920 1.00 0.00 H new ATOM 0 HA3 GLY A 69 5.636 14.174 13.765 1.00 0.00 H new ATOM 1074 N VAL A 70 7.535 16.819 14.390 1.00 0.00 N ATOM 1075 CA VAL A 70 8.169 17.577 15.462 1.00 0.00 C ATOM 1076 C VAL A 70 7.263 18.708 15.946 1.00 0.00 C ATOM 1077 O VAL A 70 6.611 18.591 16.984 1.00 0.00 O ATOM 1078 CB VAL A 70 9.526 18.158 15.010 1.00 0.00 C ATOM 1079 CG1 VAL A 70 10.143 19.013 16.108 1.00 0.00 C ATOM 1080 CG2 VAL A 70 10.473 17.039 14.604 1.00 0.00 C ATOM 0 H VAL A 70 7.673 17.211 13.458 1.00 0.00 H new ATOM 0 HA VAL A 70 8.342 16.885 16.287 1.00 0.00 H new ATOM 0 HB VAL A 70 9.353 18.796 14.143 1.00 0.00 H new ATOM 0 HG11 VAL A 70 11.098 19.411 15.766 1.00 0.00 H new ATOM 0 HG12 VAL A 70 9.471 19.837 16.348 1.00 0.00 H new ATOM 0 HG13 VAL A 70 10.302 18.404 16.998 1.00 0.00 H new ATOM 0 HG21 VAL A 70 11.425 17.465 14.288 1.00 0.00 H new ATOM 0 HG22 VAL A 70 10.636 16.375 15.453 1.00 0.00 H new ATOM 0 HG23 VAL A 70 10.037 16.474 13.780 1.00 0.00 H new ATOM 1090 N LEU A 71 7.229 19.802 15.192 1.00 0.00 N ATOM 1091 CA LEU A 71 6.404 20.950 15.550 1.00 0.00 C ATOM 1092 C LEU A 71 5.735 21.549 14.314 1.00 0.00 C ATOM 1093 O LEU A 71 5.996 22.694 13.944 1.00 0.00 O ATOM 1094 CB LEU A 71 7.255 22.010 16.256 1.00 0.00 C ATOM 1095 CG LEU A 71 6.582 22.690 17.450 1.00 0.00 C ATOM 1096 CD1 LEU A 71 5.418 23.552 16.987 1.00 0.00 C ATOM 1097 CD2 LEU A 71 6.112 21.653 18.458 1.00 0.00 C ATOM 0 H LEU A 71 7.762 19.918 14.330 1.00 0.00 H new ATOM 0 HA LEU A 71 5.622 20.610 16.229 1.00 0.00 H new ATOM 0 HB2 LEU A 71 8.180 21.544 16.596 1.00 0.00 H new ATOM 0 HB3 LEU A 71 7.532 22.775 15.530 1.00 0.00 H new ATOM 0 HG LEU A 71 7.314 23.335 17.936 1.00 0.00 H new ATOM 0 HD11 LEU A 71 4.952 24.028 17.850 1.00 0.00 H new ATOM 0 HD12 LEU A 71 5.782 24.319 16.303 1.00 0.00 H new ATOM 0 HD13 LEU A 71 4.684 22.929 16.476 1.00 0.00 H new ATOM 0 HD21 LEU A 71 5.636 22.154 19.301 1.00 0.00 H new ATOM 0 HD22 LEU A 71 5.396 20.982 17.983 1.00 0.00 H new ATOM 0 HD23 LEU A 71 6.967 21.078 18.814 1.00 0.00 H new ATOM 1109 N ASP A 72 4.868 20.765 13.680 1.00 0.00 N ATOM 1110 CA ASP A 72 4.161 21.217 12.486 1.00 0.00 C ATOM 1111 C ASP A 72 3.163 22.318 12.829 1.00 0.00 C ATOM 1112 O ASP A 72 2.417 22.213 13.803 1.00 0.00 O ATOM 1113 CB ASP A 72 3.438 20.043 11.824 1.00 0.00 C ATOM 1114 CG ASP A 72 2.353 19.455 12.707 1.00 0.00 C ATOM 1115 OD1 ASP A 72 1.318 20.126 12.901 1.00 0.00 O ATOM 1116 OD2 ASP A 72 2.541 18.325 13.204 1.00 0.00 O ATOM 0 H ASP A 72 4.638 19.815 13.972 1.00 0.00 H new ATOM 0 HA ASP A 72 4.895 21.623 11.789 1.00 0.00 H new ATOM 0 HB2 ASP A 72 2.997 20.376 10.885 1.00 0.00 H new ATOM 0 HB3 ASP A 72 4.162 19.266 11.578 1.00 0.00 H new ATOM 1121 N ARG A 73 3.151 23.374 12.020 1.00 0.00 N ATOM 1122 CA ARG A 73 2.243 24.494 12.239 1.00 0.00 C ATOM 1123 C ARG A 73 2.014 25.276 10.949 1.00 0.00 C ATOM 1124 O ARG A 73 0.886 25.647 10.628 1.00 0.00 O ATOM 1125 CB ARG A 73 2.796 25.424 13.322 1.00 0.00 C ATOM 1126 CG ARG A 73 2.955 24.751 14.675 1.00 0.00 C ATOM 1127 CD ARG A 73 3.107 25.772 15.792 1.00 0.00 C ATOM 1128 NE ARG A 73 1.861 25.960 16.533 1.00 0.00 N ATOM 1129 CZ ARG A 73 1.801 26.245 17.834 1.00 0.00 C ATOM 1130 NH1 ARG A 73 2.913 26.389 18.545 1.00 0.00 N ATOM 1131 NH2 ARG A 73 0.623 26.391 18.423 1.00 0.00 N ATOM 0 H ARG A 73 3.759 23.477 11.208 1.00 0.00 H new ATOM 0 HA ARG A 73 1.286 24.090 12.570 1.00 0.00 H new ATOM 0 HB2 ARG A 73 3.764 25.808 13.000 1.00 0.00 H new ATOM 0 HB3 ARG A 73 2.132 26.282 13.427 1.00 0.00 H new ATOM 0 HG2 ARG A 73 2.088 24.120 14.873 1.00 0.00 H new ATOM 0 HG3 ARG A 73 3.827 24.097 14.657 1.00 0.00 H new ATOM 0 HD2 ARG A 73 3.891 25.447 16.476 1.00 0.00 H new ATOM 0 HD3 ARG A 73 3.426 26.725 15.371 1.00 0.00 H new ATOM 0 HE ARG A 73 0.983 25.867 16.023 1.00 0.00 H new ATOM 0 HH11 ARG A 73 3.823 26.282 18.096 1.00 0.00 H new ATOM 0 HH12 ARG A 73 2.858 26.607 19.540 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -0.235 26.285 17.881 1.00 0.00 H new ATOM 0 HH22 ARG A 73 0.574 26.609 19.418 1.00 0.00 H new ATOM 1145 N ARG A 74 3.094 25.525 10.218 1.00 0.00 N ATOM 1146 CA ARG A 74 3.013 26.266 8.964 1.00 0.00 C ATOM 1147 C ARG A 74 2.505 25.378 7.832 1.00 0.00 C ATOM 1148 O ARG A 74 1.805 25.844 6.933 1.00 0.00 O ATOM 1149 CB ARG A 74 4.381 26.845 8.599 1.00 0.00 C ATOM 1150 CG ARG A 74 5.515 25.836 8.686 1.00 0.00 C ATOM 1151 CD ARG A 74 6.519 26.024 7.559 1.00 0.00 C ATOM 1152 NE ARG A 74 7.713 26.741 8.003 1.00 0.00 N ATOM 1153 CZ ARG A 74 7.802 28.068 8.066 1.00 0.00 C ATOM 1154 NH1 ARG A 74 6.773 28.829 7.715 1.00 0.00 N ATOM 1155 NH2 ARG A 74 8.926 28.636 8.482 1.00 0.00 N ATOM 0 H ARG A 74 4.036 25.225 10.471 1.00 0.00 H new ATOM 0 HA ARG A 74 2.305 27.083 9.103 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.338 27.244 7.585 1.00 0.00 H new ATOM 0 HB3 ARG A 74 4.600 27.682 9.262 1.00 0.00 H new ATOM 0 HG2 ARG A 74 6.021 25.938 9.646 1.00 0.00 H new ATOM 0 HG3 ARG A 74 5.108 24.826 8.647 1.00 0.00 H new ATOM 0 HD2 ARG A 74 6.807 25.050 7.164 1.00 0.00 H new ATOM 0 HD3 ARG A 74 6.049 26.573 6.743 1.00 0.00 H new ATOM 0 HE ARG A 74 8.526 26.192 8.281 1.00 0.00 H new ATOM 0 HH11 ARG A 74 5.906 28.398 7.394 1.00 0.00 H new ATOM 0 HH12 ARG A 74 6.849 29.845 7.766 1.00 0.00 H new ATOM 0 HH21 ARG A 74 9.720 28.056 8.753 1.00 0.00 H new ATOM 0 HH22 ARG A 74 8.996 29.652 8.531 1.00 0.00 H new ATOM 1169 N TRP A 75 2.861 24.098 7.879 1.00 0.00 N ATOM 1170 CA TRP A 75 2.439 23.150 6.853 1.00 0.00 C ATOM 1171 C TRP A 75 1.426 22.155 7.408 1.00 0.00 C ATOM 1172 O TRP A 75 1.419 20.985 7.027 1.00 0.00 O ATOM 1173 CB TRP A 75 3.648 22.406 6.281 1.00 0.00 C ATOM 1174 CG TRP A 75 4.514 21.764 7.325 1.00 0.00 C ATOM 1175 CD1 TRP A 75 4.158 21.429 8.600 1.00 0.00 C ATOM 1176 CD2 TRP A 75 5.886 21.379 7.178 1.00 0.00 C ATOM 1177 NE1 TRP A 75 5.224 20.860 9.254 1.00 0.00 N ATOM 1178 CE2 TRP A 75 6.297 20.819 8.403 1.00 0.00 C ATOM 1179 CE3 TRP A 75 6.808 21.454 6.130 1.00 0.00 C ATOM 1180 CZ2 TRP A 75 7.587 20.337 8.606 1.00 0.00 C ATOM 1181 CZ3 TRP A 75 8.089 20.975 6.334 1.00 0.00 C ATOM 1182 CH2 TRP A 75 8.468 20.423 7.563 1.00 0.00 C ATOM 0 H TRP A 75 3.440 23.694 8.615 1.00 0.00 H new ATOM 0 HA TRP A 75 1.960 23.715 6.053 1.00 0.00 H new ATOM 0 HB2 TRP A 75 3.297 21.638 5.591 1.00 0.00 H new ATOM 0 HB3 TRP A 75 4.251 23.104 5.701 1.00 0.00 H new ATOM 0 HD1 TRP A 75 3.181 21.588 9.032 1.00 0.00 H new ATOM 0 HE1 TRP A 75 5.218 20.523 10.217 1.00 0.00 H new ATOM 0 HE3 TRP A 75 6.525 21.878 5.178 1.00 0.00 H new ATOM 0 HZ2 TRP A 75 7.882 19.910 9.553 1.00 0.00 H new ATOM 0 HZ3 TRP A 75 8.809 21.028 5.531 1.00 0.00 H new ATOM 0 HH2 TRP A 75 9.476 20.058 7.691 1.00 0.00 H new ATOM 1193 N GLN A 76 0.572 22.627 8.311 1.00 0.00 N ATOM 1194 CA GLN A 76 -0.446 21.776 8.916 1.00 0.00 C ATOM 1195 C GLN A 76 -1.462 21.322 7.872 1.00 0.00 C ATOM 1196 O GLN A 76 -1.570 21.914 6.798 1.00 0.00 O ATOM 1197 CB GLN A 76 -1.154 22.521 10.051 1.00 0.00 C ATOM 1198 CG GLN A 76 -0.923 21.902 11.420 1.00 0.00 C ATOM 1199 CD GLN A 76 -1.599 22.678 12.533 1.00 0.00 C ATOM 1200 OE1 GLN A 76 -1.105 23.719 12.968 1.00 0.00 O ATOM 1201 NE2 GLN A 76 -2.736 22.176 13.000 1.00 0.00 N ATOM 0 H GLN A 76 0.565 23.593 8.639 1.00 0.00 H new ATOM 0 HA GLN A 76 0.046 20.893 9.325 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -0.810 23.555 10.066 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -2.225 22.544 9.847 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -1.295 20.877 11.419 1.00 0.00 H new ATOM 0 HG3 GLN A 76 0.148 21.852 11.616 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -3.109 21.311 12.610 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -3.236 22.656 13.748 1.00 0.00 H new ATOM 1210 N ARG A 77 -2.204 20.268 8.193 1.00 0.00 N ATOM 1211 CA ARG A 77 -3.209 19.736 7.282 1.00 0.00 C ATOM 1212 C ARG A 77 -4.247 18.910 8.036 1.00 0.00 C ATOM 1213 O ARG A 77 -3.923 18.226 9.007 1.00 0.00 O ATOM 1214 CB ARG A 77 -2.546 18.879 6.203 1.00 0.00 C ATOM 1215 CG ARG A 77 -1.806 17.670 6.755 1.00 0.00 C ATOM 1216 CD ARG A 77 -1.938 16.466 5.836 1.00 0.00 C ATOM 1217 NE ARG A 77 -0.693 15.705 5.749 1.00 0.00 N ATOM 1218 CZ ARG A 77 -0.290 14.835 6.673 1.00 0.00 C ATOM 1219 NH1 ARG A 77 -1.028 14.614 7.753 1.00 0.00 N ATOM 1220 NH2 ARG A 77 0.855 14.186 6.515 1.00 0.00 N ATOM 0 H ARG A 77 -2.128 19.766 9.077 1.00 0.00 H new ATOM 0 HA ARG A 77 -3.715 20.578 6.809 1.00 0.00 H new ATOM 0 HB2 ARG A 77 -3.308 18.539 5.502 1.00 0.00 H new ATOM 0 HB3 ARG A 77 -1.847 19.496 5.639 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -0.752 17.916 6.885 1.00 0.00 H new ATOM 0 HG3 ARG A 77 -2.199 17.421 7.741 1.00 0.00 H new ATOM 0 HD2 ARG A 77 -2.735 15.817 6.200 1.00 0.00 H new ATOM 0 HD3 ARG A 77 -2.229 16.800 4.840 1.00 0.00 H new ATOM 0 HE ARG A 77 -0.098 15.849 4.933 1.00 0.00 H new ATOM 0 HH11 ARG A 77 -1.909 15.112 7.879 1.00 0.00 H new ATOM 0 HH12 ARG A 77 -0.714 13.946 8.457 1.00 0.00 H new ATOM 0 HH21 ARG A 77 1.426 14.353 5.687 1.00 0.00 H new ATOM 0 HH22 ARG A 77 1.165 13.519 7.222 1.00 0.00 H new ATOM 1234 N ARG A 78 -5.493 18.975 7.581 1.00 0.00 N ATOM 1235 CA ARG A 78 -6.577 18.232 8.211 1.00 0.00 C ATOM 1236 C ARG A 78 -6.678 16.824 7.633 1.00 0.00 C ATOM 1237 O ARG A 78 -7.041 16.645 6.469 1.00 0.00 O ATOM 1238 CB ARG A 78 -7.906 18.968 8.029 1.00 0.00 C ATOM 1239 CG ARG A 78 -8.907 18.698 9.140 1.00 0.00 C ATOM 1240 CD ARG A 78 -8.888 19.797 10.193 1.00 0.00 C ATOM 1241 NE ARG A 78 -7.768 19.646 11.121 1.00 0.00 N ATOM 1242 CZ ARG A 78 -6.617 20.310 11.021 1.00 0.00 C ATOM 1243 NH1 ARG A 78 -6.417 21.172 10.031 1.00 0.00 N ATOM 1244 NH2 ARG A 78 -5.659 20.108 11.916 1.00 0.00 N ATOM 0 H ARG A 78 -5.777 19.535 6.777 1.00 0.00 H new ATOM 0 HA ARG A 78 -6.358 18.154 9.276 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -7.714 20.040 7.976 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -8.346 18.676 7.076 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -9.908 18.617 8.716 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -8.681 17.740 9.609 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -8.824 20.768 9.702 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -9.825 19.782 10.750 1.00 0.00 H new ATOM 0 HE ARG A 78 -7.875 18.990 11.895 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -7.148 21.331 9.338 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -5.532 21.675 9.964 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -5.804 19.446 12.678 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -4.777 20.615 11.842 1.00 0.00 H new ATOM 1258 N TYR A 79 -6.354 15.829 8.452 1.00 0.00 N ATOM 1259 CA TYR A 79 -6.403 14.433 8.025 1.00 0.00 C ATOM 1260 C TYR A 79 -7.721 14.115 7.319 1.00 0.00 C ATOM 1261 O TYR A 79 -7.779 13.237 6.459 1.00 0.00 O ATOM 1262 CB TYR A 79 -6.214 13.503 9.229 1.00 0.00 C ATOM 1263 CG TYR A 79 -7.424 13.411 10.134 1.00 0.00 C ATOM 1264 CD1 TYR A 79 -7.926 14.537 10.776 1.00 0.00 C ATOM 1265 CD2 TYR A 79 -8.064 12.197 10.347 1.00 0.00 C ATOM 1266 CE1 TYR A 79 -9.030 14.456 11.602 1.00 0.00 C ATOM 1267 CE2 TYR A 79 -9.169 12.107 11.172 1.00 0.00 C ATOM 1268 CZ TYR A 79 -9.648 13.238 11.798 1.00 0.00 C ATOM 1269 OH TYR A 79 -10.747 13.153 12.619 1.00 0.00 O ATOM 0 H TYR A 79 -6.054 15.963 9.418 1.00 0.00 H new ATOM 0 HA TYR A 79 -5.591 14.271 7.316 1.00 0.00 H new ATOM 0 HB2 TYR A 79 -5.967 12.505 8.868 1.00 0.00 H new ATOM 0 HB3 TYR A 79 -5.362 13.851 9.813 1.00 0.00 H new ATOM 0 HD1 TYR A 79 -7.444 15.492 10.626 1.00 0.00 H new ATOM 0 HD2 TYR A 79 -7.692 11.308 9.860 1.00 0.00 H new ATOM 0 HE1 TYR A 79 -9.408 15.341 12.092 1.00 0.00 H new ATOM 0 HE2 TYR A 79 -9.655 11.155 11.326 1.00 0.00 H new ATOM 0 HH TYR A 79 -10.600 12.456 13.292 1.00 0.00 H new ATOM 1279 N ASP A 80 -8.776 14.835 7.689 1.00 0.00 N ATOM 1280 CA ASP A 80 -10.089 14.627 7.089 1.00 0.00 C ATOM 1281 C ASP A 80 -10.348 15.631 5.970 1.00 0.00 C ATOM 1282 O ASP A 80 -11.482 16.062 5.761 1.00 0.00 O ATOM 1283 CB ASP A 80 -11.183 14.737 8.154 1.00 0.00 C ATOM 1284 CG ASP A 80 -11.227 16.110 8.796 1.00 0.00 C ATOM 1285 OD1 ASP A 80 -10.445 16.350 9.739 1.00 0.00 O ATOM 1286 OD2 ASP A 80 -12.045 16.946 8.355 1.00 0.00 O ATOM 0 H ASP A 80 -8.747 15.566 8.400 1.00 0.00 H new ATOM 0 HA ASP A 80 -10.107 13.625 6.660 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -12.150 14.519 7.701 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -11.014 13.984 8.924 1.00 0.00 H new ATOM 1291 N ASP A 81 -9.291 15.998 5.252 1.00 0.00 N ATOM 1292 CA ASP A 81 -9.406 16.949 4.151 1.00 0.00 C ATOM 1293 C ASP A 81 -9.437 16.224 2.807 1.00 0.00 C ATOM 1294 O ASP A 81 -8.409 15.742 2.332 1.00 0.00 O ATOM 1295 CB ASP A 81 -8.238 17.936 4.179 1.00 0.00 C ATOM 1296 CG ASP A 81 -8.532 19.203 3.401 1.00 0.00 C ATOM 1297 OD1 ASP A 81 -9.405 19.162 2.508 1.00 0.00 O ATOM 1298 OD2 ASP A 81 -7.890 20.236 3.683 1.00 0.00 O ATOM 0 H ASP A 81 -8.345 15.651 5.413 1.00 0.00 H new ATOM 0 HA ASP A 81 -10.341 17.496 4.273 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -8.008 18.193 5.213 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -7.351 17.457 3.765 1.00 0.00 H new ATOM 1303 N PRO A 82 -10.620 16.136 2.167 1.00 0.00 N ATOM 1304 CA PRO A 82 -10.767 15.464 0.872 1.00 0.00 C ATOM 1305 C PRO A 82 -9.712 15.907 -0.137 1.00 0.00 C ATOM 1306 O PRO A 82 -9.365 15.163 -1.055 1.00 0.00 O ATOM 1307 CB PRO A 82 -12.161 15.890 0.411 1.00 0.00 C ATOM 1308 CG PRO A 82 -12.910 16.148 1.671 1.00 0.00 C ATOM 1309 CD PRO A 82 -11.903 16.683 2.653 1.00 0.00 C ATOM 0 HA PRO A 82 -10.641 14.385 0.956 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -12.117 16.782 -0.214 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.638 15.110 -0.181 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -13.714 16.866 1.507 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -13.371 15.234 2.045 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -11.895 17.773 2.666 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -12.120 16.354 3.669 1.00 0.00 H new ATOM 1317 N GLU A 83 -9.204 17.123 0.038 1.00 0.00 N ATOM 1318 CA GLU A 83 -8.188 17.664 -0.858 1.00 0.00 C ATOM 1319 C GLU A 83 -6.957 16.765 -0.894 1.00 0.00 C ATOM 1320 O GLU A 83 -6.589 16.243 -1.947 1.00 0.00 O ATOM 1321 CB GLU A 83 -7.792 19.076 -0.421 1.00 0.00 C ATOM 1322 CG GLU A 83 -8.581 20.172 -1.121 1.00 0.00 C ATOM 1323 CD GLU A 83 -9.480 20.943 -0.174 1.00 0.00 C ATOM 1324 OE1 GLU A 83 -10.629 20.506 0.042 1.00 0.00 O ATOM 1325 OE2 GLU A 83 -9.032 21.983 0.354 1.00 0.00 O ATOM 0 H GLU A 83 -9.479 17.752 0.792 1.00 0.00 H new ATOM 0 HA GLU A 83 -8.611 17.707 -1.862 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -7.935 19.168 0.656 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -6.730 19.223 -0.616 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -7.888 20.863 -1.601 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -9.187 19.729 -1.911 1.00 0.00 H new ATOM 1332 N MET A 84 -6.324 16.585 0.261 1.00 0.00 N ATOM 1333 CA MET A 84 -5.136 15.744 0.356 1.00 0.00 C ATOM 1334 C MET A 84 -5.512 14.269 0.259 1.00 0.00 C ATOM 1335 O MET A 84 -4.762 13.461 -0.289 1.00 0.00 O ATOM 1336 CB MET A 84 -4.392 16.011 1.667 1.00 0.00 C ATOM 1337 CG MET A 84 -5.295 16.034 2.888 1.00 0.00 C ATOM 1338 SD MET A 84 -4.538 15.253 4.327 1.00 0.00 S ATOM 1339 CE MET A 84 -5.515 13.756 4.448 1.00 0.00 C ATOM 0 H MET A 84 -6.613 17.009 1.142 1.00 0.00 H new ATOM 0 HA MET A 84 -4.478 15.991 -0.477 1.00 0.00 H new ATOM 0 HB2 MET A 84 -3.630 15.244 1.804 1.00 0.00 H new ATOM 0 HB3 MET A 84 -3.873 16.967 1.592 1.00 0.00 H new ATOM 0 HG2 MET A 84 -5.546 17.067 3.130 1.00 0.00 H new ATOM 0 HG3 MET A 84 -6.230 15.525 2.653 1.00 0.00 H new ATOM 0 HE1 MET A 84 -5.123 13.129 5.249 1.00 0.00 H new ATOM 0 HE2 MET A 84 -6.552 14.015 4.664 1.00 0.00 H new ATOM 0 HE3 MET A 84 -5.466 13.212 3.505 1.00 0.00 H new ATOM 1349 N ILE A 85 -6.682 13.928 0.789 1.00 0.00 N ATOM 1350 CA ILE A 85 -7.162 12.553 0.759 1.00 0.00 C ATOM 1351 C ILE A 85 -7.340 12.074 -0.679 1.00 0.00 C ATOM 1352 O ILE A 85 -6.926 10.970 -1.031 1.00 0.00 O ATOM 1353 CB ILE A 85 -8.499 12.413 1.517 1.00 0.00 C ATOM 1354 CG1 ILE A 85 -8.323 12.827 2.978 1.00 0.00 C ATOM 1355 CG2 ILE A 85 -9.026 10.988 1.426 1.00 0.00 C ATOM 1356 CD1 ILE A 85 -9.629 13.103 3.687 1.00 0.00 C ATOM 0 H ILE A 85 -7.315 14.586 1.244 1.00 0.00 H new ATOM 0 HA ILE A 85 -6.413 11.934 1.253 1.00 0.00 H new ATOM 0 HB ILE A 85 -9.230 13.074 1.051 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -7.790 12.039 3.509 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -7.699 13.720 3.022 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -9.969 10.914 1.968 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -9.186 10.725 0.380 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -8.301 10.303 1.865 1.00 0.00 H new ATOM 0 HD11 ILE A 85 -9.429 13.391 4.719 1.00 0.00 H new ATOM 0 HD12 ILE A 85 -10.155 13.912 3.180 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -10.247 12.205 3.674 1.00 0.00 H new ATOM 1368 N ASP A 86 -7.955 12.915 -1.505 1.00 0.00 N ATOM 1369 CA ASP A 86 -8.185 12.581 -2.907 1.00 0.00 C ATOM 1370 C ASP A 86 -6.888 12.148 -3.584 1.00 0.00 C ATOM 1371 O ASP A 86 -6.843 11.123 -4.264 1.00 0.00 O ATOM 1372 CB ASP A 86 -8.784 13.779 -3.647 1.00 0.00 C ATOM 1373 CG ASP A 86 -9.302 13.409 -5.023 1.00 0.00 C ATOM 1374 OD1 ASP A 86 -8.783 12.437 -5.611 1.00 0.00 O ATOM 1375 OD2 ASP A 86 -10.227 14.091 -5.513 1.00 0.00 O ATOM 0 H ASP A 86 -8.303 13.833 -1.228 1.00 0.00 H new ATOM 0 HA ASP A 86 -8.889 11.750 -2.945 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -9.598 14.197 -3.056 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.028 14.558 -3.744 1.00 0.00 H new ATOM 1380 N GLU A 87 -5.834 12.933 -3.388 1.00 0.00 N ATOM 1381 CA GLU A 87 -4.534 12.628 -3.975 1.00 0.00 C ATOM 1382 C GLU A 87 -3.863 11.482 -3.228 1.00 0.00 C ATOM 1383 O GLU A 87 -3.184 10.649 -3.828 1.00 0.00 O ATOM 1384 CB GLU A 87 -3.634 13.865 -3.951 1.00 0.00 C ATOM 1385 CG GLU A 87 -3.736 14.714 -5.207 1.00 0.00 C ATOM 1386 CD GLU A 87 -2.808 15.913 -5.175 1.00 0.00 C ATOM 1387 OE1 GLU A 87 -3.216 16.966 -4.641 1.00 0.00 O ATOM 1388 OE2 GLU A 87 -1.673 15.799 -5.683 1.00 0.00 O ATOM 0 H GLU A 87 -5.854 13.785 -2.827 1.00 0.00 H new ATOM 0 HA GLU A 87 -4.691 12.325 -5.010 1.00 0.00 H new ATOM 0 HB2 GLU A 87 -3.893 14.476 -3.087 1.00 0.00 H new ATOM 0 HB3 GLU A 87 -2.599 13.549 -3.819 1.00 0.00 H new ATOM 0 HG2 GLU A 87 -3.501 14.100 -6.077 1.00 0.00 H new ATOM 0 HG3 GLU A 87 -4.764 15.057 -5.327 1.00 0.00 H new ATOM 1395 N ARG A 88 -4.064 11.439 -1.914 1.00 0.00 N ATOM 1396 CA ARG A 88 -3.483 10.386 -1.089 1.00 0.00 C ATOM 1397 C ARG A 88 -3.942 9.013 -1.573 1.00 0.00 C ATOM 1398 O ARG A 88 -3.257 8.011 -1.368 1.00 0.00 O ATOM 1399 CB ARG A 88 -3.872 10.584 0.379 1.00 0.00 C ATOM 1400 CG ARG A 88 -2.750 11.147 1.235 1.00 0.00 C ATOM 1401 CD ARG A 88 -2.255 12.481 0.701 1.00 0.00 C ATOM 1402 NE ARG A 88 -0.925 12.813 1.206 1.00 0.00 N ATOM 1403 CZ ARG A 88 -0.680 13.190 2.458 1.00 0.00 C ATOM 1404 NH1 ARG A 88 -1.671 13.284 3.337 1.00 0.00 N ATOM 1405 NH2 ARG A 88 0.560 13.473 2.836 1.00 0.00 N ATOM 0 H ARG A 88 -4.623 12.119 -1.399 1.00 0.00 H new ATOM 0 HA ARG A 88 -2.398 10.441 -1.175 1.00 0.00 H new ATOM 0 HB2 ARG A 88 -4.729 11.255 0.432 1.00 0.00 H new ATOM 0 HB3 ARG A 88 -4.190 9.628 0.794 1.00 0.00 H new ATOM 0 HG2 ARG A 88 -3.101 11.272 2.259 1.00 0.00 H new ATOM 0 HG3 ARG A 88 -1.923 10.437 1.265 1.00 0.00 H new ATOM 0 HD2 ARG A 88 -2.232 12.449 -0.388 1.00 0.00 H new ATOM 0 HD3 ARG A 88 -2.956 13.267 0.982 1.00 0.00 H new ATOM 0 HE ARG A 88 -0.138 12.752 0.560 1.00 0.00 H new ATOM 0 HH11 ARG A 88 -2.626 13.067 3.054 1.00 0.00 H new ATOM 0 HH12 ARG A 88 -1.477 13.574 4.296 1.00 0.00 H new ATOM 0 HH21 ARG A 88 1.326 13.402 2.166 1.00 0.00 H new ATOM 0 HH22 ARG A 88 0.747 13.762 3.796 1.00 0.00 H new ATOM 1419 N ARG A 89 -5.103 8.979 -2.221 1.00 0.00 N ATOM 1420 CA ARG A 89 -5.653 7.735 -2.742 1.00 0.00 C ATOM 1421 C ARG A 89 -4.717 7.125 -3.779 1.00 0.00 C ATOM 1422 O ARG A 89 -4.294 5.976 -3.648 1.00 0.00 O ATOM 1423 CB ARG A 89 -7.029 7.984 -3.363 1.00 0.00 C ATOM 1424 CG ARG A 89 -8.000 6.827 -3.180 1.00 0.00 C ATOM 1425 CD ARG A 89 -9.326 7.291 -2.595 1.00 0.00 C ATOM 1426 NE ARG A 89 -10.406 7.250 -3.578 1.00 0.00 N ATOM 1427 CZ ARG A 89 -10.627 8.203 -4.481 1.00 0.00 C ATOM 1428 NH1 ARG A 89 -9.843 9.273 -4.533 1.00 0.00 N ATOM 1429 NH2 ARG A 89 -11.635 8.087 -5.334 1.00 0.00 N ATOM 0 H ARG A 89 -5.681 9.801 -2.397 1.00 0.00 H new ATOM 0 HA ARG A 89 -5.758 7.034 -1.914 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -7.460 8.882 -2.921 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -6.907 8.180 -4.428 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -8.176 6.344 -4.141 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -7.555 6.079 -2.524 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -9.587 6.661 -1.745 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -9.219 8.308 -2.217 1.00 0.00 H new ATOM 0 HE ARG A 89 -11.029 6.442 -3.572 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -9.066 9.368 -3.879 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -10.017 10.000 -5.227 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -12.241 7.268 -5.299 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -11.804 8.817 -6.026 1.00 0.00 H new ATOM 1443 N ILE A 90 -4.393 7.902 -4.809 1.00 0.00 N ATOM 1444 CA ILE A 90 -3.504 7.432 -5.864 1.00 0.00 C ATOM 1445 C ILE A 90 -2.087 7.229 -5.341 1.00 0.00 C ATOM 1446 O ILE A 90 -1.738 7.705 -4.262 1.00 0.00 O ATOM 1447 CB ILE A 90 -3.460 8.410 -7.054 1.00 0.00 C ATOM 1448 CG1 ILE A 90 -3.301 9.854 -6.562 1.00 0.00 C ATOM 1449 CG2 ILE A 90 -4.714 8.257 -7.902 1.00 0.00 C ATOM 1450 CD1 ILE A 90 -3.490 10.892 -7.644 1.00 0.00 C ATOM 0 H ILE A 90 -4.732 8.856 -4.934 1.00 0.00 H new ATOM 0 HA ILE A 90 -3.907 6.478 -6.205 1.00 0.00 H new ATOM 0 HB ILE A 90 -2.595 8.172 -7.673 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -4.022 10.038 -5.765 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -2.308 9.973 -6.127 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -4.673 8.952 -8.740 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -4.775 7.236 -8.280 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -5.593 8.472 -7.294 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -3.362 11.888 -7.219 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -2.752 10.736 -8.431 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -4.492 10.802 -8.063 1.00 0.00 H new ATOM 1462 N GLY A 91 -1.278 6.519 -6.118 1.00 0.00 N ATOM 1463 CA GLY A 91 0.094 6.261 -5.721 1.00 0.00 C ATOM 1464 C GLY A 91 0.254 4.942 -4.987 1.00 0.00 C ATOM 1465 O GLY A 91 1.277 4.271 -5.119 1.00 0.00 O ATOM 0 H GLY A 91 -1.547 6.117 -7.016 1.00 0.00 H new ATOM 0 HA2 GLY A 91 0.730 6.259 -6.606 1.00 0.00 H new ATOM 0 HA3 GLY A 91 0.441 7.072 -5.081 1.00 0.00 H new ATOM 1469 N LEU A 92 -0.758 4.572 -4.209 1.00 0.00 N ATOM 1470 CA LEU A 92 -0.723 3.328 -3.448 1.00 0.00 C ATOM 1471 C LEU A 92 -0.938 2.124 -4.359 1.00 0.00 C ATOM 1472 O LEU A 92 -0.246 1.112 -4.241 1.00 0.00 O ATOM 1473 CB LEU A 92 -1.788 3.349 -2.350 1.00 0.00 C ATOM 1474 CG LEU A 92 -1.722 4.549 -1.406 1.00 0.00 C ATOM 1475 CD1 LEU A 92 -2.982 4.634 -0.561 1.00 0.00 C ATOM 1476 CD2 LEU A 92 -0.487 4.462 -0.521 1.00 0.00 C ATOM 0 H LEU A 92 -1.613 5.116 -4.089 1.00 0.00 H new ATOM 0 HA LEU A 92 0.262 3.240 -2.989 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -2.772 3.329 -2.819 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.698 2.437 -1.760 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.652 5.456 -2.006 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -2.916 5.495 0.105 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -3.850 4.744 -1.212 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -3.085 3.725 0.031 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.455 5.324 0.145 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -0.527 3.547 0.071 1.00 0.00 H new ATOM 0 HD23 LEU A 92 0.407 4.452 -1.144 1.00 0.00 H new ATOM 1488 N GLU A 93 -1.903 2.236 -5.265 1.00 0.00 N ATOM 1489 CA GLU A 93 -2.212 1.151 -6.193 1.00 0.00 C ATOM 1490 C GLU A 93 -0.977 0.736 -6.991 1.00 0.00 C ATOM 1491 O GLU A 93 -0.629 -0.443 -7.042 1.00 0.00 O ATOM 1492 CB GLU A 93 -3.337 1.564 -7.148 1.00 0.00 C ATOM 1493 CG GLU A 93 -3.207 2.984 -7.677 1.00 0.00 C ATOM 1494 CD GLU A 93 -3.011 3.032 -9.180 1.00 0.00 C ATOM 1495 OE1 GLU A 93 -2.178 2.257 -9.695 1.00 0.00 O ATOM 1496 OE2 GLU A 93 -3.691 3.844 -9.842 1.00 0.00 O ATOM 0 H GLU A 93 -2.485 3.066 -5.378 1.00 0.00 H new ATOM 0 HA GLU A 93 -2.542 0.296 -5.604 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -3.356 0.873 -7.991 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -4.292 1.465 -6.633 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -4.101 3.549 -7.413 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -2.364 3.474 -7.189 1.00 0.00 H new ATOM 1503 N ARG A 94 -0.318 1.710 -7.611 1.00 0.00 N ATOM 1504 CA ARG A 94 0.877 1.437 -8.406 1.00 0.00 C ATOM 1505 C ARG A 94 2.003 0.892 -7.532 1.00 0.00 C ATOM 1506 O ARG A 94 2.842 0.120 -7.997 1.00 0.00 O ATOM 1507 CB ARG A 94 1.346 2.701 -9.137 1.00 0.00 C ATOM 1508 CG ARG A 94 1.198 3.978 -8.325 1.00 0.00 C ATOM 1509 CD ARG A 94 -0.057 4.744 -8.715 1.00 0.00 C ATOM 1510 NE ARG A 94 0.225 6.148 -9.003 1.00 0.00 N ATOM 1511 CZ ARG A 94 0.832 6.570 -10.110 1.00 0.00 C ATOM 1512 NH1 ARG A 94 1.226 5.700 -11.031 1.00 0.00 N ATOM 1513 NH2 ARG A 94 1.046 7.866 -10.296 1.00 0.00 N ATOM 0 H ARG A 94 -0.589 2.693 -7.579 1.00 0.00 H new ATOM 0 HA ARG A 94 0.616 0.681 -9.146 1.00 0.00 H new ATOM 0 HB2 ARG A 94 2.393 2.579 -9.416 1.00 0.00 H new ATOM 0 HB3 ARG A 94 0.780 2.804 -10.063 1.00 0.00 H new ATOM 0 HG2 ARG A 94 1.161 3.733 -7.263 1.00 0.00 H new ATOM 0 HG3 ARG A 94 2.073 4.610 -8.476 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -0.508 4.278 -9.591 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -0.787 4.679 -7.908 1.00 0.00 H new ATOM 0 HE ARG A 94 -0.060 6.846 -8.316 1.00 0.00 H new ATOM 0 HH11 ARG A 94 1.064 4.702 -10.893 1.00 0.00 H new ATOM 0 HH12 ARG A 94 1.691 6.029 -11.877 1.00 0.00 H new ATOM 0 HH21 ARG A 94 0.745 8.539 -9.591 1.00 0.00 H new ATOM 0 HH22 ARG A 94 1.511 8.190 -11.144 1.00 0.00 H new ATOM 1527 N PHE A 95 2.015 1.295 -6.265 1.00 0.00 N ATOM 1528 CA PHE A 95 3.039 0.841 -5.331 1.00 0.00 C ATOM 1529 C PHE A 95 2.996 -0.676 -5.174 1.00 0.00 C ATOM 1530 O PHE A 95 4.031 -1.324 -5.024 1.00 0.00 O ATOM 1531 CB PHE A 95 2.850 1.516 -3.969 1.00 0.00 C ATOM 1532 CG PHE A 95 3.878 1.118 -2.947 1.00 0.00 C ATOM 1533 CD1 PHE A 95 3.745 -0.064 -2.236 1.00 0.00 C ATOM 1534 CD2 PHE A 95 4.973 1.929 -2.693 1.00 0.00 C ATOM 1535 CE1 PHE A 95 4.686 -0.431 -1.293 1.00 0.00 C ATOM 1536 CE2 PHE A 95 5.917 1.567 -1.752 1.00 0.00 C ATOM 1537 CZ PHE A 95 5.774 0.385 -1.050 1.00 0.00 C ATOM 0 H PHE A 95 1.329 1.933 -5.863 1.00 0.00 H new ATOM 0 HA PHE A 95 4.014 1.118 -5.733 1.00 0.00 H new ATOM 0 HB2 PHE A 95 2.883 2.597 -4.102 1.00 0.00 H new ATOM 0 HB3 PHE A 95 1.859 1.272 -3.587 1.00 0.00 H new ATOM 0 HD1 PHE A 95 2.896 -0.706 -2.421 1.00 0.00 H new ATOM 0 HD2 PHE A 95 5.089 2.855 -3.237 1.00 0.00 H new ATOM 0 HE1 PHE A 95 4.571 -1.355 -0.746 1.00 0.00 H new ATOM 0 HE2 PHE A 95 6.766 2.207 -1.565 1.00 0.00 H new ATOM 0 HZ PHE A 95 6.511 0.100 -0.314 1.00 0.00 H new ATOM 1547 N LEU A 96 1.790 -1.237 -5.211 1.00 0.00 N ATOM 1548 CA LEU A 96 1.612 -2.679 -5.076 1.00 0.00 C ATOM 1549 C LEU A 96 1.713 -3.373 -6.432 1.00 0.00 C ATOM 1550 O LEU A 96 2.278 -4.459 -6.545 1.00 0.00 O ATOM 1551 CB LEU A 96 0.256 -2.991 -4.435 1.00 0.00 C ATOM 1552 CG LEU A 96 -0.172 -2.031 -3.325 1.00 0.00 C ATOM 1553 CD1 LEU A 96 -1.665 -2.157 -3.059 1.00 0.00 C ATOM 1554 CD2 LEU A 96 0.622 -2.300 -2.056 1.00 0.00 C ATOM 0 H LEU A 96 0.922 -0.715 -5.333 1.00 0.00 H new ATOM 0 HA LEU A 96 2.408 -3.056 -4.434 1.00 0.00 H new ATOM 0 HB2 LEU A 96 -0.507 -2.985 -5.214 1.00 0.00 H new ATOM 0 HB3 LEU A 96 0.288 -4.002 -4.028 1.00 0.00 H new ATOM 0 HG LEU A 96 0.034 -1.011 -3.650 1.00 0.00 H new ATOM 0 HD11 LEU A 96 -1.953 -1.467 -2.266 1.00 0.00 H new ATOM 0 HD12 LEU A 96 -2.218 -1.917 -3.967 1.00 0.00 H new ATOM 0 HD13 LEU A 96 -1.895 -3.177 -2.753 1.00 0.00 H new ATOM 0 HD21 LEU A 96 0.306 -1.608 -1.275 1.00 0.00 H new ATOM 0 HD22 LEU A 96 0.446 -3.324 -1.727 1.00 0.00 H new ATOM 0 HD23 LEU A 96 1.685 -2.161 -2.255 1.00 0.00 H new ATOM 1566 N ASN A 97 1.149 -2.739 -7.456 1.00 0.00 N ATOM 1567 CA ASN A 97 1.161 -3.291 -8.808 1.00 0.00 C ATOM 1568 C ASN A 97 2.547 -3.805 -9.198 1.00 0.00 C ATOM 1569 O ASN A 97 2.718 -4.987 -9.488 1.00 0.00 O ATOM 1570 CB ASN A 97 0.700 -2.231 -9.810 1.00 0.00 C ATOM 1571 CG ASN A 97 -0.757 -2.393 -10.196 1.00 0.00 C ATOM 1572 OD1 ASN A 97 -1.087 -3.133 -11.122 1.00 0.00 O ATOM 1573 ND2 ASN A 97 -1.638 -1.696 -9.487 1.00 0.00 N ATOM 0 H ASN A 97 0.676 -1.839 -7.375 1.00 0.00 H new ATOM 0 HA ASN A 97 0.474 -4.137 -8.826 1.00 0.00 H new ATOM 0 HB2 ASN A 97 0.851 -1.240 -9.381 1.00 0.00 H new ATOM 0 HB3 ASN A 97 1.319 -2.289 -10.706 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -2.633 -1.762 -9.702 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -1.320 -1.094 -8.727 1.00 0.00 H new ATOM 1580 N GLU A 98 3.528 -2.909 -9.212 1.00 0.00 N ATOM 1581 CA GLU A 98 4.894 -3.275 -9.578 1.00 0.00 C ATOM 1582 C GLU A 98 5.549 -4.140 -8.502 1.00 0.00 C ATOM 1583 O GLU A 98 6.494 -4.878 -8.779 1.00 0.00 O ATOM 1584 CB GLU A 98 5.731 -2.017 -9.822 1.00 0.00 C ATOM 1585 CG GLU A 98 7.185 -2.306 -10.160 1.00 0.00 C ATOM 1586 CD GLU A 98 7.845 -1.170 -10.916 1.00 0.00 C ATOM 1587 OE1 GLU A 98 7.156 -0.514 -11.725 1.00 0.00 O ATOM 1588 OE2 GLU A 98 9.053 -0.935 -10.698 1.00 0.00 O ATOM 0 H GLU A 98 3.404 -1.925 -8.975 1.00 0.00 H new ATOM 0 HA GLU A 98 4.847 -3.860 -10.497 1.00 0.00 H new ATOM 0 HB2 GLU A 98 5.284 -1.447 -10.636 1.00 0.00 H new ATOM 0 HB3 GLU A 98 5.692 -1.387 -8.933 1.00 0.00 H new ATOM 0 HG2 GLU A 98 7.738 -2.494 -9.239 1.00 0.00 H new ATOM 0 HG3 GLU A 98 7.241 -3.216 -10.757 1.00 0.00 H new ATOM 1595 N LEU A 99 5.047 -4.042 -7.275 1.00 0.00 N ATOM 1596 CA LEU A 99 5.593 -4.813 -6.163 1.00 0.00 C ATOM 1597 C LEU A 99 5.209 -6.287 -6.262 1.00 0.00 C ATOM 1598 O LEU A 99 6.070 -7.167 -6.219 1.00 0.00 O ATOM 1599 CB LEU A 99 5.105 -4.249 -4.836 1.00 0.00 C ATOM 1600 CG LEU A 99 5.798 -4.836 -3.609 1.00 0.00 C ATOM 1601 CD1 LEU A 99 6.034 -3.760 -2.566 1.00 0.00 C ATOM 1602 CD2 LEU A 99 4.979 -5.979 -3.035 1.00 0.00 C ATOM 0 H LEU A 99 4.264 -3.437 -7.026 1.00 0.00 H new ATOM 0 HA LEU A 99 6.679 -4.736 -6.214 1.00 0.00 H new ATOM 0 HB2 LEU A 99 5.251 -3.169 -4.839 1.00 0.00 H new ATOM 0 HB3 LEU A 99 4.033 -4.426 -4.752 1.00 0.00 H new ATOM 0 HG LEU A 99 6.768 -5.231 -3.912 1.00 0.00 H new ATOM 0 HD11 LEU A 99 6.529 -4.197 -1.698 1.00 0.00 H new ATOM 0 HD12 LEU A 99 6.664 -2.977 -2.987 1.00 0.00 H new ATOM 0 HD13 LEU A 99 5.079 -3.332 -2.262 1.00 0.00 H new ATOM 0 HD21 LEU A 99 5.486 -6.387 -2.161 1.00 0.00 H new ATOM 0 HD22 LEU A 99 3.995 -5.611 -2.745 1.00 0.00 H new ATOM 0 HD23 LEU A 99 4.867 -6.760 -3.787 1.00 0.00 H new ATOM 1614 N TYR A 100 3.912 -6.548 -6.374 1.00 0.00 N ATOM 1615 CA TYR A 100 3.410 -7.914 -6.456 1.00 0.00 C ATOM 1616 C TYR A 100 3.655 -8.535 -7.831 1.00 0.00 C ATOM 1617 O TYR A 100 3.462 -9.737 -8.016 1.00 0.00 O ATOM 1618 CB TYR A 100 1.919 -7.942 -6.112 1.00 0.00 C ATOM 1619 CG TYR A 100 1.647 -7.725 -4.641 1.00 0.00 C ATOM 1620 CD1 TYR A 100 1.486 -6.444 -4.126 1.00 0.00 C ATOM 1621 CD2 TYR A 100 1.560 -8.799 -3.764 1.00 0.00 C ATOM 1622 CE1 TYR A 100 1.245 -6.240 -2.781 1.00 0.00 C ATOM 1623 CE2 TYR A 100 1.319 -8.603 -2.416 1.00 0.00 C ATOM 1624 CZ TYR A 100 1.163 -7.322 -1.931 1.00 0.00 C ATOM 1625 OH TYR A 100 0.924 -7.123 -0.590 1.00 0.00 O ATOM 0 H TYR A 100 3.188 -5.830 -6.410 1.00 0.00 H new ATOM 0 HA TYR A 100 3.960 -8.514 -5.731 1.00 0.00 H new ATOM 0 HB2 TYR A 100 1.405 -7.173 -6.688 1.00 0.00 H new ATOM 0 HB3 TYR A 100 1.500 -8.901 -6.415 1.00 0.00 H new ATOM 0 HD1 TYR A 100 1.550 -5.594 -4.789 1.00 0.00 H new ATOM 0 HD2 TYR A 100 1.683 -9.804 -4.141 1.00 0.00 H new ATOM 0 HE1 TYR A 100 1.121 -5.238 -2.398 1.00 0.00 H new ATOM 0 HE2 TYR A 100 1.253 -9.449 -1.747 1.00 0.00 H new ATOM 0 HH TYR A 100 1.461 -7.753 -0.065 1.00 0.00 H new ATOM 1635 N ASN A 101 4.083 -7.722 -8.794 1.00 0.00 N ATOM 1636 CA ASN A 101 4.353 -8.217 -10.141 1.00 0.00 C ATOM 1637 C ASN A 101 5.842 -8.496 -10.330 1.00 0.00 C ATOM 1638 O ASN A 101 6.501 -7.873 -11.164 1.00 0.00 O ATOM 1639 CB ASN A 101 3.874 -7.209 -11.190 1.00 0.00 C ATOM 1640 CG ASN A 101 2.435 -7.445 -11.605 1.00 0.00 C ATOM 1641 OD1 ASN A 101 2.155 -8.259 -12.484 1.00 0.00 O ATOM 1642 ND2 ASN A 101 1.512 -6.731 -10.971 1.00 0.00 N ATOM 0 H ASN A 101 4.249 -6.724 -8.668 1.00 0.00 H new ATOM 0 HA ASN A 101 3.805 -9.150 -10.271 1.00 0.00 H new ATOM 0 HB2 ASN A 101 3.973 -6.199 -10.791 1.00 0.00 H new ATOM 0 HB3 ASN A 101 4.517 -7.270 -12.068 1.00 0.00 H new ATOM 0 HD21 ASN A 101 0.526 -6.847 -11.207 1.00 0.00 H new ATOM 0 HD22 ASN A 101 1.789 -6.067 -10.248 1.00 0.00 H new ATOM 1649 N ASP A 102 6.368 -9.435 -9.551 1.00 0.00 N ATOM 1650 CA ASP A 102 7.780 -9.796 -9.633 1.00 0.00 C ATOM 1651 C ASP A 102 7.949 -11.288 -9.896 1.00 0.00 C ATOM 1652 O ASP A 102 7.521 -12.121 -9.097 1.00 0.00 O ATOM 1653 CB ASP A 102 8.502 -9.410 -8.340 1.00 0.00 C ATOM 1654 CG ASP A 102 9.062 -8.002 -8.388 1.00 0.00 C ATOM 1655 OD1 ASP A 102 9.786 -7.684 -9.355 1.00 0.00 O ATOM 1656 OD2 ASP A 102 8.778 -7.218 -7.459 1.00 0.00 O ATOM 0 H ASP A 102 5.838 -9.960 -8.855 1.00 0.00 H new ATOM 0 HA ASP A 102 8.220 -9.248 -10.466 1.00 0.00 H new ATOM 0 HB2 ASP A 102 7.810 -9.494 -7.502 1.00 0.00 H new ATOM 0 HB3 ASP A 102 9.313 -10.114 -8.156 1.00 0.00 H new ATOM 1661 N ARG A 103 8.578 -11.620 -11.019 1.00 0.00 N ATOM 1662 CA ARG A 103 8.806 -13.013 -11.386 1.00 0.00 C ATOM 1663 C ARG A 103 10.269 -13.395 -11.184 1.00 0.00 C ATOM 1664 O ARG A 103 10.582 -14.537 -10.850 1.00 0.00 O ATOM 1665 CB ARG A 103 8.397 -13.256 -12.840 1.00 0.00 C ATOM 1666 CG ARG A 103 9.058 -12.308 -13.826 1.00 0.00 C ATOM 1667 CD ARG A 103 9.445 -13.019 -15.113 1.00 0.00 C ATOM 1668 NE ARG A 103 8.498 -12.748 -16.193 1.00 0.00 N ATOM 1669 CZ ARG A 103 8.384 -13.500 -17.286 1.00 0.00 C ATOM 1670 NH1 ARG A 103 9.154 -14.570 -17.448 1.00 0.00 N ATOM 1671 NH2 ARG A 103 7.498 -13.183 -18.220 1.00 0.00 N ATOM 0 H ARG A 103 8.939 -10.943 -11.691 1.00 0.00 H new ATOM 0 HA ARG A 103 8.193 -13.638 -10.737 1.00 0.00 H new ATOM 0 HB2 ARG A 103 8.647 -14.282 -13.112 1.00 0.00 H new ATOM 0 HB3 ARG A 103 7.315 -13.158 -12.925 1.00 0.00 H new ATOM 0 HG2 ARG A 103 8.378 -11.487 -14.054 1.00 0.00 H new ATOM 0 HG3 ARG A 103 9.946 -11.870 -13.371 1.00 0.00 H new ATOM 0 HD2 ARG A 103 10.442 -12.702 -15.417 1.00 0.00 H new ATOM 0 HD3 ARG A 103 9.493 -14.093 -14.934 1.00 0.00 H new ATOM 0 HE ARG A 103 7.889 -11.935 -16.104 1.00 0.00 H new ATOM 0 HH11 ARG A 103 9.837 -14.820 -16.733 1.00 0.00 H new ATOM 0 HH12 ARG A 103 9.062 -15.142 -18.287 1.00 0.00 H new ATOM 0 HH21 ARG A 103 6.903 -12.363 -18.101 1.00 0.00 H new ATOM 0 HH22 ARG A 103 7.411 -13.759 -19.057 1.00 0.00 H new ATOM 1685 N PHE A 104 11.160 -12.430 -11.387 1.00 0.00 N ATOM 1686 CA PHE A 104 12.590 -12.664 -11.223 1.00 0.00 C ATOM 1687 C PHE A 104 13.013 -12.428 -9.777 1.00 0.00 C ATOM 1688 O PHE A 104 13.742 -13.228 -9.193 1.00 0.00 O ATOM 1689 CB PHE A 104 13.388 -11.752 -12.156 1.00 0.00 C ATOM 1690 CG PHE A 104 13.543 -12.304 -13.545 1.00 0.00 C ATOM 1691 CD1 PHE A 104 14.418 -13.349 -13.795 1.00 0.00 C ATOM 1692 CD2 PHE A 104 12.814 -11.778 -14.600 1.00 0.00 C ATOM 1693 CE1 PHE A 104 14.561 -13.860 -15.070 1.00 0.00 C ATOM 1694 CE2 PHE A 104 12.954 -12.284 -15.877 1.00 0.00 C ATOM 1695 CZ PHE A 104 13.829 -13.327 -16.114 1.00 0.00 C ATOM 0 H PHE A 104 10.917 -11.479 -11.665 1.00 0.00 H new ATOM 0 HA PHE A 104 12.797 -13.703 -11.480 1.00 0.00 H new ATOM 0 HB2 PHE A 104 12.895 -10.782 -12.212 1.00 0.00 H new ATOM 0 HB3 PHE A 104 14.376 -11.583 -11.728 1.00 0.00 H new ATOM 0 HD1 PHE A 104 14.995 -13.768 -12.984 1.00 0.00 H new ATOM 0 HD2 PHE A 104 12.128 -10.963 -14.421 1.00 0.00 H new ATOM 0 HE1 PHE A 104 15.245 -14.676 -15.251 1.00 0.00 H new ATOM 0 HE2 PHE A 104 12.380 -11.865 -16.690 1.00 0.00 H new ATOM 0 HZ PHE A 104 13.940 -13.724 -17.112 1.00 0.00 H new ATOM 1705 N ASP A 105 12.542 -11.325 -9.206 1.00 0.00 N ATOM 1706 CA ASP A 105 12.860 -10.980 -7.827 1.00 0.00 C ATOM 1707 C ASP A 105 11.627 -10.447 -7.109 1.00 0.00 C ATOM 1708 O ASP A 105 11.229 -9.298 -7.302 1.00 0.00 O ATOM 1709 CB ASP A 105 13.980 -9.940 -7.780 1.00 0.00 C ATOM 1710 CG ASP A 105 15.194 -10.361 -8.585 1.00 0.00 C ATOM 1711 OD1 ASP A 105 16.018 -11.135 -8.054 1.00 0.00 O ATOM 1712 OD2 ASP A 105 15.322 -9.916 -9.745 1.00 0.00 O ATOM 0 H ASP A 105 11.937 -10.653 -9.679 1.00 0.00 H new ATOM 0 HA ASP A 105 13.197 -11.884 -7.320 1.00 0.00 H new ATOM 0 HB2 ASP A 105 13.606 -8.990 -8.162 1.00 0.00 H new ATOM 0 HB3 ASP A 105 14.274 -9.774 -6.744 1.00 0.00 H new ATOM 1717 N SER A 106 11.024 -11.294 -6.285 1.00 0.00 N ATOM 1718 CA SER A 106 9.831 -10.913 -5.538 1.00 0.00 C ATOM 1719 C SER A 106 10.135 -10.778 -4.051 1.00 0.00 C ATOM 1720 O SER A 106 9.266 -11.003 -3.209 1.00 0.00 O ATOM 1721 CB SER A 106 8.721 -11.942 -5.752 1.00 0.00 C ATOM 1722 OG SER A 106 9.106 -13.217 -5.270 1.00 0.00 O ATOM 0 H SER A 106 11.341 -12.249 -6.117 1.00 0.00 H new ATOM 0 HA SER A 106 9.497 -9.944 -5.909 1.00 0.00 H new ATOM 0 HB2 SER A 106 7.815 -11.615 -5.241 1.00 0.00 H new ATOM 0 HB3 SER A 106 8.482 -12.008 -6.813 1.00 0.00 H new ATOM 0 HG SER A 106 8.764 -13.340 -4.360 1.00 0.00 H new ATOM 1728 N ARG A 107 11.372 -10.407 -3.734 1.00 0.00 N ATOM 1729 CA ARG A 107 11.782 -10.238 -2.345 1.00 0.00 C ATOM 1730 C ARG A 107 10.902 -9.206 -1.648 1.00 0.00 C ATOM 1731 O ARG A 107 10.611 -9.321 -0.458 1.00 0.00 O ATOM 1732 CB ARG A 107 13.247 -9.806 -2.267 1.00 0.00 C ATOM 1733 CG ARG A 107 14.189 -10.689 -3.069 1.00 0.00 C ATOM 1734 CD ARG A 107 15.336 -9.886 -3.658 1.00 0.00 C ATOM 1735 NE ARG A 107 14.866 -8.862 -4.589 1.00 0.00 N ATOM 1736 CZ ARG A 107 15.585 -7.799 -4.947 1.00 0.00 C ATOM 1737 NH1 ARG A 107 16.806 -7.618 -4.457 1.00 0.00 N ATOM 1738 NH2 ARG A 107 15.082 -6.916 -5.798 1.00 0.00 N ATOM 0 H ARG A 107 12.105 -10.218 -4.418 1.00 0.00 H new ATOM 0 HA ARG A 107 11.669 -11.197 -1.839 1.00 0.00 H new ATOM 0 HB2 ARG A 107 13.333 -8.780 -2.624 1.00 0.00 H new ATOM 0 HB3 ARG A 107 13.562 -9.808 -1.223 1.00 0.00 H new ATOM 0 HG2 ARG A 107 14.586 -11.476 -2.428 1.00 0.00 H new ATOM 0 HG3 ARG A 107 13.636 -11.179 -3.871 1.00 0.00 H new ATOM 0 HD2 ARG A 107 15.899 -9.413 -2.853 1.00 0.00 H new ATOM 0 HD3 ARG A 107 16.022 -10.558 -4.174 1.00 0.00 H new ATOM 0 HE ARG A 107 13.933 -8.967 -4.988 1.00 0.00 H new ATOM 0 HH11 ARG A 107 17.198 -8.295 -3.803 1.00 0.00 H new ATOM 0 HH12 ARG A 107 17.351 -6.802 -4.735 1.00 0.00 H new ATOM 0 HH21 ARG A 107 14.145 -7.051 -6.178 1.00 0.00 H new ATOM 0 HH22 ARG A 107 15.632 -6.102 -6.073 1.00 0.00 H new ATOM 1752 N TRP A 108 10.482 -8.198 -2.404 1.00 0.00 N ATOM 1753 CA TRP A 108 9.634 -7.140 -1.871 1.00 0.00 C ATOM 1754 C TRP A 108 8.321 -7.706 -1.337 1.00 0.00 C ATOM 1755 O TRP A 108 7.910 -7.395 -0.219 1.00 0.00 O ATOM 1756 CB TRP A 108 9.353 -6.094 -2.952 1.00 0.00 C ATOM 1757 CG TRP A 108 10.596 -5.458 -3.496 1.00 0.00 C ATOM 1758 CD1 TRP A 108 11.122 -5.620 -4.746 1.00 0.00 C ATOM 1759 CD2 TRP A 108 11.472 -4.561 -2.805 1.00 0.00 C ATOM 1760 NE1 TRP A 108 12.271 -4.877 -4.874 1.00 0.00 N ATOM 1761 CE2 TRP A 108 12.507 -4.218 -3.696 1.00 0.00 C ATOM 1762 CE3 TRP A 108 11.481 -4.014 -1.520 1.00 0.00 C ATOM 1763 CZ2 TRP A 108 13.539 -3.353 -3.339 1.00 0.00 C ATOM 1764 CZ3 TRP A 108 12.505 -3.156 -1.167 1.00 0.00 C ATOM 1765 CH2 TRP A 108 13.521 -2.833 -2.074 1.00 0.00 C ATOM 0 H TRP A 108 10.716 -8.092 -3.391 1.00 0.00 H new ATOM 0 HA TRP A 108 10.163 -6.667 -1.044 1.00 0.00 H new ATOM 0 HB2 TRP A 108 8.806 -6.564 -3.769 1.00 0.00 H new ATOM 0 HB3 TRP A 108 8.707 -5.319 -2.539 1.00 0.00 H new ATOM 0 HD1 TRP A 108 10.697 -6.241 -5.521 1.00 0.00 H new ATOM 0 HE1 TRP A 108 12.853 -4.825 -5.710 1.00 0.00 H new ATOM 0 HE3 TRP A 108 10.701 -4.258 -0.814 1.00 0.00 H new ATOM 0 HZ2 TRP A 108 14.325 -3.102 -4.036 1.00 0.00 H new ATOM 0 HZ3 TRP A 108 12.522 -2.728 -0.176 1.00 0.00 H new ATOM 0 HH2 TRP A 108 14.307 -2.159 -1.768 1.00 0.00 H new ATOM 1776 N ARG A 109 7.667 -8.536 -2.143 1.00 0.00 N ATOM 1777 CA ARG A 109 6.401 -9.142 -1.747 1.00 0.00 C ATOM 1778 C ARG A 109 6.637 -10.352 -0.843 1.00 0.00 C ATOM 1779 O ARG A 109 5.845 -10.632 0.057 1.00 0.00 O ATOM 1780 CB ARG A 109 5.586 -9.520 -2.997 1.00 0.00 C ATOM 1781 CG ARG A 109 5.285 -11.007 -3.150 1.00 0.00 C ATOM 1782 CD ARG A 109 5.257 -11.418 -4.611 1.00 0.00 C ATOM 1783 NE ARG A 109 5.852 -12.735 -4.809 1.00 0.00 N ATOM 1784 CZ ARG A 109 5.638 -13.493 -5.881 1.00 0.00 C ATOM 1785 NH1 ARG A 109 4.845 -13.068 -6.856 1.00 0.00 N ATOM 1786 NH2 ARG A 109 6.221 -14.681 -5.979 1.00 0.00 N ATOM 0 H ARG A 109 7.992 -8.804 -3.072 1.00 0.00 H new ATOM 0 HA ARG A 109 5.825 -8.416 -1.172 1.00 0.00 H new ATOM 0 HB2 ARG A 109 4.642 -8.975 -2.974 1.00 0.00 H new ATOM 0 HB3 ARG A 109 6.128 -9.182 -3.880 1.00 0.00 H new ATOM 0 HG2 ARG A 109 6.040 -11.589 -2.621 1.00 0.00 H new ATOM 0 HG3 ARG A 109 4.325 -11.235 -2.688 1.00 0.00 H new ATOM 0 HD2 ARG A 109 4.227 -11.426 -4.968 1.00 0.00 H new ATOM 0 HD3 ARG A 109 5.795 -10.681 -5.207 1.00 0.00 H new ATOM 0 HE ARG A 109 6.469 -13.096 -4.082 1.00 0.00 H new ATOM 0 HH11 ARG A 109 4.395 -12.155 -6.786 1.00 0.00 H new ATOM 0 HH12 ARG A 109 4.685 -13.654 -7.675 1.00 0.00 H new ATOM 0 HH21 ARG A 109 6.832 -15.012 -5.233 1.00 0.00 H new ATOM 0 HH22 ARG A 109 6.058 -15.263 -6.801 1.00 0.00 H new ATOM 1800 N ASP A 110 7.730 -11.068 -1.095 1.00 0.00 N ATOM 1801 CA ASP A 110 8.070 -12.250 -0.307 1.00 0.00 C ATOM 1802 C ASP A 110 8.135 -11.914 1.180 1.00 0.00 C ATOM 1803 O ASP A 110 7.778 -12.731 2.028 1.00 0.00 O ATOM 1804 CB ASP A 110 9.409 -12.831 -0.771 1.00 0.00 C ATOM 1805 CG ASP A 110 9.237 -14.096 -1.588 1.00 0.00 C ATOM 1806 OD1 ASP A 110 8.345 -14.123 -2.462 1.00 0.00 O ATOM 1807 OD2 ASP A 110 9.997 -15.060 -1.355 1.00 0.00 O ATOM 0 H ASP A 110 8.395 -10.851 -1.838 1.00 0.00 H new ATOM 0 HA ASP A 110 7.287 -12.994 -0.458 1.00 0.00 H new ATOM 0 HB2 ASP A 110 9.939 -12.087 -1.366 1.00 0.00 H new ATOM 0 HB3 ASP A 110 10.030 -13.045 0.099 1.00 0.00 H new ATOM 1812 N THR A 111 8.592 -10.703 1.488 1.00 0.00 N ATOM 1813 CA THR A 111 8.707 -10.249 2.867 1.00 0.00 C ATOM 1814 C THR A 111 7.423 -10.519 3.648 1.00 0.00 C ATOM 1815 O THR A 111 6.321 -10.395 3.113 1.00 0.00 O ATOM 1816 CB THR A 111 9.033 -8.756 2.895 1.00 0.00 C ATOM 1817 OG1 THR A 111 9.346 -8.285 1.596 1.00 0.00 O ATOM 1818 CG2 THR A 111 10.197 -8.420 3.796 1.00 0.00 C ATOM 0 H THR A 111 8.890 -10.016 0.795 1.00 0.00 H new ATOM 0 HA THR A 111 9.514 -10.806 3.343 1.00 0.00 H new ATOM 0 HB THR A 111 8.138 -8.271 3.284 1.00 0.00 H new ATOM 0 HG1 THR A 111 8.525 -8.218 1.066 1.00 0.00 H new ATOM 0 HG21 THR A 111 10.378 -7.345 3.772 1.00 0.00 H new ATOM 0 HG22 THR A 111 9.967 -8.726 4.817 1.00 0.00 H new ATOM 0 HG23 THR A 111 11.088 -8.945 3.451 1.00 0.00 H new ATOM 1826 N LYS A 112 7.575 -10.888 4.916 1.00 0.00 N ATOM 1827 CA LYS A 112 6.431 -11.176 5.772 1.00 0.00 C ATOM 1828 C LYS A 112 5.522 -9.956 5.889 1.00 0.00 C ATOM 1829 O LYS A 112 4.307 -10.087 6.034 1.00 0.00 O ATOM 1830 CB LYS A 112 6.901 -11.612 7.160 1.00 0.00 C ATOM 1831 CG LYS A 112 7.025 -13.118 7.315 1.00 0.00 C ATOM 1832 CD LYS A 112 7.193 -13.518 8.772 1.00 0.00 C ATOM 1833 CE LYS A 112 7.877 -14.869 8.905 1.00 0.00 C ATOM 1834 NZ LYS A 112 7.170 -15.756 9.870 1.00 0.00 N ATOM 0 H LYS A 112 8.481 -10.995 5.373 1.00 0.00 H new ATOM 0 HA LYS A 112 5.864 -11.989 5.318 1.00 0.00 H new ATOM 0 HB2 LYS A 112 7.868 -11.153 7.368 1.00 0.00 H new ATOM 0 HB3 LYS A 112 6.202 -11.235 7.906 1.00 0.00 H new ATOM 0 HG2 LYS A 112 6.138 -13.601 6.904 1.00 0.00 H new ATOM 0 HG3 LYS A 112 7.878 -13.475 6.738 1.00 0.00 H new ATOM 0 HD2 LYS A 112 7.778 -12.760 9.293 1.00 0.00 H new ATOM 0 HD3 LYS A 112 6.217 -13.555 9.255 1.00 0.00 H new ATOM 0 HE2 LYS A 112 7.918 -15.353 7.929 1.00 0.00 H new ATOM 0 HE3 LYS A 112 8.907 -14.724 9.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 7.667 -16.667 9.932 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 7.153 -15.306 10.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 6.195 -15.915 9.545 1.00 0.00 H new ATOM 1848 N ILE A 113 6.120 -8.772 5.825 1.00 0.00 N ATOM 1849 CA ILE A 113 5.364 -7.530 5.924 1.00 0.00 C ATOM 1850 C ILE A 113 4.447 -7.348 4.719 1.00 0.00 C ATOM 1851 O ILE A 113 3.306 -6.908 4.857 1.00 0.00 O ATOM 1852 CB ILE A 113 6.298 -6.308 6.036 1.00 0.00 C ATOM 1853 CG1 ILE A 113 7.224 -6.229 4.823 1.00 0.00 C ATOM 1854 CG2 ILE A 113 7.113 -6.374 7.321 1.00 0.00 C ATOM 1855 CD1 ILE A 113 8.176 -5.054 4.867 1.00 0.00 C ATOM 0 H ILE A 113 7.125 -8.646 5.705 1.00 0.00 H new ATOM 0 HA ILE A 113 4.761 -7.599 6.829 1.00 0.00 H new ATOM 0 HB ILE A 113 5.683 -5.408 6.062 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.801 -7.151 4.755 1.00 0.00 H new ATOM 0 HG13 ILE A 113 6.620 -6.163 3.918 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.766 -5.504 7.383 1.00 0.00 H new ATOM 0 HG22 ILE A 113 6.440 -6.384 8.178 1.00 0.00 H new ATOM 0 HG23 ILE A 113 7.717 -7.282 7.323 1.00 0.00 H new ATOM 0 HD11 ILE A 113 8.803 -5.060 3.975 1.00 0.00 H new ATOM 0 HD12 ILE A 113 7.606 -4.125 4.904 1.00 0.00 H new ATOM 0 HD13 ILE A 113 8.806 -5.129 5.754 1.00 0.00 H new ATOM 1867 N ALA A 114 4.952 -7.694 3.539 1.00 0.00 N ATOM 1868 CA ALA A 114 4.173 -7.572 2.313 1.00 0.00 C ATOM 1869 C ALA A 114 3.069 -8.622 2.268 1.00 0.00 C ATOM 1870 O ALA A 114 1.947 -8.340 1.847 1.00 0.00 O ATOM 1871 CB ALA A 114 5.078 -7.701 1.096 1.00 0.00 C ATOM 0 H ALA A 114 5.895 -8.060 3.406 1.00 0.00 H new ATOM 0 HA ALA A 114 3.708 -6.586 2.299 1.00 0.00 H new ATOM 0 HB1 ALA A 114 4.482 -7.608 0.188 1.00 0.00 H new ATOM 0 HB2 ALA A 114 5.832 -6.914 1.118 1.00 0.00 H new ATOM 0 HB3 ALA A 114 5.569 -8.674 1.109 1.00 0.00 H new ATOM 1877 N GLN A 115 3.396 -9.832 2.709 1.00 0.00 N ATOM 1878 CA GLN A 115 2.434 -10.927 2.723 1.00 0.00 C ATOM 1879 C GLN A 115 1.355 -10.692 3.776 1.00 0.00 C ATOM 1880 O GLN A 115 0.235 -11.185 3.648 1.00 0.00 O ATOM 1881 CB GLN A 115 3.144 -12.254 2.991 1.00 0.00 C ATOM 1882 CG GLN A 115 3.958 -12.758 1.811 1.00 0.00 C ATOM 1883 CD GLN A 115 3.207 -13.778 0.978 1.00 0.00 C ATOM 1884 OE1 GLN A 115 2.560 -14.678 1.513 1.00 0.00 O ATOM 1885 NE2 GLN A 115 3.288 -13.641 -0.341 1.00 0.00 N ATOM 0 H GLN A 115 4.321 -10.079 3.062 1.00 0.00 H new ATOM 0 HA GLN A 115 1.957 -10.970 1.744 1.00 0.00 H new ATOM 0 HB2 GLN A 115 3.802 -12.137 3.852 1.00 0.00 H new ATOM 0 HB3 GLN A 115 2.402 -13.006 3.257 1.00 0.00 H new ATOM 0 HG2 GLN A 115 4.238 -11.914 1.180 1.00 0.00 H new ATOM 0 HG3 GLN A 115 4.883 -13.203 2.176 1.00 0.00 H new ATOM 0 HE21 GLN A 115 3.836 -12.880 -0.742 1.00 0.00 H new ATOM 0 HE22 GLN A 115 2.802 -14.297 -0.953 1.00 0.00 H new ATOM 1894 N ASP A 116 1.696 -9.937 4.815 1.00 0.00 N ATOM 1895 CA ASP A 116 0.751 -9.640 5.886 1.00 0.00 C ATOM 1896 C ASP A 116 0.032 -8.315 5.638 1.00 0.00 C ATOM 1897 O ASP A 116 -0.972 -8.016 6.285 1.00 0.00 O ATOM 1898 CB ASP A 116 1.474 -9.596 7.234 1.00 0.00 C ATOM 1899 CG ASP A 116 0.515 -9.449 8.399 1.00 0.00 C ATOM 1900 OD1 ASP A 116 -0.226 -10.414 8.684 1.00 0.00 O ATOM 1901 OD2 ASP A 116 0.504 -8.369 9.026 1.00 0.00 O ATOM 0 H ASP A 116 2.619 -9.520 4.938 1.00 0.00 H new ATOM 0 HA ASP A 116 0.005 -10.435 5.904 1.00 0.00 H new ATOM 0 HB2 ASP A 116 2.058 -10.508 7.360 1.00 0.00 H new ATOM 0 HB3 ASP A 116 2.178 -8.764 7.239 1.00 0.00 H new ATOM 1906 N PHE A 117 0.549 -7.523 4.702 1.00 0.00 N ATOM 1907 CA PHE A 117 -0.045 -6.232 4.376 1.00 0.00 C ATOM 1908 C PHE A 117 -1.514 -6.383 3.990 1.00 0.00 C ATOM 1909 O PHE A 117 -2.371 -5.642 4.474 1.00 0.00 O ATOM 1910 CB PHE A 117 0.726 -5.570 3.234 1.00 0.00 C ATOM 1911 CG PHE A 117 0.499 -4.089 3.137 1.00 0.00 C ATOM 1912 CD1 PHE A 117 0.799 -3.259 4.205 1.00 0.00 C ATOM 1913 CD2 PHE A 117 -0.014 -3.528 1.979 1.00 0.00 C ATOM 1914 CE1 PHE A 117 0.591 -1.895 4.120 1.00 0.00 C ATOM 1915 CE2 PHE A 117 -0.223 -2.165 1.888 1.00 0.00 C ATOM 1916 CZ PHE A 117 0.079 -1.347 2.960 1.00 0.00 C ATOM 0 H PHE A 117 1.379 -7.754 4.156 1.00 0.00 H new ATOM 0 HA PHE A 117 0.013 -5.602 5.263 1.00 0.00 H new ATOM 0 HB2 PHE A 117 1.791 -5.758 3.368 1.00 0.00 H new ATOM 0 HB3 PHE A 117 0.436 -6.036 2.292 1.00 0.00 H new ATOM 0 HD1 PHE A 117 1.200 -3.682 5.114 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -0.253 -4.163 1.138 1.00 0.00 H new ATOM 0 HE1 PHE A 117 0.829 -1.259 4.960 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -0.622 -1.739 0.979 1.00 0.00 H new ATOM 0 HZ PHE A 117 -0.085 -0.282 2.891 1.00 0.00 H new ATOM 1926 N LEU A 118 -1.799 -7.341 3.115 1.00 0.00 N ATOM 1927 CA LEU A 118 -3.165 -7.583 2.663 1.00 0.00 C ATOM 1928 C LEU A 118 -3.709 -8.893 3.226 1.00 0.00 C ATOM 1929 O LEU A 118 -4.581 -9.521 2.626 1.00 0.00 O ATOM 1930 CB LEU A 118 -3.222 -7.608 1.134 1.00 0.00 C ATOM 1931 CG LEU A 118 -2.620 -6.385 0.437 1.00 0.00 C ATOM 1932 CD1 LEU A 118 -2.926 -6.417 -1.052 1.00 0.00 C ATOM 1933 CD2 LEU A 118 -3.144 -5.100 1.061 1.00 0.00 C ATOM 0 H LEU A 118 -1.103 -7.963 2.704 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.788 -6.768 3.031 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.702 -8.499 0.782 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -4.263 -7.705 0.827 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.538 -6.413 0.568 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -2.491 -5.540 -1.532 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -2.501 -7.320 -1.491 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -4.006 -6.414 -1.202 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -2.704 -4.243 0.552 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -4.229 -5.064 0.962 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -2.875 -5.072 2.117 1.00 0.00 H new ATOM 1945 N GLN A 119 -3.191 -9.299 4.380 1.00 0.00 N ATOM 1946 CA GLN A 119 -3.630 -10.535 5.021 1.00 0.00 C ATOM 1947 C GLN A 119 -3.396 -11.736 4.110 1.00 0.00 C ATOM 1948 O GLN A 119 -4.224 -12.644 4.036 1.00 0.00 O ATOM 1949 CB GLN A 119 -5.110 -10.443 5.396 1.00 0.00 C ATOM 1950 CG GLN A 119 -5.481 -9.146 6.096 1.00 0.00 C ATOM 1951 CD GLN A 119 -6.944 -9.094 6.490 1.00 0.00 C ATOM 1952 OE1 GLN A 119 -7.422 -9.928 7.259 1.00 0.00 O ATOM 1953 NE2 GLN A 119 -7.664 -8.110 5.963 1.00 0.00 N ATOM 0 H GLN A 119 -2.468 -8.792 4.891 1.00 0.00 H new ATOM 0 HA GLN A 119 -3.041 -10.672 5.928 1.00 0.00 H new ATOM 0 HB2 GLN A 119 -5.712 -10.544 4.493 1.00 0.00 H new ATOM 0 HB3 GLN A 119 -5.365 -11.282 6.044 1.00 0.00 H new ATOM 0 HG2 GLN A 119 -4.864 -9.029 6.987 1.00 0.00 H new ATOM 0 HG3 GLN A 119 -5.255 -8.306 5.440 1.00 0.00 H new ATOM 0 HE21 GLN A 119 -7.227 -7.441 5.330 1.00 0.00 H new ATOM 0 HE22 GLN A 119 -8.654 -8.024 6.192 1.00 0.00 H new ATOM 1962 N LEU A 120 -2.262 -11.733 3.418 1.00 0.00 N ATOM 1963 CA LEU A 120 -1.915 -12.821 2.510 1.00 0.00 C ATOM 1964 C LEU A 120 -1.044 -13.859 3.212 1.00 0.00 C ATOM 1965 O LEU A 120 -0.074 -14.359 2.642 1.00 0.00 O ATOM 1966 CB LEU A 120 -1.180 -12.275 1.280 1.00 0.00 C ATOM 1967 CG LEU A 120 -1.618 -10.882 0.820 1.00 0.00 C ATOM 1968 CD1 LEU A 120 -0.494 -10.191 0.065 1.00 0.00 C ATOM 1969 CD2 LEU A 120 -2.866 -10.977 -0.043 1.00 0.00 C ATOM 0 H LEU A 120 -1.566 -10.989 3.468 1.00 0.00 H new ATOM 0 HA LEU A 120 -2.840 -13.301 2.191 1.00 0.00 H new ATOM 0 HB2 LEU A 120 -0.112 -12.249 1.498 1.00 0.00 H new ATOM 0 HB3 LEU A 120 -1.320 -12.973 0.454 1.00 0.00 H new ATOM 0 HG LEU A 120 -1.854 -10.285 1.701 1.00 0.00 H new ATOM 0 HD11 LEU A 120 -0.824 -9.202 -0.254 1.00 0.00 H new ATOM 0 HD12 LEU A 120 0.374 -10.091 0.716 1.00 0.00 H new ATOM 0 HD13 LEU A 120 -0.225 -10.783 -0.810 1.00 0.00 H new ATOM 0 HD21 LEU A 120 -3.165 -9.978 -0.362 1.00 0.00 H new ATOM 0 HD22 LEU A 120 -2.657 -11.590 -0.919 1.00 0.00 H new ATOM 0 HD23 LEU A 120 -3.673 -11.430 0.533 1.00 0.00 H new ATOM 1981 N SER A 121 -1.395 -14.180 4.454 1.00 0.00 N ATOM 1982 CA SER A 121 -0.644 -15.158 5.232 1.00 0.00 C ATOM 1983 C SER A 121 -1.565 -16.246 5.774 1.00 0.00 C ATOM 1984 O SER A 121 -2.779 -16.200 5.580 1.00 0.00 O ATOM 1985 CB SER A 121 0.086 -14.469 6.386 1.00 0.00 C ATOM 1986 OG SER A 121 1.364 -15.043 6.597 1.00 0.00 O ATOM 0 H SER A 121 -2.195 -13.777 4.942 1.00 0.00 H new ATOM 0 HA SER A 121 0.089 -15.624 4.574 1.00 0.00 H new ATOM 0 HB2 SER A 121 0.193 -13.406 6.170 1.00 0.00 H new ATOM 0 HB3 SER A 121 -0.508 -14.551 7.296 1.00 0.00 H new ATOM 0 HG SER A 121 1.811 -14.584 7.339 1.00 0.00 H new ATOM 1992 N LYS A 122 -0.977 -17.225 6.455 1.00 0.00 N ATOM 1993 CA LYS A 122 -1.744 -18.326 7.027 1.00 0.00 C ATOM 1994 C LYS A 122 -2.722 -17.815 8.084 1.00 0.00 C ATOM 1995 O LYS A 122 -2.307 -17.306 9.126 1.00 0.00 O ATOM 1996 CB LYS A 122 -0.803 -19.362 7.645 1.00 0.00 C ATOM 1997 CG LYS A 122 -0.301 -20.397 6.653 1.00 0.00 C ATOM 1998 CD LYS A 122 -1.305 -21.523 6.468 1.00 0.00 C ATOM 1999 CE LYS A 122 -1.093 -22.248 5.148 1.00 0.00 C ATOM 2000 NZ LYS A 122 -2.000 -23.421 5.006 1.00 0.00 N ATOM 0 H LYS A 122 0.028 -17.278 6.624 1.00 0.00 H new ATOM 0 HA LYS A 122 -2.315 -18.795 6.226 1.00 0.00 H new ATOM 0 HB2 LYS A 122 0.052 -18.848 8.084 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -1.321 -19.871 8.458 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -0.108 -19.919 5.693 1.00 0.00 H new ATOM 0 HG3 LYS A 122 0.647 -20.807 7.001 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -1.215 -22.231 7.292 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -2.317 -21.119 6.504 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -1.262 -21.556 4.323 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -0.057 -22.580 5.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -1.824 -23.888 4.093 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -1.821 -24.094 5.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -2.989 -23.102 5.047 1.00 0.00 H new ATOM 2014 N PRO A 123 -4.039 -17.942 7.836 1.00 0.00 N ATOM 2015 CA PRO A 123 -5.065 -17.488 8.779 1.00 0.00 C ATOM 2016 C PRO A 123 -5.095 -18.326 10.052 1.00 0.00 C ATOM 2017 O PRO A 123 -5.170 -19.553 9.997 1.00 0.00 O ATOM 2018 CB PRO A 123 -6.371 -17.655 7.998 1.00 0.00 C ATOM 2019 CG PRO A 123 -6.077 -18.711 6.989 1.00 0.00 C ATOM 2020 CD PRO A 123 -4.629 -18.538 6.622 1.00 0.00 C ATOM 0 HA PRO A 123 -4.883 -16.467 9.115 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -7.189 -17.951 8.654 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -6.668 -16.722 7.519 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -6.260 -19.704 7.398 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -6.717 -18.604 6.113 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -4.161 -19.490 6.373 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -4.509 -17.888 5.756 1.00 0.00 H new ATOM 2028 N ASN A 124 -5.034 -17.655 11.198 1.00 0.00 N ATOM 2029 CA ASN A 124 -5.054 -18.339 12.486 1.00 0.00 C ATOM 2030 C ASN A 124 -3.862 -19.281 12.621 1.00 0.00 C ATOM 2031 O ASN A 124 -2.958 -19.216 11.762 1.00 0.00 O ATOM 2032 CB ASN A 124 -6.360 -19.120 12.653 1.00 0.00 C ATOM 2033 CG ASN A 124 -6.911 -19.029 14.061 1.00 0.00 C ATOM 2034 OD1 ASN A 124 -7.527 -18.031 14.436 1.00 0.00 O ATOM 2035 ND2 ASN A 124 -6.693 -20.075 14.851 1.00 0.00 N ATOM 2036 OXT ASN A 124 -3.845 -20.077 13.583 1.00 0.00 O ATOM 0 H ASN A 124 -4.970 -16.639 11.261 1.00 0.00 H new ATOM 0 HA ASN A 124 -4.988 -17.585 13.270 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -7.101 -18.738 11.950 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -6.190 -20.166 12.399 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -7.041 -20.071 15.810 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -6.177 -20.882 14.499 1.00 0.00 H new TER 2043 ASN A 124