USER MOD reduce.3.24.130724 H: found=0, std=0, add=938, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 940 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 48 MET CE :methyl -117:sc= -0.506 (180deg=-0.947) USER MOD Set 1.2: A 56 LYS NZ :NH3+ -144:sc= -0.435 (180deg=-0.409) USER MOD Single : A 8 ASN : amide:sc= 0 X(o=0,f=-0.088) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 THR OG1 : rot 180:sc=-0.00448 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot -4:sc= 0.455 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 ASN : amide:sc= -1.95! C(o=-1.9!,f=-9.4!) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot -137:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ -165:sc=-0.00178 (180deg=-0.1) USER MOD Single : A 51 SER OG : rot 111:sc= 0.0852 USER MOD Single : A 52 THR OG1 : rot 100:sc= 0.0204 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 HIS : no HD1:sc= -0.0446 X(o=-0.045,f=0) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 TYR OH : rot 70:sc= -1.81 USER MOD Single : A 64 THR OG1 : rot 121:sc= -0.464 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 CYS SG : rot 110:sc= -1.79 USER MOD Single : A 77 SER OG : rot 39:sc= 0.163 USER MOD Single : A 78 ASN : amide:sc= -0.922 K(o=-0.92,f=-5.7!) USER MOD Single : A 82 TYR OH : rot 150:sc= -3.75! USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 HIS : no HD1:sc=-0.00235 X(o=-0.0024,f=-0.13) USER MOD Single : A 98 CYS SG : rot 92:sc= 0.424 USER MOD Single : A 99 THR OG1 : rot 71:sc= 1.21 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 THR OG1 : rot 180:sc= -0.24 USER MOD Single : A 105 HIS : no HD1:sc= -1.48 X(o=-1.5,f=-1.2) USER MOD Single : A 117 ASN : amide:sc= -0.231 X(o=-0.23,f=-0.58) USER MOD Single : A 118 LYS NZ :NH3+ -113:sc= -0.484 (180deg=-1.72) USER MOD Single : A 120 CYS SG : rot -22:sc= -4.86! USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 59 N GLY A 7 0.434 18.775 5.120 1.00 0.00 N ATOM 60 CA GLY A 7 1.226 17.653 5.588 1.00 0.00 C ATOM 61 C GLY A 7 0.456 16.756 6.537 1.00 0.00 C ATOM 62 O GLY A 7 0.020 15.670 6.159 1.00 0.00 O ATOM 0 HA2 GLY A 7 1.563 17.068 4.732 1.00 0.00 H new ATOM 0 HA3 GLY A 7 2.119 18.026 6.090 1.00 0.00 H new ATOM 66 N ASN A 8 0.291 17.211 7.775 1.00 0.00 N ATOM 67 CA ASN A 8 -0.429 16.440 8.783 1.00 0.00 C ATOM 68 C ASN A 8 -1.600 15.688 8.158 1.00 0.00 C ATOM 69 O ASN A 8 -1.778 14.491 8.388 1.00 0.00 O ATOM 70 CB ASN A 8 -0.936 17.362 9.894 1.00 0.00 C ATOM 71 CG ASN A 8 -1.150 16.627 11.202 1.00 0.00 C ATOM 72 OD1 ASN A 8 -2.061 15.808 11.325 1.00 0.00 O ATOM 73 ND2 ASN A 8 -0.310 16.918 12.189 1.00 0.00 N ATOM 0 H ASN A 8 0.646 18.109 8.104 1.00 0.00 H new ATOM 0 HA ASN A 8 0.261 15.713 9.210 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -0.220 18.170 10.047 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -1.873 17.822 9.581 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -0.406 16.456 13.093 1.00 0.00 H new ATOM 0 HD22 ASN A 8 0.431 17.604 12.043 1.00 0.00 H new ATOM 80 N THR A 9 -2.397 16.398 7.365 1.00 0.00 N ATOM 81 CA THR A 9 -3.551 15.798 6.706 1.00 0.00 C ATOM 82 C THR A 9 -3.195 14.449 6.093 1.00 0.00 C ATOM 83 O THR A 9 -3.864 13.446 6.342 1.00 0.00 O ATOM 84 CB THR A 9 -4.110 16.718 5.605 1.00 0.00 C ATOM 85 OG1 THR A 9 -4.661 17.904 6.190 1.00 0.00 O ATOM 86 CG2 THR A 9 -5.180 16.003 4.794 1.00 0.00 C ATOM 0 H THR A 9 -2.264 17.389 7.164 1.00 0.00 H new ATOM 0 HA THR A 9 -4.313 15.656 7.472 1.00 0.00 H new ATOM 0 HB THR A 9 -3.291 16.989 4.938 1.00 0.00 H new ATOM 0 HG1 THR A 9 -5.013 18.484 5.483 1.00 0.00 H new ATOM 0 HG21 THR A 9 -5.560 16.673 4.022 1.00 0.00 H new ATOM 0 HG22 THR A 9 -4.751 15.117 4.326 1.00 0.00 H new ATOM 0 HG23 THR A 9 -5.997 15.706 5.451 1.00 0.00 H new ATOM 94 N LEU A 10 -2.136 14.430 5.291 1.00 0.00 N ATOM 95 CA LEU A 10 -1.689 13.202 4.642 1.00 0.00 C ATOM 96 C LEU A 10 -0.978 12.289 5.635 1.00 0.00 C ATOM 97 O LEU A 10 -1.176 11.074 5.628 1.00 0.00 O ATOM 98 CB LEU A 10 -0.757 13.529 3.474 1.00 0.00 C ATOM 99 CG LEU A 10 -1.318 14.477 2.413 1.00 0.00 C ATOM 100 CD1 LEU A 10 -0.212 14.949 1.481 1.00 0.00 C ATOM 101 CD2 LEU A 10 -2.429 13.798 1.625 1.00 0.00 C ATOM 0 H LEU A 10 -1.571 15.251 5.074 1.00 0.00 H new ATOM 0 HA LEU A 10 -2.568 12.680 4.262 1.00 0.00 H new ATOM 0 HB2 LEU A 10 0.157 13.966 3.876 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -0.477 12.595 2.987 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.737 15.348 2.916 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -0.630 15.623 0.733 1.00 0.00 H new ATOM 0 HD12 LEU A 10 0.550 15.474 2.057 1.00 0.00 H new ATOM 0 HD13 LEU A 10 0.237 14.089 0.985 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -2.816 14.487 0.875 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -2.035 12.909 1.132 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -3.233 13.511 2.303 1.00 0.00 H new ATOM 113 N ARG A 11 -0.150 12.883 6.489 1.00 0.00 N ATOM 114 CA ARG A 11 0.590 12.123 7.489 1.00 0.00 C ATOM 115 C ARG A 11 -0.311 11.094 8.167 1.00 0.00 C ATOM 116 O ARG A 11 0.080 9.943 8.357 1.00 0.00 O ATOM 117 CB ARG A 11 1.186 13.064 8.537 1.00 0.00 C ATOM 118 CG ARG A 11 1.933 12.344 9.648 1.00 0.00 C ATOM 119 CD ARG A 11 1.956 13.166 10.927 1.00 0.00 C ATOM 120 NE ARG A 11 3.091 14.085 10.966 1.00 0.00 N ATOM 121 CZ ARG A 11 4.344 13.697 11.170 1.00 0.00 C ATOM 122 NH1 ARG A 11 4.623 12.414 11.352 1.00 0.00 N ATOM 123 NH2 ARG A 11 5.322 14.594 11.192 1.00 0.00 N ATOM 0 H ARG A 11 0.025 13.888 6.508 1.00 0.00 H new ATOM 0 HA ARG A 11 1.398 11.595 6.983 1.00 0.00 H new ATOM 0 HB2 ARG A 11 1.866 13.759 8.044 1.00 0.00 H new ATOM 0 HB3 ARG A 11 0.385 13.659 8.976 1.00 0.00 H new ATOM 0 HG2 ARG A 11 1.460 11.381 9.841 1.00 0.00 H new ATOM 0 HG3 ARG A 11 2.954 12.139 9.328 1.00 0.00 H new ATOM 0 HD2 ARG A 11 1.028 13.732 11.011 1.00 0.00 H new ATOM 0 HD3 ARG A 11 2.001 12.498 11.787 1.00 0.00 H new ATOM 0 HE ARG A 11 2.911 15.080 10.829 1.00 0.00 H new ATOM 0 HH11 ARG A 11 3.874 11.722 11.335 1.00 0.00 H new ATOM 0 HH12 ARG A 11 5.587 12.119 11.509 1.00 0.00 H new ATOM 0 HH21 ARG A 11 5.111 15.582 11.052 1.00 0.00 H new ATOM 0 HH22 ARG A 11 6.285 14.295 11.349 1.00 0.00 H new ATOM 137 N GLU A 12 -1.517 11.519 8.529 1.00 0.00 N ATOM 138 CA GLU A 12 -2.472 10.635 9.187 1.00 0.00 C ATOM 139 C GLU A 12 -2.927 9.526 8.242 1.00 0.00 C ATOM 140 O GLU A 12 -3.059 8.369 8.643 1.00 0.00 O ATOM 141 CB GLU A 12 -3.684 11.431 9.677 1.00 0.00 C ATOM 142 CG GLU A 12 -3.334 12.514 10.684 1.00 0.00 C ATOM 143 CD GLU A 12 -4.554 13.265 11.181 1.00 0.00 C ATOM 144 OE1 GLU A 12 -5.308 13.795 10.339 1.00 0.00 O ATOM 145 OE2 GLU A 12 -4.754 13.321 12.412 1.00 0.00 O ATOM 0 H GLU A 12 -1.856 12.469 8.378 1.00 0.00 H new ATOM 0 HA GLU A 12 -1.975 10.179 10.043 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -4.178 11.889 8.820 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -4.401 10.745 10.128 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -2.819 12.063 11.532 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -2.639 13.219 10.227 1.00 0.00 H new ATOM 152 N LEU A 13 -3.165 9.888 6.987 1.00 0.00 N ATOM 153 CA LEU A 13 -3.606 8.924 5.984 1.00 0.00 C ATOM 154 C LEU A 13 -2.626 7.759 5.880 1.00 0.00 C ATOM 155 O LEU A 13 -3.032 6.604 5.751 1.00 0.00 O ATOM 156 CB LEU A 13 -3.751 9.606 4.622 1.00 0.00 C ATOM 157 CG LEU A 13 -4.119 8.694 3.451 1.00 0.00 C ATOM 158 CD1 LEU A 13 -5.581 8.282 3.535 1.00 0.00 C ATOM 159 CD2 LEU A 13 -3.834 9.387 2.126 1.00 0.00 C ATOM 0 H LEU A 13 -3.060 10.841 6.639 1.00 0.00 H new ATOM 0 HA LEU A 13 -4.575 8.533 6.293 1.00 0.00 H new ATOM 0 HB2 LEU A 13 -4.512 10.382 4.706 1.00 0.00 H new ATOM 0 HB3 LEU A 13 -2.811 10.106 4.386 1.00 0.00 H new ATOM 0 HG LEU A 13 -3.505 7.795 3.508 1.00 0.00 H new ATOM 0 HD11 LEU A 13 -5.825 7.633 2.694 1.00 0.00 H new ATOM 0 HD12 LEU A 13 -5.755 7.747 4.468 1.00 0.00 H new ATOM 0 HD13 LEU A 13 -6.212 9.170 3.503 1.00 0.00 H new ATOM 0 HD21 LEU A 13 -4.102 8.724 1.304 1.00 0.00 H new ATOM 0 HD22 LEU A 13 -4.422 10.302 2.060 1.00 0.00 H new ATOM 0 HD23 LEU A 13 -2.774 9.632 2.064 1.00 0.00 H new ATOM 171 N ARG A 14 -1.336 8.071 5.939 1.00 0.00 N ATOM 172 CA ARG A 14 -0.298 7.051 5.853 1.00 0.00 C ATOM 173 C ARG A 14 -0.423 6.051 6.999 1.00 0.00 C ATOM 174 O ARG A 14 -0.641 4.859 6.777 1.00 0.00 O ATOM 175 CB ARG A 14 1.087 7.698 5.876 1.00 0.00 C ATOM 176 CG ARG A 14 1.550 8.195 4.516 1.00 0.00 C ATOM 177 CD ARG A 14 2.989 8.684 4.562 1.00 0.00 C ATOM 178 NE ARG A 14 3.834 7.823 5.385 1.00 0.00 N ATOM 179 CZ ARG A 14 3.947 7.947 6.703 1.00 0.00 C ATOM 180 NH1 ARG A 14 3.272 8.892 7.343 1.00 0.00 N ATOM 181 NH2 ARG A 14 4.736 7.125 7.382 1.00 0.00 N ATOM 0 H ARG A 14 -0.984 9.022 6.046 1.00 0.00 H new ATOM 0 HA ARG A 14 -0.426 6.517 4.911 1.00 0.00 H new ATOM 0 HB2 ARG A 14 1.076 8.535 6.575 1.00 0.00 H new ATOM 0 HB3 ARG A 14 1.810 6.976 6.255 1.00 0.00 H new ATOM 0 HG2 ARG A 14 1.461 7.392 3.784 1.00 0.00 H new ATOM 0 HG3 ARG A 14 0.900 9.004 4.182 1.00 0.00 H new ATOM 0 HD2 ARG A 14 3.390 8.725 3.549 1.00 0.00 H new ATOM 0 HD3 ARG A 14 3.014 9.700 4.956 1.00 0.00 H new ATOM 0 HE ARG A 14 4.367 7.086 4.923 1.00 0.00 H new ATOM 0 HH11 ARG A 14 2.664 9.526 6.823 1.00 0.00 H new ATOM 0 HH12 ARG A 14 3.360 8.985 8.355 1.00 0.00 H new ATOM 0 HH21 ARG A 14 5.256 6.397 6.892 1.00 0.00 H new ATOM 0 HH22 ARG A 14 4.822 7.221 8.394 1.00 0.00 H new ATOM 195 N LEU A 15 -0.282 6.543 8.225 1.00 0.00 N ATOM 196 CA LEU A 15 -0.379 5.693 9.407 1.00 0.00 C ATOM 197 C LEU A 15 -1.701 4.934 9.425 1.00 0.00 C ATOM 198 O LEU A 15 -1.750 3.760 9.793 1.00 0.00 O ATOM 199 CB LEU A 15 -0.243 6.535 10.677 1.00 0.00 C ATOM 200 CG LEU A 15 1.090 7.260 10.863 1.00 0.00 C ATOM 201 CD1 LEU A 15 0.945 8.394 11.865 1.00 0.00 C ATOM 202 CD2 LEU A 15 2.169 6.285 11.310 1.00 0.00 C ATOM 0 H LEU A 15 -0.100 7.526 8.427 1.00 0.00 H new ATOM 0 HA LEU A 15 0.434 4.968 9.371 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -1.041 7.277 10.684 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -0.404 5.886 11.538 1.00 0.00 H new ATOM 0 HG LEU A 15 1.388 7.686 9.905 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.904 8.899 11.985 1.00 0.00 H new ATOM 0 HD12 LEU A 15 0.203 9.106 11.504 1.00 0.00 H new ATOM 0 HD13 LEU A 15 0.624 7.992 12.826 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.111 6.818 11.437 1.00 0.00 H new ATOM 0 HD22 LEU A 15 1.879 5.830 12.257 1.00 0.00 H new ATOM 0 HD23 LEU A 15 2.291 5.507 10.556 1.00 0.00 H new ATOM 214 N PHE A 16 -2.772 5.611 9.023 1.00 0.00 N ATOM 215 CA PHE A 16 -4.096 4.999 8.992 1.00 0.00 C ATOM 216 C PHE A 16 -4.109 3.778 8.077 1.00 0.00 C ATOM 217 O PHE A 16 -4.493 2.683 8.490 1.00 0.00 O ATOM 218 CB PHE A 16 -5.139 6.015 8.521 1.00 0.00 C ATOM 219 CG PHE A 16 -6.393 5.383 7.988 1.00 0.00 C ATOM 220 CD1 PHE A 16 -7.095 4.460 8.746 1.00 0.00 C ATOM 221 CD2 PHE A 16 -6.870 5.713 6.730 1.00 0.00 C ATOM 222 CE1 PHE A 16 -8.249 3.876 8.258 1.00 0.00 C ATOM 223 CE2 PHE A 16 -8.024 5.133 6.237 1.00 0.00 C ATOM 224 CZ PHE A 16 -8.715 4.214 7.003 1.00 0.00 C ATOM 0 H PHE A 16 -2.749 6.583 8.714 1.00 0.00 H new ATOM 0 HA PHE A 16 -4.344 4.676 10.003 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -5.397 6.671 9.353 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -4.699 6.642 7.745 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -6.737 4.194 9.729 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -6.334 6.432 6.128 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -8.786 3.156 8.858 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -8.385 5.398 5.254 1.00 0.00 H new ATOM 0 HZ PHE A 16 -9.618 3.761 6.621 1.00 0.00 H new ATOM 234 N LEU A 17 -3.689 3.975 6.832 1.00 0.00 N ATOM 235 CA LEU A 17 -3.653 2.890 5.857 1.00 0.00 C ATOM 236 C LEU A 17 -2.632 1.830 6.258 1.00 0.00 C ATOM 237 O LEU A 17 -2.979 0.667 6.462 1.00 0.00 O ATOM 238 CB LEU A 17 -3.317 3.438 4.468 1.00 0.00 C ATOM 239 CG LEU A 17 -4.372 4.342 3.830 1.00 0.00 C ATOM 240 CD1 LEU A 17 -3.871 4.892 2.503 1.00 0.00 C ATOM 241 CD2 LEU A 17 -5.677 3.584 3.637 1.00 0.00 C ATOM 0 H LEU A 17 -3.369 4.875 6.474 1.00 0.00 H new ATOM 0 HA LEU A 17 -4.639 2.426 5.830 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -2.383 3.995 4.536 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.138 2.595 3.800 1.00 0.00 H new ATOM 0 HG LEU A 17 -4.558 5.181 4.500 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -4.635 5.533 2.063 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -2.963 5.471 2.669 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -3.656 4.066 1.825 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -6.417 4.243 3.182 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -5.507 2.726 2.987 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -6.044 3.240 4.604 1.00 0.00 H new ATOM 253 N ARG A 18 -1.373 2.241 6.373 1.00 0.00 N ATOM 254 CA ARG A 18 -0.303 1.327 6.751 1.00 0.00 C ATOM 255 C ARG A 18 -0.759 0.386 7.862 1.00 0.00 C ATOM 256 O ARG A 18 -0.607 -0.831 7.760 1.00 0.00 O ATOM 257 CB ARG A 18 0.929 2.112 7.207 1.00 0.00 C ATOM 258 CG ARG A 18 2.208 1.291 7.206 1.00 0.00 C ATOM 259 CD ARG A 18 3.237 1.863 8.169 1.00 0.00 C ATOM 260 NE ARG A 18 4.220 0.862 8.578 1.00 0.00 N ATOM 261 CZ ARG A 18 5.361 1.160 9.189 1.00 0.00 C ATOM 262 NH1 ARG A 18 5.662 2.422 9.461 1.00 0.00 N ATOM 263 NH2 ARG A 18 6.204 0.193 9.530 1.00 0.00 N ATOM 0 H ARG A 18 -1.070 3.201 6.210 1.00 0.00 H new ATOM 0 HA ARG A 18 -0.043 0.730 5.877 1.00 0.00 H new ATOM 0 HB2 ARG A 18 1.061 2.976 6.555 1.00 0.00 H new ATOM 0 HB3 ARG A 18 0.754 2.495 8.212 1.00 0.00 H new ATOM 0 HG2 ARG A 18 1.981 0.262 7.483 1.00 0.00 H new ATOM 0 HG3 ARG A 18 2.625 1.266 6.199 1.00 0.00 H new ATOM 0 HD2 ARG A 18 3.749 2.702 7.697 1.00 0.00 H new ATOM 0 HD3 ARG A 18 2.730 2.255 9.051 1.00 0.00 H new ATOM 0 HE ARG A 18 4.019 -0.119 8.384 1.00 0.00 H new ATOM 0 HH11 ARG A 18 5.016 3.168 9.201 1.00 0.00 H new ATOM 0 HH12 ARG A 18 6.539 2.647 9.930 1.00 0.00 H new ATOM 0 HH21 ARG A 18 5.976 -0.779 9.323 1.00 0.00 H new ATOM 0 HH22 ARG A 18 7.080 0.422 9.999 1.00 0.00 H new ATOM 277 N ASP A 19 -1.318 0.958 8.923 1.00 0.00 N ATOM 278 CA ASP A 19 -1.797 0.171 10.053 1.00 0.00 C ATOM 279 C ASP A 19 -2.722 -0.948 9.583 1.00 0.00 C ATOM 280 O ASP A 19 -2.709 -2.050 10.132 1.00 0.00 O ATOM 281 CB ASP A 19 -2.528 1.067 11.053 1.00 0.00 C ATOM 282 CG ASP A 19 -2.610 0.447 12.434 1.00 0.00 C ATOM 283 OD1 ASP A 19 -3.004 -0.734 12.532 1.00 0.00 O ATOM 284 OD2 ASP A 19 -2.281 1.143 13.417 1.00 0.00 O ATOM 0 H ASP A 19 -1.450 1.964 9.024 1.00 0.00 H new ATOM 0 HA ASP A 19 -0.933 -0.278 10.543 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -2.015 2.027 11.119 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -3.535 1.268 10.688 1.00 0.00 H new ATOM 289 N VAL A 20 -3.524 -0.656 8.564 1.00 0.00 N ATOM 290 CA VAL A 20 -4.456 -1.637 8.020 1.00 0.00 C ATOM 291 C VAL A 20 -3.715 -2.753 7.292 1.00 0.00 C ATOM 292 O VAL A 20 -3.842 -3.928 7.639 1.00 0.00 O ATOM 293 CB VAL A 20 -5.457 -0.982 7.050 1.00 0.00 C ATOM 294 CG1 VAL A 20 -6.336 -2.038 6.397 1.00 0.00 C ATOM 295 CG2 VAL A 20 -6.302 0.053 7.776 1.00 0.00 C ATOM 0 H VAL A 20 -3.547 0.251 8.099 1.00 0.00 H new ATOM 0 HA VAL A 20 -5.002 -2.058 8.864 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.897 -0.474 6.265 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -7.037 -1.557 5.715 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -5.712 -2.738 5.842 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -6.890 -2.577 7.166 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -7.004 0.506 7.076 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -6.854 -0.429 8.582 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -5.654 0.825 8.191 1.00 0.00 H new ATOM 305 N THR A 21 -2.940 -2.379 6.279 1.00 0.00 N ATOM 306 CA THR A 21 -2.179 -3.348 5.500 1.00 0.00 C ATOM 307 C THR A 21 -1.360 -4.260 6.407 1.00 0.00 C ATOM 308 O THR A 21 -1.311 -5.474 6.204 1.00 0.00 O ATOM 309 CB THR A 21 -1.233 -2.650 4.504 1.00 0.00 C ATOM 310 OG1 THR A 21 -1.989 -2.078 3.431 1.00 0.00 O ATOM 311 CG2 THR A 21 -0.214 -3.632 3.947 1.00 0.00 C ATOM 0 H THR A 21 -2.823 -1.411 5.979 1.00 0.00 H new ATOM 0 HA THR A 21 -2.902 -3.945 4.945 1.00 0.00 H new ATOM 0 HB THR A 21 -0.700 -1.860 5.034 1.00 0.00 H new ATOM 0 HG1 THR A 21 -1.381 -1.635 2.803 1.00 0.00 H new ATOM 0 HG21 THR A 21 0.443 -3.117 3.246 1.00 0.00 H new ATOM 0 HG22 THR A 21 0.379 -4.044 4.764 1.00 0.00 H new ATOM 0 HG23 THR A 21 -0.732 -4.440 3.431 1.00 0.00 H new ATOM 319 N LYS A 22 -0.718 -3.669 7.409 1.00 0.00 N ATOM 320 CA LYS A 22 0.098 -4.428 8.349 1.00 0.00 C ATOM 321 C LYS A 22 -0.719 -5.535 9.008 1.00 0.00 C ATOM 322 O LYS A 22 -0.494 -6.719 8.758 1.00 0.00 O ATOM 323 CB LYS A 22 0.676 -3.500 9.419 1.00 0.00 C ATOM 324 CG LYS A 22 1.860 -4.093 10.164 1.00 0.00 C ATOM 325 CD LYS A 22 2.066 -3.420 11.510 1.00 0.00 C ATOM 326 CE LYS A 22 1.111 -3.968 12.559 1.00 0.00 C ATOM 327 NZ LYS A 22 1.145 -3.165 13.813 1.00 0.00 N ATOM 0 H LYS A 22 -0.747 -2.666 7.591 1.00 0.00 H new ATOM 0 HA LYS A 22 0.916 -4.886 7.794 1.00 0.00 H new ATOM 0 HB2 LYS A 22 0.984 -2.566 8.950 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -0.107 -3.254 10.136 1.00 0.00 H new ATOM 0 HG2 LYS A 22 1.700 -5.161 10.311 1.00 0.00 H new ATOM 0 HG3 LYS A 22 2.761 -3.985 9.561 1.00 0.00 H new ATOM 0 HD2 LYS A 22 3.094 -3.569 11.839 1.00 0.00 H new ATOM 0 HD3 LYS A 22 1.917 -2.345 11.407 1.00 0.00 H new ATOM 0 HE2 LYS A 22 0.097 -3.974 12.159 1.00 0.00 H new ATOM 0 HE3 LYS A 22 1.372 -5.002 12.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 0.481 -3.570 14.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 2.107 -3.180 14.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 0.871 -2.184 13.604 1.00 0.00 H new ATOM 341 N ARG A 23 -1.669 -5.141 9.850 1.00 0.00 N ATOM 342 CA ARG A 23 -2.519 -6.100 10.545 1.00 0.00 C ATOM 343 C ARG A 23 -2.804 -7.313 9.664 1.00 0.00 C ATOM 344 O ARG A 23 -2.755 -8.454 10.125 1.00 0.00 O ATOM 345 CB ARG A 23 -3.835 -5.439 10.962 1.00 0.00 C ATOM 346 CG ARG A 23 -4.848 -6.412 11.541 1.00 0.00 C ATOM 347 CD ARG A 23 -6.180 -5.731 11.818 1.00 0.00 C ATOM 348 NE ARG A 23 -7.074 -6.575 12.605 1.00 0.00 N ATOM 349 CZ ARG A 23 -8.118 -6.110 13.282 1.00 0.00 C ATOM 350 NH1 ARG A 23 -8.398 -4.814 13.267 1.00 0.00 N ATOM 351 NH2 ARG A 23 -8.885 -6.942 13.974 1.00 0.00 N ATOM 0 H ARG A 23 -1.869 -4.165 10.067 1.00 0.00 H new ATOM 0 HA ARG A 23 -1.990 -6.436 11.437 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -3.625 -4.664 11.700 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -4.274 -4.944 10.096 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -4.998 -7.239 10.847 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -4.457 -6.839 12.465 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -6.005 -4.795 12.349 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -6.660 -5.477 10.873 1.00 0.00 H new ATOM 0 HE ARG A 23 -6.887 -7.577 12.637 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -7.811 -4.172 12.735 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -9.200 -4.460 13.788 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -8.673 -7.940 13.987 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -9.686 -6.584 14.494 1.00 0.00 H new ATOM 365 N LEU A 24 -3.103 -7.058 8.395 1.00 0.00 N ATOM 366 CA LEU A 24 -3.396 -8.128 7.448 1.00 0.00 C ATOM 367 C LEU A 24 -2.174 -9.015 7.233 1.00 0.00 C ATOM 368 O LEU A 24 -2.261 -10.240 7.318 1.00 0.00 O ATOM 369 CB LEU A 24 -3.856 -7.543 6.112 1.00 0.00 C ATOM 370 CG LEU A 24 -5.005 -6.536 6.181 1.00 0.00 C ATOM 371 CD1 LEU A 24 -5.079 -5.722 4.898 1.00 0.00 C ATOM 372 CD2 LEU A 24 -6.324 -7.248 6.440 1.00 0.00 C ATOM 0 H LEU A 24 -3.149 -6.120 7.998 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.197 -8.738 7.865 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -3.003 -7.059 5.637 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -4.158 -8.365 5.463 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.815 -5.854 7.010 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -5.902 -5.011 4.965 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.143 -5.181 4.756 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.245 -6.390 4.053 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -7.130 -6.516 6.486 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -6.521 -7.954 5.633 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -6.268 -7.785 7.387 1.00 0.00 H new ATOM 384 N ALA A 25 -1.035 -8.388 6.958 1.00 0.00 N ATOM 385 CA ALA A 25 0.206 -9.120 6.736 1.00 0.00 C ATOM 386 C ALA A 25 0.576 -9.957 7.956 1.00 0.00 C ATOM 387 O ALA A 25 0.797 -11.164 7.851 1.00 0.00 O ATOM 388 CB ALA A 25 1.332 -8.157 6.392 1.00 0.00 C ATOM 0 H ALA A 25 -0.946 -7.375 6.884 1.00 0.00 H new ATOM 0 HA ALA A 25 0.054 -9.798 5.896 1.00 0.00 H new ATOM 0 HB1 ALA A 25 2.253 -8.717 6.229 1.00 0.00 H new ATOM 0 HB2 ALA A 25 1.076 -7.607 5.486 1.00 0.00 H new ATOM 0 HB3 ALA A 25 1.475 -7.456 7.214 1.00 0.00 H new ATOM 394 N THR A 26 0.643 -9.307 9.114 1.00 0.00 N ATOM 395 CA THR A 26 0.989 -9.990 10.354 1.00 0.00 C ATOM 396 C THR A 26 0.111 -11.218 10.569 1.00 0.00 C ATOM 397 O THR A 26 0.579 -12.253 11.044 1.00 0.00 O ATOM 398 CB THR A 26 0.849 -9.054 11.569 1.00 0.00 C ATOM 399 OG1 THR A 26 -0.434 -8.419 11.553 1.00 0.00 O ATOM 400 CG2 THR A 26 1.943 -7.998 11.567 1.00 0.00 C ATOM 0 H THR A 26 0.462 -8.309 9.219 1.00 0.00 H new ATOM 0 HA THR A 26 2.029 -10.302 10.263 1.00 0.00 H new ATOM 0 HB THR A 26 0.946 -9.653 12.474 1.00 0.00 H new ATOM 0 HG1 THR A 26 -0.911 -8.666 10.734 1.00 0.00 H new ATOM 0 HG21 THR A 26 1.824 -7.349 12.434 1.00 0.00 H new ATOM 0 HG22 THR A 26 2.918 -8.484 11.609 1.00 0.00 H new ATOM 0 HG23 THR A 26 1.873 -7.403 10.656 1.00 0.00 H new ATOM 408 N ASP A 27 -1.164 -11.096 10.216 1.00 0.00 N ATOM 409 CA ASP A 27 -2.108 -12.197 10.369 1.00 0.00 C ATOM 410 C ASP A 27 -1.688 -13.395 9.523 1.00 0.00 C ATOM 411 O ASP A 27 -1.273 -13.242 8.374 1.00 0.00 O ATOM 412 CB ASP A 27 -3.516 -11.748 9.976 1.00 0.00 C ATOM 413 CG ASP A 27 -4.596 -12.506 10.723 1.00 0.00 C ATOM 414 OD1 ASP A 27 -4.922 -12.106 11.860 1.00 0.00 O ATOM 415 OD2 ASP A 27 -5.114 -13.499 10.171 1.00 0.00 O ATOM 0 H ASP A 27 -1.567 -10.246 9.822 1.00 0.00 H new ATOM 0 HA ASP A 27 -2.110 -12.498 11.417 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -3.622 -10.681 10.174 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -3.653 -11.889 8.904 1.00 0.00 H new ATOM 420 N LYS A 28 -1.797 -14.587 10.099 1.00 0.00 N ATOM 421 CA LYS A 28 -1.429 -15.812 9.399 1.00 0.00 C ATOM 422 C LYS A 28 -2.427 -16.125 8.289 1.00 0.00 C ATOM 423 O LYS A 28 -2.059 -16.661 7.243 1.00 0.00 O ATOM 424 CB LYS A 28 -1.357 -16.983 10.381 1.00 0.00 C ATOM 425 CG LYS A 28 -0.960 -18.298 9.732 1.00 0.00 C ATOM 426 CD LYS A 28 -1.553 -19.486 10.470 1.00 0.00 C ATOM 427 CE LYS A 28 -0.894 -20.790 10.048 1.00 0.00 C ATOM 428 NZ LYS A 28 -1.052 -21.851 11.082 1.00 0.00 N ATOM 0 H LYS A 28 -2.138 -14.731 11.050 1.00 0.00 H new ATOM 0 HA LYS A 28 -0.447 -15.663 8.949 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -0.640 -16.744 11.166 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -2.328 -17.103 10.862 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -1.295 -18.309 8.695 1.00 0.00 H new ATOM 0 HG3 LYS A 28 0.127 -18.384 9.717 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -1.431 -19.346 11.544 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -2.624 -19.539 10.275 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -1.330 -21.130 9.109 1.00 0.00 H new ATOM 0 HE3 LYS A 28 0.166 -20.618 9.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -0.589 -22.724 10.757 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -0.614 -21.537 11.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -2.064 -22.034 11.240 1.00 0.00 H new ATOM 442 N ARG A 29 -3.691 -15.787 8.523 1.00 0.00 N ATOM 443 CA ARG A 29 -4.741 -16.032 7.543 1.00 0.00 C ATOM 444 C ARG A 29 -4.439 -15.315 6.230 1.00 0.00 C ATOM 445 O ARG A 29 -4.770 -15.807 5.151 1.00 0.00 O ATOM 446 CB ARG A 29 -6.095 -15.572 8.088 1.00 0.00 C ATOM 447 CG ARG A 29 -6.522 -16.302 9.351 1.00 0.00 C ATOM 448 CD ARG A 29 -7.454 -15.449 10.199 1.00 0.00 C ATOM 449 NE ARG A 29 -8.390 -16.262 10.970 1.00 0.00 N ATOM 450 CZ ARG A 29 -9.461 -15.769 11.581 1.00 0.00 C ATOM 451 NH1 ARG A 29 -9.731 -14.473 11.510 1.00 0.00 N ATOM 452 NH2 ARG A 29 -10.266 -16.573 12.264 1.00 0.00 N ATOM 0 H ARG A 29 -4.012 -15.343 9.383 1.00 0.00 H new ATOM 0 HA ARG A 29 -4.780 -17.104 7.351 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -6.050 -14.503 8.294 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -6.855 -15.717 7.320 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -7.022 -17.233 9.083 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -5.641 -16.569 9.934 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -6.864 -14.833 10.878 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -8.011 -14.769 9.554 1.00 0.00 H new ATOM 0 HE ARG A 29 -8.212 -17.264 11.043 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -9.115 -13.852 10.985 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -10.554 -14.097 11.980 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -10.062 -17.571 12.320 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -11.088 -16.193 12.733 1.00 0.00 H new ATOM 466 N PHE A 30 -3.809 -14.149 6.331 1.00 0.00 N ATOM 467 CA PHE A 30 -3.463 -13.363 5.153 1.00 0.00 C ATOM 468 C PHE A 30 -1.951 -13.191 5.038 1.00 0.00 C ATOM 469 O PHE A 30 -1.460 -12.102 4.745 1.00 0.00 O ATOM 470 CB PHE A 30 -4.140 -11.992 5.211 1.00 0.00 C ATOM 471 CG PHE A 30 -5.593 -12.057 5.585 1.00 0.00 C ATOM 472 CD1 PHE A 30 -6.458 -12.907 4.914 1.00 0.00 C ATOM 473 CD2 PHE A 30 -6.095 -11.268 6.608 1.00 0.00 C ATOM 474 CE1 PHE A 30 -7.796 -12.970 5.256 1.00 0.00 C ATOM 475 CE2 PHE A 30 -7.432 -11.327 6.954 1.00 0.00 C ATOM 476 CZ PHE A 30 -8.283 -12.177 6.277 1.00 0.00 C ATOM 0 H PHE A 30 -3.528 -13.728 7.216 1.00 0.00 H new ATOM 0 HA PHE A 30 -3.818 -13.899 4.273 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -3.615 -11.366 5.933 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -4.044 -11.507 4.240 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -6.082 -13.528 4.114 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -5.434 -10.600 7.141 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -8.459 -13.638 4.726 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -7.811 -10.708 7.754 1.00 0.00 H new ATOM 0 HZ PHE A 30 -9.328 -12.222 6.545 1.00 0.00 H new ATOM 486 N ASN A 31 -1.219 -14.276 5.271 1.00 0.00 N ATOM 487 CA ASN A 31 0.237 -14.246 5.195 1.00 0.00 C ATOM 488 C ASN A 31 0.723 -14.775 3.849 1.00 0.00 C ATOM 489 O ASN A 31 1.655 -14.230 3.256 1.00 0.00 O ATOM 490 CB ASN A 31 0.845 -15.073 6.330 1.00 0.00 C ATOM 491 CG ASN A 31 0.813 -16.562 6.041 1.00 0.00 C ATOM 492 OD1 ASN A 31 -0.182 -17.087 5.540 1.00 0.00 O ATOM 493 ND2 ASN A 31 1.904 -17.249 6.358 1.00 0.00 N ATOM 0 H ASN A 31 -1.610 -15.186 5.514 1.00 0.00 H new ATOM 0 HA ASN A 31 0.560 -13.210 5.296 1.00 0.00 H new ATOM 0 HB2 ASN A 31 1.876 -14.759 6.493 1.00 0.00 H new ATOM 0 HB3 ASN A 31 0.301 -14.873 7.253 1.00 0.00 H new ATOM 0 HD21 ASN A 31 1.941 -18.254 6.188 1.00 0.00 H new ATOM 0 HD22 ASN A 31 2.705 -16.772 6.771 1.00 0.00 H new ATOM 500 N ILE A 32 0.084 -15.838 3.372 1.00 0.00 N ATOM 501 CA ILE A 32 0.450 -16.439 2.095 1.00 0.00 C ATOM 502 C ILE A 32 0.575 -15.380 1.005 1.00 0.00 C ATOM 503 O ILE A 32 1.391 -15.506 0.092 1.00 0.00 O ATOM 504 CB ILE A 32 -0.581 -17.495 1.654 1.00 0.00 C ATOM 505 CG1 ILE A 32 -1.853 -16.815 1.145 1.00 0.00 C ATOM 506 CG2 ILE A 32 -0.901 -18.436 2.806 1.00 0.00 C ATOM 507 CD1 ILE A 32 -2.866 -17.782 0.572 1.00 0.00 C ATOM 0 H ILE A 32 -0.689 -16.301 3.850 1.00 0.00 H new ATOM 0 HA ILE A 32 1.415 -16.924 2.239 1.00 0.00 H new ATOM 0 HB ILE A 32 -0.154 -18.081 0.840 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -2.313 -16.262 1.964 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -1.585 -16.086 0.380 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -1.631 -19.177 2.479 1.00 0.00 H new ATOM 0 HG22 ILE A 32 0.010 -18.941 3.127 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.312 -17.865 3.639 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -3.742 -17.231 0.231 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -2.424 -18.317 -0.268 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -3.163 -18.496 1.341 1.00 0.00 H new ATOM 519 N PHE A 33 -0.240 -14.334 1.107 1.00 0.00 N ATOM 520 CA PHE A 33 -0.220 -13.252 0.130 1.00 0.00 C ATOM 521 C PHE A 33 1.038 -12.402 0.284 1.00 0.00 C ATOM 522 O PHE A 33 1.602 -11.925 -0.700 1.00 0.00 O ATOM 523 CB PHE A 33 -1.464 -12.374 0.286 1.00 0.00 C ATOM 524 CG PHE A 33 -2.744 -13.156 0.364 1.00 0.00 C ATOM 525 CD1 PHE A 33 -2.931 -14.285 -0.418 1.00 0.00 C ATOM 526 CD2 PHE A 33 -3.760 -12.763 1.220 1.00 0.00 C ATOM 527 CE1 PHE A 33 -4.107 -15.007 -0.347 1.00 0.00 C ATOM 528 CE2 PHE A 33 -4.939 -13.481 1.294 1.00 0.00 C ATOM 529 CZ PHE A 33 -5.113 -14.604 0.509 1.00 0.00 C ATOM 0 H PHE A 33 -0.922 -14.214 1.856 1.00 0.00 H new ATOM 0 HA PHE A 33 -0.218 -13.695 -0.866 1.00 0.00 H new ATOM 0 HB2 PHE A 33 -1.361 -11.769 1.187 1.00 0.00 H new ATOM 0 HB3 PHE A 33 -1.520 -11.684 -0.556 1.00 0.00 H new ATOM 0 HD1 PHE A 33 -2.149 -14.604 -1.091 1.00 0.00 H new ATOM 0 HD2 PHE A 33 -3.629 -11.886 1.836 1.00 0.00 H new ATOM 0 HE1 PHE A 33 -4.239 -15.886 -0.961 1.00 0.00 H new ATOM 0 HE2 PHE A 33 -5.723 -13.164 1.965 1.00 0.00 H new ATOM 0 HZ PHE A 33 -6.034 -15.166 0.564 1.00 0.00 H new ATOM 539 N SER A 34 1.471 -12.218 1.527 1.00 0.00 N ATOM 540 CA SER A 34 2.660 -11.423 1.812 1.00 0.00 C ATOM 541 C SER A 34 3.837 -11.878 0.954 1.00 0.00 C ATOM 542 O SER A 34 4.651 -11.066 0.514 1.00 0.00 O ATOM 543 CB SER A 34 3.025 -11.525 3.294 1.00 0.00 C ATOM 544 OG SER A 34 2.051 -10.889 4.104 1.00 0.00 O ATOM 0 H SER A 34 1.017 -12.608 2.353 1.00 0.00 H new ATOM 0 HA SER A 34 2.438 -10.384 1.571 1.00 0.00 H new ATOM 0 HB2 SER A 34 3.111 -12.573 3.579 1.00 0.00 H new ATOM 0 HB3 SER A 34 3.999 -11.067 3.464 1.00 0.00 H new ATOM 0 HG SER A 34 2.306 -10.970 5.047 1.00 0.00 H new ATOM 550 N LYS A 35 3.920 -13.183 0.720 1.00 0.00 N ATOM 551 CA LYS A 35 4.995 -13.750 -0.085 1.00 0.00 C ATOM 552 C LYS A 35 4.529 -14.001 -1.516 1.00 0.00 C ATOM 553 O LYS A 35 3.335 -14.117 -1.794 1.00 0.00 O ATOM 554 CB LYS A 35 5.492 -15.057 0.537 1.00 0.00 C ATOM 555 CG LYS A 35 6.477 -14.853 1.675 1.00 0.00 C ATOM 556 CD LYS A 35 5.763 -14.664 3.003 1.00 0.00 C ATOM 557 CE LYS A 35 5.539 -15.993 3.709 1.00 0.00 C ATOM 558 NZ LYS A 35 4.727 -15.833 4.947 1.00 0.00 N ATOM 0 H LYS A 35 3.255 -13.869 1.077 1.00 0.00 H new ATOM 0 HA LYS A 35 5.814 -13.032 -0.109 1.00 0.00 H new ATOM 0 HB2 LYS A 35 4.636 -15.623 0.905 1.00 0.00 H new ATOM 0 HB3 LYS A 35 5.964 -15.662 -0.237 1.00 0.00 H new ATOM 0 HG2 LYS A 35 7.144 -15.713 1.739 1.00 0.00 H new ATOM 0 HG3 LYS A 35 7.099 -13.982 1.468 1.00 0.00 H new ATOM 0 HD2 LYS A 35 6.350 -14.005 3.643 1.00 0.00 H new ATOM 0 HD3 LYS A 35 4.804 -14.174 2.835 1.00 0.00 H new ATOM 0 HE2 LYS A 35 5.037 -16.684 3.032 1.00 0.00 H new ATOM 0 HE3 LYS A 35 6.502 -16.437 3.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 4.597 -16.761 5.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 5.218 -15.194 5.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 3.798 -15.433 4.704 1.00 0.00 H new ATOM 572 N PRO A 36 5.491 -14.088 -2.446 1.00 0.00 N ATOM 573 CA PRO A 36 5.203 -14.328 -3.863 1.00 0.00 C ATOM 574 C PRO A 36 4.691 -15.742 -4.119 1.00 0.00 C ATOM 575 O PRO A 36 5.444 -16.618 -4.544 1.00 0.00 O ATOM 576 CB PRO A 36 6.559 -14.119 -4.542 1.00 0.00 C ATOM 577 CG PRO A 36 7.562 -14.405 -3.478 1.00 0.00 C ATOM 578 CD PRO A 36 6.935 -13.959 -2.186 1.00 0.00 C ATOM 0 HA PRO A 36 4.419 -13.670 -4.236 1.00 0.00 H new ATOM 0 HB2 PRO A 36 6.683 -14.788 -5.393 1.00 0.00 H new ATOM 0 HB3 PRO A 36 6.661 -13.101 -4.919 1.00 0.00 H new ATOM 0 HG2 PRO A 36 7.806 -15.467 -3.447 1.00 0.00 H new ATOM 0 HG3 PRO A 36 8.493 -13.870 -3.665 1.00 0.00 H new ATOM 0 HD2 PRO A 36 7.250 -14.583 -1.350 1.00 0.00 H new ATOM 0 HD3 PRO A 36 7.209 -12.933 -1.939 1.00 0.00 H new ATOM 586 N VAL A 37 3.406 -15.957 -3.858 1.00 0.00 N ATOM 587 CA VAL A 37 2.793 -17.265 -4.062 1.00 0.00 C ATOM 588 C VAL A 37 3.100 -17.804 -5.454 1.00 0.00 C ATOM 589 O VAL A 37 3.110 -19.016 -5.673 1.00 0.00 O ATOM 590 CB VAL A 37 1.266 -17.204 -3.872 1.00 0.00 C ATOM 591 CG1 VAL A 37 0.920 -16.797 -2.448 1.00 0.00 C ATOM 592 CG2 VAL A 37 0.642 -16.246 -4.876 1.00 0.00 C ATOM 0 H VAL A 37 2.769 -15.243 -3.505 1.00 0.00 H new ATOM 0 HA VAL A 37 3.218 -17.935 -3.315 1.00 0.00 H new ATOM 0 HB VAL A 37 0.856 -18.198 -4.049 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -0.163 -16.759 -2.333 1.00 0.00 H new ATOM 0 HG12 VAL A 37 1.334 -17.526 -1.751 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.341 -15.814 -2.238 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -0.437 -16.215 -4.727 1.00 0.00 H new ATOM 0 HG22 VAL A 37 1.057 -15.248 -4.733 1.00 0.00 H new ATOM 0 HG23 VAL A 37 0.859 -16.587 -5.888 1.00 0.00 H new ATOM 602 N SER A 38 3.352 -16.897 -6.393 1.00 0.00 N ATOM 603 CA SER A 38 3.657 -17.282 -7.766 1.00 0.00 C ATOM 604 C SER A 38 4.956 -18.079 -7.831 1.00 0.00 C ATOM 605 O SER A 38 5.672 -18.202 -6.837 1.00 0.00 O ATOM 606 CB SER A 38 3.762 -16.041 -8.654 1.00 0.00 C ATOM 607 OG SER A 38 2.495 -15.677 -9.173 1.00 0.00 O ATOM 0 H SER A 38 3.351 -15.890 -6.228 1.00 0.00 H new ATOM 0 HA SER A 38 2.846 -17.913 -8.129 1.00 0.00 H new ATOM 0 HB2 SER A 38 4.175 -15.212 -8.079 1.00 0.00 H new ATOM 0 HB3 SER A 38 4.453 -16.235 -9.475 1.00 0.00 H new ATOM 0 HG SER A 38 2.584 -15.445 -10.121 1.00 0.00 H new ATOM 613 N ASP A 39 5.253 -18.619 -9.008 1.00 0.00 N ATOM 614 CA ASP A 39 6.466 -19.404 -9.204 1.00 0.00 C ATOM 615 C ASP A 39 7.678 -18.495 -9.388 1.00 0.00 C ATOM 616 O ASP A 39 8.571 -18.456 -8.541 1.00 0.00 O ATOM 617 CB ASP A 39 6.314 -20.322 -10.418 1.00 0.00 C ATOM 618 CG ASP A 39 5.244 -21.377 -10.214 1.00 0.00 C ATOM 619 OD1 ASP A 39 4.048 -21.021 -10.239 1.00 0.00 O ATOM 620 OD2 ASP A 39 5.603 -22.559 -10.029 1.00 0.00 O ATOM 0 H ASP A 39 4.671 -18.527 -9.840 1.00 0.00 H new ATOM 0 HA ASP A 39 6.623 -20.013 -8.314 1.00 0.00 H new ATOM 0 HB2 ASP A 39 6.067 -19.723 -11.295 1.00 0.00 H new ATOM 0 HB3 ASP A 39 7.267 -20.810 -10.623 1.00 0.00 H new ATOM 625 N TYR A 40 7.702 -17.768 -10.499 1.00 0.00 N ATOM 626 CA TYR A 40 8.806 -16.862 -10.796 1.00 0.00 C ATOM 627 C TYR A 40 8.400 -15.411 -10.553 1.00 0.00 C ATOM 628 O TYR A 40 7.300 -15.134 -10.073 1.00 0.00 O ATOM 629 CB TYR A 40 9.263 -17.040 -12.244 1.00 0.00 C ATOM 630 CG TYR A 40 10.723 -16.710 -12.463 1.00 0.00 C ATOM 631 CD1 TYR A 40 11.723 -17.466 -11.864 1.00 0.00 C ATOM 632 CD2 TYR A 40 11.101 -15.644 -13.269 1.00 0.00 C ATOM 633 CE1 TYR A 40 13.058 -17.168 -12.060 1.00 0.00 C ATOM 634 CE2 TYR A 40 12.433 -15.339 -13.472 1.00 0.00 C ATOM 635 CZ TYR A 40 13.408 -16.104 -12.866 1.00 0.00 C ATOM 636 OH TYR A 40 14.736 -15.805 -13.065 1.00 0.00 O ATOM 0 H TYR A 40 6.970 -17.788 -11.209 1.00 0.00 H new ATOM 0 HA TYR A 40 9.633 -17.105 -10.129 1.00 0.00 H new ATOM 0 HB2 TYR A 40 9.082 -18.071 -12.549 1.00 0.00 H new ATOM 0 HB3 TYR A 40 8.655 -16.405 -12.889 1.00 0.00 H new ATOM 0 HD1 TYR A 40 11.452 -18.301 -11.234 1.00 0.00 H new ATOM 0 HD2 TYR A 40 10.340 -15.043 -13.745 1.00 0.00 H new ATOM 0 HE1 TYR A 40 13.823 -17.764 -11.585 1.00 0.00 H new ATOM 0 HE2 TYR A 40 12.709 -14.506 -14.102 1.00 0.00 H new ATOM 0 HH TYR A 40 14.811 -15.029 -13.658 1.00 0.00 H new ATOM 646 N LEU A 41 9.296 -14.490 -10.888 1.00 0.00 N ATOM 647 CA LEU A 41 9.034 -13.066 -10.708 1.00 0.00 C ATOM 648 C LEU A 41 8.876 -12.367 -12.054 1.00 0.00 C ATOM 649 O LEU A 41 7.991 -11.530 -12.230 1.00 0.00 O ATOM 650 CB LEU A 41 10.166 -12.415 -9.911 1.00 0.00 C ATOM 651 CG LEU A 41 11.565 -12.533 -10.516 1.00 0.00 C ATOM 652 CD1 LEU A 41 12.478 -11.448 -9.965 1.00 0.00 C ATOM 653 CD2 LEU A 41 12.150 -13.912 -10.245 1.00 0.00 C ATOM 0 H LEU A 41 10.211 -14.703 -11.286 1.00 0.00 H new ATOM 0 HA LEU A 41 8.101 -12.961 -10.154 1.00 0.00 H new ATOM 0 HB2 LEU A 41 9.934 -11.357 -9.786 1.00 0.00 H new ATOM 0 HB3 LEU A 41 10.184 -12.858 -8.915 1.00 0.00 H new ATOM 0 HG LEU A 41 11.485 -12.400 -11.595 1.00 0.00 H new ATOM 0 HD11 LEU A 41 13.469 -11.548 -10.407 1.00 0.00 H new ATOM 0 HD12 LEU A 41 12.068 -10.468 -10.211 1.00 0.00 H new ATOM 0 HD13 LEU A 41 12.551 -11.550 -8.882 1.00 0.00 H new ATOM 0 HD21 LEU A 41 13.146 -13.977 -10.683 1.00 0.00 H new ATOM 0 HD22 LEU A 41 12.215 -14.074 -9.169 1.00 0.00 H new ATOM 0 HD23 LEU A 41 11.508 -14.673 -10.688 1.00 0.00 H new ATOM 665 N GLU A 42 9.740 -12.717 -13.002 1.00 0.00 N ATOM 666 CA GLU A 42 9.695 -12.124 -14.333 1.00 0.00 C ATOM 667 C GLU A 42 8.420 -12.529 -15.067 1.00 0.00 C ATOM 668 O GLU A 42 7.984 -11.851 -15.997 1.00 0.00 O ATOM 669 CB GLU A 42 10.921 -12.546 -15.146 1.00 0.00 C ATOM 670 CG GLU A 42 12.163 -11.724 -14.847 1.00 0.00 C ATOM 671 CD GLU A 42 13.384 -12.217 -15.599 1.00 0.00 C ATOM 672 OE1 GLU A 42 13.295 -12.381 -16.833 1.00 0.00 O ATOM 673 OE2 GLU A 42 14.429 -12.439 -14.951 1.00 0.00 O ATOM 0 H GLU A 42 10.479 -13.408 -12.873 1.00 0.00 H new ATOM 0 HA GLU A 42 9.699 -11.040 -14.219 1.00 0.00 H new ATOM 0 HB2 GLU A 42 11.134 -13.596 -14.947 1.00 0.00 H new ATOM 0 HB3 GLU A 42 10.688 -12.464 -16.208 1.00 0.00 H new ATOM 0 HG2 GLU A 42 11.976 -10.682 -15.108 1.00 0.00 H new ATOM 0 HG3 GLU A 42 12.364 -11.753 -13.776 1.00 0.00 H new ATOM 680 N VAL A 43 7.827 -13.640 -14.641 1.00 0.00 N ATOM 681 CA VAL A 43 6.602 -14.136 -15.256 1.00 0.00 C ATOM 682 C VAL A 43 5.404 -13.278 -14.865 1.00 0.00 C ATOM 683 O VAL A 43 4.270 -13.564 -15.251 1.00 0.00 O ATOM 684 CB VAL A 43 6.325 -15.598 -14.857 1.00 0.00 C ATOM 685 CG1 VAL A 43 6.032 -15.698 -13.368 1.00 0.00 C ATOM 686 CG2 VAL A 43 5.175 -16.165 -15.675 1.00 0.00 C ATOM 0 H VAL A 43 8.175 -14.213 -13.873 1.00 0.00 H new ATOM 0 HA VAL A 43 6.746 -14.083 -16.335 1.00 0.00 H new ATOM 0 HB VAL A 43 7.216 -16.189 -15.068 1.00 0.00 H new ATOM 0 HG11 VAL A 43 5.839 -16.738 -13.104 1.00 0.00 H new ATOM 0 HG12 VAL A 43 6.890 -15.334 -12.803 1.00 0.00 H new ATOM 0 HG13 VAL A 43 5.157 -15.094 -13.128 1.00 0.00 H new ATOM 0 HG21 VAL A 43 4.993 -17.198 -15.380 1.00 0.00 H new ATOM 0 HG22 VAL A 43 4.277 -15.574 -15.498 1.00 0.00 H new ATOM 0 HG23 VAL A 43 5.430 -16.130 -16.734 1.00 0.00 H new ATOM 696 N ILE A 44 5.663 -12.226 -14.096 1.00 0.00 N ATOM 697 CA ILE A 44 4.606 -11.325 -13.653 1.00 0.00 C ATOM 698 C ILE A 44 4.789 -9.931 -14.243 1.00 0.00 C ATOM 699 O ILE A 44 5.881 -9.364 -14.197 1.00 0.00 O ATOM 700 CB ILE A 44 4.562 -11.220 -12.117 1.00 0.00 C ATOM 701 CG1 ILE A 44 4.145 -12.558 -11.504 1.00 0.00 C ATOM 702 CG2 ILE A 44 3.609 -10.114 -11.689 1.00 0.00 C ATOM 703 CD1 ILE A 44 4.731 -12.802 -10.131 1.00 0.00 C ATOM 0 H ILE A 44 6.596 -11.976 -13.767 1.00 0.00 H new ATOM 0 HA ILE A 44 3.664 -11.745 -14.006 1.00 0.00 H new ATOM 0 HB ILE A 44 5.560 -10.972 -11.756 1.00 0.00 H new ATOM 0 HG12 ILE A 44 3.058 -12.595 -11.438 1.00 0.00 H new ATOM 0 HG13 ILE A 44 4.452 -13.365 -12.170 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.589 -10.052 -10.601 1.00 0.00 H new ATOM 0 HG22 ILE A 44 3.947 -9.163 -12.100 1.00 0.00 H new ATOM 0 HG23 ILE A 44 2.607 -10.334 -12.059 1.00 0.00 H new ATOM 0 HD11 ILE A 44 4.393 -13.769 -9.758 1.00 0.00 H new ATOM 0 HD12 ILE A 44 5.819 -12.797 -10.194 1.00 0.00 H new ATOM 0 HD13 ILE A 44 4.404 -12.016 -9.451 1.00 0.00 H new ATOM 715 N LYS A 45 3.712 -9.382 -14.794 1.00 0.00 N ATOM 716 CA LYS A 45 3.751 -8.052 -15.390 1.00 0.00 C ATOM 717 C LYS A 45 3.520 -6.975 -14.335 1.00 0.00 C ATOM 718 O LYS A 45 4.309 -6.039 -14.207 1.00 0.00 O ATOM 719 CB LYS A 45 2.697 -7.933 -16.493 1.00 0.00 C ATOM 720 CG LYS A 45 3.092 -8.623 -17.788 1.00 0.00 C ATOM 721 CD LYS A 45 4.056 -7.774 -18.600 1.00 0.00 C ATOM 722 CE LYS A 45 3.322 -6.718 -19.412 1.00 0.00 C ATOM 723 NZ LYS A 45 2.607 -7.312 -20.576 1.00 0.00 N ATOM 0 H LYS A 45 2.801 -9.838 -14.840 1.00 0.00 H new ATOM 0 HA LYS A 45 4.740 -7.906 -15.823 1.00 0.00 H new ATOM 0 HB2 LYS A 45 1.759 -8.359 -16.136 1.00 0.00 H new ATOM 0 HB3 LYS A 45 2.512 -6.878 -16.695 1.00 0.00 H new ATOM 0 HG2 LYS A 45 3.553 -9.585 -17.563 1.00 0.00 H new ATOM 0 HG3 LYS A 45 2.199 -8.828 -18.379 1.00 0.00 H new ATOM 0 HD2 LYS A 45 4.768 -7.290 -17.931 1.00 0.00 H new ATOM 0 HD3 LYS A 45 4.631 -8.414 -19.269 1.00 0.00 H new ATOM 0 HE2 LYS A 45 2.607 -6.200 -18.773 1.00 0.00 H new ATOM 0 HE3 LYS A 45 4.034 -5.972 -19.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 2.337 -6.558 -21.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 3.232 -7.990 -21.058 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 1.753 -7.804 -20.245 1.00 0.00 H new ATOM 737 N GLU A 46 2.435 -7.116 -13.579 1.00 0.00 N ATOM 738 CA GLU A 46 2.103 -6.155 -12.534 1.00 0.00 C ATOM 739 C GLU A 46 2.234 -6.788 -11.152 1.00 0.00 C ATOM 740 O GLU A 46 1.248 -7.168 -10.519 1.00 0.00 O ATOM 741 CB GLU A 46 0.681 -5.625 -12.732 1.00 0.00 C ATOM 742 CG GLU A 46 0.435 -5.043 -14.114 1.00 0.00 C ATOM 743 CD GLU A 46 -0.012 -6.089 -15.116 1.00 0.00 C ATOM 744 OE1 GLU A 46 -0.751 -7.014 -14.717 1.00 0.00 O ATOM 745 OE2 GLU A 46 0.376 -5.984 -16.298 1.00 0.00 O ATOM 0 H GLU A 46 1.772 -7.886 -13.671 1.00 0.00 H new ATOM 0 HA GLU A 46 2.806 -5.324 -12.602 1.00 0.00 H new ATOM 0 HB2 GLU A 46 -0.027 -6.435 -12.557 1.00 0.00 H new ATOM 0 HB3 GLU A 46 0.480 -4.859 -11.983 1.00 0.00 H new ATOM 0 HG2 GLU A 46 -0.323 -4.263 -14.046 1.00 0.00 H new ATOM 0 HG3 GLU A 46 1.349 -4.569 -14.472 1.00 0.00 H new ATOM 752 N PRO A 47 3.481 -6.904 -10.671 1.00 0.00 N ATOM 753 CA PRO A 47 3.771 -7.490 -9.359 1.00 0.00 C ATOM 754 C PRO A 47 3.306 -6.601 -8.211 1.00 0.00 C ATOM 755 O PRO A 47 3.625 -5.413 -8.165 1.00 0.00 O ATOM 756 CB PRO A 47 5.297 -7.613 -9.355 1.00 0.00 C ATOM 757 CG PRO A 47 5.763 -6.568 -10.309 1.00 0.00 C ATOM 758 CD PRO A 47 4.702 -6.472 -11.370 1.00 0.00 C ATOM 0 HA PRO A 47 3.252 -8.438 -9.213 1.00 0.00 H new ATOM 0 HB2 PRO A 47 5.705 -7.449 -8.358 1.00 0.00 H new ATOM 0 HB3 PRO A 47 5.615 -8.607 -9.670 1.00 0.00 H new ATOM 0 HG2 PRO A 47 5.898 -5.611 -9.804 1.00 0.00 H new ATOM 0 HG3 PRO A 47 6.726 -6.838 -10.743 1.00 0.00 H new ATOM 0 HD2 PRO A 47 4.608 -5.456 -11.753 1.00 0.00 H new ATOM 0 HD3 PRO A 47 4.926 -7.114 -12.222 1.00 0.00 H new ATOM 766 N MET A 48 2.552 -7.184 -7.285 1.00 0.00 N ATOM 767 CA MET A 48 2.045 -6.443 -6.135 1.00 0.00 C ATOM 768 C MET A 48 1.702 -7.388 -4.988 1.00 0.00 C ATOM 769 O MET A 48 1.332 -8.541 -5.211 1.00 0.00 O ATOM 770 CB MET A 48 0.809 -5.631 -6.530 1.00 0.00 C ATOM 771 CG MET A 48 0.257 -4.777 -5.400 1.00 0.00 C ATOM 772 SD MET A 48 1.205 -3.264 -5.146 1.00 0.00 S ATOM 773 CE MET A 48 0.887 -2.404 -6.685 1.00 0.00 C ATOM 0 H MET A 48 2.279 -8.166 -7.308 1.00 0.00 H new ATOM 0 HA MET A 48 2.827 -5.762 -5.799 1.00 0.00 H new ATOM 0 HB2 MET A 48 1.062 -4.986 -7.372 1.00 0.00 H new ATOM 0 HB3 MET A 48 0.031 -6.313 -6.873 1.00 0.00 H new ATOM 0 HG2 MET A 48 -0.780 -4.519 -5.617 1.00 0.00 H new ATOM 0 HG3 MET A 48 0.254 -5.359 -4.478 1.00 0.00 H new ATOM 0 HE1 MET A 48 1.823 -2.272 -7.228 1.00 0.00 H new ATOM 0 HE2 MET A 48 0.195 -2.988 -7.292 1.00 0.00 H new ATOM 0 HE3 MET A 48 0.449 -1.428 -6.473 1.00 0.00 H new ATOM 783 N ASP A 49 1.827 -6.892 -3.762 1.00 0.00 N ATOM 784 CA ASP A 49 1.530 -7.692 -2.580 1.00 0.00 C ATOM 785 C ASP A 49 1.550 -6.831 -1.321 1.00 0.00 C ATOM 786 O ASP A 49 2.161 -5.762 -1.298 1.00 0.00 O ATOM 787 CB ASP A 49 2.536 -8.837 -2.446 1.00 0.00 C ATOM 788 CG ASP A 49 3.967 -8.374 -2.630 1.00 0.00 C ATOM 789 OD1 ASP A 49 4.168 -7.194 -2.985 1.00 0.00 O ATOM 790 OD2 ASP A 49 4.888 -9.191 -2.419 1.00 0.00 O ATOM 0 H ASP A 49 2.132 -5.940 -3.561 1.00 0.00 H new ATOM 0 HA ASP A 49 0.530 -8.109 -2.697 1.00 0.00 H new ATOM 0 HB2 ASP A 49 2.430 -9.297 -1.464 1.00 0.00 H new ATOM 0 HB3 ASP A 49 2.308 -9.606 -3.185 1.00 0.00 H new ATOM 795 N LEU A 50 0.879 -7.302 -0.276 1.00 0.00 N ATOM 796 CA LEU A 50 0.819 -6.575 0.987 1.00 0.00 C ATOM 797 C LEU A 50 2.137 -5.861 1.267 1.00 0.00 C ATOM 798 O LEU A 50 2.151 -4.699 1.672 1.00 0.00 O ATOM 799 CB LEU A 50 0.490 -7.531 2.134 1.00 0.00 C ATOM 800 CG LEU A 50 -0.963 -8.002 2.220 1.00 0.00 C ATOM 801 CD1 LEU A 50 -1.089 -9.170 3.186 1.00 0.00 C ATOM 802 CD2 LEU A 50 -1.869 -6.856 2.645 1.00 0.00 C ATOM 0 H LEU A 50 0.368 -8.185 -0.278 1.00 0.00 H new ATOM 0 HA LEU A 50 0.031 -5.826 0.910 1.00 0.00 H new ATOM 0 HB2 LEU A 50 1.131 -8.408 2.044 1.00 0.00 H new ATOM 0 HB3 LEU A 50 0.749 -7.042 3.073 1.00 0.00 H new ATOM 0 HG LEU A 50 -1.276 -8.340 1.232 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -2.129 -9.492 3.234 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -0.469 -9.997 2.840 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -0.759 -8.860 4.177 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -2.899 -7.208 2.701 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.557 -6.489 3.623 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -1.801 -6.049 1.916 1.00 0.00 H new ATOM 814 N SER A 51 3.244 -6.564 1.045 1.00 0.00 N ATOM 815 CA SER A 51 4.568 -5.998 1.275 1.00 0.00 C ATOM 816 C SER A 51 4.759 -4.717 0.468 1.00 0.00 C ATOM 817 O SER A 51 4.743 -3.615 1.015 1.00 0.00 O ATOM 818 CB SER A 51 5.651 -7.013 0.907 1.00 0.00 C ATOM 819 OG SER A 51 5.449 -8.242 1.584 1.00 0.00 O ATOM 0 H SER A 51 3.250 -7.526 0.706 1.00 0.00 H new ATOM 0 HA SER A 51 4.653 -5.755 2.334 1.00 0.00 H new ATOM 0 HB2 SER A 51 5.645 -7.182 -0.170 1.00 0.00 H new ATOM 0 HB3 SER A 51 6.632 -6.611 1.161 1.00 0.00 H new ATOM 0 HG SER A 51 5.187 -8.932 0.939 1.00 0.00 H new ATOM 825 N THR A 52 4.940 -4.872 -0.840 1.00 0.00 N ATOM 826 CA THR A 52 5.136 -3.730 -1.725 1.00 0.00 C ATOM 827 C THR A 52 4.196 -2.587 -1.363 1.00 0.00 C ATOM 828 O THR A 52 4.601 -1.424 -1.327 1.00 0.00 O ATOM 829 CB THR A 52 4.912 -4.117 -3.199 1.00 0.00 C ATOM 830 OG1 THR A 52 6.055 -4.820 -3.700 1.00 0.00 O ATOM 831 CG2 THR A 52 4.657 -2.882 -4.050 1.00 0.00 C ATOM 0 H THR A 52 4.955 -5.777 -1.310 1.00 0.00 H new ATOM 0 HA THR A 52 6.168 -3.403 -1.596 1.00 0.00 H new ATOM 0 HB THR A 52 4.036 -4.763 -3.253 1.00 0.00 H new ATOM 0 HG1 THR A 52 5.877 -5.784 -3.689 1.00 0.00 H new ATOM 0 HG21 THR A 52 4.502 -3.180 -5.087 1.00 0.00 H new ATOM 0 HG22 THR A 52 3.770 -2.365 -3.684 1.00 0.00 H new ATOM 0 HG23 THR A 52 5.517 -2.215 -3.989 1.00 0.00 H new ATOM 839 N VAL A 53 2.938 -2.923 -1.094 1.00 0.00 N ATOM 840 CA VAL A 53 1.940 -1.923 -0.733 1.00 0.00 C ATOM 841 C VAL A 53 2.464 -0.992 0.355 1.00 0.00 C ATOM 842 O VAL A 53 2.310 0.227 0.269 1.00 0.00 O ATOM 843 CB VAL A 53 0.637 -2.583 -0.244 1.00 0.00 C ATOM 844 CG1 VAL A 53 -0.309 -1.538 0.328 1.00 0.00 C ATOM 845 CG2 VAL A 53 -0.027 -3.353 -1.375 1.00 0.00 C ATOM 0 H VAL A 53 2.586 -3.880 -1.119 1.00 0.00 H new ATOM 0 HA VAL A 53 1.731 -1.344 -1.633 1.00 0.00 H new ATOM 0 HB VAL A 53 0.883 -3.289 0.550 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -1.224 -2.023 0.668 1.00 0.00 H new ATOM 0 HG12 VAL A 53 0.169 -1.035 1.168 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -0.551 -0.806 -0.442 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -0.946 -3.813 -1.012 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.261 -2.670 -2.192 1.00 0.00 H new ATOM 0 HG23 VAL A 53 0.650 -4.129 -1.733 1.00 0.00 H new ATOM 855 N ILE A 54 3.084 -1.573 1.376 1.00 0.00 N ATOM 856 CA ILE A 54 3.633 -0.794 2.479 1.00 0.00 C ATOM 857 C ILE A 54 4.748 0.129 2.000 1.00 0.00 C ATOM 858 O ILE A 54 4.922 1.233 2.517 1.00 0.00 O ATOM 859 CB ILE A 54 4.179 -1.705 3.594 1.00 0.00 C ATOM 860 CG1 ILE A 54 3.081 -2.642 4.102 1.00 0.00 C ATOM 861 CG2 ILE A 54 4.739 -0.869 4.735 1.00 0.00 C ATOM 862 CD1 ILE A 54 3.613 -3.864 4.818 1.00 0.00 C ATOM 0 H ILE A 54 3.219 -2.580 1.463 1.00 0.00 H new ATOM 0 HA ILE A 54 2.816 -0.194 2.879 1.00 0.00 H new ATOM 0 HB ILE A 54 4.986 -2.311 3.184 1.00 0.00 H new ATOM 0 HG12 ILE A 54 2.428 -2.090 4.778 1.00 0.00 H new ATOM 0 HG13 ILE A 54 2.469 -2.963 3.259 1.00 0.00 H new ATOM 0 HG21 ILE A 54 5.121 -1.527 5.515 1.00 0.00 H new ATOM 0 HG22 ILE A 54 5.548 -0.240 4.363 1.00 0.00 H new ATOM 0 HG23 ILE A 54 3.950 -0.239 5.146 1.00 0.00 H new ATOM 0 HD11 ILE A 54 2.779 -4.483 5.150 1.00 0.00 H new ATOM 0 HD12 ILE A 54 4.243 -4.438 4.139 1.00 0.00 H new ATOM 0 HD13 ILE A 54 4.201 -3.553 5.682 1.00 0.00 H new ATOM 874 N THR A 55 5.502 -0.330 1.005 1.00 0.00 N ATOM 875 CA THR A 55 6.600 0.454 0.455 1.00 0.00 C ATOM 876 C THR A 55 6.114 1.812 -0.037 1.00 0.00 C ATOM 877 O THR A 55 6.575 2.854 0.429 1.00 0.00 O ATOM 878 CB THR A 55 7.289 -0.284 -0.709 1.00 0.00 C ATOM 879 OG1 THR A 55 7.762 -1.562 -0.267 1.00 0.00 O ATOM 880 CG2 THR A 55 8.452 0.532 -1.255 1.00 0.00 C ATOM 0 H THR A 55 5.372 -1.241 0.564 1.00 0.00 H new ATOM 0 HA THR A 55 7.319 0.599 1.261 1.00 0.00 H new ATOM 0 HB THR A 55 6.558 -0.423 -1.506 1.00 0.00 H new ATOM 0 HG1 THR A 55 8.197 -2.026 -1.013 1.00 0.00 H new ATOM 0 HG21 THR A 55 8.923 -0.009 -2.076 1.00 0.00 H new ATOM 0 HG22 THR A 55 8.084 1.492 -1.617 1.00 0.00 H new ATOM 0 HG23 THR A 55 9.183 0.698 -0.464 1.00 0.00 H new ATOM 888 N LYS A 56 5.179 1.794 -0.982 1.00 0.00 N ATOM 889 CA LYS A 56 4.628 3.025 -1.536 1.00 0.00 C ATOM 890 C LYS A 56 4.222 3.988 -0.426 1.00 0.00 C ATOM 891 O LYS A 56 4.584 5.165 -0.450 1.00 0.00 O ATOM 892 CB LYS A 56 3.419 2.712 -2.422 1.00 0.00 C ATOM 893 CG LYS A 56 3.793 2.238 -3.815 1.00 0.00 C ATOM 894 CD LYS A 56 3.839 0.721 -3.894 1.00 0.00 C ATOM 895 CE LYS A 56 2.491 0.142 -4.296 1.00 0.00 C ATOM 896 NZ LYS A 56 2.125 0.506 -5.693 1.00 0.00 N ATOM 0 H LYS A 56 4.787 0.940 -1.380 1.00 0.00 H new ATOM 0 HA LYS A 56 5.401 3.501 -2.140 1.00 0.00 H new ATOM 0 HB2 LYS A 56 2.812 1.947 -1.938 1.00 0.00 H new ATOM 0 HB3 LYS A 56 2.799 3.605 -2.505 1.00 0.00 H new ATOM 0 HG2 LYS A 56 3.070 2.619 -4.536 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.765 2.647 -4.091 1.00 0.00 H new ATOM 0 HD2 LYS A 56 4.597 0.416 -4.616 1.00 0.00 H new ATOM 0 HD3 LYS A 56 4.137 0.314 -2.928 1.00 0.00 H new ATOM 0 HE2 LYS A 56 2.518 -0.943 -4.199 1.00 0.00 H new ATOM 0 HE3 LYS A 56 1.722 0.504 -3.613 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 1.099 0.664 -5.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 2.625 1.375 -5.968 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 2.395 -0.266 -6.335 1.00 0.00 H new ATOM 910 N ILE A 57 3.471 3.481 0.546 1.00 0.00 N ATOM 911 CA ILE A 57 3.020 4.297 1.666 1.00 0.00 C ATOM 912 C ILE A 57 4.175 5.085 2.274 1.00 0.00 C ATOM 913 O ILE A 57 4.049 6.278 2.551 1.00 0.00 O ATOM 914 CB ILE A 57 2.368 3.436 2.764 1.00 0.00 C ATOM 915 CG1 ILE A 57 1.156 2.689 2.203 1.00 0.00 C ATOM 916 CG2 ILE A 57 1.962 4.302 3.946 1.00 0.00 C ATOM 917 CD1 ILE A 57 0.810 1.433 2.973 1.00 0.00 C ATOM 0 H ILE A 57 3.162 2.509 0.580 1.00 0.00 H new ATOM 0 HA ILE A 57 2.278 4.991 1.271 1.00 0.00 H new ATOM 0 HB ILE A 57 3.096 2.702 3.110 1.00 0.00 H new ATOM 0 HG12 ILE A 57 0.294 3.357 2.207 1.00 0.00 H new ATOM 0 HG13 ILE A 57 1.351 2.426 1.163 1.00 0.00 H new ATOM 0 HG21 ILE A 57 1.503 3.678 4.713 1.00 0.00 H new ATOM 0 HG22 ILE A 57 2.844 4.793 4.357 1.00 0.00 H new ATOM 0 HG23 ILE A 57 1.248 5.056 3.616 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.059 0.956 2.519 1.00 0.00 H new ATOM 0 HD12 ILE A 57 1.656 0.746 2.948 1.00 0.00 H new ATOM 0 HD13 ILE A 57 0.583 1.691 4.007 1.00 0.00 H new ATOM 929 N ASP A 58 5.302 4.410 2.477 1.00 0.00 N ATOM 930 CA ASP A 58 6.482 5.048 3.049 1.00 0.00 C ATOM 931 C ASP A 58 7.190 5.912 2.010 1.00 0.00 C ATOM 932 O ASP A 58 8.044 6.733 2.347 1.00 0.00 O ATOM 933 CB ASP A 58 7.445 3.991 3.593 1.00 0.00 C ATOM 934 CG ASP A 58 8.308 4.521 4.721 1.00 0.00 C ATOM 935 OD1 ASP A 58 8.536 5.748 4.768 1.00 0.00 O ATOM 936 OD2 ASP A 58 8.756 3.709 5.557 1.00 0.00 O ATOM 0 H ASP A 58 5.423 3.422 2.254 1.00 0.00 H new ATOM 0 HA ASP A 58 6.157 5.690 3.868 1.00 0.00 H new ATOM 0 HB2 ASP A 58 6.875 3.132 3.948 1.00 0.00 H new ATOM 0 HB3 ASP A 58 8.085 3.637 2.785 1.00 0.00 H new ATOM 941 N LYS A 59 6.831 5.722 0.745 1.00 0.00 N ATOM 942 CA LYS A 59 7.430 6.483 -0.344 1.00 0.00 C ATOM 943 C LYS A 59 6.578 7.699 -0.691 1.00 0.00 C ATOM 944 O LYS A 59 6.655 8.228 -1.801 1.00 0.00 O ATOM 945 CB LYS A 59 7.601 5.597 -1.580 1.00 0.00 C ATOM 946 CG LYS A 59 8.528 4.415 -1.357 1.00 0.00 C ATOM 947 CD LYS A 59 9.985 4.845 -1.335 1.00 0.00 C ATOM 948 CE LYS A 59 10.885 3.739 -0.806 1.00 0.00 C ATOM 949 NZ LYS A 59 11.212 2.738 -1.859 1.00 0.00 N ATOM 0 H LYS A 59 6.127 5.046 0.449 1.00 0.00 H new ATOM 0 HA LYS A 59 8.410 6.830 -0.015 1.00 0.00 H new ATOM 0 HB2 LYS A 59 6.623 5.228 -1.890 1.00 0.00 H new ATOM 0 HB3 LYS A 59 7.988 6.202 -2.400 1.00 0.00 H new ATOM 0 HG2 LYS A 59 8.277 3.928 -0.415 1.00 0.00 H new ATOM 0 HG3 LYS A 59 8.377 3.679 -2.147 1.00 0.00 H new ATOM 0 HD2 LYS A 59 10.299 5.121 -2.342 1.00 0.00 H new ATOM 0 HD3 LYS A 59 10.094 5.733 -0.712 1.00 0.00 H new ATOM 0 HE2 LYS A 59 11.807 4.174 -0.420 1.00 0.00 H new ATOM 0 HE3 LYS A 59 10.394 3.240 0.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 11.827 2.001 -1.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 10.334 2.304 -2.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 11.703 3.209 -2.645 1.00 0.00 H new ATOM 963 N HIS A 60 5.766 8.140 0.265 1.00 0.00 N ATOM 964 CA HIS A 60 4.901 9.296 0.060 1.00 0.00 C ATOM 965 C HIS A 60 4.195 9.214 -1.290 1.00 0.00 C ATOM 966 O HIS A 60 4.123 10.199 -2.024 1.00 0.00 O ATOM 967 CB HIS A 60 5.712 10.589 0.147 1.00 0.00 C ATOM 968 CG HIS A 60 6.276 10.852 1.509 1.00 0.00 C ATOM 969 ND1 HIS A 60 7.299 11.748 1.740 1.00 0.00 N ATOM 970 CD2 HIS A 60 5.953 10.332 2.716 1.00 0.00 C ATOM 971 CE1 HIS A 60 7.582 11.766 3.031 1.00 0.00 C ATOM 972 NE2 HIS A 60 6.779 10.916 3.645 1.00 0.00 N ATOM 0 H HIS A 60 5.689 7.714 1.189 1.00 0.00 H new ATOM 0 HA HIS A 60 4.146 9.297 0.846 1.00 0.00 H new ATOM 0 HB2 HIS A 60 6.529 10.545 -0.573 1.00 0.00 H new ATOM 0 HB3 HIS A 60 5.077 11.426 -0.142 1.00 0.00 H new ATOM 0 HD2 HIS A 60 5.188 9.595 2.912 1.00 0.00 H new ATOM 0 HE1 HIS A 60 8.341 12.372 3.503 1.00 0.00 H new ATOM 0 HE2 HIS A 60 6.773 10.724 4.647 1.00 0.00 H new ATOM 981 N ASN A 61 3.677 8.033 -1.611 1.00 0.00 N ATOM 982 CA ASN A 61 2.978 7.822 -2.874 1.00 0.00 C ATOM 983 C ASN A 61 1.476 8.032 -2.706 1.00 0.00 C ATOM 984 O ASN A 61 0.884 8.898 -3.351 1.00 0.00 O ATOM 985 CB ASN A 61 3.252 6.413 -3.403 1.00 0.00 C ATOM 986 CG ASN A 61 2.804 6.239 -4.842 1.00 0.00 C ATOM 987 OD1 ASN A 61 1.744 5.674 -5.109 1.00 0.00 O ATOM 988 ND2 ASN A 61 3.614 6.724 -5.776 1.00 0.00 N ATOM 0 H ASN A 61 3.728 7.207 -1.014 1.00 0.00 H new ATOM 0 HA ASN A 61 3.350 8.551 -3.593 1.00 0.00 H new ATOM 0 HB2 ASN A 61 4.319 6.201 -3.329 1.00 0.00 H new ATOM 0 HB3 ASN A 61 2.738 5.685 -2.775 1.00 0.00 H new ATOM 0 HD21 ASN A 61 3.367 6.635 -6.762 1.00 0.00 H new ATOM 0 HD22 ASN A 61 4.483 7.185 -5.508 1.00 0.00 H new ATOM 995 N TYR A 62 0.867 7.234 -1.836 1.00 0.00 N ATOM 996 CA TYR A 62 -0.566 7.331 -1.585 1.00 0.00 C ATOM 997 C TYR A 62 -0.917 8.668 -0.939 1.00 0.00 C ATOM 998 O TYR A 62 -0.249 9.114 -0.005 1.00 0.00 O ATOM 999 CB TYR A 62 -1.026 6.182 -0.686 1.00 0.00 C ATOM 1000 CG TYR A 62 -1.019 4.835 -1.374 1.00 0.00 C ATOM 1001 CD1 TYR A 62 -1.566 4.678 -2.641 1.00 0.00 C ATOM 1002 CD2 TYR A 62 -0.465 3.721 -0.757 1.00 0.00 C ATOM 1003 CE1 TYR A 62 -1.563 3.449 -3.273 1.00 0.00 C ATOM 1004 CE2 TYR A 62 -0.456 2.488 -1.381 1.00 0.00 C ATOM 1005 CZ TYR A 62 -1.007 2.358 -2.639 1.00 0.00 C ATOM 1006 OH TYR A 62 -1.000 1.132 -3.265 1.00 0.00 O ATOM 0 H TYR A 62 1.343 6.513 -1.293 1.00 0.00 H new ATOM 0 HA TYR A 62 -1.082 7.264 -2.543 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -0.380 6.136 0.190 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.034 6.393 -0.328 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.001 5.531 -3.141 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -0.033 3.820 0.228 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -1.994 3.344 -4.258 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -0.021 1.632 -0.887 1.00 0.00 H new ATOM 0 HH TYR A 62 -0.375 1.154 -4.020 1.00 0.00 H new ATOM 1016 N LEU A 63 -1.970 9.302 -1.443 1.00 0.00 N ATOM 1017 CA LEU A 63 -2.412 10.589 -0.917 1.00 0.00 C ATOM 1018 C LEU A 63 -3.870 10.523 -0.472 1.00 0.00 C ATOM 1019 O LEU A 63 -4.365 11.424 0.206 1.00 0.00 O ATOM 1020 CB LEU A 63 -2.238 11.681 -1.973 1.00 0.00 C ATOM 1021 CG LEU A 63 -2.473 11.257 -3.423 1.00 0.00 C ATOM 1022 CD1 LEU A 63 -3.949 10.985 -3.667 1.00 0.00 C ATOM 1023 CD2 LEU A 63 -1.960 12.322 -4.381 1.00 0.00 C ATOM 0 H LEU A 63 -2.534 8.946 -2.215 1.00 0.00 H new ATOM 0 HA LEU A 63 -1.797 10.830 -0.050 1.00 0.00 H new ATOM 0 HB2 LEU A 63 -2.922 12.497 -1.739 1.00 0.00 H new ATOM 0 HB3 LEU A 63 -1.227 12.079 -1.891 1.00 0.00 H new ATOM 0 HG LEU A 63 -1.919 10.336 -3.606 1.00 0.00 H new ATOM 0 HD11 LEU A 63 -4.097 10.685 -4.704 1.00 0.00 H new ATOM 0 HD12 LEU A 63 -4.286 10.186 -3.006 1.00 0.00 H new ATOM 0 HD13 LEU A 63 -4.524 11.889 -3.466 1.00 0.00 H new ATOM 0 HD21 LEU A 63 -2.136 12.003 -5.408 1.00 0.00 H new ATOM 0 HD22 LEU A 63 -2.485 13.260 -4.198 1.00 0.00 H new ATOM 0 HD23 LEU A 63 -0.891 12.468 -4.224 1.00 0.00 H new ATOM 1035 N THR A 64 -4.552 9.449 -0.856 1.00 0.00 N ATOM 1036 CA THR A 64 -5.953 9.264 -0.496 1.00 0.00 C ATOM 1037 C THR A 64 -6.241 7.811 -0.135 1.00 0.00 C ATOM 1038 O THR A 64 -5.414 6.929 -0.366 1.00 0.00 O ATOM 1039 CB THR A 64 -6.888 9.692 -1.642 1.00 0.00 C ATOM 1040 OG1 THR A 64 -6.399 9.185 -2.889 1.00 0.00 O ATOM 1041 CG2 THR A 64 -6.999 11.207 -1.713 1.00 0.00 C ATOM 0 H THR A 64 -4.157 8.694 -1.416 1.00 0.00 H new ATOM 0 HA THR A 64 -6.142 9.895 0.372 1.00 0.00 H new ATOM 0 HB THR A 64 -7.878 9.280 -1.446 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.079 8.609 -3.297 1.00 0.00 H new ATOM 0 HG21 THR A 64 -7.665 11.485 -2.530 1.00 0.00 H new ATOM 0 HG22 THR A 64 -7.400 11.587 -0.773 1.00 0.00 H new ATOM 0 HG23 THR A 64 -6.012 11.636 -1.887 1.00 0.00 H new ATOM 1049 N ALA A 65 -7.418 7.569 0.431 1.00 0.00 N ATOM 1050 CA ALA A 65 -7.816 6.222 0.821 1.00 0.00 C ATOM 1051 C ALA A 65 -8.355 5.442 -0.373 1.00 0.00 C ATOM 1052 O ALA A 65 -8.152 4.233 -0.482 1.00 0.00 O ATOM 1053 CB ALA A 65 -8.856 6.279 1.930 1.00 0.00 C ATOM 0 H ALA A 65 -8.113 8.288 0.630 1.00 0.00 H new ATOM 0 HA ALA A 65 -6.933 5.702 1.193 1.00 0.00 H new ATOM 0 HB1 ALA A 65 -9.144 5.266 2.211 1.00 0.00 H new ATOM 0 HB2 ALA A 65 -8.437 6.791 2.796 1.00 0.00 H new ATOM 0 HB3 ALA A 65 -9.734 6.821 1.578 1.00 0.00 H new ATOM 1059 N LYS A 66 -9.045 6.141 -1.268 1.00 0.00 N ATOM 1060 CA LYS A 66 -9.614 5.515 -2.456 1.00 0.00 C ATOM 1061 C LYS A 66 -8.541 4.774 -3.247 1.00 0.00 C ATOM 1062 O LYS A 66 -8.689 3.591 -3.555 1.00 0.00 O ATOM 1063 CB LYS A 66 -10.281 6.568 -3.343 1.00 0.00 C ATOM 1064 CG LYS A 66 -11.649 7.004 -2.846 1.00 0.00 C ATOM 1065 CD LYS A 66 -12.721 5.987 -3.202 1.00 0.00 C ATOM 1066 CE LYS A 66 -14.093 6.431 -2.716 1.00 0.00 C ATOM 1067 NZ LYS A 66 -15.189 5.694 -3.403 1.00 0.00 N ATOM 0 H LYS A 66 -9.224 7.142 -1.193 1.00 0.00 H new ATOM 0 HA LYS A 66 -10.365 4.794 -2.132 1.00 0.00 H new ATOM 0 HB2 LYS A 66 -9.632 7.441 -3.407 1.00 0.00 H new ATOM 0 HB3 LYS A 66 -10.380 6.170 -4.353 1.00 0.00 H new ATOM 0 HG2 LYS A 66 -11.619 7.139 -1.765 1.00 0.00 H new ATOM 0 HG3 LYS A 66 -11.904 7.970 -3.281 1.00 0.00 H new ATOM 0 HD2 LYS A 66 -12.745 5.845 -4.282 1.00 0.00 H new ATOM 0 HD3 LYS A 66 -12.471 5.023 -2.759 1.00 0.00 H new ATOM 0 HE2 LYS A 66 -14.167 6.271 -1.640 1.00 0.00 H new ATOM 0 HE3 LYS A 66 -14.211 7.501 -2.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 -16.108 6.025 -3.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 -15.134 5.866 -4.427 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 -15.092 4.675 -3.218 1.00 0.00 H new ATOM 1081 N ASP A 67 -7.461 5.476 -3.572 1.00 0.00 N ATOM 1082 CA ASP A 67 -6.362 4.884 -4.325 1.00 0.00 C ATOM 1083 C ASP A 67 -5.819 3.649 -3.614 1.00 0.00 C ATOM 1084 O ASP A 67 -5.708 2.576 -4.208 1.00 0.00 O ATOM 1085 CB ASP A 67 -5.242 5.907 -4.523 1.00 0.00 C ATOM 1086 CG ASP A 67 -5.687 7.101 -5.345 1.00 0.00 C ATOM 1087 OD1 ASP A 67 -6.894 7.419 -5.324 1.00 0.00 O ATOM 1088 OD2 ASP A 67 -4.827 7.717 -6.009 1.00 0.00 O ATOM 0 H ASP A 67 -7.323 6.456 -3.326 1.00 0.00 H new ATOM 0 HA ASP A 67 -6.744 4.581 -5.300 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -4.891 6.250 -3.550 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -4.397 5.426 -5.015 1.00 0.00 H new ATOM 1093 N PHE A 68 -5.481 3.807 -2.338 1.00 0.00 N ATOM 1094 CA PHE A 68 -4.948 2.705 -1.546 1.00 0.00 C ATOM 1095 C PHE A 68 -5.744 1.426 -1.789 1.00 0.00 C ATOM 1096 O PHE A 68 -5.181 0.388 -2.141 1.00 0.00 O ATOM 1097 CB PHE A 68 -4.972 3.060 -0.058 1.00 0.00 C ATOM 1098 CG PHE A 68 -4.809 1.870 0.844 1.00 0.00 C ATOM 1099 CD1 PHE A 68 -5.913 1.142 1.259 1.00 0.00 C ATOM 1100 CD2 PHE A 68 -3.552 1.480 1.278 1.00 0.00 C ATOM 1101 CE1 PHE A 68 -5.765 0.048 2.091 1.00 0.00 C ATOM 1102 CE2 PHE A 68 -3.399 0.386 2.109 1.00 0.00 C ATOM 1103 CZ PHE A 68 -4.507 -0.332 2.515 1.00 0.00 C ATOM 0 H PHE A 68 -5.567 4.688 -1.831 1.00 0.00 H new ATOM 0 HA PHE A 68 -3.917 2.534 -1.855 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -4.176 3.775 0.150 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -5.915 3.556 0.174 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -6.899 1.433 0.929 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -2.682 2.037 0.963 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -6.633 -0.510 2.409 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -2.414 0.093 2.441 1.00 0.00 H new ATOM 0 HZ PHE A 68 -4.390 -1.188 3.162 1.00 0.00 H new ATOM 1113 N LEU A 69 -7.056 1.507 -1.597 1.00 0.00 N ATOM 1114 CA LEU A 69 -7.931 0.357 -1.794 1.00 0.00 C ATOM 1115 C LEU A 69 -7.767 -0.218 -3.198 1.00 0.00 C ATOM 1116 O LEU A 69 -7.538 -1.415 -3.368 1.00 0.00 O ATOM 1117 CB LEU A 69 -9.389 0.754 -1.560 1.00 0.00 C ATOM 1118 CG LEU A 69 -9.898 0.623 -0.124 1.00 0.00 C ATOM 1119 CD1 LEU A 69 -11.253 1.297 0.025 1.00 0.00 C ATOM 1120 CD2 LEU A 69 -9.981 -0.841 0.281 1.00 0.00 C ATOM 0 H LEU A 69 -7.537 2.358 -1.305 1.00 0.00 H new ATOM 0 HA LEU A 69 -7.650 -0.410 -1.072 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -9.518 1.789 -1.877 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -10.019 0.142 -2.205 1.00 0.00 H new ATOM 0 HG LEU A 69 -9.192 1.123 0.539 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -11.600 1.194 1.053 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -11.163 2.355 -0.223 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -11.969 0.826 -0.648 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -10.345 -0.915 1.306 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -10.666 -1.365 -0.386 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -8.992 -1.294 0.214 1.00 0.00 H new ATOM 1132 N LYS A 70 -7.885 0.645 -4.202 1.00 0.00 N ATOM 1133 CA LYS A 70 -7.747 0.226 -5.591 1.00 0.00 C ATOM 1134 C LYS A 70 -6.559 -0.716 -5.760 1.00 0.00 C ATOM 1135 O LYS A 70 -6.655 -1.736 -6.443 1.00 0.00 O ATOM 1136 CB LYS A 70 -7.577 1.446 -6.499 1.00 0.00 C ATOM 1137 CG LYS A 70 -8.886 2.141 -6.834 1.00 0.00 C ATOM 1138 CD LYS A 70 -8.666 3.604 -7.184 1.00 0.00 C ATOM 1139 CE LYS A 70 -9.888 4.203 -7.864 1.00 0.00 C ATOM 1140 NZ LYS A 70 -9.620 5.576 -8.376 1.00 0.00 N ATOM 0 H LYS A 70 -8.076 1.639 -4.079 1.00 0.00 H new ATOM 0 HA LYS A 70 -8.654 -0.307 -5.875 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -6.910 2.159 -6.014 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -7.093 1.135 -7.425 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -9.365 1.633 -7.671 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -9.566 2.067 -5.985 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -8.440 4.166 -6.278 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -7.801 3.696 -7.841 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -10.196 3.561 -8.689 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -10.718 4.234 -7.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -10.477 5.950 -8.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -9.351 6.195 -7.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -8.845 5.543 -9.069 1.00 0.00 H new ATOM 1154 N ASP A 71 -5.440 -0.367 -5.134 1.00 0.00 N ATOM 1155 CA ASP A 71 -4.234 -1.183 -5.213 1.00 0.00 C ATOM 1156 C ASP A 71 -4.435 -2.520 -4.508 1.00 0.00 C ATOM 1157 O ASP A 71 -3.849 -3.532 -4.895 1.00 0.00 O ATOM 1158 CB ASP A 71 -3.048 -0.440 -4.595 1.00 0.00 C ATOM 1159 CG ASP A 71 -2.611 0.748 -5.430 1.00 0.00 C ATOM 1160 OD1 ASP A 71 -3.222 1.828 -5.290 1.00 0.00 O ATOM 1161 OD2 ASP A 71 -1.659 0.598 -6.224 1.00 0.00 O ATOM 0 H ASP A 71 -5.343 0.475 -4.567 1.00 0.00 H new ATOM 0 HA ASP A 71 -4.024 -1.375 -6.265 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -3.318 -0.099 -3.596 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -2.211 -1.129 -4.482 1.00 0.00 H new ATOM 1166 N ILE A 72 -5.266 -2.518 -3.471 1.00 0.00 N ATOM 1167 CA ILE A 72 -5.544 -3.731 -2.712 1.00 0.00 C ATOM 1168 C ILE A 72 -6.308 -4.745 -3.557 1.00 0.00 C ATOM 1169 O ILE A 72 -6.119 -5.953 -3.416 1.00 0.00 O ATOM 1170 CB ILE A 72 -6.355 -3.425 -1.439 1.00 0.00 C ATOM 1171 CG1 ILE A 72 -5.553 -2.519 -0.503 1.00 0.00 C ATOM 1172 CG2 ILE A 72 -6.740 -4.716 -0.733 1.00 0.00 C ATOM 1173 CD1 ILE A 72 -4.382 -3.214 0.156 1.00 0.00 C ATOM 0 H ILE A 72 -5.759 -1.690 -3.137 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.580 -4.152 -2.426 1.00 0.00 H new ATOM 0 HB ILE A 72 -7.269 -2.904 -1.725 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -5.185 -1.662 -1.067 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -6.216 -2.131 0.270 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -7.313 -4.483 0.165 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -7.345 -5.329 -1.401 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -5.838 -5.262 -0.456 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.860 -2.511 0.805 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -4.744 -4.054 0.748 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -3.697 -3.578 -0.610 1.00 0.00 H new ATOM 1185 N ASP A 73 -7.170 -4.245 -4.435 1.00 0.00 N ATOM 1186 CA ASP A 73 -7.961 -5.106 -5.306 1.00 0.00 C ATOM 1187 C ASP A 73 -7.058 -5.948 -6.203 1.00 0.00 C ATOM 1188 O ASP A 73 -7.423 -7.054 -6.606 1.00 0.00 O ATOM 1189 CB ASP A 73 -8.912 -4.268 -6.161 1.00 0.00 C ATOM 1190 CG ASP A 73 -9.547 -5.072 -7.279 1.00 0.00 C ATOM 1191 OD1 ASP A 73 -8.798 -5.623 -8.113 1.00 0.00 O ATOM 1192 OD2 ASP A 73 -10.792 -5.152 -7.318 1.00 0.00 O ATOM 0 H ASP A 73 -7.339 -3.247 -4.562 1.00 0.00 H new ATOM 0 HA ASP A 73 -8.547 -5.777 -4.678 1.00 0.00 H new ATOM 0 HB2 ASP A 73 -9.695 -3.852 -5.527 1.00 0.00 H new ATOM 0 HB3 ASP A 73 -8.366 -3.426 -6.587 1.00 0.00 H new ATOM 1197 N LEU A 74 -5.881 -5.418 -6.513 1.00 0.00 N ATOM 1198 CA LEU A 74 -4.926 -6.120 -7.363 1.00 0.00 C ATOM 1199 C LEU A 74 -4.442 -7.404 -6.695 1.00 0.00 C ATOM 1200 O LEU A 74 -4.222 -8.416 -7.361 1.00 0.00 O ATOM 1201 CB LEU A 74 -3.733 -5.216 -7.679 1.00 0.00 C ATOM 1202 CG LEU A 74 -2.859 -5.645 -8.858 1.00 0.00 C ATOM 1203 CD1 LEU A 74 -3.718 -5.970 -10.070 1.00 0.00 C ATOM 1204 CD2 LEU A 74 -1.847 -4.560 -9.194 1.00 0.00 C ATOM 0 H LEU A 74 -5.564 -4.504 -6.189 1.00 0.00 H new ATOM 0 HA LEU A 74 -5.431 -6.384 -8.292 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -4.106 -4.211 -7.876 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -3.105 -5.154 -6.791 1.00 0.00 H new ATOM 0 HG LEU A 74 -2.315 -6.546 -8.573 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -3.078 -6.273 -10.899 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -4.402 -6.782 -9.824 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -4.290 -5.088 -10.357 1.00 0.00 H new ATOM 0 HD21 LEU A 74 -1.234 -4.883 -10.035 1.00 0.00 H new ATOM 0 HD22 LEU A 74 -2.372 -3.642 -9.458 1.00 0.00 H new ATOM 0 HD23 LEU A 74 -1.209 -4.377 -8.329 1.00 0.00 H new ATOM 1216 N ILE A 75 -4.281 -7.354 -5.378 1.00 0.00 N ATOM 1217 CA ILE A 75 -3.828 -8.514 -4.620 1.00 0.00 C ATOM 1218 C ILE A 75 -4.776 -9.694 -4.801 1.00 0.00 C ATOM 1219 O ILE A 75 -4.348 -10.849 -4.819 1.00 0.00 O ATOM 1220 CB ILE A 75 -3.707 -8.193 -3.118 1.00 0.00 C ATOM 1221 CG1 ILE A 75 -2.543 -7.231 -2.872 1.00 0.00 C ATOM 1222 CG2 ILE A 75 -3.522 -9.473 -2.316 1.00 0.00 C ATOM 1223 CD1 ILE A 75 -2.388 -6.828 -1.422 1.00 0.00 C ATOM 0 H ILE A 75 -4.457 -6.523 -4.813 1.00 0.00 H new ATOM 0 HA ILE A 75 -2.844 -8.779 -5.007 1.00 0.00 H new ATOM 0 HB ILE A 75 -4.628 -7.711 -2.789 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -1.618 -7.698 -3.212 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -2.689 -6.335 -3.476 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -3.438 -9.230 -1.257 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -4.380 -10.127 -2.471 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -2.615 -9.980 -2.645 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.544 -6.146 -1.322 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -3.298 -6.332 -1.083 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.211 -7.716 -0.815 1.00 0.00 H new ATOM 1235 N CYS A 76 -6.063 -9.396 -4.937 1.00 0.00 N ATOM 1236 CA CYS A 76 -7.072 -10.433 -5.119 1.00 0.00 C ATOM 1237 C CYS A 76 -6.957 -11.068 -6.501 1.00 0.00 C ATOM 1238 O CYS A 76 -6.789 -12.281 -6.626 1.00 0.00 O ATOM 1239 CB CYS A 76 -8.473 -9.850 -4.927 1.00 0.00 C ATOM 1240 SG CYS A 76 -8.706 -8.991 -3.354 1.00 0.00 S ATOM 0 H CYS A 76 -6.432 -8.445 -4.925 1.00 0.00 H new ATOM 0 HA CYS A 76 -6.902 -11.206 -4.369 1.00 0.00 H new ATOM 0 HB2 CYS A 76 -8.681 -9.156 -5.742 1.00 0.00 H new ATOM 0 HB3 CYS A 76 -9.203 -10.656 -5.000 1.00 0.00 H new ATOM 0 HG CYS A 76 -8.813 -7.713 -3.569 1.00 0.00 H new ATOM 1246 N SER A 77 -7.051 -10.240 -7.536 1.00 0.00 N ATOM 1247 CA SER A 77 -6.963 -10.721 -8.910 1.00 0.00 C ATOM 1248 C SER A 77 -5.625 -11.411 -9.159 1.00 0.00 C ATOM 1249 O SER A 77 -5.568 -12.473 -9.778 1.00 0.00 O ATOM 1250 CB SER A 77 -7.142 -9.561 -9.891 1.00 0.00 C ATOM 1251 OG SER A 77 -6.672 -8.346 -9.336 1.00 0.00 O ATOM 0 H SER A 77 -7.188 -9.233 -7.450 1.00 0.00 H new ATOM 0 HA SER A 77 -7.761 -11.447 -9.067 1.00 0.00 H new ATOM 0 HB2 SER A 77 -6.603 -9.775 -10.814 1.00 0.00 H new ATOM 0 HB3 SER A 77 -8.195 -9.461 -10.153 1.00 0.00 H new ATOM 0 HG SER A 77 -5.855 -8.516 -8.822 1.00 0.00 H new ATOM 1257 N ASN A 78 -4.551 -10.799 -8.672 1.00 0.00 N ATOM 1258 CA ASN A 78 -3.212 -11.352 -8.842 1.00 0.00 C ATOM 1259 C ASN A 78 -3.146 -12.784 -8.319 1.00 0.00 C ATOM 1260 O ASN A 78 -2.770 -13.704 -9.044 1.00 0.00 O ATOM 1261 CB ASN A 78 -2.183 -10.484 -8.117 1.00 0.00 C ATOM 1262 CG ASN A 78 -1.828 -9.233 -8.898 1.00 0.00 C ATOM 1263 OD1 ASN A 78 -2.675 -8.649 -9.573 1.00 0.00 O ATOM 1264 ND2 ASN A 78 -0.570 -8.817 -8.809 1.00 0.00 N ATOM 0 H ASN A 78 -4.581 -9.920 -8.156 1.00 0.00 H new ATOM 0 HA ASN A 78 -2.982 -11.362 -9.907 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.575 -10.200 -7.140 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -1.279 -11.067 -7.941 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -0.272 -7.981 -9.313 1.00 0.00 H new ATOM 0 HD22 ASN A 78 0.099 -9.333 -8.237 1.00 0.00 H new ATOM 1271 N ALA A 79 -3.514 -12.964 -7.055 1.00 0.00 N ATOM 1272 CA ALA A 79 -3.498 -14.283 -6.435 1.00 0.00 C ATOM 1273 C ALA A 79 -4.474 -15.227 -7.129 1.00 0.00 C ATOM 1274 O ALA A 79 -4.462 -16.435 -6.889 1.00 0.00 O ATOM 1275 CB ALA A 79 -3.830 -14.174 -4.954 1.00 0.00 C ATOM 0 H ALA A 79 -3.827 -12.213 -6.440 1.00 0.00 H new ATOM 0 HA ALA A 79 -2.495 -14.696 -6.542 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -3.814 -15.166 -4.504 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -3.092 -13.540 -4.461 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -4.821 -13.737 -4.835 1.00 0.00 H new ATOM 1281 N LEU A 80 -5.318 -14.670 -7.990 1.00 0.00 N ATOM 1282 CA LEU A 80 -6.301 -15.463 -8.720 1.00 0.00 C ATOM 1283 C LEU A 80 -6.004 -15.456 -10.216 1.00 0.00 C ATOM 1284 O LEU A 80 -6.701 -16.100 -10.999 1.00 0.00 O ATOM 1285 CB LEU A 80 -7.710 -14.924 -8.466 1.00 0.00 C ATOM 1286 CG LEU A 80 -8.161 -14.886 -7.005 1.00 0.00 C ATOM 1287 CD1 LEU A 80 -9.272 -13.865 -6.816 1.00 0.00 C ATOM 1288 CD2 LEU A 80 -8.617 -16.265 -6.551 1.00 0.00 C ATOM 0 H LEU A 80 -5.342 -13.672 -8.200 1.00 0.00 H new ATOM 0 HA LEU A 80 -6.241 -16.491 -8.361 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -7.769 -13.913 -8.870 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -8.417 -15.534 -9.028 1.00 0.00 H new ATOM 0 HG LEU A 80 -7.312 -14.586 -6.390 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -9.580 -13.852 -5.771 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -8.910 -12.877 -7.100 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -10.123 -14.133 -7.442 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -8.934 -16.219 -5.509 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -9.451 -16.594 -7.170 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -7.792 -16.971 -6.648 1.00 0.00 H new ATOM 1300 N GLU A 81 -4.964 -14.725 -10.605 1.00 0.00 N ATOM 1301 CA GLU A 81 -4.575 -14.636 -12.007 1.00 0.00 C ATOM 1302 C GLU A 81 -3.445 -15.613 -12.321 1.00 0.00 C ATOM 1303 O GLU A 81 -3.468 -16.297 -13.344 1.00 0.00 O ATOM 1304 CB GLU A 81 -4.141 -13.210 -12.350 1.00 0.00 C ATOM 1305 CG GLU A 81 -3.363 -13.106 -13.651 1.00 0.00 C ATOM 1306 CD GLU A 81 -4.230 -13.351 -14.870 1.00 0.00 C ATOM 1307 OE1 GLU A 81 -4.999 -14.335 -14.864 1.00 0.00 O ATOM 1308 OE2 GLU A 81 -4.140 -12.558 -15.831 1.00 0.00 O ATOM 0 H GLU A 81 -4.376 -14.186 -9.969 1.00 0.00 H new ATOM 0 HA GLU A 81 -5.440 -14.900 -12.615 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -5.025 -12.576 -12.414 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -3.527 -12.821 -11.538 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -2.913 -12.116 -13.723 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -2.546 -13.827 -13.640 1.00 0.00 H new ATOM 1315 N TYR A 82 -2.458 -15.671 -11.434 1.00 0.00 N ATOM 1316 CA TYR A 82 -1.317 -16.560 -11.616 1.00 0.00 C ATOM 1317 C TYR A 82 -1.587 -17.927 -10.993 1.00 0.00 C ATOM 1318 O TYR A 82 -1.146 -18.954 -11.508 1.00 0.00 O ATOM 1319 CB TYR A 82 -0.060 -15.945 -10.999 1.00 0.00 C ATOM 1320 CG TYR A 82 0.361 -14.647 -11.650 1.00 0.00 C ATOM 1321 CD1 TYR A 82 1.082 -14.645 -12.838 1.00 0.00 C ATOM 1322 CD2 TYR A 82 0.038 -13.423 -11.078 1.00 0.00 C ATOM 1323 CE1 TYR A 82 1.469 -13.461 -13.436 1.00 0.00 C ATOM 1324 CE2 TYR A 82 0.420 -12.235 -11.670 1.00 0.00 C ATOM 1325 CZ TYR A 82 1.136 -12.259 -12.848 1.00 0.00 C ATOM 1326 OH TYR A 82 1.519 -11.078 -13.441 1.00 0.00 O ATOM 0 H TYR A 82 -2.425 -15.112 -10.581 1.00 0.00 H new ATOM 0 HA TYR A 82 -1.160 -16.693 -12.686 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -0.235 -15.769 -9.938 1.00 0.00 H new ATOM 0 HB3 TYR A 82 0.759 -16.661 -11.073 1.00 0.00 H new ATOM 0 HD1 TYR A 82 1.344 -15.585 -13.302 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -0.521 -13.400 -10.154 1.00 0.00 H new ATOM 0 HE1 TYR A 82 2.029 -13.477 -14.359 1.00 0.00 H new ATOM 0 HE2 TYR A 82 0.159 -11.292 -11.212 1.00 0.00 H new ATOM 0 HH TYR A 82 0.864 -10.379 -13.232 1.00 0.00 H new ATOM 1431 N ASP A 90 -5.723 -24.807 -4.195 1.00 0.00 N ATOM 1432 CA ASP A 90 -5.908 -23.391 -4.490 1.00 0.00 C ATOM 1433 C ASP A 90 -7.379 -23.001 -4.381 1.00 0.00 C ATOM 1434 O ASP A 90 -7.714 -21.820 -4.286 1.00 0.00 O ATOM 1435 CB ASP A 90 -5.383 -23.066 -5.889 1.00 0.00 C ATOM 1436 CG ASP A 90 -3.872 -23.157 -5.976 1.00 0.00 C ATOM 1437 OD1 ASP A 90 -3.227 -23.355 -4.925 1.00 0.00 O ATOM 1438 OD2 ASP A 90 -3.334 -23.032 -7.096 1.00 0.00 O ATOM 0 HA ASP A 90 -5.343 -22.816 -3.757 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -5.827 -23.753 -6.609 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -5.700 -22.061 -6.169 1.00 0.00 H new ATOM 1443 N LYS A 91 -8.253 -24.001 -4.398 1.00 0.00 N ATOM 1444 CA LYS A 91 -9.689 -23.765 -4.302 1.00 0.00 C ATOM 1445 C LYS A 91 -10.028 -22.986 -3.035 1.00 0.00 C ATOM 1446 O LYS A 91 -10.868 -22.086 -3.055 1.00 0.00 O ATOM 1447 CB LYS A 91 -10.447 -25.094 -4.315 1.00 0.00 C ATOM 1448 CG LYS A 91 -10.590 -25.699 -5.701 1.00 0.00 C ATOM 1449 CD LYS A 91 -11.526 -26.897 -5.692 1.00 0.00 C ATOM 1450 CE LYS A 91 -11.573 -27.577 -7.052 1.00 0.00 C ATOM 1451 NZ LYS A 91 -12.377 -28.830 -7.018 1.00 0.00 N ATOM 0 H LYS A 91 -7.992 -24.984 -4.477 1.00 0.00 H new ATOM 0 HA LYS A 91 -9.993 -23.172 -5.165 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -9.930 -25.804 -3.669 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -11.439 -24.941 -3.890 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -10.969 -24.945 -6.391 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -9.610 -26.004 -6.069 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -11.197 -27.612 -4.938 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -12.528 -26.575 -5.410 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -11.998 -26.892 -7.786 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -10.559 -27.805 -7.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 -12.385 -29.263 -7.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 -11.957 -29.494 -6.336 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 -13.352 -28.609 -6.730 1.00 0.00 H new ATOM 1465 N ILE A 92 -9.369 -23.337 -1.936 1.00 0.00 N ATOM 1466 CA ILE A 92 -9.600 -22.668 -0.662 1.00 0.00 C ATOM 1467 C ILE A 92 -9.177 -21.205 -0.724 1.00 0.00 C ATOM 1468 O ILE A 92 -9.806 -20.340 -0.114 1.00 0.00 O ATOM 1469 CB ILE A 92 -8.840 -23.362 0.484 1.00 0.00 C ATOM 1470 CG1 ILE A 92 -9.512 -24.690 0.840 1.00 0.00 C ATOM 1471 CG2 ILE A 92 -8.772 -22.453 1.702 1.00 0.00 C ATOM 1472 CD1 ILE A 92 -9.246 -25.790 -0.163 1.00 0.00 C ATOM 0 H ILE A 92 -8.671 -24.080 -1.902 1.00 0.00 H new ATOM 0 HA ILE A 92 -10.671 -22.726 -0.465 1.00 0.00 H new ATOM 0 HB ILE A 92 -7.822 -23.569 0.152 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -9.164 -25.012 1.821 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -10.588 -24.534 0.919 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -8.232 -22.958 2.503 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -8.253 -21.531 1.439 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -9.782 -22.218 2.037 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -9.753 -26.701 0.154 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -9.619 -25.488 -1.142 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -8.173 -25.974 -0.225 1.00 0.00 H new ATOM 1484 N ILE A 93 -8.108 -20.935 -1.466 1.00 0.00 N ATOM 1485 CA ILE A 93 -7.603 -19.575 -1.611 1.00 0.00 C ATOM 1486 C ILE A 93 -8.721 -18.610 -1.989 1.00 0.00 C ATOM 1487 O ILE A 93 -8.885 -17.559 -1.369 1.00 0.00 O ATOM 1488 CB ILE A 93 -6.491 -19.498 -2.674 1.00 0.00 C ATOM 1489 CG1 ILE A 93 -5.319 -20.401 -2.284 1.00 0.00 C ATOM 1490 CG2 ILE A 93 -6.025 -18.060 -2.848 1.00 0.00 C ATOM 1491 CD1 ILE A 93 -4.482 -19.849 -1.151 1.00 0.00 C ATOM 0 H ILE A 93 -7.575 -21.640 -1.976 1.00 0.00 H new ATOM 0 HA ILE A 93 -7.190 -19.287 -0.644 1.00 0.00 H new ATOM 0 HB ILE A 93 -6.892 -19.847 -3.625 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -5.704 -21.379 -1.997 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -4.682 -20.552 -3.155 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -5.239 -18.021 -3.602 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -6.864 -17.442 -3.166 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -5.637 -17.686 -1.900 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -3.670 -20.541 -0.928 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -4.067 -18.884 -1.442 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -5.105 -19.724 -0.266 1.00 0.00 H new ATOM 1503 N ARG A 94 -9.490 -18.976 -3.010 1.00 0.00 N ATOM 1504 CA ARG A 94 -10.594 -18.143 -3.471 1.00 0.00 C ATOM 1505 C ARG A 94 -11.310 -17.488 -2.293 1.00 0.00 C ATOM 1506 O ARG A 94 -11.743 -16.338 -2.378 1.00 0.00 O ATOM 1507 CB ARG A 94 -11.586 -18.977 -4.284 1.00 0.00 C ATOM 1508 CG ARG A 94 -11.107 -19.291 -5.692 1.00 0.00 C ATOM 1509 CD ARG A 94 -12.265 -19.657 -6.606 1.00 0.00 C ATOM 1510 NE ARG A 94 -13.073 -18.492 -6.960 1.00 0.00 N ATOM 1511 CZ ARG A 94 -14.336 -18.568 -7.364 1.00 0.00 C ATOM 1512 NH1 ARG A 94 -14.933 -19.748 -7.464 1.00 0.00 N ATOM 1513 NH2 ARG A 94 -15.004 -17.463 -7.668 1.00 0.00 N ATOM 0 H ARG A 94 -9.369 -19.843 -3.533 1.00 0.00 H new ATOM 0 HA ARG A 94 -10.183 -17.359 -4.106 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -11.779 -19.912 -3.758 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -12.534 -18.443 -4.343 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -10.580 -18.428 -6.099 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -10.394 -20.114 -5.660 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -11.878 -20.119 -7.514 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -12.894 -20.399 -6.114 1.00 0.00 H new ATOM 0 HE ARG A 94 -12.643 -17.569 -6.893 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -14.422 -20.599 -7.230 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -15.903 -19.804 -7.774 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -14.548 -16.554 -7.592 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -15.974 -17.522 -7.978 1.00 0.00 H new ATOM 1527 N HIS A 95 -11.432 -18.228 -1.196 1.00 0.00 N ATOM 1528 CA HIS A 95 -12.096 -17.719 -0.001 1.00 0.00 C ATOM 1529 C HIS A 95 -11.212 -16.708 0.722 1.00 0.00 C ATOM 1530 O HIS A 95 -11.606 -15.560 0.928 1.00 0.00 O ATOM 1531 CB HIS A 95 -12.448 -18.871 0.942 1.00 0.00 C ATOM 1532 CG HIS A 95 -13.611 -18.576 1.838 1.00 0.00 C ATOM 1533 ND1 HIS A 95 -14.867 -18.261 1.364 1.00 0.00 N ATOM 1534 CD2 HIS A 95 -13.704 -18.552 3.189 1.00 0.00 C ATOM 1535 CE1 HIS A 95 -15.681 -18.053 2.383 1.00 0.00 C ATOM 1536 NE2 HIS A 95 -15.000 -18.224 3.502 1.00 0.00 N ATOM 0 H HIS A 95 -11.080 -19.181 -1.109 1.00 0.00 H new ATOM 0 HA HIS A 95 -13.013 -17.218 -0.310 1.00 0.00 H new ATOM 0 HB2 HIS A 95 -12.671 -19.759 0.350 1.00 0.00 H new ATOM 0 HB3 HIS A 95 -11.578 -19.107 1.555 1.00 0.00 H new ATOM 0 HD2 HIS A 95 -12.907 -18.753 3.890 1.00 0.00 H new ATOM 0 HE1 HIS A 95 -16.726 -17.788 2.313 1.00 0.00 H new ATOM 0 HE2 HIS A 95 -15.376 -18.128 4.445 1.00 0.00 H new ATOM 1545 N ARG A 96 -10.016 -17.141 1.106 1.00 0.00 N ATOM 1546 CA ARG A 96 -9.077 -16.274 1.808 1.00 0.00 C ATOM 1547 C ARG A 96 -8.919 -14.942 1.080 1.00 0.00 C ATOM 1548 O ARG A 96 -9.083 -13.876 1.672 1.00 0.00 O ATOM 1549 CB ARG A 96 -7.717 -16.960 1.940 1.00 0.00 C ATOM 1550 CG ARG A 96 -7.763 -18.258 2.729 1.00 0.00 C ATOM 1551 CD ARG A 96 -6.437 -18.999 2.661 1.00 0.00 C ATOM 1552 NE ARG A 96 -5.488 -18.517 3.661 1.00 0.00 N ATOM 1553 CZ ARG A 96 -4.312 -19.088 3.895 1.00 0.00 C ATOM 1554 NH1 ARG A 96 -3.942 -20.157 3.203 1.00 0.00 N ATOM 1555 NH2 ARG A 96 -3.503 -18.590 4.821 1.00 0.00 N ATOM 0 H ARG A 96 -9.674 -18.088 0.943 1.00 0.00 H new ATOM 0 HA ARG A 96 -9.476 -16.079 2.804 1.00 0.00 H new ATOM 0 HB2 ARG A 96 -7.324 -17.164 0.944 1.00 0.00 H new ATOM 0 HB3 ARG A 96 -7.020 -16.276 2.423 1.00 0.00 H new ATOM 0 HG2 ARG A 96 -8.008 -18.044 3.769 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -8.557 -18.894 2.338 1.00 0.00 H new ATOM 0 HD2 ARG A 96 -6.610 -20.065 2.809 1.00 0.00 H new ATOM 0 HD3 ARG A 96 -6.007 -18.881 1.667 1.00 0.00 H new ATOM 0 HE ARG A 96 -5.743 -17.696 4.210 1.00 0.00 H new ATOM 0 HH11 ARG A 96 -4.561 -20.542 2.490 1.00 0.00 H new ATOM 0 HH12 ARG A 96 -3.038 -20.594 3.384 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -3.784 -17.767 5.355 1.00 0.00 H new ATOM 0 HH22 ARG A 96 -2.600 -19.030 4.999 1.00 0.00 H new ATOM 1569 N ALA A 97 -8.598 -15.013 -0.208 1.00 0.00 N ATOM 1570 CA ALA A 97 -8.419 -13.813 -1.017 1.00 0.00 C ATOM 1571 C ALA A 97 -9.654 -12.921 -0.957 1.00 0.00 C ATOM 1572 O ALA A 97 -9.608 -11.817 -0.413 1.00 0.00 O ATOM 1573 CB ALA A 97 -8.108 -14.191 -2.458 1.00 0.00 C ATOM 0 H ALA A 97 -8.457 -15.888 -0.713 1.00 0.00 H new ATOM 0 HA ALA A 97 -7.578 -13.252 -0.610 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -7.977 -13.286 -3.051 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -7.193 -14.782 -2.490 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -8.932 -14.776 -2.867 1.00 0.00 H new ATOM 1579 N CYS A 98 -10.756 -13.405 -1.519 1.00 0.00 N ATOM 1580 CA CYS A 98 -12.004 -12.650 -1.530 1.00 0.00 C ATOM 1581 C CYS A 98 -12.192 -11.890 -0.221 1.00 0.00 C ATOM 1582 O CYS A 98 -12.664 -10.753 -0.211 1.00 0.00 O ATOM 1583 CB CYS A 98 -13.190 -13.587 -1.765 1.00 0.00 C ATOM 1584 SG CYS A 98 -13.359 -14.149 -3.475 1.00 0.00 S ATOM 0 H CYS A 98 -10.811 -14.317 -1.973 1.00 0.00 H new ATOM 0 HA CYS A 98 -11.955 -11.927 -2.344 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -13.086 -14.457 -1.117 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -14.107 -13.077 -1.469 1.00 0.00 H new ATOM 0 HG CYS A 98 -12.715 -15.267 -3.630 1.00 0.00 H new ATOM 1590 N THR A 99 -11.820 -12.528 0.886 1.00 0.00 N ATOM 1591 CA THR A 99 -11.950 -11.914 2.201 1.00 0.00 C ATOM 1592 C THR A 99 -11.084 -10.665 2.313 1.00 0.00 C ATOM 1593 O THR A 99 -11.581 -9.576 2.604 1.00 0.00 O ATOM 1594 CB THR A 99 -11.560 -12.898 3.321 1.00 0.00 C ATOM 1595 OG1 THR A 99 -12.292 -14.120 3.176 1.00 0.00 O ATOM 1596 CG2 THR A 99 -11.834 -12.295 4.690 1.00 0.00 C ATOM 0 H THR A 99 -11.427 -13.469 0.897 1.00 0.00 H new ATOM 0 HA THR A 99 -12.998 -11.637 2.319 1.00 0.00 H new ATOM 0 HB THR A 99 -10.493 -13.103 3.239 1.00 0.00 H new ATOM 0 HG1 THR A 99 -11.958 -14.611 2.396 1.00 0.00 H new ATOM 0 HG21 THR A 99 -11.551 -13.008 5.465 1.00 0.00 H new ATOM 0 HG22 THR A 99 -11.252 -11.381 4.808 1.00 0.00 H new ATOM 0 HG23 THR A 99 -12.895 -12.064 4.780 1.00 0.00 H new ATOM 1604 N LEU A 100 -9.786 -10.827 2.080 1.00 0.00 N ATOM 1605 CA LEU A 100 -8.850 -9.711 2.154 1.00 0.00 C ATOM 1606 C LEU A 100 -9.486 -8.431 1.623 1.00 0.00 C ATOM 1607 O LEU A 100 -9.313 -7.354 2.195 1.00 0.00 O ATOM 1608 CB LEU A 100 -7.581 -10.031 1.361 1.00 0.00 C ATOM 1609 CG LEU A 100 -6.508 -8.942 1.345 1.00 0.00 C ATOM 1610 CD1 LEU A 100 -5.747 -8.924 2.661 1.00 0.00 C ATOM 1611 CD2 LEU A 100 -5.554 -9.151 0.178 1.00 0.00 C ATOM 0 H LEU A 100 -9.358 -11.721 1.838 1.00 0.00 H new ATOM 0 HA LEU A 100 -8.588 -9.557 3.201 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -7.141 -10.941 1.769 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -7.865 -10.249 0.331 1.00 0.00 H new ATOM 0 HG LEU A 100 -6.998 -7.977 1.219 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -4.987 -8.143 2.631 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -6.440 -8.726 3.479 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.268 -9.890 2.817 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -4.797 -8.367 0.182 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -5.070 -10.123 0.273 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -6.111 -9.113 -0.758 1.00 0.00 H new ATOM 1623 N LYS A 101 -10.226 -8.554 0.526 1.00 0.00 N ATOM 1624 CA LYS A 101 -10.892 -7.409 -0.082 1.00 0.00 C ATOM 1625 C LYS A 101 -11.972 -6.854 0.842 1.00 0.00 C ATOM 1626 O LYS A 101 -11.955 -5.674 1.193 1.00 0.00 O ATOM 1627 CB LYS A 101 -11.510 -7.805 -1.425 1.00 0.00 C ATOM 1628 CG LYS A 101 -11.757 -6.627 -2.352 1.00 0.00 C ATOM 1629 CD LYS A 101 -11.801 -7.062 -3.807 1.00 0.00 C ATOM 1630 CE LYS A 101 -13.208 -7.457 -4.228 1.00 0.00 C ATOM 1631 NZ LYS A 101 -13.196 -8.493 -5.298 1.00 0.00 N ATOM 0 H LYS A 101 -10.379 -9.437 0.039 1.00 0.00 H new ATOM 0 HA LYS A 101 -10.145 -6.633 -0.248 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -10.851 -8.516 -1.923 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -12.454 -8.318 -1.244 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -12.698 -6.145 -2.087 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -10.970 -5.885 -2.217 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -11.445 -6.251 -4.441 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -11.125 -7.904 -3.957 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -13.753 -7.834 -3.363 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -13.742 -6.575 -4.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -14.174 -8.735 -5.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -12.698 -8.124 -6.133 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -12.709 -9.344 -4.952 1.00 0.00 H new ATOM 1645 N ASP A 102 -12.907 -7.712 1.234 1.00 0.00 N ATOM 1646 CA ASP A 102 -13.993 -7.308 2.119 1.00 0.00 C ATOM 1647 C ASP A 102 -13.446 -6.690 3.402 1.00 0.00 C ATOM 1648 O ASP A 102 -13.808 -5.571 3.769 1.00 0.00 O ATOM 1649 CB ASP A 102 -14.879 -8.509 2.455 1.00 0.00 C ATOM 1650 CG ASP A 102 -15.651 -9.012 1.251 1.00 0.00 C ATOM 1651 OD1 ASP A 102 -15.822 -8.236 0.287 1.00 0.00 O ATOM 1652 OD2 ASP A 102 -16.084 -10.183 1.272 1.00 0.00 O ATOM 0 H ASP A 102 -12.935 -8.692 0.953 1.00 0.00 H new ATOM 0 HA ASP A 102 -14.591 -6.558 1.601 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -14.260 -9.315 2.849 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -15.580 -8.231 3.242 1.00 0.00 H new ATOM 1657 N THR A 103 -12.572 -7.426 4.082 1.00 0.00 N ATOM 1658 CA THR A 103 -11.977 -6.951 5.325 1.00 0.00 C ATOM 1659 C THR A 103 -11.451 -5.528 5.175 1.00 0.00 C ATOM 1660 O THR A 103 -11.883 -4.619 5.883 1.00 0.00 O ATOM 1661 CB THR A 103 -10.825 -7.866 5.782 1.00 0.00 C ATOM 1662 OG1 THR A 103 -11.282 -9.221 5.871 1.00 0.00 O ATOM 1663 CG2 THR A 103 -10.281 -7.419 7.130 1.00 0.00 C ATOM 0 H THR A 103 -12.261 -8.353 3.793 1.00 0.00 H new ATOM 0 HA THR A 103 -12.765 -6.967 6.078 1.00 0.00 H new ATOM 0 HB THR A 103 -10.024 -7.801 5.046 1.00 0.00 H new ATOM 0 HG1 THR A 103 -10.544 -9.797 6.160 1.00 0.00 H new ATOM 0 HG21 THR A 103 -9.469 -8.080 7.432 1.00 0.00 H new ATOM 0 HG22 THR A 103 -9.908 -6.398 7.051 1.00 0.00 H new ATOM 0 HG23 THR A 103 -11.076 -7.458 7.874 1.00 0.00 H new ATOM 1671 N ALA A 104 -10.517 -5.342 4.248 1.00 0.00 N ATOM 1672 CA ALA A 104 -9.935 -4.029 4.003 1.00 0.00 C ATOM 1673 C ALA A 104 -11.019 -2.985 3.754 1.00 0.00 C ATOM 1674 O ALA A 104 -11.226 -2.084 4.567 1.00 0.00 O ATOM 1675 CB ALA A 104 -8.975 -4.088 2.824 1.00 0.00 C ATOM 0 H ALA A 104 -10.147 -6.085 3.654 1.00 0.00 H new ATOM 0 HA ALA A 104 -9.381 -3.733 4.894 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -8.548 -3.100 2.653 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -8.175 -4.796 3.041 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -9.513 -4.410 1.932 1.00 0.00 H new ATOM 1681 N HIS A 105 -11.708 -3.113 2.625 1.00 0.00 N ATOM 1682 CA HIS A 105 -12.771 -2.180 2.268 1.00 0.00 C ATOM 1683 C HIS A 105 -13.614 -1.825 3.489 1.00 0.00 C ATOM 1684 O HIS A 105 -13.915 -0.656 3.729 1.00 0.00 O ATOM 1685 CB HIS A 105 -13.659 -2.779 1.177 1.00 0.00 C ATOM 1686 CG HIS A 105 -13.107 -2.609 -0.205 1.00 0.00 C ATOM 1687 ND1 HIS A 105 -13.529 -1.620 -1.068 1.00 0.00 N ATOM 1688 CD2 HIS A 105 -12.160 -3.309 -0.871 1.00 0.00 C ATOM 1689 CE1 HIS A 105 -12.866 -1.720 -2.206 1.00 0.00 C ATOM 1690 NE2 HIS A 105 -12.029 -2.737 -2.113 1.00 0.00 N ATOM 0 H HIS A 105 -11.550 -3.853 1.942 1.00 0.00 H new ATOM 0 HA HIS A 105 -12.309 -1.268 1.890 1.00 0.00 H new ATOM 0 HB2 HIS A 105 -13.798 -3.842 1.376 1.00 0.00 H new ATOM 0 HB3 HIS A 105 -14.644 -2.314 1.226 1.00 0.00 H new ATOM 0 HD2 HIS A 105 -11.610 -4.159 -0.496 1.00 0.00 H new ATOM 0 HE1 HIS A 105 -12.988 -1.079 -3.066 1.00 0.00 H new ATOM 0 HE2 HIS A 105 -11.389 -3.047 -2.844 1.00 0.00 H new ATOM 1699 N ALA A 106 -13.992 -2.842 4.257 1.00 0.00 N ATOM 1700 CA ALA A 106 -14.799 -2.636 5.453 1.00 0.00 C ATOM 1701 C ALA A 106 -14.066 -1.764 6.467 1.00 0.00 C ATOM 1702 O ALA A 106 -14.618 -0.785 6.971 1.00 0.00 O ATOM 1703 CB ALA A 106 -15.170 -3.974 6.076 1.00 0.00 C ATOM 0 H ALA A 106 -13.752 -3.816 4.072 1.00 0.00 H new ATOM 0 HA ALA A 106 -15.712 -2.118 5.160 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -15.773 -3.805 6.968 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -15.741 -4.564 5.359 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -14.262 -4.513 6.348 1.00 0.00 H new ATOM 1709 N ILE A 107 -12.823 -2.126 6.762 1.00 0.00 N ATOM 1710 CA ILE A 107 -12.015 -1.376 7.716 1.00 0.00 C ATOM 1711 C ILE A 107 -11.871 0.081 7.288 1.00 0.00 C ATOM 1712 O ILE A 107 -11.873 0.986 8.123 1.00 0.00 O ATOM 1713 CB ILE A 107 -10.613 -1.993 7.874 1.00 0.00 C ATOM 1714 CG1 ILE A 107 -10.695 -3.303 8.661 1.00 0.00 C ATOM 1715 CG2 ILE A 107 -9.677 -1.012 8.565 1.00 0.00 C ATOM 1716 CD1 ILE A 107 -9.416 -4.110 8.625 1.00 0.00 C ATOM 0 H ILE A 107 -12.353 -2.934 6.354 1.00 0.00 H new ATOM 0 HA ILE A 107 -12.533 -1.422 8.674 1.00 0.00 H new ATOM 0 HB ILE A 107 -10.214 -2.210 6.883 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -10.945 -3.079 9.698 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -11.508 -3.908 8.260 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -8.690 -1.463 8.669 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -9.599 -0.102 7.970 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -10.070 -0.767 9.552 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -9.547 -5.025 9.203 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -9.175 -4.364 7.593 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -8.603 -3.523 9.053 1.00 0.00 H new ATOM 1728 N ILE A 108 -11.749 0.299 5.983 1.00 0.00 N ATOM 1729 CA ILE A 108 -11.607 1.646 5.445 1.00 0.00 C ATOM 1730 C ILE A 108 -12.921 2.415 5.534 1.00 0.00 C ATOM 1731 O ILE A 108 -12.962 3.539 6.034 1.00 0.00 O ATOM 1732 CB ILE A 108 -11.140 1.620 3.978 1.00 0.00 C ATOM 1733 CG1 ILE A 108 -9.902 0.733 3.830 1.00 0.00 C ATOM 1734 CG2 ILE A 108 -10.849 3.031 3.489 1.00 0.00 C ATOM 1735 CD1 ILE A 108 -8.635 1.372 4.355 1.00 0.00 C ATOM 0 H ILE A 108 -11.746 -0.439 5.279 1.00 0.00 H new ATOM 0 HA ILE A 108 -10.852 2.149 6.050 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.939 1.202 3.365 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -10.072 -0.205 4.358 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -9.766 0.486 2.777 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -10.520 2.996 2.450 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.753 3.635 3.563 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -10.065 3.474 4.103 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -7.798 0.687 4.218 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -8.441 2.296 3.810 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -8.752 1.594 5.416 1.00 0.00 H new ATOM 1747 N ALA A 109 -13.995 1.800 5.049 1.00 0.00 N ATOM 1748 CA ALA A 109 -15.311 2.424 5.078 1.00 0.00 C ATOM 1749 C ALA A 109 -15.715 2.788 6.502 1.00 0.00 C ATOM 1750 O ALA A 109 -16.327 3.830 6.736 1.00 0.00 O ATOM 1751 CB ALA A 109 -16.347 1.500 4.453 1.00 0.00 C ATOM 0 H ALA A 109 -13.979 0.870 4.631 1.00 0.00 H new ATOM 0 HA ALA A 109 -15.262 3.344 4.496 1.00 0.00 H new ATOM 0 HB1 ALA A 109 -17.326 1.979 4.481 1.00 0.00 H new ATOM 0 HB2 ALA A 109 -16.074 1.294 3.418 1.00 0.00 H new ATOM 0 HB3 ALA A 109 -16.384 0.565 5.011 1.00 0.00 H new ATOM 1757 N ALA A 110 -15.370 1.923 7.450 1.00 0.00 N ATOM 1758 CA ALA A 110 -15.695 2.155 8.852 1.00 0.00 C ATOM 1759 C ALA A 110 -14.805 3.239 9.450 1.00 0.00 C ATOM 1760 O ALA A 110 -15.293 4.267 9.918 1.00 0.00 O ATOM 1761 CB ALA A 110 -15.563 0.864 9.645 1.00 0.00 C ATOM 0 H ALA A 110 -14.865 1.055 7.272 1.00 0.00 H new ATOM 0 HA ALA A 110 -16.728 2.498 8.908 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -15.809 1.052 10.690 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -16.246 0.117 9.241 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -14.539 0.496 9.573 1.00 0.00 H new ATOM 1767 N GLU A 111 -13.497 3.002 9.431 1.00 0.00 N ATOM 1768 CA GLU A 111 -12.540 3.958 9.973 1.00 0.00 C ATOM 1769 C GLU A 111 -12.600 5.280 9.212 1.00 0.00 C ATOM 1770 O GLU A 111 -12.896 6.328 9.787 1.00 0.00 O ATOM 1771 CB GLU A 111 -11.122 3.386 9.912 1.00 0.00 C ATOM 1772 CG GLU A 111 -10.907 2.193 10.829 1.00 0.00 C ATOM 1773 CD GLU A 111 -9.457 2.027 11.239 1.00 0.00 C ATOM 1774 OE1 GLU A 111 -8.996 2.788 12.115 1.00 0.00 O ATOM 1775 OE2 GLU A 111 -8.783 1.134 10.683 1.00 0.00 O ATOM 0 H GLU A 111 -13.077 2.156 9.046 1.00 0.00 H new ATOM 0 HA GLU A 111 -12.804 4.145 11.014 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -10.903 3.089 8.886 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -10.412 4.169 10.176 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -11.522 2.310 11.721 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -11.244 1.287 10.326 1.00 0.00 H new ATOM 1782 N LEU A 112 -12.316 5.222 7.916 1.00 0.00 N ATOM 1783 CA LEU A 112 -12.337 6.413 7.074 1.00 0.00 C ATOM 1784 C LEU A 112 -13.592 7.240 7.331 1.00 0.00 C ATOM 1785 O LEU A 112 -14.658 6.695 7.621 1.00 0.00 O ATOM 1786 CB LEU A 112 -12.265 6.019 5.597 1.00 0.00 C ATOM 1787 CG LEU A 112 -11.821 7.118 4.631 1.00 0.00 C ATOM 1788 CD1 LEU A 112 -10.386 7.534 4.918 1.00 0.00 C ATOM 1789 CD2 LEU A 112 -11.964 6.650 3.190 1.00 0.00 C ATOM 0 H LEU A 112 -12.068 4.363 7.425 1.00 0.00 H new ATOM 0 HA LEU A 112 -11.467 7.020 7.325 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -11.579 5.178 5.499 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -13.249 5.666 5.287 1.00 0.00 H new ATOM 0 HG LEU A 112 -12.465 7.985 4.777 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -10.088 8.317 4.221 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -10.313 7.910 5.938 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.727 6.673 4.801 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -11.644 7.444 2.516 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -11.345 5.767 3.031 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -13.006 6.403 2.990 1.00 0.00 H new ATOM 1801 N ASP A 113 -13.460 8.557 7.221 1.00 0.00 N ATOM 1802 CA ASP A 113 -14.585 9.459 7.439 1.00 0.00 C ATOM 1803 C ASP A 113 -14.922 10.225 6.163 1.00 0.00 C ATOM 1804 O ASP A 113 -14.052 10.537 5.349 1.00 0.00 O ATOM 1805 CB ASP A 113 -14.268 10.440 8.568 1.00 0.00 C ATOM 1806 CG ASP A 113 -14.533 9.850 9.939 1.00 0.00 C ATOM 1807 OD1 ASP A 113 -15.701 9.510 10.224 1.00 0.00 O ATOM 1808 OD2 ASP A 113 -13.573 9.727 10.728 1.00 0.00 O ATOM 0 H ASP A 113 -12.585 9.024 6.982 1.00 0.00 H new ATOM 0 HA ASP A 113 -15.450 8.859 7.721 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -13.222 10.741 8.501 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -14.868 11.341 8.441 1.00 0.00 H new ATOM 1813 N PRO A 114 -16.214 10.534 5.982 1.00 0.00 N ATOM 1814 CA PRO A 114 -16.696 11.266 4.807 1.00 0.00 C ATOM 1815 C PRO A 114 -16.247 12.723 4.807 1.00 0.00 C ATOM 1816 O PRO A 114 -16.465 13.449 3.838 1.00 0.00 O ATOM 1817 CB PRO A 114 -18.219 11.176 4.932 1.00 0.00 C ATOM 1818 CG PRO A 114 -18.468 10.990 6.389 1.00 0.00 C ATOM 1819 CD PRO A 114 -17.305 10.192 6.910 1.00 0.00 C ATOM 0 HA PRO A 114 -16.306 10.848 3.879 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -18.701 12.080 4.560 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -18.615 10.342 4.353 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -18.541 11.951 6.898 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -19.408 10.466 6.560 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -17.059 10.463 7.937 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -17.517 9.123 6.905 1.00 0.00 H new ATOM 1827 N GLU A 115 -15.618 13.143 5.900 1.00 0.00 N ATOM 1828 CA GLU A 115 -15.138 14.515 6.025 1.00 0.00 C ATOM 1829 C GLU A 115 -13.629 14.586 5.807 1.00 0.00 C ATOM 1830 O GLU A 115 -13.114 15.566 5.269 1.00 0.00 O ATOM 1831 CB GLU A 115 -15.492 15.079 7.403 1.00 0.00 C ATOM 1832 CG GLU A 115 -16.987 15.188 7.650 1.00 0.00 C ATOM 1833 CD GLU A 115 -17.326 16.172 8.752 1.00 0.00 C ATOM 1834 OE1 GLU A 115 -17.285 15.776 9.936 1.00 0.00 O ATOM 1835 OE2 GLU A 115 -17.633 17.339 8.431 1.00 0.00 O ATOM 0 H GLU A 115 -15.429 12.554 6.711 1.00 0.00 H new ATOM 0 HA GLU A 115 -15.627 15.115 5.258 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -15.051 14.443 8.171 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -15.042 16.066 7.509 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -17.482 15.495 6.729 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -17.381 14.206 7.911 1.00 0.00 H new ATOM 1842 N PHE A 116 -12.927 13.539 6.228 1.00 0.00 N ATOM 1843 CA PHE A 116 -11.477 13.483 6.081 1.00 0.00 C ATOM 1844 C PHE A 116 -11.090 13.126 4.649 1.00 0.00 C ATOM 1845 O PHE A 116 -10.132 13.668 4.100 1.00 0.00 O ATOM 1846 CB PHE A 116 -10.884 12.460 7.052 1.00 0.00 C ATOM 1847 CG PHE A 116 -9.400 12.283 6.904 1.00 0.00 C ATOM 1848 CD1 PHE A 116 -8.527 13.283 7.298 1.00 0.00 C ATOM 1849 CD2 PHE A 116 -8.878 11.116 6.369 1.00 0.00 C ATOM 1850 CE1 PHE A 116 -7.160 13.124 7.164 1.00 0.00 C ATOM 1851 CE2 PHE A 116 -7.513 10.950 6.233 1.00 0.00 C ATOM 1852 CZ PHE A 116 -6.653 11.956 6.629 1.00 0.00 C ATOM 0 H PHE A 116 -13.338 12.719 6.673 1.00 0.00 H new ATOM 0 HA PHE A 116 -11.074 14.469 6.313 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -11.105 12.770 8.073 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -11.374 11.498 6.898 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -8.919 14.199 7.715 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -9.546 10.327 6.055 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -6.490 13.911 7.477 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -7.119 10.034 5.817 1.00 0.00 H new ATOM 0 HZ PHE A 116 -5.586 11.829 6.520 1.00 0.00 H new ATOM 1862 N ASN A 117 -11.842 12.208 4.050 1.00 0.00 N ATOM 1863 CA ASN A 117 -11.577 11.776 2.682 1.00 0.00 C ATOM 1864 C ASN A 117 -11.566 12.967 1.729 1.00 0.00 C ATOM 1865 O ASN A 117 -10.677 13.095 0.886 1.00 0.00 O ATOM 1866 CB ASN A 117 -12.628 10.759 2.234 1.00 0.00 C ATOM 1867 CG ASN A 117 -12.434 10.323 0.794 1.00 0.00 C ATOM 1868 OD1 ASN A 117 -11.741 9.343 0.519 1.00 0.00 O ATOM 1869 ND2 ASN A 117 -13.045 11.052 -0.132 1.00 0.00 N ATOM 0 H ASN A 117 -12.639 11.749 4.490 1.00 0.00 H new ATOM 0 HA ASN A 117 -10.594 11.306 2.659 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -12.585 9.885 2.884 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -13.621 11.193 2.349 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -12.950 10.808 -1.118 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -13.609 11.856 0.142 1.00 0.00 H new ATOM 1876 N LYS A 118 -12.560 13.838 1.867 1.00 0.00 N ATOM 1877 CA LYS A 118 -12.666 15.021 1.021 1.00 0.00 C ATOM 1878 C LYS A 118 -11.411 15.881 1.129 1.00 0.00 C ATOM 1879 O LYS A 118 -11.094 16.651 0.221 1.00 0.00 O ATOM 1880 CB LYS A 118 -13.896 15.843 1.410 1.00 0.00 C ATOM 1881 CG LYS A 118 -15.172 15.024 1.500 1.00 0.00 C ATOM 1882 CD LYS A 118 -16.387 15.908 1.729 1.00 0.00 C ATOM 1883 CE LYS A 118 -16.147 16.904 2.853 1.00 0.00 C ATOM 1884 NZ LYS A 118 -15.544 18.170 2.353 1.00 0.00 N ATOM 0 H LYS A 118 -13.305 13.747 2.558 1.00 0.00 H new ATOM 0 HA LYS A 118 -12.770 14.690 -0.012 1.00 0.00 H new ATOM 0 HB2 LYS A 118 -13.713 16.322 2.372 1.00 0.00 H new ATOM 0 HB3 LYS A 118 -14.036 16.639 0.679 1.00 0.00 H new ATOM 0 HG2 LYS A 118 -15.304 14.453 0.581 1.00 0.00 H new ATOM 0 HG3 LYS A 118 -15.086 14.304 2.314 1.00 0.00 H new ATOM 0 HD2 LYS A 118 -16.626 16.444 0.811 1.00 0.00 H new ATOM 0 HD3 LYS A 118 -17.250 15.287 1.970 1.00 0.00 H new ATOM 0 HE2 LYS A 118 -17.091 17.124 3.351 1.00 0.00 H new ATOM 0 HE3 LYS A 118 -15.489 16.458 3.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 -14.575 18.262 2.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 -15.520 18.156 1.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 -16.115 18.977 2.675 1.00 0.00 H new ATOM 1898 N LEU A 119 -10.700 15.745 2.242 1.00 0.00 N ATOM 1899 CA LEU A 119 -9.478 16.509 2.468 1.00 0.00 C ATOM 1900 C LEU A 119 -8.281 15.828 1.811 1.00 0.00 C ATOM 1901 O LEU A 119 -7.611 16.414 0.960 1.00 0.00 O ATOM 1902 CB LEU A 119 -9.226 16.674 3.968 1.00 0.00 C ATOM 1903 CG LEU A 119 -10.302 17.428 4.750 1.00 0.00 C ATOM 1904 CD1 LEU A 119 -9.938 17.500 6.225 1.00 0.00 C ATOM 1905 CD2 LEU A 119 -10.496 18.825 4.178 1.00 0.00 C ATOM 0 H LEU A 119 -10.948 15.113 3.003 1.00 0.00 H new ATOM 0 HA LEU A 119 -9.605 17.493 2.017 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -9.112 15.683 4.408 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.277 17.193 4.102 1.00 0.00 H new ATOM 0 HG LEU A 119 -11.242 16.884 4.655 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -10.715 18.040 6.766 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -9.850 16.491 6.628 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.987 18.021 6.340 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -11.265 19.347 4.747 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -9.559 19.378 4.242 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -10.803 18.752 3.135 1.00 0.00 H new ATOM 1917 N CYS A 120 -8.019 14.589 2.212 1.00 0.00 N ATOM 1918 CA CYS A 120 -6.904 13.827 1.661 1.00 0.00 C ATOM 1919 C CYS A 120 -6.861 13.947 0.141 1.00 0.00 C ATOM 1920 O CYS A 120 -5.789 13.930 -0.462 1.00 0.00 O ATOM 1921 CB CYS A 120 -7.014 12.356 2.066 1.00 0.00 C ATOM 1922 SG CYS A 120 -8.332 11.454 1.218 1.00 0.00 S ATOM 0 H CYS A 120 -8.563 14.091 2.916 1.00 0.00 H new ATOM 0 HA CYS A 120 -5.980 14.239 2.066 1.00 0.00 H new ATOM 0 HB2 CYS A 120 -6.063 11.863 1.865 1.00 0.00 H new ATOM 0 HB3 CYS A 120 -7.182 12.298 3.141 1.00 0.00 H new ATOM 0 HG CYS A 120 -9.226 12.294 0.788 1.00 0.00 H new ATOM 1928 N GLU A 121 -8.035 14.066 -0.471 1.00 0.00 N ATOM 1929 CA GLU A 121 -8.131 14.186 -1.921 1.00 0.00 C ATOM 1930 C GLU A 121 -8.004 15.643 -2.356 1.00 0.00 C ATOM 1931 O GLU A 121 -7.560 15.932 -3.467 1.00 0.00 O ATOM 1932 CB GLU A 121 -9.459 13.608 -2.416 1.00 0.00 C ATOM 1933 CG GLU A 121 -10.644 14.533 -2.197 1.00 0.00 C ATOM 1934 CD GLU A 121 -11.933 13.974 -2.767 1.00 0.00 C ATOM 1935 OE1 GLU A 121 -12.099 14.007 -4.004 1.00 0.00 O ATOM 1936 OE2 GLU A 121 -12.776 13.503 -1.975 1.00 0.00 O ATOM 0 H GLU A 121 -8.932 14.082 0.014 1.00 0.00 H new ATOM 0 HA GLU A 121 -7.310 13.621 -2.362 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -9.375 13.385 -3.480 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -9.647 12.663 -1.906 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -10.770 14.710 -1.129 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -10.436 15.499 -2.657 1.00 0.00 H new ATOM 1943 N GLU A 122 -8.396 16.555 -1.472 1.00 0.00 N ATOM 1944 CA GLU A 122 -8.327 17.981 -1.766 1.00 0.00 C ATOM 1945 C GLU A 122 -6.935 18.370 -2.254 1.00 0.00 C ATOM 1946 O GLU A 122 -6.784 19.269 -3.081 1.00 0.00 O ATOM 1947 CB GLU A 122 -8.691 18.798 -0.524 1.00 0.00 C ATOM 1948 CG GLU A 122 -8.990 20.258 -0.823 1.00 0.00 C ATOM 1949 CD GLU A 122 -9.140 21.091 0.435 1.00 0.00 C ATOM 1950 OE1 GLU A 122 -10.057 20.804 1.232 1.00 0.00 O ATOM 1951 OE2 GLU A 122 -8.339 22.031 0.623 1.00 0.00 O ATOM 0 H GLU A 122 -8.764 16.332 -0.547 1.00 0.00 H new ATOM 0 HA GLU A 122 -9.044 18.198 -2.558 1.00 0.00 H new ATOM 0 HB2 GLU A 122 -9.561 18.348 -0.045 1.00 0.00 H new ATOM 0 HB3 GLU A 122 -7.870 18.743 0.191 1.00 0.00 H new ATOM 0 HG2 GLU A 122 -8.188 20.671 -1.435 1.00 0.00 H new ATOM 0 HG3 GLU A 122 -9.906 20.325 -1.410 1.00 0.00 H new ATOM 1958 N ILE A 123 -5.920 17.686 -1.734 1.00 0.00 N ATOM 1959 CA ILE A 123 -4.541 17.959 -2.117 1.00 0.00 C ATOM 1960 C ILE A 123 -4.240 17.420 -3.511 1.00 0.00 C ATOM 1961 O ILE A 123 -3.453 18.002 -4.258 1.00 0.00 O ATOM 1962 CB ILE A 123 -3.546 17.342 -1.115 1.00 0.00 C ATOM 1963 CG1 ILE A 123 -3.641 18.056 0.235 1.00 0.00 C ATOM 1964 CG2 ILE A 123 -2.129 17.418 -1.661 1.00 0.00 C ATOM 1965 CD1 ILE A 123 -3.212 17.196 1.404 1.00 0.00 C ATOM 0 H ILE A 123 -6.028 16.940 -1.047 1.00 0.00 H new ATOM 0 HA ILE A 123 -4.422 19.042 -2.116 1.00 0.00 H new ATOM 0 HB ILE A 123 -3.803 16.293 -0.970 1.00 0.00 H new ATOM 0 HG12 ILE A 123 -3.022 18.953 0.207 1.00 0.00 H new ATOM 0 HG13 ILE A 123 -4.669 18.383 0.393 1.00 0.00 H new ATOM 0 HG21 ILE A 123 -1.438 16.978 -0.942 1.00 0.00 H new ATOM 0 HG22 ILE A 123 -2.072 16.870 -2.601 1.00 0.00 H new ATOM 0 HG23 ILE A 123 -1.860 18.460 -1.832 1.00 0.00 H new ATOM 0 HD11 ILE A 123 -3.305 17.766 2.328 1.00 0.00 H new ATOM 0 HD12 ILE A 123 -3.847 16.312 1.457 1.00 0.00 H new ATOM 0 HD13 ILE A 123 -2.175 16.890 1.269 1.00 0.00 H new ATOM 1977 N LYS A 124 -4.873 16.304 -3.858 1.00 0.00 N ATOM 1978 CA LYS A 124 -4.677 15.687 -5.164 1.00 0.00 C ATOM 1979 C LYS A 124 -4.736 16.731 -6.274 1.00 0.00 C ATOM 1980 O LYS A 124 -3.887 16.751 -7.164 1.00 0.00 O ATOM 1981 CB LYS A 124 -5.737 14.610 -5.406 1.00 0.00 C ATOM 1982 CG LYS A 124 -5.353 13.610 -6.483 1.00 0.00 C ATOM 1983 CD LYS A 124 -6.129 12.311 -6.340 1.00 0.00 C ATOM 1984 CE LYS A 124 -7.550 12.450 -6.865 1.00 0.00 C ATOM 1985 NZ LYS A 124 -8.421 11.331 -6.411 1.00 0.00 N ATOM 0 H LYS A 124 -5.527 15.808 -3.252 1.00 0.00 H new ATOM 0 HA LYS A 124 -3.689 15.226 -5.175 1.00 0.00 H new ATOM 0 HB2 LYS A 124 -5.919 14.075 -4.474 1.00 0.00 H new ATOM 0 HB3 LYS A 124 -6.674 15.091 -5.686 1.00 0.00 H new ATOM 0 HG2 LYS A 124 -5.542 14.042 -7.466 1.00 0.00 H new ATOM 0 HG3 LYS A 124 -4.284 13.405 -6.426 1.00 0.00 H new ATOM 0 HD2 LYS A 124 -5.615 11.517 -6.883 1.00 0.00 H new ATOM 0 HD3 LYS A 124 -6.155 12.015 -5.291 1.00 0.00 H new ATOM 0 HE2 LYS A 124 -7.971 13.397 -6.528 1.00 0.00 H new ATOM 0 HE3 LYS A 124 -7.533 12.478 -7.955 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 -9.381 11.462 -6.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 -8.034 10.429 -6.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 -8.458 11.319 -5.372 1.00 0.00 H new