USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 847 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 73 ASN :FLIP amide:sc= -0.0653 F(o=-1.2,f=-0.065) USER MOD Set 1.2: A 75 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 53 MET CE :methyl 163:sc= -0.0126 (180deg=-0.257) USER MOD Set 2.2: A 108 GLN : amide:sc= 0 K(o=-0.013,f=-0.99) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot -79:sc=0.000822 USER MOD Single : A 16 TYR OH : rot -176:sc= 1.27 USER MOD Single : A 17 THR OG1 : rot 33:sc= 0.0308 USER MOD Single : A 18 ASN : amide:sc= 0.995 K(o=1,f=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 THR OG1 : rot -65:sc= 1.23 USER MOD Single : A 31 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.143) USER MOD Single : A 35 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 ASN :FLIP amide:sc= -0.138 F(o=-2.6!,f=-0.14) USER MOD Single : A 39 ASN :FLIP amide:sc= -0.0855 F(o=-0.62,f=-0.085) USER MOD Single : A 40 ASN : amide:sc=-0.00119 X(o=-0.0012,f=-0.1) USER MOD Single : A 41 SER OG : rot 30:sc= 0.232 USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 SER OG : rot 180:sc= 0.0975 USER MOD Single : A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot 41:sc= 0.2 USER MOD Single : A 63 ASN :FLIP amide:sc= -1.32 F(o=-4.3!,f=-1.3) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 66 SER OG : rot 10:sc= 0.333 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN :FLIP amide:sc= 0.0399 F(o=-0.85,f=0.04) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 SER OG : rot 116:sc= 1.18 USER MOD Single : A 83 CYS SG : rot -170:sc= -1.18 USER MOD Single : A 84 MET CE :methyl -165:sc= -0.22 (180deg=-0.694) USER MOD Single : A 87 ASN : amide:sc= -0.388 K(o=-0.39,f=-5.4!) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 49:sc= 0.966 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 SER OG : rot 180:sc=-0.00804 USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 ASN : amide:sc=-0.00747 X(o=-0.0075,f=-0.25) USER MOD ----------------------------------------------------------------- ATOM 103 N LYS A 8 -2.449 0.452 -17.713 1.00 0.00 N ATOM 104 CA LYS A 8 -3.647 0.785 -18.473 1.00 0.00 C ATOM 105 C LYS A 8 -3.561 0.031 -19.796 1.00 0.00 C ATOM 106 O LYS A 8 -2.508 0.052 -20.436 1.00 0.00 O ATOM 107 CB LYS A 8 -3.726 2.297 -18.753 1.00 0.00 C ATOM 108 CG LYS A 8 -5.078 2.675 -19.396 1.00 0.00 C ATOM 109 CD LYS A 8 -5.047 3.877 -20.349 1.00 0.00 C ATOM 110 CE LYS A 8 -4.236 3.608 -21.626 1.00 0.00 C ATOM 111 NZ LYS A 8 -4.460 4.645 -22.658 1.00 0.00 N ATOM 0 HA LYS A 8 -4.535 0.507 -17.906 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -3.596 2.849 -17.822 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -2.911 2.590 -19.415 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -5.454 1.810 -19.943 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -5.793 2.884 -18.600 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -6.068 4.144 -20.623 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -4.622 4.735 -19.829 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -3.175 3.567 -21.379 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -4.508 2.632 -22.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -3.893 4.423 -23.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -5.468 4.668 -22.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -4.176 5.573 -22.285 1.00 0.00 H new ATOM 125 N VAL A 9 -4.646 -0.616 -20.206 1.00 0.00 N ATOM 126 CA VAL A 9 -4.677 -1.344 -21.460 1.00 0.00 C ATOM 127 C VAL A 9 -4.654 -0.313 -22.580 1.00 0.00 C ATOM 128 O VAL A 9 -5.378 0.686 -22.520 1.00 0.00 O ATOM 129 CB VAL A 9 -5.956 -2.195 -21.531 1.00 0.00 C ATOM 130 CG1 VAL A 9 -6.078 -2.925 -22.880 1.00 0.00 C ATOM 131 CG2 VAL A 9 -6.018 -3.224 -20.389 1.00 0.00 C ATOM 0 H VAL A 9 -5.520 -0.648 -19.681 1.00 0.00 H new ATOM 0 HA VAL A 9 -3.823 -2.016 -21.549 1.00 0.00 H new ATOM 0 HB VAL A 9 -6.792 -1.503 -21.427 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -6.994 -3.516 -22.892 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -6.107 -2.194 -23.688 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -5.220 -3.583 -23.017 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -6.936 -3.806 -20.473 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -5.158 -3.891 -20.453 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -6.004 -2.705 -19.431 1.00 0.00 H new ATOM 141 N ARG A 10 -3.845 -0.548 -23.611 1.00 0.00 N ATOM 142 CA ARG A 10 -3.748 0.356 -24.742 1.00 0.00 C ATOM 143 C ARG A 10 -4.422 -0.295 -25.940 1.00 0.00 C ATOM 144 O ARG A 10 -3.843 -1.218 -26.508 1.00 0.00 O ATOM 145 CB ARG A 10 -2.271 0.667 -25.008 1.00 0.00 C ATOM 146 CG ARG A 10 -2.126 1.779 -26.049 1.00 0.00 C ATOM 147 CD ARG A 10 -0.676 1.919 -26.511 1.00 0.00 C ATOM 148 NE ARG A 10 -0.468 3.217 -27.162 1.00 0.00 N ATOM 149 CZ ARG A 10 -0.920 3.598 -28.361 1.00 0.00 C ATOM 150 NH1 ARG A 10 -1.523 2.758 -29.199 1.00 0.00 N ATOM 151 NH2 ARG A 10 -0.769 4.871 -28.684 1.00 0.00 N ATOM 0 H ARG A 10 -3.243 -1.368 -23.681 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.253 1.300 -24.540 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -1.785 0.967 -24.079 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -1.763 -0.232 -25.357 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -2.764 1.564 -26.906 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -2.468 2.723 -25.626 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -0.005 1.822 -25.657 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -0.429 1.114 -27.204 1.00 0.00 H new ATOM 0 HE ARG A 10 0.081 3.903 -26.644 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -1.655 1.782 -28.935 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -1.853 3.091 -30.105 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -0.324 5.514 -28.029 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -1.098 5.210 -29.588 1.00 0.00 H new ATOM 165 N PHE A 11 -5.675 0.057 -26.238 1.00 0.00 N ATOM 166 CA PHE A 11 -6.354 -0.491 -27.413 1.00 0.00 C ATOM 167 C PHE A 11 -5.865 0.369 -28.575 1.00 0.00 C ATOM 168 O PHE A 11 -5.633 1.568 -28.388 1.00 0.00 O ATOM 169 CB PHE A 11 -7.883 -0.433 -27.286 1.00 0.00 C ATOM 170 CG PHE A 11 -8.414 -1.280 -26.146 1.00 0.00 C ATOM 171 CD1 PHE A 11 -8.369 -2.683 -26.239 1.00 0.00 C ATOM 172 CD2 PHE A 11 -8.928 -0.675 -24.984 1.00 0.00 C ATOM 173 CE1 PHE A 11 -8.896 -3.477 -25.206 1.00 0.00 C ATOM 174 CE2 PHE A 11 -9.423 -1.474 -23.939 1.00 0.00 C ATOM 175 CZ PHE A 11 -9.429 -2.873 -24.056 1.00 0.00 C ATOM 0 H PHE A 11 -6.234 0.711 -25.689 1.00 0.00 H new ATOM 0 HA PHE A 11 -6.125 -1.548 -27.547 1.00 0.00 H new ATOM 0 HB2 PHE A 11 -8.191 0.602 -27.137 1.00 0.00 H new ATOM 0 HB3 PHE A 11 -8.333 -0.768 -28.221 1.00 0.00 H new ATOM 0 HD1 PHE A 11 -7.928 -3.151 -27.107 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -8.942 0.401 -24.895 1.00 0.00 H new ATOM 0 HE1 PHE A 11 -8.891 -4.553 -25.297 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -9.801 -1.009 -23.041 1.00 0.00 H new ATOM 0 HZ PHE A 11 -9.842 -3.482 -23.265 1.00 0.00 H new ATOM 185 N ASP A 12 -5.771 -0.203 -29.771 1.00 0.00 N ATOM 186 CA ASP A 12 -5.286 0.537 -30.932 1.00 0.00 C ATOM 187 C ASP A 12 -6.262 1.607 -31.395 1.00 0.00 C ATOM 188 O ASP A 12 -5.800 2.686 -31.766 1.00 0.00 O ATOM 189 CB ASP A 12 -4.902 -0.426 -32.056 1.00 0.00 C ATOM 190 CG ASP A 12 -3.557 -1.076 -31.752 1.00 0.00 C ATOM 191 OD1 ASP A 12 -3.439 -1.780 -30.722 1.00 0.00 O ATOM 192 OD2 ASP A 12 -2.581 -0.803 -32.483 1.00 0.00 O ATOM 0 H ASP A 12 -6.023 -1.173 -29.962 1.00 0.00 H new ATOM 0 HA ASP A 12 -4.388 1.075 -30.629 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -5.669 -1.193 -32.166 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -4.850 0.111 -33.003 1.00 0.00 H new ATOM 197 N GLU A 13 -7.567 1.350 -31.256 1.00 0.00 N ATOM 198 CA GLU A 13 -8.723 2.182 -31.586 1.00 0.00 C ATOM 199 C GLU A 13 -9.087 2.193 -33.074 1.00 0.00 C ATOM 200 O GLU A 13 -8.268 2.452 -33.959 1.00 0.00 O ATOM 201 CB GLU A 13 -8.583 3.593 -31.006 1.00 0.00 C ATOM 202 CG GLU A 13 -9.886 4.408 -31.089 1.00 0.00 C ATOM 203 CD GLU A 13 -9.953 5.513 -30.028 1.00 0.00 C ATOM 204 OE1 GLU A 13 -10.454 5.214 -28.913 1.00 0.00 O ATOM 205 OE2 GLU A 13 -9.518 6.659 -30.279 1.00 0.00 O ATOM 0 H GLU A 13 -7.868 0.456 -30.867 1.00 0.00 H new ATOM 0 HA GLU A 13 -9.575 1.707 -31.101 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -8.271 3.522 -29.964 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -7.794 4.123 -31.540 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -9.970 4.854 -32.080 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -10.738 3.739 -30.967 1.00 0.00 H new ATOM 212 N GLY A 14 -10.377 1.975 -33.324 1.00 0.00 N ATOM 213 CA GLY A 14 -10.996 1.915 -34.637 1.00 0.00 C ATOM 214 C GLY A 14 -10.297 0.899 -35.529 1.00 0.00 C ATOM 215 O GLY A 14 -10.194 1.088 -36.741 1.00 0.00 O ATOM 0 H GLY A 14 -11.050 1.828 -32.572 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -12.048 1.650 -34.534 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -10.960 2.899 -35.104 1.00 0.00 H new ATOM 219 N SER A 15 -9.823 -0.183 -34.928 1.00 0.00 N ATOM 220 CA SER A 15 -9.134 -1.259 -35.612 1.00 0.00 C ATOM 221 C SER A 15 -9.604 -2.624 -35.083 1.00 0.00 C ATOM 222 O SER A 15 -10.373 -2.678 -34.117 1.00 0.00 O ATOM 223 CB SER A 15 -7.635 -0.964 -35.559 1.00 0.00 C ATOM 224 OG SER A 15 -7.147 -0.685 -34.266 1.00 0.00 O ATOM 0 H SER A 15 -9.911 -0.337 -33.924 1.00 0.00 H new ATOM 0 HA SER A 15 -9.382 -1.318 -36.672 1.00 0.00 H new ATOM 0 HB2 SER A 15 -7.093 -1.819 -35.963 1.00 0.00 H new ATOM 0 HB3 SER A 15 -7.420 -0.115 -36.208 1.00 0.00 H new ATOM 0 HG SER A 15 -7.368 0.239 -34.025 1.00 0.00 H new ATOM 230 N TYR A 16 -9.072 -3.712 -35.649 1.00 0.00 N ATOM 231 CA TYR A 16 -9.382 -5.104 -35.335 1.00 0.00 C ATOM 232 C TYR A 16 -8.771 -5.466 -33.975 1.00 0.00 C ATOM 233 O TYR A 16 -8.191 -4.600 -33.306 1.00 0.00 O ATOM 234 CB TYR A 16 -8.766 -6.000 -36.427 1.00 0.00 C ATOM 235 CG TYR A 16 -9.545 -7.256 -36.742 1.00 0.00 C ATOM 236 CD1 TYR A 16 -10.652 -7.184 -37.605 1.00 0.00 C ATOM 237 CD2 TYR A 16 -9.168 -8.489 -36.179 1.00 0.00 C ATOM 238 CE1 TYR A 16 -11.393 -8.347 -37.900 1.00 0.00 C ATOM 239 CE2 TYR A 16 -9.926 -9.642 -36.433 1.00 0.00 C ATOM 240 CZ TYR A 16 -11.040 -9.578 -37.296 1.00 0.00 C ATOM 241 OH TYR A 16 -11.731 -10.714 -37.578 1.00 0.00 O ATOM 0 H TYR A 16 -8.370 -3.635 -36.385 1.00 0.00 H new ATOM 0 HA TYR A 16 -10.462 -5.249 -35.295 1.00 0.00 H new ATOM 0 HB2 TYR A 16 -8.666 -5.415 -37.341 1.00 0.00 H new ATOM 0 HB3 TYR A 16 -7.760 -6.283 -36.118 1.00 0.00 H new ATOM 0 HD1 TYR A 16 -10.935 -6.238 -38.042 1.00 0.00 H new ATOM 0 HD2 TYR A 16 -8.292 -8.548 -35.549 1.00 0.00 H new ATOM 0 HE1 TYR A 16 -12.227 -8.299 -38.584 1.00 0.00 H new ATOM 0 HE2 TYR A 16 -9.657 -10.579 -35.968 1.00 0.00 H new ATOM 0 HH TYR A 16 -11.391 -11.449 -37.027 1.00 0.00 H new ATOM 251 N THR A 17 -8.757 -6.742 -33.576 1.00 0.00 N ATOM 252 CA THR A 17 -8.239 -7.018 -32.251 1.00 0.00 C ATOM 253 C THR A 17 -6.715 -7.011 -32.315 1.00 0.00 C ATOM 254 O THR A 17 -6.049 -7.813 -32.978 1.00 0.00 O ATOM 255 CB THR A 17 -8.693 -8.442 -31.884 1.00 0.00 C ATOM 256 OG1 THR A 17 -8.305 -9.365 -32.872 1.00 0.00 O ATOM 257 CG2 THR A 17 -10.204 -8.576 -31.770 1.00 0.00 C ATOM 0 H THR A 17 -9.077 -7.546 -34.116 1.00 0.00 H new ATOM 0 HA THR A 17 -8.589 -6.282 -31.527 1.00 0.00 H new ATOM 0 HB THR A 17 -8.223 -8.643 -30.921 1.00 0.00 H new ATOM 0 HG1 THR A 17 -7.457 -9.079 -33.272 1.00 0.00 H new ATOM 0 HG21 THR A 17 -10.460 -9.603 -31.509 1.00 0.00 H new ATOM 0 HG22 THR A 17 -10.572 -7.903 -30.996 1.00 0.00 H new ATOM 0 HG23 THR A 17 -10.665 -8.318 -32.723 1.00 0.00 H new ATOM 265 N ASN A 18 -6.212 -6.089 -31.510 1.00 0.00 N ATOM 266 CA ASN A 18 -4.842 -5.717 -31.233 1.00 0.00 C ATOM 267 C ASN A 18 -4.917 -4.823 -29.999 1.00 0.00 C ATOM 268 O ASN A 18 -5.944 -4.159 -29.803 1.00 0.00 O ATOM 269 CB ASN A 18 -4.277 -4.898 -32.400 1.00 0.00 C ATOM 270 CG ASN A 18 -2.763 -4.920 -32.431 1.00 0.00 C ATOM 271 OD1 ASN A 18 -2.190 -5.817 -33.040 1.00 0.00 O ATOM 272 ND2 ASN A 18 -2.081 -4.006 -31.768 1.00 0.00 N ATOM 0 H ASN A 18 -6.847 -5.508 -30.963 1.00 0.00 H new ATOM 0 HA ASN A 18 -4.206 -6.590 -31.088 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -4.664 -5.292 -33.340 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -4.623 -3.867 -32.320 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -1.062 -4.039 -31.757 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -2.573 -3.266 -31.267 1.00 0.00 H new ATOM 279 N PHE A 19 -3.894 -4.808 -29.164 1.00 0.00 N ATOM 280 CA PHE A 19 -3.793 -3.989 -27.966 1.00 0.00 C ATOM 281 C PHE A 19 -2.371 -4.180 -27.435 1.00 0.00 C ATOM 282 O PHE A 19 -1.611 -4.999 -27.957 1.00 0.00 O ATOM 283 CB PHE A 19 -4.869 -4.355 -26.915 1.00 0.00 C ATOM 284 CG PHE A 19 -4.689 -5.701 -26.247 1.00 0.00 C ATOM 285 CD1 PHE A 19 -5.206 -6.869 -26.845 1.00 0.00 C ATOM 286 CD2 PHE A 19 -3.997 -5.781 -25.024 1.00 0.00 C ATOM 287 CE1 PHE A 19 -5.020 -8.117 -26.224 1.00 0.00 C ATOM 288 CE2 PHE A 19 -3.799 -7.027 -24.417 1.00 0.00 C ATOM 289 CZ PHE A 19 -4.304 -8.183 -25.019 1.00 0.00 C ATOM 0 H PHE A 19 -3.071 -5.394 -29.308 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.980 -2.940 -28.196 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.878 -3.584 -26.145 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -5.846 -4.335 -27.397 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -5.744 -6.805 -27.779 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -3.620 -4.884 -24.555 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -5.424 -9.014 -26.669 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -3.257 -7.095 -23.485 1.00 0.00 H new ATOM 0 HZ PHE A 19 -4.141 -9.142 -24.549 1.00 0.00 H new ATOM 299 N ILE A 20 -1.985 -3.470 -26.381 1.00 0.00 N ATOM 300 CA ILE A 20 -0.658 -3.603 -25.801 1.00 0.00 C ATOM 301 C ILE A 20 -0.822 -3.686 -24.296 1.00 0.00 C ATOM 302 O ILE A 20 -1.570 -2.901 -23.703 1.00 0.00 O ATOM 303 CB ILE A 20 0.265 -2.435 -26.217 1.00 0.00 C ATOM 304 CG1 ILE A 20 0.302 -2.287 -27.753 1.00 0.00 C ATOM 305 CG2 ILE A 20 1.687 -2.601 -25.652 1.00 0.00 C ATOM 306 CD1 ILE A 20 1.321 -1.268 -28.253 1.00 0.00 C ATOM 0 H ILE A 20 -2.581 -2.790 -25.908 1.00 0.00 H new ATOM 0 HA ILE A 20 -0.175 -4.507 -26.171 1.00 0.00 H new ATOM 0 HB ILE A 20 -0.152 -1.523 -25.790 1.00 0.00 H new ATOM 0 HG12 ILE A 20 0.526 -3.257 -28.196 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -0.689 -1.997 -28.104 1.00 0.00 H new ATOM 0 HG21 ILE A 20 2.304 -1.760 -25.967 1.00 0.00 H new ATOM 0 HG22 ILE A 20 1.645 -2.632 -24.563 1.00 0.00 H new ATOM 0 HG23 ILE A 20 2.121 -3.529 -26.025 1.00 0.00 H new ATOM 0 HD11 ILE A 20 1.286 -1.222 -29.341 1.00 0.00 H new ATOM 0 HD12 ILE A 20 1.086 -0.287 -27.841 1.00 0.00 H new ATOM 0 HD13 ILE A 20 2.320 -1.566 -27.934 1.00 0.00 H new ATOM 318 N TYR A 21 -0.173 -4.679 -23.694 1.00 0.00 N ATOM 319 CA TYR A 21 -0.152 -4.899 -22.259 1.00 0.00 C ATOM 320 C TYR A 21 1.323 -5.085 -21.891 1.00 0.00 C ATOM 321 O TYR A 21 2.030 -5.816 -22.581 1.00 0.00 O ATOM 322 CB TYR A 21 -0.939 -6.137 -21.847 1.00 0.00 C ATOM 323 CG TYR A 21 -0.771 -6.416 -20.364 1.00 0.00 C ATOM 324 CD1 TYR A 21 -1.539 -5.726 -19.403 1.00 0.00 C ATOM 325 CD2 TYR A 21 0.214 -7.325 -19.940 1.00 0.00 C ATOM 326 CE1 TYR A 21 -1.303 -5.914 -18.032 1.00 0.00 C ATOM 327 CE2 TYR A 21 0.457 -7.519 -18.572 1.00 0.00 C ATOM 328 CZ TYR A 21 -0.274 -6.786 -17.612 1.00 0.00 C ATOM 329 OH TYR A 21 -0.002 -6.918 -16.286 1.00 0.00 O ATOM 0 H TYR A 21 0.368 -5.372 -24.211 1.00 0.00 H new ATOM 0 HA TYR A 21 -0.617 -4.057 -21.745 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -1.995 -5.995 -22.077 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -0.600 -6.997 -22.424 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -2.315 -5.047 -19.725 1.00 0.00 H new ATOM 0 HD2 TYR A 21 0.786 -7.877 -20.671 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -1.905 -5.394 -17.302 1.00 0.00 H new ATOM 0 HE2 TYR A 21 1.204 -8.230 -18.253 1.00 0.00 H new ATOM 0 HH TYR A 21 0.732 -7.556 -16.165 1.00 0.00 H new ATOM 339 N ASP A 22 1.776 -4.499 -20.785 1.00 0.00 N ATOM 340 CA ASP A 22 3.151 -4.573 -20.277 1.00 0.00 C ATOM 341 C ASP A 22 4.217 -4.310 -21.340 1.00 0.00 C ATOM 342 O ASP A 22 5.238 -4.993 -21.439 1.00 0.00 O ATOM 343 CB ASP A 22 3.417 -5.864 -19.491 1.00 0.00 C ATOM 344 CG ASP A 22 4.687 -5.765 -18.638 1.00 0.00 C ATOM 345 OD1 ASP A 22 4.943 -4.672 -18.078 1.00 0.00 O ATOM 346 OD2 ASP A 22 5.364 -6.804 -18.458 1.00 0.00 O ATOM 0 H ASP A 22 1.171 -3.934 -20.189 1.00 0.00 H new ATOM 0 HA ASP A 22 3.239 -3.748 -19.571 1.00 0.00 H new ATOM 0 HB2 ASP A 22 2.564 -6.079 -18.848 1.00 0.00 H new ATOM 0 HB3 ASP A 22 3.511 -6.699 -20.186 1.00 0.00 H new ATOM 351 N ASN A 23 3.964 -3.296 -22.165 1.00 0.00 N ATOM 352 CA ASN A 23 4.850 -2.852 -23.240 1.00 0.00 C ATOM 353 C ASN A 23 5.100 -3.941 -24.297 1.00 0.00 C ATOM 354 O ASN A 23 6.108 -3.913 -25.014 1.00 0.00 O ATOM 355 CB ASN A 23 6.153 -2.268 -22.650 1.00 0.00 C ATOM 356 CG ASN A 23 5.898 -1.362 -21.449 1.00 0.00 C ATOM 357 OD1 ASN A 23 5.443 -0.228 -21.596 1.00 0.00 O ATOM 358 ND2 ASN A 23 6.151 -1.814 -20.232 1.00 0.00 N ATOM 0 H ASN A 23 3.109 -2.743 -22.102 1.00 0.00 H new ATOM 0 HA ASN A 23 4.345 -2.052 -23.782 1.00 0.00 H new ATOM 0 HB2 ASN A 23 6.810 -3.085 -22.351 1.00 0.00 H new ATOM 0 HB3 ASN A 23 6.676 -1.704 -23.422 1.00 0.00 H new ATOM 0 HD21 ASN A 23 5.969 -1.223 -19.421 1.00 0.00 H new ATOM 0 HD22 ASN A 23 6.528 -2.753 -20.105 1.00 0.00 H new ATOM 365 N LYS A 24 4.200 -4.923 -24.406 1.00 0.00 N ATOM 366 CA LYS A 24 4.247 -6.035 -25.350 1.00 0.00 C ATOM 367 C LYS A 24 2.956 -5.981 -26.150 1.00 0.00 C ATOM 368 O LYS A 24 1.878 -5.837 -25.569 1.00 0.00 O ATOM 369 CB LYS A 24 4.350 -7.373 -24.600 1.00 0.00 C ATOM 370 CG LYS A 24 5.675 -7.561 -23.839 1.00 0.00 C ATOM 371 CD LYS A 24 5.494 -8.055 -22.395 1.00 0.00 C ATOM 372 CE LYS A 24 4.930 -9.471 -22.282 1.00 0.00 C ATOM 373 NZ LYS A 24 5.105 -10.027 -20.927 1.00 0.00 N ATOM 0 H LYS A 24 3.377 -4.962 -23.805 1.00 0.00 H new ATOM 0 HA LYS A 24 5.118 -5.957 -26.000 1.00 0.00 H new ATOM 0 HB2 LYS A 24 3.523 -7.447 -23.894 1.00 0.00 H new ATOM 0 HB3 LYS A 24 4.233 -8.188 -25.314 1.00 0.00 H new ATOM 0 HG2 LYS A 24 6.297 -8.273 -24.382 1.00 0.00 H new ATOM 0 HG3 LYS A 24 6.213 -6.613 -23.825 1.00 0.00 H new ATOM 0 HD2 LYS A 24 6.458 -8.019 -21.887 1.00 0.00 H new ATOM 0 HD3 LYS A 24 4.830 -7.369 -21.869 1.00 0.00 H new ATOM 0 HE2 LYS A 24 3.870 -9.461 -22.536 1.00 0.00 H new ATOM 0 HE3 LYS A 24 5.425 -10.118 -23.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 4.709 -10.988 -20.892 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 6.118 -10.061 -20.694 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 4.611 -9.424 -20.238 1.00 0.00 H new ATOM 387 N SER A 25 3.052 -6.008 -27.474 1.00 0.00 N ATOM 388 CA SER A 25 1.872 -5.983 -28.318 1.00 0.00 C ATOM 389 C SER A 25 1.234 -7.367 -28.244 1.00 0.00 C ATOM 390 O SER A 25 1.918 -8.389 -28.346 1.00 0.00 O ATOM 391 CB SER A 25 2.234 -5.564 -29.735 1.00 0.00 C ATOM 392 OG SER A 25 2.758 -4.242 -29.727 1.00 0.00 O ATOM 0 H SER A 25 3.935 -6.047 -27.982 1.00 0.00 H new ATOM 0 HA SER A 25 1.150 -5.243 -27.974 1.00 0.00 H new ATOM 0 HB2 SER A 25 2.968 -6.254 -30.152 1.00 0.00 H new ATOM 0 HB3 SER A 25 1.353 -5.612 -30.375 1.00 0.00 H new ATOM 0 HG SER A 25 2.991 -3.977 -30.641 1.00 0.00 H new ATOM 398 N TYR A 26 -0.075 -7.365 -28.027 1.00 0.00 N ATOM 399 CA TYR A 26 -0.939 -8.523 -27.884 1.00 0.00 C ATOM 400 C TYR A 26 -2.164 -8.387 -28.788 1.00 0.00 C ATOM 401 O TYR A 26 -2.450 -7.315 -29.329 1.00 0.00 O ATOM 402 CB TYR A 26 -1.343 -8.619 -26.402 1.00 0.00 C ATOM 403 CG TYR A 26 -0.494 -9.519 -25.527 1.00 0.00 C ATOM 404 CD1 TYR A 26 0.721 -9.046 -25.014 1.00 0.00 C ATOM 405 CD2 TYR A 26 -0.930 -10.816 -25.193 1.00 0.00 C ATOM 406 CE1 TYR A 26 1.508 -9.861 -24.190 1.00 0.00 C ATOM 407 CE2 TYR A 26 -0.136 -11.654 -24.388 1.00 0.00 C ATOM 408 CZ TYR A 26 1.097 -11.177 -23.888 1.00 0.00 C ATOM 409 OH TYR A 26 1.839 -11.928 -23.034 1.00 0.00 O ATOM 0 H TYR A 26 -0.594 -6.491 -27.941 1.00 0.00 H new ATOM 0 HA TYR A 26 -0.421 -9.433 -28.186 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -1.325 -7.615 -25.978 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -2.374 -8.968 -26.351 1.00 0.00 H new ATOM 0 HD1 TYR A 26 1.053 -8.047 -25.255 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -1.883 -11.171 -25.558 1.00 0.00 H new ATOM 0 HE1 TYR A 26 2.434 -9.480 -23.784 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -0.467 -12.655 -24.154 1.00 0.00 H new ATOM 0 HH TYR A 26 1.424 -12.809 -22.928 1.00 0.00 H new ATOM 419 N PHE A 27 -2.899 -9.477 -28.981 1.00 0.00 N ATOM 420 CA PHE A 27 -4.104 -9.515 -29.792 1.00 0.00 C ATOM 421 C PHE A 27 -5.047 -10.557 -29.202 1.00 0.00 C ATOM 422 O PHE A 27 -4.646 -11.348 -28.345 1.00 0.00 O ATOM 423 CB PHE A 27 -3.756 -9.781 -31.260 1.00 0.00 C ATOM 424 CG PHE A 27 -3.229 -11.161 -31.592 1.00 0.00 C ATOM 425 CD1 PHE A 27 -1.848 -11.434 -31.551 1.00 0.00 C ATOM 426 CD2 PHE A 27 -4.128 -12.166 -31.989 1.00 0.00 C ATOM 427 CE1 PHE A 27 -1.373 -12.705 -31.917 1.00 0.00 C ATOM 428 CE2 PHE A 27 -3.648 -13.435 -32.342 1.00 0.00 C ATOM 429 CZ PHE A 27 -2.273 -13.703 -32.317 1.00 0.00 C ATOM 0 H PHE A 27 -2.665 -10.379 -28.566 1.00 0.00 H new ATOM 0 HA PHE A 27 -4.612 -8.551 -29.777 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -4.649 -9.604 -31.859 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -3.012 -9.048 -31.572 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -1.155 -10.667 -31.239 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -5.188 -11.961 -32.022 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -0.314 -12.913 -31.890 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -4.341 -14.210 -32.635 1.00 0.00 H new ATOM 0 HZ PHE A 27 -1.907 -14.677 -32.606 1.00 0.00 H new ATOM 439 N VAL A 28 -6.310 -10.548 -29.629 1.00 0.00 N ATOM 440 CA VAL A 28 -7.310 -11.484 -29.131 1.00 0.00 C ATOM 441 C VAL A 28 -7.471 -12.617 -30.141 1.00 0.00 C ATOM 442 O VAL A 28 -7.643 -12.370 -31.338 1.00 0.00 O ATOM 443 CB VAL A 28 -8.625 -10.758 -28.784 1.00 0.00 C ATOM 444 CG1 VAL A 28 -9.509 -11.749 -28.004 1.00 0.00 C ATOM 445 CG2 VAL A 28 -8.409 -9.477 -27.957 1.00 0.00 C ATOM 0 H VAL A 28 -6.664 -9.894 -30.327 1.00 0.00 H new ATOM 0 HA VAL A 28 -6.982 -11.931 -28.193 1.00 0.00 H new ATOM 0 HB VAL A 28 -9.100 -10.438 -29.711 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -10.451 -11.267 -27.741 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -9.709 -12.623 -28.623 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -8.994 -12.058 -27.095 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -9.373 -9.013 -27.746 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -7.914 -9.729 -27.019 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -7.787 -8.781 -28.520 1.00 0.00 H new ATOM 455 N THR A 29 -7.343 -13.854 -29.664 1.00 0.00 N ATOM 456 CA THR A 29 -7.450 -15.053 -30.480 1.00 0.00 C ATOM 457 C THR A 29 -8.887 -15.585 -30.457 1.00 0.00 C ATOM 458 O THR A 29 -9.728 -15.118 -29.694 1.00 0.00 O ATOM 459 CB THR A 29 -6.473 -16.125 -29.936 1.00 0.00 C ATOM 460 OG1 THR A 29 -6.910 -16.710 -28.726 1.00 0.00 O ATOM 461 CG2 THR A 29 -5.064 -15.614 -29.638 1.00 0.00 C ATOM 0 H THR A 29 -7.159 -14.050 -28.680 1.00 0.00 H new ATOM 0 HA THR A 29 -7.190 -14.814 -31.511 1.00 0.00 H new ATOM 0 HB THR A 29 -6.452 -16.843 -30.756 1.00 0.00 H new ATOM 0 HG1 THR A 29 -6.926 -16.030 -28.021 1.00 0.00 H new ATOM 0 HG21 THR A 29 -4.452 -16.434 -29.262 1.00 0.00 H new ATOM 0 HG22 THR A 29 -4.620 -15.218 -30.551 1.00 0.00 H new ATOM 0 HG23 THR A 29 -5.114 -14.825 -28.888 1.00 0.00 H new ATOM 469 N ASP A 30 -9.177 -16.571 -31.300 1.00 0.00 N ATOM 470 CA ASP A 30 -10.470 -17.244 -31.405 1.00 0.00 C ATOM 471 C ASP A 30 -10.669 -18.268 -30.269 1.00 0.00 C ATOM 472 O ASP A 30 -11.785 -18.724 -30.032 1.00 0.00 O ATOM 473 CB ASP A 30 -10.542 -17.964 -32.753 1.00 0.00 C ATOM 474 CG ASP A 30 -9.599 -19.161 -32.858 1.00 0.00 C ATOM 475 OD1 ASP A 30 -8.368 -18.959 -32.717 1.00 0.00 O ATOM 476 OD2 ASP A 30 -10.055 -20.285 -33.164 1.00 0.00 O ATOM 0 H ASP A 30 -8.489 -16.939 -31.957 1.00 0.00 H new ATOM 0 HA ASP A 30 -11.258 -16.495 -31.324 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -11.565 -18.302 -32.921 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -10.306 -17.255 -33.547 1.00 0.00 H new ATOM 481 N LYS A 31 -9.601 -18.656 -29.560 1.00 0.00 N ATOM 482 CA LYS A 31 -9.633 -19.606 -28.442 1.00 0.00 C ATOM 483 C LYS A 31 -10.395 -19.019 -27.261 1.00 0.00 C ATOM 484 O LYS A 31 -9.982 -17.992 -26.726 1.00 0.00 O ATOM 485 CB LYS A 31 -8.216 -19.937 -27.962 1.00 0.00 C ATOM 486 CG LYS A 31 -7.611 -21.112 -28.714 1.00 0.00 C ATOM 487 CD LYS A 31 -7.270 -20.879 -30.186 1.00 0.00 C ATOM 488 CE LYS A 31 -6.267 -21.944 -30.647 1.00 0.00 C ATOM 489 NZ LYS A 31 -6.704 -23.332 -30.368 1.00 0.00 N ATOM 0 H LYS A 31 -8.663 -18.306 -29.755 1.00 0.00 H new ATOM 0 HA LYS A 31 -10.126 -20.509 -28.803 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -7.579 -19.062 -28.087 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -8.240 -20.164 -26.896 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -6.701 -21.415 -28.197 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -8.306 -21.950 -28.654 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -8.174 -20.927 -30.793 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -6.848 -19.883 -30.321 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -6.099 -21.833 -31.718 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -5.311 -21.767 -30.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -6.059 -24.000 -30.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -6.691 -23.501 -29.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -7.669 -23.471 -30.729 1.00 0.00 H new ATOM 503 N GLU A 32 -11.437 -19.702 -26.806 1.00 0.00 N ATOM 504 CA GLU A 32 -12.290 -19.294 -25.699 1.00 0.00 C ATOM 505 C GLU A 32 -12.086 -20.214 -24.506 1.00 0.00 C ATOM 506 O GLU A 32 -11.842 -21.413 -24.683 1.00 0.00 O ATOM 507 CB GLU A 32 -13.720 -19.368 -26.206 1.00 0.00 C ATOM 508 CG GLU A 32 -14.809 -18.731 -25.346 1.00 0.00 C ATOM 509 CD GLU A 32 -16.157 -19.047 -26.019 1.00 0.00 C ATOM 510 OE1 GLU A 32 -16.362 -18.622 -27.186 1.00 0.00 O ATOM 511 OE2 GLU A 32 -16.957 -19.837 -25.472 1.00 0.00 O ATOM 0 H GLU A 32 -11.722 -20.592 -27.215 1.00 0.00 H new ATOM 0 HA GLU A 32 -12.051 -18.285 -25.365 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -13.752 -18.900 -27.190 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -13.973 -20.419 -26.345 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -14.782 -19.129 -24.332 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -14.659 -17.654 -25.270 1.00 0.00 H new ATOM 518 N ILE A 33 -12.181 -19.665 -23.296 1.00 0.00 N ATOM 519 CA ILE A 33 -12.002 -20.386 -22.043 1.00 0.00 C ATOM 520 C ILE A 33 -13.339 -20.374 -21.271 1.00 0.00 C ATOM 521 O ILE A 33 -14.037 -19.357 -21.282 1.00 0.00 O ATOM 522 CB ILE A 33 -10.850 -19.684 -21.288 1.00 0.00 C ATOM 523 CG1 ILE A 33 -9.435 -20.047 -21.807 1.00 0.00 C ATOM 524 CG2 ILE A 33 -10.783 -20.033 -19.793 1.00 0.00 C ATOM 525 CD1 ILE A 33 -9.126 -19.702 -23.258 1.00 0.00 C ATOM 0 H ILE A 33 -12.391 -18.676 -23.160 1.00 0.00 H new ATOM 0 HA ILE A 33 -11.735 -21.433 -22.183 1.00 0.00 H new ATOM 0 HB ILE A 33 -11.092 -18.635 -21.460 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -8.702 -19.545 -21.175 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -9.289 -21.119 -21.674 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -9.950 -19.502 -19.332 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -11.714 -19.738 -19.308 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -10.638 -21.107 -19.676 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -8.107 -20.007 -23.495 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -9.823 -20.225 -23.913 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -9.227 -18.627 -23.406 1.00 0.00 H new ATOM 537 N PRO A 34 -13.715 -21.480 -20.598 1.00 0.00 N ATOM 538 CA PRO A 34 -14.952 -21.564 -19.823 1.00 0.00 C ATOM 539 C PRO A 34 -14.829 -20.750 -18.536 1.00 0.00 C ATOM 540 O PRO A 34 -13.730 -20.616 -17.992 1.00 0.00 O ATOM 541 CB PRO A 34 -15.159 -23.057 -19.561 1.00 0.00 C ATOM 542 CG PRO A 34 -13.749 -23.612 -19.544 1.00 0.00 C ATOM 543 CD PRO A 34 -12.979 -22.732 -20.518 1.00 0.00 C ATOM 0 HA PRO A 34 -15.811 -21.145 -20.348 1.00 0.00 H new ATOM 0 HB2 PRO A 34 -15.670 -23.231 -18.614 1.00 0.00 H new ATOM 0 HB3 PRO A 34 -15.764 -23.521 -20.340 1.00 0.00 H new ATOM 0 HG2 PRO A 34 -13.318 -23.568 -18.544 1.00 0.00 H new ATOM 0 HG3 PRO A 34 -13.730 -24.657 -19.854 1.00 0.00 H new ATOM 0 HD2 PRO A 34 -11.960 -22.564 -20.169 1.00 0.00 H new ATOM 0 HD3 PRO A 34 -12.907 -23.205 -21.497 1.00 0.00 H new ATOM 551 N GLN A 35 -15.954 -20.247 -18.016 1.00 0.00 N ATOM 552 CA GLN A 35 -15.961 -19.435 -16.800 1.00 0.00 C ATOM 553 C GLN A 35 -15.305 -20.142 -15.614 1.00 0.00 C ATOM 554 O GLN A 35 -14.645 -19.487 -14.813 1.00 0.00 O ATOM 555 CB GLN A 35 -17.368 -18.910 -16.474 1.00 0.00 C ATOM 556 CG GLN A 35 -18.419 -19.966 -16.103 1.00 0.00 C ATOM 557 CD GLN A 35 -19.782 -19.343 -15.816 1.00 0.00 C ATOM 558 OE1 GLN A 35 -20.757 -19.577 -16.527 1.00 0.00 O ATOM 559 NE2 GLN A 35 -19.909 -18.552 -14.768 1.00 0.00 N ATOM 0 H GLN A 35 -16.877 -20.391 -18.425 1.00 0.00 H new ATOM 0 HA GLN A 35 -15.340 -18.563 -17.002 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -17.287 -18.203 -15.648 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -17.733 -18.352 -17.336 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -18.513 -20.684 -16.917 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -18.082 -20.520 -15.227 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -19.102 -18.356 -14.176 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -20.814 -18.136 -14.549 1.00 0.00 H new ATOM 568 N GLU A 36 -15.414 -21.465 -15.522 1.00 0.00 N ATOM 569 CA GLU A 36 -14.813 -22.236 -14.431 1.00 0.00 C ATOM 570 C GLU A 36 -13.276 -22.175 -14.428 1.00 0.00 C ATOM 571 O GLU A 36 -12.648 -22.500 -13.419 1.00 0.00 O ATOM 572 CB GLU A 36 -15.286 -23.696 -14.482 1.00 0.00 C ATOM 573 CG GLU A 36 -14.739 -24.475 -15.690 1.00 0.00 C ATOM 574 CD GLU A 36 -15.002 -25.969 -15.575 1.00 0.00 C ATOM 575 OE1 GLU A 36 -14.200 -26.671 -14.926 1.00 0.00 O ATOM 576 OE2 GLU A 36 -16.028 -26.469 -16.089 1.00 0.00 O ATOM 0 H GLU A 36 -15.920 -22.035 -16.200 1.00 0.00 H new ATOM 0 HA GLU A 36 -15.149 -21.775 -13.502 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -14.981 -24.201 -13.565 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -16.375 -23.716 -14.510 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -15.198 -24.096 -16.603 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -13.666 -24.302 -15.777 1.00 0.00 H new ATOM 583 N ASN A 37 -12.660 -21.838 -15.570 1.00 0.00 N ATOM 584 CA ASN A 37 -11.200 -21.740 -15.671 1.00 0.00 C ATOM 585 C ASN A 37 -10.733 -20.313 -15.359 1.00 0.00 C ATOM 586 O ASN A 37 -9.531 -20.106 -15.171 1.00 0.00 O ATOM 587 CB ASN A 37 -10.707 -22.150 -17.070 1.00 0.00 C ATOM 588 CG ASN A 37 -10.479 -23.644 -17.264 1.00 0.00 C ATOM 589 OD1 ASN A 37 -11.517 -24.446 -17.136 1.00 0.00 O flip ATOM 590 ND2 ASN A 37 -9.377 -24.093 -17.575 1.00 0.00 N flip ATOM 0 H ASN A 37 -13.153 -21.629 -16.438 1.00 0.00 H new ATOM 0 HA ASN A 37 -10.774 -22.426 -14.939 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -11.434 -21.811 -17.808 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -9.774 -21.626 -17.277 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -8.579 -23.465 -17.672 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -9.261 -25.093 -17.736 1.00 0.00 H new ATOM 597 N VAL A 38 -11.633 -19.326 -15.359 1.00 0.00 N ATOM 598 CA VAL A 38 -11.312 -17.931 -15.071 1.00 0.00 C ATOM 599 C VAL A 38 -10.989 -17.801 -13.577 1.00 0.00 C ATOM 600 O VAL A 38 -11.777 -18.207 -12.726 1.00 0.00 O ATOM 601 CB VAL A 38 -12.470 -17.016 -15.519 1.00 0.00 C ATOM 602 CG1 VAL A 38 -12.163 -15.546 -15.226 1.00 0.00 C ATOM 603 CG2 VAL A 38 -12.725 -17.150 -17.031 1.00 0.00 C ATOM 0 H VAL A 38 -12.621 -19.479 -15.563 1.00 0.00 H new ATOM 0 HA VAL A 38 -10.434 -17.611 -15.632 1.00 0.00 H new ATOM 0 HB VAL A 38 -13.350 -17.330 -14.958 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -12.999 -14.927 -15.554 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -12.011 -15.413 -14.155 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -11.261 -15.249 -15.760 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -13.546 -16.495 -17.321 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -11.825 -16.868 -17.578 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -12.984 -18.182 -17.266 1.00 0.00 H new ATOM 613 N ASN A 39 -9.798 -17.281 -13.260 1.00 0.00 N ATOM 614 CA ASN A 39 -9.343 -17.082 -11.891 1.00 0.00 C ATOM 615 C ASN A 39 -10.057 -15.869 -11.311 1.00 0.00 C ATOM 616 O ASN A 39 -10.773 -16.009 -10.324 1.00 0.00 O ATOM 617 CB ASN A 39 -7.820 -16.886 -11.848 1.00 0.00 C ATOM 618 CG ASN A 39 -7.260 -16.992 -10.436 1.00 0.00 C ATOM 619 OD1 ASN A 39 -7.560 -16.067 -9.539 1.00 0.00 O flip ATOM 620 ND2 ASN A 39 -6.544 -17.942 -10.142 1.00 0.00 N flip ATOM 0 H ASN A 39 -9.119 -16.985 -13.961 1.00 0.00 H new ATOM 0 HA ASN A 39 -9.578 -17.964 -11.296 1.00 0.00 H new ATOM 0 HB2 ASN A 39 -7.342 -17.633 -12.482 1.00 0.00 H new ATOM 0 HB3 ASN A 39 -7.570 -15.909 -12.262 1.00 0.00 H new ATOM 0 HD21 ASN A 39 -6.320 -18.648 -10.843 1.00 0.00 H new ATOM 0 HD22 ASN A 39 -6.172 -18.026 -9.196 1.00 0.00 H new ATOM 627 N ASN A 40 -9.870 -14.667 -11.879 1.00 0.00 N ATOM 628 CA ASN A 40 -10.539 -13.456 -11.401 1.00 0.00 C ATOM 629 C ASN A 40 -10.483 -12.347 -12.461 1.00 0.00 C ATOM 630 O ASN A 40 -9.853 -12.497 -13.511 1.00 0.00 O ATOM 631 CB ASN A 40 -9.976 -12.974 -10.046 1.00 0.00 C ATOM 632 CG ASN A 40 -8.828 -11.991 -10.188 1.00 0.00 C ATOM 633 OD1 ASN A 40 -8.953 -10.832 -9.809 1.00 0.00 O ATOM 634 ND2 ASN A 40 -7.717 -12.401 -10.775 1.00 0.00 N ATOM 0 H ASN A 40 -9.254 -14.512 -12.677 1.00 0.00 H new ATOM 0 HA ASN A 40 -11.586 -13.709 -11.231 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -10.777 -12.506 -9.473 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -9.637 -13.837 -9.473 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -6.946 -11.749 -10.919 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -7.631 -13.369 -11.084 1.00 0.00 H new ATOM 641 N SER A 41 -11.183 -11.242 -12.201 1.00 0.00 N ATOM 642 CA SER A 41 -11.259 -10.065 -13.061 1.00 0.00 C ATOM 643 C SER A 41 -9.892 -9.394 -13.158 1.00 0.00 C ATOM 644 O SER A 41 -9.260 -9.200 -12.124 1.00 0.00 O ATOM 645 CB SER A 41 -12.270 -9.102 -12.427 1.00 0.00 C ATOM 646 OG SER A 41 -11.945 -8.890 -11.058 1.00 0.00 O ATOM 0 H SER A 41 -11.735 -11.141 -11.349 1.00 0.00 H new ATOM 0 HA SER A 41 -11.568 -10.345 -14.068 1.00 0.00 H new ATOM 0 HB2 SER A 41 -12.265 -8.152 -12.962 1.00 0.00 H new ATOM 0 HB3 SER A 41 -13.277 -9.511 -12.512 1.00 0.00 H new ATOM 0 HG SER A 41 -10.976 -8.968 -10.936 1.00 0.00 H new ATOM 652 N LYS A 42 -9.450 -8.985 -14.350 1.00 0.00 N ATOM 653 CA LYS A 42 -8.144 -8.356 -14.500 1.00 0.00 C ATOM 654 C LYS A 42 -8.241 -6.875 -14.803 1.00 0.00 C ATOM 655 O LYS A 42 -7.549 -6.121 -14.125 1.00 0.00 O ATOM 656 CB LYS A 42 -7.322 -9.078 -15.567 1.00 0.00 C ATOM 657 CG LYS A 42 -5.829 -8.720 -15.467 1.00 0.00 C ATOM 658 CD LYS A 42 -5.000 -9.868 -14.883 1.00 0.00 C ATOM 659 CE LYS A 42 -5.345 -10.230 -13.435 1.00 0.00 C ATOM 660 NZ LYS A 42 -4.594 -9.432 -12.440 1.00 0.00 N ATOM 0 H LYS A 42 -9.977 -9.079 -15.218 1.00 0.00 H new ATOM 0 HA LYS A 42 -7.634 -8.445 -13.541 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -7.447 -10.155 -15.457 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -7.695 -8.813 -16.556 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -5.450 -8.467 -16.457 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -5.710 -7.834 -14.844 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -5.136 -10.751 -15.507 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -3.945 -9.600 -14.935 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -6.414 -10.085 -13.276 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -5.139 -11.288 -13.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -4.871 -9.723 -11.481 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -3.574 -9.588 -12.568 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -4.809 -8.423 -12.571 1.00 0.00 H new ATOM 674 N VAL A 43 -9.047 -6.440 -15.774 1.00 0.00 N ATOM 675 CA VAL A 43 -9.130 -5.016 -16.079 1.00 0.00 C ATOM 676 C VAL A 43 -10.542 -4.596 -16.471 1.00 0.00 C ATOM 677 O VAL A 43 -11.114 -5.131 -17.427 1.00 0.00 O ATOM 678 CB VAL A 43 -8.138 -4.614 -17.197 1.00 0.00 C ATOM 679 CG1 VAL A 43 -7.939 -3.098 -17.128 1.00 0.00 C ATOM 680 CG2 VAL A 43 -6.753 -5.284 -17.161 1.00 0.00 C ATOM 0 H VAL A 43 -9.638 -7.040 -16.349 1.00 0.00 H new ATOM 0 HA VAL A 43 -8.858 -4.492 -15.163 1.00 0.00 H new ATOM 0 HB VAL A 43 -8.594 -4.960 -18.124 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -7.243 -2.787 -17.907 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -8.896 -2.598 -17.276 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -7.536 -2.828 -16.152 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -6.151 -4.921 -17.994 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -6.256 -5.042 -16.222 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -6.869 -6.365 -17.242 1.00 0.00 H new ATOM 690 N LYS A 44 -11.104 -3.637 -15.725 1.00 0.00 N ATOM 691 CA LYS A 44 -12.427 -3.090 -15.996 1.00 0.00 C ATOM 692 C LYS A 44 -12.218 -2.025 -17.073 1.00 0.00 C ATOM 693 O LYS A 44 -11.510 -1.034 -16.858 1.00 0.00 O ATOM 694 CB LYS A 44 -13.093 -2.515 -14.731 1.00 0.00 C ATOM 695 CG LYS A 44 -14.231 -3.415 -14.220 1.00 0.00 C ATOM 696 CD LYS A 44 -15.267 -2.668 -13.364 1.00 0.00 C ATOM 697 CE LYS A 44 -14.735 -2.040 -12.069 1.00 0.00 C ATOM 698 NZ LYS A 44 -14.277 -3.052 -11.099 1.00 0.00 N ATOM 0 H LYS A 44 -10.647 -3.221 -14.914 1.00 0.00 H new ATOM 0 HA LYS A 44 -13.112 -3.867 -16.335 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -12.344 -2.398 -13.948 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -13.486 -1.522 -14.948 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -14.736 -3.869 -15.073 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -13.805 -4.228 -13.633 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -15.712 -1.880 -13.971 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -16.067 -3.363 -13.107 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -13.910 -1.369 -12.307 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -15.518 -1.433 -11.614 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -13.927 -2.578 -10.242 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -15.069 -3.678 -10.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -13.511 -3.615 -11.520 1.00 0.00 H new ATOM 712 N PHE A 45 -12.771 -2.271 -18.254 1.00 0.00 N ATOM 713 CA PHE A 45 -12.714 -1.445 -19.462 1.00 0.00 C ATOM 714 C PHE A 45 -13.983 -1.651 -20.284 1.00 0.00 C ATOM 715 O PHE A 45 -14.713 -2.603 -20.007 1.00 0.00 O ATOM 716 CB PHE A 45 -11.457 -1.729 -20.298 1.00 0.00 C ATOM 717 CG PHE A 45 -10.560 -0.515 -20.412 1.00 0.00 C ATOM 718 CD1 PHE A 45 -10.907 0.545 -21.272 1.00 0.00 C ATOM 719 CD2 PHE A 45 -9.391 -0.430 -19.636 1.00 0.00 C ATOM 720 CE1 PHE A 45 -10.078 1.674 -21.365 1.00 0.00 C ATOM 721 CE2 PHE A 45 -8.565 0.705 -19.727 1.00 0.00 C ATOM 722 CZ PHE A 45 -8.907 1.756 -20.593 1.00 0.00 C ATOM 0 H PHE A 45 -13.315 -3.120 -18.408 1.00 0.00 H new ATOM 0 HA PHE A 45 -12.652 -0.400 -19.157 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -10.900 -2.549 -19.846 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -11.752 -2.056 -21.295 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -11.811 0.489 -21.860 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -9.127 -1.237 -18.969 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -10.341 2.482 -22.032 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -7.667 0.768 -19.130 1.00 0.00 H new ATOM 0 HZ PHE A 45 -8.271 2.626 -20.666 1.00 0.00 H new ATOM 732 N TYR A 46 -14.341 -0.719 -21.170 1.00 0.00 N ATOM 733 CA TYR A 46 -15.522 -0.819 -22.034 1.00 0.00 C ATOM 734 C TYR A 46 -15.202 -0.211 -23.411 1.00 0.00 C ATOM 735 O TYR A 46 -14.758 0.938 -23.462 1.00 0.00 O ATOM 736 CB TYR A 46 -16.707 -0.101 -21.368 1.00 0.00 C ATOM 737 CG TYR A 46 -18.088 -0.654 -21.675 1.00 0.00 C ATOM 738 CD1 TYR A 46 -18.496 -0.953 -22.992 1.00 0.00 C ATOM 739 CD2 TYR A 46 -18.997 -0.832 -20.616 1.00 0.00 C ATOM 740 CE1 TYR A 46 -19.806 -1.388 -23.250 1.00 0.00 C ATOM 741 CE2 TYR A 46 -20.315 -1.248 -20.866 1.00 0.00 C ATOM 742 CZ TYR A 46 -20.730 -1.512 -22.188 1.00 0.00 C ATOM 743 OH TYR A 46 -22.021 -1.864 -22.433 1.00 0.00 O ATOM 0 H TYR A 46 -13.811 0.141 -21.310 1.00 0.00 H new ATOM 0 HA TYR A 46 -15.794 -1.865 -22.177 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -16.560 -0.128 -20.288 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -16.684 0.947 -21.667 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -17.796 -0.847 -23.807 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -18.678 -0.647 -19.601 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -20.107 -1.628 -24.259 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -21.010 -1.366 -20.047 1.00 0.00 H new ATOM 0 HH TYR A 46 -22.516 -1.903 -21.588 1.00 0.00 H new ATOM 753 N LYS A 47 -15.283 -0.970 -24.514 1.00 0.00 N ATOM 754 CA LYS A 47 -15.048 -0.487 -25.884 1.00 0.00 C ATOM 755 C LYS A 47 -15.961 -1.309 -26.798 1.00 0.00 C ATOM 756 O LYS A 47 -16.016 -2.526 -26.639 1.00 0.00 O ATOM 757 CB LYS A 47 -13.561 -0.631 -26.296 1.00 0.00 C ATOM 758 CG LYS A 47 -13.065 0.239 -27.480 1.00 0.00 C ATOM 759 CD LYS A 47 -13.871 0.067 -28.778 1.00 0.00 C ATOM 760 CE LYS A 47 -13.277 0.566 -30.096 1.00 0.00 C ATOM 761 NZ LYS A 47 -13.153 2.039 -30.152 1.00 0.00 N ATOM 0 H LYS A 47 -15.520 -1.962 -24.478 1.00 0.00 H new ATOM 0 HA LYS A 47 -15.274 0.577 -25.960 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -12.946 -0.400 -25.426 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -13.380 -1.676 -26.546 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -13.098 1.287 -27.183 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -12.021 -0.003 -27.680 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -14.082 -0.996 -28.895 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -14.829 0.569 -28.639 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -12.293 0.118 -30.238 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -13.903 0.228 -30.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -12.745 2.319 -31.067 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -14.093 2.471 -30.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -12.533 2.365 -29.383 1.00 0.00 H new ATOM 775 N LEU A 48 -16.631 -0.678 -27.760 1.00 0.00 N ATOM 776 CA LEU A 48 -17.512 -1.292 -28.743 1.00 0.00 C ATOM 777 C LEU A 48 -17.181 -0.733 -30.130 1.00 0.00 C ATOM 778 O LEU A 48 -16.813 0.437 -30.245 1.00 0.00 O ATOM 779 CB LEU A 48 -18.954 -0.929 -28.379 1.00 0.00 C ATOM 780 CG LEU A 48 -19.995 -1.650 -29.257 1.00 0.00 C ATOM 781 CD1 LEU A 48 -21.225 -2.004 -28.415 1.00 0.00 C ATOM 782 CD2 LEU A 48 -20.472 -0.841 -30.470 1.00 0.00 C ATOM 0 H LEU A 48 -16.568 0.333 -27.878 1.00 0.00 H new ATOM 0 HA LEU A 48 -17.384 -2.374 -28.751 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -19.133 -1.179 -27.333 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -19.088 0.148 -28.477 1.00 0.00 H new ATOM 0 HG LEU A 48 -19.487 -2.536 -29.638 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -21.959 -2.514 -29.039 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -20.929 -2.659 -27.595 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -21.664 -1.092 -28.010 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -21.202 -1.424 -31.031 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -20.932 0.087 -30.130 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -19.621 -0.611 -31.111 1.00 0.00 H new ATOM 794 N LEU A 49 -17.278 -1.546 -31.179 1.00 0.00 N ATOM 795 CA LEU A 49 -17.043 -1.154 -32.571 1.00 0.00 C ATOM 796 C LEU A 49 -17.790 -2.115 -33.509 1.00 0.00 C ATOM 797 O LEU A 49 -18.335 -3.121 -33.045 1.00 0.00 O ATOM 798 CB LEU A 49 -15.547 -0.970 -32.880 1.00 0.00 C ATOM 799 CG LEU A 49 -14.605 -2.035 -32.306 1.00 0.00 C ATOM 800 CD1 LEU A 49 -14.936 -3.409 -32.870 1.00 0.00 C ATOM 801 CD2 LEU A 49 -13.142 -1.709 -32.625 1.00 0.00 C ATOM 0 H LEU A 49 -17.531 -2.529 -31.083 1.00 0.00 H new ATOM 0 HA LEU A 49 -17.460 -0.163 -32.749 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -15.420 -0.947 -33.962 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -15.236 0.004 -32.502 1.00 0.00 H new ATOM 0 HG LEU A 49 -14.744 -2.040 -31.225 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -14.255 -4.149 -32.449 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -15.962 -3.671 -32.611 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -14.828 -3.393 -33.955 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -12.497 -2.481 -32.206 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -13.005 -1.670 -33.706 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -12.881 -0.744 -32.191 1.00 0.00 H new ATOM 813 N ILE A 50 -17.856 -1.776 -34.802 1.00 0.00 N ATOM 814 CA ILE A 50 -18.539 -2.540 -35.847 1.00 0.00 C ATOM 815 C ILE A 50 -17.536 -2.793 -36.977 1.00 0.00 C ATOM 816 O ILE A 50 -16.841 -1.864 -37.397 1.00 0.00 O ATOM 817 CB ILE A 50 -19.798 -1.766 -36.312 1.00 0.00 C ATOM 818 CG1 ILE A 50 -20.729 -1.466 -35.109 1.00 0.00 C ATOM 819 CG2 ILE A 50 -20.548 -2.530 -37.405 1.00 0.00 C ATOM 820 CD1 ILE A 50 -22.033 -0.749 -35.463 1.00 0.00 C ATOM 0 H ILE A 50 -17.417 -0.928 -35.161 1.00 0.00 H new ATOM 0 HA ILE A 50 -18.887 -3.506 -35.482 1.00 0.00 H new ATOM 0 HB ILE A 50 -19.471 -0.818 -36.738 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -20.972 -2.406 -34.614 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -20.182 -0.858 -34.388 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -21.426 -1.961 -37.710 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -19.892 -2.673 -38.264 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -20.860 -3.501 -37.021 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -22.615 -0.584 -34.556 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -21.806 0.210 -35.928 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -22.608 -1.362 -36.157 1.00 0.00 H new ATOM 832 N VAL A 51 -17.506 -4.021 -37.500 1.00 0.00 N ATOM 833 CA VAL A 51 -16.609 -4.480 -38.554 1.00 0.00 C ATOM 834 C VAL A 51 -17.393 -5.282 -39.596 1.00 0.00 C ATOM 835 O VAL A 51 -18.242 -6.122 -39.281 1.00 0.00 O ATOM 836 CB VAL A 51 -15.481 -5.325 -37.921 1.00 0.00 C ATOM 837 CG1 VAL A 51 -14.471 -5.841 -38.960 1.00 0.00 C ATOM 838 CG2 VAL A 51 -14.677 -4.562 -36.856 1.00 0.00 C ATOM 0 H VAL A 51 -18.139 -4.755 -37.182 1.00 0.00 H new ATOM 0 HA VAL A 51 -16.161 -3.627 -39.064 1.00 0.00 H new ATOM 0 HB VAL A 51 -16.010 -6.158 -37.459 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -13.701 -6.428 -38.459 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -14.986 -6.466 -39.689 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -14.009 -4.995 -39.469 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -13.901 -5.212 -36.451 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -14.216 -3.684 -37.308 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -15.343 -4.249 -36.052 1.00 0.00 H new ATOM 848 N ASP A 52 -17.135 -4.984 -40.860 1.00 0.00 N ATOM 849 CA ASP A 52 -17.715 -5.575 -42.052 1.00 0.00 C ATOM 850 C ASP A 52 -17.203 -6.991 -42.285 1.00 0.00 C ATOM 851 O ASP A 52 -16.007 -7.175 -42.505 1.00 0.00 O ATOM 852 CB ASP A 52 -17.270 -4.730 -43.252 1.00 0.00 C ATOM 853 CG ASP A 52 -17.689 -5.346 -44.577 1.00 0.00 C ATOM 854 OD1 ASP A 52 -18.758 -5.998 -44.641 1.00 0.00 O ATOM 855 OD2 ASP A 52 -16.941 -5.162 -45.560 1.00 0.00 O ATOM 0 H ASP A 52 -16.456 -4.260 -41.096 1.00 0.00 H new ATOM 0 HA ASP A 52 -18.798 -5.605 -41.932 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -17.696 -3.730 -43.168 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -16.186 -4.617 -43.233 1.00 0.00 H new ATOM 860 N MET A 53 -18.066 -8.008 -42.248 1.00 0.00 N ATOM 861 CA MET A 53 -17.617 -9.376 -42.498 1.00 0.00 C ATOM 862 C MET A 53 -17.187 -9.587 -43.955 1.00 0.00 C ATOM 863 O MET A 53 -16.509 -10.574 -44.237 1.00 0.00 O ATOM 864 CB MET A 53 -18.716 -10.385 -42.153 1.00 0.00 C ATOM 865 CG MET A 53 -18.948 -10.491 -40.653 1.00 0.00 C ATOM 866 SD MET A 53 -19.992 -11.901 -40.193 1.00 0.00 S ATOM 867 CE MET A 53 -18.909 -13.310 -40.544 1.00 0.00 C ATOM 0 H MET A 53 -19.062 -7.913 -42.051 1.00 0.00 H new ATOM 0 HA MET A 53 -16.752 -9.538 -41.855 1.00 0.00 H new ATOM 0 HB2 MET A 53 -19.644 -10.090 -42.643 1.00 0.00 H new ATOM 0 HB3 MET A 53 -18.445 -11.364 -42.547 1.00 0.00 H new ATOM 0 HG2 MET A 53 -17.986 -10.579 -40.148 1.00 0.00 H new ATOM 0 HG3 MET A 53 -19.412 -9.571 -40.297 1.00 0.00 H new ATOM 0 HE1 MET A 53 -19.290 -14.197 -40.038 1.00 0.00 H new ATOM 0 HE2 MET A 53 -18.882 -13.489 -41.619 1.00 0.00 H new ATOM 0 HE3 MET A 53 -17.902 -13.093 -40.187 1.00 0.00 H new ATOM 877 N LYS A 54 -17.582 -8.719 -44.900 1.00 0.00 N ATOM 878 CA LYS A 54 -17.191 -8.911 -46.300 1.00 0.00 C ATOM 879 C LYS A 54 -15.690 -8.746 -46.484 1.00 0.00 C ATOM 880 O LYS A 54 -15.064 -9.677 -46.988 1.00 0.00 O ATOM 881 CB LYS A 54 -17.875 -7.923 -47.263 1.00 0.00 C ATOM 882 CG LYS A 54 -19.400 -7.994 -47.396 1.00 0.00 C ATOM 883 CD LYS A 54 -19.862 -9.317 -48.011 1.00 0.00 C ATOM 884 CE LYS A 54 -19.466 -9.416 -49.489 1.00 0.00 C ATOM 885 NZ LYS A 54 -19.301 -10.815 -49.907 1.00 0.00 N ATOM 0 H LYS A 54 -18.159 -7.896 -44.724 1.00 0.00 H new ATOM 0 HA LYS A 54 -17.509 -9.926 -46.540 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -17.613 -6.913 -46.948 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -17.445 -8.070 -48.254 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -19.855 -7.873 -46.413 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -19.749 -7.166 -48.013 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -19.424 -10.149 -47.459 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -20.944 -9.406 -47.916 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -20.228 -8.938 -50.104 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -18.536 -8.873 -49.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -19.033 -10.848 -50.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -18.556 -11.263 -49.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -20.196 -11.326 -49.771 1.00 0.00 H new ATOM 899 N SER A 55 -15.115 -7.626 -46.044 1.00 0.00 N ATOM 900 CA SER A 55 -13.685 -7.355 -46.201 1.00 0.00 C ATOM 901 C SER A 55 -12.901 -7.085 -44.903 1.00 0.00 C ATOM 902 O SER A 55 -11.732 -6.717 -44.999 1.00 0.00 O ATOM 903 CB SER A 55 -13.493 -6.251 -47.249 1.00 0.00 C ATOM 904 OG SER A 55 -14.242 -6.478 -48.440 1.00 0.00 O ATOM 0 H SER A 55 -15.626 -6.882 -45.569 1.00 0.00 H new ATOM 0 HA SER A 55 -13.236 -8.285 -46.551 1.00 0.00 H new ATOM 0 HB2 SER A 55 -13.787 -5.294 -46.818 1.00 0.00 H new ATOM 0 HB3 SER A 55 -12.435 -6.176 -47.500 1.00 0.00 H new ATOM 0 HG SER A 55 -14.084 -5.745 -49.071 1.00 0.00 H new ATOM 910 N GLU A 56 -13.484 -7.274 -43.714 1.00 0.00 N ATOM 911 CA GLU A 56 -12.860 -7.066 -42.395 1.00 0.00 C ATOM 912 C GLU A 56 -12.376 -5.626 -42.183 1.00 0.00 C ATOM 913 O GLU A 56 -11.248 -5.370 -41.746 1.00 0.00 O ATOM 914 CB GLU A 56 -11.767 -8.107 -42.104 1.00 0.00 C ATOM 915 CG GLU A 56 -12.305 -9.541 -42.060 1.00 0.00 C ATOM 916 CD GLU A 56 -11.187 -10.581 -41.897 1.00 0.00 C ATOM 917 OE1 GLU A 56 -10.068 -10.244 -41.431 1.00 0.00 O ATOM 918 OE2 GLU A 56 -11.398 -11.773 -42.230 1.00 0.00 O ATOM 0 H GLU A 56 -14.450 -7.591 -43.638 1.00 0.00 H new ATOM 0 HA GLU A 56 -13.646 -7.223 -41.656 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -10.994 -8.038 -42.869 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -11.294 -7.873 -41.150 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -13.010 -9.637 -41.234 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -12.858 -9.747 -42.976 1.00 0.00 H new ATOM 925 N LYS A 57 -13.240 -4.667 -42.511 1.00 0.00 N ATOM 926 CA LYS A 57 -12.974 -3.229 -42.374 1.00 0.00 C ATOM 927 C LYS A 57 -13.954 -2.640 -41.367 1.00 0.00 C ATOM 928 O LYS A 57 -15.068 -3.150 -41.256 1.00 0.00 O ATOM 929 CB LYS A 57 -13.134 -2.514 -43.729 1.00 0.00 C ATOM 930 CG LYS A 57 -12.437 -3.182 -44.928 1.00 0.00 C ATOM 931 CD LYS A 57 -10.932 -3.418 -44.776 1.00 0.00 C ATOM 932 CE LYS A 57 -10.160 -2.099 -44.735 1.00 0.00 C ATOM 933 NZ LYS A 57 -8.746 -2.309 -44.369 1.00 0.00 N ATOM 0 H LYS A 57 -14.166 -4.869 -42.888 1.00 0.00 H new ATOM 0 HA LYS A 57 -11.950 -3.087 -42.030 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -14.198 -2.432 -43.951 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -12.750 -1.499 -43.630 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -12.919 -4.141 -45.116 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -12.602 -2.564 -45.811 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -10.741 -3.981 -43.862 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -10.572 -4.026 -45.606 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -10.216 -1.613 -45.709 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -10.627 -1.426 -44.016 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -8.253 -1.394 -44.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -8.693 -2.750 -43.429 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -8.295 -2.932 -45.069 1.00 0.00 H new ATOM 947 N LEU A 58 -13.559 -1.624 -40.595 1.00 0.00 N ATOM 948 CA LEU A 58 -14.484 -1.014 -39.641 1.00 0.00 C ATOM 949 C LEU A 58 -15.549 -0.259 -40.429 1.00 0.00 C ATOM 950 O LEU A 58 -15.294 0.176 -41.556 1.00 0.00 O ATOM 951 CB LEU A 58 -13.789 -0.035 -38.683 1.00 0.00 C ATOM 952 CG LEU A 58 -13.530 -0.636 -37.297 1.00 0.00 C ATOM 953 CD1 LEU A 58 -12.290 -1.533 -37.300 1.00 0.00 C ATOM 954 CD2 LEU A 58 -13.467 0.478 -36.268 1.00 0.00 C ATOM 0 H LEU A 58 -12.625 -1.215 -40.611 1.00 0.00 H new ATOM 0 HA LEU A 58 -14.914 -1.810 -39.034 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -12.841 0.280 -39.119 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -14.404 0.859 -38.576 1.00 0.00 H new ATOM 0 HG LEU A 58 -14.357 -1.290 -37.020 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -12.135 -1.943 -36.302 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -12.433 -2.348 -38.009 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -11.418 -0.947 -37.591 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -13.283 0.052 -35.282 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -12.660 1.164 -36.524 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -14.413 1.019 -36.259 1.00 0.00 H new ATOM 966 N LEU A 59 -16.718 -0.067 -39.813 1.00 0.00 N ATOM 967 CA LEU A 59 -17.857 0.629 -40.394 1.00 0.00 C ATOM 968 C LEU A 59 -18.464 1.589 -39.385 1.00 0.00 C ATOM 969 O LEU A 59 -18.391 1.365 -38.177 1.00 0.00 O ATOM 970 CB LEU A 59 -18.960 -0.371 -40.745 1.00 0.00 C ATOM 971 CG LEU A 59 -18.589 -1.464 -41.752 1.00 0.00 C ATOM 972 CD1 LEU A 59 -19.849 -2.305 -41.908 1.00 0.00 C ATOM 973 CD2 LEU A 59 -18.200 -0.881 -43.111 1.00 0.00 C ATOM 0 H LEU A 59 -16.898 -0.404 -38.867 1.00 0.00 H new ATOM 0 HA LEU A 59 -17.499 1.158 -41.277 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -19.292 -0.852 -39.825 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -19.812 0.183 -41.140 1.00 0.00 H new ATOM 0 HG LEU A 59 -17.730 -2.036 -41.400 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -19.662 -3.112 -42.617 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -20.127 -2.727 -40.942 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -20.661 -1.679 -42.277 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -17.944 -1.691 -43.795 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -19.038 -0.314 -43.517 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -17.340 -0.222 -42.992 1.00 0.00 H new ATOM 985 N SER A 60 -19.182 2.589 -39.887 1.00 0.00 N ATOM 986 CA SER A 60 -19.845 3.605 -39.090 1.00 0.00 C ATOM 987 C SER A 60 -21.267 3.229 -38.647 1.00 0.00 C ATOM 988 O SER A 60 -21.791 3.927 -37.772 1.00 0.00 O ATOM 989 CB SER A 60 -19.848 4.912 -39.900 1.00 0.00 C ATOM 990 OG SER A 60 -20.090 4.666 -41.278 1.00 0.00 O ATOM 0 H SER A 60 -19.320 2.715 -40.890 1.00 0.00 H new ATOM 0 HA SER A 60 -19.289 3.717 -38.159 1.00 0.00 H new ATOM 0 HB2 SER A 60 -20.613 5.583 -39.509 1.00 0.00 H new ATOM 0 HB3 SER A 60 -18.890 5.418 -39.782 1.00 0.00 H new ATOM 0 HG SER A 60 -20.088 5.515 -41.767 1.00 0.00 H new ATOM 996 N SER A 61 -21.908 2.173 -39.185 1.00 0.00 N ATOM 997 CA SER A 61 -23.265 1.819 -38.789 1.00 0.00 C ATOM 998 C SER A 61 -23.511 0.315 -38.846 1.00 0.00 C ATOM 999 O SER A 61 -22.931 -0.406 -39.664 1.00 0.00 O ATOM 1000 CB SER A 61 -24.265 2.593 -39.661 1.00 0.00 C ATOM 1001 OG SER A 61 -24.065 2.447 -41.062 1.00 0.00 O ATOM 0 H SER A 61 -21.501 1.559 -39.891 1.00 0.00 H new ATOM 0 HA SER A 61 -23.406 2.104 -37.746 1.00 0.00 H new ATOM 0 HB2 SER A 61 -25.274 2.262 -39.415 1.00 0.00 H new ATOM 0 HB3 SER A 61 -24.206 3.651 -39.407 1.00 0.00 H new ATOM 0 HG SER A 61 -24.741 2.967 -41.545 1.00 0.00 H new ATOM 1007 N SER A 62 -24.387 -0.151 -37.959 1.00 0.00 N ATOM 1008 CA SER A 62 -24.783 -1.542 -37.836 1.00 0.00 C ATOM 1009 C SER A 62 -25.619 -1.940 -39.049 1.00 0.00 C ATOM 1010 O SER A 62 -26.694 -1.372 -39.265 1.00 0.00 O ATOM 1011 CB SER A 62 -25.581 -1.717 -36.535 1.00 0.00 C ATOM 1012 OG SER A 62 -26.559 -0.692 -36.405 1.00 0.00 O ATOM 0 H SER A 62 -24.854 0.455 -37.285 1.00 0.00 H new ATOM 0 HA SER A 62 -23.905 -2.187 -37.800 1.00 0.00 H new ATOM 0 HB2 SER A 62 -26.066 -2.693 -36.528 1.00 0.00 H new ATOM 0 HB3 SER A 62 -24.904 -1.692 -35.681 1.00 0.00 H new ATOM 0 HG SER A 62 -26.983 -0.532 -37.274 1.00 0.00 H new ATOM 1018 N ASN A 63 -25.117 -2.890 -39.834 1.00 0.00 N ATOM 1019 CA ASN A 63 -25.764 -3.422 -41.030 1.00 0.00 C ATOM 1020 C ASN A 63 -25.614 -4.943 -41.067 1.00 0.00 C ATOM 1021 O ASN A 63 -24.647 -5.484 -40.536 1.00 0.00 O ATOM 1022 CB ASN A 63 -25.180 -2.790 -42.301 1.00 0.00 C ATOM 1023 CG ASN A 63 -23.715 -3.145 -42.476 1.00 0.00 C ATOM 1024 OD1 ASN A 63 -22.849 -2.492 -41.729 1.00 0.00 O flip ATOM 1025 ND2 ASN A 63 -23.350 -4.018 -43.258 1.00 0.00 N flip ATOM 0 H ASN A 63 -24.214 -3.327 -39.647 1.00 0.00 H new ATOM 0 HA ASN A 63 -26.824 -3.170 -40.992 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -25.744 -3.130 -43.170 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -25.290 -1.707 -42.253 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -24.037 -4.512 -43.828 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -22.360 -4.249 -43.338 1.00 0.00 H new ATOM 1032 N LYS A 64 -26.513 -5.623 -41.785 1.00 0.00 N ATOM 1033 CA LYS A 64 -26.551 -7.086 -41.923 1.00 0.00 C ATOM 1034 C LYS A 64 -25.257 -7.730 -42.410 1.00 0.00 C ATOM 1035 O LYS A 64 -24.978 -8.866 -42.036 1.00 0.00 O ATOM 1036 CB LYS A 64 -27.700 -7.491 -42.855 1.00 0.00 C ATOM 1037 CG LYS A 64 -29.069 -7.173 -42.235 1.00 0.00 C ATOM 1038 CD LYS A 64 -30.227 -7.356 -43.217 1.00 0.00 C ATOM 1039 CE LYS A 64 -30.132 -6.441 -44.445 1.00 0.00 C ATOM 1040 NZ LYS A 64 -31.362 -6.509 -45.256 1.00 0.00 N ATOM 0 H LYS A 64 -27.258 -5.158 -42.303 1.00 0.00 H new ATOM 0 HA LYS A 64 -26.703 -7.461 -40.911 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -27.600 -6.967 -43.806 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -27.636 -8.558 -43.070 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -29.228 -7.817 -41.370 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -29.067 -6.145 -41.871 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -30.253 -8.394 -43.547 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -31.167 -7.162 -42.700 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -29.961 -5.413 -44.124 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -29.275 -6.732 -45.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -31.270 -5.881 -46.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -31.510 -7.486 -45.581 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -32.174 -6.209 -44.680 1.00 0.00 H new ATOM 1054 N ASN A 65 -24.464 -7.054 -43.243 1.00 0.00 N ATOM 1055 CA ASN A 65 -23.210 -7.623 -43.749 1.00 0.00 C ATOM 1056 C ASN A 65 -22.083 -7.494 -42.717 1.00 0.00 C ATOM 1057 O ASN A 65 -20.940 -7.840 -43.020 1.00 0.00 O ATOM 1058 CB ASN A 65 -22.757 -6.897 -45.030 1.00 0.00 C ATOM 1059 CG ASN A 65 -23.667 -7.031 -46.234 1.00 0.00 C ATOM 1060 OD1 ASN A 65 -24.703 -7.683 -46.205 1.00 0.00 O ATOM 1061 ND2 ASN A 65 -23.301 -6.389 -47.330 1.00 0.00 N ATOM 0 H ASN A 65 -24.666 -6.113 -43.582 1.00 0.00 H new ATOM 0 HA ASN A 65 -23.404 -8.675 -43.957 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -22.645 -5.837 -44.801 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -21.770 -7.270 -45.304 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -23.884 -6.433 -48.166 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -22.435 -5.850 -47.340 1.00 0.00 H new ATOM 1068 N SER A 66 -22.361 -6.983 -41.522 1.00 0.00 N ATOM 1069 CA SER A 66 -21.411 -6.751 -40.456 1.00 0.00 C ATOM 1070 C SER A 66 -21.834 -7.451 -39.161 1.00 0.00 C ATOM 1071 O SER A 66 -22.882 -8.099 -39.108 1.00 0.00 O ATOM 1072 CB SER A 66 -21.385 -5.223 -40.353 1.00 0.00 C ATOM 1073 OG SER A 66 -20.409 -4.711 -39.493 1.00 0.00 O ATOM 0 H SER A 66 -23.308 -6.707 -41.264 1.00 0.00 H new ATOM 0 HA SER A 66 -20.420 -7.162 -40.646 1.00 0.00 H new ATOM 0 HB2 SER A 66 -21.226 -4.808 -41.348 1.00 0.00 H new ATOM 0 HB3 SER A 66 -22.363 -4.879 -40.016 1.00 0.00 H new ATOM 0 HG SER A 66 -19.806 -5.432 -39.216 1.00 0.00 H new ATOM 1079 N VAL A 67 -20.977 -7.337 -38.145 1.00 0.00 N ATOM 1080 CA VAL A 67 -21.108 -7.876 -36.796 1.00 0.00 C ATOM 1081 C VAL A 67 -20.522 -6.812 -35.862 1.00 0.00 C ATOM 1082 O VAL A 67 -19.632 -6.054 -36.265 1.00 0.00 O ATOM 1083 CB VAL A 67 -20.358 -9.230 -36.709 1.00 0.00 C ATOM 1084 CG1 VAL A 67 -20.062 -9.731 -35.285 1.00 0.00 C ATOM 1085 CG2 VAL A 67 -21.155 -10.320 -37.435 1.00 0.00 C ATOM 0 H VAL A 67 -20.103 -6.823 -38.257 1.00 0.00 H new ATOM 0 HA VAL A 67 -22.141 -8.082 -36.516 1.00 0.00 H new ATOM 0 HB VAL A 67 -19.394 -9.036 -37.180 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -19.536 -10.684 -35.337 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -19.442 -9.002 -34.764 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -20.999 -9.863 -34.744 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -20.620 -11.267 -37.368 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -22.136 -10.424 -36.971 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -21.277 -10.045 -38.483 1.00 0.00 H new ATOM 1095 N THR A 68 -21.022 -6.733 -34.631 1.00 0.00 N ATOM 1096 CA THR A 68 -20.564 -5.794 -33.614 1.00 0.00 C ATOM 1097 C THR A 68 -19.675 -6.586 -32.643 1.00 0.00 C ATOM 1098 O THR A 68 -19.973 -7.749 -32.358 1.00 0.00 O ATOM 1099 CB THR A 68 -21.796 -5.128 -32.957 1.00 0.00 C ATOM 1100 OG1 THR A 68 -21.466 -3.924 -32.301 1.00 0.00 O ATOM 1101 CG2 THR A 68 -22.543 -6.034 -31.969 1.00 0.00 C ATOM 0 H THR A 68 -21.777 -7.337 -34.306 1.00 0.00 H new ATOM 0 HA THR A 68 -19.967 -4.976 -34.017 1.00 0.00 H new ATOM 0 HB THR A 68 -22.462 -4.923 -33.795 1.00 0.00 H new ATOM 0 HG1 THR A 68 -22.273 -3.537 -31.902 1.00 0.00 H new ATOM 0 HG21 THR A 68 -23.393 -5.494 -31.552 1.00 0.00 H new ATOM 0 HG22 THR A 68 -22.898 -6.924 -32.488 1.00 0.00 H new ATOM 0 HG23 THR A 68 -21.869 -6.328 -31.164 1.00 0.00 H new ATOM 1109 N LEU A 69 -18.569 -6.005 -32.166 1.00 0.00 N ATOM 1110 CA LEU A 69 -17.664 -6.660 -31.219 1.00 0.00 C ATOM 1111 C LEU A 69 -17.516 -5.737 -30.018 1.00 0.00 C ATOM 1112 O LEU A 69 -17.502 -4.509 -30.180 1.00 0.00 O ATOM 1113 CB LEU A 69 -16.278 -6.937 -31.829 1.00 0.00 C ATOM 1114 CG LEU A 69 -16.242 -7.931 -33.001 1.00 0.00 C ATOM 1115 CD1 LEU A 69 -14.833 -7.947 -33.606 1.00 0.00 C ATOM 1116 CD2 LEU A 69 -16.655 -9.339 -32.601 1.00 0.00 C ATOM 0 H LEU A 69 -18.276 -5.064 -32.428 1.00 0.00 H new ATOM 0 HA LEU A 69 -18.084 -7.626 -30.938 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -15.857 -5.991 -32.169 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -15.625 -7.312 -31.041 1.00 0.00 H new ATOM 0 HG LEU A 69 -16.971 -7.593 -33.738 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -14.802 -8.651 -34.438 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -14.580 -6.949 -33.965 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -14.114 -8.252 -32.846 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -16.609 -9.993 -33.472 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -15.979 -9.712 -31.831 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -17.673 -9.323 -32.213 1.00 0.00 H new ATOM 1128 N VAL A 70 -17.392 -6.310 -28.824 1.00 0.00 N ATOM 1129 CA VAL A 70 -17.231 -5.560 -27.586 1.00 0.00 C ATOM 1130 C VAL A 70 -15.839 -5.952 -27.084 1.00 0.00 C ATOM 1131 O VAL A 70 -15.660 -7.062 -26.601 1.00 0.00 O ATOM 1132 CB VAL A 70 -18.346 -5.909 -26.568 1.00 0.00 C ATOM 1133 CG1 VAL A 70 -18.425 -4.833 -25.481 1.00 0.00 C ATOM 1134 CG2 VAL A 70 -19.761 -6.034 -27.143 1.00 0.00 C ATOM 0 H VAL A 70 -17.401 -7.321 -28.689 1.00 0.00 H new ATOM 0 HA VAL A 70 -17.317 -4.483 -27.732 1.00 0.00 H new ATOM 0 HB VAL A 70 -18.050 -6.889 -26.195 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -19.212 -5.089 -24.772 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -17.471 -4.773 -24.958 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -18.649 -3.869 -25.939 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -20.459 -6.280 -26.342 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -20.053 -5.089 -27.600 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -19.780 -6.822 -27.896 1.00 0.00 H new ATOM 1144 N LEU A 71 -14.818 -5.109 -27.231 1.00 0.00 N ATOM 1145 CA LEU A 71 -13.465 -5.451 -26.770 1.00 0.00 C ATOM 1146 C LEU A 71 -13.317 -4.913 -25.363 1.00 0.00 C ATOM 1147 O LEU A 71 -12.993 -3.737 -25.177 1.00 0.00 O ATOM 1148 CB LEU A 71 -12.378 -4.861 -27.661 1.00 0.00 C ATOM 1149 CG LEU A 71 -12.307 -5.355 -29.117 1.00 0.00 C ATOM 1150 CD1 LEU A 71 -12.579 -6.854 -29.275 1.00 0.00 C ATOM 1151 CD2 LEU A 71 -13.244 -4.581 -30.039 1.00 0.00 C ATOM 0 H LEU A 71 -14.897 -4.188 -27.663 1.00 0.00 H new ATOM 0 HA LEU A 71 -13.343 -6.534 -26.805 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -12.508 -3.779 -27.679 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -11.414 -5.058 -27.191 1.00 0.00 H new ATOM 0 HG LEU A 71 -11.274 -5.170 -29.411 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -12.511 -7.127 -30.328 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -11.842 -7.420 -28.705 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -13.578 -7.084 -28.904 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -13.156 -4.968 -31.054 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -14.271 -4.697 -29.694 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -12.974 -3.525 -30.028 1.00 0.00 H new ATOM 1163 N ASN A 72 -13.576 -5.740 -24.354 1.00 0.00 N ATOM 1164 CA ASN A 72 -13.498 -5.264 -22.980 1.00 0.00 C ATOM 1165 C ASN A 72 -13.443 -6.368 -21.931 1.00 0.00 C ATOM 1166 O ASN A 72 -13.288 -7.535 -22.269 1.00 0.00 O ATOM 1167 CB ASN A 72 -14.705 -4.339 -22.746 1.00 0.00 C ATOM 1168 CG ASN A 72 -15.966 -5.059 -22.314 1.00 0.00 C ATOM 1169 OD1 ASN A 72 -16.377 -6.023 -23.108 1.00 0.00 O flip ATOM 1170 ND2 ASN A 72 -16.550 -4.742 -21.282 1.00 0.00 N flip ATOM 0 H ASN A 72 -13.836 -6.721 -24.459 1.00 0.00 H new ATOM 0 HA ASN A 72 -12.553 -4.734 -22.859 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -14.442 -3.603 -21.986 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -14.911 -3.789 -23.665 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -16.187 -3.985 -20.702 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -17.398 -5.235 -21.004 1.00 0.00 H new ATOM 1177 N ASN A 73 -13.502 -5.962 -20.657 1.00 0.00 N ATOM 1178 CA ASN A 73 -13.527 -6.817 -19.480 1.00 0.00 C ATOM 1179 C ASN A 73 -12.498 -7.938 -19.483 1.00 0.00 C ATOM 1180 O ASN A 73 -12.800 -9.076 -19.822 1.00 0.00 O ATOM 1181 CB ASN A 73 -14.956 -7.254 -19.138 1.00 0.00 C ATOM 1182 CG ASN A 73 -15.197 -7.263 -17.627 1.00 0.00 C ATOM 1183 OD1 ASN A 73 -14.220 -7.592 -16.792 1.00 0.00 O flip ATOM 1184 ND2 ASN A 73 -16.276 -6.906 -17.163 1.00 0.00 N flip ATOM 0 H ASN A 73 -13.535 -4.972 -20.414 1.00 0.00 H new ATOM 0 HA ASN A 73 -13.188 -6.201 -18.647 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -15.667 -6.580 -19.616 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -15.139 -8.250 -19.542 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -17.040 -6.649 -17.788 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -16.409 -6.866 -16.152 1.00 0.00 H new ATOM 1191 N ILE A 74 -11.234 -7.564 -19.353 1.00 0.00 N ATOM 1192 CA ILE A 74 -10.120 -8.506 -19.329 1.00 0.00 C ATOM 1193 C ILE A 74 -10.182 -9.295 -18.010 1.00 0.00 C ATOM 1194 O ILE A 74 -10.530 -8.724 -16.970 1.00 0.00 O ATOM 1195 CB ILE A 74 -8.800 -7.720 -19.500 1.00 0.00 C ATOM 1196 CG1 ILE A 74 -8.862 -6.877 -20.795 1.00 0.00 C ATOM 1197 CG2 ILE A 74 -7.536 -8.609 -19.477 1.00 0.00 C ATOM 1198 CD1 ILE A 74 -7.517 -6.387 -21.344 1.00 0.00 C ATOM 0 H ILE A 74 -10.948 -6.589 -19.260 1.00 0.00 H new ATOM 0 HA ILE A 74 -10.176 -9.224 -20.147 1.00 0.00 H new ATOM 0 HB ILE A 74 -8.707 -7.065 -18.634 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -9.353 -7.469 -21.567 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -9.494 -6.009 -20.610 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -6.651 -7.986 -19.603 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -7.478 -9.134 -18.524 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -7.587 -9.335 -20.289 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -7.684 -5.808 -22.252 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -7.026 -5.760 -20.599 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -6.883 -7.244 -21.572 1.00 0.00 H new ATOM 1210 N TYR A 75 -9.826 -10.580 -18.044 1.00 0.00 N ATOM 1211 CA TYR A 75 -9.789 -11.509 -16.914 1.00 0.00 C ATOM 1212 C TYR A 75 -8.513 -12.348 -17.006 1.00 0.00 C ATOM 1213 O TYR A 75 -7.768 -12.281 -17.988 1.00 0.00 O ATOM 1214 CB TYR A 75 -11.004 -12.455 -16.859 1.00 0.00 C ATOM 1215 CG TYR A 75 -12.361 -11.831 -16.633 1.00 0.00 C ATOM 1216 CD1 TYR A 75 -12.984 -11.174 -17.698 1.00 0.00 C ATOM 1217 CD2 TYR A 75 -13.030 -11.959 -15.399 1.00 0.00 C ATOM 1218 CE1 TYR A 75 -14.239 -10.579 -17.523 1.00 0.00 C ATOM 1219 CE2 TYR A 75 -14.299 -11.378 -15.216 1.00 0.00 C ATOM 1220 CZ TYR A 75 -14.908 -10.677 -16.282 1.00 0.00 C ATOM 1221 OH TYR A 75 -16.116 -10.070 -16.128 1.00 0.00 O ATOM 0 H TYR A 75 -9.538 -11.027 -18.915 1.00 0.00 H new ATOM 0 HA TYR A 75 -9.812 -10.907 -16.005 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -11.041 -13.011 -17.796 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -10.830 -13.181 -16.064 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -12.495 -11.125 -18.660 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -12.567 -12.505 -14.590 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -14.698 -10.043 -18.340 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -14.805 -11.467 -14.266 1.00 0.00 H new ATOM 0 HH TYR A 75 -16.449 -10.229 -15.220 1.00 0.00 H new ATOM 1231 N GLU A 76 -8.231 -13.082 -15.934 1.00 0.00 N ATOM 1232 CA GLU A 76 -7.093 -13.982 -15.811 1.00 0.00 C ATOM 1233 C GLU A 76 -7.649 -15.379 -15.614 1.00 0.00 C ATOM 1234 O GLU A 76 -8.755 -15.535 -15.100 1.00 0.00 O ATOM 1235 CB GLU A 76 -6.235 -13.571 -14.618 1.00 0.00 C ATOM 1236 CG GLU A 76 -4.827 -14.189 -14.607 1.00 0.00 C ATOM 1237 CD GLU A 76 -3.844 -13.257 -13.896 1.00 0.00 C ATOM 1238 OE1 GLU A 76 -3.834 -13.216 -12.644 1.00 0.00 O ATOM 1239 OE2 GLU A 76 -3.075 -12.519 -14.554 1.00 0.00 O ATOM 0 H GLU A 76 -8.812 -13.064 -15.096 1.00 0.00 H new ATOM 0 HA GLU A 76 -6.463 -13.946 -16.700 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -6.142 -12.485 -14.609 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -6.750 -13.854 -13.700 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -4.851 -15.156 -14.104 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -4.494 -14.369 -15.629 1.00 0.00 H new ATOM 1246 N ALA A 77 -6.879 -16.385 -15.996 1.00 0.00 N ATOM 1247 CA ALA A 77 -7.243 -17.787 -15.889 1.00 0.00 C ATOM 1248 C ALA A 77 -6.377 -18.471 -14.843 1.00 0.00 C ATOM 1249 O ALA A 77 -5.289 -17.996 -14.504 1.00 0.00 O ATOM 1250 CB ALA A 77 -7.084 -18.453 -17.253 1.00 0.00 C ATOM 0 H ALA A 77 -5.954 -16.243 -16.402 1.00 0.00 H new ATOM 0 HA ALA A 77 -8.283 -17.876 -15.575 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -7.356 -19.506 -17.178 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -7.734 -17.961 -17.976 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -6.048 -18.369 -17.581 1.00 0.00 H new ATOM 1256 N SER A 78 -6.841 -19.621 -14.363 1.00 0.00 N ATOM 1257 CA SER A 78 -6.144 -20.404 -13.359 1.00 0.00 C ATOM 1258 C SER A 78 -4.809 -20.957 -13.902 1.00 0.00 C ATOM 1259 O SER A 78 -3.982 -21.422 -13.113 1.00 0.00 O ATOM 1260 CB SER A 78 -7.102 -21.474 -12.812 1.00 0.00 C ATOM 1261 OG SER A 78 -6.763 -21.797 -11.476 1.00 0.00 O ATOM 0 H SER A 78 -7.722 -20.036 -14.666 1.00 0.00 H new ATOM 0 HA SER A 78 -5.852 -19.774 -12.518 1.00 0.00 H new ATOM 0 HB2 SER A 78 -8.129 -21.110 -12.857 1.00 0.00 H new ATOM 0 HB3 SER A 78 -7.053 -22.368 -13.434 1.00 0.00 H new ATOM 0 HG SER A 78 -7.381 -22.478 -11.137 1.00 0.00 H new ATOM 1267 N ASP A 79 -4.572 -20.914 -15.221 1.00 0.00 N ATOM 1268 CA ASP A 79 -3.340 -21.367 -15.874 1.00 0.00 C ATOM 1269 C ASP A 79 -2.370 -20.185 -16.013 1.00 0.00 C ATOM 1270 O ASP A 79 -1.281 -20.334 -16.563 1.00 0.00 O ATOM 1271 CB ASP A 79 -3.641 -21.961 -17.261 1.00 0.00 C ATOM 1272 CG ASP A 79 -3.598 -20.898 -18.355 1.00 0.00 C ATOM 1273 OD1 ASP A 79 -4.349 -19.914 -18.230 1.00 0.00 O ATOM 1274 OD2 ASP A 79 -2.752 -20.973 -19.278 1.00 0.00 O ATOM 0 H ASP A 79 -5.257 -20.550 -15.883 1.00 0.00 H new ATOM 0 HA ASP A 79 -2.886 -22.145 -15.260 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -2.916 -22.744 -17.486 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -4.624 -22.431 -17.249 1.00 0.00 H new ATOM 1279 N LYS A 80 -2.753 -19.015 -15.492 1.00 0.00 N ATOM 1280 CA LYS A 80 -2.052 -17.737 -15.485 1.00 0.00 C ATOM 1281 C LYS A 80 -2.187 -16.999 -16.818 1.00 0.00 C ATOM 1282 O LYS A 80 -1.640 -15.897 -16.919 1.00 0.00 O ATOM 1283 CB LYS A 80 -0.577 -17.874 -15.037 1.00 0.00 C ATOM 1284 CG LYS A 80 -0.320 -18.770 -13.803 1.00 0.00 C ATOM 1285 CD LYS A 80 -1.175 -18.405 -12.580 1.00 0.00 C ATOM 1286 CE LYS A 80 -0.815 -17.017 -12.057 1.00 0.00 C ATOM 1287 NZ LYS A 80 0.422 -16.998 -11.259 1.00 0.00 N ATOM 0 H LYS A 80 -3.653 -18.937 -15.018 1.00 0.00 H new ATOM 0 HA LYS A 80 -2.544 -17.119 -14.734 1.00 0.00 H new ATOM 0 HB2 LYS A 80 0.000 -18.269 -15.873 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -0.189 -16.878 -14.824 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -0.514 -19.808 -14.073 1.00 0.00 H new ATOM 0 HG3 LYS A 80 0.733 -18.703 -13.531 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -2.231 -18.434 -12.848 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -1.025 -19.144 -11.793 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -0.705 -16.336 -12.901 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -1.637 -16.641 -11.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 0.611 -16.028 -10.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 0.314 -17.624 -10.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 1.217 -17.328 -11.843 1.00 0.00 H new ATOM 1301 N SER A 81 -2.859 -17.549 -17.834 1.00 0.00 N ATOM 1302 CA SER A 81 -3.014 -16.837 -19.097 1.00 0.00 C ATOM 1303 C SER A 81 -4.097 -15.777 -18.914 1.00 0.00 C ATOM 1304 O SER A 81 -4.925 -15.846 -18.003 1.00 0.00 O ATOM 1305 CB SER A 81 -3.320 -17.778 -20.259 1.00 0.00 C ATOM 1306 OG SER A 81 -2.238 -18.672 -20.409 1.00 0.00 O ATOM 0 H SER A 81 -3.296 -18.470 -17.805 1.00 0.00 H new ATOM 0 HA SER A 81 -2.072 -16.356 -19.360 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.242 -18.328 -20.068 1.00 0.00 H new ATOM 0 HB3 SER A 81 -3.472 -17.210 -21.177 1.00 0.00 H new ATOM 0 HG SER A 81 -2.541 -19.586 -20.227 1.00 0.00 H new ATOM 1312 N LEU A 82 -4.133 -14.803 -19.815 1.00 0.00 N ATOM 1313 CA LEU A 82 -5.067 -13.686 -19.777 1.00 0.00 C ATOM 1314 C LEU A 82 -6.108 -13.849 -20.884 1.00 0.00 C ATOM 1315 O LEU A 82 -5.852 -14.570 -21.852 1.00 0.00 O ATOM 1316 CB LEU A 82 -4.263 -12.388 -19.983 1.00 0.00 C ATOM 1317 CG LEU A 82 -2.950 -12.187 -19.194 1.00 0.00 C ATOM 1318 CD1 LEU A 82 -3.086 -12.566 -17.719 1.00 0.00 C ATOM 1319 CD2 LEU A 82 -1.720 -12.884 -19.803 1.00 0.00 C ATOM 0 H LEU A 82 -3.497 -14.768 -20.612 1.00 0.00 H new ATOM 0 HA LEU A 82 -5.588 -13.652 -18.820 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -4.024 -12.314 -21.044 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -4.921 -11.552 -19.745 1.00 0.00 H new ATOM 0 HG LEU A 82 -2.770 -11.115 -19.269 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -2.134 -12.405 -17.213 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -3.854 -11.948 -17.254 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -3.367 -13.616 -17.638 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -0.846 -12.687 -19.182 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -1.897 -13.958 -19.851 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -1.545 -12.500 -20.808 1.00 0.00 H new ATOM 1331 N CYS A 83 -7.272 -13.215 -20.774 1.00 0.00 N ATOM 1332 CA CYS A 83 -8.330 -13.280 -21.786 1.00 0.00 C ATOM 1333 C CYS A 83 -9.123 -11.964 -21.785 1.00 0.00 C ATOM 1334 O CYS A 83 -8.908 -11.113 -20.917 1.00 0.00 O ATOM 1335 CB CYS A 83 -9.236 -14.504 -21.567 1.00 0.00 C ATOM 1336 SG CYS A 83 -10.116 -14.302 -19.996 1.00 0.00 S ATOM 0 H CYS A 83 -7.513 -12.634 -19.971 1.00 0.00 H new ATOM 0 HA CYS A 83 -7.878 -13.404 -22.770 1.00 0.00 H new ATOM 0 HB2 CYS A 83 -9.946 -14.600 -22.388 1.00 0.00 H new ATOM 0 HB3 CYS A 83 -8.641 -15.417 -21.552 1.00 0.00 H new ATOM 0 HG CYS A 83 -10.722 -15.411 -19.692 1.00 0.00 H new ATOM 1342 N MET A 84 -10.033 -11.785 -22.742 1.00 0.00 N ATOM 1343 CA MET A 84 -10.874 -10.604 -22.910 1.00 0.00 C ATOM 1344 C MET A 84 -12.298 -11.064 -23.213 1.00 0.00 C ATOM 1345 O MET A 84 -12.467 -12.001 -23.991 1.00 0.00 O ATOM 1346 CB MET A 84 -10.279 -9.763 -24.050 1.00 0.00 C ATOM 1347 CG MET A 84 -10.932 -8.384 -24.195 1.00 0.00 C ATOM 1348 SD MET A 84 -10.220 -7.302 -25.474 1.00 0.00 S ATOM 1349 CE MET A 84 -8.466 -7.277 -25.011 1.00 0.00 C ATOM 0 H MET A 84 -10.211 -12.494 -23.454 1.00 0.00 H new ATOM 0 HA MET A 84 -10.908 -9.990 -22.010 1.00 0.00 H new ATOM 0 HB2 MET A 84 -9.211 -9.634 -23.877 1.00 0.00 H new ATOM 0 HB3 MET A 84 -10.387 -10.308 -24.988 1.00 0.00 H new ATOM 0 HG2 MET A 84 -11.991 -8.525 -24.413 1.00 0.00 H new ATOM 0 HG3 MET A 84 -10.870 -7.871 -23.235 1.00 0.00 H new ATOM 0 HE1 MET A 84 -7.964 -6.460 -25.530 1.00 0.00 H new ATOM 0 HE2 MET A 84 -8.376 -7.133 -23.934 1.00 0.00 H new ATOM 0 HE3 MET A 84 -8.002 -8.223 -25.290 1.00 0.00 H new ATOM 1359 N GLY A 85 -13.295 -10.448 -22.577 1.00 0.00 N ATOM 1360 CA GLY A 85 -14.703 -10.759 -22.754 1.00 0.00 C ATOM 1361 C GLY A 85 -15.225 -10.048 -23.994 1.00 0.00 C ATOM 1362 O GLY A 85 -15.336 -8.819 -23.995 1.00 0.00 O ATOM 0 H GLY A 85 -13.134 -9.697 -21.906 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -14.839 -11.836 -22.854 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -15.269 -10.446 -21.877 1.00 0.00 H new ATOM 1366 N ILE A 86 -15.526 -10.803 -25.048 1.00 0.00 N ATOM 1367 CA ILE A 86 -16.044 -10.299 -26.314 1.00 0.00 C ATOM 1368 C ILE A 86 -17.360 -11.011 -26.566 1.00 0.00 C ATOM 1369 O ILE A 86 -17.383 -12.239 -26.638 1.00 0.00 O ATOM 1370 CB ILE A 86 -15.042 -10.502 -27.470 1.00 0.00 C ATOM 1371 CG1 ILE A 86 -13.691 -9.827 -27.169 1.00 0.00 C ATOM 1372 CG2 ILE A 86 -15.627 -10.001 -28.802 1.00 0.00 C ATOM 1373 CD1 ILE A 86 -12.639 -10.158 -28.222 1.00 0.00 C ATOM 0 H ILE A 86 -15.411 -11.817 -25.042 1.00 0.00 H new ATOM 0 HA ILE A 86 -16.200 -9.222 -26.261 1.00 0.00 H new ATOM 0 HB ILE A 86 -14.860 -11.573 -27.564 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -13.828 -8.747 -27.121 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -13.336 -10.147 -26.189 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -14.900 -10.156 -29.600 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -16.539 -10.553 -29.029 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -15.857 -8.938 -28.722 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -11.702 -9.661 -27.969 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -12.481 -11.236 -28.252 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -12.981 -9.814 -29.198 1.00 0.00 H new ATOM 1385 N ASN A 87 -18.432 -10.235 -26.751 1.00 0.00 N ATOM 1386 CA ASN A 87 -19.787 -10.728 -26.994 1.00 0.00 C ATOM 1387 C ASN A 87 -20.164 -11.753 -25.914 1.00 0.00 C ATOM 1388 O ASN A 87 -20.824 -12.765 -26.170 1.00 0.00 O ATOM 1389 CB ASN A 87 -19.909 -11.244 -28.433 1.00 0.00 C ATOM 1390 CG ASN A 87 -19.647 -10.154 -29.475 1.00 0.00 C ATOM 1391 OD1 ASN A 87 -18.602 -10.104 -30.104 1.00 0.00 O ATOM 1392 ND2 ASN A 87 -20.534 -9.192 -29.653 1.00 0.00 N ATOM 0 H ASN A 87 -18.377 -9.217 -26.735 1.00 0.00 H new ATOM 0 HA ASN A 87 -20.515 -9.921 -26.910 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -19.203 -12.061 -28.583 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -20.908 -11.653 -28.585 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -20.338 -8.431 -30.304 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -21.415 -9.210 -29.140 1.00 0.00 H new ATOM 1399 N ASP A 88 -19.715 -11.457 -24.689 1.00 0.00 N ATOM 1400 CA ASP A 88 -19.890 -12.200 -23.444 1.00 0.00 C ATOM 1401 C ASP A 88 -19.130 -13.532 -23.384 1.00 0.00 C ATOM 1402 O ASP A 88 -19.408 -14.359 -22.514 1.00 0.00 O ATOM 1403 CB ASP A 88 -21.371 -12.290 -23.032 1.00 0.00 C ATOM 1404 CG ASP A 88 -21.958 -10.909 -22.753 1.00 0.00 C ATOM 1405 OD1 ASP A 88 -21.378 -10.192 -21.906 1.00 0.00 O ATOM 1406 OD2 ASP A 88 -23.010 -10.566 -23.336 1.00 0.00 O ATOM 0 H ASP A 88 -19.168 -10.610 -24.534 1.00 0.00 H new ATOM 0 HA ASP A 88 -19.399 -11.609 -22.671 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -21.941 -12.776 -23.824 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -21.465 -12.913 -22.143 1.00 0.00 H new ATOM 1411 N ARG A 89 -18.148 -13.758 -24.261 1.00 0.00 N ATOM 1412 CA ARG A 89 -17.333 -14.975 -24.297 1.00 0.00 C ATOM 1413 C ARG A 89 -15.890 -14.574 -24.016 1.00 0.00 C ATOM 1414 O ARG A 89 -15.409 -13.590 -24.580 1.00 0.00 O ATOM 1415 CB ARG A 89 -17.503 -15.629 -25.668 1.00 0.00 C ATOM 1416 CG ARG A 89 -18.866 -16.319 -25.782 1.00 0.00 C ATOM 1417 CD ARG A 89 -19.273 -16.459 -27.249 1.00 0.00 C ATOM 1418 NE ARG A 89 -20.538 -17.178 -27.376 1.00 0.00 N ATOM 1419 CZ ARG A 89 -21.767 -16.744 -27.099 1.00 0.00 C ATOM 1420 NH1 ARG A 89 -22.004 -15.481 -26.740 1.00 0.00 N ATOM 1421 NH2 ARG A 89 -22.741 -17.638 -27.169 1.00 0.00 N ATOM 0 H ARG A 89 -17.892 -13.084 -24.982 1.00 0.00 H new ATOM 0 HA ARG A 89 -17.638 -15.703 -23.545 1.00 0.00 H new ATOM 0 HB2 ARG A 89 -17.407 -14.875 -26.449 1.00 0.00 H new ATOM 0 HB3 ARG A 89 -16.708 -16.357 -25.829 1.00 0.00 H new ATOM 0 HG2 ARG A 89 -18.823 -17.303 -25.315 1.00 0.00 H new ATOM 0 HG3 ARG A 89 -19.618 -15.743 -25.243 1.00 0.00 H new ATOM 0 HD2 ARG A 89 -19.366 -15.471 -27.700 1.00 0.00 H new ATOM 0 HD3 ARG A 89 -18.493 -16.988 -27.797 1.00 0.00 H new ATOM 0 HE ARG A 89 -20.472 -18.136 -27.721 1.00 0.00 H new ATOM 0 HH11 ARG A 89 -21.233 -14.817 -26.671 1.00 0.00 H new ATOM 0 HH12 ARG A 89 -22.956 -15.179 -26.534 1.00 0.00 H new ATOM 0 HH21 ARG A 89 -22.530 -18.603 -27.425 1.00 0.00 H new ATOM 0 HH22 ARG A 89 -23.702 -17.362 -26.967 1.00 0.00 H new ATOM 1435 N TYR A 90 -15.193 -15.277 -23.125 1.00 0.00 N ATOM 1436 CA TYR A 90 -13.816 -14.943 -22.783 1.00 0.00 C ATOM 1437 C TYR A 90 -12.854 -15.612 -23.756 1.00 0.00 C ATOM 1438 O TYR A 90 -12.653 -16.825 -23.711 1.00 0.00 O ATOM 1439 CB TYR A 90 -13.514 -15.384 -21.340 1.00 0.00 C ATOM 1440 CG TYR A 90 -14.602 -15.076 -20.332 1.00 0.00 C ATOM 1441 CD1 TYR A 90 -15.102 -13.767 -20.206 1.00 0.00 C ATOM 1442 CD2 TYR A 90 -15.151 -16.118 -19.561 1.00 0.00 C ATOM 1443 CE1 TYR A 90 -16.178 -13.510 -19.343 1.00 0.00 C ATOM 1444 CE2 TYR A 90 -16.224 -15.869 -18.691 1.00 0.00 C ATOM 1445 CZ TYR A 90 -16.764 -14.566 -18.610 1.00 0.00 C ATOM 1446 OH TYR A 90 -17.805 -14.310 -17.773 1.00 0.00 O ATOM 0 H TYR A 90 -15.564 -16.085 -22.626 1.00 0.00 H new ATOM 0 HA TYR A 90 -13.684 -13.863 -22.856 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -13.330 -16.458 -21.336 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -12.592 -14.902 -21.015 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -14.658 -12.962 -20.772 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -14.744 -17.115 -19.639 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -16.558 -12.505 -19.239 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -16.633 -16.667 -18.089 1.00 0.00 H new ATOM 0 HH TYR A 90 -18.093 -15.143 -17.345 1.00 0.00 H new ATOM 1456 N TYR A 91 -12.128 -14.801 -24.519 1.00 0.00 N ATOM 1457 CA TYR A 91 -11.168 -15.238 -25.514 1.00 0.00 C ATOM 1458 C TYR A 91 -9.743 -14.929 -25.080 1.00 0.00 C ATOM 1459 O TYR A 91 -9.427 -13.807 -24.678 1.00 0.00 O ATOM 1460 CB TYR A 91 -11.504 -14.582 -26.844 1.00 0.00 C ATOM 1461 CG TYR A 91 -12.800 -15.077 -27.441 1.00 0.00 C ATOM 1462 CD1 TYR A 91 -12.867 -16.361 -28.001 1.00 0.00 C ATOM 1463 CD2 TYR A 91 -13.941 -14.260 -27.429 1.00 0.00 C ATOM 1464 CE1 TYR A 91 -14.077 -16.836 -28.530 1.00 0.00 C ATOM 1465 CE2 TYR A 91 -15.148 -14.716 -27.987 1.00 0.00 C ATOM 1466 CZ TYR A 91 -15.233 -16.035 -28.481 1.00 0.00 C ATOM 1467 OH TYR A 91 -16.399 -16.557 -28.922 1.00 0.00 O ATOM 0 H TYR A 91 -12.198 -13.785 -24.455 1.00 0.00 H new ATOM 0 HA TYR A 91 -11.230 -16.320 -25.626 1.00 0.00 H new ATOM 0 HB2 TYR A 91 -11.565 -13.503 -26.704 1.00 0.00 H new ATOM 0 HB3 TYR A 91 -10.693 -14.767 -27.548 1.00 0.00 H new ATOM 0 HD1 TYR A 91 -11.986 -16.985 -28.025 1.00 0.00 H new ATOM 0 HD2 TYR A 91 -13.891 -13.275 -26.988 1.00 0.00 H new ATOM 0 HE1 TYR A 91 -14.121 -17.819 -28.976 1.00 0.00 H new ATOM 0 HE2 TYR A 91 -16.005 -14.061 -28.037 1.00 0.00 H new ATOM 0 HH TYR A 91 -16.538 -17.438 -28.515 1.00 0.00 H new ATOM 1477 N LYS A 92 -8.872 -15.940 -25.116 1.00 0.00 N ATOM 1478 CA LYS A 92 -7.469 -15.825 -24.725 1.00 0.00 C ATOM 1479 C LYS A 92 -6.755 -14.810 -25.609 1.00 0.00 C ATOM 1480 O LYS A 92 -7.023 -14.728 -26.815 1.00 0.00 O ATOM 1481 CB LYS A 92 -6.789 -17.200 -24.815 1.00 0.00 C ATOM 1482 CG LYS A 92 -5.541 -17.319 -23.917 1.00 0.00 C ATOM 1483 CD LYS A 92 -5.181 -18.741 -23.452 1.00 0.00 C ATOM 1484 CE LYS A 92 -4.655 -19.665 -24.558 1.00 0.00 C ATOM 1485 NZ LYS A 92 -4.157 -20.941 -23.998 1.00 0.00 N ATOM 0 H LYS A 92 -9.129 -16.878 -25.424 1.00 0.00 H new ATOM 0 HA LYS A 92 -7.413 -15.475 -23.694 1.00 0.00 H new ATOM 0 HB2 LYS A 92 -7.506 -17.972 -24.535 1.00 0.00 H new ATOM 0 HB3 LYS A 92 -6.504 -17.390 -25.850 1.00 0.00 H new ATOM 0 HG2 LYS A 92 -4.688 -16.907 -24.457 1.00 0.00 H new ATOM 0 HG3 LYS A 92 -5.691 -16.696 -23.035 1.00 0.00 H new ATOM 0 HD2 LYS A 92 -4.428 -18.672 -22.667 1.00 0.00 H new ATOM 0 HD3 LYS A 92 -6.065 -19.197 -23.006 1.00 0.00 H new ATOM 0 HE2 LYS A 92 -5.450 -19.866 -25.276 1.00 0.00 H new ATOM 0 HE3 LYS A 92 -3.853 -19.166 -25.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 -3.808 -21.546 -24.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 -3.383 -20.749 -23.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 -4.930 -21.427 -23.500 1.00 0.00 H new ATOM 1499 N ILE A 93 -5.815 -14.069 -25.028 1.00 0.00 N ATOM 1500 CA ILE A 93 -5.040 -13.065 -25.734 1.00 0.00 C ATOM 1501 C ILE A 93 -3.594 -13.555 -25.796 1.00 0.00 C ATOM 1502 O ILE A 93 -3.057 -13.990 -24.777 1.00 0.00 O ATOM 1503 CB ILE A 93 -5.255 -11.691 -25.065 1.00 0.00 C ATOM 1504 CG1 ILE A 93 -4.702 -11.592 -23.621 1.00 0.00 C ATOM 1505 CG2 ILE A 93 -6.759 -11.353 -25.125 1.00 0.00 C ATOM 1506 CD1 ILE A 93 -5.404 -10.578 -22.698 1.00 0.00 C ATOM 0 H ILE A 93 -5.571 -14.154 -24.041 1.00 0.00 H new ATOM 0 HA ILE A 93 -5.361 -12.922 -26.766 1.00 0.00 H new ATOM 0 HB ILE A 93 -4.675 -10.955 -25.622 1.00 0.00 H new ATOM 0 HG12 ILE A 93 -4.766 -12.578 -23.160 1.00 0.00 H new ATOM 0 HG13 ILE A 93 -3.645 -11.333 -23.675 1.00 0.00 H new ATOM 0 HG21 ILE A 93 -6.933 -10.384 -24.657 1.00 0.00 H new ATOM 0 HG22 ILE A 93 -7.083 -11.317 -26.165 1.00 0.00 H new ATOM 0 HG23 ILE A 93 -7.325 -12.119 -24.595 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -4.934 -10.595 -21.715 1.00 0.00 H new ATOM 0 HD12 ILE A 93 -5.319 -9.578 -23.124 1.00 0.00 H new ATOM 0 HD13 ILE A 93 -6.457 -10.842 -22.601 1.00 0.00 H new ATOM 1518 N LEU A 94 -2.967 -13.485 -26.974 1.00 0.00 N ATOM 1519 CA LEU A 94 -1.590 -13.932 -27.209 1.00 0.00 C ATOM 1520 C LEU A 94 -0.772 -12.747 -27.722 1.00 0.00 C ATOM 1521 O LEU A 94 -1.351 -11.783 -28.232 1.00 0.00 O ATOM 1522 CB LEU A 94 -1.552 -15.103 -28.226 1.00 0.00 C ATOM 1523 CG LEU A 94 -1.638 -16.536 -27.657 1.00 0.00 C ATOM 1524 CD1 LEU A 94 -0.369 -16.959 -26.906 1.00 0.00 C ATOM 1525 CD2 LEU A 94 -2.849 -16.782 -26.752 1.00 0.00 C ATOM 0 H LEU A 94 -3.413 -13.107 -27.810 1.00 0.00 H new ATOM 0 HA LEU A 94 -1.164 -14.298 -26.275 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -2.376 -14.968 -28.927 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.629 -15.022 -28.800 1.00 0.00 H new ATOM 0 HG LEU A 94 -1.754 -17.152 -28.549 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -0.490 -17.975 -26.530 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.484 -16.922 -27.584 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -0.198 -16.281 -26.070 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -2.833 -17.812 -26.395 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -2.811 -16.102 -25.901 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -3.766 -16.607 -27.315 1.00 0.00 H new ATOM 1537 N PRO A 95 0.560 -12.765 -27.556 1.00 0.00 N ATOM 1538 CA PRO A 95 1.413 -11.688 -28.024 1.00 0.00 C ATOM 1539 C PRO A 95 1.544 -11.798 -29.541 1.00 0.00 C ATOM 1540 O PRO A 95 1.412 -12.892 -30.099 1.00 0.00 O ATOM 1541 CB PRO A 95 2.745 -11.912 -27.317 1.00 0.00 C ATOM 1542 CG PRO A 95 2.821 -13.435 -27.234 1.00 0.00 C ATOM 1543 CD PRO A 95 1.368 -13.826 -26.971 1.00 0.00 C ATOM 0 HA PRO A 95 1.027 -10.691 -27.809 1.00 0.00 H new ATOM 0 HB2 PRO A 95 3.579 -11.494 -27.880 1.00 0.00 H new ATOM 0 HB3 PRO A 95 2.764 -11.450 -26.330 1.00 0.00 H new ATOM 0 HG2 PRO A 95 3.198 -13.873 -28.158 1.00 0.00 H new ATOM 0 HG3 PRO A 95 3.481 -13.765 -26.432 1.00 0.00 H new ATOM 0 HD2 PRO A 95 1.134 -14.790 -27.423 1.00 0.00 H new ATOM 0 HD3 PRO A 95 1.176 -13.920 -25.902 1.00 0.00 H new ATOM 1551 N GLU A 96 1.858 -10.697 -30.230 1.00 0.00 N ATOM 1552 CA GLU A 96 2.021 -10.761 -31.685 1.00 0.00 C ATOM 1553 C GLU A 96 3.231 -11.635 -32.066 1.00 0.00 C ATOM 1554 O GLU A 96 3.423 -11.966 -33.236 1.00 0.00 O ATOM 1555 CB GLU A 96 2.052 -9.371 -32.327 1.00 0.00 C ATOM 1556 CG GLU A 96 3.318 -8.572 -32.011 1.00 0.00 C ATOM 1557 CD GLU A 96 3.426 -7.241 -32.766 1.00 0.00 C ATOM 1558 OE1 GLU A 96 2.764 -7.049 -33.815 1.00 0.00 O ATOM 1559 OE2 GLU A 96 4.186 -6.363 -32.286 1.00 0.00 O ATOM 0 H GLU A 96 2.001 -9.775 -29.818 1.00 0.00 H new ATOM 0 HA GLU A 96 1.139 -11.249 -32.100 1.00 0.00 H new ATOM 0 HB2 GLU A 96 1.962 -9.478 -33.408 1.00 0.00 H new ATOM 0 HB3 GLU A 96 1.183 -8.806 -31.989 1.00 0.00 H new ATOM 0 HG2 GLU A 96 3.351 -8.373 -30.940 1.00 0.00 H new ATOM 0 HG3 GLU A 96 4.189 -9.183 -32.248 1.00 0.00 H new ATOM 1566 N SER A 97 4.072 -12.006 -31.095 1.00 0.00 N ATOM 1567 CA SER A 97 5.224 -12.865 -31.327 1.00 0.00 C ATOM 1568 C SER A 97 4.745 -14.287 -31.660 1.00 0.00 C ATOM 1569 O SER A 97 5.468 -15.039 -32.310 1.00 0.00 O ATOM 1570 CB SER A 97 6.193 -12.847 -30.130 1.00 0.00 C ATOM 1571 OG SER A 97 5.642 -12.253 -28.964 1.00 0.00 O ATOM 0 H SER A 97 3.967 -11.714 -30.123 1.00 0.00 H new ATOM 0 HA SER A 97 5.785 -12.482 -32.179 1.00 0.00 H new ATOM 0 HB2 SER A 97 6.493 -13.869 -29.900 1.00 0.00 H new ATOM 0 HB3 SER A 97 7.096 -12.306 -30.412 1.00 0.00 H new ATOM 0 HG SER A 97 6.304 -12.274 -28.242 1.00 0.00 H new ATOM 1577 N ASP A 98 3.517 -14.650 -31.268 1.00 0.00 N ATOM 1578 CA ASP A 98 2.922 -15.963 -31.518 1.00 0.00 C ATOM 1579 C ASP A 98 2.328 -16.061 -32.931 1.00 0.00 C ATOM 1580 O ASP A 98 1.878 -17.129 -33.354 1.00 0.00 O ATOM 1581 CB ASP A 98 1.859 -16.269 -30.451 1.00 0.00 C ATOM 1582 CG ASP A 98 1.985 -17.714 -29.970 1.00 0.00 C ATOM 1583 OD1 ASP A 98 2.776 -17.952 -29.034 1.00 0.00 O ATOM 1584 OD2 ASP A 98 1.324 -18.644 -30.481 1.00 0.00 O ATOM 0 H ASP A 98 2.897 -14.022 -30.756 1.00 0.00 H new ATOM 0 HA ASP A 98 3.713 -16.710 -31.453 1.00 0.00 H new ATOM 0 HB2 ASP A 98 1.974 -15.587 -29.608 1.00 0.00 H new ATOM 0 HB3 ASP A 98 0.864 -16.102 -30.862 1.00 0.00 H new ATOM 1589 N LYS A 99 2.286 -14.941 -33.670 1.00 0.00 N ATOM 1590 CA LYS A 99 1.757 -14.908 -35.029 1.00 0.00 C ATOM 1591 C LYS A 99 2.507 -15.924 -35.871 1.00 0.00 C ATOM 1592 O LYS A 99 3.703 -16.147 -35.681 1.00 0.00 O ATOM 1593 CB LYS A 99 1.919 -13.520 -35.651 1.00 0.00 C ATOM 1594 CG LYS A 99 0.917 -12.486 -35.136 1.00 0.00 C ATOM 1595 CD LYS A 99 -0.491 -12.669 -35.713 1.00 0.00 C ATOM 1596 CE LYS A 99 -1.322 -11.414 -35.418 1.00 0.00 C ATOM 1597 NZ LYS A 99 -2.297 -11.135 -36.489 1.00 0.00 N ATOM 0 H LYS A 99 2.619 -14.037 -33.336 1.00 0.00 H new ATOM 0 HA LYS A 99 0.694 -15.146 -34.996 1.00 0.00 H new ATOM 0 HB2 LYS A 99 2.929 -13.161 -35.454 1.00 0.00 H new ATOM 0 HB3 LYS A 99 1.815 -13.604 -36.733 1.00 0.00 H new ATOM 0 HG2 LYS A 99 0.868 -12.548 -34.049 1.00 0.00 H new ATOM 0 HG3 LYS A 99 1.277 -11.487 -35.383 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -0.437 -12.840 -36.788 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -0.966 -13.546 -35.274 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -1.848 -11.541 -34.472 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -0.657 -10.558 -35.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -2.838 -10.279 -36.251 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -1.794 -10.988 -37.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -2.948 -11.941 -36.585 1.00 0.00 H new ATOM 1611 N GLY A 100 1.809 -16.471 -36.855 1.00 0.00 N ATOM 1612 CA GLY A 100 2.336 -17.490 -37.750 1.00 0.00 C ATOM 1613 C GLY A 100 1.685 -18.828 -37.408 1.00 0.00 C ATOM 1614 O GLY A 100 1.434 -19.623 -38.315 1.00 0.00 O ATOM 0 H GLY A 100 0.843 -16.214 -37.057 1.00 0.00 H new ATOM 0 HA2 GLY A 100 2.131 -17.224 -38.787 1.00 0.00 H new ATOM 0 HA3 GLY A 100 3.419 -17.560 -37.647 1.00 0.00 H new ATOM 1618 N ALA A 101 1.349 -19.057 -36.131 1.00 0.00 N ATOM 1619 CA ALA A 101 0.703 -20.269 -35.629 1.00 0.00 C ATOM 1620 C ALA A 101 -0.691 -19.981 -35.065 1.00 0.00 C ATOM 1621 O ALA A 101 -1.415 -20.910 -34.712 1.00 0.00 O ATOM 1622 CB ALA A 101 1.600 -20.921 -34.583 1.00 0.00 C ATOM 0 H ALA A 101 1.528 -18.375 -35.394 1.00 0.00 H new ATOM 0 HA ALA A 101 0.563 -20.959 -36.461 1.00 0.00 H new ATOM 0 HB1 ALA A 101 1.122 -21.825 -34.206 1.00 0.00 H new ATOM 0 HB2 ALA A 101 2.558 -21.179 -35.035 1.00 0.00 H new ATOM 0 HB3 ALA A 101 1.763 -20.226 -33.759 1.00 0.00 H new ATOM 1628 N VAL A 102 -1.059 -18.711 -34.927 1.00 0.00 N ATOM 1629 CA VAL A 102 -2.337 -18.235 -34.444 1.00 0.00 C ATOM 1630 C VAL A 102 -2.598 -16.886 -35.115 1.00 0.00 C ATOM 1631 O VAL A 102 -1.662 -16.146 -35.444 1.00 0.00 O ATOM 1632 CB VAL A 102 -2.332 -18.180 -32.902 1.00 0.00 C ATOM 1633 CG1 VAL A 102 -1.114 -17.470 -32.308 1.00 0.00 C ATOM 1634 CG2 VAL A 102 -3.624 -17.610 -32.307 1.00 0.00 C ATOM 0 H VAL A 102 -0.429 -17.945 -35.166 1.00 0.00 H new ATOM 0 HA VAL A 102 -3.155 -18.908 -34.703 1.00 0.00 H new ATOM 0 HB VAL A 102 -2.266 -19.228 -32.610 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -1.185 -17.474 -31.220 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -0.205 -17.989 -32.614 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -1.082 -16.441 -32.666 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -3.551 -17.601 -31.220 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -3.774 -16.593 -32.669 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -4.468 -18.230 -32.608 1.00 0.00 H new ATOM 1644 N LYS A 103 -3.873 -16.566 -35.321 1.00 0.00 N ATOM 1645 CA LYS A 103 -4.353 -15.331 -35.918 1.00 0.00 C ATOM 1646 C LYS A 103 -5.445 -14.773 -35.026 1.00 0.00 C ATOM 1647 O LYS A 103 -5.863 -15.408 -34.049 1.00 0.00 O ATOM 1648 CB LYS A 103 -4.893 -15.562 -37.338 1.00 0.00 C ATOM 1649 CG LYS A 103 -3.763 -15.887 -38.311 1.00 0.00 C ATOM 1650 CD LYS A 103 -4.231 -15.758 -39.762 1.00 0.00 C ATOM 1651 CE LYS A 103 -3.048 -16.129 -40.650 1.00 0.00 C ATOM 1652 NZ LYS A 103 -3.264 -15.776 -42.063 1.00 0.00 N ATOM 0 H LYS A 103 -4.634 -17.194 -35.062 1.00 0.00 H new ATOM 0 HA LYS A 103 -3.526 -14.626 -36.002 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -5.614 -16.379 -37.327 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -5.424 -14.673 -37.677 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -2.923 -15.215 -38.135 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -3.403 -16.900 -38.130 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -5.078 -16.417 -39.954 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -4.565 -14.741 -39.970 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -2.154 -15.623 -40.286 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -2.862 -17.200 -40.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -2.430 -16.050 -42.621 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -4.101 -16.278 -42.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -3.414 -14.750 -42.146 1.00 0.00 H new ATOM 1666 N ALA A 104 -5.836 -13.537 -35.323 1.00 0.00 N ATOM 1667 CA ALA A 104 -6.876 -12.872 -34.580 1.00 0.00 C ATOM 1668 C ALA A 104 -8.186 -13.633 -34.763 1.00 0.00 C ATOM 1669 O ALA A 104 -8.332 -14.443 -35.685 1.00 0.00 O ATOM 1670 CB ALA A 104 -6.989 -11.430 -35.052 1.00 0.00 C ATOM 0 H ALA A 104 -5.439 -12.981 -36.080 1.00 0.00 H new ATOM 0 HA ALA A 104 -6.639 -12.858 -33.516 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -7.775 -10.924 -34.492 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -6.040 -10.918 -34.889 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -7.232 -11.413 -36.114 1.00 0.00 H new ATOM 1676 N LEU A 105 -9.148 -13.357 -33.886 1.00 0.00 N ATOM 1677 CA LEU A 105 -10.430 -14.037 -33.948 1.00 0.00 C ATOM 1678 C LEU A 105 -11.279 -13.731 -35.185 1.00 0.00 C ATOM 1679 O LEU A 105 -11.005 -12.809 -35.959 1.00 0.00 O ATOM 1680 CB LEU A 105 -11.186 -13.879 -32.642 1.00 0.00 C ATOM 1681 CG LEU A 105 -11.840 -12.513 -32.417 1.00 0.00 C ATOM 1682 CD1 LEU A 105 -13.347 -12.648 -32.507 1.00 0.00 C ATOM 1683 CD2 LEU A 105 -11.505 -12.001 -31.020 1.00 0.00 C ATOM 0 H LEU A 105 -9.062 -12.674 -33.133 1.00 0.00 H new ATOM 0 HA LEU A 105 -10.197 -15.094 -34.079 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -11.961 -14.645 -32.596 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -10.498 -14.072 -31.819 1.00 0.00 H new ATOM 0 HG LEU A 105 -11.469 -11.823 -33.175 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -13.810 -11.674 -32.346 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -13.621 -13.021 -33.494 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -13.696 -13.346 -31.746 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -11.973 -11.029 -30.867 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -11.877 -12.705 -30.276 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -10.424 -11.903 -30.918 1.00 0.00 H new ATOM 1695 N ARG A 106 -12.320 -14.547 -35.356 1.00 0.00 N ATOM 1696 CA ARG A 106 -13.273 -14.504 -36.455 1.00 0.00 C ATOM 1697 C ARG A 106 -14.628 -14.042 -35.971 1.00 0.00 C ATOM 1698 O ARG A 106 -15.132 -14.539 -34.968 1.00 0.00 O ATOM 1699 CB ARG A 106 -13.454 -15.929 -37.019 1.00 0.00 C ATOM 1700 CG ARG A 106 -12.178 -16.569 -37.577 1.00 0.00 C ATOM 1701 CD ARG A 106 -11.869 -15.967 -38.947 1.00 0.00 C ATOM 1702 NE ARG A 106 -10.611 -16.470 -39.510 1.00 0.00 N ATOM 1703 CZ ARG A 106 -10.423 -17.682 -40.041 1.00 0.00 C ATOM 1704 NH1 ARG A 106 -11.399 -18.576 -40.073 1.00 0.00 N ATOM 1705 NH2 ARG A 106 -9.247 -18.021 -40.551 1.00 0.00 N ATOM 0 H ARG A 106 -12.528 -15.294 -34.693 1.00 0.00 H new ATOM 0 HA ARG A 106 -12.891 -13.816 -37.210 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -13.849 -16.569 -36.230 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -14.204 -15.899 -37.810 1.00 0.00 H new ATOM 0 HG2 ARG A 106 -11.344 -16.399 -36.896 1.00 0.00 H new ATOM 0 HG3 ARG A 106 -12.306 -17.648 -37.662 1.00 0.00 H new ATOM 0 HD2 ARG A 106 -12.686 -16.193 -39.632 1.00 0.00 H new ATOM 0 HD3 ARG A 106 -11.816 -14.882 -38.860 1.00 0.00 H new ATOM 0 HE ARG A 106 -9.809 -15.839 -39.495 1.00 0.00 H new ATOM 0 HH11 ARG A 106 -12.315 -18.345 -39.688 1.00 0.00 H new ATOM 0 HH12 ARG A 106 -11.235 -19.496 -40.483 1.00 0.00 H new ATOM 0 HH21 ARG A 106 -8.475 -17.354 -40.540 1.00 0.00 H new ATOM 0 HH22 ARG A 106 -9.114 -18.949 -40.954 1.00 0.00 H new ATOM 1719 N LEU A 107 -15.247 -13.144 -36.731 1.00 0.00 N ATOM 1720 CA LEU A 107 -16.577 -12.629 -36.408 1.00 0.00 C ATOM 1721 C LEU A 107 -17.611 -13.743 -36.586 1.00 0.00 C ATOM 1722 O LEU A 107 -18.729 -13.619 -36.105 1.00 0.00 O ATOM 1723 CB LEU A 107 -16.942 -11.435 -37.302 1.00 0.00 C ATOM 1724 CG LEU A 107 -15.816 -10.389 -37.409 1.00 0.00 C ATOM 1725 CD1 LEU A 107 -15.120 -10.498 -38.772 1.00 0.00 C ATOM 1726 CD2 LEU A 107 -16.347 -8.972 -37.209 1.00 0.00 C ATOM 0 H LEU A 107 -14.845 -12.754 -37.583 1.00 0.00 H new ATOM 0 HA LEU A 107 -16.573 -12.288 -35.373 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -17.187 -11.798 -38.300 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -17.838 -10.955 -36.908 1.00 0.00 H new ATOM 0 HG LEU A 107 -15.096 -10.594 -36.617 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -14.326 -9.754 -38.836 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -14.693 -11.495 -38.884 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -15.846 -10.323 -39.566 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -15.525 -8.261 -37.291 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -17.095 -8.753 -37.971 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -16.801 -8.890 -36.221 1.00 0.00 H new ATOM 1738 N GLN A 108 -17.230 -14.823 -37.278 1.00 0.00 N ATOM 1739 CA GLN A 108 -18.040 -15.996 -37.550 1.00 0.00 C ATOM 1740 C GLN A 108 -18.507 -16.667 -36.254 1.00 0.00 C ATOM 1741 O GLN A 108 -19.502 -17.395 -36.279 1.00 0.00 O ATOM 1742 CB GLN A 108 -17.190 -16.999 -38.351 1.00 0.00 C ATOM 1743 CG GLN A 108 -16.896 -16.540 -39.789 1.00 0.00 C ATOM 1744 CD GLN A 108 -18.084 -16.707 -40.734 1.00 0.00 C ATOM 1745 OE1 GLN A 108 -19.079 -17.367 -40.430 1.00 0.00 O ATOM 1746 NE2 GLN A 108 -17.999 -16.151 -41.923 1.00 0.00 N ATOM 0 H GLN A 108 -16.296 -14.897 -37.681 1.00 0.00 H new ATOM 0 HA GLN A 108 -18.922 -15.688 -38.112 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -16.247 -17.162 -37.830 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -17.707 -17.958 -38.382 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -16.598 -15.492 -39.774 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -16.050 -17.107 -40.177 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -17.175 -15.605 -42.173 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -18.758 -16.266 -42.595 1.00 0.00 H new ATOM 1755 N ASN A 109 -17.798 -16.449 -35.140 1.00 0.00 N ATOM 1756 CA ASN A 109 -18.145 -17.019 -33.847 1.00 0.00 C ATOM 1757 C ASN A 109 -19.371 -16.332 -33.226 1.00 0.00 C ATOM 1758 O ASN A 109 -19.833 -16.793 -32.178 1.00 0.00 O ATOM 1759 CB ASN A 109 -16.962 -16.855 -32.869 1.00 0.00 C ATOM 1760 CG ASN A 109 -15.619 -17.364 -33.386 1.00 0.00 C ATOM 1761 OD1 ASN A 109 -15.519 -18.173 -34.309 1.00 0.00 O ATOM 1762 ND2 ASN A 109 -14.520 -16.872 -32.848 1.00 0.00 N ATOM 0 H ASN A 109 -16.961 -15.866 -35.118 1.00 0.00 H new ATOM 0 HA ASN A 109 -18.375 -18.071 -34.013 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -16.861 -15.799 -32.619 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -17.200 -17.380 -31.944 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -13.607 -17.163 -33.197 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -14.583 -16.201 -32.083 1.00 0.00 H new ATOM 1769 N PHE A 110 -19.888 -15.259 -33.837 1.00 0.00 N ATOM 1770 CA PHE A 110 -21.015 -14.471 -33.356 1.00 0.00 C ATOM 1771 C PHE A 110 -22.142 -14.407 -34.386 1.00 0.00 C ATOM 1772 O PHE A 110 -22.194 -15.263 -35.293 1.00 0.00 O ATOM 1773 CB PHE A 110 -20.467 -13.083 -32.976 1.00 0.00 C ATOM 1774 CG PHE A 110 -19.181 -13.102 -32.156 1.00 0.00 C ATOM 1775 CD1 PHE A 110 -19.112 -13.758 -30.909 1.00 0.00 C ATOM 1776 CD2 PHE A 110 -18.020 -12.502 -32.675 1.00 0.00 C ATOM 1777 CE1 PHE A 110 -17.901 -13.820 -30.203 1.00 0.00 C ATOM 1778 CE2 PHE A 110 -16.812 -12.557 -31.960 1.00 0.00 C ATOM 1779 CZ PHE A 110 -16.747 -13.217 -30.726 1.00 0.00 C ATOM 0 H PHE A 110 -19.512 -14.906 -34.717 1.00 0.00 H new ATOM 0 HA PHE A 110 -21.468 -14.936 -32.480 1.00 0.00 H new ATOM 0 HB2 PHE A 110 -20.289 -12.516 -33.890 1.00 0.00 H new ATOM 0 HB3 PHE A 110 -21.232 -12.548 -32.413 1.00 0.00 H new ATOM 0 HD1 PHE A 110 -19.998 -14.216 -30.495 1.00 0.00 H new ATOM 0 HD2 PHE A 110 -18.057 -11.996 -33.628 1.00 0.00 H new ATOM 0 HE1 PHE A 110 -17.857 -14.334 -29.254 1.00 0.00 H new ATOM 0 HE2 PHE A 110 -15.928 -12.087 -32.364 1.00 0.00 H new ATOM 0 HZ PHE A 110 -15.816 -13.261 -30.181 1.00 0.00 H new