USER MOD reduce.3.24.130724 H: found=0, std=0, add=1017, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1017 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 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 1.2: A 110 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 19 MET CE :methyl -120:sc= 0 (180deg=-0.00655) USER MOD Set 2.2: A 57 LYS NZ :NH3+ 161:sc= 0 (180deg=-0.14) USER MOD Set 2.3: A 74 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.4: A 100 SER OG : rot 180:sc= 0 USER MOD Set 2.5: A 102 THR OG1 : rot 180:sc= 0.038 USER MOD Set 2.6: A 111 ASN : amide:sc= 0.037 K(o=0.075,f=-0.55) USER MOD Set 2.7: A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 30 GLN : amide:sc= 0.342 K(o=0.51,f=0) USER MOD Set 3.2: A 33 LYS NZ :NH3+ -141:sc= 0.166 (180deg=0) USER MOD Set 4.1: A 2 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 4 SER OG : rot 33:sc= 0.158 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 TYR OH : rot -1:sc= 0.0877 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 GLN : amide:sc= 0.373 K(o=0.37,f=-4.2!) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -3.2! K(o=-3.2!,f=-1.6) USER MOD Single : A 14 ASN : amide:sc= 0.0301 X(o=0.03,f=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 LYS NZ :NH3+ 158:sc= 0 (180deg=-0.258) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 44 ASN : amide:sc= 0 X(o=0,f=-0.01) USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot 180:sc= -0.147 USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 60 GLN : amide:sc=-0.00398 X(o=-0.004,f=-0.04) USER MOD Single : A 61 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 CYS SG : rot -170:sc= -0.151 USER MOD Single : A 73 THR OG1 : rot -71:sc= 0.563 USER MOD Single : A 75 THR OG1 : rot 153:sc= 0.0521 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 174:sc= 0.0441 USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=-0.092) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot 79:sc= 0.049 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=-0.073) USER MOD Single : A 99 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 9.771 -10.605 13.436 1.00 0.00 N ATOM 2 CA SER A 2 9.202 -10.734 14.783 1.00 0.00 C ATOM 3 C SER A 2 8.586 -9.378 15.209 1.00 0.00 C ATOM 4 O SER A 2 9.301 -8.389 15.402 1.00 0.00 O ATOM 5 CB SER A 2 10.285 -11.237 15.763 1.00 0.00 C ATOM 6 OG SER A 2 9.725 -11.481 17.049 1.00 0.00 O ATOM 0 HA SER A 2 8.401 -11.473 14.793 1.00 0.00 H new ATOM 0 HB2 SER A 2 10.735 -12.152 15.377 1.00 0.00 H new ATOM 0 HB3 SER A 2 11.082 -10.498 15.842 1.00 0.00 H new ATOM 0 HG SER A 2 10.425 -11.800 17.656 1.00 0.00 H new ATOM 12 N PHE A 3 7.252 -9.357 15.371 1.00 0.00 N ATOM 13 CA PHE A 3 6.501 -8.126 15.747 1.00 0.00 C ATOM 14 C PHE A 3 6.563 -7.675 17.241 1.00 0.00 C ATOM 15 O PHE A 3 6.247 -6.510 17.486 1.00 0.00 O ATOM 16 CB PHE A 3 5.025 -8.251 15.273 1.00 0.00 C ATOM 17 CG PHE A 3 4.782 -8.002 13.772 1.00 0.00 C ATOM 18 CD1 PHE A 3 4.643 -6.693 13.297 1.00 0.00 C ATOM 19 CD2 PHE A 3 4.648 -9.071 12.881 1.00 0.00 C ATOM 20 CE1 PHE A 3 4.376 -6.456 11.951 1.00 0.00 C ATOM 21 CE2 PHE A 3 4.371 -8.833 11.537 1.00 0.00 C ATOM 22 CZ PHE A 3 4.243 -7.527 11.071 1.00 0.00 C ATOM 0 H PHE A 3 6.660 -10.179 15.249 1.00 0.00 H new ATOM 0 HA PHE A 3 7.027 -7.324 15.229 1.00 0.00 H new ATOM 0 HB2 PHE A 3 4.667 -9.251 15.519 1.00 0.00 H new ATOM 0 HB3 PHE A 3 4.419 -7.546 15.842 1.00 0.00 H new ATOM 0 HD1 PHE A 3 4.743 -5.861 13.979 1.00 0.00 H new ATOM 0 HD2 PHE A 3 4.760 -10.085 13.236 1.00 0.00 H new ATOM 0 HE1 PHE A 3 4.272 -5.443 11.590 1.00 0.00 H new ATOM 0 HE2 PHE A 3 4.255 -9.663 10.855 1.00 0.00 H new ATOM 0 HZ PHE A 3 4.040 -7.345 10.026 1.00 0.00 H new ATOM 32 N SER A 4 6.969 -8.514 18.222 1.00 0.00 N ATOM 33 CA SER A 4 7.090 -8.115 19.649 1.00 0.00 C ATOM 34 C SER A 4 8.145 -6.991 19.885 1.00 0.00 C ATOM 35 O SER A 4 9.340 -7.186 19.635 1.00 0.00 O ATOM 36 CB SER A 4 7.408 -9.378 20.481 1.00 0.00 C ATOM 37 OG SER A 4 8.628 -10.011 20.098 1.00 0.00 O ATOM 0 H SER A 4 7.222 -9.487 18.050 1.00 0.00 H new ATOM 0 HA SER A 4 6.142 -7.683 19.969 1.00 0.00 H new ATOM 0 HB2 SER A 4 7.462 -9.106 21.535 1.00 0.00 H new ATOM 0 HB3 SER A 4 6.589 -10.089 20.377 1.00 0.00 H new ATOM 0 HG SER A 4 9.270 -9.332 19.802 1.00 0.00 H new ATOM 43 N GLY A 5 7.676 -5.813 20.331 1.00 0.00 N ATOM 44 CA GLY A 5 8.553 -4.640 20.519 1.00 0.00 C ATOM 45 C GLY A 5 7.805 -3.311 20.732 1.00 0.00 C ATOM 46 O GLY A 5 6.665 -3.127 20.293 1.00 0.00 O ATOM 0 H GLY A 5 6.698 -5.646 20.568 1.00 0.00 H new ATOM 0 HA2 GLY A 5 9.200 -4.820 21.378 1.00 0.00 H new ATOM 0 HA3 GLY A 5 9.200 -4.543 19.647 1.00 0.00 H new ATOM 50 N LYS A 6 8.512 -2.357 21.362 1.00 0.00 N ATOM 51 CA LYS A 6 8.047 -0.950 21.497 1.00 0.00 C ATOM 52 C LYS A 6 8.521 -0.113 20.274 1.00 0.00 C ATOM 53 O LYS A 6 9.720 -0.032 19.993 1.00 0.00 O ATOM 54 CB LYS A 6 8.457 -0.345 22.870 1.00 0.00 C ATOM 55 CG LYS A 6 9.963 -0.125 23.155 1.00 0.00 C ATOM 56 CD LYS A 6 10.233 0.390 24.586 1.00 0.00 C ATOM 57 CE LYS A 6 11.704 0.749 24.881 1.00 0.00 C ATOM 58 NZ LYS A 6 12.601 -0.423 24.922 1.00 0.00 N ATOM 0 H LYS A 6 9.420 -2.530 21.793 1.00 0.00 H new ATOM 0 HA LYS A 6 6.957 -0.927 21.490 1.00 0.00 H new ATOM 0 HB2 LYS A 6 7.955 0.617 22.972 1.00 0.00 H new ATOM 0 HB3 LYS A 6 8.062 -0.995 23.651 1.00 0.00 H new ATOM 0 HG2 LYS A 6 10.497 -1.063 23.005 1.00 0.00 H new ATOM 0 HG3 LYS A 6 10.364 0.589 22.435 1.00 0.00 H new ATOM 0 HD2 LYS A 6 9.617 1.272 24.761 1.00 0.00 H new ATOM 0 HD3 LYS A 6 9.910 -0.371 25.297 1.00 0.00 H new ATOM 0 HE2 LYS A 6 12.060 1.442 24.119 1.00 0.00 H new ATOM 0 HE3 LYS A 6 11.757 1.271 25.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 13.572 -0.110 25.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 12.285 -1.076 25.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 12.579 -0.910 24.003 1.00 0.00 H new ATOM 72 N TYR A 7 7.558 0.482 19.548 1.00 0.00 N ATOM 73 CA TYR A 7 7.832 1.233 18.294 1.00 0.00 C ATOM 74 C TYR A 7 7.405 2.702 18.541 1.00 0.00 C ATOM 75 O TYR A 7 6.209 3.013 18.574 1.00 0.00 O ATOM 76 CB TYR A 7 7.086 0.631 17.070 1.00 0.00 C ATOM 77 CG TYR A 7 7.417 -0.828 16.695 1.00 0.00 C ATOM 78 CD1 TYR A 7 6.710 -1.881 17.287 1.00 0.00 C ATOM 79 CD2 TYR A 7 8.380 -1.115 15.724 1.00 0.00 C ATOM 80 CE1 TYR A 7 6.989 -3.198 16.940 1.00 0.00 C ATOM 81 CE2 TYR A 7 8.641 -2.435 15.357 1.00 0.00 C ATOM 82 CZ TYR A 7 7.952 -3.477 15.977 1.00 0.00 C ATOM 83 OH TYR A 7 8.223 -4.777 15.641 1.00 0.00 O ATOM 0 H TYR A 7 6.571 0.461 19.806 1.00 0.00 H new ATOM 0 HA TYR A 7 8.893 1.170 18.051 1.00 0.00 H new ATOM 0 HB2 TYR A 7 6.015 0.697 17.261 1.00 0.00 H new ATOM 0 HB3 TYR A 7 7.295 1.259 16.204 1.00 0.00 H new ATOM 0 HD1 TYR A 7 5.943 -1.669 18.018 1.00 0.00 H new ATOM 0 HD2 TYR A 7 8.926 -0.310 15.255 1.00 0.00 H new ATOM 0 HE1 TYR A 7 6.457 -4.006 17.420 1.00 0.00 H new ATOM 0 HE2 TYR A 7 9.375 -2.650 14.594 1.00 0.00 H new ATOM 0 HH TYR A 7 7.666 -5.377 16.179 1.00 0.00 H new ATOM 93 N GLN A 8 8.392 3.602 18.710 1.00 0.00 N ATOM 94 CA GLN A 8 8.138 5.055 18.885 1.00 0.00 C ATOM 95 C GLN A 8 7.831 5.695 17.505 1.00 0.00 C ATOM 96 O GLN A 8 8.620 5.580 16.564 1.00 0.00 O ATOM 97 CB GLN A 8 9.369 5.704 19.581 1.00 0.00 C ATOM 98 CG GLN A 8 9.352 7.238 19.803 1.00 0.00 C ATOM 99 CD GLN A 8 8.312 7.752 20.812 1.00 0.00 C ATOM 100 OE1 GLN A 8 8.494 7.642 22.024 1.00 0.00 O ATOM 101 NE2 GLN A 8 7.217 8.337 20.347 1.00 0.00 N ATOM 0 H GLN A 8 9.381 3.352 18.730 1.00 0.00 H new ATOM 0 HA GLN A 8 7.269 5.224 19.521 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.493 5.227 20.553 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.253 5.461 18.991 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.341 7.550 20.138 1.00 0.00 H new ATOM 0 HG3 GLN A 8 9.172 7.724 18.844 1.00 0.00 H new ATOM 0 HE21 GLN A 8 7.073 8.424 19.341 1.00 0.00 H new ATOM 0 HE22 GLN A 8 6.518 8.700 20.995 1.00 0.00 H new ATOM 110 N LEU A 9 6.693 6.403 17.432 1.00 0.00 N ATOM 111 CA LEU A 9 6.304 7.199 16.242 1.00 0.00 C ATOM 112 C LEU A 9 7.203 8.459 16.068 1.00 0.00 C ATOM 113 O LEU A 9 7.497 9.172 17.033 1.00 0.00 O ATOM 114 CB LEU A 9 4.789 7.518 16.372 1.00 0.00 C ATOM 115 CG LEU A 9 4.126 8.382 15.265 1.00 0.00 C ATOM 116 CD1 LEU A 9 4.268 7.807 13.842 1.00 0.00 C ATOM 117 CD2 LEU A 9 2.637 8.611 15.589 1.00 0.00 C ATOM 0 H LEU A 9 6.013 6.444 18.191 1.00 0.00 H new ATOM 0 HA LEU A 9 6.465 6.633 15.325 1.00 0.00 H new ATOM 0 HB2 LEU A 9 4.252 6.571 16.422 1.00 0.00 H new ATOM 0 HB3 LEU A 9 4.635 8.023 17.326 1.00 0.00 H new ATOM 0 HG LEU A 9 4.668 9.328 15.265 1.00 0.00 H new ATOM 0 HD11 LEU A 9 3.778 8.471 13.131 1.00 0.00 H new ATOM 0 HD12 LEU A 9 5.325 7.720 13.588 1.00 0.00 H new ATOM 0 HD13 LEU A 9 3.802 6.822 13.799 1.00 0.00 H new ATOM 0 HD21 LEU A 9 2.183 9.218 14.806 1.00 0.00 H new ATOM 0 HD22 LEU A 9 2.125 7.650 15.646 1.00 0.00 H new ATOM 0 HD23 LEU A 9 2.548 9.127 16.545 1.00 0.00 H new ATOM 129 N GLN A 10 7.615 8.703 14.812 1.00 0.00 N ATOM 130 CA GLN A 10 8.349 9.933 14.404 1.00 0.00 C ATOM 131 C GLN A 10 7.478 10.810 13.457 1.00 0.00 C ATOM 132 O GLN A 10 7.207 11.962 13.810 1.00 0.00 O ATOM 133 CB GLN A 10 9.742 9.629 13.776 1.00 0.00 C ATOM 134 CG GLN A 10 10.856 9.147 14.737 1.00 0.00 C ATOM 135 CD GLN A 10 10.774 7.674 15.172 1.00 0.00 C ATOM 136 OE1 GLN A 10 10.337 6.798 14.426 1.00 0.00 O ATOM 137 NE2 GLN A 10 11.214 7.369 16.383 1.00 0.00 N ATOM 0 H GLN A 10 7.452 8.055 14.041 1.00 0.00 H new ATOM 0 HA GLN A 10 8.544 10.499 15.315 1.00 0.00 H new ATOM 0 HB2 GLN A 10 9.608 8.870 13.005 1.00 0.00 H new ATOM 0 HB3 GLN A 10 10.093 10.532 13.277 1.00 0.00 H new ATOM 0 HG2 GLN A 10 11.820 9.311 14.256 1.00 0.00 H new ATOM 0 HG3 GLN A 10 10.835 9.772 15.630 1.00 0.00 H new ATOM 0 HE21 GLN A 10 11.574 8.102 16.994 1.00 0.00 H new ATOM 0 HE22 GLN A 10 11.193 6.401 16.705 1.00 0.00 H new ATOM 146 N SER A 11 7.088 10.311 12.261 1.00 0.00 N ATOM 147 CA SER A 11 6.470 11.147 11.195 1.00 0.00 C ATOM 148 C SER A 11 5.046 10.644 10.828 1.00 0.00 C ATOM 149 O SER A 11 4.785 9.440 10.736 1.00 0.00 O ATOM 150 CB SER A 11 7.415 11.175 9.972 1.00 0.00 C ATOM 151 OG SER A 11 6.927 12.053 8.963 1.00 0.00 O ATOM 0 H SER A 11 7.189 9.329 12.005 1.00 0.00 H new ATOM 0 HA SER A 11 6.341 12.166 11.561 1.00 0.00 H new ATOM 0 HB2 SER A 11 8.409 11.494 10.285 1.00 0.00 H new ATOM 0 HB3 SER A 11 7.516 10.169 9.564 1.00 0.00 H new ATOM 0 HG SER A 11 7.545 12.053 8.202 1.00 0.00 H new ATOM 157 N GLN A 12 4.148 11.616 10.592 1.00 0.00 N ATOM 158 CA GLN A 12 2.736 11.365 10.202 1.00 0.00 C ATOM 159 C GLN A 12 2.502 11.941 8.776 1.00 0.00 C ATOM 160 O GLN A 12 2.794 13.115 8.519 1.00 0.00 O ATOM 161 CB GLN A 12 1.775 12.066 11.206 1.00 0.00 C ATOM 162 CG GLN A 12 1.746 11.513 12.652 1.00 0.00 C ATOM 163 CD GLN A 12 0.927 10.232 12.876 1.00 0.00 C ATOM 164 OE1 GLN A 12 -0.030 10.217 13.649 1.00 0.00 O ATOM 165 NE2 GLN A 12 1.299 9.117 12.271 1.00 0.00 N ATOM 0 H GLN A 12 4.376 12.607 10.665 1.00 0.00 H new ATOM 0 HA GLN A 12 2.539 10.293 10.212 1.00 0.00 H new ATOM 0 HB2 GLN A 12 2.044 13.121 11.252 1.00 0.00 H new ATOM 0 HB3 GLN A 12 0.764 12.012 10.802 1.00 0.00 H new ATOM 0 HG2 GLN A 12 2.772 11.322 12.966 1.00 0.00 H new ATOM 0 HG3 GLN A 12 1.352 12.290 13.307 1.00 0.00 H new ATOM 0 HE21 GLN A 12 2.092 9.125 11.629 1.00 0.00 H new ATOM 0 HE22 GLN A 12 0.793 8.249 12.446 1.00 0.00 H new ATOM 174 N GLU A 13 1.937 11.124 7.866 1.00 0.00 N ATOM 175 CA GLU A 13 1.609 11.565 6.478 1.00 0.00 C ATOM 176 C GLU A 13 0.230 12.291 6.402 1.00 0.00 C ATOM 177 O GLU A 13 0.206 13.483 6.081 1.00 0.00 O ATOM 178 CB GLU A 13 1.775 10.374 5.496 1.00 0.00 C ATOM 179 CG GLU A 13 1.720 10.756 4.001 1.00 0.00 C ATOM 180 CD GLU A 13 1.967 9.567 3.069 1.00 0.00 C ATOM 181 OE1 GLU A 13 3.129 9.119 2.955 1.00 0.00 O ATOM 182 OE2 GLU A 13 1.004 9.082 2.438 1.00 0.00 O ATOM 0 H GLU A 13 1.694 10.152 8.059 1.00 0.00 H new ATOM 0 HA GLU A 13 2.320 12.327 6.161 1.00 0.00 H new ATOM 0 HB2 GLU A 13 2.728 9.886 5.697 1.00 0.00 H new ATOM 0 HB3 GLU A 13 0.993 9.642 5.699 1.00 0.00 H new ATOM 0 HG2 GLU A 13 0.745 11.188 3.778 1.00 0.00 H new ATOM 0 HG3 GLU A 13 2.464 11.527 3.801 1.00 0.00 H new ATOM 189 N ASN A 14 -0.891 11.594 6.684 1.00 0.00 N ATOM 190 CA ASN A 14 -2.247 12.210 6.716 1.00 0.00 C ATOM 191 C ASN A 14 -2.942 11.853 8.059 1.00 0.00 C ATOM 192 O ASN A 14 -3.898 11.075 8.097 1.00 0.00 O ATOM 193 CB ASN A 14 -3.076 11.759 5.476 1.00 0.00 C ATOM 194 CG ASN A 14 -2.754 12.491 4.159 1.00 0.00 C ATOM 195 OD1 ASN A 14 -2.986 13.691 4.023 1.00 0.00 O ATOM 196 ND2 ASN A 14 -2.242 11.790 3.162 1.00 0.00 N ATOM 0 H ASN A 14 -0.889 10.596 6.895 1.00 0.00 H new ATOM 0 HA ASN A 14 -2.167 13.296 6.661 1.00 0.00 H new ATOM 0 HB2 ASN A 14 -2.919 10.691 5.325 1.00 0.00 H new ATOM 0 HB3 ASN A 14 -4.134 11.897 5.699 1.00 0.00 H new ATOM 0 HD21 ASN A 14 -2.037 12.244 2.272 1.00 0.00 H new ATOM 0 HD22 ASN A 14 -2.052 10.795 3.283 1.00 0.00 H new ATOM 203 N PHE A 15 -2.485 12.470 9.166 1.00 0.00 N ATOM 204 CA PHE A 15 -3.170 12.378 10.487 1.00 0.00 C ATOM 205 C PHE A 15 -4.448 13.268 10.547 1.00 0.00 C ATOM 206 O PHE A 15 -5.524 12.739 10.829 1.00 0.00 O ATOM 207 CB PHE A 15 -2.145 12.648 11.624 1.00 0.00 C ATOM 208 CG PHE A 15 -2.704 12.598 13.058 1.00 0.00 C ATOM 209 CD1 PHE A 15 -2.895 11.378 13.718 1.00 0.00 C ATOM 210 CD2 PHE A 15 -3.046 13.788 13.708 1.00 0.00 C ATOM 211 CE1 PHE A 15 -3.388 11.355 15.020 1.00 0.00 C ATOM 212 CE2 PHE A 15 -3.565 13.756 14.997 1.00 0.00 C ATOM 213 CZ PHE A 15 -3.726 12.544 15.658 1.00 0.00 C ATOM 0 H PHE A 15 -1.641 13.042 9.179 1.00 0.00 H new ATOM 0 HA PHE A 15 -3.545 11.365 10.633 1.00 0.00 H new ATOM 0 HB2 PHE A 15 -1.340 11.917 11.543 1.00 0.00 H new ATOM 0 HB3 PHE A 15 -1.701 13.630 11.461 1.00 0.00 H new ATOM 0 HD1 PHE A 15 -2.659 10.452 13.215 1.00 0.00 H new ATOM 0 HD2 PHE A 15 -2.906 14.735 13.207 1.00 0.00 H new ATOM 0 HE1 PHE A 15 -3.508 10.413 15.535 1.00 0.00 H new ATOM 0 HE2 PHE A 15 -3.844 14.677 15.487 1.00 0.00 H new ATOM 0 HZ PHE A 15 -4.113 12.525 16.666 1.00 0.00 H new ATOM 223 N GLU A 16 -4.339 14.587 10.304 1.00 0.00 N ATOM 224 CA GLU A 16 -5.504 15.520 10.359 1.00 0.00 C ATOM 225 C GLU A 16 -6.583 15.296 9.247 1.00 0.00 C ATOM 226 O GLU A 16 -7.772 15.438 9.547 1.00 0.00 O ATOM 227 CB GLU A 16 -5.018 16.994 10.413 1.00 0.00 C ATOM 228 CG GLU A 16 -4.226 17.373 11.689 1.00 0.00 C ATOM 229 CD GLU A 16 -3.768 18.833 11.707 1.00 0.00 C ATOM 230 OE1 GLU A 16 -4.577 19.719 12.061 1.00 0.00 O ATOM 231 OE2 GLU A 16 -2.593 19.103 11.373 1.00 0.00 O ATOM 0 H GLU A 16 -3.458 15.042 10.066 1.00 0.00 H new ATOM 0 HA GLU A 16 -6.029 15.284 11.285 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -4.390 17.186 9.543 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -5.885 17.650 10.332 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.848 17.184 12.564 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.354 16.725 11.772 1.00 0.00 H new ATOM 238 N ALA A 17 -6.201 14.906 8.009 1.00 0.00 N ATOM 239 CA ALA A 17 -7.160 14.443 6.968 1.00 0.00 C ATOM 240 C ALA A 17 -7.894 13.098 7.264 1.00 0.00 C ATOM 241 O ALA A 17 -9.102 13.026 7.033 1.00 0.00 O ATOM 242 CB ALA A 17 -6.438 14.392 5.606 1.00 0.00 C ATOM 0 H ALA A 17 -5.229 14.902 7.701 1.00 0.00 H new ATOM 0 HA ALA A 17 -7.966 15.177 6.961 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -7.134 14.054 4.838 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -6.071 15.386 5.351 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -5.598 13.700 5.665 1.00 0.00 H new ATOM 248 N PHE A 18 -7.199 12.056 7.768 1.00 0.00 N ATOM 249 CA PHE A 18 -7.823 10.744 8.119 1.00 0.00 C ATOM 250 C PHE A 18 -8.748 10.804 9.371 1.00 0.00 C ATOM 251 O PHE A 18 -9.876 10.307 9.313 1.00 0.00 O ATOM 252 CB PHE A 18 -6.691 9.682 8.260 1.00 0.00 C ATOM 253 CG PHE A 18 -7.129 8.213 8.413 1.00 0.00 C ATOM 254 CD1 PHE A 18 -7.433 7.695 9.679 1.00 0.00 C ATOM 255 CD2 PHE A 18 -7.208 7.375 7.295 1.00 0.00 C ATOM 256 CE1 PHE A 18 -7.845 6.373 9.818 1.00 0.00 C ATOM 257 CE2 PHE A 18 -7.608 6.050 7.440 1.00 0.00 C ATOM 258 CZ PHE A 18 -7.940 5.554 8.696 1.00 0.00 C ATOM 0 H PHE A 18 -6.195 12.091 7.945 1.00 0.00 H new ATOM 0 HA PHE A 18 -8.496 10.456 7.312 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -6.047 9.754 7.384 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -6.083 9.947 9.125 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -7.347 8.325 10.552 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -6.958 7.758 6.317 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -8.091 5.983 10.795 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -7.661 5.405 6.575 1.00 0.00 H new ATOM 0 HZ PHE A 18 -8.272 4.532 8.801 1.00 0.00 H new ATOM 268 N MET A 19 -8.256 11.373 10.488 1.00 0.00 N ATOM 269 CA MET A 19 -8.987 11.425 11.784 1.00 0.00 C ATOM 270 C MET A 19 -10.250 12.343 11.796 1.00 0.00 C ATOM 271 O MET A 19 -11.265 11.954 12.380 1.00 0.00 O ATOM 272 CB MET A 19 -8.003 11.788 12.929 1.00 0.00 C ATOM 273 CG MET A 19 -6.815 10.835 13.165 1.00 0.00 C ATOM 274 SD MET A 19 -7.389 9.175 13.577 1.00 0.00 S ATOM 275 CE MET A 19 -5.848 8.264 13.352 1.00 0.00 C ATOM 0 H MET A 19 -7.337 11.814 10.525 1.00 0.00 H new ATOM 0 HA MET A 19 -9.389 10.424 11.943 1.00 0.00 H new ATOM 0 HB2 MET A 19 -7.604 12.782 12.729 1.00 0.00 H new ATOM 0 HB3 MET A 19 -8.573 11.854 13.856 1.00 0.00 H new ATOM 0 HG2 MET A 19 -6.192 10.797 12.271 1.00 0.00 H new ATOM 0 HG3 MET A 19 -6.191 11.219 13.972 1.00 0.00 H new ATOM 0 HE1 MET A 19 -5.984 7.504 12.582 1.00 0.00 H new ATOM 0 HE2 MET A 19 -5.060 8.952 13.048 1.00 0.00 H new ATOM 0 HE3 MET A 19 -5.569 7.784 14.290 1.00 0.00 H new ATOM 285 N LYS A 20 -10.216 13.516 11.126 1.00 0.00 N ATOM 286 CA LYS A 20 -11.432 14.326 10.837 1.00 0.00 C ATOM 287 C LYS A 20 -12.447 13.652 9.851 1.00 0.00 C ATOM 288 O LYS A 20 -13.652 13.719 10.110 1.00 0.00 O ATOM 289 CB LYS A 20 -10.959 15.721 10.341 1.00 0.00 C ATOM 290 CG LYS A 20 -12.059 16.805 10.276 1.00 0.00 C ATOM 291 CD LYS A 20 -11.599 18.182 9.751 1.00 0.00 C ATOM 292 CE LYS A 20 -11.261 18.210 8.246 1.00 0.00 C ATOM 293 NZ LYS A 20 -10.944 19.574 7.786 1.00 0.00 N ATOM 0 H LYS A 20 -9.354 13.930 10.770 1.00 0.00 H new ATOM 0 HA LYS A 20 -12.009 14.419 11.757 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -10.164 16.072 10.999 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -10.524 15.607 9.348 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -12.866 16.443 9.639 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -12.476 16.936 11.274 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -12.383 18.913 9.948 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -10.720 18.497 10.314 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -10.413 17.553 8.051 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -12.104 17.820 7.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.722 19.555 6.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -11.762 20.195 7.950 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.124 19.936 8.313 1.00 0.00 H new ATOM 307 N ALA A 21 -11.982 13.021 8.748 1.00 0.00 N ATOM 308 CA ALA A 21 -12.872 12.359 7.749 1.00 0.00 C ATOM 309 C ALA A 21 -13.690 11.127 8.242 1.00 0.00 C ATOM 310 O ALA A 21 -14.855 10.996 7.855 1.00 0.00 O ATOM 311 CB ALA A 21 -12.055 11.991 6.497 1.00 0.00 C ATOM 0 H ALA A 21 -10.990 12.953 8.521 1.00 0.00 H new ATOM 0 HA ALA A 21 -13.637 13.104 7.530 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -12.705 11.508 5.768 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -11.630 12.895 6.061 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -11.251 11.309 6.775 1.00 0.00 H new ATOM 317 N ILE A 22 -13.114 10.258 9.100 1.00 0.00 N ATOM 318 CA ILE A 22 -13.869 9.174 9.806 1.00 0.00 C ATOM 319 C ILE A 22 -15.002 9.679 10.767 1.00 0.00 C ATOM 320 O ILE A 22 -16.092 9.100 10.757 1.00 0.00 O ATOM 321 CB ILE A 22 -12.912 8.136 10.500 1.00 0.00 C ATOM 322 CG1 ILE A 22 -12.034 8.733 11.645 1.00 0.00 C ATOM 323 CG2 ILE A 22 -12.082 7.339 9.465 1.00 0.00 C ATOM 324 CD1 ILE A 22 -11.086 7.771 12.371 1.00 0.00 C ATOM 0 H ILE A 22 -12.120 10.278 9.329 1.00 0.00 H new ATOM 0 HA ILE A 22 -14.401 8.648 9.013 1.00 0.00 H new ATOM 0 HB ILE A 22 -13.570 7.429 11.005 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -11.438 9.544 11.227 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -12.700 9.176 12.386 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -11.434 6.633 9.984 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -12.754 6.794 8.801 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -11.473 8.027 8.879 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -10.537 8.313 13.141 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -11.664 6.971 12.833 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -10.383 7.344 11.656 1.00 0.00 H new ATOM 336 N GLY A 23 -14.740 10.723 11.579 1.00 0.00 N ATOM 337 CA GLY A 23 -15.713 11.279 12.544 1.00 0.00 C ATOM 338 C GLY A 23 -15.134 11.368 13.968 1.00 0.00 C ATOM 339 O GLY A 23 -15.537 10.593 14.839 1.00 0.00 O ATOM 0 H GLY A 23 -13.842 11.208 11.585 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -16.021 12.272 12.216 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -16.607 10.656 12.556 1.00 0.00 H new ATOM 343 N LEU A 24 -14.218 12.329 14.193 1.00 0.00 N ATOM 344 CA LEU A 24 -13.646 12.622 15.539 1.00 0.00 C ATOM 345 C LEU A 24 -13.653 14.162 15.828 1.00 0.00 C ATOM 346 O LEU A 24 -13.468 14.946 14.888 1.00 0.00 O ATOM 347 CB LEU A 24 -12.191 12.086 15.680 1.00 0.00 C ATOM 348 CG LEU A 24 -11.999 10.547 15.722 1.00 0.00 C ATOM 349 CD1 LEU A 24 -10.500 10.205 15.673 1.00 0.00 C ATOM 350 CD2 LEU A 24 -12.639 9.892 16.961 1.00 0.00 C ATOM 0 H LEU A 24 -13.849 12.928 13.455 1.00 0.00 H new ATOM 0 HA LEU A 24 -14.278 12.111 16.265 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -11.606 12.476 14.847 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -11.765 12.504 16.592 1.00 0.00 H new ATOM 0 HG LEU A 24 -12.510 10.143 14.848 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -10.373 9.123 15.703 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -10.067 10.596 14.752 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -9.996 10.653 16.529 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -12.470 8.816 16.932 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -12.190 10.305 17.864 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -13.711 10.091 16.965 1.00 0.00 H new ATOM 362 N PRO A 25 -13.804 14.649 17.098 1.00 0.00 N ATOM 363 CA PRO A 25 -13.769 16.100 17.421 1.00 0.00 C ATOM 364 C PRO A 25 -12.334 16.709 17.439 1.00 0.00 C ATOM 365 O PRO A 25 -11.323 16.002 17.516 1.00 0.00 O ATOM 366 CB PRO A 25 -14.449 16.124 18.807 1.00 0.00 C ATOM 367 CG PRO A 25 -14.072 14.795 19.456 1.00 0.00 C ATOM 368 CD PRO A 25 -14.053 13.807 18.289 1.00 0.00 C ATOM 0 HA PRO A 25 -14.264 16.717 16.671 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -14.100 16.967 19.403 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -15.530 16.225 18.714 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -13.101 14.852 19.947 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -14.797 14.502 20.216 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -13.272 13.057 18.416 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -14.999 13.271 18.206 1.00 0.00 H new ATOM 376 N GLU A 26 -12.284 18.051 17.431 1.00 0.00 N ATOM 377 CA GLU A 26 -11.028 18.833 17.629 1.00 0.00 C ATOM 378 C GLU A 26 -10.240 18.552 18.958 1.00 0.00 C ATOM 379 O GLU A 26 -9.007 18.573 18.932 1.00 0.00 O ATOM 380 CB GLU A 26 -11.402 20.332 17.469 1.00 0.00 C ATOM 381 CG GLU A 26 -10.206 21.294 17.316 1.00 0.00 C ATOM 382 CD GLU A 26 -10.639 22.755 17.179 1.00 0.00 C ATOM 383 OE1 GLU A 26 -10.908 23.202 16.043 1.00 0.00 O ATOM 384 OE2 GLU A 26 -10.714 23.462 18.209 1.00 0.00 O ATOM 0 H GLU A 26 -13.108 18.635 17.288 1.00 0.00 H new ATOM 0 HA GLU A 26 -10.311 18.509 16.875 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -12.047 20.438 16.597 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -11.986 20.639 18.337 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -9.550 21.193 18.181 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -9.624 21.008 16.440 1.00 0.00 H new ATOM 391 N GLU A 27 -10.931 18.258 20.084 1.00 0.00 N ATOM 392 CA GLU A 27 -10.313 17.784 21.353 1.00 0.00 C ATOM 393 C GLU A 27 -9.321 16.579 21.211 1.00 0.00 C ATOM 394 O GLU A 27 -8.179 16.688 21.667 1.00 0.00 O ATOM 395 CB GLU A 27 -11.485 17.481 22.334 1.00 0.00 C ATOM 396 CG GLU A 27 -11.070 17.158 23.786 1.00 0.00 C ATOM 397 CD GLU A 27 -12.244 16.698 24.653 1.00 0.00 C ATOM 398 OE1 GLU A 27 -12.522 15.479 24.694 1.00 0.00 O ATOM 399 OE2 GLU A 27 -12.892 17.552 25.299 1.00 0.00 O ATOM 0 H GLU A 27 -11.946 18.343 20.142 1.00 0.00 H new ATOM 0 HA GLU A 27 -9.662 18.570 21.735 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -12.155 18.341 22.349 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -12.056 16.639 21.942 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -10.306 16.381 23.776 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -10.618 18.043 24.235 1.00 0.00 H new ATOM 406 N LEU A 28 -9.751 15.461 20.593 1.00 0.00 N ATOM 407 CA LEU A 28 -8.922 14.228 20.469 1.00 0.00 C ATOM 408 C LEU A 28 -7.809 14.286 19.375 1.00 0.00 C ATOM 409 O LEU A 28 -6.716 13.760 19.602 1.00 0.00 O ATOM 410 CB LEU A 28 -9.832 12.980 20.260 1.00 0.00 C ATOM 411 CG LEU A 28 -11.030 12.748 21.233 1.00 0.00 C ATOM 412 CD1 LEU A 28 -11.748 11.427 20.905 1.00 0.00 C ATOM 413 CD2 LEU A 28 -10.671 12.805 22.729 1.00 0.00 C ATOM 0 H LEU A 28 -10.674 15.379 20.166 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.385 14.148 21.414 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -10.234 13.031 19.248 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -9.195 12.097 20.305 1.00 0.00 H new ATOM 0 HG LEU A 28 -11.700 13.591 21.064 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -12.580 11.284 21.595 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -12.126 11.462 19.883 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -11.048 10.598 21.005 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -11.567 12.632 23.325 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -9.931 12.037 22.955 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -10.260 13.786 22.967 1.00 0.00 H new ATOM 425 N ILE A 29 -8.083 14.919 18.213 1.00 0.00 N ATOM 426 CA ILE A 29 -7.116 15.063 17.084 1.00 0.00 C ATOM 427 C ILE A 29 -5.938 16.016 17.485 1.00 0.00 C ATOM 428 O ILE A 29 -4.787 15.576 17.498 1.00 0.00 O ATOM 429 CB ILE A 29 -7.838 15.504 15.750 1.00 0.00 C ATOM 430 CG1 ILE A 29 -9.093 14.660 15.362 1.00 0.00 C ATOM 431 CG2 ILE A 29 -6.855 15.527 14.545 1.00 0.00 C ATOM 432 CD1 ILE A 29 -10.055 15.345 14.378 1.00 0.00 C ATOM 0 H ILE A 29 -8.987 15.351 18.023 1.00 0.00 H new ATOM 0 HA ILE A 29 -6.680 14.086 16.877 1.00 0.00 H new ATOM 0 HB ILE A 29 -8.194 16.510 15.973 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -8.759 13.719 14.925 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -9.642 14.413 16.271 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -7.389 15.835 13.646 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -6.048 16.231 14.747 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -6.438 14.531 14.396 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -10.895 14.682 14.169 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -10.425 16.272 14.816 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -9.529 15.567 13.450 1.00 0.00 H new ATOM 444 N GLN A 30 -6.221 17.294 17.813 1.00 0.00 N ATOM 445 CA GLN A 30 -5.178 18.328 18.081 1.00 0.00 C ATOM 446 C GLN A 30 -4.260 18.105 19.330 1.00 0.00 C ATOM 447 O GLN A 30 -3.135 18.613 19.340 1.00 0.00 O ATOM 448 CB GLN A 30 -5.821 19.745 18.134 1.00 0.00 C ATOM 449 CG GLN A 30 -6.731 20.192 16.959 1.00 0.00 C ATOM 450 CD GLN A 30 -6.066 20.287 15.576 1.00 0.00 C ATOM 451 OE1 GLN A 30 -5.509 21.320 15.207 1.00 0.00 O ATOM 452 NE2 GLN A 30 -6.137 19.235 14.775 1.00 0.00 N ATOM 0 H GLN A 30 -7.174 17.646 17.901 1.00 0.00 H new ATOM 0 HA GLN A 30 -4.497 18.231 17.236 1.00 0.00 H new ATOM 0 HB2 GLN A 30 -6.408 19.808 19.050 1.00 0.00 H new ATOM 0 HB3 GLN A 30 -5.014 20.472 18.222 1.00 0.00 H new ATOM 0 HG2 GLN A 30 -7.566 19.495 16.889 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -7.150 21.168 17.204 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -6.601 18.384 15.091 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -5.727 19.276 13.842 1.00 0.00 H new ATOM 461 N LYS A 31 -4.699 17.339 20.351 1.00 0.00 N ATOM 462 CA LYS A 31 -3.807 16.823 21.431 1.00 0.00 C ATOM 463 C LYS A 31 -2.823 15.701 20.966 1.00 0.00 C ATOM 464 O LYS A 31 -1.636 15.763 21.300 1.00 0.00 O ATOM 465 CB LYS A 31 -4.672 16.349 22.631 1.00 0.00 C ATOM 466 CG LYS A 31 -5.374 17.497 23.386 1.00 0.00 C ATOM 467 CD LYS A 31 -6.225 17.035 24.585 1.00 0.00 C ATOM 468 CE LYS A 31 -6.832 18.175 25.427 1.00 0.00 C ATOM 469 NZ LYS A 31 -7.883 18.933 24.720 1.00 0.00 N ATOM 0 H LYS A 31 -5.674 17.058 20.457 1.00 0.00 H new ATOM 0 HA LYS A 31 -3.166 17.650 21.735 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -5.426 15.650 22.269 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -4.039 15.801 23.329 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -4.619 18.200 23.739 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -6.013 18.039 22.688 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -7.034 16.405 24.216 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -5.607 16.414 25.233 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -7.250 17.757 26.343 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -6.038 18.860 25.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -8.493 19.410 25.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -7.442 19.643 24.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -8.455 18.281 24.146 1.00 0.00 H new ATOM 483 N GLY A 32 -3.309 14.702 20.201 1.00 0.00 N ATOM 484 CA GLY A 32 -2.460 13.627 19.631 1.00 0.00 C ATOM 485 C GLY A 32 -1.531 13.927 18.423 1.00 0.00 C ATOM 486 O GLY A 32 -0.737 13.044 18.084 1.00 0.00 O ATOM 0 H GLY A 32 -4.296 14.615 19.960 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -1.831 13.249 20.437 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -3.123 12.813 19.336 1.00 0.00 H new ATOM 490 N LYS A 33 -1.587 15.119 17.786 1.00 0.00 N ATOM 491 CA LYS A 33 -0.615 15.516 16.722 1.00 0.00 C ATOM 492 C LYS A 33 0.823 15.825 17.248 1.00 0.00 C ATOM 493 O LYS A 33 1.791 15.277 16.711 1.00 0.00 O ATOM 494 CB LYS A 33 -1.181 16.604 15.768 1.00 0.00 C ATOM 495 CG LYS A 33 -1.431 18.019 16.331 1.00 0.00 C ATOM 496 CD LYS A 33 -1.892 19.023 15.258 1.00 0.00 C ATOM 497 CE LYS A 33 -2.094 20.438 15.828 1.00 0.00 C ATOM 498 NZ LYS A 33 -2.379 21.415 14.762 1.00 0.00 N ATOM 0 H LYS A 33 -2.293 15.828 17.985 1.00 0.00 H new ATOM 0 HA LYS A 33 -0.483 14.624 16.109 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -0.493 16.698 14.928 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -2.125 16.235 15.367 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -2.185 17.963 17.116 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -0.515 18.386 16.794 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -1.154 19.059 14.457 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -2.826 18.675 14.816 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -2.916 20.429 16.544 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -1.200 20.743 16.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -1.891 22.309 14.971 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -2.043 21.043 13.851 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -3.404 21.583 14.710 1.00 0.00 H new ATOM 512 N ASP A 34 0.957 16.660 18.301 1.00 0.00 N ATOM 513 CA ASP A 34 2.247 16.888 19.009 1.00 0.00 C ATOM 514 C ASP A 34 2.686 15.668 19.880 1.00 0.00 C ATOM 515 O ASP A 34 3.845 15.254 19.784 1.00 0.00 O ATOM 516 CB ASP A 34 2.131 18.211 19.819 1.00 0.00 C ATOM 517 CG ASP A 34 3.446 18.708 20.438 1.00 0.00 C ATOM 518 OD1 ASP A 34 4.221 19.402 19.743 1.00 0.00 O ATOM 519 OD2 ASP A 34 3.709 18.400 21.622 1.00 0.00 O ATOM 0 H ASP A 34 0.180 17.196 18.687 1.00 0.00 H new ATOM 0 HA ASP A 34 3.048 16.990 18.277 1.00 0.00 H new ATOM 0 HB2 ASP A 34 1.739 18.988 19.163 1.00 0.00 H new ATOM 0 HB3 ASP A 34 1.402 18.069 20.617 1.00 0.00 H new ATOM 524 N ILE A 35 1.778 15.106 20.711 1.00 0.00 N ATOM 525 CA ILE A 35 2.078 13.946 21.596 1.00 0.00 C ATOM 526 C ILE A 35 1.835 12.667 20.733 1.00 0.00 C ATOM 527 O ILE A 35 0.698 12.215 20.563 1.00 0.00 O ATOM 528 CB ILE A 35 1.231 13.988 22.920 1.00 0.00 C ATOM 529 CG1 ILE A 35 1.319 15.337 23.703 1.00 0.00 C ATOM 530 CG2 ILE A 35 1.608 12.806 23.854 1.00 0.00 C ATOM 531 CD1 ILE A 35 0.273 15.533 24.815 1.00 0.00 C ATOM 0 H ILE A 35 0.817 15.440 20.790 1.00 0.00 H new ATOM 0 HA ILE A 35 3.110 13.961 21.947 1.00 0.00 H new ATOM 0 HB ILE A 35 0.194 13.894 22.597 1.00 0.00 H new ATOM 0 HG12 ILE A 35 2.312 15.415 24.146 1.00 0.00 H new ATOM 0 HG13 ILE A 35 1.223 16.156 22.991 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.009 12.856 24.764 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.414 11.863 23.343 1.00 0.00 H new ATOM 0 HG23 ILE A 35 2.665 12.869 24.112 1.00 0.00 H new ATOM 0 HD11 ILE A 35 0.426 16.501 25.292 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -0.728 15.495 24.384 1.00 0.00 H new ATOM 0 HD13 ILE A 35 0.379 14.742 25.557 1.00 0.00 H new ATOM 543 N LYS A 36 2.929 12.127 20.171 1.00 0.00 N ATOM 544 CA LYS A 36 2.882 11.058 19.138 1.00 0.00 C ATOM 545 C LYS A 36 3.106 9.664 19.790 1.00 0.00 C ATOM 546 O LYS A 36 4.073 9.456 20.532 1.00 0.00 O ATOM 547 CB LYS A 36 3.855 11.415 17.982 1.00 0.00 C ATOM 548 CG LYS A 36 5.366 11.527 18.304 1.00 0.00 C ATOM 549 CD LYS A 36 6.233 12.036 17.131 1.00 0.00 C ATOM 550 CE LYS A 36 6.065 13.518 16.742 1.00 0.00 C ATOM 551 NZ LYS A 36 6.572 14.448 17.769 1.00 0.00 N ATOM 0 H LYS A 36 3.877 12.414 20.415 1.00 0.00 H new ATOM 0 HA LYS A 36 1.894 10.994 18.683 1.00 0.00 H new ATOM 0 HB2 LYS A 36 3.736 10.663 17.202 1.00 0.00 H new ATOM 0 HB3 LYS A 36 3.534 12.367 17.558 1.00 0.00 H new ATOM 0 HG2 LYS A 36 5.495 12.198 19.153 1.00 0.00 H new ATOM 0 HG3 LYS A 36 5.733 10.548 18.613 1.00 0.00 H new ATOM 0 HD2 LYS A 36 7.280 11.866 17.382 1.00 0.00 H new ATOM 0 HD3 LYS A 36 6.013 11.426 16.255 1.00 0.00 H new ATOM 0 HE2 LYS A 36 6.588 13.702 15.804 1.00 0.00 H new ATOM 0 HE3 LYS A 36 5.009 13.723 16.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 6.431 15.428 17.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 6.057 14.296 18.659 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 7.586 14.276 17.922 1.00 0.00 H new ATOM 565 N GLY A 37 2.167 8.733 19.544 1.00 0.00 N ATOM 566 CA GLY A 37 2.017 7.519 20.376 1.00 0.00 C ATOM 567 C GLY A 37 3.000 6.362 20.110 1.00 0.00 C ATOM 568 O GLY A 37 3.432 6.123 18.979 1.00 0.00 O ATOM 0 H GLY A 37 1.499 8.796 18.776 1.00 0.00 H new ATOM 0 HA2 GLY A 37 2.113 7.811 21.422 1.00 0.00 H new ATOM 0 HA3 GLY A 37 1.004 7.140 20.243 1.00 0.00 H new ATOM 572 N VAL A 38 3.295 5.619 21.190 1.00 0.00 N ATOM 573 CA VAL A 38 4.151 4.401 21.139 1.00 0.00 C ATOM 574 C VAL A 38 3.190 3.193 20.945 1.00 0.00 C ATOM 575 O VAL A 38 2.392 2.878 21.835 1.00 0.00 O ATOM 576 CB VAL A 38 5.042 4.246 22.424 1.00 0.00 C ATOM 577 CG1 VAL A 38 5.949 2.989 22.377 1.00 0.00 C ATOM 578 CG2 VAL A 38 5.952 5.463 22.711 1.00 0.00 C ATOM 0 H VAL A 38 2.952 5.837 22.125 1.00 0.00 H new ATOM 0 HA VAL A 38 4.860 4.466 20.314 1.00 0.00 H new ATOM 0 HB VAL A 38 4.309 4.155 23.225 1.00 0.00 H new ATOM 0 HG11 VAL A 38 6.542 2.934 23.290 1.00 0.00 H new ATOM 0 HG12 VAL A 38 5.329 2.096 22.292 1.00 0.00 H new ATOM 0 HG13 VAL A 38 6.614 3.052 21.516 1.00 0.00 H new ATOM 0 HG21 VAL A 38 6.534 5.277 23.614 1.00 0.00 H new ATOM 0 HG22 VAL A 38 6.627 5.619 21.870 1.00 0.00 H new ATOM 0 HG23 VAL A 38 5.337 6.352 22.852 1.00 0.00 H new ATOM 588 N SER A 39 3.318 2.499 19.799 1.00 0.00 N ATOM 589 CA SER A 39 2.602 1.223 19.549 1.00 0.00 C ATOM 590 C SER A 39 3.428 0.056 20.152 1.00 0.00 C ATOM 591 O SER A 39 4.458 -0.340 19.596 1.00 0.00 O ATOM 592 CB SER A 39 2.394 1.061 18.028 1.00 0.00 C ATOM 593 OG SER A 39 1.602 -0.087 17.746 1.00 0.00 O ATOM 0 H SER A 39 3.912 2.798 19.025 1.00 0.00 H new ATOM 0 HA SER A 39 1.622 1.220 20.026 1.00 0.00 H new ATOM 0 HB2 SER A 39 1.909 1.951 17.626 1.00 0.00 H new ATOM 0 HB3 SER A 39 3.360 0.973 17.532 1.00 0.00 H new ATOM 0 HG SER A 39 1.481 -0.171 16.777 1.00 0.00 H new ATOM 599 N GLU A 40 2.981 -0.456 21.312 1.00 0.00 N ATOM 600 CA GLU A 40 3.746 -1.460 22.097 1.00 0.00 C ATOM 601 C GLU A 40 3.101 -2.857 21.903 1.00 0.00 C ATOM 602 O GLU A 40 2.096 -3.187 22.543 1.00 0.00 O ATOM 603 CB GLU A 40 3.837 -0.992 23.574 1.00 0.00 C ATOM 604 CG GLU A 40 4.806 -1.831 24.435 1.00 0.00 C ATOM 605 CD GLU A 40 4.992 -1.264 25.843 1.00 0.00 C ATOM 606 OE1 GLU A 40 5.865 -0.387 26.029 1.00 0.00 O ATOM 607 OE2 GLU A 40 4.269 -1.692 26.769 1.00 0.00 O ATOM 0 H GLU A 40 2.090 -0.194 21.734 1.00 0.00 H new ATOM 0 HA GLU A 40 4.774 -1.550 21.745 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.156 0.050 23.596 1.00 0.00 H new ATOM 0 HB3 GLU A 40 2.843 -1.031 24.020 1.00 0.00 H new ATOM 0 HG2 GLU A 40 4.430 -2.852 24.506 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.775 -1.882 23.938 1.00 0.00 H new ATOM 614 N ILE A 41 3.706 -3.665 21.011 1.00 0.00 N ATOM 615 CA ILE A 41 3.171 -5.000 20.623 1.00 0.00 C ATOM 616 C ILE A 41 3.710 -6.055 21.636 1.00 0.00 C ATOM 617 O ILE A 41 4.923 -6.208 21.816 1.00 0.00 O ATOM 618 CB ILE A 41 3.488 -5.396 19.133 1.00 0.00 C ATOM 619 CG1 ILE A 41 3.089 -4.303 18.098 1.00 0.00 C ATOM 620 CG2 ILE A 41 2.828 -6.757 18.764 1.00 0.00 C ATOM 621 CD1 ILE A 41 3.349 -4.600 16.614 1.00 0.00 C ATOM 0 H ILE A 41 4.575 -3.419 20.537 1.00 0.00 H new ATOM 0 HA ILE A 41 2.083 -4.961 20.667 1.00 0.00 H new ATOM 0 HB ILE A 41 4.572 -5.494 19.078 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.025 -4.099 18.218 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.620 -3.387 18.355 1.00 0.00 H new ATOM 0 HG21 ILE A 41 3.063 -7.007 17.729 1.00 0.00 H new ATOM 0 HG22 ILE A 41 3.211 -7.537 19.422 1.00 0.00 H new ATOM 0 HG23 ILE A 41 1.747 -6.681 18.882 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.023 -3.753 16.011 1.00 0.00 H new ATOM 0 HD12 ILE A 41 4.415 -4.768 16.458 1.00 0.00 H new ATOM 0 HD13 ILE A 41 2.795 -5.491 16.319 1.00 0.00 H new ATOM 633 N VAL A 42 2.776 -6.822 22.223 1.00 0.00 N ATOM 634 CA VAL A 42 3.093 -8.075 22.963 1.00 0.00 C ATOM 635 C VAL A 42 2.635 -9.237 22.028 1.00 0.00 C ATOM 636 O VAL A 42 1.452 -9.596 22.003 1.00 0.00 O ATOM 637 CB VAL A 42 2.434 -8.086 24.388 1.00 0.00 C ATOM 638 CG1 VAL A 42 2.697 -9.400 25.164 1.00 0.00 C ATOM 639 CG2 VAL A 42 2.889 -6.905 25.282 1.00 0.00 C ATOM 0 H VAL A 42 1.781 -6.600 22.203 1.00 0.00 H new ATOM 0 HA VAL A 42 4.156 -8.178 23.179 1.00 0.00 H new ATOM 0 HB VAL A 42 1.368 -7.990 24.182 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.217 -9.348 26.141 1.00 0.00 H new ATOM 0 HG12 VAL A 42 2.289 -10.241 24.604 1.00 0.00 H new ATOM 0 HG13 VAL A 42 3.770 -9.537 25.294 1.00 0.00 H new ATOM 0 HG21 VAL A 42 2.397 -6.972 26.252 1.00 0.00 H new ATOM 0 HG22 VAL A 42 3.969 -6.948 25.420 1.00 0.00 H new ATOM 0 HG23 VAL A 42 2.621 -5.963 24.804 1.00 0.00 H new ATOM 649 N GLN A 43 3.591 -9.810 21.268 1.00 0.00 N ATOM 650 CA GLN A 43 3.329 -10.954 20.355 1.00 0.00 C ATOM 651 C GLN A 43 3.774 -12.257 21.076 1.00 0.00 C ATOM 652 O GLN A 43 4.955 -12.432 21.400 1.00 0.00 O ATOM 653 CB GLN A 43 4.056 -10.753 18.993 1.00 0.00 C ATOM 654 CG GLN A 43 3.375 -11.408 17.771 1.00 0.00 C ATOM 655 CD GLN A 43 3.227 -12.939 17.777 1.00 0.00 C ATOM 656 OE1 GLN A 43 2.167 -13.471 18.102 1.00 0.00 O ATOM 657 NE2 GLN A 43 4.272 -13.668 17.416 1.00 0.00 N ATOM 0 H GLN A 43 4.562 -9.499 21.266 1.00 0.00 H new ATOM 0 HA GLN A 43 2.266 -11.023 20.123 1.00 0.00 H new ATOM 0 HB2 GLN A 43 4.148 -9.683 18.805 1.00 0.00 H new ATOM 0 HB3 GLN A 43 5.067 -11.150 19.079 1.00 0.00 H new ATOM 0 HG2 GLN A 43 2.380 -10.974 17.668 1.00 0.00 H new ATOM 0 HG3 GLN A 43 3.939 -11.128 16.881 1.00 0.00 H new ATOM 0 HE21 GLN A 43 5.144 -13.212 17.149 1.00 0.00 H new ATOM 0 HE22 GLN A 43 4.204 -14.686 17.405 1.00 0.00 H new ATOM 666 N ASN A 44 2.806 -13.155 21.322 1.00 0.00 N ATOM 667 CA ASN A 44 3.014 -14.416 22.074 1.00 0.00 C ATOM 668 C ASN A 44 2.361 -15.602 21.311 1.00 0.00 C ATOM 669 O ASN A 44 1.245 -16.022 21.633 1.00 0.00 O ATOM 670 CB ASN A 44 2.576 -14.293 23.567 1.00 0.00 C ATOM 671 CG ASN A 44 1.168 -13.743 23.908 1.00 0.00 C ATOM 672 OD1 ASN A 44 0.835 -12.592 23.622 1.00 0.00 O ATOM 673 ND2 ASN A 44 0.327 -14.538 24.554 1.00 0.00 N ATOM 0 H ASN A 44 1.845 -13.030 21.004 1.00 0.00 H new ATOM 0 HA ASN A 44 4.082 -14.627 22.127 1.00 0.00 H new ATOM 0 HB2 ASN A 44 2.656 -15.284 24.013 1.00 0.00 H new ATOM 0 HB3 ASN A 44 3.305 -13.657 24.070 1.00 0.00 H new ATOM 0 HD21 ASN A 44 -0.598 -14.197 24.815 1.00 0.00 H new ATOM 0 HD22 ASN A 44 0.605 -15.491 24.790 1.00 0.00 H new ATOM 680 N GLY A 45 3.079 -16.141 20.299 1.00 0.00 N ATOM 681 CA GLY A 45 2.668 -17.355 19.547 1.00 0.00 C ATOM 682 C GLY A 45 1.294 -17.280 18.850 1.00 0.00 C ATOM 683 O GLY A 45 0.316 -17.798 19.397 1.00 0.00 O ATOM 0 H GLY A 45 3.963 -15.747 19.978 1.00 0.00 H new ATOM 0 HA2 GLY A 45 3.426 -17.566 18.793 1.00 0.00 H new ATOM 0 HA3 GLY A 45 2.659 -18.200 20.235 1.00 0.00 H new ATOM 687 N LYS A 46 1.214 -16.577 17.702 1.00 0.00 N ATOM 688 CA LYS A 46 -0.066 -16.111 17.094 1.00 0.00 C ATOM 689 C LYS A 46 -0.807 -14.945 17.829 1.00 0.00 C ATOM 690 O LYS A 46 -1.475 -14.161 17.151 1.00 0.00 O ATOM 691 CB LYS A 46 -1.076 -17.219 16.695 1.00 0.00 C ATOM 692 CG LYS A 46 -0.549 -18.347 15.785 1.00 0.00 C ATOM 693 CD LYS A 46 -1.670 -19.313 15.352 1.00 0.00 C ATOM 694 CE LYS A 46 -1.157 -20.449 14.452 1.00 0.00 C ATOM 695 NZ LYS A 46 -2.246 -21.365 14.068 1.00 0.00 N ATOM 0 H LYS A 46 2.037 -16.311 17.161 1.00 0.00 H new ATOM 0 HA LYS A 46 0.331 -15.691 16.170 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -1.461 -17.672 17.608 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -1.920 -16.745 16.194 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -0.084 -17.912 14.900 1.00 0.00 H new ATOM 0 HG3 LYS A 46 0.226 -18.904 16.311 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -2.139 -19.740 16.238 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.441 -18.754 14.822 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -0.701 -20.028 13.556 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -0.379 -21.005 14.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -1.867 -22.120 13.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -2.664 -21.785 14.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -2.976 -20.837 13.549 1.00 0.00 H new ATOM 709 N HIS A 47 -0.748 -14.845 19.177 1.00 0.00 N ATOM 710 CA HIS A 47 -1.603 -13.926 19.965 1.00 0.00 C ATOM 711 C HIS A 47 -0.977 -12.505 20.023 1.00 0.00 C ATOM 712 O HIS A 47 0.007 -12.263 20.725 1.00 0.00 O ATOM 713 CB HIS A 47 -1.839 -14.508 21.395 1.00 0.00 C ATOM 714 CG HIS A 47 -3.220 -14.222 22.001 1.00 0.00 C ATOM 715 ND1 HIS A 47 -3.947 -15.160 22.710 1.00 0.00 N ATOM 716 CD2 HIS A 47 -3.947 -13.012 21.943 1.00 0.00 C ATOM 717 CE1 HIS A 47 -5.064 -14.424 23.007 1.00 0.00 C ATOM 718 NE2 HIS A 47 -5.168 -13.121 22.592 1.00 0.00 N ATOM 0 H HIS A 47 -0.108 -15.397 19.748 1.00 0.00 H new ATOM 0 HA HIS A 47 -2.571 -13.835 19.473 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -1.693 -15.588 21.358 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.077 -14.106 22.063 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.596 -12.115 21.455 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -5.868 -14.873 23.572 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -5.916 -12.439 22.721 1.00 0.00 H new ATOM 726 N PHE A 48 -1.592 -11.573 19.287 1.00 0.00 N ATOM 727 CA PHE A 48 -1.191 -10.145 19.271 1.00 0.00 C ATOM 728 C PHE A 48 -2.023 -9.313 20.286 1.00 0.00 C ATOM 729 O PHE A 48 -3.208 -9.557 20.533 1.00 0.00 O ATOM 730 CB PHE A 48 -1.419 -9.581 17.842 1.00 0.00 C ATOM 731 CG PHE A 48 -0.301 -9.859 16.827 1.00 0.00 C ATOM 732 CD1 PHE A 48 -0.215 -11.095 16.175 1.00 0.00 C ATOM 733 CD2 PHE A 48 0.591 -8.838 16.478 1.00 0.00 C ATOM 734 CE1 PHE A 48 0.761 -11.313 15.208 1.00 0.00 C ATOM 735 CE2 PHE A 48 1.550 -9.052 15.497 1.00 0.00 C ATOM 736 CZ PHE A 48 1.639 -10.290 14.866 1.00 0.00 C ATOM 0 H PHE A 48 -2.386 -11.779 18.680 1.00 0.00 H new ATOM 0 HA PHE A 48 -0.141 -10.074 19.553 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -2.349 -9.996 17.452 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -1.557 -8.502 17.915 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -0.910 -11.883 16.424 1.00 0.00 H new ATOM 0 HD2 PHE A 48 0.533 -7.880 16.974 1.00 0.00 H new ATOM 0 HE1 PHE A 48 0.837 -12.275 14.724 1.00 0.00 H new ATOM 0 HE2 PHE A 48 2.228 -8.257 15.223 1.00 0.00 H new ATOM 0 HZ PHE A 48 2.391 -10.456 14.109 1.00 0.00 H new ATOM 746 N LYS A 49 -1.383 -8.254 20.799 1.00 0.00 N ATOM 747 CA LYS A 49 -2.096 -7.086 21.376 1.00 0.00 C ATOM 748 C LYS A 49 -1.163 -5.853 21.277 1.00 0.00 C ATOM 749 O LYS A 49 0.024 -5.937 21.600 1.00 0.00 O ATOM 750 CB LYS A 49 -2.660 -7.294 22.805 1.00 0.00 C ATOM 751 CG LYS A 49 -1.655 -7.634 23.929 1.00 0.00 C ATOM 752 CD LYS A 49 -2.286 -7.457 25.318 1.00 0.00 C ATOM 753 CE LYS A 49 -1.339 -7.858 26.463 1.00 0.00 C ATOM 754 NZ LYS A 49 -1.990 -7.698 27.775 1.00 0.00 N ATOM 0 H LYS A 49 -0.367 -8.174 20.830 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.999 -6.929 20.786 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -3.190 -6.386 23.092 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -3.399 -8.094 22.761 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.311 -8.662 23.813 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.778 -6.992 23.842 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -2.582 -6.416 25.447 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -3.194 -8.057 25.378 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -1.026 -8.894 26.333 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -0.438 -7.246 26.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -1.328 -7.976 28.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.266 -6.704 27.907 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.836 -8.301 27.819 1.00 0.00 H new ATOM 768 N PHE A 50 -1.716 -4.712 20.837 1.00 0.00 N ATOM 769 CA PHE A 50 -0.927 -3.480 20.572 1.00 0.00 C ATOM 770 C PHE A 50 -1.649 -2.255 21.188 1.00 0.00 C ATOM 771 O PHE A 50 -2.774 -1.923 20.798 1.00 0.00 O ATOM 772 CB PHE A 50 -0.570 -3.325 19.067 1.00 0.00 C ATOM 773 CG PHE A 50 -1.665 -3.019 18.025 1.00 0.00 C ATOM 774 CD1 PHE A 50 -2.415 -4.054 17.459 1.00 0.00 C ATOM 775 CD2 PHE A 50 -1.870 -1.705 17.586 1.00 0.00 C ATOM 776 CE1 PHE A 50 -3.357 -3.779 16.469 1.00 0.00 C ATOM 777 CE2 PHE A 50 -2.814 -1.434 16.598 1.00 0.00 C ATOM 778 CZ PHE A 50 -3.554 -2.471 16.037 1.00 0.00 C ATOM 0 H PHE A 50 -2.714 -4.609 20.653 1.00 0.00 H new ATOM 0 HA PHE A 50 0.041 -3.558 21.067 1.00 0.00 H new ATOM 0 HB2 PHE A 50 0.173 -2.531 18.994 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -0.081 -4.248 18.757 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -2.264 -5.071 17.790 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -1.294 -0.899 18.015 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -3.935 -4.582 16.037 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -2.972 -0.418 16.267 1.00 0.00 H new ATOM 0 HZ PHE A 50 -4.281 -2.260 15.267 1.00 0.00 H new ATOM 788 N THR A 51 -0.981 -1.595 22.152 1.00 0.00 N ATOM 789 CA THR A 51 -1.566 -0.458 22.912 1.00 0.00 C ATOM 790 C THR A 51 -0.903 0.848 22.385 1.00 0.00 C ATOM 791 O THR A 51 0.268 1.115 22.676 1.00 0.00 O ATOM 792 CB THR A 51 -1.380 -0.671 24.448 1.00 0.00 C ATOM 793 OG1 THR A 51 -1.782 -1.981 24.842 1.00 0.00 O ATOM 794 CG2 THR A 51 -2.186 0.327 25.299 1.00 0.00 C ATOM 0 H THR A 51 -0.027 -1.827 22.430 1.00 0.00 H new ATOM 0 HA THR A 51 -2.643 -0.387 22.758 1.00 0.00 H new ATOM 0 HB THR A 51 -0.316 -0.517 24.626 1.00 0.00 H new ATOM 0 HG1 THR A 51 -1.653 -2.086 25.808 1.00 0.00 H new ATOM 0 HG21 THR A 51 -2.014 0.126 26.356 1.00 0.00 H new ATOM 0 HG22 THR A 51 -1.868 1.343 25.066 1.00 0.00 H new ATOM 0 HG23 THR A 51 -3.248 0.219 25.078 1.00 0.00 H new ATOM 802 N ILE A 52 -1.670 1.655 21.625 1.00 0.00 N ATOM 803 CA ILE A 52 -1.207 2.978 21.108 1.00 0.00 C ATOM 804 C ILE A 52 -1.637 4.032 22.171 1.00 0.00 C ATOM 805 O ILE A 52 -2.829 4.317 22.319 1.00 0.00 O ATOM 806 CB ILE A 52 -1.747 3.280 19.661 1.00 0.00 C ATOM 807 CG1 ILE A 52 -1.210 2.257 18.616 1.00 0.00 C ATOM 808 CG2 ILE A 52 -1.399 4.723 19.193 1.00 0.00 C ATOM 809 CD1 ILE A 52 -1.898 2.258 17.242 1.00 0.00 C ATOM 0 H ILE A 52 -2.623 1.419 21.348 1.00 0.00 H new ATOM 0 HA ILE A 52 -0.125 2.998 20.981 1.00 0.00 H new ATOM 0 HB ILE A 52 -2.831 3.187 19.723 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -0.147 2.448 18.466 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -1.297 1.257 19.041 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -1.792 4.885 18.189 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -1.844 5.445 19.878 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -0.317 4.851 19.184 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -1.437 1.504 16.604 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -2.957 2.030 17.365 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -1.789 3.240 16.781 1.00 0.00 H new ATOM 821 N THR A 53 -0.645 4.607 22.874 1.00 0.00 N ATOM 822 CA THR A 53 -0.892 5.623 23.939 1.00 0.00 C ATOM 823 C THR A 53 -0.365 6.995 23.423 1.00 0.00 C ATOM 824 O THR A 53 0.816 7.315 23.587 1.00 0.00 O ATOM 825 CB THR A 53 -0.262 5.150 25.286 1.00 0.00 C ATOM 826 OG1 THR A 53 -0.768 3.866 25.643 1.00 0.00 O ATOM 827 CG2 THR A 53 -0.548 6.087 26.475 1.00 0.00 C ATOM 0 H THR A 53 0.342 4.391 22.731 1.00 0.00 H new ATOM 0 HA THR A 53 -1.954 5.744 24.152 1.00 0.00 H new ATOM 0 HB THR A 53 0.813 5.138 25.105 1.00 0.00 H new ATOM 0 HG1 THR A 53 -0.364 3.579 26.489 1.00 0.00 H new ATOM 0 HG21 THR A 53 -0.076 5.689 27.374 1.00 0.00 H new ATOM 0 HG22 THR A 53 -0.146 7.078 26.263 1.00 0.00 H new ATOM 0 HG23 THR A 53 -1.624 6.158 26.631 1.00 0.00 H new ATOM 835 N ALA A 54 -1.265 7.792 22.812 1.00 0.00 N ATOM 836 CA ALA A 54 -0.923 9.117 22.225 1.00 0.00 C ATOM 837 C ALA A 54 -1.260 10.277 23.219 1.00 0.00 C ATOM 838 O ALA A 54 -1.040 10.138 24.428 1.00 0.00 O ATOM 839 CB ALA A 54 -1.589 9.155 20.826 1.00 0.00 C ATOM 0 H ALA A 54 -2.248 7.542 22.708 1.00 0.00 H new ATOM 0 HA ALA A 54 0.145 9.268 22.070 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -1.371 10.109 20.345 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -1.197 8.342 20.214 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -2.668 9.041 20.933 1.00 0.00 H new ATOM 845 N GLY A 55 -1.751 11.432 22.724 1.00 0.00 N ATOM 846 CA GLY A 55 -2.151 12.579 23.576 1.00 0.00 C ATOM 847 C GLY A 55 -3.513 12.358 24.248 1.00 0.00 C ATOM 848 O GLY A 55 -3.559 11.849 25.372 1.00 0.00 O ATOM 0 H GLY A 55 -1.882 11.599 21.726 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -1.393 12.742 24.342 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -2.190 13.483 22.969 1.00 0.00 H new ATOM 852 N SER A 56 -4.601 12.685 23.531 1.00 0.00 N ATOM 853 CA SER A 56 -5.958 12.179 23.878 1.00 0.00 C ATOM 854 C SER A 56 -6.502 11.202 22.790 1.00 0.00 C ATOM 855 O SER A 56 -7.613 11.374 22.281 1.00 0.00 O ATOM 856 CB SER A 56 -6.864 13.393 24.179 1.00 0.00 C ATOM 857 OG SER A 56 -8.121 12.981 24.700 1.00 0.00 O ATOM 0 H SER A 56 -4.578 13.292 22.712 1.00 0.00 H new ATOM 0 HA SER A 56 -5.928 11.567 24.779 1.00 0.00 H new ATOM 0 HB2 SER A 56 -6.369 14.051 24.894 1.00 0.00 H new ATOM 0 HB3 SER A 56 -7.017 13.971 23.267 1.00 0.00 H new ATOM 0 HG SER A 56 -8.674 13.769 24.883 1.00 0.00 H new ATOM 863 N LYS A 57 -5.739 10.129 22.495 1.00 0.00 N ATOM 864 CA LYS A 57 -6.261 8.921 21.810 1.00 0.00 C ATOM 865 C LYS A 57 -5.479 7.718 22.404 1.00 0.00 C ATOM 866 O LYS A 57 -4.419 7.332 21.895 1.00 0.00 O ATOM 867 CB LYS A 57 -6.148 8.952 20.261 1.00 0.00 C ATOM 868 CG LYS A 57 -7.073 9.938 19.518 1.00 0.00 C ATOM 869 CD LYS A 57 -7.221 9.708 17.997 1.00 0.00 C ATOM 870 CE LYS A 57 -5.939 9.809 17.147 1.00 0.00 C ATOM 871 NZ LYS A 57 -5.137 8.569 17.136 1.00 0.00 N ATOM 0 H LYS A 57 -4.746 10.072 22.723 1.00 0.00 H new ATOM 0 HA LYS A 57 -7.334 8.852 21.987 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -5.117 9.190 20.000 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -6.348 7.949 19.885 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -8.063 9.889 19.971 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -6.698 10.949 19.678 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -7.652 8.719 17.844 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -7.940 10.432 17.613 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -6.211 10.065 16.123 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -5.325 10.626 17.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -4.489 8.582 16.323 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -4.587 8.503 18.016 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -5.770 7.747 17.061 1.00 0.00 H new ATOM 885 N VAL A 58 -6.019 7.126 23.489 1.00 0.00 N ATOM 886 CA VAL A 58 -5.410 5.939 24.154 1.00 0.00 C ATOM 887 C VAL A 58 -6.308 4.733 23.743 1.00 0.00 C ATOM 888 O VAL A 58 -7.333 4.458 24.378 1.00 0.00 O ATOM 889 CB VAL A 58 -5.237 6.163 25.697 1.00 0.00 C ATOM 890 CG1 VAL A 58 -4.600 4.939 26.396 1.00 0.00 C ATOM 891 CG2 VAL A 58 -4.384 7.410 26.047 1.00 0.00 C ATOM 0 H VAL A 58 -6.880 7.447 23.931 1.00 0.00 H new ATOM 0 HA VAL A 58 -4.386 5.745 23.833 1.00 0.00 H new ATOM 0 HB VAL A 58 -6.252 6.318 26.062 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -4.500 5.140 27.463 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.235 4.065 26.250 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -3.616 4.748 25.969 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -4.305 7.505 27.130 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -3.388 7.301 25.619 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -4.859 8.302 25.638 1.00 0.00 H new ATOM 901 N ILE A 59 -5.924 4.062 22.639 1.00 0.00 N ATOM 902 CA ILE A 59 -6.783 3.069 21.937 1.00 0.00 C ATOM 903 C ILE A 59 -6.032 1.711 22.041 1.00 0.00 C ATOM 904 O ILE A 59 -4.947 1.547 21.468 1.00 0.00 O ATOM 905 CB ILE A 59 -7.073 3.496 20.451 1.00 0.00 C ATOM 906 CG1 ILE A 59 -7.749 4.898 20.318 1.00 0.00 C ATOM 907 CG2 ILE A 59 -7.944 2.443 19.716 1.00 0.00 C ATOM 908 CD1 ILE A 59 -7.669 5.520 18.916 1.00 0.00 C ATOM 0 H ILE A 59 -5.010 4.188 22.203 1.00 0.00 H new ATOM 0 HA ILE A 59 -7.769 2.995 22.395 1.00 0.00 H new ATOM 0 HB ILE A 59 -6.091 3.560 19.983 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -8.798 4.809 20.601 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -7.283 5.580 21.030 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -8.125 2.771 18.692 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -7.424 1.485 19.704 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -8.896 2.332 20.235 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -8.164 6.491 18.920 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -6.624 5.647 18.633 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -8.162 4.864 18.198 1.00 0.00 H new ATOM 920 N GLN A 60 -6.644 0.744 22.749 1.00 0.00 N ATOM 921 CA GLN A 60 -6.044 -0.595 22.968 1.00 0.00 C ATOM 922 C GLN A 60 -6.725 -1.643 22.049 1.00 0.00 C ATOM 923 O GLN A 60 -7.933 -1.887 22.134 1.00 0.00 O ATOM 924 CB GLN A 60 -6.127 -0.952 24.478 1.00 0.00 C ATOM 925 CG GLN A 60 -5.168 -2.078 24.929 1.00 0.00 C ATOM 926 CD GLN A 60 -5.578 -3.527 24.610 1.00 0.00 C ATOM 927 OE1 GLN A 60 -6.743 -3.863 24.399 1.00 0.00 O ATOM 928 NE2 GLN A 60 -4.605 -4.422 24.573 1.00 0.00 N ATOM 0 H GLN A 60 -7.559 0.862 23.184 1.00 0.00 H new ATOM 0 HA GLN A 60 -4.989 -0.592 22.695 1.00 0.00 H new ATOM 0 HB2 GLN A 60 -5.914 -0.056 25.061 1.00 0.00 H new ATOM 0 HB3 GLN A 60 -7.149 -1.249 24.712 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -4.195 -1.895 24.473 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -5.035 -1.995 26.008 1.00 0.00 H new ATOM 0 HE21 GLN A 60 -3.642 -4.136 24.749 1.00 0.00 H new ATOM 0 HE22 GLN A 60 -4.818 -5.398 24.368 1.00 0.00 H new ATOM 937 N ASN A 61 -5.898 -2.270 21.200 1.00 0.00 N ATOM 938 CA ASN A 61 -6.334 -3.288 20.206 1.00 0.00 C ATOM 939 C ASN A 61 -5.798 -4.689 20.624 1.00 0.00 C ATOM 940 O ASN A 61 -4.727 -4.810 21.229 1.00 0.00 O ATOM 941 CB ASN A 61 -5.797 -2.904 18.802 1.00 0.00 C ATOM 942 CG ASN A 61 -6.269 -1.547 18.242 1.00 0.00 C ATOM 943 OD1 ASN A 61 -5.671 -0.504 18.506 1.00 0.00 O ATOM 944 ND2 ASN A 61 -7.346 -1.524 17.482 1.00 0.00 N ATOM 0 H ASN A 61 -4.894 -2.090 21.176 1.00 0.00 H new ATOM 0 HA ASN A 61 -7.423 -3.323 20.171 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -4.708 -2.899 18.841 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -6.087 -3.685 18.099 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -7.688 -0.638 17.109 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -7.837 -2.392 17.267 1.00 0.00 H new ATOM 951 N GLU A 62 -6.556 -5.751 20.299 1.00 0.00 N ATOM 952 CA GLU A 62 -6.243 -7.138 20.752 1.00 0.00 C ATOM 953 C GLU A 62 -6.820 -8.165 19.739 1.00 0.00 C ATOM 954 O GLU A 62 -8.037 -8.232 19.533 1.00 0.00 O ATOM 955 CB GLU A 62 -6.667 -7.393 22.230 1.00 0.00 C ATOM 956 CG GLU A 62 -8.145 -7.129 22.593 1.00 0.00 C ATOM 957 CD GLU A 62 -8.456 -7.307 24.081 1.00 0.00 C ATOM 958 OE1 GLU A 62 -8.234 -6.358 24.864 1.00 0.00 O ATOM 959 OE2 GLU A 62 -8.933 -8.395 24.473 1.00 0.00 O ATOM 0 H GLU A 62 -7.395 -5.685 19.723 1.00 0.00 H new ATOM 0 HA GLU A 62 -5.161 -7.271 20.761 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -6.439 -8.431 22.473 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -6.044 -6.771 22.873 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -8.407 -6.114 22.295 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -8.777 -7.803 22.016 1.00 0.00 H new ATOM 966 N PHE A 63 -5.932 -8.955 19.102 1.00 0.00 N ATOM 967 CA PHE A 63 -6.315 -9.937 18.045 1.00 0.00 C ATOM 968 C PHE A 63 -5.490 -11.262 18.126 1.00 0.00 C ATOM 969 O PHE A 63 -4.571 -11.414 18.936 1.00 0.00 O ATOM 970 CB PHE A 63 -6.309 -9.251 16.639 1.00 0.00 C ATOM 971 CG PHE A 63 -4.941 -8.915 16.005 1.00 0.00 C ATOM 972 CD1 PHE A 63 -4.309 -7.691 16.259 1.00 0.00 C ATOM 973 CD2 PHE A 63 -4.332 -9.831 15.139 1.00 0.00 C ATOM 974 CE1 PHE A 63 -3.102 -7.384 15.632 1.00 0.00 C ATOM 975 CE2 PHE A 63 -3.122 -9.522 14.526 1.00 0.00 C ATOM 976 CZ PHE A 63 -2.519 -8.293 14.760 1.00 0.00 C ATOM 0 H PHE A 63 -4.931 -8.937 19.298 1.00 0.00 H new ATOM 0 HA PHE A 63 -7.340 -10.260 18.226 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -6.848 -9.900 15.948 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -6.878 -8.325 16.716 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -4.757 -6.984 16.941 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -4.804 -10.783 14.946 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -2.620 -6.437 15.825 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -2.652 -10.238 13.868 1.00 0.00 H new ATOM 0 HZ PHE A 63 -1.594 -8.044 14.262 1.00 0.00 H new ATOM 986 N THR A 64 -5.834 -12.230 17.256 1.00 0.00 N ATOM 987 CA THR A 64 -5.014 -13.451 17.015 1.00 0.00 C ATOM 988 C THR A 64 -5.040 -13.718 15.476 1.00 0.00 C ATOM 989 O THR A 64 -6.105 -13.697 14.847 1.00 0.00 O ATOM 990 CB THR A 64 -5.537 -14.648 17.868 1.00 0.00 C ATOM 991 OG1 THR A 64 -5.472 -14.322 19.254 1.00 0.00 O ATOM 992 CG2 THR A 64 -4.755 -15.961 17.686 1.00 0.00 C ATOM 0 H THR A 64 -6.686 -12.196 16.696 1.00 0.00 H new ATOM 0 HA THR A 64 -3.980 -13.315 17.332 1.00 0.00 H new ATOM 0 HB THR A 64 -6.555 -14.812 17.516 1.00 0.00 H new ATOM 0 HG1 THR A 64 -5.803 -15.077 19.784 1.00 0.00 H new ATOM 0 HG21 THR A 64 -5.191 -16.735 18.318 1.00 0.00 H new ATOM 0 HG22 THR A 64 -4.806 -16.273 16.643 1.00 0.00 H new ATOM 0 HG23 THR A 64 -3.714 -15.806 17.968 1.00 0.00 H new ATOM 1000 N VAL A 65 -3.859 -13.995 14.881 1.00 0.00 N ATOM 1001 CA VAL A 65 -3.717 -14.225 13.409 1.00 0.00 C ATOM 1002 C VAL A 65 -4.428 -15.531 12.937 1.00 0.00 C ATOM 1003 O VAL A 65 -4.284 -16.591 13.559 1.00 0.00 O ATOM 1004 CB VAL A 65 -2.233 -14.167 12.901 1.00 0.00 C ATOM 1005 CG1 VAL A 65 -1.656 -12.739 12.929 1.00 0.00 C ATOM 1006 CG2 VAL A 65 -1.248 -15.136 13.583 1.00 0.00 C ATOM 0 H VAL A 65 -2.980 -14.067 15.393 1.00 0.00 H new ATOM 0 HA VAL A 65 -4.231 -13.384 12.944 1.00 0.00 H new ATOM 0 HB VAL A 65 -2.323 -14.510 11.870 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.628 -12.755 12.568 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -2.255 -12.092 12.289 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -1.676 -12.358 13.950 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.255 -15.008 13.153 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -1.211 -14.924 14.652 1.00 0.00 H new ATOM 0 HG23 VAL A 65 -1.581 -16.162 13.428 1.00 0.00 H new ATOM 1016 N GLY A 66 -5.224 -15.414 11.858 1.00 0.00 N ATOM 1017 CA GLY A 66 -6.128 -16.507 11.412 1.00 0.00 C ATOM 1018 C GLY A 66 -7.576 -16.524 11.973 1.00 0.00 C ATOM 1019 O GLY A 66 -8.485 -16.972 11.268 1.00 0.00 O ATOM 0 H GLY A 66 -5.264 -14.578 11.275 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -6.191 -16.467 10.325 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -5.658 -17.456 11.669 1.00 0.00 H new ATOM 1023 N GLU A 67 -7.785 -16.061 13.218 1.00 0.00 N ATOM 1024 CA GLU A 67 -9.117 -16.010 13.879 1.00 0.00 C ATOM 1025 C GLU A 67 -9.711 -14.578 13.768 1.00 0.00 C ATOM 1026 O GLU A 67 -8.993 -13.576 13.880 1.00 0.00 O ATOM 1027 CB GLU A 67 -8.977 -16.402 15.381 1.00 0.00 C ATOM 1028 CG GLU A 67 -8.452 -17.819 15.710 1.00 0.00 C ATOM 1029 CD GLU A 67 -9.354 -18.964 15.237 1.00 0.00 C ATOM 1030 OE1 GLU A 67 -10.277 -19.358 15.983 1.00 0.00 O ATOM 1031 OE2 GLU A 67 -9.141 -19.474 14.114 1.00 0.00 O ATOM 0 H GLU A 67 -7.031 -15.706 13.806 1.00 0.00 H new ATOM 0 HA GLU A 67 -9.785 -16.714 13.383 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -8.312 -15.680 15.855 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -9.955 -16.290 15.849 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -7.467 -17.940 15.258 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -8.320 -17.901 16.789 1.00 0.00 H new ATOM 1038 N GLU A 68 -11.048 -14.495 13.604 1.00 0.00 N ATOM 1039 CA GLU A 68 -11.778 -13.196 13.596 1.00 0.00 C ATOM 1040 C GLU A 68 -11.952 -12.663 15.048 1.00 0.00 C ATOM 1041 O GLU A 68 -12.665 -13.258 15.863 1.00 0.00 O ATOM 1042 CB GLU A 68 -13.100 -13.254 12.781 1.00 0.00 C ATOM 1043 CG GLU A 68 -14.245 -14.163 13.283 1.00 0.00 C ATOM 1044 CD GLU A 68 -15.442 -14.164 12.327 1.00 0.00 C ATOM 1045 OE1 GLU A 68 -16.217 -13.182 12.324 1.00 0.00 O ATOM 1046 OE2 GLU A 68 -15.609 -15.145 11.568 1.00 0.00 O ATOM 0 H GLU A 68 -11.650 -15.308 13.475 1.00 0.00 H new ATOM 0 HA GLU A 68 -11.169 -12.466 13.063 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -13.490 -12.239 12.713 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -12.850 -13.568 11.768 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -13.874 -15.181 13.400 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -14.569 -13.827 14.268 1.00 0.00 H new ATOM 1053 N CYS A 69 -11.224 -11.579 15.364 1.00 0.00 N ATOM 1054 CA CYS A 69 -11.043 -11.093 16.757 1.00 0.00 C ATOM 1055 C CYS A 69 -11.176 -9.548 16.809 1.00 0.00 C ATOM 1056 O CYS A 69 -10.742 -8.834 15.895 1.00 0.00 O ATOM 1057 CB CYS A 69 -9.664 -11.553 17.273 1.00 0.00 C ATOM 1058 SG CYS A 69 -9.538 -13.375 17.292 1.00 0.00 S ATOM 0 H CYS A 69 -10.742 -11.010 14.668 1.00 0.00 H new ATOM 0 HA CYS A 69 -11.818 -11.511 17.399 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -8.879 -11.138 16.640 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -9.501 -11.164 18.278 1.00 0.00 H new ATOM 0 HG CYS A 69 -8.457 -13.729 17.922 1.00 0.00 H new ATOM 1064 N GLU A 70 -11.806 -9.040 17.889 1.00 0.00 N ATOM 1065 CA GLU A 70 -12.303 -7.638 17.948 1.00 0.00 C ATOM 1066 C GLU A 70 -11.175 -6.570 17.983 1.00 0.00 C ATOM 1067 O GLU A 70 -10.277 -6.628 18.829 1.00 0.00 O ATOM 1068 CB GLU A 70 -13.383 -7.459 19.054 1.00 0.00 C ATOM 1069 CG GLU A 70 -13.000 -7.616 20.548 1.00 0.00 C ATOM 1070 CD GLU A 70 -12.231 -6.452 21.191 1.00 0.00 C ATOM 1071 OE1 GLU A 70 -12.621 -5.276 21.015 1.00 0.00 O ATOM 1072 OE2 GLU A 70 -11.226 -6.715 21.885 1.00 0.00 O ATOM 0 H GLU A 70 -11.986 -9.577 18.737 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.804 -7.447 16.999 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -13.809 -6.463 18.932 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -14.179 -8.174 18.847 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -13.915 -7.775 21.119 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -12.399 -8.519 20.652 1.00 0.00 H new ATOM 1079 N LEU A 71 -11.237 -5.609 17.044 1.00 0.00 N ATOM 1080 CA LEU A 71 -10.274 -4.482 16.977 1.00 0.00 C ATOM 1081 C LEU A 71 -11.040 -3.198 17.366 1.00 0.00 C ATOM 1082 O LEU A 71 -11.997 -2.801 16.693 1.00 0.00 O ATOM 1083 CB LEU A 71 -9.650 -4.359 15.558 1.00 0.00 C ATOM 1084 CG LEU A 71 -8.664 -5.484 15.134 1.00 0.00 C ATOM 1085 CD1 LEU A 71 -8.314 -5.357 13.643 1.00 0.00 C ATOM 1086 CD2 LEU A 71 -7.365 -5.497 15.963 1.00 0.00 C ATOM 0 H LEU A 71 -11.948 -5.586 16.313 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.444 -4.650 17.664 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -10.461 -4.324 14.831 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -9.126 -3.405 15.497 1.00 0.00 H new ATOM 0 HG LEU A 71 -9.179 -6.426 15.322 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -7.623 -6.152 13.362 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -9.223 -5.440 13.048 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.847 -4.389 13.460 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.721 -6.305 15.617 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.848 -4.545 15.844 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.606 -5.650 17.015 1.00 0.00 H new ATOM 1098 N GLU A 72 -10.591 -2.538 18.447 1.00 0.00 N ATOM 1099 CA GLU A 72 -11.182 -1.263 18.926 1.00 0.00 C ATOM 1100 C GLU A 72 -10.757 -0.102 17.982 1.00 0.00 C ATOM 1101 O GLU A 72 -9.653 0.436 18.095 1.00 0.00 O ATOM 1102 CB GLU A 72 -10.711 -1.064 20.391 1.00 0.00 C ATOM 1103 CG GLU A 72 -11.334 0.138 21.132 1.00 0.00 C ATOM 1104 CD GLU A 72 -10.767 0.298 22.547 1.00 0.00 C ATOM 1105 OE1 GLU A 72 -11.168 -0.466 23.451 1.00 0.00 O ATOM 1106 OE2 GLU A 72 -9.910 1.185 22.758 1.00 0.00 O ATOM 0 H GLU A 72 -9.811 -2.867 19.016 1.00 0.00 H new ATOM 0 HA GLU A 72 -12.272 -1.281 18.910 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -10.935 -1.971 20.953 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -9.627 -0.948 20.393 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -11.150 1.049 20.563 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -12.415 0.009 21.187 1.00 0.00 H new ATOM 1113 N THR A 73 -11.646 0.259 17.040 1.00 0.00 N ATOM 1114 CA THR A 73 -11.355 1.298 16.012 1.00 0.00 C ATOM 1115 C THR A 73 -11.405 2.733 16.617 1.00 0.00 C ATOM 1116 O THR A 73 -12.019 2.981 17.661 1.00 0.00 O ATOM 1117 CB THR A 73 -12.289 1.152 14.768 1.00 0.00 C ATOM 1118 OG1 THR A 73 -13.652 1.380 15.118 1.00 0.00 O ATOM 1119 CG2 THR A 73 -12.187 -0.197 14.034 1.00 0.00 C ATOM 0 H THR A 73 -12.577 -0.150 16.962 1.00 0.00 H new ATOM 0 HA THR A 73 -10.335 1.137 15.663 1.00 0.00 H new ATOM 0 HB THR A 73 -11.931 1.915 14.076 1.00 0.00 H new ATOM 0 HG1 THR A 73 -13.981 0.631 15.658 1.00 0.00 H new ATOM 0 HG21 THR A 73 -12.872 -0.203 13.186 1.00 0.00 H new ATOM 0 HG22 THR A 73 -11.167 -0.341 13.677 1.00 0.00 H new ATOM 0 HG23 THR A 73 -12.449 -1.004 14.718 1.00 0.00 H new ATOM 1127 N MET A 74 -10.758 3.678 15.910 1.00 0.00 N ATOM 1128 CA MET A 74 -10.744 5.127 16.263 1.00 0.00 C ATOM 1129 C MET A 74 -12.141 5.761 16.559 1.00 0.00 C ATOM 1130 O MET A 74 -12.303 6.353 17.631 1.00 0.00 O ATOM 1131 CB MET A 74 -9.973 5.903 15.158 1.00 0.00 C ATOM 1132 CG MET A 74 -8.435 5.846 15.211 1.00 0.00 C ATOM 1133 SD MET A 74 -7.815 4.148 15.171 1.00 0.00 S ATOM 1134 CE MET A 74 -6.042 4.420 15.354 1.00 0.00 C ATOM 0 H MET A 74 -10.223 3.465 15.068 1.00 0.00 H new ATOM 0 HA MET A 74 -10.229 5.211 17.220 1.00 0.00 H new ATOM 0 HB2 MET A 74 -10.293 5.521 14.189 1.00 0.00 H new ATOM 0 HB3 MET A 74 -10.276 6.949 15.204 1.00 0.00 H new ATOM 0 HG2 MET A 74 -8.023 6.402 14.369 1.00 0.00 H new ATOM 0 HG3 MET A 74 -8.086 6.338 16.119 1.00 0.00 H new ATOM 0 HE1 MET A 74 -5.524 3.461 15.347 1.00 0.00 H new ATOM 0 HE2 MET A 74 -5.681 5.033 14.528 1.00 0.00 H new ATOM 0 HE3 MET A 74 -5.848 4.931 16.297 1.00 0.00 H new ATOM 1144 N THR A 75 -13.135 5.588 15.663 1.00 0.00 N ATOM 1145 CA THR A 75 -14.555 5.930 15.947 1.00 0.00 C ATOM 1146 C THR A 75 -15.442 4.673 15.696 1.00 0.00 C ATOM 1147 O THR A 75 -15.425 4.088 14.606 1.00 0.00 O ATOM 1148 CB THR A 75 -14.997 7.204 15.164 1.00 0.00 C ATOM 1149 OG1 THR A 75 -16.281 7.616 15.617 1.00 0.00 O ATOM 1150 CG2 THR A 75 -15.039 7.102 13.629 1.00 0.00 C ATOM 0 H THR A 75 -12.984 5.211 14.728 1.00 0.00 H new ATOM 0 HA THR A 75 -14.680 6.199 16.996 1.00 0.00 H new ATOM 0 HB THR A 75 -14.210 7.927 15.379 1.00 0.00 H new ATOM 0 HG1 THR A 75 -16.380 8.582 15.486 1.00 0.00 H new ATOM 0 HG21 THR A 75 -15.362 8.055 13.210 1.00 0.00 H new ATOM 0 HG22 THR A 75 -14.045 6.858 13.253 1.00 0.00 H new ATOM 0 HG23 THR A 75 -15.740 6.321 13.335 1.00 0.00 H new ATOM 1158 N GLY A 76 -16.244 4.298 16.708 1.00 0.00 N ATOM 1159 CA GLY A 76 -17.372 3.360 16.522 1.00 0.00 C ATOM 1160 C GLY A 76 -17.151 1.952 17.101 1.00 0.00 C ATOM 1161 O GLY A 76 -17.504 1.694 18.254 1.00 0.00 O ATOM 0 H GLY A 76 -16.134 4.630 17.666 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -18.262 3.790 16.982 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -17.577 3.269 15.455 1.00 0.00 H new ATOM 1165 N GLU A 77 -16.664 1.030 16.254 1.00 0.00 N ATOM 1166 CA GLU A 77 -16.926 -0.424 16.420 1.00 0.00 C ATOM 1167 C GLU A 77 -15.722 -1.193 17.040 1.00 0.00 C ATOM 1168 O GLU A 77 -14.552 -0.928 16.748 1.00 0.00 O ATOM 1169 CB GLU A 77 -17.346 -0.990 15.034 1.00 0.00 C ATOM 1170 CG GLU A 77 -18.000 -2.392 15.036 1.00 0.00 C ATOM 1171 CD GLU A 77 -19.345 -2.492 15.763 1.00 0.00 C ATOM 1172 OE1 GLU A 77 -20.378 -2.086 15.185 1.00 0.00 O ATOM 1173 OE2 GLU A 77 -19.373 -2.978 16.916 1.00 0.00 O ATOM 0 H GLU A 77 -16.086 1.258 15.445 1.00 0.00 H new ATOM 0 HA GLU A 77 -17.733 -0.567 17.139 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -18.042 -0.288 14.575 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -16.462 -1.026 14.397 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -18.141 -2.709 14.003 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -17.306 -3.097 15.494 1.00 0.00 H new ATOM 1180 N LYS A 78 -16.068 -2.207 17.852 1.00 0.00 N ATOM 1181 CA LYS A 78 -15.120 -3.252 18.324 1.00 0.00 C ATOM 1182 C LYS A 78 -15.365 -4.478 17.402 1.00 0.00 C ATOM 1183 O LYS A 78 -16.331 -5.230 17.574 1.00 0.00 O ATOM 1184 CB LYS A 78 -15.366 -3.555 19.826 1.00 0.00 C ATOM 1185 CG LYS A 78 -14.909 -2.429 20.781 1.00 0.00 C ATOM 1186 CD LYS A 78 -15.152 -2.745 22.269 1.00 0.00 C ATOM 1187 CE LYS A 78 -14.793 -1.551 23.172 1.00 0.00 C ATOM 1188 NZ LYS A 78 -15.087 -1.825 24.590 1.00 0.00 N ATOM 0 H LYS A 78 -17.016 -2.332 18.206 1.00 0.00 H new ATOM 0 HA LYS A 78 -14.077 -2.943 18.262 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -16.430 -3.737 19.979 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -14.844 -4.475 20.090 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -13.846 -2.242 20.627 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -15.435 -1.510 20.523 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -16.198 -3.012 22.418 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -14.558 -3.612 22.559 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -13.734 -1.317 23.060 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -15.350 -0.672 22.849 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -14.831 -0.996 25.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -16.102 -2.024 24.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -14.536 -2.649 24.906 1.00 0.00 H new ATOM 1202 N VAL A 79 -14.536 -4.588 16.351 1.00 0.00 N ATOM 1203 CA VAL A 79 -14.959 -5.185 15.057 1.00 0.00 C ATOM 1204 C VAL A 79 -14.221 -6.534 14.819 1.00 0.00 C ATOM 1205 O VAL A 79 -12.998 -6.556 14.647 1.00 0.00 O ATOM 1206 CB VAL A 79 -14.790 -4.098 13.935 1.00 0.00 C ATOM 1207 CG1 VAL A 79 -13.347 -3.719 13.537 1.00 0.00 C ATOM 1208 CG2 VAL A 79 -15.604 -4.440 12.679 1.00 0.00 C ATOM 0 H VAL A 79 -13.566 -4.273 16.364 1.00 0.00 H new ATOM 0 HA VAL A 79 -16.014 -5.461 15.053 1.00 0.00 H new ATOM 0 HB VAL A 79 -15.186 -3.205 14.418 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.373 -2.960 12.755 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -12.821 -3.326 14.407 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -12.827 -4.603 13.168 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -15.459 -3.663 11.929 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -15.271 -5.398 12.279 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -16.661 -4.503 12.937 1.00 0.00 H new ATOM 1218 N LYS A 80 -14.973 -7.657 14.816 1.00 0.00 N ATOM 1219 CA LYS A 80 -14.386 -9.022 14.700 1.00 0.00 C ATOM 1220 C LYS A 80 -13.971 -9.336 13.233 1.00 0.00 C ATOM 1221 O LYS A 80 -14.814 -9.565 12.359 1.00 0.00 O ATOM 1222 CB LYS A 80 -15.279 -10.093 15.382 1.00 0.00 C ATOM 1223 CG LYS A 80 -16.669 -10.395 14.769 1.00 0.00 C ATOM 1224 CD LYS A 80 -17.589 -11.265 15.652 1.00 0.00 C ATOM 1225 CE LYS A 80 -17.095 -12.707 15.889 1.00 0.00 C ATOM 1226 NZ LYS A 80 -18.049 -13.477 16.706 1.00 0.00 N ATOM 0 H LYS A 80 -15.990 -7.651 14.892 1.00 0.00 H new ATOM 0 HA LYS A 80 -13.454 -9.054 15.264 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -14.717 -11.027 15.406 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -15.432 -9.787 16.417 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -17.173 -9.451 14.563 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -16.527 -10.896 13.811 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -17.709 -10.775 16.618 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -18.576 -11.307 15.191 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -16.950 -13.205 14.930 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -16.125 -12.683 16.386 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -17.686 -14.442 16.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -18.168 -13.014 17.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -18.967 -13.520 16.220 1.00 0.00 H new ATOM 1240 N THR A 81 -12.653 -9.251 12.981 1.00 0.00 N ATOM 1241 CA THR A 81 -12.074 -9.192 11.608 1.00 0.00 C ATOM 1242 C THR A 81 -10.756 -10.011 11.613 1.00 0.00 C ATOM 1243 O THR A 81 -9.894 -9.820 12.481 1.00 0.00 O ATOM 1244 CB THR A 81 -11.818 -7.724 11.131 1.00 0.00 C ATOM 1245 OG1 THR A 81 -10.972 -7.023 12.039 1.00 0.00 O ATOM 1246 CG2 THR A 81 -13.096 -6.899 10.937 1.00 0.00 C ATOM 0 H THR A 81 -11.949 -9.221 13.719 1.00 0.00 H new ATOM 0 HA THR A 81 -12.787 -9.616 10.901 1.00 0.00 H new ATOM 0 HB THR A 81 -11.337 -7.833 10.159 1.00 0.00 H new ATOM 0 HG1 THR A 81 -10.751 -6.143 11.668 1.00 0.00 H new ATOM 0 HG21 THR A 81 -12.834 -5.894 10.606 1.00 0.00 H new ATOM 0 HG22 THR A 81 -13.726 -7.375 10.186 1.00 0.00 H new ATOM 0 HG23 THR A 81 -13.638 -6.840 11.881 1.00 0.00 H new ATOM 1254 N VAL A 82 -10.593 -10.907 10.618 1.00 0.00 N ATOM 1255 CA VAL A 82 -9.384 -11.774 10.499 1.00 0.00 C ATOM 1256 C VAL A 82 -8.173 -10.901 10.049 1.00 0.00 C ATOM 1257 O VAL A 82 -8.236 -10.220 9.018 1.00 0.00 O ATOM 1258 CB VAL A 82 -9.583 -12.994 9.528 1.00 0.00 C ATOM 1259 CG1 VAL A 82 -8.357 -13.940 9.542 1.00 0.00 C ATOM 1260 CG2 VAL A 82 -10.827 -13.864 9.817 1.00 0.00 C ATOM 0 H VAL A 82 -11.281 -11.055 9.880 1.00 0.00 H new ATOM 0 HA VAL A 82 -9.194 -12.207 11.481 1.00 0.00 H new ATOM 0 HB VAL A 82 -9.718 -12.519 8.556 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.531 -14.771 8.859 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -7.470 -13.391 9.226 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -8.206 -14.325 10.551 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -10.877 -14.679 9.095 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -10.757 -14.276 10.824 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -11.726 -13.252 9.737 1.00 0.00 H new ATOM 1270 N VAL A 83 -7.072 -10.978 10.818 1.00 0.00 N ATOM 1271 CA VAL A 83 -5.790 -10.328 10.441 1.00 0.00 C ATOM 1272 C VAL A 83 -4.874 -11.480 9.948 1.00 0.00 C ATOM 1273 O VAL A 83 -4.244 -12.172 10.753 1.00 0.00 O ATOM 1274 CB VAL A 83 -5.173 -9.483 11.605 1.00 0.00 C ATOM 1275 CG1 VAL A 83 -3.905 -8.721 11.149 1.00 0.00 C ATOM 1276 CG2 VAL A 83 -6.143 -8.480 12.275 1.00 0.00 C ATOM 0 H VAL A 83 -7.038 -11.482 11.704 1.00 0.00 H new ATOM 0 HA VAL A 83 -5.931 -9.587 9.654 1.00 0.00 H new ATOM 0 HB VAL A 83 -4.922 -10.230 12.358 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -3.506 -8.146 11.985 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -3.155 -9.434 10.808 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.160 -8.045 10.333 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -5.622 -7.944 13.068 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -6.502 -7.769 11.531 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -6.990 -9.020 12.698 1.00 0.00 H new ATOM 1286 N GLN A 84 -4.827 -11.689 8.621 1.00 0.00 N ATOM 1287 CA GLN A 84 -4.083 -12.816 8.019 1.00 0.00 C ATOM 1288 C GLN A 84 -2.655 -12.332 7.655 1.00 0.00 C ATOM 1289 O GLN A 84 -2.479 -11.447 6.808 1.00 0.00 O ATOM 1290 CB GLN A 84 -4.905 -13.339 6.807 1.00 0.00 C ATOM 1291 CG GLN A 84 -4.433 -14.694 6.240 1.00 0.00 C ATOM 1292 CD GLN A 84 -4.781 -15.907 7.126 1.00 0.00 C ATOM 1293 OE1 GLN A 84 -5.887 -16.444 7.063 1.00 0.00 O ATOM 1294 NE2 GLN A 84 -3.863 -16.355 7.971 1.00 0.00 N ATOM 0 H GLN A 84 -5.296 -11.092 7.940 1.00 0.00 H new ATOM 0 HA GLN A 84 -3.957 -13.652 8.707 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -5.949 -13.431 7.107 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -4.866 -12.595 6.011 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -4.878 -14.838 5.256 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -3.353 -14.659 6.099 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -2.949 -15.904 8.017 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -4.071 -17.150 8.575 1.00 0.00 H new ATOM 1303 N LEU A 85 -1.643 -12.934 8.311 1.00 0.00 N ATOM 1304 CA LEU A 85 -0.218 -12.572 8.105 1.00 0.00 C ATOM 1305 C LEU A 85 0.293 -13.121 6.742 1.00 0.00 C ATOM 1306 O LEU A 85 0.303 -14.332 6.492 1.00 0.00 O ATOM 1307 CB LEU A 85 0.616 -13.048 9.328 1.00 0.00 C ATOM 1308 CG LEU A 85 2.156 -12.808 9.311 1.00 0.00 C ATOM 1309 CD1 LEU A 85 2.592 -11.398 8.874 1.00 0.00 C ATOM 1310 CD2 LEU A 85 2.773 -13.131 10.683 1.00 0.00 C ATOM 0 H LEU A 85 -1.783 -13.679 8.994 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.104 -11.490 8.046 1.00 0.00 H new ATOM 0 HB2 LEU A 85 0.213 -12.560 10.215 1.00 0.00 H new ATOM 0 HB3 LEU A 85 0.448 -14.118 9.449 1.00 0.00 H new ATOM 0 HG LEU A 85 2.531 -13.489 8.547 1.00 0.00 H new ATOM 0 HD11 LEU A 85 3.680 -11.331 8.895 1.00 0.00 H new ATOM 0 HD12 LEU A 85 2.236 -11.204 7.862 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.170 -10.659 9.555 1.00 0.00 H new ATOM 0 HD21 LEU A 85 3.848 -12.957 10.648 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.326 -12.490 11.443 1.00 0.00 H new ATOM 0 HD23 LEU A 85 2.583 -14.175 10.931 1.00 0.00 H new ATOM 1322 N GLU A 86 0.696 -12.176 5.883 1.00 0.00 N ATOM 1323 CA GLU A 86 1.154 -12.447 4.502 1.00 0.00 C ATOM 1324 C GLU A 86 2.702 -12.388 4.440 1.00 0.00 C ATOM 1325 O GLU A 86 3.346 -11.469 4.962 1.00 0.00 O ATOM 1326 CB GLU A 86 0.500 -11.414 3.552 1.00 0.00 C ATOM 1327 CG GLU A 86 0.663 -11.693 2.042 1.00 0.00 C ATOM 1328 CD GLU A 86 0.009 -10.605 1.184 1.00 0.00 C ATOM 1329 OE1 GLU A 86 -1.209 -10.699 0.911 1.00 0.00 O ATOM 1330 OE2 GLU A 86 0.709 -9.648 0.784 1.00 0.00 O ATOM 0 H GLU A 86 0.716 -11.185 6.125 1.00 0.00 H new ATOM 0 HA GLU A 86 0.854 -13.447 4.187 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -0.565 -11.362 3.780 1.00 0.00 H new ATOM 0 HB3 GLU A 86 0.921 -10.432 3.768 1.00 0.00 H new ATOM 0 HG2 GLU A 86 1.723 -11.759 1.798 1.00 0.00 H new ATOM 0 HG3 GLU A 86 0.220 -12.659 1.802 1.00 0.00 H new ATOM 1337 N GLY A 87 3.259 -13.400 3.764 1.00 0.00 N ATOM 1338 CA GLY A 87 4.718 -13.528 3.545 1.00 0.00 C ATOM 1339 C GLY A 87 5.492 -13.941 4.814 1.00 0.00 C ATOM 1340 O GLY A 87 5.504 -15.115 5.191 1.00 0.00 O ATOM 0 H GLY A 87 2.716 -14.158 3.350 1.00 0.00 H new ATOM 0 HA2 GLY A 87 4.898 -14.265 2.762 1.00 0.00 H new ATOM 0 HA3 GLY A 87 5.109 -12.577 3.183 1.00 0.00 H new ATOM 1344 N ASP A 88 6.113 -12.939 5.456 1.00 0.00 N ATOM 1345 CA ASP A 88 6.806 -13.092 6.767 1.00 0.00 C ATOM 1346 C ASP A 88 6.447 -11.970 7.790 1.00 0.00 C ATOM 1347 O ASP A 88 6.309 -12.260 8.983 1.00 0.00 O ATOM 1348 CB ASP A 88 8.338 -13.224 6.529 1.00 0.00 C ATOM 1349 CG ASP A 88 9.154 -13.654 7.758 1.00 0.00 C ATOM 1350 OD1 ASP A 88 9.249 -14.872 8.024 1.00 0.00 O ATOM 1351 OD2 ASP A 88 9.698 -12.774 8.461 1.00 0.00 O ATOM 0 H ASP A 88 6.155 -11.989 5.086 1.00 0.00 H new ATOM 0 HA ASP A 88 6.446 -14.008 7.235 1.00 0.00 H new ATOM 0 HB2 ASP A 88 8.505 -13.947 5.730 1.00 0.00 H new ATOM 0 HB3 ASP A 88 8.719 -12.266 6.176 1.00 0.00 H new ATOM 1356 N ASN A 89 6.366 -10.706 7.338 1.00 0.00 N ATOM 1357 CA ASN A 89 6.204 -9.516 8.211 1.00 0.00 C ATOM 1358 C ASN A 89 5.296 -8.422 7.563 1.00 0.00 C ATOM 1359 O ASN A 89 5.696 -7.263 7.417 1.00 0.00 O ATOM 1360 CB ASN A 89 7.611 -9.033 8.671 1.00 0.00 C ATOM 1361 CG ASN A 89 8.600 -8.456 7.626 1.00 0.00 C ATOM 1362 OD1 ASN A 89 8.353 -8.421 6.420 1.00 0.00 O ATOM 1363 ND2 ASN A 89 9.750 -7.988 8.082 1.00 0.00 N ATOM 0 H ASN A 89 6.411 -10.473 6.346 1.00 0.00 H new ATOM 0 HA ASN A 89 5.653 -9.782 9.113 1.00 0.00 H new ATOM 0 HB2 ASN A 89 7.461 -8.270 9.434 1.00 0.00 H new ATOM 0 HB3 ASN A 89 8.103 -9.876 9.156 1.00 0.00 H new ATOM 0 HD21 ASN A 89 10.434 -7.597 7.434 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.953 -8.018 9.081 1.00 0.00 H new ATOM 1370 N LYS A 90 4.051 -8.796 7.208 1.00 0.00 N ATOM 1371 CA LYS A 90 3.053 -7.871 6.607 1.00 0.00 C ATOM 1372 C LYS A 90 1.635 -8.319 7.054 1.00 0.00 C ATOM 1373 O LYS A 90 1.097 -9.304 6.541 1.00 0.00 O ATOM 1374 CB LYS A 90 3.213 -7.846 5.062 1.00 0.00 C ATOM 1375 CG LYS A 90 2.455 -6.693 4.368 1.00 0.00 C ATOM 1376 CD LYS A 90 2.163 -6.985 2.884 1.00 0.00 C ATOM 1377 CE LYS A 90 1.392 -5.855 2.182 1.00 0.00 C ATOM 1378 NZ LYS A 90 1.117 -6.193 0.774 1.00 0.00 N ATOM 0 H LYS A 90 3.703 -9.747 7.327 1.00 0.00 H new ATOM 0 HA LYS A 90 3.212 -6.850 6.953 1.00 0.00 H new ATOM 0 HB2 LYS A 90 4.273 -7.768 4.818 1.00 0.00 H new ATOM 0 HB3 LYS A 90 2.861 -8.794 4.656 1.00 0.00 H new ATOM 0 HG2 LYS A 90 1.516 -6.514 4.891 1.00 0.00 H new ATOM 0 HG3 LYS A 90 3.042 -5.778 4.446 1.00 0.00 H new ATOM 0 HD2 LYS A 90 3.105 -7.152 2.362 1.00 0.00 H new ATOM 0 HD3 LYS A 90 1.589 -7.908 2.809 1.00 0.00 H new ATOM 0 HE2 LYS A 90 0.453 -5.672 2.705 1.00 0.00 H new ATOM 0 HE3 LYS A 90 1.969 -4.932 2.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 0.596 -5.413 0.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 2.015 -6.344 0.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 0.546 -7.061 0.731 1.00 0.00 H new ATOM 1392 N LEU A 91 1.022 -7.579 7.995 1.00 0.00 N ATOM 1393 CA LEU A 91 -0.310 -7.930 8.564 1.00 0.00 C ATOM 1394 C LEU A 91 -1.416 -7.233 7.729 1.00 0.00 C ATOM 1395 O LEU A 91 -1.527 -6.004 7.719 1.00 0.00 O ATOM 1396 CB LEU A 91 -0.392 -7.489 10.049 1.00 0.00 C ATOM 1397 CG LEU A 91 0.568 -8.200 11.041 1.00 0.00 C ATOM 1398 CD1 LEU A 91 0.815 -7.327 12.285 1.00 0.00 C ATOM 1399 CD2 LEU A 91 0.080 -9.607 11.437 1.00 0.00 C ATOM 0 H LEU A 91 1.424 -6.727 8.386 1.00 0.00 H new ATOM 0 HA LEU A 91 -0.453 -9.010 8.523 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -0.198 -6.417 10.097 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -1.414 -7.644 10.394 1.00 0.00 H new ATOM 0 HG LEU A 91 1.515 -8.337 10.520 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.490 -7.846 12.965 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.262 -6.380 11.982 1.00 0.00 H new ATOM 0 HD13 LEU A 91 -0.132 -7.136 12.789 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.790 -10.056 12.132 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.897 -9.532 11.914 1.00 0.00 H new ATOM 0 HD23 LEU A 91 0.001 -10.229 10.545 1.00 0.00 H new ATOM 1411 N VAL A 92 -2.211 -8.045 7.021 1.00 0.00 N ATOM 1412 CA VAL A 92 -3.189 -7.554 6.007 1.00 0.00 C ATOM 1413 C VAL A 92 -4.608 -7.785 6.603 1.00 0.00 C ATOM 1414 O VAL A 92 -5.031 -8.926 6.824 1.00 0.00 O ATOM 1415 CB VAL A 92 -2.959 -8.256 4.622 1.00 0.00 C ATOM 1416 CG1 VAL A 92 -3.967 -7.797 3.543 1.00 0.00 C ATOM 1417 CG2 VAL A 92 -1.534 -8.049 4.047 1.00 0.00 C ATOM 0 H VAL A 92 -2.205 -9.060 7.125 1.00 0.00 H new ATOM 0 HA VAL A 92 -3.063 -6.491 5.800 1.00 0.00 H new ATOM 0 HB VAL A 92 -3.104 -9.313 4.846 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.759 -8.316 2.607 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -4.981 -8.030 3.870 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -3.873 -6.722 3.391 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -1.450 -8.563 3.089 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -1.350 -6.984 3.905 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -0.799 -8.455 4.742 1.00 0.00 H new ATOM 1427 N THR A 93 -5.330 -6.675 6.836 1.00 0.00 N ATOM 1428 CA THR A 93 -6.723 -6.693 7.358 1.00 0.00 C ATOM 1429 C THR A 93 -7.533 -5.520 6.740 1.00 0.00 C ATOM 1430 O THR A 93 -7.012 -4.429 6.494 1.00 0.00 O ATOM 1431 CB THR A 93 -6.744 -6.713 8.917 1.00 0.00 C ATOM 1432 OG1 THR A 93 -8.062 -6.995 9.380 1.00 0.00 O ATOM 1433 CG2 THR A 93 -6.232 -5.457 9.644 1.00 0.00 C ATOM 0 H THR A 93 -4.971 -5.735 6.670 1.00 0.00 H new ATOM 0 HA THR A 93 -7.214 -7.616 7.051 1.00 0.00 H new ATOM 0 HB THR A 93 -6.027 -7.495 9.168 1.00 0.00 H new ATOM 0 HG1 THR A 93 -8.233 -7.958 9.315 1.00 0.00 H new ATOM 0 HG21 THR A 93 -6.302 -5.606 10.721 1.00 0.00 H new ATOM 0 HG22 THR A 93 -5.193 -5.276 9.370 1.00 0.00 H new ATOM 0 HG23 THR A 93 -6.838 -4.598 9.356 1.00 0.00 H new ATOM 1441 N THR A 94 -8.832 -5.768 6.519 1.00 0.00 N ATOM 1442 CA THR A 94 -9.779 -4.766 5.966 1.00 0.00 C ATOM 1443 C THR A 94 -11.159 -4.996 6.635 1.00 0.00 C ATOM 1444 O THR A 94 -11.686 -6.116 6.630 1.00 0.00 O ATOM 1445 CB THR A 94 -9.805 -4.763 4.410 1.00 0.00 C ATOM 1446 OG1 THR A 94 -10.702 -3.760 3.941 1.00 0.00 O ATOM 1447 CG2 THR A 94 -10.161 -6.101 3.739 1.00 0.00 C ATOM 0 H THR A 94 -9.265 -6.670 6.717 1.00 0.00 H new ATOM 0 HA THR A 94 -9.448 -3.756 6.207 1.00 0.00 H new ATOM 0 HB THR A 94 -8.774 -4.558 4.123 1.00 0.00 H new ATOM 0 HG1 THR A 94 -10.712 -3.763 2.961 1.00 0.00 H new ATOM 0 HG21 THR A 94 -10.148 -5.980 2.656 1.00 0.00 H new ATOM 0 HG22 THR A 94 -9.432 -6.858 4.028 1.00 0.00 H new ATOM 0 HG23 THR A 94 -11.155 -6.415 4.057 1.00 0.00 H new ATOM 1455 N PHE A 95 -11.733 -3.927 7.220 1.00 0.00 N ATOM 1456 CA PHE A 95 -12.931 -4.046 8.099 1.00 0.00 C ATOM 1457 C PHE A 95 -14.205 -3.822 7.232 1.00 0.00 C ATOM 1458 O PHE A 95 -14.763 -4.797 6.719 1.00 0.00 O ATOM 1459 CB PHE A 95 -12.855 -3.223 9.434 1.00 0.00 C ATOM 1460 CG PHE A 95 -11.494 -2.918 10.106 1.00 0.00 C ATOM 1461 CD1 PHE A 95 -10.520 -3.907 10.282 1.00 0.00 C ATOM 1462 CD2 PHE A 95 -11.222 -1.613 10.539 1.00 0.00 C ATOM 1463 CE1 PHE A 95 -9.286 -3.586 10.837 1.00 0.00 C ATOM 1464 CE2 PHE A 95 -9.991 -1.297 11.102 1.00 0.00 C ATOM 1465 CZ PHE A 95 -9.023 -2.284 11.254 1.00 0.00 C ATOM 0 H PHE A 95 -11.394 -2.972 7.106 1.00 0.00 H new ATOM 0 HA PHE A 95 -12.977 -5.059 8.500 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -13.340 -2.265 9.247 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -13.463 -3.750 10.169 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -10.728 -4.925 9.985 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -11.975 -0.846 10.434 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -8.529 -4.349 10.945 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -9.786 -0.286 11.421 1.00 0.00 H new ATOM 0 HZ PHE A 95 -8.068 -2.041 11.695 1.00 0.00 H new ATOM 1475 N LYS A 96 -14.617 -2.555 7.028 1.00 0.00 N ATOM 1476 CA LYS A 96 -15.718 -2.178 6.112 1.00 0.00 C ATOM 1477 C LYS A 96 -15.065 -1.525 4.857 1.00 0.00 C ATOM 1478 O LYS A 96 -14.837 -2.233 3.872 1.00 0.00 O ATOM 1479 CB LYS A 96 -16.737 -1.347 6.930 1.00 0.00 C ATOM 1480 CG LYS A 96 -18.061 -1.098 6.187 1.00 0.00 C ATOM 1481 CD LYS A 96 -19.057 -0.268 7.009 1.00 0.00 C ATOM 1482 CE LYS A 96 -19.756 -1.037 8.148 1.00 0.00 C ATOM 1483 NZ LYS A 96 -20.724 -0.186 8.861 1.00 0.00 N ATOM 0 H LYS A 96 -14.192 -1.755 7.498 1.00 0.00 H new ATOM 0 HA LYS A 96 -16.310 -3.001 5.711 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -16.947 -1.863 7.867 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -16.288 -0.388 7.188 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -17.854 -0.584 5.248 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -18.516 -2.056 5.933 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -18.531 0.586 7.436 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -19.818 0.129 6.338 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -20.268 -1.908 7.739 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -19.009 -1.407 8.850 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -21.176 -0.735 9.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -20.230 0.632 9.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -21.450 0.146 8.195 1.00 0.00 H new ATOM 1497 N ASN A 97 -14.712 -0.223 4.912 1.00 0.00 N ATOM 1498 CA ASN A 97 -13.788 0.420 3.943 1.00 0.00 C ATOM 1499 C ASN A 97 -12.576 1.049 4.708 1.00 0.00 C ATOM 1500 O ASN A 97 -12.354 2.261 4.640 1.00 0.00 O ATOM 1501 CB ASN A 97 -14.646 1.423 3.109 1.00 0.00 C ATOM 1502 CG ASN A 97 -13.938 2.139 1.947 1.00 0.00 C ATOM 1503 OD1 ASN A 97 -13.813 3.364 1.932 1.00 0.00 O ATOM 1504 ND2 ASN A 97 -13.470 1.402 0.954 1.00 0.00 N ATOM 0 H ASN A 97 -15.058 0.415 5.628 1.00 0.00 H new ATOM 0 HA ASN A 97 -13.332 -0.282 3.246 1.00 0.00 H new ATOM 0 HB2 ASN A 97 -15.502 0.883 2.705 1.00 0.00 H new ATOM 0 HB3 ASN A 97 -15.038 2.181 3.787 1.00 0.00 H new ATOM 0 HD21 ASN A 97 -13.000 1.847 0.166 1.00 0.00 H new ATOM 0 HD22 ASN A 97 -13.579 0.388 0.976 1.00 0.00 H new ATOM 1511 N ILE A 98 -11.785 0.223 5.432 1.00 0.00 N ATOM 1512 CA ILE A 98 -10.596 0.688 6.199 1.00 0.00 C ATOM 1513 C ILE A 98 -9.514 -0.404 5.944 1.00 0.00 C ATOM 1514 O ILE A 98 -9.473 -1.417 6.647 1.00 0.00 O ATOM 1515 CB ILE A 98 -10.866 0.948 7.730 1.00 0.00 C ATOM 1516 CG1 ILE A 98 -12.039 1.925 8.065 1.00 0.00 C ATOM 1517 CG2 ILE A 98 -9.585 1.470 8.434 1.00 0.00 C ATOM 1518 CD1 ILE A 98 -13.411 1.257 8.252 1.00 0.00 C ATOM 0 H ILE A 98 -11.949 -0.781 5.504 1.00 0.00 H new ATOM 0 HA ILE A 98 -10.276 1.673 5.859 1.00 0.00 H new ATOM 0 HB ILE A 98 -11.168 -0.031 8.103 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -11.790 2.468 8.976 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -12.117 2.662 7.266 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -9.795 1.643 9.490 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -8.790 0.730 8.338 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -9.269 2.404 7.969 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -14.158 2.017 8.481 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -13.691 0.738 7.335 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -13.358 0.541 9.073 1.00 0.00 H new ATOM 1530 N LYS A 99 -8.632 -0.166 4.957 1.00 0.00 N ATOM 1531 CA LYS A 99 -7.534 -1.097 4.587 1.00 0.00 C ATOM 1532 C LYS A 99 -6.299 -0.831 5.493 1.00 0.00 C ATOM 1533 O LYS A 99 -5.483 0.049 5.207 1.00 0.00 O ATOM 1534 CB LYS A 99 -7.270 -0.914 3.071 1.00 0.00 C ATOM 1535 CG LYS A 99 -6.189 -1.814 2.438 1.00 0.00 C ATOM 1536 CD LYS A 99 -6.462 -3.333 2.462 1.00 0.00 C ATOM 1537 CE LYS A 99 -5.443 -4.111 1.608 1.00 0.00 C ATOM 1538 NZ LYS A 99 -5.791 -5.538 1.500 1.00 0.00 N ATOM 0 H LYS A 99 -8.655 0.679 4.387 1.00 0.00 H new ATOM 0 HA LYS A 99 -7.792 -2.143 4.754 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -8.207 -1.084 2.540 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -6.990 0.125 2.898 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -6.053 -1.507 1.401 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -5.246 -1.628 2.951 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -6.424 -3.693 3.490 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -7.469 -3.527 2.093 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -5.395 -3.673 0.611 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -4.450 -4.012 2.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -5.081 -6.025 0.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -5.812 -5.963 2.449 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -6.727 -5.635 1.057 1.00 0.00 H new ATOM 1552 N SER A 100 -6.198 -1.596 6.595 1.00 0.00 N ATOM 1553 CA SER A 100 -5.161 -1.392 7.636 1.00 0.00 C ATOM 1554 C SER A 100 -4.017 -2.409 7.407 1.00 0.00 C ATOM 1555 O SER A 100 -4.191 -3.619 7.586 1.00 0.00 O ATOM 1556 CB SER A 100 -5.818 -1.519 9.028 1.00 0.00 C ATOM 1557 OG SER A 100 -4.876 -1.258 10.062 1.00 0.00 O ATOM 0 H SER A 100 -6.829 -2.373 6.793 1.00 0.00 H new ATOM 0 HA SER A 100 -4.723 -0.396 7.577 1.00 0.00 H new ATOM 0 HB2 SER A 100 -6.651 -0.821 9.106 1.00 0.00 H new ATOM 0 HB3 SER A 100 -6.229 -2.521 9.150 1.00 0.00 H new ATOM 0 HG SER A 100 -5.315 -1.343 10.934 1.00 0.00 H new ATOM 1563 N VAL A 101 -2.858 -1.886 6.971 1.00 0.00 N ATOM 1564 CA VAL A 101 -1.705 -2.724 6.528 1.00 0.00 C ATOM 1565 C VAL A 101 -0.515 -2.350 7.443 1.00 0.00 C ATOM 1566 O VAL A 101 0.115 -1.309 7.248 1.00 0.00 O ATOM 1567 CB VAL A 101 -1.419 -2.549 4.997 1.00 0.00 C ATOM 1568 CG1 VAL A 101 -0.141 -3.276 4.513 1.00 0.00 C ATOM 1569 CG2 VAL A 101 -2.599 -3.057 4.137 1.00 0.00 C ATOM 0 H VAL A 101 -2.684 -0.883 6.912 1.00 0.00 H new ATOM 0 HA VAL A 101 -1.914 -3.789 6.631 1.00 0.00 H new ATOM 0 HB VAL A 101 -1.277 -1.476 4.870 1.00 0.00 H new ATOM 0 HG11 VAL A 101 -0.010 -3.109 3.444 1.00 0.00 H new ATOM 0 HG12 VAL A 101 0.724 -2.887 5.050 1.00 0.00 H new ATOM 0 HG13 VAL A 101 -0.236 -4.345 4.704 1.00 0.00 H new ATOM 0 HG21 VAL A 101 -2.365 -2.920 3.081 1.00 0.00 H new ATOM 0 HG22 VAL A 101 -2.766 -4.115 4.337 1.00 0.00 H new ATOM 0 HG23 VAL A 101 -3.499 -2.494 4.385 1.00 0.00 H new ATOM 1579 N THR A 102 -0.211 -3.229 8.413 1.00 0.00 N ATOM 1580 CA THR A 102 0.866 -2.998 9.416 1.00 0.00 C ATOM 1581 C THR A 102 2.112 -3.818 8.963 1.00 0.00 C ATOM 1582 O THR A 102 2.292 -4.976 9.358 1.00 0.00 O ATOM 1583 CB THR A 102 0.346 -3.361 10.842 1.00 0.00 C ATOM 1584 OG1 THR A 102 -0.860 -2.664 11.139 1.00 0.00 O ATOM 1585 CG2 THR A 102 1.338 -3.035 11.968 1.00 0.00 C ATOM 0 H THR A 102 -0.697 -4.118 8.532 1.00 0.00 H new ATOM 0 HA THR A 102 1.161 -1.950 9.474 1.00 0.00 H new ATOM 0 HB THR A 102 0.193 -4.440 10.810 1.00 0.00 H new ATOM 0 HG1 THR A 102 -1.167 -2.909 12.037 1.00 0.00 H new ATOM 0 HG21 THR A 102 0.904 -3.316 12.928 1.00 0.00 H new ATOM 0 HG22 THR A 102 2.262 -3.591 11.811 1.00 0.00 H new ATOM 0 HG23 THR A 102 1.553 -1.966 11.966 1.00 0.00 H new ATOM 1593 N GLU A 103 2.954 -3.198 8.114 1.00 0.00 N ATOM 1594 CA GLU A 103 4.126 -3.870 7.499 1.00 0.00 C ATOM 1595 C GLU A 103 5.404 -3.535 8.303 1.00 0.00 C ATOM 1596 O GLU A 103 5.817 -2.376 8.381 1.00 0.00 O ATOM 1597 CB GLU A 103 4.254 -3.447 6.011 1.00 0.00 C ATOM 1598 CG GLU A 103 5.331 -4.230 5.224 1.00 0.00 C ATOM 1599 CD GLU A 103 5.433 -3.792 3.762 1.00 0.00 C ATOM 1600 OE1 GLU A 103 6.161 -2.815 3.475 1.00 0.00 O ATOM 1601 OE2 GLU A 103 4.789 -4.420 2.894 1.00 0.00 O ATOM 0 H GLU A 103 2.846 -2.223 7.833 1.00 0.00 H new ATOM 0 HA GLU A 103 3.989 -4.951 7.527 1.00 0.00 H new ATOM 0 HB2 GLU A 103 3.290 -3.583 5.521 1.00 0.00 H new ATOM 0 HB3 GLU A 103 4.487 -2.383 5.965 1.00 0.00 H new ATOM 0 HG2 GLU A 103 6.298 -4.094 5.708 1.00 0.00 H new ATOM 0 HG3 GLU A 103 5.101 -5.295 5.264 1.00 0.00 H new ATOM 1608 N LEU A 104 6.065 -4.580 8.821 1.00 0.00 N ATOM 1609 CA LEU A 104 7.408 -4.444 9.450 1.00 0.00 C ATOM 1610 C LEU A 104 8.512 -4.319 8.357 1.00 0.00 C ATOM 1611 O LEU A 104 8.533 -5.074 7.377 1.00 0.00 O ATOM 1612 CB LEU A 104 7.708 -5.634 10.411 1.00 0.00 C ATOM 1613 CG LEU A 104 8.189 -5.283 11.844 1.00 0.00 C ATOM 1614 CD1 LEU A 104 8.409 -6.580 12.647 1.00 0.00 C ATOM 1615 CD2 LEU A 104 9.473 -4.432 11.884 1.00 0.00 C ATOM 0 H LEU A 104 5.701 -5.533 8.822 1.00 0.00 H new ATOM 0 HA LEU A 104 7.409 -3.532 10.047 1.00 0.00 H new ATOM 0 HB2 LEU A 104 6.803 -6.236 10.496 1.00 0.00 H new ATOM 0 HB3 LEU A 104 8.466 -6.262 9.944 1.00 0.00 H new ATOM 0 HG LEU A 104 7.402 -4.674 12.289 1.00 0.00 H new ATOM 0 HD11 LEU A 104 8.747 -6.332 13.653 1.00 0.00 H new ATOM 0 HD12 LEU A 104 7.473 -7.135 12.705 1.00 0.00 H new ATOM 0 HD13 LEU A 104 9.163 -7.191 12.151 1.00 0.00 H new ATOM 0 HD21 LEU A 104 9.743 -4.230 12.920 1.00 0.00 H new ATOM 0 HD22 LEU A 104 10.284 -4.974 11.397 1.00 0.00 H new ATOM 0 HD23 LEU A 104 9.302 -3.490 11.363 1.00 0.00 H new ATOM 1627 N ASN A 105 9.426 -3.359 8.560 1.00 0.00 N ATOM 1628 CA ASN A 105 10.599 -3.130 7.671 1.00 0.00 C ATOM 1629 C ASN A 105 11.891 -3.044 8.544 1.00 0.00 C ATOM 1630 O ASN A 105 12.541 -1.994 8.621 1.00 0.00 O ATOM 1631 CB ASN A 105 10.381 -1.856 6.801 1.00 0.00 C ATOM 1632 CG ASN A 105 9.300 -1.955 5.705 1.00 0.00 C ATOM 1633 OD1 ASN A 105 9.561 -2.364 4.575 1.00 0.00 O ATOM 1634 ND2 ASN A 105 8.073 -1.581 6.024 1.00 0.00 N ATOM 0 H ASN A 105 9.382 -2.711 9.346 1.00 0.00 H new ATOM 0 HA ASN A 105 10.715 -3.964 6.978 1.00 0.00 H new ATOM 0 HB2 ASN A 105 10.123 -1.029 7.463 1.00 0.00 H new ATOM 0 HB3 ASN A 105 11.328 -1.600 6.326 1.00 0.00 H new ATOM 0 HD21 ASN A 105 7.328 -1.630 5.329 1.00 0.00 H new ATOM 0 HD22 ASN A 105 7.871 -1.244 6.965 1.00 0.00 H new ATOM 1641 N GLY A 106 12.263 -4.161 9.207 1.00 0.00 N ATOM 1642 CA GLY A 106 13.429 -4.206 10.124 1.00 0.00 C ATOM 1643 C GLY A 106 13.143 -3.570 11.502 1.00 0.00 C ATOM 1644 O GLY A 106 12.644 -4.240 12.409 1.00 0.00 O ATOM 0 H GLY A 106 11.770 -5.050 9.125 1.00 0.00 H new ATOM 0 HA2 GLY A 106 13.732 -5.243 10.266 1.00 0.00 H new ATOM 0 HA3 GLY A 106 14.269 -3.689 9.660 1.00 0.00 H new ATOM 1648 N ASP A 107 13.443 -2.267 11.617 1.00 0.00 N ATOM 1649 CA ASP A 107 12.978 -1.413 12.750 1.00 0.00 C ATOM 1650 C ASP A 107 11.647 -0.645 12.454 1.00 0.00 C ATOM 1651 O ASP A 107 10.855 -0.471 13.385 1.00 0.00 O ATOM 1652 CB ASP A 107 14.084 -0.410 13.182 1.00 0.00 C ATOM 1653 CG ASP A 107 15.358 -1.028 13.778 1.00 0.00 C ATOM 1654 OD1 ASP A 107 15.420 -1.222 15.012 1.00 0.00 O ATOM 1655 OD2 ASP A 107 16.303 -1.318 13.012 1.00 0.00 O ATOM 0 H ASP A 107 14.013 -1.765 10.935 1.00 0.00 H new ATOM 0 HA ASP A 107 12.767 -2.102 13.568 1.00 0.00 H new ATOM 0 HB2 ASP A 107 14.365 0.186 12.314 1.00 0.00 H new ATOM 0 HB3 ASP A 107 13.659 0.275 13.915 1.00 0.00 H new ATOM 1660 N ILE A 108 11.403 -0.163 11.210 1.00 0.00 N ATOM 1661 CA ILE A 108 10.265 0.747 10.883 1.00 0.00 C ATOM 1662 C ILE A 108 8.962 -0.093 10.722 1.00 0.00 C ATOM 1663 O ILE A 108 8.789 -0.771 9.707 1.00 0.00 O ATOM 1664 CB ILE A 108 10.521 1.616 9.590 1.00 0.00 C ATOM 1665 CG1 ILE A 108 11.948 2.203 9.380 1.00 0.00 C ATOM 1666 CG2 ILE A 108 9.458 2.735 9.427 1.00 0.00 C ATOM 1667 CD1 ILE A 108 12.463 3.156 10.464 1.00 0.00 C ATOM 0 H ILE A 108 11.985 -0.391 10.404 1.00 0.00 H new ATOM 0 HA ILE A 108 10.161 1.450 11.710 1.00 0.00 H new ATOM 0 HB ILE A 108 10.427 0.870 8.801 1.00 0.00 H new ATOM 0 HG12 ILE A 108 12.649 1.373 9.295 1.00 0.00 H new ATOM 0 HG13 ILE A 108 11.962 2.731 8.427 1.00 0.00 H new ATOM 0 HG21 ILE A 108 9.670 3.310 8.526 1.00 0.00 H new ATOM 0 HG22 ILE A 108 8.468 2.287 9.347 1.00 0.00 H new ATOM 0 HG23 ILE A 108 9.489 3.395 10.294 1.00 0.00 H new ATOM 0 HD11 ILE A 108 13.465 3.496 10.203 1.00 0.00 H new ATOM 0 HD12 ILE A 108 11.797 4.015 10.540 1.00 0.00 H new ATOM 0 HD13 ILE A 108 12.494 2.636 11.421 1.00 0.00 H new ATOM 1679 N ILE A 109 8.019 0.016 11.677 1.00 0.00 N ATOM 1680 CA ILE A 109 6.642 -0.521 11.499 1.00 0.00 C ATOM 1681 C ILE A 109 5.809 0.567 10.758 1.00 0.00 C ATOM 1682 O ILE A 109 5.516 1.640 11.294 1.00 0.00 O ATOM 1683 CB ILE A 109 6.042 -1.075 12.833 1.00 0.00 C ATOM 1684 CG1 ILE A 109 4.901 -2.092 12.577 1.00 0.00 C ATOM 1685 CG2 ILE A 109 5.607 0.004 13.852 1.00 0.00 C ATOM 1686 CD1 ILE A 109 4.511 -2.898 13.823 1.00 0.00 C ATOM 0 H ILE A 109 8.177 0.467 12.578 1.00 0.00 H new ATOM 0 HA ILE A 109 6.634 -1.412 10.871 1.00 0.00 H new ATOM 0 HB ILE A 109 6.875 -1.595 13.305 1.00 0.00 H new ATOM 0 HG12 ILE A 109 4.024 -1.558 12.210 1.00 0.00 H new ATOM 0 HG13 ILE A 109 5.208 -2.780 11.790 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.205 -0.478 14.743 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.468 0.613 14.127 1.00 0.00 H new ATOM 0 HG23 ILE A 109 4.841 0.638 13.406 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.707 -3.590 13.572 1.00 0.00 H new ATOM 0 HD12 ILE A 109 5.375 -3.459 14.179 1.00 0.00 H new ATOM 0 HD13 ILE A 109 4.173 -2.218 14.605 1.00 0.00 H new ATOM 1698 N THR A 110 5.502 0.275 9.490 1.00 0.00 N ATOM 1699 CA THR A 110 4.871 1.232 8.555 1.00 0.00 C ATOM 1700 C THR A 110 3.369 0.839 8.460 1.00 0.00 C ATOM 1701 O THR A 110 3.007 -0.068 7.702 1.00 0.00 O ATOM 1702 CB THR A 110 5.625 1.196 7.189 1.00 0.00 C ATOM 1703 OG1 THR A 110 7.010 1.478 7.373 1.00 0.00 O ATOM 1704 CG2 THR A 110 5.095 2.215 6.168 1.00 0.00 C ATOM 0 H THR A 110 5.683 -0.638 9.073 1.00 0.00 H new ATOM 0 HA THR A 110 4.934 2.265 8.896 1.00 0.00 H new ATOM 0 HB THR A 110 5.461 0.190 6.802 1.00 0.00 H new ATOM 0 HG1 THR A 110 7.468 1.450 6.507 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.666 2.133 5.243 1.00 0.00 H new ATOM 0 HG22 THR A 110 4.043 2.013 5.965 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.200 3.222 6.571 1.00 0.00 H new ATOM 1712 N ASN A 111 2.510 1.527 9.238 1.00 0.00 N ATOM 1713 CA ASN A 111 1.041 1.296 9.211 1.00 0.00 C ATOM 1714 C ASN A 111 0.401 2.280 8.200 1.00 0.00 C ATOM 1715 O ASN A 111 0.142 3.445 8.514 1.00 0.00 O ATOM 1716 CB ASN A 111 0.441 1.332 10.645 1.00 0.00 C ATOM 1717 CG ASN A 111 -1.102 1.321 10.748 1.00 0.00 C ATOM 1718 OD1 ASN A 111 -1.719 2.331 11.085 1.00 0.00 O ATOM 1719 ND2 ASN A 111 -1.755 0.211 10.440 1.00 0.00 N ATOM 0 H ASN A 111 2.803 2.249 9.896 1.00 0.00 H new ATOM 0 HA ASN A 111 0.808 0.292 8.856 1.00 0.00 H new ATOM 0 HB2 ASN A 111 0.826 0.475 11.197 1.00 0.00 H new ATOM 0 HB3 ASN A 111 0.810 2.226 11.147 1.00 0.00 H new ATOM 0 HD21 ASN A 111 -2.774 0.191 10.481 1.00 0.00 H new ATOM 0 HD22 ASN A 111 -1.239 -0.624 10.161 1.00 0.00 H new ATOM 1726 N THR A 112 0.125 1.744 7.002 1.00 0.00 N ATOM 1727 CA THR A 112 -0.544 2.475 5.905 1.00 0.00 C ATOM 1728 C THR A 112 -2.063 2.140 5.994 1.00 0.00 C ATOM 1729 O THR A 112 -2.517 1.104 5.495 1.00 0.00 O ATOM 1730 CB THR A 112 0.129 2.074 4.560 1.00 0.00 C ATOM 1731 OG1 THR A 112 1.532 2.330 4.602 1.00 0.00 O ATOM 1732 CG2 THR A 112 -0.420 2.855 3.362 1.00 0.00 C ATOM 0 H THR A 112 0.361 0.781 6.761 1.00 0.00 H new ATOM 0 HA THR A 112 -0.443 3.558 5.978 1.00 0.00 H new ATOM 0 HB THR A 112 -0.087 1.013 4.435 1.00 0.00 H new ATOM 0 HG1 THR A 112 1.938 2.070 3.749 1.00 0.00 H new ATOM 0 HG21 THR A 112 0.088 2.532 2.453 1.00 0.00 H new ATOM 0 HG22 THR A 112 -1.490 2.669 3.266 1.00 0.00 H new ATOM 0 HG23 THR A 112 -0.249 3.921 3.513 1.00 0.00 H new ATOM 1740 N MET A 113 -2.820 3.033 6.656 1.00 0.00 N ATOM 1741 CA MET A 113 -4.276 2.866 6.882 1.00 0.00 C ATOM 1742 C MET A 113 -5.024 3.777 5.869 1.00 0.00 C ATOM 1743 O MET A 113 -4.878 5.003 5.910 1.00 0.00 O ATOM 1744 CB MET A 113 -4.630 3.200 8.361 1.00 0.00 C ATOM 1745 CG MET A 113 -5.707 2.283 8.960 1.00 0.00 C ATOM 1746 SD MET A 113 -6.416 2.999 10.461 1.00 0.00 S ATOM 1747 CE MET A 113 -5.165 2.608 11.702 1.00 0.00 C ATOM 0 H MET A 113 -2.443 3.894 7.052 1.00 0.00 H new ATOM 0 HA MET A 113 -4.585 1.834 6.717 1.00 0.00 H new ATOM 0 HB2 MET A 113 -3.727 3.129 8.967 1.00 0.00 H new ATOM 0 HB3 MET A 113 -4.972 4.233 8.419 1.00 0.00 H new ATOM 0 HG2 MET A 113 -6.495 2.116 8.226 1.00 0.00 H new ATOM 0 HG3 MET A 113 -5.273 1.309 9.188 1.00 0.00 H new ATOM 0 HE1 MET A 113 -5.481 2.994 12.671 1.00 0.00 H new ATOM 0 HE2 MET A 113 -5.041 1.527 11.765 1.00 0.00 H new ATOM 0 HE3 MET A 113 -4.217 3.066 11.420 1.00 0.00 H new ATOM 1757 N THR A 114 -5.792 3.171 4.947 1.00 0.00 N ATOM 1758 CA THR A 114 -6.437 3.905 3.822 1.00 0.00 C ATOM 1759 C THR A 114 -7.978 3.778 3.967 1.00 0.00 C ATOM 1760 O THR A 114 -8.525 2.673 3.977 1.00 0.00 O ATOM 1761 CB THR A 114 -5.887 3.397 2.455 1.00 0.00 C ATOM 1762 OG1 THR A 114 -4.467 3.535 2.420 1.00 0.00 O ATOM 1763 CG2 THR A 114 -6.432 4.160 1.233 1.00 0.00 C ATOM 0 H THR A 114 -5.987 2.170 4.951 1.00 0.00 H new ATOM 0 HA THR A 114 -6.193 4.967 3.856 1.00 0.00 H new ATOM 0 HB THR A 114 -6.213 2.359 2.388 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.128 3.212 1.559 1.00 0.00 H new ATOM 0 HG21 THR A 114 -6.000 3.745 0.322 1.00 0.00 H new ATOM 0 HG22 THR A 114 -7.517 4.062 1.197 1.00 0.00 H new ATOM 0 HG23 THR A 114 -6.165 5.214 1.313 1.00 0.00 H new ATOM 1771 N LEU A 115 -8.671 4.933 4.028 1.00 0.00 N ATOM 1772 CA LEU A 115 -10.156 4.998 4.123 1.00 0.00 C ATOM 1773 C LEU A 115 -10.758 4.744 2.704 1.00 0.00 C ATOM 1774 O LEU A 115 -10.891 3.580 2.314 1.00 0.00 O ATOM 1775 CB LEU A 115 -10.528 6.326 4.859 1.00 0.00 C ATOM 1776 CG LEU A 115 -12.034 6.615 5.121 1.00 0.00 C ATOM 1777 CD1 LEU A 115 -12.704 5.559 6.018 1.00 0.00 C ATOM 1778 CD2 LEU A 115 -12.217 8.023 5.721 1.00 0.00 C ATOM 0 H LEU A 115 -8.224 5.850 4.013 1.00 0.00 H new ATOM 0 HA LEU A 115 -10.610 4.216 4.732 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -10.014 6.331 5.820 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -10.124 7.155 4.278 1.00 0.00 H new ATOM 0 HG LEU A 115 -12.533 6.565 4.153 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -13.753 5.817 6.163 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -12.634 4.581 5.543 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -12.201 5.530 6.984 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -13.276 8.208 5.898 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -11.675 8.090 6.664 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -11.830 8.768 5.026 1.00 0.00 H new ATOM 1790 N GLY A 116 -11.043 5.802 1.924 1.00 0.00 N ATOM 1791 CA GLY A 116 -11.275 5.691 0.465 1.00 0.00 C ATOM 1792 C GLY A 116 -9.959 5.855 -0.319 1.00 0.00 C ATOM 1793 O GLY A 116 -9.448 4.879 -0.876 1.00 0.00 O ATOM 0 H GLY A 116 -11.120 6.755 2.281 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -11.720 4.722 0.237 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -11.988 6.452 0.148 1.00 0.00 H new ATOM 1797 N ASP A 117 -9.412 7.086 -0.319 1.00 0.00 N ATOM 1798 CA ASP A 117 -8.018 7.344 -0.774 1.00 0.00 C ATOM 1799 C ASP A 117 -7.393 8.476 0.104 1.00 0.00 C ATOM 1800 O ASP A 117 -7.062 9.559 -0.389 1.00 0.00 O ATOM 1801 CB ASP A 117 -8.003 7.616 -2.307 1.00 0.00 C ATOM 1802 CG ASP A 117 -6.602 7.627 -2.937 1.00 0.00 C ATOM 1803 OD1 ASP A 117 -6.017 6.539 -3.130 1.00 0.00 O ATOM 1804 OD2 ASP A 117 -6.082 8.725 -3.238 1.00 0.00 O ATOM 0 H ASP A 117 -9.908 7.922 -0.010 1.00 0.00 H new ATOM 0 HA ASP A 117 -7.383 6.469 -0.633 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -8.605 6.856 -2.804 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -8.481 8.577 -2.498 1.00 0.00 H new ATOM 1809 N ILE A 118 -7.205 8.191 1.409 1.00 0.00 N ATOM 1810 CA ILE A 118 -6.473 9.081 2.354 1.00 0.00 C ATOM 1811 C ILE A 118 -5.352 8.177 2.932 1.00 0.00 C ATOM 1812 O ILE A 118 -5.623 7.302 3.762 1.00 0.00 O ATOM 1813 CB ILE A 118 -7.393 9.710 3.460 1.00 0.00 C ATOM 1814 CG1 ILE A 118 -8.538 10.575 2.854 1.00 0.00 C ATOM 1815 CG2 ILE A 118 -6.551 10.545 4.459 1.00 0.00 C ATOM 1816 CD1 ILE A 118 -9.613 11.063 3.840 1.00 0.00 C ATOM 0 H ILE A 118 -7.554 7.338 1.845 1.00 0.00 H new ATOM 0 HA ILE A 118 -6.072 9.962 1.853 1.00 0.00 H new ATOM 0 HB ILE A 118 -7.862 8.884 3.995 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -8.092 11.446 2.374 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -9.028 9.996 2.071 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -7.206 10.973 5.218 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -5.812 9.903 4.938 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -6.042 11.347 3.924 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -10.356 11.654 3.305 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -10.098 10.204 4.304 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -9.148 11.677 4.611 1.00 0.00 H new ATOM 1828 N VAL A 119 -4.097 8.411 2.504 1.00 0.00 N ATOM 1829 CA VAL A 119 -2.956 7.508 2.827 1.00 0.00 C ATOM 1830 C VAL A 119 -2.314 7.998 4.164 1.00 0.00 C ATOM 1831 O VAL A 119 -1.358 8.782 4.169 1.00 0.00 O ATOM 1832 CB VAL A 119 -1.958 7.408 1.616 1.00 0.00 C ATOM 1833 CG1 VAL A 119 -0.800 6.416 1.876 1.00 0.00 C ATOM 1834 CG2 VAL A 119 -2.619 6.988 0.277 1.00 0.00 C ATOM 0 H VAL A 119 -3.839 9.216 1.933 1.00 0.00 H new ATOM 0 HA VAL A 119 -3.292 6.483 2.984 1.00 0.00 H new ATOM 0 HB VAL A 119 -1.583 8.427 1.526 1.00 0.00 H new ATOM 0 HG11 VAL A 119 -0.143 6.388 1.007 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -0.233 6.739 2.749 1.00 0.00 H new ATOM 0 HG13 VAL A 119 -1.207 5.421 2.056 1.00 0.00 H new ATOM 0 HG21 VAL A 119 -1.861 6.943 -0.505 1.00 0.00 H new ATOM 0 HG22 VAL A 119 -3.081 6.007 0.391 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -3.381 7.718 0.003 1.00 0.00 H new ATOM 1844 N PHE A 120 -2.852 7.499 5.293 1.00 0.00 N ATOM 1845 CA PHE A 120 -2.313 7.769 6.651 1.00 0.00 C ATOM 1846 C PHE A 120 -1.168 6.764 6.957 1.00 0.00 C ATOM 1847 O PHE A 120 -1.425 5.618 7.334 1.00 0.00 O ATOM 1848 CB PHE A 120 -3.494 7.711 7.666 1.00 0.00 C ATOM 1849 CG PHE A 120 -3.153 7.720 9.173 1.00 0.00 C ATOM 1850 CD1 PHE A 120 -2.302 8.693 9.705 1.00 0.00 C ATOM 1851 CD2 PHE A 120 -3.667 6.728 10.018 1.00 0.00 C ATOM 1852 CE1 PHE A 120 -1.976 8.681 11.055 1.00 0.00 C ATOM 1853 CE2 PHE A 120 -3.320 6.704 11.368 1.00 0.00 C ATOM 1854 CZ PHE A 120 -2.479 7.686 11.887 1.00 0.00 C ATOM 0 H PHE A 120 -3.674 6.895 5.295 1.00 0.00 H new ATOM 0 HA PHE A 120 -1.872 8.763 6.726 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -4.149 8.559 7.466 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -4.069 6.809 7.459 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -1.895 9.459 9.062 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -4.335 5.978 9.622 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -1.330 9.446 11.460 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -3.703 5.925 12.011 1.00 0.00 H new ATOM 0 HZ PHE A 120 -2.218 7.675 12.935 1.00 0.00 H new ATOM 1864 N LYS A 121 0.083 7.229 6.809 1.00 0.00 N ATOM 1865 CA LYS A 121 1.292 6.390 7.008 1.00 0.00 C ATOM 1866 C LYS A 121 1.965 6.766 8.358 1.00 0.00 C ATOM 1867 O LYS A 121 2.277 7.937 8.611 1.00 0.00 O ATOM 1868 CB LYS A 121 2.226 6.561 5.781 1.00 0.00 C ATOM 1869 CG LYS A 121 3.319 5.475 5.659 1.00 0.00 C ATOM 1870 CD LYS A 121 4.120 5.528 4.342 1.00 0.00 C ATOM 1871 CE LYS A 121 5.174 6.650 4.280 1.00 0.00 C ATOM 1872 NZ LYS A 121 5.847 6.683 2.970 1.00 0.00 N ATOM 0 H LYS A 121 0.292 8.193 6.549 1.00 0.00 H new ATOM 0 HA LYS A 121 1.037 5.332 7.073 1.00 0.00 H new ATOM 0 HB2 LYS A 121 1.621 6.555 4.874 1.00 0.00 H new ATOM 0 HB3 LYS A 121 2.706 7.538 5.837 1.00 0.00 H new ATOM 0 HG2 LYS A 121 4.010 5.576 6.496 1.00 0.00 H new ATOM 0 HG3 LYS A 121 2.852 4.494 5.748 1.00 0.00 H new ATOM 0 HD2 LYS A 121 4.619 4.570 4.196 1.00 0.00 H new ATOM 0 HD3 LYS A 121 3.424 5.655 3.513 1.00 0.00 H new ATOM 0 HE2 LYS A 121 4.696 7.611 4.470 1.00 0.00 H new ATOM 0 HE3 LYS A 121 5.913 6.501 5.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 6.550 7.449 2.960 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 6.323 5.774 2.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 5.144 6.850 2.222 1.00 0.00 H new ATOM 1886 N ARG A 122 2.191 5.748 9.206 1.00 0.00 N ATOM 1887 CA ARG A 122 2.836 5.917 10.536 1.00 0.00 C ATOM 1888 C ARG A 122 4.290 5.386 10.428 1.00 0.00 C ATOM 1889 O ARG A 122 4.499 4.174 10.313 1.00 0.00 O ATOM 1890 CB ARG A 122 2.075 5.131 11.645 1.00 0.00 C ATOM 1891 CG ARG A 122 0.593 5.506 11.885 1.00 0.00 C ATOM 1892 CD ARG A 122 -0.078 4.778 13.069 1.00 0.00 C ATOM 1893 NE ARG A 122 0.376 5.246 14.408 1.00 0.00 N ATOM 1894 CZ ARG A 122 1.186 4.556 15.240 1.00 0.00 C ATOM 1895 NH1 ARG A 122 1.764 3.398 14.930 1.00 0.00 N ATOM 1896 NH2 ARG A 122 1.423 5.062 16.437 1.00 0.00 N ATOM 0 H ARG A 122 1.935 4.783 8.997 1.00 0.00 H new ATOM 0 HA ARG A 122 2.820 6.971 10.812 1.00 0.00 H new ATOM 0 HB2 ARG A 122 2.120 4.070 11.399 1.00 0.00 H new ATOM 0 HB3 ARG A 122 2.614 5.263 12.583 1.00 0.00 H new ATOM 0 HG2 ARG A 122 0.528 6.581 12.054 1.00 0.00 H new ATOM 0 HG3 ARG A 122 0.028 5.292 10.978 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -1.158 4.909 12.997 1.00 0.00 H new ATOM 0 HD3 ARG A 122 0.120 3.709 12.983 1.00 0.00 H new ATOM 0 HE ARG A 122 0.049 6.160 14.722 1.00 0.00 H new ATOM 0 HH11 ARG A 122 1.606 2.978 14.014 1.00 0.00 H new ATOM 0 HH12 ARG A 122 2.365 2.930 15.608 1.00 0.00 H new ATOM 0 HH21 ARG A 122 0.999 5.949 16.709 1.00 0.00 H new ATOM 0 HH22 ARG A 122 2.030 4.566 17.089 1.00 0.00 H new ATOM 1910 N ILE A 123 5.292 6.283 10.470 1.00 0.00 N ATOM 1911 CA ILE A 123 6.729 5.902 10.334 1.00 0.00 C ATOM 1912 C ILE A 123 7.254 5.716 11.792 1.00 0.00 C ATOM 1913 O ILE A 123 7.601 6.697 12.459 1.00 0.00 O ATOM 1914 CB ILE A 123 7.534 6.951 9.480 1.00 0.00 C ATOM 1915 CG1 ILE A 123 7.039 7.158 8.010 1.00 0.00 C ATOM 1916 CG2 ILE A 123 9.043 6.595 9.407 1.00 0.00 C ATOM 1917 CD1 ILE A 123 5.804 8.051 7.806 1.00 0.00 C ATOM 0 H ILE A 123 5.142 7.284 10.597 1.00 0.00 H new ATOM 0 HA ILE A 123 6.862 4.975 9.776 1.00 0.00 H new ATOM 0 HB ILE A 123 7.358 7.881 10.021 1.00 0.00 H new ATOM 0 HG12 ILE A 123 7.861 7.581 7.433 1.00 0.00 H new ATOM 0 HG13 ILE A 123 6.822 6.178 7.585 1.00 0.00 H new ATOM 0 HG21 ILE A 123 9.565 7.342 8.809 1.00 0.00 H new ATOM 0 HG22 ILE A 123 9.462 6.578 10.413 1.00 0.00 H new ATOM 0 HG23 ILE A 123 9.164 5.614 8.947 1.00 0.00 H new ATOM 0 HD11 ILE A 123 5.569 8.110 6.743 1.00 0.00 H new ATOM 0 HD12 ILE A 123 4.955 7.626 8.342 1.00 0.00 H new ATOM 0 HD13 ILE A 123 6.011 9.051 8.188 1.00 0.00 H new ATOM 1929 N SER A 124 7.266 4.457 12.272 1.00 0.00 N ATOM 1930 CA SER A 124 7.479 4.152 13.716 1.00 0.00 C ATOM 1931 C SER A 124 8.693 3.200 13.908 1.00 0.00 C ATOM 1932 O SER A 124 8.574 1.979 13.796 1.00 0.00 O ATOM 1933 CB SER A 124 6.167 3.584 14.315 1.00 0.00 C ATOM 1934 OG SER A 124 5.151 4.575 14.404 1.00 0.00 O ATOM 0 H SER A 124 7.132 3.631 11.689 1.00 0.00 H new ATOM 0 HA SER A 124 7.725 5.066 14.257 1.00 0.00 H new ATOM 0 HB2 SER A 124 5.815 2.757 13.698 1.00 0.00 H new ATOM 0 HB3 SER A 124 6.367 3.179 15.307 1.00 0.00 H new ATOM 0 HG SER A 124 4.340 4.178 14.784 1.00 0.00 H new ATOM 1940 N LYS A 125 9.863 3.775 14.232 1.00 0.00 N ATOM 1941 CA LYS A 125 11.125 3.019 14.470 1.00 0.00 C ATOM 1942 C LYS A 125 11.195 2.453 15.922 1.00 0.00 C ATOM 1943 O LYS A 125 10.775 3.118 16.875 1.00 0.00 O ATOM 1944 CB LYS A 125 12.304 3.994 14.179 1.00 0.00 C ATOM 1945 CG LYS A 125 13.702 3.337 14.121 1.00 0.00 C ATOM 1946 CD LYS A 125 14.848 4.332 13.852 1.00 0.00 C ATOM 1947 CE LYS A 125 16.244 3.685 13.743 1.00 0.00 C ATOM 1948 NZ LYS A 125 16.734 3.109 15.010 1.00 0.00 N ATOM 0 H LYS A 125 9.971 4.784 14.339 1.00 0.00 H new ATOM 0 HA LYS A 125 11.176 2.151 13.812 1.00 0.00 H new ATOM 0 HB2 LYS A 125 12.115 4.494 13.229 1.00 0.00 H new ATOM 0 HB3 LYS A 125 12.315 4.766 14.948 1.00 0.00 H new ATOM 0 HG2 LYS A 125 13.892 2.825 15.065 1.00 0.00 H new ATOM 0 HG3 LYS A 125 13.703 2.576 13.340 1.00 0.00 H new ATOM 0 HD2 LYS A 125 14.637 4.869 12.927 1.00 0.00 H new ATOM 0 HD3 LYS A 125 14.866 5.072 14.653 1.00 0.00 H new ATOM 0 HE2 LYS A 125 16.213 2.901 12.986 1.00 0.00 H new ATOM 0 HE3 LYS A 125 16.955 4.434 13.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 17.675 2.693 14.861 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 16.796 3.857 15.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 16.076 2.371 15.333 1.00 0.00 H new ATOM 1962 N ARG A 126 11.811 1.263 16.087 1.00 0.00 N ATOM 1963 CA ARG A 126 12.207 0.746 17.429 1.00 0.00 C ATOM 1964 C ARG A 126 13.402 1.547 18.018 1.00 0.00 C ATOM 1965 O ARG A 126 14.446 1.696 17.374 1.00 0.00 O ATOM 1966 CB ARG A 126 12.602 -0.755 17.398 1.00 0.00 C ATOM 1967 CG ARG A 126 11.418 -1.740 17.291 1.00 0.00 C ATOM 1968 CD ARG A 126 11.620 -3.095 17.996 1.00 0.00 C ATOM 1969 NE ARG A 126 11.673 -2.949 19.474 1.00 0.00 N ATOM 1970 CZ ARG A 126 12.064 -3.916 20.326 1.00 0.00 C ATOM 1971 NH1 ARG A 126 12.412 -5.143 19.947 1.00 0.00 N ATOM 1972 NH2 ARG A 126 12.097 -3.628 21.614 1.00 0.00 N ATOM 0 H ARG A 126 12.047 0.639 15.315 1.00 0.00 H new ATOM 0 HA ARG A 126 11.325 0.868 18.058 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.271 -0.922 16.554 1.00 0.00 H new ATOM 0 HB3 ARG A 126 13.166 -0.985 18.302 1.00 0.00 H new ATOM 0 HG2 ARG A 126 10.531 -1.262 17.707 1.00 0.00 H new ATOM 0 HG3 ARG A 126 11.216 -1.925 16.236 1.00 0.00 H new ATOM 0 HD2 ARG A 126 10.807 -3.769 17.727 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.544 -3.553 17.643 1.00 0.00 H new ATOM 0 HE ARG A 126 11.393 -2.052 19.872 1.00 0.00 H new ATOM 0 HH11 ARG A 126 12.392 -5.397 18.959 1.00 0.00 H new ATOM 0 HH12 ARG A 126 12.699 -5.830 20.644 1.00 0.00 H new ATOM 0 HH21 ARG A 126 11.831 -2.697 21.935 1.00 0.00 H new ATOM 0 HH22 ARG A 126 12.388 -4.336 22.288 1.00 0.00 H new ATOM 1986 N ILE A 127 13.217 2.031 19.258 1.00 0.00 N ATOM 1987 CA ILE A 127 14.222 2.871 19.963 1.00 0.00 C ATOM 1988 C ILE A 127 14.584 2.089 21.241 1.00 0.00 C ATOM 1989 O ILE A 127 13.845 2.062 22.226 1.00 0.00 O ATOM 1990 CB ILE A 127 13.724 4.342 20.208 1.00 0.00 C ATOM 1991 CG1 ILE A 127 13.184 5.090 18.949 1.00 0.00 C ATOM 1992 CG2 ILE A 127 14.782 5.218 20.925 1.00 0.00 C ATOM 1993 CD1 ILE A 127 14.143 5.276 17.762 1.00 0.00 C ATOM 0 H ILE A 127 12.374 1.857 19.804 1.00 0.00 H new ATOM 0 HA ILE A 127 15.116 3.032 19.360 1.00 0.00 H new ATOM 0 HB ILE A 127 12.866 4.199 20.864 1.00 0.00 H new ATOM 0 HG12 ILE A 127 12.307 4.552 18.590 1.00 0.00 H new ATOM 0 HG13 ILE A 127 12.846 6.077 19.265 1.00 0.00 H new ATOM 0 HG21 ILE A 127 14.385 6.223 21.069 1.00 0.00 H new ATOM 0 HG22 ILE A 127 15.021 4.780 21.894 1.00 0.00 H new ATOM 0 HG23 ILE A 127 15.685 5.268 20.317 1.00 0.00 H new ATOM 0 HD11 ILE A 127 13.632 5.811 16.962 1.00 0.00 H new ATOM 0 HD12 ILE A 127 15.013 5.849 18.083 1.00 0.00 H new ATOM 0 HD13 ILE A 127 14.465 4.300 17.398 1.00 0.00 H new TER 2005 ILE A 127