USER MOD reduce.3.24.130724 H: found=0, std=0, add=952, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 956 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: B 62 THR OG1 : rot 180:sc= -0.584 USER MOD Set 1.2: B 64 GLN : amide:sc= -0.0291 X(o=-5.5,f=-5.2) USER MOD Set 1.3: B 78 ASN : amide:sc= -4.9 X(o=-5.5,f=-5.2!) USER MOD Set 2.1: A 62 THR OG1 : rot 180:sc= -0.522 USER MOD Set 2.2: A 64 GLN : amide:sc= -0.0409 X(o=-5.4,f=-5.1) USER MOD Set 2.3: A 78 ASN : amide:sc= -4.82 X(o=-5.4,f=-5.1!) USER MOD Single : A 32 SER OG : rot 180:sc= 0.0106 USER MOD Single : A 37 HIS : no HD1:sc= 0 X(o=0,f=-0.0029) USER MOD Single : A 38 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 GLN : amide:sc= -1.67 X(o=-1.7,f=-1.9) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 CYS SG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 TYR OH : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 MET CE :methyl 154:sc= -3.54 (180deg=-5.24!) USER MOD Single : A 67 GLN : amide:sc= 0 X(o=0,f=-0.47) USER MOD Single : A 68 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.074) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 THR OG1 : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 180:sc= 0.0221 USER MOD Single : B 37 HIS : no HD1:sc= 0 X(o=0,f=-0.0077) USER MOD Single : B 38 TYR OH : rot 180:sc= 0 USER MOD Single : B 41 GLN : amide:sc= -1.84 X(o=-1.8,f=-2) USER MOD Single : B 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 51 CYS SG : rot 180:sc= 0 USER MOD Single : B 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 53 TYR OH : rot 180:sc= 0 USER MOD Single : B 55 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 60 MET CE :methyl 148:sc= -3.46 (180deg=-5.21!) USER MOD Single : B 67 GLN : amide:sc= 0 K(o=0,f=-0.54) USER MOD Single : B 68 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.0774) USER MOD Single : B 73 SER OG : rot 180:sc= 0 USER MOD Single : B 80 THR OG1 : rot 180:sc= 0 USER MOD Single : B 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 31 4.212 -0.034 2.834 1.00 0.00 N ATOM 2 CA ARG A 31 4.645 0.663 1.590 1.00 0.00 C ATOM 3 C ARG A 31 6.061 0.206 1.218 1.00 0.00 C ATOM 4 O ARG A 31 7.021 0.942 1.358 1.00 0.00 O ATOM 5 CB ARG A 31 4.629 2.178 1.825 1.00 0.00 C ATOM 6 CG ARG A 31 4.169 2.890 0.551 1.00 0.00 C ATOM 7 CD ARG A 31 2.662 3.144 0.623 1.00 0.00 C ATOM 8 NE ARG A 31 2.222 3.884 -0.601 1.00 0.00 N ATOM 9 CZ ARG A 31 2.074 3.271 -1.759 1.00 0.00 C ATOM 10 NH1 ARG A 31 2.308 1.984 -1.891 1.00 0.00 N ATOM 11 NH2 ARG A 31 1.687 3.958 -2.798 1.00 0.00 N ATOM 0 HA ARG A 31 3.964 0.420 0.774 1.00 0.00 H new ATOM 0 HB2 ARG A 31 3.961 2.421 2.651 1.00 0.00 H new ATOM 0 HB3 ARG A 31 5.624 2.523 2.108 1.00 0.00 H new ATOM 0 HG2 ARG A 31 4.702 3.834 0.437 1.00 0.00 H new ATOM 0 HG3 ARG A 31 4.405 2.283 -0.323 1.00 0.00 H new ATOM 0 HD2 ARG A 31 2.126 2.198 0.701 1.00 0.00 H new ATOM 0 HD3 ARG A 31 2.422 3.721 1.516 1.00 0.00 H new ATOM 0 HE ARG A 31 2.032 4.884 -0.538 1.00 0.00 H new ATOM 0 HH11 ARG A 31 2.612 1.436 -1.086 1.00 0.00 H new ATOM 0 HH12 ARG A 31 2.186 1.534 -2.798 1.00 0.00 H new ATOM 0 HH21 ARG A 31 1.503 4.957 -2.709 1.00 0.00 H new ATOM 0 HH22 ARG A 31 1.569 3.496 -3.700 1.00 0.00 H new ATOM 27 N SER A 32 6.194 -1.008 0.749 1.00 0.00 N ATOM 28 CA SER A 32 7.537 -1.529 0.368 1.00 0.00 C ATOM 29 C SER A 32 8.083 -0.741 -0.824 1.00 0.00 C ATOM 30 O SER A 32 9.281 -0.624 -0.999 1.00 0.00 O ATOM 31 CB SER A 32 7.425 -3.003 -0.013 1.00 0.00 C ATOM 32 OG SER A 32 6.525 -3.652 0.877 1.00 0.00 O ATOM 0 H SER A 32 5.424 -1.663 0.614 1.00 0.00 H new ATOM 0 HA SER A 32 8.214 -1.419 1.215 1.00 0.00 H new ATOM 0 HB2 SER A 32 7.072 -3.099 -1.040 1.00 0.00 H new ATOM 0 HB3 SER A 32 8.405 -3.478 0.033 1.00 0.00 H new ATOM 0 HG SER A 32 6.450 -4.598 0.634 1.00 0.00 H new ATOM 38 N ASP A 33 7.214 -0.202 -1.644 1.00 0.00 N ATOM 39 CA ASP A 33 7.681 0.577 -2.824 1.00 0.00 C ATOM 40 C ASP A 33 8.004 2.025 -2.427 1.00 0.00 C ATOM 41 O ASP A 33 8.261 2.852 -3.276 1.00 0.00 O ATOM 42 CB ASP A 33 6.600 0.579 -3.905 1.00 0.00 C ATOM 43 CG ASP A 33 5.278 1.070 -3.310 1.00 0.00 C ATOM 44 OD1 ASP A 33 4.685 0.328 -2.545 1.00 0.00 O ATOM 45 OD2 ASP A 33 4.882 2.178 -3.630 1.00 0.00 O ATOM 0 H ASP A 33 6.201 -0.270 -1.544 1.00 0.00 H new ATOM 0 HA ASP A 33 8.586 0.107 -3.208 1.00 0.00 H new ATOM 0 HB2 ASP A 33 6.900 1.223 -4.732 1.00 0.00 H new ATOM 0 HB3 ASP A 33 6.477 -0.425 -4.312 1.00 0.00 H new ATOM 50 N ALA A 34 7.999 2.340 -1.153 1.00 0.00 N ATOM 51 CA ALA A 34 8.316 3.727 -0.723 1.00 0.00 C ATOM 52 C ALA A 34 9.822 3.861 -0.433 1.00 0.00 C ATOM 53 O ALA A 34 10.283 4.904 -0.008 1.00 0.00 O ATOM 54 CB ALA A 34 7.522 4.056 0.539 1.00 0.00 C ATOM 0 H ALA A 34 7.788 1.690 -0.396 1.00 0.00 H new ATOM 0 HA ALA A 34 8.047 4.420 -1.520 1.00 0.00 H new ATOM 0 HB1 ALA A 34 7.751 5.073 0.858 1.00 0.00 H new ATOM 0 HB2 ALA A 34 6.455 3.973 0.330 1.00 0.00 H new ATOM 0 HB3 ALA A 34 7.792 3.357 1.331 1.00 0.00 H new ATOM 60 N GLU A 35 10.592 2.818 -0.657 1.00 0.00 N ATOM 61 CA GLU A 35 12.060 2.887 -0.392 1.00 0.00 C ATOM 62 C GLU A 35 12.800 3.593 -1.551 1.00 0.00 C ATOM 63 O GLU A 35 13.661 4.411 -1.295 1.00 0.00 O ATOM 64 CB GLU A 35 12.625 1.473 -0.202 1.00 0.00 C ATOM 65 CG GLU A 35 11.830 0.738 0.884 1.00 0.00 C ATOM 66 CD GLU A 35 12.560 0.858 2.224 1.00 0.00 C ATOM 67 OE1 GLU A 35 13.003 1.950 2.538 1.00 0.00 O ATOM 68 OE2 GLU A 35 12.661 -0.145 2.912 1.00 0.00 O ATOM 0 H GLU A 35 10.261 1.921 -1.013 1.00 0.00 H new ATOM 0 HA GLU A 35 12.214 3.466 0.519 1.00 0.00 H new ATOM 0 HB2 GLU A 35 12.572 0.921 -1.141 1.00 0.00 H new ATOM 0 HB3 GLU A 35 13.677 1.526 0.078 1.00 0.00 H new ATOM 0 HG2 GLU A 35 10.829 1.161 0.965 1.00 0.00 H new ATOM 0 HG3 GLU A 35 11.712 -0.312 0.615 1.00 0.00 H new ATOM 75 N PRO A 36 12.466 3.276 -2.795 1.00 0.00 N ATOM 76 CA PRO A 36 13.121 3.896 -3.993 1.00 0.00 C ATOM 77 C PRO A 36 12.467 5.238 -4.336 1.00 0.00 C ATOM 78 O PRO A 36 13.138 6.200 -4.651 1.00 0.00 O ATOM 79 CB PRO A 36 12.878 2.876 -5.099 1.00 0.00 C ATOM 80 CG PRO A 36 11.654 2.071 -4.710 1.00 0.00 C ATOM 81 CD PRO A 36 11.410 2.283 -3.216 1.00 0.00 C ATOM 0 HA PRO A 36 14.178 4.110 -3.837 1.00 0.00 H new ATOM 0 HB2 PRO A 36 12.721 3.376 -6.055 1.00 0.00 H new ATOM 0 HB3 PRO A 36 13.744 2.225 -5.218 1.00 0.00 H new ATOM 0 HG2 PRO A 36 10.787 2.391 -5.288 1.00 0.00 H new ATOM 0 HG3 PRO A 36 11.808 1.014 -4.926 1.00 0.00 H new ATOM 0 HD2 PRO A 36 10.407 2.667 -3.029 1.00 0.00 H new ATOM 0 HD3 PRO A 36 11.502 1.348 -2.663 1.00 0.00 H new ATOM 89 N HIS A 37 11.154 5.299 -4.285 1.00 0.00 N ATOM 90 CA HIS A 37 10.406 6.564 -4.609 1.00 0.00 C ATOM 91 C HIS A 37 10.337 6.794 -6.130 1.00 0.00 C ATOM 92 O HIS A 37 9.689 7.718 -6.584 1.00 0.00 O ATOM 93 CB HIS A 37 11.062 7.780 -3.934 1.00 0.00 C ATOM 94 CG HIS A 37 10.007 8.800 -3.599 1.00 0.00 C ATOM 95 ND1 HIS A 37 9.189 8.678 -2.488 1.00 0.00 N ATOM 96 CD2 HIS A 37 9.629 9.965 -4.219 1.00 0.00 C ATOM 97 CE1 HIS A 37 8.365 9.743 -2.473 1.00 0.00 C ATOM 98 NE2 HIS A 37 8.591 10.559 -3.506 1.00 0.00 N ATOM 0 H HIS A 37 10.558 4.512 -4.028 1.00 0.00 H new ATOM 0 HA HIS A 37 9.393 6.449 -4.224 1.00 0.00 H new ATOM 0 HB2 HIS A 37 11.583 7.469 -3.028 1.00 0.00 H new ATOM 0 HB3 HIS A 37 11.809 8.218 -4.597 1.00 0.00 H new ATOM 0 HD2 HIS A 37 10.070 10.361 -5.122 1.00 0.00 H new ATOM 0 HE1 HIS A 37 7.613 9.916 -1.718 1.00 0.00 H new ATOM 0 HE2 HIS A 37 8.107 11.430 -3.725 1.00 0.00 H new ATOM 106 N TYR A 38 10.980 5.965 -6.922 1.00 0.00 N ATOM 107 CA TYR A 38 10.925 6.143 -8.405 1.00 0.00 C ATOM 108 C TYR A 38 10.247 4.921 -9.031 1.00 0.00 C ATOM 109 O TYR A 38 9.576 5.021 -10.038 1.00 0.00 O ATOM 110 CB TYR A 38 12.342 6.299 -8.972 1.00 0.00 C ATOM 111 CG TYR A 38 13.249 5.218 -8.428 1.00 0.00 C ATOM 112 CD1 TYR A 38 13.355 3.991 -9.094 1.00 0.00 C ATOM 113 CD2 TYR A 38 13.988 5.448 -7.261 1.00 0.00 C ATOM 114 CE1 TYR A 38 14.201 2.994 -8.591 1.00 0.00 C ATOM 115 CE2 TYR A 38 14.832 4.450 -6.759 1.00 0.00 C ATOM 116 CZ TYR A 38 14.939 3.224 -7.425 1.00 0.00 C ATOM 117 OH TYR A 38 15.773 2.240 -6.931 1.00 0.00 O ATOM 0 H TYR A 38 11.539 5.174 -6.602 1.00 0.00 H new ATOM 0 HA TYR A 38 10.355 7.041 -8.641 1.00 0.00 H new ATOM 0 HB2 TYR A 38 12.313 6.245 -10.060 1.00 0.00 H new ATOM 0 HB3 TYR A 38 12.739 7.280 -8.712 1.00 0.00 H new ATOM 0 HD1 TYR A 38 12.785 3.813 -9.994 1.00 0.00 H new ATOM 0 HD2 TYR A 38 13.907 6.395 -6.748 1.00 0.00 H new ATOM 0 HE1 TYR A 38 14.284 2.047 -9.104 1.00 0.00 H new ATOM 0 HE2 TYR A 38 15.400 4.626 -5.858 1.00 0.00 H new ATOM 0 HH TYR A 38 16.212 2.562 -6.116 1.00 0.00 H new ATOM 127 N LEU A 39 10.410 3.769 -8.430 1.00 0.00 N ATOM 128 CA LEU A 39 9.775 2.529 -8.965 1.00 0.00 C ATOM 129 C LEU A 39 8.248 2.715 -9.104 1.00 0.00 C ATOM 130 O LEU A 39 7.702 2.438 -10.156 1.00 0.00 O ATOM 131 CB LEU A 39 10.073 1.360 -8.010 1.00 0.00 C ATOM 132 CG LEU A 39 10.808 0.231 -8.757 1.00 0.00 C ATOM 133 CD1 LEU A 39 9.972 -0.248 -9.953 1.00 0.00 C ATOM 134 CD2 LEU A 39 12.165 0.745 -9.253 1.00 0.00 C ATOM 0 H LEU A 39 10.962 3.635 -7.583 1.00 0.00 H new ATOM 0 HA LEU A 39 10.185 2.316 -9.952 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.682 1.709 -7.176 1.00 0.00 H new ATOM 0 HB3 LEU A 39 9.142 0.980 -7.588 1.00 0.00 H new ATOM 0 HG LEU A 39 10.959 -0.605 -8.074 1.00 0.00 H new ATOM 0 HD11 LEU A 39 10.503 -1.046 -10.472 1.00 0.00 H new ATOM 0 HD12 LEU A 39 9.011 -0.622 -9.599 1.00 0.00 H new ATOM 0 HD13 LEU A 39 9.807 0.584 -10.638 1.00 0.00 H new ATOM 0 HD21 LEU A 39 12.685 -0.054 -9.782 1.00 0.00 H new ATOM 0 HD22 LEU A 39 12.011 1.587 -9.928 1.00 0.00 H new ATOM 0 HD23 LEU A 39 12.765 1.068 -8.402 1.00 0.00 H new ATOM 146 N PRO A 40 7.584 3.177 -8.055 1.00 0.00 N ATOM 147 CA PRO A 40 6.100 3.397 -8.076 1.00 0.00 C ATOM 148 C PRO A 40 5.741 4.617 -8.935 1.00 0.00 C ATOM 149 O PRO A 40 4.604 4.786 -9.340 1.00 0.00 O ATOM 150 CB PRO A 40 5.735 3.602 -6.613 1.00 0.00 C ATOM 151 CG PRO A 40 6.988 4.061 -5.903 1.00 0.00 C ATOM 152 CD PRO A 40 8.180 3.559 -6.717 1.00 0.00 C ATOM 0 HA PRO A 40 5.552 2.565 -8.518 1.00 0.00 H new ATOM 0 HB2 PRO A 40 4.942 4.344 -6.514 1.00 0.00 H new ATOM 0 HB3 PRO A 40 5.362 2.676 -6.176 1.00 0.00 H new ATOM 0 HG2 PRO A 40 7.008 5.148 -5.822 1.00 0.00 H new ATOM 0 HG3 PRO A 40 7.022 3.665 -4.888 1.00 0.00 H new ATOM 0 HD2 PRO A 40 8.941 4.332 -6.826 1.00 0.00 H new ATOM 0 HD3 PRO A 40 8.659 2.706 -6.237 1.00 0.00 H new ATOM 160 N GLN A 41 6.703 5.453 -9.236 1.00 0.00 N ATOM 161 CA GLN A 41 6.426 6.640 -10.091 1.00 0.00 C ATOM 162 C GLN A 41 6.354 6.176 -11.549 1.00 0.00 C ATOM 163 O GLN A 41 5.627 6.729 -12.357 1.00 0.00 O ATOM 164 CB GLN A 41 7.563 7.657 -9.923 1.00 0.00 C ATOM 165 CG GLN A 41 7.309 8.883 -10.804 1.00 0.00 C ATOM 166 CD GLN A 41 6.069 9.626 -10.304 1.00 0.00 C ATOM 167 OE1 GLN A 41 5.840 9.718 -9.114 1.00 0.00 O ATOM 168 NE2 GLN A 41 5.252 10.163 -11.168 1.00 0.00 N ATOM 0 H GLN A 41 7.670 5.361 -8.924 1.00 0.00 H new ATOM 0 HA GLN A 41 5.484 7.108 -9.804 1.00 0.00 H new ATOM 0 HB2 GLN A 41 7.639 7.960 -8.879 1.00 0.00 H new ATOM 0 HB3 GLN A 41 8.514 7.198 -10.192 1.00 0.00 H new ATOM 0 HG2 GLN A 41 8.175 9.545 -10.783 1.00 0.00 H new ATOM 0 HG3 GLN A 41 7.168 8.576 -11.840 1.00 0.00 H new ATOM 0 HE21 GLN A 41 5.443 10.086 -12.167 1.00 0.00 H new ATOM 0 HE22 GLN A 41 4.422 10.660 -10.845 1.00 0.00 H new ATOM 177 N LEU A 42 7.112 5.166 -11.889 1.00 0.00 N ATOM 178 CA LEU A 42 7.114 4.660 -13.282 1.00 0.00 C ATOM 179 C LEU A 42 5.869 3.806 -13.517 1.00 0.00 C ATOM 180 O LEU A 42 5.239 3.888 -14.554 1.00 0.00 O ATOM 181 CB LEU A 42 8.365 3.797 -13.513 1.00 0.00 C ATOM 182 CG LEU A 42 9.706 4.597 -13.432 1.00 0.00 C ATOM 183 CD1 LEU A 42 9.530 6.065 -12.998 1.00 0.00 C ATOM 184 CD2 LEU A 42 10.639 3.906 -12.431 1.00 0.00 C ATOM 0 H LEU A 42 7.734 4.670 -11.251 1.00 0.00 H new ATOM 0 HA LEU A 42 7.117 5.504 -13.971 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.385 2.997 -12.773 1.00 0.00 H new ATOM 0 HB3 LEU A 42 8.293 3.324 -14.492 1.00 0.00 H new ATOM 0 HG LEU A 42 10.121 4.608 -14.440 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.504 6.554 -12.965 1.00 0.00 H new ATOM 0 HD12 LEU A 42 8.889 6.581 -13.712 1.00 0.00 H new ATOM 0 HD13 LEU A 42 9.073 6.100 -12.009 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.577 4.457 -12.368 1.00 0.00 H new ATOM 0 HD22 LEU A 42 10.166 3.882 -11.449 1.00 0.00 H new ATOM 0 HD23 LEU A 42 10.838 2.887 -12.763 1.00 0.00 H new ATOM 196 N ARG A 43 5.508 2.978 -12.563 1.00 0.00 N ATOM 197 CA ARG A 43 4.302 2.119 -12.740 1.00 0.00 C ATOM 198 C ARG A 43 3.071 3.012 -12.893 1.00 0.00 C ATOM 199 O ARG A 43 2.239 2.793 -13.757 1.00 0.00 O ATOM 200 CB ARG A 43 4.143 1.180 -11.535 1.00 0.00 C ATOM 201 CG ARG A 43 3.798 1.964 -10.264 1.00 0.00 C ATOM 202 CD ARG A 43 3.744 1.005 -9.074 1.00 0.00 C ATOM 203 NE ARG A 43 3.041 1.669 -7.933 1.00 0.00 N ATOM 204 CZ ARG A 43 3.149 1.214 -6.700 1.00 0.00 C ATOM 205 NH1 ARG A 43 3.877 0.157 -6.416 1.00 0.00 N ATOM 206 NH2 ARG A 43 2.517 1.827 -5.737 1.00 0.00 N ATOM 0 H ARG A 43 5.997 2.863 -11.675 1.00 0.00 H new ATOM 0 HA ARG A 43 4.414 1.507 -13.635 1.00 0.00 H new ATOM 0 HB2 ARG A 43 3.359 0.451 -11.740 1.00 0.00 H new ATOM 0 HB3 ARG A 43 5.066 0.621 -11.382 1.00 0.00 H new ATOM 0 HG2 ARG A 43 4.544 2.738 -10.087 1.00 0.00 H new ATOM 0 HG3 ARG A 43 2.839 2.467 -10.383 1.00 0.00 H new ATOM 0 HD2 ARG A 43 3.223 0.090 -9.354 1.00 0.00 H new ATOM 0 HD3 ARG A 43 4.753 0.719 -8.777 1.00 0.00 H new ATOM 0 HE ARG A 43 2.465 2.492 -8.113 1.00 0.00 H new ATOM 0 HH11 ARG A 43 4.376 -0.333 -7.158 1.00 0.00 H new ATOM 0 HH12 ARG A 43 3.943 -0.173 -5.453 1.00 0.00 H new ATOM 0 HH21 ARG A 43 1.948 2.648 -5.942 1.00 0.00 H new ATOM 0 HH22 ARG A 43 2.592 1.485 -4.779 1.00 0.00 H new ATOM 220 N LYS A 44 2.953 4.030 -12.072 1.00 0.00 N ATOM 221 CA LYS A 44 1.788 4.932 -12.194 1.00 0.00 C ATOM 222 C LYS A 44 1.869 5.640 -13.550 1.00 0.00 C ATOM 223 O LYS A 44 0.865 5.942 -14.162 1.00 0.00 O ATOM 224 CB LYS A 44 1.782 5.949 -11.041 1.00 0.00 C ATOM 225 CG LYS A 44 2.973 6.905 -11.155 1.00 0.00 C ATOM 226 CD LYS A 44 2.881 7.974 -10.061 1.00 0.00 C ATOM 227 CE LYS A 44 3.155 7.342 -8.692 1.00 0.00 C ATOM 228 NZ LYS A 44 2.202 7.898 -7.690 1.00 0.00 N ATOM 0 H LYS A 44 3.614 4.265 -11.331 1.00 0.00 H new ATOM 0 HA LYS A 44 0.860 4.363 -12.136 1.00 0.00 H new ATOM 0 HB2 LYS A 44 0.851 6.516 -11.055 1.00 0.00 H new ATOM 0 HB3 LYS A 44 1.821 5.424 -10.087 1.00 0.00 H new ATOM 0 HG2 LYS A 44 3.907 6.351 -11.059 1.00 0.00 H new ATOM 0 HG3 LYS A 44 2.981 7.376 -12.138 1.00 0.00 H new ATOM 0 HD2 LYS A 44 3.601 8.769 -10.255 1.00 0.00 H new ATOM 0 HD3 LYS A 44 1.892 8.431 -10.069 1.00 0.00 H new ATOM 0 HE2 LYS A 44 3.047 6.259 -8.751 1.00 0.00 H new ATOM 0 HE3 LYS A 44 4.181 7.544 -8.385 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 2.387 7.470 -6.760 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 2.326 8.929 -7.627 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 1.227 7.684 -7.982 1.00 0.00 H new ATOM 242 N ASP A 45 3.069 5.884 -14.027 1.00 0.00 N ATOM 243 CA ASP A 45 3.227 6.547 -15.344 1.00 0.00 C ATOM 244 C ASP A 45 2.667 5.631 -16.434 1.00 0.00 C ATOM 245 O ASP A 45 1.919 6.066 -17.283 1.00 0.00 O ATOM 246 CB ASP A 45 4.707 6.818 -15.613 1.00 0.00 C ATOM 247 CG ASP A 45 5.182 7.992 -14.753 1.00 0.00 C ATOM 248 OD1 ASP A 45 4.381 8.873 -14.488 1.00 0.00 O ATOM 249 OD2 ASP A 45 6.343 7.992 -14.378 1.00 0.00 O ATOM 0 H ASP A 45 3.941 5.649 -13.553 1.00 0.00 H new ATOM 0 HA ASP A 45 2.687 7.494 -15.344 1.00 0.00 H new ATOM 0 HB2 ASP A 45 5.296 5.929 -15.388 1.00 0.00 H new ATOM 0 HB3 ASP A 45 4.859 7.043 -16.669 1.00 0.00 H new ATOM 254 N ILE A 46 3.017 4.360 -16.415 1.00 0.00 N ATOM 255 CA ILE A 46 2.491 3.423 -17.459 1.00 0.00 C ATOM 256 C ILE A 46 0.956 3.404 -17.396 1.00 0.00 C ATOM 257 O ILE A 46 0.290 3.203 -18.394 1.00 0.00 O ATOM 258 CB ILE A 46 3.088 2.009 -17.264 1.00 0.00 C ATOM 259 CG1 ILE A 46 2.785 1.168 -18.509 1.00 0.00 C ATOM 260 CG2 ILE A 46 2.524 1.305 -16.017 1.00 0.00 C ATOM 261 CD1 ILE A 46 3.516 -0.175 -18.418 1.00 0.00 C ATOM 0 H ILE A 46 3.639 3.938 -15.726 1.00 0.00 H new ATOM 0 HA ILE A 46 2.791 3.768 -18.449 1.00 0.00 H new ATOM 0 HB ILE A 46 4.163 2.113 -17.119 1.00 0.00 H new ATOM 0 HG12 ILE A 46 1.711 1.003 -18.595 1.00 0.00 H new ATOM 0 HG13 ILE A 46 3.098 1.703 -19.406 1.00 0.00 H new ATOM 0 HG21 ILE A 46 2.973 0.316 -15.923 1.00 0.00 H new ATOM 0 HG22 ILE A 46 2.756 1.895 -15.130 1.00 0.00 H new ATOM 0 HG23 ILE A 46 1.443 1.205 -16.114 1.00 0.00 H new ATOM 0 HD11 ILE A 46 3.297 -0.769 -19.305 1.00 0.00 H new ATOM 0 HD12 ILE A 46 4.590 -0.001 -18.353 1.00 0.00 H new ATOM 0 HD13 ILE A 46 3.181 -0.712 -17.530 1.00 0.00 H new ATOM 273 N LEU A 47 0.394 3.642 -16.231 1.00 0.00 N ATOM 274 CA LEU A 47 -1.086 3.668 -16.105 1.00 0.00 C ATOM 275 C LEU A 47 -1.607 4.881 -16.874 1.00 0.00 C ATOM 276 O LEU A 47 -2.518 4.779 -17.676 1.00 0.00 O ATOM 277 CB LEU A 47 -1.476 3.789 -14.630 1.00 0.00 C ATOM 278 CG LEU A 47 -1.396 2.416 -13.961 1.00 0.00 C ATOM 279 CD1 LEU A 47 -1.401 2.587 -12.441 1.00 0.00 C ATOM 280 CD2 LEU A 47 -2.602 1.575 -14.383 1.00 0.00 C ATOM 0 H LEU A 47 0.905 3.819 -15.366 1.00 0.00 H new ATOM 0 HA LEU A 47 -1.515 2.751 -16.508 1.00 0.00 H new ATOM 0 HB2 LEU A 47 -0.811 4.490 -14.125 1.00 0.00 H new ATOM 0 HB3 LEU A 47 -2.486 4.188 -14.543 1.00 0.00 H new ATOM 0 HG LEU A 47 -0.477 1.915 -14.266 1.00 0.00 H new ATOM 0 HD11 LEU A 47 -1.344 1.608 -11.965 1.00 0.00 H new ATOM 0 HD12 LEU A 47 -0.543 3.188 -12.140 1.00 0.00 H new ATOM 0 HD13 LEU A 47 -2.320 3.087 -12.134 1.00 0.00 H new ATOM 0 HD21 LEU A 47 -2.547 0.596 -13.907 1.00 0.00 H new ATOM 0 HD22 LEU A 47 -3.520 2.076 -14.077 1.00 0.00 H new ATOM 0 HD23 LEU A 47 -2.599 1.453 -15.466 1.00 0.00 H new ATOM 292 N GLU A 48 -1.008 6.025 -16.652 1.00 0.00 N ATOM 293 CA GLU A 48 -1.435 7.250 -17.382 1.00 0.00 C ATOM 294 C GLU A 48 -1.087 7.065 -18.845 1.00 0.00 C ATOM 295 O GLU A 48 -1.822 7.462 -19.728 1.00 0.00 O ATOM 296 CB GLU A 48 -0.691 8.483 -16.867 1.00 0.00 C ATOM 297 CG GLU A 48 -0.740 8.540 -15.345 1.00 0.00 C ATOM 298 CD GLU A 48 -2.191 8.680 -14.875 1.00 0.00 C ATOM 299 OE1 GLU A 48 -2.792 9.701 -15.169 1.00 0.00 O ATOM 300 OE2 GLU A 48 -2.675 7.765 -14.230 1.00 0.00 O ATOM 0 H GLU A 48 -0.240 6.160 -15.994 1.00 0.00 H new ATOM 0 HA GLU A 48 -2.505 7.398 -17.234 1.00 0.00 H new ATOM 0 HB2 GLU A 48 0.346 8.456 -17.202 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -1.138 9.385 -17.285 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -0.298 7.637 -14.924 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -0.149 9.382 -14.985 1.00 0.00 H new ATOM 307 N VAL A 49 0.042 6.452 -19.104 1.00 0.00 N ATOM 308 CA VAL A 49 0.461 6.222 -20.508 1.00 0.00 C ATOM 309 C VAL A 49 -0.621 5.387 -21.202 1.00 0.00 C ATOM 310 O VAL A 49 -1.168 5.785 -22.207 1.00 0.00 O ATOM 311 CB VAL A 49 1.809 5.487 -20.541 1.00 0.00 C ATOM 312 CG1 VAL A 49 2.241 5.253 -21.994 1.00 0.00 C ATOM 313 CG2 VAL A 49 2.873 6.335 -19.830 1.00 0.00 C ATOM 0 H VAL A 49 0.689 6.103 -18.397 1.00 0.00 H new ATOM 0 HA VAL A 49 0.582 7.174 -21.026 1.00 0.00 H new ATOM 0 HB VAL A 49 1.703 4.527 -20.035 1.00 0.00 H new ATOM 0 HG11 VAL A 49 3.198 4.731 -22.010 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.490 4.649 -22.504 1.00 0.00 H new ATOM 0 HG13 VAL A 49 2.342 6.212 -22.502 1.00 0.00 H new ATOM 0 HG21 VAL A 49 3.830 5.813 -19.854 1.00 0.00 H new ATOM 0 HG22 VAL A 49 2.971 7.295 -20.336 1.00 0.00 H new ATOM 0 HG23 VAL A 49 2.575 6.500 -18.795 1.00 0.00 H new ATOM 323 N ILE A 50 -0.967 4.251 -20.640 1.00 0.00 N ATOM 324 CA ILE A 50 -2.050 3.414 -21.248 1.00 0.00 C ATOM 325 C ILE A 50 -3.328 4.260 -21.363 1.00 0.00 C ATOM 326 O ILE A 50 -4.182 3.997 -22.186 1.00 0.00 O ATOM 327 CB ILE A 50 -2.310 2.184 -20.372 1.00 0.00 C ATOM 328 CG1 ILE A 50 -1.010 1.391 -20.211 1.00 0.00 C ATOM 329 CG2 ILE A 50 -3.364 1.292 -21.034 1.00 0.00 C ATOM 330 CD1 ILE A 50 -0.998 0.699 -18.847 1.00 0.00 C ATOM 0 H ILE A 50 -0.548 3.870 -19.792 1.00 0.00 H new ATOM 0 HA ILE A 50 -1.745 3.078 -22.239 1.00 0.00 H new ATOM 0 HB ILE A 50 -2.669 2.508 -19.395 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.922 0.651 -21.006 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -0.152 2.057 -20.300 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -3.546 0.418 -20.408 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -4.291 1.852 -21.154 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -3.006 0.970 -22.012 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -0.072 0.135 -18.733 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -1.065 1.448 -18.058 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.848 0.020 -18.776 1.00 0.00 H new ATOM 342 N CYS A 51 -3.448 5.286 -20.550 1.00 0.00 N ATOM 343 CA CYS A 51 -4.643 6.165 -20.618 1.00 0.00 C ATOM 344 C CYS A 51 -4.532 7.070 -21.851 1.00 0.00 C ATOM 345 O CYS A 51 -5.473 7.232 -22.600 1.00 0.00 O ATOM 346 CB CYS A 51 -4.713 7.026 -19.352 1.00 0.00 C ATOM 347 SG CYS A 51 -6.393 7.673 -19.156 1.00 0.00 S ATOM 0 H CYS A 51 -2.762 5.546 -19.842 1.00 0.00 H new ATOM 0 HA CYS A 51 -5.545 5.557 -20.692 1.00 0.00 H new ATOM 0 HB2 CYS A 51 -4.436 6.433 -18.480 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -4.000 7.848 -19.418 1.00 0.00 H new ATOM 0 HG CYS A 51 -6.455 8.402 -18.081 1.00 0.00 H new ATOM 353 N LYS A 52 -3.382 7.657 -22.069 1.00 0.00 N ATOM 354 CA LYS A 52 -3.200 8.558 -23.253 1.00 0.00 C ATOM 355 C LYS A 52 -3.517 7.799 -24.544 1.00 0.00 C ATOM 356 O LYS A 52 -3.989 8.367 -25.511 1.00 0.00 O ATOM 357 CB LYS A 52 -1.749 9.043 -23.330 1.00 0.00 C ATOM 358 CG LYS A 52 -1.347 9.751 -22.036 1.00 0.00 C ATOM 359 CD LYS A 52 0.177 9.699 -21.894 1.00 0.00 C ATOM 360 CE LYS A 52 0.787 10.985 -22.457 1.00 0.00 C ATOM 361 NZ LYS A 52 0.828 12.025 -21.391 1.00 0.00 N ATOM 0 H LYS A 52 -2.558 7.552 -21.477 1.00 0.00 H new ATOM 0 HA LYS A 52 -3.874 9.407 -23.140 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -1.086 8.196 -23.508 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -1.632 9.723 -24.174 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.689 10.786 -22.051 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -1.822 9.271 -21.180 1.00 0.00 H new ATOM 0 HD2 LYS A 52 0.451 9.583 -20.846 1.00 0.00 H new ATOM 0 HD3 LYS A 52 0.573 8.833 -22.425 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.793 10.790 -22.829 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.198 11.339 -23.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 1.243 12.899 -21.774 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 -0.138 12.218 -21.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 1.408 11.686 -20.597 1.00 0.00 H new ATOM 375 N TYR A 53 -3.239 6.523 -24.567 1.00 0.00 N ATOM 376 CA TYR A 53 -3.492 5.713 -25.784 1.00 0.00 C ATOM 377 C TYR A 53 -4.778 4.884 -25.614 1.00 0.00 C ATOM 378 O TYR A 53 -5.311 4.362 -26.574 1.00 0.00 O ATOM 379 CB TYR A 53 -2.312 4.758 -25.995 1.00 0.00 C ATOM 380 CG TYR A 53 -1.019 5.521 -26.222 1.00 0.00 C ATOM 381 CD1 TYR A 53 -0.470 6.305 -25.199 1.00 0.00 C ATOM 382 CD2 TYR A 53 -0.354 5.420 -27.450 1.00 0.00 C ATOM 383 CE1 TYR A 53 0.734 6.988 -25.400 1.00 0.00 C ATOM 384 CE2 TYR A 53 0.855 6.102 -27.650 1.00 0.00 C ATOM 385 CZ TYR A 53 1.397 6.886 -26.623 1.00 0.00 C ATOM 386 OH TYR A 53 2.587 7.555 -26.820 1.00 0.00 O ATOM 0 H TYR A 53 -2.843 6.005 -23.783 1.00 0.00 H new ATOM 0 HA TYR A 53 -3.605 6.378 -26.640 1.00 0.00 H new ATOM 0 HB2 TYR A 53 -2.206 4.109 -25.125 1.00 0.00 H new ATOM 0 HB3 TYR A 53 -2.512 4.113 -26.851 1.00 0.00 H new ATOM 0 HD1 TYR A 53 -0.979 6.382 -24.250 1.00 0.00 H new ATOM 0 HD2 TYR A 53 -0.772 4.817 -28.243 1.00 0.00 H new ATOM 0 HE1 TYR A 53 1.150 7.594 -24.609 1.00 0.00 H new ATOM 0 HE2 TYR A 53 1.369 6.023 -28.597 1.00 0.00 H new ATOM 0 HH TYR A 53 2.917 7.376 -27.725 1.00 0.00 H new ATOM 396 N VAL A 54 -5.274 4.742 -24.401 1.00 0.00 N ATOM 397 CA VAL A 54 -6.514 3.927 -24.176 1.00 0.00 C ATOM 398 C VAL A 54 -7.252 4.490 -22.937 1.00 0.00 C ATOM 399 O VAL A 54 -7.344 5.691 -22.781 1.00 0.00 O ATOM 400 CB VAL A 54 -6.147 2.435 -23.968 1.00 0.00 C ATOM 401 CG1 VAL A 54 -7.349 1.564 -24.340 1.00 0.00 C ATOM 402 CG2 VAL A 54 -4.959 2.027 -24.851 1.00 0.00 C ATOM 0 H VAL A 54 -4.872 5.156 -23.560 1.00 0.00 H new ATOM 0 HA VAL A 54 -7.165 3.989 -25.048 1.00 0.00 H new ATOM 0 HB VAL A 54 -5.874 2.295 -22.922 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -7.096 0.514 -24.195 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -8.197 1.824 -23.706 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -7.612 1.733 -25.384 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -4.725 0.976 -24.683 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -5.216 2.179 -25.899 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.091 2.637 -24.598 1.00 0.00 H new ATOM 412 N GLN A 55 -7.785 3.659 -22.057 1.00 0.00 N ATOM 413 CA GLN A 55 -8.495 4.196 -20.858 1.00 0.00 C ATOM 414 C GLN A 55 -8.807 3.050 -19.895 1.00 0.00 C ATOM 415 O GLN A 55 -9.674 2.232 -20.141 1.00 0.00 O ATOM 416 CB GLN A 55 -9.794 4.878 -21.298 1.00 0.00 C ATOM 417 CG GLN A 55 -9.812 6.327 -20.806 1.00 0.00 C ATOM 418 CD GLN A 55 -11.252 6.844 -20.785 1.00 0.00 C ATOM 419 OE1 GLN A 55 -11.910 6.883 -21.806 1.00 0.00 O ATOM 420 NE2 GLN A 55 -11.772 7.245 -19.658 1.00 0.00 N ATOM 0 H GLN A 55 -7.755 2.642 -22.124 1.00 0.00 H new ATOM 0 HA GLN A 55 -7.862 4.925 -20.352 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -9.879 4.852 -22.384 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -10.652 4.338 -20.898 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -9.378 6.388 -19.808 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -9.200 6.951 -21.458 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -11.220 7.212 -18.801 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -12.731 7.591 -19.634 1.00 0.00 H new ATOM 429 N ILE A 56 -8.100 2.991 -18.801 1.00 0.00 N ATOM 430 CA ILE A 56 -8.328 1.905 -17.800 1.00 0.00 C ATOM 431 C ILE A 56 -8.211 2.484 -16.391 1.00 0.00 C ATOM 432 O ILE A 56 -7.755 3.596 -16.204 1.00 0.00 O ATOM 433 CB ILE A 56 -7.286 0.793 -17.979 1.00 0.00 C ATOM 434 CG1 ILE A 56 -5.909 1.401 -18.292 1.00 0.00 C ATOM 435 CG2 ILE A 56 -7.715 -0.120 -19.125 1.00 0.00 C ATOM 436 CD1 ILE A 56 -4.826 0.651 -17.515 1.00 0.00 C ATOM 0 H ILE A 56 -7.366 3.654 -18.553 1.00 0.00 H new ATOM 0 HA ILE A 56 -9.324 1.487 -17.949 1.00 0.00 H new ATOM 0 HB ILE A 56 -7.215 0.218 -17.056 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.709 1.342 -19.362 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -5.897 2.457 -18.023 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.977 -0.912 -19.255 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -8.684 -0.562 -18.895 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -7.790 0.461 -20.044 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -3.851 1.084 -17.739 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -5.022 0.733 -16.446 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -4.831 -0.400 -17.805 1.00 0.00 H new ATOM 448 N ASP A 57 -8.612 1.732 -15.401 1.00 0.00 N ATOM 449 CA ASP A 57 -8.522 2.223 -13.997 1.00 0.00 C ATOM 450 C ASP A 57 -7.306 1.576 -13.320 1.00 0.00 C ATOM 451 O ASP A 57 -6.785 0.599 -13.820 1.00 0.00 O ATOM 452 CB ASP A 57 -9.794 1.837 -13.239 1.00 0.00 C ATOM 453 CG ASP A 57 -10.860 2.915 -13.448 1.00 0.00 C ATOM 454 OD1 ASP A 57 -10.856 3.877 -12.696 1.00 0.00 O ATOM 455 OD2 ASP A 57 -11.661 2.760 -14.354 1.00 0.00 O ATOM 0 H ASP A 57 -9.000 0.794 -15.506 1.00 0.00 H new ATOM 0 HA ASP A 57 -8.415 3.308 -13.991 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -10.162 0.874 -13.592 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -9.577 1.726 -12.177 1.00 0.00 H new ATOM 460 N PRO A 58 -6.878 2.122 -12.200 1.00 0.00 N ATOM 461 CA PRO A 58 -5.704 1.588 -11.438 1.00 0.00 C ATOM 462 C PRO A 58 -6.092 0.292 -10.732 1.00 0.00 C ATOM 463 O PRO A 58 -5.272 -0.586 -10.538 1.00 0.00 O ATOM 464 CB PRO A 58 -5.370 2.696 -10.451 1.00 0.00 C ATOM 465 CG PRO A 58 -6.633 3.511 -10.259 1.00 0.00 C ATOM 466 CD PRO A 58 -7.485 3.326 -11.517 1.00 0.00 C ATOM 0 HA PRO A 58 -4.849 1.342 -12.068 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -5.032 2.279 -9.502 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -4.562 3.321 -10.831 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -7.175 3.178 -9.374 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -6.393 4.563 -10.108 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -8.532 3.157 -11.268 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -7.448 4.208 -12.157 1.00 0.00 H new ATOM 474 N GLU A 59 -7.345 0.151 -10.382 1.00 0.00 N ATOM 475 CA GLU A 59 -7.800 -1.106 -9.727 1.00 0.00 C ATOM 476 C GLU A 59 -7.745 -2.257 -10.747 1.00 0.00 C ATOM 477 O GLU A 59 -7.839 -3.415 -10.386 1.00 0.00 O ATOM 478 CB GLU A 59 -9.236 -0.933 -9.229 1.00 0.00 C ATOM 479 CG GLU A 59 -9.232 -0.122 -7.931 1.00 0.00 C ATOM 480 CD GLU A 59 -10.425 -0.535 -7.068 1.00 0.00 C ATOM 481 OE1 GLU A 59 -10.561 -1.718 -6.806 1.00 0.00 O ATOM 482 OE2 GLU A 59 -11.183 0.340 -6.683 1.00 0.00 O ATOM 0 H GLU A 59 -8.071 0.854 -10.523 1.00 0.00 H new ATOM 0 HA GLU A 59 -7.150 -1.334 -8.882 1.00 0.00 H new ATOM 0 HB2 GLU A 59 -9.836 -0.426 -9.985 1.00 0.00 H new ATOM 0 HB3 GLU A 59 -9.693 -1.908 -9.060 1.00 0.00 H new ATOM 0 HG2 GLU A 59 -8.302 -0.289 -7.388 1.00 0.00 H new ATOM 0 HG3 GLU A 59 -9.283 0.943 -8.155 1.00 0.00 H new ATOM 489 N MET A 60 -7.589 -1.948 -12.021 1.00 0.00 N ATOM 490 CA MET A 60 -7.523 -3.017 -13.056 1.00 0.00 C ATOM 491 C MET A 60 -6.065 -3.434 -13.296 1.00 0.00 C ATOM 492 O MET A 60 -5.802 -4.431 -13.943 1.00 0.00 O ATOM 493 CB MET A 60 -8.117 -2.477 -14.363 1.00 0.00 C ATOM 494 CG MET A 60 -9.650 -2.544 -14.305 1.00 0.00 C ATOM 495 SD MET A 60 -10.247 -3.950 -15.278 1.00 0.00 S ATOM 496 CE MET A 60 -10.105 -3.172 -16.907 1.00 0.00 C ATOM 0 H MET A 60 -7.505 -0.997 -12.379 1.00 0.00 H new ATOM 0 HA MET A 60 -8.087 -3.885 -12.715 1.00 0.00 H new ATOM 0 HB2 MET A 60 -7.795 -1.448 -14.522 1.00 0.00 H new ATOM 0 HB3 MET A 60 -7.750 -3.060 -15.208 1.00 0.00 H new ATOM 0 HG2 MET A 60 -9.979 -2.642 -13.270 1.00 0.00 H new ATOM 0 HG3 MET A 60 -10.077 -1.618 -14.689 1.00 0.00 H new ATOM 0 HE1 MET A 60 -9.971 -3.941 -17.667 1.00 0.00 H new ATOM 0 HE2 MET A 60 -11.012 -2.606 -17.120 1.00 0.00 H new ATOM 0 HE3 MET A 60 -9.247 -2.500 -16.916 1.00 0.00 H new ATOM 506 N VAL A 61 -5.113 -2.680 -12.791 1.00 0.00 N ATOM 507 CA VAL A 61 -3.681 -3.036 -13.003 1.00 0.00 C ATOM 508 C VAL A 61 -3.068 -3.535 -11.688 1.00 0.00 C ATOM 509 O VAL A 61 -3.129 -2.867 -10.674 1.00 0.00 O ATOM 510 CB VAL A 61 -2.927 -1.792 -13.488 1.00 0.00 C ATOM 511 CG1 VAL A 61 -1.471 -2.150 -13.798 1.00 0.00 C ATOM 512 CG2 VAL A 61 -3.598 -1.257 -14.756 1.00 0.00 C ATOM 0 H VAL A 61 -5.272 -1.835 -12.242 1.00 0.00 H new ATOM 0 HA VAL A 61 -3.605 -3.827 -13.749 1.00 0.00 H new ATOM 0 HB VAL A 61 -2.950 -1.032 -12.707 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -0.943 -1.261 -14.142 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -0.990 -2.532 -12.897 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -1.442 -2.913 -14.576 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -3.065 -0.372 -15.104 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -3.575 -2.023 -15.531 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -4.633 -0.994 -14.537 1.00 0.00 H new ATOM 522 N THR A 62 -2.479 -4.707 -11.702 1.00 0.00 N ATOM 523 CA THR A 62 -1.861 -5.259 -10.463 1.00 0.00 C ATOM 524 C THR A 62 -0.393 -4.839 -10.384 1.00 0.00 C ATOM 525 O THR A 62 0.233 -4.538 -11.383 1.00 0.00 O ATOM 526 CB THR A 62 -1.938 -6.788 -10.477 1.00 0.00 C ATOM 527 OG1 THR A 62 -3.208 -7.196 -10.965 1.00 0.00 O ATOM 528 CG2 THR A 62 -1.735 -7.322 -9.058 1.00 0.00 C ATOM 0 H THR A 62 -2.401 -5.305 -12.525 1.00 0.00 H new ATOM 0 HA THR A 62 -2.403 -4.872 -9.600 1.00 0.00 H new ATOM 0 HB THR A 62 -1.159 -7.185 -11.127 1.00 0.00 H new ATOM 0 HG1 THR A 62 -3.256 -8.175 -10.975 1.00 0.00 H new ATOM 0 HG21 THR A 62 -1.790 -8.411 -9.068 1.00 0.00 H new ATOM 0 HG22 THR A 62 -0.758 -7.011 -8.689 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.513 -6.925 -8.405 1.00 0.00 H new ATOM 536 N VAL A 63 0.157 -4.833 -9.200 1.00 0.00 N ATOM 537 CA VAL A 63 1.586 -4.451 -9.029 1.00 0.00 C ATOM 538 C VAL A 63 2.198 -5.330 -7.940 1.00 0.00 C ATOM 539 O VAL A 63 1.714 -5.374 -6.824 1.00 0.00 O ATOM 540 CB VAL A 63 1.674 -2.986 -8.613 1.00 0.00 C ATOM 541 CG1 VAL A 63 3.141 -2.552 -8.568 1.00 0.00 C ATOM 542 CG2 VAL A 63 0.920 -2.125 -9.624 1.00 0.00 C ATOM 0 H VAL A 63 -0.328 -5.079 -8.337 1.00 0.00 H new ATOM 0 HA VAL A 63 2.125 -4.589 -9.966 1.00 0.00 H new ATOM 0 HB VAL A 63 1.230 -2.863 -7.625 1.00 0.00 H new ATOM 0 HG11 VAL A 63 3.202 -1.505 -8.271 1.00 0.00 H new ATOM 0 HG12 VAL A 63 3.680 -3.166 -7.847 1.00 0.00 H new ATOM 0 HG13 VAL A 63 3.587 -2.675 -9.555 1.00 0.00 H new ATOM 0 HG21 VAL A 63 0.982 -1.078 -9.328 1.00 0.00 H new ATOM 0 HG22 VAL A 63 1.364 -2.250 -10.611 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -0.125 -2.432 -9.655 1.00 0.00 H new ATOM 552 N GLN A 64 3.248 -6.036 -8.259 1.00 0.00 N ATOM 553 CA GLN A 64 3.888 -6.926 -7.252 1.00 0.00 C ATOM 554 C GLN A 64 5.410 -6.889 -7.426 1.00 0.00 C ATOM 555 O GLN A 64 5.923 -7.120 -8.504 1.00 0.00 O ATOM 556 CB GLN A 64 3.367 -8.354 -7.453 1.00 0.00 C ATOM 557 CG GLN A 64 3.642 -8.810 -8.890 1.00 0.00 C ATOM 558 CD GLN A 64 2.483 -9.679 -9.383 1.00 0.00 C ATOM 559 OE1 GLN A 64 2.166 -10.687 -8.783 1.00 0.00 O ATOM 560 NE2 GLN A 64 1.834 -9.329 -10.459 1.00 0.00 N ATOM 0 H GLN A 64 3.691 -6.034 -9.178 1.00 0.00 H new ATOM 0 HA GLN A 64 3.644 -6.588 -6.245 1.00 0.00 H new ATOM 0 HB2 GLN A 64 3.851 -9.030 -6.748 1.00 0.00 H new ATOM 0 HB3 GLN A 64 2.297 -8.393 -7.248 1.00 0.00 H new ATOM 0 HG2 GLN A 64 3.763 -7.944 -9.540 1.00 0.00 H new ATOM 0 HG3 GLN A 64 4.575 -9.372 -8.932 1.00 0.00 H new ATOM 0 HE21 GLN A 64 2.100 -8.483 -10.963 1.00 0.00 H new ATOM 0 HE22 GLN A 64 1.060 -9.901 -10.797 1.00 0.00 H new ATOM 569 N LEU A 65 6.131 -6.582 -6.374 1.00 0.00 N ATOM 570 CA LEU A 65 7.613 -6.509 -6.473 1.00 0.00 C ATOM 571 C LEU A 65 8.251 -7.791 -5.939 1.00 0.00 C ATOM 572 O LEU A 65 7.630 -8.562 -5.232 1.00 0.00 O ATOM 573 CB LEU A 65 8.113 -5.315 -5.661 1.00 0.00 C ATOM 574 CG LEU A 65 7.575 -5.395 -4.227 1.00 0.00 C ATOM 575 CD1 LEU A 65 8.667 -4.964 -3.244 1.00 0.00 C ATOM 576 CD2 LEU A 65 6.367 -4.466 -4.080 1.00 0.00 C ATOM 0 H LEU A 65 5.750 -6.379 -5.450 1.00 0.00 H new ATOM 0 HA LEU A 65 7.891 -6.391 -7.520 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.203 -5.303 -5.649 1.00 0.00 H new ATOM 0 HB3 LEU A 65 7.789 -4.385 -6.129 1.00 0.00 H new ATOM 0 HG LEU A 65 7.275 -6.421 -4.012 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.283 -5.021 -2.225 1.00 0.00 H new ATOM 0 HD12 LEU A 65 9.528 -5.624 -3.345 1.00 0.00 H new ATOM 0 HD13 LEU A 65 8.968 -3.939 -3.461 1.00 0.00 H new ATOM 0 HD21 LEU A 65 5.986 -4.524 -3.061 1.00 0.00 H new ATOM 0 HD22 LEU A 65 6.668 -3.441 -4.297 1.00 0.00 H new ATOM 0 HD23 LEU A 65 5.587 -4.771 -4.777 1.00 0.00 H new ATOM 588 N GLU A 66 9.495 -8.016 -6.279 1.00 0.00 N ATOM 589 CA GLU A 66 10.203 -9.240 -5.807 1.00 0.00 C ATOM 590 C GLU A 66 11.697 -8.934 -5.674 1.00 0.00 C ATOM 591 O GLU A 66 12.143 -7.851 -5.996 1.00 0.00 O ATOM 592 CB GLU A 66 9.992 -10.373 -6.818 1.00 0.00 C ATOM 593 CG GLU A 66 8.550 -10.874 -6.748 1.00 0.00 C ATOM 594 CD GLU A 66 8.272 -11.468 -5.364 1.00 0.00 C ATOM 595 OE1 GLU A 66 8.976 -12.388 -4.984 1.00 0.00 O ATOM 596 OE2 GLU A 66 7.359 -10.991 -4.709 1.00 0.00 O ATOM 0 H GLU A 66 10.053 -7.398 -6.868 1.00 0.00 H new ATOM 0 HA GLU A 66 9.807 -9.547 -4.839 1.00 0.00 H new ATOM 0 HB2 GLU A 66 10.214 -10.019 -7.825 1.00 0.00 H new ATOM 0 HB3 GLU A 66 10.681 -11.191 -6.608 1.00 0.00 H new ATOM 0 HG2 GLU A 66 7.861 -10.053 -6.946 1.00 0.00 H new ATOM 0 HG3 GLU A 66 8.379 -11.627 -7.518 1.00 0.00 H new ATOM 603 N GLN A 67 12.469 -9.876 -5.195 1.00 0.00 N ATOM 604 CA GLN A 67 13.937 -9.638 -5.034 1.00 0.00 C ATOM 605 C GLN A 67 14.690 -10.961 -5.192 1.00 0.00 C ATOM 606 O GLN A 67 14.151 -12.023 -4.941 1.00 0.00 O ATOM 607 CB GLN A 67 14.210 -9.063 -3.641 1.00 0.00 C ATOM 608 CG GLN A 67 13.734 -7.610 -3.581 1.00 0.00 C ATOM 609 CD GLN A 67 13.915 -7.071 -2.160 1.00 0.00 C ATOM 610 OE1 GLN A 67 14.889 -7.376 -1.502 1.00 0.00 O ATOM 611 NE2 GLN A 67 13.009 -6.277 -1.658 1.00 0.00 N ATOM 0 H GLN A 67 12.147 -10.800 -4.908 1.00 0.00 H new ATOM 0 HA GLN A 67 14.275 -8.933 -5.794 1.00 0.00 H new ATOM 0 HB2 GLN A 67 13.695 -9.656 -2.885 1.00 0.00 H new ATOM 0 HB3 GLN A 67 15.275 -9.116 -3.417 1.00 0.00 H new ATOM 0 HG2 GLN A 67 14.300 -7.002 -4.287 1.00 0.00 H new ATOM 0 HG3 GLN A 67 12.686 -7.547 -3.874 1.00 0.00 H new ATOM 0 HE21 GLN A 67 12.191 -6.022 -2.212 1.00 0.00 H new ATOM 0 HE22 GLN A 67 13.119 -5.912 -0.712 1.00 0.00 H new ATOM 620 N LYS A 68 15.933 -10.903 -5.602 1.00 0.00 N ATOM 621 CA LYS A 68 16.729 -12.154 -5.772 1.00 0.00 C ATOM 622 C LYS A 68 17.857 -12.184 -4.736 1.00 0.00 C ATOM 623 O LYS A 68 18.132 -11.197 -4.079 1.00 0.00 O ATOM 624 CB LYS A 68 17.325 -12.201 -7.182 1.00 0.00 C ATOM 625 CG LYS A 68 16.225 -12.540 -8.201 1.00 0.00 C ATOM 626 CD LYS A 68 16.181 -11.467 -9.294 1.00 0.00 C ATOM 627 CE LYS A 68 17.449 -11.552 -10.144 1.00 0.00 C ATOM 628 NZ LYS A 68 17.340 -12.700 -11.088 1.00 0.00 N ATOM 0 H LYS A 68 16.430 -10.041 -5.826 1.00 0.00 H new ATOM 0 HA LYS A 68 16.080 -13.018 -5.629 1.00 0.00 H new ATOM 0 HB2 LYS A 68 17.778 -11.240 -7.428 1.00 0.00 H new ATOM 0 HB3 LYS A 68 18.118 -12.948 -7.227 1.00 0.00 H new ATOM 0 HG2 LYS A 68 16.417 -13.517 -8.645 1.00 0.00 H new ATOM 0 HG3 LYS A 68 15.259 -12.602 -7.700 1.00 0.00 H new ATOM 0 HD2 LYS A 68 15.300 -11.607 -9.921 1.00 0.00 H new ATOM 0 HD3 LYS A 68 16.098 -10.478 -8.844 1.00 0.00 H new ATOM 0 HE2 LYS A 68 17.591 -10.624 -10.698 1.00 0.00 H new ATOM 0 HE3 LYS A 68 18.322 -11.677 -9.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 18.098 -12.640 -11.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 17.429 -13.592 -10.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 16.417 -12.670 -11.565 1.00 0.00 H new ATOM 642 N ASP A 69 18.504 -13.311 -4.584 1.00 0.00 N ATOM 643 CA ASP A 69 19.608 -13.421 -3.590 1.00 0.00 C ATOM 644 C ASP A 69 20.889 -12.754 -4.118 1.00 0.00 C ATOM 645 O ASP A 69 21.888 -12.704 -3.425 1.00 0.00 O ATOM 646 CB ASP A 69 19.888 -14.899 -3.309 1.00 0.00 C ATOM 647 CG ASP A 69 18.808 -15.457 -2.380 1.00 0.00 C ATOM 648 OD1 ASP A 69 18.484 -14.789 -1.413 1.00 0.00 O ATOM 649 OD2 ASP A 69 18.323 -16.543 -2.653 1.00 0.00 O ATOM 0 H ASP A 69 18.312 -14.164 -5.110 1.00 0.00 H new ATOM 0 HA ASP A 69 19.304 -12.914 -2.674 1.00 0.00 H new ATOM 0 HB2 ASP A 69 19.904 -15.461 -4.243 1.00 0.00 H new ATOM 0 HB3 ASP A 69 20.871 -15.013 -2.851 1.00 0.00 H new ATOM 654 N GLY A 70 20.879 -12.250 -5.332 1.00 0.00 N ATOM 655 CA GLY A 70 22.107 -11.599 -5.884 1.00 0.00 C ATOM 656 C GLY A 70 22.012 -10.082 -5.713 1.00 0.00 C ATOM 657 O GLY A 70 22.497 -9.327 -6.535 1.00 0.00 O ATOM 0 H GLY A 70 20.075 -12.263 -5.960 1.00 0.00 H new ATOM 0 HA2 GLY A 70 22.992 -11.977 -5.371 1.00 0.00 H new ATOM 0 HA3 GLY A 70 22.219 -11.849 -6.939 1.00 0.00 H new ATOM 661 N ASP A 71 21.384 -9.629 -4.654 1.00 0.00 N ATOM 662 CA ASP A 71 21.244 -8.158 -4.418 1.00 0.00 C ATOM 663 C ASP A 71 20.506 -7.528 -5.598 1.00 0.00 C ATOM 664 O ASP A 71 20.924 -6.525 -6.149 1.00 0.00 O ATOM 665 CB ASP A 71 22.629 -7.520 -4.270 1.00 0.00 C ATOM 666 CG ASP A 71 23.162 -7.775 -2.858 1.00 0.00 C ATOM 667 OD1 ASP A 71 22.830 -7.004 -1.973 1.00 0.00 O ATOM 668 OD2 ASP A 71 23.893 -8.736 -2.686 1.00 0.00 O ATOM 0 H ASP A 71 20.960 -10.220 -3.939 1.00 0.00 H new ATOM 0 HA ASP A 71 20.678 -7.988 -3.502 1.00 0.00 H new ATOM 0 HB2 ASP A 71 23.313 -7.937 -5.009 1.00 0.00 H new ATOM 0 HB3 ASP A 71 22.569 -6.448 -4.459 1.00 0.00 H new ATOM 673 N ILE A 72 19.417 -8.126 -5.998 1.00 0.00 N ATOM 674 CA ILE A 72 18.645 -7.595 -7.155 1.00 0.00 C ATOM 675 C ILE A 72 17.178 -7.417 -6.757 1.00 0.00 C ATOM 676 O ILE A 72 16.699 -8.035 -5.824 1.00 0.00 O ATOM 677 CB ILE A 72 18.745 -8.582 -8.323 1.00 0.00 C ATOM 678 CG1 ILE A 72 20.219 -9.001 -8.507 1.00 0.00 C ATOM 679 CG2 ILE A 72 18.212 -7.910 -9.591 1.00 0.00 C ATOM 680 CD1 ILE A 72 20.402 -9.824 -9.792 1.00 0.00 C ATOM 0 H ILE A 72 19.027 -8.965 -5.569 1.00 0.00 H new ATOM 0 HA ILE A 72 19.054 -6.630 -7.455 1.00 0.00 H new ATOM 0 HB ILE A 72 18.151 -9.473 -8.120 1.00 0.00 H new ATOM 0 HG12 ILE A 72 20.851 -8.114 -8.546 1.00 0.00 H new ATOM 0 HG13 ILE A 72 20.544 -9.586 -7.647 1.00 0.00 H new ATOM 0 HG21 ILE A 72 18.280 -8.606 -10.427 1.00 0.00 H new ATOM 0 HG22 ILE A 72 17.171 -7.623 -9.441 1.00 0.00 H new ATOM 0 HG23 ILE A 72 18.805 -7.022 -9.809 1.00 0.00 H new ATOM 0 HD11 ILE A 72 21.450 -10.106 -9.897 1.00 0.00 H new ATOM 0 HD12 ILE A 72 19.788 -10.723 -9.739 1.00 0.00 H new ATOM 0 HD13 ILE A 72 20.099 -9.227 -10.652 1.00 0.00 H new ATOM 692 N SER A 73 16.465 -6.579 -7.463 1.00 0.00 N ATOM 693 CA SER A 73 15.027 -6.352 -7.144 1.00 0.00 C ATOM 694 C SER A 73 14.197 -6.554 -8.407 1.00 0.00 C ATOM 695 O SER A 73 14.717 -6.574 -9.507 1.00 0.00 O ATOM 696 CB SER A 73 14.836 -4.924 -6.629 1.00 0.00 C ATOM 697 OG SER A 73 15.922 -4.585 -5.776 1.00 0.00 O ATOM 0 H SER A 73 16.821 -6.039 -8.252 1.00 0.00 H new ATOM 0 HA SER A 73 14.706 -7.057 -6.377 1.00 0.00 H new ATOM 0 HB2 SER A 73 14.784 -4.227 -7.465 1.00 0.00 H new ATOM 0 HB3 SER A 73 13.894 -4.843 -6.087 1.00 0.00 H new ATOM 0 HG SER A 73 15.805 -3.670 -5.445 1.00 0.00 H new ATOM 703 N ILE A 74 12.913 -6.720 -8.253 1.00 0.00 N ATOM 704 CA ILE A 74 12.032 -6.941 -9.430 1.00 0.00 C ATOM 705 C ILE A 74 10.713 -6.195 -9.217 1.00 0.00 C ATOM 706 O ILE A 74 10.382 -5.808 -8.112 1.00 0.00 O ATOM 707 CB ILE A 74 11.770 -8.445 -9.563 1.00 0.00 C ATOM 708 CG1 ILE A 74 13.099 -9.175 -9.793 1.00 0.00 C ATOM 709 CG2 ILE A 74 10.818 -8.724 -10.734 1.00 0.00 C ATOM 710 CD1 ILE A 74 12.865 -10.690 -9.814 1.00 0.00 C ATOM 0 H ILE A 74 12.433 -6.712 -7.353 1.00 0.00 H new ATOM 0 HA ILE A 74 12.506 -6.569 -10.338 1.00 0.00 H new ATOM 0 HB ILE A 74 11.306 -8.805 -8.645 1.00 0.00 H new ATOM 0 HG12 ILE A 74 13.542 -8.854 -10.736 1.00 0.00 H new ATOM 0 HG13 ILE A 74 13.806 -8.918 -9.004 1.00 0.00 H new ATOM 0 HG21 ILE A 74 10.643 -9.797 -10.813 1.00 0.00 H new ATOM 0 HG22 ILE A 74 9.870 -8.214 -10.562 1.00 0.00 H new ATOM 0 HG23 ILE A 74 11.263 -8.360 -11.660 1.00 0.00 H new ATOM 0 HD11 ILE A 74 13.813 -11.202 -9.978 1.00 0.00 H new ATOM 0 HD12 ILE A 74 12.442 -11.006 -8.861 1.00 0.00 H new ATOM 0 HD13 ILE A 74 12.174 -10.940 -10.619 1.00 0.00 H new ATOM 722 N LEU A 75 9.957 -6.002 -10.267 1.00 0.00 N ATOM 723 CA LEU A 75 8.657 -5.295 -10.136 1.00 0.00 C ATOM 724 C LEU A 75 7.722 -5.732 -11.262 1.00 0.00 C ATOM 725 O LEU A 75 7.781 -5.224 -12.365 1.00 0.00 O ATOM 726 CB LEU A 75 8.875 -3.780 -10.202 1.00 0.00 C ATOM 727 CG LEU A 75 7.567 -3.052 -9.843 1.00 0.00 C ATOM 728 CD1 LEU A 75 7.740 -2.296 -8.522 1.00 0.00 C ATOM 729 CD2 LEU A 75 7.208 -2.056 -10.952 1.00 0.00 C ATOM 0 H LEU A 75 10.189 -6.307 -11.212 1.00 0.00 H new ATOM 0 HA LEU A 75 8.208 -5.546 -9.175 1.00 0.00 H new ATOM 0 HB2 LEU A 75 9.667 -3.486 -9.513 1.00 0.00 H new ATOM 0 HB3 LEU A 75 9.200 -3.493 -11.202 1.00 0.00 H new ATOM 0 HG LEU A 75 6.768 -3.787 -9.740 1.00 0.00 H new ATOM 0 HD11 LEU A 75 6.812 -1.782 -8.272 1.00 0.00 H new ATOM 0 HD12 LEU A 75 7.989 -3.001 -7.729 1.00 0.00 H new ATOM 0 HD13 LEU A 75 8.543 -1.566 -8.623 1.00 0.00 H new ATOM 0 HD21 LEU A 75 6.282 -1.543 -10.694 1.00 0.00 H new ATOM 0 HD22 LEU A 75 8.010 -1.326 -11.059 1.00 0.00 H new ATOM 0 HD23 LEU A 75 7.077 -2.591 -11.893 1.00 0.00 H new ATOM 741 N GLU A 76 6.857 -6.670 -10.981 1.00 0.00 N ATOM 742 CA GLU A 76 5.901 -7.153 -12.016 1.00 0.00 C ATOM 743 C GLU A 76 4.581 -6.402 -11.853 1.00 0.00 C ATOM 744 O GLU A 76 4.160 -6.120 -10.749 1.00 0.00 O ATOM 745 CB GLU A 76 5.652 -8.654 -11.826 1.00 0.00 C ATOM 746 CG GLU A 76 6.987 -9.397 -11.715 1.00 0.00 C ATOM 747 CD GLU A 76 6.725 -10.893 -11.539 1.00 0.00 C ATOM 748 OE1 GLU A 76 6.085 -11.254 -10.565 1.00 0.00 O ATOM 749 OE2 GLU A 76 7.167 -11.655 -12.384 1.00 0.00 O ATOM 0 H GLU A 76 6.772 -7.125 -10.072 1.00 0.00 H new ATOM 0 HA GLU A 76 6.314 -6.978 -13.009 1.00 0.00 H new ATOM 0 HB2 GLU A 76 5.058 -8.821 -10.928 1.00 0.00 H new ATOM 0 HB3 GLU A 76 5.078 -9.045 -12.666 1.00 0.00 H new ATOM 0 HG2 GLU A 76 7.587 -9.225 -12.609 1.00 0.00 H new ATOM 0 HG3 GLU A 76 7.559 -9.015 -10.869 1.00 0.00 H new ATOM 756 N LEU A 77 3.922 -6.081 -12.935 1.00 0.00 N ATOM 757 CA LEU A 77 2.623 -5.356 -12.830 1.00 0.00 C ATOM 758 C LEU A 77 1.646 -5.921 -13.861 1.00 0.00 C ATOM 759 O LEU A 77 1.941 -5.997 -15.039 1.00 0.00 O ATOM 760 CB LEU A 77 2.832 -3.855 -13.074 1.00 0.00 C ATOM 761 CG LEU A 77 3.648 -3.629 -14.349 1.00 0.00 C ATOM 762 CD1 LEU A 77 3.306 -2.258 -14.934 1.00 0.00 C ATOM 763 CD2 LEU A 77 5.141 -3.677 -14.013 1.00 0.00 C ATOM 0 H LEU A 77 4.227 -6.289 -13.886 1.00 0.00 H new ATOM 0 HA LEU A 77 2.215 -5.491 -11.828 1.00 0.00 H new ATOM 0 HB2 LEU A 77 1.867 -3.356 -13.160 1.00 0.00 H new ATOM 0 HB3 LEU A 77 3.346 -3.410 -12.222 1.00 0.00 H new ATOM 0 HG LEU A 77 3.411 -4.407 -15.075 1.00 0.00 H new ATOM 0 HD11 LEU A 77 3.886 -2.095 -15.842 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.243 -2.218 -15.171 1.00 0.00 H new ATOM 0 HD13 LEU A 77 3.545 -1.482 -14.207 1.00 0.00 H new ATOM 0 HD21 LEU A 77 5.723 -3.516 -14.920 1.00 0.00 H new ATOM 0 HD22 LEU A 77 5.376 -2.898 -13.288 1.00 0.00 H new ATOM 0 HD23 LEU A 77 5.388 -4.651 -13.591 1.00 0.00 H new ATOM 775 N ASN A 78 0.485 -6.327 -13.425 1.00 0.00 N ATOM 776 CA ASN A 78 -0.515 -6.891 -14.365 1.00 0.00 C ATOM 777 C ASN A 78 -1.378 -5.753 -14.898 1.00 0.00 C ATOM 778 O ASN A 78 -1.717 -4.843 -14.172 1.00 0.00 O ATOM 779 CB ASN A 78 -1.407 -7.879 -13.621 1.00 0.00 C ATOM 780 CG ASN A 78 -0.557 -8.884 -12.830 1.00 0.00 C ATOM 781 OD1 ASN A 78 -0.962 -9.338 -11.778 1.00 0.00 O ATOM 782 ND2 ASN A 78 0.607 -9.255 -13.291 1.00 0.00 N ATOM 0 H ASN A 78 0.188 -6.290 -12.450 1.00 0.00 H new ATOM 0 HA ASN A 78 -0.008 -7.400 -15.185 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -2.069 -7.340 -12.942 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -2.042 -8.410 -14.330 1.00 0.00 H new ATOM 0 HD21 ASN A 78 1.173 -9.924 -12.769 1.00 0.00 H new ATOM 0 HD22 ASN A 78 0.950 -8.876 -14.174 1.00 0.00 H new ATOM 789 N VAL A 79 -1.733 -5.796 -16.153 1.00 0.00 N ATOM 790 CA VAL A 79 -2.579 -4.707 -16.726 1.00 0.00 C ATOM 791 C VAL A 79 -3.810 -5.315 -17.401 1.00 0.00 C ATOM 792 O VAL A 79 -3.772 -5.690 -18.556 1.00 0.00 O ATOM 793 CB VAL A 79 -1.771 -3.908 -17.750 1.00 0.00 C ATOM 794 CG1 VAL A 79 -2.549 -2.644 -18.120 1.00 0.00 C ATOM 795 CG2 VAL A 79 -0.408 -3.520 -17.150 1.00 0.00 C ATOM 0 H VAL A 79 -1.475 -6.536 -16.806 1.00 0.00 H new ATOM 0 HA VAL A 79 -2.899 -4.041 -15.925 1.00 0.00 H new ATOM 0 HB VAL A 79 -1.606 -4.514 -18.641 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -1.981 -2.068 -18.850 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -3.512 -2.922 -18.548 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -2.709 -2.041 -17.226 1.00 0.00 H new ATOM 0 HG21 VAL A 79 0.164 -2.951 -17.883 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.563 -2.911 -16.259 1.00 0.00 H new ATOM 0 HG23 VAL A 79 0.142 -4.422 -16.882 1.00 0.00 H new ATOM 805 N THR A 80 -4.899 -5.415 -16.680 1.00 0.00 N ATOM 806 CA THR A 80 -6.144 -6.002 -17.261 1.00 0.00 C ATOM 807 C THR A 80 -6.932 -4.920 -18.003 1.00 0.00 C ATOM 808 O THR A 80 -7.565 -4.077 -17.397 1.00 0.00 O ATOM 809 CB THR A 80 -7.006 -6.573 -16.132 1.00 0.00 C ATOM 810 OG1 THR A 80 -6.231 -7.482 -15.362 1.00 0.00 O ATOM 811 CG2 THR A 80 -8.212 -7.304 -16.724 1.00 0.00 C ATOM 0 H THR A 80 -4.979 -5.113 -15.709 1.00 0.00 H new ATOM 0 HA THR A 80 -5.877 -6.794 -17.960 1.00 0.00 H new ATOM 0 HB THR A 80 -7.355 -5.760 -15.496 1.00 0.00 H new ATOM 0 HG1 THR A 80 -6.780 -7.848 -14.637 1.00 0.00 H new ATOM 0 HG21 THR A 80 -8.824 -7.709 -15.918 1.00 0.00 H new ATOM 0 HG22 THR A 80 -8.806 -6.607 -17.315 1.00 0.00 H new ATOM 0 HG23 THR A 80 -7.867 -8.118 -17.362 1.00 0.00 H new ATOM 819 N LEU A 81 -6.904 -4.946 -19.312 1.00 0.00 N ATOM 820 CA LEU A 81 -7.653 -3.936 -20.105 1.00 0.00 C ATOM 821 C LEU A 81 -9.072 -4.471 -20.380 1.00 0.00 C ATOM 822 O LEU A 81 -9.227 -5.641 -20.664 1.00 0.00 O ATOM 823 CB LEU A 81 -6.927 -3.717 -21.431 1.00 0.00 C ATOM 824 CG LEU A 81 -5.482 -3.286 -21.166 1.00 0.00 C ATOM 825 CD1 LEU A 81 -4.564 -3.891 -22.229 1.00 0.00 C ATOM 826 CD2 LEU A 81 -5.385 -1.759 -21.222 1.00 0.00 C ATOM 0 H LEU A 81 -6.389 -5.631 -19.865 1.00 0.00 H new ATOM 0 HA LEU A 81 -7.715 -2.995 -19.558 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.940 -4.634 -22.019 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.442 -2.955 -22.017 1.00 0.00 H new ATOM 0 HG LEU A 81 -5.177 -3.635 -20.180 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -3.536 -3.583 -22.039 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.630 -4.978 -22.191 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -4.871 -3.543 -23.215 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -4.356 -1.453 -21.033 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.692 -1.411 -22.208 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -6.038 -1.325 -20.464 1.00 0.00 H new ATOM 838 N PRO A 82 -10.075 -3.616 -20.291 1.00 0.00 N ATOM 839 CA PRO A 82 -11.502 -4.002 -20.530 1.00 0.00 C ATOM 840 C PRO A 82 -11.837 -3.936 -22.023 1.00 0.00 C ATOM 841 O PRO A 82 -10.975 -3.721 -22.853 1.00 0.00 O ATOM 842 CB PRO A 82 -12.285 -2.953 -19.754 1.00 0.00 C ATOM 843 CG PRO A 82 -11.397 -1.727 -19.631 1.00 0.00 C ATOM 844 CD PRO A 82 -9.962 -2.153 -19.946 1.00 0.00 C ATOM 0 HA PRO A 82 -11.728 -5.021 -20.216 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -13.212 -2.706 -20.270 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -12.560 -3.329 -18.769 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -11.724 -0.948 -20.320 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -11.459 -1.310 -18.626 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -9.550 -1.579 -20.776 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -9.304 -1.995 -19.092 1.00 0.00 H new ATOM 852 N GLU A 83 -13.088 -4.122 -22.364 1.00 0.00 N ATOM 853 CA GLU A 83 -13.499 -4.075 -23.798 1.00 0.00 C ATOM 854 C GLU A 83 -13.183 -2.691 -24.377 1.00 0.00 C ATOM 855 O GLU A 83 -12.501 -1.895 -23.760 1.00 0.00 O ATOM 856 CB GLU A 83 -15.008 -4.344 -23.899 1.00 0.00 C ATOM 857 CG GLU A 83 -15.246 -5.767 -24.410 1.00 0.00 C ATOM 858 CD GLU A 83 -16.732 -6.110 -24.288 1.00 0.00 C ATOM 859 OE1 GLU A 83 -17.242 -6.065 -23.181 1.00 0.00 O ATOM 860 OE2 GLU A 83 -17.335 -6.413 -25.306 1.00 0.00 O ATOM 0 H GLU A 83 -13.845 -4.305 -21.706 1.00 0.00 H new ATOM 0 HA GLU A 83 -12.954 -4.833 -24.361 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -15.476 -4.215 -22.923 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -15.471 -3.623 -24.573 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -14.927 -5.850 -25.449 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -14.650 -6.476 -23.835 1.00 0.00 H new ATOM 867 N ALA A 84 -13.678 -2.403 -25.553 1.00 0.00 N ATOM 868 CA ALA A 84 -13.415 -1.076 -26.175 1.00 0.00 C ATOM 869 C ALA A 84 -14.271 -0.920 -27.435 1.00 0.00 C ATOM 870 O ALA A 84 -15.141 -1.727 -27.707 1.00 0.00 O ATOM 871 CB ALA A 84 -11.935 -0.967 -26.546 1.00 0.00 C ATOM 0 H ALA A 84 -14.255 -3.034 -26.109 1.00 0.00 H new ATOM 0 HA ALA A 84 -13.669 -0.289 -25.465 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -11.745 0.005 -27.001 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -11.326 -1.073 -25.648 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.678 -1.755 -27.253 1.00 0.00 H new ATOM 877 N GLU A 85 -14.030 0.114 -28.200 1.00 0.00 N ATOM 878 CA GLU A 85 -14.824 0.337 -29.444 1.00 0.00 C ATOM 879 C GLU A 85 -14.628 -0.842 -30.400 1.00 0.00 C ATOM 880 O GLU A 85 -15.573 -1.352 -30.970 1.00 0.00 O ATOM 881 CB GLU A 85 -14.356 1.627 -30.123 1.00 0.00 C ATOM 882 CG GLU A 85 -14.726 2.826 -29.248 1.00 0.00 C ATOM 883 CD GLU A 85 -14.259 4.116 -29.926 1.00 0.00 C ATOM 884 OE1 GLU A 85 -13.070 4.240 -30.164 1.00 0.00 O ATOM 885 OE2 GLU A 85 -15.100 4.958 -30.195 1.00 0.00 O ATOM 0 H GLU A 85 -13.314 0.816 -28.015 1.00 0.00 H new ATOM 0 HA GLU A 85 -15.880 0.421 -29.187 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -13.278 1.597 -30.281 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -14.819 1.723 -31.105 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -15.804 2.855 -29.090 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -14.262 2.730 -28.266 1.00 0.00 H new ATOM 892 N GLU A 86 -13.405 -1.277 -30.578 1.00 0.00 N ATOM 893 CA GLU A 86 -13.132 -2.425 -31.496 1.00 0.00 C ATOM 894 C GLU A 86 -13.597 -2.073 -32.915 1.00 0.00 C ATOM 895 O GLU A 86 -14.540 -2.643 -33.431 1.00 0.00 O ATOM 896 CB GLU A 86 -13.877 -3.669 -30.998 1.00 0.00 C ATOM 897 CG GLU A 86 -13.398 -4.898 -31.774 1.00 0.00 C ATOM 898 CD GLU A 86 -14.263 -6.103 -31.405 1.00 0.00 C ATOM 899 OE1 GLU A 86 -14.604 -6.229 -30.241 1.00 0.00 O ATOM 900 OE2 GLU A 86 -14.570 -6.881 -32.293 1.00 0.00 O ATOM 0 H GLU A 86 -12.580 -0.884 -30.124 1.00 0.00 H new ATOM 0 HA GLU A 86 -12.062 -2.630 -31.511 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -13.701 -3.808 -29.931 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -14.951 -3.539 -31.129 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -13.456 -4.710 -32.846 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -12.353 -5.103 -31.543 1.00 0.00 H new ATOM 907 N LEU A 87 -12.938 -1.133 -33.544 1.00 0.00 N ATOM 908 CA LEU A 87 -13.332 -0.733 -34.927 1.00 0.00 C ATOM 909 C LEU A 87 -12.572 -1.588 -35.945 1.00 0.00 C ATOM 910 O LEU A 87 -11.357 -1.563 -36.005 1.00 0.00 O ATOM 911 CB LEU A 87 -13.005 0.751 -35.147 1.00 0.00 C ATOM 912 CG LEU A 87 -11.499 1.000 -34.935 1.00 0.00 C ATOM 913 CD1 LEU A 87 -10.831 1.305 -36.278 1.00 0.00 C ATOM 914 CD2 LEU A 87 -11.301 2.192 -33.992 1.00 0.00 C ATOM 0 H LEU A 87 -12.142 -0.625 -33.158 1.00 0.00 H new ATOM 0 HA LEU A 87 -14.403 -0.887 -35.057 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -13.292 1.049 -36.155 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -13.583 1.365 -34.457 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.049 0.109 -34.498 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -9.766 1.480 -36.123 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -10.965 0.459 -36.952 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -11.285 2.193 -36.717 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -10.235 2.366 -33.844 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -11.756 3.081 -34.429 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -11.771 1.978 -33.032 1.00 0.00 H new ATOM 926 N LYS A 88 -13.282 -2.343 -36.745 1.00 0.00 N ATOM 927 CA LYS A 88 -12.612 -3.205 -37.762 1.00 0.00 C ATOM 928 C LYS A 88 -13.042 -2.767 -39.164 1.00 0.00 C ATOM 929 O LYS A 88 -12.438 -3.226 -40.118 1.00 0.00 O ATOM 930 CB LYS A 88 -13.013 -4.665 -37.540 1.00 0.00 C ATOM 931 CG LYS A 88 -14.538 -4.780 -37.517 1.00 0.00 C ATOM 932 CD LYS A 88 -14.945 -6.237 -37.740 1.00 0.00 C ATOM 933 CE LYS A 88 -16.233 -6.531 -36.969 1.00 0.00 C ATOM 934 NZ LYS A 88 -16.998 -7.601 -37.671 1.00 0.00 N ATOM 935 OXT LYS A 88 -13.969 -1.978 -39.258 1.00 0.00 O ATOM 0 H LYS A 88 -14.300 -2.399 -36.736 1.00 0.00 H new ATOM 0 HA LYS A 88 -11.531 -3.107 -37.665 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -12.603 -5.290 -38.333 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -12.597 -5.028 -36.601 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -14.925 -4.426 -36.562 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -14.972 -4.148 -38.291 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -15.094 -6.425 -38.803 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -14.149 -6.903 -37.407 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -15.997 -6.845 -35.952 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -16.838 -5.627 -36.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -17.874 -7.802 -37.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -17.234 -7.285 -38.633 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -16.420 -8.464 -37.723 1.00 0.00 H new TER 949 LYS A 88 ATOM 950 N ARG B 31 3.826 -11.886 -33.257 1.00 0.00 N ATOM 951 CA ARG B 31 3.637 -10.520 -32.694 1.00 0.00 C ATOM 952 C ARG B 31 2.187 -10.358 -32.225 1.00 0.00 C ATOM 953 O ARG B 31 1.397 -9.662 -32.837 1.00 0.00 O ATOM 954 CB ARG B 31 3.958 -9.478 -33.772 1.00 0.00 C ATOM 955 CG ARG B 31 4.647 -8.271 -33.130 1.00 0.00 C ATOM 956 CD ARG B 31 6.164 -8.434 -33.232 1.00 0.00 C ATOM 957 NE ARG B 31 6.835 -7.231 -32.649 1.00 0.00 N ATOM 958 CZ ARG B 31 6.930 -7.061 -31.345 1.00 0.00 C ATOM 959 NH1 ARG B 31 6.440 -7.938 -30.499 1.00 0.00 N ATOM 960 NH2 ARG B 31 7.526 -5.996 -30.883 1.00 0.00 N ATOM 0 HA ARG B 31 4.305 -10.376 -31.845 1.00 0.00 H new ATOM 0 HB2 ARG B 31 4.603 -9.915 -34.534 1.00 0.00 H new ATOM 0 HB3 ARG B 31 3.042 -9.163 -34.272 1.00 0.00 H new ATOM 0 HG2 ARG B 31 4.335 -7.353 -33.629 1.00 0.00 H new ATOM 0 HG3 ARG B 31 4.350 -8.183 -32.085 1.00 0.00 H new ATOM 0 HD2 ARG B 31 6.480 -9.333 -32.702 1.00 0.00 H new ATOM 0 HD3 ARG B 31 6.458 -8.558 -34.274 1.00 0.00 H new ATOM 0 HE ARG B 31 7.228 -6.527 -33.274 1.00 0.00 H new ATOM 0 HH11 ARG B 31 5.972 -8.775 -30.846 1.00 0.00 H new ATOM 0 HH12 ARG B 31 6.527 -7.782 -29.495 1.00 0.00 H new ATOM 0 HH21 ARG B 31 7.912 -5.307 -31.529 1.00 0.00 H new ATOM 0 HH22 ARG B 31 7.606 -5.853 -29.876 1.00 0.00 H new ATOM 976 N SER B 32 1.832 -11.003 -31.142 1.00 0.00 N ATOM 977 CA SER B 32 0.439 -10.902 -30.623 1.00 0.00 C ATOM 978 C SER B 32 0.158 -9.471 -30.163 1.00 0.00 C ATOM 979 O SER B 32 -0.973 -9.022 -30.174 1.00 0.00 O ATOM 980 CB SER B 32 0.264 -11.854 -29.443 1.00 0.00 C ATOM 981 OG SER B 32 0.941 -13.073 -29.716 1.00 0.00 O ATOM 0 H SER B 32 2.453 -11.598 -30.594 1.00 0.00 H new ATOM 0 HA SER B 32 -0.258 -11.169 -31.417 1.00 0.00 H new ATOM 0 HB2 SER B 32 0.660 -11.401 -28.534 1.00 0.00 H new ATOM 0 HB3 SER B 32 -0.795 -12.044 -29.269 1.00 0.00 H new ATOM 0 HG SER B 32 0.831 -13.685 -28.958 1.00 0.00 H new ATOM 987 N ASP B 33 1.176 -8.752 -29.758 1.00 0.00 N ATOM 988 CA ASP B 33 0.969 -7.352 -29.296 1.00 0.00 C ATOM 989 C ASP B 33 0.933 -6.387 -30.489 1.00 0.00 C ATOM 990 O ASP B 33 0.918 -5.185 -30.308 1.00 0.00 O ATOM 991 CB ASP B 33 2.098 -6.944 -28.350 1.00 0.00 C ATOM 992 CG ASP B 33 3.449 -7.191 -29.024 1.00 0.00 C ATOM 993 OD1 ASP B 33 3.817 -8.346 -29.165 1.00 0.00 O ATOM 994 OD2 ASP B 33 4.092 -6.221 -29.390 1.00 0.00 O ATOM 0 H ASP B 33 2.142 -9.078 -29.729 1.00 0.00 H new ATOM 0 HA ASP B 33 0.014 -7.302 -28.772 1.00 0.00 H new ATOM 0 HB2 ASP B 33 2.000 -5.891 -28.084 1.00 0.00 H new ATOM 0 HB3 ASP B 33 2.033 -7.514 -27.423 1.00 0.00 H new ATOM 999 N ALA B 34 0.916 -6.888 -31.702 1.00 0.00 N ATOM 1000 CA ALA B 34 0.870 -5.989 -32.884 1.00 0.00 C ATOM 1001 C ALA B 34 -0.590 -5.737 -33.302 1.00 0.00 C ATOM 1002 O ALA B 34 -0.847 -5.074 -34.290 1.00 0.00 O ATOM 1003 CB ALA B 34 1.625 -6.642 -34.040 1.00 0.00 C ATOM 0 H ALA B 34 0.932 -7.885 -31.918 1.00 0.00 H new ATOM 0 HA ALA B 34 1.334 -5.036 -32.629 1.00 0.00 H new ATOM 0 HB1 ALA B 34 1.595 -5.987 -34.911 1.00 0.00 H new ATOM 0 HB2 ALA B 34 2.662 -6.810 -33.748 1.00 0.00 H new ATOM 0 HB3 ALA B 34 1.158 -7.595 -34.287 1.00 0.00 H new ATOM 1009 N GLU B 35 -1.546 -6.257 -32.564 1.00 0.00 N ATOM 1010 CA GLU B 35 -2.980 -6.047 -32.920 1.00 0.00 C ATOM 1011 C GLU B 35 -3.471 -4.658 -32.451 1.00 0.00 C ATOM 1012 O GLU B 35 -4.155 -3.988 -33.198 1.00 0.00 O ATOM 1013 CB GLU B 35 -3.844 -7.144 -32.282 1.00 0.00 C ATOM 1014 CG GLU B 35 -3.300 -8.523 -32.671 1.00 0.00 C ATOM 1015 CD GLU B 35 -4.080 -9.063 -33.872 1.00 0.00 C ATOM 1016 OE1 GLU B 35 -4.303 -8.301 -34.798 1.00 0.00 O ATOM 1017 OE2 GLU B 35 -4.440 -10.228 -33.846 1.00 0.00 O ATOM 0 H GLU B 35 -1.389 -6.819 -31.728 1.00 0.00 H new ATOM 0 HA GLU B 35 -3.071 -6.096 -34.005 1.00 0.00 H new ATOM 0 HB2 GLU B 35 -3.844 -7.035 -31.197 1.00 0.00 H new ATOM 0 HB3 GLU B 35 -4.878 -7.044 -32.612 1.00 0.00 H new ATOM 0 HG2 GLU B 35 -2.240 -8.451 -32.915 1.00 0.00 H new ATOM 0 HG3 GLU B 35 -3.387 -9.210 -31.829 1.00 0.00 H new ATOM 1024 N PRO B 36 -3.127 -4.246 -31.238 1.00 0.00 N ATOM 1025 CA PRO B 36 -3.550 -2.919 -30.682 1.00 0.00 C ATOM 1026 C PRO B 36 -2.604 -1.809 -31.148 1.00 0.00 C ATOM 1027 O PRO B 36 -3.032 -0.729 -31.506 1.00 0.00 O ATOM 1028 CB PRO B 36 -3.451 -3.118 -29.175 1.00 0.00 C ATOM 1029 CG PRO B 36 -2.456 -4.235 -28.929 1.00 0.00 C ATOM 1030 CD PRO B 36 -2.278 -4.999 -30.243 1.00 0.00 C ATOM 0 HA PRO B 36 -4.546 -2.619 -31.006 1.00 0.00 H new ATOM 0 HB2 PRO B 36 -3.125 -2.199 -28.687 1.00 0.00 H new ATOM 0 HB3 PRO B 36 -4.425 -3.373 -28.757 1.00 0.00 H new ATOM 0 HG2 PRO B 36 -1.502 -3.830 -28.590 1.00 0.00 H new ATOM 0 HG3 PRO B 36 -2.816 -4.901 -28.145 1.00 0.00 H new ATOM 0 HD2 PRO B 36 -1.232 -5.021 -30.550 1.00 0.00 H new ATOM 0 HD3 PRO B 36 -2.604 -6.035 -30.147 1.00 0.00 H new ATOM 1038 N HIS B 37 -1.314 -2.069 -31.134 1.00 0.00 N ATOM 1039 CA HIS B 37 -0.293 -1.050 -31.563 1.00 0.00 C ATOM 1040 C HIS B 37 -0.073 0.009 -30.466 1.00 0.00 C ATOM 1041 O HIS B 37 0.788 0.860 -30.598 1.00 0.00 O ATOM 1042 CB HIS B 37 -0.723 -0.356 -32.867 1.00 0.00 C ATOM 1043 CG HIS B 37 0.497 0.020 -33.662 1.00 0.00 C ATOM 1044 ND1 HIS B 37 1.193 -0.901 -34.429 1.00 0.00 N ATOM 1045 CD2 HIS B 37 1.157 1.213 -33.820 1.00 0.00 C ATOM 1046 CE1 HIS B 37 2.220 -0.252 -35.009 1.00 0.00 C ATOM 1047 NE2 HIS B 37 2.244 1.039 -34.671 1.00 0.00 N ATOM 0 H HIS B 37 -0.918 -2.961 -30.838 1.00 0.00 H new ATOM 0 HA HIS B 37 0.644 -1.580 -31.735 1.00 0.00 H new ATOM 0 HB2 HIS B 37 -1.360 -1.020 -33.451 1.00 0.00 H new ATOM 0 HB3 HIS B 37 -1.311 0.533 -32.641 1.00 0.00 H new ATOM 0 HD2 HIS B 37 0.875 2.146 -33.354 1.00 0.00 H new ATOM 0 HE1 HIS B 37 2.937 -0.719 -35.668 1.00 0.00 H new ATOM 0 HE2 HIS B 37 2.915 1.746 -34.972 1.00 0.00 H new ATOM 1055 N TYR B 38 -0.819 -0.037 -29.387 1.00 0.00 N ATOM 1056 CA TYR B 38 -0.625 0.961 -28.291 1.00 0.00 C ATOM 1057 C TYR B 38 -0.179 0.230 -27.021 1.00 0.00 C ATOM 1058 O TYR B 38 0.568 0.759 -26.220 1.00 0.00 O ATOM 1059 CB TYR B 38 -1.933 1.716 -28.024 1.00 0.00 C ATOM 1060 CG TYR B 38 -3.083 0.744 -27.891 1.00 0.00 C ATOM 1061 CD1 TYR B 38 -3.401 0.199 -26.641 1.00 0.00 C ATOM 1062 CD2 TYR B 38 -3.837 0.396 -29.019 1.00 0.00 C ATOM 1063 CE1 TYR B 38 -4.472 -0.695 -26.519 1.00 0.00 C ATOM 1064 CE2 TYR B 38 -4.907 -0.499 -28.897 1.00 0.00 C ATOM 1065 CZ TYR B 38 -5.225 -1.044 -27.647 1.00 0.00 C ATOM 1066 OH TYR B 38 -6.279 -1.926 -27.527 1.00 0.00 O ATOM 0 H TYR B 38 -1.554 -0.724 -29.220 1.00 0.00 H new ATOM 0 HA TYR B 38 0.138 1.681 -28.589 1.00 0.00 H new ATOM 0 HB2 TYR B 38 -1.840 2.307 -27.113 1.00 0.00 H new ATOM 0 HB3 TYR B 38 -2.130 2.414 -28.838 1.00 0.00 H new ATOM 0 HD1 TYR B 38 -2.820 0.468 -25.771 1.00 0.00 H new ATOM 0 HD2 TYR B 38 -3.593 0.818 -29.983 1.00 0.00 H new ATOM 0 HE1 TYR B 38 -4.717 -1.115 -25.555 1.00 0.00 H new ATOM 0 HE2 TYR B 38 -5.487 -0.769 -29.767 1.00 0.00 H new ATOM 0 HH TYR B 38 -6.696 -2.059 -28.404 1.00 0.00 H new ATOM 1076 N LEU B 39 -0.624 -0.988 -26.840 1.00 0.00 N ATOM 1077 CA LEU B 39 -0.230 -1.777 -25.637 1.00 0.00 C ATOM 1078 C LEU B 39 1.308 -1.873 -25.527 1.00 0.00 C ATOM 1079 O LEU B 39 1.856 -1.588 -24.478 1.00 0.00 O ATOM 1080 CB LEU B 39 -0.835 -3.187 -25.741 1.00 0.00 C ATOM 1081 CG LEU B 39 -1.738 -3.475 -24.528 1.00 0.00 C ATOM 1082 CD1 LEU B 39 -0.941 -3.324 -23.222 1.00 0.00 C ATOM 1083 CD2 LEU B 39 -2.917 -2.495 -24.523 1.00 0.00 C ATOM 0 H LEU B 39 -1.250 -1.473 -27.483 1.00 0.00 H new ATOM 0 HA LEU B 39 -0.606 -1.277 -24.744 1.00 0.00 H new ATOM 0 HB2 LEU B 39 -1.413 -3.275 -26.661 1.00 0.00 H new ATOM 0 HB3 LEU B 39 -0.038 -3.929 -25.793 1.00 0.00 H new ATOM 0 HG LEU B 39 -2.109 -4.497 -24.600 1.00 0.00 H new ATOM 0 HD11 LEU B 39 -1.592 -3.531 -22.373 1.00 0.00 H new ATOM 0 HD12 LEU B 39 -0.108 -4.027 -23.221 1.00 0.00 H new ATOM 0 HD13 LEU B 39 -0.557 -2.307 -23.146 1.00 0.00 H new ATOM 0 HD21 LEU B 39 -3.556 -2.699 -23.664 1.00 0.00 H new ATOM 0 HD22 LEU B 39 -2.541 -1.474 -24.461 1.00 0.00 H new ATOM 0 HD23 LEU B 39 -3.493 -2.614 -25.441 1.00 0.00 H new ATOM 1095 N PRO B 40 1.979 -2.270 -26.598 1.00 0.00 N ATOM 1096 CA PRO B 40 3.474 -2.400 -26.606 1.00 0.00 C ATOM 1097 C PRO B 40 4.142 -1.019 -26.605 1.00 0.00 C ATOM 1098 O PRO B 40 5.314 -0.890 -26.298 1.00 0.00 O ATOM 1099 CB PRO B 40 3.771 -3.176 -27.880 1.00 0.00 C ATOM 1100 CG PRO B 40 2.597 -2.968 -28.810 1.00 0.00 C ATOM 1101 CD PRO B 40 1.386 -2.631 -27.942 1.00 0.00 C ATOM 0 HA PRO B 40 3.862 -2.906 -25.722 1.00 0.00 H new ATOM 0 HB2 PRO B 40 4.694 -2.823 -28.340 1.00 0.00 H new ATOM 0 HB3 PRO B 40 3.908 -4.235 -27.663 1.00 0.00 H new ATOM 0 HG2 PRO B 40 2.802 -2.161 -29.514 1.00 0.00 H new ATOM 0 HG3 PRO B 40 2.410 -3.865 -29.400 1.00 0.00 H new ATOM 0 HD2 PRO B 40 0.815 -1.802 -28.360 1.00 0.00 H new ATOM 0 HD3 PRO B 40 0.706 -3.479 -27.862 1.00 0.00 H new ATOM 1109 N GLN B 41 3.403 0.016 -26.920 1.00 0.00 N ATOM 1110 CA GLN B 41 3.983 1.386 -26.909 1.00 0.00 C ATOM 1111 C GLN B 41 4.059 1.865 -25.455 1.00 0.00 C ATOM 1112 O GLN B 41 4.941 2.616 -25.078 1.00 0.00 O ATOM 1113 CB GLN B 41 3.080 2.322 -27.721 1.00 0.00 C ATOM 1114 CG GLN B 41 3.649 3.745 -27.712 1.00 0.00 C ATOM 1115 CD GLN B 41 4.980 3.768 -28.465 1.00 0.00 C ATOM 1116 OE1 GLN B 41 5.140 3.093 -29.462 1.00 0.00 O ATOM 1117 NE2 GLN B 41 5.951 4.523 -28.028 1.00 0.00 N ATOM 0 H GLN B 41 2.419 -0.034 -27.185 1.00 0.00 H new ATOM 0 HA GLN B 41 4.980 1.384 -27.350 1.00 0.00 H new ATOM 0 HB2 GLN B 41 2.999 1.962 -28.746 1.00 0.00 H new ATOM 0 HB3 GLN B 41 2.074 2.322 -27.302 1.00 0.00 H new ATOM 0 HG2 GLN B 41 2.944 4.433 -28.178 1.00 0.00 H new ATOM 0 HG3 GLN B 41 3.794 4.084 -26.686 1.00 0.00 H new ATOM 0 HE21 GLN B 41 5.819 5.091 -27.191 1.00 0.00 H new ATOM 0 HE22 GLN B 41 6.842 4.545 -28.524 1.00 0.00 H new ATOM 1126 N LEU B 42 3.129 1.436 -24.641 1.00 0.00 N ATOM 1127 CA LEU B 42 3.117 1.859 -23.222 1.00 0.00 C ATOM 1128 C LEU B 42 4.166 1.065 -22.443 1.00 0.00 C ATOM 1129 O LEU B 42 4.870 1.606 -21.611 1.00 0.00 O ATOM 1130 CB LEU B 42 1.730 1.585 -22.616 1.00 0.00 C ATOM 1131 CG LEU B 42 0.587 2.447 -23.244 1.00 0.00 C ATOM 1132 CD1 LEU B 42 1.040 3.302 -24.443 1.00 0.00 C ATOM 1133 CD2 LEU B 42 -0.539 1.518 -23.710 1.00 0.00 C ATOM 0 H LEU B 42 2.373 0.805 -24.908 1.00 0.00 H new ATOM 0 HA LEU B 42 3.342 2.924 -23.163 1.00 0.00 H new ATOM 0 HB2 LEU B 42 1.489 0.530 -22.745 1.00 0.00 H new ATOM 0 HB3 LEU B 42 1.768 1.775 -21.543 1.00 0.00 H new ATOM 0 HG LEU B 42 0.255 3.135 -22.467 1.00 0.00 H new ATOM 0 HD11 LEU B 42 0.193 3.872 -24.825 1.00 0.00 H new ATOM 0 HD12 LEU B 42 1.825 3.988 -24.125 1.00 0.00 H new ATOM 0 HD13 LEU B 42 1.424 2.652 -25.229 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -1.341 2.111 -24.150 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -0.152 0.822 -24.454 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -0.926 0.959 -22.858 1.00 0.00 H new ATOM 1145 N ARG B 43 4.276 -0.218 -22.700 1.00 0.00 N ATOM 1146 CA ARG B 43 5.281 -1.040 -21.969 1.00 0.00 C ATOM 1147 C ARG B 43 6.682 -0.514 -22.284 1.00 0.00 C ATOM 1148 O ARG B 43 7.507 -0.354 -21.401 1.00 0.00 O ATOM 1149 CB ARG B 43 5.154 -2.515 -22.378 1.00 0.00 C ATOM 1150 CG ARG B 43 5.567 -2.721 -23.839 1.00 0.00 C ATOM 1151 CD ARG B 43 5.333 -4.182 -24.232 1.00 0.00 C ATOM 1152 NE ARG B 43 6.079 -4.482 -25.493 1.00 0.00 N ATOM 1153 CZ ARG B 43 5.791 -5.539 -26.227 1.00 0.00 C ATOM 1154 NH1 ARG B 43 4.838 -6.375 -25.887 1.00 0.00 N ATOM 1155 NH2 ARG B 43 6.471 -5.759 -27.320 1.00 0.00 N ATOM 0 H ARG B 43 3.713 -0.726 -23.383 1.00 0.00 H new ATOM 0 HA ARG B 43 5.104 -0.968 -20.896 1.00 0.00 H new ATOM 0 HB2 ARG B 43 5.779 -3.130 -21.730 1.00 0.00 H new ATOM 0 HB3 ARG B 43 4.125 -2.847 -22.238 1.00 0.00 H new ATOM 0 HG2 ARG B 43 4.991 -2.062 -24.488 1.00 0.00 H new ATOM 0 HG3 ARG B 43 6.617 -2.461 -23.972 1.00 0.00 H new ATOM 0 HD2 ARG B 43 5.667 -4.843 -23.433 1.00 0.00 H new ATOM 0 HD3 ARG B 43 4.268 -4.366 -24.374 1.00 0.00 H new ATOM 0 HE ARG B 43 6.827 -3.856 -25.792 1.00 0.00 H new ATOM 0 HH11 ARG B 43 4.299 -6.215 -25.036 1.00 0.00 H new ATOM 0 HH12 ARG B 43 4.637 -7.185 -26.474 1.00 0.00 H new ATOM 0 HH21 ARG B 43 7.214 -5.117 -27.596 1.00 0.00 H new ATOM 0 HH22 ARG B 43 6.259 -6.573 -27.897 1.00 0.00 H new ATOM 1169 N LYS B 44 6.955 -0.225 -23.535 1.00 0.00 N ATOM 1170 CA LYS B 44 8.290 0.303 -23.885 1.00 0.00 C ATOM 1171 C LYS B 44 8.456 1.670 -23.212 1.00 0.00 C ATOM 1172 O LYS B 44 9.541 2.053 -22.826 1.00 0.00 O ATOM 1173 CB LYS B 44 8.431 0.420 -25.412 1.00 0.00 C ATOM 1174 CG LYS B 44 7.480 1.486 -25.966 1.00 0.00 C ATOM 1175 CD LYS B 44 7.721 1.659 -27.467 1.00 0.00 C ATOM 1176 CE LYS B 44 7.224 0.420 -28.219 1.00 0.00 C ATOM 1177 NZ LYS B 44 8.201 0.064 -29.287 1.00 0.00 N ATOM 0 H LYS B 44 6.309 -0.335 -24.316 1.00 0.00 H new ATOM 0 HA LYS B 44 9.069 -0.373 -23.534 1.00 0.00 H new ATOM 0 HB2 LYS B 44 9.459 0.675 -25.668 1.00 0.00 H new ATOM 0 HB3 LYS B 44 8.216 -0.542 -25.876 1.00 0.00 H new ATOM 0 HG2 LYS B 44 6.445 1.194 -25.785 1.00 0.00 H new ATOM 0 HG3 LYS B 44 7.639 2.433 -25.450 1.00 0.00 H new ATOM 0 HD2 LYS B 44 7.202 2.547 -27.828 1.00 0.00 H new ATOM 0 HD3 LYS B 44 8.783 1.810 -27.659 1.00 0.00 H new ATOM 0 HE2 LYS B 44 7.104 -0.414 -27.528 1.00 0.00 H new ATOM 0 HE3 LYS B 44 6.245 0.615 -28.657 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 7.865 -0.777 -29.798 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 8.294 0.859 -29.951 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 9.126 -0.139 -28.858 1.00 0.00 H new ATOM 1191 N ASP B 45 7.372 2.396 -23.056 1.00 0.00 N ATOM 1192 CA ASP B 45 7.450 3.720 -22.394 1.00 0.00 C ATOM 1193 C ASP B 45 7.877 3.526 -20.938 1.00 0.00 C ATOM 1194 O ASP B 45 8.759 4.206 -20.457 1.00 0.00 O ATOM 1195 CB ASP B 45 6.084 4.404 -22.440 1.00 0.00 C ATOM 1196 CG ASP B 45 5.808 4.917 -23.856 1.00 0.00 C ATOM 1197 OD1 ASP B 45 6.758 5.278 -24.532 1.00 0.00 O ATOM 1198 OD2 ASP B 45 4.651 4.943 -24.240 1.00 0.00 O ATOM 0 H ASP B 45 6.439 2.120 -23.362 1.00 0.00 H new ATOM 0 HA ASP B 45 8.178 4.344 -22.912 1.00 0.00 H new ATOM 0 HB2 ASP B 45 5.306 3.703 -22.139 1.00 0.00 H new ATOM 0 HB3 ASP B 45 6.058 5.232 -21.732 1.00 0.00 H new ATOM 1203 N ILE B 46 7.266 2.596 -20.231 1.00 0.00 N ATOM 1204 CA ILE B 46 7.653 2.367 -18.804 1.00 0.00 C ATOM 1205 C ILE B 46 9.141 1.990 -18.736 1.00 0.00 C ATOM 1206 O ILE B 46 9.817 2.276 -17.765 1.00 0.00 O ATOM 1207 CB ILE B 46 6.758 1.274 -18.172 1.00 0.00 C ATOM 1208 CG1 ILE B 46 6.961 1.283 -16.652 1.00 0.00 C ATOM 1209 CG2 ILE B 46 7.070 -0.128 -18.724 1.00 0.00 C ATOM 1210 CD1 ILE B 46 5.958 0.336 -15.989 1.00 0.00 C ATOM 0 H ILE B 46 6.522 1.992 -20.582 1.00 0.00 H new ATOM 0 HA ILE B 46 7.502 3.281 -18.230 1.00 0.00 H new ATOM 0 HB ILE B 46 5.722 1.500 -18.426 1.00 0.00 H new ATOM 0 HG12 ILE B 46 7.979 0.977 -16.410 1.00 0.00 H new ATOM 0 HG13 ILE B 46 6.832 2.294 -16.265 1.00 0.00 H new ATOM 0 HG21 ILE B 46 6.416 -0.860 -18.250 1.00 0.00 H new ATOM 0 HG22 ILE B 46 6.906 -0.140 -19.802 1.00 0.00 H new ATOM 0 HG23 ILE B 46 8.109 -0.379 -18.512 1.00 0.00 H new ATOM 0 HD11 ILE B 46 6.107 0.346 -14.909 1.00 0.00 H new ATOM 0 HD12 ILE B 46 4.943 0.662 -16.219 1.00 0.00 H new ATOM 0 HD13 ILE B 46 6.108 -0.675 -16.366 1.00 0.00 H new ATOM 1222 N LEU B 47 9.657 1.371 -19.774 1.00 0.00 N ATOM 1223 CA LEU B 47 11.097 1.004 -19.789 1.00 0.00 C ATOM 1224 C LEU B 47 11.915 2.293 -19.844 1.00 0.00 C ATOM 1225 O LEU B 47 12.838 2.491 -19.074 1.00 0.00 O ATOM 1226 CB LEU B 47 11.400 0.150 -21.021 1.00 0.00 C ATOM 1227 CG LEU B 47 10.983 -1.298 -20.760 1.00 0.00 C ATOM 1228 CD1 LEU B 47 10.919 -2.058 -22.086 1.00 0.00 C ATOM 1229 CD2 LEU B 47 12.011 -1.963 -19.843 1.00 0.00 C ATOM 0 H LEU B 47 9.135 1.107 -20.610 1.00 0.00 H new ATOM 0 HA LEU B 47 11.350 0.432 -18.896 1.00 0.00 H new ATOM 0 HB2 LEU B 47 10.866 0.542 -21.887 1.00 0.00 H new ATOM 0 HB3 LEU B 47 12.464 0.196 -21.254 1.00 0.00 H new ATOM 0 HG LEU B 47 10.002 -1.315 -20.284 1.00 0.00 H new ATOM 0 HD11 LEU B 47 10.622 -3.090 -21.900 1.00 0.00 H new ATOM 0 HD12 LEU B 47 10.190 -1.583 -22.743 1.00 0.00 H new ATOM 0 HD13 LEU B 47 11.900 -2.043 -22.562 1.00 0.00 H new ATOM 0 HD21 LEU B 47 11.717 -2.996 -19.655 1.00 0.00 H new ATOM 0 HD22 LEU B 47 12.990 -1.946 -20.322 1.00 0.00 H new ATOM 0 HD23 LEU B 47 12.060 -1.422 -18.898 1.00 0.00 H new ATOM 1241 N GLU B 48 11.558 3.184 -20.738 1.00 0.00 N ATOM 1242 CA GLU B 48 12.286 4.479 -20.837 1.00 0.00 C ATOM 1243 C GLU B 48 12.010 5.266 -19.574 1.00 0.00 C ATOM 1244 O GLU B 48 12.873 5.940 -19.043 1.00 0.00 O ATOM 1245 CB GLU B 48 11.786 5.297 -22.029 1.00 0.00 C ATOM 1246 CG GLU B 48 11.740 4.437 -23.286 1.00 0.00 C ATOM 1247 CD GLU B 48 13.151 3.964 -23.646 1.00 0.00 C ATOM 1248 OE1 GLU B 48 13.973 4.805 -23.967 1.00 0.00 O ATOM 1249 OE2 GLU B 48 13.384 2.767 -23.595 1.00 0.00 O ATOM 0 H GLU B 48 10.793 3.066 -21.402 1.00 0.00 H new ATOM 0 HA GLU B 48 13.350 4.282 -20.967 1.00 0.00 H new ATOM 0 HB2 GLU B 48 10.793 5.692 -21.815 1.00 0.00 H new ATOM 0 HB3 GLU B 48 12.441 6.153 -22.191 1.00 0.00 H new ATOM 0 HG2 GLU B 48 11.089 3.578 -23.126 1.00 0.00 H new ATOM 0 HG3 GLU B 48 11.317 5.008 -24.112 1.00 0.00 H new ATOM 1256 N VAL B 49 10.797 5.179 -19.085 1.00 0.00 N ATOM 1257 CA VAL B 49 10.437 5.913 -17.845 1.00 0.00 C ATOM 1258 C VAL B 49 11.364 5.439 -16.721 1.00 0.00 C ATOM 1259 O VAL B 49 12.052 6.224 -16.105 1.00 0.00 O ATOM 1260 CB VAL B 49 8.970 5.644 -17.482 1.00 0.00 C ATOM 1261 CG1 VAL B 49 8.600 6.405 -16.203 1.00 0.00 C ATOM 1262 CG2 VAL B 49 8.063 6.114 -18.629 1.00 0.00 C ATOM 0 H VAL B 49 10.043 4.629 -19.496 1.00 0.00 H new ATOM 0 HA VAL B 49 10.556 6.986 -17.993 1.00 0.00 H new ATOM 0 HB VAL B 49 8.834 4.575 -17.319 1.00 0.00 H new ATOM 0 HG11 VAL B 49 7.558 6.209 -15.952 1.00 0.00 H new ATOM 0 HG12 VAL B 49 9.239 6.073 -15.385 1.00 0.00 H new ATOM 0 HG13 VAL B 49 8.740 7.474 -16.362 1.00 0.00 H new ATOM 0 HG21 VAL B 49 7.021 5.923 -18.371 1.00 0.00 H new ATOM 0 HG22 VAL B 49 8.206 7.182 -18.792 1.00 0.00 H new ATOM 0 HG23 VAL B 49 8.317 5.571 -19.539 1.00 0.00 H new ATOM 1272 N ILE B 50 11.421 4.148 -16.481 1.00 0.00 N ATOM 1273 CA ILE B 50 12.343 3.622 -15.425 1.00 0.00 C ATOM 1274 C ILE B 50 13.775 4.079 -15.740 1.00 0.00 C ATOM 1275 O ILE B 50 14.609 4.176 -14.862 1.00 0.00 O ATOM 1276 CB ILE B 50 12.274 2.091 -15.391 1.00 0.00 C ATOM 1277 CG1 ILE B 50 10.827 1.653 -15.146 1.00 0.00 C ATOM 1278 CG2 ILE B 50 13.158 1.559 -14.260 1.00 0.00 C ATOM 1279 CD1 ILE B 50 10.573 0.314 -15.840 1.00 0.00 C ATOM 0 H ILE B 50 10.871 3.441 -16.969 1.00 0.00 H new ATOM 0 HA ILE B 50 12.045 4.006 -14.450 1.00 0.00 H new ATOM 0 HB ILE B 50 12.624 1.694 -16.344 1.00 0.00 H new ATOM 0 HG12 ILE B 50 10.640 1.561 -14.076 1.00 0.00 H new ATOM 0 HG13 ILE B 50 10.138 2.408 -15.526 1.00 0.00 H new ATOM 0 HG21 ILE B 50 13.106 0.470 -14.239 1.00 0.00 H new ATOM 0 HG22 ILE B 50 14.189 1.870 -14.427 1.00 0.00 H new ATOM 0 HG23 ILE B 50 12.809 1.957 -13.307 1.00 0.00 H new ATOM 0 HD11 ILE B 50 9.543 0.003 -15.665 1.00 0.00 H new ATOM 0 HD12 ILE B 50 10.743 0.422 -16.911 1.00 0.00 H new ATOM 0 HD13 ILE B 50 11.252 -0.438 -15.439 1.00 0.00 H new ATOM 1291 N CYS B 51 14.053 4.378 -16.989 1.00 0.00 N ATOM 1292 CA CYS B 51 15.408 4.851 -17.367 1.00 0.00 C ATOM 1293 C CYS B 51 15.578 6.305 -16.912 1.00 0.00 C ATOM 1294 O CYS B 51 16.582 6.672 -16.337 1.00 0.00 O ATOM 1295 CB CYS B 51 15.571 4.766 -18.889 1.00 0.00 C ATOM 1296 SG CYS B 51 17.332 4.799 -19.309 1.00 0.00 S ATOM 0 H CYS B 51 13.390 4.311 -17.761 1.00 0.00 H new ATOM 0 HA CYS B 51 16.163 4.228 -16.888 1.00 0.00 H new ATOM 0 HB2 CYS B 51 15.114 3.850 -19.264 1.00 0.00 H new ATOM 0 HB3 CYS B 51 15.056 5.599 -19.368 1.00 0.00 H new ATOM 0 HG CYS B 51 17.472 4.725 -20.599 1.00 0.00 H new ATOM 1302 N LYS B 52 14.598 7.136 -17.162 1.00 0.00 N ATOM 1303 CA LYS B 52 14.693 8.574 -16.748 1.00 0.00 C ATOM 1304 C LYS B 52 14.931 8.671 -15.239 1.00 0.00 C ATOM 1305 O LYS B 52 15.580 9.583 -14.760 1.00 0.00 O ATOM 1306 CB LYS B 52 13.388 9.307 -17.073 1.00 0.00 C ATOM 1307 CG LYS B 52 13.055 9.184 -18.560 1.00 0.00 C ATOM 1308 CD LYS B 52 11.548 9.383 -18.750 1.00 0.00 C ATOM 1309 CE LYS B 52 11.266 10.847 -19.093 1.00 0.00 C ATOM 1310 NZ LYS B 52 11.372 11.041 -20.566 1.00 0.00 N ATOM 0 H LYS B 52 13.732 6.882 -17.637 1.00 0.00 H new ATOM 0 HA LYS B 52 15.522 9.029 -17.291 1.00 0.00 H new ATOM 0 HB2 LYS B 52 12.574 8.893 -16.478 1.00 0.00 H new ATOM 0 HB3 LYS B 52 13.478 10.359 -16.801 1.00 0.00 H new ATOM 0 HG2 LYS B 52 13.608 9.928 -19.133 1.00 0.00 H new ATOM 0 HG3 LYS B 52 13.356 8.205 -18.934 1.00 0.00 H new ATOM 0 HD2 LYS B 52 11.182 8.735 -19.546 1.00 0.00 H new ATOM 0 HD3 LYS B 52 11.016 9.102 -17.841 1.00 0.00 H new ATOM 0 HE2 LYS B 52 10.270 11.127 -18.749 1.00 0.00 H new ATOM 0 HE3 LYS B 52 11.975 11.495 -18.578 1.00 0.00 H new ATOM 0 HZ1 LYS B 52 11.180 12.036 -20.800 1.00 0.00 H new ATOM 0 HZ2 LYS B 52 12.331 10.790 -20.881 1.00 0.00 H new ATOM 0 HZ3 LYS B 52 10.679 10.433 -21.047 1.00 0.00 H new ATOM 1324 N TYR B 53 14.392 7.747 -14.490 1.00 0.00 N ATOM 1325 CA TYR B 53 14.552 7.775 -13.016 1.00 0.00 C ATOM 1326 C TYR B 53 15.618 6.756 -12.578 1.00 0.00 C ATOM 1327 O TYR B 53 16.093 6.798 -11.458 1.00 0.00 O ATOM 1328 CB TYR B 53 13.213 7.403 -12.368 1.00 0.00 C ATOM 1329 CG TYR B 53 12.131 8.407 -12.723 1.00 0.00 C ATOM 1330 CD1 TYR B 53 11.690 8.536 -14.047 1.00 0.00 C ATOM 1331 CD2 TYR B 53 11.547 9.190 -11.720 1.00 0.00 C ATOM 1332 CE1 TYR B 53 10.676 9.441 -14.369 1.00 0.00 C ATOM 1333 CE2 TYR B 53 10.527 10.096 -12.044 1.00 0.00 C ATOM 1334 CZ TYR B 53 10.093 10.220 -13.370 1.00 0.00 C ATOM 1335 OH TYR B 53 9.089 11.112 -13.688 1.00 0.00 O ATOM 0 H TYR B 53 13.841 6.966 -14.846 1.00 0.00 H new ATOM 0 HA TYR B 53 14.863 8.773 -12.706 1.00 0.00 H new ATOM 0 HB2 TYR B 53 12.911 6.408 -12.697 1.00 0.00 H new ATOM 0 HB3 TYR B 53 13.330 7.359 -11.285 1.00 0.00 H new ATOM 0 HD1 TYR B 53 12.137 7.932 -14.823 1.00 0.00 H new ATOM 0 HD2 TYR B 53 11.882 9.096 -10.698 1.00 0.00 H new ATOM 0 HE1 TYR B 53 10.343 9.537 -15.392 1.00 0.00 H new ATOM 0 HE2 TYR B 53 10.075 10.699 -11.270 1.00 0.00 H new ATOM 0 HH TYR B 53 8.792 11.574 -12.876 1.00 0.00 H new ATOM 1345 N VAL B 54 15.986 5.828 -13.437 1.00 0.00 N ATOM 1346 CA VAL B 54 17.007 4.795 -13.053 1.00 0.00 C ATOM 1347 C VAL B 54 17.759 4.352 -14.331 1.00 0.00 C ATOM 1348 O VAL B 54 18.092 5.179 -15.155 1.00 0.00 O ATOM 1349 CB VAL B 54 16.318 3.585 -12.370 1.00 0.00 C ATOM 1350 CG1 VAL B 54 17.332 2.869 -11.474 1.00 0.00 C ATOM 1351 CG2 VAL B 54 15.136 4.038 -11.502 1.00 0.00 C ATOM 0 H VAL B 54 15.623 5.742 -14.386 1.00 0.00 H new ATOM 0 HA VAL B 54 17.716 5.216 -12.340 1.00 0.00 H new ATOM 0 HB VAL B 54 15.949 2.918 -13.149 1.00 0.00 H new ATOM 0 HG11 VAL B 54 16.853 2.017 -10.991 1.00 0.00 H new ATOM 0 HG12 VAL B 54 18.169 2.520 -12.079 1.00 0.00 H new ATOM 0 HG13 VAL B 54 17.697 3.559 -10.713 1.00 0.00 H new ATOM 0 HG21 VAL B 54 14.673 3.168 -11.036 1.00 0.00 H new ATOM 0 HG22 VAL B 54 15.492 4.718 -10.728 1.00 0.00 H new ATOM 0 HG23 VAL B 54 14.402 4.550 -12.125 1.00 0.00 H new ATOM 1361 N GLN B 55 18.041 3.073 -14.515 1.00 0.00 N ATOM 1362 CA GLN B 55 18.763 2.639 -15.747 1.00 0.00 C ATOM 1363 C GLN B 55 18.757 1.111 -15.830 1.00 0.00 C ATOM 1364 O GLN B 55 19.446 0.433 -15.090 1.00 0.00 O ATOM 1365 CB GLN B 55 20.204 3.154 -15.702 1.00 0.00 C ATOM 1366 CG GLN B 55 20.495 3.993 -16.950 1.00 0.00 C ATOM 1367 CD GLN B 55 22.006 4.079 -17.169 1.00 0.00 C ATOM 1368 OE1 GLN B 55 22.728 4.569 -16.322 1.00 0.00 O ATOM 1369 NE2 GLN B 55 22.520 3.619 -18.277 1.00 0.00 N ATOM 0 H GLN B 55 17.801 2.324 -13.866 1.00 0.00 H new ATOM 0 HA GLN B 55 18.265 3.047 -16.626 1.00 0.00 H new ATOM 0 HB2 GLN B 55 20.357 3.754 -14.805 1.00 0.00 H new ATOM 0 HB3 GLN B 55 20.898 2.315 -15.647 1.00 0.00 H new ATOM 0 HG2 GLN B 55 20.016 3.546 -17.821 1.00 0.00 H new ATOM 0 HG3 GLN B 55 20.077 4.993 -16.834 1.00 0.00 H new ATOM 0 HE21 GLN B 55 21.915 3.208 -18.988 1.00 0.00 H new ATOM 0 HE22 GLN B 55 23.527 3.671 -18.432 1.00 0.00 H new ATOM 1378 N ILE B 56 17.979 0.572 -16.727 1.00 0.00 N ATOM 1379 CA ILE B 56 17.901 -0.913 -16.881 1.00 0.00 C ATOM 1380 C ILE B 56 17.811 -1.263 -18.364 1.00 0.00 C ATOM 1381 O ILE B 56 17.590 -0.406 -19.201 1.00 0.00 O ATOM 1382 CB ILE B 56 16.662 -1.455 -16.155 1.00 0.00 C ATOM 1383 CG1 ILE B 56 15.471 -0.504 -16.356 1.00 0.00 C ATOM 1384 CG2 ILE B 56 16.968 -1.587 -14.665 1.00 0.00 C ATOM 1385 CD1 ILE B 56 14.202 -1.318 -16.619 1.00 0.00 C ATOM 0 H ILE B 56 17.387 1.100 -17.368 1.00 0.00 H new ATOM 0 HA ILE B 56 18.794 -1.364 -16.447 1.00 0.00 H new ATOM 0 HB ILE B 56 16.405 -2.432 -16.566 1.00 0.00 H new ATOM 0 HG12 ILE B 56 15.338 0.120 -15.472 1.00 0.00 H new ATOM 0 HG13 ILE B 56 15.665 0.166 -17.193 1.00 0.00 H new ATOM 0 HG21 ILE B 56 16.090 -1.972 -14.146 1.00 0.00 H new ATOM 0 HG22 ILE B 56 17.803 -2.274 -14.524 1.00 0.00 H new ATOM 0 HG23 ILE B 56 17.230 -0.610 -14.259 1.00 0.00 H new ATOM 0 HD11 ILE B 56 13.359 -0.642 -16.761 1.00 0.00 H new ATOM 0 HD12 ILE B 56 14.337 -1.923 -17.516 1.00 0.00 H new ATOM 0 HD13 ILE B 56 14.005 -1.970 -15.768 1.00 0.00 H new ATOM 1397 N ASP B 57 17.973 -2.517 -18.694 1.00 0.00 N ATOM 1398 CA ASP B 57 17.892 -2.938 -20.121 1.00 0.00 C ATOM 1399 C ASP B 57 16.521 -3.583 -20.371 1.00 0.00 C ATOM 1400 O ASP B 57 15.842 -3.943 -19.430 1.00 0.00 O ATOM 1401 CB ASP B 57 18.997 -3.954 -20.416 1.00 0.00 C ATOM 1402 CG ASP B 57 20.279 -3.216 -20.806 1.00 0.00 C ATOM 1403 OD1 ASP B 57 20.427 -2.905 -21.977 1.00 0.00 O ATOM 1404 OD2 ASP B 57 21.091 -2.975 -19.928 1.00 0.00 O ATOM 0 H ASP B 57 18.159 -3.271 -18.032 1.00 0.00 H new ATOM 0 HA ASP B 57 18.017 -2.072 -20.771 1.00 0.00 H new ATOM 0 HB2 ASP B 57 19.176 -4.577 -19.540 1.00 0.00 H new ATOM 0 HB3 ASP B 57 18.688 -4.619 -21.222 1.00 0.00 H new ATOM 1409 N PRO B 58 16.143 -3.724 -21.625 1.00 0.00 N ATOM 1410 CA PRO B 58 14.833 -4.341 -22.008 1.00 0.00 C ATOM 1411 C PRO B 58 14.886 -5.849 -21.788 1.00 0.00 C ATOM 1412 O PRO B 58 13.887 -6.476 -21.487 1.00 0.00 O ATOM 1413 CB PRO B 58 14.672 -3.984 -23.478 1.00 0.00 C ATOM 1414 CG PRO B 58 16.062 -3.727 -24.023 1.00 0.00 C ATOM 1415 CD PRO B 58 16.941 -3.313 -22.840 1.00 0.00 C ATOM 0 HA PRO B 58 13.992 -3.983 -21.415 1.00 0.00 H new ATOM 0 HB2 PRO B 58 14.188 -4.795 -24.022 1.00 0.00 H new ATOM 0 HB3 PRO B 58 14.042 -3.102 -23.595 1.00 0.00 H new ATOM 0 HG2 PRO B 58 16.459 -4.622 -24.503 1.00 0.00 H new ATOM 0 HG3 PRO B 58 16.040 -2.943 -24.779 1.00 0.00 H new ATOM 0 HD2 PRO B 58 17.909 -3.813 -22.869 1.00 0.00 H new ATOM 0 HD3 PRO B 58 17.136 -2.241 -22.845 1.00 0.00 H new ATOM 1423 N GLU B 59 16.053 -6.430 -21.902 1.00 0.00 N ATOM 1424 CA GLU B 59 16.184 -7.893 -21.660 1.00 0.00 C ATOM 1425 C GLU B 59 15.958 -8.181 -20.164 1.00 0.00 C ATOM 1426 O GLU B 59 15.780 -9.318 -19.769 1.00 0.00 O ATOM 1427 CB GLU B 59 17.586 -8.355 -22.062 1.00 0.00 C ATOM 1428 CG GLU B 59 17.663 -8.483 -23.585 1.00 0.00 C ATOM 1429 CD GLU B 59 18.679 -9.566 -23.956 1.00 0.00 C ATOM 1430 OE1 GLU B 59 18.543 -10.672 -23.462 1.00 0.00 O ATOM 1431 OE2 GLU B 59 19.577 -9.269 -24.726 1.00 0.00 O ATOM 0 H GLU B 59 16.919 -5.952 -22.152 1.00 0.00 H new ATOM 0 HA GLU B 59 15.443 -8.429 -22.253 1.00 0.00 H new ATOM 0 HB2 GLU B 59 18.331 -7.642 -21.708 1.00 0.00 H new ATOM 0 HB3 GLU B 59 17.813 -9.313 -21.594 1.00 0.00 H new ATOM 0 HG2 GLU B 59 16.683 -8.735 -23.989 1.00 0.00 H new ATOM 0 HG3 GLU B 59 17.954 -7.530 -24.026 1.00 0.00 H new ATOM 1438 N MET B 60 15.960 -7.159 -19.330 1.00 0.00 N ATOM 1439 CA MET B 60 15.743 -7.372 -17.871 1.00 0.00 C ATOM 1440 C MET B 60 14.249 -7.249 -17.535 1.00 0.00 C ATOM 1441 O MET B 60 13.827 -7.592 -16.447 1.00 0.00 O ATOM 1442 CB MET B 60 16.527 -6.309 -17.094 1.00 0.00 C ATOM 1443 CG MET B 60 18.002 -6.720 -16.995 1.00 0.00 C ATOM 1444 SD MET B 60 18.354 -7.373 -15.341 1.00 0.00 S ATOM 1445 CE MET B 60 18.495 -5.780 -14.496 1.00 0.00 C ATOM 0 H MET B 60 16.104 -6.188 -19.606 1.00 0.00 H new ATOM 0 HA MET B 60 16.086 -8.369 -17.596 1.00 0.00 H new ATOM 0 HB2 MET B 60 16.442 -5.344 -17.593 1.00 0.00 H new ATOM 0 HB3 MET B 60 16.105 -6.190 -16.096 1.00 0.00 H new ATOM 0 HG2 MET B 60 18.229 -7.474 -17.749 1.00 0.00 H new ATOM 0 HG3 MET B 60 18.642 -5.862 -17.200 1.00 0.00 H new ATOM 0 HE1 MET B 60 18.152 -5.883 -13.466 1.00 0.00 H new ATOM 0 HE2 MET B 60 19.536 -5.456 -14.501 1.00 0.00 H new ATOM 0 HE3 MET B 60 17.882 -5.040 -15.010 1.00 0.00 H new ATOM 1455 N VAL B 61 13.446 -6.754 -18.452 1.00 0.00 N ATOM 1456 CA VAL B 61 11.988 -6.603 -18.172 1.00 0.00 C ATOM 1457 C VAL B 61 11.194 -7.637 -18.982 1.00 0.00 C ATOM 1458 O VAL B 61 11.324 -7.723 -20.188 1.00 0.00 O ATOM 1459 CB VAL B 61 11.551 -5.188 -18.563 1.00 0.00 C ATOM 1460 CG1 VAL B 61 10.078 -4.977 -18.205 1.00 0.00 C ATOM 1461 CG2 VAL B 61 12.408 -4.168 -17.808 1.00 0.00 C ATOM 0 H VAL B 61 13.742 -6.450 -19.380 1.00 0.00 H new ATOM 0 HA VAL B 61 11.797 -6.766 -17.111 1.00 0.00 H new ATOM 0 HB VAL B 61 11.679 -5.057 -19.637 1.00 0.00 H new ATOM 0 HG11 VAL B 61 9.776 -3.968 -18.487 1.00 0.00 H new ATOM 0 HG12 VAL B 61 9.466 -5.702 -18.741 1.00 0.00 H new ATOM 0 HG13 VAL B 61 9.942 -5.110 -17.132 1.00 0.00 H new ATOM 0 HG21 VAL B 61 12.100 -3.159 -18.083 1.00 0.00 H new ATOM 0 HG22 VAL B 61 12.278 -4.307 -16.735 1.00 0.00 H new ATOM 0 HG23 VAL B 61 13.457 -4.311 -18.068 1.00 0.00 H new ATOM 1471 N THR B 62 10.372 -8.419 -18.324 1.00 0.00 N ATOM 1472 CA THR B 62 9.567 -9.446 -19.041 1.00 0.00 C ATOM 1473 C THR B 62 8.220 -8.854 -19.454 1.00 0.00 C ATOM 1474 O THR B 62 7.742 -7.899 -18.870 1.00 0.00 O ATOM 1475 CB THR B 62 9.319 -10.649 -18.127 1.00 0.00 C ATOM 1476 OG1 THR B 62 10.504 -10.950 -17.405 1.00 0.00 O ATOM 1477 CG2 THR B 62 8.908 -11.857 -18.972 1.00 0.00 C ATOM 0 H THR B 62 10.227 -8.386 -17.315 1.00 0.00 H new ATOM 0 HA THR B 62 10.117 -9.765 -19.926 1.00 0.00 H new ATOM 0 HB THR B 62 8.520 -10.412 -17.424 1.00 0.00 H new ATOM 0 HG1 THR B 62 10.344 -11.719 -16.819 1.00 0.00 H new ATOM 0 HG21 THR B 62 8.732 -12.713 -18.321 1.00 0.00 H new ATOM 0 HG22 THR B 62 7.995 -11.624 -19.520 1.00 0.00 H new ATOM 0 HG23 THR B 62 9.704 -12.095 -19.677 1.00 0.00 H new ATOM 1485 N VAL B 63 7.602 -9.428 -20.452 1.00 0.00 N ATOM 1486 CA VAL B 63 6.277 -8.928 -20.914 1.00 0.00 C ATOM 1487 C VAL B 63 5.418 -10.124 -21.318 1.00 0.00 C ATOM 1488 O VAL B 63 5.803 -10.916 -22.158 1.00 0.00 O ATOM 1489 CB VAL B 63 6.472 -8.008 -22.115 1.00 0.00 C ATOM 1490 CG1 VAL B 63 5.132 -7.384 -22.509 1.00 0.00 C ATOM 1491 CG2 VAL B 63 7.461 -6.902 -21.753 1.00 0.00 C ATOM 0 H VAL B 63 7.963 -10.229 -20.970 1.00 0.00 H new ATOM 0 HA VAL B 63 5.787 -8.372 -20.115 1.00 0.00 H new ATOM 0 HB VAL B 63 6.861 -8.586 -22.953 1.00 0.00 H new ATOM 0 HG11 VAL B 63 5.275 -6.727 -23.367 1.00 0.00 H new ATOM 0 HG12 VAL B 63 4.426 -8.173 -22.769 1.00 0.00 H new ATOM 0 HG13 VAL B 63 4.739 -6.807 -21.672 1.00 0.00 H new ATOM 0 HG21 VAL B 63 7.601 -6.244 -22.611 1.00 0.00 H new ATOM 0 HG22 VAL B 63 7.071 -6.326 -20.914 1.00 0.00 H new ATOM 0 HG23 VAL B 63 8.417 -7.345 -21.476 1.00 0.00 H new ATOM 1501 N GLN B 64 4.267 -10.266 -20.720 1.00 0.00 N ATOM 1502 CA GLN B 64 3.385 -11.416 -21.053 1.00 0.00 C ATOM 1503 C GLN B 64 1.922 -10.963 -21.042 1.00 0.00 C ATOM 1504 O GLN B 64 1.447 -10.402 -20.072 1.00 0.00 O ATOM 1505 CB GLN B 64 3.604 -12.525 -20.017 1.00 0.00 C ATOM 1506 CG GLN B 64 3.339 -11.978 -18.610 1.00 0.00 C ATOM 1507 CD GLN B 64 4.319 -12.613 -17.621 1.00 0.00 C ATOM 1508 OE1 GLN B 64 4.374 -13.819 -17.491 1.00 0.00 O ATOM 1509 NE2 GLN B 64 5.102 -11.846 -16.913 1.00 0.00 N ATOM 0 H GLN B 64 3.899 -9.631 -20.012 1.00 0.00 H new ATOM 0 HA GLN B 64 3.625 -11.795 -22.046 1.00 0.00 H new ATOM 0 HB2 GLN B 64 2.939 -13.364 -20.222 1.00 0.00 H new ATOM 0 HB3 GLN B 64 4.624 -12.903 -20.085 1.00 0.00 H new ATOM 0 HG2 GLN B 64 3.451 -10.894 -18.603 1.00 0.00 H new ATOM 0 HG3 GLN B 64 2.313 -12.195 -18.312 1.00 0.00 H new ATOM 0 HE21 GLN B 64 5.057 -10.833 -17.021 1.00 0.00 H new ATOM 0 HE22 GLN B 64 5.759 -12.260 -16.252 1.00 0.00 H new ATOM 1518 N LEU B 65 1.210 -11.188 -22.120 1.00 0.00 N ATOM 1519 CA LEU B 65 -0.212 -10.758 -22.187 1.00 0.00 C ATOM 1520 C LEU B 65 -1.143 -11.938 -21.910 1.00 0.00 C ATOM 1521 O LEU B 65 -0.752 -13.088 -21.984 1.00 0.00 O ATOM 1522 CB LEU B 65 -0.503 -10.197 -23.578 1.00 0.00 C ATOM 1523 CG LEU B 65 -0.096 -11.216 -24.650 1.00 0.00 C ATOM 1524 CD1 LEU B 65 -1.137 -11.225 -25.772 1.00 0.00 C ATOM 1525 CD2 LEU B 65 1.269 -10.832 -25.229 1.00 0.00 C ATOM 0 H LEU B 65 1.559 -11.654 -22.958 1.00 0.00 H new ATOM 0 HA LEU B 65 -0.385 -9.992 -21.431 1.00 0.00 H new ATOM 0 HB2 LEU B 65 -1.564 -9.964 -23.670 1.00 0.00 H new ATOM 0 HB3 LEU B 65 0.043 -9.265 -23.725 1.00 0.00 H new ATOM 0 HG LEU B 65 -0.037 -12.207 -24.200 1.00 0.00 H new ATOM 0 HD11 LEU B 65 -0.846 -11.950 -26.533 1.00 0.00 H new ATOM 0 HD12 LEU B 65 -2.110 -11.499 -25.364 1.00 0.00 H new ATOM 0 HD13 LEU B 65 -1.198 -10.233 -26.220 1.00 0.00 H new ATOM 0 HD21 LEU B 65 1.558 -11.556 -25.991 1.00 0.00 H new ATOM 0 HD22 LEU B 65 1.208 -9.840 -25.676 1.00 0.00 H new ATOM 0 HD23 LEU B 65 2.013 -10.826 -24.433 1.00 0.00 H new ATOM 1537 N GLU B 66 -2.380 -11.651 -21.590 1.00 0.00 N ATOM 1538 CA GLU B 66 -3.364 -12.733 -21.303 1.00 0.00 C ATOM 1539 C GLU B 66 -4.764 -12.256 -21.692 1.00 0.00 C ATOM 1540 O GLU B 66 -4.945 -11.127 -22.100 1.00 0.00 O ATOM 1541 CB GLU B 66 -3.327 -13.070 -19.806 1.00 0.00 C ATOM 1542 CG GLU B 66 -2.031 -13.808 -19.469 1.00 0.00 C ATOM 1543 CD GLU B 66 -1.982 -15.144 -20.216 1.00 0.00 C ATOM 1544 OE1 GLU B 66 -2.891 -15.937 -20.031 1.00 0.00 O ATOM 1545 OE2 GLU B 66 -1.039 -15.350 -20.960 1.00 0.00 O ATOM 0 H GLU B 66 -2.751 -10.704 -21.515 1.00 0.00 H new ATOM 0 HA GLU B 66 -3.112 -13.624 -21.878 1.00 0.00 H new ATOM 0 HB2 GLU B 66 -3.398 -12.156 -19.217 1.00 0.00 H new ATOM 0 HB3 GLU B 66 -4.186 -13.687 -19.542 1.00 0.00 H new ATOM 0 HG2 GLU B 66 -1.172 -13.196 -19.744 1.00 0.00 H new ATOM 0 HG3 GLU B 66 -1.969 -13.980 -18.394 1.00 0.00 H new ATOM 1552 N GLN B 67 -5.750 -13.109 -21.580 1.00 0.00 N ATOM 1553 CA GLN B 67 -7.139 -12.708 -21.952 1.00 0.00 C ATOM 1554 C GLN B 67 -8.144 -13.489 -21.101 1.00 0.00 C ATOM 1555 O GLN B 67 -7.862 -14.580 -20.642 1.00 0.00 O ATOM 1556 CB GLN B 67 -7.382 -13.019 -23.432 1.00 0.00 C ATOM 1557 CG GLN B 67 -6.614 -12.020 -24.301 1.00 0.00 C ATOM 1558 CD GLN B 67 -6.776 -12.394 -25.776 1.00 0.00 C ATOM 1559 OE1 GLN B 67 -7.836 -12.813 -26.196 1.00 0.00 O ATOM 1560 NE2 GLN B 67 -5.759 -12.261 -26.584 1.00 0.00 N ATOM 0 H GLN B 67 -5.652 -14.068 -21.246 1.00 0.00 H new ATOM 0 HA GLN B 67 -7.265 -11.640 -21.777 1.00 0.00 H new ATOM 0 HB2 GLN B 67 -7.060 -14.035 -23.658 1.00 0.00 H new ATOM 0 HB3 GLN B 67 -8.448 -12.966 -23.655 1.00 0.00 H new ATOM 0 HG2 GLN B 67 -6.986 -11.010 -24.128 1.00 0.00 H new ATOM 0 HG3 GLN B 67 -5.559 -12.021 -24.029 1.00 0.00 H new ATOM 0 HE21 GLN B 67 -4.869 -11.909 -26.230 1.00 0.00 H new ATOM 0 HE22 GLN B 67 -5.854 -12.509 -27.569 1.00 0.00 H new ATOM 1569 N LYS B 68 -9.314 -12.939 -20.892 1.00 0.00 N ATOM 1570 CA LYS B 68 -10.344 -13.649 -20.075 1.00 0.00 C ATOM 1571 C LYS B 68 -11.521 -14.041 -20.971 1.00 0.00 C ATOM 1572 O LYS B 68 -11.628 -13.597 -22.100 1.00 0.00 O ATOM 1573 CB LYS B 68 -10.836 -12.731 -18.952 1.00 0.00 C ATOM 1574 CG LYS B 68 -9.764 -12.629 -17.855 1.00 0.00 C ATOM 1575 CD LYS B 68 -9.418 -11.160 -17.600 1.00 0.00 C ATOM 1576 CE LYS B 68 -10.613 -10.457 -16.953 1.00 0.00 C ATOM 1577 NZ LYS B 68 -10.683 -10.823 -15.510 1.00 0.00 N ATOM 0 H LYS B 68 -9.600 -12.029 -21.252 1.00 0.00 H new ATOM 0 HA LYS B 68 -9.905 -14.546 -19.638 1.00 0.00 H new ATOM 0 HB2 LYS B 68 -11.057 -11.741 -19.350 1.00 0.00 H new ATOM 0 HB3 LYS B 68 -11.763 -13.120 -18.532 1.00 0.00 H new ATOM 0 HG2 LYS B 68 -10.126 -13.091 -16.937 1.00 0.00 H new ATOM 0 HG3 LYS B 68 -8.870 -13.175 -18.156 1.00 0.00 H new ATOM 0 HD2 LYS B 68 -8.546 -11.089 -16.950 1.00 0.00 H new ATOM 0 HD3 LYS B 68 -9.158 -10.669 -18.538 1.00 0.00 H new ATOM 0 HE2 LYS B 68 -10.515 -9.377 -17.061 1.00 0.00 H new ATOM 0 HE3 LYS B 68 -11.535 -10.745 -17.458 1.00 0.00 H new ATOM 0 HZ1 LYS B 68 -11.359 -10.198 -15.026 1.00 0.00 H new ATOM 0 HZ2 LYS B 68 -10.996 -11.810 -15.417 1.00 0.00 H new ATOM 0 HZ3 LYS B 68 -9.743 -10.716 -15.079 1.00 0.00 H new ATOM 1591 N ASP B 69 -12.402 -14.874 -20.477 1.00 0.00 N ATOM 1592 CA ASP B 69 -13.571 -15.310 -21.292 1.00 0.00 C ATOM 1593 C ASP B 69 -14.642 -14.207 -21.347 1.00 0.00 C ATOM 1594 O ASP B 69 -15.654 -14.362 -22.006 1.00 0.00 O ATOM 1595 CB ASP B 69 -14.177 -16.570 -20.670 1.00 0.00 C ATOM 1596 CG ASP B 69 -13.307 -17.779 -21.016 1.00 0.00 C ATOM 1597 OD1 ASP B 69 -12.917 -17.895 -22.166 1.00 0.00 O ATOM 1598 OD2 ASP B 69 -13.045 -18.570 -20.124 1.00 0.00 O ATOM 0 H ASP B 69 -12.359 -15.272 -19.539 1.00 0.00 H new ATOM 0 HA ASP B 69 -13.231 -15.516 -22.307 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -14.247 -16.457 -19.588 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -15.191 -16.720 -21.041 1.00 0.00 H new ATOM 1603 N GLY B 70 -14.441 -13.102 -20.663 1.00 0.00 N ATOM 1604 CA GLY B 70 -15.460 -12.010 -20.688 1.00 0.00 C ATOM 1605 C GLY B 70 -15.058 -10.945 -21.709 1.00 0.00 C ATOM 1606 O GLY B 70 -15.313 -9.770 -21.523 1.00 0.00 O ATOM 0 H GLY B 70 -13.617 -12.913 -20.092 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -16.438 -12.419 -20.942 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -15.550 -11.562 -19.698 1.00 0.00 H new ATOM 1610 N ASP B 71 -14.425 -11.346 -22.784 1.00 0.00 N ATOM 1611 CA ASP B 71 -13.993 -10.365 -23.829 1.00 0.00 C ATOM 1612 C ASP B 71 -13.056 -9.336 -23.196 1.00 0.00 C ATOM 1613 O ASP B 71 -13.213 -8.141 -23.370 1.00 0.00 O ATOM 1614 CB ASP B 71 -15.218 -9.660 -24.421 1.00 0.00 C ATOM 1615 CG ASP B 71 -15.890 -10.576 -25.446 1.00 0.00 C ATOM 1616 OD1 ASP B 71 -15.464 -10.563 -26.589 1.00 0.00 O ATOM 1617 OD2 ASP B 71 -16.818 -11.272 -25.071 1.00 0.00 O ATOM 0 H ASP B 71 -14.187 -12.318 -22.984 1.00 0.00 H new ATOM 0 HA ASP B 71 -13.470 -10.891 -24.628 1.00 0.00 H new ATOM 0 HB2 ASP B 71 -15.922 -9.405 -23.629 1.00 0.00 H new ATOM 0 HB3 ASP B 71 -14.919 -8.725 -24.894 1.00 0.00 H new ATOM 1622 N ILE B 72 -12.094 -9.800 -22.447 1.00 0.00 N ATOM 1623 CA ILE B 72 -11.148 -8.869 -21.771 1.00 0.00 C ATOM 1624 C ILE B 72 -9.709 -9.276 -22.093 1.00 0.00 C ATOM 1625 O ILE B 72 -9.439 -10.407 -22.450 1.00 0.00 O ATOM 1626 CB ILE B 72 -11.374 -8.933 -20.257 1.00 0.00 C ATOM 1627 CG1 ILE B 72 -12.887 -8.840 -19.965 1.00 0.00 C ATOM 1628 CG2 ILE B 72 -10.622 -7.776 -19.592 1.00 0.00 C ATOM 1629 CD1 ILE B 72 -13.149 -8.689 -18.458 1.00 0.00 C ATOM 0 H ILE B 72 -11.922 -10.790 -22.273 1.00 0.00 H new ATOM 0 HA ILE B 72 -11.320 -7.852 -22.124 1.00 0.00 H new ATOM 0 HB ILE B 72 -10.999 -9.875 -19.856 1.00 0.00 H new ATOM 0 HG12 ILE B 72 -13.312 -7.990 -20.499 1.00 0.00 H new ATOM 0 HG13 ILE B 72 -13.388 -9.733 -20.337 1.00 0.00 H new ATOM 0 HG21 ILE B 72 -10.777 -7.813 -18.514 1.00 0.00 H new ATOM 0 HG22 ILE B 72 -9.557 -7.862 -19.809 1.00 0.00 H new ATOM 0 HG23 ILE B 72 -10.996 -6.828 -19.980 1.00 0.00 H new ATOM 0 HD11 ILE B 72 -14.222 -8.626 -18.280 1.00 0.00 H new ATOM 0 HD12 ILE B 72 -12.744 -9.552 -17.930 1.00 0.00 H new ATOM 0 HD13 ILE B 72 -12.667 -7.782 -18.094 1.00 0.00 H new ATOM 1641 N SER B 73 -8.786 -8.357 -21.967 1.00 0.00 N ATOM 1642 CA SER B 73 -7.357 -8.672 -22.258 1.00 0.00 C ATOM 1643 C SER B 73 -6.504 -8.264 -21.062 1.00 0.00 C ATOM 1644 O SER B 73 -6.939 -7.523 -20.200 1.00 0.00 O ATOM 1645 CB SER B 73 -6.906 -7.899 -23.497 1.00 0.00 C ATOM 1646 OG SER B 73 -7.952 -7.904 -24.461 1.00 0.00 O ATOM 0 H SER B 73 -8.963 -7.396 -21.673 1.00 0.00 H new ATOM 0 HA SER B 73 -7.245 -9.741 -22.441 1.00 0.00 H new ATOM 0 HB2 SER B 73 -6.650 -6.875 -23.227 1.00 0.00 H new ATOM 0 HB3 SER B 73 -6.008 -8.353 -23.916 1.00 0.00 H new ATOM 0 HG SER B 73 -7.666 -7.407 -25.256 1.00 0.00 H new ATOM 1652 N ILE B 74 -5.298 -8.756 -20.999 1.00 0.00 N ATOM 1653 CA ILE B 74 -4.405 -8.422 -19.858 1.00 0.00 C ATOM 1654 C ILE B 74 -2.975 -8.245 -20.376 1.00 0.00 C ATOM 1655 O ILE B 74 -2.648 -8.662 -21.471 1.00 0.00 O ATOM 1656 CB ILE B 74 -4.459 -9.576 -18.849 1.00 0.00 C ATOM 1657 CG1 ILE B 74 -5.892 -9.730 -18.328 1.00 0.00 C ATOM 1658 CG2 ILE B 74 -3.508 -9.307 -17.674 1.00 0.00 C ATOM 1659 CD1 ILE B 74 -5.984 -10.949 -17.406 1.00 0.00 C ATOM 0 H ILE B 74 -4.891 -9.380 -21.696 1.00 0.00 H new ATOM 0 HA ILE B 74 -4.725 -7.498 -19.377 1.00 0.00 H new ATOM 0 HB ILE B 74 -4.147 -10.495 -19.346 1.00 0.00 H new ATOM 0 HG12 ILE B 74 -6.190 -8.831 -17.788 1.00 0.00 H new ATOM 0 HG13 ILE B 74 -6.582 -9.843 -19.164 1.00 0.00 H new ATOM 0 HG21 ILE B 74 -3.559 -10.136 -16.968 1.00 0.00 H new ATOM 0 HG22 ILE B 74 -2.488 -9.210 -18.046 1.00 0.00 H new ATOM 0 HG23 ILE B 74 -3.801 -8.384 -17.173 1.00 0.00 H new ATOM 0 HD11 ILE B 74 -7.005 -11.052 -17.040 1.00 0.00 H new ATOM 0 HD12 ILE B 74 -5.705 -11.846 -17.959 1.00 0.00 H new ATOM 0 HD13 ILE B 74 -5.307 -10.818 -16.562 1.00 0.00 H new ATOM 1671 N LEU B 75 -2.125 -7.637 -19.590 1.00 0.00 N ATOM 1672 CA LEU B 75 -0.717 -7.438 -20.020 1.00 0.00 C ATOM 1673 C LEU B 75 0.181 -7.317 -18.790 1.00 0.00 C ATOM 1674 O LEU B 75 0.308 -6.260 -18.202 1.00 0.00 O ATOM 1675 CB LEU B 75 -0.604 -6.170 -20.871 1.00 0.00 C ATOM 1676 CG LEU B 75 0.800 -6.088 -21.498 1.00 0.00 C ATOM 1677 CD1 LEU B 75 0.700 -6.238 -23.019 1.00 0.00 C ATOM 1678 CD2 LEU B 75 1.439 -4.736 -21.163 1.00 0.00 C ATOM 0 H LEU B 75 -2.350 -7.270 -18.666 1.00 0.00 H new ATOM 0 HA LEU B 75 -0.400 -8.294 -20.616 1.00 0.00 H new ATOM 0 HB2 LEU B 75 -1.362 -6.177 -21.654 1.00 0.00 H new ATOM 0 HB3 LEU B 75 -0.790 -5.290 -20.255 1.00 0.00 H new ATOM 0 HG LEU B 75 1.416 -6.892 -21.094 1.00 0.00 H new ATOM 0 HD11 LEU B 75 1.697 -6.179 -23.457 1.00 0.00 H new ATOM 0 HD12 LEU B 75 0.254 -7.203 -23.261 1.00 0.00 H new ATOM 0 HD13 LEU B 75 0.078 -5.439 -23.423 1.00 0.00 H new ATOM 0 HD21 LEU B 75 2.432 -4.683 -21.609 1.00 0.00 H new ATOM 0 HD22 LEU B 75 0.819 -3.932 -21.560 1.00 0.00 H new ATOM 0 HD23 LEU B 75 1.521 -4.630 -20.081 1.00 0.00 H new ATOM 1690 N GLU B 76 0.806 -8.398 -18.405 1.00 0.00 N ATOM 1691 CA GLU B 76 1.707 -8.370 -17.220 1.00 0.00 C ATOM 1692 C GLU B 76 3.142 -8.159 -17.700 1.00 0.00 C ATOM 1693 O GLU B 76 3.536 -8.676 -18.725 1.00 0.00 O ATOM 1694 CB GLU B 76 1.619 -9.706 -16.474 1.00 0.00 C ATOM 1695 CG GLU B 76 0.152 -10.070 -16.221 1.00 0.00 C ATOM 1696 CD GLU B 76 0.078 -11.397 -15.465 1.00 0.00 C ATOM 1697 OE1 GLU B 76 0.558 -12.386 -15.995 1.00 0.00 O ATOM 1698 OE2 GLU B 76 -0.456 -11.402 -14.367 1.00 0.00 O ATOM 0 H GLU B 76 0.729 -9.305 -18.865 1.00 0.00 H new ATOM 0 HA GLU B 76 1.410 -7.562 -16.551 1.00 0.00 H new ATOM 0 HB2 GLU B 76 2.101 -10.490 -17.058 1.00 0.00 H new ATOM 0 HB3 GLU B 76 2.154 -9.639 -15.527 1.00 0.00 H new ATOM 0 HG2 GLU B 76 -0.335 -9.283 -15.644 1.00 0.00 H new ATOM 0 HG3 GLU B 76 -0.383 -10.148 -17.168 1.00 0.00 H new ATOM 1705 N LEU B 77 3.927 -7.412 -16.970 1.00 0.00 N ATOM 1706 CA LEU B 77 5.341 -7.182 -17.389 1.00 0.00 C ATOM 1707 C LEU B 77 6.245 -7.225 -16.158 1.00 0.00 C ATOM 1708 O LEU B 77 6.024 -6.530 -15.184 1.00 0.00 O ATOM 1709 CB LEU B 77 5.472 -5.822 -18.088 1.00 0.00 C ATOM 1710 CG LEU B 77 4.813 -4.724 -17.250 1.00 0.00 C ATOM 1711 CD1 LEU B 77 5.478 -3.382 -17.560 1.00 0.00 C ATOM 1712 CD2 LEU B 77 3.324 -4.643 -17.597 1.00 0.00 C ATOM 0 H LEU B 77 3.651 -6.952 -16.103 1.00 0.00 H new ATOM 0 HA LEU B 77 5.641 -7.962 -18.088 1.00 0.00 H new ATOM 0 HB2 LEU B 77 6.525 -5.586 -18.244 1.00 0.00 H new ATOM 0 HB3 LEU B 77 5.006 -5.866 -19.072 1.00 0.00 H new ATOM 0 HG LEU B 77 4.929 -4.955 -16.191 1.00 0.00 H new ATOM 0 HD11 LEU B 77 5.010 -2.598 -16.964 1.00 0.00 H new ATOM 0 HD12 LEU B 77 6.539 -3.437 -17.318 1.00 0.00 H new ATOM 0 HD13 LEU B 77 5.359 -3.153 -18.619 1.00 0.00 H new ATOM 0 HD21 LEU B 77 2.853 -3.861 -17.001 1.00 0.00 H new ATOM 0 HD22 LEU B 77 3.209 -4.410 -18.656 1.00 0.00 H new ATOM 0 HD23 LEU B 77 2.848 -5.600 -17.382 1.00 0.00 H new ATOM 1724 N ASN B 78 7.260 -8.045 -16.190 1.00 0.00 N ATOM 1725 CA ASN B 78 8.180 -8.144 -15.031 1.00 0.00 C ATOM 1726 C ASN B 78 9.301 -7.127 -15.209 1.00 0.00 C ATOM 1727 O ASN B 78 9.774 -6.913 -16.305 1.00 0.00 O ATOM 1728 CB ASN B 78 8.789 -9.543 -14.989 1.00 0.00 C ATOM 1729 CG ASN B 78 7.693 -10.613 -15.096 1.00 0.00 C ATOM 1730 OD1 ASN B 78 7.917 -11.670 -15.649 1.00 0.00 O ATOM 1731 ND2 ASN B 78 6.511 -10.384 -14.587 1.00 0.00 N ATOM 0 H ASN B 78 7.489 -8.653 -16.976 1.00 0.00 H new ATOM 0 HA ASN B 78 7.635 -7.950 -14.107 1.00 0.00 H new ATOM 0 HB2 ASN B 78 9.500 -9.660 -15.806 1.00 0.00 H new ATOM 0 HB3 ASN B 78 9.345 -9.676 -14.061 1.00 0.00 H new ATOM 0 HD21 ASN B 78 5.780 -11.092 -14.655 1.00 0.00 H new ATOM 0 HD22 ASN B 78 6.319 -9.497 -14.122 1.00 0.00 H new ATOM 1738 N VAL B 79 9.726 -6.497 -14.147 1.00 0.00 N ATOM 1739 CA VAL B 79 10.821 -5.490 -14.266 1.00 0.00 C ATOM 1740 C VAL B 79 11.939 -5.830 -13.278 1.00 0.00 C ATOM 1741 O VAL B 79 11.903 -5.436 -12.128 1.00 0.00 O ATOM 1742 CB VAL B 79 10.274 -4.093 -13.966 1.00 0.00 C ATOM 1743 CG1 VAL B 79 11.325 -3.054 -14.354 1.00 0.00 C ATOM 1744 CG2 VAL B 79 8.985 -3.854 -14.773 1.00 0.00 C ATOM 0 H VAL B 79 9.363 -6.635 -13.204 1.00 0.00 H new ATOM 0 HA VAL B 79 11.218 -5.508 -15.281 1.00 0.00 H new ATOM 0 HB VAL B 79 10.047 -4.008 -12.903 1.00 0.00 H new ATOM 0 HG11 VAL B 79 10.944 -2.055 -14.144 1.00 0.00 H new ATOM 0 HG12 VAL B 79 12.235 -3.224 -13.778 1.00 0.00 H new ATOM 0 HG13 VAL B 79 11.547 -3.141 -15.418 1.00 0.00 H new ATOM 0 HG21 VAL B 79 8.599 -2.858 -14.556 1.00 0.00 H new ATOM 0 HG22 VAL B 79 9.202 -3.935 -15.838 1.00 0.00 H new ATOM 0 HG23 VAL B 79 8.239 -4.600 -14.497 1.00 0.00 H new ATOM 1754 N THR B 80 12.929 -6.561 -13.724 1.00 0.00 N ATOM 1755 CA THR B 80 14.058 -6.942 -12.824 1.00 0.00 C ATOM 1756 C THR B 80 15.108 -5.829 -12.806 1.00 0.00 C ATOM 1757 O THR B 80 15.861 -5.660 -13.746 1.00 0.00 O ATOM 1758 CB THR B 80 14.699 -8.235 -13.339 1.00 0.00 C ATOM 1759 OG1 THR B 80 13.697 -9.232 -13.481 1.00 0.00 O ATOM 1760 CG2 THR B 80 15.762 -8.714 -12.348 1.00 0.00 C ATOM 0 H THR B 80 13.003 -6.912 -14.679 1.00 0.00 H new ATOM 0 HA THR B 80 13.678 -7.093 -11.814 1.00 0.00 H new ATOM 0 HB THR B 80 15.168 -8.048 -14.305 1.00 0.00 H new ATOM 0 HG1 THR B 80 14.104 -10.060 -13.812 1.00 0.00 H new ATOM 0 HG21 THR B 80 16.216 -9.634 -12.717 1.00 0.00 H new ATOM 0 HG22 THR B 80 16.530 -7.948 -12.240 1.00 0.00 H new ATOM 0 HG23 THR B 80 15.298 -8.902 -11.380 1.00 0.00 H new ATOM 1768 N LEU B 81 15.166 -5.074 -11.737 1.00 0.00 N ATOM 1769 CA LEU B 81 16.166 -3.979 -11.639 1.00 0.00 C ATOM 1770 C LEU B 81 17.455 -4.536 -11.004 1.00 0.00 C ATOM 1771 O LEU B 81 17.378 -5.316 -10.076 1.00 0.00 O ATOM 1772 CB LEU B 81 15.598 -2.875 -10.748 1.00 0.00 C ATOM 1773 CG LEU B 81 14.262 -2.387 -11.317 1.00 0.00 C ATOM 1774 CD1 LEU B 81 13.313 -2.041 -10.168 1.00 0.00 C ATOM 1775 CD2 LEU B 81 14.495 -1.141 -12.175 1.00 0.00 C ATOM 0 H LEU B 81 14.557 -5.174 -10.925 1.00 0.00 H new ATOM 0 HA LEU B 81 16.388 -3.579 -12.628 1.00 0.00 H new ATOM 0 HB2 LEU B 81 15.457 -3.249 -9.734 1.00 0.00 H new ATOM 0 HB3 LEU B 81 16.303 -2.046 -10.687 1.00 0.00 H new ATOM 0 HG LEU B 81 13.822 -3.174 -11.930 1.00 0.00 H new ATOM 0 HD11 LEU B 81 12.363 -1.694 -10.573 1.00 0.00 H new ATOM 0 HD12 LEU B 81 13.145 -2.927 -9.556 1.00 0.00 H new ATOM 0 HD13 LEU B 81 13.755 -1.255 -9.555 1.00 0.00 H new ATOM 0 HD21 LEU B 81 13.544 -0.795 -12.579 1.00 0.00 H new ATOM 0 HD22 LEU B 81 14.937 -0.355 -11.563 1.00 0.00 H new ATOM 0 HD23 LEU B 81 15.171 -1.385 -12.995 1.00 0.00 H new ATOM 1787 N PRO B 82 18.608 -4.132 -11.508 1.00 0.00 N ATOM 1788 CA PRO B 82 19.934 -4.596 -10.988 1.00 0.00 C ATOM 1789 C PRO B 82 20.379 -3.739 -9.799 1.00 0.00 C ATOM 1790 O PRO B 82 19.641 -2.901 -9.316 1.00 0.00 O ATOM 1791 CB PRO B 82 20.866 -4.399 -12.176 1.00 0.00 C ATOM 1792 CG PRO B 82 20.252 -3.325 -13.057 1.00 0.00 C ATOM 1793 CD PRO B 82 18.784 -3.168 -12.652 1.00 0.00 C ATOM 0 HA PRO B 82 19.916 -5.624 -10.627 1.00 0.00 H new ATOM 0 HB2 PRO B 82 21.859 -4.100 -11.840 1.00 0.00 H new ATOM 0 HB3 PRO B 82 20.984 -5.330 -12.730 1.00 0.00 H new ATOM 0 HG2 PRO B 82 20.784 -2.382 -12.936 1.00 0.00 H new ATOM 0 HG3 PRO B 82 20.330 -3.603 -14.108 1.00 0.00 H new ATOM 0 HD2 PRO B 82 18.563 -2.145 -12.348 1.00 0.00 H new ATOM 0 HD3 PRO B 82 18.115 -3.406 -13.479 1.00 0.00 H new ATOM 1801 N GLU B 83 21.583 -3.949 -9.327 1.00 0.00 N ATOM 1802 CA GLU B 83 22.093 -3.157 -8.170 1.00 0.00 C ATOM 1803 C GLU B 83 22.119 -1.670 -8.538 1.00 0.00 C ATOM 1804 O GLU B 83 21.580 -1.265 -9.552 1.00 0.00 O ATOM 1805 CB GLU B 83 23.513 -3.628 -7.827 1.00 0.00 C ATOM 1806 CG GLU B 83 23.480 -4.490 -6.562 1.00 0.00 C ATOM 1807 CD GLU B 83 24.848 -5.144 -6.354 1.00 0.00 C ATOM 1808 OE1 GLU B 83 25.277 -5.867 -7.238 1.00 0.00 O ATOM 1809 OE2 GLU B 83 25.442 -4.911 -5.314 1.00 0.00 O ATOM 0 H GLU B 83 22.236 -4.639 -9.697 1.00 0.00 H new ATOM 0 HA GLU B 83 21.441 -3.301 -7.309 1.00 0.00 H new ATOM 0 HB2 GLU B 83 23.927 -4.200 -8.657 1.00 0.00 H new ATOM 0 HB3 GLU B 83 24.165 -2.768 -7.676 1.00 0.00 H new ATOM 0 HG2 GLU B 83 23.223 -3.877 -5.698 1.00 0.00 H new ATOM 0 HG3 GLU B 83 22.709 -5.255 -6.651 1.00 0.00 H new ATOM 1816 N ALA B 84 22.745 -0.858 -7.724 1.00 0.00 N ATOM 1817 CA ALA B 84 22.813 0.600 -8.020 1.00 0.00 C ATOM 1818 C ALA B 84 23.768 1.279 -7.037 1.00 0.00 C ATOM 1819 O ALA B 84 24.464 0.625 -6.283 1.00 0.00 O ATOM 1820 CB ALA B 84 21.419 1.215 -7.889 1.00 0.00 C ATOM 0 H ALA B 84 23.213 -1.146 -6.865 1.00 0.00 H new ATOM 0 HA ALA B 84 23.178 0.746 -9.037 1.00 0.00 H new ATOM 0 HB1 ALA B 84 21.470 2.282 -8.106 1.00 0.00 H new ATOM 0 HB2 ALA B 84 20.741 0.734 -8.594 1.00 0.00 H new ATOM 0 HB3 ALA B 84 21.051 1.068 -6.874 1.00 0.00 H new ATOM 1826 N GLU B 85 23.806 2.588 -7.043 1.00 0.00 N ATOM 1827 CA GLU B 85 24.715 3.324 -6.115 1.00 0.00 C ATOM 1828 C GLU B 85 24.341 3.006 -4.666 1.00 0.00 C ATOM 1829 O GLU B 85 25.194 2.742 -3.841 1.00 0.00 O ATOM 1830 CB GLU B 85 24.579 4.829 -6.358 1.00 0.00 C ATOM 1831 CG GLU B 85 25.133 5.174 -7.742 1.00 0.00 C ATOM 1832 CD GLU B 85 24.999 6.679 -7.985 1.00 0.00 C ATOM 1833 OE1 GLU B 85 23.881 7.167 -7.950 1.00 0.00 O ATOM 1834 OE2 GLU B 85 26.015 7.316 -8.204 1.00 0.00 O ATOM 0 H GLU B 85 23.243 3.180 -7.654 1.00 0.00 H new ATOM 0 HA GLU B 85 25.744 3.015 -6.297 1.00 0.00 H new ATOM 0 HB2 GLU B 85 23.533 5.126 -6.289 1.00 0.00 H new ATOM 0 HB3 GLU B 85 25.119 5.383 -5.590 1.00 0.00 H new ATOM 0 HG2 GLU B 85 26.179 4.875 -7.811 1.00 0.00 H new ATOM 0 HG3 GLU B 85 24.592 4.621 -8.510 1.00 0.00 H new ATOM 1841 N GLU B 86 23.068 3.029 -4.353 1.00 0.00 N ATOM 1842 CA GLU B 86 22.622 2.730 -2.958 1.00 0.00 C ATOM 1843 C GLU B 86 23.249 3.740 -1.988 1.00 0.00 C ATOM 1844 O GLU B 86 24.085 3.397 -1.170 1.00 0.00 O ATOM 1845 CB GLU B 86 23.051 1.308 -2.576 1.00 0.00 C ATOM 1846 CG GLU B 86 22.377 0.906 -1.263 1.00 0.00 C ATOM 1847 CD GLU B 86 22.940 -0.437 -0.791 1.00 0.00 C ATOM 1848 OE1 GLU B 86 23.164 -1.291 -1.633 1.00 0.00 O ATOM 1849 OE2 GLU B 86 23.135 -0.588 0.403 1.00 0.00 O ATOM 0 H GLU B 86 22.316 3.243 -5.008 1.00 0.00 H new ATOM 0 HA GLU B 86 21.536 2.806 -2.901 1.00 0.00 H new ATOM 0 HB2 GLU B 86 22.777 0.609 -3.366 1.00 0.00 H new ATOM 0 HB3 GLU B 86 24.135 1.260 -2.470 1.00 0.00 H new ATOM 0 HG2 GLU B 86 22.548 1.671 -0.505 1.00 0.00 H new ATOM 0 HG3 GLU B 86 21.299 0.831 -1.403 1.00 0.00 H new ATOM 1856 N LEU B 87 22.850 4.983 -2.078 1.00 0.00 N ATOM 1857 CA LEU B 87 23.416 6.024 -1.170 1.00 0.00 C ATOM 1858 C LEU B 87 22.565 6.116 0.099 1.00 0.00 C ATOM 1859 O LEU B 87 21.390 6.427 0.048 1.00 0.00 O ATOM 1860 CB LEU B 87 23.427 7.381 -1.887 1.00 0.00 C ATOM 1861 CG LEU B 87 21.998 7.771 -2.310 1.00 0.00 C ATOM 1862 CD1 LEU B 87 21.503 8.939 -1.453 1.00 0.00 C ATOM 1863 CD2 LEU B 87 21.991 8.190 -3.783 1.00 0.00 C ATOM 0 H LEU B 87 22.155 5.322 -2.743 1.00 0.00 H new ATOM 0 HA LEU B 87 24.436 5.753 -0.899 1.00 0.00 H new ATOM 0 HB2 LEU B 87 23.840 8.145 -1.229 1.00 0.00 H new ATOM 0 HB3 LEU B 87 24.073 7.332 -2.764 1.00 0.00 H new ATOM 0 HG LEU B 87 21.341 6.913 -2.170 1.00 0.00 H new ATOM 0 HD11 LEU B 87 20.492 9.210 -1.757 1.00 0.00 H new ATOM 0 HD12 LEU B 87 21.500 8.645 -0.404 1.00 0.00 H new ATOM 0 HD13 LEU B 87 22.164 9.795 -1.588 1.00 0.00 H new ATOM 0 HD21 LEU B 87 20.978 8.465 -4.078 1.00 0.00 H new ATOM 0 HD22 LEU B 87 22.654 9.044 -3.922 1.00 0.00 H new ATOM 0 HD23 LEU B 87 22.336 7.360 -4.399 1.00 0.00 H new ATOM 1875 N LYS B 88 23.153 5.844 1.237 1.00 0.00 N ATOM 1876 CA LYS B 88 22.389 5.911 2.518 1.00 0.00 C ATOM 1877 C LYS B 88 22.999 6.985 3.420 1.00 0.00 C ATOM 1878 O LYS B 88 22.378 7.315 4.418 1.00 0.00 O ATOM 1879 CB LYS B 88 22.454 4.554 3.223 1.00 0.00 C ATOM 1880 CG LYS B 88 23.915 4.128 3.378 1.00 0.00 C ATOM 1881 CD LYS B 88 24.018 3.034 4.443 1.00 0.00 C ATOM 1882 CE LYS B 88 25.158 2.079 4.085 1.00 0.00 C ATOM 1883 NZ LYS B 88 25.726 1.493 5.331 1.00 0.00 N ATOM 1884 OXT LYS B 88 24.075 7.459 3.098 1.00 0.00 O ATOM 0 H LYS B 88 24.133 5.578 1.333 1.00 0.00 H new ATOM 0 HA LYS B 88 21.349 6.161 2.308 1.00 0.00 H new ATOM 0 HB2 LYS B 88 21.977 4.617 4.201 1.00 0.00 H new ATOM 0 HB3 LYS B 88 21.906 3.807 2.649 1.00 0.00 H new ATOM 0 HG2 LYS B 88 24.301 3.762 2.427 1.00 0.00 H new ATOM 0 HG3 LYS B 88 24.527 4.985 3.661 1.00 0.00 H new ATOM 0 HD2 LYS B 88 24.197 3.480 5.421 1.00 0.00 H new ATOM 0 HD3 LYS B 88 23.078 2.486 4.509 1.00 0.00 H new ATOM 0 HE2 LYS B 88 24.791 1.287 3.432 1.00 0.00 H new ATOM 0 HE3 LYS B 88 25.934 2.612 3.535 1.00 0.00 H new ATOM 0 HZ1 LYS B 88 26.501 0.844 5.087 1.00 0.00 H new ATOM 0 HZ2 LYS B 88 26.090 2.255 5.938 1.00 0.00 H new ATOM 0 HZ3 LYS B 88 24.984 0.971 5.839 1.00 0.00 H new TER 1898 LYS B 88