USER MOD reduce.3.24.130724 H: found=0, std=0, add=1204, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1201 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 100 MET CE :methyl -107:sc= -0.613 (180deg=-4.25!) USER MOD Set 1.2: A 101 TYR OH : rot 180:sc= -0.0362 USER MOD Set 2.1: A 58 SER OG : rot 180:sc= 0.0551 USER MOD Set 2.2: A 62 LYS NZ :NH3+ 170:sc= 0.0407 (180deg=0) USER MOD Set 3.1: A 57 MET CE :methyl 166:sc= -3.7 (180deg=-2.92) USER MOD Set 3.2: A 96 CYS SG : rot 94:sc= -2.36! USER MOD Set 4.1: A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Set 4.2: A 36 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 1 MET CE :methyl 160:sc= -2.38 (180deg=-3.35!) USER MOD Set 5.2: A -2 SER OG : rot 180:sc= 0 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot -55:sc= 0.623 USER MOD Single : A 4 SER OG : rot -3:sc= 0.862 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A -1 SER OG : rot 180:sc= -0.449 USER MOD Single : A -3 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 ASN : amide:sc= -0.219 X(o=-0.22,f=-0.38) USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 16 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= 0.156 USER MOD Single : A 23 LYS NZ :NH3+ -164:sc= -0.0673 (180deg=-0.418) USER MOD Single : A 28 THR OG1 : rot -84:sc= 0.465 USER MOD Single : A 29 SER OG : rot -17:sc= 0.392! USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 MET CE :methyl 151:sc= -0.498 (180deg=-2.68!) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot -75:sc= -2.95! USER MOD Single : A 48 TYR OH : rot 174:sc= 0.707 USER MOD Single : A 49 ASN : amide:sc=-0.00324 X(o=-0.0032,f=-0.11) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 59 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 65 ASN : amide:sc= -1.18 X(o=-1.2,f=-1.4) USER MOD Single : A 67 HIS : no HD1:sc= -0.177 X(o=-0.18,f=-0.028) USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 ASN : amide:sc= -0.562 K(o=-0.56,f=-4.3!) USER MOD Single : A 73 HIS : no HD1:sc= -3.1! K(o=-3.1!,f=-1.3) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 MET CE :methyl -116:sc= -14.6! (180deg=-17.3!) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.00472 USER MOD Single : A 81 MET CE :methyl -162:sc= -4.14! (180deg=-5.73!) USER MOD Single : A 83 TYR OH : rot 30:sc= -0.0217 USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot -29:sc= 0.124 USER MOD Single : A 89 SER OG : rot 180:sc= 0.143 USER MOD Single : A 93 SER OG : rot -61:sc= 0.941 USER MOD Single : A 94 GLN : amide:sc= -0.594 X(o=-0.59,f=-0.45!) USER MOD Single : A 95 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN : amide:sc= -0.43 K(o=-0.43,f=-4.3!) USER MOD Single : A 104 GLN : amide:sc= -5.39! C(o=-5.4!,f=-8.7!) USER MOD Single : A 105 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= -1.89! C(o=-1.9!,f=-2.8!) USER MOD Single : A 111 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= -2.09! C(o=-2.1!,f=-3!) USER MOD Single : A 122 ASN : amide:sc= 0 K(o=0,f=0.69) USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 GLN : amide:sc= -0.554 K(o=-0.55,f=-4.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 133.349 40.170 -0.840 1.00 0.00 N ATOM 2 CA GLY A -3 134.676 39.517 -0.649 1.00 0.00 C ATOM 3 C GLY A -3 134.506 38.247 0.185 1.00 0.00 C ATOM 4 O GLY A -3 134.409 38.295 1.395 1.00 0.00 O ATOM 0 H1 GLY A -3 133.466 41.034 -1.407 1.00 0.00 H new ATOM 0 H2 GLY A -3 132.708 39.516 -1.333 1.00 0.00 H new ATOM 0 H3 GLY A -3 132.947 40.416 0.087 1.00 0.00 H new ATOM 0 HA2 GLY A -3 135.115 39.273 -1.616 1.00 0.00 H new ATOM 0 HA3 GLY A -3 135.362 40.202 -0.151 1.00 0.00 H new ATOM 10 N SER A -2 134.469 37.107 -0.451 1.00 0.00 N ATOM 11 CA SER A -2 134.306 35.834 0.307 1.00 0.00 C ATOM 12 C SER A -2 135.085 34.708 -0.375 1.00 0.00 C ATOM 13 O SER A -2 134.824 33.540 -0.163 1.00 0.00 O ATOM 14 CB SER A -2 132.806 35.544 0.278 1.00 0.00 C ATOM 15 OG SER A -2 132.298 35.831 -1.019 1.00 0.00 O ATOM 0 H SER A -2 134.545 37.003 -1.463 1.00 0.00 H new ATOM 0 HA SER A -2 134.686 35.909 1.326 1.00 0.00 H new ATOM 0 HB2 SER A -2 132.621 34.500 0.531 1.00 0.00 H new ATOM 0 HB3 SER A -2 132.292 36.149 1.025 1.00 0.00 H new ATOM 0 HG SER A -2 131.336 35.645 -1.042 1.00 0.00 H new ATOM 21 N SER A -1 136.042 35.048 -1.196 1.00 0.00 N ATOM 22 CA SER A -1 136.838 33.996 -1.892 1.00 0.00 C ATOM 23 C SER A -1 135.915 33.092 -2.715 1.00 0.00 C ATOM 24 O SER A -1 134.710 33.246 -2.708 1.00 0.00 O ATOM 25 CB SER A -1 137.507 33.201 -0.772 1.00 0.00 C ATOM 26 OG SER A -1 137.638 34.026 0.378 1.00 0.00 O ATOM 0 H SER A -1 136.307 36.008 -1.415 1.00 0.00 H new ATOM 0 HA SER A -1 137.567 34.419 -2.583 1.00 0.00 H new ATOM 0 HB2 SER A -1 136.915 32.318 -0.534 1.00 0.00 H new ATOM 0 HB3 SER A -1 138.487 32.850 -1.095 1.00 0.00 H new ATOM 0 HG SER A -1 138.065 33.517 1.098 1.00 0.00 H new ATOM 32 N ARG A 0 136.473 32.150 -3.425 1.00 0.00 N ATOM 33 CA ARG A 0 135.628 31.238 -4.248 1.00 0.00 C ATOM 34 C ARG A 0 134.889 30.242 -3.349 1.00 0.00 C ATOM 35 O ARG A 0 135.169 30.128 -2.172 1.00 0.00 O ATOM 36 CB ARG A 0 136.612 30.505 -5.161 1.00 0.00 C ATOM 37 CG ARG A 0 136.188 30.687 -6.619 1.00 0.00 C ATOM 38 CD ARG A 0 137.424 30.626 -7.521 1.00 0.00 C ATOM 39 NE ARG A 0 137.913 32.031 -7.594 1.00 0.00 N ATOM 40 CZ ARG A 0 139.105 32.282 -8.064 1.00 0.00 C ATOM 41 NH1 ARG A 0 139.736 31.376 -8.759 1.00 0.00 N ATOM 42 NH2 ARG A 0 139.665 33.439 -7.837 1.00 0.00 N ATOM 0 H ARG A 0 137.476 31.972 -3.471 1.00 0.00 H new ATOM 0 HA ARG A 0 134.869 31.778 -4.813 1.00 0.00 H new ATOM 0 HB2 ARG A 0 137.620 30.893 -5.013 1.00 0.00 H new ATOM 0 HB3 ARG A 0 136.638 29.445 -4.908 1.00 0.00 H new ATOM 0 HG2 ARG A 0 135.479 29.909 -6.903 1.00 0.00 H new ATOM 0 HG3 ARG A 0 135.680 31.643 -6.745 1.00 0.00 H new ATOM 0 HD2 ARG A 0 138.184 29.964 -7.106 1.00 0.00 H new ATOM 0 HD3 ARG A 0 137.173 30.243 -8.510 1.00 0.00 H new ATOM 0 HE ARG A 0 137.317 32.796 -7.277 1.00 0.00 H new ATOM 0 HH11 ARG A 0 139.298 30.472 -8.935 1.00 0.00 H new ATOM 0 HH12 ARG A 0 140.667 31.572 -9.126 1.00 0.00 H new ATOM 0 HH21 ARG A 0 139.171 34.146 -7.293 1.00 0.00 H new ATOM 0 HH22 ARG A 0 140.596 33.636 -8.204 1.00 0.00 H new ATOM 56 N MET A 1 133.950 29.519 -3.896 1.00 0.00 N ATOM 57 CA MET A 1 133.196 28.530 -3.075 1.00 0.00 C ATOM 58 C MET A 1 132.773 27.339 -3.939 1.00 0.00 C ATOM 59 O MET A 1 132.906 27.358 -5.146 1.00 0.00 O ATOM 60 CB MET A 1 131.967 29.288 -2.569 1.00 0.00 C ATOM 61 CG MET A 1 131.163 29.812 -3.761 1.00 0.00 C ATOM 62 SD MET A 1 130.525 31.462 -3.380 1.00 0.00 S ATOM 63 CE MET A 1 132.124 32.268 -3.124 1.00 0.00 C ATOM 0 H MET A 1 133.673 29.571 -4.876 1.00 0.00 H new ATOM 0 HA MET A 1 133.795 28.132 -2.256 1.00 0.00 H new ATOM 0 HB2 MET A 1 131.347 28.631 -1.959 1.00 0.00 H new ATOM 0 HB3 MET A 1 132.275 30.117 -1.932 1.00 0.00 H new ATOM 0 HG2 MET A 1 131.793 29.850 -4.650 1.00 0.00 H new ATOM 0 HG3 MET A 1 130.339 29.134 -3.984 1.00 0.00 H new ATOM 0 HE1 MET A 1 132.008 33.347 -3.226 1.00 0.00 H new ATOM 0 HE2 MET A 1 132.493 32.035 -2.125 1.00 0.00 H new ATOM 0 HE3 MET A 1 132.836 31.908 -3.867 1.00 0.00 H new ATOM 73 N SER A 2 132.263 26.303 -3.331 1.00 0.00 N ATOM 74 CA SER A 2 131.833 25.113 -4.120 1.00 0.00 C ATOM 75 C SER A 2 130.608 25.458 -4.972 1.00 0.00 C ATOM 76 O SER A 2 129.573 25.840 -4.462 1.00 0.00 O ATOM 77 CB SER A 2 131.480 24.053 -3.077 1.00 0.00 C ATOM 78 OG SER A 2 131.387 22.784 -3.710 1.00 0.00 O ATOM 0 H SER A 2 132.125 26.229 -2.323 1.00 0.00 H new ATOM 0 HA SER A 2 132.608 24.769 -4.804 1.00 0.00 H new ATOM 0 HB2 SER A 2 132.240 24.028 -2.296 1.00 0.00 H new ATOM 0 HB3 SER A 2 130.535 24.302 -2.594 1.00 0.00 H new ATOM 0 HG SER A 2 131.162 22.102 -3.043 1.00 0.00 H new ATOM 84 N THR A 3 130.715 25.324 -6.265 1.00 0.00 N ATOM 85 CA THR A 3 129.556 25.644 -7.148 1.00 0.00 C ATOM 86 C THR A 3 129.692 24.912 -8.485 1.00 0.00 C ATOM 87 O THR A 3 129.507 25.487 -9.540 1.00 0.00 O ATOM 88 CB THR A 3 129.620 27.159 -7.356 1.00 0.00 C ATOM 89 OG1 THR A 3 128.512 27.574 -8.143 1.00 0.00 O ATOM 90 CG2 THR A 3 130.922 27.525 -8.070 1.00 0.00 C ATOM 0 H THR A 3 131.555 25.007 -6.749 1.00 0.00 H new ATOM 0 HA THR A 3 128.607 25.333 -6.711 1.00 0.00 H new ATOM 0 HB THR A 3 129.587 27.660 -6.389 1.00 0.00 H new ATOM 0 HG1 THR A 3 128.496 27.064 -8.980 1.00 0.00 H new ATOM 0 HG21 THR A 3 130.965 28.604 -8.217 1.00 0.00 H new ATOM 0 HG22 THR A 3 131.771 27.207 -7.465 1.00 0.00 H new ATOM 0 HG23 THR A 3 130.959 27.025 -9.038 1.00 0.00 H new ATOM 98 N SER A 4 130.012 23.648 -8.450 1.00 0.00 N ATOM 99 CA SER A 4 130.159 22.879 -9.720 1.00 0.00 C ATOM 100 C SER A 4 130.044 21.378 -9.443 1.00 0.00 C ATOM 101 O SER A 4 130.436 20.898 -8.397 1.00 0.00 O ATOM 102 CB SER A 4 131.555 23.226 -10.234 1.00 0.00 C ATOM 103 OG SER A 4 131.562 24.566 -10.707 1.00 0.00 O ATOM 0 H SER A 4 130.178 23.113 -7.597 1.00 0.00 H new ATOM 0 HA SER A 4 129.386 23.128 -10.447 1.00 0.00 H new ATOM 0 HB2 SER A 4 132.289 23.106 -9.437 1.00 0.00 H new ATOM 0 HB3 SER A 4 131.840 22.544 -11.035 1.00 0.00 H new ATOM 0 HG SER A 4 130.658 24.939 -10.647 1.00 0.00 H new ATOM 109 N SER A 5 129.511 20.633 -10.371 1.00 0.00 N ATOM 110 CA SER A 5 129.371 19.164 -10.159 1.00 0.00 C ATOM 111 C SER A 5 130.627 18.438 -10.649 1.00 0.00 C ATOM 112 O SER A 5 131.484 19.020 -11.283 1.00 0.00 O ATOM 113 CB SER A 5 128.156 18.756 -10.989 1.00 0.00 C ATOM 114 OG SER A 5 127.003 19.420 -10.490 1.00 0.00 O ATOM 0 H SER A 5 129.166 20.977 -11.267 1.00 0.00 H new ATOM 0 HA SER A 5 129.247 18.909 -9.107 1.00 0.00 H new ATOM 0 HB2 SER A 5 128.313 19.013 -12.036 1.00 0.00 H new ATOM 0 HB3 SER A 5 128.016 17.676 -10.944 1.00 0.00 H new ATOM 0 HG SER A 5 126.221 19.162 -11.021 1.00 0.00 H new ATOM 120 N LEU A 6 130.739 17.170 -10.362 1.00 0.00 N ATOM 121 CA LEU A 6 131.939 16.407 -10.813 1.00 0.00 C ATOM 122 C LEU A 6 132.112 16.541 -12.328 1.00 0.00 C ATOM 123 O LEU A 6 131.177 16.375 -13.085 1.00 0.00 O ATOM 124 CB LEU A 6 131.654 14.955 -10.430 1.00 0.00 C ATOM 125 CG LEU A 6 132.394 14.614 -9.137 1.00 0.00 C ATOM 126 CD1 LEU A 6 131.445 13.893 -8.178 1.00 0.00 C ATOM 127 CD2 LEU A 6 133.583 13.706 -9.455 1.00 0.00 C ATOM 0 H LEU A 6 130.053 16.629 -9.835 1.00 0.00 H new ATOM 0 HA LEU A 6 132.858 16.774 -10.356 1.00 0.00 H new ATOM 0 HB2 LEU A 6 130.582 14.806 -10.298 1.00 0.00 H new ATOM 0 HB3 LEU A 6 131.972 14.287 -11.231 1.00 0.00 H new ATOM 0 HG LEU A 6 132.751 15.532 -8.671 1.00 0.00 H new ATOM 0 HD11 LEU A 6 131.974 13.650 -7.256 1.00 0.00 H new ATOM 0 HD12 LEU A 6 130.597 14.539 -7.950 1.00 0.00 H new ATOM 0 HD13 LEU A 6 131.086 12.975 -8.643 1.00 0.00 H new ATOM 0 HD21 LEU A 6 134.111 13.462 -8.533 1.00 0.00 H new ATOM 0 HD22 LEU A 6 133.225 12.788 -9.922 1.00 0.00 H new ATOM 0 HD23 LEU A 6 134.261 14.220 -10.137 1.00 0.00 H new ATOM 139 N ARG A 7 133.300 16.840 -12.775 1.00 0.00 N ATOM 140 CA ARG A 7 133.531 16.984 -14.240 1.00 0.00 C ATOM 141 C ARG A 7 132.850 15.839 -14.997 1.00 0.00 C ATOM 142 O ARG A 7 131.700 15.932 -15.379 1.00 0.00 O ATOM 143 CB ARG A 7 135.049 16.915 -14.411 1.00 0.00 C ATOM 144 CG ARG A 7 135.665 18.267 -14.047 1.00 0.00 C ATOM 145 CD ARG A 7 135.886 19.087 -15.319 1.00 0.00 C ATOM 146 NE ARG A 7 135.924 20.503 -14.862 1.00 0.00 N ATOM 147 CZ ARG A 7 134.932 21.304 -15.143 1.00 0.00 C ATOM 148 NH1 ARG A 7 134.431 21.324 -16.348 1.00 0.00 N ATOM 149 NH2 ARG A 7 134.441 22.084 -14.219 1.00 0.00 N ATOM 0 H ARG A 7 134.121 16.991 -12.189 1.00 0.00 H new ATOM 0 HA ARG A 7 133.120 17.913 -14.634 1.00 0.00 H new ATOM 0 HB2 ARG A 7 135.462 16.132 -13.775 1.00 0.00 H new ATOM 0 HB3 ARG A 7 135.298 16.655 -15.440 1.00 0.00 H new ATOM 0 HG2 ARG A 7 135.008 18.806 -13.364 1.00 0.00 H new ATOM 0 HG3 ARG A 7 136.612 18.119 -13.528 1.00 0.00 H new ATOM 0 HD2 ARG A 7 136.816 18.806 -15.813 1.00 0.00 H new ATOM 0 HD3 ARG A 7 135.082 18.925 -16.037 1.00 0.00 H new ATOM 0 HE ARG A 7 136.724 20.847 -14.330 1.00 0.00 H new ATOM 0 HH11 ARG A 7 134.814 20.714 -17.070 1.00 0.00 H new ATOM 0 HH12 ARG A 7 133.656 21.950 -16.568 1.00 0.00 H new ATOM 0 HH21 ARG A 7 134.832 22.068 -13.277 1.00 0.00 H new ATOM 0 HH22 ARG A 7 133.666 22.710 -14.439 1.00 0.00 H new ATOM 163 N ARG A 8 133.549 14.759 -15.218 1.00 0.00 N ATOM 164 CA ARG A 8 132.940 13.612 -15.949 1.00 0.00 C ATOM 165 C ARG A 8 133.180 12.310 -15.181 1.00 0.00 C ATOM 166 O ARG A 8 133.155 12.280 -13.967 1.00 0.00 O ATOM 167 CB ARG A 8 133.656 13.577 -17.299 1.00 0.00 C ATOM 168 CG ARG A 8 133.527 14.940 -17.982 1.00 0.00 C ATOM 169 CD ARG A 8 132.220 14.993 -18.777 1.00 0.00 C ATOM 170 NE ARG A 8 131.728 16.388 -18.615 1.00 0.00 N ATOM 171 CZ ARG A 8 130.477 16.671 -18.852 1.00 0.00 C ATOM 172 NH1 ARG A 8 129.964 16.427 -20.027 1.00 0.00 N ATOM 173 NH2 ARG A 8 129.738 17.196 -17.913 1.00 0.00 N ATOM 0 H ARG A 8 134.516 14.622 -14.924 1.00 0.00 H new ATOM 0 HA ARG A 8 131.861 13.720 -16.063 1.00 0.00 H new ATOM 0 HB2 ARG A 8 134.708 13.327 -17.158 1.00 0.00 H new ATOM 0 HB3 ARG A 8 133.226 12.800 -17.931 1.00 0.00 H new ATOM 0 HG2 ARG A 8 133.544 15.735 -17.236 1.00 0.00 H new ATOM 0 HG3 ARG A 8 134.375 15.108 -18.646 1.00 0.00 H new ATOM 0 HD2 ARG A 8 132.387 14.753 -19.827 1.00 0.00 H new ATOM 0 HD3 ARG A 8 131.496 14.272 -18.396 1.00 0.00 H new ATOM 0 HE ARG A 8 132.370 17.123 -18.318 1.00 0.00 H new ATOM 0 HH11 ARG A 8 130.541 16.015 -20.760 1.00 0.00 H new ATOM 0 HH12 ARG A 8 128.986 16.648 -20.212 1.00 0.00 H new ATOM 0 HH21 ARG A 8 130.139 17.385 -16.994 1.00 0.00 H new ATOM 0 HH22 ARG A 8 128.760 17.417 -18.098 1.00 0.00 H new ATOM 187 N GLN A 9 133.410 11.232 -15.880 1.00 0.00 N ATOM 188 CA GLN A 9 133.652 9.933 -15.188 1.00 0.00 C ATOM 189 C GLN A 9 134.581 10.137 -13.989 1.00 0.00 C ATOM 190 O GLN A 9 135.439 10.996 -13.995 1.00 0.00 O ATOM 191 CB GLN A 9 134.318 9.044 -16.238 1.00 0.00 C ATOM 192 CG GLN A 9 133.246 8.257 -16.996 1.00 0.00 C ATOM 193 CD GLN A 9 133.101 6.867 -16.375 1.00 0.00 C ATOM 194 OE1 GLN A 9 133.781 5.939 -16.768 1.00 0.00 O ATOM 195 NE2 GLN A 9 132.236 6.681 -15.416 1.00 0.00 N ATOM 0 H GLN A 9 133.441 11.194 -16.899 1.00 0.00 H new ATOM 0 HA GLN A 9 132.732 9.492 -14.804 1.00 0.00 H new ATOM 0 HB2 GLN A 9 134.896 9.654 -16.933 1.00 0.00 H new ATOM 0 HB3 GLN A 9 135.017 8.358 -15.759 1.00 0.00 H new ATOM 0 HG2 GLN A 9 132.294 8.786 -16.956 1.00 0.00 H new ATOM 0 HG3 GLN A 9 133.518 8.171 -18.048 1.00 0.00 H new ATOM 0 HE21 GLN A 9 131.665 7.459 -15.086 1.00 0.00 H new ATOM 0 HE22 GLN A 9 132.131 5.757 -14.996 1.00 0.00 H new ATOM 204 N MET A 10 134.416 9.351 -12.961 1.00 0.00 N ATOM 205 CA MET A 10 135.291 9.499 -11.761 1.00 0.00 C ATOM 206 C MET A 10 136.736 9.129 -12.108 1.00 0.00 C ATOM 207 O MET A 10 137.082 8.953 -13.260 1.00 0.00 O ATOM 208 CB MET A 10 134.720 8.521 -10.733 1.00 0.00 C ATOM 209 CG MET A 10 135.035 7.087 -11.164 1.00 0.00 C ATOM 210 SD MET A 10 134.548 5.943 -9.849 1.00 0.00 S ATOM 211 CE MET A 10 134.419 4.458 -10.876 1.00 0.00 C ATOM 0 H MET A 10 133.714 8.613 -12.899 1.00 0.00 H new ATOM 0 HA MET A 10 135.308 10.523 -11.387 1.00 0.00 H new ATOM 0 HB2 MET A 10 135.148 8.719 -9.750 1.00 0.00 H new ATOM 0 HB3 MET A 10 133.642 8.657 -10.645 1.00 0.00 H new ATOM 0 HG2 MET A 10 134.503 6.847 -12.085 1.00 0.00 H new ATOM 0 HG3 MET A 10 136.100 6.984 -11.375 1.00 0.00 H new ATOM 0 HE1 MET A 10 134.124 3.611 -10.256 1.00 0.00 H new ATOM 0 HE2 MET A 10 133.671 4.617 -11.653 1.00 0.00 H new ATOM 0 HE3 MET A 10 135.384 4.250 -11.338 1.00 0.00 H new ATOM 221 N LYS A 11 137.581 9.008 -11.120 1.00 0.00 N ATOM 222 CA LYS A 11 139.003 8.648 -11.393 1.00 0.00 C ATOM 223 C LYS A 11 139.145 7.130 -11.539 1.00 0.00 C ATOM 224 O LYS A 11 138.172 6.416 -11.676 1.00 0.00 O ATOM 225 CB LYS A 11 139.779 9.143 -10.170 1.00 0.00 C ATOM 226 CG LYS A 11 139.540 10.644 -9.987 1.00 0.00 C ATOM 227 CD LYS A 11 140.742 11.268 -9.274 1.00 0.00 C ATOM 228 CE LYS A 11 140.310 11.784 -7.899 1.00 0.00 C ATOM 229 NZ LYS A 11 141.556 11.783 -7.082 1.00 0.00 N ATOM 0 H LYS A 11 137.349 9.143 -10.136 1.00 0.00 H new ATOM 0 HA LYS A 11 139.371 9.093 -12.317 1.00 0.00 H new ATOM 0 HB2 LYS A 11 139.459 8.602 -9.280 1.00 0.00 H new ATOM 0 HB3 LYS A 11 140.844 8.946 -10.297 1.00 0.00 H new ATOM 0 HG2 LYS A 11 139.391 11.120 -10.956 1.00 0.00 H new ATOM 0 HG3 LYS A 11 138.632 10.811 -9.407 1.00 0.00 H new ATOM 0 HD2 LYS A 11 141.536 10.530 -9.164 1.00 0.00 H new ATOM 0 HD3 LYS A 11 141.147 12.086 -9.870 1.00 0.00 H new ATOM 0 HE2 LYS A 11 139.884 12.785 -7.968 1.00 0.00 H new ATOM 0 HE3 LYS A 11 139.547 11.142 -7.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 141.343 12.125 -6.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 141.935 10.816 -7.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 142.261 12.407 -7.523 1.00 0.00 H new ATOM 243 N ASN A 12 140.351 6.633 -11.509 1.00 0.00 N ATOM 244 CA ASN A 12 140.555 5.161 -11.644 1.00 0.00 C ATOM 245 C ASN A 12 140.862 4.544 -10.278 1.00 0.00 C ATOM 246 O ASN A 12 141.949 4.683 -9.754 1.00 0.00 O ATOM 247 CB ASN A 12 141.753 5.012 -12.583 1.00 0.00 C ATOM 248 CG ASN A 12 142.107 3.532 -12.727 1.00 0.00 C ATOM 249 OD1 ASN A 12 142.701 2.948 -11.842 1.00 0.00 O ATOM 250 ND2 ASN A 12 141.767 2.895 -13.813 1.00 0.00 N ATOM 0 H ASN A 12 141.204 7.181 -11.397 1.00 0.00 H new ATOM 0 HA ASN A 12 139.671 4.654 -12.030 1.00 0.00 H new ATOM 0 HB2 ASN A 12 141.519 5.437 -13.559 1.00 0.00 H new ATOM 0 HB3 ASN A 12 142.607 5.565 -12.191 1.00 0.00 H new ATOM 0 HD21 ASN A 12 142.000 1.908 -13.919 1.00 0.00 H new ATOM 0 HD22 ASN A 12 141.268 3.384 -14.556 1.00 0.00 H new ATOM 257 N ILE A 13 139.911 3.865 -9.696 1.00 0.00 N ATOM 258 CA ILE A 13 140.150 3.242 -8.362 1.00 0.00 C ATOM 259 C ILE A 13 140.371 1.736 -8.512 1.00 0.00 C ATOM 260 O ILE A 13 140.010 1.140 -9.508 1.00 0.00 O ATOM 261 CB ILE A 13 138.876 3.520 -7.564 1.00 0.00 C ATOM 262 CG1 ILE A 13 138.494 4.994 -7.710 1.00 0.00 C ATOM 263 CG2 ILE A 13 139.118 3.200 -6.088 1.00 0.00 C ATOM 264 CD1 ILE A 13 139.525 5.863 -6.986 1.00 0.00 C ATOM 0 H ILE A 13 138.980 3.715 -10.085 1.00 0.00 H new ATOM 0 HA ILE A 13 141.036 3.644 -7.871 1.00 0.00 H new ATOM 0 HB ILE A 13 138.067 2.896 -7.943 1.00 0.00 H new ATOM 0 HG12 ILE A 13 138.450 5.266 -8.764 1.00 0.00 H new ATOM 0 HG13 ILE A 13 137.501 5.166 -7.294 1.00 0.00 H new ATOM 0 HG21 ILE A 13 138.210 3.398 -5.519 1.00 0.00 H new ATOM 0 HG22 ILE A 13 139.390 2.150 -5.983 1.00 0.00 H new ATOM 0 HG23 ILE A 13 139.927 3.824 -5.708 1.00 0.00 H new ATOM 0 HD11 ILE A 13 139.253 6.913 -7.090 1.00 0.00 H new ATOM 0 HD12 ILE A 13 139.547 5.597 -5.929 1.00 0.00 H new ATOM 0 HD13 ILE A 13 140.510 5.699 -7.422 1.00 0.00 H new ATOM 276 N VAL A 14 140.963 1.114 -7.528 1.00 0.00 N ATOM 277 CA VAL A 14 141.207 -0.355 -7.613 1.00 0.00 C ATOM 278 C VAL A 14 139.936 -1.078 -8.062 1.00 0.00 C ATOM 279 O VAL A 14 138.938 -1.087 -7.369 1.00 0.00 O ATOM 280 CB VAL A 14 141.598 -0.785 -6.198 1.00 0.00 C ATOM 281 CG1 VAL A 14 143.064 -0.432 -5.953 1.00 0.00 C ATOM 282 CG2 VAL A 14 140.719 -0.060 -5.172 1.00 0.00 C ATOM 0 H VAL A 14 141.288 1.559 -6.670 1.00 0.00 H new ATOM 0 HA VAL A 14 141.984 -0.598 -8.337 1.00 0.00 H new ATOM 0 HB VAL A 14 141.455 -1.861 -6.094 1.00 0.00 H new ATOM 0 HG11 VAL A 14 143.348 -0.736 -4.946 1.00 0.00 H new ATOM 0 HG12 VAL A 14 143.690 -0.951 -6.679 1.00 0.00 H new ATOM 0 HG13 VAL A 14 143.202 0.644 -6.059 1.00 0.00 H new ATOM 0 HG21 VAL A 14 141.002 -0.370 -4.166 1.00 0.00 H new ATOM 0 HG22 VAL A 14 140.856 1.017 -5.272 1.00 0.00 H new ATOM 0 HG23 VAL A 14 139.673 -0.310 -5.348 1.00 0.00 H new ATOM 292 N HIS A 15 139.963 -1.685 -9.217 1.00 0.00 N ATOM 293 CA HIS A 15 138.754 -2.405 -9.710 1.00 0.00 C ATOM 294 C HIS A 15 138.696 -3.813 -9.112 1.00 0.00 C ATOM 295 O HIS A 15 138.920 -4.797 -9.789 1.00 0.00 O ATOM 296 CB HIS A 15 138.926 -2.475 -11.227 1.00 0.00 C ATOM 297 CG HIS A 15 137.900 -1.596 -11.888 1.00 0.00 C ATOM 298 ND1 HIS A 15 136.638 -2.059 -12.226 1.00 0.00 N ATOM 299 CD2 HIS A 15 137.934 -0.280 -12.278 1.00 0.00 C ATOM 300 CE1 HIS A 15 135.970 -1.038 -12.794 1.00 0.00 C ATOM 301 NE2 HIS A 15 136.714 0.070 -12.850 1.00 0.00 N ATOM 0 H HIS A 15 140.770 -1.714 -9.841 1.00 0.00 H new ATOM 0 HA HIS A 15 137.830 -1.901 -9.427 1.00 0.00 H new ATOM 0 HB2 HIS A 15 139.930 -2.154 -11.505 1.00 0.00 H new ATOM 0 HB3 HIS A 15 138.814 -3.504 -11.569 1.00 0.00 H new ATOM 0 HD2 HIS A 15 138.778 0.383 -12.159 1.00 0.00 H new ATOM 0 HE1 HIS A 15 134.956 -1.106 -13.160 1.00 0.00 H new ATOM 0 HE2 HIS A 15 136.446 0.978 -13.230 1.00 0.00 H new ATOM 309 N ASN A 16 138.396 -3.919 -7.845 1.00 0.00 N ATOM 310 CA ASN A 16 138.324 -5.265 -7.207 1.00 0.00 C ATOM 311 C ASN A 16 136.889 -5.794 -7.252 1.00 0.00 C ATOM 312 O ASN A 16 136.022 -5.215 -7.876 1.00 0.00 O ATOM 313 CB ASN A 16 138.768 -5.042 -5.760 1.00 0.00 C ATOM 314 CG ASN A 16 140.113 -5.731 -5.527 1.00 0.00 C ATOM 315 OD1 ASN A 16 140.214 -6.634 -4.721 1.00 0.00 O ATOM 316 ND2 ASN A 16 141.157 -5.339 -6.204 1.00 0.00 N ATOM 0 H ASN A 16 138.198 -3.133 -7.226 1.00 0.00 H new ATOM 0 HA ASN A 16 138.949 -5.998 -7.717 1.00 0.00 H new ATOM 0 HB2 ASN A 16 138.854 -3.975 -5.555 1.00 0.00 H new ATOM 0 HB3 ASN A 16 138.020 -5.439 -5.074 1.00 0.00 H new ATOM 0 HD21 ASN A 16 142.059 -5.791 -6.057 1.00 0.00 H new ATOM 0 HD22 ASN A 16 141.071 -4.581 -6.881 1.00 0.00 H new ATOM 323 N TYR A 17 136.631 -6.891 -6.595 1.00 0.00 N ATOM 324 CA TYR A 17 135.250 -7.456 -6.600 1.00 0.00 C ATOM 325 C TYR A 17 134.359 -6.681 -5.626 1.00 0.00 C ATOM 326 O TYR A 17 134.830 -5.894 -4.830 1.00 0.00 O ATOM 327 CB TYR A 17 135.411 -8.906 -6.143 1.00 0.00 C ATOM 328 CG TYR A 17 135.498 -9.807 -7.350 1.00 0.00 C ATOM 329 CD1 TYR A 17 136.555 -9.660 -8.257 1.00 0.00 C ATOM 330 CD2 TYR A 17 134.524 -10.789 -7.564 1.00 0.00 C ATOM 331 CE1 TYR A 17 136.636 -10.495 -9.378 1.00 0.00 C ATOM 332 CE2 TYR A 17 134.605 -11.624 -8.684 1.00 0.00 C ATOM 333 CZ TYR A 17 135.662 -11.477 -9.591 1.00 0.00 C ATOM 334 OH TYR A 17 135.743 -12.300 -10.695 1.00 0.00 O ATOM 0 H TYR A 17 137.315 -7.421 -6.055 1.00 0.00 H new ATOM 0 HA TYR A 17 134.781 -7.390 -7.582 1.00 0.00 H new ATOM 0 HB2 TYR A 17 136.309 -9.009 -5.534 1.00 0.00 H new ATOM 0 HB3 TYR A 17 134.567 -9.198 -5.518 1.00 0.00 H new ATOM 0 HD1 TYR A 17 137.307 -8.903 -8.092 1.00 0.00 H new ATOM 0 HD2 TYR A 17 133.709 -10.902 -6.864 1.00 0.00 H new ATOM 0 HE1 TYR A 17 137.450 -10.381 -10.078 1.00 0.00 H new ATOM 0 HE2 TYR A 17 133.853 -12.381 -8.849 1.00 0.00 H new ATOM 0 HH TYR A 17 134.989 -12.926 -10.692 1.00 0.00 H new ATOM 344 N SER A 18 133.074 -6.899 -5.682 1.00 0.00 N ATOM 345 CA SER A 18 132.153 -6.176 -4.760 1.00 0.00 C ATOM 346 C SER A 18 130.696 -6.453 -5.143 1.00 0.00 C ATOM 347 O SER A 18 129.961 -7.084 -4.409 1.00 0.00 O ATOM 348 CB SER A 18 132.488 -4.697 -4.948 1.00 0.00 C ATOM 349 OG SER A 18 131.292 -3.931 -4.889 1.00 0.00 O ATOM 0 H SER A 18 132.622 -7.547 -6.327 1.00 0.00 H new ATOM 0 HA SER A 18 132.272 -6.492 -3.723 1.00 0.00 H new ATOM 0 HB2 SER A 18 133.182 -4.369 -4.174 1.00 0.00 H new ATOM 0 HB3 SER A 18 132.984 -4.544 -5.906 1.00 0.00 H new ATOM 0 HG SER A 18 131.505 -2.982 -5.008 1.00 0.00 H new ATOM 355 N GLU A 19 130.274 -5.989 -6.287 1.00 0.00 N ATOM 356 CA GLU A 19 128.866 -6.229 -6.717 1.00 0.00 C ATOM 357 C GLU A 19 127.889 -5.682 -5.673 1.00 0.00 C ATOM 358 O GLU A 19 126.723 -6.021 -5.663 1.00 0.00 O ATOM 359 CB GLU A 19 128.737 -7.750 -6.821 1.00 0.00 C ATOM 360 CG GLU A 19 129.778 -8.283 -7.807 1.00 0.00 C ATOM 361 CD GLU A 19 129.389 -9.698 -8.242 1.00 0.00 C ATOM 362 OE1 GLU A 19 128.557 -10.293 -7.578 1.00 0.00 O ATOM 363 OE2 GLU A 19 129.930 -10.161 -9.233 1.00 0.00 O ATOM 0 H GLU A 19 130.843 -5.454 -6.943 1.00 0.00 H new ATOM 0 HA GLU A 19 128.635 -5.732 -7.659 1.00 0.00 H new ATOM 0 HB2 GLU A 19 128.881 -8.206 -5.841 1.00 0.00 H new ATOM 0 HB3 GLU A 19 127.734 -8.019 -7.153 1.00 0.00 H new ATOM 0 HG2 GLU A 19 129.841 -7.628 -8.676 1.00 0.00 H new ATOM 0 HG3 GLU A 19 130.764 -8.292 -7.342 1.00 0.00 H new ATOM 370 N ALA A 20 128.357 -4.838 -4.795 1.00 0.00 N ATOM 371 CA ALA A 20 127.455 -4.271 -3.754 1.00 0.00 C ATOM 372 C ALA A 20 126.290 -3.526 -4.413 1.00 0.00 C ATOM 373 O ALA A 20 125.144 -3.705 -4.054 1.00 0.00 O ATOM 374 CB ALA A 20 128.329 -3.302 -2.959 1.00 0.00 C ATOM 0 H ALA A 20 129.324 -4.517 -4.754 1.00 0.00 H new ATOM 0 HA ALA A 20 127.020 -5.043 -3.119 1.00 0.00 H new ATOM 0 HB1 ALA A 20 127.736 -2.841 -2.169 1.00 0.00 H new ATOM 0 HB2 ALA A 20 129.164 -3.845 -2.516 1.00 0.00 H new ATOM 0 HB3 ALA A 20 128.712 -2.528 -3.624 1.00 0.00 H new ATOM 380 N GLU A 21 126.576 -2.694 -5.378 1.00 0.00 N ATOM 381 CA GLU A 21 125.485 -1.942 -6.059 1.00 0.00 C ATOM 382 C GLU A 21 124.322 -2.884 -6.381 1.00 0.00 C ATOM 383 O GLU A 21 123.174 -2.485 -6.403 1.00 0.00 O ATOM 384 CB GLU A 21 126.114 -1.408 -7.347 1.00 0.00 C ATOM 385 CG GLU A 21 126.696 -2.572 -8.150 1.00 0.00 C ATOM 386 CD GLU A 21 127.517 -2.025 -9.320 1.00 0.00 C ATOM 387 OE1 GLU A 21 128.469 -1.307 -9.065 1.00 0.00 O ATOM 388 OE2 GLU A 21 127.180 -2.336 -10.451 1.00 0.00 O ATOM 0 H GLU A 21 127.517 -2.503 -5.723 1.00 0.00 H new ATOM 0 HA GLU A 21 125.085 -1.139 -5.439 1.00 0.00 H new ATOM 0 HB2 GLU A 21 125.365 -0.882 -7.939 1.00 0.00 H new ATOM 0 HB3 GLU A 21 126.897 -0.688 -7.111 1.00 0.00 H new ATOM 0 HG2 GLU A 21 127.324 -3.192 -7.510 1.00 0.00 H new ATOM 0 HG3 GLU A 21 125.893 -3.209 -8.522 1.00 0.00 H new ATOM 395 N ILE A 22 124.612 -4.133 -6.629 1.00 0.00 N ATOM 396 CA ILE A 22 123.523 -5.101 -6.945 1.00 0.00 C ATOM 397 C ILE A 22 122.769 -5.477 -5.668 1.00 0.00 C ATOM 398 O ILE A 22 121.554 -5.516 -5.641 1.00 0.00 O ATOM 399 CB ILE A 22 124.234 -6.323 -7.527 1.00 0.00 C ATOM 400 CG1 ILE A 22 125.146 -5.883 -8.675 1.00 0.00 C ATOM 401 CG2 ILE A 22 123.195 -7.315 -8.053 1.00 0.00 C ATOM 402 CD1 ILE A 22 124.293 -5.369 -9.837 1.00 0.00 C ATOM 0 H ILE A 22 125.554 -4.524 -6.626 1.00 0.00 H new ATOM 0 HA ILE A 22 122.791 -4.689 -7.639 1.00 0.00 H new ATOM 0 HB ILE A 22 124.831 -6.800 -6.750 1.00 0.00 H new ATOM 0 HG12 ILE A 22 125.825 -5.101 -8.335 1.00 0.00 H new ATOM 0 HG13 ILE A 22 125.762 -6.719 -9.005 1.00 0.00 H new ATOM 0 HG21 ILE A 22 123.701 -8.186 -8.468 1.00 0.00 H new ATOM 0 HG22 ILE A 22 122.545 -7.628 -7.236 1.00 0.00 H new ATOM 0 HG23 ILE A 22 122.598 -6.838 -8.830 1.00 0.00 H new ATOM 0 HD11 ILE A 22 124.942 -5.056 -10.654 1.00 0.00 H new ATOM 0 HD12 ILE A 22 123.632 -6.164 -10.183 1.00 0.00 H new ATOM 0 HD13 ILE A 22 123.696 -4.521 -9.503 1.00 0.00 H new ATOM 414 N LYS A 23 123.479 -5.750 -4.607 1.00 0.00 N ATOM 415 CA LYS A 23 122.804 -6.118 -3.330 1.00 0.00 C ATOM 416 C LYS A 23 121.812 -5.024 -2.928 1.00 0.00 C ATOM 417 O LYS A 23 120.656 -5.288 -2.661 1.00 0.00 O ATOM 418 CB LYS A 23 123.930 -6.227 -2.302 1.00 0.00 C ATOM 419 CG LYS A 23 124.874 -7.365 -2.695 1.00 0.00 C ATOM 420 CD LYS A 23 124.351 -8.684 -2.124 1.00 0.00 C ATOM 421 CE LYS A 23 124.524 -9.796 -3.162 1.00 0.00 C ATOM 422 NZ LYS A 23 125.519 -10.728 -2.561 1.00 0.00 N ATOM 0 H LYS A 23 124.498 -5.734 -4.570 1.00 0.00 H new ATOM 0 HA LYS A 23 122.239 -7.047 -3.412 1.00 0.00 H new ATOM 0 HB2 LYS A 23 124.479 -5.287 -2.248 1.00 0.00 H new ATOM 0 HB3 LYS A 23 123.515 -6.411 -1.311 1.00 0.00 H new ATOM 0 HG2 LYS A 23 124.949 -7.431 -3.780 1.00 0.00 H new ATOM 0 HG3 LYS A 23 125.877 -7.166 -2.318 1.00 0.00 H new ATOM 0 HD2 LYS A 23 124.891 -8.937 -1.212 1.00 0.00 H new ATOM 0 HD3 LYS A 23 123.300 -8.584 -1.855 1.00 0.00 H new ATOM 0 HE2 LYS A 23 123.579 -10.301 -3.361 1.00 0.00 H new ATOM 0 HE3 LYS A 23 124.879 -9.398 -4.113 1.00 0.00 H new ATOM 0 HZ1 LYS A 23 125.895 -11.358 -3.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 23 126.298 -10.181 -2.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 23 125.059 -11.297 -1.822 1.00 0.00 H new ATOM 436 N VAL A 24 122.253 -3.797 -2.884 1.00 0.00 N ATOM 437 CA VAL A 24 121.334 -2.688 -2.502 1.00 0.00 C ATOM 438 C VAL A 24 120.144 -2.637 -3.464 1.00 0.00 C ATOM 439 O VAL A 24 119.026 -2.372 -3.071 1.00 0.00 O ATOM 440 CB VAL A 24 122.175 -1.416 -2.619 1.00 0.00 C ATOM 441 CG1 VAL A 24 121.297 -0.196 -2.333 1.00 0.00 C ATOM 442 CG2 VAL A 24 123.320 -1.467 -1.604 1.00 0.00 C ATOM 0 H VAL A 24 123.210 -3.514 -3.096 1.00 0.00 H new ATOM 0 HA VAL A 24 120.927 -2.814 -1.499 1.00 0.00 H new ATOM 0 HB VAL A 24 122.584 -1.342 -3.627 1.00 0.00 H new ATOM 0 HG11 VAL A 24 121.896 0.711 -2.416 1.00 0.00 H new ATOM 0 HG12 VAL A 24 120.480 -0.159 -3.054 1.00 0.00 H new ATOM 0 HG13 VAL A 24 120.889 -0.270 -1.325 1.00 0.00 H new ATOM 0 HG21 VAL A 24 123.920 -0.561 -1.687 1.00 0.00 H new ATOM 0 HG22 VAL A 24 122.910 -1.540 -0.597 1.00 0.00 H new ATOM 0 HG23 VAL A 24 123.946 -2.336 -1.805 1.00 0.00 H new ATOM 452 N ARG A 25 120.377 -2.891 -4.724 1.00 0.00 N ATOM 453 CA ARG A 25 119.258 -2.861 -5.709 1.00 0.00 C ATOM 454 C ARG A 25 118.128 -3.780 -5.244 1.00 0.00 C ATOM 455 O ARG A 25 117.060 -3.334 -4.872 1.00 0.00 O ATOM 456 CB ARG A 25 119.865 -3.374 -7.014 1.00 0.00 C ATOM 457 CG ARG A 25 119.411 -2.486 -8.175 1.00 0.00 C ATOM 458 CD ARG A 25 119.624 -3.226 -9.498 1.00 0.00 C ATOM 459 NE ARG A 25 118.254 -3.541 -9.988 1.00 0.00 N ATOM 460 CZ ARG A 25 118.021 -4.670 -10.598 1.00 0.00 C ATOM 461 NH1 ARG A 25 118.710 -4.994 -11.659 1.00 0.00 N ATOM 462 NH2 ARG A 25 117.100 -5.478 -10.147 1.00 0.00 N ATOM 0 H ARG A 25 121.292 -3.118 -5.113 1.00 0.00 H new ATOM 0 HA ARG A 25 118.832 -1.864 -5.824 1.00 0.00 H new ATOM 0 HB2 ARG A 25 120.953 -3.373 -6.946 1.00 0.00 H new ATOM 0 HB3 ARG A 25 119.557 -4.405 -7.189 1.00 0.00 H new ATOM 0 HG2 ARG A 25 118.359 -2.225 -8.057 1.00 0.00 H new ATOM 0 HG3 ARG A 25 119.973 -1.552 -8.174 1.00 0.00 H new ATOM 0 HD2 ARG A 25 120.167 -2.608 -10.213 1.00 0.00 H new ATOM 0 HD3 ARG A 25 120.210 -4.134 -9.353 1.00 0.00 H new ATOM 0 HE ARG A 25 117.496 -2.873 -9.846 1.00 0.00 H new ATOM 0 HH11 ARG A 25 119.431 -4.364 -12.011 1.00 0.00 H new ATOM 0 HH12 ARG A 25 118.527 -5.877 -12.136 1.00 0.00 H new ATOM 0 HH21 ARG A 25 116.562 -5.226 -9.317 1.00 0.00 H new ATOM 0 HH22 ARG A 25 116.918 -6.361 -10.624 1.00 0.00 H new ATOM 476 N GLU A 26 118.359 -5.061 -5.263 1.00 0.00 N ATOM 477 CA GLU A 26 117.304 -6.019 -4.822 1.00 0.00 C ATOM 478 C GLU A 26 116.992 -5.815 -3.337 1.00 0.00 C ATOM 479 O GLU A 26 116.005 -6.307 -2.827 1.00 0.00 O ATOM 480 CB GLU A 26 117.907 -7.404 -5.058 1.00 0.00 C ATOM 481 CG GLU A 26 116.795 -8.391 -5.416 1.00 0.00 C ATOM 482 CD GLU A 26 117.327 -9.421 -6.416 1.00 0.00 C ATOM 483 OE1 GLU A 26 118.243 -10.143 -6.061 1.00 0.00 O ATOM 484 OE2 GLU A 26 116.809 -9.468 -7.519 1.00 0.00 O ATOM 0 H GLU A 26 119.234 -5.489 -5.565 1.00 0.00 H new ATOM 0 HA GLU A 26 116.368 -5.883 -5.364 1.00 0.00 H new ATOM 0 HB2 GLU A 26 118.642 -7.360 -5.862 1.00 0.00 H new ATOM 0 HB3 GLU A 26 118.433 -7.741 -4.164 1.00 0.00 H new ATOM 0 HG2 GLU A 26 116.437 -8.893 -4.517 1.00 0.00 H new ATOM 0 HG3 GLU A 26 115.946 -7.858 -5.844 1.00 0.00 H new ATOM 491 N ALA A 27 117.825 -5.092 -2.640 1.00 0.00 N ATOM 492 CA ALA A 27 117.576 -4.856 -1.188 1.00 0.00 C ATOM 493 C ALA A 27 116.482 -3.800 -1.007 1.00 0.00 C ATOM 494 O ALA A 27 115.743 -3.818 -0.043 1.00 0.00 O ATOM 495 CB ALA A 27 118.908 -4.351 -0.635 1.00 0.00 C ATOM 0 H ALA A 27 118.668 -4.654 -3.012 1.00 0.00 H new ATOM 0 HA ALA A 27 117.238 -5.755 -0.673 1.00 0.00 H new ATOM 0 HB1 ALA A 27 118.807 -4.154 0.432 1.00 0.00 H new ATOM 0 HB2 ALA A 27 119.678 -5.107 -0.793 1.00 0.00 H new ATOM 0 HB3 ALA A 27 119.190 -3.432 -1.149 1.00 0.00 H new ATOM 501 N THR A 28 116.374 -2.881 -1.927 1.00 0.00 N ATOM 502 CA THR A 28 115.327 -1.827 -1.807 1.00 0.00 C ATOM 503 C THR A 28 114.125 -2.179 -2.688 1.00 0.00 C ATOM 504 O THR A 28 113.474 -1.317 -3.244 1.00 0.00 O ATOM 505 CB THR A 28 115.995 -0.542 -2.298 1.00 0.00 C ATOM 506 OG1 THR A 28 116.582 -0.772 -3.572 1.00 0.00 O ATOM 507 CG2 THR A 28 117.076 -0.115 -1.304 1.00 0.00 C ATOM 0 H THR A 28 116.965 -2.814 -2.756 1.00 0.00 H new ATOM 0 HA THR A 28 114.957 -1.726 -0.787 1.00 0.00 H new ATOM 0 HB THR A 28 115.249 0.248 -2.380 1.00 0.00 H new ATOM 0 HG1 THR A 28 117.469 -1.172 -3.456 1.00 0.00 H new ATOM 0 HG21 THR A 28 117.552 0.801 -1.655 1.00 0.00 H new ATOM 0 HG22 THR A 28 116.624 0.062 -0.328 1.00 0.00 H new ATOM 0 HG23 THR A 28 117.824 -0.903 -1.220 1.00 0.00 H new ATOM 515 N SER A 29 113.827 -3.443 -2.819 1.00 0.00 N ATOM 516 CA SER A 29 112.670 -3.856 -3.664 1.00 0.00 C ATOM 517 C SER A 29 112.412 -5.355 -3.499 1.00 0.00 C ATOM 518 O SER A 29 113.298 -6.169 -3.674 1.00 0.00 O ATOM 519 CB SER A 29 113.091 -3.537 -5.097 1.00 0.00 C ATOM 520 OG SER A 29 113.781 -4.654 -5.643 1.00 0.00 O ATOM 0 H SER A 29 114.335 -4.209 -2.377 1.00 0.00 H new ATOM 0 HA SER A 29 111.749 -3.341 -3.389 1.00 0.00 H new ATOM 0 HB2 SER A 29 112.215 -3.304 -5.703 1.00 0.00 H new ATOM 0 HB3 SER A 29 113.732 -2.656 -5.112 1.00 0.00 H new ATOM 0 HG SER A 29 114.064 -5.250 -4.918 1.00 0.00 H new ATOM 526 N ASN A 30 111.209 -5.729 -3.160 1.00 0.00 N ATOM 527 CA ASN A 30 110.906 -7.177 -2.982 1.00 0.00 C ATOM 528 C ASN A 30 109.430 -7.455 -3.278 1.00 0.00 C ATOM 529 O ASN A 30 108.578 -6.609 -3.091 1.00 0.00 O ATOM 530 CB ASN A 30 111.221 -7.466 -1.514 1.00 0.00 C ATOM 531 CG ASN A 30 111.757 -8.891 -1.376 1.00 0.00 C ATOM 532 OD1 ASN A 30 110.996 -9.835 -1.297 1.00 0.00 O ATOM 533 ND2 ASN A 30 113.047 -9.088 -1.344 1.00 0.00 N ATOM 0 H ASN A 30 110.425 -5.097 -2.999 1.00 0.00 H new ATOM 0 HA ASN A 30 111.486 -7.805 -3.658 1.00 0.00 H new ATOM 0 HB2 ASN A 30 111.956 -6.752 -1.142 1.00 0.00 H new ATOM 0 HB3 ASN A 30 110.323 -7.344 -0.908 1.00 0.00 H new ATOM 0 HD21 ASN A 30 113.416 -10.034 -1.253 1.00 0.00 H new ATOM 0 HD22 ASN A 30 113.686 -8.296 -1.410 1.00 0.00 H new ATOM 540 N ASP A 31 109.123 -8.638 -3.737 1.00 0.00 N ATOM 541 CA ASP A 31 107.703 -8.975 -4.042 1.00 0.00 C ATOM 542 C ASP A 31 107.590 -10.447 -4.451 1.00 0.00 C ATOM 543 O ASP A 31 106.924 -11.223 -3.795 1.00 0.00 O ATOM 544 CB ASP A 31 107.316 -8.059 -5.203 1.00 0.00 C ATOM 545 CG ASP A 31 106.325 -7.003 -4.711 1.00 0.00 C ATOM 546 OD1 ASP A 31 106.151 -6.898 -3.507 1.00 0.00 O ATOM 547 OD2 ASP A 31 105.757 -6.317 -5.545 1.00 0.00 O ATOM 0 H ASP A 31 109.794 -9.386 -3.914 1.00 0.00 H new ATOM 0 HA ASP A 31 107.049 -8.833 -3.182 1.00 0.00 H new ATOM 0 HB2 ASP A 31 108.204 -7.577 -5.612 1.00 0.00 H new ATOM 0 HB3 ASP A 31 106.871 -8.643 -6.009 1.00 0.00 H new ATOM 552 N PRO A 32 108.254 -10.783 -5.525 1.00 0.00 N ATOM 553 CA PRO A 32 108.230 -12.179 -6.026 1.00 0.00 C ATOM 554 C PRO A 32 108.987 -13.099 -5.063 1.00 0.00 C ATOM 555 O PRO A 32 109.677 -12.646 -4.171 1.00 0.00 O ATOM 556 CB PRO A 32 108.947 -12.100 -7.371 1.00 0.00 C ATOM 557 CG PRO A 32 109.766 -10.849 -7.312 1.00 0.00 C ATOM 558 CD PRO A 32 109.077 -9.906 -6.362 1.00 0.00 C ATOM 0 HA PRO A 32 107.221 -12.583 -6.114 1.00 0.00 H new ATOM 0 HB2 PRO A 32 109.577 -12.975 -7.532 1.00 0.00 H new ATOM 0 HB3 PRO A 32 108.234 -12.064 -8.195 1.00 0.00 H new ATOM 0 HG2 PRO A 32 110.777 -11.068 -6.970 1.00 0.00 H new ATOM 0 HG3 PRO A 32 109.854 -10.401 -8.302 1.00 0.00 H new ATOM 0 HD2 PRO A 32 109.796 -9.345 -5.765 1.00 0.00 H new ATOM 0 HD3 PRO A 32 108.468 -9.177 -6.896 1.00 0.00 H new ATOM 566 N TRP A 33 108.867 -14.386 -5.239 1.00 0.00 N ATOM 567 CA TRP A 33 109.580 -15.332 -4.340 1.00 0.00 C ATOM 568 C TRP A 33 109.267 -15.024 -2.875 1.00 0.00 C ATOM 569 O TRP A 33 108.630 -14.040 -2.556 1.00 0.00 O ATOM 570 CB TRP A 33 111.056 -15.117 -4.628 1.00 0.00 C ATOM 571 CG TRP A 33 111.590 -16.364 -5.244 1.00 0.00 C ATOM 572 CD1 TRP A 33 112.266 -17.322 -4.583 1.00 0.00 C ATOM 573 CD2 TRP A 33 111.479 -16.813 -6.620 1.00 0.00 C ATOM 574 NE1 TRP A 33 112.605 -18.327 -5.473 1.00 0.00 N ATOM 575 CE2 TRP A 33 112.138 -18.057 -6.745 1.00 0.00 C ATOM 576 CE3 TRP A 33 110.881 -16.258 -7.758 1.00 0.00 C ATOM 577 CZ2 TRP A 33 112.204 -18.728 -7.966 1.00 0.00 C ATOM 578 CZ3 TRP A 33 110.940 -16.929 -8.991 1.00 0.00 C ATOM 579 CH2 TRP A 33 111.602 -18.163 -9.095 1.00 0.00 C ATOM 0 H TRP A 33 108.304 -14.823 -5.969 1.00 0.00 H new ATOM 0 HA TRP A 33 109.277 -16.365 -4.513 1.00 0.00 H new ATOM 0 HB2 TRP A 33 111.194 -14.270 -5.300 1.00 0.00 H new ATOM 0 HB3 TRP A 33 111.594 -14.885 -3.709 1.00 0.00 H new ATOM 0 HD1 TRP A 33 112.505 -17.309 -3.530 1.00 0.00 H new ATOM 0 HE1 TRP A 33 113.133 -19.162 -5.221 1.00 0.00 H new ATOM 0 HE3 TRP A 33 110.371 -15.308 -7.688 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 112.716 -19.676 -8.039 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 110.474 -16.494 -9.863 1.00 0.00 H new ATOM 0 HH2 TRP A 33 111.646 -18.675 -10.045 1.00 0.00 H new ATOM 590 N GLY A 34 109.714 -15.863 -1.986 1.00 0.00 N ATOM 591 CA GLY A 34 109.449 -15.630 -0.536 1.00 0.00 C ATOM 592 C GLY A 34 110.436 -14.593 0.006 1.00 0.00 C ATOM 593 O GLY A 34 110.777 -13.645 -0.674 1.00 0.00 O ATOM 0 H GLY A 34 110.253 -16.703 -2.198 1.00 0.00 H new ATOM 0 HA2 GLY A 34 108.426 -15.282 -0.394 1.00 0.00 H new ATOM 0 HA3 GLY A 34 109.547 -16.564 0.017 1.00 0.00 H new ATOM 597 N PRO A 35 110.861 -14.811 1.221 1.00 0.00 N ATOM 598 CA PRO A 35 111.820 -13.883 1.869 1.00 0.00 C ATOM 599 C PRO A 35 113.170 -13.921 1.147 1.00 0.00 C ATOM 600 O PRO A 35 113.326 -14.576 0.136 1.00 0.00 O ATOM 601 CB PRO A 35 111.952 -14.420 3.294 1.00 0.00 C ATOM 602 CG PRO A 35 111.461 -15.833 3.239 1.00 0.00 C ATOM 603 CD PRO A 35 110.491 -15.928 2.092 1.00 0.00 C ATOM 0 HA PRO A 35 111.487 -12.845 1.844 1.00 0.00 H new ATOM 0 HB2 PRO A 35 112.987 -14.378 3.635 1.00 0.00 H new ATOM 0 HB3 PRO A 35 111.362 -13.827 3.993 1.00 0.00 H new ATOM 0 HG2 PRO A 35 112.293 -16.523 3.097 1.00 0.00 H new ATOM 0 HG3 PRO A 35 110.976 -16.108 4.176 1.00 0.00 H new ATOM 0 HD2 PRO A 35 110.578 -16.883 1.574 1.00 0.00 H new ATOM 0 HD3 PRO A 35 109.459 -15.843 2.434 1.00 0.00 H new ATOM 611 N SER A 36 114.147 -13.224 1.660 1.00 0.00 N ATOM 612 CA SER A 36 115.486 -13.220 1.004 1.00 0.00 C ATOM 613 C SER A 36 116.472 -14.072 1.808 1.00 0.00 C ATOM 614 O SER A 36 116.118 -14.674 2.802 1.00 0.00 O ATOM 615 CB SER A 36 115.921 -11.756 1.001 1.00 0.00 C ATOM 616 OG SER A 36 114.768 -10.924 1.020 1.00 0.00 O ATOM 0 H SER A 36 114.076 -12.657 2.505 1.00 0.00 H new ATOM 0 HA SER A 36 115.454 -13.637 -0.002 1.00 0.00 H new ATOM 0 HB2 SER A 36 116.548 -11.549 1.869 1.00 0.00 H new ATOM 0 HB3 SER A 36 116.522 -11.545 0.116 1.00 0.00 H new ATOM 0 HG SER A 36 115.043 -9.983 1.020 1.00 0.00 H new ATOM 622 N SER A 37 117.706 -14.126 1.387 1.00 0.00 N ATOM 623 CA SER A 37 118.713 -14.939 2.129 1.00 0.00 C ATOM 624 C SER A 37 119.727 -14.023 2.820 1.00 0.00 C ATOM 625 O SER A 37 119.666 -13.803 4.013 1.00 0.00 O ATOM 626 CB SER A 37 119.399 -15.790 1.062 1.00 0.00 C ATOM 627 OG SER A 37 118.535 -16.854 0.682 1.00 0.00 O ATOM 0 H SER A 37 118.061 -13.643 0.562 1.00 0.00 H new ATOM 0 HA SER A 37 118.257 -15.551 2.907 1.00 0.00 H new ATOM 0 HB2 SER A 37 119.644 -15.178 0.194 1.00 0.00 H new ATOM 0 HB3 SER A 37 120.338 -16.188 1.446 1.00 0.00 H new ATOM 0 HG SER A 37 118.972 -17.401 -0.004 1.00 0.00 H new ATOM 633 N SER A 38 120.658 -13.487 2.080 1.00 0.00 N ATOM 634 CA SER A 38 121.675 -12.588 2.697 1.00 0.00 C ATOM 635 C SER A 38 121.796 -11.292 1.890 1.00 0.00 C ATOM 636 O SER A 38 122.738 -11.098 1.147 1.00 0.00 O ATOM 637 CB SER A 38 122.984 -13.374 2.644 1.00 0.00 C ATOM 638 OG SER A 38 123.068 -14.222 3.782 1.00 0.00 O ATOM 0 H SER A 38 120.759 -13.632 1.075 1.00 0.00 H new ATOM 0 HA SER A 38 121.410 -12.305 3.716 1.00 0.00 H new ATOM 0 HB2 SER A 38 123.029 -13.967 1.730 1.00 0.00 H new ATOM 0 HB3 SER A 38 123.832 -12.690 2.622 1.00 0.00 H new ATOM 0 HG SER A 38 123.906 -14.729 3.751 1.00 0.00 H new ATOM 644 N LEU A 39 120.851 -10.403 2.031 1.00 0.00 N ATOM 645 CA LEU A 39 120.914 -9.120 1.272 1.00 0.00 C ATOM 646 C LEU A 39 121.375 -7.984 2.189 1.00 0.00 C ATOM 647 O LEU A 39 122.251 -7.216 1.848 1.00 0.00 O ATOM 648 CB LEU A 39 119.482 -8.876 0.790 1.00 0.00 C ATOM 649 CG LEU A 39 119.475 -8.701 -0.728 1.00 0.00 C ATOM 650 CD1 LEU A 39 120.162 -7.385 -1.095 1.00 0.00 C ATOM 651 CD2 LEU A 39 120.226 -9.865 -1.379 1.00 0.00 C ATOM 0 H LEU A 39 120.038 -10.509 2.638 1.00 0.00 H new ATOM 0 HA LEU A 39 121.621 -9.163 0.444 1.00 0.00 H new ATOM 0 HB2 LEU A 39 118.845 -9.714 1.073 1.00 0.00 H new ATOM 0 HB3 LEU A 39 119.072 -7.988 1.271 1.00 0.00 H new ATOM 0 HG LEU A 39 118.445 -8.685 -1.086 1.00 0.00 H new ATOM 0 HD11 LEU A 39 120.156 -7.261 -2.178 1.00 0.00 H new ATOM 0 HD12 LEU A 39 119.629 -6.555 -0.632 1.00 0.00 H new ATOM 0 HD13 LEU A 39 121.191 -7.400 -0.737 1.00 0.00 H new ATOM 0 HD21 LEU A 39 120.221 -9.741 -2.462 1.00 0.00 H new ATOM 0 HD22 LEU A 39 121.255 -9.880 -1.020 1.00 0.00 H new ATOM 0 HD23 LEU A 39 119.737 -10.804 -1.119 1.00 0.00 H new ATOM 663 N MET A 40 120.790 -7.872 3.351 1.00 0.00 N ATOM 664 CA MET A 40 121.195 -6.785 4.288 1.00 0.00 C ATOM 665 C MET A 40 122.550 -7.110 4.922 1.00 0.00 C ATOM 666 O MET A 40 123.475 -6.324 4.873 1.00 0.00 O ATOM 667 CB MET A 40 120.099 -6.750 5.354 1.00 0.00 C ATOM 668 CG MET A 40 119.100 -5.639 5.027 1.00 0.00 C ATOM 669 SD MET A 40 117.414 -6.267 5.227 1.00 0.00 S ATOM 670 CE MET A 40 117.081 -5.518 6.839 1.00 0.00 C ATOM 0 H MET A 40 120.050 -8.486 3.692 1.00 0.00 H new ATOM 0 HA MET A 40 121.303 -5.825 3.783 1.00 0.00 H new ATOM 0 HB2 MET A 40 119.588 -7.712 5.396 1.00 0.00 H new ATOM 0 HB3 MET A 40 120.539 -6.580 6.337 1.00 0.00 H new ATOM 0 HG2 MET A 40 119.262 -4.785 5.684 1.00 0.00 H new ATOM 0 HG3 MET A 40 119.250 -5.289 4.006 1.00 0.00 H new ATOM 0 HE1 MET A 40 116.013 -5.322 6.936 1.00 0.00 H new ATOM 0 HE2 MET A 40 117.398 -6.199 7.629 1.00 0.00 H new ATOM 0 HE3 MET A 40 117.631 -4.581 6.925 1.00 0.00 H new ATOM 680 N SER A 41 122.675 -8.265 5.517 1.00 0.00 N ATOM 681 CA SER A 41 123.970 -8.642 6.155 1.00 0.00 C ATOM 682 C SER A 41 125.104 -8.578 5.128 1.00 0.00 C ATOM 683 O SER A 41 126.249 -8.357 5.466 1.00 0.00 O ATOM 684 CB SER A 41 123.768 -10.076 6.641 1.00 0.00 C ATOM 685 OG SER A 41 125.031 -10.648 6.952 1.00 0.00 O ATOM 0 H SER A 41 121.936 -8.965 5.589 1.00 0.00 H new ATOM 0 HA SER A 41 124.241 -7.970 6.969 1.00 0.00 H new ATOM 0 HB2 SER A 41 123.124 -10.087 7.521 1.00 0.00 H new ATOM 0 HB3 SER A 41 123.268 -10.666 5.873 1.00 0.00 H new ATOM 0 HG SER A 41 124.905 -11.568 7.266 1.00 0.00 H new ATOM 691 N GLU A 42 124.792 -8.772 3.875 1.00 0.00 N ATOM 692 CA GLU A 42 125.852 -8.725 2.828 1.00 0.00 C ATOM 693 C GLU A 42 126.212 -7.273 2.504 1.00 0.00 C ATOM 694 O GLU A 42 127.367 -6.898 2.493 1.00 0.00 O ATOM 695 CB GLU A 42 125.232 -9.409 1.609 1.00 0.00 C ATOM 696 CG GLU A 42 126.183 -10.490 1.091 1.00 0.00 C ATOM 697 CD GLU A 42 125.984 -11.774 1.898 1.00 0.00 C ATOM 698 OE1 GLU A 42 125.701 -11.670 3.080 1.00 0.00 O ATOM 699 OE2 GLU A 42 126.117 -12.841 1.319 1.00 0.00 O ATOM 0 H GLU A 42 123.850 -8.961 3.532 1.00 0.00 H new ATOM 0 HA GLU A 42 126.772 -9.215 3.148 1.00 0.00 H new ATOM 0 HB2 GLU A 42 124.272 -9.852 1.876 1.00 0.00 H new ATOM 0 HB3 GLU A 42 125.038 -8.675 0.827 1.00 0.00 H new ATOM 0 HG2 GLU A 42 125.994 -10.679 0.034 1.00 0.00 H new ATOM 0 HG3 GLU A 42 127.216 -10.151 1.175 1.00 0.00 H new ATOM 706 N ILE A 43 125.232 -6.452 2.241 1.00 0.00 N ATOM 707 CA ILE A 43 125.523 -5.027 1.919 1.00 0.00 C ATOM 708 C ILE A 43 126.328 -4.387 3.054 1.00 0.00 C ATOM 709 O ILE A 43 127.204 -3.577 2.824 1.00 0.00 O ATOM 710 CB ILE A 43 124.154 -4.363 1.783 1.00 0.00 C ATOM 711 CG1 ILE A 43 123.452 -4.904 0.536 1.00 0.00 C ATOM 712 CG2 ILE A 43 124.330 -2.849 1.652 1.00 0.00 C ATOM 713 CD1 ILE A 43 121.965 -4.550 0.589 1.00 0.00 C ATOM 0 H ILE A 43 124.244 -6.706 2.235 1.00 0.00 H new ATOM 0 HA ILE A 43 126.115 -4.918 1.010 1.00 0.00 H new ATOM 0 HB ILE A 43 123.553 -4.582 2.666 1.00 0.00 H new ATOM 0 HG12 ILE A 43 123.905 -4.481 -0.361 1.00 0.00 H new ATOM 0 HG13 ILE A 43 123.577 -5.985 0.477 1.00 0.00 H new ATOM 0 HG21 ILE A 43 123.353 -2.376 1.555 1.00 0.00 H new ATOM 0 HG22 ILE A 43 124.833 -2.463 2.538 1.00 0.00 H new ATOM 0 HG23 ILE A 43 124.929 -2.627 0.769 1.00 0.00 H new ATOM 0 HD11 ILE A 43 121.467 -4.936 -0.300 1.00 0.00 H new ATOM 0 HD12 ILE A 43 121.517 -4.994 1.478 1.00 0.00 H new ATOM 0 HD13 ILE A 43 121.850 -3.467 0.627 1.00 0.00 H new ATOM 725 N ALA A 44 126.045 -4.751 4.274 1.00 0.00 N ATOM 726 CA ALA A 44 126.803 -4.169 5.419 1.00 0.00 C ATOM 727 C ALA A 44 128.253 -4.656 5.377 1.00 0.00 C ATOM 728 O ALA A 44 129.186 -3.878 5.448 1.00 0.00 O ATOM 729 CB ALA A 44 126.093 -4.687 6.669 1.00 0.00 C ATOM 0 H ALA A 44 125.323 -5.425 4.528 1.00 0.00 H new ATOM 0 HA ALA A 44 126.829 -3.080 5.395 1.00 0.00 H new ATOM 0 HB1 ALA A 44 126.593 -4.302 7.558 1.00 0.00 H new ATOM 0 HB2 ALA A 44 125.055 -4.353 6.663 1.00 0.00 H new ATOM 0 HB3 ALA A 44 126.123 -5.777 6.680 1.00 0.00 H new ATOM 735 N ASP A 45 128.453 -5.939 5.244 1.00 0.00 N ATOM 736 CA ASP A 45 129.843 -6.463 5.178 1.00 0.00 C ATOM 737 C ASP A 45 130.593 -5.754 4.050 1.00 0.00 C ATOM 738 O ASP A 45 131.807 -5.742 4.005 1.00 0.00 O ATOM 739 CB ASP A 45 129.694 -7.955 4.874 1.00 0.00 C ATOM 740 CG ASP A 45 131.033 -8.660 5.099 1.00 0.00 C ATOM 741 OD1 ASP A 45 131.643 -8.415 6.127 1.00 0.00 O ATOM 742 OD2 ASP A 45 131.424 -9.432 4.240 1.00 0.00 O ATOM 0 H ASP A 45 127.717 -6.642 5.179 1.00 0.00 H new ATOM 0 HA ASP A 45 130.402 -6.299 6.099 1.00 0.00 H new ATOM 0 HB2 ASP A 45 128.929 -8.393 5.515 1.00 0.00 H new ATOM 0 HB3 ASP A 45 129.366 -8.096 3.844 1.00 0.00 H new ATOM 747 N LEU A 46 129.870 -5.157 3.141 1.00 0.00 N ATOM 748 CA LEU A 46 130.525 -4.440 2.014 1.00 0.00 C ATOM 749 C LEU A 46 130.880 -3.012 2.434 1.00 0.00 C ATOM 750 O LEU A 46 131.880 -2.464 2.017 1.00 0.00 O ATOM 751 CB LEU A 46 129.483 -4.427 0.895 1.00 0.00 C ATOM 752 CG LEU A 46 129.551 -5.742 0.120 1.00 0.00 C ATOM 753 CD1 LEU A 46 128.208 -6.002 -0.565 1.00 0.00 C ATOM 754 CD2 LEU A 46 130.654 -5.653 -0.938 1.00 0.00 C ATOM 0 H LEU A 46 128.850 -5.136 3.132 1.00 0.00 H new ATOM 0 HA LEU A 46 131.453 -4.919 1.701 1.00 0.00 H new ATOM 0 HB2 LEU A 46 128.486 -4.290 1.314 1.00 0.00 H new ATOM 0 HB3 LEU A 46 129.665 -3.587 0.224 1.00 0.00 H new ATOM 0 HG LEU A 46 129.771 -6.558 0.808 1.00 0.00 H new ATOM 0 HD11 LEU A 46 128.257 -6.940 -1.118 1.00 0.00 H new ATOM 0 HD12 LEU A 46 127.422 -6.065 0.187 1.00 0.00 H new ATOM 0 HD13 LEU A 46 127.987 -5.186 -1.254 1.00 0.00 H new ATOM 0 HD21 LEU A 46 130.704 -6.591 -1.492 1.00 0.00 H new ATOM 0 HD22 LEU A 46 130.433 -4.837 -1.626 1.00 0.00 H new ATOM 0 HD23 LEU A 46 131.611 -5.468 -0.451 1.00 0.00 H new ATOM 766 N THR A 47 130.072 -2.405 3.261 1.00 0.00 N ATOM 767 CA THR A 47 130.382 -1.014 3.702 1.00 0.00 C ATOM 768 C THR A 47 131.773 -0.976 4.330 1.00 0.00 C ATOM 769 O THR A 47 132.543 -0.064 4.103 1.00 0.00 O ATOM 770 CB THR A 47 129.316 -0.662 4.739 1.00 0.00 C ATOM 771 OG1 THR A 47 129.370 -1.595 5.808 1.00 0.00 O ATOM 772 CG2 THR A 47 127.938 -0.705 4.086 1.00 0.00 C ATOM 0 H THR A 47 129.218 -2.807 3.648 1.00 0.00 H new ATOM 0 HA THR A 47 130.376 -0.307 2.873 1.00 0.00 H new ATOM 0 HB THR A 47 129.500 0.340 5.126 1.00 0.00 H new ATOM 0 HG1 THR A 47 128.981 -2.447 5.519 1.00 0.00 H new ATOM 0 HG21 THR A 47 127.177 -0.454 4.825 1.00 0.00 H new ATOM 0 HG22 THR A 47 127.900 0.014 3.268 1.00 0.00 H new ATOM 0 HG23 THR A 47 127.750 -1.706 3.698 1.00 0.00 H new ATOM 780 N TYR A 48 132.102 -1.968 5.112 1.00 0.00 N ATOM 781 CA TYR A 48 133.453 -1.995 5.747 1.00 0.00 C ATOM 782 C TYR A 48 134.503 -1.591 4.712 1.00 0.00 C ATOM 783 O TYR A 48 135.394 -0.810 4.981 1.00 0.00 O ATOM 784 CB TYR A 48 133.663 -3.444 6.185 1.00 0.00 C ATOM 785 CG TYR A 48 132.747 -3.760 7.341 1.00 0.00 C ATOM 786 CD1 TYR A 48 133.125 -3.421 8.646 1.00 0.00 C ATOM 787 CD2 TYR A 48 131.521 -4.393 7.109 1.00 0.00 C ATOM 788 CE1 TYR A 48 132.275 -3.715 9.719 1.00 0.00 C ATOM 789 CE2 TYR A 48 130.671 -4.687 8.182 1.00 0.00 C ATOM 790 CZ TYR A 48 131.048 -4.348 9.487 1.00 0.00 C ATOM 791 OH TYR A 48 130.211 -4.639 10.545 1.00 0.00 O ATOM 0 H TYR A 48 131.498 -2.758 5.339 1.00 0.00 H new ATOM 0 HA TYR A 48 133.536 -1.308 6.589 1.00 0.00 H new ATOM 0 HB2 TYR A 48 133.462 -4.119 5.353 1.00 0.00 H new ATOM 0 HB3 TYR A 48 134.701 -3.599 6.477 1.00 0.00 H new ATOM 0 HD1 TYR A 48 134.072 -2.933 8.825 1.00 0.00 H new ATOM 0 HD2 TYR A 48 131.230 -4.655 6.102 1.00 0.00 H new ATOM 0 HE1 TYR A 48 132.566 -3.453 10.726 1.00 0.00 H new ATOM 0 HE2 TYR A 48 129.724 -5.175 8.003 1.00 0.00 H new ATOM 0 HH TYR A 48 129.361 -4.988 10.204 1.00 0.00 H new ATOM 801 N ASN A 49 134.387 -2.112 3.523 1.00 0.00 N ATOM 802 CA ASN A 49 135.355 -1.756 2.447 1.00 0.00 C ATOM 803 C ASN A 49 135.333 -0.259 2.202 1.00 0.00 C ATOM 804 O ASN A 49 134.926 0.518 3.041 1.00 0.00 O ATOM 805 CB ASN A 49 134.871 -2.520 1.211 1.00 0.00 C ATOM 806 CG ASN A 49 135.709 -3.787 1.034 1.00 0.00 C ATOM 807 OD1 ASN A 49 136.920 -3.722 0.945 1.00 0.00 O ATOM 808 ND2 ASN A 49 135.114 -4.948 0.979 1.00 0.00 N ATOM 0 H ASN A 49 133.660 -2.772 3.248 1.00 0.00 H new ATOM 0 HA ASN A 49 136.381 -2.017 2.705 1.00 0.00 H new ATOM 0 HB2 ASN A 49 133.818 -2.780 1.320 1.00 0.00 H new ATOM 0 HB3 ASN A 49 134.954 -1.890 0.325 1.00 0.00 H new ATOM 0 HD21 ASN A 49 135.665 -5.798 0.862 1.00 0.00 H new ATOM 0 HD22 ASN A 49 134.098 -5.005 1.053 1.00 0.00 H new ATOM 815 N VAL A 50 135.802 0.148 1.071 1.00 0.00 N ATOM 816 CA VAL A 50 135.856 1.589 0.767 1.00 0.00 C ATOM 817 C VAL A 50 135.058 1.859 -0.507 1.00 0.00 C ATOM 818 O VAL A 50 134.443 2.896 -0.663 1.00 0.00 O ATOM 819 CB VAL A 50 137.349 1.860 0.583 1.00 0.00 C ATOM 820 CG1 VAL A 50 138.142 1.160 1.707 1.00 0.00 C ATOM 821 CG2 VAL A 50 137.802 1.311 -0.771 1.00 0.00 C ATOM 0 H VAL A 50 136.155 -0.463 0.335 1.00 0.00 H new ATOM 0 HA VAL A 50 135.426 2.230 1.536 1.00 0.00 H new ATOM 0 HB VAL A 50 137.530 2.934 0.623 1.00 0.00 H new ATOM 0 HG11 VAL A 50 139.207 1.353 1.576 1.00 0.00 H new ATOM 0 HG12 VAL A 50 137.820 1.546 2.674 1.00 0.00 H new ATOM 0 HG13 VAL A 50 137.960 0.086 1.666 1.00 0.00 H new ATOM 0 HG21 VAL A 50 138.867 1.503 -0.904 1.00 0.00 H new ATOM 0 HG22 VAL A 50 137.620 0.237 -0.807 1.00 0.00 H new ATOM 0 HG23 VAL A 50 137.243 1.801 -1.568 1.00 0.00 H new ATOM 831 N VAL A 51 135.048 0.917 -1.406 1.00 0.00 N ATOM 832 CA VAL A 51 134.274 1.091 -2.663 1.00 0.00 C ATOM 833 C VAL A 51 132.830 0.667 -2.442 1.00 0.00 C ATOM 834 O VAL A 51 131.917 1.469 -2.443 1.00 0.00 O ATOM 835 CB VAL A 51 134.919 0.133 -3.663 1.00 0.00 C ATOM 836 CG1 VAL A 51 133.943 -0.149 -4.820 1.00 0.00 C ATOM 837 CG2 VAL A 51 136.203 0.760 -4.200 1.00 0.00 C ATOM 0 H VAL A 51 135.545 0.030 -1.323 1.00 0.00 H new ATOM 0 HA VAL A 51 134.280 2.126 -3.003 1.00 0.00 H new ATOM 0 HB VAL A 51 135.156 -0.809 -3.169 1.00 0.00 H new ATOM 0 HG11 VAL A 51 134.408 -0.833 -5.530 1.00 0.00 H new ATOM 0 HG12 VAL A 51 133.032 -0.600 -4.426 1.00 0.00 H new ATOM 0 HG13 VAL A 51 133.697 0.785 -5.324 1.00 0.00 H new ATOM 0 HG21 VAL A 51 136.668 0.081 -4.914 1.00 0.00 H new ATOM 0 HG22 VAL A 51 135.968 1.702 -4.695 1.00 0.00 H new ATOM 0 HG23 VAL A 51 136.890 0.945 -3.375 1.00 0.00 H new ATOM 847 N ALA A 52 132.633 -0.611 -2.296 1.00 0.00 N ATOM 848 CA ALA A 52 131.267 -1.149 -2.120 1.00 0.00 C ATOM 849 C ALA A 52 130.426 -0.219 -1.244 1.00 0.00 C ATOM 850 O ALA A 52 129.260 0.003 -1.503 1.00 0.00 O ATOM 851 CB ALA A 52 131.460 -2.498 -1.433 1.00 0.00 C ATOM 0 H ALA A 52 133.374 -1.312 -2.292 1.00 0.00 H new ATOM 0 HA ALA A 52 130.741 -1.241 -3.070 1.00 0.00 H new ATOM 0 HB1 ALA A 52 130.489 -2.964 -1.266 1.00 0.00 H new ATOM 0 HB2 ALA A 52 132.069 -3.144 -2.065 1.00 0.00 H new ATOM 0 HB3 ALA A 52 131.961 -2.351 -0.476 1.00 0.00 H new ATOM 857 N PHE A 53 131.004 0.323 -0.209 1.00 0.00 N ATOM 858 CA PHE A 53 130.236 1.236 0.681 1.00 0.00 C ATOM 859 C PHE A 53 129.626 2.381 -0.132 1.00 0.00 C ATOM 860 O PHE A 53 128.428 2.576 -0.147 1.00 0.00 O ATOM 861 CB PHE A 53 131.267 1.774 1.673 1.00 0.00 C ATOM 862 CG PHE A 53 130.695 2.980 2.368 1.00 0.00 C ATOM 863 CD1 PHE A 53 129.419 2.916 2.932 1.00 0.00 C ATOM 864 CD2 PHE A 53 131.436 4.162 2.437 1.00 0.00 C ATOM 865 CE1 PHE A 53 128.880 4.036 3.570 1.00 0.00 C ATOM 866 CE2 PHE A 53 130.899 5.287 3.076 1.00 0.00 C ATOM 867 CZ PHE A 53 129.619 5.224 3.642 1.00 0.00 C ATOM 0 H PHE A 53 131.977 0.173 0.059 1.00 0.00 H new ATOM 0 HA PHE A 53 129.411 0.729 1.181 1.00 0.00 H new ATOM 0 HB2 PHE A 53 131.524 1.006 2.402 1.00 0.00 H new ATOM 0 HB3 PHE A 53 132.187 2.040 1.153 1.00 0.00 H new ATOM 0 HD1 PHE A 53 128.849 2.001 2.875 1.00 0.00 H new ATOM 0 HD2 PHE A 53 132.422 4.209 1.998 1.00 0.00 H new ATOM 0 HE1 PHE A 53 127.894 3.986 4.008 1.00 0.00 H new ATOM 0 HE2 PHE A 53 131.471 6.201 3.132 1.00 0.00 H new ATOM 0 HZ PHE A 53 129.202 6.091 4.133 1.00 0.00 H new ATOM 877 N SER A 54 130.444 3.147 -0.802 1.00 0.00 N ATOM 878 CA SER A 54 129.909 4.279 -1.611 1.00 0.00 C ATOM 879 C SER A 54 128.868 3.766 -2.609 1.00 0.00 C ATOM 880 O SER A 54 127.840 4.379 -2.818 1.00 0.00 O ATOM 881 CB SER A 54 131.122 4.848 -2.347 1.00 0.00 C ATOM 882 OG SER A 54 132.008 5.439 -1.405 1.00 0.00 O ATOM 0 H SER A 54 131.458 3.038 -0.824 1.00 0.00 H new ATOM 0 HA SER A 54 129.417 5.032 -0.995 1.00 0.00 H new ATOM 0 HB2 SER A 54 131.632 4.057 -2.897 1.00 0.00 H new ATOM 0 HB3 SER A 54 130.803 5.590 -3.079 1.00 0.00 H new ATOM 0 HG SER A 54 132.788 5.803 -1.873 1.00 0.00 H new ATOM 888 N GLU A 55 129.125 2.641 -3.221 1.00 0.00 N ATOM 889 CA GLU A 55 128.147 2.087 -4.201 1.00 0.00 C ATOM 890 C GLU A 55 126.851 1.696 -3.483 1.00 0.00 C ATOM 891 O GLU A 55 125.789 1.656 -4.070 1.00 0.00 O ATOM 892 CB GLU A 55 128.829 0.848 -4.786 1.00 0.00 C ATOM 893 CG GLU A 55 130.286 1.172 -5.127 1.00 0.00 C ATOM 894 CD GLU A 55 130.556 0.831 -6.593 1.00 0.00 C ATOM 895 OE1 GLU A 55 130.927 -0.300 -6.860 1.00 0.00 O ATOM 896 OE2 GLU A 55 130.388 1.708 -7.425 1.00 0.00 O ATOM 0 H GLU A 55 129.968 2.083 -3.085 1.00 0.00 H new ATOM 0 HA GLU A 55 127.881 2.808 -4.974 1.00 0.00 H new ATOM 0 HB2 GLU A 55 128.787 0.026 -4.071 1.00 0.00 H new ATOM 0 HB3 GLU A 55 128.301 0.519 -5.681 1.00 0.00 H new ATOM 0 HG2 GLU A 55 130.487 2.228 -4.946 1.00 0.00 H new ATOM 0 HG3 GLU A 55 130.956 0.605 -4.481 1.00 0.00 H new ATOM 903 N ILE A 56 126.937 1.410 -2.212 1.00 0.00 N ATOM 904 CA ILE A 56 125.719 1.020 -1.445 1.00 0.00 C ATOM 905 C ILE A 56 124.909 2.265 -1.073 1.00 0.00 C ATOM 906 O ILE A 56 123.842 2.502 -1.604 1.00 0.00 O ATOM 907 CB ILE A 56 126.253 0.327 -0.190 1.00 0.00 C ATOM 908 CG1 ILE A 56 126.712 -1.087 -0.552 1.00 0.00 C ATOM 909 CG2 ILE A 56 125.148 0.246 0.864 1.00 0.00 C ATOM 910 CD1 ILE A 56 127.869 -1.502 0.360 1.00 0.00 C ATOM 0 H ILE A 56 127.801 1.430 -1.670 1.00 0.00 H new ATOM 0 HA ILE A 56 125.055 0.372 -2.017 1.00 0.00 H new ATOM 0 HB ILE A 56 127.092 0.897 0.210 1.00 0.00 H new ATOM 0 HG12 ILE A 56 125.883 -1.787 -0.446 1.00 0.00 H new ATOM 0 HG13 ILE A 56 127.027 -1.122 -1.595 1.00 0.00 H new ATOM 0 HG21 ILE A 56 125.532 -0.248 1.756 1.00 0.00 H new ATOM 0 HG22 ILE A 56 124.816 1.252 1.121 1.00 0.00 H new ATOM 0 HG23 ILE A 56 124.308 -0.324 0.467 1.00 0.00 H new ATOM 0 HD11 ILE A 56 128.194 -2.509 0.100 1.00 0.00 H new ATOM 0 HD12 ILE A 56 128.700 -0.808 0.232 1.00 0.00 H new ATOM 0 HD13 ILE A 56 127.538 -1.484 1.398 1.00 0.00 H new ATOM 922 N MET A 57 125.409 3.067 -0.173 1.00 0.00 N ATOM 923 CA MET A 57 124.664 4.299 0.220 1.00 0.00 C ATOM 924 C MET A 57 124.208 5.045 -1.035 1.00 0.00 C ATOM 925 O MET A 57 123.113 5.562 -1.097 1.00 0.00 O ATOM 926 CB MET A 57 125.669 5.140 1.007 1.00 0.00 C ATOM 927 CG MET A 57 125.603 4.765 2.489 1.00 0.00 C ATOM 928 SD MET A 57 126.297 6.111 3.482 1.00 0.00 S ATOM 929 CE MET A 57 124.748 6.999 3.774 1.00 0.00 C ATOM 0 H MET A 57 126.298 2.924 0.306 1.00 0.00 H new ATOM 0 HA MET A 57 123.774 4.079 0.810 1.00 0.00 H new ATOM 0 HB2 MET A 57 126.676 4.974 0.624 1.00 0.00 H new ATOM 0 HB3 MET A 57 125.450 6.200 0.880 1.00 0.00 H new ATOM 0 HG2 MET A 57 124.570 4.577 2.782 1.00 0.00 H new ATOM 0 HG3 MET A 57 126.157 3.844 2.667 1.00 0.00 H new ATOM 0 HE1 MET A 57 124.892 7.730 4.570 1.00 0.00 H new ATOM 0 HE2 MET A 57 124.445 7.512 2.861 1.00 0.00 H new ATOM 0 HE3 MET A 57 123.973 6.291 4.067 1.00 0.00 H new ATOM 939 N SER A 58 125.041 5.097 -2.039 1.00 0.00 N ATOM 940 CA SER A 58 124.650 5.802 -3.293 1.00 0.00 C ATOM 941 C SER A 58 123.314 5.256 -3.798 1.00 0.00 C ATOM 942 O SER A 58 122.356 5.985 -3.961 1.00 0.00 O ATOM 943 CB SER A 58 125.770 5.495 -4.287 1.00 0.00 C ATOM 944 OG SER A 58 125.505 6.166 -5.512 1.00 0.00 O ATOM 0 H SER A 58 125.973 4.683 -2.045 1.00 0.00 H new ATOM 0 HA SER A 58 124.524 6.875 -3.148 1.00 0.00 H new ATOM 0 HB2 SER A 58 126.730 5.817 -3.883 1.00 0.00 H new ATOM 0 HB3 SER A 58 125.839 4.420 -4.455 1.00 0.00 H new ATOM 0 HG SER A 58 126.222 5.973 -6.152 1.00 0.00 H new ATOM 950 N MET A 59 123.238 3.974 -4.037 1.00 0.00 N ATOM 951 CA MET A 59 121.958 3.384 -4.520 1.00 0.00 C ATOM 952 C MET A 59 120.869 3.586 -3.464 1.00 0.00 C ATOM 953 O MET A 59 119.691 3.589 -3.761 1.00 0.00 O ATOM 954 CB MET A 59 122.253 1.896 -4.717 1.00 0.00 C ATOM 955 CG MET A 59 123.051 1.701 -6.008 1.00 0.00 C ATOM 956 SD MET A 59 122.070 2.278 -7.416 1.00 0.00 S ATOM 957 CE MET A 59 122.914 1.311 -8.691 1.00 0.00 C ATOM 0 H MET A 59 124.005 3.312 -3.919 1.00 0.00 H new ATOM 0 HA MET A 59 121.604 3.847 -5.441 1.00 0.00 H new ATOM 0 HB2 MET A 59 122.816 1.510 -3.867 1.00 0.00 H new ATOM 0 HB3 MET A 59 121.321 1.333 -4.764 1.00 0.00 H new ATOM 0 HG2 MET A 59 123.990 2.252 -5.955 1.00 0.00 H new ATOM 0 HG3 MET A 59 123.306 0.649 -6.135 1.00 0.00 H new ATOM 0 HE1 MET A 59 122.462 1.516 -9.662 1.00 0.00 H new ATOM 0 HE2 MET A 59 123.969 1.585 -8.717 1.00 0.00 H new ATOM 0 HE3 MET A 59 122.820 0.249 -8.464 1.00 0.00 H new ATOM 967 N ILE A 60 121.260 3.764 -2.232 1.00 0.00 N ATOM 968 CA ILE A 60 120.258 3.978 -1.149 1.00 0.00 C ATOM 969 C ILE A 60 119.652 5.381 -1.289 1.00 0.00 C ATOM 970 O ILE A 60 118.502 5.604 -0.968 1.00 0.00 O ATOM 971 CB ILE A 60 121.058 3.813 0.156 1.00 0.00 C ATOM 972 CG1 ILE A 60 120.796 2.418 0.730 1.00 0.00 C ATOM 973 CG2 ILE A 60 120.645 4.865 1.193 1.00 0.00 C ATOM 974 CD1 ILE A 60 122.102 1.622 0.762 1.00 0.00 C ATOM 0 H ILE A 60 122.233 3.771 -1.928 1.00 0.00 H new ATOM 0 HA ILE A 60 119.421 3.281 -1.181 1.00 0.00 H new ATOM 0 HB ILE A 60 122.117 3.943 -0.068 1.00 0.00 H new ATOM 0 HG12 ILE A 60 120.383 2.499 1.736 1.00 0.00 H new ATOM 0 HG13 ILE A 60 120.056 1.897 0.123 1.00 0.00 H new ATOM 0 HG21 ILE A 60 121.226 4.725 2.105 1.00 0.00 H new ATOM 0 HG22 ILE A 60 120.831 5.862 0.794 1.00 0.00 H new ATOM 0 HG23 ILE A 60 119.584 4.757 1.419 1.00 0.00 H new ATOM 0 HD11 ILE A 60 121.913 0.629 1.171 1.00 0.00 H new ATOM 0 HD12 ILE A 60 122.496 1.529 -0.250 1.00 0.00 H new ATOM 0 HD13 ILE A 60 122.829 2.140 1.388 1.00 0.00 H new ATOM 986 N TRP A 61 120.416 6.321 -1.773 1.00 0.00 N ATOM 987 CA TRP A 61 119.882 7.703 -1.942 1.00 0.00 C ATOM 988 C TRP A 61 118.941 7.749 -3.147 1.00 0.00 C ATOM 989 O TRP A 61 117.864 8.310 -3.086 1.00 0.00 O ATOM 990 CB TRP A 61 121.112 8.578 -2.188 1.00 0.00 C ATOM 991 CG TRP A 61 121.937 8.644 -0.942 1.00 0.00 C ATOM 992 CD1 TRP A 61 123.270 8.427 -0.881 1.00 0.00 C ATOM 993 CD2 TRP A 61 121.508 8.944 0.419 1.00 0.00 C ATOM 994 NE1 TRP A 61 123.687 8.575 0.430 1.00 0.00 N ATOM 995 CE2 TRP A 61 122.638 8.893 1.268 1.00 0.00 C ATOM 996 CE3 TRP A 61 120.261 9.253 0.993 1.00 0.00 C ATOM 997 CZ2 TRP A 61 122.536 9.139 2.638 1.00 0.00 C ATOM 998 CZ3 TRP A 61 120.154 9.501 2.371 1.00 0.00 C ATOM 999 CH2 TRP A 61 121.290 9.444 3.191 1.00 0.00 C ATOM 0 H TRP A 61 121.387 6.193 -2.059 1.00 0.00 H new ATOM 0 HA TRP A 61 119.314 8.040 -1.075 1.00 0.00 H new ATOM 0 HB2 TRP A 61 121.704 8.169 -3.007 1.00 0.00 H new ATOM 0 HB3 TRP A 61 120.804 9.580 -2.486 1.00 0.00 H new ATOM 0 HD1 TRP A 61 123.905 8.179 -1.718 1.00 0.00 H new ATOM 0 HE1 TRP A 61 124.652 8.463 0.739 1.00 0.00 H new ATOM 0 HE3 TRP A 61 119.380 9.300 0.370 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 123.414 9.094 3.266 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 119.192 9.737 2.801 1.00 0.00 H new ATOM 0 HH2 TRP A 61 121.202 9.636 4.250 1.00 0.00 H new ATOM 1010 N LYS A 62 119.334 7.154 -4.241 1.00 0.00 N ATOM 1011 CA LYS A 62 118.457 7.154 -5.447 1.00 0.00 C ATOM 1012 C LYS A 62 117.154 6.416 -5.137 1.00 0.00 C ATOM 1013 O LYS A 62 116.073 6.934 -5.332 1.00 0.00 O ATOM 1014 CB LYS A 62 119.256 6.413 -6.519 1.00 0.00 C ATOM 1015 CG LYS A 62 120.275 7.366 -7.148 1.00 0.00 C ATOM 1016 CD LYS A 62 121.688 6.945 -6.740 1.00 0.00 C ATOM 1017 CE LYS A 62 122.680 7.354 -7.831 1.00 0.00 C ATOM 1018 NZ LYS A 62 123.484 6.129 -8.097 1.00 0.00 N ATOM 0 H LYS A 62 120.224 6.668 -4.352 1.00 0.00 H new ATOM 0 HA LYS A 62 118.188 8.160 -5.770 1.00 0.00 H new ATOM 0 HB2 LYS A 62 119.767 5.556 -6.079 1.00 0.00 H new ATOM 0 HB3 LYS A 62 118.584 6.025 -7.285 1.00 0.00 H new ATOM 0 HG2 LYS A 62 120.179 7.352 -8.234 1.00 0.00 H new ATOM 0 HG3 LYS A 62 120.081 8.388 -6.824 1.00 0.00 H new ATOM 0 HD2 LYS A 62 121.959 7.413 -5.794 1.00 0.00 H new ATOM 0 HD3 LYS A 62 121.727 5.867 -6.585 1.00 0.00 H new ATOM 0 HE2 LYS A 62 122.163 7.690 -8.730 1.00 0.00 H new ATOM 0 HE3 LYS A 62 123.313 8.178 -7.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 124.069 6.275 -8.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 124.099 5.934 -7.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 122.846 5.322 -8.251 1.00 0.00 H new ATOM 1032 N ARG A 63 117.248 5.211 -4.643 1.00 0.00 N ATOM 1033 CA ARG A 63 116.014 4.444 -4.310 1.00 0.00 C ATOM 1034 C ARG A 63 115.233 5.173 -3.214 1.00 0.00 C ATOM 1035 O ARG A 63 114.019 5.182 -3.203 1.00 0.00 O ATOM 1036 CB ARG A 63 116.512 3.089 -3.803 1.00 0.00 C ATOM 1037 CG ARG A 63 117.154 2.315 -4.956 1.00 0.00 C ATOM 1038 CD ARG A 63 116.094 1.998 -6.013 1.00 0.00 C ATOM 1039 NE ARG A 63 116.207 3.096 -7.012 1.00 0.00 N ATOM 1040 CZ ARG A 63 117.182 3.093 -7.883 1.00 0.00 C ATOM 1041 NH1 ARG A 63 118.104 2.170 -7.832 1.00 0.00 N ATOM 1042 NH2 ARG A 63 117.234 4.015 -8.805 1.00 0.00 N ATOM 0 H ARG A 63 118.125 4.725 -4.456 1.00 0.00 H new ATOM 0 HA ARG A 63 115.347 4.335 -5.165 1.00 0.00 H new ATOM 0 HB2 ARG A 63 117.236 3.233 -3.001 1.00 0.00 H new ATOM 0 HB3 ARG A 63 115.683 2.518 -3.386 1.00 0.00 H new ATOM 0 HG2 ARG A 63 117.959 2.902 -5.398 1.00 0.00 H new ATOM 0 HG3 ARG A 63 117.599 1.392 -4.585 1.00 0.00 H new ATOM 0 HD2 ARG A 63 116.273 1.026 -6.473 1.00 0.00 H new ATOM 0 HD3 ARG A 63 115.097 1.964 -5.574 1.00 0.00 H new ATOM 0 HE ARG A 63 115.522 3.852 -7.017 1.00 0.00 H new ATOM 0 HH11 ARG A 63 118.065 1.449 -7.111 1.00 0.00 H new ATOM 0 HH12 ARG A 63 118.864 2.170 -8.513 1.00 0.00 H new ATOM 0 HH21 ARG A 63 116.515 4.737 -8.846 1.00 0.00 H new ATOM 0 HH22 ARG A 63 117.994 4.014 -9.485 1.00 0.00 H new ATOM 1056 N LEU A 64 115.925 5.788 -2.294 1.00 0.00 N ATOM 1057 CA LEU A 64 115.227 6.522 -1.200 1.00 0.00 C ATOM 1058 C LEU A 64 114.248 7.530 -1.789 1.00 0.00 C ATOM 1059 O LEU A 64 113.291 7.926 -1.157 1.00 0.00 O ATOM 1060 CB LEU A 64 116.328 7.256 -0.446 1.00 0.00 C ATOM 1061 CG LEU A 64 116.592 6.546 0.880 1.00 0.00 C ATOM 1062 CD1 LEU A 64 117.780 7.201 1.587 1.00 0.00 C ATOM 1063 CD2 LEU A 64 115.345 6.652 1.760 1.00 0.00 C ATOM 0 H LEU A 64 116.944 5.814 -2.253 1.00 0.00 H new ATOM 0 HA LEU A 64 114.661 5.850 -0.555 1.00 0.00 H new ATOM 0 HB2 LEU A 64 117.239 7.283 -1.045 1.00 0.00 H new ATOM 0 HB3 LEU A 64 116.034 8.290 -0.266 1.00 0.00 H new ATOM 0 HG LEU A 64 116.822 5.497 0.696 1.00 0.00 H new ATOM 0 HD11 LEU A 64 117.966 6.692 2.533 1.00 0.00 H new ATOM 0 HD12 LEU A 64 118.665 7.127 0.955 1.00 0.00 H new ATOM 0 HD13 LEU A 64 117.556 8.251 1.777 1.00 0.00 H new ATOM 0 HD21 LEU A 64 115.525 6.147 2.709 1.00 0.00 H new ATOM 0 HD22 LEU A 64 115.118 7.702 1.945 1.00 0.00 H new ATOM 0 HD23 LEU A 64 114.502 6.182 1.254 1.00 0.00 H new ATOM 1075 N ASN A 65 114.485 7.950 -2.995 1.00 0.00 N ATOM 1076 CA ASN A 65 113.575 8.928 -3.631 1.00 0.00 C ATOM 1077 C ASN A 65 113.029 8.334 -4.929 1.00 0.00 C ATOM 1078 O ASN A 65 113.061 8.955 -5.973 1.00 0.00 O ATOM 1079 CB ASN A 65 114.441 10.155 -3.917 1.00 0.00 C ATOM 1080 CG ASN A 65 113.558 11.303 -4.409 1.00 0.00 C ATOM 1081 OD1 ASN A 65 112.973 12.017 -3.620 1.00 0.00 O ATOM 1082 ND2 ASN A 65 113.436 11.512 -5.692 1.00 0.00 N ATOM 0 H ASN A 65 115.275 7.655 -3.569 1.00 0.00 H new ATOM 0 HA ASN A 65 112.722 9.184 -3.003 1.00 0.00 H new ATOM 0 HB2 ASN A 65 114.975 10.454 -3.015 1.00 0.00 H new ATOM 0 HB3 ASN A 65 115.194 9.914 -4.668 1.00 0.00 H new ATOM 0 HD21 ASN A 65 112.850 12.275 -6.031 1.00 0.00 H new ATOM 0 HD22 ASN A 65 113.927 10.913 -6.355 1.00 0.00 H new ATOM 1089 N ASP A 66 112.546 7.124 -4.871 1.00 0.00 N ATOM 1090 CA ASP A 66 112.018 6.471 -6.096 1.00 0.00 C ATOM 1091 C ASP A 66 110.580 6.906 -6.367 1.00 0.00 C ATOM 1092 O ASP A 66 109.913 7.462 -5.517 1.00 0.00 O ATOM 1093 CB ASP A 66 112.075 4.972 -5.799 1.00 0.00 C ATOM 1094 CG ASP A 66 112.755 4.247 -6.960 1.00 0.00 C ATOM 1095 OD1 ASP A 66 112.586 4.684 -8.086 1.00 0.00 O ATOM 1096 OD2 ASP A 66 113.434 3.265 -6.703 1.00 0.00 O ATOM 0 H ASP A 66 112.495 6.559 -4.023 1.00 0.00 H new ATOM 0 HA ASP A 66 112.595 6.740 -6.981 1.00 0.00 H new ATOM 0 HB2 ASP A 66 112.624 4.794 -4.874 1.00 0.00 H new ATOM 0 HB3 ASP A 66 111.068 4.581 -5.652 1.00 0.00 H new ATOM 1101 N HIS A 67 110.103 6.647 -7.548 1.00 0.00 N ATOM 1102 CA HIS A 67 108.708 7.031 -7.902 1.00 0.00 C ATOM 1103 C HIS A 67 108.483 8.522 -7.639 1.00 0.00 C ATOM 1104 O HIS A 67 109.260 9.167 -6.964 1.00 0.00 O ATOM 1105 CB HIS A 67 107.823 6.183 -6.989 1.00 0.00 C ATOM 1106 CG HIS A 67 107.680 4.803 -7.571 1.00 0.00 C ATOM 1107 ND1 HIS A 67 107.488 3.683 -6.777 1.00 0.00 N ATOM 1108 CD2 HIS A 67 107.700 4.347 -8.865 1.00 0.00 C ATOM 1109 CE1 HIS A 67 107.400 2.618 -7.594 1.00 0.00 C ATOM 1110 NE2 HIS A 67 107.523 2.967 -8.879 1.00 0.00 N ATOM 0 H HIS A 67 110.623 6.181 -8.292 1.00 0.00 H new ATOM 0 HA HIS A 67 108.488 6.862 -8.956 1.00 0.00 H new ATOM 0 HB2 HIS A 67 108.260 6.125 -5.992 1.00 0.00 H new ATOM 0 HB3 HIS A 67 106.843 6.647 -6.881 1.00 0.00 H new ATOM 0 HD2 HIS A 67 107.833 4.966 -9.740 1.00 0.00 H new ATOM 0 HE1 HIS A 67 107.248 1.604 -7.254 1.00 0.00 H new ATOM 0 HE2 HIS A 67 107.493 2.354 -9.694 1.00 0.00 H new ATOM 1118 N GLY A 68 107.426 9.070 -8.167 1.00 0.00 N ATOM 1119 CA GLY A 68 107.149 10.517 -7.945 1.00 0.00 C ATOM 1120 C GLY A 68 107.033 10.786 -6.448 1.00 0.00 C ATOM 1121 O GLY A 68 108.014 10.986 -5.762 1.00 0.00 O ATOM 0 H GLY A 68 106.741 8.580 -8.743 1.00 0.00 H new ATOM 0 HA2 GLY A 68 107.948 11.122 -8.374 1.00 0.00 H new ATOM 0 HA3 GLY A 68 106.227 10.804 -8.450 1.00 0.00 H new ATOM 1125 N LYS A 69 105.832 10.794 -5.944 1.00 0.00 N ATOM 1126 CA LYS A 69 105.624 11.050 -4.491 1.00 0.00 C ATOM 1127 C LYS A 69 105.285 9.740 -3.757 1.00 0.00 C ATOM 1128 O LYS A 69 104.726 9.743 -2.678 1.00 0.00 O ATOM 1129 CB LYS A 69 104.446 12.017 -4.438 1.00 0.00 C ATOM 1130 CG LYS A 69 104.015 12.191 -2.988 1.00 0.00 C ATOM 1131 CD LYS A 69 103.221 13.489 -2.839 1.00 0.00 C ATOM 1132 CE LYS A 69 104.159 14.686 -3.011 1.00 0.00 C ATOM 1133 NZ LYS A 69 103.323 15.878 -2.693 1.00 0.00 N ATOM 0 H LYS A 69 104.979 10.633 -6.479 1.00 0.00 H new ATOM 0 HA LYS A 69 106.513 11.455 -4.008 1.00 0.00 H new ATOM 0 HB2 LYS A 69 104.729 12.979 -4.865 1.00 0.00 H new ATOM 0 HB3 LYS A 69 103.617 11.635 -5.034 1.00 0.00 H new ATOM 0 HG2 LYS A 69 103.406 11.343 -2.675 1.00 0.00 H new ATOM 0 HG3 LYS A 69 104.890 12.212 -2.338 1.00 0.00 H new ATOM 0 HD2 LYS A 69 102.425 13.528 -3.583 1.00 0.00 H new ATOM 0 HD3 LYS A 69 102.744 13.525 -1.859 1.00 0.00 H new ATOM 0 HE2 LYS A 69 105.017 14.615 -2.342 1.00 0.00 H new ATOM 0 HE3 LYS A 69 104.551 14.738 -4.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 103.897 16.740 -2.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 102.518 15.923 -3.350 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 102.970 15.804 -1.718 1.00 0.00 H new ATOM 1147 N ASN A 70 105.630 8.626 -4.343 1.00 0.00 N ATOM 1148 CA ASN A 70 105.344 7.305 -3.707 1.00 0.00 C ATOM 1149 C ASN A 70 106.337 7.021 -2.577 1.00 0.00 C ATOM 1150 O ASN A 70 107.486 7.413 -2.628 1.00 0.00 O ATOM 1151 CB ASN A 70 105.513 6.285 -4.832 1.00 0.00 C ATOM 1152 CG ASN A 70 104.533 5.129 -4.625 1.00 0.00 C ATOM 1153 OD1 ASN A 70 104.921 4.057 -4.203 1.00 0.00 O ATOM 1154 ND2 ASN A 70 103.271 5.301 -4.906 1.00 0.00 N ATOM 0 H ASN A 70 106.103 8.573 -5.245 1.00 0.00 H new ATOM 0 HA ASN A 70 104.349 7.272 -3.263 1.00 0.00 H new ATOM 0 HB2 ASN A 70 105.334 6.759 -5.797 1.00 0.00 H new ATOM 0 HB3 ASN A 70 106.536 5.910 -4.846 1.00 0.00 H new ATOM 0 HD21 ASN A 70 102.610 4.536 -4.772 1.00 0.00 H new ATOM 0 HD22 ASN A 70 102.945 6.200 -5.260 1.00 0.00 H new ATOM 1161 N TRP A 71 105.895 6.341 -1.555 1.00 0.00 N ATOM 1162 CA TRP A 71 106.793 6.025 -0.413 1.00 0.00 C ATOM 1163 C TRP A 71 107.104 4.525 -0.375 1.00 0.00 C ATOM 1164 O TRP A 71 107.529 3.997 0.633 1.00 0.00 O ATOM 1165 CB TRP A 71 105.990 6.432 0.818 1.00 0.00 C ATOM 1166 CG TRP A 71 104.823 5.510 0.977 1.00 0.00 C ATOM 1167 CD1 TRP A 71 103.598 5.711 0.439 1.00 0.00 C ATOM 1168 CD2 TRP A 71 104.747 4.249 1.705 1.00 0.00 C ATOM 1169 NE1 TRP A 71 102.775 4.657 0.792 1.00 0.00 N ATOM 1170 CE2 TRP A 71 103.438 3.730 1.573 1.00 0.00 C ATOM 1171 CE3 TRP A 71 105.678 3.512 2.461 1.00 0.00 C ATOM 1172 CZ2 TRP A 71 103.064 2.525 2.167 1.00 0.00 C ATOM 1173 CZ3 TRP A 71 105.305 2.298 3.062 1.00 0.00 C ATOM 1174 CH2 TRP A 71 104.000 1.806 2.914 1.00 0.00 C ATOM 0 H TRP A 71 104.942 5.989 -1.463 1.00 0.00 H new ATOM 0 HA TRP A 71 107.751 6.541 -0.479 1.00 0.00 H new ATOM 0 HB2 TRP A 71 106.621 6.394 1.706 1.00 0.00 H new ATOM 0 HB3 TRP A 71 105.644 7.461 0.716 1.00 0.00 H new ATOM 0 HD1 TRP A 71 103.310 6.557 -0.167 1.00 0.00 H new ATOM 0 HE1 TRP A 71 101.798 4.574 0.510 1.00 0.00 H new ATOM 0 HE3 TRP A 71 106.686 3.882 2.580 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 102.058 2.150 2.050 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 106.027 1.741 3.641 1.00 0.00 H new ATOM 0 HH2 TRP A 71 103.719 0.872 3.377 1.00 0.00 H new ATOM 1185 N ARG A 72 106.890 3.834 -1.461 1.00 0.00 N ATOM 1186 CA ARG A 72 107.167 2.367 -1.477 1.00 0.00 C ATOM 1187 C ARG A 72 108.676 2.106 -1.454 1.00 0.00 C ATOM 1188 O ARG A 72 109.221 1.639 -0.472 1.00 0.00 O ATOM 1189 CB ARG A 72 106.559 1.866 -2.787 1.00 0.00 C ATOM 1190 CG ARG A 72 105.085 1.524 -2.567 1.00 0.00 C ATOM 1191 CD ARG A 72 104.975 0.305 -1.649 1.00 0.00 C ATOM 1192 NE ARG A 72 103.993 -0.591 -2.319 1.00 0.00 N ATOM 1193 CZ ARG A 72 103.876 -1.834 -1.938 1.00 0.00 C ATOM 1194 NH1 ARG A 72 104.095 -2.158 -0.693 1.00 0.00 N ATOM 1195 NH2 ARG A 72 103.540 -2.751 -2.802 1.00 0.00 N ATOM 0 H ARG A 72 106.536 4.219 -2.337 1.00 0.00 H new ATOM 0 HA ARG A 72 106.747 1.861 -0.608 1.00 0.00 H new ATOM 0 HB2 ARG A 72 106.655 2.629 -3.560 1.00 0.00 H new ATOM 0 HB3 ARG A 72 107.099 0.987 -3.138 1.00 0.00 H new ATOM 0 HG2 ARG A 72 104.566 2.374 -2.124 1.00 0.00 H new ATOM 0 HG3 ARG A 72 104.602 1.318 -3.522 1.00 0.00 H new ATOM 0 HD2 ARG A 72 105.940 -0.187 -1.528 1.00 0.00 H new ATOM 0 HD3 ARG A 72 104.635 0.590 -0.653 1.00 0.00 H new ATOM 0 HE ARG A 72 103.411 -0.233 -3.076 1.00 0.00 H new ATOM 0 HH11 ARG A 72 104.358 -1.440 -0.018 1.00 0.00 H new ATOM 0 HH12 ARG A 72 104.004 -3.129 -0.395 1.00 0.00 H new ATOM 0 HH21 ARG A 72 103.369 -2.497 -3.775 1.00 0.00 H new ATOM 0 HH22 ARG A 72 103.448 -3.722 -2.505 1.00 0.00 H new ATOM 1209 N HIS A 73 109.355 2.402 -2.527 1.00 0.00 N ATOM 1210 CA HIS A 73 110.826 2.167 -2.565 1.00 0.00 C ATOM 1211 C HIS A 73 111.507 2.899 -1.405 1.00 0.00 C ATOM 1212 O HIS A 73 112.293 2.329 -0.678 1.00 0.00 O ATOM 1213 CB HIS A 73 111.284 2.739 -3.906 1.00 0.00 C ATOM 1214 CG HIS A 73 111.786 1.624 -4.782 1.00 0.00 C ATOM 1215 ND1 HIS A 73 110.975 0.991 -5.710 1.00 0.00 N ATOM 1216 CD2 HIS A 73 113.014 1.019 -4.882 1.00 0.00 C ATOM 1217 CE1 HIS A 73 111.717 0.051 -6.322 1.00 0.00 C ATOM 1218 NE2 HIS A 73 112.969 0.025 -5.855 1.00 0.00 N ATOM 0 H HIS A 73 108.956 2.796 -3.379 1.00 0.00 H new ATOM 0 HA HIS A 73 111.080 1.112 -2.466 1.00 0.00 H new ATOM 0 HB2 HIS A 73 110.458 3.255 -4.394 1.00 0.00 H new ATOM 0 HB3 HIS A 73 112.072 3.475 -3.749 1.00 0.00 H new ATOM 0 HD2 HIS A 73 113.883 1.275 -4.295 1.00 0.00 H new ATOM 0 HE1 HIS A 73 111.346 -0.604 -7.097 1.00 0.00 H new ATOM 0 HE2 HIS A 73 113.728 -0.590 -6.148 1.00 0.00 H new ATOM 1226 N VAL A 74 111.206 4.155 -1.229 1.00 0.00 N ATOM 1227 CA VAL A 74 111.830 4.927 -0.115 1.00 0.00 C ATOM 1228 C VAL A 74 111.832 4.101 1.174 1.00 0.00 C ATOM 1229 O VAL A 74 112.853 3.926 1.808 1.00 0.00 O ATOM 1230 CB VAL A 74 110.940 6.156 0.049 1.00 0.00 C ATOM 1231 CG1 VAL A 74 111.483 7.024 1.186 1.00 0.00 C ATOM 1232 CG2 VAL A 74 110.926 6.958 -1.257 1.00 0.00 C ATOM 0 H VAL A 74 110.554 4.683 -1.809 1.00 0.00 H new ATOM 0 HA VAL A 74 112.867 5.188 -0.325 1.00 0.00 H new ATOM 0 HB VAL A 74 109.923 5.844 0.286 1.00 0.00 H new ATOM 0 HG11 VAL A 74 110.850 7.903 1.307 1.00 0.00 H new ATOM 0 HG12 VAL A 74 111.487 6.450 2.112 1.00 0.00 H new ATOM 0 HG13 VAL A 74 112.500 7.338 0.950 1.00 0.00 H new ATOM 0 HG21 VAL A 74 110.290 7.835 -1.138 1.00 0.00 H new ATOM 0 HG22 VAL A 74 111.940 7.275 -1.500 1.00 0.00 H new ATOM 0 HG23 VAL A 74 110.538 6.335 -2.063 1.00 0.00 H new ATOM 1242 N TYR A 75 110.694 3.597 1.569 1.00 0.00 N ATOM 1243 CA TYR A 75 110.633 2.789 2.820 1.00 0.00 C ATOM 1244 C TYR A 75 111.726 1.718 2.811 1.00 0.00 C ATOM 1245 O TYR A 75 112.542 1.643 3.709 1.00 0.00 O ATOM 1246 CB TYR A 75 109.247 2.144 2.810 1.00 0.00 C ATOM 1247 CG TYR A 75 108.906 1.660 4.200 1.00 0.00 C ATOM 1248 CD1 TYR A 75 109.164 2.476 5.308 1.00 0.00 C ATOM 1249 CD2 TYR A 75 108.332 0.395 4.380 1.00 0.00 C ATOM 1250 CE1 TYR A 75 108.847 2.027 6.596 1.00 0.00 C ATOM 1251 CE2 TYR A 75 108.016 -0.053 5.668 1.00 0.00 C ATOM 1252 CZ TYR A 75 108.273 0.763 6.776 1.00 0.00 C ATOM 1253 OH TYR A 75 107.961 0.322 8.046 1.00 0.00 O ATOM 0 H TYR A 75 109.806 3.710 1.080 1.00 0.00 H new ATOM 0 HA TYR A 75 110.792 3.396 3.712 1.00 0.00 H new ATOM 0 HB2 TYR A 75 108.502 2.864 2.471 1.00 0.00 H new ATOM 0 HB3 TYR A 75 109.227 1.310 2.108 1.00 0.00 H new ATOM 0 HD1 TYR A 75 109.607 3.451 5.169 1.00 0.00 H new ATOM 0 HD2 TYR A 75 108.133 -0.235 3.525 1.00 0.00 H new ATOM 0 HE1 TYR A 75 109.045 2.656 7.451 1.00 0.00 H new ATOM 0 HE2 TYR A 75 107.574 -1.028 5.807 1.00 0.00 H new ATOM 0 HH TYR A 75 107.569 -0.575 7.994 1.00 0.00 H new ATOM 1263 N LYS A 76 111.749 0.887 1.806 1.00 0.00 N ATOM 1264 CA LYS A 76 112.792 -0.176 1.744 1.00 0.00 C ATOM 1265 C LYS A 76 114.189 0.451 1.807 1.00 0.00 C ATOM 1266 O LYS A 76 115.134 -0.153 2.278 1.00 0.00 O ATOM 1267 CB LYS A 76 112.574 -0.868 0.398 1.00 0.00 C ATOM 1268 CG LYS A 76 112.159 -2.323 0.630 1.00 0.00 C ATOM 1269 CD LYS A 76 110.710 -2.519 0.181 1.00 0.00 C ATOM 1270 CE LYS A 76 109.818 -2.727 1.407 1.00 0.00 C ATOM 1271 NZ LYS A 76 109.629 -4.201 1.499 1.00 0.00 N ATOM 0 H LYS A 76 111.092 0.898 1.026 1.00 0.00 H new ATOM 0 HA LYS A 76 112.720 -0.875 2.577 1.00 0.00 H new ATOM 0 HB2 LYS A 76 111.804 -0.346 -0.170 1.00 0.00 H new ATOM 0 HB3 LYS A 76 113.488 -0.830 -0.194 1.00 0.00 H new ATOM 0 HG2 LYS A 76 112.816 -2.992 0.075 1.00 0.00 H new ATOM 0 HG3 LYS A 76 112.261 -2.578 1.685 1.00 0.00 H new ATOM 0 HD2 LYS A 76 110.373 -1.650 -0.384 1.00 0.00 H new ATOM 0 HD3 LYS A 76 110.638 -3.379 -0.484 1.00 0.00 H new ATOM 0 HE2 LYS A 76 110.287 -2.332 2.308 1.00 0.00 H new ATOM 0 HE3 LYS A 76 108.864 -2.213 1.293 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 109.027 -4.423 2.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 109.175 -4.548 0.630 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 110.554 -4.663 1.614 1.00 0.00 H new ATOM 1285 N ALA A 77 114.322 1.663 1.339 1.00 0.00 N ATOM 1286 CA ALA A 77 115.652 2.333 1.374 1.00 0.00 C ATOM 1287 C ALA A 77 116.012 2.695 2.815 1.00 0.00 C ATOM 1288 O ALA A 77 117.158 2.643 3.212 1.00 0.00 O ATOM 1289 CB ALA A 77 115.480 3.592 0.525 1.00 0.00 C ATOM 0 H ALA A 77 113.567 2.217 0.934 1.00 0.00 H new ATOM 0 HA ALA A 77 116.453 1.698 0.996 1.00 0.00 H new ATOM 0 HB1 ALA A 77 116.419 4.145 0.500 1.00 0.00 H new ATOM 0 HB2 ALA A 77 115.197 3.311 -0.489 1.00 0.00 H new ATOM 0 HB3 ALA A 77 114.701 4.219 0.958 1.00 0.00 H new ATOM 1295 N MET A 78 115.036 3.052 3.600 1.00 0.00 N ATOM 1296 CA MET A 78 115.313 3.408 5.020 1.00 0.00 C ATOM 1297 C MET A 78 115.899 2.199 5.750 1.00 0.00 C ATOM 1298 O MET A 78 116.792 2.322 6.563 1.00 0.00 O ATOM 1299 CB MET A 78 113.952 3.782 5.609 1.00 0.00 C ATOM 1300 CG MET A 78 113.859 5.301 5.762 1.00 0.00 C ATOM 1301 SD MET A 78 113.501 6.046 4.153 1.00 0.00 S ATOM 1302 CE MET A 78 111.706 6.159 4.349 1.00 0.00 C ATOM 0 H MET A 78 114.057 3.113 3.320 1.00 0.00 H new ATOM 0 HA MET A 78 116.031 4.222 5.114 1.00 0.00 H new ATOM 0 HB2 MET A 78 113.153 3.422 4.961 1.00 0.00 H new ATOM 0 HB3 MET A 78 113.819 3.300 6.578 1.00 0.00 H new ATOM 0 HG2 MET A 78 113.077 5.558 6.476 1.00 0.00 H new ATOM 0 HG3 MET A 78 114.795 5.696 6.158 1.00 0.00 H new ATOM 0 HE1 MET A 78 111.219 5.524 3.610 1.00 0.00 H new ATOM 0 HE2 MET A 78 111.428 5.830 5.350 1.00 0.00 H new ATOM 0 HE3 MET A 78 111.389 7.192 4.205 1.00 0.00 H new ATOM 1312 N THR A 79 115.403 1.028 5.461 1.00 0.00 N ATOM 1313 CA THR A 79 115.932 -0.189 6.135 1.00 0.00 C ATOM 1314 C THR A 79 117.417 -0.360 5.818 1.00 0.00 C ATOM 1315 O THR A 79 118.257 -0.297 6.690 1.00 0.00 O ATOM 1316 CB THR A 79 115.118 -1.348 5.560 1.00 0.00 C ATOM 1317 OG1 THR A 79 113.733 -1.081 5.733 1.00 0.00 O ATOM 1318 CG2 THR A 79 115.483 -2.643 6.286 1.00 0.00 C ATOM 0 H THR A 79 114.655 0.862 4.788 1.00 0.00 H new ATOM 0 HA THR A 79 115.844 -0.134 7.220 1.00 0.00 H new ATOM 0 HB THR A 79 115.340 -1.456 4.498 1.00 0.00 H new ATOM 0 HG1 THR A 79 113.208 -1.822 5.364 1.00 0.00 H new ATOM 0 HG21 THR A 79 114.901 -3.468 5.874 1.00 0.00 H new ATOM 0 HG22 THR A 79 116.546 -2.847 6.154 1.00 0.00 H new ATOM 0 HG23 THR A 79 115.263 -2.539 7.348 1.00 0.00 H new ATOM 1326 N LEU A 80 117.747 -0.573 4.579 1.00 0.00 N ATOM 1327 CA LEU A 80 119.184 -0.743 4.220 1.00 0.00 C ATOM 1328 C LEU A 80 120.022 0.360 4.871 1.00 0.00 C ATOM 1329 O LEU A 80 120.980 0.094 5.564 1.00 0.00 O ATOM 1330 CB LEU A 80 119.240 -0.627 2.697 1.00 0.00 C ATOM 1331 CG LEU A 80 120.649 -0.976 2.222 1.00 0.00 C ATOM 1332 CD1 LEU A 80 121.078 -2.311 2.835 1.00 0.00 C ATOM 1333 CD2 LEU A 80 120.662 -1.087 0.696 1.00 0.00 C ATOM 0 H LEU A 80 117.091 -0.637 3.801 1.00 0.00 H new ATOM 0 HA LEU A 80 119.582 -1.697 4.566 1.00 0.00 H new ATOM 0 HB2 LEU A 80 118.512 -1.299 2.241 1.00 0.00 H new ATOM 0 HB3 LEU A 80 118.978 0.385 2.387 1.00 0.00 H new ATOM 0 HG LEU A 80 121.341 -0.194 2.534 1.00 0.00 H new ATOM 0 HD11 LEU A 80 122.084 -2.561 2.496 1.00 0.00 H new ATOM 0 HD12 LEU A 80 121.071 -2.231 3.922 1.00 0.00 H new ATOM 0 HD13 LEU A 80 120.386 -3.093 2.524 1.00 0.00 H new ATOM 0 HD21 LEU A 80 121.668 -1.336 0.358 1.00 0.00 H new ATOM 0 HD22 LEU A 80 119.970 -1.868 0.382 1.00 0.00 H new ATOM 0 HD23 LEU A 80 120.358 -0.136 0.259 1.00 0.00 H new ATOM 1345 N MET A 81 119.669 1.595 4.653 1.00 0.00 N ATOM 1346 CA MET A 81 120.453 2.709 5.260 1.00 0.00 C ATOM 1347 C MET A 81 120.636 2.475 6.763 1.00 0.00 C ATOM 1348 O MET A 81 121.673 2.771 7.324 1.00 0.00 O ATOM 1349 CB MET A 81 119.623 3.967 5.000 1.00 0.00 C ATOM 1350 CG MET A 81 120.175 5.124 5.836 1.00 0.00 C ATOM 1351 SD MET A 81 120.136 6.647 4.858 1.00 0.00 S ATOM 1352 CE MET A 81 118.393 7.050 5.136 1.00 0.00 C ATOM 0 H MET A 81 118.874 1.882 4.082 1.00 0.00 H new ATOM 0 HA MET A 81 121.453 2.790 4.834 1.00 0.00 H new ATOM 0 HB2 MET A 81 119.653 4.223 3.941 1.00 0.00 H new ATOM 0 HB3 MET A 81 118.579 3.786 5.255 1.00 0.00 H new ATOM 0 HG2 MET A 81 119.583 5.246 6.743 1.00 0.00 H new ATOM 0 HG3 MET A 81 121.196 4.906 6.149 1.00 0.00 H new ATOM 0 HE1 MET A 81 118.060 7.765 4.383 1.00 0.00 H new ATOM 0 HE2 MET A 81 117.794 6.142 5.065 1.00 0.00 H new ATOM 0 HE3 MET A 81 118.274 7.486 6.128 1.00 0.00 H new ATOM 1362 N GLU A 82 119.641 1.946 7.421 1.00 0.00 N ATOM 1363 CA GLU A 82 119.764 1.696 8.887 1.00 0.00 C ATOM 1364 C GLU A 82 120.674 0.488 9.154 1.00 0.00 C ATOM 1365 O GLU A 82 121.762 0.622 9.679 1.00 0.00 O ATOM 1366 CB GLU A 82 118.339 1.408 9.361 1.00 0.00 C ATOM 1367 CG GLU A 82 118.218 1.737 10.849 1.00 0.00 C ATOM 1368 CD GLU A 82 116.741 1.863 11.227 1.00 0.00 C ATOM 1369 OE1 GLU A 82 115.912 1.778 10.335 1.00 0.00 O ATOM 1370 OE2 GLU A 82 116.463 2.042 12.401 1.00 0.00 O ATOM 0 H GLU A 82 118.748 1.676 7.008 1.00 0.00 H new ATOM 0 HA GLU A 82 120.207 2.543 9.410 1.00 0.00 H new ATOM 0 HB2 GLU A 82 117.627 2.002 8.788 1.00 0.00 H new ATOM 0 HB3 GLU A 82 118.092 0.360 9.188 1.00 0.00 H new ATOM 0 HG2 GLU A 82 118.691 0.956 11.444 1.00 0.00 H new ATOM 0 HG3 GLU A 82 118.741 2.667 11.070 1.00 0.00 H new ATOM 1377 N TYR A 83 120.227 -0.687 8.801 1.00 0.00 N ATOM 1378 CA TYR A 83 121.043 -1.917 9.031 1.00 0.00 C ATOM 1379 C TYR A 83 122.533 -1.651 8.793 1.00 0.00 C ATOM 1380 O TYR A 83 123.376 -2.055 9.569 1.00 0.00 O ATOM 1381 CB TYR A 83 120.517 -2.922 8.006 1.00 0.00 C ATOM 1382 CG TYR A 83 121.121 -4.276 8.277 1.00 0.00 C ATOM 1383 CD1 TYR A 83 120.503 -5.148 9.179 1.00 0.00 C ATOM 1384 CD2 TYR A 83 122.299 -4.661 7.626 1.00 0.00 C ATOM 1385 CE1 TYR A 83 121.062 -6.407 9.432 1.00 0.00 C ATOM 1386 CE2 TYR A 83 122.859 -5.919 7.878 1.00 0.00 C ATOM 1387 CZ TYR A 83 122.239 -6.792 8.780 1.00 0.00 C ATOM 1388 OH TYR A 83 122.791 -8.034 9.029 1.00 0.00 O ATOM 0 H TYR A 83 119.322 -0.850 8.359 1.00 0.00 H new ATOM 0 HA TYR A 83 120.957 -2.273 10.058 1.00 0.00 H new ATOM 0 HB2 TYR A 83 119.430 -2.979 8.061 1.00 0.00 H new ATOM 0 HB3 TYR A 83 120.768 -2.595 6.997 1.00 0.00 H new ATOM 0 HD1 TYR A 83 119.594 -4.850 9.681 1.00 0.00 H new ATOM 0 HD2 TYR A 83 122.776 -3.987 6.929 1.00 0.00 H new ATOM 0 HE1 TYR A 83 120.585 -7.080 10.129 1.00 0.00 H new ATOM 0 HE2 TYR A 83 123.769 -6.216 7.377 1.00 0.00 H new ATOM 0 HH TYR A 83 122.080 -8.668 9.258 1.00 0.00 H new ATOM 1398 N LEU A 84 122.866 -0.990 7.720 1.00 0.00 N ATOM 1399 CA LEU A 84 124.304 -0.717 7.429 1.00 0.00 C ATOM 1400 C LEU A 84 124.895 0.239 8.470 1.00 0.00 C ATOM 1401 O LEU A 84 126.000 0.053 8.939 1.00 0.00 O ATOM 1402 CB LEU A 84 124.309 -0.080 6.038 1.00 0.00 C ATOM 1403 CG LEU A 84 123.611 -1.015 5.047 1.00 0.00 C ATOM 1404 CD1 LEU A 84 123.584 -0.369 3.660 1.00 0.00 C ATOM 1405 CD2 LEU A 84 124.370 -2.342 4.977 1.00 0.00 C ATOM 0 H LEU A 84 122.207 -0.627 7.032 1.00 0.00 H new ATOM 0 HA LEU A 84 124.910 -1.622 7.466 1.00 0.00 H new ATOM 0 HB2 LEU A 84 123.800 0.884 6.066 1.00 0.00 H new ATOM 0 HB3 LEU A 84 125.333 0.109 5.717 1.00 0.00 H new ATOM 0 HG LEU A 84 122.589 -1.196 5.380 1.00 0.00 H new ATOM 0 HD11 LEU A 84 123.087 -1.037 2.957 1.00 0.00 H new ATOM 0 HD12 LEU A 84 123.042 0.575 3.709 1.00 0.00 H new ATOM 0 HD13 LEU A 84 124.605 -0.184 3.325 1.00 0.00 H new ATOM 0 HD21 LEU A 84 123.874 -3.008 4.272 1.00 0.00 H new ATOM 0 HD22 LEU A 84 125.392 -2.159 4.646 1.00 0.00 H new ATOM 0 HD23 LEU A 84 124.386 -2.805 5.964 1.00 0.00 H new ATOM 1417 N ILE A 85 124.172 1.260 8.841 1.00 0.00 N ATOM 1418 CA ILE A 85 124.705 2.218 9.853 1.00 0.00 C ATOM 1419 C ILE A 85 125.169 1.462 11.103 1.00 0.00 C ATOM 1420 O ILE A 85 125.945 1.965 11.890 1.00 0.00 O ATOM 1421 CB ILE A 85 123.529 3.139 10.183 1.00 0.00 C ATOM 1422 CG1 ILE A 85 123.353 4.162 9.059 1.00 0.00 C ATOM 1423 CG2 ILE A 85 123.801 3.874 11.497 1.00 0.00 C ATOM 1424 CD1 ILE A 85 121.962 4.790 9.158 1.00 0.00 C ATOM 0 H ILE A 85 123.239 1.473 8.489 1.00 0.00 H new ATOM 0 HA ILE A 85 125.566 2.776 9.484 1.00 0.00 H new ATOM 0 HB ILE A 85 122.622 2.542 10.283 1.00 0.00 H new ATOM 0 HG12 ILE A 85 124.119 4.934 9.132 1.00 0.00 H new ATOM 0 HG13 ILE A 85 123.478 3.679 8.090 1.00 0.00 H new ATOM 0 HG21 ILE A 85 122.961 4.529 11.728 1.00 0.00 H new ATOM 0 HG22 ILE A 85 123.927 3.148 12.300 1.00 0.00 H new ATOM 0 HG23 ILE A 85 124.709 4.469 11.400 1.00 0.00 H new ATOM 0 HD11 ILE A 85 121.834 5.519 8.358 1.00 0.00 H new ATOM 0 HD12 ILE A 85 121.204 4.012 9.064 1.00 0.00 H new ATOM 0 HD13 ILE A 85 121.855 5.287 10.122 1.00 0.00 H new ATOM 1436 N LYS A 86 124.698 0.259 11.290 1.00 0.00 N ATOM 1437 CA LYS A 86 125.113 -0.524 12.490 1.00 0.00 C ATOM 1438 C LYS A 86 126.116 -1.611 12.094 1.00 0.00 C ATOM 1439 O LYS A 86 127.313 -1.406 12.129 1.00 0.00 O ATOM 1440 CB LYS A 86 123.822 -1.151 13.021 1.00 0.00 C ATOM 1441 CG LYS A 86 123.352 -0.382 14.258 1.00 0.00 C ATOM 1442 CD LYS A 86 122.893 -1.370 15.333 1.00 0.00 C ATOM 1443 CE LYS A 86 121.721 -2.197 14.800 1.00 0.00 C ATOM 1444 NZ LYS A 86 120.642 -2.032 15.813 1.00 0.00 N ATOM 0 H LYS A 86 124.045 -0.215 10.666 1.00 0.00 H new ATOM 0 HA LYS A 86 125.602 0.099 13.240 1.00 0.00 H new ATOM 0 HB2 LYS A 86 123.051 -1.129 12.251 1.00 0.00 H new ATOM 0 HB3 LYS A 86 123.991 -2.198 13.273 1.00 0.00 H new ATOM 0 HG2 LYS A 86 124.162 0.239 14.642 1.00 0.00 H new ATOM 0 HG3 LYS A 86 122.534 0.288 13.993 1.00 0.00 H new ATOM 0 HD2 LYS A 86 123.717 -2.026 15.614 1.00 0.00 H new ATOM 0 HD3 LYS A 86 122.593 -0.832 16.232 1.00 0.00 H new ATOM 0 HE2 LYS A 86 121.401 -1.842 13.820 1.00 0.00 H new ATOM 0 HE3 LYS A 86 121.997 -3.245 14.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 119.803 -2.571 15.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 120.973 -2.384 16.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 120.395 -1.025 15.896 1.00 0.00 H new ATOM 1458 N THR A 87 125.638 -2.766 11.718 1.00 0.00 N ATOM 1459 CA THR A 87 126.567 -3.863 11.322 1.00 0.00 C ATOM 1460 C THR A 87 127.256 -3.521 9.998 1.00 0.00 C ATOM 1461 O THR A 87 128.138 -4.224 9.547 1.00 0.00 O ATOM 1462 CB THR A 87 125.680 -5.098 11.164 1.00 0.00 C ATOM 1463 OG1 THR A 87 126.498 -6.244 10.979 1.00 0.00 O ATOM 1464 CG2 THR A 87 124.766 -4.920 9.950 1.00 0.00 C ATOM 0 H THR A 87 124.646 -2.997 11.668 1.00 0.00 H new ATOM 0 HA THR A 87 127.356 -4.021 12.057 1.00 0.00 H new ATOM 0 HB THR A 87 125.071 -5.226 12.059 1.00 0.00 H new ATOM 0 HG1 THR A 87 127.337 -5.981 10.547 1.00 0.00 H new ATOM 0 HG21 THR A 87 124.134 -5.801 9.838 1.00 0.00 H new ATOM 0 HG22 THR A 87 124.139 -4.040 10.092 1.00 0.00 H new ATOM 0 HG23 THR A 87 125.373 -4.792 9.053 1.00 0.00 H new ATOM 1472 N GLY A 88 126.861 -2.445 9.373 1.00 0.00 N ATOM 1473 CA GLY A 88 127.496 -2.061 8.080 1.00 0.00 C ATOM 1474 C GLY A 88 128.912 -1.545 8.340 1.00 0.00 C ATOM 1475 O GLY A 88 129.884 -2.246 8.146 1.00 0.00 O ATOM 0 H GLY A 88 126.128 -1.817 9.701 1.00 0.00 H new ATOM 0 HA2 GLY A 88 127.528 -2.920 7.409 1.00 0.00 H new ATOM 0 HA3 GLY A 88 126.902 -1.292 7.585 1.00 0.00 H new ATOM 1479 N SER A 89 129.039 -0.323 8.778 1.00 0.00 N ATOM 1480 CA SER A 89 130.395 0.233 9.049 1.00 0.00 C ATOM 1481 C SER A 89 130.281 1.626 9.672 1.00 0.00 C ATOM 1482 O SER A 89 129.286 2.305 9.518 1.00 0.00 O ATOM 1483 CB SER A 89 131.071 0.311 7.681 1.00 0.00 C ATOM 1484 OG SER A 89 132.150 1.235 7.742 1.00 0.00 O ATOM 0 H SER A 89 128.264 0.314 8.960 1.00 0.00 H new ATOM 0 HA SER A 89 130.961 -0.382 9.749 1.00 0.00 H new ATOM 0 HB2 SER A 89 131.436 -0.673 7.386 1.00 0.00 H new ATOM 0 HB3 SER A 89 130.352 0.624 6.924 1.00 0.00 H new ATOM 0 HG SER A 89 132.587 1.286 6.866 1.00 0.00 H new ATOM 1490 N GLU A 90 131.292 2.055 10.376 1.00 0.00 N ATOM 1491 CA GLU A 90 131.240 3.405 11.008 1.00 0.00 C ATOM 1492 C GLU A 90 131.114 4.486 9.934 1.00 0.00 C ATOM 1493 O GLU A 90 130.670 5.586 10.195 1.00 0.00 O ATOM 1494 CB GLU A 90 132.564 3.544 11.757 1.00 0.00 C ATOM 1495 CG GLU A 90 132.488 2.776 13.077 1.00 0.00 C ATOM 1496 CD GLU A 90 133.458 1.594 13.036 1.00 0.00 C ATOM 1497 OE1 GLU A 90 134.650 1.835 12.940 1.00 0.00 O ATOM 1498 OE2 GLU A 90 132.994 0.468 13.101 1.00 0.00 O ATOM 0 H GLU A 90 132.151 1.531 10.541 1.00 0.00 H new ATOM 0 HA GLU A 90 130.383 3.517 11.673 1.00 0.00 H new ATOM 0 HB2 GLU A 90 133.381 3.159 11.147 1.00 0.00 H new ATOM 0 HB3 GLU A 90 132.777 4.596 11.948 1.00 0.00 H new ATOM 0 HG2 GLU A 90 132.737 3.435 13.909 1.00 0.00 H new ATOM 0 HG3 GLU A 90 131.471 2.420 13.245 1.00 0.00 H new ATOM 1505 N ARG A 91 131.501 4.182 8.725 1.00 0.00 N ATOM 1506 CA ARG A 91 131.401 5.193 7.636 1.00 0.00 C ATOM 1507 C ARG A 91 129.946 5.343 7.191 1.00 0.00 C ATOM 1508 O ARG A 91 129.479 6.431 6.920 1.00 0.00 O ATOM 1509 CB ARG A 91 132.256 4.638 6.496 1.00 0.00 C ATOM 1510 CG ARG A 91 133.708 4.511 6.961 1.00 0.00 C ATOM 1511 CD ARG A 91 134.579 5.513 6.199 1.00 0.00 C ATOM 1512 NE ARG A 91 135.358 6.221 7.252 1.00 0.00 N ATOM 1513 CZ ARG A 91 136.659 6.124 7.277 1.00 0.00 C ATOM 1514 NH1 ARG A 91 137.333 6.075 6.161 1.00 0.00 N ATOM 1515 NH2 ARG A 91 137.287 6.077 8.420 1.00 0.00 N ATOM 0 H ARG A 91 131.882 3.278 8.445 1.00 0.00 H new ATOM 0 HA ARG A 91 131.741 6.178 7.955 1.00 0.00 H new ATOM 0 HB2 ARG A 91 131.877 3.665 6.184 1.00 0.00 H new ATOM 0 HB3 ARG A 91 132.197 5.296 5.629 1.00 0.00 H new ATOM 0 HG2 ARG A 91 133.775 4.697 8.033 1.00 0.00 H new ATOM 0 HG3 ARG A 91 134.068 3.497 6.790 1.00 0.00 H new ATOM 0 HD2 ARG A 91 135.238 5.007 5.493 1.00 0.00 H new ATOM 0 HD3 ARG A 91 133.969 6.209 5.623 1.00 0.00 H new ATOM 0 HE ARG A 91 134.875 6.782 7.954 1.00 0.00 H new ATOM 0 HH11 ARG A 91 136.843 6.113 5.267 1.00 0.00 H new ATOM 0 HH12 ARG A 91 138.350 5.999 6.182 1.00 0.00 H new ATOM 0 HH21 ARG A 91 136.761 6.116 9.293 1.00 0.00 H new ATOM 0 HH22 ARG A 91 138.304 6.001 8.440 1.00 0.00 H new ATOM 1529 N VAL A 92 129.225 4.258 7.115 1.00 0.00 N ATOM 1530 CA VAL A 92 127.800 4.345 6.690 1.00 0.00 C ATOM 1531 C VAL A 92 127.024 5.260 7.639 1.00 0.00 C ATOM 1532 O VAL A 92 126.091 5.929 7.246 1.00 0.00 O ATOM 1533 CB VAL A 92 127.271 2.911 6.766 1.00 0.00 C ATOM 1534 CG1 VAL A 92 125.760 2.910 6.531 1.00 0.00 C ATOM 1535 CG2 VAL A 92 127.951 2.061 5.690 1.00 0.00 C ATOM 0 H VAL A 92 129.560 3.318 7.328 1.00 0.00 H new ATOM 0 HA VAL A 92 127.691 4.761 5.689 1.00 0.00 H new ATOM 0 HB VAL A 92 127.486 2.497 7.751 1.00 0.00 H new ATOM 0 HG11 VAL A 92 125.384 1.888 6.585 1.00 0.00 H new ATOM 0 HG12 VAL A 92 125.273 3.517 7.294 1.00 0.00 H new ATOM 0 HG13 VAL A 92 125.545 3.324 5.546 1.00 0.00 H new ATOM 0 HG21 VAL A 92 127.576 1.039 5.742 1.00 0.00 H new ATOM 0 HG22 VAL A 92 127.734 2.477 4.706 1.00 0.00 H new ATOM 0 HG23 VAL A 92 129.029 2.060 5.854 1.00 0.00 H new ATOM 1545 N SER A 93 127.406 5.301 8.885 1.00 0.00 N ATOM 1546 CA SER A 93 126.690 6.180 9.852 1.00 0.00 C ATOM 1547 C SER A 93 127.155 7.628 9.687 1.00 0.00 C ATOM 1548 O SER A 93 126.373 8.554 9.768 1.00 0.00 O ATOM 1549 CB SER A 93 127.073 5.647 11.232 1.00 0.00 C ATOM 1550 OG SER A 93 128.385 6.087 11.557 1.00 0.00 O ATOM 0 H SER A 93 128.181 4.765 9.275 1.00 0.00 H new ATOM 0 HA SER A 93 125.611 6.172 9.700 1.00 0.00 H new ATOM 0 HB2 SER A 93 126.363 5.999 11.980 1.00 0.00 H new ATOM 0 HB3 SER A 93 127.030 4.558 11.239 1.00 0.00 H new ATOM 0 HG SER A 93 129.020 5.740 10.895 1.00 0.00 H new ATOM 1556 N GLN A 94 128.422 7.830 9.451 1.00 0.00 N ATOM 1557 CA GLN A 94 128.932 9.218 9.275 1.00 0.00 C ATOM 1558 C GLN A 94 128.224 9.885 8.096 1.00 0.00 C ATOM 1559 O GLN A 94 127.571 10.900 8.241 1.00 0.00 O ATOM 1560 CB GLN A 94 130.425 9.060 8.986 1.00 0.00 C ATOM 1561 CG GLN A 94 131.176 8.810 10.295 1.00 0.00 C ATOM 1562 CD GLN A 94 132.555 8.224 9.987 1.00 0.00 C ATOM 1563 OE1 GLN A 94 132.774 7.040 10.150 1.00 0.00 O ATOM 1564 NE2 GLN A 94 133.499 9.007 9.544 1.00 0.00 N ATOM 0 H GLN A 94 129.125 7.095 9.373 1.00 0.00 H new ATOM 0 HA GLN A 94 128.754 9.841 10.151 1.00 0.00 H new ATOM 0 HB2 GLN A 94 130.587 8.230 8.298 1.00 0.00 H new ATOM 0 HB3 GLN A 94 130.809 9.957 8.500 1.00 0.00 H new ATOM 0 HG2 GLN A 94 131.281 9.742 10.850 1.00 0.00 H new ATOM 0 HG3 GLN A 94 130.610 8.125 10.926 1.00 0.00 H new ATOM 0 HE21 GLN A 94 133.315 10.001 9.407 1.00 0.00 H new ATOM 0 HE22 GLN A 94 134.421 8.626 9.334 1.00 0.00 H new ATOM 1573 N GLN A 95 128.343 9.314 6.933 1.00 0.00 N ATOM 1574 CA GLN A 95 127.672 9.904 5.741 1.00 0.00 C ATOM 1575 C GLN A 95 126.179 10.082 6.022 1.00 0.00 C ATOM 1576 O GLN A 95 125.565 11.035 5.587 1.00 0.00 O ATOM 1577 CB GLN A 95 127.890 8.889 4.618 1.00 0.00 C ATOM 1578 CG GLN A 95 127.218 9.391 3.339 1.00 0.00 C ATOM 1579 CD GLN A 95 128.239 9.424 2.201 1.00 0.00 C ATOM 1580 OE1 GLN A 95 129.047 10.329 2.121 1.00 0.00 O ATOM 1581 NE2 GLN A 95 128.238 8.469 1.311 1.00 0.00 N ATOM 0 H GLN A 95 128.876 8.463 6.754 1.00 0.00 H new ATOM 0 HA GLN A 95 128.070 10.885 5.482 1.00 0.00 H new ATOM 0 HB2 GLN A 95 128.957 8.743 4.448 1.00 0.00 H new ATOM 0 HB3 GLN A 95 127.477 7.921 4.903 1.00 0.00 H new ATOM 0 HG2 GLN A 95 126.385 8.740 3.075 1.00 0.00 H new ATOM 0 HG3 GLN A 95 126.806 10.387 3.500 1.00 0.00 H new ATOM 0 HE21 GLN A 95 127.560 7.710 1.378 1.00 0.00 H new ATOM 0 HE22 GLN A 95 128.915 8.482 0.548 1.00 0.00 H new ATOM 1590 N CYS A 96 125.589 9.173 6.753 1.00 0.00 N ATOM 1591 CA CYS A 96 124.138 9.301 7.065 1.00 0.00 C ATOM 1592 C CYS A 96 123.890 10.593 7.844 1.00 0.00 C ATOM 1593 O CYS A 96 122.889 11.259 7.664 1.00 0.00 O ATOM 1594 CB CYS A 96 123.801 8.082 7.924 1.00 0.00 C ATOM 1595 SG CYS A 96 123.485 6.659 6.851 1.00 0.00 S ATOM 0 H CYS A 96 126.048 8.351 7.145 1.00 0.00 H new ATOM 0 HA CYS A 96 123.522 9.341 6.167 1.00 0.00 H new ATOM 0 HB2 CYS A 96 124.625 7.863 8.603 1.00 0.00 H new ATOM 0 HB3 CYS A 96 122.926 8.288 8.540 1.00 0.00 H new ATOM 0 HG CYS A 96 124.580 5.974 6.704 1.00 0.00 H new ATOM 1601 N LYS A 97 124.802 10.956 8.701 1.00 0.00 N ATOM 1602 CA LYS A 97 124.631 12.209 9.487 1.00 0.00 C ATOM 1603 C LYS A 97 124.871 13.419 8.582 1.00 0.00 C ATOM 1604 O LYS A 97 124.353 14.494 8.811 1.00 0.00 O ATOM 1605 CB LYS A 97 125.693 12.137 10.584 1.00 0.00 C ATOM 1606 CG LYS A 97 125.545 13.338 11.520 1.00 0.00 C ATOM 1607 CD LYS A 97 126.780 13.442 12.417 1.00 0.00 C ATOM 1608 CE LYS A 97 127.888 14.197 11.679 1.00 0.00 C ATOM 1609 NZ LYS A 97 128.897 14.518 12.726 1.00 0.00 N ATOM 0 H LYS A 97 125.660 10.438 8.891 1.00 0.00 H new ATOM 0 HA LYS A 97 123.629 12.310 9.904 1.00 0.00 H new ATOM 0 HB2 LYS A 97 125.587 11.209 11.146 1.00 0.00 H new ATOM 0 HB3 LYS A 97 126.689 12.129 10.141 1.00 0.00 H new ATOM 0 HG2 LYS A 97 125.426 14.253 10.939 1.00 0.00 H new ATOM 0 HG3 LYS A 97 124.648 13.229 12.130 1.00 0.00 H new ATOM 0 HD2 LYS A 97 126.527 13.960 13.342 1.00 0.00 H new ATOM 0 HD3 LYS A 97 127.126 12.446 12.693 1.00 0.00 H new ATOM 0 HE2 LYS A 97 128.322 13.587 10.887 1.00 0.00 H new ATOM 0 HE3 LYS A 97 127.504 15.103 11.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 129.690 15.037 12.297 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 128.457 15.105 13.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 129.250 13.636 13.150 1.00 0.00 H new ATOM 1623 N GLU A 98 125.654 13.248 7.553 1.00 0.00 N ATOM 1624 CA GLU A 98 125.933 14.378 6.624 1.00 0.00 C ATOM 1625 C GLU A 98 124.790 14.524 5.617 1.00 0.00 C ATOM 1626 O GLU A 98 124.581 15.576 5.046 1.00 0.00 O ATOM 1627 CB GLU A 98 127.229 13.992 5.914 1.00 0.00 C ATOM 1628 CG GLU A 98 128.344 13.826 6.947 1.00 0.00 C ATOM 1629 CD GLU A 98 128.961 15.192 7.256 1.00 0.00 C ATOM 1630 OE1 GLU A 98 128.223 16.074 7.664 1.00 0.00 O ATOM 1631 OE2 GLU A 98 130.159 15.333 7.078 1.00 0.00 O ATOM 0 H GLU A 98 126.115 12.370 7.315 1.00 0.00 H new ATOM 0 HA GLU A 98 126.022 15.332 7.144 1.00 0.00 H new ATOM 0 HB2 GLU A 98 127.090 13.064 5.360 1.00 0.00 H new ATOM 0 HB3 GLU A 98 127.501 14.759 5.189 1.00 0.00 H new ATOM 0 HG2 GLU A 98 127.946 13.380 7.859 1.00 0.00 H new ATOM 0 HG3 GLU A 98 129.108 13.147 6.567 1.00 0.00 H new ATOM 1638 N ASN A 99 124.048 13.473 5.395 1.00 0.00 N ATOM 1639 CA ASN A 99 122.921 13.546 4.427 1.00 0.00 C ATOM 1640 C ASN A 99 121.581 13.439 5.161 1.00 0.00 C ATOM 1641 O ASN A 99 120.631 12.873 4.658 1.00 0.00 O ATOM 1642 CB ASN A 99 123.119 12.350 3.496 1.00 0.00 C ATOM 1643 CG ASN A 99 124.335 12.594 2.600 1.00 0.00 C ATOM 1644 OD1 ASN A 99 125.382 12.990 3.072 1.00 0.00 O ATOM 1645 ND2 ASN A 99 124.240 12.374 1.317 1.00 0.00 N ATOM 0 H ASN A 99 124.175 12.566 5.844 1.00 0.00 H new ATOM 0 HA ASN A 99 122.908 14.490 3.882 1.00 0.00 H new ATOM 0 HB2 ASN A 99 123.262 11.441 4.080 1.00 0.00 H new ATOM 0 HB3 ASN A 99 122.229 12.200 2.885 1.00 0.00 H new ATOM 0 HD21 ASN A 99 125.045 12.535 0.711 1.00 0.00 H new ATOM 0 HD22 ASN A 99 123.361 12.041 0.920 1.00 0.00 H new ATOM 1652 N MET A 100 121.497 13.978 6.346 1.00 0.00 N ATOM 1653 CA MET A 100 120.217 13.906 7.109 1.00 0.00 C ATOM 1654 C MET A 100 119.101 14.611 6.335 1.00 0.00 C ATOM 1655 O MET A 100 117.946 14.247 6.419 1.00 0.00 O ATOM 1656 CB MET A 100 120.497 14.631 8.426 1.00 0.00 C ATOM 1657 CG MET A 100 120.590 16.137 8.170 1.00 0.00 C ATOM 1658 SD MET A 100 121.189 16.968 9.662 1.00 0.00 S ATOM 1659 CE MET A 100 122.848 17.361 9.052 1.00 0.00 C ATOM 0 H MET A 100 122.258 14.465 6.819 1.00 0.00 H new ATOM 0 HA MET A 100 119.891 12.879 7.272 1.00 0.00 H new ATOM 0 HB2 MET A 100 119.704 14.422 9.144 1.00 0.00 H new ATOM 0 HB3 MET A 100 121.427 14.268 8.863 1.00 0.00 H new ATOM 0 HG2 MET A 100 121.264 16.334 7.336 1.00 0.00 H new ATOM 0 HG3 MET A 100 119.613 16.530 7.890 1.00 0.00 H new ATOM 0 HE1 MET A 100 123.577 16.712 9.537 1.00 0.00 H new ATOM 0 HE2 MET A 100 122.885 17.206 7.974 1.00 0.00 H new ATOM 0 HE3 MET A 100 123.081 18.402 9.277 1.00 0.00 H new ATOM 1669 N TYR A 101 119.440 15.620 5.581 1.00 0.00 N ATOM 1670 CA TYR A 101 118.403 16.351 4.799 1.00 0.00 C ATOM 1671 C TYR A 101 117.730 15.406 3.801 1.00 0.00 C ATOM 1672 O TYR A 101 116.597 15.604 3.409 1.00 0.00 O ATOM 1673 CB TYR A 101 119.167 17.454 4.066 1.00 0.00 C ATOM 1674 CG TYR A 101 120.029 18.208 5.050 1.00 0.00 C ATOM 1675 CD1 TYR A 101 119.438 18.876 6.129 1.00 0.00 C ATOM 1676 CD2 TYR A 101 121.419 18.240 4.883 1.00 0.00 C ATOM 1677 CE1 TYR A 101 120.238 19.575 7.042 1.00 0.00 C ATOM 1678 CE2 TYR A 101 122.217 18.939 5.795 1.00 0.00 C ATOM 1679 CZ TYR A 101 121.627 19.606 6.875 1.00 0.00 C ATOM 1680 OH TYR A 101 122.415 20.295 7.775 1.00 0.00 O ATOM 0 H TYR A 101 120.392 15.970 5.472 1.00 0.00 H new ATOM 0 HA TYR A 101 117.614 16.755 5.433 1.00 0.00 H new ATOM 0 HB2 TYR A 101 119.786 17.022 3.280 1.00 0.00 H new ATOM 0 HB3 TYR A 101 118.468 18.136 3.582 1.00 0.00 H new ATOM 0 HD1 TYR A 101 118.366 18.852 6.257 1.00 0.00 H new ATOM 0 HD2 TYR A 101 121.875 17.725 4.050 1.00 0.00 H new ATOM 0 HE1 TYR A 101 119.783 20.090 7.875 1.00 0.00 H new ATOM 0 HE2 TYR A 101 123.289 18.964 5.666 1.00 0.00 H new ATOM 0 HH TYR A 101 123.356 20.215 7.514 1.00 0.00 H new ATOM 1690 N ALA A 102 118.419 14.378 3.388 1.00 0.00 N ATOM 1691 CA ALA A 102 117.819 13.420 2.416 1.00 0.00 C ATOM 1692 C ALA A 102 116.827 12.499 3.128 1.00 0.00 C ATOM 1693 O ALA A 102 115.767 12.197 2.617 1.00 0.00 O ATOM 1694 CB ALA A 102 119.001 12.618 1.872 1.00 0.00 C ATOM 0 H ALA A 102 119.371 14.160 3.681 1.00 0.00 H new ATOM 0 HA ALA A 102 117.269 13.925 1.622 1.00 0.00 H new ATOM 0 HB1 ALA A 102 118.642 11.888 1.147 1.00 0.00 H new ATOM 0 HB2 ALA A 102 119.707 13.293 1.388 1.00 0.00 H new ATOM 0 HB3 ALA A 102 119.498 12.101 2.693 1.00 0.00 H new ATOM 1700 N VAL A 103 117.163 12.055 4.304 1.00 0.00 N ATOM 1701 CA VAL A 103 116.241 11.155 5.055 1.00 0.00 C ATOM 1702 C VAL A 103 115.035 11.945 5.568 1.00 0.00 C ATOM 1703 O VAL A 103 113.962 11.406 5.757 1.00 0.00 O ATOM 1704 CB VAL A 103 117.069 10.622 6.223 1.00 0.00 C ATOM 1705 CG1 VAL A 103 116.350 9.425 6.847 1.00 0.00 C ATOM 1706 CG2 VAL A 103 118.442 10.181 5.712 1.00 0.00 C ATOM 0 H VAL A 103 118.037 12.275 4.781 1.00 0.00 H new ATOM 0 HA VAL A 103 115.852 10.350 4.432 1.00 0.00 H new ATOM 0 HB VAL A 103 117.193 11.405 6.971 1.00 0.00 H new ATOM 0 HG11 VAL A 103 116.938 9.042 7.681 1.00 0.00 H new ATOM 0 HG12 VAL A 103 115.370 9.737 7.207 1.00 0.00 H new ATOM 0 HG13 VAL A 103 116.229 8.642 6.098 1.00 0.00 H new ATOM 0 HG21 VAL A 103 119.035 9.800 6.544 1.00 0.00 H new ATOM 0 HG22 VAL A 103 118.318 9.396 4.966 1.00 0.00 H new ATOM 0 HG23 VAL A 103 118.953 11.032 5.262 1.00 0.00 H new ATOM 1716 N GLN A 104 115.201 13.220 5.798 1.00 0.00 N ATOM 1717 CA GLN A 104 114.065 14.043 6.301 1.00 0.00 C ATOM 1718 C GLN A 104 113.163 14.470 5.140 1.00 0.00 C ATOM 1719 O GLN A 104 111.984 14.708 5.312 1.00 0.00 O ATOM 1720 CB GLN A 104 114.714 15.263 6.953 1.00 0.00 C ATOM 1721 CG GLN A 104 115.609 14.811 8.107 1.00 0.00 C ATOM 1722 CD GLN A 104 114.741 14.441 9.312 1.00 0.00 C ATOM 1723 OE1 GLN A 104 113.788 13.698 9.182 1.00 0.00 O ATOM 1724 NE2 GLN A 104 115.034 14.929 10.485 1.00 0.00 N ATOM 0 H GLN A 104 116.075 13.727 5.659 1.00 0.00 H new ATOM 0 HA GLN A 104 113.438 13.492 7.003 1.00 0.00 H new ATOM 0 HB2 GLN A 104 115.301 15.812 6.217 1.00 0.00 H new ATOM 0 HB3 GLN A 104 113.946 15.944 7.320 1.00 0.00 H new ATOM 0 HG2 GLN A 104 116.210 13.954 7.801 1.00 0.00 H new ATOM 0 HG3 GLN A 104 116.303 15.607 8.376 1.00 0.00 H new ATOM 0 HE21 GLN A 104 115.834 15.552 10.593 1.00 0.00 H new ATOM 0 HE22 GLN A 104 114.463 14.687 11.295 1.00 0.00 H new ATOM 1733 N THR A 105 113.706 14.571 3.958 1.00 0.00 N ATOM 1734 CA THR A 105 112.875 14.984 2.790 1.00 0.00 C ATOM 1735 C THR A 105 111.808 13.925 2.505 1.00 0.00 C ATOM 1736 O THR A 105 110.881 14.149 1.752 1.00 0.00 O ATOM 1737 CB THR A 105 113.856 15.091 1.620 1.00 0.00 C ATOM 1738 OG1 THR A 105 113.236 15.786 0.549 1.00 0.00 O ATOM 1739 CG2 THR A 105 114.259 13.691 1.157 1.00 0.00 C ATOM 0 H THR A 105 114.687 14.386 3.750 1.00 0.00 H new ATOM 0 HA THR A 105 112.352 15.924 2.965 1.00 0.00 H new ATOM 0 HB THR A 105 114.746 15.633 1.940 1.00 0.00 H new ATOM 0 HG1 THR A 105 113.863 15.857 -0.201 1.00 0.00 H new ATOM 0 HG21 THR A 105 114.957 13.770 0.324 1.00 0.00 H new ATOM 0 HG22 THR A 105 114.735 13.159 1.980 1.00 0.00 H new ATOM 0 HG23 THR A 105 113.372 13.145 0.836 1.00 0.00 H new ATOM 1747 N LEU A 106 111.932 12.772 3.102 1.00 0.00 N ATOM 1748 CA LEU A 106 110.928 11.695 2.871 1.00 0.00 C ATOM 1749 C LEU A 106 109.653 11.981 3.670 1.00 0.00 C ATOM 1750 O LEU A 106 108.559 11.657 3.254 1.00 0.00 O ATOM 1751 CB LEU A 106 111.598 10.420 3.377 1.00 0.00 C ATOM 1752 CG LEU A 106 112.873 10.157 2.573 1.00 0.00 C ATOM 1753 CD1 LEU A 106 113.479 8.818 3.001 1.00 0.00 C ATOM 1754 CD2 LEU A 106 112.534 10.108 1.082 1.00 0.00 C ATOM 0 H LEU A 106 112.688 12.528 3.742 1.00 0.00 H new ATOM 0 HA LEU A 106 110.637 11.618 1.823 1.00 0.00 H new ATOM 0 HB2 LEU A 106 111.837 10.518 4.436 1.00 0.00 H new ATOM 0 HB3 LEU A 106 110.915 9.576 3.282 1.00 0.00 H new ATOM 0 HG LEU A 106 113.590 10.957 2.758 1.00 0.00 H new ATOM 0 HD11 LEU A 106 114.387 8.630 2.429 1.00 0.00 H new ATOM 0 HD12 LEU A 106 113.720 8.851 4.064 1.00 0.00 H new ATOM 0 HD13 LEU A 106 112.762 8.018 2.816 1.00 0.00 H new ATOM 0 HD21 LEU A 106 113.442 9.921 0.508 1.00 0.00 H new ATOM 0 HD22 LEU A 106 111.817 9.308 0.898 1.00 0.00 H new ATOM 0 HD23 LEU A 106 112.101 11.060 0.776 1.00 0.00 H new ATOM 1766 N LYS A 107 109.792 12.582 4.820 1.00 0.00 N ATOM 1767 CA LYS A 107 108.595 12.892 5.655 1.00 0.00 C ATOM 1768 C LYS A 107 107.448 13.402 4.778 1.00 0.00 C ATOM 1769 O LYS A 107 106.289 13.254 5.107 1.00 0.00 O ATOM 1770 CB LYS A 107 109.061 13.982 6.622 1.00 0.00 C ATOM 1771 CG LYS A 107 107.852 14.593 7.335 1.00 0.00 C ATOM 1772 CD LYS A 107 107.862 16.111 7.148 1.00 0.00 C ATOM 1773 CE LYS A 107 108.799 16.748 8.178 1.00 0.00 C ATOM 1774 NZ LYS A 107 108.032 17.897 8.736 1.00 0.00 N ATOM 0 H LYS A 107 110.685 12.873 5.219 1.00 0.00 H new ATOM 0 HA LYS A 107 108.220 12.013 6.180 1.00 0.00 H new ATOM 0 HB2 LYS A 107 109.752 13.562 7.353 1.00 0.00 H new ATOM 0 HB3 LYS A 107 109.604 14.756 6.079 1.00 0.00 H new ATOM 0 HG2 LYS A 107 106.930 14.173 6.934 1.00 0.00 H new ATOM 0 HG3 LYS A 107 107.880 14.347 8.396 1.00 0.00 H new ATOM 0 HD2 LYS A 107 108.190 16.361 6.139 1.00 0.00 H new ATOM 0 HD3 LYS A 107 106.854 16.509 7.263 1.00 0.00 H new ATOM 0 HE2 LYS A 107 109.069 16.037 8.959 1.00 0.00 H new ATOM 0 HE3 LYS A 107 109.728 17.081 7.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 108.609 18.385 9.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 107.794 18.560 7.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 107.157 17.549 9.177 1.00 0.00 H new ATOM 1788 N ASP A 108 107.764 14.003 3.664 1.00 0.00 N ATOM 1789 CA ASP A 108 106.693 14.525 2.769 1.00 0.00 C ATOM 1790 C ASP A 108 106.275 13.452 1.760 1.00 0.00 C ATOM 1791 O ASP A 108 105.114 13.321 1.424 1.00 0.00 O ATOM 1792 CB ASP A 108 107.322 15.720 2.053 1.00 0.00 C ATOM 1793 CG ASP A 108 106.733 17.018 2.611 1.00 0.00 C ATOM 1794 OD1 ASP A 108 105.528 17.067 2.796 1.00 0.00 O ATOM 1795 OD2 ASP A 108 107.497 17.939 2.843 1.00 0.00 O ATOM 0 H ASP A 108 108.717 14.155 3.335 1.00 0.00 H new ATOM 0 HA ASP A 108 105.796 14.807 3.320 1.00 0.00 H new ATOM 0 HB2 ASP A 108 108.403 15.711 2.189 1.00 0.00 H new ATOM 0 HB3 ASP A 108 107.135 15.655 0.981 1.00 0.00 H new ATOM 1800 N PHE A 109 107.213 12.687 1.271 1.00 0.00 N ATOM 1801 CA PHE A 109 106.875 11.624 0.281 1.00 0.00 C ATOM 1802 C PHE A 109 105.584 10.902 0.685 1.00 0.00 C ATOM 1803 O PHE A 109 105.583 10.045 1.546 1.00 0.00 O ATOM 1804 CB PHE A 109 108.062 10.660 0.316 1.00 0.00 C ATOM 1805 CG PHE A 109 108.587 10.459 -1.086 1.00 0.00 C ATOM 1806 CD1 PHE A 109 107.705 10.127 -2.119 1.00 0.00 C ATOM 1807 CD2 PHE A 109 109.953 10.605 -1.350 1.00 0.00 C ATOM 1808 CE1 PHE A 109 108.189 9.938 -3.422 1.00 0.00 C ATOM 1809 CE2 PHE A 109 110.439 10.417 -2.650 1.00 0.00 C ATOM 1810 CZ PHE A 109 109.556 10.085 -3.685 1.00 0.00 C ATOM 0 H PHE A 109 108.201 12.752 1.515 1.00 0.00 H new ATOM 0 HA PHE A 109 106.706 12.031 -0.716 1.00 0.00 H new ATOM 0 HB2 PHE A 109 108.849 11.058 0.957 1.00 0.00 H new ATOM 0 HB3 PHE A 109 107.756 9.704 0.742 1.00 0.00 H new ATOM 0 HD1 PHE A 109 106.651 10.016 -1.914 1.00 0.00 H new ATOM 0 HD2 PHE A 109 110.633 10.863 -0.551 1.00 0.00 H new ATOM 0 HE1 PHE A 109 107.509 9.680 -4.220 1.00 0.00 H new ATOM 0 HE2 PHE A 109 111.494 10.528 -2.854 1.00 0.00 H new ATOM 0 HZ PHE A 109 109.930 9.942 -4.688 1.00 0.00 H new ATOM 1820 N GLN A 110 104.486 11.244 0.066 1.00 0.00 N ATOM 1821 CA GLN A 110 103.193 10.583 0.404 1.00 0.00 C ATOM 1822 C GLN A 110 102.247 10.613 -0.803 1.00 0.00 C ATOM 1823 O GLN A 110 101.404 11.480 -0.922 1.00 0.00 O ATOM 1824 CB GLN A 110 102.619 11.410 1.556 1.00 0.00 C ATOM 1825 CG GLN A 110 102.413 12.854 1.092 1.00 0.00 C ATOM 1826 CD GLN A 110 102.632 13.806 2.270 1.00 0.00 C ATOM 1827 OE1 GLN A 110 102.507 13.416 3.413 1.00 0.00 O ATOM 1828 NE2 GLN A 110 102.957 15.048 2.036 1.00 0.00 N ATOM 0 H GLN A 110 104.429 11.956 -0.662 1.00 0.00 H new ATOM 0 HA GLN A 110 103.323 9.536 0.676 1.00 0.00 H new ATOM 0 HB2 GLN A 110 101.672 10.984 1.887 1.00 0.00 H new ATOM 0 HB3 GLN A 110 103.296 11.384 2.410 1.00 0.00 H new ATOM 0 HG2 GLN A 110 103.107 13.091 0.286 1.00 0.00 H new ATOM 0 HG3 GLN A 110 101.407 12.979 0.693 1.00 0.00 H new ATOM 0 HE21 GLN A 110 103.062 15.375 1.076 1.00 0.00 H new ATOM 0 HE22 GLN A 110 103.106 15.691 2.813 1.00 0.00 H new ATOM 1837 N TYR A 111 102.380 9.670 -1.699 1.00 0.00 N ATOM 1838 CA TYR A 111 101.488 9.639 -2.896 1.00 0.00 C ATOM 1839 C TYR A 111 100.114 9.090 -2.506 1.00 0.00 C ATOM 1840 O TYR A 111 99.997 8.010 -1.963 1.00 0.00 O ATOM 1841 CB TYR A 111 102.184 8.694 -3.879 1.00 0.00 C ATOM 1842 CG TYR A 111 102.000 9.191 -5.293 1.00 0.00 C ATOM 1843 CD1 TYR A 111 100.711 9.378 -5.804 1.00 0.00 C ATOM 1844 CD2 TYR A 111 103.119 9.459 -6.098 1.00 0.00 C ATOM 1845 CE1 TYR A 111 100.536 9.835 -7.116 1.00 0.00 C ATOM 1846 CE2 TYR A 111 102.942 9.916 -7.409 1.00 0.00 C ATOM 1847 CZ TYR A 111 101.652 10.104 -7.918 1.00 0.00 C ATOM 1848 OH TYR A 111 101.479 10.553 -9.211 1.00 0.00 O ATOM 0 H TYR A 111 103.069 8.919 -1.653 1.00 0.00 H new ATOM 0 HA TYR A 111 101.328 10.628 -3.325 1.00 0.00 H new ATOM 0 HB2 TYR A 111 103.246 8.629 -3.643 1.00 0.00 H new ATOM 0 HB3 TYR A 111 101.774 7.689 -3.782 1.00 0.00 H new ATOM 0 HD1 TYR A 111 99.850 9.170 -5.186 1.00 0.00 H new ATOM 0 HD2 TYR A 111 104.115 9.313 -5.706 1.00 0.00 H new ATOM 0 HE1 TYR A 111 99.541 9.980 -7.509 1.00 0.00 H new ATOM 0 HE2 TYR A 111 103.802 10.124 -8.029 1.00 0.00 H new ATOM 0 HH TYR A 111 102.354 10.692 -9.629 1.00 0.00 H new ATOM 1858 N VAL A 112 99.071 9.827 -2.773 1.00 0.00 N ATOM 1859 CA VAL A 112 97.707 9.345 -2.409 1.00 0.00 C ATOM 1860 C VAL A 112 96.882 9.064 -3.667 1.00 0.00 C ATOM 1861 O VAL A 112 95.826 8.465 -3.610 1.00 0.00 O ATOM 1862 CB VAL A 112 97.092 10.480 -1.590 1.00 0.00 C ATOM 1863 CG1 VAL A 112 96.578 11.580 -2.524 1.00 0.00 C ATOM 1864 CG2 VAL A 112 95.932 9.924 -0.765 1.00 0.00 C ATOM 0 H VAL A 112 99.103 10.740 -3.226 1.00 0.00 H new ATOM 0 HA VAL A 112 97.736 8.411 -1.848 1.00 0.00 H new ATOM 0 HB VAL A 112 97.848 10.904 -0.929 1.00 0.00 H new ATOM 0 HG11 VAL A 112 96.141 12.385 -1.933 1.00 0.00 H new ATOM 0 HG12 VAL A 112 97.406 11.972 -3.115 1.00 0.00 H new ATOM 0 HG13 VAL A 112 95.820 11.167 -3.190 1.00 0.00 H new ATOM 0 HG21 VAL A 112 95.486 10.726 -0.177 1.00 0.00 H new ATOM 0 HG22 VAL A 112 95.180 9.502 -1.432 1.00 0.00 H new ATOM 0 HG23 VAL A 112 96.301 9.146 -0.097 1.00 0.00 H new ATOM 1874 N ASP A 113 97.359 9.488 -4.799 1.00 0.00 N ATOM 1875 CA ASP A 113 96.611 9.247 -6.067 1.00 0.00 C ATOM 1876 C ASP A 113 95.187 9.803 -5.966 1.00 0.00 C ATOM 1877 O ASP A 113 94.804 10.383 -4.971 1.00 0.00 O ATOM 1878 CB ASP A 113 96.584 7.727 -6.227 1.00 0.00 C ATOM 1879 CG ASP A 113 97.700 7.291 -7.178 1.00 0.00 C ATOM 1880 OD1 ASP A 113 97.754 7.819 -8.276 1.00 0.00 O ATOM 1881 OD2 ASP A 113 98.482 6.439 -6.791 1.00 0.00 O ATOM 0 H ASP A 113 98.238 9.994 -4.905 1.00 0.00 H new ATOM 0 HA ASP A 113 97.079 9.740 -6.919 1.00 0.00 H new ATOM 0 HB2 ASP A 113 96.711 7.247 -5.257 1.00 0.00 H new ATOM 0 HB3 ASP A 113 95.616 7.409 -6.616 1.00 0.00 H new ATOM 1886 N ARG A 114 94.403 9.633 -6.997 1.00 0.00 N ATOM 1887 CA ARG A 114 93.004 10.155 -6.973 1.00 0.00 C ATOM 1888 C ARG A 114 92.238 9.612 -5.761 1.00 0.00 C ATOM 1889 O ARG A 114 91.545 10.341 -5.079 1.00 0.00 O ATOM 1890 CB ARG A 114 92.363 9.658 -8.273 1.00 0.00 C ATOM 1891 CG ARG A 114 92.641 8.165 -8.469 1.00 0.00 C ATOM 1892 CD ARG A 114 91.376 7.366 -8.148 1.00 0.00 C ATOM 1893 NE ARG A 114 91.677 5.974 -8.578 1.00 0.00 N ATOM 1894 CZ ARG A 114 90.759 5.051 -8.487 1.00 0.00 C ATOM 1895 NH1 ARG A 114 89.729 5.076 -9.287 1.00 0.00 N ATOM 1896 NH2 ARG A 114 90.871 4.106 -7.595 1.00 0.00 N ATOM 0 H ARG A 114 94.671 9.154 -7.857 1.00 0.00 H new ATOM 0 HA ARG A 114 92.984 11.242 -6.895 1.00 0.00 H new ATOM 0 HB2 ARG A 114 91.288 9.834 -8.246 1.00 0.00 H new ATOM 0 HB3 ARG A 114 92.757 10.222 -9.119 1.00 0.00 H new ATOM 0 HG2 ARG A 114 92.954 7.974 -9.495 1.00 0.00 H new ATOM 0 HG3 ARG A 114 93.459 7.848 -7.822 1.00 0.00 H new ATOM 0 HD2 ARG A 114 91.143 7.408 -7.084 1.00 0.00 H new ATOM 0 HD3 ARG A 114 90.512 7.765 -8.680 1.00 0.00 H new ATOM 0 HE ARG A 114 92.600 5.741 -8.944 1.00 0.00 H new ATOM 0 HH11 ARG A 114 89.642 5.817 -9.983 1.00 0.00 H new ATOM 0 HH12 ARG A 114 89.011 4.355 -9.217 1.00 0.00 H new ATOM 0 HH21 ARG A 114 91.676 4.089 -6.969 1.00 0.00 H new ATOM 0 HH22 ARG A 114 90.154 3.384 -7.524 1.00 0.00 H new ATOM 1910 N ASP A 115 92.351 8.339 -5.497 1.00 0.00 N ATOM 1911 CA ASP A 115 91.624 7.740 -4.337 1.00 0.00 C ATOM 1912 C ASP A 115 91.637 8.693 -3.138 1.00 0.00 C ATOM 1913 O ASP A 115 90.743 8.682 -2.316 1.00 0.00 O ATOM 1914 CB ASP A 115 92.391 6.458 -4.009 1.00 0.00 C ATOM 1915 CG ASP A 115 93.883 6.773 -3.884 1.00 0.00 C ATOM 1916 OD1 ASP A 115 94.514 6.973 -4.908 1.00 0.00 O ATOM 1917 OD2 ASP A 115 94.368 6.809 -2.765 1.00 0.00 O ATOM 0 H ASP A 115 92.917 7.684 -6.036 1.00 0.00 H new ATOM 0 HA ASP A 115 90.577 7.546 -4.569 1.00 0.00 H new ATOM 0 HB2 ASP A 115 92.020 6.028 -3.079 1.00 0.00 H new ATOM 0 HB3 ASP A 115 92.230 5.715 -4.790 1.00 0.00 H new ATOM 1922 N GLY A 116 92.641 9.519 -3.033 1.00 0.00 N ATOM 1923 CA GLY A 116 92.704 10.472 -1.888 1.00 0.00 C ATOM 1924 C GLY A 116 92.807 9.691 -0.576 1.00 0.00 C ATOM 1925 O GLY A 116 92.205 10.047 0.418 1.00 0.00 O ATOM 0 H GLY A 116 93.420 9.576 -3.689 1.00 0.00 H new ATOM 0 HA2 GLY A 116 93.564 11.133 -1.998 1.00 0.00 H new ATOM 0 HA3 GLY A 116 91.816 11.104 -1.878 1.00 0.00 H new ATOM 1929 N LYS A 117 93.565 8.629 -0.566 1.00 0.00 N ATOM 1930 CA LYS A 117 93.709 7.826 0.683 1.00 0.00 C ATOM 1931 C LYS A 117 95.094 8.047 1.296 1.00 0.00 C ATOM 1932 O LYS A 117 96.065 7.437 0.894 1.00 0.00 O ATOM 1933 CB LYS A 117 93.545 6.372 0.240 1.00 0.00 C ATOM 1934 CG LYS A 117 92.070 5.972 0.328 1.00 0.00 C ATOM 1935 CD LYS A 117 91.674 5.797 1.795 1.00 0.00 C ATOM 1936 CE LYS A 117 90.199 6.161 1.973 1.00 0.00 C ATOM 1937 NZ LYS A 117 89.582 4.965 2.613 1.00 0.00 N ATOM 0 H LYS A 117 94.091 8.282 -1.368 1.00 0.00 H new ATOM 0 HA LYS A 117 92.978 8.106 1.441 1.00 0.00 H new ATOM 0 HB2 LYS A 117 93.905 6.250 -0.781 1.00 0.00 H new ATOM 0 HB3 LYS A 117 94.148 5.719 0.871 1.00 0.00 H new ATOM 0 HG2 LYS A 117 91.447 6.735 -0.139 1.00 0.00 H new ATOM 0 HG3 LYS A 117 91.901 5.044 -0.218 1.00 0.00 H new ATOM 0 HD2 LYS A 117 91.846 4.767 2.109 1.00 0.00 H new ATOM 0 HD3 LYS A 117 92.295 6.431 2.428 1.00 0.00 H new ATOM 0 HE2 LYS A 117 90.084 7.047 2.598 1.00 0.00 H new ATOM 0 HE3 LYS A 117 89.729 6.383 1.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 88.568 5.138 2.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 89.701 4.139 1.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 90.045 4.782 3.526 1.00 0.00 H new ATOM 1951 N ASP A 118 95.195 8.917 2.264 1.00 0.00 N ATOM 1952 CA ASP A 118 96.519 9.176 2.898 1.00 0.00 C ATOM 1953 C ASP A 118 97.113 7.870 3.432 1.00 0.00 C ATOM 1954 O ASP A 118 96.591 7.268 4.349 1.00 0.00 O ATOM 1955 CB ASP A 118 96.226 10.140 4.048 1.00 0.00 C ATOM 1956 CG ASP A 118 95.382 11.308 3.535 1.00 0.00 C ATOM 1957 OD1 ASP A 118 95.462 11.598 2.353 1.00 0.00 O ATOM 1958 OD2 ASP A 118 94.668 11.892 4.334 1.00 0.00 O ATOM 0 H ASP A 118 94.419 9.459 2.643 1.00 0.00 H new ATOM 0 HA ASP A 118 97.241 9.589 2.193 1.00 0.00 H new ATOM 0 HB2 ASP A 118 95.698 9.619 4.847 1.00 0.00 H new ATOM 0 HB3 ASP A 118 97.159 10.511 4.472 1.00 0.00 H new ATOM 1963 N GLN A 119 98.202 7.427 2.867 1.00 0.00 N ATOM 1964 CA GLN A 119 98.827 6.160 3.344 1.00 0.00 C ATOM 1965 C GLN A 119 100.334 6.177 3.072 1.00 0.00 C ATOM 1966 O GLN A 119 100.956 5.146 2.908 1.00 0.00 O ATOM 1967 CB GLN A 119 98.147 5.054 2.536 1.00 0.00 C ATOM 1968 CG GLN A 119 98.328 5.326 1.042 1.00 0.00 C ATOM 1969 CD GLN A 119 97.239 4.595 0.255 1.00 0.00 C ATOM 1970 OE1 GLN A 119 96.071 4.907 0.376 1.00 0.00 O ATOM 1971 NE2 GLN A 119 97.573 3.627 -0.554 1.00 0.00 N ATOM 0 H GLN A 119 98.686 7.887 2.096 1.00 0.00 H new ATOM 0 HA GLN A 119 98.701 6.016 4.417 1.00 0.00 H new ATOM 0 HB2 GLN A 119 98.575 4.085 2.794 1.00 0.00 H new ATOM 0 HB3 GLN A 119 97.086 5.010 2.782 1.00 0.00 H new ATOM 0 HG2 GLN A 119 98.275 6.397 0.848 1.00 0.00 H new ATOM 0 HG3 GLN A 119 99.313 4.991 0.717 1.00 0.00 H new ATOM 0 HE21 GLN A 119 98.553 3.364 -0.657 1.00 0.00 H new ATOM 0 HE22 GLN A 119 96.854 3.134 -1.083 1.00 0.00 H new ATOM 1980 N GLY A 120 100.925 7.340 3.021 1.00 0.00 N ATOM 1981 CA GLY A 120 102.390 7.419 2.759 1.00 0.00 C ATOM 1982 C GLY A 120 103.109 7.914 4.014 1.00 0.00 C ATOM 1983 O GLY A 120 103.721 8.963 4.019 1.00 0.00 O ATOM 0 H GLY A 120 100.457 8.237 3.149 1.00 0.00 H new ATOM 0 HA2 GLY A 120 102.772 6.439 2.471 1.00 0.00 H new ATOM 0 HA3 GLY A 120 102.585 8.094 1.926 1.00 0.00 H new ATOM 1987 N VAL A 121 103.038 7.167 5.081 1.00 0.00 N ATOM 1988 CA VAL A 121 103.713 7.592 6.337 1.00 0.00 C ATOM 1989 C VAL A 121 104.863 6.638 6.666 1.00 0.00 C ATOM 1990 O VAL A 121 105.926 7.052 7.085 1.00 0.00 O ATOM 1991 CB VAL A 121 102.623 7.522 7.409 1.00 0.00 C ATOM 1992 CG1 VAL A 121 102.449 6.078 7.893 1.00 0.00 C ATOM 1993 CG2 VAL A 121 103.016 8.412 8.590 1.00 0.00 C ATOM 0 H VAL A 121 102.540 6.279 5.136 1.00 0.00 H new ATOM 0 HA VAL A 121 104.146 8.590 6.262 1.00 0.00 H new ATOM 0 HB VAL A 121 101.681 7.868 6.983 1.00 0.00 H new ATOM 0 HG11 VAL A 121 101.671 6.041 8.655 1.00 0.00 H new ATOM 0 HG12 VAL A 121 102.164 5.445 7.053 1.00 0.00 H new ATOM 0 HG13 VAL A 121 103.388 5.720 8.315 1.00 0.00 H new ATOM 0 HG21 VAL A 121 102.241 8.364 9.355 1.00 0.00 H new ATOM 0 HG22 VAL A 121 103.961 8.065 9.008 1.00 0.00 H new ATOM 0 HG23 VAL A 121 103.126 9.441 8.249 1.00 0.00 H new ATOM 2003 N ASN A 122 104.643 5.364 6.486 1.00 0.00 N ATOM 2004 CA ASN A 122 105.704 4.354 6.787 1.00 0.00 C ATOM 2005 C ASN A 122 107.091 4.899 6.428 1.00 0.00 C ATOM 2006 O ASN A 122 108.079 4.565 7.051 1.00 0.00 O ATOM 2007 CB ASN A 122 105.363 3.150 5.908 1.00 0.00 C ATOM 2008 CG ASN A 122 104.637 2.094 6.745 1.00 0.00 C ATOM 2009 OD1 ASN A 122 105.024 0.943 6.761 1.00 0.00 O ATOM 2010 ND2 ASN A 122 103.592 2.441 7.447 1.00 0.00 N ATOM 0 H ASN A 122 103.766 4.974 6.140 1.00 0.00 H new ATOM 0 HA ASN A 122 105.733 4.099 7.846 1.00 0.00 H new ATOM 0 HB2 ASN A 122 104.735 3.462 5.073 1.00 0.00 H new ATOM 0 HB3 ASN A 122 106.273 2.728 5.482 1.00 0.00 H new ATOM 0 HD21 ASN A 122 103.101 1.745 8.009 1.00 0.00 H new ATOM 0 HD22 ASN A 122 103.267 3.408 7.434 1.00 0.00 H new ATOM 2017 N VAL A 123 107.170 5.738 5.433 1.00 0.00 N ATOM 2018 CA VAL A 123 108.492 6.306 5.040 1.00 0.00 C ATOM 2019 C VAL A 123 108.842 7.492 5.948 1.00 0.00 C ATOM 2020 O VAL A 123 109.948 7.607 6.435 1.00 0.00 O ATOM 2021 CB VAL A 123 108.306 6.742 3.576 1.00 0.00 C ATOM 2022 CG1 VAL A 123 109.034 8.064 3.304 1.00 0.00 C ATOM 2023 CG2 VAL A 123 108.874 5.662 2.655 1.00 0.00 C ATOM 0 H VAL A 123 106.378 6.055 4.875 1.00 0.00 H new ATOM 0 HA VAL A 123 109.312 5.595 5.141 1.00 0.00 H new ATOM 0 HB VAL A 123 107.242 6.883 3.387 1.00 0.00 H new ATOM 0 HG11 VAL A 123 108.888 8.352 2.263 1.00 0.00 H new ATOM 0 HG12 VAL A 123 108.633 8.841 3.955 1.00 0.00 H new ATOM 0 HG13 VAL A 123 110.099 7.940 3.500 1.00 0.00 H new ATOM 0 HG21 VAL A 123 108.745 5.965 1.616 1.00 0.00 H new ATOM 0 HG22 VAL A 123 109.935 5.526 2.864 1.00 0.00 H new ATOM 0 HG23 VAL A 123 108.347 4.723 2.827 1.00 0.00 H new ATOM 2033 N ARG A 124 107.910 8.376 6.172 1.00 0.00 N ATOM 2034 CA ARG A 124 108.195 9.553 7.043 1.00 0.00 C ATOM 2035 C ARG A 124 108.658 9.098 8.429 1.00 0.00 C ATOM 2036 O ARG A 124 109.428 9.767 9.086 1.00 0.00 O ATOM 2037 CB ARG A 124 106.865 10.302 7.141 1.00 0.00 C ATOM 2038 CG ARG A 124 107.014 11.486 8.099 1.00 0.00 C ATOM 2039 CD ARG A 124 105.884 11.455 9.130 1.00 0.00 C ATOM 2040 NE ARG A 124 105.356 12.846 9.165 1.00 0.00 N ATOM 2041 CZ ARG A 124 105.059 13.403 10.307 1.00 0.00 C ATOM 2042 NH1 ARG A 124 104.311 12.767 11.168 1.00 0.00 N ATOM 2043 NH2 ARG A 124 105.507 14.596 10.589 1.00 0.00 N ATOM 0 H ARG A 124 106.965 8.336 5.791 1.00 0.00 H new ATOM 0 HA ARG A 124 108.990 10.179 6.638 1.00 0.00 H new ATOM 0 HB2 ARG A 124 106.561 10.654 6.155 1.00 0.00 H new ATOM 0 HB3 ARG A 124 106.083 9.631 7.495 1.00 0.00 H new ATOM 0 HG2 ARG A 124 107.980 11.441 8.602 1.00 0.00 H new ATOM 0 HG3 ARG A 124 106.987 12.423 7.543 1.00 0.00 H new ATOM 0 HD2 ARG A 124 105.108 10.745 8.844 1.00 0.00 H new ATOM 0 HD3 ARG A 124 106.251 11.148 10.109 1.00 0.00 H new ATOM 0 HE ARG A 124 105.226 13.364 8.296 1.00 0.00 H new ATOM 0 HH11 ARG A 124 103.959 11.835 10.948 1.00 0.00 H new ATOM 0 HH12 ARG A 124 104.079 13.202 12.061 1.00 0.00 H new ATOM 0 HH21 ARG A 124 106.090 15.094 9.916 1.00 0.00 H new ATOM 0 HH22 ARG A 124 105.274 15.030 11.482 1.00 0.00 H new ATOM 2057 N GLU A 125 108.188 7.969 8.882 1.00 0.00 N ATOM 2058 CA GLU A 125 108.595 7.479 10.231 1.00 0.00 C ATOM 2059 C GLU A 125 109.945 6.756 10.170 1.00 0.00 C ATOM 2060 O GLU A 125 110.867 7.088 10.886 1.00 0.00 O ATOM 2061 CB GLU A 125 107.489 6.509 10.648 1.00 0.00 C ATOM 2062 CG GLU A 125 106.173 7.272 10.810 1.00 0.00 C ATOM 2063 CD GLU A 125 105.035 6.280 11.058 1.00 0.00 C ATOM 2064 OE1 GLU A 125 104.526 5.738 10.091 1.00 0.00 O ATOM 2065 OE2 GLU A 125 104.691 6.080 12.211 1.00 0.00 O ATOM 0 H GLU A 125 107.540 7.364 8.378 1.00 0.00 H new ATOM 0 HA GLU A 125 108.717 8.299 10.939 1.00 0.00 H new ATOM 0 HB2 GLU A 125 107.377 5.725 9.899 1.00 0.00 H new ATOM 0 HB3 GLU A 125 107.755 6.019 11.585 1.00 0.00 H new ATOM 0 HG2 GLU A 125 106.247 7.973 11.642 1.00 0.00 H new ATOM 0 HG3 GLU A 125 105.969 7.860 9.915 1.00 0.00 H new ATOM 2072 N LYS A 126 110.068 5.767 9.328 1.00 0.00 N ATOM 2073 CA LYS A 126 111.360 5.026 9.237 1.00 0.00 C ATOM 2074 C LYS A 126 112.517 6.004 9.021 1.00 0.00 C ATOM 2075 O LYS A 126 113.519 5.956 9.704 1.00 0.00 O ATOM 2076 CB LYS A 126 111.203 4.098 8.031 1.00 0.00 C ATOM 2077 CG LYS A 126 111.243 2.643 8.501 1.00 0.00 C ATOM 2078 CD LYS A 126 112.637 2.320 9.045 1.00 0.00 C ATOM 2079 CE LYS A 126 112.793 0.805 9.186 1.00 0.00 C ATOM 2080 NZ LYS A 126 112.507 0.521 10.619 1.00 0.00 N ATOM 0 H LYS A 126 109.333 5.440 8.701 1.00 0.00 H new ATOM 0 HA LYS A 126 111.583 4.471 10.148 1.00 0.00 H new ATOM 0 HB2 LYS A 126 110.261 4.301 7.522 1.00 0.00 H new ATOM 0 HB3 LYS A 126 112.001 4.281 7.311 1.00 0.00 H new ATOM 0 HG2 LYS A 126 110.492 2.479 9.274 1.00 0.00 H new ATOM 0 HG3 LYS A 126 111.000 1.976 7.674 1.00 0.00 H new ATOM 0 HD2 LYS A 126 113.401 2.714 8.374 1.00 0.00 H new ATOM 0 HD3 LYS A 126 112.782 2.802 10.012 1.00 0.00 H new ATOM 0 HE2 LYS A 126 112.101 0.274 8.532 1.00 0.00 H new ATOM 0 HE3 LYS A 126 113.798 0.484 8.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 112.594 -0.500 10.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 113.186 1.034 11.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 111.541 0.830 10.848 1.00 0.00 H new ATOM 2094 N ALA A 127 112.385 6.889 8.073 1.00 0.00 N ATOM 2095 CA ALA A 127 113.477 7.869 7.810 1.00 0.00 C ATOM 2096 C ALA A 127 113.723 8.741 9.047 1.00 0.00 C ATOM 2097 O ALA A 127 114.851 9.025 9.400 1.00 0.00 O ATOM 2098 CB ALA A 127 112.971 8.724 6.648 1.00 0.00 C ATOM 0 H ALA A 127 111.568 6.977 7.468 1.00 0.00 H new ATOM 0 HA ALA A 127 114.421 7.377 7.577 1.00 0.00 H new ATOM 0 HB1 ALA A 127 113.721 9.473 6.393 1.00 0.00 H new ATOM 0 HB2 ALA A 127 112.785 8.088 5.783 1.00 0.00 H new ATOM 0 HB3 ALA A 127 112.046 9.222 6.938 1.00 0.00 H new ATOM 2104 N LYS A 128 112.681 9.171 9.705 1.00 0.00 N ATOM 2105 CA LYS A 128 112.869 10.028 10.913 1.00 0.00 C ATOM 2106 C LYS A 128 113.745 9.311 11.944 1.00 0.00 C ATOM 2107 O LYS A 128 114.697 9.867 12.456 1.00 0.00 O ATOM 2108 CB LYS A 128 111.462 10.247 11.469 1.00 0.00 C ATOM 2109 CG LYS A 128 111.335 11.680 11.986 1.00 0.00 C ATOM 2110 CD LYS A 128 110.468 11.692 13.246 1.00 0.00 C ATOM 2111 CE LYS A 128 108.993 11.598 12.852 1.00 0.00 C ATOM 2112 NZ LYS A 128 108.274 12.440 13.847 1.00 0.00 N ATOM 0 H LYS A 128 111.712 8.968 9.461 1.00 0.00 H new ATOM 0 HA LYS A 128 113.365 10.969 10.674 1.00 0.00 H new ATOM 0 HB2 LYS A 128 110.720 10.062 10.692 1.00 0.00 H new ATOM 0 HB3 LYS A 128 111.264 9.540 12.274 1.00 0.00 H new ATOM 0 HG2 LYS A 128 112.322 12.087 12.207 1.00 0.00 H new ATOM 0 HG3 LYS A 128 110.891 12.316 11.220 1.00 0.00 H new ATOM 0 HD2 LYS A 128 110.736 10.857 13.893 1.00 0.00 H new ATOM 0 HD3 LYS A 128 110.646 12.605 13.814 1.00 0.00 H new ATOM 0 HE2 LYS A 128 108.832 11.962 11.837 1.00 0.00 H new ATOM 0 HE3 LYS A 128 108.642 10.567 12.881 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 107.255 12.425 13.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 108.440 12.066 14.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 108.624 13.418 13.792 1.00 0.00 H new ATOM 2126 N GLN A 129 113.430 8.085 12.256 1.00 0.00 N ATOM 2127 CA GLN A 129 114.245 7.338 13.257 1.00 0.00 C ATOM 2128 C GLN A 129 115.718 7.325 12.842 1.00 0.00 C ATOM 2129 O GLN A 129 116.596 7.629 13.625 1.00 0.00 O ATOM 2130 CB GLN A 129 113.673 5.920 13.253 1.00 0.00 C ATOM 2131 CG GLN A 129 112.795 5.720 14.490 1.00 0.00 C ATOM 2132 CD GLN A 129 113.683 5.553 15.725 1.00 0.00 C ATOM 2133 OE1 GLN A 129 114.810 6.006 15.741 1.00 0.00 O ATOM 2134 NE2 GLN A 129 113.219 4.919 16.765 1.00 0.00 N ATOM 0 H GLN A 129 112.644 7.567 11.862 1.00 0.00 H new ATOM 0 HA GLN A 129 114.201 7.793 14.246 1.00 0.00 H new ATOM 0 HB2 GLN A 129 113.088 5.755 12.348 1.00 0.00 H new ATOM 0 HB3 GLN A 129 114.482 5.190 13.247 1.00 0.00 H new ATOM 0 HG2 GLN A 129 112.131 6.574 14.620 1.00 0.00 H new ATOM 0 HG3 GLN A 129 112.163 4.841 14.362 1.00 0.00 H new ATOM 0 HE21 GLN A 129 112.272 4.539 16.750 1.00 0.00 H new ATOM 0 HE22 GLN A 129 113.802 4.803 17.594 1.00 0.00 H new ATOM 2143 N LEU A 130 115.998 6.972 11.617 1.00 0.00 N ATOM 2144 CA LEU A 130 117.416 6.939 11.157 1.00 0.00 C ATOM 2145 C LEU A 130 118.092 8.282 11.436 1.00 0.00 C ATOM 2146 O LEU A 130 119.230 8.340 11.855 1.00 0.00 O ATOM 2147 CB LEU A 130 117.341 6.674 9.654 1.00 0.00 C ATOM 2148 CG LEU A 130 117.625 5.196 9.382 1.00 0.00 C ATOM 2149 CD1 LEU A 130 116.746 4.708 8.230 1.00 0.00 C ATOM 2150 CD2 LEU A 130 119.096 5.021 9.005 1.00 0.00 C ATOM 0 H LEU A 130 115.307 6.705 10.915 1.00 0.00 H new ATOM 0 HA LEU A 130 118.001 6.177 11.673 1.00 0.00 H new ATOM 0 HB2 LEU A 130 116.354 6.941 9.276 1.00 0.00 H new ATOM 0 HB3 LEU A 130 118.064 7.297 9.128 1.00 0.00 H new ATOM 0 HG LEU A 130 117.405 4.615 10.278 1.00 0.00 H new ATOM 0 HD11 LEU A 130 116.950 3.655 8.038 1.00 0.00 H new ATOM 0 HD12 LEU A 130 115.696 4.832 8.496 1.00 0.00 H new ATOM 0 HD13 LEU A 130 116.964 5.289 7.334 1.00 0.00 H new ATOM 0 HD21 LEU A 130 119.299 3.968 8.811 1.00 0.00 H new ATOM 0 HD22 LEU A 130 119.314 5.603 8.110 1.00 0.00 H new ATOM 0 HD23 LEU A 130 119.725 5.367 9.825 1.00 0.00 H new ATOM 2162 N VAL A 131 117.397 9.360 11.211 1.00 0.00 N ATOM 2163 CA VAL A 131 117.996 10.703 11.465 1.00 0.00 C ATOM 2164 C VAL A 131 118.100 10.959 12.971 1.00 0.00 C ATOM 2165 O VAL A 131 118.933 11.717 13.426 1.00 0.00 O ATOM 2166 CB VAL A 131 117.028 11.694 10.818 1.00 0.00 C ATOM 2167 CG1 VAL A 131 117.319 13.105 11.331 1.00 0.00 C ATOM 2168 CG2 VAL A 131 117.207 11.659 9.298 1.00 0.00 C ATOM 0 H VAL A 131 116.439 9.372 10.862 1.00 0.00 H new ATOM 0 HA VAL A 131 119.003 10.791 11.058 1.00 0.00 H new ATOM 0 HB VAL A 131 116.004 11.420 11.073 1.00 0.00 H new ATOM 0 HG11 VAL A 131 116.628 13.810 10.869 1.00 0.00 H new ATOM 0 HG12 VAL A 131 117.194 13.132 12.414 1.00 0.00 H new ATOM 0 HG13 VAL A 131 118.343 13.381 11.077 1.00 0.00 H new ATOM 0 HG21 VAL A 131 116.518 12.365 8.834 1.00 0.00 H new ATOM 0 HG22 VAL A 131 118.231 11.933 9.046 1.00 0.00 H new ATOM 0 HG23 VAL A 131 116.999 10.654 8.930 1.00 0.00 H new ATOM 2178 N ALA A 132 117.260 10.332 13.748 1.00 0.00 N ATOM 2179 CA ALA A 132 117.308 10.540 15.224 1.00 0.00 C ATOM 2180 C ALA A 132 118.569 9.898 15.813 1.00 0.00 C ATOM 2181 O ALA A 132 119.357 10.549 16.469 1.00 0.00 O ATOM 2182 CB ALA A 132 116.053 9.850 15.761 1.00 0.00 C ATOM 0 H ALA A 132 116.542 9.684 13.425 1.00 0.00 H new ATOM 0 HA ALA A 132 117.339 11.597 15.490 1.00 0.00 H new ATOM 0 HB1 ALA A 132 116.014 9.958 16.845 1.00 0.00 H new ATOM 0 HB2 ALA A 132 115.168 10.308 15.319 1.00 0.00 H new ATOM 0 HB3 ALA A 132 116.081 8.791 15.503 1.00 0.00 H new ATOM 2188 N LEU A 133 118.761 8.628 15.589 1.00 0.00 N ATOM 2189 CA LEU A 133 119.968 7.947 16.141 1.00 0.00 C ATOM 2190 C LEU A 133 121.230 8.430 15.419 1.00 0.00 C ATOM 2191 O LEU A 133 122.272 8.601 16.019 1.00 0.00 O ATOM 2192 CB LEU A 133 119.736 6.459 15.879 1.00 0.00 C ATOM 2193 CG LEU A 133 120.855 5.643 16.529 1.00 0.00 C ATOM 2194 CD1 LEU A 133 120.599 5.527 18.033 1.00 0.00 C ATOM 2195 CD2 LEU A 133 120.889 4.243 15.908 1.00 0.00 C ATOM 0 H LEU A 133 118.135 8.031 15.048 1.00 0.00 H new ATOM 0 HA LEU A 133 120.112 8.158 17.201 1.00 0.00 H new ATOM 0 HB2 LEU A 133 118.770 6.155 16.281 1.00 0.00 H new ATOM 0 HB3 LEU A 133 119.709 6.268 14.806 1.00 0.00 H new ATOM 0 HG LEU A 133 121.810 6.140 16.363 1.00 0.00 H new ATOM 0 HD11 LEU A 133 121.397 4.945 18.494 1.00 0.00 H new ATOM 0 HD12 LEU A 133 120.573 6.523 18.476 1.00 0.00 H new ATOM 0 HD13 LEU A 133 119.644 5.030 18.202 1.00 0.00 H new ATOM 0 HD21 LEU A 133 121.686 3.660 16.370 1.00 0.00 H new ATOM 0 HD22 LEU A 133 119.933 3.747 16.075 1.00 0.00 H new ATOM 0 HD23 LEU A 133 121.073 4.325 14.837 1.00 0.00 H new ATOM 2207 N LEU A 134 121.145 8.654 14.136 1.00 0.00 N ATOM 2208 CA LEU A 134 122.342 9.125 13.381 1.00 0.00 C ATOM 2209 C LEU A 134 122.670 10.572 13.759 1.00 0.00 C ATOM 2210 O LEU A 134 123.676 10.849 14.380 1.00 0.00 O ATOM 2211 CB LEU A 134 121.945 9.030 11.907 1.00 0.00 C ATOM 2212 CG LEU A 134 121.877 7.560 11.492 1.00 0.00 C ATOM 2213 CD1 LEU A 134 121.007 7.419 10.241 1.00 0.00 C ATOM 2214 CD2 LEU A 134 123.289 7.051 11.188 1.00 0.00 C ATOM 0 H LEU A 134 120.300 8.532 13.578 1.00 0.00 H new ATOM 0 HA LEU A 134 123.229 8.531 13.601 1.00 0.00 H new ATOM 0 HB2 LEU A 134 120.979 9.509 11.748 1.00 0.00 H new ATOM 0 HB3 LEU A 134 122.670 9.560 11.289 1.00 0.00 H new ATOM 0 HG LEU A 134 121.443 6.975 12.303 1.00 0.00 H new ATOM 0 HD11 LEU A 134 120.960 6.370 9.947 1.00 0.00 H new ATOM 0 HD12 LEU A 134 120.001 7.782 10.454 1.00 0.00 H new ATOM 0 HD13 LEU A 134 121.439 8.004 9.429 1.00 0.00 H new ATOM 0 HD21 LEU A 134 123.242 6.003 10.892 1.00 0.00 H new ATOM 0 HD22 LEU A 134 123.721 7.638 10.377 1.00 0.00 H new ATOM 0 HD23 LEU A 134 123.911 7.149 12.078 1.00 0.00 H new ATOM 2226 N ARG A 135 121.827 11.499 13.390 1.00 0.00 N ATOM 2227 CA ARG A 135 122.092 12.926 13.730 1.00 0.00 C ATOM 2228 C ARG A 135 121.409 13.290 15.051 1.00 0.00 C ATOM 2229 O ARG A 135 120.199 13.319 15.147 1.00 0.00 O ATOM 2230 CB ARG A 135 121.490 13.727 12.575 1.00 0.00 C ATOM 2231 CG ARG A 135 122.450 14.850 12.178 1.00 0.00 C ATOM 2232 CD ARG A 135 122.024 16.150 12.864 1.00 0.00 C ATOM 2233 NE ARG A 135 122.909 16.262 14.057 1.00 0.00 N ATOM 2234 CZ ARG A 135 123.681 17.303 14.202 1.00 0.00 C ATOM 2235 NH1 ARG A 135 123.199 18.503 14.023 1.00 0.00 N ATOM 2236 NH2 ARG A 135 124.935 17.145 14.525 1.00 0.00 N ATOM 0 H ARG A 135 120.967 11.329 12.868 1.00 0.00 H new ATOM 0 HA ARG A 135 123.155 13.130 13.856 1.00 0.00 H new ATOM 0 HB2 ARG A 135 121.306 13.073 11.722 1.00 0.00 H new ATOM 0 HB3 ARG A 135 120.528 14.144 12.871 1.00 0.00 H new ATOM 0 HG2 ARG A 135 123.469 14.591 12.466 1.00 0.00 H new ATOM 0 HG3 ARG A 135 122.448 14.979 11.096 1.00 0.00 H new ATOM 0 HD2 ARG A 135 122.146 17.006 12.200 1.00 0.00 H new ATOM 0 HD3 ARG A 135 120.973 16.118 13.153 1.00 0.00 H new ATOM 0 HE ARG A 135 122.911 15.524 14.761 1.00 0.00 H new ATOM 0 HH11 ARG A 135 122.219 18.626 13.770 1.00 0.00 H new ATOM 0 HH12 ARG A 135 123.803 19.317 14.136 1.00 0.00 H new ATOM 0 HH21 ARG A 135 125.312 16.207 14.664 1.00 0.00 H new ATOM 0 HH22 ARG A 135 125.539 17.959 14.638 1.00 0.00 H new ATOM 2250 N ASP A 136 122.176 13.569 16.070 1.00 0.00 N ATOM 2251 CA ASP A 136 121.571 13.930 17.381 1.00 0.00 C ATOM 2252 C ASP A 136 122.419 14.994 18.084 1.00 0.00 C ATOM 2253 O ASP A 136 121.994 16.116 18.271 1.00 0.00 O ATOM 2254 CB ASP A 136 121.562 12.632 18.187 1.00 0.00 C ATOM 2255 CG ASP A 136 120.230 12.499 18.927 1.00 0.00 C ATOM 2256 OD1 ASP A 136 119.312 11.933 18.357 1.00 0.00 O ATOM 2257 OD2 ASP A 136 120.151 12.967 20.052 1.00 0.00 O ATOM 0 H ASP A 136 123.196 13.562 16.050 1.00 0.00 H new ATOM 0 HA ASP A 136 120.570 14.347 17.270 1.00 0.00 H new ATOM 0 HB2 ASP A 136 121.708 11.779 17.524 1.00 0.00 H new ATOM 0 HB3 ASP A 136 122.387 12.628 18.899 1.00 0.00 H new ATOM 2262 N GLU A 137 123.615 14.651 18.477 1.00 0.00 N ATOM 2263 CA GLU A 137 124.486 15.644 19.170 1.00 0.00 C ATOM 2264 C GLU A 137 125.923 15.121 19.256 1.00 0.00 C ATOM 2265 O GLU A 137 126.439 14.871 20.327 1.00 0.00 O ATOM 2266 CB GLU A 137 123.884 15.788 20.568 1.00 0.00 C ATOM 2267 CG GLU A 137 123.604 14.401 21.149 1.00 0.00 C ATOM 2268 CD GLU A 137 123.729 14.449 22.673 1.00 0.00 C ATOM 2269 OE1 GLU A 137 123.000 15.212 23.284 1.00 0.00 O ATOM 2270 OE2 GLU A 137 124.552 13.720 23.204 1.00 0.00 O ATOM 0 H GLU A 137 124.027 13.727 18.349 1.00 0.00 H new ATOM 0 HA GLU A 137 124.527 16.597 18.642 1.00 0.00 H new ATOM 0 HB2 GLU A 137 124.570 16.334 21.216 1.00 0.00 H new ATOM 0 HB3 GLU A 137 122.962 16.367 20.520 1.00 0.00 H new ATOM 0 HG2 GLU A 137 122.604 14.072 20.866 1.00 0.00 H new ATOM 0 HG3 GLU A 137 124.306 13.675 20.739 1.00 0.00 H new ATOM 2277 N ASP A 138 126.572 14.953 18.136 1.00 0.00 N ATOM 2278 CA ASP A 138 127.975 14.448 18.155 1.00 0.00 C ATOM 2279 C ASP A 138 128.842 15.317 19.070 1.00 0.00 C ATOM 2280 O ASP A 138 129.004 16.500 18.846 1.00 0.00 O ATOM 2281 CB ASP A 138 128.454 14.551 16.707 1.00 0.00 C ATOM 2282 CG ASP A 138 129.262 13.304 16.346 1.00 0.00 C ATOM 2283 OD1 ASP A 138 130.440 13.274 16.659 1.00 0.00 O ATOM 2284 OD2 ASP A 138 128.688 12.399 15.762 1.00 0.00 O ATOM 0 H ASP A 138 126.192 15.143 17.209 1.00 0.00 H new ATOM 0 HA ASP A 138 128.039 13.428 18.535 1.00 0.00 H new ATOM 0 HB2 ASP A 138 127.600 14.650 16.037 1.00 0.00 H new ATOM 0 HB3 ASP A 138 129.066 15.444 16.578 1.00 0.00 H new ATOM 2289 N ARG A 139 129.402 14.738 20.098 1.00 0.00 N ATOM 2290 CA ARG A 139 130.257 15.530 21.025 1.00 0.00 C ATOM 2291 C ARG A 139 131.732 15.379 20.642 1.00 0.00 C ATOM 2292 O ARG A 139 132.062 15.035 19.525 1.00 0.00 O ATOM 2293 CB ARG A 139 129.999 14.935 22.409 1.00 0.00 C ATOM 2294 CG ARG A 139 128.532 15.139 22.788 1.00 0.00 C ATOM 2295 CD ARG A 139 128.447 15.901 24.113 1.00 0.00 C ATOM 2296 NE ARG A 139 128.367 17.337 23.725 1.00 0.00 N ATOM 2297 CZ ARG A 139 128.100 18.242 24.627 1.00 0.00 C ATOM 2298 NH1 ARG A 139 127.659 17.883 25.802 1.00 0.00 N ATOM 2299 NH2 ARG A 139 128.276 19.506 24.354 1.00 0.00 N ATOM 0 H ARG A 139 129.304 13.751 20.335 1.00 0.00 H new ATOM 0 HA ARG A 139 130.027 16.595 20.991 1.00 0.00 H new ATOM 0 HB2 ARG A 139 130.241 13.872 22.410 1.00 0.00 H new ATOM 0 HB3 ARG A 139 130.645 15.410 23.147 1.00 0.00 H new ATOM 0 HG2 ARG A 139 128.017 15.694 22.004 1.00 0.00 H new ATOM 0 HG3 ARG A 139 128.031 14.175 22.878 1.00 0.00 H new ATOM 0 HD2 ARG A 139 127.572 15.598 24.688 1.00 0.00 H new ATOM 0 HD3 ARG A 139 129.320 15.708 24.736 1.00 0.00 H new ATOM 0 HE ARG A 139 128.521 17.613 22.755 1.00 0.00 H new ATOM 0 HH11 ARG A 139 127.523 16.895 26.016 1.00 0.00 H new ATOM 0 HH12 ARG A 139 127.451 18.591 26.507 1.00 0.00 H new ATOM 0 HH21 ARG A 139 128.622 19.786 23.436 1.00 0.00 H new ATOM 0 HH22 ARG A 139 128.068 20.214 25.058 1.00 0.00 H new ATOM 2313 N LEU A 140 132.622 15.633 21.563 1.00 0.00 N ATOM 2314 CA LEU A 140 134.075 15.501 21.253 1.00 0.00 C ATOM 2315 C LEU A 140 134.902 15.602 22.536 1.00 0.00 C ATOM 2316 O LEU A 140 134.504 16.234 23.495 1.00 0.00 O ATOM 2317 CB LEU A 140 134.389 16.668 20.316 1.00 0.00 C ATOM 2318 CG LEU A 140 134.063 17.988 21.014 1.00 0.00 C ATOM 2319 CD1 LEU A 140 135.334 18.831 21.134 1.00 0.00 C ATOM 2320 CD2 LEU A 140 133.021 18.752 20.196 1.00 0.00 C ATOM 0 H LEU A 140 132.406 15.926 22.516 1.00 0.00 H new ATOM 0 HA LEU A 140 134.314 14.540 20.799 1.00 0.00 H new ATOM 0 HB2 LEU A 140 135.441 16.646 20.031 1.00 0.00 H new ATOM 0 HB3 LEU A 140 133.808 16.577 19.398 1.00 0.00 H new ATOM 0 HG LEU A 140 133.668 17.784 22.009 1.00 0.00 H new ATOM 0 HD11 LEU A 140 135.101 19.772 21.632 1.00 0.00 H new ATOM 0 HD12 LEU A 140 136.078 18.287 21.716 1.00 0.00 H new ATOM 0 HD13 LEU A 140 135.730 19.035 20.139 1.00 0.00 H new ATOM 0 HD21 LEU A 140 132.788 19.694 20.693 1.00 0.00 H new ATOM 0 HD22 LEU A 140 133.417 18.955 19.201 1.00 0.00 H new ATOM 0 HD23 LEU A 140 132.115 18.153 20.110 1.00 0.00 H new ATOM 2332 N ARG A 141 136.050 14.982 22.564 1.00 0.00 N ATOM 2333 CA ARG A 141 136.903 15.038 23.786 1.00 0.00 C ATOM 2334 C ARG A 141 137.202 16.492 24.160 1.00 0.00 C ATOM 2335 O ARG A 141 136.536 17.408 23.721 1.00 0.00 O ATOM 2336 CB ARG A 141 138.189 14.306 23.403 1.00 0.00 C ATOM 2337 CG ARG A 141 139.019 15.184 22.464 1.00 0.00 C ATOM 2338 CD ARG A 141 139.762 14.299 21.461 1.00 0.00 C ATOM 2339 NE ARG A 141 139.900 15.137 20.238 1.00 0.00 N ATOM 2340 CZ ARG A 141 139.394 14.727 19.106 1.00 0.00 C ATOM 2341 NH1 ARG A 141 139.640 13.519 18.680 1.00 0.00 N ATOM 2342 NH2 ARG A 141 138.641 15.527 18.402 1.00 0.00 N ATOM 0 H ARG A 141 136.435 14.438 21.792 1.00 0.00 H new ATOM 0 HA ARG A 141 136.417 14.585 24.650 1.00 0.00 H new ATOM 0 HB2 ARG A 141 138.764 14.068 24.298 1.00 0.00 H new ATOM 0 HB3 ARG A 141 137.950 13.360 22.917 1.00 0.00 H new ATOM 0 HG2 ARG A 141 138.371 15.885 21.937 1.00 0.00 H new ATOM 0 HG3 ARG A 141 139.730 15.778 23.038 1.00 0.00 H new ATOM 0 HD2 ARG A 141 140.737 13.998 21.846 1.00 0.00 H new ATOM 0 HD3 ARG A 141 139.206 13.385 21.253 1.00 0.00 H new ATOM 0 HE ARG A 141 140.389 16.031 20.284 1.00 0.00 H new ATOM 0 HH11 ARG A 141 140.228 12.894 19.231 1.00 0.00 H new ATOM 0 HH12 ARG A 141 139.244 13.200 17.796 1.00 0.00 H new ATOM 0 HH21 ARG A 141 138.448 16.471 18.736 1.00 0.00 H new ATOM 0 HH22 ARG A 141 138.245 15.208 17.518 1.00 0.00 H new ATOM 2356 N GLU A 142 138.201 16.710 24.973 1.00 0.00 N ATOM 2357 CA GLU A 142 138.544 18.103 25.379 1.00 0.00 C ATOM 2358 C GLU A 142 137.391 18.720 26.174 1.00 0.00 C ATOM 2359 O GLU A 142 137.291 19.923 26.307 1.00 0.00 O ATOM 2360 CB GLU A 142 138.757 18.860 24.068 1.00 0.00 C ATOM 2361 CG GLU A 142 139.749 20.002 24.293 1.00 0.00 C ATOM 2362 CD GLU A 142 138.991 21.327 24.390 1.00 0.00 C ATOM 2363 OE1 GLU A 142 138.187 21.592 23.512 1.00 0.00 O ATOM 2364 OE2 GLU A 142 139.230 22.056 25.339 1.00 0.00 O ATOM 0 H GLU A 142 138.794 15.983 25.373 1.00 0.00 H new ATOM 0 HA GLU A 142 139.427 18.141 26.017 1.00 0.00 H new ATOM 0 HB2 GLU A 142 139.134 18.183 23.302 1.00 0.00 H new ATOM 0 HB3 GLU A 142 137.808 19.255 23.705 1.00 0.00 H new ATOM 0 HG2 GLU A 142 140.318 19.829 25.207 1.00 0.00 H new ATOM 0 HG3 GLU A 142 140.467 20.041 23.473 1.00 0.00 H new ATOM 2371 N GLU A 143 136.520 17.905 26.702 1.00 0.00 N ATOM 2372 CA GLU A 143 135.374 18.446 27.487 1.00 0.00 C ATOM 2373 C GLU A 143 134.804 17.363 28.408 1.00 0.00 C ATOM 2374 O GLU A 143 135.393 16.315 28.588 1.00 0.00 O ATOM 2375 CB GLU A 143 134.339 18.858 26.440 1.00 0.00 C ATOM 2376 CG GLU A 143 134.339 20.381 26.293 1.00 0.00 C ATOM 2377 CD GLU A 143 132.898 20.888 26.222 1.00 0.00 C ATOM 2378 OE1 GLU A 143 132.031 20.102 25.878 1.00 0.00 O ATOM 2379 OE2 GLU A 143 132.686 22.054 26.513 1.00 0.00 O ATOM 0 H GLU A 143 136.552 16.888 26.624 1.00 0.00 H new ATOM 0 HA GLU A 143 135.667 19.281 28.124 1.00 0.00 H new ATOM 0 HB2 GLU A 143 134.568 18.390 25.483 1.00 0.00 H new ATOM 0 HB3 GLU A 143 133.349 18.511 26.736 1.00 0.00 H new ATOM 0 HG2 GLU A 143 134.855 20.838 27.137 1.00 0.00 H new ATOM 0 HG3 GLU A 143 134.882 20.670 25.393 1.00 0.00 H new ATOM 2386 N ARG A 144 133.663 17.608 28.990 1.00 0.00 N ATOM 2387 CA ARG A 144 133.056 16.593 29.897 1.00 0.00 C ATOM 2388 C ARG A 144 131.592 16.944 30.180 1.00 0.00 C ATOM 2389 O ARG A 144 130.755 16.068 30.037 1.00 0.00 O ATOM 2390 CB ARG A 144 133.882 16.665 31.183 1.00 0.00 C ATOM 2391 CG ARG A 144 134.049 18.127 31.602 1.00 0.00 C ATOM 2392 CD ARG A 144 134.963 18.205 32.827 1.00 0.00 C ATOM 2393 NE ARG A 144 134.054 18.052 33.995 1.00 0.00 N ATOM 2394 CZ ARG A 144 134.527 18.149 35.208 1.00 0.00 C ATOM 2395 NH1 ARG A 144 135.721 17.698 35.480 1.00 0.00 N ATOM 2396 NH2 ARG A 144 133.805 18.695 36.148 1.00 0.00 N ATOM 2397 OXT ARG A 144 131.333 18.083 30.533 1.00 0.00 O ATOM 0 H ARG A 144 133.124 18.467 28.877 1.00 0.00 H new ATOM 0 HA ARG A 144 133.065 15.594 29.462 1.00 0.00 H new ATOM 0 HB2 ARG A 144 133.389 16.102 31.976 1.00 0.00 H new ATOM 0 HB3 ARG A 144 134.859 16.207 31.027 1.00 0.00 H new ATOM 0 HG2 ARG A 144 134.473 18.706 30.781 1.00 0.00 H new ATOM 0 HG3 ARG A 144 133.077 18.564 31.832 1.00 0.00 H new ATOM 0 HD2 ARG A 144 135.717 17.418 32.808 1.00 0.00 H new ATOM 0 HD3 ARG A 144 135.495 19.156 32.863 1.00 0.00 H new ATOM 0 HE ARG A 144 133.061 17.871 33.848 1.00 0.00 H new ATOM 0 HH11 ARG A 144 136.284 17.270 34.745 1.00 0.00 H new ATOM 0 HH12 ARG A 144 136.091 17.774 36.427 1.00 0.00 H new ATOM 0 HH21 ARG A 144 132.871 19.046 35.935 1.00 0.00 H new ATOM 0 HH22 ARG A 144 134.174 18.771 37.096 1.00 0.00 H new TER 2411 ARG A 144