USER MOD reduce.3.24.130724 H: found=0, std=0, add=657, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 659 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 132 SER OG : rot 180:sc= -1.78 USER MOD Set 1.2: A 136 GLN : amide:sc= -0.765 K(o=-2.5,f=-0.055) USER MOD Set 2.1: A 82 GLN : amide:sc= -2.56! K(o=-2.7!,f=-1.3) USER MOD Set 2.2: A 83 GLN : amide:sc= -0.114 K(o=-2.7,f=-1.5) USER MOD Set 3.1: A 68 LYS NZ :NH3+ -119:sc= 0.585 (180deg=-0.0925) USER MOD Set 3.2: A 105 GLN : amide:sc= -10.6! C(o=-10!,f=-13!) USER MOD Set 4.1: A 60 HIS : no HD1:sc= -0.279 K(o=-0.28,f=-1.2) USER MOD Set 4.2: A 61 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 SER OG : rot -170:sc= 2.1 USER MOD Single : A 43 THR OG1 : rot 57:sc= -0.9! USER MOD Single : A 47 CYS SG : rot 180:sc= 0 USER MOD Single : A 51 SER OG : rot -46:sc= 0.0118 USER MOD Single : A 69 ASN : amide:sc= 0.708 K(o=0.71,f=0) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 79:sc= 1.29 USER MOD Single : A 74 CYS SG : rot -75:sc= 0.784 USER MOD Single : A 76 SER OG : rot -26:sc= 0.28 USER MOD Single : A 77 TYR OH : rot 15:sc= -0.895 USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 84 MET CE :methyl -171:sc=-0.00803 (180deg=-0.191) USER MOD Single : A 86 ASN : amide:sc= -11.3! C(o=-11!,f=-5.2!) USER MOD Single : A 87 LYS NZ :NH3+ -161:sc= 0.817 (180deg=0.585) USER MOD Single : A 95 ASN : amide:sc= -5.66! K(o=-5.7!,f=-2) USER MOD Single : A 96 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.037) USER MOD Single : A 99 ASN : amide:sc= -2.78! K(o=-2.8!,f=-1.8) USER MOD Single : A 100 ASN : amide:sc= -6.72! C(o=-6.7!,f=-3.5!) USER MOD Single : A 122 SER OG : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ -177:sc= -4.14! (180deg=-4.39!) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 74:sc= 0.339 USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 29 N ILE A 34 5.913 -8.861 1.357 1.00 0.39 N ATOM 30 CA ILE A 34 4.620 -8.285 1.013 1.00 0.25 C ATOM 31 C ILE A 34 3.483 -9.279 1.214 1.00 0.24 C ATOM 32 O ILE A 34 3.227 -10.134 0.367 1.00 0.25 O ATOM 33 CB ILE A 34 4.593 -7.772 -0.441 1.00 0.25 C ATOM 34 CG1 ILE A 34 5.670 -6.707 -0.652 1.00 0.29 C ATOM 35 CG2 ILE A 34 3.218 -7.213 -0.779 1.00 0.32 C ATOM 36 CD1 ILE A 34 5.523 -5.515 0.265 1.00 0.35 C ATOM 0 HA ILE A 34 4.474 -7.443 1.690 1.00 0.25 H new ATOM 0 HB ILE A 34 4.801 -8.609 -1.108 1.00 0.25 H new ATOM 0 HG12 ILE A 34 6.651 -7.157 -0.497 1.00 0.29 H new ATOM 0 HG13 ILE A 34 5.636 -6.366 -1.687 1.00 0.29 H new ATOM 0 HG21 ILE A 34 3.214 -6.855 -1.808 1.00 0.32 H new ATOM 0 HG22 ILE A 34 2.469 -7.996 -0.664 1.00 0.32 H new ATOM 0 HG23 ILE A 34 2.986 -6.387 -0.106 1.00 0.32 H new ATOM 0 HD11 ILE A 34 6.319 -4.799 0.062 1.00 0.35 H new ATOM 0 HD12 ILE A 34 4.556 -5.041 0.094 1.00 0.35 H new ATOM 0 HD13 ILE A 34 5.587 -5.844 1.302 1.00 0.35 H new ATOM 48 N THR A 35 2.808 -9.154 2.349 1.00 0.25 N ATOM 49 CA THR A 35 1.681 -10.012 2.676 1.00 0.26 C ATOM 50 C THR A 35 0.507 -9.167 3.150 1.00 0.23 C ATOM 51 O THR A 35 0.557 -7.941 3.072 1.00 0.31 O ATOM 52 CB THR A 35 2.047 -11.037 3.765 1.00 0.33 C ATOM 53 OG1 THR A 35 2.545 -10.362 4.927 1.00 0.36 O ATOM 54 CG2 THR A 35 3.093 -12.018 3.256 1.00 0.35 C ATOM 0 H THR A 35 3.026 -8.459 3.063 1.00 0.25 H new ATOM 0 HA THR A 35 1.406 -10.557 1.773 1.00 0.26 H new ATOM 0 HB THR A 35 1.146 -11.593 4.026 1.00 0.33 H new ATOM 0 HG1 THR A 35 2.774 -11.021 5.615 1.00 0.36 H new ATOM 0 HG21 THR A 35 3.335 -12.732 4.043 1.00 0.35 H new ATOM 0 HG22 THR A 35 2.701 -12.551 2.390 1.00 0.35 H new ATOM 0 HG23 THR A 35 3.993 -11.474 2.970 1.00 0.35 H new ATOM 62 N LYS A 36 -0.550 -9.809 3.634 1.00 0.18 N ATOM 63 CA LYS A 36 -1.709 -9.068 4.120 1.00 0.15 C ATOM 64 C LYS A 36 -1.335 -8.267 5.358 1.00 0.12 C ATOM 65 O LYS A 36 -1.864 -7.183 5.590 1.00 0.14 O ATOM 66 CB LYS A 36 -2.878 -10.012 4.409 1.00 0.20 C ATOM 67 CG LYS A 36 -3.806 -9.541 5.523 1.00 0.27 C ATOM 68 CD LYS A 36 -3.366 -10.064 6.887 1.00 0.61 C ATOM 69 CE LYS A 36 -3.555 -11.569 6.997 1.00 0.57 C ATOM 70 NZ LYS A 36 -3.214 -12.075 8.355 1.00 0.99 N ATOM 0 H LYS A 36 -0.630 -10.824 3.700 1.00 0.18 H new ATOM 0 HA LYS A 36 -2.030 -8.374 3.343 1.00 0.15 H new ATOM 0 HB2 LYS A 36 -3.461 -10.139 3.497 1.00 0.20 H new ATOM 0 HB3 LYS A 36 -2.481 -10.992 4.673 1.00 0.20 H new ATOM 0 HG2 LYS A 36 -3.828 -8.451 5.541 1.00 0.27 H new ATOM 0 HG3 LYS A 36 -4.822 -9.877 5.316 1.00 0.27 H new ATOM 0 HD2 LYS A 36 -2.318 -9.815 7.052 1.00 0.61 H new ATOM 0 HD3 LYS A 36 -3.938 -9.567 7.670 1.00 0.61 H new ATOM 0 HE2 LYS A 36 -4.589 -11.823 6.765 1.00 0.57 H new ATOM 0 HE3 LYS A 36 -2.930 -12.068 6.256 1.00 0.57 H new ATOM 0 HZ1 LYS A 36 -3.356 -13.105 8.388 1.00 0.99 H new ATOM 0 HZ2 LYS A 36 -2.220 -11.856 8.568 1.00 0.99 H new ATOM 0 HZ3 LYS A 36 -3.827 -11.618 9.060 1.00 0.99 H new ATOM 84 N GLY A 37 -0.430 -8.817 6.155 1.00 0.13 N ATOM 85 CA GLY A 37 0.023 -8.128 7.351 1.00 0.14 C ATOM 86 C GLY A 37 0.717 -6.826 7.007 1.00 0.14 C ATOM 87 O GLY A 37 0.460 -5.790 7.620 1.00 0.15 O ATOM 0 H GLY A 37 0.000 -9.728 5.997 1.00 0.13 H new ATOM 0 HA2 GLY A 37 -0.828 -7.928 8.002 1.00 0.14 H new ATOM 0 HA3 GLY A 37 0.706 -8.771 7.907 1.00 0.14 H new ATOM 91 N VAL A 38 1.603 -6.891 6.019 1.00 0.15 N ATOM 92 CA VAL A 38 2.334 -5.718 5.554 1.00 0.16 C ATOM 93 C VAL A 38 1.372 -4.755 4.878 1.00 0.15 C ATOM 94 O VAL A 38 1.461 -3.536 5.034 1.00 0.16 O ATOM 95 CB VAL A 38 3.438 -6.125 4.555 1.00 0.21 C ATOM 96 CG1 VAL A 38 4.048 -4.906 3.875 1.00 1.11 C ATOM 97 CG2 VAL A 38 4.509 -6.945 5.256 1.00 1.28 C ATOM 0 H VAL A 38 1.833 -7.751 5.521 1.00 0.15 H new ATOM 0 HA VAL A 38 2.800 -5.235 6.413 1.00 0.16 H new ATOM 0 HB VAL A 38 2.981 -6.740 3.779 1.00 0.21 H new ATOM 0 HG11 VAL A 38 4.822 -5.227 3.178 1.00 1.11 H new ATOM 0 HG12 VAL A 38 3.272 -4.366 3.332 1.00 1.11 H new ATOM 0 HG13 VAL A 38 4.487 -4.251 4.628 1.00 1.11 H new ATOM 0 HG21 VAL A 38 5.281 -7.225 4.539 1.00 1.28 H new ATOM 0 HG22 VAL A 38 4.954 -6.354 6.056 1.00 1.28 H new ATOM 0 HG23 VAL A 38 4.061 -7.845 5.676 1.00 1.28 H new ATOM 107 N VAL A 39 0.453 -5.334 4.121 1.00 0.14 N ATOM 108 CA VAL A 39 -0.557 -4.575 3.406 1.00 0.15 C ATOM 109 C VAL A 39 -1.435 -3.787 4.378 1.00 0.14 C ATOM 110 O VAL A 39 -1.743 -2.623 4.143 1.00 0.17 O ATOM 111 CB VAL A 39 -1.410 -5.514 2.519 1.00 0.15 C ATOM 112 CG1 VAL A 39 -2.891 -5.172 2.573 1.00 0.15 C ATOM 113 CG2 VAL A 39 -0.903 -5.468 1.088 1.00 0.17 C ATOM 0 H VAL A 39 0.388 -6.343 3.986 1.00 0.14 H new ATOM 0 HA VAL A 39 -0.055 -3.858 2.757 1.00 0.15 H new ATOM 0 HB VAL A 39 -1.306 -6.526 2.911 1.00 0.15 H new ATOM 0 HG11 VAL A 39 -3.447 -5.859 1.934 1.00 0.15 H new ATOM 0 HG12 VAL A 39 -3.248 -5.261 3.599 1.00 0.15 H new ATOM 0 HG13 VAL A 39 -3.041 -4.150 2.224 1.00 0.15 H new ATOM 0 HG21 VAL A 39 -1.506 -6.130 0.467 1.00 0.17 H new ATOM 0 HG22 VAL A 39 -0.976 -4.449 0.709 1.00 0.17 H new ATOM 0 HG23 VAL A 39 0.137 -5.792 1.060 1.00 0.17 H new ATOM 123 N LEU A 40 -1.833 -4.426 5.472 1.00 0.13 N ATOM 124 CA LEU A 40 -2.659 -3.767 6.472 1.00 0.14 C ATOM 125 C LEU A 40 -1.931 -2.563 7.058 1.00 0.14 C ATOM 126 O LEU A 40 -2.493 -1.473 7.153 1.00 0.15 O ATOM 127 CB LEU A 40 -3.047 -4.751 7.572 1.00 0.15 C ATOM 128 CG LEU A 40 -4.160 -5.724 7.186 1.00 0.16 C ATOM 129 CD1 LEU A 40 -4.137 -6.946 8.087 1.00 0.17 C ATOM 130 CD2 LEU A 40 -5.513 -5.036 7.257 1.00 0.21 C ATOM 0 H LEU A 40 -1.598 -5.395 5.687 1.00 0.13 H new ATOM 0 HA LEU A 40 -3.570 -3.412 5.991 1.00 0.14 H new ATOM 0 HB2 LEU A 40 -2.164 -5.323 7.859 1.00 0.15 H new ATOM 0 HB3 LEU A 40 -3.362 -4.189 8.451 1.00 0.15 H new ATOM 0 HG LEU A 40 -3.991 -6.051 6.160 1.00 0.16 H new ATOM 0 HD11 LEU A 40 -4.937 -7.627 7.797 1.00 0.17 H new ATOM 0 HD12 LEU A 40 -3.176 -7.452 7.990 1.00 0.17 H new ATOM 0 HD13 LEU A 40 -4.281 -6.637 9.122 1.00 0.17 H new ATOM 0 HD21 LEU A 40 -6.295 -5.742 6.979 1.00 0.21 H new ATOM 0 HD22 LEU A 40 -5.688 -4.682 8.273 1.00 0.21 H new ATOM 0 HD23 LEU A 40 -5.527 -4.190 6.570 1.00 0.21 H new ATOM 142 N ASP A 41 -0.681 -2.771 7.457 1.00 0.16 N ATOM 143 CA ASP A 41 0.131 -1.693 8.014 1.00 0.18 C ATOM 144 C ASP A 41 0.181 -0.512 7.048 1.00 0.18 C ATOM 145 O ASP A 41 0.244 0.645 7.465 1.00 0.20 O ATOM 146 CB ASP A 41 1.548 -2.190 8.309 1.00 0.18 C ATOM 147 CG ASP A 41 2.421 -1.115 8.926 1.00 0.20 C ATOM 148 OD1 ASP A 41 3.077 -0.373 8.164 1.00 0.21 O ATOM 149 OD2 ASP A 41 2.450 -1.015 10.170 1.00 0.24 O ATOM 0 H ASP A 41 -0.208 -3.673 7.406 1.00 0.16 H new ATOM 0 HA ASP A 41 -0.326 -1.364 8.947 1.00 0.18 H new ATOM 0 HB2 ASP A 41 1.497 -3.045 8.984 1.00 0.18 H new ATOM 0 HB3 ASP A 41 2.007 -2.541 7.385 1.00 0.18 H new ATOM 154 N SER A 42 0.152 -0.818 5.753 1.00 0.17 N ATOM 155 CA SER A 42 0.186 0.206 4.715 1.00 0.19 C ATOM 156 C SER A 42 -1.172 0.891 4.560 1.00 0.24 C ATOM 157 O SER A 42 -1.238 2.097 4.312 1.00 0.34 O ATOM 158 CB SER A 42 0.667 -0.404 3.399 1.00 0.21 C ATOM 159 OG SER A 42 2.047 -0.723 3.464 1.00 0.30 O ATOM 0 H SER A 42 0.105 -1.773 5.397 1.00 0.17 H new ATOM 0 HA SER A 42 0.893 0.980 5.012 1.00 0.19 H new ATOM 0 HB2 SER A 42 0.092 -1.303 3.179 1.00 0.21 H new ATOM 0 HB3 SER A 42 0.489 0.296 2.583 1.00 0.21 H new ATOM 0 HG SER A 42 2.371 -0.957 2.569 1.00 0.30 H new ATOM 165 N THR A 43 -2.250 0.131 4.732 1.00 0.20 N ATOM 166 CA THR A 43 -3.595 0.691 4.626 1.00 0.25 C ATOM 167 C THR A 43 -3.908 1.581 5.824 1.00 0.26 C ATOM 168 O THR A 43 -4.625 2.574 5.705 1.00 0.28 O ATOM 169 CB THR A 43 -4.666 -0.412 4.535 1.00 0.33 C ATOM 170 OG1 THR A 43 -4.166 -1.629 5.091 1.00 0.42 O ATOM 171 CG2 THR A 43 -5.096 -0.645 3.096 1.00 0.38 C ATOM 0 H THR A 43 -2.220 -0.866 4.944 1.00 0.20 H new ATOM 0 HA THR A 43 -3.618 1.282 3.710 1.00 0.25 H new ATOM 0 HB THR A 43 -5.536 -0.082 5.103 1.00 0.33 H new ATOM 0 HG1 THR A 43 -3.883 -1.474 6.016 1.00 0.42 H new ATOM 0 HG21 THR A 43 -5.853 -1.429 3.065 1.00 0.38 H new ATOM 0 HG22 THR A 43 -5.511 0.276 2.687 1.00 0.38 H new ATOM 0 HG23 THR A 43 -4.233 -0.949 2.503 1.00 0.38 H new ATOM 179 N GLU A 44 -3.364 1.214 6.982 1.00 0.25 N ATOM 180 CA GLU A 44 -3.578 1.973 8.206 1.00 0.27 C ATOM 181 C GLU A 44 -2.717 3.230 8.220 1.00 0.23 C ATOM 182 O GLU A 44 -3.206 4.323 8.503 1.00 0.21 O ATOM 183 CB GLU A 44 -3.260 1.110 9.423 1.00 0.31 C ATOM 184 CG GLU A 44 -4.152 1.394 10.613 1.00 0.65 C ATOM 185 CD GLU A 44 -3.839 0.508 11.804 1.00 0.79 C ATOM 186 OE1 GLU A 44 -4.371 -0.620 11.860 1.00 1.52 O ATOM 187 OE2 GLU A 44 -3.064 0.945 12.681 1.00 1.06 O ATOM 0 H GLU A 44 -2.770 0.392 7.096 1.00 0.25 H new ATOM 0 HA GLU A 44 -4.626 2.271 8.244 1.00 0.27 H new ATOM 0 HB2 GLU A 44 -3.356 0.059 9.149 1.00 0.31 H new ATOM 0 HB3 GLU A 44 -2.221 1.270 9.711 1.00 0.31 H new ATOM 0 HG2 GLU A 44 -4.041 2.439 10.904 1.00 0.65 H new ATOM 0 HG3 GLU A 44 -5.193 1.252 10.323 1.00 0.65 H new ATOM 194 N ALA A 45 -1.431 3.063 7.922 1.00 0.26 N ATOM 195 CA ALA A 45 -0.500 4.185 7.893 1.00 0.26 C ATOM 196 C ALA A 45 -1.055 5.333 7.058 1.00 0.23 C ATOM 197 O ALA A 45 -1.033 6.490 7.481 1.00 0.23 O ATOM 198 CB ALA A 45 0.849 3.739 7.349 1.00 0.28 C ATOM 0 H ALA A 45 -1.011 2.161 7.697 1.00 0.26 H new ATOM 0 HA ALA A 45 -0.366 4.542 8.914 1.00 0.26 H new ATOM 0 HB1 ALA A 45 1.533 4.587 7.333 1.00 0.28 H new ATOM 0 HB2 ALA A 45 1.257 2.955 7.987 1.00 0.28 H new ATOM 0 HB3 ALA A 45 0.724 3.355 6.337 1.00 0.28 H new ATOM 204 N LEU A 46 -1.560 5.008 5.870 1.00 0.22 N ATOM 205 CA LEU A 46 -2.131 6.027 5.000 1.00 0.21 C ATOM 206 C LEU A 46 -3.424 6.564 5.596 1.00 0.18 C ATOM 207 O LEU A 46 -3.702 7.760 5.512 1.00 0.16 O ATOM 208 CB LEU A 46 -2.361 5.488 3.585 1.00 0.23 C ATOM 209 CG LEU A 46 -3.397 4.373 3.451 1.00 0.23 C ATOM 210 CD1 LEU A 46 -4.794 4.956 3.303 1.00 0.21 C ATOM 211 CD2 LEU A 46 -3.063 3.499 2.257 1.00 0.30 C ATOM 0 H LEU A 46 -1.585 4.060 5.494 1.00 0.22 H new ATOM 0 HA LEU A 46 -1.417 6.847 4.924 1.00 0.21 H new ATOM 0 HB2 LEU A 46 -2.665 6.318 2.947 1.00 0.23 H new ATOM 0 HB3 LEU A 46 -1.410 5.121 3.199 1.00 0.23 H new ATOM 0 HG LEU A 46 -3.374 3.764 4.355 1.00 0.23 H new ATOM 0 HD11 LEU A 46 -5.518 4.147 3.209 1.00 0.21 H new ATOM 0 HD12 LEU A 46 -5.033 5.556 4.181 1.00 0.21 H new ATOM 0 HD13 LEU A 46 -4.834 5.584 2.413 1.00 0.21 H new ATOM 0 HD21 LEU A 46 -3.806 2.706 2.167 1.00 0.30 H new ATOM 0 HD22 LEU A 46 -3.067 4.104 1.351 1.00 0.30 H new ATOM 0 HD23 LEU A 46 -2.076 3.058 2.394 1.00 0.30 H new ATOM 223 N CYS A 47 -4.214 5.675 6.198 1.00 0.17 N ATOM 224 CA CYS A 47 -5.468 6.080 6.825 1.00 0.16 C ATOM 225 C CYS A 47 -5.204 7.176 7.848 1.00 0.16 C ATOM 226 O CYS A 47 -6.011 8.090 8.021 1.00 0.20 O ATOM 227 CB CYS A 47 -6.154 4.886 7.495 1.00 0.19 C ATOM 228 SG CYS A 47 -7.499 5.340 8.615 1.00 0.23 S ATOM 0 H CYS A 47 -4.009 4.678 6.264 1.00 0.17 H new ATOM 0 HA CYS A 47 -6.133 6.464 6.052 1.00 0.16 H new ATOM 0 HB2 CYS A 47 -6.547 4.226 6.722 1.00 0.19 H new ATOM 0 HB3 CYS A 47 -5.409 4.318 8.051 1.00 0.19 H new ATOM 0 HG CYS A 47 -8.017 4.264 9.130 1.00 0.23 H new ATOM 234 N LEU A 48 -4.063 7.075 8.524 1.00 0.17 N ATOM 235 CA LEU A 48 -3.676 8.069 9.512 1.00 0.18 C ATOM 236 C LEU A 48 -3.271 9.357 8.816 1.00 0.18 C ATOM 237 O LEU A 48 -3.499 10.451 9.332 1.00 0.23 O ATOM 238 CB LEU A 48 -2.533 7.545 10.385 1.00 0.21 C ATOM 239 CG LEU A 48 -2.971 6.876 11.692 1.00 0.23 C ATOM 240 CD1 LEU A 48 -4.085 5.870 11.437 1.00 1.20 C ATOM 241 CD2 LEU A 48 -1.787 6.203 12.365 1.00 1.14 C ATOM 0 H LEU A 48 -3.393 6.315 8.404 1.00 0.17 H new ATOM 0 HA LEU A 48 -4.529 8.272 10.160 1.00 0.18 H new ATOM 0 HB2 LEU A 48 -1.952 6.828 9.805 1.00 0.21 H new ATOM 0 HB3 LEU A 48 -1.869 8.375 10.624 1.00 0.21 H new ATOM 0 HG LEU A 48 -3.356 7.647 12.359 1.00 0.23 H new ATOM 0 HD11 LEU A 48 -4.380 5.407 12.379 1.00 1.20 H new ATOM 0 HD12 LEU A 48 -4.943 6.380 10.999 1.00 1.20 H new ATOM 0 HD13 LEU A 48 -3.731 5.101 10.750 1.00 1.20 H new ATOM 0 HD21 LEU A 48 -2.115 5.732 13.292 1.00 1.14 H new ATOM 0 HD22 LEU A 48 -1.373 5.445 11.700 1.00 1.14 H new ATOM 0 HD23 LEU A 48 -1.023 6.948 12.587 1.00 1.14 H new ATOM 253 N ALA A 49 -2.663 9.221 7.637 1.00 0.16 N ATOM 254 CA ALA A 49 -2.264 10.384 6.861 1.00 0.18 C ATOM 255 C ALA A 49 -3.491 11.222 6.549 1.00 0.18 C ATOM 256 O ALA A 49 -3.428 12.451 6.511 1.00 0.28 O ATOM 257 CB ALA A 49 -1.566 9.970 5.577 1.00 0.19 C ATOM 0 H ALA A 49 -2.440 8.324 7.206 1.00 0.16 H new ATOM 0 HA ALA A 49 -1.558 10.973 7.447 1.00 0.18 H new ATOM 0 HB1 ALA A 49 -1.278 10.859 5.016 1.00 0.19 H new ATOM 0 HB2 ALA A 49 -0.676 9.389 5.818 1.00 0.19 H new ATOM 0 HB3 ALA A 49 -2.242 9.364 4.974 1.00 0.19 H new ATOM 263 N ILE A 50 -4.613 10.539 6.326 1.00 0.12 N ATOM 264 CA ILE A 50 -5.867 11.217 6.049 1.00 0.14 C ATOM 265 C ILE A 50 -6.366 11.861 7.331 1.00 0.18 C ATOM 266 O ILE A 50 -6.986 12.925 7.314 1.00 0.21 O ATOM 267 CB ILE A 50 -6.960 10.264 5.515 1.00 0.14 C ATOM 268 CG1 ILE A 50 -6.364 9.129 4.680 1.00 0.15 C ATOM 269 CG2 ILE A 50 -7.947 11.050 4.674 1.00 0.17 C ATOM 270 CD1 ILE A 50 -7.374 8.069 4.294 1.00 0.18 C ATOM 0 H ILE A 50 -4.674 9.521 6.333 1.00 0.12 H new ATOM 0 HA ILE A 50 -5.673 11.959 5.274 1.00 0.14 H new ATOM 0 HB ILE A 50 -7.466 9.818 6.371 1.00 0.14 H new ATOM 0 HG12 ILE A 50 -5.924 9.547 3.775 1.00 0.15 H new ATOM 0 HG13 ILE A 50 -5.555 8.662 5.241 1.00 0.15 H new ATOM 0 HG21 ILE A 50 -8.719 10.379 4.297 1.00 0.17 H new ATOM 0 HG22 ILE A 50 -8.408 11.826 5.285 1.00 0.17 H new ATOM 0 HG23 ILE A 50 -7.425 11.510 3.835 1.00 0.17 H new ATOM 0 HD11 ILE A 50 -6.882 7.296 3.704 1.00 0.18 H new ATOM 0 HD12 ILE A 50 -7.797 7.624 5.195 1.00 0.18 H new ATOM 0 HD13 ILE A 50 -8.171 8.523 3.705 1.00 0.18 H new ATOM 282 N SER A 51 -6.084 11.191 8.444 1.00 0.25 N ATOM 283 CA SER A 51 -6.467 11.679 9.759 1.00 0.31 C ATOM 284 C SER A 51 -5.560 12.835 10.159 1.00 0.35 C ATOM 285 O SER A 51 -5.832 13.557 11.118 1.00 0.40 O ATOM 286 CB SER A 51 -6.362 10.553 10.792 1.00 0.35 C ATOM 287 OG SER A 51 -7.036 10.895 11.992 1.00 0.45 O ATOM 0 H SER A 51 -5.587 10.301 8.458 1.00 0.25 H new ATOM 0 HA SER A 51 -7.500 12.026 9.723 1.00 0.31 H new ATOM 0 HB2 SER A 51 -6.787 9.638 10.381 1.00 0.35 H new ATOM 0 HB3 SER A 51 -5.313 10.349 11.006 1.00 0.35 H new ATOM 0 HG SER A 51 -6.799 11.810 12.251 1.00 0.45 H new ATOM 293 N ARG A 52 -4.473 12.995 9.405 1.00 0.33 N ATOM 294 CA ARG A 52 -3.507 14.054 9.658 1.00 0.40 C ATOM 295 C ARG A 52 -3.920 15.345 8.966 1.00 0.41 C ATOM 296 O ARG A 52 -3.476 16.429 9.342 1.00 0.85 O ATOM 297 CB ARG A 52 -2.123 13.633 9.175 1.00 0.46 C ATOM 298 CG ARG A 52 -0.998 14.197 10.023 1.00 1.01 C ATOM 299 CD ARG A 52 0.329 14.102 9.300 1.00 1.09 C ATOM 300 NE ARG A 52 0.764 12.719 9.129 1.00 1.61 N ATOM 301 CZ ARG A 52 1.510 12.300 8.111 1.00 1.97 C ATOM 302 NH1 ARG A 52 1.895 13.154 7.171 1.00 1.88 N ATOM 303 NH2 ARG A 52 1.873 11.027 8.031 1.00 2.91 N ATOM 0 H ARG A 52 -4.242 12.399 8.610 1.00 0.33 H new ATOM 0 HA ARG A 52 -3.476 14.231 10.733 1.00 0.40 H new ATOM 0 HB2 ARG A 52 -2.060 12.545 9.176 1.00 0.46 H new ATOM 0 HB3 ARG A 52 -1.990 13.959 8.143 1.00 0.46 H new ATOM 0 HG2 ARG A 52 -1.209 15.238 10.267 1.00 1.01 H new ATOM 0 HG3 ARG A 52 -0.942 13.654 10.966 1.00 1.01 H new ATOM 0 HD2 ARG A 52 0.244 14.578 8.323 1.00 1.09 H new ATOM 0 HD3 ARG A 52 1.086 14.653 9.858 1.00 1.09 H new ATOM 0 HE ARG A 52 0.480 12.035 9.830 1.00 1.61 H new ATOM 0 HH11 ARG A 52 1.619 14.134 7.228 1.00 1.88 H new ATOM 0 HH12 ARG A 52 2.467 12.830 6.391 1.00 1.88 H new ATOM 0 HH21 ARG A 52 1.580 10.367 8.751 1.00 2.91 H new ATOM 0 HH22 ARG A 52 2.445 10.708 7.249 1.00 2.91 H new ATOM 412 N HIS A 60 -2.741 16.353 1.065 1.00 0.54 N ATOM 413 CA HIS A 60 -3.507 15.350 0.336 1.00 0.41 C ATOM 414 C HIS A 60 -2.560 14.374 -0.353 1.00 0.37 C ATOM 415 O HIS A 60 -2.932 13.243 -0.662 1.00 0.60 O ATOM 416 CB HIS A 60 -4.428 16.020 -0.694 1.00 0.56 C ATOM 417 CG HIS A 60 -3.861 16.072 -2.082 1.00 0.48 C ATOM 418 ND1 HIS A 60 -2.941 17.024 -2.451 1.00 1.10 N ATOM 419 CD2 HIS A 60 -4.115 15.268 -3.144 1.00 0.48 C ATOM 420 CE1 HIS A 60 -2.658 16.780 -3.718 1.00 1.30 C ATOM 421 NE2 HIS A 60 -3.345 15.725 -4.182 1.00 0.80 N ATOM 0 HA HIS A 60 -4.128 14.800 1.043 1.00 0.41 H new ATOM 0 HB2 HIS A 60 -5.376 15.483 -0.721 1.00 0.56 H new ATOM 0 HB3 HIS A 60 -4.646 17.036 -0.364 1.00 0.56 H new ATOM 0 HD2 HIS A 60 -4.794 14.428 -3.168 1.00 0.48 H new ATOM 0 HE1 HIS A 60 -1.961 17.358 -4.307 1.00 1.30 H new ATOM 0 HE2 HIS A 60 -3.303 15.338 -5.125 1.00 0.80 H new ATOM 429 N SER A 61 -1.332 14.829 -0.589 1.00 0.33 N ATOM 430 CA SER A 61 -0.319 14.007 -1.238 1.00 0.40 C ATOM 431 C SER A 61 0.259 12.988 -0.263 1.00 0.29 C ATOM 432 O SER A 61 1.092 12.165 -0.636 1.00 0.28 O ATOM 433 CB SER A 61 0.800 14.885 -1.800 1.00 0.58 C ATOM 434 OG SER A 61 0.300 15.791 -2.769 1.00 1.58 O ATOM 0 H SER A 61 -1.016 15.766 -0.339 1.00 0.33 H new ATOM 0 HA SER A 61 -0.794 13.470 -2.059 1.00 0.40 H new ATOM 0 HB2 SER A 61 1.273 15.439 -0.990 1.00 0.58 H new ATOM 0 HB3 SER A 61 1.569 14.256 -2.248 1.00 0.58 H new ATOM 0 HG SER A 61 1.035 16.342 -3.112 1.00 1.58 H new ATOM 440 N ALA A 62 -0.185 13.055 0.988 1.00 0.26 N ATOM 441 CA ALA A 62 0.280 12.130 2.013 1.00 0.24 C ATOM 442 C ALA A 62 -0.487 10.817 1.913 1.00 0.19 C ATOM 443 O ALA A 62 0.104 9.741 1.817 1.00 0.21 O ATOM 444 CB ALA A 62 0.115 12.748 3.394 1.00 0.33 C ATOM 0 H ALA A 62 -0.866 13.740 1.315 1.00 0.26 H new ATOM 0 HA ALA A 62 1.339 11.926 1.856 1.00 0.24 H new ATOM 0 HB1 ALA A 62 0.466 12.047 4.151 1.00 0.33 H new ATOM 0 HB2 ALA A 62 0.698 13.667 3.453 1.00 0.33 H new ATOM 0 HB3 ALA A 62 -0.937 12.973 3.568 1.00 0.33 H new ATOM 450 N VAL A 63 -1.809 10.924 1.939 1.00 0.18 N ATOM 451 CA VAL A 63 -2.684 9.761 1.824 1.00 0.16 C ATOM 452 C VAL A 63 -2.607 9.198 0.410 1.00 0.15 C ATOM 453 O VAL A 63 -2.812 8.009 0.182 1.00 0.18 O ATOM 454 CB VAL A 63 -4.150 10.124 2.165 1.00 0.17 C ATOM 455 CG1 VAL A 63 -4.458 11.560 1.775 1.00 0.21 C ATOM 456 CG2 VAL A 63 -5.127 9.171 1.491 1.00 0.19 C ATOM 0 H VAL A 63 -2.303 11.811 2.039 1.00 0.18 H new ATOM 0 HA VAL A 63 -2.347 9.010 2.538 1.00 0.16 H new ATOM 0 HB VAL A 63 -4.270 10.025 3.244 1.00 0.17 H new ATOM 0 HG11 VAL A 63 -5.494 11.791 2.025 1.00 0.21 H new ATOM 0 HG12 VAL A 63 -3.795 12.234 2.317 1.00 0.21 H new ATOM 0 HG13 VAL A 63 -4.306 11.686 0.703 1.00 0.21 H new ATOM 0 HG21 VAL A 63 -6.148 9.453 1.750 1.00 0.19 H new ATOM 0 HG22 VAL A 63 -5.000 9.224 0.410 1.00 0.19 H new ATOM 0 HG23 VAL A 63 -4.934 8.153 1.830 1.00 0.19 H new ATOM 466 N LEU A 64 -2.330 10.088 -0.528 1.00 0.16 N ATOM 467 CA LEU A 64 -2.196 9.739 -1.938 1.00 0.18 C ATOM 468 C LEU A 64 -0.902 8.970 -2.190 1.00 0.20 C ATOM 469 O LEU A 64 -0.922 7.884 -2.770 1.00 0.24 O ATOM 470 CB LEU A 64 -2.225 11.016 -2.790 1.00 0.17 C ATOM 471 CG LEU A 64 -2.790 10.862 -4.205 1.00 0.17 C ATOM 472 CD1 LEU A 64 -1.815 10.106 -5.094 1.00 0.23 C ATOM 473 CD2 LEU A 64 -4.141 10.159 -4.164 1.00 0.24 C ATOM 0 H LEU A 64 -2.190 11.080 -0.335 1.00 0.16 H new ATOM 0 HA LEU A 64 -3.031 9.097 -2.217 1.00 0.18 H new ATOM 0 HB2 LEU A 64 -2.814 11.767 -2.264 1.00 0.17 H new ATOM 0 HB3 LEU A 64 -1.209 11.403 -2.865 1.00 0.17 H new ATOM 0 HG LEU A 64 -2.933 11.856 -4.629 1.00 0.17 H new ATOM 0 HD11 LEU A 64 -2.236 10.008 -6.095 1.00 0.23 H new ATOM 0 HD12 LEU A 64 -0.873 10.653 -5.149 1.00 0.23 H new ATOM 0 HD13 LEU A 64 -1.636 9.115 -4.677 1.00 0.23 H new ATOM 0 HD21 LEU A 64 -4.529 10.057 -5.177 1.00 0.24 H new ATOM 0 HD22 LEU A 64 -4.024 9.171 -3.720 1.00 0.24 H new ATOM 0 HD23 LEU A 64 -4.838 10.745 -3.566 1.00 0.24 H new ATOM 485 N GLU A 65 0.223 9.540 -1.758 1.00 0.19 N ATOM 486 CA GLU A 65 1.524 8.895 -1.932 1.00 0.22 C ATOM 487 C GLU A 65 1.528 7.542 -1.237 1.00 0.20 C ATOM 488 O GLU A 65 1.903 6.523 -1.821 1.00 0.21 O ATOM 489 CB GLU A 65 2.638 9.781 -1.368 1.00 0.23 C ATOM 490 CG GLU A 65 4.021 9.160 -1.468 1.00 0.32 C ATOM 491 CD GLU A 65 5.102 10.055 -0.896 1.00 1.32 C ATOM 492 OE1 GLU A 65 5.635 10.897 -1.650 1.00 1.65 O ATOM 493 OE2 GLU A 65 5.416 9.916 0.304 1.00 2.32 O ATOM 0 H GLU A 65 0.260 10.444 -1.287 1.00 0.19 H new ATOM 0 HA GLU A 65 1.704 8.748 -2.997 1.00 0.22 H new ATOM 0 HB2 GLU A 65 2.637 10.733 -1.899 1.00 0.23 H new ATOM 0 HB3 GLU A 65 2.422 10.000 -0.322 1.00 0.23 H new ATOM 0 HG2 GLU A 65 4.026 8.206 -0.940 1.00 0.32 H new ATOM 0 HG3 GLU A 65 4.245 8.947 -2.513 1.00 0.32 H new ATOM 500 N ALA A 66 1.089 7.546 0.015 1.00 0.18 N ATOM 501 CA ALA A 66 1.013 6.321 0.788 1.00 0.16 C ATOM 502 C ALA A 66 -0.052 5.435 0.175 1.00 0.22 C ATOM 503 O ALA A 66 -0.004 4.208 0.274 1.00 0.29 O ATOM 504 CB ALA A 66 0.688 6.614 2.246 1.00 0.16 C ATOM 0 H ALA A 66 0.782 8.382 0.512 1.00 0.18 H new ATOM 0 HA ALA A 66 1.979 5.816 0.765 1.00 0.16 H new ATOM 0 HB1 ALA A 66 0.637 5.678 2.803 1.00 0.16 H new ATOM 0 HB2 ALA A 66 1.466 7.248 2.672 1.00 0.16 H new ATOM 0 HB3 ALA A 66 -0.272 7.126 2.309 1.00 0.16 H new ATOM 510 N GLY A 67 -1.016 6.087 -0.468 1.00 0.29 N ATOM 511 CA GLY A 67 -2.099 5.389 -1.117 1.00 0.40 C ATOM 512 C GLY A 67 -1.620 4.475 -2.227 1.00 0.26 C ATOM 513 O GLY A 67 -2.025 3.315 -2.308 1.00 0.25 O ATOM 0 H GLY A 67 -1.061 7.103 -0.549 1.00 0.29 H new ATOM 0 HA2 GLY A 67 -2.643 4.802 -0.377 1.00 0.40 H new ATOM 0 HA3 GLY A 67 -2.801 6.115 -1.527 1.00 0.40 H new ATOM 517 N LYS A 68 -0.752 5.007 -3.085 1.00 0.21 N ATOM 518 CA LYS A 68 -0.214 4.250 -4.207 1.00 0.15 C ATOM 519 C LYS A 68 0.656 3.100 -3.728 1.00 0.16 C ATOM 520 O LYS A 68 0.593 1.998 -4.273 1.00 0.21 O ATOM 521 CB LYS A 68 0.591 5.162 -5.132 1.00 0.18 C ATOM 522 CG LYS A 68 -0.220 5.721 -6.290 1.00 0.66 C ATOM 523 CD LYS A 68 -1.301 6.668 -5.812 1.00 0.65 C ATOM 524 CE LYS A 68 -2.316 6.953 -6.906 1.00 0.73 C ATOM 525 NZ LYS A 68 -1.675 7.499 -8.135 1.00 0.83 N ATOM 0 H LYS A 68 -0.406 5.965 -3.022 1.00 0.21 H new ATOM 0 HA LYS A 68 -1.056 3.835 -4.761 1.00 0.15 H new ATOM 0 HB2 LYS A 68 0.996 5.990 -4.550 1.00 0.18 H new ATOM 0 HB3 LYS A 68 1.440 4.605 -5.529 1.00 0.18 H new ATOM 0 HG2 LYS A 68 0.443 6.244 -6.979 1.00 0.66 H new ATOM 0 HG3 LYS A 68 -0.675 4.901 -6.845 1.00 0.66 H new ATOM 0 HD2 LYS A 68 -1.807 6.237 -4.948 1.00 0.65 H new ATOM 0 HD3 LYS A 68 -0.847 7.603 -5.483 1.00 0.65 H new ATOM 0 HE2 LYS A 68 -2.850 6.035 -7.153 1.00 0.73 H new ATOM 0 HE3 LYS A 68 -3.056 7.663 -6.537 1.00 0.73 H new ATOM 0 HZ1 LYS A 68 -2.052 8.448 -8.331 1.00 0.83 H new ATOM 0 HZ2 LYS A 68 -0.646 7.557 -7.993 1.00 0.83 H new ATOM 0 HZ3 LYS A 68 -1.879 6.873 -8.940 1.00 0.83 H new ATOM 539 N ASN A 69 1.469 3.357 -2.710 1.00 0.16 N ATOM 540 CA ASN A 69 2.345 2.332 -2.163 1.00 0.19 C ATOM 541 C ASN A 69 1.541 1.129 -1.678 1.00 0.20 C ATOM 542 O ASN A 69 1.910 -0.017 -1.923 1.00 0.23 O ATOM 543 CB ASN A 69 3.164 2.910 -1.008 1.00 0.21 C ATOM 544 CG ASN A 69 4.431 3.597 -1.480 1.00 0.25 C ATOM 545 OD1 ASN A 69 5.479 2.966 -1.617 1.00 0.53 O ATOM 546 ND2 ASN A 69 4.341 4.898 -1.725 1.00 0.30 N ATOM 0 H ASN A 69 1.539 4.264 -2.249 1.00 0.16 H new ATOM 0 HA ASN A 69 3.018 1.999 -2.953 1.00 0.19 H new ATOM 0 HB2 ASN A 69 2.553 3.623 -0.455 1.00 0.21 H new ATOM 0 HB3 ASN A 69 3.425 2.109 -0.316 1.00 0.21 H new ATOM 0 HD21 ASN A 69 5.161 5.415 -2.041 1.00 0.30 H new ATOM 0 HD22 ASN A 69 3.451 5.381 -1.598 1.00 0.30 H new ATOM 553 N LEU A 70 0.434 1.405 -0.998 1.00 0.20 N ATOM 554 CA LEU A 70 -0.427 0.353 -0.468 1.00 0.21 C ATOM 555 C LEU A 70 -1.050 -0.464 -1.591 1.00 0.19 C ATOM 556 O LEU A 70 -0.999 -1.695 -1.572 1.00 0.21 O ATOM 557 CB LEU A 70 -1.531 0.988 0.369 1.00 0.24 C ATOM 558 CG LEU A 70 -2.531 0.035 1.047 1.00 0.28 C ATOM 559 CD1 LEU A 70 -3.495 -0.550 0.054 1.00 1.00 C ATOM 560 CD2 LEU A 70 -1.833 -1.087 1.778 1.00 1.41 C ATOM 0 H LEU A 70 0.110 2.352 -0.800 1.00 0.20 H new ATOM 0 HA LEU A 70 0.177 -0.315 0.146 1.00 0.21 H new ATOM 0 HB2 LEU A 70 -1.062 1.594 1.144 1.00 0.24 H new ATOM 0 HB3 LEU A 70 -2.093 1.668 -0.271 1.00 0.24 H new ATOM 0 HG LEU A 70 -3.082 0.636 1.770 1.00 0.28 H new ATOM 0 HD11 LEU A 70 -4.186 -1.218 0.568 1.00 1.00 H new ATOM 0 HD12 LEU A 70 -4.055 0.253 -0.426 1.00 1.00 H new ATOM 0 HD13 LEU A 70 -2.944 -1.110 -0.702 1.00 1.00 H new ATOM 0 HD21 LEU A 70 -2.575 -1.736 2.242 1.00 1.41 H new ATOM 0 HD22 LEU A 70 -1.236 -1.665 1.073 1.00 1.41 H new ATOM 0 HD23 LEU A 70 -1.183 -0.671 2.548 1.00 1.41 H new ATOM 572 N TYR A 71 -1.646 0.222 -2.567 1.00 0.15 N ATOM 573 CA TYR A 71 -2.268 -0.466 -3.690 1.00 0.14 C ATOM 574 C TYR A 71 -1.230 -1.348 -4.354 1.00 0.14 C ATOM 575 O TYR A 71 -1.537 -2.423 -4.868 1.00 0.16 O ATOM 576 CB TYR A 71 -2.852 0.531 -4.705 1.00 0.14 C ATOM 577 CG TYR A 71 -3.033 -0.052 -6.091 1.00 0.13 C ATOM 578 CD1 TYR A 71 -4.210 -0.697 -6.446 1.00 0.75 C ATOM 579 CD2 TYR A 71 -2.021 0.035 -7.043 1.00 0.71 C ATOM 580 CE1 TYR A 71 -4.377 -1.238 -7.707 1.00 0.75 C ATOM 581 CE2 TYR A 71 -2.180 -0.504 -8.304 1.00 0.72 C ATOM 582 CZ TYR A 71 -3.359 -1.140 -8.632 1.00 0.16 C ATOM 583 OH TYR A 71 -3.522 -1.678 -9.887 1.00 0.19 O ATOM 0 H TYR A 71 -1.709 1.239 -2.600 1.00 0.15 H new ATOM 0 HA TYR A 71 -3.094 -1.074 -3.321 1.00 0.14 H new ATOM 0 HB2 TYR A 71 -3.816 0.886 -4.340 1.00 0.14 H new ATOM 0 HB3 TYR A 71 -2.196 1.399 -4.768 1.00 0.14 H new ATOM 0 HD1 TYR A 71 -5.009 -0.777 -5.724 1.00 0.75 H new ATOM 0 HD2 TYR A 71 -1.096 0.532 -6.791 1.00 0.71 H new ATOM 0 HE1 TYR A 71 -5.300 -1.735 -7.966 1.00 0.75 H new ATOM 0 HE2 TYR A 71 -1.385 -0.428 -9.031 1.00 0.72 H new ATOM 0 HH TYR A 71 -2.713 -1.522 -10.417 1.00 0.19 H new ATOM 593 N SER A 72 0.006 -0.874 -4.329 1.00 0.14 N ATOM 594 CA SER A 72 1.112 -1.605 -4.913 1.00 0.17 C ATOM 595 C SER A 72 1.359 -2.908 -4.167 1.00 0.13 C ATOM 596 O SER A 72 1.452 -3.965 -4.793 1.00 0.32 O ATOM 597 CB SER A 72 2.382 -0.753 -4.915 1.00 0.29 C ATOM 598 OG SER A 72 2.216 0.409 -5.709 1.00 1.13 O ATOM 0 H SER A 72 0.266 0.018 -3.908 1.00 0.14 H new ATOM 0 HA SER A 72 0.847 -1.842 -5.943 1.00 0.17 H new ATOM 0 HB2 SER A 72 2.633 -0.466 -3.894 1.00 0.29 H new ATOM 0 HB3 SER A 72 3.217 -1.341 -5.295 1.00 0.29 H new ATOM 0 HG SER A 72 1.708 1.079 -5.206 1.00 1.13 H new ATOM 604 N PHE A 73 1.474 -2.857 -2.835 1.00 0.20 N ATOM 605 CA PHE A 73 1.729 -4.077 -2.067 1.00 0.17 C ATOM 606 C PHE A 73 0.598 -5.081 -2.218 1.00 0.13 C ATOM 607 O PHE A 73 0.836 -6.274 -2.403 1.00 0.15 O ATOM 608 CB PHE A 73 1.918 -3.748 -0.584 1.00 0.24 C ATOM 609 CG PHE A 73 2.841 -2.590 -0.324 1.00 0.24 C ATOM 610 CD1 PHE A 73 4.098 -2.536 -0.907 1.00 0.27 C ATOM 611 CD2 PHE A 73 2.449 -1.555 0.509 1.00 0.23 C ATOM 612 CE1 PHE A 73 4.945 -1.472 -0.663 1.00 0.28 C ATOM 613 CE2 PHE A 73 3.290 -0.488 0.757 1.00 0.23 C ATOM 614 CZ PHE A 73 4.540 -0.445 0.169 1.00 0.26 C ATOM 0 H PHE A 73 1.397 -2.005 -2.279 1.00 0.20 H new ATOM 0 HA PHE A 73 2.642 -4.522 -2.463 1.00 0.17 H new ATOM 0 HB2 PHE A 73 0.945 -3.529 -0.145 1.00 0.24 H new ATOM 0 HB3 PHE A 73 2.306 -4.630 -0.074 1.00 0.24 H new ATOM 0 HD1 PHE A 73 4.419 -3.335 -1.559 1.00 0.27 H new ATOM 0 HD2 PHE A 73 1.473 -1.583 0.971 1.00 0.23 H new ATOM 0 HE1 PHE A 73 5.922 -1.443 -1.122 1.00 0.28 H new ATOM 0 HE2 PHE A 73 2.971 0.312 1.409 1.00 0.23 H new ATOM 0 HZ PHE A 73 5.199 0.389 0.359 1.00 0.26 H new ATOM 624 N CYS A 74 -0.631 -4.594 -2.147 1.00 0.15 N ATOM 625 CA CYS A 74 -1.798 -5.449 -2.275 1.00 0.20 C ATOM 626 C CYS A 74 -1.812 -6.153 -3.632 1.00 0.16 C ATOM 627 O CYS A 74 -1.964 -7.373 -3.709 1.00 0.27 O ATOM 628 CB CYS A 74 -3.061 -4.611 -2.100 1.00 0.31 C ATOM 629 SG CYS A 74 -4.039 -5.039 -0.643 1.00 0.90 S ATOM 0 H CYS A 74 -0.845 -3.608 -2.001 1.00 0.15 H new ATOM 0 HA CYS A 74 -1.760 -6.215 -1.501 1.00 0.20 H new ATOM 0 HB2 CYS A 74 -2.780 -3.560 -2.039 1.00 0.31 H new ATOM 0 HB3 CYS A 74 -3.684 -4.723 -2.987 1.00 0.31 H new ATOM 0 HG CYS A 74 -4.680 -6.149 -0.861 1.00 0.90 H new ATOM 635 N VAL A 75 -1.656 -5.371 -4.698 1.00 0.25 N ATOM 636 CA VAL A 75 -1.647 -5.889 -6.054 1.00 0.28 C ATOM 637 C VAL A 75 -0.602 -6.984 -6.255 1.00 0.27 C ATOM 638 O VAL A 75 -0.838 -7.949 -6.982 1.00 0.29 O ATOM 639 CB VAL A 75 -1.400 -4.742 -7.054 1.00 0.37 C ATOM 640 CG1 VAL A 75 0.033 -4.718 -7.568 1.00 0.38 C ATOM 641 CG2 VAL A 75 -2.376 -4.850 -8.191 1.00 0.43 C ATOM 0 H VAL A 75 -1.533 -4.360 -4.640 1.00 0.25 H new ATOM 0 HA VAL A 75 -2.625 -6.336 -6.233 1.00 0.28 H new ATOM 0 HB VAL A 75 -1.555 -3.799 -6.529 1.00 0.37 H new ATOM 0 HG11 VAL A 75 0.154 -3.892 -8.269 1.00 0.38 H new ATOM 0 HG12 VAL A 75 0.718 -4.587 -6.730 1.00 0.38 H new ATOM 0 HG13 VAL A 75 0.254 -5.658 -8.074 1.00 0.38 H new ATOM 0 HG21 VAL A 75 -2.202 -4.039 -8.898 1.00 0.43 H new ATOM 0 HG22 VAL A 75 -2.242 -5.807 -8.696 1.00 0.43 H new ATOM 0 HG23 VAL A 75 -3.393 -4.782 -7.805 1.00 0.43 H new ATOM 651 N SER A 76 0.553 -6.828 -5.628 1.00 0.27 N ATOM 652 CA SER A 76 1.614 -7.812 -5.763 1.00 0.28 C ATOM 653 C SER A 76 1.445 -8.937 -4.745 1.00 0.23 C ATOM 654 O SER A 76 2.123 -9.962 -4.813 1.00 0.26 O ATOM 655 CB SER A 76 2.982 -7.147 -5.590 1.00 0.32 C ATOM 656 OG SER A 76 4.033 -8.081 -5.775 1.00 0.90 O ATOM 0 H SER A 76 0.778 -6.036 -5.026 1.00 0.27 H new ATOM 0 HA SER A 76 1.553 -8.241 -6.763 1.00 0.28 H new ATOM 0 HB2 SER A 76 3.086 -6.332 -6.306 1.00 0.32 H new ATOM 0 HB3 SER A 76 3.053 -6.708 -4.595 1.00 0.32 H new ATOM 0 HG SER A 76 3.712 -8.982 -5.561 1.00 0.90 H new ATOM 662 N TYR A 77 0.531 -8.732 -3.804 1.00 0.18 N ATOM 663 CA TYR A 77 0.263 -9.713 -2.757 1.00 0.16 C ATOM 664 C TYR A 77 -0.860 -10.677 -3.155 1.00 0.17 C ATOM 665 O TYR A 77 -0.934 -11.796 -2.644 1.00 0.20 O ATOM 666 CB TYR A 77 -0.069 -8.975 -1.453 1.00 0.16 C ATOM 667 CG TYR A 77 -1.099 -9.654 -0.587 1.00 0.15 C ATOM 668 CD1 TYR A 77 -0.753 -10.700 0.256 1.00 0.17 C ATOM 669 CD2 TYR A 77 -2.421 -9.242 -0.617 1.00 0.20 C ATOM 670 CE1 TYR A 77 -1.701 -11.316 1.046 1.00 0.19 C ATOM 671 CE2 TYR A 77 -3.372 -9.850 0.169 1.00 0.22 C ATOM 672 CZ TYR A 77 -3.009 -10.889 1.000 1.00 0.21 C ATOM 673 OH TYR A 77 -3.958 -11.500 1.786 1.00 0.25 O ATOM 0 H TYR A 77 -0.041 -7.890 -3.744 1.00 0.18 H new ATOM 0 HA TYR A 77 1.154 -10.323 -2.609 1.00 0.16 H new ATOM 0 HB2 TYR A 77 0.848 -8.855 -0.876 1.00 0.16 H new ATOM 0 HB3 TYR A 77 -0.424 -7.974 -1.699 1.00 0.16 H new ATOM 0 HD1 TYR A 77 0.273 -11.037 0.294 1.00 0.17 H new ATOM 0 HD2 TYR A 77 -2.710 -8.430 -1.268 1.00 0.20 H new ATOM 0 HE1 TYR A 77 -1.419 -12.130 1.698 1.00 0.19 H new ATOM 0 HE2 TYR A 77 -4.398 -9.515 0.136 1.00 0.22 H new ATOM 0 HH TYR A 77 -3.515 -12.037 2.475 1.00 0.25 H new ATOM 683 N VAL A 78 -1.726 -10.250 -4.073 1.00 0.19 N ATOM 684 CA VAL A 78 -2.833 -11.094 -4.524 1.00 0.25 C ATOM 685 C VAL A 78 -2.345 -12.229 -5.415 1.00 0.27 C ATOM 686 O VAL A 78 -3.093 -13.155 -5.727 1.00 0.25 O ATOM 687 CB VAL A 78 -3.910 -10.294 -5.278 1.00 0.33 C ATOM 688 CG1 VAL A 78 -4.865 -9.650 -4.298 1.00 0.98 C ATOM 689 CG2 VAL A 78 -3.281 -9.249 -6.186 1.00 0.72 C ATOM 0 H VAL A 78 -1.684 -9.332 -4.516 1.00 0.19 H new ATOM 0 HA VAL A 78 -3.278 -11.509 -3.619 1.00 0.25 H new ATOM 0 HB VAL A 78 -4.471 -10.985 -5.908 1.00 0.33 H new ATOM 0 HG11 VAL A 78 -5.622 -9.087 -4.844 1.00 0.98 H new ATOM 0 HG12 VAL A 78 -5.348 -10.422 -3.700 1.00 0.98 H new ATOM 0 HG13 VAL A 78 -4.314 -8.976 -3.643 1.00 0.98 H new ATOM 0 HG21 VAL A 78 -4.065 -8.699 -6.706 1.00 0.72 H new ATOM 0 HG22 VAL A 78 -2.688 -8.557 -5.588 1.00 0.72 H new ATOM 0 HG23 VAL A 78 -2.638 -9.741 -6.916 1.00 0.72 H new ATOM 699 N ASP A 79 -1.091 -12.147 -5.829 1.00 0.36 N ATOM 700 CA ASP A 79 -0.499 -13.178 -6.668 1.00 0.41 C ATOM 701 C ASP A 79 -0.263 -14.437 -5.844 1.00 0.43 C ATOM 702 O ASP A 79 0.168 -15.467 -6.362 1.00 0.51 O ATOM 703 CB ASP A 79 0.820 -12.684 -7.269 1.00 0.48 C ATOM 704 CG ASP A 79 1.419 -13.674 -8.247 1.00 0.68 C ATOM 705 OD1 ASP A 79 1.022 -13.653 -9.432 1.00 1.31 O ATOM 706 OD2 ASP A 79 2.288 -14.469 -7.831 1.00 0.93 O ATOM 0 H ASP A 79 -0.463 -11.377 -5.598 1.00 0.36 H new ATOM 0 HA ASP A 79 -1.185 -13.408 -7.484 1.00 0.41 H new ATOM 0 HB2 ASP A 79 0.651 -11.734 -7.776 1.00 0.48 H new ATOM 0 HB3 ASP A 79 1.533 -12.495 -6.466 1.00 0.48 H new ATOM 711 N SER A 80 -0.557 -14.337 -4.550 1.00 0.41 N ATOM 712 CA SER A 80 -0.383 -15.448 -3.633 1.00 0.46 C ATOM 713 C SER A 80 -1.726 -15.993 -3.155 1.00 0.42 C ATOM 714 O SER A 80 -1.769 -16.916 -2.342 1.00 0.46 O ATOM 715 CB SER A 80 0.452 -15.006 -2.434 1.00 0.52 C ATOM 716 OG SER A 80 1.785 -14.717 -2.817 1.00 1.49 O ATOM 0 H SER A 80 -0.919 -13.488 -4.115 1.00 0.41 H new ATOM 0 HA SER A 80 0.134 -16.246 -4.166 1.00 0.46 H new ATOM 0 HB2 SER A 80 0.002 -14.123 -1.980 1.00 0.52 H new ATOM 0 HB3 SER A 80 0.450 -15.790 -1.677 1.00 0.52 H new ATOM 0 HG SER A 80 2.297 -14.435 -2.031 1.00 1.49 H new ATOM 722 N ILE A 81 -2.825 -15.426 -3.656 1.00 0.38 N ATOM 723 CA ILE A 81 -4.148 -15.893 -3.256 1.00 0.38 C ATOM 724 C ILE A 81 -4.377 -17.316 -3.756 1.00 0.51 C ATOM 725 O ILE A 81 -4.420 -17.558 -4.963 1.00 1.39 O ATOM 726 CB ILE A 81 -5.303 -15.016 -3.795 1.00 0.29 C ATOM 727 CG1 ILE A 81 -5.148 -13.530 -3.442 1.00 0.33 C ATOM 728 CG2 ILE A 81 -6.626 -15.535 -3.258 1.00 0.40 C ATOM 729 CD1 ILE A 81 -4.822 -13.255 -1.987 1.00 0.56 C ATOM 0 H ILE A 81 -2.825 -14.657 -4.327 1.00 0.38 H new ATOM 0 HA ILE A 81 -4.160 -15.841 -2.167 1.00 0.38 H new ATOM 0 HB ILE A 81 -5.276 -15.085 -4.882 1.00 0.29 H new ATOM 0 HG12 ILE A 81 -4.361 -13.103 -4.064 1.00 0.33 H new ATOM 0 HG13 ILE A 81 -6.072 -13.012 -3.697 1.00 0.33 H new ATOM 0 HG21 ILE A 81 -7.440 -14.917 -3.637 1.00 0.40 H new ATOM 0 HG22 ILE A 81 -6.771 -16.566 -3.582 1.00 0.40 H new ATOM 0 HG23 ILE A 81 -6.617 -15.495 -2.169 1.00 0.40 H new ATOM 0 HD11 ILE A 81 -4.731 -12.180 -1.831 1.00 0.56 H new ATOM 0 HD12 ILE A 81 -5.619 -13.647 -1.355 1.00 0.56 H new ATOM 0 HD13 ILE A 81 -3.881 -13.740 -1.727 1.00 0.56 H new ATOM 741 N GLN A 82 -4.526 -18.256 -2.829 1.00 0.92 N ATOM 742 CA GLN A 82 -4.762 -19.639 -3.176 1.00 0.92 C ATOM 743 C GLN A 82 -6.248 -19.872 -3.417 1.00 0.93 C ATOM 744 O GLN A 82 -6.636 -20.744 -4.190 1.00 1.11 O ATOM 745 CB GLN A 82 -4.260 -20.543 -2.047 1.00 0.98 C ATOM 746 CG GLN A 82 -4.851 -21.935 -2.088 1.00 1.54 C ATOM 747 CD GLN A 82 -6.052 -22.100 -1.172 1.00 1.78 C ATOM 748 OE1 GLN A 82 -5.906 -22.428 0.006 1.00 2.55 O ATOM 749 NE2 GLN A 82 -7.247 -21.880 -1.713 1.00 1.43 N ATOM 0 H GLN A 82 -4.486 -18.076 -1.826 1.00 0.92 H new ATOM 0 HA GLN A 82 -4.221 -19.878 -4.092 1.00 0.92 H new ATOM 0 HB2 GLN A 82 -3.174 -20.615 -2.104 1.00 0.98 H new ATOM 0 HB3 GLN A 82 -4.499 -20.082 -1.088 1.00 0.98 H new ATOM 0 HG2 GLN A 82 -5.147 -22.167 -3.111 1.00 1.54 H new ATOM 0 HG3 GLN A 82 -4.085 -22.657 -1.806 1.00 1.54 H new ATOM 0 HE21 GLN A 82 -7.321 -21.610 -2.694 1.00 1.43 H new ATOM 0 HE22 GLN A 82 -8.090 -21.981 -1.147 1.00 1.43 H new ATOM 758 N GLN A 83 -7.063 -19.079 -2.735 1.00 0.85 N ATOM 759 CA GLN A 83 -8.509 -19.159 -2.822 1.00 0.93 C ATOM 760 C GLN A 83 -9.021 -19.249 -4.265 1.00 0.96 C ATOM 761 O GLN A 83 -9.877 -20.081 -4.563 1.00 1.85 O ATOM 762 CB GLN A 83 -9.091 -17.951 -2.109 1.00 0.93 C ATOM 763 CG GLN A 83 -9.034 -18.068 -0.596 1.00 1.39 C ATOM 764 CD GLN A 83 -9.954 -19.145 -0.063 1.00 2.06 C ATOM 765 OE1 GLN A 83 -9.554 -20.298 0.098 1.00 2.56 O ATOM 766 NE2 GLN A 83 -11.199 -18.774 0.211 1.00 2.55 N ATOM 0 H GLN A 83 -6.731 -18.354 -2.099 1.00 0.85 H new ATOM 0 HA GLN A 83 -8.835 -20.082 -2.343 1.00 0.93 H new ATOM 0 HB2 GLN A 83 -8.549 -17.058 -2.419 1.00 0.93 H new ATOM 0 HB3 GLN A 83 -10.128 -17.818 -2.418 1.00 0.93 H new ATOM 0 HG2 GLN A 83 -8.011 -18.285 -0.290 1.00 1.39 H new ATOM 0 HG3 GLN A 83 -9.304 -17.111 -0.150 1.00 1.39 H new ATOM 0 HE21 GLN A 83 -11.487 -17.807 0.062 1.00 2.55 H new ATOM 0 HE22 GLN A 83 -11.867 -19.456 0.570 1.00 2.55 H new ATOM 775 N MET A 84 -8.503 -18.384 -5.143 1.00 0.95 N ATOM 776 CA MET A 84 -8.886 -18.365 -6.567 1.00 0.91 C ATOM 777 C MET A 84 -10.191 -17.602 -6.820 1.00 0.86 C ATOM 778 O MET A 84 -10.176 -16.394 -7.051 1.00 0.93 O ATOM 779 CB MET A 84 -9.007 -19.785 -7.135 1.00 1.14 C ATOM 780 CG MET A 84 -7.789 -20.653 -6.887 1.00 1.34 C ATOM 781 SD MET A 84 -7.764 -22.132 -7.920 1.00 1.97 S ATOM 782 CE MET A 84 -9.276 -22.938 -7.397 1.00 2.71 C ATOM 0 H MET A 84 -7.810 -17.679 -4.893 1.00 0.95 H new ATOM 0 HA MET A 84 -8.083 -17.837 -7.082 1.00 0.91 H new ATOM 0 HB2 MET A 84 -9.880 -20.268 -6.696 1.00 1.14 H new ATOM 0 HB3 MET A 84 -9.183 -19.722 -8.209 1.00 1.14 H new ATOM 0 HG2 MET A 84 -6.888 -20.069 -7.074 1.00 1.34 H new ATOM 0 HG3 MET A 84 -7.766 -20.947 -5.838 1.00 1.34 H new ATOM 0 HE1 MET A 84 -9.322 -23.939 -7.826 1.00 2.71 H new ATOM 0 HE2 MET A 84 -9.294 -23.008 -6.309 1.00 2.71 H new ATOM 0 HE3 MET A 84 -10.134 -22.358 -7.737 1.00 2.71 H new ATOM 792 N ARG A 85 -11.317 -18.317 -6.787 1.00 0.91 N ATOM 793 CA ARG A 85 -12.631 -17.713 -7.037 1.00 0.92 C ATOM 794 C ARG A 85 -12.997 -16.690 -5.963 1.00 0.87 C ATOM 795 O ARG A 85 -14.073 -16.092 -6.000 1.00 1.16 O ATOM 796 CB ARG A 85 -13.703 -18.802 -7.109 1.00 1.03 C ATOM 797 CG ARG A 85 -13.753 -19.689 -5.876 1.00 1.44 C ATOM 798 CD ARG A 85 -14.713 -20.854 -6.067 1.00 1.51 C ATOM 799 NE ARG A 85 -14.765 -21.718 -4.891 1.00 1.72 N ATOM 800 CZ ARG A 85 -15.315 -22.928 -4.887 1.00 1.89 C ATOM 801 NH1 ARG A 85 -15.856 -23.419 -5.996 1.00 1.65 N ATOM 802 NH2 ARG A 85 -15.325 -23.651 -3.775 1.00 2.78 N ATOM 0 H ARG A 85 -11.347 -19.317 -6.589 1.00 0.91 H new ATOM 0 HA ARG A 85 -12.579 -17.189 -7.991 1.00 0.92 H new ATOM 0 HB2 ARG A 85 -14.677 -18.333 -7.248 1.00 1.03 H new ATOM 0 HB3 ARG A 85 -13.520 -19.423 -7.986 1.00 1.03 H new ATOM 0 HG2 ARG A 85 -12.755 -20.070 -5.660 1.00 1.44 H new ATOM 0 HG3 ARG A 85 -14.063 -19.098 -5.014 1.00 1.44 H new ATOM 0 HD2 ARG A 85 -15.711 -20.470 -6.280 1.00 1.51 H new ATOM 0 HD3 ARG A 85 -14.405 -21.439 -6.934 1.00 1.51 H new ATOM 0 HE ARG A 85 -14.356 -21.373 -4.023 1.00 1.72 H new ATOM 0 HH11 ARG A 85 -15.850 -22.867 -6.854 1.00 1.65 H new ATOM 0 HH12 ARG A 85 -16.277 -24.348 -5.990 1.00 1.65 H new ATOM 0 HH21 ARG A 85 -14.910 -23.279 -2.921 1.00 2.78 H new ATOM 0 HH22 ARG A 85 -15.748 -24.579 -3.774 1.00 2.78 H new ATOM 816 N ASN A 86 -12.095 -16.498 -5.015 1.00 0.63 N ATOM 817 CA ASN A 86 -12.295 -15.553 -3.925 1.00 0.62 C ATOM 818 C ASN A 86 -11.276 -14.433 -4.046 1.00 0.53 C ATOM 819 O ASN A 86 -11.432 -13.362 -3.458 1.00 0.53 O ATOM 820 CB ASN A 86 -12.153 -16.278 -2.588 1.00 0.78 C ATOM 821 CG ASN A 86 -12.448 -17.762 -2.718 1.00 1.65 C ATOM 822 OD1 ASN A 86 -13.347 -18.292 -2.064 1.00 2.49 O ATOM 823 ND2 ASN A 86 -11.682 -18.440 -3.572 1.00 1.68 N ATOM 0 H ASN A 86 -11.203 -16.992 -4.978 1.00 0.63 H new ATOM 0 HA ASN A 86 -13.296 -15.124 -3.977 1.00 0.62 H new ATOM 0 HB2 ASN A 86 -11.142 -16.140 -2.205 1.00 0.78 H new ATOM 0 HB3 ASN A 86 -12.832 -15.835 -1.860 1.00 0.78 H new ATOM 0 HD21 ASN A 86 -11.829 -19.441 -3.705 1.00 1.68 H new ATOM 0 HD22 ASN A 86 -10.949 -17.958 -4.092 1.00 1.68 H new ATOM 830 N LYS A 87 -10.228 -14.703 -4.818 1.00 0.53 N ATOM 831 CA LYS A 87 -9.184 -13.724 -5.066 1.00 0.56 C ATOM 832 C LYS A 87 -9.797 -12.486 -5.701 1.00 0.45 C ATOM 833 O LYS A 87 -9.378 -11.366 -5.433 1.00 0.40 O ATOM 834 CB LYS A 87 -8.105 -14.330 -5.971 1.00 0.71 C ATOM 835 CG LYS A 87 -7.413 -13.334 -6.886 1.00 1.06 C ATOM 836 CD LYS A 87 -8.016 -13.359 -8.278 1.00 1.59 C ATOM 837 CE LYS A 87 -8.265 -11.956 -8.797 1.00 1.84 C ATOM 838 NZ LYS A 87 -8.795 -11.964 -10.190 1.00 2.28 N ATOM 0 H LYS A 87 -10.082 -15.599 -5.284 1.00 0.53 H new ATOM 0 HA LYS A 87 -8.714 -13.437 -4.125 1.00 0.56 H new ATOM 0 HB2 LYS A 87 -7.353 -14.811 -5.345 1.00 0.71 H new ATOM 0 HB3 LYS A 87 -8.558 -15.110 -6.582 1.00 0.71 H new ATOM 0 HG2 LYS A 87 -7.498 -12.331 -6.468 1.00 1.06 H new ATOM 0 HG3 LYS A 87 -6.350 -13.566 -6.943 1.00 1.06 H new ATOM 0 HD2 LYS A 87 -7.346 -13.887 -8.957 1.00 1.59 H new ATOM 0 HD3 LYS A 87 -8.954 -13.914 -8.260 1.00 1.59 H new ATOM 0 HE2 LYS A 87 -8.973 -11.447 -8.142 1.00 1.84 H new ATOM 0 HE3 LYS A 87 -7.336 -11.387 -8.765 1.00 1.84 H new ATOM 0 HZ1 LYS A 87 -8.652 -11.029 -10.621 1.00 2.28 H new ATOM 0 HZ2 LYS A 87 -8.293 -12.683 -10.748 1.00 2.28 H new ATOM 0 HZ3 LYS A 87 -9.811 -12.186 -10.174 1.00 2.28 H new ATOM 852 N PHE A 88 -10.802 -12.710 -6.541 1.00 0.43 N ATOM 853 CA PHE A 88 -11.496 -11.619 -7.210 1.00 0.38 C ATOM 854 C PHE A 88 -12.058 -10.648 -6.179 1.00 0.31 C ATOM 855 O PHE A 88 -11.958 -9.436 -6.338 1.00 0.29 O ATOM 856 CB PHE A 88 -12.625 -12.159 -8.091 1.00 0.41 C ATOM 857 CG PHE A 88 -12.143 -12.936 -9.281 1.00 1.01 C ATOM 858 CD1 PHE A 88 -11.741 -14.255 -9.147 1.00 1.34 C ATOM 859 CD2 PHE A 88 -12.091 -12.347 -10.535 1.00 1.44 C ATOM 860 CE1 PHE A 88 -11.297 -14.973 -10.242 1.00 2.07 C ATOM 861 CE2 PHE A 88 -11.648 -13.060 -11.633 1.00 2.19 C ATOM 862 CZ PHE A 88 -11.250 -14.375 -11.486 1.00 2.49 C ATOM 0 H PHE A 88 -11.153 -13.639 -6.774 1.00 0.43 H new ATOM 0 HA PHE A 88 -10.783 -11.093 -7.845 1.00 0.38 H new ATOM 0 HB2 PHE A 88 -13.270 -12.798 -7.488 1.00 0.41 H new ATOM 0 HB3 PHE A 88 -13.235 -11.324 -8.436 1.00 0.41 H new ATOM 0 HD1 PHE A 88 -11.775 -14.728 -8.176 1.00 1.34 H new ATOM 0 HD2 PHE A 88 -12.400 -11.319 -10.655 1.00 1.44 H new ATOM 0 HE1 PHE A 88 -10.987 -16.001 -10.125 1.00 2.07 H new ATOM 0 HE2 PHE A 88 -11.613 -12.590 -12.605 1.00 2.19 H new ATOM 0 HZ PHE A 88 -10.903 -14.934 -12.342 1.00 2.49 H new ATOM 872 N ALA A 89 -12.663 -11.198 -5.132 1.00 0.31 N ATOM 873 CA ALA A 89 -13.236 -10.393 -4.058 1.00 0.29 C ATOM 874 C ALA A 89 -12.219 -9.411 -3.469 1.00 0.26 C ATOM 875 O ALA A 89 -12.407 -8.194 -3.528 1.00 0.27 O ATOM 876 CB ALA A 89 -13.781 -11.307 -2.969 1.00 0.35 C ATOM 0 H ALA A 89 -12.770 -12.204 -5.003 1.00 0.31 H new ATOM 0 HA ALA A 89 -14.047 -9.800 -4.480 1.00 0.29 H new ATOM 0 HB1 ALA A 89 -14.208 -10.704 -2.168 1.00 0.35 H new ATOM 0 HB2 ALA A 89 -14.553 -11.953 -3.388 1.00 0.35 H new ATOM 0 HB3 ALA A 89 -12.973 -11.920 -2.570 1.00 0.35 H new ATOM 882 N PHE A 90 -11.142 -9.940 -2.900 1.00 0.24 N ATOM 883 CA PHE A 90 -10.110 -9.102 -2.293 1.00 0.24 C ATOM 884 C PHE A 90 -9.435 -8.207 -3.327 1.00 0.21 C ATOM 885 O PHE A 90 -9.243 -7.014 -3.097 1.00 0.22 O ATOM 886 CB PHE A 90 -9.046 -9.966 -1.612 1.00 0.26 C ATOM 887 CG PHE A 90 -7.957 -9.153 -0.973 1.00 0.23 C ATOM 888 CD1 PHE A 90 -8.063 -8.719 0.339 1.00 0.28 C ATOM 889 CD2 PHE A 90 -6.831 -8.809 -1.696 1.00 0.27 C ATOM 890 CE1 PHE A 90 -7.059 -7.957 0.914 1.00 0.27 C ATOM 891 CE2 PHE A 90 -5.828 -8.053 -1.131 1.00 0.28 C ATOM 892 CZ PHE A 90 -5.941 -7.624 0.175 1.00 0.23 C ATOM 0 H PHE A 90 -10.959 -10.942 -2.845 1.00 0.24 H new ATOM 0 HA PHE A 90 -10.603 -8.472 -1.552 1.00 0.24 H new ATOM 0 HB2 PHE A 90 -9.521 -10.588 -0.854 1.00 0.26 H new ATOM 0 HB3 PHE A 90 -8.606 -10.640 -2.348 1.00 0.26 H new ATOM 0 HD1 PHE A 90 -8.937 -8.977 0.919 1.00 0.28 H new ATOM 0 HD2 PHE A 90 -6.736 -9.138 -2.720 1.00 0.27 H new ATOM 0 HE1 PHE A 90 -7.150 -7.624 1.937 1.00 0.27 H new ATOM 0 HE2 PHE A 90 -4.953 -7.796 -1.710 1.00 0.28 H new ATOM 0 HZ PHE A 90 -5.157 -7.029 0.619 1.00 0.23 H new ATOM 902 N ARG A 91 -9.085 -8.791 -4.465 1.00 0.19 N ATOM 903 CA ARG A 91 -8.395 -8.063 -5.526 1.00 0.21 C ATOM 904 C ARG A 91 -9.202 -6.857 -6.001 1.00 0.20 C ATOM 905 O ARG A 91 -8.686 -5.742 -6.054 1.00 0.19 O ATOM 906 CB ARG A 91 -8.090 -8.990 -6.697 1.00 0.25 C ATOM 907 CG ARG A 91 -6.711 -8.767 -7.288 1.00 0.34 C ATOM 908 CD ARG A 91 -6.779 -8.616 -8.794 1.00 1.15 C ATOM 909 NE ARG A 91 -7.381 -7.345 -9.192 1.00 1.75 N ATOM 910 CZ ARG A 91 -8.003 -7.152 -10.352 1.00 2.52 C ATOM 911 NH1 ARG A 91 -8.113 -8.145 -11.223 1.00 2.91 N ATOM 912 NH2 ARG A 91 -8.518 -5.964 -10.641 1.00 3.34 N ATOM 0 H ARG A 91 -9.268 -9.771 -4.679 1.00 0.19 H new ATOM 0 HA ARG A 91 -7.457 -7.692 -5.113 1.00 0.21 H new ATOM 0 HB2 ARG A 91 -8.174 -10.025 -6.365 1.00 0.25 H new ATOM 0 HB3 ARG A 91 -8.840 -8.843 -7.474 1.00 0.25 H new ATOM 0 HG2 ARG A 91 -6.265 -7.874 -6.850 1.00 0.34 H new ATOM 0 HG3 ARG A 91 -6.063 -9.605 -7.033 1.00 0.34 H new ATOM 0 HD2 ARG A 91 -5.774 -8.687 -9.211 1.00 1.15 H new ATOM 0 HD3 ARG A 91 -7.358 -9.438 -9.215 1.00 1.15 H new ATOM 0 HE ARG A 91 -7.321 -6.561 -8.543 1.00 1.75 H new ATOM 0 HH11 ARG A 91 -7.720 -9.061 -11.005 1.00 2.91 H new ATOM 0 HH12 ARG A 91 -8.591 -7.994 -12.111 1.00 2.91 H new ATOM 0 HH21 ARG A 91 -8.437 -5.197 -9.973 1.00 3.34 H new ATOM 0 HH22 ARG A 91 -8.995 -5.818 -11.531 1.00 3.34 H new ATOM 926 N GLU A 92 -10.464 -7.084 -6.356 1.00 0.25 N ATOM 927 CA GLU A 92 -11.323 -5.998 -6.819 1.00 0.27 C ATOM 928 C GLU A 92 -11.359 -4.877 -5.784 1.00 0.26 C ATOM 929 O GLU A 92 -11.406 -3.701 -6.139 1.00 0.25 O ATOM 930 CB GLU A 92 -12.741 -6.493 -7.129 1.00 0.32 C ATOM 931 CG GLU A 92 -13.542 -6.900 -5.904 1.00 1.17 C ATOM 932 CD GLU A 92 -14.975 -7.265 -6.240 1.00 1.97 C ATOM 933 OE1 GLU A 92 -15.213 -8.422 -6.648 1.00 2.58 O ATOM 934 OE2 GLU A 92 -15.859 -6.396 -6.093 1.00 2.25 O ATOM 0 H GLU A 92 -10.911 -8.001 -6.333 1.00 0.25 H new ATOM 0 HA GLU A 92 -10.902 -5.610 -7.746 1.00 0.27 H new ATOM 0 HB2 GLU A 92 -13.281 -5.707 -7.657 1.00 0.32 H new ATOM 0 HB3 GLU A 92 -12.676 -7.345 -7.806 1.00 0.32 H new ATOM 0 HG2 GLU A 92 -13.057 -7.750 -5.423 1.00 1.17 H new ATOM 0 HG3 GLU A 92 -13.539 -6.082 -5.184 1.00 1.17 H new ATOM 941 N ALA A 93 -11.337 -5.244 -4.501 1.00 0.26 N ATOM 942 CA ALA A 93 -11.328 -4.247 -3.435 1.00 0.26 C ATOM 943 C ALA A 93 -10.088 -3.372 -3.580 1.00 0.23 C ATOM 944 O ALA A 93 -10.131 -2.149 -3.397 1.00 0.22 O ATOM 945 CB ALA A 93 -11.358 -4.917 -2.069 1.00 0.29 C ATOM 0 H ALA A 93 -11.325 -6.212 -4.180 1.00 0.26 H new ATOM 0 HA ALA A 93 -12.219 -3.625 -3.517 1.00 0.26 H new ATOM 0 HB1 ALA A 93 -11.351 -4.155 -1.290 1.00 0.29 H new ATOM 0 HB2 ALA A 93 -12.262 -5.519 -1.979 1.00 0.29 H new ATOM 0 HB3 ALA A 93 -10.483 -5.557 -1.959 1.00 0.29 H new ATOM 951 N ILE A 94 -8.978 -4.017 -3.924 1.00 0.21 N ATOM 952 CA ILE A 94 -7.725 -3.316 -4.134 1.00 0.20 C ATOM 953 C ILE A 94 -7.892 -2.339 -5.279 1.00 0.19 C ATOM 954 O ILE A 94 -7.411 -1.205 -5.235 1.00 0.20 O ATOM 955 CB ILE A 94 -6.586 -4.278 -4.497 1.00 0.20 C ATOM 956 CG1 ILE A 94 -6.529 -5.451 -3.531 1.00 0.23 C ATOM 957 CG2 ILE A 94 -5.267 -3.540 -4.508 1.00 0.22 C ATOM 958 CD1 ILE A 94 -5.586 -6.538 -3.991 1.00 0.24 C ATOM 0 H ILE A 94 -8.925 -5.026 -4.062 1.00 0.21 H new ATOM 0 HA ILE A 94 -7.471 -2.806 -3.205 1.00 0.20 H new ATOM 0 HB ILE A 94 -6.780 -4.674 -5.494 1.00 0.20 H new ATOM 0 HG12 ILE A 94 -6.215 -5.094 -2.550 1.00 0.23 H new ATOM 0 HG13 ILE A 94 -7.529 -5.869 -3.413 1.00 0.23 H new ATOM 0 HG21 ILE A 94 -4.465 -4.232 -4.767 1.00 0.22 H new ATOM 0 HG22 ILE A 94 -5.305 -2.737 -5.244 1.00 0.22 H new ATOM 0 HG23 ILE A 94 -5.078 -3.118 -3.521 1.00 0.22 H new ATOM 0 HD11 ILE A 94 -5.585 -7.350 -3.264 1.00 0.24 H new ATOM 0 HD12 ILE A 94 -5.913 -6.918 -4.959 1.00 0.24 H new ATOM 0 HD13 ILE A 94 -4.579 -6.131 -4.082 1.00 0.24 H new ATOM 970 N ASN A 95 -8.588 -2.807 -6.307 1.00 0.20 N ATOM 971 CA ASN A 95 -8.855 -2.005 -7.481 1.00 0.21 C ATOM 972 C ASN A 95 -9.604 -0.746 -7.070 1.00 0.21 C ATOM 973 O ASN A 95 -9.354 0.333 -7.598 1.00 0.25 O ATOM 974 CB ASN A 95 -9.661 -2.826 -8.493 1.00 0.23 C ATOM 975 CG ASN A 95 -10.805 -2.046 -9.102 1.00 0.26 C ATOM 976 OD1 ASN A 95 -10.752 -1.631 -10.259 1.00 0.33 O ATOM 977 ND2 ASN A 95 -11.837 -1.831 -8.304 1.00 0.24 N ATOM 0 H ASN A 95 -8.979 -3.748 -6.345 1.00 0.20 H new ATOM 0 HA ASN A 95 -7.918 -1.710 -7.954 1.00 0.21 H new ATOM 0 HB2 ASN A 95 -8.997 -3.168 -9.287 1.00 0.23 H new ATOM 0 HB3 ASN A 95 -10.055 -3.715 -8.001 1.00 0.23 H new ATOM 0 HD21 ASN A 95 -12.639 -1.299 -8.640 1.00 0.24 H new ATOM 0 HD22 ASN A 95 -11.831 -2.198 -7.352 1.00 0.24 H new ATOM 984 N LYS A 96 -10.531 -0.891 -6.120 1.00 0.20 N ATOM 985 CA LYS A 96 -11.290 0.248 -5.628 1.00 0.20 C ATOM 986 C LYS A 96 -10.338 1.336 -5.160 1.00 0.19 C ATOM 987 O LYS A 96 -10.504 2.507 -5.506 1.00 0.20 O ATOM 988 CB LYS A 96 -12.218 -0.164 -4.483 1.00 0.24 C ATOM 989 CG LYS A 96 -13.630 -0.488 -4.938 1.00 0.34 C ATOM 990 CD LYS A 96 -13.699 -1.835 -5.634 1.00 0.76 C ATOM 991 CE LYS A 96 -15.038 -2.032 -6.323 1.00 0.75 C ATOM 992 NZ LYS A 96 -16.169 -2.007 -5.355 1.00 1.64 N ATOM 0 H LYS A 96 -10.769 -1.781 -5.682 1.00 0.20 H new ATOM 0 HA LYS A 96 -11.905 0.630 -6.443 1.00 0.20 H new ATOM 0 HB2 LYS A 96 -11.798 -1.035 -3.980 1.00 0.24 H new ATOM 0 HB3 LYS A 96 -12.256 0.641 -3.749 1.00 0.24 H new ATOM 0 HG2 LYS A 96 -14.299 -0.488 -4.077 1.00 0.34 H new ATOM 0 HG3 LYS A 96 -13.982 0.290 -5.615 1.00 0.34 H new ATOM 0 HD2 LYS A 96 -12.896 -1.909 -6.367 1.00 0.76 H new ATOM 0 HD3 LYS A 96 -13.541 -2.631 -4.906 1.00 0.76 H new ATOM 0 HE2 LYS A 96 -15.181 -1.250 -7.069 1.00 0.75 H new ATOM 0 HE3 LYS A 96 -15.036 -2.983 -6.855 1.00 0.75 H new ATOM 0 HZ1 LYS A 96 -17.048 -2.278 -5.841 1.00 1.64 H new ATOM 0 HZ2 LYS A 96 -15.979 -2.677 -4.582 1.00 1.64 H new ATOM 0 HZ3 LYS A 96 -16.271 -1.048 -4.965 1.00 1.64 H new ATOM 1006 N LEU A 97 -9.336 0.948 -4.369 1.00 0.21 N ATOM 1007 CA LEU A 97 -8.354 1.914 -3.884 1.00 0.22 C ATOM 1008 C LEU A 97 -7.637 2.570 -5.058 1.00 0.21 C ATOM 1009 O LEU A 97 -7.259 3.734 -4.992 1.00 0.25 O ATOM 1010 CB LEU A 97 -7.319 1.264 -2.966 1.00 0.25 C ATOM 1011 CG LEU A 97 -6.284 2.248 -2.408 1.00 0.38 C ATOM 1012 CD1 LEU A 97 -6.926 3.157 -1.381 1.00 0.52 C ATOM 1013 CD2 LEU A 97 -5.097 1.524 -1.799 1.00 0.62 C ATOM 0 H LEU A 97 -9.186 -0.011 -4.056 1.00 0.21 H new ATOM 0 HA LEU A 97 -8.897 2.665 -3.310 1.00 0.22 H new ATOM 0 HB2 LEU A 97 -7.835 0.783 -2.135 1.00 0.25 H new ATOM 0 HB3 LEU A 97 -6.801 0.479 -3.516 1.00 0.25 H new ATOM 0 HG LEU A 97 -5.916 2.850 -3.239 1.00 0.38 H new ATOM 0 HD11 LEU A 97 -6.180 3.851 -0.993 1.00 0.52 H new ATOM 0 HD12 LEU A 97 -7.736 3.718 -1.847 1.00 0.52 H new ATOM 0 HD13 LEU A 97 -7.325 2.557 -0.563 1.00 0.52 H new ATOM 0 HD21 LEU A 97 -4.384 2.253 -1.414 1.00 0.62 H new ATOM 0 HD22 LEU A 97 -5.439 0.886 -0.984 1.00 0.62 H new ATOM 0 HD23 LEU A 97 -4.614 0.912 -2.561 1.00 0.62 H new ATOM 1025 N GLU A 98 -7.467 1.814 -6.136 1.00 0.18 N ATOM 1026 CA GLU A 98 -6.790 2.319 -7.326 1.00 0.19 C ATOM 1027 C GLU A 98 -7.507 3.553 -7.874 1.00 0.17 C ATOM 1028 O GLU A 98 -6.926 4.635 -7.956 1.00 0.20 O ATOM 1029 CB GLU A 98 -6.735 1.227 -8.394 1.00 0.21 C ATOM 1030 CG GLU A 98 -5.724 1.491 -9.495 1.00 0.27 C ATOM 1031 CD GLU A 98 -6.131 2.632 -10.405 1.00 0.88 C ATOM 1032 OE1 GLU A 98 -7.051 2.438 -11.226 1.00 1.87 O ATOM 1033 OE2 GLU A 98 -5.528 3.721 -10.296 1.00 0.96 O ATOM 0 H GLU A 98 -7.788 0.849 -6.211 1.00 0.18 H new ATOM 0 HA GLU A 98 -5.775 2.606 -7.052 1.00 0.19 H new ATOM 0 HB2 GLU A 98 -6.496 0.277 -7.916 1.00 0.21 H new ATOM 0 HB3 GLU A 98 -7.724 1.120 -8.841 1.00 0.21 H new ATOM 0 HG2 GLU A 98 -4.756 1.717 -9.047 1.00 0.27 H new ATOM 0 HG3 GLU A 98 -5.596 0.586 -10.089 1.00 0.27 H new ATOM 1040 N ASN A 99 -8.774 3.381 -8.241 1.00 0.16 N ATOM 1041 CA ASN A 99 -9.575 4.474 -8.775 1.00 0.17 C ATOM 1042 C ASN A 99 -9.977 5.458 -7.681 1.00 0.21 C ATOM 1043 O ASN A 99 -10.474 6.549 -7.970 1.00 0.44 O ATOM 1044 CB ASN A 99 -10.812 3.925 -9.477 1.00 0.22 C ATOM 1045 CG ASN A 99 -11.398 2.737 -8.754 1.00 1.00 C ATOM 1046 OD1 ASN A 99 -12.245 2.880 -7.872 1.00 2.12 O ATOM 1047 ND2 ASN A 99 -10.945 1.550 -9.130 1.00 0.62 N ATOM 0 H ASN A 99 -9.268 2.491 -8.177 1.00 0.16 H new ATOM 0 HA ASN A 99 -8.965 5.015 -9.499 1.00 0.17 H new ATOM 0 HB2 ASN A 99 -11.564 4.710 -9.551 1.00 0.22 H new ATOM 0 HB3 ASN A 99 -10.552 3.636 -10.495 1.00 0.22 H new ATOM 0 HD21 ASN A 99 -11.299 0.704 -8.683 1.00 0.62 H new ATOM 0 HD22 ASN A 99 -10.242 1.482 -9.866 1.00 0.62 H new ATOM 1054 N ASN A 100 -9.740 5.086 -6.424 1.00 0.17 N ATOM 1055 CA ASN A 100 -10.080 5.953 -5.305 1.00 0.16 C ATOM 1056 C ASN A 100 -9.037 7.051 -5.205 1.00 0.16 C ATOM 1057 O ASN A 100 -9.362 8.233 -5.082 1.00 0.21 O ATOM 1058 CB ASN A 100 -10.143 5.152 -4.000 1.00 0.19 C ATOM 1059 CG ASN A 100 -9.558 5.907 -2.821 1.00 0.18 C ATOM 1060 OD1 ASN A 100 -10.264 6.630 -2.119 1.00 0.26 O ATOM 1061 ND2 ASN A 100 -8.260 5.737 -2.602 1.00 0.21 N ATOM 0 H ASN A 100 -9.317 4.196 -6.159 1.00 0.17 H new ATOM 0 HA ASN A 100 -11.063 6.394 -5.471 1.00 0.16 H new ATOM 0 HB2 ASN A 100 -11.181 4.897 -3.784 1.00 0.19 H new ATOM 0 HB3 ASN A 100 -9.604 4.213 -4.128 1.00 0.19 H new ATOM 0 HD21 ASN A 100 -7.807 6.216 -1.824 1.00 0.21 H new ATOM 0 HD22 ASN A 100 -7.716 5.127 -3.212 1.00 0.21 H new ATOM 1068 N LEU A 101 -7.775 6.640 -5.260 1.00 0.19 N ATOM 1069 CA LEU A 101 -6.669 7.575 -5.214 1.00 0.25 C ATOM 1070 C LEU A 101 -6.696 8.423 -6.476 1.00 0.23 C ATOM 1071 O LEU A 101 -6.322 9.594 -6.466 1.00 0.25 O ATOM 1072 CB LEU A 101 -5.341 6.822 -5.108 1.00 0.32 C ATOM 1073 CG LEU A 101 -5.314 5.715 -4.053 1.00 0.42 C ATOM 1074 CD1 LEU A 101 -4.234 4.695 -4.371 1.00 0.32 C ATOM 1075 CD2 LEU A 101 -5.103 6.297 -2.667 1.00 0.58 C ATOM 0 H LEU A 101 -7.497 5.662 -5.337 1.00 0.19 H new ATOM 0 HA LEU A 101 -6.765 8.216 -4.338 1.00 0.25 H new ATOM 0 HB2 LEU A 101 -5.109 6.385 -6.079 1.00 0.32 H new ATOM 0 HB3 LEU A 101 -4.550 7.538 -4.883 1.00 0.32 H new ATOM 0 HG LEU A 101 -6.280 5.209 -4.069 1.00 0.42 H new ATOM 0 HD11 LEU A 101 -4.233 3.917 -3.608 1.00 0.32 H new ATOM 0 HD12 LEU A 101 -4.432 4.248 -5.345 1.00 0.32 H new ATOM 0 HD13 LEU A 101 -3.262 5.188 -4.388 1.00 0.32 H new ATOM 0 HD21 LEU A 101 -5.087 5.492 -1.933 1.00 0.58 H new ATOM 0 HD22 LEU A 101 -4.154 6.833 -2.638 1.00 0.58 H new ATOM 0 HD23 LEU A 101 -5.916 6.985 -2.434 1.00 0.58 H new ATOM 1087 N ARG A 102 -7.165 7.807 -7.561 1.00 0.22 N ATOM 1088 CA ARG A 102 -7.272 8.484 -8.848 1.00 0.23 C ATOM 1089 C ARG A 102 -8.085 9.766 -8.718 1.00 0.24 C ATOM 1090 O ARG A 102 -7.612 10.845 -9.072 1.00 0.34 O ATOM 1091 CB ARG A 102 -7.931 7.561 -9.879 1.00 0.25 C ATOM 1092 CG ARG A 102 -6.972 6.587 -10.541 1.00 0.29 C ATOM 1093 CD ARG A 102 -7.644 5.854 -11.691 1.00 0.38 C ATOM 1094 NE ARG A 102 -6.706 5.023 -12.442 1.00 0.97 N ATOM 1095 CZ ARG A 102 -7.063 4.239 -13.454 1.00 1.26 C ATOM 1096 NH1 ARG A 102 -8.335 4.167 -13.826 1.00 1.25 N ATOM 1097 NH2 ARG A 102 -6.151 3.520 -14.094 1.00 2.09 N ATOM 0 H ARG A 102 -7.477 6.836 -7.571 1.00 0.22 H new ATOM 0 HA ARG A 102 -6.266 8.738 -9.182 1.00 0.23 H new ATOM 0 HB2 ARG A 102 -8.725 6.997 -9.390 1.00 0.25 H new ATOM 0 HB3 ARG A 102 -8.401 8.172 -10.650 1.00 0.25 H new ATOM 0 HG2 ARG A 102 -6.099 7.125 -10.909 1.00 0.29 H new ATOM 0 HG3 ARG A 102 -6.615 5.866 -9.805 1.00 0.29 H new ATOM 0 HD2 ARG A 102 -8.448 5.229 -11.301 1.00 0.38 H new ATOM 0 HD3 ARG A 102 -8.102 6.579 -12.363 1.00 0.38 H new ATOM 0 HE ARG A 102 -5.722 5.046 -12.175 1.00 0.97 H new ATOM 0 HH11 ARG A 102 -9.042 4.714 -13.335 1.00 1.25 H new ATOM 0 HH12 ARG A 102 -8.606 3.564 -14.603 1.00 1.25 H new ATOM 0 HH21 ARG A 102 -5.173 3.568 -13.810 1.00 2.09 H new ATOM 0 HH22 ARG A 102 -6.428 2.919 -14.870 1.00 2.09 H new ATOM 1111 N GLU A 103 -9.310 9.649 -8.209 1.00 0.24 N ATOM 1112 CA GLU A 103 -10.165 10.817 -8.026 1.00 0.24 C ATOM 1113 C GLU A 103 -9.655 11.677 -6.874 1.00 0.24 C ATOM 1114 O GLU A 103 -9.992 12.856 -6.766 1.00 0.25 O ATOM 1115 CB GLU A 103 -11.608 10.381 -7.757 1.00 0.26 C ATOM 1116 CG GLU A 103 -12.577 11.541 -7.594 1.00 0.34 C ATOM 1117 CD GLU A 103 -13.994 11.084 -7.308 1.00 1.36 C ATOM 1118 OE1 GLU A 103 -14.271 10.695 -6.154 1.00 2.32 O ATOM 1119 OE2 GLU A 103 -14.827 11.115 -8.238 1.00 1.82 O ATOM 0 H GLU A 103 -9.729 8.765 -7.919 1.00 0.24 H new ATOM 0 HA GLU A 103 -10.140 11.409 -8.941 1.00 0.24 H new ATOM 0 HB2 GLU A 103 -11.946 9.749 -8.578 1.00 0.26 H new ATOM 0 HB3 GLU A 103 -11.631 9.770 -6.855 1.00 0.26 H new ATOM 0 HG2 GLU A 103 -12.236 12.183 -6.782 1.00 0.34 H new ATOM 0 HG3 GLU A 103 -12.571 12.145 -8.501 1.00 0.34 H new ATOM 1126 N LEU A 104 -8.834 11.076 -6.019 1.00 0.24 N ATOM 1127 CA LEU A 104 -8.272 11.773 -4.871 1.00 0.25 C ATOM 1128 C LEU A 104 -7.088 12.647 -5.280 1.00 0.29 C ATOM 1129 O LEU A 104 -6.691 13.546 -4.541 1.00 0.31 O ATOM 1130 CB LEU A 104 -7.834 10.750 -3.824 1.00 0.24 C ATOM 1131 CG LEU A 104 -7.302 11.323 -2.519 1.00 0.24 C ATOM 1132 CD1 LEU A 104 -8.431 11.939 -1.730 1.00 0.29 C ATOM 1133 CD2 LEU A 104 -6.617 10.236 -1.712 1.00 0.24 C ATOM 0 H LEU A 104 -8.543 10.102 -6.102 1.00 0.24 H new ATOM 0 HA LEU A 104 -9.037 12.425 -4.451 1.00 0.25 H new ATOM 0 HB2 LEU A 104 -8.683 10.105 -3.596 1.00 0.24 H new ATOM 0 HB3 LEU A 104 -7.062 10.118 -4.262 1.00 0.24 H new ATOM 0 HG LEU A 104 -6.570 12.099 -2.742 1.00 0.24 H new ATOM 0 HD11 LEU A 104 -8.043 12.347 -0.797 1.00 0.29 H new ATOM 0 HD12 LEU A 104 -8.889 12.738 -2.313 1.00 0.29 H new ATOM 0 HD13 LEU A 104 -9.179 11.177 -1.509 1.00 0.29 H new ATOM 0 HD21 LEU A 104 -6.240 10.657 -0.780 1.00 0.24 H new ATOM 0 HD22 LEU A 104 -7.331 9.443 -1.489 1.00 0.24 H new ATOM 0 HD23 LEU A 104 -5.787 9.825 -2.286 1.00 0.24 H new ATOM 1145 N GLN A 105 -6.523 12.371 -6.458 1.00 0.40 N ATOM 1146 CA GLN A 105 -5.381 13.136 -6.960 1.00 0.51 C ATOM 1147 C GLN A 105 -5.663 14.631 -6.936 1.00 0.45 C ATOM 1148 O GLN A 105 -5.473 15.291 -5.915 1.00 1.00 O ATOM 1149 CB GLN A 105 -5.015 12.697 -8.386 1.00 0.86 C ATOM 1150 CG GLN A 105 -3.545 12.348 -8.557 1.00 0.44 C ATOM 1151 CD GLN A 105 -3.237 10.943 -8.103 1.00 1.31 C ATOM 1152 OE1 GLN A 105 -2.312 10.301 -8.601 1.00 2.04 O ATOM 1153 NE2 GLN A 105 -4.021 10.456 -7.155 1.00 1.38 N ATOM 0 H GLN A 105 -6.837 11.626 -7.080 1.00 0.40 H new ATOM 0 HA GLN A 105 -4.537 12.934 -6.300 1.00 0.51 H new ATOM 0 HB2 GLN A 105 -5.619 11.831 -8.657 1.00 0.86 H new ATOM 0 HB3 GLN A 105 -5.273 13.496 -9.081 1.00 0.86 H new ATOM 0 HG2 GLN A 105 -3.266 12.459 -9.605 1.00 0.44 H new ATOM 0 HG3 GLN A 105 -2.937 13.053 -7.989 1.00 0.44 H new ATOM 0 HE21 GLN A 105 -4.775 11.027 -6.773 1.00 1.38 H new ATOM 0 HE22 GLN A 105 -3.871 9.509 -6.806 1.00 1.38 H new ATOM 1342 N PHE A 121 -12.786 12.481 3.298 1.00 0.45 N ATOM 1343 CA PHE A 121 -12.255 11.295 2.636 1.00 0.36 C ATOM 1344 C PHE A 121 -12.729 10.010 3.312 1.00 0.31 C ATOM 1345 O PHE A 121 -11.944 9.082 3.510 1.00 0.33 O ATOM 1346 CB PHE A 121 -10.721 11.333 2.628 1.00 0.47 C ATOM 1347 CG PHE A 121 -10.107 12.534 1.942 1.00 0.37 C ATOM 1348 CD1 PHE A 121 -10.885 13.568 1.432 1.00 0.46 C ATOM 1349 CD2 PHE A 121 -8.728 12.622 1.815 1.00 0.27 C ATOM 1350 CE1 PHE A 121 -10.297 14.656 0.813 1.00 0.41 C ATOM 1351 CE2 PHE A 121 -8.139 13.708 1.198 1.00 0.26 C ATOM 1352 CZ PHE A 121 -8.923 14.725 0.696 1.00 0.31 C ATOM 0 HA PHE A 121 -12.629 11.299 1.612 1.00 0.36 H new ATOM 0 HB2 PHE A 121 -10.368 11.304 3.659 1.00 0.47 H new ATOM 0 HB3 PHE A 121 -10.354 10.430 2.140 1.00 0.47 H new ATOM 0 HD1 PHE A 121 -11.960 13.521 1.520 1.00 0.46 H new ATOM 0 HD2 PHE A 121 -8.106 11.829 2.204 1.00 0.27 H new ATOM 0 HE1 PHE A 121 -10.913 15.452 0.421 1.00 0.41 H new ATOM 0 HE2 PHE A 121 -7.064 13.761 1.109 1.00 0.26 H new ATOM 0 HZ PHE A 121 -8.463 15.574 0.212 1.00 0.31 H new ATOM 1362 N SER A 122 -14.009 9.953 3.667 1.00 0.32 N ATOM 1363 CA SER A 122 -14.557 8.763 4.310 1.00 0.34 C ATOM 1364 C SER A 122 -14.669 7.618 3.312 1.00 0.29 C ATOM 1365 O SER A 122 -14.862 6.466 3.699 1.00 0.32 O ATOM 1366 CB SER A 122 -15.923 9.047 4.930 1.00 0.42 C ATOM 1367 OG SER A 122 -15.857 10.126 5.845 1.00 1.26 O ATOM 0 H SER A 122 -14.680 10.708 3.523 1.00 0.32 H new ATOM 0 HA SER A 122 -13.872 8.475 5.107 1.00 0.34 H new ATOM 0 HB2 SER A 122 -16.641 9.278 4.143 1.00 0.42 H new ATOM 0 HB3 SER A 122 -16.286 8.155 5.441 1.00 0.42 H new ATOM 0 HG SER A 122 -16.746 10.287 6.225 1.00 1.26 H new ATOM 1373 N LYS A 123 -14.553 7.939 2.025 1.00 0.27 N ATOM 1374 CA LYS A 123 -14.621 6.927 0.987 1.00 0.29 C ATOM 1375 C LYS A 123 -13.380 6.059 1.055 1.00 0.24 C ATOM 1376 O LYS A 123 -13.454 4.834 0.962 1.00 0.27 O ATOM 1377 CB LYS A 123 -14.739 7.580 -0.387 1.00 0.37 C ATOM 1378 CG LYS A 123 -16.111 8.157 -0.672 1.00 0.42 C ATOM 1379 CD LYS A 123 -16.288 9.528 -0.053 1.00 0.91 C ATOM 1380 CE LYS A 123 -17.017 9.417 1.263 1.00 1.81 C ATOM 1381 NZ LYS A 123 -16.686 10.537 2.184 1.00 2.58 N ATOM 0 H LYS A 123 -14.412 8.889 1.683 1.00 0.27 H new ATOM 0 HA LYS A 123 -15.504 6.308 1.144 1.00 0.29 H new ATOM 0 HB2 LYS A 123 -13.997 8.374 -0.467 1.00 0.37 H new ATOM 0 HB3 LYS A 123 -14.499 6.842 -1.152 1.00 0.37 H new ATOM 0 HG2 LYS A 123 -16.260 8.224 -1.750 1.00 0.42 H new ATOM 0 HG3 LYS A 123 -16.876 7.483 -0.286 1.00 0.42 H new ATOM 0 HD2 LYS A 123 -15.315 9.994 0.101 1.00 0.91 H new ATOM 0 HD3 LYS A 123 -16.846 10.172 -0.733 1.00 0.91 H new ATOM 0 HE2 LYS A 123 -18.092 9.404 1.081 1.00 1.81 H new ATOM 0 HE3 LYS A 123 -16.762 8.470 1.739 1.00 1.81 H new ATOM 0 HZ1 LYS A 123 -17.169 10.393 3.094 1.00 2.58 H new ATOM 0 HZ2 LYS A 123 -15.658 10.567 2.339 1.00 2.58 H new ATOM 0 HZ3 LYS A 123 -16.999 11.436 1.764 1.00 2.58 H new ATOM 1395 N LEU A 124 -12.235 6.714 1.216 1.00 0.22 N ATOM 1396 CA LEU A 124 -10.967 6.024 1.340 1.00 0.20 C ATOM 1397 C LEU A 124 -11.027 5.101 2.553 1.00 0.16 C ATOM 1398 O LEU A 124 -10.331 4.088 2.625 1.00 0.16 O ATOM 1399 CB LEU A 124 -9.844 7.060 1.501 1.00 0.25 C ATOM 1400 CG LEU A 124 -8.414 6.605 1.164 1.00 0.24 C ATOM 1401 CD1 LEU A 124 -8.385 5.192 0.608 1.00 0.26 C ATOM 1402 CD2 LEU A 124 -7.779 7.571 0.175 1.00 0.25 C ATOM 0 H LEU A 124 -12.165 7.731 1.263 1.00 0.22 H new ATOM 0 HA LEU A 124 -10.766 5.428 0.450 1.00 0.20 H new ATOM 0 HB2 LEU A 124 -10.083 7.917 0.872 1.00 0.25 H new ATOM 0 HB3 LEU A 124 -9.853 7.410 2.533 1.00 0.25 H new ATOM 0 HG LEU A 124 -7.840 6.605 2.091 1.00 0.24 H new ATOM 0 HD11 LEU A 124 -7.356 4.910 0.383 1.00 0.26 H new ATOM 0 HD12 LEU A 124 -8.797 4.503 1.345 1.00 0.26 H new ATOM 0 HD13 LEU A 124 -8.981 5.147 -0.304 1.00 0.26 H new ATOM 0 HD21 LEU A 124 -6.767 7.241 -0.058 1.00 0.25 H new ATOM 0 HD22 LEU A 124 -8.371 7.597 -0.740 1.00 0.25 H new ATOM 0 HD23 LEU A 124 -7.743 8.569 0.613 1.00 0.25 H new ATOM 1414 N LEU A 125 -11.889 5.464 3.496 1.00 0.18 N ATOM 1415 CA LEU A 125 -12.075 4.692 4.715 1.00 0.22 C ATOM 1416 C LEU A 125 -12.854 3.411 4.427 1.00 0.24 C ATOM 1417 O LEU A 125 -12.460 2.325 4.850 1.00 0.26 O ATOM 1418 CB LEU A 125 -12.807 5.540 5.761 1.00 0.28 C ATOM 1419 CG LEU A 125 -12.158 5.558 7.145 1.00 0.32 C ATOM 1420 CD1 LEU A 125 -10.889 6.396 7.122 1.00 1.23 C ATOM 1421 CD2 LEU A 125 -13.130 6.089 8.184 1.00 1.30 C ATOM 0 H LEU A 125 -12.475 6.297 3.436 1.00 0.18 H new ATOM 0 HA LEU A 125 -11.097 4.413 5.106 1.00 0.22 H new ATOM 0 HB2 LEU A 125 -12.875 6.564 5.394 1.00 0.28 H new ATOM 0 HB3 LEU A 125 -13.827 5.169 5.859 1.00 0.28 H new ATOM 0 HG LEU A 125 -11.893 4.536 7.417 1.00 0.32 H new ATOM 0 HD11 LEU A 125 -10.438 6.400 8.114 1.00 1.23 H new ATOM 0 HD12 LEU A 125 -10.186 5.972 6.405 1.00 1.23 H new ATOM 0 HD13 LEU A 125 -11.133 7.418 6.830 1.00 1.23 H new ATOM 0 HD21 LEU A 125 -12.650 6.094 9.162 1.00 1.30 H new ATOM 0 HD22 LEU A 125 -13.426 7.104 7.920 1.00 1.30 H new ATOM 0 HD23 LEU A 125 -14.013 5.450 8.216 1.00 1.30 H new ATOM 1433 N SER A 126 -13.962 3.549 3.702 1.00 0.28 N ATOM 1434 CA SER A 126 -14.793 2.402 3.351 1.00 0.34 C ATOM 1435 C SER A 126 -14.033 1.425 2.455 1.00 0.28 C ATOM 1436 O SER A 126 -14.204 0.210 2.556 1.00 0.29 O ATOM 1437 CB SER A 126 -16.070 2.867 2.646 1.00 0.44 C ATOM 1438 OG SER A 126 -16.886 1.766 2.287 1.00 1.40 O ATOM 0 H SER A 126 -14.304 4.442 3.347 1.00 0.28 H new ATOM 0 HA SER A 126 -15.059 1.887 4.274 1.00 0.34 H new ATOM 0 HB2 SER A 126 -16.627 3.538 3.301 1.00 0.44 H new ATOM 0 HB3 SER A 126 -15.809 3.436 1.754 1.00 0.44 H new ATOM 0 HG SER A 126 -17.695 2.091 1.840 1.00 1.40 H new ATOM 1444 N SER A 127 -13.196 1.969 1.578 1.00 0.25 N ATOM 1445 CA SER A 127 -12.412 1.158 0.653 1.00 0.25 C ATOM 1446 C SER A 127 -11.391 0.287 1.383 1.00 0.21 C ATOM 1447 O SER A 127 -11.279 -0.906 1.109 1.00 0.23 O ATOM 1448 CB SER A 127 -11.696 2.059 -0.356 1.00 0.31 C ATOM 1449 OG SER A 127 -12.626 2.798 -1.131 1.00 1.09 O ATOM 0 H SER A 127 -13.043 2.973 1.488 1.00 0.25 H new ATOM 0 HA SER A 127 -13.102 0.495 0.131 1.00 0.25 H new ATOM 0 HB2 SER A 127 -11.032 2.744 0.171 1.00 0.31 H new ATOM 0 HB3 SER A 127 -11.073 1.452 -1.012 1.00 0.31 H new ATOM 0 HG SER A 127 -13.016 3.511 -0.583 1.00 1.09 H new ATOM 1455 N VAL A 128 -10.662 0.887 2.320 1.00 0.23 N ATOM 1456 CA VAL A 128 -9.635 0.172 3.077 1.00 0.30 C ATOM 1457 C VAL A 128 -10.235 -0.954 3.907 1.00 0.29 C ATOM 1458 O VAL A 128 -9.825 -2.112 3.793 1.00 0.32 O ATOM 1459 CB VAL A 128 -8.869 1.133 4.009 1.00 0.40 C ATOM 1460 CG1 VAL A 128 -7.988 0.362 4.979 1.00 0.51 C ATOM 1461 CG2 VAL A 128 -8.044 2.117 3.196 1.00 0.48 C ATOM 0 H VAL A 128 -10.763 1.869 2.575 1.00 0.23 H new ATOM 0 HA VAL A 128 -8.945 -0.256 2.350 1.00 0.30 H new ATOM 0 HB VAL A 128 -9.598 1.695 4.593 1.00 0.40 H new ATOM 0 HG11 VAL A 128 -7.459 1.062 5.625 1.00 0.51 H new ATOM 0 HG12 VAL A 128 -8.607 -0.297 5.588 1.00 0.51 H new ATOM 0 HG13 VAL A 128 -7.266 -0.233 4.420 1.00 0.51 H new ATOM 0 HG21 VAL A 128 -7.510 2.788 3.869 1.00 0.48 H new ATOM 0 HG22 VAL A 128 -7.327 1.571 2.583 1.00 0.48 H new ATOM 0 HG23 VAL A 128 -8.703 2.699 2.552 1.00 0.48 H new ATOM 1471 N LYS A 129 -11.201 -0.602 4.742 1.00 0.28 N ATOM 1472 CA LYS A 129 -11.865 -1.571 5.600 1.00 0.32 C ATOM 1473 C LYS A 129 -12.342 -2.776 4.797 1.00 0.27 C ATOM 1474 O LYS A 129 -12.239 -3.916 5.246 1.00 0.27 O ATOM 1475 CB LYS A 129 -13.047 -0.906 6.300 1.00 0.38 C ATOM 1476 CG LYS A 129 -12.649 0.092 7.376 1.00 0.50 C ATOM 1477 CD LYS A 129 -11.910 -0.586 8.513 1.00 1.12 C ATOM 1478 CE LYS A 129 -12.848 -1.419 9.373 1.00 1.77 C ATOM 1479 NZ LYS A 129 -12.112 -2.169 10.427 1.00 2.69 N ATOM 0 H LYS A 129 -11.544 0.353 4.844 1.00 0.28 H new ATOM 0 HA LYS A 129 -11.151 -1.923 6.344 1.00 0.32 H new ATOM 0 HB2 LYS A 129 -13.657 -0.396 5.554 1.00 0.38 H new ATOM 0 HB3 LYS A 129 -13.671 -1.679 6.749 1.00 0.38 H new ATOM 0 HG2 LYS A 129 -12.018 0.867 6.940 1.00 0.50 H new ATOM 0 HG3 LYS A 129 -13.540 0.587 7.763 1.00 0.50 H new ATOM 0 HD2 LYS A 129 -11.124 -1.224 8.108 1.00 1.12 H new ATOM 0 HD3 LYS A 129 -11.422 0.168 9.131 1.00 1.12 H new ATOM 0 HE2 LYS A 129 -13.588 -0.768 9.839 1.00 1.77 H new ATOM 0 HE3 LYS A 129 -13.393 -2.120 8.742 1.00 1.77 H new ATOM 0 HZ1 LYS A 129 -12.785 -2.725 10.992 1.00 2.69 H new ATOM 0 HZ2 LYS A 129 -11.424 -2.809 9.981 1.00 2.69 H new ATOM 0 HZ3 LYS A 129 -11.612 -1.499 11.045 1.00 2.69 H new ATOM 1493 N GLU A 130 -12.871 -2.507 3.608 1.00 0.23 N ATOM 1494 CA GLU A 130 -13.367 -3.561 2.729 1.00 0.21 C ATOM 1495 C GLU A 130 -12.279 -4.576 2.379 1.00 0.17 C ATOM 1496 O GLU A 130 -12.454 -5.778 2.602 1.00 0.16 O ATOM 1497 CB GLU A 130 -13.942 -2.954 1.448 1.00 0.21 C ATOM 1498 CG GLU A 130 -14.560 -3.979 0.509 1.00 0.35 C ATOM 1499 CD GLU A 130 -15.690 -4.755 1.155 1.00 1.20 C ATOM 1500 OE1 GLU A 130 -16.821 -4.227 1.204 1.00 1.71 O ATOM 1501 OE2 GLU A 130 -15.444 -5.890 1.614 1.00 2.10 O ATOM 0 H GLU A 130 -12.968 -1.565 3.230 1.00 0.23 H new ATOM 0 HA GLU A 130 -14.153 -4.090 3.268 1.00 0.21 H new ATOM 0 HB2 GLU A 130 -14.698 -2.216 1.714 1.00 0.21 H new ATOM 0 HB3 GLU A 130 -13.150 -2.423 0.921 1.00 0.21 H new ATOM 0 HG2 GLU A 130 -14.934 -3.472 -0.380 1.00 0.35 H new ATOM 0 HG3 GLU A 130 -13.789 -4.675 0.179 1.00 0.35 H new ATOM 1508 N ILE A 131 -11.157 -4.100 1.837 1.00 0.18 N ATOM 1509 CA ILE A 131 -10.068 -4.996 1.445 1.00 0.16 C ATOM 1510 C ILE A 131 -9.705 -5.948 2.577 1.00 0.17 C ATOM 1511 O ILE A 131 -9.725 -7.166 2.405 1.00 0.16 O ATOM 1512 CB ILE A 131 -8.790 -4.239 1.027 1.00 0.18 C ATOM 1513 CG1 ILE A 131 -9.085 -2.774 0.711 1.00 0.28 C ATOM 1514 CG2 ILE A 131 -8.158 -4.920 -0.179 1.00 0.29 C ATOM 1515 CD1 ILE A 131 -7.849 -1.902 0.728 1.00 0.27 C ATOM 0 H ILE A 131 -10.979 -3.111 1.661 1.00 0.18 H new ATOM 0 HA ILE A 131 -10.443 -5.551 0.585 1.00 0.16 H new ATOM 0 HB ILE A 131 -8.093 -4.263 1.864 1.00 0.18 H new ATOM 0 HG12 ILE A 131 -9.555 -2.708 -0.270 1.00 0.28 H new ATOM 0 HG13 ILE A 131 -9.803 -2.390 1.435 1.00 0.28 H new ATOM 0 HG21 ILE A 131 -7.256 -4.381 -0.470 1.00 0.29 H new ATOM 0 HG22 ILE A 131 -7.900 -5.948 0.077 1.00 0.29 H new ATOM 0 HG23 ILE A 131 -8.865 -4.919 -1.009 1.00 0.29 H new ATOM 0 HD11 ILE A 131 -8.126 -0.874 0.496 1.00 0.27 H new ATOM 0 HD12 ILE A 131 -7.390 -1.940 1.716 1.00 0.27 H new ATOM 0 HD13 ILE A 131 -7.139 -2.263 -0.016 1.00 0.27 H new ATOM 1527 N SER A 132 -9.373 -5.386 3.734 1.00 0.20 N ATOM 1528 CA SER A 132 -9.021 -6.192 4.896 1.00 0.23 C ATOM 1529 C SER A 132 -10.149 -7.162 5.244 1.00 0.23 C ATOM 1530 O SER A 132 -9.914 -8.354 5.468 1.00 0.26 O ATOM 1531 CB SER A 132 -8.718 -5.290 6.092 1.00 0.27 C ATOM 1532 OG SER A 132 -8.526 -6.050 7.271 1.00 1.02 O ATOM 0 H SER A 132 -9.340 -4.379 3.892 1.00 0.20 H new ATOM 0 HA SER A 132 -8.130 -6.771 4.653 1.00 0.23 H new ATOM 0 HB2 SER A 132 -7.825 -4.699 5.888 1.00 0.27 H new ATOM 0 HB3 SER A 132 -9.539 -4.588 6.238 1.00 0.27 H new ATOM 0 HG SER A 132 -8.333 -5.448 8.020 1.00 1.02 H new ATOM 1538 N ASP A 133 -11.374 -6.639 5.289 1.00 0.23 N ATOM 1539 CA ASP A 133 -12.552 -7.438 5.610 1.00 0.26 C ATOM 1540 C ASP A 133 -12.632 -8.713 4.774 1.00 0.25 C ATOM 1541 O ASP A 133 -13.222 -9.706 5.201 1.00 0.36 O ATOM 1542 CB ASP A 133 -13.818 -6.608 5.398 1.00 0.28 C ATOM 1543 CG ASP A 133 -15.064 -7.311 5.900 1.00 0.33 C ATOM 1544 OD1 ASP A 133 -15.678 -8.063 5.115 1.00 0.37 O ATOM 1545 OD2 ASP A 133 -15.425 -7.110 7.079 1.00 0.37 O ATOM 0 H ASP A 133 -11.575 -5.656 5.105 1.00 0.23 H new ATOM 0 HA ASP A 133 -12.467 -7.733 6.656 1.00 0.26 H new ATOM 0 HB2 ASP A 133 -13.712 -5.652 5.911 1.00 0.28 H new ATOM 0 HB3 ASP A 133 -13.931 -6.389 4.336 1.00 0.28 H new ATOM 1550 N ILE A 134 -12.041 -8.686 3.586 1.00 0.16 N ATOM 1551 CA ILE A 134 -12.075 -9.844 2.696 1.00 0.16 C ATOM 1552 C ILE A 134 -10.950 -10.848 2.971 1.00 0.16 C ATOM 1553 O ILE A 134 -11.211 -12.038 3.136 1.00 0.26 O ATOM 1554 CB ILE A 134 -12.006 -9.413 1.216 1.00 0.17 C ATOM 1555 CG1 ILE A 134 -13.129 -8.422 0.902 1.00 0.17 C ATOM 1556 CG2 ILE A 134 -12.094 -10.630 0.302 1.00 0.22 C ATOM 1557 CD1 ILE A 134 -12.997 -7.762 -0.453 1.00 0.18 C ATOM 0 H ILE A 134 -11.535 -7.881 3.216 1.00 0.16 H new ATOM 0 HA ILE A 134 -13.025 -10.338 2.898 1.00 0.16 H new ATOM 0 HB ILE A 134 -11.049 -8.921 1.039 1.00 0.17 H new ATOM 0 HG12 ILE A 134 -14.085 -8.943 0.951 1.00 0.17 H new ATOM 0 HG13 ILE A 134 -13.146 -7.651 1.672 1.00 0.17 H new ATOM 0 HG21 ILE A 134 -12.044 -10.308 -0.738 1.00 0.22 H new ATOM 0 HG22 ILE A 134 -11.264 -11.305 0.514 1.00 0.22 H new ATOM 0 HG23 ILE A 134 -13.037 -11.149 0.476 1.00 0.22 H new ATOM 0 HD11 ILE A 134 -13.828 -7.073 -0.605 1.00 0.18 H new ATOM 0 HD12 ILE A 134 -12.057 -7.212 -0.500 1.00 0.18 H new ATOM 0 HD13 ILE A 134 -13.010 -8.524 -1.232 1.00 0.18 H new ATOM 1569 N VAL A 135 -9.709 -10.369 3.029 1.00 0.15 N ATOM 1570 CA VAL A 135 -8.554 -11.249 3.239 1.00 0.17 C ATOM 1571 C VAL A 135 -8.671 -12.141 4.478 1.00 0.19 C ATOM 1572 O VAL A 135 -8.413 -13.341 4.397 1.00 0.25 O ATOM 1573 CB VAL A 135 -7.224 -10.464 3.313 1.00 0.17 C ATOM 1574 CG1 VAL A 135 -7.366 -9.200 4.141 1.00 0.18 C ATOM 1575 CG2 VAL A 135 -6.121 -11.339 3.887 1.00 0.23 C ATOM 0 H VAL A 135 -9.475 -9.381 2.934 1.00 0.15 H new ATOM 0 HA VAL A 135 -8.550 -11.895 2.361 1.00 0.17 H new ATOM 0 HB VAL A 135 -6.959 -10.173 2.297 1.00 0.17 H new ATOM 0 HG11 VAL A 135 -6.411 -8.675 4.170 1.00 0.18 H new ATOM 0 HG12 VAL A 135 -8.121 -8.555 3.693 1.00 0.18 H new ATOM 0 HG13 VAL A 135 -7.667 -9.461 5.155 1.00 0.18 H new ATOM 0 HG21 VAL A 135 -5.192 -10.771 3.932 1.00 0.23 H new ATOM 0 HG22 VAL A 135 -6.398 -11.662 4.891 1.00 0.23 H new ATOM 0 HG23 VAL A 135 -5.981 -12.213 3.250 1.00 0.23 H new ATOM 1585 N GLN A 136 -9.046 -11.572 5.615 1.00 0.22 N ATOM 1586 CA GLN A 136 -9.144 -12.359 6.847 1.00 0.29 C ATOM 1587 C GLN A 136 -10.155 -13.500 6.711 1.00 0.42 C ATOM 1588 O GLN A 136 -9.939 -14.594 7.232 1.00 0.52 O ATOM 1589 CB GLN A 136 -9.490 -11.455 8.023 1.00 0.31 C ATOM 1590 CG GLN A 136 -8.393 -10.453 8.340 1.00 0.37 C ATOM 1591 CD GLN A 136 -8.892 -9.289 9.168 1.00 0.52 C ATOM 1592 OE1 GLN A 136 -8.883 -9.333 10.398 1.00 0.91 O ATOM 1593 NE2 GLN A 136 -9.328 -8.236 8.490 1.00 0.54 N ATOM 0 H GLN A 136 -9.285 -10.585 5.716 1.00 0.22 H new ATOM 0 HA GLN A 136 -8.172 -12.815 7.034 1.00 0.29 H new ATOM 0 HB2 GLN A 136 -10.413 -10.918 7.803 1.00 0.31 H new ATOM 0 HB3 GLN A 136 -9.680 -12.069 8.903 1.00 0.31 H new ATOM 0 HG2 GLN A 136 -7.589 -10.957 8.876 1.00 0.37 H new ATOM 0 HG3 GLN A 136 -7.969 -10.077 7.409 1.00 0.37 H new ATOM 0 HE21 GLN A 136 -9.316 -8.246 7.470 1.00 0.54 H new ATOM 0 HE22 GLN A 136 -9.675 -7.417 8.988 1.00 0.54 H new