USER MOD reduce.3.24.130724 H: found=0, std=0, add=1048, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1048 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 57 CYS SG : rot 55:sc= 0.554 USER MOD Set 1.2: A 89 HIS : no HE2:sc= -0.866 K(o=-0.31,f=-4.5!) USER MOD Set 2.1: A 29 TYR OH : rot 70:sc= 0.701 USER MOD Set 2.2: A 97 THR OG1 : rot -123:sc= 0.773 USER MOD Single : A 6 SER OG : rot 56:sc= 0.976 USER MOD Single : A 9 SER OG : rot 180:sc= -0.169 USER MOD Single : A 15 LYS NZ :NH3+ 166:sc=-0.00899 (180deg=-0.13) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ -170:sc=-0.00215 (180deg=-0.102) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= -3.91! C(o=-3.9!,f=-6.5!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 LYS NZ :NH3+ -121:sc= -0.0058 (180deg=-0.0144) USER MOD Single : A 33 HIS : no HD1:sc= -2.95! C(o=-3!,f=-9.3!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 47 ASN : amide:sc= -0.174 K(o=-0.17,f=-2.7!) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0.44 USER MOD Single : A 54 SER OG : rot -60:sc= -0.142 USER MOD Single : A 59 GLN : amide:sc= -0.0766 K(o=-0.077,f=-1.7!) USER MOD Single : A 63 GLN : amide:sc= -0.131 K(o=-0.13,f=-2.2!) USER MOD Single : A 65 GLN : amide:sc= -0.0502 K(o=-0.05,f=-0.93) USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot 180:sc= -1.1 USER MOD Single : A 80 ASN : amide:sc= -0.986 K(o=-0.99,f=-2.2!) USER MOD Single : A 81 THR OG1 : rot 79:sc= 0.995 USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 CYS SG : rot -31:sc= 0.598 USER MOD Single : A 90 GLN : amide:sc= -0.442 X(o=-0.44,f=-0.49) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 GLN : amide:sc=-0.00378 X(o=-0.0038,f=-0.12) USER MOD Single : A 109 ASN : amide:sc= -0.114 X(o=-0.11,f=-0.0062) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 LYS NZ :NH3+ -172:sc= -0.0765 (180deg=-0.102) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 122 THR OG1 : rot -21:sc= 0.817 USER MOD Single : A 124 ASN : amide:sc= -0.374 K(o=-0.37,f=-1.7) USER MOD Single : A 125 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 GLN : amide:sc=-0.00459 X(o=-0.0046,f=-0.27) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 131 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 132 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 -0.820 1.177 2.705 1.00 13.00 N ATOM 2 CA GLY A 2 0.059 1.127 1.552 1.00 45.03 C ATOM 3 C GLY A 2 1.432 0.583 1.893 1.00 71.22 C ATOM 4 O GLY A 2 1.667 0.131 3.014 1.00 42.43 O ATOM 0 HA2 GLY A 2 -0.394 0.504 0.781 1.00 45.03 H new ATOM 0 HA3 GLY A 2 0.162 2.128 1.134 1.00 45.03 H new ATOM 8 N ALA A 3 2.341 0.624 0.925 1.00 64.12 N ATOM 9 CA ALA A 3 3.698 0.132 1.128 1.00 71.01 C ATOM 10 C ALA A 3 4.712 0.989 0.378 1.00 72.12 C ATOM 11 O ALA A 3 4.341 1.849 -0.421 1.00 12.10 O ATOM 12 CB ALA A 3 3.804 -1.321 0.688 1.00 51.21 C ATOM 0 H ALA A 3 2.162 0.993 -0.009 1.00 64.12 H new ATOM 0 HA ALA A 3 3.925 0.196 2.192 1.00 71.01 H new ATOM 0 HB1 ALA A 3 4.823 -1.675 0.845 1.00 51.21 H new ATOM 0 HB2 ALA A 3 3.114 -1.929 1.273 1.00 51.21 H new ATOM 0 HB3 ALA A 3 3.551 -1.400 -0.369 1.00 51.21 H new ATOM 18 N ARG A 4 5.992 0.751 0.641 1.00 22.24 N ATOM 19 CA ARG A 4 7.059 1.502 -0.007 1.00 55.42 C ATOM 20 C ARG A 4 7.060 1.256 -1.513 1.00 74.30 C ATOM 21 O ARG A 4 6.494 0.273 -1.991 1.00 43.42 O ATOM 22 CB ARG A 4 8.416 1.117 0.584 1.00 13.40 C ATOM 23 CG ARG A 4 8.700 -0.375 0.534 1.00 5.52 C ATOM 24 CD ARG A 4 10.192 -0.661 0.619 1.00 51.40 C ATOM 25 NE ARG A 4 10.550 -1.332 1.865 1.00 65.42 N ATOM 26 CZ ARG A 4 11.705 -1.963 2.054 1.00 51.34 C ATOM 27 NH1 ARG A 4 12.607 -2.005 1.083 1.00 23.44 N ATOM 28 NH2 ARG A 4 11.959 -2.550 3.216 1.00 50.41 N ATOM 0 H ARG A 4 6.316 0.043 1.300 1.00 22.24 H new ATOM 0 HA ARG A 4 6.881 2.563 0.171 1.00 55.42 H new ATOM 0 HB2 ARG A 4 9.201 1.646 0.044 1.00 13.40 H new ATOM 0 HB3 ARG A 4 8.460 1.452 1.620 1.00 13.40 H new ATOM 0 HG2 ARG A 4 8.186 -0.872 1.356 1.00 5.52 H new ATOM 0 HG3 ARG A 4 8.300 -0.792 -0.391 1.00 5.52 H new ATOM 0 HD2 ARG A 4 10.491 -1.282 -0.226 1.00 51.40 H new ATOM 0 HD3 ARG A 4 10.746 0.275 0.539 1.00 51.40 H new ATOM 0 HE ARG A 4 9.878 -1.316 2.632 1.00 65.42 H new ATOM 0 HH11 ARG A 4 12.415 -1.553 0.189 1.00 23.44 H new ATOM 0 HH12 ARG A 4 13.492 -2.490 1.230 1.00 23.44 H new ATOM 0 HH21 ARG A 4 11.268 -2.518 3.966 1.00 50.41 H new ATOM 0 HH22 ARG A 4 12.845 -3.034 3.360 1.00 50.41 H new ATOM 42 N ALA A 5 7.697 2.156 -2.254 1.00 42.04 N ATOM 43 CA ALA A 5 7.773 2.035 -3.705 1.00 3.25 C ATOM 44 C ALA A 5 8.964 2.810 -4.259 1.00 1.42 C ATOM 45 O ALA A 5 9.673 3.491 -3.518 1.00 64.40 O ATOM 46 CB ALA A 5 6.481 2.523 -4.343 1.00 44.32 C ATOM 0 H ALA A 5 8.168 2.977 -1.874 1.00 42.04 H new ATOM 0 HA ALA A 5 7.912 0.982 -3.950 1.00 3.25 H new ATOM 0 HB1 ALA A 5 6.551 2.427 -5.426 1.00 44.32 H new ATOM 0 HB2 ALA A 5 5.646 1.924 -3.979 1.00 44.32 H new ATOM 0 HB3 ALA A 5 6.318 3.568 -4.081 1.00 44.32 H new ATOM 52 N SER A 6 9.179 2.702 -5.566 1.00 33.21 N ATOM 53 CA SER A 6 10.288 3.388 -6.218 1.00 73.21 C ATOM 54 C SER A 6 9.841 4.005 -7.541 1.00 23.24 C ATOM 55 O SER A 6 10.255 3.567 -8.614 1.00 32.11 O ATOM 56 CB SER A 6 11.445 2.418 -6.460 1.00 0.11 C ATOM 57 OG SER A 6 11.087 1.422 -7.403 1.00 41.32 O ATOM 0 H SER A 6 8.599 2.146 -6.195 1.00 33.21 H new ATOM 0 HA SER A 6 10.627 4.187 -5.559 1.00 73.21 H new ATOM 0 HB2 SER A 6 12.315 2.967 -6.819 1.00 0.11 H new ATOM 0 HB3 SER A 6 11.731 1.947 -5.520 1.00 0.11 H new ATOM 0 HG SER A 6 10.790 1.849 -8.233 1.00 41.32 H new ATOM 63 N VAL A 7 8.995 5.026 -7.455 1.00 12.22 N ATOM 64 CA VAL A 7 8.493 5.705 -8.643 1.00 33.11 C ATOM 65 C VAL A 7 9.191 7.044 -8.847 1.00 53.52 C ATOM 66 O VAL A 7 9.751 7.310 -9.912 1.00 34.42 O ATOM 67 CB VAL A 7 6.972 5.939 -8.556 1.00 3.32 C ATOM 68 CG1 VAL A 7 6.491 6.767 -9.737 1.00 21.13 C ATOM 69 CG2 VAL A 7 6.232 4.612 -8.486 1.00 60.23 C ATOM 0 H VAL A 7 8.643 5.401 -6.574 1.00 12.22 H new ATOM 0 HA VAL A 7 8.705 5.055 -9.492 1.00 33.11 H new ATOM 0 HB VAL A 7 6.759 6.495 -7.643 1.00 3.32 H new ATOM 0 HG11 VAL A 7 5.415 6.922 -9.659 1.00 21.13 H new ATOM 0 HG12 VAL A 7 6.998 7.732 -9.735 1.00 21.13 H new ATOM 0 HG13 VAL A 7 6.715 6.241 -10.665 1.00 21.13 H new ATOM 0 HG21 VAL A 7 5.159 4.796 -8.425 1.00 60.23 H new ATOM 0 HG22 VAL A 7 6.449 4.027 -9.379 1.00 60.23 H new ATOM 0 HG23 VAL A 7 6.556 4.061 -7.603 1.00 60.23 H new ATOM 79 N LEU A 8 9.155 7.886 -7.820 1.00 71.13 N ATOM 80 CA LEU A 8 9.786 9.200 -7.886 1.00 13.23 C ATOM 81 C LEU A 8 11.040 9.246 -7.018 1.00 54.33 C ATOM 82 O LEU A 8 11.075 8.673 -5.929 1.00 22.01 O ATOM 83 CB LEU A 8 8.803 10.282 -7.437 1.00 52.45 C ATOM 84 CG LEU A 8 7.476 10.339 -8.195 1.00 75.01 C ATOM 85 CD1 LEU A 8 6.644 11.523 -7.728 1.00 34.13 C ATOM 86 CD2 LEU A 8 7.720 10.415 -9.695 1.00 73.02 C ATOM 0 H LEU A 8 8.696 7.683 -6.932 1.00 71.13 H new ATOM 0 HA LEU A 8 10.075 9.386 -8.921 1.00 13.23 H new ATOM 0 HB2 LEU A 8 8.588 10.133 -6.379 1.00 52.45 H new ATOM 0 HB3 LEU A 8 9.293 11.251 -7.529 1.00 52.45 H new ATOM 0 HG LEU A 8 6.921 9.425 -7.984 1.00 75.01 H new ATOM 0 HD11 LEU A 8 5.704 11.547 -8.279 1.00 34.13 H new ATOM 0 HD12 LEU A 8 6.438 11.425 -6.662 1.00 34.13 H new ATOM 0 HD13 LEU A 8 7.193 12.447 -7.908 1.00 34.13 H new ATOM 0 HD21 LEU A 8 6.764 10.455 -10.218 1.00 73.02 H new ATOM 0 HD22 LEU A 8 8.297 11.311 -9.925 1.00 73.02 H new ATOM 0 HD23 LEU A 8 8.274 9.534 -10.019 1.00 73.02 H new ATOM 98 N SER A 9 12.067 9.934 -7.507 1.00 62.25 N ATOM 99 CA SER A 9 13.324 10.053 -6.778 1.00 72.11 C ATOM 100 C SER A 9 13.260 11.197 -5.771 1.00 5.35 C ATOM 101 O SER A 9 12.271 11.925 -5.702 1.00 71.25 O ATOM 102 CB SER A 9 14.483 10.279 -7.751 1.00 1.23 C ATOM 103 OG SER A 9 14.795 11.657 -7.861 1.00 50.13 O ATOM 0 H SER A 9 12.053 10.417 -8.405 1.00 62.25 H new ATOM 0 HA SER A 9 13.491 9.123 -6.235 1.00 72.11 H new ATOM 0 HB2 SER A 9 15.361 9.730 -7.410 1.00 1.23 H new ATOM 0 HB3 SER A 9 14.221 9.883 -8.732 1.00 1.23 H new ATOM 0 HG SER A 9 15.540 11.775 -8.487 1.00 50.13 H new ATOM 109 N GLY A 10 14.325 11.349 -4.989 1.00 10.30 N ATOM 110 CA GLY A 10 14.371 12.406 -3.995 1.00 23.31 C ATOM 111 C GLY A 10 14.066 13.769 -4.583 1.00 73.52 C ATOM 112 O GLY A 10 13.329 14.557 -3.991 1.00 72.32 O ATOM 0 H GLY A 10 15.156 10.759 -5.026 1.00 10.30 H new ATOM 0 HA2 GLY A 10 13.655 12.187 -3.203 1.00 23.31 H new ATOM 0 HA3 GLY A 10 15.359 12.425 -3.535 1.00 23.31 H new ATOM 116 N GLY A 11 14.635 14.049 -5.751 1.00 1.11 N ATOM 117 CA GLY A 11 14.409 15.328 -6.399 1.00 20.30 C ATOM 118 C GLY A 11 13.022 15.435 -7.001 1.00 40.42 C ATOM 119 O GLY A 11 12.348 16.452 -6.844 1.00 4.13 O ATOM 0 H GLY A 11 15.249 13.413 -6.260 1.00 1.11 H new ATOM 0 HA2 GLY A 11 14.550 16.129 -5.674 1.00 20.30 H new ATOM 0 HA3 GLY A 11 15.154 15.472 -7.182 1.00 20.30 H new ATOM 123 N GLU A 12 12.597 14.383 -7.694 1.00 15.40 N ATOM 124 CA GLU A 12 11.281 14.366 -8.324 1.00 44.25 C ATOM 125 C GLU A 12 10.175 14.467 -7.278 1.00 45.05 C ATOM 126 O GLU A 12 9.145 15.102 -7.507 1.00 32.52 O ATOM 127 CB GLU A 12 11.104 13.090 -9.150 1.00 32.15 C ATOM 128 CG GLU A 12 12.296 12.765 -10.033 1.00 64.11 C ATOM 129 CD GLU A 12 12.062 11.546 -10.904 1.00 70.13 C ATOM 130 OE1 GLU A 12 12.176 10.416 -10.385 1.00 73.02 O ATOM 131 OE2 GLU A 12 11.766 11.722 -12.104 1.00 14.12 O ATOM 0 H GLU A 12 13.143 13.533 -7.833 1.00 15.40 H new ATOM 0 HA GLU A 12 11.211 15.230 -8.984 1.00 44.25 H new ATOM 0 HB2 GLU A 12 10.924 12.253 -8.475 1.00 32.15 H new ATOM 0 HB3 GLU A 12 10.217 13.192 -9.775 1.00 32.15 H new ATOM 0 HG2 GLU A 12 12.518 13.623 -10.668 1.00 64.11 H new ATOM 0 HG3 GLU A 12 13.172 12.597 -9.407 1.00 64.11 H new ATOM 138 N LEU A 13 10.396 13.836 -6.130 1.00 62.21 N ATOM 139 CA LEU A 13 9.419 13.853 -5.047 1.00 74.31 C ATOM 140 C LEU A 13 9.020 15.282 -4.697 1.00 14.32 C ATOM 141 O LEU A 13 7.843 15.574 -4.481 1.00 31.51 O ATOM 142 CB LEU A 13 9.985 13.152 -3.812 1.00 25.45 C ATOM 143 CG LEU A 13 8.987 12.851 -2.693 1.00 52.35 C ATOM 144 CD1 LEU A 13 8.047 11.727 -3.104 1.00 3.43 C ATOM 145 CD2 LEU A 13 9.717 12.495 -1.407 1.00 22.05 C ATOM 0 H LEU A 13 11.243 13.306 -5.925 1.00 62.21 H new ATOM 0 HA LEU A 13 8.530 13.319 -5.384 1.00 74.31 H new ATOM 0 HB2 LEU A 13 10.439 12.213 -4.128 1.00 25.45 H new ATOM 0 HB3 LEU A 13 10.784 13.770 -3.402 1.00 25.45 H new ATOM 0 HG LEU A 13 8.393 13.747 -2.513 1.00 52.35 H new ATOM 0 HD11 LEU A 13 7.344 11.527 -2.295 1.00 3.43 H new ATOM 0 HD12 LEU A 13 7.497 12.021 -3.998 1.00 3.43 H new ATOM 0 HD13 LEU A 13 8.625 10.827 -3.313 1.00 3.43 H new ATOM 0 HD21 LEU A 13 8.990 12.284 -0.622 1.00 22.05 H new ATOM 0 HD22 LEU A 13 10.338 11.614 -1.573 1.00 22.05 H new ATOM 0 HD23 LEU A 13 10.347 13.331 -1.103 1.00 22.05 H new ATOM 157 N ASP A 14 10.006 16.171 -4.644 1.00 23.44 N ATOM 158 CA ASP A 14 9.757 17.571 -4.322 1.00 62.15 C ATOM 159 C ASP A 14 8.647 18.140 -5.200 1.00 1.34 C ATOM 160 O ASP A 14 7.685 18.726 -4.701 1.00 52.12 O ATOM 161 CB ASP A 14 11.035 18.392 -4.500 1.00 25.42 C ATOM 162 CG ASP A 14 11.025 19.665 -3.678 1.00 51.14 C ATOM 163 OD1 ASP A 14 10.282 19.718 -2.675 1.00 13.40 O ATOM 164 OD2 ASP A 14 11.760 20.609 -4.037 1.00 40.11 O ATOM 0 H ASP A 14 10.985 15.947 -4.820 1.00 23.44 H new ATOM 0 HA ASP A 14 9.439 17.628 -3.281 1.00 62.15 H new ATOM 0 HB2 ASP A 14 11.895 17.786 -4.215 1.00 25.42 H new ATOM 0 HB3 ASP A 14 11.157 18.644 -5.553 1.00 25.42 H new ATOM 169 N LYS A 15 8.785 17.966 -6.509 1.00 43.21 N ATOM 170 CA LYS A 15 7.795 18.462 -7.457 1.00 51.32 C ATOM 171 C LYS A 15 6.417 17.880 -7.159 1.00 1.53 C ATOM 172 O LYS A 15 5.434 18.613 -7.051 1.00 63.21 O ATOM 173 CB LYS A 15 8.209 18.112 -8.889 1.00 12.32 C ATOM 174 CG LYS A 15 8.868 19.263 -9.630 1.00 74.11 C ATOM 175 CD LYS A 15 7.837 20.166 -10.287 1.00 63.11 C ATOM 176 CE LYS A 15 8.492 21.169 -11.224 1.00 2.21 C ATOM 177 NZ LYS A 15 9.023 20.517 -12.453 1.00 14.22 N ATOM 0 H LYS A 15 9.575 17.484 -6.939 1.00 43.21 H new ATOM 0 HA LYS A 15 7.742 19.546 -7.355 1.00 51.32 H new ATOM 0 HB2 LYS A 15 8.896 17.266 -8.863 1.00 12.32 H new ATOM 0 HB3 LYS A 15 7.328 17.790 -9.445 1.00 12.32 H new ATOM 0 HG2 LYS A 15 9.473 19.845 -8.935 1.00 74.11 H new ATOM 0 HG3 LYS A 15 9.544 18.869 -10.389 1.00 74.11 H new ATOM 0 HD2 LYS A 15 7.122 19.560 -10.843 1.00 63.11 H new ATOM 0 HD3 LYS A 15 7.275 20.697 -9.519 1.00 63.11 H new ATOM 0 HE2 LYS A 15 7.766 21.933 -11.503 1.00 2.21 H new ATOM 0 HE3 LYS A 15 9.304 21.676 -10.703 1.00 2.21 H new ATOM 0 HZ1 LYS A 15 9.244 21.244 -13.164 1.00 14.22 H new ATOM 0 HZ2 LYS A 15 9.887 19.987 -12.219 1.00 14.22 H new ATOM 0 HZ3 LYS A 15 8.310 19.864 -12.836 1.00 14.22 H new ATOM 191 N TRP A 16 6.354 16.560 -7.025 1.00 12.43 N ATOM 192 CA TRP A 16 5.096 15.881 -6.737 1.00 1.35 C ATOM 193 C TRP A 16 4.384 16.531 -5.556 1.00 12.21 C ATOM 194 O TRP A 16 3.244 16.979 -5.678 1.00 42.14 O ATOM 195 CB TRP A 16 5.347 14.401 -6.444 1.00 64.50 C ATOM 196 CG TRP A 16 4.097 13.636 -6.134 1.00 74.21 C ATOM 197 CD1 TRP A 16 3.618 13.315 -4.896 1.00 32.53 C ATOM 198 CD2 TRP A 16 3.166 13.094 -7.078 1.00 5.10 C ATOM 199 NE1 TRP A 16 2.446 12.607 -5.014 1.00 24.53 N ATOM 200 CE2 TRP A 16 2.148 12.459 -6.342 1.00 71.43 C ATOM 201 CE3 TRP A 16 3.095 13.087 -8.474 1.00 20.55 C ATOM 202 CZ2 TRP A 16 1.073 11.822 -6.956 1.00 22.21 C ATOM 203 CZ3 TRP A 16 2.027 12.453 -9.082 1.00 14.43 C ATOM 204 CH2 TRP A 16 1.027 11.830 -8.324 1.00 71.21 C ATOM 0 H TRP A 16 7.159 15.939 -7.111 1.00 12.43 H new ATOM 0 HA TRP A 16 4.456 15.967 -7.615 1.00 1.35 H new ATOM 0 HB2 TRP A 16 5.839 13.946 -7.304 1.00 64.50 H new ATOM 0 HB3 TRP A 16 6.034 14.316 -5.602 1.00 64.50 H new ATOM 0 HD1 TRP A 16 4.091 13.579 -3.961 1.00 32.53 H new ATOM 0 HE1 TRP A 16 1.889 12.250 -4.238 1.00 24.53 H new ATOM 0 HE3 TRP A 16 3.860 13.568 -9.066 1.00 20.55 H new ATOM 0 HZ2 TRP A 16 0.303 11.339 -6.374 1.00 22.21 H new ATOM 0 HZ3 TRP A 16 1.963 12.438 -10.160 1.00 14.43 H new ATOM 0 HH2 TRP A 16 0.204 11.347 -8.829 1.00 71.21 H new ATOM 215 N GLU A 17 5.063 16.581 -4.414 1.00 60.13 N ATOM 216 CA GLU A 17 4.492 17.177 -3.212 1.00 42.52 C ATOM 217 C GLU A 17 4.097 18.629 -3.460 1.00 44.43 C ATOM 218 O GLU A 17 3.253 19.184 -2.757 1.00 34.01 O ATOM 219 CB GLU A 17 5.490 17.100 -2.055 1.00 64.42 C ATOM 220 CG GLU A 17 5.635 15.705 -1.469 1.00 23.02 C ATOM 221 CD GLU A 17 6.425 15.695 -0.174 1.00 0.52 C ATOM 222 OE1 GLU A 17 6.015 16.392 0.777 1.00 11.33 O ATOM 223 OE2 GLU A 17 7.454 14.990 -0.113 1.00 33.31 O ATOM 0 H GLU A 17 6.008 16.216 -4.296 1.00 60.13 H new ATOM 0 HA GLU A 17 3.596 16.614 -2.949 1.00 42.52 H new ATOM 0 HB2 GLU A 17 6.465 17.442 -2.403 1.00 64.42 H new ATOM 0 HB3 GLU A 17 5.175 17.785 -1.268 1.00 64.42 H new ATOM 0 HG2 GLU A 17 4.645 15.286 -1.289 1.00 23.02 H new ATOM 0 HG3 GLU A 17 6.128 15.059 -2.196 1.00 23.02 H new ATOM 230 N LYS A 18 4.714 19.241 -4.466 1.00 51.52 N ATOM 231 CA LYS A 18 4.428 20.629 -4.810 1.00 13.43 C ATOM 232 C LYS A 18 3.052 20.756 -5.456 1.00 42.51 C ATOM 233 O LYS A 18 2.108 21.248 -4.837 1.00 1.23 O ATOM 234 CB LYS A 18 5.501 21.173 -5.756 1.00 11.55 C ATOM 235 CG LYS A 18 6.191 22.423 -5.237 1.00 43.32 C ATOM 236 CD LYS A 18 7.134 23.010 -6.274 1.00 41.33 C ATOM 237 CE LYS A 18 8.065 24.044 -5.660 1.00 32.10 C ATOM 238 NZ LYS A 18 8.773 24.840 -6.700 1.00 44.22 N ATOM 0 H LYS A 18 5.416 18.797 -5.058 1.00 51.52 H new ATOM 0 HA LYS A 18 4.434 21.214 -3.891 1.00 13.43 H new ATOM 0 HB2 LYS A 18 6.249 20.399 -5.927 1.00 11.55 H new ATOM 0 HB3 LYS A 18 5.045 21.394 -6.721 1.00 11.55 H new ATOM 0 HG2 LYS A 18 5.442 23.166 -4.963 1.00 43.32 H new ATOM 0 HG3 LYS A 18 6.748 22.183 -4.331 1.00 43.32 H new ATOM 0 HD2 LYS A 18 7.723 22.211 -6.725 1.00 41.33 H new ATOM 0 HD3 LYS A 18 6.555 23.470 -7.075 1.00 41.33 H new ATOM 0 HE2 LYS A 18 7.492 24.713 -5.018 1.00 32.10 H new ATOM 0 HE3 LYS A 18 8.796 23.543 -5.026 1.00 32.10 H new ATOM 0 HZ1 LYS A 18 9.398 25.533 -6.241 1.00 44.22 H new ATOM 0 HZ2 LYS A 18 9.340 24.205 -7.297 1.00 44.22 H new ATOM 0 HZ3 LYS A 18 8.076 25.339 -7.290 1.00 44.22 H new ATOM 252 N ILE A 19 2.947 20.311 -6.704 1.00 12.34 N ATOM 253 CA ILE A 19 1.686 20.374 -7.432 1.00 14.33 C ATOM 254 C ILE A 19 0.508 20.030 -6.524 1.00 65.21 C ATOM 255 O ILE A 19 0.628 19.200 -5.623 1.00 5.12 O ATOM 256 CB ILE A 19 1.685 19.418 -8.639 1.00 52.15 C ATOM 257 CG1 ILE A 19 2.833 19.762 -9.590 1.00 60.03 C ATOM 258 CG2 ILE A 19 0.350 19.484 -9.367 1.00 14.54 C ATOM 259 CD1 ILE A 19 3.379 18.564 -10.336 1.00 70.32 C ATOM 0 H ILE A 19 3.719 19.903 -7.231 1.00 12.34 H new ATOM 0 HA ILE A 19 1.579 21.398 -7.789 1.00 14.33 H new ATOM 0 HB ILE A 19 1.829 18.400 -8.277 1.00 52.15 H new ATOM 0 HG12 ILE A 19 2.487 20.502 -10.311 1.00 60.03 H new ATOM 0 HG13 ILE A 19 3.640 20.224 -9.021 1.00 60.03 H new ATOM 0 HG21 ILE A 19 0.365 18.803 -10.218 1.00 14.54 H new ATOM 0 HG22 ILE A 19 -0.451 19.196 -8.686 1.00 14.54 H new ATOM 0 HG23 ILE A 19 0.178 20.501 -9.720 1.00 14.54 H new ATOM 0 HD11 ILE A 19 4.190 18.882 -10.991 1.00 70.32 H new ATOM 0 HD12 ILE A 19 3.756 17.832 -9.622 1.00 70.32 H new ATOM 0 HD13 ILE A 19 2.585 18.114 -10.933 1.00 70.32 H new ATOM 271 N ARG A 20 -0.628 20.672 -6.771 1.00 31.34 N ATOM 272 CA ARG A 20 -1.828 20.434 -5.976 1.00 4.11 C ATOM 273 C ARG A 20 -2.775 19.477 -6.696 1.00 12.51 C ATOM 274 O ARG A 20 -2.597 19.182 -7.878 1.00 2.22 O ATOM 275 CB ARG A 20 -2.543 21.754 -5.685 1.00 71.10 C ATOM 276 CG ARG A 20 -1.707 22.734 -4.877 1.00 32.21 C ATOM 277 CD ARG A 20 -2.127 24.172 -5.139 1.00 3.13 C ATOM 278 NE ARG A 20 -1.009 25.102 -5.006 1.00 21.41 N ATOM 279 CZ ARG A 20 -0.498 25.474 -3.838 1.00 13.43 C ATOM 280 NH1 ARG A 20 -1.004 24.999 -2.708 1.00 3.12 N ATOM 281 NH2 ARG A 20 0.520 26.324 -3.798 1.00 32.25 N ATOM 0 H ARG A 20 -0.744 21.361 -7.514 1.00 31.34 H new ATOM 0 HA ARG A 20 -1.525 19.978 -5.033 1.00 4.11 H new ATOM 0 HB2 ARG A 20 -2.824 22.221 -6.629 1.00 71.10 H new ATOM 0 HB3 ARG A 20 -3.467 21.546 -5.145 1.00 71.10 H new ATOM 0 HG2 ARG A 20 -1.809 22.512 -3.815 1.00 32.21 H new ATOM 0 HG3 ARG A 20 -0.654 22.610 -5.129 1.00 32.21 H new ATOM 0 HD2 ARG A 20 -2.546 24.250 -6.142 1.00 3.13 H new ATOM 0 HD3 ARG A 20 -2.916 24.452 -4.441 1.00 3.13 H new ATOM 0 HE ARG A 20 -0.598 25.487 -5.857 1.00 21.41 H new ATOM 0 HH11 ARG A 20 -1.787 24.346 -2.735 1.00 3.12 H new ATOM 0 HH12 ARG A 20 -0.610 25.286 -1.812 1.00 3.12 H new ATOM 0 HH21 ARG A 20 0.911 26.693 -4.665 1.00 32.25 H new ATOM 0 HH22 ARG A 20 0.912 26.609 -2.900 1.00 32.25 H new ATOM 295 N LEU A 21 -3.781 18.997 -5.974 1.00 53.24 N ATOM 296 CA LEU A 21 -4.758 18.073 -6.543 1.00 44.30 C ATOM 297 C LEU A 21 -5.853 18.829 -7.289 1.00 45.44 C ATOM 298 O LEU A 21 -6.264 18.430 -8.378 1.00 31.23 O ATOM 299 CB LEU A 21 -5.377 17.212 -5.441 1.00 2.15 C ATOM 300 CG LEU A 21 -4.401 16.369 -4.620 1.00 1.23 C ATOM 301 CD1 LEU A 21 -4.745 16.444 -3.140 1.00 33.03 C ATOM 302 CD2 LEU A 21 -4.409 14.925 -5.099 1.00 14.32 C ATOM 0 H LEU A 21 -3.942 19.231 -4.994 1.00 53.24 H new ATOM 0 HA LEU A 21 -4.240 17.427 -7.252 1.00 44.30 H new ATOM 0 HB2 LEU A 21 -5.923 17.866 -4.760 1.00 2.15 H new ATOM 0 HB3 LEU A 21 -6.108 16.544 -5.897 1.00 2.15 H new ATOM 0 HG LEU A 21 -3.397 16.771 -4.760 1.00 1.23 H new ATOM 0 HD11 LEU A 21 -4.040 15.838 -2.571 1.00 33.03 H new ATOM 0 HD12 LEU A 21 -4.686 17.480 -2.805 1.00 33.03 H new ATOM 0 HD13 LEU A 21 -5.756 16.068 -2.982 1.00 33.03 H new ATOM 0 HD21 LEU A 21 -3.708 14.340 -4.503 1.00 14.32 H new ATOM 0 HD22 LEU A 21 -5.412 14.511 -4.990 1.00 14.32 H new ATOM 0 HD23 LEU A 21 -4.113 14.888 -6.147 1.00 14.32 H new ATOM 314 N ARG A 22 -6.318 19.924 -6.696 1.00 2.40 N ATOM 315 CA ARG A 22 -7.364 20.737 -7.305 1.00 2.00 C ATOM 316 C ARG A 22 -6.813 22.090 -7.747 1.00 23.44 C ATOM 317 O ARG A 22 -5.775 22.551 -7.271 1.00 52.01 O ATOM 318 CB ARG A 22 -8.518 20.941 -6.322 1.00 71.22 C ATOM 319 CG ARG A 22 -9.656 19.949 -6.505 1.00 45.43 C ATOM 320 CD ARG A 22 -10.195 19.467 -5.168 1.00 23.12 C ATOM 321 NE ARG A 22 -9.292 18.518 -4.523 1.00 3.22 N ATOM 322 CZ ARG A 22 -9.375 18.180 -3.240 1.00 62.14 C ATOM 323 NH1 ARG A 22 -10.315 18.709 -2.472 1.00 2.24 N ATOM 324 NH2 ARG A 22 -8.515 17.309 -2.726 1.00 34.30 N ATOM 0 H ARG A 22 -5.987 20.268 -5.795 1.00 2.40 H new ATOM 0 HA ARG A 22 -7.734 20.210 -8.184 1.00 2.00 H new ATOM 0 HB2 ARG A 22 -8.136 20.859 -5.304 1.00 71.22 H new ATOM 0 HB3 ARG A 22 -8.907 21.953 -6.436 1.00 71.22 H new ATOM 0 HG2 ARG A 22 -10.459 20.416 -7.075 1.00 45.43 H new ATOM 0 HG3 ARG A 22 -9.307 19.096 -7.087 1.00 45.43 H new ATOM 0 HD2 ARG A 22 -10.351 20.322 -4.511 1.00 23.12 H new ATOM 0 HD3 ARG A 22 -11.167 18.998 -5.317 1.00 23.12 H new ATOM 0 HE ARG A 22 -8.558 18.091 -5.088 1.00 3.22 H new ATOM 0 HH11 ARG A 22 -10.978 19.378 -2.864 1.00 2.24 H new ATOM 0 HH12 ARG A 22 -10.376 18.448 -1.488 1.00 2.24 H new ATOM 0 HH21 ARG A 22 -7.791 16.899 -3.316 1.00 34.30 H new ATOM 0 HH22 ARG A 22 -8.579 17.050 -1.742 1.00 34.30 H new ATOM 338 N PRO A 23 -7.523 22.742 -8.679 1.00 43.24 N ATOM 339 CA PRO A 23 -7.125 24.050 -9.206 1.00 13.40 C ATOM 340 C PRO A 23 -7.277 25.162 -8.173 1.00 31.14 C ATOM 341 O PRO A 23 -6.360 25.953 -7.959 1.00 10.12 O ATOM 342 CB PRO A 23 -8.089 24.271 -10.374 1.00 65.02 C ATOM 343 CG PRO A 23 -9.286 23.451 -10.038 1.00 62.22 C ATOM 344 CD PRO A 23 -8.770 22.252 -9.291 1.00 63.13 C ATOM 0 HA PRO A 23 -6.074 24.070 -9.493 1.00 13.40 H new ATOM 0 HB2 PRO A 23 -8.348 25.325 -10.480 1.00 65.02 H new ATOM 0 HB3 PRO A 23 -7.645 23.956 -11.318 1.00 65.02 H new ATOM 0 HG2 PRO A 23 -9.989 24.018 -9.428 1.00 62.22 H new ATOM 0 HG3 PRO A 23 -9.818 23.149 -10.940 1.00 62.22 H new ATOM 0 HD2 PRO A 23 -9.480 21.911 -8.538 1.00 63.13 H new ATOM 0 HD3 PRO A 23 -8.586 21.411 -9.959 1.00 63.13 H new ATOM 352 N GLY A 24 -8.442 25.215 -7.534 1.00 23.34 N ATOM 353 CA GLY A 24 -8.692 26.232 -6.530 1.00 52.12 C ATOM 354 C GLY A 24 -8.691 25.671 -5.123 1.00 11.52 C ATOM 355 O GLY A 24 -9.551 26.012 -4.310 1.00 61.41 O ATOM 0 H GLY A 24 -9.217 24.571 -7.694 1.00 23.34 H new ATOM 0 HA2 GLY A 24 -7.932 27.010 -6.608 1.00 52.12 H new ATOM 0 HA3 GLY A 24 -9.654 26.705 -6.728 1.00 52.12 H new ATOM 359 N GLY A 25 -7.724 24.806 -4.833 1.00 22.42 N ATOM 360 CA GLY A 25 -7.635 24.209 -3.513 1.00 73.42 C ATOM 361 C GLY A 25 -6.423 24.689 -2.740 1.00 4.43 C ATOM 362 O GLY A 25 -5.715 25.594 -3.181 1.00 62.10 O ATOM 0 H GLY A 25 -7.001 24.508 -5.488 1.00 22.42 H new ATOM 0 HA2 GLY A 25 -8.538 24.444 -2.950 1.00 73.42 H new ATOM 0 HA3 GLY A 25 -7.594 23.124 -3.610 1.00 73.42 H new ATOM 366 N LYS A 26 -6.184 24.083 -1.582 1.00 2.34 N ATOM 367 CA LYS A 26 -5.049 24.455 -0.744 1.00 31.13 C ATOM 368 C LYS A 26 -4.248 23.223 -0.336 1.00 65.52 C ATOM 369 O LYS A 26 -3.290 23.318 0.431 1.00 33.11 O ATOM 370 CB LYS A 26 -5.532 25.197 0.504 1.00 20.25 C ATOM 371 CG LYS A 26 -6.033 26.603 0.221 1.00 43.14 C ATOM 372 CD LYS A 26 -5.025 27.653 0.659 1.00 71.53 C ATOM 373 CE LYS A 26 -5.492 29.056 0.305 1.00 32.12 C ATOM 374 NZ LYS A 26 -5.487 29.288 -1.167 1.00 22.24 N ATOM 0 H LYS A 26 -6.761 23.332 -1.202 1.00 2.34 H new ATOM 0 HA LYS A 26 -4.402 25.113 -1.324 1.00 31.13 H new ATOM 0 HB2 LYS A 26 -6.332 24.623 0.971 1.00 20.25 H new ATOM 0 HB3 LYS A 26 -4.715 25.250 1.224 1.00 20.25 H new ATOM 0 HG2 LYS A 26 -6.233 26.711 -0.845 1.00 43.14 H new ATOM 0 HG3 LYS A 26 -6.978 26.765 0.740 1.00 43.14 H new ATOM 0 HD2 LYS A 26 -4.868 27.581 1.735 1.00 71.53 H new ATOM 0 HD3 LYS A 26 -4.064 27.457 0.183 1.00 71.53 H new ATOM 0 HE2 LYS A 26 -6.498 29.213 0.694 1.00 32.12 H new ATOM 0 HE3 LYS A 26 -4.845 29.787 0.790 1.00 32.12 H new ATOM 0 HZ1 LYS A 26 -5.646 30.298 -1.360 1.00 22.24 H new ATOM 0 HZ2 LYS A 26 -4.568 29.001 -1.561 1.00 22.24 H new ATOM 0 HZ3 LYS A 26 -6.243 28.728 -1.609 1.00 22.24 H new ATOM 388 N LYS A 27 -4.644 22.066 -0.857 1.00 22.01 N ATOM 389 CA LYS A 27 -3.961 20.814 -0.551 1.00 12.33 C ATOM 390 C LYS A 27 -2.986 20.441 -1.663 1.00 30.42 C ATOM 391 O LYS A 27 -3.218 20.745 -2.832 1.00 73.13 O ATOM 392 CB LYS A 27 -4.979 19.689 -0.351 1.00 11.32 C ATOM 393 CG LYS A 27 -5.297 19.409 1.107 1.00 43.32 C ATOM 394 CD LYS A 27 -5.209 17.926 1.422 1.00 22.51 C ATOM 395 CE LYS A 27 -6.404 17.456 2.236 1.00 75.34 C ATOM 396 NZ LYS A 27 -7.541 17.047 1.365 1.00 73.14 N ATOM 0 H LYS A 27 -5.435 21.969 -1.494 1.00 22.01 H new ATOM 0 HA LYS A 27 -3.397 20.952 0.371 1.00 12.33 H new ATOM 0 HB2 LYS A 27 -5.901 19.948 -0.872 1.00 11.32 H new ATOM 0 HB3 LYS A 27 -4.597 18.778 -0.812 1.00 11.32 H new ATOM 0 HG2 LYS A 27 -4.604 19.959 1.744 1.00 43.32 H new ATOM 0 HG3 LYS A 27 -6.298 19.772 1.338 1.00 43.32 H new ATOM 0 HD2 LYS A 27 -5.155 17.359 0.493 1.00 22.51 H new ATOM 0 HD3 LYS A 27 -4.290 17.724 1.973 1.00 22.51 H new ATOM 0 HE2 LYS A 27 -6.108 16.616 2.865 1.00 75.34 H new ATOM 0 HE3 LYS A 27 -6.726 18.256 2.903 1.00 75.34 H new ATOM 0 HZ1 LYS A 27 -8.336 16.733 1.957 1.00 73.14 H new ATOM 0 HZ2 LYS A 27 -7.841 17.855 0.783 1.00 73.14 H new ATOM 0 HZ3 LYS A 27 -7.241 16.267 0.746 1.00 73.14 H new ATOM 410 N GLN A 28 -1.895 19.778 -1.290 1.00 11.31 N ATOM 411 CA GLN A 28 -0.886 19.363 -2.256 1.00 74.34 C ATOM 412 C GLN A 28 -0.893 17.848 -2.434 1.00 33.03 C ATOM 413 O GLN A 28 -1.581 17.132 -1.707 1.00 32.43 O ATOM 414 CB GLN A 28 0.501 19.830 -1.810 1.00 73.42 C ATOM 415 CG GLN A 28 1.175 18.884 -0.830 1.00 35.54 C ATOM 416 CD GLN A 28 0.283 18.528 0.345 1.00 42.24 C ATOM 417 OE1 GLN A 28 0.011 17.355 0.600 1.00 3.10 O ATOM 418 NE2 GLN A 28 -0.177 19.543 1.067 1.00 40.34 N ATOM 0 H GLN A 28 -1.688 19.517 -0.326 1.00 11.31 H new ATOM 0 HA GLN A 28 -1.126 19.824 -3.214 1.00 74.34 H new ATOM 0 HB2 GLN A 28 1.137 19.944 -2.688 1.00 73.42 H new ATOM 0 HB3 GLN A 28 0.413 20.814 -1.350 1.00 73.42 H new ATOM 0 HG2 GLN A 28 1.464 17.972 -1.352 1.00 35.54 H new ATOM 0 HG3 GLN A 28 2.092 19.343 -0.460 1.00 35.54 H new ATOM 0 HE21 GLN A 28 0.074 20.500 0.819 1.00 40.34 H new ATOM 0 HE22 GLN A 28 -0.781 19.366 1.869 1.00 40.34 H new ATOM 427 N TYR A 29 -0.125 17.368 -3.405 1.00 74.11 N ATOM 428 CA TYR A 29 -0.045 15.938 -3.680 1.00 13.24 C ATOM 429 C TYR A 29 0.801 15.227 -2.629 1.00 4.32 C ATOM 430 O TYR A 29 1.739 15.803 -2.076 1.00 44.41 O ATOM 431 CB TYR A 29 0.541 15.696 -5.072 1.00 54.22 C ATOM 432 CG TYR A 29 -0.500 15.367 -6.119 1.00 1.33 C ATOM 433 CD1 TYR A 29 -1.170 14.151 -6.101 1.00 12.14 C ATOM 434 CD2 TYR A 29 -0.811 16.272 -7.126 1.00 45.11 C ATOM 435 CE1 TYR A 29 -2.122 13.845 -7.055 1.00 21.33 C ATOM 436 CE2 TYR A 29 -1.761 15.976 -8.084 1.00 21.10 C ATOM 437 CZ TYR A 29 -2.413 14.761 -8.044 1.00 12.34 C ATOM 438 OH TYR A 29 -3.360 14.462 -8.998 1.00 31.45 O ATOM 0 H TYR A 29 0.451 17.948 -4.015 1.00 74.11 H new ATOM 0 HA TYR A 29 -1.055 15.531 -3.643 1.00 13.24 H new ATOM 0 HB2 TYR A 29 1.091 16.584 -5.385 1.00 54.22 H new ATOM 0 HB3 TYR A 29 1.260 14.879 -5.017 1.00 54.22 H new ATOM 0 HD1 TYR A 29 -0.943 13.432 -5.328 1.00 12.14 H new ATOM 0 HD2 TYR A 29 -0.301 17.223 -7.160 1.00 45.11 H new ATOM 0 HE1 TYR A 29 -2.635 12.895 -7.026 1.00 21.33 H new ATOM 0 HE2 TYR A 29 -1.992 16.691 -8.860 1.00 21.10 H new ATOM 0 HH TYR A 29 -4.249 14.456 -8.586 1.00 31.45 H new ATOM 448 N LYS A 30 0.465 13.971 -2.358 1.00 20.54 N ATOM 449 CA LYS A 30 1.194 13.179 -1.374 1.00 71.43 C ATOM 450 C LYS A 30 1.414 11.756 -1.878 1.00 21.42 C ATOM 451 O LYS A 30 0.775 11.319 -2.837 1.00 3.15 O ATOM 452 CB LYS A 30 0.433 13.149 -0.047 1.00 71.50 C ATOM 453 CG LYS A 30 0.304 14.511 0.611 1.00 10.12 C ATOM 454 CD LYS A 30 -0.461 14.428 1.922 1.00 73.51 C ATOM 455 CE LYS A 30 0.434 13.967 3.062 1.00 73.34 C ATOM 456 NZ LYS A 30 0.488 14.967 4.164 1.00 42.44 N ATOM 0 H LYS A 30 -0.308 13.479 -2.806 1.00 20.54 H new ATOM 0 HA LYS A 30 2.166 13.646 -1.217 1.00 71.43 H new ATOM 0 HB2 LYS A 30 -0.563 12.742 -0.218 1.00 71.50 H new ATOM 0 HB3 LYS A 30 0.941 12.470 0.638 1.00 71.50 H new ATOM 0 HG2 LYS A 30 1.296 14.923 0.793 1.00 10.12 H new ATOM 0 HG3 LYS A 30 -0.206 15.196 -0.066 1.00 10.12 H new ATOM 0 HD2 LYS A 30 -0.882 15.404 2.161 1.00 73.51 H new ATOM 0 HD3 LYS A 30 -1.298 13.738 1.813 1.00 73.51 H new ATOM 0 HE2 LYS A 30 0.066 13.017 3.451 1.00 73.34 H new ATOM 0 HE3 LYS A 30 1.441 13.788 2.684 1.00 73.34 H new ATOM 0 HZ1 LYS A 30 1.108 14.616 4.922 1.00 42.44 H new ATOM 0 HZ2 LYS A 30 0.863 15.866 3.799 1.00 42.44 H new ATOM 0 HZ3 LYS A 30 -0.469 15.119 4.542 1.00 42.44 H new ATOM 470 N LEU A 31 2.321 11.036 -1.226 1.00 40.24 N ATOM 471 CA LEU A 31 2.625 9.661 -1.607 1.00 55.11 C ATOM 472 C LEU A 31 1.354 8.821 -1.672 1.00 75.34 C ATOM 473 O LEU A 31 1.203 7.968 -2.549 1.00 10.40 O ATOM 474 CB LEU A 31 3.608 9.041 -0.615 1.00 25.13 C ATOM 475 CG LEU A 31 5.091 9.291 -0.893 1.00 60.44 C ATOM 476 CD1 LEU A 31 5.863 9.439 0.409 1.00 32.01 C ATOM 477 CD2 LEU A 31 5.673 8.165 -1.734 1.00 71.45 C ATOM 0 H LEU A 31 2.859 11.382 -0.431 1.00 40.24 H new ATOM 0 HA LEU A 31 3.080 9.677 -2.597 1.00 55.11 H new ATOM 0 HB2 LEU A 31 3.377 9.421 0.380 1.00 25.13 H new ATOM 0 HB3 LEU A 31 3.440 7.964 -0.593 1.00 25.13 H new ATOM 0 HG LEU A 31 5.183 10.222 -1.453 1.00 60.44 H new ATOM 0 HD11 LEU A 31 6.916 9.616 0.190 1.00 32.01 H new ATOM 0 HD12 LEU A 31 5.464 10.281 0.975 1.00 32.01 H new ATOM 0 HD13 LEU A 31 5.763 8.526 0.997 1.00 32.01 H new ATOM 0 HD21 LEU A 31 6.729 8.360 -1.922 1.00 71.45 H new ATOM 0 HD22 LEU A 31 5.568 7.220 -1.200 1.00 71.45 H new ATOM 0 HD23 LEU A 31 5.140 8.107 -2.683 1.00 71.45 H new ATOM 489 N LYS A 32 0.438 9.067 -0.742 1.00 5.25 N ATOM 490 CA LYS A 32 -0.822 8.336 -0.693 1.00 54.23 C ATOM 491 C LYS A 32 -1.468 8.275 -2.074 1.00 64.54 C ATOM 492 O LYS A 32 -2.173 7.319 -2.399 1.00 30.45 O ATOM 493 CB LYS A 32 -1.780 8.997 0.300 1.00 72.33 C ATOM 494 CG LYS A 32 -1.890 8.258 1.623 1.00 61.24 C ATOM 495 CD LYS A 32 -3.316 8.256 2.145 1.00 51.02 C ATOM 496 CE LYS A 32 -3.664 9.573 2.821 1.00 51.42 C ATOM 497 NZ LYS A 32 -4.287 10.536 1.871 1.00 2.21 N ATOM 0 H LYS A 32 0.545 9.769 -0.010 1.00 5.25 H new ATOM 0 HA LYS A 32 -0.611 7.319 -0.363 1.00 54.23 H new ATOM 0 HB2 LYS A 32 -1.446 10.017 0.490 1.00 72.33 H new ATOM 0 HB3 LYS A 32 -2.769 9.064 -0.152 1.00 72.33 H new ATOM 0 HG2 LYS A 32 -1.547 7.231 1.497 1.00 61.24 H new ATOM 0 HG3 LYS A 32 -1.234 8.725 2.357 1.00 61.24 H new ATOM 0 HD2 LYS A 32 -4.006 8.075 1.321 1.00 51.02 H new ATOM 0 HD3 LYS A 32 -3.444 7.437 2.853 1.00 51.02 H new ATOM 0 HE2 LYS A 32 -4.347 9.387 3.650 1.00 51.42 H new ATOM 0 HE3 LYS A 32 -2.762 10.013 3.245 1.00 51.42 H new ATOM 0 HZ1 LYS A 32 -3.712 11.401 1.826 1.00 2.21 H new ATOM 0 HZ2 LYS A 32 -4.340 10.106 0.925 1.00 2.21 H new ATOM 0 HZ3 LYS A 32 -5.246 10.774 2.197 1.00 2.21 H new ATOM 511 N HIS A 33 -1.221 9.299 -2.885 1.00 11.23 N ATOM 512 CA HIS A 33 -1.777 9.361 -4.232 1.00 0.51 C ATOM 513 C HIS A 33 -0.989 8.466 -5.185 1.00 5.32 C ATOM 514 O HIS A 33 -1.620 7.895 -6.075 1.00 3.32 O ATOM 515 CB HIS A 33 -1.769 10.801 -4.745 1.00 41.42 C ATOM 516 CG HIS A 33 -2.568 11.743 -3.896 1.00 23.23 C ATOM 517 ND1 HIS A 33 -1.999 12.766 -3.167 1.00 44.32 N ATOM 518 CD2 HIS A 33 -3.899 11.813 -3.664 1.00 24.04 C ATOM 519 CE1 HIS A 33 -2.946 13.423 -2.523 1.00 22.04 C ATOM 520 NE2 HIS A 33 -4.109 12.865 -2.807 1.00 63.14 N ATOM 0 H HIS A 33 -0.639 10.098 -2.632 1.00 11.23 H new ATOM 0 HA HIS A 33 -2.806 9.004 -4.191 1.00 0.51 H new ATOM 0 HB2 HIS A 33 -0.739 11.155 -4.795 1.00 41.42 H new ATOM 0 HB3 HIS A 33 -2.162 10.818 -5.762 1.00 41.42 H new ATOM 0 HD2 HIS A 33 -4.656 11.162 -4.076 1.00 24.04 H new ATOM 0 HE1 HIS A 33 -2.795 14.273 -1.874 1.00 22.04 H new ATOM 0 HE2 HIS A 33 -5.015 13.166 -2.448 1.00 63.14 H new ATOM 528 N ILE A 34 0.324 8.334 -5.027 1.00 72.43 N ATOM 529 CA ILE A 34 1.117 7.489 -5.913 1.00 2.23 C ATOM 530 C ILE A 34 0.940 6.014 -5.569 1.00 12.04 C ATOM 531 O ILE A 34 0.521 5.216 -6.407 1.00 31.11 O ATOM 532 CB ILE A 34 2.614 7.845 -5.839 1.00 13.45 C ATOM 533 CG1 ILE A 34 2.808 9.356 -5.990 1.00 63.23 C ATOM 534 CG2 ILE A 34 3.390 7.096 -6.911 1.00 61.32 C ATOM 535 CD1 ILE A 34 4.240 9.803 -5.796 1.00 21.42 C ATOM 0 H ILE A 34 0.861 8.800 -4.295 1.00 72.43 H new ATOM 0 HA ILE A 34 0.758 7.669 -6.926 1.00 2.23 H new ATOM 0 HB ILE A 34 2.997 7.544 -4.864 1.00 13.45 H new ATOM 0 HG12 ILE A 34 2.472 9.660 -6.981 1.00 63.23 H new ATOM 0 HG13 ILE A 34 2.174 9.870 -5.267 1.00 63.23 H new ATOM 0 HG21 ILE A 34 4.446 7.358 -6.846 1.00 61.32 H new ATOM 0 HG22 ILE A 34 3.273 6.023 -6.762 1.00 61.32 H new ATOM 0 HG23 ILE A 34 3.008 7.370 -7.895 1.00 61.32 H new ATOM 0 HD11 ILE A 34 4.303 10.884 -5.917 1.00 21.42 H new ATOM 0 HD12 ILE A 34 4.574 9.530 -4.795 1.00 21.42 H new ATOM 0 HD13 ILE A 34 4.876 9.317 -6.536 1.00 21.42 H new ATOM 547 N VAL A 35 1.261 5.658 -4.329 1.00 21.31 N ATOM 548 CA VAL A 35 1.136 4.279 -3.872 1.00 32.25 C ATOM 549 C VAL A 35 -0.209 3.686 -4.279 1.00 61.12 C ATOM 550 O VAL A 35 -0.303 2.505 -4.612 1.00 22.43 O ATOM 551 CB VAL A 35 1.287 4.179 -2.343 1.00 21.52 C ATOM 552 CG1 VAL A 35 1.188 2.730 -1.891 1.00 23.43 C ATOM 553 CG2 VAL A 35 2.603 4.797 -1.896 1.00 61.33 C ATOM 0 H VAL A 35 1.610 6.306 -3.623 1.00 21.31 H new ATOM 0 HA VAL A 35 1.938 3.714 -4.346 1.00 32.25 H new ATOM 0 HB VAL A 35 0.474 4.736 -1.878 1.00 21.52 H new ATOM 0 HG11 VAL A 35 1.297 2.679 -0.808 1.00 23.43 H new ATOM 0 HG12 VAL A 35 0.218 2.325 -2.178 1.00 23.43 H new ATOM 0 HG13 VAL A 35 1.978 2.147 -2.363 1.00 23.43 H new ATOM 0 HG21 VAL A 35 2.693 4.717 -0.813 1.00 61.33 H new ATOM 0 HG22 VAL A 35 3.432 4.270 -2.369 1.00 61.33 H new ATOM 0 HG23 VAL A 35 2.629 5.847 -2.186 1.00 61.33 H new ATOM 563 N TRP A 36 -1.247 4.514 -4.249 1.00 73.13 N ATOM 564 CA TRP A 36 -2.588 4.071 -4.617 1.00 21.15 C ATOM 565 C TRP A 36 -2.633 3.620 -6.072 1.00 22.50 C ATOM 566 O TRP A 36 -3.155 2.550 -6.383 1.00 63.42 O ATOM 567 CB TRP A 36 -3.599 5.196 -4.386 1.00 31.11 C ATOM 568 CG TRP A 36 -4.989 4.842 -4.821 1.00 11.45 C ATOM 569 CD1 TRP A 36 -5.803 3.892 -4.272 1.00 41.43 C ATOM 570 CD2 TRP A 36 -5.727 5.433 -5.896 1.00 12.34 C ATOM 571 NE1 TRP A 36 -7.002 3.857 -4.942 1.00 50.01 N ATOM 572 CE2 TRP A 36 -6.981 4.794 -5.941 1.00 32.10 C ATOM 573 CE3 TRP A 36 -5.452 6.442 -6.823 1.00 2.33 C ATOM 574 CZ2 TRP A 36 -7.954 5.130 -6.878 1.00 51.24 C ATOM 575 CZ3 TRP A 36 -6.419 6.775 -7.752 1.00 3.34 C ATOM 576 CH2 TRP A 36 -7.657 6.122 -7.774 1.00 35.31 C ATOM 0 H TRP A 36 -1.187 5.494 -3.974 1.00 73.13 H new ATOM 0 HA TRP A 36 -2.849 3.221 -3.986 1.00 21.15 H new ATOM 0 HB2 TRP A 36 -3.611 5.452 -3.327 1.00 31.11 H new ATOM 0 HB3 TRP A 36 -3.272 6.085 -4.925 1.00 31.11 H new ATOM 0 HD1 TRP A 36 -5.542 3.261 -3.435 1.00 41.43 H new ATOM 0 HE1 TRP A 36 -7.781 3.234 -4.730 1.00 50.01 H new ATOM 0 HE3 TRP A 36 -4.500 6.953 -6.813 1.00 2.33 H new ATOM 0 HZ2 TRP A 36 -8.909 4.626 -6.898 1.00 51.24 H new ATOM 0 HZ3 TRP A 36 -6.216 7.553 -8.474 1.00 3.34 H new ATOM 0 HH2 TRP A 36 -8.392 6.406 -8.512 1.00 35.31 H new ATOM 587 N ALA A 37 -2.083 4.443 -6.959 1.00 61.44 N ATOM 588 CA ALA A 37 -2.060 4.125 -8.382 1.00 2.01 C ATOM 589 C ALA A 37 -1.224 2.879 -8.653 1.00 13.35 C ATOM 590 O ALA A 37 -1.624 2.008 -9.426 1.00 65.20 O ATOM 591 CB ALA A 37 -1.522 5.306 -9.176 1.00 43.20 C ATOM 0 H ALA A 37 -1.648 5.334 -6.718 1.00 61.44 H new ATOM 0 HA ALA A 37 -3.082 3.921 -8.701 1.00 2.01 H new ATOM 0 HB1 ALA A 37 -1.510 5.056 -10.237 1.00 43.20 H new ATOM 0 HB2 ALA A 37 -2.161 6.174 -9.015 1.00 43.20 H new ATOM 0 HB3 ALA A 37 -0.509 5.535 -8.846 1.00 43.20 H new ATOM 597 N SER A 38 -0.062 2.800 -8.012 1.00 43.13 N ATOM 598 CA SER A 38 0.832 1.661 -8.189 1.00 10.55 C ATOM 599 C SER A 38 0.157 0.367 -7.743 1.00 63.13 C ATOM 600 O SER A 38 0.396 -0.697 -8.313 1.00 33.41 O ATOM 601 CB SER A 38 2.125 1.874 -7.398 1.00 72.25 C ATOM 602 OG SER A 38 2.704 3.132 -7.698 1.00 4.44 O ATOM 0 H SER A 38 0.282 3.510 -7.366 1.00 43.13 H new ATOM 0 HA SER A 38 1.072 1.579 -9.249 1.00 10.55 H new ATOM 0 HB2 SER A 38 1.916 1.811 -6.330 1.00 72.25 H new ATOM 0 HB3 SER A 38 2.833 1.079 -7.632 1.00 72.25 H new ATOM 0 HG SER A 38 3.528 3.245 -7.179 1.00 4.44 H new ATOM 608 N ARG A 39 -0.685 0.468 -6.720 1.00 5.12 N ATOM 609 CA ARG A 39 -1.394 -0.693 -6.196 1.00 63.00 C ATOM 610 C ARG A 39 -2.626 -1.004 -7.041 1.00 22.24 C ATOM 611 O ARG A 39 -3.174 -2.104 -6.973 1.00 55.34 O ATOM 612 CB ARG A 39 -1.805 -0.454 -4.743 1.00 62.22 C ATOM 613 CG ARG A 39 -0.717 -0.794 -3.737 1.00 70.35 C ATOM 614 CD ARG A 39 -1.112 -1.978 -2.869 1.00 1.13 C ATOM 615 NE ARG A 39 -0.494 -1.916 -1.547 1.00 14.55 N ATOM 616 CZ ARG A 39 -0.749 -2.785 -0.575 1.00 54.01 C ATOM 617 NH1 ARG A 39 -1.604 -3.779 -0.777 1.00 13.34 N ATOM 618 NH2 ARG A 39 -0.147 -2.663 0.601 1.00 1.14 N ATOM 0 H ARG A 39 -0.893 1.342 -6.237 1.00 5.12 H new ATOM 0 HA ARG A 39 -0.720 -1.549 -6.239 1.00 63.00 H new ATOM 0 HB2 ARG A 39 -2.086 0.592 -4.621 1.00 62.22 H new ATOM 0 HB3 ARG A 39 -2.691 -1.050 -4.522 1.00 62.22 H new ATOM 0 HG2 ARG A 39 0.210 -1.021 -4.264 1.00 70.35 H new ATOM 0 HG3 ARG A 39 -0.520 0.072 -3.105 1.00 70.35 H new ATOM 0 HD2 ARG A 39 -2.196 -2.003 -2.762 1.00 1.13 H new ATOM 0 HD3 ARG A 39 -0.819 -2.904 -3.363 1.00 1.13 H new ATOM 0 HE ARG A 39 0.170 -1.164 -1.360 1.00 14.55 H new ATOM 0 HH11 ARG A 39 -2.067 -3.877 -1.680 1.00 13.34 H new ATOM 0 HH12 ARG A 39 -1.798 -4.445 -0.029 1.00 13.34 H new ATOM 0 HH21 ARG A 39 0.513 -1.901 0.760 1.00 1.14 H new ATOM 0 HH22 ARG A 39 -0.344 -3.331 1.346 1.00 1.14 H new ATOM 632 N GLU A 40 -3.055 -0.028 -7.833 1.00 53.13 N ATOM 633 CA GLU A 40 -4.224 -0.198 -8.689 1.00 54.53 C ATOM 634 C GLU A 40 -3.821 -0.729 -10.062 1.00 4.41 C ATOM 635 O GLU A 40 -4.542 -1.521 -10.670 1.00 62.34 O ATOM 636 CB GLU A 40 -4.969 1.130 -8.843 1.00 22.11 C ATOM 637 CG GLU A 40 -6.481 0.982 -8.848 1.00 54.01 C ATOM 638 CD GLU A 40 -7.034 0.595 -7.490 1.00 71.22 C ATOM 639 OE1 GLU A 40 -6.418 0.966 -6.470 1.00 13.12 O ATOM 640 OE2 GLU A 40 -8.084 -0.080 -7.449 1.00 61.44 O ATOM 0 H GLU A 40 -2.612 0.888 -7.900 1.00 53.13 H new ATOM 0 HA GLU A 40 -4.885 -0.925 -8.217 1.00 54.53 H new ATOM 0 HB2 GLU A 40 -4.680 1.796 -8.030 1.00 22.11 H new ATOM 0 HB3 GLU A 40 -4.656 1.607 -9.772 1.00 22.11 H new ATOM 0 HG2 GLU A 40 -6.933 1.921 -9.166 1.00 54.01 H new ATOM 0 HG3 GLU A 40 -6.766 0.227 -9.581 1.00 54.01 H new ATOM 647 N LEU A 41 -2.664 -0.287 -10.544 1.00 74.14 N ATOM 648 CA LEU A 41 -2.164 -0.717 -11.845 1.00 71.00 C ATOM 649 C LEU A 41 -1.982 -2.231 -11.886 1.00 40.43 C ATOM 650 O LEU A 41 -2.308 -2.878 -12.881 1.00 5.34 O ATOM 651 CB LEU A 41 -0.837 -0.023 -12.157 1.00 51.53 C ATOM 652 CG LEU A 41 -0.935 1.416 -12.666 1.00 70.20 C ATOM 653 CD1 LEU A 41 0.452 2.020 -12.829 1.00 12.00 C ATOM 654 CD2 LEU A 41 -1.698 1.466 -13.981 1.00 33.13 C ATOM 0 H LEU A 41 -2.055 0.368 -10.054 1.00 74.14 H new ATOM 0 HA LEU A 41 -2.899 -0.438 -12.600 1.00 71.00 H new ATOM 0 HB2 LEU A 41 -0.227 -0.027 -11.254 1.00 51.53 H new ATOM 0 HB3 LEU A 41 -0.307 -0.616 -12.902 1.00 51.53 H new ATOM 0 HG LEU A 41 -1.482 2.005 -11.930 1.00 70.20 H new ATOM 0 HD11 LEU A 41 0.363 3.044 -13.192 1.00 12.00 H new ATOM 0 HD12 LEU A 41 0.964 2.019 -11.867 1.00 12.00 H new ATOM 0 HD13 LEU A 41 1.024 1.430 -13.545 1.00 12.00 H new ATOM 0 HD21 LEU A 41 -1.758 2.498 -14.328 1.00 33.13 H new ATOM 0 HD22 LEU A 41 -1.179 0.862 -14.726 1.00 33.13 H new ATOM 0 HD23 LEU A 41 -2.704 1.074 -13.833 1.00 33.13 H new ATOM 666 N GLU A 42 -1.461 -2.788 -10.797 1.00 3.01 N ATOM 667 CA GLU A 42 -1.237 -4.227 -10.709 1.00 53.52 C ATOM 668 C GLU A 42 -2.531 -4.995 -10.961 1.00 41.21 C ATOM 669 O GLU A 42 -2.507 -6.153 -11.378 1.00 3.11 O ATOM 670 CB GLU A 42 -0.672 -4.594 -9.335 1.00 41.23 C ATOM 671 CG GLU A 42 0.465 -5.600 -9.394 1.00 75.23 C ATOM 672 CD GLU A 42 -0.014 -7.004 -9.713 1.00 51.40 C ATOM 673 OE1 GLU A 42 -0.840 -7.537 -8.944 1.00 34.32 O ATOM 674 OE2 GLU A 42 0.437 -7.566 -10.732 1.00 62.53 O ATOM 0 H GLU A 42 -1.187 -2.266 -9.965 1.00 3.01 H new ATOM 0 HA GLU A 42 -0.515 -4.505 -11.477 1.00 53.52 H new ATOM 0 HB2 GLU A 42 -0.319 -3.688 -8.843 1.00 41.23 H new ATOM 0 HB3 GLU A 42 -1.474 -5.000 -8.718 1.00 41.23 H new ATOM 0 HG2 GLU A 42 1.185 -5.285 -10.150 1.00 75.23 H new ATOM 0 HG3 GLU A 42 0.989 -5.607 -8.438 1.00 75.23 H new ATOM 681 N ARG A 43 -3.660 -4.342 -10.704 1.00 64.12 N ATOM 682 CA ARG A 43 -4.964 -4.963 -10.901 1.00 20.43 C ATOM 683 C ARG A 43 -5.371 -4.917 -12.371 1.00 30.53 C ATOM 684 O ARG A 43 -6.194 -5.715 -12.823 1.00 11.43 O ATOM 685 CB ARG A 43 -6.021 -4.262 -10.046 1.00 24.34 C ATOM 686 CG ARG A 43 -7.047 -5.210 -9.447 1.00 25.52 C ATOM 687 CD ARG A 43 -7.199 -4.993 -7.950 1.00 14.14 C ATOM 688 NE ARG A 43 -8.554 -5.285 -7.489 1.00 73.34 N ATOM 689 CZ ARG A 43 -9.604 -4.517 -7.757 1.00 70.01 C ATOM 690 NH1 ARG A 43 -9.456 -3.415 -8.480 1.00 30.43 N ATOM 691 NH2 ARG A 43 -10.805 -4.850 -7.304 1.00 31.44 N ATOM 0 H ARG A 43 -3.698 -3.383 -10.359 1.00 64.12 H new ATOM 0 HA ARG A 43 -4.892 -6.006 -10.594 1.00 20.43 H new ATOM 0 HB2 ARG A 43 -5.524 -3.722 -9.240 1.00 24.34 H new ATOM 0 HB3 ARG A 43 -6.537 -3.521 -10.656 1.00 24.34 H new ATOM 0 HG2 ARG A 43 -8.010 -5.063 -9.937 1.00 25.52 H new ATOM 0 HG3 ARG A 43 -6.747 -6.240 -9.638 1.00 25.52 H new ATOM 0 HD2 ARG A 43 -6.490 -5.628 -7.418 1.00 14.14 H new ATOM 0 HD3 ARG A 43 -6.948 -3.961 -7.706 1.00 14.14 H new ATOM 0 HE ARG A 43 -8.702 -6.125 -6.930 1.00 73.34 H new ATOM 0 HH11 ARG A 43 -8.534 -3.156 -8.832 1.00 30.43 H new ATOM 0 HH12 ARG A 43 -10.264 -2.827 -8.684 1.00 30.43 H new ATOM 0 HH21 ARG A 43 -10.924 -5.697 -6.749 1.00 31.44 H new ATOM 0 HH22 ARG A 43 -11.610 -4.259 -7.511 1.00 31.44 H new ATOM 705 N PHE A 44 -4.791 -3.980 -13.111 1.00 52.11 N ATOM 706 CA PHE A 44 -5.095 -3.829 -14.529 1.00 53.15 C ATOM 707 C PHE A 44 -4.053 -4.541 -15.388 1.00 53.20 C ATOM 708 O PHE A 44 -3.874 -4.217 -16.561 1.00 3.23 O ATOM 709 CB PHE A 44 -5.155 -2.347 -14.906 1.00 23.10 C ATOM 710 CG PHE A 44 -6.321 -1.620 -14.297 1.00 61.43 C ATOM 711 CD1 PHE A 44 -7.598 -2.154 -14.366 1.00 14.41 C ATOM 712 CD2 PHE A 44 -6.139 -0.406 -13.657 1.00 32.10 C ATOM 713 CE1 PHE A 44 -8.673 -1.488 -13.807 1.00 42.34 C ATOM 714 CE2 PHE A 44 -7.211 0.265 -13.096 1.00 45.04 C ATOM 715 CZ PHE A 44 -8.478 -0.277 -13.171 1.00 23.22 C ATOM 0 H PHE A 44 -4.107 -3.313 -12.753 1.00 52.11 H new ATOM 0 HA PHE A 44 -6.068 -4.284 -14.716 1.00 53.15 H new ATOM 0 HB2 PHE A 44 -4.231 -1.863 -14.591 1.00 23.10 H new ATOM 0 HB3 PHE A 44 -5.208 -2.258 -15.991 1.00 23.10 H new ATOM 0 HD1 PHE A 44 -7.755 -3.101 -14.862 1.00 14.41 H new ATOM 0 HD2 PHE A 44 -5.149 0.022 -13.595 1.00 32.10 H new ATOM 0 HE1 PHE A 44 -9.664 -1.914 -13.867 1.00 42.34 H new ATOM 0 HE2 PHE A 44 -7.057 1.212 -12.600 1.00 45.04 H new ATOM 0 HZ PHE A 44 -9.316 0.245 -12.733 1.00 23.22 H new ATOM 725 N ALA A 45 -3.370 -5.513 -14.793 1.00 22.13 N ATOM 726 CA ALA A 45 -2.347 -6.272 -15.502 1.00 1.24 C ATOM 727 C ALA A 45 -1.178 -5.378 -15.900 1.00 45.03 C ATOM 728 O ALA A 45 -0.420 -5.702 -16.815 1.00 65.32 O ATOM 729 CB ALA A 45 -2.944 -6.942 -16.730 1.00 31.41 C ATOM 0 H ALA A 45 -3.506 -5.794 -13.822 1.00 22.13 H new ATOM 0 HA ALA A 45 -1.969 -7.042 -14.830 1.00 1.24 H new ATOM 0 HB1 ALA A 45 -2.169 -7.505 -17.250 1.00 31.41 H new ATOM 0 HB2 ALA A 45 -3.741 -7.619 -16.424 1.00 31.41 H new ATOM 0 HB3 ALA A 45 -3.350 -6.182 -17.398 1.00 31.41 H new ATOM 735 N VAL A 46 -1.037 -4.252 -15.209 1.00 30.34 N ATOM 736 CA VAL A 46 0.041 -3.312 -15.490 1.00 43.35 C ATOM 737 C VAL A 46 0.936 -3.119 -14.271 1.00 11.10 C ATOM 738 O VAL A 46 0.469 -2.732 -13.202 1.00 13.51 O ATOM 739 CB VAL A 46 -0.510 -1.942 -15.931 1.00 11.34 C ATOM 740 CG1 VAL A 46 0.625 -0.949 -16.130 1.00 41.32 C ATOM 741 CG2 VAL A 46 -1.334 -2.084 -17.201 1.00 15.32 C ATOM 0 H VAL A 46 -1.656 -3.968 -14.450 1.00 30.34 H new ATOM 0 HA VAL A 46 0.628 -3.739 -16.303 1.00 43.35 H new ATOM 0 HB VAL A 46 -1.160 -1.560 -15.144 1.00 11.34 H new ATOM 0 HG11 VAL A 46 0.217 0.013 -16.441 1.00 41.32 H new ATOM 0 HG12 VAL A 46 1.169 -0.826 -15.194 1.00 41.32 H new ATOM 0 HG13 VAL A 46 1.303 -1.321 -16.898 1.00 41.32 H new ATOM 0 HG21 VAL A 46 -1.715 -1.107 -17.498 1.00 15.32 H new ATOM 0 HG22 VAL A 46 -0.708 -2.487 -17.997 1.00 15.32 H new ATOM 0 HG23 VAL A 46 -2.170 -2.760 -17.019 1.00 15.32 H new ATOM 751 N ASN A 47 2.224 -3.392 -14.441 1.00 64.32 N ATOM 752 CA ASN A 47 3.186 -3.249 -13.354 1.00 25.51 C ATOM 753 C ASN A 47 3.415 -1.779 -13.020 1.00 10.33 C ATOM 754 O ASN A 47 3.472 -0.918 -13.898 1.00 54.10 O ATOM 755 CB ASN A 47 4.514 -3.911 -13.728 1.00 43.32 C ATOM 756 CG ASN A 47 4.392 -5.417 -13.865 1.00 51.23 C ATOM 757 OD1 ASN A 47 3.326 -5.936 -14.199 1.00 3.04 O ATOM 758 ND2 ASN A 47 5.485 -6.125 -13.606 1.00 51.32 N ATOM 0 H ASN A 47 2.627 -3.714 -15.321 1.00 64.32 H new ATOM 0 HA ASN A 47 2.776 -3.744 -12.474 1.00 25.51 H new ATOM 0 HB2 ASN A 47 4.874 -3.492 -14.668 1.00 43.32 H new ATOM 0 HB3 ASN A 47 5.260 -3.677 -12.968 1.00 43.32 H new ATOM 0 HD21 ASN A 47 5.463 -7.142 -13.681 1.00 51.32 H new ATOM 0 HD22 ASN A 47 6.346 -5.652 -13.333 1.00 51.32 H new ATOM 765 N PRO A 48 3.550 -1.481 -11.718 1.00 34.10 N ATOM 766 CA PRO A 48 3.775 -0.115 -11.238 1.00 0.44 C ATOM 767 C PRO A 48 5.162 0.406 -11.602 1.00 14.43 C ATOM 768 O PRO A 48 5.469 1.579 -11.392 1.00 41.02 O ATOM 769 CB PRO A 48 3.634 -0.245 -9.720 1.00 21.13 C ATOM 770 CG PRO A 48 3.969 -1.667 -9.429 1.00 22.02 C ATOM 771 CD PRO A 48 3.493 -2.457 -10.616 1.00 42.52 C ATOM 0 HA PRO A 48 3.079 0.594 -11.685 1.00 0.44 H new ATOM 0 HB2 PRO A 48 4.309 0.435 -9.200 1.00 21.13 H new ATOM 0 HB3 PRO A 48 2.623 -0.002 -9.394 1.00 21.13 H new ATOM 0 HG2 PRO A 48 5.042 -1.793 -9.282 1.00 22.02 H new ATOM 0 HG3 PRO A 48 3.480 -2.004 -8.515 1.00 22.02 H new ATOM 0 HD2 PRO A 48 4.132 -3.319 -10.808 1.00 42.52 H new ATOM 0 HD3 PRO A 48 2.482 -2.837 -10.467 1.00 42.52 H new ATOM 779 N GLY A 49 5.995 -0.475 -12.148 1.00 41.50 N ATOM 780 CA GLY A 49 7.339 -0.084 -12.532 1.00 14.14 C ATOM 781 C GLY A 49 7.348 0.924 -13.664 1.00 44.33 C ATOM 782 O GLY A 49 8.287 1.711 -13.798 1.00 65.31 O ATOM 0 H GLY A 49 5.763 -1.451 -12.331 1.00 41.50 H new ATOM 0 HA2 GLY A 49 7.852 0.340 -11.668 1.00 14.14 H new ATOM 0 HA3 GLY A 49 7.900 -0.969 -12.833 1.00 14.14 H new ATOM 786 N LEU A 50 6.303 0.901 -14.483 1.00 63.14 N ATOM 787 CA LEU A 50 6.195 1.819 -15.612 1.00 32.23 C ATOM 788 C LEU A 50 6.067 3.261 -15.131 1.00 2.04 C ATOM 789 O LEU A 50 6.452 4.197 -15.833 1.00 72.13 O ATOM 790 CB LEU A 50 4.990 1.451 -16.481 1.00 30.54 C ATOM 791 CG LEU A 50 4.851 -0.028 -16.842 1.00 54.13 C ATOM 792 CD1 LEU A 50 3.512 -0.290 -17.513 1.00 14.44 C ATOM 793 CD2 LEU A 50 5.996 -0.466 -17.745 1.00 74.22 C ATOM 0 H LEU A 50 5.518 0.257 -14.387 1.00 63.14 H new ATOM 0 HA LEU A 50 7.104 1.733 -16.207 1.00 32.23 H new ATOM 0 HB2 LEU A 50 4.084 1.765 -15.963 1.00 30.54 H new ATOM 0 HB3 LEU A 50 5.044 2.027 -17.405 1.00 30.54 H new ATOM 0 HG LEU A 50 4.894 -0.612 -15.923 1.00 54.13 H new ATOM 0 HD11 LEU A 50 3.431 -1.348 -17.763 1.00 14.44 H new ATOM 0 HD12 LEU A 50 2.705 -0.015 -16.834 1.00 14.44 H new ATOM 0 HD13 LEU A 50 3.439 0.304 -18.424 1.00 14.44 H new ATOM 0 HD21 LEU A 50 5.881 -1.521 -17.992 1.00 74.22 H new ATOM 0 HD22 LEU A 50 5.983 0.125 -18.661 1.00 74.22 H new ATOM 0 HD23 LEU A 50 6.944 -0.315 -17.229 1.00 74.22 H new ATOM 805 N LEU A 51 5.528 3.432 -13.930 1.00 1.52 N ATOM 806 CA LEU A 51 5.352 4.761 -13.352 1.00 31.21 C ATOM 807 C LEU A 51 6.700 5.399 -13.035 1.00 3.12 C ATOM 808 O LEU A 51 6.798 6.615 -12.867 1.00 51.02 O ATOM 809 CB LEU A 51 4.502 4.679 -12.083 1.00 24.13 C ATOM 810 CG LEU A 51 3.077 4.156 -12.263 1.00 20.31 C ATOM 811 CD1 LEU A 51 2.576 3.518 -10.975 1.00 52.13 C ATOM 812 CD2 LEU A 51 2.148 5.279 -12.700 1.00 73.40 C ATOM 0 H LEU A 51 5.205 2.668 -13.337 1.00 1.52 H new ATOM 0 HA LEU A 51 4.839 5.384 -14.085 1.00 31.21 H new ATOM 0 HB2 LEU A 51 5.015 4.038 -11.367 1.00 24.13 H new ATOM 0 HB3 LEU A 51 4.449 5.673 -11.640 1.00 24.13 H new ATOM 0 HG LEU A 51 3.086 3.394 -13.043 1.00 20.31 H new ATOM 0 HD11 LEU A 51 1.560 3.151 -11.122 1.00 52.13 H new ATOM 0 HD12 LEU A 51 3.226 2.686 -10.704 1.00 52.13 H new ATOM 0 HD13 LEU A 51 2.582 4.259 -10.176 1.00 52.13 H new ATOM 0 HD21 LEU A 51 1.138 4.888 -12.823 1.00 73.40 H new ATOM 0 HD22 LEU A 51 2.144 6.063 -11.943 1.00 73.40 H new ATOM 0 HD23 LEU A 51 2.496 5.691 -13.647 1.00 73.40 H new ATOM 824 N GLU A 52 7.738 4.572 -12.957 1.00 1.25 N ATOM 825 CA GLU A 52 9.081 5.057 -12.660 1.00 73.44 C ATOM 826 C GLU A 52 9.693 5.741 -13.879 1.00 0.22 C ATOM 827 O GLU A 52 10.639 6.519 -13.759 1.00 44.25 O ATOM 828 CB GLU A 52 9.976 3.902 -12.207 1.00 11.42 C ATOM 829 CG GLU A 52 11.394 4.329 -11.868 1.00 24.24 C ATOM 830 CD GLU A 52 12.017 3.471 -10.783 1.00 64.33 C ATOM 831 OE1 GLU A 52 11.860 2.233 -10.841 1.00 43.55 O ATOM 832 OE2 GLU A 52 12.663 4.038 -9.877 1.00 62.32 O ATOM 0 H GLU A 52 7.675 3.563 -13.095 1.00 1.25 H new ATOM 0 HA GLU A 52 9.006 5.787 -11.854 1.00 73.44 H new ATOM 0 HB2 GLU A 52 9.529 3.428 -11.333 1.00 11.42 H new ATOM 0 HB3 GLU A 52 10.010 3.149 -12.995 1.00 11.42 H new ATOM 0 HG2 GLU A 52 12.010 4.277 -12.766 1.00 24.24 H new ATOM 0 HG3 GLU A 52 11.389 5.370 -11.545 1.00 24.24 H new ATOM 839 N THR A 53 9.145 5.446 -15.054 1.00 33.21 N ATOM 840 CA THR A 53 9.636 6.030 -16.295 1.00 41.20 C ATOM 841 C THR A 53 8.536 6.806 -17.011 1.00 73.12 C ATOM 842 O THR A 53 7.441 6.289 -17.229 1.00 34.25 O ATOM 843 CB THR A 53 10.189 4.951 -17.244 1.00 51.13 C ATOM 844 OG1 THR A 53 9.118 4.353 -17.983 1.00 53.10 O ATOM 845 CG2 THR A 53 10.936 3.877 -16.466 1.00 52.02 C ATOM 0 H THR A 53 8.360 4.805 -15.171 1.00 33.21 H new ATOM 0 HA THR A 53 10.442 6.713 -16.025 1.00 41.20 H new ATOM 0 HB THR A 53 10.885 5.428 -17.934 1.00 51.13 H new ATOM 0 HG1 THR A 53 9.478 3.669 -18.585 1.00 53.10 H new ATOM 0 HG21 THR A 53 11.317 3.126 -17.158 1.00 52.02 H new ATOM 0 HG22 THR A 53 11.768 4.330 -15.927 1.00 52.02 H new ATOM 0 HG23 THR A 53 10.258 3.405 -15.755 1.00 52.02 H new ATOM 853 N SER A 54 8.836 8.048 -17.377 1.00 3.31 N ATOM 854 CA SER A 54 7.871 8.896 -18.066 1.00 40.53 C ATOM 855 C SER A 54 7.303 8.187 -19.292 1.00 42.41 C ATOM 856 O SER A 54 6.169 8.438 -19.698 1.00 32.33 O ATOM 857 CB SER A 54 8.524 10.216 -18.482 1.00 31.21 C ATOM 858 OG SER A 54 7.607 11.292 -18.388 1.00 33.43 O ATOM 0 H SER A 54 9.740 8.489 -17.208 1.00 3.31 H new ATOM 0 HA SER A 54 7.052 9.106 -17.377 1.00 40.53 H new ATOM 0 HB2 SER A 54 9.388 10.414 -17.847 1.00 31.21 H new ATOM 0 HB3 SER A 54 8.892 10.136 -19.505 1.00 31.21 H new ATOM 0 HG SER A 54 6.844 11.124 -18.979 1.00 33.43 H new ATOM 864 N GLU A 55 8.103 7.301 -19.878 1.00 40.54 N ATOM 865 CA GLU A 55 7.681 6.557 -21.059 1.00 41.24 C ATOM 866 C GLU A 55 6.619 5.523 -20.700 1.00 34.21 C ATOM 867 O GLU A 55 5.703 5.261 -21.478 1.00 55.43 O ATOM 868 CB GLU A 55 8.882 5.866 -21.710 1.00 33.14 C ATOM 869 CG GLU A 55 9.268 6.454 -23.056 1.00 53.21 C ATOM 870 CD GLU A 55 10.082 5.493 -23.900 1.00 54.45 C ATOM 871 OE1 GLU A 55 11.241 5.213 -23.528 1.00 54.33 O ATOM 872 OE2 GLU A 55 9.561 5.023 -24.934 1.00 63.01 O ATOM 0 H GLU A 55 9.045 7.081 -19.555 1.00 40.54 H new ATOM 0 HA GLU A 55 7.250 7.264 -21.767 1.00 41.24 H new ATOM 0 HB2 GLU A 55 9.737 5.931 -21.036 1.00 33.14 H new ATOM 0 HB3 GLU A 55 8.656 4.807 -21.837 1.00 33.14 H new ATOM 0 HG2 GLU A 55 8.365 6.733 -23.599 1.00 53.21 H new ATOM 0 HG3 GLU A 55 9.841 7.368 -22.898 1.00 53.21 H new ATOM 879 N GLY A 56 6.749 4.937 -19.513 1.00 54.12 N ATOM 880 CA GLY A 56 5.794 3.938 -19.070 1.00 75.30 C ATOM 881 C GLY A 56 4.530 4.555 -18.502 1.00 65.42 C ATOM 882 O GLY A 56 3.503 3.885 -18.385 1.00 44.32 O ATOM 0 H GLY A 56 7.499 5.137 -18.851 1.00 54.12 H new ATOM 0 HA2 GLY A 56 5.534 3.292 -19.908 1.00 75.30 H new ATOM 0 HA3 GLY A 56 6.258 3.307 -18.313 1.00 75.30 H new ATOM 886 N CYS A 57 4.607 5.832 -18.145 1.00 74.44 N ATOM 887 CA CYS A 57 3.462 6.538 -17.582 1.00 52.14 C ATOM 888 C CYS A 57 2.424 6.836 -18.660 1.00 4.10 C ATOM 889 O CYS A 57 1.220 6.787 -18.407 1.00 4.44 O ATOM 890 CB CYS A 57 3.914 7.840 -16.919 1.00 42.01 C ATOM 891 SG CYS A 57 5.167 7.617 -15.635 1.00 3.23 S ATOM 0 H CYS A 57 5.450 6.399 -18.235 1.00 74.44 H new ATOM 0 HA CYS A 57 3.005 5.896 -16.829 1.00 52.14 H new ATOM 0 HB2 CYS A 57 4.309 8.507 -17.685 1.00 42.01 H new ATOM 0 HB3 CYS A 57 3.046 8.334 -16.483 1.00 42.01 H new ATOM 0 HG CYS A 57 6.176 6.958 -16.123 1.00 3.23 H new ATOM 897 N ARG A 58 2.899 7.146 -19.862 1.00 15.24 N ATOM 898 CA ARG A 58 2.012 7.454 -20.978 1.00 1.34 C ATOM 899 C ARG A 58 1.128 6.258 -21.316 1.00 55.43 C ATOM 900 O ARG A 58 -0.078 6.402 -21.512 1.00 13.50 O ATOM 901 CB ARG A 58 2.828 7.865 -22.206 1.00 35.42 C ATOM 902 CG ARG A 58 2.551 9.284 -22.673 1.00 23.11 C ATOM 903 CD ARG A 58 3.027 9.503 -24.101 1.00 41.43 C ATOM 904 NE ARG A 58 2.169 8.831 -25.073 1.00 43.45 N ATOM 905 CZ ARG A 58 2.458 8.735 -26.366 1.00 51.32 C ATOM 906 NH1 ARG A 58 3.578 9.263 -26.839 1.00 54.54 N ATOM 907 NH2 ARG A 58 1.626 8.109 -27.188 1.00 65.55 N ATOM 0 H ARG A 58 3.893 7.191 -20.088 1.00 15.24 H new ATOM 0 HA ARG A 58 1.370 8.284 -20.682 1.00 1.34 H new ATOM 0 HB2 ARG A 58 3.889 7.768 -21.976 1.00 35.42 H new ATOM 0 HB3 ARG A 58 2.614 7.175 -23.022 1.00 35.42 H new ATOM 0 HG2 ARG A 58 1.482 9.487 -22.609 1.00 23.11 H new ATOM 0 HG3 ARG A 58 3.050 9.991 -22.010 1.00 23.11 H new ATOM 0 HD2 ARG A 58 3.050 10.571 -24.316 1.00 41.43 H new ATOM 0 HD3 ARG A 58 4.048 9.135 -24.203 1.00 41.43 H new ATOM 0 HE ARG A 58 1.300 8.412 -24.741 1.00 43.45 H new ATOM 0 HH11 ARG A 58 4.220 9.744 -26.210 1.00 54.54 H new ATOM 0 HH12 ARG A 58 3.798 9.188 -27.832 1.00 54.54 H new ATOM 0 HH21 ARG A 58 0.764 7.701 -26.827 1.00 65.55 H new ATOM 0 HH22 ARG A 58 1.849 8.036 -28.181 1.00 65.55 H new ATOM 921 N GLN A 59 1.737 5.079 -21.385 1.00 33.21 N ATOM 922 CA GLN A 59 1.005 3.859 -21.701 1.00 63.30 C ATOM 923 C GLN A 59 -0.213 3.703 -20.795 1.00 42.43 C ATOM 924 O GLN A 59 -1.218 3.110 -21.187 1.00 13.32 O ATOM 925 CB GLN A 59 1.919 2.639 -21.561 1.00 54.42 C ATOM 926 CG GLN A 59 1.479 1.450 -22.400 1.00 50.40 C ATOM 927 CD GLN A 59 2.041 0.138 -21.892 1.00 34.33 C ATOM 928 OE1 GLN A 59 2.773 0.105 -20.902 1.00 33.44 O ATOM 929 NE2 GLN A 59 1.699 -0.953 -22.566 1.00 64.23 N ATOM 0 H GLN A 59 2.735 4.943 -21.226 1.00 33.21 H new ATOM 0 HA GLN A 59 0.661 3.930 -22.733 1.00 63.30 H new ATOM 0 HB2 GLN A 59 2.933 2.920 -21.847 1.00 54.42 H new ATOM 0 HB3 GLN A 59 1.955 2.340 -20.513 1.00 54.42 H new ATOM 0 HG2 GLN A 59 0.390 1.397 -22.405 1.00 50.40 H new ATOM 0 HG3 GLN A 59 1.796 1.601 -23.432 1.00 50.40 H new ATOM 0 HE21 GLN A 59 1.090 -0.879 -23.381 1.00 64.23 H new ATOM 0 HE22 GLN A 59 2.045 -1.865 -22.269 1.00 64.23 H new ATOM 938 N ILE A 60 -0.114 4.240 -19.583 1.00 73.14 N ATOM 939 CA ILE A 60 -1.208 4.161 -18.623 1.00 42.43 C ATOM 940 C ILE A 60 -2.361 5.071 -19.028 1.00 34.22 C ATOM 941 O ILE A 60 -3.531 4.707 -18.893 1.00 11.11 O ATOM 942 CB ILE A 60 -0.741 4.543 -17.206 1.00 42.31 C ATOM 943 CG1 ILE A 60 0.536 3.781 -16.843 1.00 14.22 C ATOM 944 CG2 ILE A 60 -1.839 4.261 -16.192 1.00 73.33 C ATOM 945 CD1 ILE A 60 1.200 4.280 -15.579 1.00 12.45 C ATOM 0 H ILE A 60 0.711 4.734 -19.243 1.00 73.14 H new ATOM 0 HA ILE A 60 -1.550 3.126 -18.618 1.00 42.43 H new ATOM 0 HB ILE A 60 -0.522 5.611 -17.187 1.00 42.31 H new ATOM 0 HG12 ILE A 60 0.297 2.724 -16.725 1.00 14.22 H new ATOM 0 HG13 ILE A 60 1.243 3.858 -17.669 1.00 14.22 H new ATOM 0 HG21 ILE A 60 -1.493 4.536 -15.196 1.00 73.33 H new ATOM 0 HG22 ILE A 60 -2.725 4.845 -16.443 1.00 73.33 H new ATOM 0 HG23 ILE A 60 -2.087 3.200 -16.210 1.00 73.33 H new ATOM 0 HD11 ILE A 60 2.098 3.694 -15.384 1.00 12.45 H new ATOM 0 HD12 ILE A 60 1.470 5.329 -15.700 1.00 12.45 H new ATOM 0 HD13 ILE A 60 0.511 4.177 -14.741 1.00 12.45 H new ATOM 957 N LEU A 61 -2.027 6.256 -19.528 1.00 1.25 N ATOM 958 CA LEU A 61 -3.035 7.219 -19.955 1.00 73.23 C ATOM 959 C LEU A 61 -3.599 6.845 -21.323 1.00 3.43 C ATOM 960 O LEU A 61 -4.749 7.150 -21.635 1.00 70.04 O ATOM 961 CB LEU A 61 -2.437 8.626 -20.004 1.00 31.32 C ATOM 962 CG LEU A 61 -1.752 9.109 -18.725 1.00 54.11 C ATOM 963 CD1 LEU A 61 -0.619 10.069 -19.056 1.00 21.53 C ATOM 964 CD2 LEU A 61 -2.760 9.771 -17.798 1.00 33.42 C ATOM 0 H LEU A 61 -1.065 6.573 -19.648 1.00 1.25 H new ATOM 0 HA LEU A 61 -3.849 7.203 -19.230 1.00 73.23 H new ATOM 0 HB2 LEU A 61 -1.712 8.663 -20.817 1.00 31.32 H new ATOM 0 HB3 LEU A 61 -3.232 9.329 -20.254 1.00 31.32 H new ATOM 0 HG LEU A 61 -1.330 8.244 -18.213 1.00 54.11 H new ATOM 0 HD11 LEU A 61 -0.143 10.402 -18.134 1.00 21.53 H new ATOM 0 HD12 LEU A 61 0.116 9.562 -19.681 1.00 21.53 H new ATOM 0 HD13 LEU A 61 -1.017 10.931 -19.591 1.00 21.53 H new ATOM 0 HD21 LEU A 61 -2.255 10.109 -16.893 1.00 33.42 H new ATOM 0 HD22 LEU A 61 -3.211 10.626 -18.302 1.00 33.42 H new ATOM 0 HD23 LEU A 61 -3.537 9.054 -17.534 1.00 33.42 H new ATOM 976 N GLY A 62 -2.780 6.182 -22.134 1.00 13.14 N ATOM 977 CA GLY A 62 -3.216 5.776 -23.457 1.00 21.00 C ATOM 978 C GLY A 62 -4.295 4.712 -23.412 1.00 73.10 C ATOM 979 O GLY A 62 -5.007 4.500 -24.393 1.00 11.02 O ATOM 0 H GLY A 62 -1.823 5.919 -21.898 1.00 13.14 H new ATOM 0 HA2 GLY A 62 -3.591 6.646 -23.995 1.00 21.00 H new ATOM 0 HA3 GLY A 62 -2.361 5.398 -24.018 1.00 21.00 H new ATOM 983 N GLN A 63 -4.414 4.042 -22.270 1.00 61.24 N ATOM 984 CA GLN A 63 -5.412 2.992 -22.103 1.00 33.42 C ATOM 985 C GLN A 63 -6.734 3.571 -21.608 1.00 45.24 C ATOM 986 O GLN A 63 -7.798 3.265 -22.147 1.00 11.32 O ATOM 987 CB GLN A 63 -4.908 1.931 -21.123 1.00 31.03 C ATOM 988 CG GLN A 63 -4.213 0.759 -21.799 1.00 14.53 C ATOM 989 CD GLN A 63 -5.170 -0.361 -22.152 1.00 22.51 C ATOM 990 OE1 GLN A 63 -6.319 -0.374 -21.711 1.00 54.14 O ATOM 991 NE2 GLN A 63 -4.698 -1.313 -22.950 1.00 15.44 N ATOM 0 H GLN A 63 -3.833 4.207 -21.448 1.00 61.24 H new ATOM 0 HA GLN A 63 -5.580 2.528 -23.075 1.00 33.42 H new ATOM 0 HB2 GLN A 63 -4.217 2.396 -20.420 1.00 31.03 H new ATOM 0 HB3 GLN A 63 -5.750 1.557 -20.541 1.00 31.03 H new ATOM 0 HG2 GLN A 63 -3.718 1.108 -22.705 1.00 14.53 H new ATOM 0 HG3 GLN A 63 -3.435 0.373 -21.140 1.00 14.53 H new ATOM 0 HE21 GLN A 63 -3.739 -1.262 -23.292 1.00 15.44 H new ATOM 0 HE22 GLN A 63 -5.295 -2.095 -23.220 1.00 15.44 H new ATOM 1000 N LEU A 64 -6.658 4.409 -20.580 1.00 71.02 N ATOM 1001 CA LEU A 64 -7.848 5.031 -20.012 1.00 14.25 C ATOM 1002 C LEU A 64 -8.377 6.132 -20.926 1.00 14.00 C ATOM 1003 O LEU A 64 -9.580 6.386 -20.975 1.00 33.23 O ATOM 1004 CB LEU A 64 -7.536 5.608 -18.629 1.00 33.30 C ATOM 1005 CG LEU A 64 -6.728 4.707 -17.694 1.00 2.43 C ATOM 1006 CD1 LEU A 64 -6.367 5.452 -16.418 1.00 61.31 C ATOM 1007 CD2 LEU A 64 -7.504 3.439 -17.372 1.00 63.11 C ATOM 0 H LEU A 64 -5.785 4.673 -20.123 1.00 71.02 H new ATOM 0 HA LEU A 64 -8.616 4.264 -19.915 1.00 14.25 H new ATOM 0 HB2 LEU A 64 -6.991 6.543 -18.762 1.00 33.30 H new ATOM 0 HB3 LEU A 64 -8.478 5.855 -18.139 1.00 33.30 H new ATOM 0 HG LEU A 64 -5.805 4.424 -18.200 1.00 2.43 H new ATOM 0 HD11 LEU A 64 -5.792 4.796 -15.764 1.00 61.31 H new ATOM 0 HD12 LEU A 64 -5.771 6.330 -16.666 1.00 61.31 H new ATOM 0 HD13 LEU A 64 -7.279 5.764 -15.909 1.00 61.31 H new ATOM 0 HD21 LEU A 64 -6.913 2.810 -16.706 1.00 63.11 H new ATOM 0 HD22 LEU A 64 -8.444 3.701 -16.886 1.00 63.11 H new ATOM 0 HD23 LEU A 64 -7.712 2.896 -18.294 1.00 63.11 H new ATOM 1019 N GLN A 65 -7.470 6.779 -21.650 1.00 21.01 N ATOM 1020 CA GLN A 65 -7.845 7.851 -22.564 1.00 2.51 C ATOM 1021 C GLN A 65 -9.082 7.470 -23.370 1.00 54.44 C ATOM 1022 O GLN A 65 -10.120 8.131 -23.312 1.00 4.14 O ATOM 1023 CB GLN A 65 -6.686 8.175 -23.508 1.00 74.43 C ATOM 1024 CG GLN A 65 -5.886 9.399 -23.092 1.00 61.51 C ATOM 1025 CD GLN A 65 -4.494 9.418 -23.694 1.00 50.05 C ATOM 1026 OE1 GLN A 65 -3.503 9.611 -22.990 1.00 23.22 O ATOM 1027 NE2 GLN A 65 -4.413 9.218 -25.004 1.00 41.10 N ATOM 0 H GLN A 65 -6.470 6.580 -21.621 1.00 21.01 H new ATOM 0 HA GLN A 65 -8.078 8.735 -21.971 1.00 2.51 H new ATOM 0 HB2 GLN A 65 -6.018 7.315 -23.559 1.00 74.43 H new ATOM 0 HB3 GLN A 65 -7.079 8.333 -24.512 1.00 74.43 H new ATOM 0 HG2 GLN A 65 -6.421 10.299 -23.395 1.00 61.51 H new ATOM 0 HG3 GLN A 65 -5.808 9.426 -22.005 1.00 61.51 H new ATOM 0 HE21 GLN A 65 -5.261 9.062 -25.549 1.00 41.10 H new ATOM 0 HE22 GLN A 65 -3.503 9.220 -25.465 1.00 41.10 H new ATOM 1036 N PRO A 66 -8.973 6.380 -24.144 1.00 22.44 N ATOM 1037 CA PRO A 66 -10.073 5.886 -24.977 1.00 62.22 C ATOM 1038 C PRO A 66 -11.212 5.303 -24.147 1.00 53.32 C ATOM 1039 O PRO A 66 -12.265 4.952 -24.680 1.00 44.35 O ATOM 1040 CB PRO A 66 -9.415 4.793 -25.823 1.00 24.03 C ATOM 1041 CG PRO A 66 -8.253 4.333 -25.010 1.00 14.41 C ATOM 1042 CD PRO A 66 -7.767 5.543 -24.263 1.00 3.24 C ATOM 0 HA PRO A 66 -10.528 6.683 -25.565 1.00 62.22 H new ATOM 0 HB2 PRO A 66 -10.108 3.975 -26.022 1.00 24.03 H new ATOM 0 HB3 PRO A 66 -9.093 5.180 -26.790 1.00 24.03 H new ATOM 0 HG2 PRO A 66 -8.547 3.541 -24.321 1.00 14.41 H new ATOM 0 HG3 PRO A 66 -7.468 3.926 -25.647 1.00 14.41 H new ATOM 0 HD2 PRO A 66 -7.365 5.277 -23.285 1.00 3.24 H new ATOM 0 HD3 PRO A 66 -6.973 6.057 -24.805 1.00 3.24 H new ATOM 1050 N SER A 67 -10.996 5.206 -22.840 1.00 24.52 N ATOM 1051 CA SER A 67 -12.004 4.663 -21.936 1.00 64.50 C ATOM 1052 C SER A 67 -12.711 5.781 -21.177 1.00 22.21 C ATOM 1053 O SER A 67 -13.722 5.552 -20.512 1.00 35.34 O ATOM 1054 CB SER A 67 -11.362 3.686 -20.949 1.00 10.22 C ATOM 1055 OG SER A 67 -12.059 2.453 -20.924 1.00 52.35 O ATOM 0 H SER A 67 -10.132 5.496 -22.382 1.00 24.52 H new ATOM 0 HA SER A 67 -12.743 4.130 -22.534 1.00 64.50 H new ATOM 0 HB2 SER A 67 -10.322 3.514 -21.228 1.00 10.22 H new ATOM 0 HB3 SER A 67 -11.356 4.124 -19.951 1.00 10.22 H new ATOM 0 HG SER A 67 -11.628 1.846 -20.287 1.00 52.35 H new ATOM 1061 N LEU A 68 -12.172 6.990 -21.280 1.00 10.24 N ATOM 1062 CA LEU A 68 -12.750 8.146 -20.602 1.00 63.15 C ATOM 1063 C LEU A 68 -14.200 8.357 -21.027 1.00 32.55 C ATOM 1064 O LEU A 68 -15.003 8.906 -20.273 1.00 60.34 O ATOM 1065 CB LEU A 68 -11.931 9.402 -20.905 1.00 24.31 C ATOM 1066 CG LEU A 68 -10.631 9.562 -20.115 1.00 35.22 C ATOM 1067 CD1 LEU A 68 -9.655 10.453 -20.868 1.00 31.30 C ATOM 1068 CD2 LEU A 68 -10.916 10.129 -18.732 1.00 10.35 C ATOM 0 H LEU A 68 -11.336 7.196 -21.826 1.00 10.24 H new ATOM 0 HA LEU A 68 -12.728 7.955 -19.529 1.00 63.15 H new ATOM 0 HB2 LEU A 68 -11.690 9.407 -21.968 1.00 24.31 H new ATOM 0 HB3 LEU A 68 -12.557 10.274 -20.716 1.00 24.31 H new ATOM 0 HG LEU A 68 -10.176 8.579 -19.997 1.00 35.22 H new ATOM 0 HD11 LEU A 68 -8.736 10.555 -20.291 1.00 31.30 H new ATOM 0 HD12 LEU A 68 -9.428 10.007 -21.836 1.00 31.30 H new ATOM 0 HD13 LEU A 68 -10.101 11.436 -21.017 1.00 31.30 H new ATOM 0 HD21 LEU A 68 -9.981 10.237 -18.183 1.00 10.35 H new ATOM 0 HD22 LEU A 68 -11.394 11.104 -18.830 1.00 10.35 H new ATOM 0 HD23 LEU A 68 -11.578 9.453 -18.191 1.00 10.35 H new ATOM 1080 N GLN A 69 -14.527 7.914 -22.236 1.00 52.02 N ATOM 1081 CA GLN A 69 -15.881 8.052 -22.760 1.00 41.31 C ATOM 1082 C GLN A 69 -16.907 7.516 -21.766 1.00 44.11 C ATOM 1083 O GLN A 69 -17.911 8.169 -21.480 1.00 45.12 O ATOM 1084 CB GLN A 69 -16.013 7.316 -24.094 1.00 53.13 C ATOM 1085 CG GLN A 69 -17.318 7.602 -24.820 1.00 53.24 C ATOM 1086 CD GLN A 69 -17.140 8.553 -25.987 1.00 13.50 C ATOM 1087 OE1 GLN A 69 -16.611 9.653 -25.831 1.00 45.12 O ATOM 1088 NE2 GLN A 69 -17.583 8.132 -27.167 1.00 51.21 N ATOM 0 H GLN A 69 -13.873 7.456 -22.871 1.00 52.02 H new ATOM 0 HA GLN A 69 -16.075 9.113 -22.918 1.00 41.31 H new ATOM 0 HB2 GLN A 69 -15.180 7.596 -24.738 1.00 53.13 H new ATOM 0 HB3 GLN A 69 -15.933 6.243 -23.917 1.00 53.13 H new ATOM 0 HG2 GLN A 69 -17.741 6.665 -25.181 1.00 53.24 H new ATOM 0 HG3 GLN A 69 -18.035 8.026 -24.117 1.00 53.24 H new ATOM 0 HE21 GLN A 69 -18.015 7.212 -27.251 1.00 51.21 H new ATOM 0 HE22 GLN A 69 -17.491 8.729 -27.989 1.00 51.21 H new ATOM 1097 N THR A 70 -16.647 6.322 -21.242 1.00 51.24 N ATOM 1098 CA THR A 70 -17.548 5.697 -20.282 1.00 73.43 C ATOM 1099 C THR A 70 -16.774 5.085 -19.120 1.00 0.52 C ATOM 1100 O THR A 70 -16.991 3.930 -18.755 1.00 41.44 O ATOM 1101 CB THR A 70 -18.405 4.603 -20.946 1.00 24.43 C ATOM 1102 OG1 THR A 70 -18.686 4.956 -22.304 1.00 41.02 O ATOM 1103 CG2 THR A 70 -19.709 4.403 -20.188 1.00 11.42 C ATOM 0 H THR A 70 -15.820 5.769 -21.466 1.00 51.24 H new ATOM 0 HA THR A 70 -18.203 6.483 -19.905 1.00 73.43 H new ATOM 0 HB THR A 70 -17.843 3.669 -20.924 1.00 24.43 H new ATOM 0 HG1 THR A 70 -19.230 4.254 -22.719 1.00 41.02 H new ATOM 0 HG21 THR A 70 -20.298 3.626 -20.675 1.00 11.42 H new ATOM 0 HG22 THR A 70 -19.492 4.104 -19.163 1.00 11.42 H new ATOM 0 HG23 THR A 70 -20.273 5.336 -20.182 1.00 11.42 H new ATOM 1111 N GLY A 71 -15.870 5.869 -18.540 1.00 20.33 N ATOM 1112 CA GLY A 71 -15.077 5.387 -17.423 1.00 73.34 C ATOM 1113 C GLY A 71 -15.667 5.777 -16.082 1.00 74.13 C ATOM 1114 O GLY A 71 -15.973 6.945 -15.847 1.00 52.11 O ATOM 0 H GLY A 71 -15.672 6.829 -18.823 1.00 20.33 H new ATOM 0 HA2 GLY A 71 -14.997 4.301 -17.480 1.00 73.34 H new ATOM 0 HA3 GLY A 71 -14.065 5.785 -17.501 1.00 73.34 H new ATOM 1118 N SER A 72 -15.828 4.795 -15.200 1.00 43.24 N ATOM 1119 CA SER A 72 -16.390 5.040 -13.878 1.00 35.11 C ATOM 1120 C SER A 72 -15.550 6.055 -13.110 1.00 44.11 C ATOM 1121 O SER A 72 -14.467 6.439 -13.550 1.00 3.42 O ATOM 1122 CB SER A 72 -16.480 3.733 -13.088 1.00 53.24 C ATOM 1123 OG SER A 72 -15.190 3.250 -12.754 1.00 14.35 O ATOM 0 H SER A 72 -15.577 3.823 -15.378 1.00 43.24 H new ATOM 0 HA SER A 72 -17.393 5.448 -14.007 1.00 35.11 H new ATOM 0 HB2 SER A 72 -17.059 3.893 -12.178 1.00 53.24 H new ATOM 0 HB3 SER A 72 -17.011 2.985 -13.676 1.00 53.24 H new ATOM 0 HG SER A 72 -15.274 2.415 -12.248 1.00 14.35 H new ATOM 1129 N GLU A 73 -16.057 6.486 -11.959 1.00 32.42 N ATOM 1130 CA GLU A 73 -15.354 7.456 -11.130 1.00 5.42 C ATOM 1131 C GLU A 73 -13.903 7.035 -10.910 1.00 32.14 C ATOM 1132 O GLU A 73 -12.988 7.851 -11.002 1.00 12.32 O ATOM 1133 CB GLU A 73 -16.059 7.616 -9.781 1.00 41.14 C ATOM 1134 CG GLU A 73 -16.332 9.063 -9.405 1.00 24.50 C ATOM 1135 CD GLU A 73 -15.280 9.631 -8.473 1.00 2.12 C ATOM 1136 OE1 GLU A 73 -14.189 9.993 -8.961 1.00 64.01 O ATOM 1137 OE2 GLU A 73 -15.546 9.713 -7.256 1.00 12.04 O ATOM 0 H GLU A 73 -16.953 6.178 -11.580 1.00 32.42 H new ATOM 0 HA GLU A 73 -15.362 8.413 -11.652 1.00 5.42 H new ATOM 0 HB2 GLU A 73 -17.003 7.072 -9.807 1.00 41.14 H new ATOM 0 HB3 GLU A 73 -15.448 7.157 -9.004 1.00 41.14 H new ATOM 0 HG2 GLU A 73 -16.375 9.668 -10.311 1.00 24.50 H new ATOM 0 HG3 GLU A 73 -17.310 9.133 -8.929 1.00 24.50 H new ATOM 1144 N GLU A 74 -13.704 5.753 -10.618 1.00 61.03 N ATOM 1145 CA GLU A 74 -12.365 5.223 -10.383 1.00 50.24 C ATOM 1146 C GLU A 74 -11.438 5.552 -11.550 1.00 61.23 C ATOM 1147 O GLU A 74 -10.293 5.960 -11.351 1.00 52.20 O ATOM 1148 CB GLU A 74 -12.422 3.708 -10.174 1.00 40.23 C ATOM 1149 CG GLU A 74 -13.235 3.292 -8.959 1.00 61.02 C ATOM 1150 CD GLU A 74 -12.426 3.327 -7.678 1.00 23.45 C ATOM 1151 OE1 GLU A 74 -12.123 4.439 -7.196 1.00 72.12 O ATOM 1152 OE2 GLU A 74 -12.097 2.241 -7.154 1.00 43.40 O ATOM 0 H GLU A 74 -14.451 5.063 -10.539 1.00 61.03 H new ATOM 0 HA GLU A 74 -11.968 5.692 -9.483 1.00 50.24 H new ATOM 0 HB2 GLU A 74 -12.848 3.243 -11.063 1.00 40.23 H new ATOM 0 HB3 GLU A 74 -11.407 3.325 -10.070 1.00 40.23 H new ATOM 0 HG2 GLU A 74 -14.096 3.953 -8.859 1.00 61.02 H new ATOM 0 HG3 GLU A 74 -13.622 2.285 -9.113 1.00 61.02 H new ATOM 1159 N LEU A 75 -11.940 5.371 -12.766 1.00 51.02 N ATOM 1160 CA LEU A 75 -11.158 5.647 -13.966 1.00 43.14 C ATOM 1161 C LEU A 75 -10.687 7.098 -13.987 1.00 65.20 C ATOM 1162 O LEU A 75 -9.541 7.384 -14.336 1.00 12.44 O ATOM 1163 CB LEU A 75 -11.984 5.349 -15.219 1.00 23.35 C ATOM 1164 CG LEU A 75 -11.198 4.896 -16.449 1.00 74.03 C ATOM 1165 CD1 LEU A 75 -11.808 3.634 -17.037 1.00 35.11 C ATOM 1166 CD2 LEU A 75 -11.153 6.004 -17.491 1.00 55.31 C ATOM 0 H LEU A 75 -12.886 5.034 -12.947 1.00 51.02 H new ATOM 0 HA LEU A 75 -10.281 4.999 -13.955 1.00 43.14 H new ATOM 0 HB2 LEU A 75 -12.713 4.577 -14.974 1.00 23.35 H new ATOM 0 HB3 LEU A 75 -12.545 6.246 -15.481 1.00 23.35 H new ATOM 0 HG LEU A 75 -10.177 4.672 -16.141 1.00 74.03 H new ATOM 0 HD11 LEU A 75 -11.235 3.326 -17.912 1.00 35.11 H new ATOM 0 HD12 LEU A 75 -11.788 2.839 -16.292 1.00 35.11 H new ATOM 0 HD13 LEU A 75 -12.839 3.831 -17.329 1.00 35.11 H new ATOM 0 HD21 LEU A 75 -10.589 5.664 -18.360 1.00 55.31 H new ATOM 0 HD22 LEU A 75 -12.168 6.260 -17.794 1.00 55.31 H new ATOM 0 HD23 LEU A 75 -10.669 6.883 -17.066 1.00 55.31 H new ATOM 1178 N ARG A 76 -11.577 8.009 -13.608 1.00 53.22 N ATOM 1179 CA ARG A 76 -11.253 9.430 -13.583 1.00 34.35 C ATOM 1180 C ARG A 76 -10.133 9.714 -12.587 1.00 45.02 C ATOM 1181 O ARG A 76 -9.131 10.345 -12.927 1.00 14.12 O ATOM 1182 CB ARG A 76 -12.492 10.252 -13.220 1.00 73.32 C ATOM 1183 CG ARG A 76 -13.174 10.887 -14.421 1.00 1.53 C ATOM 1184 CD ARG A 76 -14.200 11.926 -13.993 1.00 60.30 C ATOM 1185 NE ARG A 76 -15.415 11.310 -13.468 1.00 74.30 N ATOM 1186 CZ ARG A 76 -16.566 11.957 -13.329 1.00 31.23 C ATOM 1187 NH1 ARG A 76 -16.659 13.234 -13.675 1.00 2.21 N ATOM 1188 NH2 ARG A 76 -17.629 11.328 -12.843 1.00 72.34 N ATOM 0 H ARG A 76 -12.528 7.788 -13.314 1.00 53.22 H new ATOM 0 HA ARG A 76 -10.914 9.717 -14.578 1.00 34.35 H new ATOM 0 HB2 ARG A 76 -13.206 9.609 -12.705 1.00 73.32 H new ATOM 0 HB3 ARG A 76 -12.205 11.036 -12.519 1.00 73.32 H new ATOM 0 HG2 ARG A 76 -12.426 11.355 -15.061 1.00 1.53 H new ATOM 0 HG3 ARG A 76 -13.663 10.114 -15.014 1.00 1.53 H new ATOM 0 HD2 ARG A 76 -13.764 12.574 -13.233 1.00 60.30 H new ATOM 0 HD3 ARG A 76 -14.453 12.558 -14.844 1.00 60.30 H new ATOM 0 HE ARG A 76 -15.378 10.329 -13.193 1.00 74.30 H new ATOM 0 HH11 ARG A 76 -15.845 13.722 -14.049 1.00 2.21 H new ATOM 0 HH12 ARG A 76 -17.545 13.728 -13.567 1.00 2.21 H new ATOM 0 HH21 ARG A 76 -17.562 10.346 -12.576 1.00 72.34 H new ATOM 0 HH22 ARG A 76 -18.512 11.827 -12.737 1.00 72.34 H new ATOM 1202 N SER A 77 -10.308 9.244 -11.357 1.00 21.02 N ATOM 1203 CA SER A 77 -9.313 9.450 -10.310 1.00 14.34 C ATOM 1204 C SER A 77 -7.928 9.023 -10.785 1.00 11.50 C ATOM 1205 O SER A 77 -6.933 9.703 -10.526 1.00 70.05 O ATOM 1206 CB SER A 77 -9.697 8.669 -9.051 1.00 44.13 C ATOM 1207 OG SER A 77 -10.572 9.422 -8.230 1.00 74.53 O ATOM 0 H SER A 77 -11.130 8.718 -11.060 1.00 21.02 H new ATOM 0 HA SER A 77 -9.285 10.514 -10.074 1.00 14.34 H new ATOM 0 HB2 SER A 77 -10.175 7.731 -9.333 1.00 44.13 H new ATOM 0 HB3 SER A 77 -8.798 8.412 -8.490 1.00 44.13 H new ATOM 0 HG SER A 77 -10.803 8.900 -7.433 1.00 74.53 H new ATOM 1213 N LEU A 78 -7.870 7.895 -11.482 1.00 33.53 N ATOM 1214 CA LEU A 78 -6.607 7.375 -11.995 1.00 34.21 C ATOM 1215 C LEU A 78 -6.006 8.326 -13.025 1.00 3.34 C ATOM 1216 O LEU A 78 -4.854 8.745 -12.899 1.00 53.42 O ATOM 1217 CB LEU A 78 -6.816 5.995 -12.619 1.00 73.11 C ATOM 1218 CG LEU A 78 -6.305 4.805 -11.806 1.00 31.20 C ATOM 1219 CD1 LEU A 78 -4.832 4.983 -11.470 1.00 22.34 C ATOM 1220 CD2 LEU A 78 -7.127 4.634 -10.537 1.00 24.52 C ATOM 0 H LEU A 78 -8.683 7.322 -11.706 1.00 33.53 H new ATOM 0 HA LEU A 78 -5.913 7.287 -11.160 1.00 34.21 H new ATOM 0 HB2 LEU A 78 -7.883 5.857 -12.797 1.00 73.11 H new ATOM 0 HB3 LEU A 78 -6.326 5.981 -13.593 1.00 73.11 H new ATOM 0 HG LEU A 78 -6.413 3.903 -12.409 1.00 31.20 H new ATOM 0 HD11 LEU A 78 -4.485 4.127 -10.891 1.00 22.34 H new ATOM 0 HD12 LEU A 78 -4.255 5.056 -12.392 1.00 22.34 H new ATOM 0 HD13 LEU A 78 -4.700 5.894 -10.886 1.00 22.34 H new ATOM 0 HD21 LEU A 78 -6.749 3.783 -9.971 1.00 24.52 H new ATOM 0 HD22 LEU A 78 -7.051 5.536 -9.930 1.00 24.52 H new ATOM 0 HD23 LEU A 78 -8.171 4.461 -10.800 1.00 24.52 H new ATOM 1232 N TYR A 79 -6.792 8.664 -14.040 1.00 23.33 N ATOM 1233 CA TYR A 79 -6.336 9.566 -15.092 1.00 30.00 C ATOM 1234 C TYR A 79 -5.710 10.824 -14.497 1.00 53.14 C ATOM 1235 O TYR A 79 -4.551 11.140 -14.764 1.00 35.44 O ATOM 1236 CB TYR A 79 -7.502 9.945 -16.006 1.00 44.54 C ATOM 1237 CG TYR A 79 -7.070 10.374 -17.391 1.00 20.04 C ATOM 1238 CD1 TYR A 79 -6.325 9.527 -18.201 1.00 71.52 C ATOM 1239 CD2 TYR A 79 -7.406 11.627 -17.888 1.00 14.33 C ATOM 1240 CE1 TYR A 79 -5.928 9.914 -19.466 1.00 61.15 C ATOM 1241 CE2 TYR A 79 -7.015 12.023 -19.152 1.00 64.51 C ATOM 1242 CZ TYR A 79 -6.276 11.163 -19.938 1.00 20.23 C ATOM 1243 OH TYR A 79 -5.882 11.553 -21.197 1.00 10.12 O ATOM 0 H TYR A 79 -7.748 8.328 -14.157 1.00 23.33 H new ATOM 0 HA TYR A 79 -5.577 9.048 -15.678 1.00 30.00 H new ATOM 0 HB2 TYR A 79 -8.177 9.093 -16.092 1.00 44.54 H new ATOM 0 HB3 TYR A 79 -8.067 10.754 -15.544 1.00 44.54 H new ATOM 0 HD1 TYR A 79 -6.051 8.548 -17.835 1.00 71.52 H new ATOM 0 HD2 TYR A 79 -7.983 12.303 -17.275 1.00 14.33 H new ATOM 0 HE1 TYR A 79 -5.348 9.243 -20.082 1.00 61.15 H new ATOM 0 HE2 TYR A 79 -7.286 13.000 -19.523 1.00 64.51 H new ATOM 0 HH TYR A 79 -6.210 12.459 -21.376 1.00 10.12 H new ATOM 1253 N ASN A 80 -6.488 11.539 -13.690 1.00 71.11 N ATOM 1254 CA ASN A 80 -6.011 12.763 -13.057 1.00 3.05 C ATOM 1255 C ASN A 80 -4.648 12.544 -12.406 1.00 75.13 C ATOM 1256 O ASN A 80 -3.689 13.260 -12.693 1.00 43.10 O ATOM 1257 CB ASN A 80 -7.017 13.245 -12.010 1.00 30.14 C ATOM 1258 CG ASN A 80 -8.132 14.073 -12.618 1.00 52.12 C ATOM 1259 OD1 ASN A 80 -8.505 13.879 -13.775 1.00 61.54 O ATOM 1260 ND2 ASN A 80 -8.670 15.005 -11.839 1.00 73.30 N ATOM 0 H ASN A 80 -7.450 11.292 -13.459 1.00 71.11 H new ATOM 0 HA ASN A 80 -5.906 13.525 -13.829 1.00 3.05 H new ATOM 0 HB2 ASN A 80 -7.446 12.383 -11.498 1.00 30.14 H new ATOM 0 HB3 ASN A 80 -6.498 13.837 -11.257 1.00 30.14 H new ATOM 0 HD21 ASN A 80 -9.423 15.594 -12.194 1.00 73.30 H new ATOM 0 HD22 ASN A 80 -8.330 15.132 -10.886 1.00 73.30 H new ATOM 1267 N THR A 81 -4.571 11.549 -11.528 1.00 75.54 N ATOM 1268 CA THR A 81 -3.327 11.235 -10.837 1.00 14.15 C ATOM 1269 C THR A 81 -2.218 10.899 -11.826 1.00 25.55 C ATOM 1270 O THR A 81 -1.181 11.562 -11.860 1.00 13.23 O ATOM 1271 CB THR A 81 -3.508 10.054 -9.864 1.00 25.12 C ATOM 1272 OG1 THR A 81 -4.628 10.294 -9.005 1.00 14.01 O ATOM 1273 CG2 THR A 81 -2.255 9.847 -9.026 1.00 20.53 C ATOM 0 H THR A 81 -5.356 10.947 -11.279 1.00 75.54 H new ATOM 0 HA THR A 81 -3.047 12.123 -10.271 1.00 14.15 H new ATOM 0 HB THR A 81 -3.687 9.153 -10.450 1.00 25.12 H new ATOM 0 HG1 THR A 81 -5.458 10.104 -9.489 1.00 14.01 H new ATOM 0 HG21 THR A 81 -2.406 9.008 -8.347 1.00 20.53 H new ATOM 0 HG22 THR A 81 -1.410 9.636 -9.681 1.00 20.53 H new ATOM 0 HG23 THR A 81 -2.050 10.749 -8.449 1.00 20.53 H new ATOM 1281 N ILE A 82 -2.442 9.865 -12.630 1.00 23.44 N ATOM 1282 CA ILE A 82 -1.460 9.442 -13.622 1.00 34.25 C ATOM 1283 C ILE A 82 -0.910 10.636 -14.393 1.00 71.24 C ATOM 1284 O ILE A 82 0.301 10.769 -14.571 1.00 12.04 O ATOM 1285 CB ILE A 82 -2.064 8.435 -14.617 1.00 74.53 C ATOM 1286 CG1 ILE A 82 -2.603 7.210 -13.875 1.00 12.25 C ATOM 1287 CG2 ILE A 82 -1.024 8.020 -15.648 1.00 30.23 C ATOM 1288 CD1 ILE A 82 -3.808 6.582 -14.540 1.00 12.54 C ATOM 0 H ILE A 82 -3.294 9.305 -12.614 1.00 23.44 H new ATOM 0 HA ILE A 82 -0.648 8.959 -13.078 1.00 34.25 H new ATOM 0 HB ILE A 82 -2.893 8.915 -15.137 1.00 74.53 H new ATOM 0 HG12 ILE A 82 -1.811 6.465 -13.798 1.00 12.25 H new ATOM 0 HG13 ILE A 82 -2.869 7.499 -12.858 1.00 12.25 H new ATOM 0 HG21 ILE A 82 -1.466 7.308 -16.345 1.00 30.23 H new ATOM 0 HG22 ILE A 82 -0.683 8.899 -16.195 1.00 30.23 H new ATOM 0 HG23 ILE A 82 -0.177 7.556 -15.144 1.00 30.23 H new ATOM 0 HD11 ILE A 82 -4.136 5.720 -13.959 1.00 12.54 H new ATOM 0 HD12 ILE A 82 -4.616 7.312 -14.593 1.00 12.54 H new ATOM 0 HD13 ILE A 82 -3.542 6.261 -15.547 1.00 12.54 H new ATOM 1300 N ALA A 83 -1.807 11.503 -14.850 1.00 74.31 N ATOM 1301 CA ALA A 83 -1.412 12.689 -15.601 1.00 34.14 C ATOM 1302 C ALA A 83 -0.276 13.427 -14.901 1.00 2.33 C ATOM 1303 O ALA A 83 0.773 13.678 -15.493 1.00 21.12 O ATOM 1304 CB ALA A 83 -2.605 13.612 -15.794 1.00 51.41 C ATOM 0 H ALA A 83 -2.813 11.407 -14.713 1.00 74.31 H new ATOM 0 HA ALA A 83 -1.054 12.368 -16.579 1.00 34.14 H new ATOM 0 HB1 ALA A 83 -2.296 14.493 -16.356 1.00 51.41 H new ATOM 0 HB2 ALA A 83 -3.386 13.087 -16.343 1.00 51.41 H new ATOM 0 HB3 ALA A 83 -2.989 13.918 -14.821 1.00 51.41 H new ATOM 1310 N VAL A 84 -0.493 13.775 -13.636 1.00 71.22 N ATOM 1311 CA VAL A 84 0.513 14.485 -12.855 1.00 21.25 C ATOM 1312 C VAL A 84 1.814 13.694 -12.787 1.00 1.12 C ATOM 1313 O VAL A 84 2.900 14.247 -12.971 1.00 74.14 O ATOM 1314 CB VAL A 84 0.018 14.764 -11.423 1.00 33.21 C ATOM 1315 CG1 VAL A 84 1.115 15.418 -10.597 1.00 4.35 C ATOM 1316 CG2 VAL A 84 -1.230 15.633 -11.451 1.00 71.10 C ATOM 0 H VAL A 84 -1.357 13.577 -13.131 1.00 71.22 H new ATOM 0 HA VAL A 84 0.694 15.434 -13.360 1.00 21.25 H new ATOM 0 HB VAL A 84 -0.239 13.814 -10.954 1.00 33.21 H new ATOM 0 HG11 VAL A 84 0.747 15.608 -9.589 1.00 4.35 H new ATOM 0 HG12 VAL A 84 1.979 14.755 -10.549 1.00 4.35 H new ATOM 0 HG13 VAL A 84 1.406 16.361 -11.060 1.00 4.35 H new ATOM 0 HG21 VAL A 84 -1.566 15.820 -10.431 1.00 71.10 H new ATOM 0 HG22 VAL A 84 -1.002 16.581 -11.938 1.00 71.10 H new ATOM 0 HG23 VAL A 84 -2.017 15.121 -12.004 1.00 71.10 H new ATOM 1326 N LEU A 85 1.700 12.398 -12.520 1.00 75.23 N ATOM 1327 CA LEU A 85 2.867 11.530 -12.428 1.00 22.54 C ATOM 1328 C LEU A 85 3.728 11.638 -13.682 1.00 43.13 C ATOM 1329 O LEU A 85 4.926 11.359 -13.652 1.00 21.43 O ATOM 1330 CB LEU A 85 2.433 10.077 -12.218 1.00 12.43 C ATOM 1331 CG LEU A 85 3.374 9.209 -11.382 1.00 51.32 C ATOM 1332 CD1 LEU A 85 2.596 8.455 -10.315 1.00 13.33 C ATOM 1333 CD2 LEU A 85 4.138 8.240 -12.273 1.00 12.43 C ATOM 0 H LEU A 85 0.810 11.925 -12.363 1.00 75.23 H new ATOM 0 HA LEU A 85 3.461 11.853 -11.573 1.00 22.54 H new ATOM 0 HB2 LEU A 85 1.452 10.077 -11.742 1.00 12.43 H new ATOM 0 HB3 LEU A 85 2.313 9.610 -13.196 1.00 12.43 H new ATOM 0 HG LEU A 85 4.094 9.860 -10.886 1.00 51.32 H new ATOM 0 HD11 LEU A 85 3.282 7.842 -9.730 1.00 13.33 H new ATOM 0 HD12 LEU A 85 2.095 9.167 -9.659 1.00 13.33 H new ATOM 0 HD13 LEU A 85 1.853 7.815 -10.791 1.00 13.33 H new ATOM 0 HD21 LEU A 85 4.803 7.630 -11.661 1.00 12.43 H new ATOM 0 HD22 LEU A 85 3.433 7.594 -12.797 1.00 12.43 H new ATOM 0 HD23 LEU A 85 4.726 8.800 -13.000 1.00 12.43 H new ATOM 1345 N TYR A 86 3.109 12.048 -14.784 1.00 1.34 N ATOM 1346 CA TYR A 86 3.818 12.194 -16.050 1.00 3.52 C ATOM 1347 C TYR A 86 4.547 13.533 -16.115 1.00 3.35 C ATOM 1348 O TYR A 86 5.722 13.596 -16.477 1.00 2.23 O ATOM 1349 CB TYR A 86 2.842 12.075 -17.222 1.00 14.31 C ATOM 1350 CG TYR A 86 3.500 12.226 -18.575 1.00 11.23 C ATOM 1351 CD1 TYR A 86 4.151 11.156 -19.175 1.00 52.11 C ATOM 1352 CD2 TYR A 86 3.469 13.438 -19.253 1.00 34.23 C ATOM 1353 CE1 TYR A 86 4.754 11.289 -20.411 1.00 54.41 C ATOM 1354 CE2 TYR A 86 4.066 13.580 -20.490 1.00 25.11 C ATOM 1355 CZ TYR A 86 4.709 12.503 -21.065 1.00 14.33 C ATOM 1356 OH TYR A 86 5.307 12.640 -22.297 1.00 62.40 O ATOM 0 H TYR A 86 2.118 12.285 -14.826 1.00 1.34 H new ATOM 0 HA TYR A 86 4.556 11.395 -16.118 1.00 3.52 H new ATOM 0 HB2 TYR A 86 2.347 11.105 -17.174 1.00 14.31 H new ATOM 0 HB3 TYR A 86 2.067 12.834 -17.117 1.00 14.31 H new ATOM 0 HD1 TYR A 86 4.187 10.204 -18.667 1.00 52.11 H new ATOM 0 HD2 TYR A 86 2.969 14.284 -18.805 1.00 34.23 H new ATOM 0 HE1 TYR A 86 5.258 10.447 -20.863 1.00 54.41 H new ATOM 0 HE2 TYR A 86 4.030 14.529 -21.005 1.00 25.11 H new ATOM 0 HH TYR A 86 5.183 13.557 -22.621 1.00 62.40 H new ATOM 1366 N CYS A 87 3.841 14.602 -15.761 1.00 63.42 N ATOM 1367 CA CYS A 87 4.419 15.940 -15.779 1.00 0.13 C ATOM 1368 C CYS A 87 5.577 16.046 -14.791 1.00 63.23 C ATOM 1369 O CYS A 87 6.385 16.971 -14.862 1.00 24.13 O ATOM 1370 CB CYS A 87 3.353 16.983 -15.445 1.00 14.51 C ATOM 1371 SG CYS A 87 2.923 17.065 -13.690 1.00 13.21 S ATOM 0 H CYS A 87 2.868 14.567 -15.458 1.00 63.42 H new ATOM 0 HA CYS A 87 4.802 16.130 -16.782 1.00 0.13 H new ATOM 0 HB2 CYS A 87 3.705 17.963 -15.768 1.00 14.51 H new ATOM 0 HB3 CYS A 87 2.453 16.763 -16.019 1.00 14.51 H new ATOM 0 HG CYS A 87 3.053 15.887 -13.156 1.00 13.21 H new ATOM 1377 N VAL A 88 5.651 15.091 -13.869 1.00 72.30 N ATOM 1378 CA VAL A 88 6.709 15.076 -12.866 1.00 52.02 C ATOM 1379 C VAL A 88 8.016 14.559 -13.455 1.00 42.33 C ATOM 1380 O VAL A 88 9.098 15.032 -13.105 1.00 63.20 O ATOM 1381 CB VAL A 88 6.323 14.204 -11.656 1.00 41.05 C ATOM 1382 CG1 VAL A 88 7.449 14.182 -10.634 1.00 30.14 C ATOM 1383 CG2 VAL A 88 5.031 14.705 -11.029 1.00 63.21 C ATOM 0 H VAL A 88 4.990 14.317 -13.796 1.00 72.30 H new ATOM 0 HA VAL A 88 6.845 16.105 -12.534 1.00 52.02 H new ATOM 0 HB VAL A 88 6.159 13.184 -12.002 1.00 41.05 H new ATOM 0 HG11 VAL A 88 7.159 13.561 -9.786 1.00 30.14 H new ATOM 0 HG12 VAL A 88 8.349 13.772 -11.093 1.00 30.14 H new ATOM 0 HG13 VAL A 88 7.648 15.197 -10.290 1.00 30.14 H new ATOM 0 HG21 VAL A 88 4.773 14.077 -10.176 1.00 63.21 H new ATOM 0 HG22 VAL A 88 5.164 15.734 -10.696 1.00 63.21 H new ATOM 0 HG23 VAL A 88 4.229 14.663 -11.766 1.00 63.21 H new ATOM 1393 N HIS A 89 7.911 13.585 -14.354 1.00 75.15 N ATOM 1394 CA HIS A 89 9.086 13.004 -14.995 1.00 31.44 C ATOM 1395 C HIS A 89 9.510 13.832 -16.204 1.00 32.15 C ATOM 1396 O HIS A 89 10.707 14.092 -16.317 1.00 42.03 O ATOM 1397 CB HIS A 89 8.798 11.563 -15.424 1.00 3.41 C ATOM 1398 CG HIS A 89 8.621 10.620 -14.274 1.00 44.32 C ATOM 1399 ND1 HIS A 89 9.566 10.455 -13.284 1.00 25.54 N ATOM 1400 CD2 HIS A 89 7.601 9.790 -13.960 1.00 30.04 C ATOM 1401 CE1 HIS A 89 9.134 9.563 -12.410 1.00 45.15 C ATOM 1402 NE2 HIS A 89 7.943 9.144 -12.798 1.00 11.32 N ATOM 0 H HIS A 89 7.024 13.181 -14.655 1.00 75.15 H new ATOM 0 HA HIS A 89 9.902 13.004 -14.272 1.00 31.44 H new ATOM 0 HB2 HIS A 89 7.897 11.548 -16.037 1.00 3.41 H new ATOM 0 HB3 HIS A 89 9.616 11.209 -16.051 1.00 3.41 H new ATOM 0 HD1 HIS A 89 10.459 10.945 -13.234 1.00 25.54 H new ATOM 0 HD2 HIS A 89 6.687 9.659 -14.520 1.00 30.04 H new ATOM 0 HE1 HIS A 89 9.664 9.233 -11.529 1.00 45.15 H new ATOM 1411 N GLN A 90 8.595 14.237 -17.077 1.00 55.45 N ATOM 1412 CA GLN A 90 8.953 15.029 -18.248 1.00 4.41 C ATOM 1413 C GLN A 90 9.277 16.467 -17.854 1.00 33.15 C ATOM 1414 O GLN A 90 9.682 17.274 -18.690 1.00 12.23 O ATOM 1415 CB GLN A 90 7.816 15.012 -19.270 1.00 11.20 C ATOM 1416 CG GLN A 90 8.119 14.177 -20.504 1.00 42.41 C ATOM 1417 CD GLN A 90 9.426 14.567 -21.166 1.00 0.35 C ATOM 1418 OE1 GLN A 90 10.406 13.823 -21.115 1.00 40.24 O ATOM 1419 NE2 GLN A 90 9.448 15.739 -21.790 1.00 71.44 N ATOM 0 H GLN A 90 7.599 14.030 -16.996 1.00 55.45 H new ATOM 0 HA GLN A 90 9.841 14.585 -18.697 1.00 4.41 H new ATOM 0 HB2 GLN A 90 6.915 14.626 -18.793 1.00 11.20 H new ATOM 0 HB3 GLN A 90 7.600 16.035 -19.578 1.00 11.20 H new ATOM 0 HG2 GLN A 90 8.157 13.124 -20.225 1.00 42.41 H new ATOM 0 HG3 GLN A 90 7.306 14.287 -21.221 1.00 42.41 H new ATOM 0 HE21 GLN A 90 8.612 16.323 -21.807 1.00 71.44 H new ATOM 0 HE22 GLN A 90 10.301 16.055 -22.252 1.00 71.44 H new ATOM 1428 N ARG A 91 9.096 16.779 -16.575 1.00 11.14 N ATOM 1429 CA ARG A 91 9.367 18.120 -16.070 1.00 30.22 C ATOM 1430 C ARG A 91 8.405 19.135 -16.680 1.00 23.04 C ATOM 1431 O ARG A 91 8.812 20.225 -17.082 1.00 51.11 O ATOM 1432 CB ARG A 91 10.811 18.521 -16.377 1.00 20.53 C ATOM 1433 CG ARG A 91 11.412 19.468 -15.351 1.00 31.42 C ATOM 1434 CD ARG A 91 12.047 18.708 -14.197 1.00 25.32 C ATOM 1435 NE ARG A 91 13.301 19.320 -13.763 1.00 42.23 N ATOM 1436 CZ ARG A 91 14.024 18.869 -12.745 1.00 45.31 C ATOM 1437 NH1 ARG A 91 13.622 17.808 -12.059 1.00 4.33 N ATOM 1438 NH2 ARG A 91 15.155 19.480 -12.411 1.00 61.32 N ATOM 0 H ARG A 91 8.763 16.122 -15.870 1.00 11.14 H new ATOM 0 HA ARG A 91 9.221 18.111 -14.990 1.00 30.22 H new ATOM 0 HB2 ARG A 91 11.425 17.622 -16.432 1.00 20.53 H new ATOM 0 HB3 ARG A 91 10.847 18.993 -17.359 1.00 20.53 H new ATOM 0 HG2 ARG A 91 12.162 20.097 -15.830 1.00 31.42 H new ATOM 0 HG3 ARG A 91 10.637 20.132 -14.968 1.00 31.42 H new ATOM 0 HD2 ARG A 91 11.351 18.674 -13.359 1.00 25.32 H new ATOM 0 HD3 ARG A 91 12.232 17.677 -14.500 1.00 25.32 H new ATOM 0 HE ARG A 91 13.639 20.138 -14.270 1.00 42.23 H new ATOM 0 HH11 ARG A 91 12.755 17.335 -12.313 1.00 4.33 H new ATOM 0 HH12 ARG A 91 14.180 17.464 -11.277 1.00 4.33 H new ATOM 0 HH21 ARG A 91 15.468 20.296 -12.937 1.00 61.32 H new ATOM 0 HH22 ARG A 91 15.710 19.133 -11.629 1.00 61.32 H new ATOM 1452 N ILE A 92 7.130 18.769 -16.744 1.00 11.44 N ATOM 1453 CA ILE A 92 6.111 19.648 -17.303 1.00 54.54 C ATOM 1454 C ILE A 92 5.434 20.471 -16.212 1.00 41.22 C ATOM 1455 O ILE A 92 4.653 19.946 -15.418 1.00 61.44 O ATOM 1456 CB ILE A 92 5.038 18.852 -18.069 1.00 23.51 C ATOM 1457 CG1 ILE A 92 5.678 18.056 -19.208 1.00 45.11 C ATOM 1458 CG2 ILE A 92 3.966 19.788 -18.607 1.00 34.55 C ATOM 1459 CD1 ILE A 92 4.845 16.881 -19.668 1.00 64.41 C ATOM 0 H ILE A 92 6.778 17.870 -16.416 1.00 11.44 H new ATOM 0 HA ILE A 92 6.620 20.317 -17.997 1.00 54.54 H new ATOM 0 HB ILE A 92 4.567 18.150 -17.380 1.00 23.51 H new ATOM 0 HG12 ILE A 92 5.850 18.722 -20.054 1.00 45.11 H new ATOM 0 HG13 ILE A 92 6.654 17.694 -18.884 1.00 45.11 H new ATOM 0 HG21 ILE A 92 3.215 19.210 -19.146 1.00 34.55 H new ATOM 0 HG22 ILE A 92 3.493 20.314 -17.778 1.00 34.55 H new ATOM 0 HG23 ILE A 92 4.421 20.512 -19.283 1.00 34.55 H new ATOM 0 HD11 ILE A 92 5.361 16.364 -20.477 1.00 64.41 H new ATOM 0 HD12 ILE A 92 4.694 16.194 -18.836 1.00 64.41 H new ATOM 0 HD13 ILE A 92 3.878 17.237 -20.024 1.00 64.41 H new ATOM 1471 N ASP A 93 5.738 21.763 -16.179 1.00 3.25 N ATOM 1472 CA ASP A 93 5.158 22.660 -15.187 1.00 11.53 C ATOM 1473 C ASP A 93 3.634 22.601 -15.226 1.00 54.11 C ATOM 1474 O ASP A 93 3.028 22.651 -16.297 1.00 41.03 O ATOM 1475 CB ASP A 93 5.631 24.095 -15.425 1.00 23.34 C ATOM 1476 CG ASP A 93 7.064 24.313 -14.980 1.00 43.11 C ATOM 1477 OD1 ASP A 93 7.981 24.053 -15.787 1.00 12.04 O ATOM 1478 OD2 ASP A 93 7.269 24.744 -13.826 1.00 34.35 O ATOM 0 H ASP A 93 6.383 22.213 -16.828 1.00 3.25 H new ATOM 0 HA ASP A 93 5.492 22.335 -14.202 1.00 11.53 H new ATOM 0 HB2 ASP A 93 5.543 24.333 -16.485 1.00 23.34 H new ATOM 0 HB3 ASP A 93 4.978 24.783 -14.888 1.00 23.34 H new ATOM 1483 N VAL A 94 3.020 22.495 -14.053 1.00 31.53 N ATOM 1484 CA VAL A 94 1.566 22.429 -13.953 1.00 65.12 C ATOM 1485 C VAL A 94 1.071 23.104 -12.680 1.00 3.24 C ATOM 1486 O VAL A 94 1.577 22.843 -11.587 1.00 25.41 O ATOM 1487 CB VAL A 94 1.067 20.971 -13.975 1.00 3.51 C ATOM 1488 CG1 VAL A 94 1.413 20.309 -15.299 1.00 51.04 C ATOM 1489 CG2 VAL A 94 1.656 20.190 -12.809 1.00 20.11 C ATOM 0 H VAL A 94 3.506 22.453 -13.157 1.00 31.53 H new ATOM 0 HA VAL A 94 1.166 22.956 -14.819 1.00 65.12 H new ATOM 0 HB VAL A 94 -0.018 20.974 -13.870 1.00 3.51 H new ATOM 0 HG11 VAL A 94 1.053 19.280 -15.296 1.00 51.04 H new ATOM 0 HG12 VAL A 94 0.940 20.857 -16.114 1.00 51.04 H new ATOM 0 HG13 VAL A 94 2.494 20.315 -15.437 1.00 51.04 H new ATOM 0 HG21 VAL A 94 1.294 19.162 -12.839 1.00 20.11 H new ATOM 0 HG22 VAL A 94 2.744 20.193 -12.881 1.00 20.11 H new ATOM 0 HG23 VAL A 94 1.353 20.654 -11.870 1.00 20.11 H new ATOM 1499 N LYS A 95 0.079 23.975 -12.826 1.00 0.43 N ATOM 1500 CA LYS A 95 -0.488 24.690 -11.687 1.00 61.33 C ATOM 1501 C LYS A 95 -1.385 23.772 -10.862 1.00 2.22 C ATOM 1502 O LYS A 95 -1.773 24.110 -9.743 1.00 42.22 O ATOM 1503 CB LYS A 95 -1.284 25.904 -12.166 1.00 13.12 C ATOM 1504 CG LYS A 95 -1.505 26.951 -11.088 1.00 30.40 C ATOM 1505 CD LYS A 95 -2.748 27.782 -11.362 1.00 24.32 C ATOM 1506 CE LYS A 95 -2.714 29.100 -10.606 1.00 50.41 C ATOM 1507 NZ LYS A 95 -4.062 29.487 -10.104 1.00 61.42 N ATOM 0 H LYS A 95 -0.350 24.204 -13.723 1.00 0.43 H new ATOM 0 HA LYS A 95 0.334 25.029 -11.056 1.00 61.33 H new ATOM 0 HB2 LYS A 95 -0.761 26.363 -13.005 1.00 13.12 H new ATOM 0 HB3 LYS A 95 -2.252 25.569 -12.539 1.00 13.12 H new ATOM 0 HG2 LYS A 95 -1.600 26.462 -10.119 1.00 30.40 H new ATOM 0 HG3 LYS A 95 -0.635 27.605 -11.031 1.00 30.40 H new ATOM 0 HD2 LYS A 95 -2.828 27.977 -12.431 1.00 24.32 H new ATOM 0 HD3 LYS A 95 -3.635 27.218 -11.073 1.00 24.32 H new ATOM 0 HE2 LYS A 95 -2.023 29.019 -9.767 1.00 50.41 H new ATOM 0 HE3 LYS A 95 -2.331 29.884 -11.260 1.00 50.41 H new ATOM 0 HZ1 LYS A 95 -3.996 30.391 -9.594 1.00 61.42 H new ATOM 0 HZ2 LYS A 95 -4.715 29.589 -10.907 1.00 61.42 H new ATOM 0 HZ3 LYS A 95 -4.417 28.752 -9.460 1.00 61.42 H new ATOM 1521 N ASP A 96 -1.710 22.611 -11.420 1.00 4.32 N ATOM 1522 CA ASP A 96 -2.559 21.645 -10.734 1.00 22.31 C ATOM 1523 C ASP A 96 -2.836 20.437 -11.624 1.00 54.04 C ATOM 1524 O ASP A 96 -2.327 20.345 -12.742 1.00 43.00 O ATOM 1525 CB ASP A 96 -3.877 22.299 -10.315 1.00 63.31 C ATOM 1526 CG ASP A 96 -4.438 23.210 -11.388 1.00 40.12 C ATOM 1527 OD1 ASP A 96 -4.801 22.701 -12.470 1.00 21.31 O ATOM 1528 OD2 ASP A 96 -4.515 24.433 -11.147 1.00 71.21 O ATOM 0 H ASP A 96 -1.398 22.316 -12.345 1.00 4.32 H new ATOM 0 HA ASP A 96 -2.033 21.304 -9.843 1.00 22.31 H new ATOM 0 HB2 ASP A 96 -4.607 21.523 -10.083 1.00 63.31 H new ATOM 0 HB3 ASP A 96 -3.720 22.872 -9.401 1.00 63.31 H new ATOM 1533 N THR A 97 -3.647 19.512 -11.121 1.00 75.24 N ATOM 1534 CA THR A 97 -3.991 18.309 -11.870 1.00 34.11 C ATOM 1535 C THR A 97 -4.872 18.641 -13.069 1.00 21.20 C ATOM 1536 O THR A 97 -5.123 17.789 -13.922 1.00 54.11 O ATOM 1537 CB THR A 97 -4.720 17.283 -10.980 1.00 52.02 C ATOM 1538 OG1 THR A 97 -4.041 17.153 -9.727 1.00 23.31 O ATOM 1539 CG2 THR A 97 -4.794 15.928 -11.668 1.00 31.22 C ATOM 0 H THR A 97 -4.078 19.572 -10.198 1.00 75.24 H new ATOM 0 HA THR A 97 -3.054 17.875 -12.220 1.00 34.11 H new ATOM 0 HB THR A 97 -5.735 17.640 -10.806 1.00 52.02 H new ATOM 0 HG1 THR A 97 -3.791 16.216 -9.586 1.00 23.31 H new ATOM 0 HG21 THR A 97 -5.312 15.220 -11.022 1.00 31.22 H new ATOM 0 HG22 THR A 97 -5.337 16.026 -12.608 1.00 31.22 H new ATOM 0 HG23 THR A 97 -3.786 15.566 -11.868 1.00 31.22 H new ATOM 1547 N LYS A 98 -5.338 19.883 -13.130 1.00 35.23 N ATOM 1548 CA LYS A 98 -6.189 20.329 -14.226 1.00 13.11 C ATOM 1549 C LYS A 98 -5.351 20.770 -15.422 1.00 4.45 C ATOM 1550 O LYS A 98 -5.597 20.352 -16.552 1.00 14.23 O ATOM 1551 CB LYS A 98 -7.087 21.480 -13.767 1.00 41.23 C ATOM 1552 CG LYS A 98 -8.432 21.522 -14.471 1.00 72.51 C ATOM 1553 CD LYS A 98 -9.426 20.569 -13.830 1.00 73.43 C ATOM 1554 CE LYS A 98 -10.071 19.657 -14.865 1.00 1.14 C ATOM 1555 NZ LYS A 98 -11.318 20.248 -15.424 1.00 40.44 N ATOM 0 H LYS A 98 -5.140 20.600 -12.432 1.00 35.23 H new ATOM 0 HA LYS A 98 -6.813 19.489 -14.532 1.00 13.11 H new ATOM 0 HB2 LYS A 98 -7.251 21.395 -12.693 1.00 41.23 H new ATOM 0 HB3 LYS A 98 -6.568 22.424 -13.936 1.00 41.23 H new ATOM 0 HG2 LYS A 98 -8.828 22.537 -14.441 1.00 72.51 H new ATOM 0 HG3 LYS A 98 -8.302 21.262 -15.521 1.00 72.51 H new ATOM 0 HD2 LYS A 98 -8.919 19.965 -13.077 1.00 73.43 H new ATOM 0 HD3 LYS A 98 -10.198 21.140 -13.314 1.00 73.43 H new ATOM 0 HE2 LYS A 98 -9.365 19.468 -15.673 1.00 1.14 H new ATOM 0 HE3 LYS A 98 -10.298 18.694 -14.409 1.00 1.14 H new ATOM 0 HZ1 LYS A 98 -11.727 19.597 -16.125 1.00 40.44 H new ATOM 0 HZ2 LYS A 98 -12.002 20.405 -14.657 1.00 40.44 H new ATOM 0 HZ3 LYS A 98 -11.097 21.155 -15.882 1.00 40.44 H new ATOM 1569 N GLU A 99 -4.358 21.616 -15.163 1.00 70.20 N ATOM 1570 CA GLU A 99 -3.482 22.111 -16.219 1.00 15.04 C ATOM 1571 C GLU A 99 -2.509 21.028 -16.671 1.00 45.33 C ATOM 1572 O GLU A 99 -1.874 21.147 -17.719 1.00 53.20 O ATOM 1573 CB GLU A 99 -2.708 23.339 -15.735 1.00 71.11 C ATOM 1574 CG GLU A 99 -2.403 24.340 -16.837 1.00 75.51 C ATOM 1575 CD GLU A 99 -3.433 25.449 -16.918 1.00 41.33 C ATOM 1576 OE1 GLU A 99 -3.638 26.144 -15.901 1.00 45.41 O ATOM 1577 OE2 GLU A 99 -4.035 25.624 -17.999 1.00 64.02 O ATOM 0 H GLU A 99 -4.140 21.972 -14.232 1.00 70.20 H new ATOM 0 HA GLU A 99 -4.103 22.394 -17.069 1.00 15.04 H new ATOM 0 HB2 GLU A 99 -3.283 23.836 -14.954 1.00 71.11 H new ATOM 0 HB3 GLU A 99 -1.771 23.013 -15.283 1.00 71.11 H new ATOM 0 HG2 GLU A 99 -1.419 24.775 -16.665 1.00 75.51 H new ATOM 0 HG3 GLU A 99 -2.359 23.819 -17.794 1.00 75.51 H new ATOM 1584 N ALA A 100 -2.395 19.972 -15.874 1.00 31.41 N ATOM 1585 CA ALA A 100 -1.500 18.866 -16.192 1.00 70.23 C ATOM 1586 C ALA A 100 -2.143 17.909 -17.192 1.00 2.31 C ATOM 1587 O ALA A 100 -1.452 17.261 -17.978 1.00 70.11 O ATOM 1588 CB ALA A 100 -1.108 18.122 -14.924 1.00 71.52 C ATOM 0 H ALA A 100 -2.912 19.858 -15.002 1.00 31.41 H new ATOM 0 HA ALA A 100 -0.601 19.279 -16.650 1.00 70.23 H new ATOM 0 HB1 ALA A 100 -0.440 17.299 -15.177 1.00 71.52 H new ATOM 0 HB2 ALA A 100 -0.600 18.805 -14.243 1.00 71.52 H new ATOM 0 HB3 ALA A 100 -2.003 17.728 -14.442 1.00 71.52 H new ATOM 1594 N LEU A 101 -3.468 17.826 -17.156 1.00 3.24 N ATOM 1595 CA LEU A 101 -4.204 16.949 -18.058 1.00 34.54 C ATOM 1596 C LEU A 101 -4.376 17.596 -19.429 1.00 13.45 C ATOM 1597 O LEU A 101 -4.448 16.908 -20.446 1.00 52.25 O ATOM 1598 CB LEU A 101 -5.574 16.609 -17.466 1.00 2.22 C ATOM 1599 CG LEU A 101 -5.584 15.559 -16.355 1.00 23.02 C ATOM 1600 CD1 LEU A 101 -6.706 15.838 -15.367 1.00 73.21 C ATOM 1601 CD2 LEU A 101 -5.722 14.162 -16.941 1.00 43.55 C ATOM 0 H LEU A 101 -4.055 18.356 -16.511 1.00 3.24 H new ATOM 0 HA LEU A 101 -3.630 16.031 -18.180 1.00 34.54 H new ATOM 0 HB2 LEU A 101 -6.016 17.526 -17.076 1.00 2.22 H new ATOM 0 HB3 LEU A 101 -6.220 16.262 -18.272 1.00 2.22 H new ATOM 0 HG LEU A 101 -4.635 15.614 -15.821 1.00 23.02 H new ATOM 0 HD11 LEU A 101 -6.698 15.080 -14.583 1.00 73.21 H new ATOM 0 HD12 LEU A 101 -6.562 16.822 -14.922 1.00 73.21 H new ATOM 0 HD13 LEU A 101 -7.664 15.811 -15.887 1.00 73.21 H new ATOM 0 HD21 LEU A 101 -5.727 13.428 -16.135 1.00 43.55 H new ATOM 0 HD22 LEU A 101 -6.655 14.093 -17.501 1.00 43.55 H new ATOM 0 HD23 LEU A 101 -4.883 13.963 -17.608 1.00 43.55 H new ATOM 1613 N ASP A 102 -4.439 18.923 -19.446 1.00 20.14 N ATOM 1614 CA ASP A 102 -4.599 19.664 -20.691 1.00 51.43 C ATOM 1615 C ASP A 102 -3.345 19.554 -21.554 1.00 2.41 C ATOM 1616 O ASP A 102 -3.428 19.353 -22.765 1.00 41.12 O ATOM 1617 CB ASP A 102 -4.905 21.134 -20.400 1.00 13.12 C ATOM 1618 CG ASP A 102 -6.324 21.343 -19.911 1.00 55.34 C ATOM 1619 OD1 ASP A 102 -7.258 20.827 -20.561 1.00 31.03 O ATOM 1620 OD2 ASP A 102 -6.503 22.024 -18.880 1.00 53.31 O ATOM 0 H ASP A 102 -4.382 19.507 -18.612 1.00 20.14 H new ATOM 0 HA ASP A 102 -5.435 19.229 -21.239 1.00 51.43 H new ATOM 0 HB2 ASP A 102 -4.207 21.506 -19.650 1.00 13.12 H new ATOM 0 HB3 ASP A 102 -4.745 21.721 -21.304 1.00 13.12 H new ATOM 1625 N LYS A 103 -2.184 19.689 -20.921 1.00 35.40 N ATOM 1626 CA LYS A 103 -0.913 19.605 -21.629 1.00 61.30 C ATOM 1627 C LYS A 103 -0.729 18.227 -22.257 1.00 74.33 C ATOM 1628 O LYS A 103 0.052 18.060 -23.193 1.00 44.22 O ATOM 1629 CB LYS A 103 0.246 19.900 -20.674 1.00 24.42 C ATOM 1630 CG LYS A 103 0.508 21.382 -20.474 1.00 51.04 C ATOM 1631 CD LYS A 103 1.215 21.990 -21.674 1.00 24.31 C ATOM 1632 CE LYS A 103 0.531 23.267 -22.136 1.00 71.44 C ATOM 1633 NZ LYS A 103 0.854 23.587 -23.554 1.00 53.13 N ATOM 0 H LYS A 103 -2.098 19.857 -19.919 1.00 35.40 H new ATOM 0 HA LYS A 103 -0.920 20.350 -22.425 1.00 61.30 H new ATOM 0 HB2 LYS A 103 0.034 19.444 -19.707 1.00 24.42 H new ATOM 0 HB3 LYS A 103 1.151 19.428 -21.058 1.00 24.42 H new ATOM 0 HG2 LYS A 103 -0.436 21.900 -20.306 1.00 51.04 H new ATOM 0 HG3 LYS A 103 1.115 21.528 -19.580 1.00 51.04 H new ATOM 0 HD2 LYS A 103 2.252 22.204 -21.416 1.00 24.31 H new ATOM 0 HD3 LYS A 103 1.232 21.269 -22.491 1.00 24.31 H new ATOM 0 HE2 LYS A 103 -0.548 23.162 -22.024 1.00 71.44 H new ATOM 0 HE3 LYS A 103 0.839 24.095 -21.498 1.00 71.44 H new ATOM 0 HZ1 LYS A 103 0.369 24.464 -23.831 1.00 53.13 H new ATOM 0 HZ2 LYS A 103 1.881 23.712 -23.656 1.00 53.13 H new ATOM 0 HZ3 LYS A 103 0.538 22.808 -24.166 1.00 53.13 H new ATOM 1647 N ILE A 104 -1.457 17.243 -21.737 1.00 61.11 N ATOM 1648 CA ILE A 104 -1.375 15.882 -22.250 1.00 32.40 C ATOM 1649 C ILE A 104 -2.464 15.617 -23.285 1.00 1.21 C ATOM 1650 O ILE A 104 -2.343 14.712 -24.109 1.00 21.03 O ATOM 1651 CB ILE A 104 -1.498 14.845 -21.117 1.00 41.51 C ATOM 1652 CG1 ILE A 104 -0.417 15.082 -20.060 1.00 43.12 C ATOM 1653 CG2 ILE A 104 -1.399 13.433 -21.677 1.00 3.55 C ATOM 1654 CD1 ILE A 104 -0.580 14.222 -18.826 1.00 51.14 C ATOM 0 H ILE A 104 -2.109 17.364 -20.962 1.00 61.11 H new ATOM 0 HA ILE A 104 -0.397 15.781 -22.721 1.00 32.40 H new ATOM 0 HB ILE A 104 -2.473 14.959 -20.644 1.00 41.51 H new ATOM 0 HG12 ILE A 104 0.560 14.888 -20.502 1.00 43.12 H new ATOM 0 HG13 ILE A 104 -0.431 16.132 -19.766 1.00 43.12 H new ATOM 0 HG21 ILE A 104 -1.488 12.712 -20.864 1.00 3.55 H new ATOM 0 HG22 ILE A 104 -2.202 13.270 -22.396 1.00 3.55 H new ATOM 0 HG23 ILE A 104 -0.437 13.305 -22.172 1.00 3.55 H new ATOM 0 HD11 ILE A 104 0.221 14.443 -18.120 1.00 51.14 H new ATOM 0 HD12 ILE A 104 -1.543 14.433 -18.360 1.00 51.14 H new ATOM 0 HD13 ILE A 104 -0.535 13.170 -19.107 1.00 51.14 H new ATOM 1666 N GLU A 105 -3.526 16.417 -23.236 1.00 63.14 N ATOM 1667 CA GLU A 105 -4.635 16.270 -24.171 1.00 63.34 C ATOM 1668 C GLU A 105 -4.314 16.937 -25.505 1.00 14.32 C ATOM 1669 O GLU A 105 -4.647 16.413 -26.567 1.00 54.44 O ATOM 1670 CB GLU A 105 -5.911 16.871 -23.580 1.00 55.40 C ATOM 1671 CG GLU A 105 -6.807 15.851 -22.899 1.00 32.12 C ATOM 1672 CD GLU A 105 -7.528 16.420 -21.692 1.00 44.22 C ATOM 1673 OE1 GLU A 105 -7.774 17.645 -21.672 1.00 70.42 O ATOM 1674 OE2 GLU A 105 -7.844 15.643 -20.768 1.00 22.31 O ATOM 0 H GLU A 105 -3.641 17.172 -22.560 1.00 63.14 H new ATOM 0 HA GLU A 105 -4.791 15.206 -24.346 1.00 63.34 H new ATOM 0 HB2 GLU A 105 -5.639 17.642 -22.859 1.00 55.40 H new ATOM 0 HB3 GLU A 105 -6.473 17.362 -24.375 1.00 55.40 H new ATOM 0 HG2 GLU A 105 -7.541 15.482 -23.615 1.00 32.12 H new ATOM 0 HG3 GLU A 105 -6.207 14.996 -22.589 1.00 32.12 H new ATOM 1681 N GLU A 106 -3.667 18.096 -25.440 1.00 22.15 N ATOM 1682 CA GLU A 106 -3.303 18.836 -26.643 1.00 21.13 C ATOM 1683 C GLU A 106 -2.363 18.016 -27.522 1.00 22.14 C ATOM 1684 O GLU A 106 -2.433 18.078 -28.749 1.00 41.24 O ATOM 1685 CB GLU A 106 -2.641 20.165 -26.271 1.00 35.13 C ATOM 1686 CG GLU A 106 -3.458 21.383 -26.666 1.00 41.42 C ATOM 1687 CD GLU A 106 -4.580 21.676 -25.689 1.00 72.14 C ATOM 1688 OE1 GLU A 106 -5.231 20.714 -25.229 1.00 51.32 O ATOM 1689 OE2 GLU A 106 -4.807 22.865 -25.385 1.00 21.10 O ATOM 0 H GLU A 106 -3.384 18.543 -24.568 1.00 22.15 H new ATOM 0 HA GLU A 106 -4.215 19.037 -27.205 1.00 21.13 H new ATOM 0 HB2 GLU A 106 -2.469 20.187 -25.195 1.00 35.13 H new ATOM 0 HB3 GLU A 106 -1.664 20.222 -26.751 1.00 35.13 H new ATOM 0 HG2 GLU A 106 -2.801 22.251 -26.730 1.00 41.42 H new ATOM 0 HG3 GLU A 106 -3.878 21.227 -27.660 1.00 41.42 H new ATOM 1696 N GLU A 107 -1.484 17.250 -26.885 1.00 24.51 N ATOM 1697 CA GLU A 107 -0.529 16.418 -27.609 1.00 73.02 C ATOM 1698 C GLU A 107 -1.250 15.366 -28.447 1.00 31.31 C ATOM 1699 O GLU A 107 -0.773 14.973 -29.511 1.00 23.33 O ATOM 1700 CB GLU A 107 0.432 15.738 -26.633 1.00 61.51 C ATOM 1701 CG GLU A 107 1.870 16.213 -26.763 1.00 31.10 C ATOM 1702 CD GLU A 107 2.799 15.128 -27.270 1.00 64.04 C ATOM 1703 OE1 GLU A 107 2.545 14.596 -28.371 1.00 22.53 O ATOM 1704 OE2 GLU A 107 3.781 14.812 -26.566 1.00 11.12 O ATOM 0 H GLU A 107 -1.413 17.188 -25.869 1.00 24.51 H new ATOM 0 HA GLU A 107 0.041 17.062 -28.278 1.00 73.02 H new ATOM 0 HB2 GLU A 107 0.089 15.918 -25.614 1.00 61.51 H new ATOM 0 HB3 GLU A 107 0.398 14.661 -26.794 1.00 61.51 H new ATOM 0 HG2 GLU A 107 1.907 17.065 -27.442 1.00 31.10 H new ATOM 0 HG3 GLU A 107 2.222 16.563 -25.793 1.00 31.10 H new ATOM 1711 N GLN A 108 -2.401 14.914 -27.957 1.00 43.44 N ATOM 1712 CA GLN A 108 -3.186 13.907 -28.660 1.00 41.43 C ATOM 1713 C GLN A 108 -4.097 14.554 -29.697 1.00 74.13 C ATOM 1714 O GLN A 108 -4.415 13.951 -30.721 1.00 73.33 O ATOM 1715 CB GLN A 108 -4.019 13.096 -27.667 1.00 20.21 C ATOM 1716 CG GLN A 108 -3.690 11.612 -27.667 1.00 24.13 C ATOM 1717 CD GLN A 108 -4.581 10.816 -28.599 1.00 35.31 C ATOM 1718 OE1 GLN A 108 -5.808 10.865 -28.496 1.00 62.10 O ATOM 1719 NE2 GLN A 108 -3.970 10.076 -29.516 1.00 25.14 N ATOM 0 H GLN A 108 -2.809 15.229 -27.077 1.00 43.44 H new ATOM 0 HA GLN A 108 -2.496 13.239 -29.176 1.00 41.43 H new ATOM 0 HB2 GLN A 108 -3.863 13.494 -26.664 1.00 20.21 H new ATOM 0 HB3 GLN A 108 -5.076 13.225 -27.901 1.00 20.21 H new ATOM 0 HG2 GLN A 108 -2.649 11.475 -27.960 1.00 24.13 H new ATOM 0 HG3 GLN A 108 -3.790 11.222 -26.654 1.00 24.13 H new ATOM 0 HE21 GLN A 108 -2.951 10.065 -29.566 1.00 25.14 H new ATOM 0 HE22 GLN A 108 -4.519 9.519 -30.171 1.00 25.14 H new ATOM 1728 N ASN A 109 -4.516 15.786 -29.424 1.00 42.33 N ATOM 1729 CA ASN A 109 -5.393 16.514 -30.334 1.00 52.14 C ATOM 1730 C ASN A 109 -4.630 16.973 -31.575 1.00 34.34 C ATOM 1731 O ASN A 109 -5.183 17.021 -32.673 1.00 41.24 O ATOM 1732 CB ASN A 109 -6.008 17.723 -29.625 1.00 60.31 C ATOM 1733 CG ASN A 109 -7.246 17.356 -28.829 1.00 13.50 C ATOM 1734 OD1 ASN A 109 -7.317 17.599 -27.624 1.00 12.12 O ATOM 1735 ND2 ASN A 109 -8.230 16.770 -29.501 1.00 44.51 N ATOM 0 H ASN A 109 -4.262 16.300 -28.581 1.00 42.33 H new ATOM 0 HA ASN A 109 -6.190 15.840 -30.647 1.00 52.14 H new ATOM 0 HB2 ASN A 109 -5.268 18.165 -28.958 1.00 60.31 H new ATOM 0 HB3 ASN A 109 -6.266 18.482 -30.364 1.00 60.31 H new ATOM 0 HD21 ASN A 109 -9.088 16.502 -29.019 1.00 44.51 H new ATOM 0 HD22 ASN A 109 -8.128 16.588 -30.499 1.00 44.51 H new ATOM 1742 N LYS A 110 -3.358 17.306 -31.390 1.00 1.03 N ATOM 1743 CA LYS A 110 -2.518 17.759 -32.492 1.00 22.52 C ATOM 1744 C LYS A 110 -2.465 16.712 -33.600 1.00 50.25 C ATOM 1745 O LYS A 110 -2.249 17.042 -34.767 1.00 72.53 O ATOM 1746 CB LYS A 110 -1.103 18.059 -31.992 1.00 1.31 C ATOM 1747 CG LYS A 110 -0.949 19.449 -31.398 1.00 71.12 C ATOM 1748 CD LYS A 110 0.321 20.126 -31.885 1.00 42.10 C ATOM 1749 CE LYS A 110 0.616 21.391 -31.095 1.00 14.43 C ATOM 1750 NZ LYS A 110 -0.313 22.499 -31.454 1.00 43.24 N ATOM 0 H LYS A 110 -2.886 17.271 -30.487 1.00 1.03 H new ATOM 0 HA LYS A 110 -2.954 18.672 -32.898 1.00 22.52 H new ATOM 0 HB2 LYS A 110 -0.828 17.319 -31.240 1.00 1.31 H new ATOM 0 HB3 LYS A 110 -0.403 17.947 -32.820 1.00 1.31 H new ATOM 0 HG2 LYS A 110 -1.813 20.058 -31.666 1.00 71.12 H new ATOM 0 HG3 LYS A 110 -0.932 19.381 -30.310 1.00 71.12 H new ATOM 0 HD2 LYS A 110 1.160 19.436 -31.795 1.00 42.10 H new ATOM 0 HD3 LYS A 110 0.221 20.371 -32.942 1.00 42.10 H new ATOM 0 HE2 LYS A 110 0.535 21.180 -30.029 1.00 14.43 H new ATOM 0 HE3 LYS A 110 1.643 21.704 -31.281 1.00 14.43 H new ATOM 0 HZ1 LYS A 110 -0.079 23.343 -30.894 1.00 43.24 H new ATOM 0 HZ2 LYS A 110 -0.218 22.718 -32.466 1.00 43.24 H new ATOM 0 HZ3 LYS A 110 -1.292 22.210 -31.253 1.00 43.24 H new ATOM 1764 N SER A 111 -2.665 15.452 -33.229 1.00 2.24 N ATOM 1765 CA SER A 111 -2.638 14.358 -34.192 1.00 42.14 C ATOM 1766 C SER A 111 -3.914 14.337 -35.027 1.00 50.22 C ATOM 1767 O SER A 111 -3.906 13.916 -36.185 1.00 32.44 O ATOM 1768 CB SER A 111 -2.465 13.020 -33.470 1.00 60.13 C ATOM 1769 OG SER A 111 -1.207 12.439 -33.767 1.00 21.24 O ATOM 0 H SER A 111 -2.848 15.163 -32.268 1.00 2.24 H new ATOM 0 HA SER A 111 -1.791 14.515 -34.860 1.00 42.14 H new ATOM 0 HB2 SER A 111 -2.555 13.170 -32.394 1.00 60.13 H new ATOM 0 HB3 SER A 111 -3.263 12.338 -33.765 1.00 60.13 H new ATOM 0 HG SER A 111 -1.120 11.586 -33.292 1.00 21.24 H new ATOM 1775 N LYS A 112 -5.010 14.796 -34.433 1.00 4.31 N ATOM 1776 CA LYS A 112 -6.295 14.833 -35.120 1.00 21.45 C ATOM 1777 C LYS A 112 -6.460 16.135 -35.897 1.00 64.43 C ATOM 1778 O LYS A 112 -7.076 16.161 -36.963 1.00 63.53 O ATOM 1779 CB LYS A 112 -7.438 14.680 -34.114 1.00 75.33 C ATOM 1780 CG LYS A 112 -8.102 13.314 -34.151 1.00 54.55 C ATOM 1781 CD LYS A 112 -9.349 13.323 -35.020 1.00 52.24 C ATOM 1782 CE LYS A 112 -10.593 13.643 -34.207 1.00 3.40 C ATOM 1783 NZ LYS A 112 -11.747 14.004 -35.076 1.00 21.21 N ATOM 0 H LYS A 112 -5.034 15.148 -33.476 1.00 4.31 H new ATOM 0 HA LYS A 112 -6.325 14.003 -35.826 1.00 21.45 H new ATOM 0 HB2 LYS A 112 -7.054 14.861 -33.110 1.00 75.33 H new ATOM 0 HB3 LYS A 112 -8.189 15.445 -34.311 1.00 75.33 H new ATOM 0 HG2 LYS A 112 -7.397 12.576 -34.533 1.00 54.55 H new ATOM 0 HG3 LYS A 112 -8.365 13.009 -33.138 1.00 54.55 H new ATOM 0 HD2 LYS A 112 -9.234 14.059 -35.816 1.00 52.24 H new ATOM 0 HD3 LYS A 112 -9.467 12.351 -35.499 1.00 52.24 H new ATOM 0 HE2 LYS A 112 -10.857 12.782 -33.593 1.00 3.40 H new ATOM 0 HE3 LYS A 112 -10.380 14.467 -33.526 1.00 3.40 H new ATOM 0 HZ1 LYS A 112 -12.575 14.215 -34.483 1.00 21.21 H new ATOM 0 HZ2 LYS A 112 -11.505 14.841 -35.644 1.00 21.21 H new ATOM 0 HZ3 LYS A 112 -11.968 13.208 -35.708 1.00 21.21 H new ATOM 1797 N LYS A 113 -5.902 17.214 -35.360 1.00 10.44 N ATOM 1798 CA LYS A 113 -5.984 18.520 -36.004 1.00 63.31 C ATOM 1799 C LYS A 113 -5.073 18.582 -37.225 1.00 3.01 C ATOM 1800 O LYS A 113 -5.326 19.337 -38.164 1.00 62.42 O ATOM 1801 CB LYS A 113 -5.605 19.624 -35.014 1.00 42.14 C ATOM 1802 CG LYS A 113 -6.541 20.820 -35.050 1.00 43.00 C ATOM 1803 CD LYS A 113 -5.782 22.115 -35.291 1.00 31.23 C ATOM 1804 CE LYS A 113 -6.730 23.293 -35.463 1.00 24.24 C ATOM 1805 NZ LYS A 113 -7.419 23.261 -36.783 1.00 23.14 N ATOM 0 H LYS A 113 -5.387 17.210 -34.479 1.00 10.44 H new ATOM 0 HA LYS A 113 -7.012 18.672 -36.332 1.00 63.31 H new ATOM 0 HB2 LYS A 113 -5.597 19.210 -34.006 1.00 42.14 H new ATOM 0 HB3 LYS A 113 -4.591 19.960 -35.228 1.00 42.14 H new ATOM 0 HG2 LYS A 113 -7.282 20.680 -35.837 1.00 43.00 H new ATOM 0 HG3 LYS A 113 -7.085 20.886 -34.108 1.00 43.00 H new ATOM 0 HD2 LYS A 113 -5.111 22.306 -34.454 1.00 31.23 H new ATOM 0 HD3 LYS A 113 -5.161 22.014 -36.181 1.00 31.23 H new ATOM 0 HE2 LYS A 113 -7.473 23.281 -34.665 1.00 24.24 H new ATOM 0 HE3 LYS A 113 -6.173 24.225 -35.366 1.00 24.24 H new ATOM 0 HZ1 LYS A 113 -7.950 24.145 -36.919 1.00 23.14 H new ATOM 0 HZ2 LYS A 113 -6.713 23.161 -37.541 1.00 23.14 H new ATOM 0 HZ3 LYS A 113 -8.075 22.455 -36.813 1.00 23.14 H new ATOM 1819 N LYS A 114 -4.012 17.782 -37.207 1.00 5.41 N ATOM 1820 CA LYS A 114 -3.063 17.744 -38.313 1.00 42.54 C ATOM 1821 C LYS A 114 -3.670 17.047 -39.527 1.00 32.53 C ATOM 1822 O LYS A 114 -3.331 17.358 -40.667 1.00 62.24 O ATOM 1823 CB LYS A 114 -1.780 17.026 -37.888 1.00 30.32 C ATOM 1824 CG LYS A 114 -0.768 17.935 -37.214 1.00 40.14 C ATOM 1825 CD LYS A 114 0.329 18.358 -38.176 1.00 60.04 C ATOM 1826 CE LYS A 114 1.545 18.891 -37.435 1.00 64.11 C ATOM 1827 NZ LYS A 114 2.819 18.456 -38.072 1.00 33.54 N ATOM 0 H LYS A 114 -3.788 17.151 -36.438 1.00 5.41 H new ATOM 0 HA LYS A 114 -2.823 18.771 -38.588 1.00 42.54 H new ATOM 0 HB2 LYS A 114 -2.037 16.214 -37.207 1.00 30.32 H new ATOM 0 HB3 LYS A 114 -1.320 16.572 -38.766 1.00 30.32 H new ATOM 0 HG2 LYS A 114 -1.274 18.819 -36.826 1.00 40.14 H new ATOM 0 HG3 LYS A 114 -0.326 17.420 -36.361 1.00 40.14 H new ATOM 0 HD2 LYS A 114 0.621 17.508 -38.793 1.00 60.04 H new ATOM 0 HD3 LYS A 114 -0.053 19.125 -38.850 1.00 60.04 H new ATOM 0 HE2 LYS A 114 1.506 19.980 -37.409 1.00 64.11 H new ATOM 0 HE3 LYS A 114 1.520 18.546 -36.401 1.00 64.11 H new ATOM 0 HZ1 LYS A 114 3.624 18.840 -37.537 1.00 33.54 H new ATOM 0 HZ2 LYS A 114 2.869 17.417 -38.074 1.00 33.54 H new ATOM 0 HZ3 LYS A 114 2.855 18.806 -39.051 1.00 33.54 H new ATOM 1841 N ALA A 115 -4.571 16.103 -39.271 1.00 44.20 N ATOM 1842 CA ALA A 115 -5.228 15.365 -40.343 1.00 41.32 C ATOM 1843 C ALA A 115 -5.969 16.308 -41.285 1.00 31.11 C ATOM 1844 O ALA A 115 -6.125 16.018 -42.471 1.00 24.53 O ATOM 1845 CB ALA A 115 -6.186 14.334 -39.763 1.00 40.45 C ATOM 0 H ALA A 115 -4.862 15.832 -38.332 1.00 44.20 H new ATOM 0 HA ALA A 115 -4.460 14.848 -40.919 1.00 41.32 H new ATOM 0 HB1 ALA A 115 -6.670 13.790 -40.574 1.00 40.45 H new ATOM 0 HB2 ALA A 115 -5.632 13.635 -39.137 1.00 40.45 H new ATOM 0 HB3 ALA A 115 -6.943 14.838 -39.162 1.00 40.45 H new ATOM 1851 N GLN A 116 -6.424 17.436 -40.749 1.00 71.22 N ATOM 1852 CA GLN A 116 -7.150 18.420 -41.544 1.00 21.44 C ATOM 1853 C GLN A 116 -6.638 19.829 -41.265 1.00 4.04 C ATOM 1854 O GLN A 116 -7.419 20.744 -41.011 1.00 14.21 O ATOM 1855 CB GLN A 116 -8.648 18.341 -41.246 1.00 50.30 C ATOM 1856 CG GLN A 116 -9.299 17.057 -41.735 1.00 14.23 C ATOM 1857 CD GLN A 116 -10.811 17.090 -41.622 1.00 33.53 C ATOM 1858 OE1 GLN A 116 -11.371 16.836 -40.554 1.00 62.54 O ATOM 1859 NE2 GLN A 116 -11.481 17.403 -42.724 1.00 32.33 N ATOM 0 H GLN A 116 -6.303 17.691 -39.769 1.00 71.22 H new ATOM 0 HA GLN A 116 -6.983 18.194 -42.597 1.00 21.44 H new ATOM 0 HB2 GLN A 116 -8.801 18.429 -40.170 1.00 50.30 H new ATOM 0 HB3 GLN A 116 -9.148 19.191 -41.710 1.00 50.30 H new ATOM 0 HG2 GLN A 116 -9.020 16.885 -42.775 1.00 14.23 H new ATOM 0 HG3 GLN A 116 -8.914 16.216 -41.158 1.00 14.23 H new ATOM 0 HE21 GLN A 116 -10.977 17.606 -43.587 1.00 32.33 H new ATOM 0 HE22 GLN A 116 -12.500 17.440 -42.708 1.00 32.33 H new ATOM 1868 N GLN A 117 -5.320 19.994 -41.315 1.00 51.34 N ATOM 1869 CA GLN A 117 -4.703 21.292 -41.067 1.00 54.12 C ATOM 1870 C GLN A 117 -4.944 22.241 -42.236 1.00 73.12 C ATOM 1871 O GLN A 117 -4.983 23.459 -42.062 1.00 74.35 O ATOM 1872 CB GLN A 117 -3.201 21.130 -40.827 1.00 72.15 C ATOM 1873 CG GLN A 117 -2.502 22.426 -40.446 1.00 75.25 C ATOM 1874 CD GLN A 117 -1.051 22.215 -40.061 1.00 74.23 C ATOM 1875 OE1 GLN A 117 -0.680 22.353 -38.896 1.00 75.01 O ATOM 1876 NE2 GLN A 117 -0.222 21.877 -41.042 1.00 62.42 N ATOM 0 H GLN A 117 -4.659 19.246 -41.525 1.00 51.34 H new ATOM 0 HA GLN A 117 -5.161 21.719 -40.175 1.00 54.12 H new ATOM 0 HB2 GLN A 117 -3.045 20.397 -40.036 1.00 72.15 H new ATOM 0 HB3 GLN A 117 -2.739 20.729 -41.729 1.00 72.15 H new ATOM 0 HG2 GLN A 117 -2.554 23.122 -41.283 1.00 75.25 H new ATOM 0 HG3 GLN A 117 -3.031 22.889 -39.613 1.00 75.25 H new ATOM 0 HE21 GLN A 117 -0.574 21.774 -41.994 1.00 62.42 H new ATOM 0 HE22 GLN A 117 0.766 21.721 -40.843 1.00 62.42 H new ATOM 1885 N ALA A 118 -5.104 21.675 -43.429 1.00 14.23 N ATOM 1886 CA ALA A 118 -5.342 22.471 -44.626 1.00 51.42 C ATOM 1887 C ALA A 118 -6.782 22.970 -44.676 1.00 5.54 C ATOM 1888 O ALA A 118 -7.044 24.096 -45.101 1.00 31.34 O ATOM 1889 CB ALA A 118 -5.020 21.659 -45.872 1.00 60.23 C ATOM 0 H ALA A 118 -5.073 20.668 -43.591 1.00 14.23 H new ATOM 0 HA ALA A 118 -4.685 23.340 -44.591 1.00 51.42 H new ATOM 0 HB1 ALA A 118 -5.202 22.266 -46.759 1.00 60.23 H new ATOM 0 HB2 ALA A 118 -3.973 21.356 -45.848 1.00 60.23 H new ATOM 0 HB3 ALA A 118 -5.654 20.773 -45.902 1.00 60.23 H new ATOM 1895 N ALA A 119 -7.711 22.128 -44.239 1.00 73.42 N ATOM 1896 CA ALA A 119 -9.125 22.485 -44.233 1.00 24.05 C ATOM 1897 C ALA A 119 -9.418 23.547 -43.178 1.00 71.23 C ATOM 1898 O ALA A 119 -10.380 24.305 -43.299 1.00 24.25 O ATOM 1899 CB ALA A 119 -9.980 21.250 -43.993 1.00 75.34 C ATOM 0 H ALA A 119 -7.511 21.193 -43.884 1.00 73.42 H new ATOM 0 HA ALA A 119 -9.374 22.901 -45.209 1.00 24.05 H new ATOM 0 HB1 ALA A 119 -11.033 21.531 -43.991 1.00 75.34 H new ATOM 0 HB2 ALA A 119 -9.800 20.523 -44.785 1.00 75.34 H new ATOM 0 HB3 ALA A 119 -9.720 20.809 -43.030 1.00 75.34 H new ATOM 1905 N ALA A 120 -8.584 23.594 -42.145 1.00 64.15 N ATOM 1906 CA ALA A 120 -8.753 24.564 -41.070 1.00 45.20 C ATOM 1907 C ALA A 120 -8.015 25.862 -41.381 1.00 31.22 C ATOM 1908 O ALA A 120 -7.241 25.935 -42.335 1.00 71.35 O ATOM 1909 CB ALA A 120 -8.266 23.981 -39.752 1.00 73.53 C ATOM 0 H ALA A 120 -7.784 22.972 -42.030 1.00 64.15 H new ATOM 0 HA ALA A 120 -9.815 24.792 -40.983 1.00 45.20 H new ATOM 0 HB1 ALA A 120 -8.398 24.716 -38.958 1.00 73.53 H new ATOM 0 HB2 ALA A 120 -8.840 23.085 -39.516 1.00 73.53 H new ATOM 0 HB3 ALA A 120 -7.210 23.724 -39.836 1.00 73.53 H new ATOM 1915 N ASP A 121 -8.261 26.885 -40.570 1.00 32.43 N ATOM 1916 CA ASP A 121 -7.620 28.181 -40.758 1.00 74.21 C ATOM 1917 C ASP A 121 -8.141 28.867 -42.018 1.00 44.30 C ATOM 1918 O ASP A 121 -8.942 29.800 -41.945 1.00 51.01 O ATOM 1919 CB ASP A 121 -6.102 28.016 -40.844 1.00 31.14 C ATOM 1920 CG ASP A 121 -5.383 28.669 -39.680 1.00 0.35 C ATOM 1921 OD1 ASP A 121 -5.049 29.868 -39.787 1.00 35.51 O ATOM 1922 OD2 ASP A 121 -5.152 27.982 -38.663 1.00 33.01 O ATOM 0 H ASP A 121 -8.900 26.842 -39.776 1.00 32.43 H new ATOM 0 HA ASP A 121 -7.862 28.806 -39.898 1.00 74.21 H new ATOM 0 HB2 ASP A 121 -5.856 26.955 -40.870 1.00 31.14 H new ATOM 0 HB3 ASP A 121 -5.744 28.450 -41.778 1.00 31.14 H new ATOM 1927 N THR A 122 -7.680 28.399 -43.174 1.00 40.01 N ATOM 1928 CA THR A 122 -8.097 28.968 -44.449 1.00 11.52 C ATOM 1929 C THR A 122 -7.928 30.483 -44.456 1.00 43.44 C ATOM 1930 O THR A 122 -7.338 31.057 -43.542 1.00 22.35 O ATOM 1931 CB THR A 122 -9.565 28.626 -44.765 1.00 22.35 C ATOM 1932 OG1 THR A 122 -10.439 29.472 -44.009 1.00 32.10 O ATOM 1933 CG2 THR A 122 -9.861 27.168 -44.445 1.00 22.13 C ATOM 0 H THR A 122 -7.018 27.627 -43.253 1.00 40.01 H new ATOM 0 HA THR A 122 -7.457 28.529 -45.215 1.00 11.52 H new ATOM 0 HB THR A 122 -9.732 28.790 -45.829 1.00 22.35 H new ATOM 0 HG1 THR A 122 -9.957 29.833 -43.236 1.00 32.10 H new ATOM 0 HG21 THR A 122 -10.904 26.949 -44.676 1.00 22.13 H new ATOM 0 HG22 THR A 122 -9.214 26.526 -45.043 1.00 22.13 H new ATOM 0 HG23 THR A 122 -9.677 26.983 -43.387 1.00 22.13 H new ATOM 1941 N GLY A 123 -8.451 31.127 -45.496 1.00 13.55 N ATOM 1942 CA GLY A 123 -8.348 32.571 -45.602 1.00 44.32 C ATOM 1943 C GLY A 123 -9.330 33.291 -44.698 1.00 40.43 C ATOM 1944 O GLY A 123 -10.518 32.975 -44.687 1.00 14.02 O ATOM 0 H GLY A 123 -8.944 30.675 -46.266 1.00 13.55 H new ATOM 0 HA2 GLY A 123 -7.333 32.879 -45.350 1.00 44.32 H new ATOM 0 HA3 GLY A 123 -8.524 32.870 -46.635 1.00 44.32 H new ATOM 1948 N ASN A 124 -8.831 34.260 -43.939 1.00 13.51 N ATOM 1949 CA ASN A 124 -9.674 35.026 -43.026 1.00 64.42 C ATOM 1950 C ASN A 124 -9.719 36.496 -43.431 1.00 4.23 C ATOM 1951 O ASN A 124 -8.694 37.090 -43.766 1.00 73.25 O ATOM 1952 CB ASN A 124 -9.157 34.896 -41.592 1.00 64.44 C ATOM 1953 CG ASN A 124 -9.755 35.936 -40.665 1.00 43.22 C ATOM 1954 OD1 ASN A 124 -10.939 36.260 -40.758 1.00 45.35 O ATOM 1955 ND2 ASN A 124 -8.936 36.466 -39.764 1.00 42.34 N ATOM 0 H ASN A 124 -7.849 34.534 -43.937 1.00 13.51 H new ATOM 0 HA ASN A 124 -10.685 34.622 -43.079 1.00 64.42 H new ATOM 0 HB2 ASN A 124 -9.389 33.900 -41.214 1.00 64.44 H new ATOM 0 HB3 ASN A 124 -8.071 34.993 -41.590 1.00 64.44 H new ATOM 0 HD21 ASN A 124 -9.281 37.171 -39.113 1.00 42.34 H new ATOM 0 HD22 ASN A 124 -7.962 36.168 -39.723 1.00 42.34 H new ATOM 1962 N ASN A 125 -10.914 37.078 -43.396 1.00 64.12 N ATOM 1963 CA ASN A 125 -11.092 38.479 -43.760 1.00 33.33 C ATOM 1964 C ASN A 125 -11.550 39.298 -42.556 1.00 73.43 C ATOM 1965 O ASN A 125 -10.822 40.161 -42.067 1.00 31.23 O ATOM 1966 CB ASN A 125 -12.109 38.607 -44.895 1.00 53.04 C ATOM 1967 CG ASN A 125 -11.454 38.929 -46.224 1.00 74.02 C ATOM 1968 OD1 ASN A 125 -10.936 38.043 -46.904 1.00 62.21 O ATOM 1969 ND2 ASN A 125 -11.475 40.202 -46.601 1.00 60.10 N ATOM 0 H ASN A 125 -11.772 36.601 -43.120 1.00 64.12 H new ATOM 0 HA ASN A 125 -10.131 38.867 -44.098 1.00 33.33 H new ATOM 0 HB2 ASN A 125 -12.668 37.676 -44.985 1.00 53.04 H new ATOM 0 HB3 ASN A 125 -12.828 39.388 -44.649 1.00 53.04 H new ATOM 0 HD21 ASN A 125 -11.051 40.479 -47.486 1.00 60.10 H new ATOM 0 HD22 ASN A 125 -11.916 40.903 -46.005 1.00 60.10 H new ATOM 1976 N SER A 126 -12.761 39.021 -42.086 1.00 34.44 N ATOM 1977 CA SER A 126 -13.319 39.734 -40.942 1.00 64.12 C ATOM 1978 C SER A 126 -14.622 39.088 -40.481 1.00 30.20 C ATOM 1979 O SER A 126 -15.453 38.691 -41.298 1.00 51.52 O ATOM 1980 CB SER A 126 -13.562 41.202 -41.298 1.00 61.24 C ATOM 1981 OG SER A 126 -14.920 41.425 -41.638 1.00 44.43 O ATOM 0 H SER A 126 -13.375 38.308 -42.479 1.00 34.44 H new ATOM 0 HA SER A 126 -12.599 39.680 -40.126 1.00 64.12 H new ATOM 0 HB2 SER A 126 -13.286 41.835 -40.454 1.00 61.24 H new ATOM 0 HB3 SER A 126 -12.923 41.488 -42.133 1.00 61.24 H new ATOM 0 HG SER A 126 -15.051 42.371 -41.860 1.00 44.43 H new ATOM 1987 N GLN A 127 -14.793 38.987 -39.167 1.00 32.30 N ATOM 1988 CA GLN A 127 -15.994 38.388 -38.597 1.00 72.14 C ATOM 1989 C GLN A 127 -16.735 39.389 -37.716 1.00 74.35 C ATOM 1990 O GLN A 127 -17.261 39.033 -36.661 1.00 53.14 O ATOM 1991 CB GLN A 127 -15.634 37.144 -37.784 1.00 2.01 C ATOM 1992 CG GLN A 127 -14.753 37.438 -36.580 1.00 41.51 C ATOM 1993 CD GLN A 127 -13.712 36.362 -36.341 1.00 73.25 C ATOM 1994 OE1 GLN A 127 -13.952 35.182 -36.601 1.00 22.12 O ATOM 1995 NE2 GLN A 127 -12.548 36.764 -35.845 1.00 1.11 N ATOM 0 H GLN A 127 -14.115 39.312 -38.477 1.00 32.30 H new ATOM 0 HA GLN A 127 -16.650 38.098 -39.418 1.00 72.14 H new ATOM 0 HB2 GLN A 127 -16.552 36.664 -37.444 1.00 2.01 H new ATOM 0 HB3 GLN A 127 -15.123 36.432 -38.432 1.00 2.01 H new ATOM 0 HG2 GLN A 127 -14.253 38.396 -36.726 1.00 41.51 H new ATOM 0 HG3 GLN A 127 -15.378 37.537 -35.693 1.00 41.51 H new ATOM 0 HE21 GLN A 127 -12.393 37.752 -35.645 1.00 1.11 H new ATOM 0 HE22 GLN A 127 -11.809 36.085 -35.664 1.00 1.11 H new ATOM 2004 N VAL A 128 -16.773 40.643 -38.156 1.00 33.11 N ATOM 2005 CA VAL A 128 -17.450 41.695 -37.408 1.00 73.14 C ATOM 2006 C VAL A 128 -17.932 42.806 -38.335 1.00 21.21 C ATOM 2007 O VAL A 128 -17.237 43.188 -39.276 1.00 24.31 O ATOM 2008 CB VAL A 128 -16.528 42.302 -36.333 1.00 53.01 C ATOM 2009 CG1 VAL A 128 -15.352 43.016 -36.980 1.00 55.33 C ATOM 2010 CG2 VAL A 128 -17.310 43.249 -35.435 1.00 55.33 C ATOM 0 H VAL A 128 -16.343 40.955 -39.027 1.00 33.11 H new ATOM 0 HA VAL A 128 -18.309 41.234 -36.921 1.00 73.14 H new ATOM 0 HB VAL A 128 -16.136 41.494 -35.716 1.00 53.01 H new ATOM 0 HG11 VAL A 128 -14.712 43.438 -36.205 1.00 55.33 H new ATOM 0 HG12 VAL A 128 -14.779 42.306 -37.577 1.00 55.33 H new ATOM 0 HG13 VAL A 128 -15.721 43.816 -37.622 1.00 55.33 H new ATOM 0 HG21 VAL A 128 -16.644 43.669 -34.681 1.00 55.33 H new ATOM 0 HG22 VAL A 128 -17.732 44.055 -36.036 1.00 55.33 H new ATOM 0 HG23 VAL A 128 -18.115 42.703 -34.944 1.00 55.33 H new ATOM 2020 N SER A 129 -19.127 43.320 -38.063 1.00 32.11 N ATOM 2021 CA SER A 129 -19.703 44.385 -38.875 1.00 34.34 C ATOM 2022 C SER A 129 -18.933 45.688 -38.687 1.00 52.22 C ATOM 2023 O SER A 129 -18.629 46.086 -37.563 1.00 13.33 O ATOM 2024 CB SER A 129 -21.175 44.593 -38.510 1.00 62.03 C ATOM 2025 OG SER A 129 -21.931 44.982 -39.644 1.00 61.01 O ATOM 0 H SER A 129 -19.715 43.016 -37.287 1.00 32.11 H new ATOM 0 HA SER A 129 -19.633 44.089 -39.922 1.00 34.34 H new ATOM 0 HB2 SER A 129 -21.584 43.672 -38.095 1.00 62.03 H new ATOM 0 HB3 SER A 129 -21.257 45.355 -37.735 1.00 62.03 H new ATOM 0 HG SER A 129 -22.868 45.107 -39.385 1.00 61.01 H new ATOM 2031 N GLN A 130 -18.621 46.348 -39.798 1.00 44.14 N ATOM 2032 CA GLN A 130 -17.884 47.607 -39.757 1.00 74.33 C ATOM 2033 C GLN A 130 -18.562 48.662 -40.626 1.00 25.51 C ATOM 2034 O GLN A 130 -18.186 48.863 -41.780 1.00 43.22 O ATOM 2035 CB GLN A 130 -16.443 47.394 -40.223 1.00 11.34 C ATOM 2036 CG GLN A 130 -15.695 46.339 -39.422 1.00 54.33 C ATOM 2037 CD GLN A 130 -14.330 46.813 -38.964 1.00 53.32 C ATOM 2038 OE1 GLN A 130 -14.218 47.632 -38.051 1.00 74.42 O ATOM 2039 NE2 GLN A 130 -13.282 46.300 -39.598 1.00 65.30 N ATOM 0 H GLN A 130 -18.866 46.033 -40.737 1.00 44.14 H new ATOM 0 HA GLN A 130 -17.876 47.962 -38.726 1.00 74.33 H new ATOM 0 HB2 GLN A 130 -16.449 47.104 -41.274 1.00 11.34 H new ATOM 0 HB3 GLN A 130 -15.904 48.339 -40.156 1.00 11.34 H new ATOM 0 HG2 GLN A 130 -16.289 46.060 -38.552 1.00 54.33 H new ATOM 0 HG3 GLN A 130 -15.579 45.442 -40.030 1.00 54.33 H new ATOM 0 HE21 GLN A 130 -13.421 45.624 -40.349 1.00 65.30 H new ATOM 0 HE22 GLN A 130 -12.338 46.582 -39.334 1.00 65.30 H new ATOM 2048 N ASN A 131 -19.562 49.332 -40.063 1.00 44.12 N ATOM 2049 CA ASN A 131 -20.292 50.366 -40.788 1.00 43.03 C ATOM 2050 C ASN A 131 -21.174 51.174 -39.841 1.00 21.15 C ATOM 2051 O ASN A 131 -21.403 50.776 -38.699 1.00 13.14 O ATOM 2052 CB ASN A 131 -21.148 49.738 -41.890 1.00 35.43 C ATOM 2053 CG ASN A 131 -22.440 49.152 -41.354 1.00 21.41 C ATOM 2054 OD1 ASN A 131 -22.432 48.362 -40.409 1.00 11.20 O ATOM 2055 ND2 ASN A 131 -23.560 49.536 -41.957 1.00 43.30 N ATOM 0 H ASN A 131 -19.885 49.178 -39.108 1.00 44.12 H new ATOM 0 HA ASN A 131 -19.565 51.039 -41.242 1.00 43.03 H new ATOM 0 HB2 ASN A 131 -21.379 50.493 -42.642 1.00 35.43 H new ATOM 0 HB3 ASN A 131 -20.576 48.955 -42.389 1.00 35.43 H new ATOM 0 HD21 ASN A 131 -24.460 49.174 -41.640 1.00 43.30 H new ATOM 0 HD22 ASN A 131 -23.520 50.193 -42.736 1.00 43.30 H new ATOM 2062 N TYR A 132 -21.666 52.309 -40.324 1.00 72.21 N ATOM 2063 CA TYR A 132 -22.521 53.174 -39.520 1.00 13.32 C ATOM 2064 C TYR A 132 -23.742 52.414 -39.011 1.00 71.50 C ATOM 2065 O TYR A 132 -24.797 52.419 -39.643 1.00 63.41 O ATOM 2066 CB TYR A 132 -22.967 54.387 -40.338 1.00 15.42 C ATOM 2067 CG TYR A 132 -23.884 55.323 -39.583 1.00 1.31 C ATOM 2068 CD1 TYR A 132 -23.424 56.047 -38.491 1.00 1.34 C ATOM 2069 CD2 TYR A 132 -25.211 55.484 -39.963 1.00 11.02 C ATOM 2070 CE1 TYR A 132 -24.258 56.902 -37.797 1.00 11.22 C ATOM 2071 CE2 TYR A 132 -26.053 56.337 -39.277 1.00 1.31 C ATOM 2072 CZ TYR A 132 -25.572 57.044 -38.194 1.00 50.21 C ATOM 2073 OH TYR A 132 -26.406 57.896 -37.508 1.00 4.35 O ATOM 0 H TYR A 132 -21.488 52.652 -41.268 1.00 72.21 H new ATOM 0 HA TYR A 132 -21.944 53.515 -38.660 1.00 13.32 H new ATOM 0 HB2 TYR A 132 -22.085 54.939 -40.663 1.00 15.42 H new ATOM 0 HB3 TYR A 132 -23.476 54.041 -41.238 1.00 15.42 H new ATOM 0 HD1 TYR A 132 -22.396 55.940 -38.179 1.00 1.34 H new ATOM 0 HD2 TYR A 132 -25.591 54.932 -40.810 1.00 11.02 H new ATOM 0 HE1 TYR A 132 -23.884 57.456 -36.949 1.00 11.22 H new ATOM 0 HE2 TYR A 132 -27.082 56.450 -39.586 1.00 1.31 H new ATOM 0 HH TYR A 132 -27.297 57.881 -37.916 1.00 4.35 H new TER 2083 TYR A 132