USER MOD reduce.3.24.130724 H: found=0, std=0, add=975, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 973 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 72 GLN : amide:sc= -4.15 K(o=-5.9,f=-1.2!) USER MOD Set 1.2: A 81 LYS NZ :NH3+ 180:sc=-0.00999 (180deg=0) USER MOD Set 1.3: A 150 TYR OH : rot 180:sc= -1.69 USER MOD Set 2.1: A 134 LYS NZ :NH3+ -127:sc= -0.213 (180deg=-2.08!) USER MOD Set 2.2: A 146 HIS : no HD1:sc= 0.116 K(o=-0.097,f=-1.7) USER MOD Set 3.1: A 83 TYR OH : rot 5:sc= 0.397 USER MOD Set 3.2: A 99 ASN : amide:sc= -1.33 K(o=-0.94,f=-0.039) USER MOD Set 4.1: A 96 THR OG1 : rot -98:sc= 0.191 USER MOD Set 4.2: A 114 HIS : no HD1:sc= 0.173 K(o=0.36,f=-0.34) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot 41:sc= 0.459 USER MOD Single : A 38 SER OG : rot -57:sc= 0.71 USER MOD Single : A 39 SER OG : rot 180:sc= 0.00515 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot -83:sc= 1.08 USER MOD Single : A 52 CYS SG : rot 130:sc= -1.87 USER MOD Single : A 55 SER OG : rot 135:sc= 0.0203 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -0.0917 K(o=-0.092,f=-1.9!) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=-0.023) USER MOD Single : A 63 TYR OH : rot 180:sc= -0.0199 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -2.13 K(o=-2.1,f=-3.2!) USER MOD Single : A 68 CYS SG : rot 160:sc= 0.96 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -0.205 K(o=-0.21,f=-6!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.0569 X(o=-0.057,f=0) USER MOD Single : A 77 ASN : amide:sc= -0.586 X(o=-0.59,f=-0.81) USER MOD Single : A 78 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 ASN : amide:sc= -0.0457 K(o=-0.046,f=-1.2) USER MOD Single : A 80 ASN : amide:sc= -4.14! C(o=-4.1!,f=-7!) USER MOD Single : A 86 GLN : amide:sc= -1.2 K(o=-1.2,f=-4.8!) USER MOD Single : A 89 GLN : amide:sc= -0.021 K(o=-0.021,f=-1.6) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -0.0664 K(o=-0.066,f=-1.3) USER MOD Single : A 97 CYS SG : rot 124:sc= 0.223 USER MOD Single : A 109 GLN : amide:sc= 0.0586 K(o=0.059,f=-3.2!) USER MOD Single : A 110 SER OG : rot 3:sc= 0.699 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 THR OG1 : rot -174:sc= 1.88 USER MOD Single : A 135 ASN : amide:sc= -0.414 K(o=-0.41,f=-2.9!) USER MOD Single : A 136 ASN : amide:sc= -0.274 X(o=-0.27,f=-0.54) USER MOD Single : A 142 HIS : no HE2:sc= -8.89! C(o=-8.9!,f=-8.3!) USER MOD Single : A 145 SER OG : rot -153:sc= -0.936 USER MOD Single : A 149 LYS NZ :NH3+ -158:sc= 0.022 (180deg=0) USER MOD Single : A 151 THR OG1 : rot 180:sc= 0.00111 USER MOD Single : A 156 GLN : amide:sc= -0.0725 K(o=-0.073,f=-1.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 34 -3.137 2.318 -25.318 1.00 0.00 N ATOM 2 CA GLY A 34 -3.730 2.606 -26.611 1.00 0.00 C ATOM 3 C GLY A 34 -4.184 4.047 -26.733 1.00 0.00 C ATOM 4 O GLY A 34 -5.353 4.358 -26.504 1.00 0.00 O ATOM 0 HA2 GLY A 34 -3.005 2.389 -27.396 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -4.582 1.945 -26.772 1.00 0.00 H new ATOM 8 N SER A 35 -3.257 4.930 -27.092 1.00 0.00 N ATOM 9 CA SER A 35 -3.568 6.347 -27.239 1.00 0.00 C ATOM 10 C SER A 35 -3.395 6.795 -28.687 1.00 0.00 C ATOM 11 O SER A 35 -4.330 7.299 -29.308 1.00 0.00 O ATOM 12 CB SER A 35 -2.672 7.184 -26.324 1.00 0.00 C ATOM 13 OG SER A 35 -3.076 7.070 -24.970 1.00 0.00 O ATOM 0 H SER A 35 -2.285 4.689 -27.286 1.00 0.00 H new ATOM 0 HA SER A 35 -4.609 6.497 -26.953 1.00 0.00 H new ATOM 0 HB2 SER A 35 -1.637 6.858 -26.426 1.00 0.00 H new ATOM 0 HB3 SER A 35 -2.709 8.229 -26.631 1.00 0.00 H new ATOM 0 HG SER A 35 -2.486 7.613 -24.406 1.00 0.00 H new ATOM 19 N SER A 36 -2.191 6.606 -29.218 1.00 0.00 N ATOM 20 CA SER A 36 -1.892 6.993 -30.592 1.00 0.00 C ATOM 21 C SER A 36 -2.608 8.290 -30.959 1.00 0.00 C ATOM 22 O SER A 36 -3.690 8.270 -31.544 1.00 0.00 O ATOM 23 CB SER A 36 -2.302 5.880 -31.558 1.00 0.00 C ATOM 24 OG SER A 36 -3.655 5.507 -31.363 1.00 0.00 O ATOM 0 H SER A 36 -1.407 6.187 -28.718 1.00 0.00 H new ATOM 0 HA SER A 36 -0.817 7.156 -30.672 1.00 0.00 H new ATOM 0 HB2 SER A 36 -2.158 6.215 -32.585 1.00 0.00 H new ATOM 0 HB3 SER A 36 -1.658 5.013 -31.413 1.00 0.00 H new ATOM 0 HG SER A 36 -4.198 6.310 -31.217 1.00 0.00 H new ATOM 30 N GLY A 37 -1.995 9.416 -30.609 1.00 0.00 N ATOM 31 CA GLY A 37 -2.588 10.707 -30.908 1.00 0.00 C ATOM 32 C GLY A 37 -3.443 11.231 -29.771 1.00 0.00 C ATOM 33 O GLY A 37 -4.558 11.704 -29.991 1.00 0.00 O ATOM 0 H GLY A 37 -1.099 9.458 -30.124 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -1.797 11.425 -31.124 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -3.197 10.624 -31.808 1.00 0.00 H new ATOM 37 N SER A 38 -2.920 11.145 -28.552 1.00 0.00 N ATOM 38 CA SER A 38 -3.646 11.609 -27.375 1.00 0.00 C ATOM 39 C SER A 38 -2.815 11.409 -26.111 1.00 0.00 C ATOM 40 O SER A 38 -3.331 10.985 -25.077 1.00 0.00 O ATOM 41 CB SER A 38 -4.978 10.868 -27.246 1.00 0.00 C ATOM 42 OG SER A 38 -5.739 11.372 -26.162 1.00 0.00 O ATOM 0 H SER A 38 -1.997 10.759 -28.354 1.00 0.00 H new ATOM 0 HA SER A 38 -3.842 12.674 -27.496 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.545 10.970 -28.171 1.00 0.00 H new ATOM 0 HB3 SER A 38 -4.793 9.804 -27.101 1.00 0.00 H new ATOM 0 HG SER A 38 -5.215 11.306 -25.336 1.00 0.00 H new ATOM 48 N SER A 39 -1.525 11.716 -26.203 1.00 0.00 N ATOM 49 CA SER A 39 -0.621 11.567 -25.069 1.00 0.00 C ATOM 50 C SER A 39 -0.728 12.763 -24.128 1.00 0.00 C ATOM 51 O SER A 39 -0.906 13.899 -24.566 1.00 0.00 O ATOM 52 CB SER A 39 0.821 11.415 -25.557 1.00 0.00 C ATOM 53 OG SER A 39 1.170 12.458 -26.451 1.00 0.00 O ATOM 0 H SER A 39 -1.083 12.069 -27.051 1.00 0.00 H new ATOM 0 HA SER A 39 -0.909 10.670 -24.521 1.00 0.00 H new ATOM 0 HB2 SER A 39 1.499 11.421 -24.704 1.00 0.00 H new ATOM 0 HB3 SER A 39 0.941 10.452 -26.053 1.00 0.00 H new ATOM 0 HG SER A 39 2.097 12.339 -26.747 1.00 0.00 H new ATOM 59 N GLY A 40 -0.620 12.498 -22.829 1.00 0.00 N ATOM 60 CA GLY A 40 -0.707 13.561 -21.845 1.00 0.00 C ATOM 61 C GLY A 40 -1.805 13.320 -20.828 1.00 0.00 C ATOM 62 O GLY A 40 -1.530 13.037 -19.663 1.00 0.00 O ATOM 0 H GLY A 40 -0.474 11.566 -22.441 1.00 0.00 H new ATOM 0 HA2 GLY A 40 0.249 13.653 -21.329 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -0.888 14.508 -22.353 1.00 0.00 H new ATOM 66 N ALA A 41 -3.054 13.435 -21.270 1.00 0.00 N ATOM 67 CA ALA A 41 -4.197 13.228 -20.390 1.00 0.00 C ATOM 68 C ALA A 41 -4.470 11.742 -20.184 1.00 0.00 C ATOM 69 O ALA A 41 -5.308 11.156 -20.868 1.00 0.00 O ATOM 70 CB ALA A 41 -5.429 13.920 -20.954 1.00 0.00 C ATOM 0 H ALA A 41 -3.299 13.670 -22.232 1.00 0.00 H new ATOM 0 HA ALA A 41 -3.961 13.665 -19.420 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -6.275 13.757 -20.287 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -5.237 14.989 -21.043 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -5.658 13.510 -21.938 1.00 0.00 H new ATOM 76 N GLU A 42 -3.755 11.139 -19.239 1.00 0.00 N ATOM 77 CA GLU A 42 -3.920 9.720 -18.946 1.00 0.00 C ATOM 78 C GLU A 42 -4.385 9.513 -17.507 1.00 0.00 C ATOM 79 O GLU A 42 -4.164 10.361 -16.642 1.00 0.00 O ATOM 80 CB GLU A 42 -2.607 8.972 -19.182 1.00 0.00 C ATOM 81 CG GLU A 42 -2.790 7.483 -19.425 1.00 0.00 C ATOM 82 CD GLU A 42 -1.649 6.876 -20.218 1.00 0.00 C ATOM 83 OE1 GLU A 42 -1.654 7.005 -21.460 1.00 0.00 O ATOM 84 OE2 GLU A 42 -0.750 6.273 -19.595 1.00 0.00 O ATOM 0 H GLU A 42 -3.057 11.610 -18.664 1.00 0.00 H new ATOM 0 HA GLU A 42 -4.682 9.322 -19.617 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -2.097 9.412 -20.039 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -1.958 9.114 -18.318 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -2.875 6.970 -18.467 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -3.726 7.318 -19.958 1.00 0.00 H new ATOM 91 N LYS A 43 -5.030 8.378 -17.258 1.00 0.00 N ATOM 92 CA LYS A 43 -5.526 8.056 -15.925 1.00 0.00 C ATOM 93 C LYS A 43 -4.581 7.095 -15.211 1.00 0.00 C ATOM 94 O LYS A 43 -4.485 5.922 -15.571 1.00 0.00 O ATOM 95 CB LYS A 43 -6.925 7.441 -16.014 1.00 0.00 C ATOM 96 CG LYS A 43 -7.935 8.327 -16.724 1.00 0.00 C ATOM 97 CD LYS A 43 -7.892 8.126 -18.229 1.00 0.00 C ATOM 98 CE LYS A 43 -8.944 8.968 -18.934 1.00 0.00 C ATOM 99 NZ LYS A 43 -8.498 10.378 -19.110 1.00 0.00 N ATOM 0 H LYS A 43 -5.221 7.666 -17.962 1.00 0.00 H new ATOM 0 HA LYS A 43 -5.578 8.981 -15.350 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.861 6.487 -16.537 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -7.284 7.229 -15.007 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -8.937 8.106 -16.355 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -7.732 9.372 -16.490 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -6.903 8.389 -18.604 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -8.052 7.073 -18.461 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -9.165 8.532 -19.908 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -9.870 8.949 -18.359 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -9.242 10.920 -19.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -8.311 10.802 -18.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -7.628 10.398 -19.680 1.00 0.00 H new ATOM 113 N ARG A 44 -3.888 7.600 -14.196 1.00 0.00 N ATOM 114 CA ARG A 44 -2.951 6.786 -13.430 1.00 0.00 C ATOM 115 C ARG A 44 -3.601 5.477 -12.992 1.00 0.00 C ATOM 116 O ARG A 44 -4.740 5.464 -12.526 1.00 0.00 O ATOM 117 CB ARG A 44 -2.455 7.557 -12.205 1.00 0.00 C ATOM 118 CG ARG A 44 -1.046 7.180 -11.778 1.00 0.00 C ATOM 119 CD ARG A 44 -1.048 5.964 -10.864 1.00 0.00 C ATOM 120 NE ARG A 44 0.301 5.463 -10.616 1.00 0.00 N ATOM 121 CZ ARG A 44 1.125 5.986 -9.715 1.00 0.00 C ATOM 122 NH1 ARG A 44 0.738 7.019 -8.979 1.00 0.00 N ATOM 123 NH2 ARG A 44 2.338 5.475 -9.547 1.00 0.00 N ATOM 0 H ARG A 44 -3.957 8.569 -13.885 1.00 0.00 H new ATOM 0 HA ARG A 44 -2.101 6.553 -14.072 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -2.487 8.625 -12.421 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -3.137 7.380 -11.374 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -0.440 6.973 -12.660 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -0.583 8.022 -11.264 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -1.518 6.224 -9.916 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -1.651 5.175 -11.312 1.00 0.00 H new ATOM 0 HE ARG A 44 0.628 4.668 -11.165 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -0.194 7.414 -9.104 1.00 0.00 H new ATOM 0 HH12 ARG A 44 1.373 7.419 -8.288 1.00 0.00 H new ATOM 0 HH21 ARG A 44 2.639 4.680 -10.110 1.00 0.00 H new ATOM 0 HH22 ARG A 44 2.970 5.878 -8.855 1.00 0.00 H new ATOM 137 N ILE A 45 -2.869 4.379 -13.145 1.00 0.00 N ATOM 138 CA ILE A 45 -3.373 3.066 -12.765 1.00 0.00 C ATOM 139 C ILE A 45 -2.578 2.487 -11.599 1.00 0.00 C ATOM 140 O ILE A 45 -1.370 2.702 -11.492 1.00 0.00 O ATOM 141 CB ILE A 45 -3.322 2.079 -13.946 1.00 0.00 C ATOM 142 CG1 ILE A 45 -4.037 2.669 -15.164 1.00 0.00 C ATOM 143 CG2 ILE A 45 -3.945 0.748 -13.552 1.00 0.00 C ATOM 144 CD1 ILE A 45 -5.540 2.735 -15.008 1.00 0.00 C ATOM 0 H ILE A 45 -1.924 4.373 -13.530 1.00 0.00 H new ATOM 0 HA ILE A 45 -4.411 3.203 -12.461 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.279 1.905 -14.210 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -3.654 3.673 -15.349 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -3.797 2.070 -16.042 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -3.901 0.061 -14.397 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -3.396 0.324 -12.711 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -4.985 0.904 -13.265 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -5.981 3.163 -15.908 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -5.934 1.731 -14.853 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -5.790 3.359 -14.150 1.00 0.00 H new ATOM 156 N ILE A 46 -3.264 1.753 -10.729 1.00 0.00 N ATOM 157 CA ILE A 46 -2.621 1.142 -9.573 1.00 0.00 C ATOM 158 C ILE A 46 -2.800 -0.373 -9.581 1.00 0.00 C ATOM 159 O ILE A 46 -3.743 -0.893 -10.177 1.00 0.00 O ATOM 160 CB ILE A 46 -3.180 1.706 -8.254 1.00 0.00 C ATOM 161 CG1 ILE A 46 -3.220 3.235 -8.305 1.00 0.00 C ATOM 162 CG2 ILE A 46 -2.340 1.232 -7.077 1.00 0.00 C ATOM 163 CD1 ILE A 46 -1.855 3.879 -8.208 1.00 0.00 C ATOM 0 H ILE A 46 -4.264 1.567 -10.803 1.00 0.00 H new ATOM 0 HA ILE A 46 -1.560 1.381 -9.640 1.00 0.00 H new ATOM 0 HB ILE A 46 -4.197 1.338 -8.121 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.695 3.547 -9.235 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -3.844 3.601 -7.490 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.748 1.639 -6.152 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.357 0.143 -7.033 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -1.313 1.574 -7.202 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -1.960 4.963 -8.251 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.386 3.597 -7.265 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.234 3.542 -9.038 1.00 0.00 H new ATOM 175 N ARG A 47 -1.889 -1.075 -8.914 1.00 0.00 N ATOM 176 CA ARG A 47 -1.947 -2.530 -8.844 1.00 0.00 C ATOM 177 C ARG A 47 -1.609 -3.020 -7.439 1.00 0.00 C ATOM 178 O ARG A 47 -0.521 -2.760 -6.925 1.00 0.00 O ATOM 179 CB ARG A 47 -0.983 -3.149 -9.858 1.00 0.00 C ATOM 180 CG ARG A 47 -1.164 -2.621 -11.272 1.00 0.00 C ATOM 181 CD ARG A 47 -2.467 -3.110 -11.886 1.00 0.00 C ATOM 182 NE ARG A 47 -2.303 -4.391 -12.568 1.00 0.00 N ATOM 183 CZ ARG A 47 -3.309 -5.219 -12.827 1.00 0.00 C ATOM 184 NH1 ARG A 47 -4.544 -4.901 -12.463 1.00 0.00 N ATOM 185 NH2 ARG A 47 -3.081 -6.367 -13.451 1.00 0.00 N ATOM 0 H ARG A 47 -1.103 -0.660 -8.415 1.00 0.00 H new ATOM 0 HA ARG A 47 -2.964 -2.841 -9.084 1.00 0.00 H new ATOM 0 HB2 ARG A 47 0.041 -2.958 -9.536 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -1.119 -4.230 -9.863 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -1.153 -1.531 -11.259 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -0.326 -2.941 -11.891 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -3.221 -3.209 -11.105 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -2.836 -2.367 -12.593 1.00 0.00 H new ATOM 0 HE ARG A 47 -1.365 -4.665 -12.861 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -4.723 -4.019 -11.983 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -5.315 -5.538 -12.663 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -2.132 -6.615 -13.732 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -3.854 -7.002 -13.649 1.00 0.00 H new ATOM 199 N VAL A 48 -2.549 -3.730 -6.824 1.00 0.00 N ATOM 200 CA VAL A 48 -2.350 -4.258 -5.479 1.00 0.00 C ATOM 201 C VAL A 48 -0.999 -4.952 -5.355 1.00 0.00 C ATOM 202 O VAL A 48 -0.730 -5.936 -6.044 1.00 0.00 O ATOM 203 CB VAL A 48 -3.463 -5.251 -5.096 1.00 0.00 C ATOM 204 CG1 VAL A 48 -3.237 -5.792 -3.692 1.00 0.00 C ATOM 205 CG2 VAL A 48 -4.829 -4.590 -5.207 1.00 0.00 C ATOM 0 H VAL A 48 -3.455 -3.953 -7.235 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.382 -3.408 -4.797 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.432 -6.089 -5.792 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -4.033 -6.492 -3.439 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.276 -6.305 -3.650 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -3.239 -4.967 -2.979 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.603 -5.306 -4.933 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.874 -3.732 -4.536 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.990 -4.257 -6.232 1.00 0.00 H new ATOM 215 N ASP A 49 -0.153 -4.435 -4.471 1.00 0.00 N ATOM 216 CA ASP A 49 1.171 -5.006 -4.254 1.00 0.00 C ATOM 217 C ASP A 49 1.091 -6.523 -4.109 1.00 0.00 C ATOM 218 O ASP A 49 0.151 -7.067 -3.530 1.00 0.00 O ATOM 219 CB ASP A 49 1.816 -4.396 -3.009 1.00 0.00 C ATOM 220 CG ASP A 49 3.313 -4.214 -3.163 1.00 0.00 C ATOM 221 OD1 ASP A 49 3.727 -3.381 -3.996 1.00 0.00 O ATOM 222 OD2 ASP A 49 4.071 -4.905 -2.450 1.00 0.00 O ATOM 0 H ASP A 49 -0.361 -3.621 -3.893 1.00 0.00 H new ATOM 0 HA ASP A 49 1.787 -4.773 -5.123 1.00 0.00 H new ATOM 0 HB2 ASP A 49 1.355 -3.430 -2.801 1.00 0.00 H new ATOM 0 HB3 ASP A 49 1.617 -5.036 -2.150 1.00 0.00 H new ATOM 227 N PRO A 50 2.100 -7.223 -4.649 1.00 0.00 N ATOM 228 CA PRO A 50 2.167 -8.686 -4.593 1.00 0.00 C ATOM 229 C PRO A 50 2.434 -9.201 -3.183 1.00 0.00 C ATOM 230 O PRO A 50 1.914 -10.243 -2.781 1.00 0.00 O ATOM 231 CB PRO A 50 3.340 -9.024 -5.516 1.00 0.00 C ATOM 232 CG PRO A 50 4.195 -7.803 -5.504 1.00 0.00 C ATOM 233 CD PRO A 50 3.253 -6.640 -5.354 1.00 0.00 C ATOM 0 HA PRO A 50 1.226 -9.148 -4.891 1.00 0.00 H new ATOM 0 HB2 PRO A 50 3.888 -9.895 -5.157 1.00 0.00 H new ATOM 0 HB3 PRO A 50 2.996 -9.257 -6.524 1.00 0.00 H new ATOM 0 HG2 PRO A 50 4.910 -7.835 -4.682 1.00 0.00 H new ATOM 0 HG3 PRO A 50 4.772 -7.722 -6.425 1.00 0.00 H new ATOM 0 HD2 PRO A 50 3.704 -5.828 -4.783 1.00 0.00 H new ATOM 0 HD3 PRO A 50 2.966 -6.228 -6.322 1.00 0.00 H new ATOM 241 N THR A 51 3.248 -8.464 -2.433 1.00 0.00 N ATOM 242 CA THR A 51 3.585 -8.847 -1.068 1.00 0.00 C ATOM 243 C THR A 51 2.329 -9.039 -0.225 1.00 0.00 C ATOM 244 O THR A 51 2.245 -9.970 0.577 1.00 0.00 O ATOM 245 CB THR A 51 4.485 -7.793 -0.395 1.00 0.00 C ATOM 246 OG1 THR A 51 3.944 -6.483 -0.602 1.00 0.00 O ATOM 247 CG2 THR A 51 5.900 -7.857 -0.949 1.00 0.00 C ATOM 0 H THR A 51 3.686 -7.598 -2.748 1.00 0.00 H new ATOM 0 HA THR A 51 4.126 -9.791 -1.129 1.00 0.00 H new ATOM 0 HB THR A 51 4.521 -8.006 0.673 1.00 0.00 H new ATOM 0 HG1 THR A 51 4.227 -6.147 -1.478 1.00 0.00 H new ATOM 0 HG21 THR A 51 6.517 -7.104 -0.459 1.00 0.00 H new ATOM 0 HG22 THR A 51 6.319 -8.846 -0.764 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.880 -7.667 -2.022 1.00 0.00 H new ATOM 255 N CYS A 52 1.356 -8.154 -0.411 1.00 0.00 N ATOM 256 CA CYS A 52 0.104 -8.227 0.333 1.00 0.00 C ATOM 257 C CYS A 52 -0.653 -9.508 -0.001 1.00 0.00 C ATOM 258 O CYS A 52 -0.726 -9.933 -1.154 1.00 0.00 O ATOM 259 CB CYS A 52 -0.768 -7.009 0.024 1.00 0.00 C ATOM 260 SG CYS A 52 -2.458 -7.132 0.655 1.00 0.00 S ATOM 0 H CYS A 52 1.410 -7.378 -1.070 1.00 0.00 H new ATOM 0 HA CYS A 52 0.342 -8.234 1.397 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -0.297 -6.122 0.447 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -0.804 -6.866 -1.056 1.00 0.00 H new ATOM 0 HG CYS A 52 -2.754 -6.053 1.316 1.00 0.00 H new ATOM 266 N PRO A 53 -1.230 -10.141 1.031 1.00 0.00 N ATOM 267 CA PRO A 53 -1.991 -11.383 0.873 1.00 0.00 C ATOM 268 C PRO A 53 -3.312 -11.165 0.142 1.00 0.00 C ATOM 269 O PRO A 53 -3.651 -11.906 -0.782 1.00 0.00 O ATOM 270 CB PRO A 53 -2.246 -11.830 2.315 1.00 0.00 C ATOM 271 CG PRO A 53 -2.192 -10.575 3.115 1.00 0.00 C ATOM 272 CD PRO A 53 -1.184 -9.691 2.433 1.00 0.00 C ATOM 0 HA PRO A 53 -1.452 -12.117 0.274 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -3.215 -12.320 2.412 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -1.493 -12.544 2.647 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -3.170 -10.094 3.153 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -1.897 -10.781 4.144 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -1.446 -8.637 2.526 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -0.189 -9.811 2.861 1.00 0.00 H new ATOM 280 N LEU A 54 -4.053 -10.145 0.560 1.00 0.00 N ATOM 281 CA LEU A 54 -5.337 -9.829 -0.055 1.00 0.00 C ATOM 282 C LEU A 54 -5.237 -9.873 -1.577 1.00 0.00 C ATOM 283 O LEU A 54 -6.171 -10.294 -2.258 1.00 0.00 O ATOM 284 CB LEU A 54 -5.814 -8.447 0.396 1.00 0.00 C ATOM 285 CG LEU A 54 -6.047 -8.275 1.897 1.00 0.00 C ATOM 286 CD1 LEU A 54 -6.322 -6.817 2.231 1.00 0.00 C ATOM 287 CD2 LEU A 54 -7.197 -9.156 2.363 1.00 0.00 C ATOM 0 H LEU A 54 -3.786 -9.522 1.323 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.060 -10.579 0.265 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -5.079 -7.709 0.076 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.744 -8.218 -0.124 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.143 -8.583 2.423 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -6.485 -6.714 3.304 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.468 -6.208 1.934 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -7.210 -6.482 1.695 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -7.348 -9.020 3.434 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -8.107 -8.879 1.830 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -6.961 -10.200 2.159 1.00 0.00 H new ATOM 299 N SER A 55 -4.096 -9.438 -2.103 1.00 0.00 N ATOM 300 CA SER A 55 -3.875 -9.426 -3.544 1.00 0.00 C ATOM 301 C SER A 55 -4.442 -10.686 -4.191 1.00 0.00 C ATOM 302 O SER A 55 -5.167 -10.615 -5.183 1.00 0.00 O ATOM 303 CB SER A 55 -2.380 -9.310 -3.850 1.00 0.00 C ATOM 304 OG SER A 55 -2.162 -8.631 -5.075 1.00 0.00 O ATOM 0 H SER A 55 -3.311 -9.090 -1.553 1.00 0.00 H new ATOM 0 HA SER A 55 -4.392 -8.561 -3.960 1.00 0.00 H new ATOM 0 HB2 SER A 55 -1.880 -8.777 -3.041 1.00 0.00 H new ATOM 0 HB3 SER A 55 -1.937 -10.305 -3.898 1.00 0.00 H new ATOM 0 HG SER A 55 -1.442 -7.976 -4.962 1.00 0.00 H new ATOM 310 N SER A 56 -4.105 -11.839 -3.622 1.00 0.00 N ATOM 311 CA SER A 56 -4.577 -13.116 -4.144 1.00 0.00 C ATOM 312 C SER A 56 -6.102 -13.151 -4.198 1.00 0.00 C ATOM 313 O SER A 56 -6.689 -13.621 -5.171 1.00 0.00 O ATOM 314 CB SER A 56 -4.059 -14.267 -3.280 1.00 0.00 C ATOM 315 OG SER A 56 -2.736 -14.622 -3.643 1.00 0.00 O ATOM 0 H SER A 56 -3.507 -11.915 -2.799 1.00 0.00 H new ATOM 0 HA SER A 56 -4.192 -13.231 -5.157 1.00 0.00 H new ATOM 0 HB2 SER A 56 -4.086 -13.978 -2.229 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.714 -15.131 -3.390 1.00 0.00 H new ATOM 0 HG SER A 56 -2.427 -15.359 -3.075 1.00 0.00 H new ATOM 321 N ASN A 57 -6.736 -12.649 -3.143 1.00 0.00 N ATOM 322 CA ASN A 57 -8.192 -12.623 -3.069 1.00 0.00 C ATOM 323 C ASN A 57 -8.781 -11.800 -4.211 1.00 0.00 C ATOM 324 O ASN A 57 -8.436 -10.635 -4.411 1.00 0.00 O ATOM 325 CB ASN A 57 -8.645 -12.048 -1.725 1.00 0.00 C ATOM 326 CG ASN A 57 -8.637 -13.087 -0.620 1.00 0.00 C ATOM 327 OD1 ASN A 57 -8.398 -14.269 -0.866 1.00 0.00 O ATOM 328 ND2 ASN A 57 -8.900 -12.649 0.606 1.00 0.00 N ATOM 0 H ASN A 57 -6.265 -12.255 -2.329 1.00 0.00 H new ATOM 0 HA ASN A 57 -8.553 -13.647 -3.159 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -7.991 -11.221 -1.448 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -9.650 -11.639 -1.828 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -8.909 -13.302 1.390 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -9.093 -11.660 0.764 1.00 0.00 H new ATOM 335 N PRO A 58 -9.691 -12.418 -4.978 1.00 0.00 N ATOM 336 CA PRO A 58 -10.348 -11.761 -6.112 1.00 0.00 C ATOM 337 C PRO A 58 -11.318 -10.671 -5.668 1.00 0.00 C ATOM 338 O PRO A 58 -12.097 -10.862 -4.736 1.00 0.00 O ATOM 339 CB PRO A 58 -11.103 -12.904 -6.795 1.00 0.00 C ATOM 340 CG PRO A 58 -11.337 -13.902 -5.715 1.00 0.00 C ATOM 341 CD PRO A 58 -10.149 -13.805 -4.797 1.00 0.00 C ATOM 0 HA PRO A 58 -9.633 -11.257 -6.762 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -12.043 -12.557 -7.224 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -10.520 -13.332 -7.610 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -12.262 -13.688 -5.180 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -11.432 -14.907 -6.126 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -10.424 -14.006 -3.761 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -9.374 -14.523 -5.066 1.00 0.00 H new ATOM 349 N GLY A 59 -11.265 -9.527 -6.344 1.00 0.00 N ATOM 350 CA GLY A 59 -12.145 -8.424 -6.004 1.00 0.00 C ATOM 351 C GLY A 59 -11.424 -7.313 -5.267 1.00 0.00 C ATOM 352 O GLY A 59 -11.709 -6.133 -5.473 1.00 0.00 O ATOM 0 H GLY A 59 -10.629 -9.345 -7.120 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -12.589 -8.023 -6.915 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -12.964 -8.794 -5.387 1.00 0.00 H new ATOM 356 N THR A 60 -10.487 -7.690 -4.402 1.00 0.00 N ATOM 357 CA THR A 60 -9.725 -6.718 -3.629 1.00 0.00 C ATOM 358 C THR A 60 -8.960 -5.767 -4.542 1.00 0.00 C ATOM 359 O THR A 60 -8.070 -6.185 -5.282 1.00 0.00 O ATOM 360 CB THR A 60 -8.730 -7.411 -2.679 1.00 0.00 C ATOM 361 OG1 THR A 60 -9.437 -8.235 -1.745 1.00 0.00 O ATOM 362 CG2 THR A 60 -7.896 -6.385 -1.927 1.00 0.00 C ATOM 0 H THR A 60 -10.238 -8.662 -4.220 1.00 0.00 H new ATOM 0 HA THR A 60 -10.444 -6.150 -3.039 1.00 0.00 H new ATOM 0 HB THR A 60 -8.062 -8.031 -3.277 1.00 0.00 H new ATOM 0 HG1 THR A 60 -8.797 -8.673 -1.146 1.00 0.00 H new ATOM 0 HG21 THR A 60 -7.201 -6.898 -1.262 1.00 0.00 H new ATOM 0 HG22 THR A 60 -7.337 -5.778 -2.639 1.00 0.00 H new ATOM 0 HG23 THR A 60 -8.552 -5.743 -1.340 1.00 0.00 H new ATOM 370 N GLN A 61 -9.313 -4.487 -4.484 1.00 0.00 N ATOM 371 CA GLN A 61 -8.658 -3.477 -5.307 1.00 0.00 C ATOM 372 C GLN A 61 -8.064 -2.371 -4.441 1.00 0.00 C ATOM 373 O GLN A 61 -8.367 -2.267 -3.253 1.00 0.00 O ATOM 374 CB GLN A 61 -9.651 -2.880 -6.306 1.00 0.00 C ATOM 375 CG GLN A 61 -10.825 -2.173 -5.648 1.00 0.00 C ATOM 376 CD GLN A 61 -12.047 -2.112 -6.544 1.00 0.00 C ATOM 377 OE1 GLN A 61 -12.614 -3.142 -6.911 1.00 0.00 O ATOM 378 NE2 GLN A 61 -12.458 -0.902 -6.903 1.00 0.00 N ATOM 0 H GLN A 61 -10.048 -4.125 -3.876 1.00 0.00 H new ATOM 0 HA GLN A 61 -7.848 -3.960 -5.854 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -9.126 -2.174 -6.949 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -10.030 -3.675 -6.948 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -11.083 -2.689 -4.723 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -10.528 -1.160 -5.376 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -11.958 -0.076 -6.575 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -13.274 -0.799 -7.506 1.00 0.00 H new ATOM 387 N VAL A 62 -7.214 -1.546 -5.045 1.00 0.00 N ATOM 388 CA VAL A 62 -6.577 -0.447 -4.330 1.00 0.00 C ATOM 389 C VAL A 62 -7.462 0.795 -4.328 1.00 0.00 C ATOM 390 O VAL A 62 -7.544 1.512 -5.326 1.00 0.00 O ATOM 391 CB VAL A 62 -5.212 -0.090 -4.949 1.00 0.00 C ATOM 392 CG1 VAL A 62 -4.616 1.130 -4.262 1.00 0.00 C ATOM 393 CG2 VAL A 62 -4.263 -1.276 -4.864 1.00 0.00 C ATOM 0 H VAL A 62 -6.951 -1.618 -6.028 1.00 0.00 H new ATOM 0 HA VAL A 62 -6.426 -0.783 -3.304 1.00 0.00 H new ATOM 0 HB VAL A 62 -5.362 0.153 -6.001 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -3.652 1.367 -4.713 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -5.290 1.979 -4.379 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -4.479 0.919 -3.201 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -3.304 -1.007 -5.306 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -4.117 -1.551 -3.819 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -4.687 -2.121 -5.406 1.00 0.00 H new ATOM 403 N TYR A 63 -8.122 1.043 -3.203 1.00 0.00 N ATOM 404 CA TYR A 63 -9.003 2.197 -3.072 1.00 0.00 C ATOM 405 C TYR A 63 -8.396 3.425 -3.744 1.00 0.00 C ATOM 406 O TYR A 63 -7.266 3.812 -3.448 1.00 0.00 O ATOM 407 CB TYR A 63 -9.276 2.492 -1.596 1.00 0.00 C ATOM 408 CG TYR A 63 -10.165 3.695 -1.373 1.00 0.00 C ATOM 409 CD1 TYR A 63 -11.490 3.691 -1.790 1.00 0.00 C ATOM 410 CD2 TYR A 63 -9.679 4.836 -0.747 1.00 0.00 C ATOM 411 CE1 TYR A 63 -12.306 4.788 -1.590 1.00 0.00 C ATOM 412 CE2 TYR A 63 -10.487 5.937 -0.541 1.00 0.00 C ATOM 413 CZ TYR A 63 -11.800 5.908 -0.964 1.00 0.00 C ATOM 414 OH TYR A 63 -12.608 7.003 -0.762 1.00 0.00 O ATOM 0 H TYR A 63 -8.064 0.460 -2.368 1.00 0.00 H new ATOM 0 HA TYR A 63 -9.944 1.962 -3.569 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -9.740 1.618 -1.139 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -8.327 2.652 -1.085 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -11.889 2.815 -2.279 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -8.651 4.863 -0.416 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -13.334 4.769 -1.922 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -10.093 6.816 -0.052 1.00 0.00 H new ATOM 0 HH TYR A 63 -12.099 7.706 -0.307 1.00 0.00 H new ATOM 424 N GLU A 64 -9.156 4.033 -4.649 1.00 0.00 N ATOM 425 CA GLU A 64 -8.693 5.217 -5.363 1.00 0.00 C ATOM 426 C GLU A 64 -7.229 5.071 -5.767 1.00 0.00 C ATOM 427 O GLU A 64 -6.777 3.981 -6.121 1.00 0.00 O ATOM 428 CB GLU A 64 -8.872 6.465 -4.496 1.00 0.00 C ATOM 429 CG GLU A 64 -10.230 6.547 -3.820 1.00 0.00 C ATOM 430 CD GLU A 64 -10.688 7.976 -3.601 1.00 0.00 C ATOM 431 OE1 GLU A 64 -10.164 8.630 -2.674 1.00 0.00 O ATOM 432 OE2 GLU A 64 -11.568 8.440 -4.355 1.00 0.00 O ATOM 0 H GLU A 64 -10.094 3.726 -4.905 1.00 0.00 H new ATOM 0 HA GLU A 64 -9.293 5.322 -6.267 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -8.094 6.481 -3.733 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -8.730 7.351 -5.115 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -10.967 6.023 -4.429 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -10.185 6.033 -2.860 1.00 0.00 H new ATOM 439 N ASP A 65 -6.493 6.176 -5.713 1.00 0.00 N ATOM 440 CA ASP A 65 -5.080 6.172 -6.073 1.00 0.00 C ATOM 441 C ASP A 65 -4.206 6.402 -4.844 1.00 0.00 C ATOM 442 O ASP A 65 -3.276 7.209 -4.873 1.00 0.00 O ATOM 443 CB ASP A 65 -4.796 7.246 -7.124 1.00 0.00 C ATOM 444 CG ASP A 65 -5.632 7.066 -8.376 1.00 0.00 C ATOM 445 OD1 ASP A 65 -6.710 6.442 -8.284 1.00 0.00 O ATOM 446 OD2 ASP A 65 -5.208 7.548 -9.447 1.00 0.00 O ATOM 0 H ASP A 65 -6.852 7.086 -5.423 1.00 0.00 H new ATOM 0 HA ASP A 65 -4.840 5.194 -6.490 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -4.993 8.229 -6.697 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -3.739 7.220 -7.389 1.00 0.00 H new ATOM 451 N TYR A 66 -4.511 5.688 -3.766 1.00 0.00 N ATOM 452 CA TYR A 66 -3.755 5.817 -2.525 1.00 0.00 C ATOM 453 C TYR A 66 -2.576 4.849 -2.503 1.00 0.00 C ATOM 454 O TYR A 66 -2.647 3.781 -1.896 1.00 0.00 O ATOM 455 CB TYR A 66 -4.663 5.560 -1.321 1.00 0.00 C ATOM 456 CG TYR A 66 -5.539 6.739 -0.961 1.00 0.00 C ATOM 457 CD1 TYR A 66 -5.013 7.845 -0.304 1.00 0.00 C ATOM 458 CD2 TYR A 66 -6.892 6.747 -1.276 1.00 0.00 C ATOM 459 CE1 TYR A 66 -5.809 8.924 0.028 1.00 0.00 C ATOM 460 CE2 TYR A 66 -7.695 7.822 -0.949 1.00 0.00 C ATOM 461 CZ TYR A 66 -7.149 8.908 -0.297 1.00 0.00 C ATOM 462 OH TYR A 66 -7.947 9.980 0.031 1.00 0.00 O ATOM 0 H TYR A 66 -5.276 5.014 -3.726 1.00 0.00 H new ATOM 0 HA TYR A 66 -3.368 6.834 -2.469 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -5.296 4.698 -1.532 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -4.047 5.300 -0.461 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -3.964 7.861 -0.049 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -7.323 5.898 -1.785 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -5.384 9.775 0.539 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -8.745 7.812 -1.202 1.00 0.00 H new ATOM 0 HH TYR A 66 -8.864 9.809 -0.270 1.00 0.00 H new ATOM 472 N ASN A 67 -1.491 5.233 -3.168 1.00 0.00 N ATOM 473 CA ASN A 67 -0.295 4.400 -3.226 1.00 0.00 C ATOM 474 C ASN A 67 0.914 5.215 -3.674 1.00 0.00 C ATOM 475 O ASN A 67 1.022 5.592 -4.842 1.00 0.00 O ATOM 476 CB ASN A 67 -0.513 3.223 -4.178 1.00 0.00 C ATOM 477 CG ASN A 67 0.792 2.628 -4.670 1.00 0.00 C ATOM 478 OD1 ASN A 67 1.664 2.274 -3.876 1.00 0.00 O ATOM 479 ND2 ASN A 67 0.932 2.515 -5.986 1.00 0.00 N ATOM 0 H ASN A 67 -1.415 6.115 -3.674 1.00 0.00 H new ATOM 0 HA ASN A 67 -0.101 4.016 -2.224 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -1.092 2.452 -3.671 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -1.103 3.555 -5.032 1.00 0.00 H new ATOM 0 HD21 ASN A 67 1.789 2.122 -6.376 1.00 0.00 H new ATOM 0 HD22 ASN A 67 0.183 2.821 -6.607 1.00 0.00 H new ATOM 486 N CYS A 68 1.820 5.482 -2.740 1.00 0.00 N ATOM 487 CA CYS A 68 3.022 6.253 -3.039 1.00 0.00 C ATOM 488 C CYS A 68 4.261 5.571 -2.468 1.00 0.00 C ATOM 489 O CYS A 68 4.219 4.992 -1.381 1.00 0.00 O ATOM 490 CB CYS A 68 2.898 7.669 -2.475 1.00 0.00 C ATOM 491 SG CYS A 68 2.503 7.729 -0.712 1.00 0.00 S ATOM 0 H CYS A 68 1.745 5.176 -1.770 1.00 0.00 H new ATOM 0 HA CYS A 68 3.128 6.310 -4.122 1.00 0.00 H new ATOM 0 HB2 CYS A 68 3.835 8.200 -2.645 1.00 0.00 H new ATOM 0 HB3 CYS A 68 2.125 8.202 -3.028 1.00 0.00 H new ATOM 0 HG CYS A 68 2.839 8.889 -0.231 1.00 0.00 H new ATOM 497 N THR A 69 5.363 5.642 -3.207 1.00 0.00 N ATOM 498 CA THR A 69 6.613 5.029 -2.776 1.00 0.00 C ATOM 499 C THR A 69 7.546 6.063 -2.155 1.00 0.00 C ATOM 500 O THR A 69 7.731 7.153 -2.698 1.00 0.00 O ATOM 501 CB THR A 69 7.336 4.341 -3.950 1.00 0.00 C ATOM 502 OG1 THR A 69 6.514 3.299 -4.488 1.00 0.00 O ATOM 503 CG2 THR A 69 8.669 3.763 -3.500 1.00 0.00 C ATOM 0 H THR A 69 5.415 6.118 -4.107 1.00 0.00 H new ATOM 0 HA THR A 69 6.356 4.279 -2.028 1.00 0.00 H new ATOM 0 HB THR A 69 7.525 5.088 -4.721 1.00 0.00 H new ATOM 0 HG1 THR A 69 6.980 2.868 -5.235 1.00 0.00 H new ATOM 0 HG21 THR A 69 9.161 3.282 -4.345 1.00 0.00 H new ATOM 0 HG22 THR A 69 9.303 4.564 -3.119 1.00 0.00 H new ATOM 0 HG23 THR A 69 8.500 3.028 -2.713 1.00 0.00 H new ATOM 511 N LEU A 70 8.133 5.714 -1.016 1.00 0.00 N ATOM 512 CA LEU A 70 9.049 6.612 -0.320 1.00 0.00 C ATOM 513 C LEU A 70 10.441 5.998 -0.219 1.00 0.00 C ATOM 514 O LEU A 70 10.586 4.784 -0.081 1.00 0.00 O ATOM 515 CB LEU A 70 8.517 6.932 1.078 1.00 0.00 C ATOM 516 CG LEU A 70 7.043 7.327 1.161 1.00 0.00 C ATOM 517 CD1 LEU A 70 6.673 7.713 2.585 1.00 0.00 C ATOM 518 CD2 LEU A 70 6.742 8.470 0.202 1.00 0.00 C ATOM 0 H LEU A 70 7.991 4.816 -0.554 1.00 0.00 H new ATOM 0 HA LEU A 70 9.120 7.535 -0.895 1.00 0.00 H new ATOM 0 HB2 LEU A 70 8.675 6.061 1.713 1.00 0.00 H new ATOM 0 HB3 LEU A 70 9.114 7.743 1.495 1.00 0.00 H new ATOM 0 HG LEU A 70 6.440 6.467 0.871 1.00 0.00 H new ATOM 0 HD11 LEU A 70 5.620 7.991 2.625 1.00 0.00 H new ATOM 0 HD12 LEU A 70 6.850 6.867 3.249 1.00 0.00 H new ATOM 0 HD13 LEU A 70 7.284 8.558 2.903 1.00 0.00 H new ATOM 0 HD21 LEU A 70 5.688 8.738 0.275 1.00 0.00 H new ATOM 0 HD22 LEU A 70 7.355 9.333 0.461 1.00 0.00 H new ATOM 0 HD23 LEU A 70 6.968 8.158 -0.818 1.00 0.00 H new ATOM 530 N ASN A 71 11.463 6.845 -0.286 1.00 0.00 N ATOM 531 CA ASN A 71 12.844 6.386 -0.200 1.00 0.00 C ATOM 532 C ASN A 71 13.611 7.165 0.864 1.00 0.00 C ATOM 533 O ASN A 71 13.327 8.335 1.116 1.00 0.00 O ATOM 534 CB ASN A 71 13.538 6.534 -1.556 1.00 0.00 C ATOM 535 CG ASN A 71 13.358 5.312 -2.434 1.00 0.00 C ATOM 536 OD1 ASN A 71 12.589 5.332 -3.396 1.00 0.00 O ATOM 537 ND2 ASN A 71 14.068 4.238 -2.107 1.00 0.00 N ATOM 0 H ASN A 71 11.360 7.853 -0.400 1.00 0.00 H new ATOM 0 HA ASN A 71 12.834 5.333 0.083 1.00 0.00 H new ATOM 0 HB2 ASN A 71 13.141 7.409 -2.070 1.00 0.00 H new ATOM 0 HB3 ASN A 71 14.602 6.712 -1.399 1.00 0.00 H new ATOM 0 HD21 ASN A 71 13.988 3.386 -2.661 1.00 0.00 H new ATOM 0 HD22 ASN A 71 14.693 4.266 -1.302 1.00 0.00 H new ATOM 544 N GLN A 72 14.585 6.506 1.485 1.00 0.00 N ATOM 545 CA GLN A 72 15.392 7.137 2.522 1.00 0.00 C ATOM 546 C GLN A 72 16.788 6.525 2.573 1.00 0.00 C ATOM 547 O GLN A 72 16.941 5.305 2.645 1.00 0.00 O ATOM 548 CB GLN A 72 14.711 6.996 3.885 1.00 0.00 C ATOM 549 CG GLN A 72 14.408 5.557 4.267 1.00 0.00 C ATOM 550 CD GLN A 72 14.175 5.385 5.756 1.00 0.00 C ATOM 551 OE1 GLN A 72 14.439 6.292 6.546 1.00 0.00 O ATOM 552 NE2 GLN A 72 13.678 4.218 6.147 1.00 0.00 N ATOM 0 H GLN A 72 14.834 5.537 1.288 1.00 0.00 H new ATOM 0 HA GLN A 72 15.487 8.195 2.279 1.00 0.00 H new ATOM 0 HB2 GLN A 72 15.350 7.439 4.649 1.00 0.00 H new ATOM 0 HB3 GLN A 72 13.781 7.565 3.878 1.00 0.00 H new ATOM 0 HG2 GLN A 72 13.526 5.219 3.724 1.00 0.00 H new ATOM 0 HG3 GLN A 72 15.237 4.921 3.957 1.00 0.00 H new ATOM 0 HE21 GLN A 72 13.474 3.494 5.458 1.00 0.00 H new ATOM 0 HE22 GLN A 72 13.500 4.045 7.136 1.00 0.00 H new ATOM 561 N THR A 73 17.806 7.380 2.534 1.00 0.00 N ATOM 562 CA THR A 73 19.189 6.923 2.574 1.00 0.00 C ATOM 563 C THR A 73 19.982 7.664 3.644 1.00 0.00 C ATOM 564 O THR A 73 19.602 8.755 4.068 1.00 0.00 O ATOM 565 CB THR A 73 19.883 7.115 1.212 1.00 0.00 C ATOM 566 OG1 THR A 73 19.599 8.420 0.696 1.00 0.00 O ATOM 567 CG2 THR A 73 19.424 6.060 0.217 1.00 0.00 C ATOM 0 H THR A 73 17.698 8.393 2.475 1.00 0.00 H new ATOM 0 HA THR A 73 19.164 5.860 2.815 1.00 0.00 H new ATOM 0 HB THR A 73 20.958 7.010 1.360 1.00 0.00 H new ATOM 0 HG1 THR A 73 20.045 8.534 -0.169 1.00 0.00 H new ATOM 0 HG21 THR A 73 19.928 6.216 -0.737 1.00 0.00 H new ATOM 0 HG22 THR A 73 19.669 5.069 0.599 1.00 0.00 H new ATOM 0 HG23 THR A 73 18.346 6.138 0.075 1.00 0.00 H new ATOM 575 N ASN A 74 21.086 7.064 4.078 1.00 0.00 N ATOM 576 CA ASN A 74 21.933 7.668 5.100 1.00 0.00 C ATOM 577 C ASN A 74 23.400 7.322 4.865 1.00 0.00 C ATOM 578 O ASN A 74 23.720 6.263 4.323 1.00 0.00 O ATOM 579 CB ASN A 74 21.503 7.198 6.491 1.00 0.00 C ATOM 580 CG ASN A 74 20.458 8.106 7.110 1.00 0.00 C ATOM 581 OD1 ASN A 74 20.782 9.010 7.880 1.00 0.00 O ATOM 582 ND2 ASN A 74 19.195 7.868 6.776 1.00 0.00 N ATOM 0 H ASN A 74 21.415 6.160 3.738 1.00 0.00 H new ATOM 0 HA ASN A 74 21.819 8.750 5.038 1.00 0.00 H new ATOM 0 HB2 ASN A 74 21.106 6.185 6.423 1.00 0.00 H new ATOM 0 HB3 ASN A 74 22.375 7.155 7.143 1.00 0.00 H new ATOM 0 HD21 ASN A 74 18.448 8.446 7.162 1.00 0.00 H new ATOM 0 HD22 ASN A 74 18.972 7.108 6.134 1.00 0.00 H new ATOM 589 N ILE A 75 24.288 8.221 5.276 1.00 0.00 N ATOM 590 CA ILE A 75 25.721 8.010 5.112 1.00 0.00 C ATOM 591 C ILE A 75 26.248 7.001 6.127 1.00 0.00 C ATOM 592 O ILE A 75 27.235 7.257 6.816 1.00 0.00 O ATOM 593 CB ILE A 75 26.505 9.327 5.260 1.00 0.00 C ATOM 594 CG1 ILE A 75 27.981 9.109 4.920 1.00 0.00 C ATOM 595 CG2 ILE A 75 26.356 9.877 6.671 1.00 0.00 C ATOM 596 CD1 ILE A 75 28.656 10.333 4.344 1.00 0.00 C ATOM 0 H ILE A 75 24.040 9.103 5.725 1.00 0.00 H new ATOM 0 HA ILE A 75 25.869 7.620 4.105 1.00 0.00 H new ATOM 0 HB ILE A 75 26.095 10.057 4.562 1.00 0.00 H new ATOM 0 HG12 ILE A 75 28.511 8.802 5.821 1.00 0.00 H new ATOM 0 HG13 ILE A 75 28.064 8.289 4.207 1.00 0.00 H new ATOM 0 HG21 ILE A 75 26.916 10.808 6.760 1.00 0.00 H new ATOM 0 HG22 ILE A 75 25.303 10.066 6.879 1.00 0.00 H new ATOM 0 HG23 ILE A 75 26.743 9.152 7.387 1.00 0.00 H new ATOM 0 HD11 ILE A 75 29.700 10.105 4.127 1.00 0.00 H new ATOM 0 HD12 ILE A 75 28.151 10.628 3.425 1.00 0.00 H new ATOM 0 HD13 ILE A 75 28.605 11.149 5.064 1.00 0.00 H new ATOM 608 N GLU A 76 25.583 5.853 6.212 1.00 0.00 N ATOM 609 CA GLU A 76 25.986 4.805 7.142 1.00 0.00 C ATOM 610 C GLU A 76 25.996 3.442 6.456 1.00 0.00 C ATOM 611 O GLU A 76 24.945 2.879 6.155 1.00 0.00 O ATOM 612 CB GLU A 76 25.044 4.774 8.348 1.00 0.00 C ATOM 613 CG GLU A 76 25.227 5.948 9.294 1.00 0.00 C ATOM 614 CD GLU A 76 24.203 5.962 10.412 1.00 0.00 C ATOM 615 OE1 GLU A 76 24.426 5.276 11.431 1.00 0.00 O ATOM 616 OE2 GLU A 76 23.177 6.661 10.267 1.00 0.00 O ATOM 0 H GLU A 76 24.764 5.625 5.649 1.00 0.00 H new ATOM 0 HA GLU A 76 26.997 5.027 7.484 1.00 0.00 H new ATOM 0 HB2 GLU A 76 24.013 4.762 7.993 1.00 0.00 H new ATOM 0 HB3 GLU A 76 25.203 3.847 8.898 1.00 0.00 H new ATOM 0 HG2 GLU A 76 26.228 5.911 9.724 1.00 0.00 H new ATOM 0 HG3 GLU A 76 25.157 6.878 8.730 1.00 0.00 H new ATOM 623 N ASN A 77 27.193 2.919 6.210 1.00 0.00 N ATOM 624 CA ASN A 77 27.342 1.623 5.558 1.00 0.00 C ATOM 625 C ASN A 77 26.357 1.480 4.401 1.00 0.00 C ATOM 626 O ASN A 77 25.768 0.419 4.203 1.00 0.00 O ATOM 627 CB ASN A 77 27.128 0.494 6.567 1.00 0.00 C ATOM 628 CG ASN A 77 27.571 -0.854 6.030 1.00 0.00 C ATOM 629 OD1 ASN A 77 26.773 -1.600 5.461 1.00 0.00 O ATOM 630 ND2 ASN A 77 28.848 -1.171 6.208 1.00 0.00 N ATOM 0 H ASN A 77 28.074 3.373 6.452 1.00 0.00 H new ATOM 0 HA ASN A 77 28.355 1.558 5.160 1.00 0.00 H new ATOM 0 HB2 ASN A 77 27.680 0.717 7.480 1.00 0.00 H new ATOM 0 HB3 ASN A 77 26.073 0.446 6.836 1.00 0.00 H new ATOM 0 HD21 ASN A 77 29.204 -2.064 5.867 1.00 0.00 H new ATOM 0 HD22 ASN A 77 29.473 -0.521 6.685 1.00 0.00 H new ATOM 637 N ASN A 78 26.185 2.557 3.641 1.00 0.00 N ATOM 638 CA ASN A 78 25.272 2.552 2.504 1.00 0.00 C ATOM 639 C ASN A 78 23.941 1.907 2.878 1.00 0.00 C ATOM 640 O ASN A 78 23.492 0.964 2.228 1.00 0.00 O ATOM 641 CB ASN A 78 25.899 1.806 1.324 1.00 0.00 C ATOM 642 CG ASN A 78 26.726 2.717 0.438 1.00 0.00 C ATOM 643 OD1 ASN A 78 27.938 2.843 0.618 1.00 0.00 O ATOM 644 ND2 ASN A 78 26.074 3.359 -0.524 1.00 0.00 N ATOM 0 H ASN A 78 26.666 3.444 3.792 1.00 0.00 H new ATOM 0 HA ASN A 78 25.086 3.586 2.215 1.00 0.00 H new ATOM 0 HB2 ASN A 78 26.529 1.000 1.701 1.00 0.00 H new ATOM 0 HB3 ASN A 78 25.111 1.343 0.730 1.00 0.00 H new ATOM 0 HD21 ASN A 78 26.578 3.987 -1.150 1.00 0.00 H new ATOM 0 HD22 ASN A 78 25.069 3.224 -0.637 1.00 0.00 H new ATOM 651 N ASN A 79 23.315 2.423 3.930 1.00 0.00 N ATOM 652 CA ASN A 79 22.035 1.898 4.392 1.00 0.00 C ATOM 653 C ASN A 79 20.875 2.579 3.670 1.00 0.00 C ATOM 654 O ASN A 79 20.662 3.782 3.813 1.00 0.00 O ATOM 655 CB ASN A 79 21.894 2.094 5.903 1.00 0.00 C ATOM 656 CG ASN A 79 22.447 0.922 6.691 1.00 0.00 C ATOM 657 OD1 ASN A 79 23.147 0.068 6.147 1.00 0.00 O ATOM 658 ND2 ASN A 79 22.134 0.877 7.981 1.00 0.00 N ATOM 0 H ASN A 79 23.673 3.204 4.479 1.00 0.00 H new ATOM 0 HA ASN A 79 22.006 0.832 4.166 1.00 0.00 H new ATOM 0 HB2 ASN A 79 22.414 3.005 6.199 1.00 0.00 H new ATOM 0 HB3 ASN A 79 20.842 2.232 6.152 1.00 0.00 H new ATOM 0 HD21 ASN A 79 22.477 0.113 8.563 1.00 0.00 H new ATOM 0 HD22 ASN A 79 21.551 1.607 8.390 1.00 0.00 H new ATOM 665 N ASN A 80 20.130 1.799 2.893 1.00 0.00 N ATOM 666 CA ASN A 80 18.992 2.326 2.149 1.00 0.00 C ATOM 667 C ASN A 80 17.736 1.503 2.419 1.00 0.00 C ATOM 668 O ASN A 80 17.762 0.274 2.364 1.00 0.00 O ATOM 669 CB ASN A 80 19.297 2.335 0.649 1.00 0.00 C ATOM 670 CG ASN A 80 20.652 2.940 0.338 1.00 0.00 C ATOM 671 OD1 ASN A 80 21.242 3.629 1.171 1.00 0.00 O ATOM 672 ND2 ASN A 80 21.151 2.686 -0.866 1.00 0.00 N ATOM 0 H ASN A 80 20.294 0.801 2.762 1.00 0.00 H new ATOM 0 HA ASN A 80 18.813 3.348 2.483 1.00 0.00 H new ATOM 0 HB2 ASN A 80 19.262 1.314 0.268 1.00 0.00 H new ATOM 0 HB3 ASN A 80 18.523 2.897 0.127 1.00 0.00 H new ATOM 0 HD21 ASN A 80 22.059 3.067 -1.133 1.00 0.00 H new ATOM 0 HD22 ASN A 80 20.627 2.110 -1.524 1.00 0.00 H new ATOM 679 N LYS A 81 16.637 2.190 2.711 1.00 0.00 N ATOM 680 CA LYS A 81 15.370 1.524 2.988 1.00 0.00 C ATOM 681 C LYS A 81 14.266 2.053 2.077 1.00 0.00 C ATOM 682 O LYS A 81 14.497 2.944 1.259 1.00 0.00 O ATOM 683 CB LYS A 81 14.975 1.724 4.454 1.00 0.00 C ATOM 684 CG LYS A 81 15.845 0.950 5.429 1.00 0.00 C ATOM 685 CD LYS A 81 15.142 0.743 6.760 1.00 0.00 C ATOM 686 CE LYS A 81 15.304 1.952 7.669 1.00 0.00 C ATOM 687 NZ LYS A 81 14.150 2.104 8.599 1.00 0.00 N ATOM 0 H LYS A 81 16.598 3.208 2.762 1.00 0.00 H new ATOM 0 HA LYS A 81 15.498 0.459 2.794 1.00 0.00 H new ATOM 0 HB2 LYS A 81 15.030 2.786 4.695 1.00 0.00 H new ATOM 0 HB3 LYS A 81 13.937 1.420 4.587 1.00 0.00 H new ATOM 0 HG2 LYS A 81 16.103 -0.018 4.999 1.00 0.00 H new ATOM 0 HG3 LYS A 81 16.780 1.487 5.590 1.00 0.00 H new ATOM 0 HD2 LYS A 81 14.082 0.555 6.588 1.00 0.00 H new ATOM 0 HD3 LYS A 81 15.546 -0.141 7.253 1.00 0.00 H new ATOM 0 HE2 LYS A 81 16.224 1.853 8.245 1.00 0.00 H new ATOM 0 HE3 LYS A 81 15.403 2.852 7.062 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 14.297 2.939 9.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 13.275 2.224 8.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 14.071 1.256 9.196 1.00 0.00 H new ATOM 701 N PHE A 82 13.067 1.500 2.225 1.00 0.00 N ATOM 702 CA PHE A 82 11.928 1.916 1.416 1.00 0.00 C ATOM 703 C PHE A 82 10.628 1.798 2.205 1.00 0.00 C ATOM 704 O PHE A 82 10.405 0.815 2.912 1.00 0.00 O ATOM 705 CB PHE A 82 11.844 1.071 0.143 1.00 0.00 C ATOM 706 CG PHE A 82 11.456 -0.357 0.396 1.00 0.00 C ATOM 707 CD1 PHE A 82 12.419 -1.310 0.684 1.00 0.00 C ATOM 708 CD2 PHE A 82 10.127 -0.748 0.346 1.00 0.00 C ATOM 709 CE1 PHE A 82 12.066 -2.626 0.918 1.00 0.00 C ATOM 710 CE2 PHE A 82 9.768 -2.061 0.579 1.00 0.00 C ATOM 711 CZ PHE A 82 10.738 -3.002 0.865 1.00 0.00 C ATOM 0 H PHE A 82 12.859 0.762 2.898 1.00 0.00 H new ATOM 0 HA PHE A 82 12.072 2.961 1.141 1.00 0.00 H new ATOM 0 HB2 PHE A 82 11.119 1.521 -0.535 1.00 0.00 H new ATOM 0 HB3 PHE A 82 12.810 1.093 -0.362 1.00 0.00 H new ATOM 0 HD1 PHE A 82 13.459 -1.021 0.726 1.00 0.00 H new ATOM 0 HD2 PHE A 82 9.364 -0.017 0.122 1.00 0.00 H new ATOM 0 HE1 PHE A 82 12.827 -3.359 1.142 1.00 0.00 H new ATOM 0 HE2 PHE A 82 8.729 -2.352 0.538 1.00 0.00 H new ATOM 0 HZ PHE A 82 10.459 -4.029 1.047 1.00 0.00 H new ATOM 721 N TYR A 83 9.773 2.807 2.080 1.00 0.00 N ATOM 722 CA TYR A 83 8.496 2.819 2.783 1.00 0.00 C ATOM 723 C TYR A 83 7.332 2.870 1.798 1.00 0.00 C ATOM 724 O TYR A 83 7.236 3.786 0.981 1.00 0.00 O ATOM 725 CB TYR A 83 8.425 4.013 3.736 1.00 0.00 C ATOM 726 CG TYR A 83 7.510 3.792 4.919 1.00 0.00 C ATOM 727 CD1 TYR A 83 6.202 3.361 4.739 1.00 0.00 C ATOM 728 CD2 TYR A 83 7.955 4.011 6.217 1.00 0.00 C ATOM 729 CE1 TYR A 83 5.362 3.158 5.817 1.00 0.00 C ATOM 730 CE2 TYR A 83 7.123 3.809 7.301 1.00 0.00 C ATOM 731 CZ TYR A 83 5.827 3.383 7.095 1.00 0.00 C ATOM 732 OH TYR A 83 4.994 3.181 8.172 1.00 0.00 O ATOM 0 H TYR A 83 9.941 3.628 1.498 1.00 0.00 H new ATOM 0 HA TYR A 83 8.420 1.897 3.360 1.00 0.00 H new ATOM 0 HB2 TYR A 83 9.428 4.236 4.100 1.00 0.00 H new ATOM 0 HB3 TYR A 83 8.085 4.888 3.183 1.00 0.00 H new ATOM 0 HD1 TYR A 83 5.835 3.181 3.739 1.00 0.00 H new ATOM 0 HD2 TYR A 83 8.969 4.345 6.381 1.00 0.00 H new ATOM 0 HE1 TYR A 83 4.347 2.825 5.659 1.00 0.00 H new ATOM 0 HE2 TYR A 83 7.485 3.983 8.304 1.00 0.00 H new ATOM 0 HH TYR A 83 4.143 2.807 7.862 1.00 0.00 H new ATOM 742 N ILE A 84 6.449 1.880 1.883 1.00 0.00 N ATOM 743 CA ILE A 84 5.291 1.813 1.001 1.00 0.00 C ATOM 744 C ILE A 84 3.991 1.901 1.794 1.00 0.00 C ATOM 745 O ILE A 84 3.847 1.268 2.840 1.00 0.00 O ATOM 746 CB ILE A 84 5.288 0.513 0.174 1.00 0.00 C ATOM 747 CG1 ILE A 84 6.531 0.447 -0.716 1.00 0.00 C ATOM 748 CG2 ILE A 84 4.023 0.424 -0.666 1.00 0.00 C ATOM 749 CD1 ILE A 84 6.684 -0.871 -1.442 1.00 0.00 C ATOM 0 H ILE A 84 6.514 1.114 2.553 1.00 0.00 H new ATOM 0 HA ILE A 84 5.360 2.664 0.324 1.00 0.00 H new ATOM 0 HB ILE A 84 5.308 -0.336 0.857 1.00 0.00 H new ATOM 0 HG12 ILE A 84 6.487 1.253 -1.448 1.00 0.00 H new ATOM 0 HG13 ILE A 84 7.416 0.620 -0.104 1.00 0.00 H new ATOM 0 HG21 ILE A 84 4.035 -0.500 -1.245 1.00 0.00 H new ATOM 0 HG22 ILE A 84 3.151 0.431 -0.012 1.00 0.00 H new ATOM 0 HG23 ILE A 84 3.976 1.276 -1.344 1.00 0.00 H new ATOM 0 HD11 ILE A 84 7.586 -0.847 -2.054 1.00 0.00 H new ATOM 0 HD12 ILE A 84 6.760 -1.680 -0.715 1.00 0.00 H new ATOM 0 HD13 ILE A 84 5.817 -1.037 -2.081 1.00 0.00 H new ATOM 761 N ILE A 85 3.048 2.687 1.287 1.00 0.00 N ATOM 762 CA ILE A 85 1.759 2.855 1.947 1.00 0.00 C ATOM 763 C ILE A 85 0.619 2.861 0.933 1.00 0.00 C ATOM 764 O ILE A 85 0.465 3.810 0.164 1.00 0.00 O ATOM 765 CB ILE A 85 1.710 4.159 2.764 1.00 0.00 C ATOM 766 CG1 ILE A 85 2.792 4.149 3.847 1.00 0.00 C ATOM 767 CG2 ILE A 85 0.334 4.345 3.385 1.00 0.00 C ATOM 768 CD1 ILE A 85 3.023 5.502 4.483 1.00 0.00 C ATOM 0 H ILE A 85 3.152 3.217 0.422 1.00 0.00 H new ATOM 0 HA ILE A 85 1.638 2.008 2.622 1.00 0.00 H new ATOM 0 HB ILE A 85 1.900 4.997 2.094 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.512 3.435 4.622 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.727 3.797 3.412 1.00 0.00 H new ATOM 0 HG21 ILE A 85 0.316 5.271 3.959 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -0.418 4.392 2.597 1.00 0.00 H new ATOM 0 HG23 ILE A 85 0.116 3.505 4.045 1.00 0.00 H new ATOM 0 HD11 ILE A 85 3.802 5.420 5.241 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.333 6.215 3.719 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.100 5.848 4.948 1.00 0.00 H new ATOM 780 N GLN A 86 -0.177 1.797 0.939 1.00 0.00 N ATOM 781 CA GLN A 86 -1.303 1.681 0.020 1.00 0.00 C ATOM 782 C GLN A 86 -2.602 1.435 0.780 1.00 0.00 C ATOM 783 O GLN A 86 -2.614 0.758 1.809 1.00 0.00 O ATOM 784 CB GLN A 86 -1.060 0.547 -0.977 1.00 0.00 C ATOM 785 CG GLN A 86 0.248 0.679 -1.741 1.00 0.00 C ATOM 786 CD GLN A 86 0.569 -0.552 -2.565 1.00 0.00 C ATOM 787 OE1 GLN A 86 1.483 -1.310 -2.240 1.00 0.00 O ATOM 788 NE2 GLN A 86 -0.183 -0.758 -3.640 1.00 0.00 N ATOM 0 H GLN A 86 -0.063 1.003 1.570 1.00 0.00 H new ATOM 0 HA GLN A 86 -1.394 2.621 -0.524 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -1.065 -0.403 -0.442 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -1.885 0.517 -1.688 1.00 0.00 H new ATOM 0 HG2 GLN A 86 0.195 1.547 -2.398 1.00 0.00 H new ATOM 0 HG3 GLN A 86 1.059 0.862 -1.036 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -0.930 -0.104 -3.872 1.00 0.00 H new ATOM 0 HE22 GLN A 86 -0.013 -1.570 -4.233 1.00 0.00 H new ATOM 797 N LEU A 87 -3.695 1.991 0.268 1.00 0.00 N ATOM 798 CA LEU A 87 -5.001 1.832 0.899 1.00 0.00 C ATOM 799 C LEU A 87 -5.894 0.908 0.078 1.00 0.00 C ATOM 800 O LEU A 87 -6.282 1.237 -1.044 1.00 0.00 O ATOM 801 CB LEU A 87 -5.676 3.194 1.068 1.00 0.00 C ATOM 802 CG LEU A 87 -6.665 3.314 2.228 1.00 0.00 C ATOM 803 CD1 LEU A 87 -6.697 4.740 2.757 1.00 0.00 C ATOM 804 CD2 LEU A 87 -8.055 2.873 1.793 1.00 0.00 C ATOM 0 H LEU A 87 -3.703 2.555 -0.582 1.00 0.00 H new ATOM 0 HA LEU A 87 -4.850 1.383 1.881 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.900 3.948 1.199 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -6.201 3.434 0.143 1.00 0.00 H new ATOM 0 HG LEU A 87 -6.333 2.657 3.032 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -7.406 4.806 3.582 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.704 5.020 3.109 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -7.004 5.417 1.960 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -8.745 2.965 2.632 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.396 3.503 0.971 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.021 1.834 1.464 1.00 0.00 H new ATOM 816 N LEU A 88 -6.218 -0.250 0.644 1.00 0.00 N ATOM 817 CA LEU A 88 -7.068 -1.222 -0.035 1.00 0.00 C ATOM 818 C LEU A 88 -8.496 -1.162 0.497 1.00 0.00 C ATOM 819 O LEU A 88 -8.759 -0.539 1.525 1.00 0.00 O ATOM 820 CB LEU A 88 -6.504 -2.633 0.142 1.00 0.00 C ATOM 821 CG LEU A 88 -5.014 -2.803 -0.159 1.00 0.00 C ATOM 822 CD1 LEU A 88 -4.535 -4.177 0.282 1.00 0.00 C ATOM 823 CD2 LEU A 88 -4.742 -2.591 -1.641 1.00 0.00 C ATOM 0 H LEU A 88 -5.905 -0.538 1.571 1.00 0.00 H new ATOM 0 HA LEU A 88 -7.085 -0.975 -1.096 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -6.685 -2.949 1.169 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -7.064 -3.310 -0.503 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.460 -2.050 0.402 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -3.473 -4.281 0.060 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.695 -4.291 1.354 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -5.094 -4.946 -0.252 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -3.677 -2.716 -1.837 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.306 -3.320 -2.222 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -5.048 -1.585 -1.927 1.00 0.00 H new ATOM 835 N GLN A 89 -9.413 -1.816 -0.208 1.00 0.00 N ATOM 836 CA GLN A 89 -10.814 -1.838 0.195 1.00 0.00 C ATOM 837 C GLN A 89 -11.490 -3.128 -0.259 1.00 0.00 C ATOM 838 O GLN A 89 -11.559 -3.418 -1.453 1.00 0.00 O ATOM 839 CB GLN A 89 -11.552 -0.630 -0.385 1.00 0.00 C ATOM 840 CG GLN A 89 -13.031 -0.597 -0.036 1.00 0.00 C ATOM 841 CD GLN A 89 -13.830 0.293 -0.968 1.00 0.00 C ATOM 842 OE1 GLN A 89 -13.273 0.945 -1.852 1.00 0.00 O ATOM 843 NE2 GLN A 89 -15.144 0.324 -0.775 1.00 0.00 N ATOM 0 H GLN A 89 -9.211 -2.338 -1.061 1.00 0.00 H new ATOM 0 HA GLN A 89 -10.854 -1.791 1.283 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -11.081 0.283 -0.021 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -11.443 -0.634 -1.470 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -13.432 -1.610 -0.074 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -13.151 -0.245 0.989 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -15.563 -0.233 -0.030 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -15.734 0.904 -1.372 1.00 0.00 H new ATOM 852 N ASP A 90 -11.988 -3.898 0.702 1.00 0.00 N ATOM 853 CA ASP A 90 -12.661 -5.157 0.402 1.00 0.00 C ATOM 854 C ASP A 90 -14.158 -4.940 0.205 1.00 0.00 C ATOM 855 O ASP A 90 -14.686 -3.871 0.513 1.00 0.00 O ATOM 856 CB ASP A 90 -12.422 -6.168 1.525 1.00 0.00 C ATOM 857 CG ASP A 90 -13.096 -5.763 2.821 1.00 0.00 C ATOM 858 OD1 ASP A 90 -14.123 -5.054 2.760 1.00 0.00 O ATOM 859 OD2 ASP A 90 -12.596 -6.155 3.896 1.00 0.00 O ATOM 0 H ASP A 90 -11.939 -3.673 1.696 1.00 0.00 H new ATOM 0 HA ASP A 90 -12.245 -5.551 -0.525 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -12.793 -7.145 1.216 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -11.350 -6.273 1.694 1.00 0.00 H new ATOM 864 N SER A 91 -14.836 -5.961 -0.309 1.00 0.00 N ATOM 865 CA SER A 91 -16.272 -5.880 -0.552 1.00 0.00 C ATOM 866 C SER A 91 -17.044 -5.857 0.764 1.00 0.00 C ATOM 867 O SER A 91 -18.263 -5.693 0.778 1.00 0.00 O ATOM 868 CB SER A 91 -16.733 -7.062 -1.407 1.00 0.00 C ATOM 869 OG SER A 91 -16.070 -7.075 -2.659 1.00 0.00 O ATOM 0 H SER A 91 -14.414 -6.854 -0.565 1.00 0.00 H new ATOM 0 HA SER A 91 -16.474 -4.953 -1.088 1.00 0.00 H new ATOM 0 HB2 SER A 91 -16.537 -7.995 -0.879 1.00 0.00 H new ATOM 0 HB3 SER A 91 -17.810 -7.004 -1.563 1.00 0.00 H new ATOM 0 HG SER A 91 -16.381 -7.841 -3.186 1.00 0.00 H new ATOM 875 N ASN A 92 -16.324 -6.023 1.869 1.00 0.00 N ATOM 876 CA ASN A 92 -16.940 -6.022 3.190 1.00 0.00 C ATOM 877 C ASN A 92 -16.884 -4.632 3.816 1.00 0.00 C ATOM 878 O ASN A 92 -16.685 -4.490 5.022 1.00 0.00 O ATOM 879 CB ASN A 92 -16.242 -7.033 4.102 1.00 0.00 C ATOM 880 CG ASN A 92 -16.793 -8.436 3.939 1.00 0.00 C ATOM 881 OD1 ASN A 92 -17.588 -8.702 3.038 1.00 0.00 O ATOM 882 ND2 ASN A 92 -16.371 -9.342 4.813 1.00 0.00 N ATOM 0 H ASN A 92 -15.313 -6.160 1.875 1.00 0.00 H new ATOM 0 HA ASN A 92 -17.986 -6.307 3.076 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -15.174 -7.038 3.884 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -16.354 -6.720 5.140 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -16.707 -10.303 4.753 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -15.711 -9.077 5.544 1.00 0.00 H new ATOM 889 N ARG A 93 -17.061 -3.608 2.987 1.00 0.00 N ATOM 890 CA ARG A 93 -17.030 -2.229 3.458 1.00 0.00 C ATOM 891 C ARG A 93 -15.945 -2.039 4.514 1.00 0.00 C ATOM 892 O ARG A 93 -16.130 -1.306 5.485 1.00 0.00 O ATOM 893 CB ARG A 93 -18.391 -1.833 4.034 1.00 0.00 C ATOM 894 CG ARG A 93 -19.553 -2.103 3.092 1.00 0.00 C ATOM 895 CD ARG A 93 -20.834 -2.397 3.856 1.00 0.00 C ATOM 896 NE ARG A 93 -21.865 -2.971 2.996 1.00 0.00 N ATOM 897 CZ ARG A 93 -22.889 -3.684 3.452 1.00 0.00 C ATOM 898 NH1 ARG A 93 -23.018 -3.909 4.752 1.00 0.00 N ATOM 899 NH2 ARG A 93 -23.787 -4.173 2.606 1.00 0.00 N ATOM 0 H ARG A 93 -17.227 -3.708 1.986 1.00 0.00 H new ATOM 0 HA ARG A 93 -16.802 -1.587 2.607 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -18.555 -2.377 4.964 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -18.376 -0.772 4.284 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -19.705 -1.240 2.444 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -19.311 -2.948 2.447 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -20.619 -3.086 4.673 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -21.208 -1.477 4.305 1.00 0.00 H new ATOM 0 HE ARG A 93 -21.795 -2.816 1.990 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -22.330 -3.534 5.405 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -23.805 -4.457 5.099 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -23.691 -4.001 1.605 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -24.573 -4.720 2.957 1.00 0.00 H new ATOM 913 N PHE A 94 -14.812 -2.706 4.317 1.00 0.00 N ATOM 914 CA PHE A 94 -13.697 -2.613 5.252 1.00 0.00 C ATOM 915 C PHE A 94 -12.388 -2.352 4.513 1.00 0.00 C ATOM 916 O PHE A 94 -11.997 -3.116 3.630 1.00 0.00 O ATOM 917 CB PHE A 94 -13.585 -3.898 6.074 1.00 0.00 C ATOM 918 CG PHE A 94 -14.816 -4.207 6.876 1.00 0.00 C ATOM 919 CD1 PHE A 94 -15.533 -3.191 7.488 1.00 0.00 C ATOM 920 CD2 PHE A 94 -15.257 -5.513 7.019 1.00 0.00 C ATOM 921 CE1 PHE A 94 -16.668 -3.472 8.227 1.00 0.00 C ATOM 922 CE2 PHE A 94 -16.391 -5.799 7.756 1.00 0.00 C ATOM 923 CZ PHE A 94 -17.096 -4.778 8.362 1.00 0.00 C ATOM 0 H PHE A 94 -14.642 -3.317 3.518 1.00 0.00 H new ATOM 0 HA PHE A 94 -13.887 -1.776 5.924 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -13.380 -4.732 5.403 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -12.733 -3.815 6.749 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -15.202 -2.168 7.387 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -14.709 -6.316 6.549 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -17.219 -2.671 8.698 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -16.726 -6.821 7.858 1.00 0.00 H new ATOM 0 HZ PHE A 94 -17.980 -5.000 8.940 1.00 0.00 H new ATOM 933 N PHE A 95 -11.715 -1.267 4.880 1.00 0.00 N ATOM 934 CA PHE A 95 -10.450 -0.903 4.252 1.00 0.00 C ATOM 935 C PHE A 95 -9.270 -1.450 5.049 1.00 0.00 C ATOM 936 O PHE A 95 -9.377 -1.697 6.250 1.00 0.00 O ATOM 937 CB PHE A 95 -10.336 0.618 4.130 1.00 0.00 C ATOM 938 CG PHE A 95 -11.443 1.240 3.327 1.00 0.00 C ATOM 939 CD1 PHE A 95 -12.720 1.351 3.853 1.00 0.00 C ATOM 940 CD2 PHE A 95 -11.206 1.713 2.046 1.00 0.00 C ATOM 941 CE1 PHE A 95 -13.740 1.923 3.117 1.00 0.00 C ATOM 942 CE2 PHE A 95 -12.222 2.286 1.306 1.00 0.00 C ATOM 943 CZ PHE A 95 -13.491 2.390 1.841 1.00 0.00 C ATOM 0 H PHE A 95 -12.024 -0.624 5.609 1.00 0.00 H new ATOM 0 HA PHE A 95 -10.428 -1.343 3.255 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -10.332 1.055 5.128 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -9.380 0.867 3.670 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -12.920 0.986 4.850 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.216 1.633 1.622 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -14.731 2.005 3.539 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -12.024 2.652 0.310 1.00 0.00 H new ATOM 0 HZ PHE A 95 -14.287 2.836 1.263 1.00 0.00 H new ATOM 953 N THR A 96 -8.142 -1.639 4.370 1.00 0.00 N ATOM 954 CA THR A 96 -6.941 -2.159 5.012 1.00 0.00 C ATOM 955 C THR A 96 -5.719 -1.324 4.650 1.00 0.00 C ATOM 956 O THR A 96 -5.536 -0.943 3.493 1.00 0.00 O ATOM 957 CB THR A 96 -6.683 -3.625 4.618 1.00 0.00 C ATOM 958 OG1 THR A 96 -7.864 -4.406 4.832 1.00 0.00 O ATOM 959 CG2 THR A 96 -5.531 -4.208 5.422 1.00 0.00 C ATOM 0 H THR A 96 -8.036 -1.440 3.375 1.00 0.00 H new ATOM 0 HA THR A 96 -7.109 -2.104 6.088 1.00 0.00 H new ATOM 0 HB THR A 96 -6.417 -3.651 3.561 1.00 0.00 H new ATOM 0 HG1 THR A 96 -7.799 -4.868 5.694 1.00 0.00 H new ATOM 0 HG21 THR A 96 -5.368 -5.244 5.126 1.00 0.00 H new ATOM 0 HG22 THR A 96 -4.626 -3.630 5.233 1.00 0.00 H new ATOM 0 HG23 THR A 96 -5.772 -4.168 6.484 1.00 0.00 H new ATOM 967 N CYS A 97 -4.883 -1.044 5.645 1.00 0.00 N ATOM 968 CA CYS A 97 -3.677 -0.254 5.430 1.00 0.00 C ATOM 969 C CYS A 97 -2.450 -1.154 5.316 1.00 0.00 C ATOM 970 O CYS A 97 -1.936 -1.648 6.319 1.00 0.00 O ATOM 971 CB CYS A 97 -3.486 0.745 6.572 1.00 0.00 C ATOM 972 SG CYS A 97 -4.304 2.335 6.306 1.00 0.00 S ATOM 0 H CYS A 97 -5.019 -1.353 6.608 1.00 0.00 H new ATOM 0 HA CYS A 97 -3.793 0.292 4.494 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -3.865 0.303 7.494 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -2.419 0.917 6.716 1.00 0.00 H new ATOM 0 HG CYS A 97 -5.112 2.578 7.295 1.00 0.00 H new ATOM 978 N TRP A 98 -1.989 -1.362 4.088 1.00 0.00 N ATOM 979 CA TRP A 98 -0.824 -2.205 3.843 1.00 0.00 C ATOM 980 C TRP A 98 0.465 -1.400 3.964 1.00 0.00 C ATOM 981 O TRP A 98 0.716 -0.490 3.175 1.00 0.00 O ATOM 982 CB TRP A 98 -0.913 -2.842 2.455 1.00 0.00 C ATOM 983 CG TRP A 98 0.323 -3.596 2.067 1.00 0.00 C ATOM 984 CD1 TRP A 98 1.184 -3.292 1.052 1.00 0.00 C ATOM 985 CD2 TRP A 98 0.835 -4.780 2.688 1.00 0.00 C ATOM 986 NE1 TRP A 98 2.200 -4.216 1.004 1.00 0.00 N ATOM 987 CE2 TRP A 98 2.009 -5.139 1.998 1.00 0.00 C ATOM 988 CE3 TRP A 98 0.416 -5.572 3.761 1.00 0.00 C ATOM 989 CZ2 TRP A 98 2.766 -6.254 2.346 1.00 0.00 C ATOM 990 CZ3 TRP A 98 1.168 -6.679 4.106 1.00 0.00 C ATOM 991 CH2 TRP A 98 2.333 -7.011 3.401 1.00 0.00 C ATOM 0 H TRP A 98 -2.403 -0.959 3.247 1.00 0.00 H new ATOM 0 HA TRP A 98 -0.811 -2.992 4.597 1.00 0.00 H new ATOM 0 HB2 TRP A 98 -1.767 -3.519 2.428 1.00 0.00 H new ATOM 0 HB3 TRP A 98 -1.101 -2.062 1.717 1.00 0.00 H new ATOM 0 HD1 TRP A 98 1.082 -2.449 0.385 1.00 0.00 H new ATOM 0 HE1 TRP A 98 2.971 -4.215 0.336 1.00 0.00 H new ATOM 0 HE3 TRP A 98 -0.480 -5.323 4.311 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 3.663 -6.513 1.803 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 0.853 -7.299 4.933 1.00 0.00 H new ATOM 0 HH2 TRP A 98 2.900 -7.881 3.696 1.00 0.00 H new ATOM 1002 N ASN A 99 1.280 -1.741 4.958 1.00 0.00 N ATOM 1003 CA ASN A 99 2.544 -1.049 5.182 1.00 0.00 C ATOM 1004 C ASN A 99 3.715 -2.025 5.132 1.00 0.00 C ATOM 1005 O ASN A 99 3.814 -2.934 5.956 1.00 0.00 O ATOM 1006 CB ASN A 99 2.522 -0.329 6.532 1.00 0.00 C ATOM 1007 CG ASN A 99 1.911 1.056 6.440 1.00 0.00 C ATOM 1008 OD1 ASN A 99 2.500 2.038 6.893 1.00 0.00 O ATOM 1009 ND2 ASN A 99 0.724 1.140 5.851 1.00 0.00 N ATOM 0 H ASN A 99 1.087 -2.492 5.621 1.00 0.00 H new ATOM 0 HA ASN A 99 2.673 -0.314 4.388 1.00 0.00 H new ATOM 0 HB2 ASN A 99 1.958 -0.925 7.249 1.00 0.00 H new ATOM 0 HB3 ASN A 99 3.540 -0.249 6.915 1.00 0.00 H new ATOM 0 HD21 ASN A 99 0.263 2.045 5.759 1.00 0.00 H new ATOM 0 HD22 ASN A 99 0.273 0.299 5.490 1.00 0.00 H new ATOM 1016 N ARG A 100 4.600 -1.829 4.160 1.00 0.00 N ATOM 1017 CA ARG A 100 5.764 -2.692 4.002 1.00 0.00 C ATOM 1018 C ARG A 100 7.045 -1.867 3.912 1.00 0.00 C ATOM 1019 O ARG A 100 7.208 -1.054 3.002 1.00 0.00 O ATOM 1020 CB ARG A 100 5.616 -3.561 2.751 1.00 0.00 C ATOM 1021 CG ARG A 100 6.863 -4.362 2.415 1.00 0.00 C ATOM 1022 CD ARG A 100 6.572 -5.436 1.378 1.00 0.00 C ATOM 1023 NE ARG A 100 6.594 -4.905 0.018 1.00 0.00 N ATOM 1024 CZ ARG A 100 7.702 -4.775 -0.702 1.00 0.00 C ATOM 1025 NH1 ARG A 100 8.873 -5.136 -0.194 1.00 0.00 N ATOM 1026 NH2 ARG A 100 7.642 -4.283 -1.933 1.00 0.00 N ATOM 0 H ARG A 100 4.533 -1.080 3.470 1.00 0.00 H new ATOM 0 HA ARG A 100 5.828 -3.337 4.879 1.00 0.00 H new ATOM 0 HB2 ARG A 100 4.781 -4.247 2.892 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.365 -2.923 1.904 1.00 0.00 H new ATOM 0 HG2 ARG A 100 7.637 -3.692 2.040 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.254 -4.825 3.321 1.00 0.00 H new ATOM 0 HD2 ARG A 100 7.308 -6.235 1.467 1.00 0.00 H new ATOM 0 HD3 ARG A 100 5.596 -5.878 1.579 1.00 0.00 H new ATOM 0 HE ARG A 100 5.710 -4.618 -0.402 1.00 0.00 H new ATOM 0 HH11 ARG A 100 8.924 -5.515 0.752 1.00 0.00 H new ATOM 0 HH12 ARG A 100 9.723 -5.035 -0.749 1.00 0.00 H new ATOM 0 HH21 ARG A 100 6.744 -4.004 -2.327 1.00 0.00 H new ATOM 0 HH22 ARG A 100 8.494 -4.184 -2.485 1.00 0.00 H new ATOM 1040 N TRP A 101 7.948 -2.082 4.861 1.00 0.00 N ATOM 1041 CA TRP A 101 9.214 -1.357 4.889 1.00 0.00 C ATOM 1042 C TRP A 101 10.389 -2.319 5.026 1.00 0.00 C ATOM 1043 O TRP A 101 10.212 -3.484 5.381 1.00 0.00 O ATOM 1044 CB TRP A 101 9.224 -0.353 6.043 1.00 0.00 C ATOM 1045 CG TRP A 101 9.179 -0.999 7.394 1.00 0.00 C ATOM 1046 CD1 TRP A 101 10.235 -1.508 8.095 1.00 0.00 C ATOM 1047 CD2 TRP A 101 8.018 -1.208 8.205 1.00 0.00 C ATOM 1048 NE1 TRP A 101 9.800 -2.020 9.294 1.00 0.00 N ATOM 1049 CE2 TRP A 101 8.444 -1.848 9.386 1.00 0.00 C ATOM 1050 CE3 TRP A 101 6.660 -0.916 8.051 1.00 0.00 C ATOM 1051 CZ2 TRP A 101 7.560 -2.200 10.402 1.00 0.00 C ATOM 1052 CZ3 TRP A 101 5.784 -1.266 9.060 1.00 0.00 C ATOM 1053 CH2 TRP A 101 6.236 -1.902 10.224 1.00 0.00 C ATOM 0 H TRP A 101 7.828 -2.752 5.621 1.00 0.00 H new ATOM 0 HA TRP A 101 9.317 -0.819 3.947 1.00 0.00 H new ATOM 0 HB2 TRP A 101 10.121 0.262 5.972 1.00 0.00 H new ATOM 0 HB3 TRP A 101 8.370 0.316 5.940 1.00 0.00 H new ATOM 0 HD1 TRP A 101 11.261 -1.508 7.757 1.00 0.00 H new ATOM 0 HE1 TRP A 101 10.391 -2.457 10.001 1.00 0.00 H new ATOM 0 HE3 TRP A 101 6.302 -0.425 7.158 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 7.907 -2.691 11.299 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 4.732 -1.046 8.950 1.00 0.00 H new ATOM 0 HH2 TRP A 101 5.526 -2.162 10.995 1.00 0.00 H new ATOM 1064 N GLY A 102 11.590 -1.824 4.742 1.00 0.00 N ATOM 1065 CA GLY A 102 12.776 -2.654 4.839 1.00 0.00 C ATOM 1066 C GLY A 102 13.906 -2.157 3.959 1.00 0.00 C ATOM 1067 O GLY A 102 13.848 -1.045 3.433 1.00 0.00 O ATOM 0 H GLY A 102 11.762 -0.863 4.447 1.00 0.00 H new ATOM 0 HA2 GLY A 102 13.112 -2.682 5.875 1.00 0.00 H new ATOM 0 HA3 GLY A 102 12.524 -3.677 4.558 1.00 0.00 H new ATOM 1071 N ARG A 103 14.937 -2.980 3.801 1.00 0.00 N ATOM 1072 CA ARG A 103 16.086 -2.616 2.981 1.00 0.00 C ATOM 1073 C ARG A 103 15.715 -2.600 1.501 1.00 0.00 C ATOM 1074 O ARG A 103 15.019 -3.491 1.015 1.00 0.00 O ATOM 1075 CB ARG A 103 17.239 -3.593 3.219 1.00 0.00 C ATOM 1076 CG ARG A 103 18.175 -3.171 4.340 1.00 0.00 C ATOM 1077 CD ARG A 103 19.327 -4.151 4.502 1.00 0.00 C ATOM 1078 NE ARG A 103 18.933 -5.337 5.257 1.00 0.00 N ATOM 1079 CZ ARG A 103 19.798 -6.142 5.864 1.00 0.00 C ATOM 1080 NH1 ARG A 103 21.098 -5.889 5.806 1.00 0.00 N ATOM 1081 NH2 ARG A 103 19.363 -7.203 6.532 1.00 0.00 N ATOM 0 H ARG A 103 15.000 -3.903 4.230 1.00 0.00 H new ATOM 0 HA ARG A 103 16.403 -1.614 3.269 1.00 0.00 H new ATOM 0 HB2 ARG A 103 16.829 -4.576 3.451 1.00 0.00 H new ATOM 0 HB3 ARG A 103 17.813 -3.696 2.298 1.00 0.00 H new ATOM 0 HG2 ARG A 103 18.569 -2.176 4.132 1.00 0.00 H new ATOM 0 HG3 ARG A 103 17.618 -3.104 5.275 1.00 0.00 H new ATOM 0 HD2 ARG A 103 19.689 -4.451 3.519 1.00 0.00 H new ATOM 0 HD3 ARG A 103 20.155 -3.656 5.010 1.00 0.00 H new ATOM 0 HE ARG A 103 17.940 -5.559 5.322 1.00 0.00 H new ATOM 0 HH11 ARG A 103 21.437 -5.074 5.294 1.00 0.00 H new ATOM 0 HH12 ARG A 103 21.760 -6.509 6.273 1.00 0.00 H new ATOM 0 HH21 ARG A 103 18.364 -7.401 6.580 1.00 0.00 H new ATOM 0 HH22 ARG A 103 20.028 -7.820 6.998 1.00 0.00 H new ATOM 1095 N VAL A 104 16.185 -1.580 0.790 1.00 0.00 N ATOM 1096 CA VAL A 104 15.903 -1.447 -0.635 1.00 0.00 C ATOM 1097 C VAL A 104 16.313 -2.704 -1.395 1.00 0.00 C ATOM 1098 O VAL A 104 17.479 -3.095 -1.387 1.00 0.00 O ATOM 1099 CB VAL A 104 16.633 -0.234 -1.240 1.00 0.00 C ATOM 1100 CG1 VAL A 104 16.381 -0.152 -2.738 1.00 0.00 C ATOM 1101 CG2 VAL A 104 16.198 1.049 -0.548 1.00 0.00 C ATOM 0 H VAL A 104 16.763 -0.834 1.177 1.00 0.00 H new ATOM 0 HA VAL A 104 14.827 -1.300 -0.733 1.00 0.00 H new ATOM 0 HB VAL A 104 17.704 -0.361 -1.082 1.00 0.00 H new ATOM 0 HG11 VAL A 104 16.905 0.711 -3.148 1.00 0.00 H new ATOM 0 HG12 VAL A 104 16.746 -1.060 -3.219 1.00 0.00 H new ATOM 0 HG13 VAL A 104 15.312 -0.049 -2.922 1.00 0.00 H new ATOM 0 HG21 VAL A 104 16.724 1.896 -0.988 1.00 0.00 H new ATOM 0 HG22 VAL A 104 15.124 1.184 -0.673 1.00 0.00 H new ATOM 0 HG23 VAL A 104 16.434 0.988 0.514 1.00 0.00 H new ATOM 1111 N GLY A 105 15.344 -3.333 -2.053 1.00 0.00 N ATOM 1112 CA GLY A 105 15.623 -4.539 -2.810 1.00 0.00 C ATOM 1113 C GLY A 105 14.975 -5.768 -2.203 1.00 0.00 C ATOM 1114 O GLY A 105 14.461 -6.625 -2.921 1.00 0.00 O ATOM 0 H GLY A 105 14.371 -3.029 -2.075 1.00 0.00 H new ATOM 0 HA2 GLY A 105 15.268 -4.413 -3.833 1.00 0.00 H new ATOM 0 HA3 GLY A 105 16.701 -4.689 -2.863 1.00 0.00 H new ATOM 1118 N GLU A 106 15.001 -5.855 -0.877 1.00 0.00 N ATOM 1119 CA GLU A 106 14.413 -6.990 -0.174 1.00 0.00 C ATOM 1120 C GLU A 106 12.950 -6.721 0.165 1.00 0.00 C ATOM 1121 O GLU A 106 12.438 -5.626 -0.067 1.00 0.00 O ATOM 1122 CB GLU A 106 15.198 -7.289 1.105 1.00 0.00 C ATOM 1123 CG GLU A 106 14.927 -6.304 2.229 1.00 0.00 C ATOM 1124 CD GLU A 106 15.274 -6.866 3.594 1.00 0.00 C ATOM 1125 OE1 GLU A 106 16.189 -7.713 3.670 1.00 0.00 O ATOM 1126 OE2 GLU A 106 14.632 -6.460 4.585 1.00 0.00 O ATOM 0 H GLU A 106 15.423 -5.154 -0.268 1.00 0.00 H new ATOM 0 HA GLU A 106 14.462 -7.857 -0.832 1.00 0.00 H new ATOM 0 HB2 GLU A 106 14.951 -8.294 1.447 1.00 0.00 H new ATOM 0 HB3 GLU A 106 16.264 -7.283 0.877 1.00 0.00 H new ATOM 0 HG2 GLU A 106 15.504 -5.395 2.057 1.00 0.00 H new ATOM 0 HG3 GLU A 106 13.874 -6.021 2.213 1.00 0.00 H new ATOM 1133 N VAL A 107 12.281 -7.730 0.714 1.00 0.00 N ATOM 1134 CA VAL A 107 10.877 -7.604 1.086 1.00 0.00 C ATOM 1135 C VAL A 107 10.716 -6.765 2.349 1.00 0.00 C ATOM 1136 O VAL A 107 9.864 -5.880 2.414 1.00 0.00 O ATOM 1137 CB VAL A 107 10.230 -8.983 1.313 1.00 0.00 C ATOM 1138 CG1 VAL A 107 8.773 -8.829 1.723 1.00 0.00 C ATOM 1139 CG2 VAL A 107 10.353 -9.841 0.062 1.00 0.00 C ATOM 0 H VAL A 107 12.689 -8.644 0.911 1.00 0.00 H new ATOM 0 HA VAL A 107 10.374 -7.107 0.257 1.00 0.00 H new ATOM 0 HB VAL A 107 10.759 -9.484 2.124 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.333 -9.814 1.879 1.00 0.00 H new ATOM 0 HG12 VAL A 107 8.714 -8.255 2.648 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.227 -8.308 0.937 1.00 0.00 H new ATOM 0 HG21 VAL A 107 9.891 -10.812 0.240 1.00 0.00 H new ATOM 0 HG22 VAL A 107 9.850 -9.347 -0.769 1.00 0.00 H new ATOM 0 HG23 VAL A 107 11.406 -9.980 -0.182 1.00 0.00 H new ATOM 1149 N GLY A 108 11.541 -7.051 3.351 1.00 0.00 N ATOM 1150 CA GLY A 108 11.475 -6.314 4.600 1.00 0.00 C ATOM 1151 C GLY A 108 10.358 -6.801 5.502 1.00 0.00 C ATOM 1152 O GLY A 108 9.746 -7.835 5.238 1.00 0.00 O ATOM 0 H GLY A 108 12.254 -7.780 3.321 1.00 0.00 H new ATOM 0 HA2 GLY A 108 12.427 -6.406 5.123 1.00 0.00 H new ATOM 0 HA3 GLY A 108 11.330 -5.255 4.386 1.00 0.00 H new ATOM 1156 N GLN A 109 10.094 -6.055 6.569 1.00 0.00 N ATOM 1157 CA GLN A 109 9.045 -6.418 7.515 1.00 0.00 C ATOM 1158 C GLN A 109 7.668 -6.307 6.869 1.00 0.00 C ATOM 1159 O GLN A 109 7.521 -5.728 5.792 1.00 0.00 O ATOM 1160 CB GLN A 109 9.114 -5.525 8.754 1.00 0.00 C ATOM 1161 CG GLN A 109 10.124 -5.995 9.788 1.00 0.00 C ATOM 1162 CD GLN A 109 11.557 -5.782 9.342 1.00 0.00 C ATOM 1163 OE1 GLN A 109 11.838 -4.926 8.503 1.00 0.00 O ATOM 1164 NE2 GLN A 109 12.474 -6.562 9.903 1.00 0.00 N ATOM 0 H GLN A 109 10.592 -5.195 6.801 1.00 0.00 H new ATOM 0 HA GLN A 109 9.203 -7.454 7.814 1.00 0.00 H new ATOM 0 HB2 GLN A 109 9.367 -4.510 8.446 1.00 0.00 H new ATOM 0 HB3 GLN A 109 8.128 -5.482 9.216 1.00 0.00 H new ATOM 0 HG2 GLN A 109 9.956 -5.462 10.724 1.00 0.00 H new ATOM 0 HG3 GLN A 109 9.964 -7.054 9.991 1.00 0.00 H new ATOM 0 HE21 GLN A 109 12.197 -7.259 10.594 1.00 0.00 H new ATOM 0 HE22 GLN A 109 13.455 -6.464 9.642 1.00 0.00 H new ATOM 1173 N SER A 110 6.661 -6.866 7.533 1.00 0.00 N ATOM 1174 CA SER A 110 5.296 -6.833 7.021 1.00 0.00 C ATOM 1175 C SER A 110 4.321 -6.378 8.103 1.00 0.00 C ATOM 1176 O SER A 110 4.207 -7.005 9.157 1.00 0.00 O ATOM 1177 CB SER A 110 4.890 -8.214 6.502 1.00 0.00 C ATOM 1178 OG SER A 110 4.584 -9.091 7.571 1.00 0.00 O ATOM 0 H SER A 110 6.765 -7.347 8.426 1.00 0.00 H new ATOM 0 HA SER A 110 5.260 -6.118 6.199 1.00 0.00 H new ATOM 0 HB2 SER A 110 4.025 -8.119 5.846 1.00 0.00 H new ATOM 0 HB3 SER A 110 5.699 -8.633 5.904 1.00 0.00 H new ATOM 0 HG SER A 110 4.649 -8.607 8.420 1.00 0.00 H new ATOM 1184 N LYS A 111 3.620 -5.282 7.835 1.00 0.00 N ATOM 1185 CA LYS A 111 2.653 -4.741 8.783 1.00 0.00 C ATOM 1186 C LYS A 111 1.354 -4.360 8.079 1.00 0.00 C ATOM 1187 O LYS A 111 1.360 -3.575 7.130 1.00 0.00 O ATOM 1188 CB LYS A 111 3.236 -3.519 9.496 1.00 0.00 C ATOM 1189 CG LYS A 111 2.319 -2.941 10.561 1.00 0.00 C ATOM 1190 CD LYS A 111 2.399 -3.734 11.855 1.00 0.00 C ATOM 1191 CE LYS A 111 3.577 -3.292 12.708 1.00 0.00 C ATOM 1192 NZ LYS A 111 3.422 -3.711 14.129 1.00 0.00 N ATOM 0 H LYS A 111 3.703 -4.750 6.968 1.00 0.00 H new ATOM 0 HA LYS A 111 2.433 -5.514 9.520 1.00 0.00 H new ATOM 0 HB2 LYS A 111 4.185 -3.796 9.956 1.00 0.00 H new ATOM 0 HB3 LYS A 111 3.453 -2.747 8.758 1.00 0.00 H new ATOM 0 HG2 LYS A 111 2.591 -1.903 10.752 1.00 0.00 H new ATOM 0 HG3 LYS A 111 1.292 -2.940 10.197 1.00 0.00 H new ATOM 0 HD2 LYS A 111 1.474 -3.608 12.418 1.00 0.00 H new ATOM 0 HD3 LYS A 111 2.492 -4.796 11.627 1.00 0.00 H new ATOM 0 HE2 LYS A 111 4.497 -3.714 12.303 1.00 0.00 H new ATOM 0 HE3 LYS A 111 3.675 -2.208 12.658 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 4.246 -3.391 14.677 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 2.558 -3.288 14.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 3.354 -4.748 14.180 1.00 0.00 H new ATOM 1206 N ILE A 112 0.245 -4.919 8.550 1.00 0.00 N ATOM 1207 CA ILE A 112 -1.060 -4.635 7.966 1.00 0.00 C ATOM 1208 C ILE A 112 -2.044 -4.154 9.027 1.00 0.00 C ATOM 1209 O ILE A 112 -2.003 -4.598 10.173 1.00 0.00 O ATOM 1210 CB ILE A 112 -1.645 -5.875 7.265 1.00 0.00 C ATOM 1211 CG1 ILE A 112 -2.878 -5.491 6.445 1.00 0.00 C ATOM 1212 CG2 ILE A 112 -1.995 -6.946 8.287 1.00 0.00 C ATOM 1213 CD1 ILE A 112 -3.191 -6.464 5.330 1.00 0.00 C ATOM 0 H ILE A 112 0.224 -5.571 9.334 1.00 0.00 H new ATOM 0 HA ILE A 112 -0.910 -3.847 7.228 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.893 -6.279 6.587 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -3.739 -5.424 7.110 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.726 -4.499 6.019 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -2.407 -7.816 7.776 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -1.097 -7.237 8.831 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -2.732 -6.554 8.987 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -4.077 -6.128 4.792 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.346 -6.514 4.643 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.375 -7.452 5.751 1.00 0.00 H new ATOM 1225 N ASN A 113 -2.929 -3.242 8.635 1.00 0.00 N ATOM 1226 CA ASN A 113 -3.925 -2.701 9.553 1.00 0.00 C ATOM 1227 C ASN A 113 -5.327 -2.819 8.964 1.00 0.00 C ATOM 1228 O ASN A 113 -5.508 -2.770 7.747 1.00 0.00 O ATOM 1229 CB ASN A 113 -3.614 -1.236 9.870 1.00 0.00 C ATOM 1230 CG ASN A 113 -2.698 -1.086 11.068 1.00 0.00 C ATOM 1231 OD1 ASN A 113 -3.144 -0.756 12.167 1.00 0.00 O ATOM 1232 ND2 ASN A 113 -1.408 -1.328 10.861 1.00 0.00 N ATOM 0 H ASN A 113 -2.976 -2.863 7.689 1.00 0.00 H new ATOM 0 HA ASN A 113 -3.887 -3.281 10.475 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -3.150 -0.770 9.001 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -4.545 -0.702 10.059 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -0.743 -1.243 11.630 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -1.082 -1.599 9.933 1.00 0.00 H new ATOM 1239 N HIS A 114 -6.318 -2.974 9.837 1.00 0.00 N ATOM 1240 CA HIS A 114 -7.706 -3.098 9.404 1.00 0.00 C ATOM 1241 C HIS A 114 -8.578 -2.034 10.065 1.00 0.00 C ATOM 1242 O HIS A 114 -8.631 -1.934 11.291 1.00 0.00 O ATOM 1243 CB HIS A 114 -8.242 -4.491 9.734 1.00 0.00 C ATOM 1244 CG HIS A 114 -7.449 -5.600 9.115 1.00 0.00 C ATOM 1245 ND1 HIS A 114 -7.440 -5.855 7.760 1.00 0.00 N ATOM 1246 CD2 HIS A 114 -6.632 -6.524 9.674 1.00 0.00 C ATOM 1247 CE1 HIS A 114 -6.655 -6.887 7.513 1.00 0.00 C ATOM 1248 NE2 HIS A 114 -6.151 -7.311 8.658 1.00 0.00 N ATOM 0 H HIS A 114 -6.186 -3.017 10.848 1.00 0.00 H new ATOM 0 HA HIS A 114 -7.739 -2.951 8.325 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -8.250 -4.621 10.816 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -9.276 -4.563 9.397 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -6.402 -6.623 10.724 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -6.458 -7.312 6.540 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -5.509 -8.096 8.769 1.00 0.00 H new ATOM 1256 N PHE A 115 -9.260 -1.242 9.244 1.00 0.00 N ATOM 1257 CA PHE A 115 -10.129 -0.185 9.749 1.00 0.00 C ATOM 1258 C PHE A 115 -11.568 -0.398 9.290 1.00 0.00 C ATOM 1259 O PHE A 115 -11.823 -0.689 8.121 1.00 0.00 O ATOM 1260 CB PHE A 115 -9.629 1.183 9.279 1.00 0.00 C ATOM 1261 CG PHE A 115 -8.248 1.516 9.765 1.00 0.00 C ATOM 1262 CD1 PHE A 115 -8.061 2.126 10.995 1.00 0.00 C ATOM 1263 CD2 PHE A 115 -7.136 1.219 8.993 1.00 0.00 C ATOM 1264 CE1 PHE A 115 -6.791 2.434 11.445 1.00 0.00 C ATOM 1265 CE2 PHE A 115 -5.864 1.525 9.438 1.00 0.00 C ATOM 1266 CZ PHE A 115 -5.691 2.133 10.666 1.00 0.00 C ATOM 0 H PHE A 115 -9.228 -1.312 8.227 1.00 0.00 H new ATOM 0 HA PHE A 115 -10.105 -0.219 10.838 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -9.638 1.209 8.189 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -10.321 1.952 9.622 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -8.917 2.363 11.609 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -7.265 0.743 8.032 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -6.659 2.910 12.405 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -5.006 1.289 8.826 1.00 0.00 H new ATOM 0 HZ PHE A 115 -4.698 2.372 11.016 1.00 0.00 H new ATOM 1276 N THR A 116 -12.507 -0.253 10.220 1.00 0.00 N ATOM 1277 CA THR A 116 -13.921 -0.431 9.913 1.00 0.00 C ATOM 1278 C THR A 116 -14.489 0.795 9.207 1.00 0.00 C ATOM 1279 O THR A 116 -15.465 0.697 8.463 1.00 0.00 O ATOM 1280 CB THR A 116 -14.742 -0.701 11.188 1.00 0.00 C ATOM 1281 OG1 THR A 116 -14.620 0.401 12.093 1.00 0.00 O ATOM 1282 CG2 THR A 116 -14.277 -1.979 11.870 1.00 0.00 C ATOM 0 H THR A 116 -12.314 -0.013 11.192 1.00 0.00 H new ATOM 0 HA THR A 116 -13.995 -1.294 9.252 1.00 0.00 H new ATOM 0 HB THR A 116 -15.787 -0.820 10.902 1.00 0.00 H new ATOM 0 HG1 THR A 116 -15.146 0.222 12.900 1.00 0.00 H new ATOM 0 HG21 THR A 116 -14.871 -2.149 12.768 1.00 0.00 H new ATOM 0 HG22 THR A 116 -14.400 -2.821 11.188 1.00 0.00 H new ATOM 0 HG23 THR A 116 -13.226 -1.884 12.143 1.00 0.00 H new ATOM 1290 N ARG A 117 -13.871 1.947 9.443 1.00 0.00 N ATOM 1291 CA ARG A 117 -14.316 3.193 8.829 1.00 0.00 C ATOM 1292 C ARG A 117 -13.355 3.630 7.728 1.00 0.00 C ATOM 1293 O ARG A 117 -12.137 3.513 7.870 1.00 0.00 O ATOM 1294 CB ARG A 117 -14.434 4.293 9.885 1.00 0.00 C ATOM 1295 CG ARG A 117 -15.541 4.050 10.897 1.00 0.00 C ATOM 1296 CD ARG A 117 -15.451 5.020 12.065 1.00 0.00 C ATOM 1297 NE ARG A 117 -16.546 4.838 13.014 1.00 0.00 N ATOM 1298 CZ ARG A 117 -16.558 5.365 14.233 1.00 0.00 C ATOM 1299 NH1 ARG A 117 -15.539 6.105 14.649 1.00 0.00 N ATOM 1300 NH2 ARG A 117 -17.591 5.154 15.039 1.00 0.00 N ATOM 0 H ARG A 117 -13.061 2.044 10.055 1.00 0.00 H new ATOM 0 HA ARG A 117 -15.296 3.020 8.384 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -13.484 4.382 10.413 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -14.612 5.246 9.386 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -16.510 4.155 10.410 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -15.479 3.027 11.267 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -14.500 4.881 12.579 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -15.464 6.043 11.688 1.00 0.00 H new ATOM 0 HE ARG A 117 -17.346 4.275 12.725 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -14.744 6.271 14.032 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -15.551 6.509 15.586 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -18.377 4.586 14.723 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -17.599 5.559 15.975 1.00 0.00 H new ATOM 1314 N LEU A 118 -13.909 4.134 6.631 1.00 0.00 N ATOM 1315 CA LEU A 118 -13.101 4.588 5.505 1.00 0.00 C ATOM 1316 C LEU A 118 -12.225 5.771 5.905 1.00 0.00 C ATOM 1317 O LEU A 118 -11.020 5.774 5.658 1.00 0.00 O ATOM 1318 CB LEU A 118 -14.001 4.980 4.332 1.00 0.00 C ATOM 1319 CG LEU A 118 -13.339 5.796 3.221 1.00 0.00 C ATOM 1320 CD1 LEU A 118 -12.229 4.993 2.558 1.00 0.00 C ATOM 1321 CD2 LEU A 118 -14.371 6.233 2.191 1.00 0.00 C ATOM 0 H LEU A 118 -14.915 4.239 6.497 1.00 0.00 H new ATOM 0 HA LEU A 118 -12.453 3.766 5.200 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -14.409 4.069 3.893 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -14.844 5.551 4.722 1.00 0.00 H new ATOM 0 HG LEU A 118 -12.899 6.689 3.666 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -11.769 5.589 1.770 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -11.476 4.731 3.301 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -12.646 4.083 2.127 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -13.881 6.812 1.408 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -14.841 5.353 1.751 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -15.131 6.847 2.675 1.00 0.00 H new ATOM 1333 N GLU A 119 -12.839 6.772 6.528 1.00 0.00 N ATOM 1334 CA GLU A 119 -12.114 7.959 6.964 1.00 0.00 C ATOM 1335 C GLU A 119 -10.859 7.575 7.743 1.00 0.00 C ATOM 1336 O GLU A 119 -9.749 7.967 7.385 1.00 0.00 O ATOM 1337 CB GLU A 119 -13.013 8.845 7.829 1.00 0.00 C ATOM 1338 CG GLU A 119 -14.297 9.269 7.137 1.00 0.00 C ATOM 1339 CD GLU A 119 -15.173 10.141 8.015 1.00 0.00 C ATOM 1340 OE1 GLU A 119 -15.562 9.681 9.109 1.00 0.00 O ATOM 1341 OE2 GLU A 119 -15.470 11.284 7.608 1.00 0.00 O ATOM 0 H GLU A 119 -13.836 6.784 6.742 1.00 0.00 H new ATOM 0 HA GLU A 119 -11.814 8.516 6.076 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -13.264 8.310 8.745 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -12.457 9.736 8.122 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.051 9.811 6.224 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -14.856 8.381 6.841 1.00 0.00 H new ATOM 1348 N ASP A 120 -11.045 6.805 8.810 1.00 0.00 N ATOM 1349 CA ASP A 120 -9.929 6.367 9.640 1.00 0.00 C ATOM 1350 C ASP A 120 -8.737 5.962 8.778 1.00 0.00 C ATOM 1351 O ASP A 120 -7.598 6.324 9.068 1.00 0.00 O ATOM 1352 CB ASP A 120 -10.355 5.195 10.526 1.00 0.00 C ATOM 1353 CG ASP A 120 -11.413 5.589 11.538 1.00 0.00 C ATOM 1354 OD1 ASP A 120 -12.292 6.405 11.190 1.00 0.00 O ATOM 1355 OD2 ASP A 120 -11.362 5.081 12.677 1.00 0.00 O ATOM 0 H ASP A 120 -11.958 6.472 9.120 1.00 0.00 H new ATOM 0 HA ASP A 120 -9.629 7.202 10.274 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -10.738 4.390 9.899 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -9.483 4.804 11.050 1.00 0.00 H new ATOM 1360 N ALA A 121 -9.009 5.207 7.718 1.00 0.00 N ATOM 1361 CA ALA A 121 -7.959 4.754 6.814 1.00 0.00 C ATOM 1362 C ALA A 121 -7.360 5.922 6.038 1.00 0.00 C ATOM 1363 O ALA A 121 -6.140 6.053 5.936 1.00 0.00 O ATOM 1364 CB ALA A 121 -8.505 3.706 5.856 1.00 0.00 C ATOM 0 H ALA A 121 -9.947 4.897 7.465 1.00 0.00 H new ATOM 0 HA ALA A 121 -7.166 4.306 7.413 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -7.711 3.376 5.186 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -8.878 2.854 6.424 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -9.318 4.136 5.271 1.00 0.00 H new ATOM 1370 N LYS A 122 -8.226 6.770 5.492 1.00 0.00 N ATOM 1371 CA LYS A 122 -7.784 7.928 4.725 1.00 0.00 C ATOM 1372 C LYS A 122 -6.747 8.732 5.503 1.00 0.00 C ATOM 1373 O LYS A 122 -5.699 9.095 4.969 1.00 0.00 O ATOM 1374 CB LYS A 122 -8.977 8.820 4.375 1.00 0.00 C ATOM 1375 CG LYS A 122 -10.056 8.107 3.578 1.00 0.00 C ATOM 1376 CD LYS A 122 -11.206 9.039 3.239 1.00 0.00 C ATOM 1377 CE LYS A 122 -10.981 9.741 1.908 1.00 0.00 C ATOM 1378 NZ LYS A 122 -11.931 10.871 1.709 1.00 0.00 N ATOM 0 H LYS A 122 -9.239 6.676 5.567 1.00 0.00 H new ATOM 0 HA LYS A 122 -7.324 7.568 3.804 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -9.413 9.207 5.296 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -8.623 9.679 3.804 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -9.627 7.708 2.659 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -10.431 7.258 4.150 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -12.136 8.472 3.200 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -11.319 9.782 4.029 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -9.958 10.114 1.863 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -11.095 9.024 1.095 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -11.745 11.323 0.791 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -12.907 10.511 1.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -11.805 11.568 2.470 1.00 0.00 H new ATOM 1392 N LYS A 123 -7.044 9.005 6.769 1.00 0.00 N ATOM 1393 CA LYS A 123 -6.137 9.763 7.623 1.00 0.00 C ATOM 1394 C LYS A 123 -4.816 9.023 7.805 1.00 0.00 C ATOM 1395 O LYS A 123 -3.779 9.450 7.299 1.00 0.00 O ATOM 1396 CB LYS A 123 -6.782 10.020 8.986 1.00 0.00 C ATOM 1397 CG LYS A 123 -8.199 10.562 8.896 1.00 0.00 C ATOM 1398 CD LYS A 123 -9.042 10.117 10.079 1.00 0.00 C ATOM 1399 CE LYS A 123 -10.108 11.146 10.422 1.00 0.00 C ATOM 1400 NZ LYS A 123 -11.008 10.671 11.509 1.00 0.00 N ATOM 0 H LYS A 123 -7.907 8.712 7.227 1.00 0.00 H new ATOM 0 HA LYS A 123 -5.935 10.718 7.138 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -6.793 9.090 9.555 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -6.166 10.727 9.543 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -8.171 11.651 8.857 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -8.662 10.221 7.970 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -9.516 9.163 9.851 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -8.400 9.955 10.944 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -9.630 12.077 10.727 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -10.698 11.368 9.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -11.720 11.401 11.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -11.484 9.797 11.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -10.449 10.484 12.366 1.00 0.00 H new ATOM 1414 N ASP A 124 -4.862 7.910 8.530 1.00 0.00 N ATOM 1415 CA ASP A 124 -3.669 7.109 8.778 1.00 0.00 C ATOM 1416 C ASP A 124 -2.745 7.122 7.564 1.00 0.00 C ATOM 1417 O ASP A 124 -1.540 7.345 7.690 1.00 0.00 O ATOM 1418 CB ASP A 124 -4.057 5.671 9.123 1.00 0.00 C ATOM 1419 CG ASP A 124 -2.870 4.844 9.577 1.00 0.00 C ATOM 1420 OD1 ASP A 124 -1.896 4.732 8.803 1.00 0.00 O ATOM 1421 OD2 ASP A 124 -2.915 4.308 10.704 1.00 0.00 O ATOM 0 H ASP A 124 -5.713 7.542 8.956 1.00 0.00 H new ATOM 0 HA ASP A 124 -3.137 7.546 9.623 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.812 5.680 9.909 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -4.511 5.201 8.251 1.00 0.00 H new ATOM 1426 N PHE A 125 -3.316 6.880 6.389 1.00 0.00 N ATOM 1427 CA PHE A 125 -2.544 6.861 5.152 1.00 0.00 C ATOM 1428 C PHE A 125 -1.875 8.211 4.908 1.00 0.00 C ATOM 1429 O PHE A 125 -0.654 8.296 4.779 1.00 0.00 O ATOM 1430 CB PHE A 125 -3.445 6.505 3.968 1.00 0.00 C ATOM 1431 CG PHE A 125 -2.736 6.534 2.645 1.00 0.00 C ATOM 1432 CD1 PHE A 125 -2.278 7.730 2.116 1.00 0.00 C ATOM 1433 CD2 PHE A 125 -2.526 5.366 1.929 1.00 0.00 C ATOM 1434 CE1 PHE A 125 -1.625 7.760 0.898 1.00 0.00 C ATOM 1435 CE2 PHE A 125 -1.874 5.390 0.711 1.00 0.00 C ATOM 1436 CZ PHE A 125 -1.422 6.589 0.195 1.00 0.00 C ATOM 0 H PHE A 125 -4.312 6.694 6.267 1.00 0.00 H new ATOM 0 HA PHE A 125 -1.768 6.102 5.250 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.862 5.511 4.126 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -4.283 7.201 3.937 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.433 8.649 2.661 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -2.876 4.426 2.328 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.274 8.699 0.496 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -1.718 4.472 0.163 1.00 0.00 H new ATOM 0 HZ PHE A 125 -0.911 6.610 -0.756 1.00 0.00 H new ATOM 1446 N GLU A 126 -2.685 9.263 4.846 1.00 0.00 N ATOM 1447 CA GLU A 126 -2.172 10.609 4.616 1.00 0.00 C ATOM 1448 C GLU A 126 -1.246 11.039 5.750 1.00 0.00 C ATOM 1449 O GLU A 126 -0.059 11.289 5.538 1.00 0.00 O ATOM 1450 CB GLU A 126 -3.327 11.603 4.481 1.00 0.00 C ATOM 1451 CG GLU A 126 -3.980 11.594 3.109 1.00 0.00 C ATOM 1452 CD GLU A 126 -4.876 12.796 2.881 1.00 0.00 C ATOM 1453 OE1 GLU A 126 -4.455 13.923 3.217 1.00 0.00 O ATOM 1454 OE2 GLU A 126 -5.998 12.610 2.366 1.00 0.00 O ATOM 0 H GLU A 126 -3.698 9.210 4.952 1.00 0.00 H new ATOM 0 HA GLU A 126 -1.601 10.599 3.688 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -4.081 11.376 5.235 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -2.958 12.607 4.692 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -3.205 11.572 2.342 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -4.566 10.682 2.996 1.00 0.00 H new ATOM 1461 N LYS A 127 -1.798 11.125 6.956 1.00 0.00 N ATOM 1462 CA LYS A 127 -1.024 11.524 8.126 1.00 0.00 C ATOM 1463 C LYS A 127 0.370 10.905 8.093 1.00 0.00 C ATOM 1464 O LYS A 127 1.375 11.607 8.207 1.00 0.00 O ATOM 1465 CB LYS A 127 -1.748 11.108 9.408 1.00 0.00 C ATOM 1466 CG LYS A 127 -0.967 11.413 10.674 1.00 0.00 C ATOM 1467 CD LYS A 127 -0.072 10.250 11.070 1.00 0.00 C ATOM 1468 CE LYS A 127 -0.827 9.223 11.900 1.00 0.00 C ATOM 1469 NZ LYS A 127 -0.788 9.546 13.353 1.00 0.00 N ATOM 0 H LYS A 127 -2.779 10.924 7.149 1.00 0.00 H new ATOM 0 HA LYS A 127 -0.921 12.609 8.110 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -2.711 11.618 9.453 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -1.955 10.039 9.368 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -0.360 12.305 10.522 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -1.660 11.633 11.486 1.00 0.00 H new ATOM 0 HD2 LYS A 127 0.325 9.774 10.174 1.00 0.00 H new ATOM 0 HD3 LYS A 127 0.781 10.623 11.638 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -1.864 9.177 11.566 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -0.396 8.236 11.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -1.314 8.822 13.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 0.200 9.565 13.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -1.223 10.477 13.513 1.00 0.00 H new ATOM 1483 N LYS A 128 0.423 9.587 7.936 1.00 0.00 N ATOM 1484 CA LYS A 128 1.693 8.872 7.886 1.00 0.00 C ATOM 1485 C LYS A 128 2.592 9.438 6.791 1.00 0.00 C ATOM 1486 O LYS A 128 3.761 9.741 7.029 1.00 0.00 O ATOM 1487 CB LYS A 128 1.454 7.380 7.644 1.00 0.00 C ATOM 1488 CG LYS A 128 2.727 6.553 7.638 1.00 0.00 C ATOM 1489 CD LYS A 128 3.363 6.498 9.018 1.00 0.00 C ATOM 1490 CE LYS A 128 2.567 5.611 9.963 1.00 0.00 C ATOM 1491 NZ LYS A 128 3.429 5.015 11.021 1.00 0.00 N ATOM 0 H LYS A 128 -0.400 8.991 7.841 1.00 0.00 H new ATOM 0 HA LYS A 128 2.192 9.002 8.846 1.00 0.00 H new ATOM 0 HB2 LYS A 128 0.786 6.998 8.416 1.00 0.00 H new ATOM 0 HB3 LYS A 128 0.944 7.253 6.689 1.00 0.00 H new ATOM 0 HG2 LYS A 128 2.503 5.542 7.299 1.00 0.00 H new ATOM 0 HG3 LYS A 128 3.435 6.978 6.927 1.00 0.00 H new ATOM 0 HD2 LYS A 128 4.382 6.121 8.935 1.00 0.00 H new ATOM 0 HD3 LYS A 128 3.428 7.505 9.430 1.00 0.00 H new ATOM 0 HE2 LYS A 128 1.773 6.196 10.428 1.00 0.00 H new ATOM 0 HE3 LYS A 128 2.086 4.815 9.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 2.850 4.417 11.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 4.172 4.436 10.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 3.868 5.774 11.579 1.00 0.00 H new ATOM 1505 N PHE A 129 2.039 9.578 5.591 1.00 0.00 N ATOM 1506 CA PHE A 129 2.790 10.107 4.459 1.00 0.00 C ATOM 1507 C PHE A 129 3.320 11.506 4.764 1.00 0.00 C ATOM 1508 O PHE A 129 4.526 11.747 4.725 1.00 0.00 O ATOM 1509 CB PHE A 129 1.911 10.145 3.208 1.00 0.00 C ATOM 1510 CG PHE A 129 2.452 11.029 2.121 1.00 0.00 C ATOM 1511 CD1 PHE A 129 3.334 10.528 1.177 1.00 0.00 C ATOM 1512 CD2 PHE A 129 2.078 12.361 2.042 1.00 0.00 C ATOM 1513 CE1 PHE A 129 3.834 11.339 0.176 1.00 0.00 C ATOM 1514 CE2 PHE A 129 2.575 13.177 1.043 1.00 0.00 C ATOM 1515 CZ PHE A 129 3.453 12.665 0.109 1.00 0.00 C ATOM 0 H PHE A 129 1.072 9.332 5.377 1.00 0.00 H new ATOM 0 HA PHE A 129 3.638 9.447 4.278 1.00 0.00 H new ATOM 0 HB2 PHE A 129 1.801 9.132 2.820 1.00 0.00 H new ATOM 0 HB3 PHE A 129 0.915 10.491 3.484 1.00 0.00 H new ATOM 0 HD1 PHE A 129 3.634 9.492 1.224 1.00 0.00 H new ATOM 0 HD2 PHE A 129 1.390 12.766 2.769 1.00 0.00 H new ATOM 0 HE1 PHE A 129 4.522 10.937 -0.553 1.00 0.00 H new ATOM 0 HE2 PHE A 129 2.277 14.214 0.993 1.00 0.00 H new ATOM 0 HZ PHE A 129 3.842 13.300 -0.673 1.00 0.00 H new ATOM 1525 N ARG A 130 2.408 12.424 5.068 1.00 0.00 N ATOM 1526 CA ARG A 130 2.781 13.798 5.378 1.00 0.00 C ATOM 1527 C ARG A 130 3.807 13.841 6.507 1.00 0.00 C ATOM 1528 O ARG A 130 4.660 14.728 6.550 1.00 0.00 O ATOM 1529 CB ARG A 130 1.545 14.610 5.768 1.00 0.00 C ATOM 1530 CG ARG A 130 1.868 16.000 6.292 1.00 0.00 C ATOM 1531 CD ARG A 130 0.688 16.944 6.132 1.00 0.00 C ATOM 1532 NE ARG A 130 0.684 17.994 7.148 1.00 0.00 N ATOM 1533 CZ ARG A 130 1.570 18.983 7.185 1.00 0.00 C ATOM 1534 NH1 ARG A 130 2.524 19.058 6.267 1.00 0.00 N ATOM 1535 NH2 ARG A 130 1.501 19.901 8.141 1.00 0.00 N ATOM 0 H ARG A 130 1.405 12.240 5.106 1.00 0.00 H new ATOM 0 HA ARG A 130 3.228 14.236 4.486 1.00 0.00 H new ATOM 0 HB2 ARG A 130 0.892 14.701 4.900 1.00 0.00 H new ATOM 0 HB3 ARG A 130 0.988 14.064 6.530 1.00 0.00 H new ATOM 0 HG2 ARG A 130 2.145 15.938 7.344 1.00 0.00 H new ATOM 0 HG3 ARG A 130 2.730 16.400 5.758 1.00 0.00 H new ATOM 0 HD2 ARG A 130 0.719 17.398 5.142 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -0.241 16.377 6.193 1.00 0.00 H new ATOM 0 HE ARG A 130 -0.038 17.966 7.868 1.00 0.00 H new ATOM 0 HH11 ARG A 130 2.579 18.355 5.530 1.00 0.00 H new ATOM 0 HH12 ARG A 130 3.203 19.819 6.298 1.00 0.00 H new ATOM 0 HH21 ARG A 130 0.767 19.847 8.848 1.00 0.00 H new ATOM 0 HH22 ARG A 130 2.182 20.660 8.169 1.00 0.00 H new ATOM 1549 N GLU A 131 3.717 12.878 7.419 1.00 0.00 N ATOM 1550 CA GLU A 131 4.637 12.808 8.548 1.00 0.00 C ATOM 1551 C GLU A 131 6.032 12.394 8.089 1.00 0.00 C ATOM 1552 O GLU A 131 7.034 12.748 8.711 1.00 0.00 O ATOM 1553 CB GLU A 131 4.119 11.820 9.596 1.00 0.00 C ATOM 1554 CG GLU A 131 3.129 12.432 10.572 1.00 0.00 C ATOM 1555 CD GLU A 131 3.600 13.763 11.125 1.00 0.00 C ATOM 1556 OE1 GLU A 131 4.385 13.757 12.096 1.00 0.00 O ATOM 1557 OE2 GLU A 131 3.185 14.810 10.586 1.00 0.00 O ATOM 0 H GLU A 131 3.017 12.136 7.398 1.00 0.00 H new ATOM 0 HA GLU A 131 4.700 13.801 8.994 1.00 0.00 H new ATOM 0 HB2 GLU A 131 3.644 10.981 9.088 1.00 0.00 H new ATOM 0 HB3 GLU A 131 4.965 11.418 10.154 1.00 0.00 H new ATOM 0 HG2 GLU A 131 2.170 12.570 10.072 1.00 0.00 H new ATOM 0 HG3 GLU A 131 2.962 11.739 11.397 1.00 0.00 H new ATOM 1564 N LYS A 132 6.089 11.642 6.995 1.00 0.00 N ATOM 1565 CA LYS A 132 7.360 11.179 6.450 1.00 0.00 C ATOM 1566 C LYS A 132 7.860 12.121 5.359 1.00 0.00 C ATOM 1567 O LYS A 132 9.057 12.183 5.078 1.00 0.00 O ATOM 1568 CB LYS A 132 7.212 9.764 5.887 1.00 0.00 C ATOM 1569 CG LYS A 132 6.715 8.753 6.906 1.00 0.00 C ATOM 1570 CD LYS A 132 7.801 8.387 7.904 1.00 0.00 C ATOM 1571 CE LYS A 132 7.420 7.160 8.718 1.00 0.00 C ATOM 1572 NZ LYS A 132 8.580 6.615 9.477 1.00 0.00 N ATOM 0 H LYS A 132 5.269 11.340 6.468 1.00 0.00 H new ATOM 0 HA LYS A 132 8.090 11.167 7.259 1.00 0.00 H new ATOM 0 HB2 LYS A 132 6.521 9.788 5.044 1.00 0.00 H new ATOM 0 HB3 LYS A 132 8.176 9.433 5.500 1.00 0.00 H new ATOM 0 HG2 LYS A 132 5.855 9.162 7.436 1.00 0.00 H new ATOM 0 HG3 LYS A 132 6.374 7.854 6.392 1.00 0.00 H new ATOM 0 HD2 LYS A 132 8.735 8.198 7.374 1.00 0.00 H new ATOM 0 HD3 LYS A 132 7.979 9.228 8.574 1.00 0.00 H new ATOM 0 HE2 LYS A 132 6.621 7.419 9.413 1.00 0.00 H new ATOM 0 HE3 LYS A 132 7.027 6.391 8.053 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 8.279 5.780 10.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 9.333 6.344 8.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 8.939 7.340 10.130 1.00 0.00 H new ATOM 1586 N THR A 133 6.935 12.856 4.749 1.00 0.00 N ATOM 1587 CA THR A 133 7.281 13.795 3.689 1.00 0.00 C ATOM 1588 C THR A 133 6.982 15.230 4.108 1.00 0.00 C ATOM 1589 O THR A 133 7.006 16.145 3.285 1.00 0.00 O ATOM 1590 CB THR A 133 6.518 13.482 2.389 1.00 0.00 C ATOM 1591 OG1 THR A 133 5.109 13.635 2.598 1.00 0.00 O ATOM 1592 CG2 THR A 133 6.814 12.067 1.915 1.00 0.00 C ATOM 0 H THR A 133 5.940 12.819 4.971 1.00 0.00 H new ATOM 0 HA THR A 133 8.350 13.687 3.508 1.00 0.00 H new ATOM 0 HB THR A 133 6.849 14.182 1.622 1.00 0.00 H new ATOM 0 HG1 THR A 133 4.626 13.340 1.798 1.00 0.00 H new ATOM 0 HG21 THR A 133 6.264 11.869 0.995 1.00 0.00 H new ATOM 0 HG22 THR A 133 7.883 11.962 1.728 1.00 0.00 H new ATOM 0 HG23 THR A 133 6.508 11.355 2.681 1.00 0.00 H new ATOM 1600 N LYS A 134 6.702 15.420 5.392 1.00 0.00 N ATOM 1601 CA LYS A 134 6.400 16.745 5.922 1.00 0.00 C ATOM 1602 C LYS A 134 5.651 17.585 4.892 1.00 0.00 C ATOM 1603 O LYS A 134 5.911 18.778 4.743 1.00 0.00 O ATOM 1604 CB LYS A 134 7.689 17.458 6.336 1.00 0.00 C ATOM 1605 CG LYS A 134 8.351 16.854 7.563 1.00 0.00 C ATOM 1606 CD LYS A 134 9.748 17.413 7.775 1.00 0.00 C ATOM 1607 CE LYS A 134 9.704 18.835 8.313 1.00 0.00 C ATOM 1608 NZ LYS A 134 9.541 19.835 7.222 1.00 0.00 N ATOM 0 H LYS A 134 6.678 14.673 6.086 1.00 0.00 H new ATOM 0 HA LYS A 134 5.763 16.622 6.798 1.00 0.00 H new ATOM 0 HB2 LYS A 134 8.392 17.431 5.504 1.00 0.00 H new ATOM 0 HB3 LYS A 134 7.467 18.507 6.532 1.00 0.00 H new ATOM 0 HG2 LYS A 134 7.740 17.055 8.443 1.00 0.00 H new ATOM 0 HG3 LYS A 134 8.404 15.771 7.453 1.00 0.00 H new ATOM 0 HD2 LYS A 134 10.294 16.776 8.471 1.00 0.00 H new ATOM 0 HD3 LYS A 134 10.295 17.396 6.832 1.00 0.00 H new ATOM 0 HE2 LYS A 134 8.880 18.931 9.020 1.00 0.00 H new ATOM 0 HE3 LYS A 134 10.621 19.044 8.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 10.289 20.554 7.296 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 9.609 19.358 6.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 8.611 20.293 7.307 1.00 0.00 H new ATOM 1622 N ASN A 135 4.719 16.953 4.185 1.00 0.00 N ATOM 1623 CA ASN A 135 3.932 17.644 3.170 1.00 0.00 C ATOM 1624 C ASN A 135 2.516 17.078 3.102 1.00 0.00 C ATOM 1625 O ASN A 135 2.285 15.916 3.431 1.00 0.00 O ATOM 1626 CB ASN A 135 4.607 17.523 1.802 1.00 0.00 C ATOM 1627 CG ASN A 135 5.585 18.651 1.539 1.00 0.00 C ATOM 1628 OD1 ASN A 135 5.321 19.541 0.730 1.00 0.00 O ATOM 1629 ND2 ASN A 135 6.723 18.619 2.222 1.00 0.00 N ATOM 0 H ASN A 135 4.491 15.965 4.296 1.00 0.00 H new ATOM 0 HA ASN A 135 3.872 18.697 3.446 1.00 0.00 H new ATOM 0 HB2 ASN A 135 5.132 16.569 1.742 1.00 0.00 H new ATOM 0 HB3 ASN A 135 3.845 17.517 1.023 1.00 0.00 H new ATOM 0 HD21 ASN A 135 7.420 19.351 2.086 1.00 0.00 H new ATOM 0 HD22 ASN A 135 6.900 17.862 2.883 1.00 0.00 H new ATOM 1636 N ASN A 136 1.573 17.910 2.674 1.00 0.00 N ATOM 1637 CA ASN A 136 0.179 17.494 2.563 1.00 0.00 C ATOM 1638 C ASN A 136 -0.058 16.727 1.265 1.00 0.00 C ATOM 1639 O ASN A 136 0.408 17.130 0.200 1.00 0.00 O ATOM 1640 CB ASN A 136 -0.745 18.712 2.624 1.00 0.00 C ATOM 1641 CG ASN A 136 -0.784 19.339 4.004 1.00 0.00 C ATOM 1642 OD1 ASN A 136 0.202 19.912 4.466 1.00 0.00 O ATOM 1643 ND2 ASN A 136 -1.928 19.232 4.670 1.00 0.00 N ATOM 0 H ASN A 136 1.748 18.876 2.398 1.00 0.00 H new ATOM 0 HA ASN A 136 -0.045 16.834 3.401 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -0.411 19.455 1.900 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -1.753 18.415 2.334 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -2.014 19.634 5.604 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -2.720 18.748 4.248 1.00 0.00 H new ATOM 1650 N TRP A 137 -0.785 15.620 1.364 1.00 0.00 N ATOM 1651 CA TRP A 137 -1.084 14.796 0.198 1.00 0.00 C ATOM 1652 C TRP A 137 -1.831 15.601 -0.860 1.00 0.00 C ATOM 1653 O TRP A 137 -1.570 15.464 -2.055 1.00 0.00 O ATOM 1654 CB TRP A 137 -1.912 13.577 0.609 1.00 0.00 C ATOM 1655 CG TRP A 137 -2.220 12.657 -0.533 1.00 0.00 C ATOM 1656 CD1 TRP A 137 -3.418 12.520 -1.176 1.00 0.00 C ATOM 1657 CD2 TRP A 137 -1.316 11.744 -1.166 1.00 0.00 C ATOM 1658 NE1 TRP A 137 -3.313 11.577 -2.170 1.00 0.00 N ATOM 1659 CE2 TRP A 137 -2.034 11.087 -2.185 1.00 0.00 C ATOM 1660 CE3 TRP A 137 0.029 11.420 -0.973 1.00 0.00 C ATOM 1661 CZ2 TRP A 137 -1.449 10.125 -3.005 1.00 0.00 C ATOM 1662 CZ3 TRP A 137 0.607 10.465 -1.787 1.00 0.00 C ATOM 1663 CH2 TRP A 137 -0.130 9.827 -2.793 1.00 0.00 C ATOM 0 H TRP A 137 -1.178 15.272 2.239 1.00 0.00 H new ATOM 0 HA TRP A 137 -0.140 14.458 -0.230 1.00 0.00 H new ATOM 0 HB2 TRP A 137 -1.373 13.023 1.378 1.00 0.00 H new ATOM 0 HB3 TRP A 137 -2.847 13.915 1.056 1.00 0.00 H new ATOM 0 HD1 TRP A 137 -4.315 13.072 -0.938 1.00 0.00 H new ATOM 0 HE1 TRP A 137 -4.066 11.289 -2.795 1.00 0.00 H new ATOM 0 HE3 TRP A 137 0.607 11.907 -0.201 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 -2.016 9.632 -3.781 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 1.646 10.206 -1.645 1.00 0.00 H new ATOM 0 HH2 TRP A 137 0.352 9.086 -3.413 1.00 0.00 H new ATOM 1674 N ALA A 138 -2.760 16.440 -0.413 1.00 0.00 N ATOM 1675 CA ALA A 138 -3.542 17.268 -1.322 1.00 0.00 C ATOM 1676 C ALA A 138 -2.662 18.296 -2.023 1.00 0.00 C ATOM 1677 O ALA A 138 -2.816 18.547 -3.218 1.00 0.00 O ATOM 1678 CB ALA A 138 -4.668 17.960 -0.568 1.00 0.00 C ATOM 0 H ALA A 138 -2.989 16.564 0.573 1.00 0.00 H new ATOM 0 HA ALA A 138 -3.974 16.620 -2.084 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -5.244 18.575 -1.259 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -5.320 17.210 -0.119 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -4.248 18.591 0.215 1.00 0.00 H new ATOM 1684 N GLU A 139 -1.739 18.890 -1.271 1.00 0.00 N ATOM 1685 CA GLU A 139 -0.836 19.893 -1.822 1.00 0.00 C ATOM 1686 C GLU A 139 0.454 19.247 -2.322 1.00 0.00 C ATOM 1687 O GLU A 139 1.542 19.796 -2.149 1.00 0.00 O ATOM 1688 CB GLU A 139 -0.512 20.954 -0.768 1.00 0.00 C ATOM 1689 CG GLU A 139 -1.744 21.570 -0.127 1.00 0.00 C ATOM 1690 CD GLU A 139 -1.493 22.972 0.392 1.00 0.00 C ATOM 1691 OE1 GLU A 139 -0.894 23.104 1.480 1.00 0.00 O ATOM 1692 OE2 GLU A 139 -1.894 23.938 -0.291 1.00 0.00 O ATOM 0 H GLU A 139 -1.598 18.694 -0.280 1.00 0.00 H new ATOM 0 HA GLU A 139 -1.335 20.370 -2.666 1.00 0.00 H new ATOM 0 HB2 GLU A 139 0.106 20.505 0.010 1.00 0.00 H new ATOM 0 HB3 GLU A 139 0.081 21.744 -1.230 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -2.554 21.596 -0.856 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -2.076 20.936 0.695 1.00 0.00 H new ATOM 1699 N ARG A 140 0.322 18.079 -2.942 1.00 0.00 N ATOM 1700 CA ARG A 140 1.476 17.358 -3.465 1.00 0.00 C ATOM 1701 C ARG A 140 2.181 18.171 -4.547 1.00 0.00 C ATOM 1702 O ARG A 140 3.358 17.953 -4.834 1.00 0.00 O ATOM 1703 CB ARG A 140 1.044 16.004 -4.031 1.00 0.00 C ATOM 1704 CG ARG A 140 0.244 16.109 -5.319 1.00 0.00 C ATOM 1705 CD ARG A 140 -0.669 14.907 -5.508 1.00 0.00 C ATOM 1706 NE ARG A 140 -1.688 15.148 -6.526 1.00 0.00 N ATOM 1707 CZ ARG A 140 -1.420 15.264 -7.822 1.00 0.00 C ATOM 1708 NH1 ARG A 140 -0.171 15.160 -8.255 1.00 0.00 N ATOM 1709 NH2 ARG A 140 -2.401 15.483 -8.687 1.00 0.00 N ATOM 0 H ARG A 140 -0.572 17.612 -3.094 1.00 0.00 H new ATOM 0 HA ARG A 140 2.174 17.196 -2.644 1.00 0.00 H new ATOM 0 HB2 ARG A 140 1.930 15.396 -4.212 1.00 0.00 H new ATOM 0 HB3 ARG A 140 0.447 15.481 -3.284 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -0.352 17.021 -5.305 1.00 0.00 H new ATOM 0 HG3 ARG A 140 0.925 16.187 -6.166 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -0.072 14.040 -5.791 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -1.152 14.667 -4.561 1.00 0.00 H new ATOM 0 HE ARG A 140 -2.659 15.232 -6.225 1.00 0.00 H new ATOM 0 HH11 ARG A 140 0.586 14.991 -7.593 1.00 0.00 H new ATOM 0 HH12 ARG A 140 0.033 15.249 -9.250 1.00 0.00 H new ATOM 0 HH21 ARG A 140 -3.363 15.563 -8.358 1.00 0.00 H new ATOM 0 HH22 ARG A 140 -2.193 15.572 -9.682 1.00 0.00 H new ATOM 1723 N ASP A 141 1.453 19.108 -5.144 1.00 0.00 N ATOM 1724 CA ASP A 141 2.008 19.955 -6.193 1.00 0.00 C ATOM 1725 C ASP A 141 3.309 20.606 -5.735 1.00 0.00 C ATOM 1726 O ASP A 141 4.297 20.628 -6.471 1.00 0.00 O ATOM 1727 CB ASP A 141 0.999 21.032 -6.596 1.00 0.00 C ATOM 1728 CG ASP A 141 1.252 21.568 -7.992 1.00 0.00 C ATOM 1729 OD1 ASP A 141 1.217 20.769 -8.951 1.00 0.00 O ATOM 1730 OD2 ASP A 141 1.483 22.788 -8.125 1.00 0.00 O ATOM 0 H ASP A 141 0.477 19.300 -4.919 1.00 0.00 H new ATOM 0 HA ASP A 141 2.222 19.326 -7.057 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -0.009 20.619 -6.545 1.00 0.00 H new ATOM 0 HB3 ASP A 141 1.043 21.853 -5.881 1.00 0.00 H new ATOM 1735 N HIS A 142 3.303 21.135 -4.516 1.00 0.00 N ATOM 1736 CA HIS A 142 4.484 21.787 -3.960 1.00 0.00 C ATOM 1737 C HIS A 142 5.230 20.847 -3.018 1.00 0.00 C ATOM 1738 O HIS A 142 5.701 21.259 -1.958 1.00 0.00 O ATOM 1739 CB HIS A 142 4.085 23.062 -3.216 1.00 0.00 C ATOM 1740 CG HIS A 142 3.229 22.811 -2.013 1.00 0.00 C ATOM 1741 ND1 HIS A 142 2.461 23.790 -1.419 1.00 0.00 N ATOM 1742 CD2 HIS A 142 3.021 21.684 -1.294 1.00 0.00 C ATOM 1743 CE1 HIS A 142 1.819 23.276 -0.386 1.00 0.00 C ATOM 1744 NE2 HIS A 142 2.141 21.999 -0.288 1.00 0.00 N ATOM 0 H HIS A 142 2.494 21.125 -3.894 1.00 0.00 H new ATOM 0 HA HIS A 142 5.147 22.048 -4.785 1.00 0.00 H new ATOM 0 HB2 HIS A 142 4.987 23.589 -2.906 1.00 0.00 H new ATOM 0 HB3 HIS A 142 3.551 23.720 -3.901 1.00 0.00 H new ATOM 0 HD1 HIS A 142 2.399 24.760 -1.729 1.00 0.00 H new ATOM 0 HD2 HIS A 142 3.465 20.716 -1.477 1.00 0.00 H new ATOM 0 HE1 HIS A 142 1.145 23.809 0.268 1.00 0.00 H new ATOM 1752 N PHE A 143 5.334 19.582 -3.412 1.00 0.00 N ATOM 1753 CA PHE A 143 6.022 18.583 -2.602 1.00 0.00 C ATOM 1754 C PHE A 143 7.458 19.011 -2.315 1.00 0.00 C ATOM 1755 O PHE A 143 8.332 18.911 -3.177 1.00 0.00 O ATOM 1756 CB PHE A 143 6.013 17.227 -3.311 1.00 0.00 C ATOM 1757 CG PHE A 143 6.666 16.132 -2.517 1.00 0.00 C ATOM 1758 CD1 PHE A 143 5.939 15.402 -1.591 1.00 0.00 C ATOM 1759 CD2 PHE A 143 8.007 15.831 -2.698 1.00 0.00 C ATOM 1760 CE1 PHE A 143 6.538 14.394 -0.858 1.00 0.00 C ATOM 1761 CE2 PHE A 143 8.611 14.824 -1.969 1.00 0.00 C ATOM 1762 CZ PHE A 143 7.875 14.104 -1.049 1.00 0.00 C ATOM 0 H PHE A 143 4.951 19.224 -4.287 1.00 0.00 H new ATOM 0 HA PHE A 143 5.493 18.492 -1.654 1.00 0.00 H new ATOM 0 HB2 PHE A 143 4.982 16.945 -3.525 1.00 0.00 H new ATOM 0 HB3 PHE A 143 6.523 17.324 -4.270 1.00 0.00 H new ATOM 0 HD1 PHE A 143 4.893 15.623 -1.440 1.00 0.00 H new ATOM 0 HD2 PHE A 143 8.587 16.390 -3.417 1.00 0.00 H new ATOM 0 HE1 PHE A 143 5.961 13.834 -0.137 1.00 0.00 H new ATOM 0 HE2 PHE A 143 9.657 14.601 -2.119 1.00 0.00 H new ATOM 0 HZ PHE A 143 8.344 13.315 -0.480 1.00 0.00 H new ATOM 1772 N VAL A 144 7.695 19.488 -1.097 1.00 0.00 N ATOM 1773 CA VAL A 144 9.025 19.930 -0.695 1.00 0.00 C ATOM 1774 C VAL A 144 9.796 18.805 -0.014 1.00 0.00 C ATOM 1775 O VAL A 144 9.530 18.466 1.139 1.00 0.00 O ATOM 1776 CB VAL A 144 8.950 21.137 0.260 1.00 0.00 C ATOM 1777 CG1 VAL A 144 10.335 21.498 0.774 1.00 0.00 C ATOM 1778 CG2 VAL A 144 8.303 22.326 -0.435 1.00 0.00 C ATOM 0 H VAL A 144 6.983 19.578 -0.372 1.00 0.00 H new ATOM 0 HA VAL A 144 9.548 20.226 -1.604 1.00 0.00 H new ATOM 0 HB VAL A 144 8.331 20.864 1.115 1.00 0.00 H new ATOM 0 HG11 VAL A 144 10.262 22.352 1.447 1.00 0.00 H new ATOM 0 HG12 VAL A 144 10.757 20.648 1.311 1.00 0.00 H new ATOM 0 HG13 VAL A 144 10.980 21.752 -0.067 1.00 0.00 H new ATOM 0 HG21 VAL A 144 8.258 23.170 0.254 1.00 0.00 H new ATOM 0 HG22 VAL A 144 8.893 22.602 -1.309 1.00 0.00 H new ATOM 0 HG23 VAL A 144 7.294 22.059 -0.748 1.00 0.00 H new ATOM 1788 N SER A 145 10.753 18.230 -0.735 1.00 0.00 N ATOM 1789 CA SER A 145 11.562 17.140 -0.202 1.00 0.00 C ATOM 1790 C SER A 145 12.656 17.675 0.718 1.00 0.00 C ATOM 1791 O SER A 145 13.106 18.812 0.571 1.00 0.00 O ATOM 1792 CB SER A 145 12.187 16.336 -1.343 1.00 0.00 C ATOM 1793 OG SER A 145 13.158 15.427 -0.854 1.00 0.00 O ATOM 0 H SER A 145 10.987 18.501 -1.690 1.00 0.00 H new ATOM 0 HA SER A 145 10.911 16.487 0.379 1.00 0.00 H new ATOM 0 HB2 SER A 145 11.409 15.790 -1.876 1.00 0.00 H new ATOM 0 HB3 SER A 145 12.648 17.015 -2.060 1.00 0.00 H new ATOM 0 HG SER A 145 13.821 15.249 -1.553 1.00 0.00 H new ATOM 1799 N HIS A 146 13.079 16.847 1.667 1.00 0.00 N ATOM 1800 CA HIS A 146 14.120 17.235 2.612 1.00 0.00 C ATOM 1801 C HIS A 146 15.256 16.215 2.618 1.00 0.00 C ATOM 1802 O HIS A 146 15.063 15.034 2.329 1.00 0.00 O ATOM 1803 CB HIS A 146 13.537 17.374 4.018 1.00 0.00 C ATOM 1804 CG HIS A 146 12.345 18.278 4.085 1.00 0.00 C ATOM 1805 ND1 HIS A 146 12.436 19.625 4.365 1.00 0.00 N ATOM 1806 CD2 HIS A 146 11.028 18.021 3.906 1.00 0.00 C ATOM 1807 CE1 HIS A 146 11.227 20.157 4.356 1.00 0.00 C ATOM 1808 NE2 HIS A 146 10.355 19.205 4.079 1.00 0.00 N ATOM 0 H HIS A 146 12.717 15.903 1.802 1.00 0.00 H new ATOM 0 HA HIS A 146 14.521 18.198 2.297 1.00 0.00 H new ATOM 0 HB2 HIS A 146 13.255 16.387 4.385 1.00 0.00 H new ATOM 0 HB3 HIS A 146 14.309 17.754 4.687 1.00 0.00 H new ATOM 0 HD2 HIS A 146 10.589 17.063 3.671 1.00 0.00 H new ATOM 0 HE1 HIS A 146 10.992 21.194 4.543 1.00 0.00 H new ATOM 0 HE2 HIS A 146 9.345 19.329 4.005 1.00 0.00 H new ATOM 1816 N PRO A 147 16.468 16.681 2.953 1.00 0.00 N ATOM 1817 CA PRO A 147 17.658 15.826 3.004 1.00 0.00 C ATOM 1818 C PRO A 147 17.610 14.835 4.162 1.00 0.00 C ATOM 1819 O PRO A 147 17.617 15.226 5.328 1.00 0.00 O ATOM 1820 CB PRO A 147 18.803 16.823 3.200 1.00 0.00 C ATOM 1821 CG PRO A 147 18.170 18.002 3.854 1.00 0.00 C ATOM 1822 CD PRO A 147 16.771 18.077 3.309 1.00 0.00 C ATOM 0 HA PRO A 147 17.758 15.212 2.109 1.00 0.00 H new ATOM 0 HB2 PRO A 147 19.593 16.402 3.822 1.00 0.00 H new ATOM 0 HB3 PRO A 147 19.258 17.095 2.248 1.00 0.00 H new ATOM 0 HG2 PRO A 147 18.161 17.889 4.938 1.00 0.00 H new ATOM 0 HG3 PRO A 147 18.724 18.915 3.634 1.00 0.00 H new ATOM 0 HD2 PRO A 147 16.071 18.464 4.050 1.00 0.00 H new ATOM 0 HD3 PRO A 147 16.712 18.735 2.442 1.00 0.00 H new ATOM 1830 N GLY A 148 17.562 13.547 3.831 1.00 0.00 N ATOM 1831 CA GLY A 148 17.514 12.520 4.855 1.00 0.00 C ATOM 1832 C GLY A 148 16.114 11.980 5.070 1.00 0.00 C ATOM 1833 O GLY A 148 15.936 10.805 5.390 1.00 0.00 O ATOM 0 H GLY A 148 17.556 13.198 2.873 1.00 0.00 H new ATOM 0 HA2 GLY A 148 18.177 11.701 4.575 1.00 0.00 H new ATOM 0 HA3 GLY A 148 17.890 12.929 5.793 1.00 0.00 H new ATOM 1837 N LYS A 149 15.117 12.841 4.896 1.00 0.00 N ATOM 1838 CA LYS A 149 13.724 12.445 5.073 1.00 0.00 C ATOM 1839 C LYS A 149 13.266 11.543 3.931 1.00 0.00 C ATOM 1840 O LYS A 149 14.059 11.167 3.067 1.00 0.00 O ATOM 1841 CB LYS A 149 12.827 13.682 5.152 1.00 0.00 C ATOM 1842 CG LYS A 149 13.043 14.511 6.406 1.00 0.00 C ATOM 1843 CD LYS A 149 12.407 13.858 7.622 1.00 0.00 C ATOM 1844 CE LYS A 149 10.896 14.028 7.619 1.00 0.00 C ATOM 1845 NZ LYS A 149 10.282 13.555 8.891 1.00 0.00 N ATOM 0 H LYS A 149 15.247 13.818 4.633 1.00 0.00 H new ATOM 0 HA LYS A 149 13.646 11.888 6.006 1.00 0.00 H new ATOM 0 HB2 LYS A 149 13.007 14.307 4.278 1.00 0.00 H new ATOM 0 HB3 LYS A 149 11.784 13.368 5.110 1.00 0.00 H new ATOM 0 HG2 LYS A 149 14.111 14.640 6.578 1.00 0.00 H new ATOM 0 HG3 LYS A 149 12.621 15.506 6.263 1.00 0.00 H new ATOM 0 HD2 LYS A 149 12.655 12.797 7.638 1.00 0.00 H new ATOM 0 HD3 LYS A 149 12.822 14.296 8.530 1.00 0.00 H new ATOM 0 HE2 LYS A 149 10.649 15.078 7.465 1.00 0.00 H new ATOM 0 HE3 LYS A 149 10.470 13.475 6.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 9.278 13.334 8.731 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 10.777 12.701 9.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 10.362 14.300 9.613 1.00 0.00 H new ATOM 1859 N TYR A 150 11.982 11.202 3.932 1.00 0.00 N ATOM 1860 CA TYR A 150 11.419 10.344 2.897 1.00 0.00 C ATOM 1861 C TYR A 150 11.084 11.149 1.645 1.00 0.00 C ATOM 1862 O TYR A 150 10.439 12.196 1.718 1.00 0.00 O ATOM 1863 CB TYR A 150 10.163 9.641 3.415 1.00 0.00 C ATOM 1864 CG TYR A 150 10.456 8.396 4.222 1.00 0.00 C ATOM 1865 CD1 TYR A 150 10.826 7.211 3.599 1.00 0.00 C ATOM 1866 CD2 TYR A 150 10.363 8.406 5.609 1.00 0.00 C ATOM 1867 CE1 TYR A 150 11.094 6.071 4.333 1.00 0.00 C ATOM 1868 CE2 TYR A 150 10.630 7.271 6.350 1.00 0.00 C ATOM 1869 CZ TYR A 150 10.995 6.107 5.708 1.00 0.00 C ATOM 1870 OH TYR A 150 11.262 4.974 6.442 1.00 0.00 O ATOM 0 H TYR A 150 11.312 11.507 4.638 1.00 0.00 H new ATOM 0 HA TYR A 150 12.166 9.594 2.637 1.00 0.00 H new ATOM 0 HB2 TYR A 150 9.595 10.338 4.031 1.00 0.00 H new ATOM 0 HB3 TYR A 150 9.530 9.375 2.568 1.00 0.00 H new ATOM 0 HD1 TYR A 150 10.906 7.180 2.522 1.00 0.00 H new ATOM 0 HD2 TYR A 150 10.077 9.316 6.116 1.00 0.00 H new ATOM 0 HE1 TYR A 150 11.379 5.157 3.833 1.00 0.00 H new ATOM 0 HE2 TYR A 150 10.553 7.296 7.427 1.00 0.00 H new ATOM 0 HH TYR A 150 11.147 5.168 7.396 1.00 0.00 H new ATOM 1880 N THR A 151 11.526 10.652 0.494 1.00 0.00 N ATOM 1881 CA THR A 151 11.275 11.324 -0.775 1.00 0.00 C ATOM 1882 C THR A 151 10.061 10.730 -1.481 1.00 0.00 C ATOM 1883 O THR A 151 9.578 9.659 -1.112 1.00 0.00 O ATOM 1884 CB THR A 151 12.495 11.230 -1.712 1.00 0.00 C ATOM 1885 OG1 THR A 151 13.041 9.907 -1.674 1.00 0.00 O ATOM 1886 CG2 THR A 151 13.563 12.236 -1.311 1.00 0.00 C ATOM 0 H THR A 151 12.060 9.786 0.415 1.00 0.00 H new ATOM 0 HA THR A 151 11.082 12.372 -0.545 1.00 0.00 H new ATOM 0 HB THR A 151 12.166 11.458 -2.726 1.00 0.00 H new ATOM 0 HG1 THR A 151 13.815 9.855 -2.273 1.00 0.00 H new ATOM 0 HG21 THR A 151 14.414 12.151 -1.986 1.00 0.00 H new ATOM 0 HG22 THR A 151 13.153 13.244 -1.369 1.00 0.00 H new ATOM 0 HG23 THR A 151 13.888 12.034 -0.290 1.00 0.00 H new ATOM 1894 N LEU A 152 9.572 11.432 -2.497 1.00 0.00 N ATOM 1895 CA LEU A 152 8.413 10.974 -3.255 1.00 0.00 C ATOM 1896 C LEU A 152 8.826 10.492 -4.642 1.00 0.00 C ATOM 1897 O LEU A 152 9.243 11.286 -5.487 1.00 0.00 O ATOM 1898 CB LEU A 152 7.382 12.098 -3.378 1.00 0.00 C ATOM 1899 CG LEU A 152 6.193 11.820 -4.298 1.00 0.00 C ATOM 1900 CD1 LEU A 152 5.403 10.619 -3.801 1.00 0.00 C ATOM 1901 CD2 LEU A 152 5.297 13.046 -4.397 1.00 0.00 C ATOM 0 H LEU A 152 9.960 12.320 -2.815 1.00 0.00 H new ATOM 0 HA LEU A 152 7.966 10.137 -2.718 1.00 0.00 H new ATOM 0 HB2 LEU A 152 7.000 12.324 -2.382 1.00 0.00 H new ATOM 0 HB3 LEU A 152 7.891 12.993 -3.735 1.00 0.00 H new ATOM 0 HG LEU A 152 6.574 11.592 -5.293 1.00 0.00 H new ATOM 0 HD11 LEU A 152 4.561 10.436 -4.468 1.00 0.00 H new ATOM 0 HD12 LEU A 152 6.049 9.741 -3.783 1.00 0.00 H new ATOM 0 HD13 LEU A 152 5.033 10.818 -2.795 1.00 0.00 H new ATOM 0 HD21 LEU A 152 4.456 12.830 -5.056 1.00 0.00 H new ATOM 0 HD22 LEU A 152 4.924 13.305 -3.406 1.00 0.00 H new ATOM 0 HD23 LEU A 152 5.868 13.882 -4.800 1.00 0.00 H new ATOM 1913 N ILE A 153 8.704 9.189 -4.871 1.00 0.00 N ATOM 1914 CA ILE A 153 9.062 8.603 -6.157 1.00 0.00 C ATOM 1915 C ILE A 153 7.847 7.975 -6.832 1.00 0.00 C ATOM 1916 O ILE A 153 6.779 7.867 -6.231 1.00 0.00 O ATOM 1917 CB ILE A 153 10.159 7.534 -6.003 1.00 0.00 C ATOM 1918 CG1 ILE A 153 10.010 6.808 -4.664 1.00 0.00 C ATOM 1919 CG2 ILE A 153 11.537 8.169 -6.116 1.00 0.00 C ATOM 1920 CD1 ILE A 153 10.624 7.553 -3.501 1.00 0.00 C ATOM 0 H ILE A 153 8.360 8.519 -4.183 1.00 0.00 H new ATOM 0 HA ILE A 153 9.442 9.414 -6.778 1.00 0.00 H new ATOM 0 HB ILE A 153 10.049 6.804 -6.805 1.00 0.00 H new ATOM 0 HG12 ILE A 153 8.951 6.647 -4.463 1.00 0.00 H new ATOM 0 HG13 ILE A 153 10.473 5.824 -4.740 1.00 0.00 H new ATOM 0 HG21 ILE A 153 12.302 7.400 -6.005 1.00 0.00 H new ATOM 0 HG22 ILE A 153 11.639 8.645 -7.091 1.00 0.00 H new ATOM 0 HG23 ILE A 153 11.658 8.917 -5.333 1.00 0.00 H new ATOM 0 HD11 ILE A 153 10.481 6.980 -2.585 1.00 0.00 H new ATOM 0 HD12 ILE A 153 11.690 7.691 -3.680 1.00 0.00 H new ATOM 0 HD13 ILE A 153 10.144 8.526 -3.398 1.00 0.00 H new ATOM 1932 N GLU A 154 8.020 7.562 -8.083 1.00 0.00 N ATOM 1933 CA GLU A 154 6.937 6.943 -8.839 1.00 0.00 C ATOM 1934 C GLU A 154 7.323 5.538 -9.291 1.00 0.00 C ATOM 1935 O GLU A 154 6.694 4.966 -10.182 1.00 0.00 O ATOM 1936 CB GLU A 154 6.578 7.801 -10.054 1.00 0.00 C ATOM 1937 CG GLU A 154 7.766 8.122 -10.945 1.00 0.00 C ATOM 1938 CD GLU A 154 7.449 9.184 -11.980 1.00 0.00 C ATOM 1939 OE1 GLU A 154 7.253 10.354 -11.590 1.00 0.00 O ATOM 1940 OE2 GLU A 154 7.398 8.845 -13.181 1.00 0.00 O ATOM 0 H GLU A 154 8.899 7.644 -8.594 1.00 0.00 H new ATOM 0 HA GLU A 154 6.068 6.870 -8.185 1.00 0.00 H new ATOM 0 HB2 GLU A 154 5.822 7.283 -10.644 1.00 0.00 H new ATOM 0 HB3 GLU A 154 6.130 8.733 -9.710 1.00 0.00 H new ATOM 0 HG2 GLU A 154 8.598 8.459 -10.327 1.00 0.00 H new ATOM 0 HG3 GLU A 154 8.092 7.213 -11.451 1.00 0.00 H new ATOM 1947 N VAL A 155 8.361 4.987 -8.671 1.00 0.00 N ATOM 1948 CA VAL A 155 8.832 3.649 -9.008 1.00 0.00 C ATOM 1949 C VAL A 155 9.033 3.500 -10.512 1.00 0.00 C ATOM 1950 O VAL A 155 8.677 4.388 -11.286 1.00 0.00 O ATOM 1951 CB VAL A 155 7.846 2.569 -8.524 1.00 0.00 C ATOM 1952 CG1 VAL A 155 6.607 2.542 -9.406 1.00 0.00 C ATOM 1953 CG2 VAL A 155 8.521 1.206 -8.497 1.00 0.00 C ATOM 0 H VAL A 155 8.892 5.447 -7.932 1.00 0.00 H new ATOM 0 HA VAL A 155 9.787 3.512 -8.501 1.00 0.00 H new ATOM 0 HB VAL A 155 7.534 2.815 -7.509 1.00 0.00 H new ATOM 0 HG11 VAL A 155 5.922 1.773 -9.048 1.00 0.00 H new ATOM 0 HG12 VAL A 155 6.113 3.513 -9.369 1.00 0.00 H new ATOM 0 HG13 VAL A 155 6.896 2.321 -10.433 1.00 0.00 H new ATOM 0 HG21 VAL A 155 7.810 0.455 -8.153 1.00 0.00 H new ATOM 0 HG22 VAL A 155 8.863 0.949 -9.500 1.00 0.00 H new ATOM 0 HG23 VAL A 155 9.374 1.236 -7.819 1.00 0.00 H new ATOM 1963 N GLN A 156 9.604 2.371 -10.918 1.00 0.00 N ATOM 1964 CA GLN A 156 9.853 2.106 -12.330 1.00 0.00 C ATOM 1965 C GLN A 156 9.205 0.794 -12.760 1.00 0.00 C ATOM 1966 O GLN A 156 9.782 -0.280 -12.589 1.00 0.00 O ATOM 1967 CB GLN A 156 11.357 2.060 -12.606 1.00 0.00 C ATOM 1968 CG GLN A 156 12.091 1.001 -11.799 1.00 0.00 C ATOM 1969 CD GLN A 156 13.564 1.315 -11.627 1.00 0.00 C ATOM 1970 OE1 GLN A 156 13.956 2.479 -11.545 1.00 0.00 O ATOM 1971 NE2 GLN A 156 14.389 0.276 -11.571 1.00 0.00 N ATOM 0 H GLN A 156 9.903 1.625 -10.290 1.00 0.00 H new ATOM 0 HA GLN A 156 9.410 2.916 -12.909 1.00 0.00 H new ATOM 0 HB2 GLN A 156 11.518 1.872 -13.668 1.00 0.00 H new ATOM 0 HB3 GLN A 156 11.788 3.037 -12.386 1.00 0.00 H new ATOM 0 HG2 GLN A 156 11.626 0.910 -10.817 1.00 0.00 H new ATOM 0 HG3 GLN A 156 11.985 0.035 -12.293 1.00 0.00 H new ATOM 0 HE21 GLN A 156 14.020 -0.672 -11.643 1.00 0.00 H new ATOM 0 HE22 GLN A 156 15.391 0.426 -11.456 1.00 0.00 H new ATOM 1980 N ALA A 157 8.003 0.888 -13.319 1.00 0.00 N ATOM 1981 CA ALA A 157 7.277 -0.291 -13.775 1.00 0.00 C ATOM 1982 C ALA A 157 6.195 0.085 -14.780 1.00 0.00 C ATOM 1983 O ALA A 157 5.251 0.804 -14.451 1.00 0.00 O ATOM 1984 CB ALA A 157 6.668 -1.026 -12.590 1.00 0.00 C ATOM 0 H ALA A 157 7.511 1.769 -13.467 1.00 0.00 H new ATOM 0 HA ALA A 157 7.985 -0.953 -14.274 1.00 0.00 H new ATOM 0 HB1 ALA A 157 6.129 -1.904 -12.945 1.00 0.00 H new ATOM 0 HB2 ALA A 157 7.460 -1.337 -11.909 1.00 0.00 H new ATOM 0 HB3 ALA A 157 5.978 -0.364 -12.066 1.00 0.00 H new TER 1990 ALA A 157