USER MOD reduce.3.24.130724 H: found=0, std=0, add=975, rem=0, adj=31 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 134 LYS NZ :NH3+ 178:sc= 0.00139 (180deg=0) USER MOD Set 1.2: A 146 HIS : no HD1:sc= -0.739 K(o=-0.74,f=-0.11) USER MOD Set 2.1: A 132 LYS NZ :NH3+ -158:sc= 0.693 (180deg=0.41) USER MOD Set 2.2: A 150 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 99 ASN : amide:sc= -1.7 K(o=-3.1,f=-4!) USER MOD Set 3.2: A 113 ASN : amide:sc= -1.38 K(o=-3.1,f=-3.7!) USER MOD Set 4.1: A 96 THR OG1 : rot -109:sc= 0.015 USER MOD Set 4.2: A 114 HIS : no HD1:sc= -0.145 K(o=-0.13,f=-1) USER MOD Set 5.1: A 83 TYR OH : rot 108:sc= 0.0307 USER MOD Set 5.2: A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 SER OG : rot 24:sc= 0.259 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 12:sc= 0.704 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 THR OG1 : rot -81:sc= 0.241 USER MOD Single : A 52 CYS SG : rot -160:sc= -0.692 USER MOD Single : A 55 SER OG : rot 121:sc= 0.0121 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 57 ASN : amide:sc= -0.106 K(o=-0.11,f=-2.2!) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -4.15! C(o=-4.1!,f=-6.9!) USER MOD Single : A 68 CYS SG : rot 159:sc= 0.543 USER MOD Single : A 69 THR OG1 : rot -160:sc= 0 USER MOD Single : A 71 ASN : amide:sc= -0.135 K(o=-0.14,f=-3.1!) USER MOD Single : A 72 GLN : amide:sc= -0.618 K(o=-0.62,f=-7.1!) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -1.25 K(o=-1.2,f=-2.9!) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 ASN : amide:sc= -0.0489 K(o=-0.049,f=-1.2!) USER MOD Single : A 79 ASN : amide:sc= -0.777 K(o=-0.78,f=-2.1!) USER MOD Single : A 80 ASN : amide:sc= -2.17! C(o=-2.2!,f=-9.2!) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 GLN : amide:sc= -1.12 K(o=-1.1,f=-5!) USER MOD Single : A 89 GLN : amide:sc= -0.109 K(o=-0.11,f=-1.4!) USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= -0.0023 X(o=-0.0023,f=-0.13) USER MOD Single : A 97 CYS SG : rot 119:sc= 0.468 USER MOD Single : A 109 GLN : amide:sc= -0.0621 K(o=-0.062,f=-0.59) USER MOD Single : A 110 SER OG : rot 19:sc= 0.296 USER MOD Single : A 111 LYS NZ :NH3+ 161:sc= -0.0122 (180deg=-0.217) USER MOD Single : A 116 THR OG1 : rot 180:sc= -0.021 USER MOD Single : A 122 LYS NZ :NH3+ 178:sc= -0.572 (180deg=-0.593) USER MOD Single : A 123 LYS NZ :NH3+ 163:sc= -0.0202 (180deg=-0.206) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 THR OG1 : rot -165:sc= 1.14 USER MOD Single : A 135 ASN : amide:sc= -1.05 X(o=-1,f=-1.5) USER MOD Single : A 136 ASN : amide:sc= -0.112 K(o=-0.11,f=-2.1!) USER MOD Single : A 142 HIS : no HE2:sc= -8.74! C(o=-8.7!,f=-7.5!) USER MOD Single : A 145 SER OG : rot 41:sc= 0.948 USER MOD Single : A 149 LYS NZ :NH3+ 143:sc= -1.26 (180deg=-4.45!) USER MOD Single : A 151 THR OG1 : rot 180:sc= -0.16 USER MOD Single : A 156 GLN : amide:sc= -0.104 K(o=-0.1,f=-0.83) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 34 -16.287 -7.330 -33.971 1.00 0.00 N ATOM 2 CA GLY A 34 -15.287 -7.087 -32.948 1.00 0.00 C ATOM 3 C GLY A 34 -15.537 -5.801 -32.186 1.00 0.00 C ATOM 4 O GLY A 34 -16.576 -5.163 -32.355 1.00 0.00 O ATOM 0 HA2 GLY A 34 -15.276 -7.923 -32.249 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -14.301 -7.046 -33.411 1.00 0.00 H new ATOM 8 N SER A 35 -14.583 -5.419 -31.343 1.00 0.00 N ATOM 9 CA SER A 35 -14.707 -4.203 -30.547 1.00 0.00 C ATOM 10 C SER A 35 -13.389 -3.871 -29.854 1.00 0.00 C ATOM 11 O SER A 35 -12.795 -4.717 -29.187 1.00 0.00 O ATOM 12 CB SER A 35 -15.818 -4.360 -29.507 1.00 0.00 C ATOM 13 OG SER A 35 -15.492 -5.363 -28.560 1.00 0.00 O ATOM 0 H SER A 35 -13.715 -5.934 -31.193 1.00 0.00 H new ATOM 0 HA SER A 35 -14.961 -3.383 -31.218 1.00 0.00 H new ATOM 0 HB2 SER A 35 -15.978 -3.411 -28.996 1.00 0.00 H new ATOM 0 HB3 SER A 35 -16.753 -4.616 -30.005 1.00 0.00 H new ATOM 0 HG SER A 35 -14.519 -5.477 -28.526 1.00 0.00 H new ATOM 19 N SER A 36 -12.938 -2.631 -30.018 1.00 0.00 N ATOM 20 CA SER A 36 -11.689 -2.186 -29.412 1.00 0.00 C ATOM 21 C SER A 36 -11.369 -0.751 -29.818 1.00 0.00 C ATOM 22 O SER A 36 -11.432 -0.398 -30.996 1.00 0.00 O ATOM 23 CB SER A 36 -10.541 -3.112 -29.821 1.00 0.00 C ATOM 24 OG SER A 36 -9.287 -2.560 -29.457 1.00 0.00 O ATOM 0 H SER A 36 -13.419 -1.917 -30.565 1.00 0.00 H new ATOM 0 HA SER A 36 -11.807 -2.221 -28.329 1.00 0.00 H new ATOM 0 HB2 SER A 36 -10.666 -4.084 -29.344 1.00 0.00 H new ATOM 0 HB3 SER A 36 -10.570 -3.279 -30.898 1.00 0.00 H new ATOM 0 HG SER A 36 -8.570 -3.171 -29.727 1.00 0.00 H new ATOM 30 N GLY A 37 -11.026 0.074 -28.834 1.00 0.00 N ATOM 31 CA GLY A 37 -10.701 1.462 -29.108 1.00 0.00 C ATOM 32 C GLY A 37 -10.844 2.343 -27.883 1.00 0.00 C ATOM 33 O GLY A 37 -11.536 1.986 -26.929 1.00 0.00 O ATOM 0 H GLY A 37 -10.967 -0.194 -27.852 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -9.679 1.526 -29.480 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -11.352 1.835 -29.898 1.00 0.00 H new ATOM 37 N SER A 38 -10.186 3.498 -27.907 1.00 0.00 N ATOM 38 CA SER A 38 -10.238 4.431 -26.787 1.00 0.00 C ATOM 39 C SER A 38 -9.533 5.738 -27.136 1.00 0.00 C ATOM 40 O SER A 38 -8.516 5.742 -27.829 1.00 0.00 O ATOM 41 CB SER A 38 -9.596 3.808 -25.546 1.00 0.00 C ATOM 42 OG SER A 38 -9.944 4.527 -24.376 1.00 0.00 O ATOM 0 H SER A 38 -9.611 3.810 -28.689 1.00 0.00 H new ATOM 0 HA SER A 38 -11.285 4.648 -26.575 1.00 0.00 H new ATOM 0 HB2 SER A 38 -9.917 2.771 -25.448 1.00 0.00 H new ATOM 0 HB3 SER A 38 -8.512 3.796 -25.661 1.00 0.00 H new ATOM 0 HG SER A 38 -9.523 4.108 -23.597 1.00 0.00 H new ATOM 48 N SER A 39 -10.082 6.847 -26.650 1.00 0.00 N ATOM 49 CA SER A 39 -9.509 8.162 -26.913 1.00 0.00 C ATOM 50 C SER A 39 -9.961 9.172 -25.862 1.00 0.00 C ATOM 51 O SER A 39 -11.154 9.434 -25.710 1.00 0.00 O ATOM 52 CB SER A 39 -9.909 8.647 -28.308 1.00 0.00 C ATOM 53 OG SER A 39 -11.264 9.060 -28.335 1.00 0.00 O ATOM 0 H SER A 39 -10.923 6.861 -26.072 1.00 0.00 H new ATOM 0 HA SER A 39 -8.424 8.074 -26.864 1.00 0.00 H new ATOM 0 HB2 SER A 39 -9.267 9.476 -28.606 1.00 0.00 H new ATOM 0 HB3 SER A 39 -9.755 7.847 -29.033 1.00 0.00 H new ATOM 0 HG SER A 39 -11.606 9.120 -27.419 1.00 0.00 H new ATOM 59 N GLY A 40 -8.999 9.735 -25.139 1.00 0.00 N ATOM 60 CA GLY A 40 -9.317 10.709 -24.111 1.00 0.00 C ATOM 61 C GLY A 40 -8.101 11.118 -23.303 1.00 0.00 C ATOM 62 O GLY A 40 -6.978 11.096 -23.805 1.00 0.00 O ATOM 0 H GLY A 40 -8.005 9.534 -25.246 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -9.755 11.593 -24.575 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -10.071 10.294 -23.442 1.00 0.00 H new ATOM 66 N ALA A 41 -8.325 11.492 -22.048 1.00 0.00 N ATOM 67 CA ALA A 41 -7.239 11.907 -21.168 1.00 0.00 C ATOM 68 C ALA A 41 -6.527 10.699 -20.569 1.00 0.00 C ATOM 69 O ALA A 41 -7.166 9.730 -20.160 1.00 0.00 O ATOM 70 CB ALA A 41 -7.769 12.811 -20.065 1.00 0.00 C ATOM 0 H ALA A 41 -9.249 11.516 -21.617 1.00 0.00 H new ATOM 0 HA ALA A 41 -6.515 12.465 -21.762 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -6.947 13.113 -19.416 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -8.226 13.696 -20.508 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -8.514 12.272 -19.480 1.00 0.00 H new ATOM 76 N GLU A 42 -5.200 10.764 -20.521 1.00 0.00 N ATOM 77 CA GLU A 42 -4.401 9.674 -19.972 1.00 0.00 C ATOM 78 C GLU A 42 -5.056 9.096 -18.721 1.00 0.00 C ATOM 79 O GLU A 42 -5.550 9.833 -17.868 1.00 0.00 O ATOM 80 CB GLU A 42 -2.989 10.163 -19.643 1.00 0.00 C ATOM 81 CG GLU A 42 -2.963 11.380 -18.734 1.00 0.00 C ATOM 82 CD GLU A 42 -1.626 11.563 -18.042 1.00 0.00 C ATOM 83 OE1 GLU A 42 -1.048 10.552 -17.591 1.00 0.00 O ATOM 84 OE2 GLU A 42 -1.158 12.717 -17.951 1.00 0.00 O ATOM 0 H GLU A 42 -4.656 11.559 -20.855 1.00 0.00 H new ATOM 0 HA GLU A 42 -4.339 8.888 -20.724 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -2.435 9.353 -19.168 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -2.471 10.402 -20.572 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -3.190 12.271 -19.319 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -3.747 11.284 -17.983 1.00 0.00 H new ATOM 91 N LYS A 43 -5.057 7.772 -18.619 1.00 0.00 N ATOM 92 CA LYS A 43 -5.650 7.092 -17.474 1.00 0.00 C ATOM 93 C LYS A 43 -4.584 6.361 -16.664 1.00 0.00 C ATOM 94 O LYS A 43 -3.668 5.760 -17.225 1.00 0.00 O ATOM 95 CB LYS A 43 -6.720 6.102 -17.939 1.00 0.00 C ATOM 96 CG LYS A 43 -6.183 5.007 -18.844 1.00 0.00 C ATOM 97 CD LYS A 43 -7.018 3.741 -18.742 1.00 0.00 C ATOM 98 CE LYS A 43 -6.179 2.498 -18.996 1.00 0.00 C ATOM 99 NZ LYS A 43 -5.832 2.347 -20.436 1.00 0.00 N ATOM 0 H LYS A 43 -4.653 7.147 -19.317 1.00 0.00 H new ATOM 0 HA LYS A 43 -6.114 7.845 -16.837 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -7.184 5.645 -17.065 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -7.502 6.647 -18.467 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -6.176 5.357 -19.876 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -5.150 4.786 -18.576 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -7.469 3.680 -17.752 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -7.835 3.784 -19.463 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -5.264 2.551 -18.406 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -6.725 1.617 -18.660 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -5.260 1.488 -20.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -6.704 2.271 -20.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -5.289 3.176 -20.751 1.00 0.00 H new ATOM 113 N ARG A 44 -4.712 6.414 -15.342 1.00 0.00 N ATOM 114 CA ARG A 44 -3.760 5.756 -14.455 1.00 0.00 C ATOM 115 C ARG A 44 -4.349 4.470 -13.882 1.00 0.00 C ATOM 116 O ARG A 44 -5.545 4.397 -13.597 1.00 0.00 O ATOM 117 CB ARG A 44 -3.356 6.695 -13.318 1.00 0.00 C ATOM 118 CG ARG A 44 -1.976 6.408 -12.751 1.00 0.00 C ATOM 119 CD ARG A 44 -1.888 6.783 -11.280 1.00 0.00 C ATOM 120 NE ARG A 44 -0.576 6.479 -10.714 1.00 0.00 N ATOM 121 CZ ARG A 44 -0.272 6.646 -9.432 1.00 0.00 C ATOM 122 NH1 ARG A 44 -1.181 7.111 -8.587 1.00 0.00 N ATOM 123 NH2 ARG A 44 0.944 6.347 -8.993 1.00 0.00 N ATOM 0 H ARG A 44 -5.466 6.906 -14.862 1.00 0.00 H new ATOM 0 HA ARG A 44 -2.875 5.502 -15.038 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -3.384 7.723 -13.680 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.091 6.619 -12.517 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -1.745 5.350 -12.872 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -1.227 6.964 -13.315 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -2.095 7.847 -11.164 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -2.656 6.247 -10.723 1.00 0.00 H new ATOM 0 HE ARG A 44 0.146 6.119 -11.338 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -2.117 7.342 -8.921 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -0.945 7.238 -7.603 1.00 0.00 H new ATOM 0 HH21 ARG A 44 1.646 5.989 -9.640 1.00 0.00 H new ATOM 0 HH22 ARG A 44 1.177 6.476 -8.008 1.00 0.00 H new ATOM 137 N ILE A 45 -3.503 3.459 -13.717 1.00 0.00 N ATOM 138 CA ILE A 45 -3.940 2.178 -13.178 1.00 0.00 C ATOM 139 C ILE A 45 -3.043 1.730 -12.029 1.00 0.00 C ATOM 140 O ILE A 45 -1.833 1.957 -12.048 1.00 0.00 O ATOM 141 CB ILE A 45 -3.949 1.084 -14.263 1.00 0.00 C ATOM 142 CG1 ILE A 45 -4.876 1.484 -15.413 1.00 0.00 C ATOM 143 CG2 ILE A 45 -4.378 -0.248 -13.668 1.00 0.00 C ATOM 144 CD1 ILE A 45 -6.326 1.616 -15.002 1.00 0.00 C ATOM 0 H ILE A 45 -2.511 3.503 -13.949 1.00 0.00 H new ATOM 0 HA ILE A 45 -4.956 2.321 -12.809 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.939 0.975 -14.657 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -4.537 2.433 -15.829 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -4.798 0.741 -16.207 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -4.379 -1.011 -14.447 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -3.682 -0.535 -12.880 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -5.380 -0.154 -13.250 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -6.925 1.902 -15.867 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -6.682 0.662 -14.613 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -6.417 2.380 -14.229 1.00 0.00 H new ATOM 156 N ILE A 46 -3.645 1.092 -11.031 1.00 0.00 N ATOM 157 CA ILE A 46 -2.900 0.610 -9.874 1.00 0.00 C ATOM 158 C ILE A 46 -3.073 -0.895 -9.697 1.00 0.00 C ATOM 159 O ILE A 46 -4.042 -1.480 -10.182 1.00 0.00 O ATOM 160 CB ILE A 46 -3.343 1.322 -8.582 1.00 0.00 C ATOM 161 CG1 ILE A 46 -3.452 2.830 -8.817 1.00 0.00 C ATOM 162 CG2 ILE A 46 -2.368 1.025 -7.453 1.00 0.00 C ATOM 163 CD1 ILE A 46 -2.115 3.510 -9.008 1.00 0.00 C ATOM 0 H ILE A 46 -4.646 0.897 -11.000 1.00 0.00 H new ATOM 0 HA ILE A 46 -1.849 0.833 -10.060 1.00 0.00 H new ATOM 0 HB ILE A 46 -4.325 0.946 -8.295 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -4.070 3.009 -9.697 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -3.964 3.285 -7.970 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.694 1.535 -6.547 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.336 -0.050 -7.273 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -1.374 1.376 -7.729 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.269 4.577 -9.170 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -1.502 3.363 -8.119 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -1.609 3.081 -9.873 1.00 0.00 H new ATOM 175 N ARG A 47 -2.128 -1.515 -8.998 1.00 0.00 N ATOM 176 CA ARG A 47 -2.177 -2.952 -8.756 1.00 0.00 C ATOM 177 C ARG A 47 -1.818 -3.272 -7.308 1.00 0.00 C ATOM 178 O ARG A 47 -0.797 -2.815 -6.794 1.00 0.00 O ATOM 179 CB ARG A 47 -1.222 -3.683 -9.702 1.00 0.00 C ATOM 180 CG ARG A 47 -1.371 -3.270 -11.157 1.00 0.00 C ATOM 181 CD ARG A 47 -2.488 -4.041 -11.843 1.00 0.00 C ATOM 182 NE ARG A 47 -2.222 -5.476 -11.876 1.00 0.00 N ATOM 183 CZ ARG A 47 -2.648 -6.324 -10.946 1.00 0.00 C ATOM 184 NH1 ARG A 47 -3.356 -5.883 -9.916 1.00 0.00 N ATOM 185 NH2 ARG A 47 -2.365 -7.617 -11.046 1.00 0.00 N ATOM 0 H ARG A 47 -1.320 -1.045 -8.590 1.00 0.00 H new ATOM 0 HA ARG A 47 -3.195 -3.292 -8.944 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -0.196 -3.497 -9.384 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -1.392 -4.756 -9.619 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -1.577 -2.201 -11.214 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -0.432 -3.442 -11.683 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -3.428 -3.858 -11.322 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -2.611 -3.672 -12.861 1.00 0.00 H new ATOM 0 HE ARG A 47 -1.679 -5.848 -12.656 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -3.575 -4.890 -9.836 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -3.682 -6.537 -9.204 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -1.820 -7.960 -11.837 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -2.692 -8.267 -10.332 1.00 0.00 H new ATOM 199 N VAL A 48 -2.666 -4.060 -6.654 1.00 0.00 N ATOM 200 CA VAL A 48 -2.439 -4.442 -5.265 1.00 0.00 C ATOM 201 C VAL A 48 -1.075 -5.100 -5.092 1.00 0.00 C ATOM 202 O VAL A 48 -0.816 -6.170 -5.642 1.00 0.00 O ATOM 203 CB VAL A 48 -3.529 -5.406 -4.763 1.00 0.00 C ATOM 204 CG1 VAL A 48 -3.210 -5.887 -3.355 1.00 0.00 C ATOM 205 CG2 VAL A 48 -4.895 -4.737 -4.809 1.00 0.00 C ATOM 0 H VAL A 48 -3.516 -4.446 -7.064 1.00 0.00 H new ATOM 0 HA VAL A 48 -2.475 -3.526 -4.675 1.00 0.00 H new ATOM 0 HB VAL A 48 -3.552 -6.274 -5.422 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -3.992 -6.567 -3.017 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -2.252 -6.407 -3.356 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -3.158 -5.032 -2.681 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.653 -5.433 -4.451 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -4.888 -3.850 -4.175 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -5.124 -4.447 -5.835 1.00 0.00 H new ATOM 215 N ASP A 49 -0.205 -4.452 -4.324 1.00 0.00 N ATOM 216 CA ASP A 49 1.134 -4.975 -4.076 1.00 0.00 C ATOM 217 C ASP A 49 1.109 -6.495 -3.953 1.00 0.00 C ATOM 218 O ASP A 49 0.183 -7.082 -3.392 1.00 0.00 O ATOM 219 CB ASP A 49 1.718 -4.357 -2.805 1.00 0.00 C ATOM 220 CG ASP A 49 3.221 -4.171 -2.890 1.00 0.00 C ATOM 221 OD1 ASP A 49 3.693 -3.616 -3.904 1.00 0.00 O ATOM 222 OD2 ASP A 49 3.924 -4.582 -1.943 1.00 0.00 O ATOM 0 H ASP A 49 -0.403 -3.564 -3.863 1.00 0.00 H new ATOM 0 HA ASP A 49 1.765 -4.708 -4.924 1.00 0.00 H new ATOM 0 HB2 ASP A 49 1.245 -3.392 -2.623 1.00 0.00 H new ATOM 0 HB3 ASP A 49 1.481 -4.994 -1.953 1.00 0.00 H new ATOM 227 N PRO A 50 2.149 -7.150 -4.490 1.00 0.00 N ATOM 228 CA PRO A 50 2.270 -8.610 -4.453 1.00 0.00 C ATOM 229 C PRO A 50 2.541 -9.134 -3.047 1.00 0.00 C ATOM 230 O PRO A 50 1.956 -10.131 -2.621 1.00 0.00 O ATOM 231 CB PRO A 50 3.466 -8.890 -5.368 1.00 0.00 C ATOM 232 CG PRO A 50 4.274 -7.640 -5.328 1.00 0.00 C ATOM 233 CD PRO A 50 3.288 -6.514 -5.174 1.00 0.00 C ATOM 0 HA PRO A 50 1.350 -9.103 -4.767 1.00 0.00 H new ATOM 0 HB2 PRO A 50 4.042 -9.745 -5.016 1.00 0.00 H new ATOM 0 HB3 PRO A 50 3.143 -9.120 -6.383 1.00 0.00 H new ATOM 0 HG2 PRO A 50 4.979 -7.658 -4.497 1.00 0.00 H new ATOM 0 HG3 PRO A 50 4.859 -7.524 -6.240 1.00 0.00 H new ATOM 0 HD2 PRO A 50 3.702 -5.694 -4.587 1.00 0.00 H new ATOM 0 HD3 PRO A 50 2.997 -6.100 -6.139 1.00 0.00 H new ATOM 241 N THR A 51 3.430 -8.457 -2.329 1.00 0.00 N ATOM 242 CA THR A 51 3.779 -8.854 -0.971 1.00 0.00 C ATOM 243 C THR A 51 2.535 -8.985 -0.100 1.00 0.00 C ATOM 244 O THR A 51 2.511 -9.765 0.853 1.00 0.00 O ATOM 245 CB THR A 51 4.744 -7.845 -0.320 1.00 0.00 C ATOM 246 OG1 THR A 51 4.248 -6.513 -0.490 1.00 0.00 O ATOM 247 CG2 THR A 51 6.134 -7.956 -0.928 1.00 0.00 C ATOM 0 H THR A 51 3.922 -7.630 -2.666 1.00 0.00 H new ATOM 0 HA THR A 51 4.273 -9.823 -1.043 1.00 0.00 H new ATOM 0 HB THR A 51 4.811 -8.074 0.744 1.00 0.00 H new ATOM 0 HG1 THR A 51 4.481 -6.189 -1.385 1.00 0.00 H new ATOM 0 HG21 THR A 51 6.798 -7.234 -0.453 1.00 0.00 H new ATOM 0 HG22 THR A 51 6.521 -8.963 -0.771 1.00 0.00 H new ATOM 0 HG23 THR A 51 6.081 -7.751 -1.997 1.00 0.00 H new ATOM 255 N CYS A 52 1.502 -8.218 -0.432 1.00 0.00 N ATOM 256 CA CYS A 52 0.253 -8.248 0.321 1.00 0.00 C ATOM 257 C CYS A 52 -0.529 -9.524 0.025 1.00 0.00 C ATOM 258 O CYS A 52 -0.662 -9.947 -1.123 1.00 0.00 O ATOM 259 CB CYS A 52 -0.599 -7.023 -0.016 1.00 0.00 C ATOM 260 SG CYS A 52 -2.352 -7.211 0.386 1.00 0.00 S ATOM 0 H CYS A 52 1.505 -7.568 -1.218 1.00 0.00 H new ATOM 0 HA CYS A 52 0.497 -8.231 1.383 1.00 0.00 H new ATOM 0 HB2 CYS A 52 -0.204 -6.160 0.521 1.00 0.00 H new ATOM 0 HB3 CYS A 52 -0.502 -6.808 -1.080 1.00 0.00 H new ATOM 0 HG CYS A 52 -3.048 -6.346 -0.291 1.00 0.00 H new ATOM 266 N PRO A 53 -1.058 -10.153 1.085 1.00 0.00 N ATOM 267 CA PRO A 53 -1.835 -11.390 0.964 1.00 0.00 C ATOM 268 C PRO A 53 -3.189 -11.162 0.301 1.00 0.00 C ATOM 269 O PRO A 53 -3.546 -11.850 -0.656 1.00 0.00 O ATOM 270 CB PRO A 53 -2.020 -11.835 2.417 1.00 0.00 C ATOM 271 CG PRO A 53 -1.918 -10.580 3.214 1.00 0.00 C ATOM 272 CD PRO A 53 -0.939 -9.704 2.482 1.00 0.00 C ATOM 0 HA PRO A 53 -1.333 -12.127 0.338 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -2.986 -12.319 2.563 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -1.255 -12.554 2.711 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -2.889 -10.093 3.301 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -1.574 -10.788 4.227 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -1.188 -8.648 2.587 1.00 0.00 H new ATOM 0 HD3 PRO A 53 0.075 -9.832 2.860 1.00 0.00 H new ATOM 280 N LEU A 54 -3.938 -10.192 0.813 1.00 0.00 N ATOM 281 CA LEU A 54 -5.253 -9.872 0.269 1.00 0.00 C ATOM 282 C LEU A 54 -5.233 -9.898 -1.256 1.00 0.00 C ATOM 283 O LEU A 54 -6.203 -10.308 -1.893 1.00 0.00 O ATOM 284 CB LEU A 54 -5.710 -8.498 0.761 1.00 0.00 C ATOM 285 CG LEU A 54 -5.802 -8.324 2.278 1.00 0.00 C ATOM 286 CD1 LEU A 54 -5.960 -6.856 2.638 1.00 0.00 C ATOM 287 CD2 LEU A 54 -6.957 -9.141 2.839 1.00 0.00 C ATOM 0 H LEU A 54 -3.657 -9.613 1.604 1.00 0.00 H new ATOM 0 HA LEU A 54 -5.956 -10.628 0.618 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -5.023 -7.747 0.370 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -6.689 -8.288 0.331 1.00 0.00 H new ATOM 0 HG LEU A 54 -4.876 -8.688 2.723 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -6.024 -6.752 3.721 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.100 -6.296 2.270 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -6.870 -6.465 2.182 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -7.008 -9.005 3.919 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -7.891 -8.808 2.387 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -6.800 -10.196 2.613 1.00 0.00 H new ATOM 299 N SER A 55 -4.120 -9.459 -1.835 1.00 0.00 N ATOM 300 CA SER A 55 -3.973 -9.430 -3.286 1.00 0.00 C ATOM 301 C SER A 55 -4.568 -10.685 -3.917 1.00 0.00 C ATOM 302 O SER A 55 -5.283 -10.612 -4.916 1.00 0.00 O ATOM 303 CB SER A 55 -2.497 -9.303 -3.668 1.00 0.00 C ATOM 304 OG SER A 55 -2.349 -9.049 -5.054 1.00 0.00 O ATOM 0 H SER A 55 -3.307 -9.119 -1.322 1.00 0.00 H new ATOM 0 HA SER A 55 -4.514 -8.563 -3.664 1.00 0.00 H new ATOM 0 HB2 SER A 55 -2.038 -8.496 -3.096 1.00 0.00 H new ATOM 0 HB3 SER A 55 -1.970 -10.220 -3.405 1.00 0.00 H new ATOM 0 HG SER A 55 -1.880 -8.198 -5.182 1.00 0.00 H new ATOM 310 N SER A 56 -4.265 -11.837 -3.326 1.00 0.00 N ATOM 311 CA SER A 56 -4.766 -13.110 -3.832 1.00 0.00 C ATOM 312 C SER A 56 -6.291 -13.132 -3.833 1.00 0.00 C ATOM 313 O SER A 56 -6.917 -13.493 -4.829 1.00 0.00 O ATOM 314 CB SER A 56 -4.228 -14.266 -2.986 1.00 0.00 C ATOM 315 OG SER A 56 -2.846 -14.469 -3.220 1.00 0.00 O ATOM 0 H SER A 56 -3.676 -11.915 -2.497 1.00 0.00 H new ATOM 0 HA SER A 56 -4.418 -13.227 -4.858 1.00 0.00 H new ATOM 0 HB2 SER A 56 -4.394 -14.056 -1.929 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.777 -15.178 -3.219 1.00 0.00 H new ATOM 0 HG SER A 56 -2.526 -15.212 -2.666 1.00 0.00 H new ATOM 321 N ASN A 57 -6.883 -12.742 -2.709 1.00 0.00 N ATOM 322 CA ASN A 57 -8.336 -12.718 -2.578 1.00 0.00 C ATOM 323 C ASN A 57 -8.969 -11.900 -3.700 1.00 0.00 C ATOM 324 O ASN A 57 -8.577 -10.765 -3.971 1.00 0.00 O ATOM 325 CB ASN A 57 -8.737 -12.138 -1.220 1.00 0.00 C ATOM 326 CG ASN A 57 -8.730 -13.183 -0.121 1.00 0.00 C ATOM 327 OD1 ASN A 57 -8.736 -14.384 -0.391 1.00 0.00 O ATOM 328 ND2 ASN A 57 -8.718 -12.728 1.127 1.00 0.00 N ATOM 0 H ASN A 57 -6.379 -12.438 -1.876 1.00 0.00 H new ATOM 0 HA ASN A 57 -8.700 -13.743 -2.649 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -8.053 -11.332 -0.956 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -9.732 -11.700 -1.295 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -8.713 -13.383 1.909 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -8.713 -11.723 1.304 1.00 0.00 H new ATOM 335 N PRO A 58 -9.971 -12.489 -4.368 1.00 0.00 N ATOM 336 CA PRO A 58 -10.681 -11.832 -5.470 1.00 0.00 C ATOM 337 C PRO A 58 -11.549 -10.673 -4.993 1.00 0.00 C ATOM 338 O PRO A 58 -12.294 -10.802 -4.022 1.00 0.00 O ATOM 339 CB PRO A 58 -11.552 -12.951 -6.047 1.00 0.00 C ATOM 340 CG PRO A 58 -11.753 -13.898 -4.914 1.00 0.00 C ATOM 341 CD PRO A 58 -10.491 -13.840 -4.099 1.00 0.00 C ATOM 0 HA PRO A 58 -9.994 -11.392 -6.192 1.00 0.00 H new ATOM 0 HB2 PRO A 58 -12.503 -12.564 -6.413 1.00 0.00 H new ATOM 0 HB3 PRO A 58 -11.062 -13.440 -6.889 1.00 0.00 H new ATOM 0 HG2 PRO A 58 -12.618 -13.613 -4.315 1.00 0.00 H new ATOM 0 HG3 PRO A 58 -11.937 -14.909 -5.278 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -10.691 -13.989 -3.038 1.00 0.00 H new ATOM 0 HD3 PRO A 58 -9.782 -14.611 -4.401 1.00 0.00 H new ATOM 349 N GLY A 59 -11.448 -9.541 -5.682 1.00 0.00 N ATOM 350 CA GLY A 59 -12.230 -8.375 -5.312 1.00 0.00 C ATOM 351 C GLY A 59 -11.392 -7.302 -4.647 1.00 0.00 C ATOM 352 O GLY A 59 -11.618 -6.109 -4.854 1.00 0.00 O ATOM 0 H GLY A 59 -10.839 -9.410 -6.490 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -12.704 -7.962 -6.202 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -13.030 -8.677 -4.636 1.00 0.00 H new ATOM 356 N THR A 60 -10.421 -7.724 -3.843 1.00 0.00 N ATOM 357 CA THR A 60 -9.548 -6.791 -3.142 1.00 0.00 C ATOM 358 C THR A 60 -8.682 -6.007 -4.122 1.00 0.00 C ATOM 359 O THR A 60 -7.795 -6.568 -4.765 1.00 0.00 O ATOM 360 CB THR A 60 -8.636 -7.520 -2.138 1.00 0.00 C ATOM 361 OG1 THR A 60 -9.426 -8.319 -1.250 1.00 0.00 O ATOM 362 CG2 THR A 60 -7.811 -6.526 -1.336 1.00 0.00 C ATOM 0 H THR A 60 -10.219 -8.707 -3.661 1.00 0.00 H new ATOM 0 HA THR A 60 -10.194 -6.101 -2.599 1.00 0.00 H new ATOM 0 HB THR A 60 -7.957 -8.163 -2.698 1.00 0.00 H new ATOM 0 HG1 THR A 60 -8.839 -8.781 -0.616 1.00 0.00 H new ATOM 0 HG21 THR A 60 -7.175 -7.064 -0.634 1.00 0.00 H new ATOM 0 HG22 THR A 60 -7.189 -5.939 -2.013 1.00 0.00 H new ATOM 0 HG23 THR A 60 -8.477 -5.861 -0.786 1.00 0.00 H new ATOM 370 N GLN A 61 -8.946 -4.709 -4.230 1.00 0.00 N ATOM 371 CA GLN A 61 -8.189 -3.849 -5.132 1.00 0.00 C ATOM 372 C GLN A 61 -7.722 -2.586 -4.416 1.00 0.00 C ATOM 373 O GLN A 61 -8.257 -2.219 -3.371 1.00 0.00 O ATOM 374 CB GLN A 61 -9.039 -3.476 -6.348 1.00 0.00 C ATOM 375 CG GLN A 61 -10.231 -2.594 -6.009 1.00 0.00 C ATOM 376 CD GLN A 61 -10.930 -2.059 -7.243 1.00 0.00 C ATOM 377 OE1 GLN A 61 -10.285 -1.652 -8.210 1.00 0.00 O ATOM 378 NE2 GLN A 61 -12.258 -2.057 -7.217 1.00 0.00 N ATOM 0 H GLN A 61 -9.678 -4.230 -3.705 1.00 0.00 H new ATOM 0 HA GLN A 61 -7.310 -4.400 -5.467 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -8.412 -2.961 -7.075 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -9.397 -4.389 -6.825 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -10.942 -3.165 -5.412 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -9.897 -1.758 -5.394 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -12.753 -2.404 -6.395 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -12.783 -1.709 -8.019 1.00 0.00 H new ATOM 387 N VAL A 62 -6.719 -1.925 -4.987 1.00 0.00 N ATOM 388 CA VAL A 62 -6.180 -0.702 -4.403 1.00 0.00 C ATOM 389 C VAL A 62 -7.157 0.458 -4.558 1.00 0.00 C ATOM 390 O VAL A 62 -7.398 0.936 -5.667 1.00 0.00 O ATOM 391 CB VAL A 62 -4.836 -0.317 -5.050 1.00 0.00 C ATOM 392 CG1 VAL A 62 -4.280 0.947 -4.413 1.00 0.00 C ATOM 393 CG2 VAL A 62 -3.843 -1.463 -4.935 1.00 0.00 C ATOM 0 H VAL A 62 -6.264 -2.216 -5.852 1.00 0.00 H new ATOM 0 HA VAL A 62 -6.021 -0.900 -3.343 1.00 0.00 H new ATOM 0 HB VAL A 62 -5.005 -0.118 -6.108 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -3.330 1.204 -4.883 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -4.986 1.765 -4.552 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -4.124 0.779 -3.347 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -2.899 -1.174 -5.397 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -3.676 -1.696 -3.883 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -4.241 -2.342 -5.442 1.00 0.00 H new ATOM 403 N TYR A 63 -7.716 0.906 -3.440 1.00 0.00 N ATOM 404 CA TYR A 63 -8.669 2.010 -3.451 1.00 0.00 C ATOM 405 C TYR A 63 -8.103 3.211 -4.203 1.00 0.00 C ATOM 406 O TYR A 63 -6.977 3.639 -3.952 1.00 0.00 O ATOM 407 CB TYR A 63 -9.031 2.414 -2.021 1.00 0.00 C ATOM 408 CG TYR A 63 -10.117 3.463 -1.944 1.00 0.00 C ATOM 409 CD1 TYR A 63 -11.406 3.190 -2.385 1.00 0.00 C ATOM 410 CD2 TYR A 63 -9.854 4.728 -1.432 1.00 0.00 C ATOM 411 CE1 TYR A 63 -12.401 4.145 -2.317 1.00 0.00 C ATOM 412 CE2 TYR A 63 -10.843 5.689 -1.359 1.00 0.00 C ATOM 413 CZ TYR A 63 -12.115 5.393 -1.803 1.00 0.00 C ATOM 414 OH TYR A 63 -13.103 6.348 -1.734 1.00 0.00 O ATOM 0 H TYR A 63 -7.526 0.522 -2.514 1.00 0.00 H new ATOM 0 HA TYR A 63 -9.569 1.674 -3.965 1.00 0.00 H new ATOM 0 HB2 TYR A 63 -9.353 1.529 -1.473 1.00 0.00 H new ATOM 0 HB3 TYR A 63 -8.138 2.790 -1.522 1.00 0.00 H new ATOM 0 HD1 TYR A 63 -11.634 2.214 -2.788 1.00 0.00 H new ATOM 0 HD2 TYR A 63 -8.859 4.964 -1.085 1.00 0.00 H new ATOM 0 HE1 TYR A 63 -13.398 3.916 -2.664 1.00 0.00 H new ATOM 0 HE2 TYR A 63 -10.622 6.667 -0.957 1.00 0.00 H new ATOM 0 HH TYR A 63 -12.737 7.170 -1.346 1.00 0.00 H new ATOM 424 N GLU A 64 -8.894 3.749 -5.126 1.00 0.00 N ATOM 425 CA GLU A 64 -8.472 4.901 -5.915 1.00 0.00 C ATOM 426 C GLU A 64 -6.990 4.807 -6.265 1.00 0.00 C ATOM 427 O GLU A 64 -6.469 3.721 -6.522 1.00 0.00 O ATOM 428 CB GLU A 64 -8.746 6.198 -5.152 1.00 0.00 C ATOM 429 CG GLU A 64 -10.128 6.254 -4.523 1.00 0.00 C ATOM 430 CD GLU A 64 -10.595 7.673 -4.264 1.00 0.00 C ATOM 431 OE1 GLU A 64 -10.052 8.316 -3.341 1.00 0.00 O ATOM 432 OE2 GLU A 64 -11.502 8.141 -4.983 1.00 0.00 O ATOM 0 H GLU A 64 -9.829 3.406 -5.346 1.00 0.00 H new ATOM 0 HA GLU A 64 -9.047 4.905 -6.841 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -7.995 6.315 -4.370 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -8.632 7.041 -5.833 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -10.842 5.755 -5.178 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -10.118 5.702 -3.583 1.00 0.00 H new ATOM 439 N ASP A 65 -6.317 5.952 -6.273 1.00 0.00 N ATOM 440 CA ASP A 65 -4.894 6.000 -6.590 1.00 0.00 C ATOM 441 C ASP A 65 -4.067 6.270 -5.338 1.00 0.00 C ATOM 442 O ASP A 65 -3.118 7.055 -5.364 1.00 0.00 O ATOM 443 CB ASP A 65 -4.620 7.079 -7.639 1.00 0.00 C ATOM 444 CG ASP A 65 -5.397 8.354 -7.375 1.00 0.00 C ATOM 445 OD1 ASP A 65 -5.719 8.619 -6.198 1.00 0.00 O ATOM 446 OD2 ASP A 65 -5.683 9.087 -8.345 1.00 0.00 O ATOM 0 H ASP A 65 -6.733 6.859 -6.064 1.00 0.00 H new ATOM 0 HA ASP A 65 -4.604 5.030 -6.993 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -3.554 7.304 -7.655 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -4.880 6.696 -8.626 1.00 0.00 H new ATOM 451 N TYR A 66 -4.432 5.615 -4.241 1.00 0.00 N ATOM 452 CA TYR A 66 -3.726 5.786 -2.977 1.00 0.00 C ATOM 453 C TYR A 66 -2.506 4.873 -2.907 1.00 0.00 C ATOM 454 O TYR A 66 -2.489 3.899 -2.156 1.00 0.00 O ATOM 455 CB TYR A 66 -4.662 5.497 -1.803 1.00 0.00 C ATOM 456 CG TYR A 66 -5.587 6.645 -1.468 1.00 0.00 C ATOM 457 CD1 TYR A 66 -5.101 7.802 -0.870 1.00 0.00 C ATOM 458 CD2 TYR A 66 -6.945 6.574 -1.749 1.00 0.00 C ATOM 459 CE1 TYR A 66 -5.942 8.854 -0.562 1.00 0.00 C ATOM 460 CE2 TYR A 66 -7.793 7.622 -1.446 1.00 0.00 C ATOM 461 CZ TYR A 66 -7.287 8.759 -0.852 1.00 0.00 C ATOM 462 OH TYR A 66 -8.128 9.804 -0.547 1.00 0.00 O ATOM 0 H TYR A 66 -5.213 4.960 -4.202 1.00 0.00 H new ATOM 0 HA TYR A 66 -3.387 6.820 -2.916 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -5.260 4.616 -2.035 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -4.064 5.255 -0.924 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -4.048 7.880 -0.642 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -7.345 5.684 -2.212 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -5.548 9.746 -0.097 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -8.846 7.551 -1.673 1.00 0.00 H new ATOM 0 HH TYR A 66 -9.043 9.577 -0.817 1.00 0.00 H new ATOM 472 N ASN A 67 -1.486 5.196 -3.695 1.00 0.00 N ATOM 473 CA ASN A 67 -0.261 4.406 -3.723 1.00 0.00 C ATOM 474 C ASN A 67 0.951 5.291 -3.997 1.00 0.00 C ATOM 475 O ASN A 67 1.192 5.698 -5.134 1.00 0.00 O ATOM 476 CB ASN A 67 -0.359 3.313 -4.789 1.00 0.00 C ATOM 477 CG ASN A 67 -0.237 3.865 -6.196 1.00 0.00 C ATOM 478 OD1 ASN A 67 -0.915 4.827 -6.558 1.00 0.00 O ATOM 479 ND2 ASN A 67 0.629 3.256 -6.998 1.00 0.00 N ATOM 0 H ASN A 67 -1.484 6.000 -4.323 1.00 0.00 H new ATOM 0 HA ASN A 67 -0.136 3.941 -2.745 1.00 0.00 H new ATOM 0 HB2 ASN A 67 0.426 2.575 -4.622 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -1.312 2.794 -4.687 1.00 0.00 H new ATOM 0 HD21 ASN A 67 0.753 3.582 -7.956 1.00 0.00 H new ATOM 0 HD22 ASN A 67 1.170 2.462 -6.655 1.00 0.00 H new ATOM 486 N CYS A 68 1.711 5.585 -2.947 1.00 0.00 N ATOM 487 CA CYS A 68 2.899 6.422 -3.074 1.00 0.00 C ATOM 488 C CYS A 68 4.128 5.708 -2.522 1.00 0.00 C ATOM 489 O CYS A 68 4.071 5.072 -1.469 1.00 0.00 O ATOM 490 CB CYS A 68 2.693 7.749 -2.341 1.00 0.00 C ATOM 491 SG CYS A 68 2.228 7.568 -0.603 1.00 0.00 S ATOM 0 H CYS A 68 1.526 5.256 -1.999 1.00 0.00 H new ATOM 0 HA CYS A 68 3.062 6.621 -4.133 1.00 0.00 H new ATOM 0 HB2 CYS A 68 3.612 8.332 -2.401 1.00 0.00 H new ATOM 0 HB3 CYS A 68 1.920 8.320 -2.855 1.00 0.00 H new ATOM 0 HG CYS A 68 2.514 8.662 0.039 1.00 0.00 H new ATOM 497 N THR A 69 5.241 5.815 -3.241 1.00 0.00 N ATOM 498 CA THR A 69 6.484 5.178 -2.826 1.00 0.00 C ATOM 499 C THR A 69 7.408 6.173 -2.132 1.00 0.00 C ATOM 500 O THR A 69 7.650 7.268 -2.641 1.00 0.00 O ATOM 501 CB THR A 69 7.225 4.557 -4.025 1.00 0.00 C ATOM 502 OG1 THR A 69 6.356 3.664 -4.730 1.00 0.00 O ATOM 503 CG2 THR A 69 8.467 3.808 -3.566 1.00 0.00 C ATOM 0 H THR A 69 5.307 6.338 -4.115 1.00 0.00 H new ATOM 0 HA THR A 69 6.215 4.387 -2.126 1.00 0.00 H new ATOM 0 HB THR A 69 7.532 5.364 -4.690 1.00 0.00 H new ATOM 0 HG1 THR A 69 6.891 3.047 -5.273 1.00 0.00 H new ATOM 0 HG21 THR A 69 8.973 3.378 -4.431 1.00 0.00 H new ATOM 0 HG22 THR A 69 9.140 4.498 -3.057 1.00 0.00 H new ATOM 0 HG23 THR A 69 8.179 3.011 -2.881 1.00 0.00 H new ATOM 511 N LEU A 70 7.920 5.786 -0.970 1.00 0.00 N ATOM 512 CA LEU A 70 8.819 6.645 -0.206 1.00 0.00 C ATOM 513 C LEU A 70 10.197 6.007 -0.070 1.00 0.00 C ATOM 514 O LEU A 70 10.317 4.794 0.102 1.00 0.00 O ATOM 515 CB LEU A 70 8.234 6.923 1.180 1.00 0.00 C ATOM 516 CG LEU A 70 6.761 7.330 1.218 1.00 0.00 C ATOM 517 CD1 LEU A 70 6.304 7.550 2.652 1.00 0.00 C ATOM 518 CD2 LEU A 70 6.532 8.583 0.385 1.00 0.00 C ATOM 0 H LEU A 70 7.729 4.883 -0.535 1.00 0.00 H new ATOM 0 HA LEU A 70 8.927 7.587 -0.744 1.00 0.00 H new ATOM 0 HB2 LEU A 70 8.359 6.029 1.791 1.00 0.00 H new ATOM 0 HB3 LEU A 70 8.821 7.713 1.648 1.00 0.00 H new ATOM 0 HG LEU A 70 6.169 6.520 0.790 1.00 0.00 H new ATOM 0 HD11 LEU A 70 5.253 7.839 2.659 1.00 0.00 H new ATOM 0 HD12 LEU A 70 6.430 6.628 3.220 1.00 0.00 H new ATOM 0 HD13 LEU A 70 6.901 8.341 3.107 1.00 0.00 H new ATOM 0 HD21 LEU A 70 5.478 8.858 0.424 1.00 0.00 H new ATOM 0 HD22 LEU A 70 7.135 9.399 0.783 1.00 0.00 H new ATOM 0 HD23 LEU A 70 6.819 8.390 -0.649 1.00 0.00 H new ATOM 530 N ASN A 71 11.236 6.832 -0.147 1.00 0.00 N ATOM 531 CA ASN A 71 12.607 6.349 -0.031 1.00 0.00 C ATOM 532 C ASN A 71 13.313 6.996 1.157 1.00 0.00 C ATOM 533 O ASN A 71 12.903 8.053 1.634 1.00 0.00 O ATOM 534 CB ASN A 71 13.382 6.637 -1.318 1.00 0.00 C ATOM 535 CG ASN A 71 13.294 5.496 -2.314 1.00 0.00 C ATOM 536 OD1 ASN A 71 12.826 5.675 -3.439 1.00 0.00 O ATOM 537 ND2 ASN A 71 13.743 4.316 -1.903 1.00 0.00 N ATOM 0 H ASN A 71 11.154 7.839 -0.289 1.00 0.00 H new ATOM 0 HA ASN A 71 12.574 5.272 0.132 1.00 0.00 H new ATOM 0 HB2 ASN A 71 12.994 7.547 -1.777 1.00 0.00 H new ATOM 0 HB3 ASN A 71 14.428 6.824 -1.075 1.00 0.00 H new ATOM 0 HD21 ASN A 71 13.708 3.511 -2.529 1.00 0.00 H new ATOM 0 HD22 ASN A 71 14.123 4.214 -0.962 1.00 0.00 H new ATOM 544 N GLN A 72 14.377 6.353 1.628 1.00 0.00 N ATOM 545 CA GLN A 72 15.140 6.865 2.759 1.00 0.00 C ATOM 546 C GLN A 72 16.576 6.352 2.725 1.00 0.00 C ATOM 547 O GLN A 72 16.839 5.190 3.035 1.00 0.00 O ATOM 548 CB GLN A 72 14.473 6.463 4.076 1.00 0.00 C ATOM 549 CG GLN A 72 15.092 7.122 5.298 1.00 0.00 C ATOM 550 CD GLN A 72 14.614 8.546 5.498 1.00 0.00 C ATOM 551 OE1 GLN A 72 14.645 9.359 4.574 1.00 0.00 O ATOM 552 NE2 GLN A 72 14.167 8.856 6.709 1.00 0.00 N ATOM 0 H GLN A 72 14.730 5.477 1.243 1.00 0.00 H new ATOM 0 HA GLN A 72 15.161 7.952 2.688 1.00 0.00 H new ATOM 0 HB2 GLN A 72 13.415 6.721 4.031 1.00 0.00 H new ATOM 0 HB3 GLN A 72 14.533 5.380 4.188 1.00 0.00 H new ATOM 0 HG2 GLN A 72 14.852 6.534 6.184 1.00 0.00 H new ATOM 0 HG3 GLN A 72 16.177 7.118 5.198 1.00 0.00 H new ATOM 0 HE21 GLN A 72 14.159 8.151 7.446 1.00 0.00 H new ATOM 0 HE22 GLN A 72 13.831 9.800 6.903 1.00 0.00 H new ATOM 561 N THR A 73 17.503 7.227 2.346 1.00 0.00 N ATOM 562 CA THR A 73 18.912 6.862 2.269 1.00 0.00 C ATOM 563 C THR A 73 19.724 7.577 3.344 1.00 0.00 C ATOM 564 O THR A 73 19.315 8.618 3.854 1.00 0.00 O ATOM 565 CB THR A 73 19.505 7.196 0.887 1.00 0.00 C ATOM 566 OG1 THR A 73 19.069 8.494 0.468 1.00 0.00 O ATOM 567 CG2 THR A 73 19.089 6.159 -0.145 1.00 0.00 C ATOM 0 H THR A 73 17.303 8.193 2.088 1.00 0.00 H new ATOM 0 HA THR A 73 18.969 5.785 2.429 1.00 0.00 H new ATOM 0 HB THR A 73 20.592 7.187 0.971 1.00 0.00 H new ATOM 0 HG1 THR A 73 19.452 8.700 -0.410 1.00 0.00 H new ATOM 0 HG21 THR A 73 19.520 6.416 -1.113 1.00 0.00 H new ATOM 0 HG22 THR A 73 19.447 5.176 0.162 1.00 0.00 H new ATOM 0 HG23 THR A 73 18.002 6.141 -0.225 1.00 0.00 H new ATOM 575 N ASN A 74 20.877 7.010 3.682 1.00 0.00 N ATOM 576 CA ASN A 74 21.747 7.594 4.697 1.00 0.00 C ATOM 577 C ASN A 74 23.212 7.290 4.397 1.00 0.00 C ATOM 578 O ASN A 74 23.539 6.232 3.858 1.00 0.00 O ATOM 579 CB ASN A 74 21.377 7.062 6.083 1.00 0.00 C ATOM 580 CG ASN A 74 20.336 7.922 6.773 1.00 0.00 C ATOM 581 OD1 ASN A 74 19.903 8.942 6.237 1.00 0.00 O ATOM 582 ND2 ASN A 74 19.930 7.512 7.970 1.00 0.00 N ATOM 0 H ASN A 74 21.231 6.147 3.269 1.00 0.00 H new ATOM 0 HA ASN A 74 21.608 8.675 4.682 1.00 0.00 H new ATOM 0 HB2 ASN A 74 20.999 6.044 5.989 1.00 0.00 H new ATOM 0 HB3 ASN A 74 22.273 7.014 6.702 1.00 0.00 H new ATOM 0 HD21 ASN A 74 19.231 8.050 8.483 1.00 0.00 H new ATOM 0 HD22 ASN A 74 20.317 6.660 8.375 1.00 0.00 H new ATOM 589 N ILE A 75 24.088 8.224 4.752 1.00 0.00 N ATOM 590 CA ILE A 75 25.518 8.055 4.523 1.00 0.00 C ATOM 591 C ILE A 75 26.125 7.084 5.529 1.00 0.00 C ATOM 592 O ILE A 75 27.120 7.395 6.183 1.00 0.00 O ATOM 593 CB ILE A 75 26.264 9.400 4.609 1.00 0.00 C ATOM 594 CG1 ILE A 75 27.688 9.253 4.066 1.00 0.00 C ATOM 595 CG2 ILE A 75 26.288 9.901 6.045 1.00 0.00 C ATOM 596 CD1 ILE A 75 27.793 9.487 2.575 1.00 0.00 C ATOM 0 H ILE A 75 23.833 9.105 5.199 1.00 0.00 H new ATOM 0 HA ILE A 75 25.631 7.650 3.518 1.00 0.00 H new ATOM 0 HB ILE A 75 25.736 10.132 3.998 1.00 0.00 H new ATOM 0 HG12 ILE A 75 28.340 9.957 4.583 1.00 0.00 H new ATOM 0 HG13 ILE A 75 28.054 8.252 4.295 1.00 0.00 H new ATOM 0 HG21 ILE A 75 26.818 10.852 6.090 1.00 0.00 H new ATOM 0 HG22 ILE A 75 25.266 10.038 6.400 1.00 0.00 H new ATOM 0 HG23 ILE A 75 26.796 9.172 6.676 1.00 0.00 H new ATOM 0 HD11 ILE A 75 28.829 9.367 2.260 1.00 0.00 H new ATOM 0 HD12 ILE A 75 27.168 8.766 2.049 1.00 0.00 H new ATOM 0 HD13 ILE A 75 27.458 10.497 2.341 1.00 0.00 H new ATOM 608 N GLU A 76 25.520 5.906 5.647 1.00 0.00 N ATOM 609 CA GLU A 76 26.002 4.889 6.574 1.00 0.00 C ATOM 610 C GLU A 76 26.006 3.512 5.916 1.00 0.00 C ATOM 611 O GLU A 76 24.951 2.933 5.659 1.00 0.00 O ATOM 612 CB GLU A 76 25.135 4.863 7.834 1.00 0.00 C ATOM 613 CG GLU A 76 25.500 5.935 8.847 1.00 0.00 C ATOM 614 CD GLU A 76 24.706 5.816 10.133 1.00 0.00 C ATOM 615 OE1 GLU A 76 23.490 5.542 10.056 1.00 0.00 O ATOM 616 OE2 GLU A 76 25.300 5.998 11.217 1.00 0.00 O ATOM 0 H GLU A 76 24.695 5.633 5.112 1.00 0.00 H new ATOM 0 HA GLU A 76 27.025 5.143 6.852 1.00 0.00 H new ATOM 0 HB2 GLU A 76 24.090 4.986 7.548 1.00 0.00 H new ATOM 0 HB3 GLU A 76 25.224 3.884 8.306 1.00 0.00 H new ATOM 0 HG2 GLU A 76 26.564 5.868 9.074 1.00 0.00 H new ATOM 0 HG3 GLU A 76 25.329 6.918 8.408 1.00 0.00 H new ATOM 623 N ASN A 77 27.200 2.995 5.647 1.00 0.00 N ATOM 624 CA ASN A 77 27.342 1.686 5.018 1.00 0.00 C ATOM 625 C ASN A 77 26.334 1.515 3.885 1.00 0.00 C ATOM 626 O ASN A 77 25.750 0.445 3.717 1.00 0.00 O ATOM 627 CB ASN A 77 27.154 0.576 6.055 1.00 0.00 C ATOM 628 CG ASN A 77 27.779 0.923 7.392 1.00 0.00 C ATOM 629 OD1 ASN A 77 27.080 1.087 8.392 1.00 0.00 O ATOM 630 ND2 ASN A 77 29.102 1.037 7.416 1.00 0.00 N ATOM 0 H ASN A 77 28.083 3.462 5.854 1.00 0.00 H new ATOM 0 HA ASN A 77 28.347 1.618 4.600 1.00 0.00 H new ATOM 0 HB2 ASN A 77 26.089 0.387 6.193 1.00 0.00 H new ATOM 0 HB3 ASN A 77 27.595 -0.347 5.679 1.00 0.00 H new ATOM 0 HD21 ASN A 77 29.578 1.269 8.288 1.00 0.00 H new ATOM 0 HD22 ASN A 77 29.642 0.892 6.563 1.00 0.00 H new ATOM 637 N ASN A 78 26.136 2.577 3.111 1.00 0.00 N ATOM 638 CA ASN A 78 25.200 2.544 1.994 1.00 0.00 C ATOM 639 C ASN A 78 23.865 1.941 2.421 1.00 0.00 C ATOM 640 O ASN A 78 23.384 0.982 1.818 1.00 0.00 O ATOM 641 CB ASN A 78 25.787 1.740 0.832 1.00 0.00 C ATOM 642 CG ASN A 78 26.850 2.511 0.074 1.00 0.00 C ATOM 643 OD1 ASN A 78 26.787 3.736 -0.032 1.00 0.00 O ATOM 644 ND2 ASN A 78 27.834 1.795 -0.457 1.00 0.00 N ATOM 0 H ASN A 78 26.611 3.471 3.237 1.00 0.00 H new ATOM 0 HA ASN A 78 25.028 3.569 1.667 1.00 0.00 H new ATOM 0 HB2 ASN A 78 26.217 0.814 1.215 1.00 0.00 H new ATOM 0 HB3 ASN A 78 24.987 1.460 0.147 1.00 0.00 H new ATOM 0 HD21 ASN A 78 28.578 2.259 -0.978 1.00 0.00 H new ATOM 0 HD22 ASN A 78 27.846 0.781 -0.344 1.00 0.00 H new ATOM 651 N ASN A 79 23.271 2.512 3.464 1.00 0.00 N ATOM 652 CA ASN A 79 21.991 2.031 3.972 1.00 0.00 C ATOM 653 C ASN A 79 20.833 2.615 3.168 1.00 0.00 C ATOM 654 O ASN A 79 20.596 3.822 3.188 1.00 0.00 O ATOM 655 CB ASN A 79 21.836 2.396 5.449 1.00 0.00 C ATOM 656 CG ASN A 79 20.988 1.392 6.207 1.00 0.00 C ATOM 657 OD1 ASN A 79 19.810 1.631 6.471 1.00 0.00 O ATOM 658 ND2 ASN A 79 21.586 0.260 6.560 1.00 0.00 N ATOM 0 H ASN A 79 23.655 3.308 3.974 1.00 0.00 H new ATOM 0 HA ASN A 79 21.971 0.946 3.869 1.00 0.00 H new ATOM 0 HB2 ASN A 79 22.821 2.457 5.911 1.00 0.00 H new ATOM 0 HB3 ASN A 79 21.384 3.384 5.531 1.00 0.00 H new ATOM 0 HD21 ASN A 79 21.066 -0.453 7.071 1.00 0.00 H new ATOM 0 HD22 ASN A 79 22.565 0.104 6.320 1.00 0.00 H new ATOM 665 N ASN A 80 20.114 1.749 2.461 1.00 0.00 N ATOM 666 CA ASN A 80 18.980 2.178 1.650 1.00 0.00 C ATOM 667 C ASN A 80 17.721 1.400 2.020 1.00 0.00 C ATOM 668 O ASN A 80 17.720 0.169 2.034 1.00 0.00 O ATOM 669 CB ASN A 80 19.290 1.992 0.164 1.00 0.00 C ATOM 670 CG ASN A 80 20.579 2.677 -0.249 1.00 0.00 C ATOM 671 OD1 ASN A 80 21.330 3.169 0.593 1.00 0.00 O ATOM 672 ND2 ASN A 80 20.840 2.711 -1.550 1.00 0.00 N ATOM 0 H ASN A 80 20.297 0.746 2.433 1.00 0.00 H new ATOM 0 HA ASN A 80 18.803 3.235 1.848 1.00 0.00 H new ATOM 0 HB2 ASN A 80 19.360 0.927 -0.059 1.00 0.00 H new ATOM 0 HB3 ASN A 80 18.465 2.388 -0.429 1.00 0.00 H new ATOM 0 HD21 ASN A 80 21.692 3.158 -1.888 1.00 0.00 H new ATOM 0 HD22 ASN A 80 20.188 2.290 -2.212 1.00 0.00 H new ATOM 679 N LYS A 81 16.650 2.126 2.320 1.00 0.00 N ATOM 680 CA LYS A 81 15.383 1.506 2.689 1.00 0.00 C ATOM 681 C LYS A 81 14.260 1.975 1.769 1.00 0.00 C ATOM 682 O LYS A 81 14.468 2.824 0.902 1.00 0.00 O ATOM 683 CB LYS A 81 15.035 1.833 4.143 1.00 0.00 C ATOM 684 CG LYS A 81 15.892 1.092 5.154 1.00 0.00 C ATOM 685 CD LYS A 81 15.614 1.561 6.572 1.00 0.00 C ATOM 686 CE LYS A 81 16.753 1.200 7.513 1.00 0.00 C ATOM 687 NZ LYS A 81 16.437 1.549 8.926 1.00 0.00 N ATOM 0 H LYS A 81 16.634 3.146 2.315 1.00 0.00 H new ATOM 0 HA LYS A 81 15.491 0.427 2.582 1.00 0.00 H new ATOM 0 HB2 LYS A 81 15.146 2.906 4.302 1.00 0.00 H new ATOM 0 HB3 LYS A 81 13.987 1.591 4.320 1.00 0.00 H new ATOM 0 HG2 LYS A 81 15.700 0.022 5.080 1.00 0.00 H new ATOM 0 HG3 LYS A 81 16.946 1.244 4.920 1.00 0.00 H new ATOM 0 HD2 LYS A 81 15.466 2.641 6.576 1.00 0.00 H new ATOM 0 HD3 LYS A 81 14.688 1.111 6.930 1.00 0.00 H new ATOM 0 HE2 LYS A 81 16.960 0.132 7.440 1.00 0.00 H new ATOM 0 HE3 LYS A 81 17.659 1.722 7.204 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 17.238 1.287 9.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 16.265 2.572 9.001 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 15.587 1.032 9.230 1.00 0.00 H new ATOM 701 N PHE A 82 13.069 1.418 1.965 1.00 0.00 N ATOM 702 CA PHE A 82 11.913 1.780 1.153 1.00 0.00 C ATOM 703 C PHE A 82 10.619 1.608 1.943 1.00 0.00 C ATOM 704 O PHE A 82 10.400 0.579 2.582 1.00 0.00 O ATOM 705 CB PHE A 82 11.867 0.925 -0.115 1.00 0.00 C ATOM 706 CG PHE A 82 11.507 -0.510 0.142 1.00 0.00 C ATOM 707 CD1 PHE A 82 12.384 -1.350 0.808 1.00 0.00 C ATOM 708 CD2 PHE A 82 10.290 -1.020 -0.284 1.00 0.00 C ATOM 709 CE1 PHE A 82 12.056 -2.671 1.046 1.00 0.00 C ATOM 710 CE2 PHE A 82 9.957 -2.340 -0.048 1.00 0.00 C ATOM 711 CZ PHE A 82 10.841 -3.167 0.617 1.00 0.00 C ATOM 0 H PHE A 82 12.879 0.715 2.679 1.00 0.00 H new ATOM 0 HA PHE A 82 12.010 2.829 0.873 1.00 0.00 H new ATOM 0 HB2 PHE A 82 11.143 1.355 -0.807 1.00 0.00 H new ATOM 0 HB3 PHE A 82 12.839 0.965 -0.606 1.00 0.00 H new ATOM 0 HD1 PHE A 82 13.336 -0.968 1.145 1.00 0.00 H new ATOM 0 HD2 PHE A 82 9.595 -0.379 -0.806 1.00 0.00 H new ATOM 0 HE1 PHE A 82 12.749 -3.315 1.567 1.00 0.00 H new ATOM 0 HE2 PHE A 82 9.005 -2.725 -0.384 1.00 0.00 H new ATOM 0 HZ PHE A 82 10.582 -4.199 0.801 1.00 0.00 H new ATOM 721 N TYR A 83 9.765 2.625 1.895 1.00 0.00 N ATOM 722 CA TYR A 83 8.494 2.589 2.608 1.00 0.00 C ATOM 723 C TYR A 83 7.321 2.682 1.637 1.00 0.00 C ATOM 724 O TYR A 83 7.188 3.659 0.899 1.00 0.00 O ATOM 725 CB TYR A 83 8.422 3.731 3.623 1.00 0.00 C ATOM 726 CG TYR A 83 7.576 3.412 4.835 1.00 0.00 C ATOM 727 CD1 TYR A 83 6.205 3.225 4.721 1.00 0.00 C ATOM 728 CD2 TYR A 83 8.150 3.296 6.096 1.00 0.00 C ATOM 729 CE1 TYR A 83 5.429 2.934 5.826 1.00 0.00 C ATOM 730 CE2 TYR A 83 7.382 3.004 7.206 1.00 0.00 C ATOM 731 CZ TYR A 83 6.022 2.824 7.066 1.00 0.00 C ATOM 732 OH TYR A 83 5.253 2.533 8.169 1.00 0.00 O ATOM 0 H TYR A 83 9.930 3.484 1.370 1.00 0.00 H new ATOM 0 HA TYR A 83 8.430 1.638 3.136 1.00 0.00 H new ATOM 0 HB2 TYR A 83 9.432 3.979 3.950 1.00 0.00 H new ATOM 0 HB3 TYR A 83 8.019 4.617 3.132 1.00 0.00 H new ATOM 0 HD1 TYR A 83 5.737 3.309 3.751 1.00 0.00 H new ATOM 0 HD2 TYR A 83 9.215 3.437 6.209 1.00 0.00 H new ATOM 0 HE1 TYR A 83 4.364 2.793 5.719 1.00 0.00 H new ATOM 0 HE2 TYR A 83 7.844 2.917 8.178 1.00 0.00 H new ATOM 0 HH TYR A 83 5.428 1.613 8.457 1.00 0.00 H new ATOM 742 N ILE A 84 6.474 1.659 1.642 1.00 0.00 N ATOM 743 CA ILE A 84 5.311 1.625 0.763 1.00 0.00 C ATOM 744 C ILE A 84 4.016 1.743 1.560 1.00 0.00 C ATOM 745 O ILE A 84 3.849 1.092 2.592 1.00 0.00 O ATOM 746 CB ILE A 84 5.273 0.330 -0.069 1.00 0.00 C ATOM 747 CG1 ILE A 84 6.524 0.222 -0.943 1.00 0.00 C ATOM 748 CG2 ILE A 84 4.016 0.289 -0.927 1.00 0.00 C ATOM 749 CD1 ILE A 84 6.736 -1.157 -1.527 1.00 0.00 C ATOM 0 H ILE A 84 6.571 0.842 2.245 1.00 0.00 H new ATOM 0 HA ILE A 84 5.399 2.477 0.089 1.00 0.00 H new ATOM 0 HB ILE A 84 5.254 -0.521 0.612 1.00 0.00 H new ATOM 0 HG12 ILE A 84 6.453 0.945 -1.756 1.00 0.00 H new ATOM 0 HG13 ILE A 84 7.397 0.494 -0.349 1.00 0.00 H new ATOM 0 HG21 ILE A 84 4.003 -0.632 -1.510 1.00 0.00 H new ATOM 0 HG22 ILE A 84 3.136 0.325 -0.285 1.00 0.00 H new ATOM 0 HG23 ILE A 84 4.008 1.145 -1.602 1.00 0.00 H new ATOM 0 HD11 ILE A 84 7.641 -1.160 -2.135 1.00 0.00 H new ATOM 0 HD12 ILE A 84 6.839 -1.882 -0.720 1.00 0.00 H new ATOM 0 HD13 ILE A 84 5.881 -1.425 -2.148 1.00 0.00 H new ATOM 761 N ILE A 85 3.103 2.576 1.073 1.00 0.00 N ATOM 762 CA ILE A 85 1.821 2.776 1.738 1.00 0.00 C ATOM 763 C ILE A 85 0.682 2.843 0.727 1.00 0.00 C ATOM 764 O ILE A 85 0.524 3.838 0.020 1.00 0.00 O ATOM 765 CB ILE A 85 1.820 4.065 2.581 1.00 0.00 C ATOM 766 CG1 ILE A 85 2.926 4.011 3.637 1.00 0.00 C ATOM 767 CG2 ILE A 85 0.463 4.267 3.238 1.00 0.00 C ATOM 768 CD1 ILE A 85 3.199 5.345 4.296 1.00 0.00 C ATOM 0 H ILE A 85 3.227 3.123 0.221 1.00 0.00 H new ATOM 0 HA ILE A 85 1.670 1.920 2.396 1.00 0.00 H new ATOM 0 HB ILE A 85 2.013 4.912 1.923 1.00 0.00 H new ATOM 0 HG12 ILE A 85 2.650 3.286 4.403 1.00 0.00 H new ATOM 0 HG13 ILE A 85 3.844 3.650 3.172 1.00 0.00 H new ATOM 0 HG21 ILE A 85 0.478 5.182 3.830 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -0.306 4.345 2.469 1.00 0.00 H new ATOM 0 HG23 ILE A 85 0.243 3.419 3.886 1.00 0.00 H new ATOM 0 HD11 ILE A 85 3.994 5.231 5.033 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.506 6.068 3.540 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.294 5.699 4.790 1.00 0.00 H new ATOM 780 N GLN A 86 -0.111 1.777 0.666 1.00 0.00 N ATOM 781 CA GLN A 86 -1.237 1.716 -0.258 1.00 0.00 C ATOM 782 C GLN A 86 -2.548 1.510 0.494 1.00 0.00 C ATOM 783 O GLN A 86 -2.582 0.848 1.532 1.00 0.00 O ATOM 784 CB GLN A 86 -1.033 0.586 -1.270 1.00 0.00 C ATOM 785 CG GLN A 86 0.218 0.749 -2.119 1.00 0.00 C ATOM 786 CD GLN A 86 0.591 -0.522 -2.856 1.00 0.00 C ATOM 787 OE1 GLN A 86 1.546 -1.208 -2.490 1.00 0.00 O ATOM 788 NE2 GLN A 86 -0.161 -0.842 -3.902 1.00 0.00 N ATOM 0 H GLN A 86 0.006 0.945 1.245 1.00 0.00 H new ATOM 0 HA GLN A 86 -1.290 2.666 -0.790 1.00 0.00 H new ATOM 0 HB2 GLN A 86 -0.979 -0.363 -0.737 1.00 0.00 H new ATOM 0 HB3 GLN A 86 -1.903 0.535 -1.925 1.00 0.00 H new ATOM 0 HG2 GLN A 86 0.061 1.551 -2.841 1.00 0.00 H new ATOM 0 HG3 GLN A 86 1.049 1.052 -1.481 1.00 0.00 H new ATOM 0 HE21 GLN A 86 -0.943 -0.244 -4.170 1.00 0.00 H new ATOM 0 HE22 GLN A 86 0.043 -1.686 -4.438 1.00 0.00 H new ATOM 797 N LEU A 87 -3.624 2.081 -0.036 1.00 0.00 N ATOM 798 CA LEU A 87 -4.938 1.960 0.586 1.00 0.00 C ATOM 799 C LEU A 87 -5.807 0.958 -0.168 1.00 0.00 C ATOM 800 O LEU A 87 -6.210 1.202 -1.306 1.00 0.00 O ATOM 801 CB LEU A 87 -5.631 3.323 0.628 1.00 0.00 C ATOM 802 CG LEU A 87 -6.605 3.545 1.785 1.00 0.00 C ATOM 803 CD1 LEU A 87 -6.652 5.016 2.168 1.00 0.00 C ATOM 804 CD2 LEU A 87 -7.994 3.044 1.418 1.00 0.00 C ATOM 0 H LEU A 87 -3.613 2.632 -0.894 1.00 0.00 H new ATOM 0 HA LEU A 87 -4.799 1.598 1.605 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -4.864 4.097 0.671 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -6.172 3.462 -0.308 1.00 0.00 H new ATOM 0 HG LEU A 87 -6.251 2.977 2.645 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -7.350 5.155 2.993 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -5.659 5.344 2.474 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -6.981 5.605 1.311 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -8.673 3.210 2.254 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.356 3.584 0.543 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -7.949 1.978 1.194 1.00 0.00 H new ATOM 816 N LEU A 88 -6.094 -0.169 0.474 1.00 0.00 N ATOM 817 CA LEU A 88 -6.918 -1.208 -0.134 1.00 0.00 C ATOM 818 C LEU A 88 -8.364 -1.104 0.340 1.00 0.00 C ATOM 819 O LEU A 88 -8.633 -0.617 1.438 1.00 0.00 O ATOM 820 CB LEU A 88 -6.358 -2.591 0.201 1.00 0.00 C ATOM 821 CG LEU A 88 -4.865 -2.793 -0.062 1.00 0.00 C ATOM 822 CD1 LEU A 88 -4.386 -4.100 0.551 1.00 0.00 C ATOM 823 CD2 LEU A 88 -4.578 -2.765 -1.556 1.00 0.00 C ATOM 0 H LEU A 88 -5.768 -0.387 1.416 1.00 0.00 H new ATOM 0 HA LEU A 88 -6.899 -1.066 -1.215 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -6.552 -2.794 1.254 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -6.911 -3.334 -0.374 1.00 0.00 H new ATOM 0 HG LEU A 88 -4.319 -1.975 0.408 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -3.322 -4.226 0.353 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -4.555 -4.081 1.628 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -4.937 -4.931 0.112 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -3.511 -2.910 -1.724 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -5.135 -3.562 -2.048 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -4.882 -1.802 -1.967 1.00 0.00 H new ATOM 835 N GLN A 89 -9.289 -1.566 -0.494 1.00 0.00 N ATOM 836 CA GLN A 89 -10.708 -1.526 -0.158 1.00 0.00 C ATOM 837 C GLN A 89 -11.364 -2.880 -0.404 1.00 0.00 C ATOM 838 O GLN A 89 -11.438 -3.348 -1.541 1.00 0.00 O ATOM 839 CB GLN A 89 -11.417 -0.446 -0.978 1.00 0.00 C ATOM 840 CG GLN A 89 -12.918 -0.394 -0.746 1.00 0.00 C ATOM 841 CD GLN A 89 -13.670 0.201 -1.920 1.00 0.00 C ATOM 842 OE1 GLN A 89 -13.267 0.046 -3.073 1.00 0.00 O ATOM 843 NE2 GLN A 89 -14.770 0.887 -1.633 1.00 0.00 N ATOM 0 H GLN A 89 -9.082 -1.972 -1.407 1.00 0.00 H new ATOM 0 HA GLN A 89 -10.798 -1.286 0.901 1.00 0.00 H new ATOM 0 HB2 GLN A 89 -10.986 0.525 -0.734 1.00 0.00 H new ATOM 0 HB3 GLN A 89 -11.227 -0.622 -2.037 1.00 0.00 H new ATOM 0 HG2 GLN A 89 -13.287 -1.402 -0.556 1.00 0.00 H new ATOM 0 HG3 GLN A 89 -13.123 0.195 0.148 1.00 0.00 H new ATOM 0 HE21 GLN A 89 -15.068 0.991 -0.663 1.00 0.00 H new ATOM 0 HE22 GLN A 89 -15.317 1.310 -2.383 1.00 0.00 H new ATOM 852 N ASP A 90 -11.838 -3.506 0.668 1.00 0.00 N ATOM 853 CA ASP A 90 -12.489 -4.807 0.568 1.00 0.00 C ATOM 854 C ASP A 90 -13.939 -4.656 0.119 1.00 0.00 C ATOM 855 O ASP A 90 -14.475 -3.549 0.078 1.00 0.00 O ATOM 856 CB ASP A 90 -12.431 -5.534 1.913 1.00 0.00 C ATOM 857 CG ASP A 90 -11.012 -5.709 2.416 1.00 0.00 C ATOM 858 OD1 ASP A 90 -10.199 -4.779 2.235 1.00 0.00 O ATOM 859 OD2 ASP A 90 -10.715 -6.776 2.992 1.00 0.00 O ATOM 0 H ASP A 90 -11.784 -3.133 1.616 1.00 0.00 H new ATOM 0 HA ASP A 90 -11.956 -5.396 -0.178 1.00 0.00 H new ATOM 0 HB2 ASP A 90 -13.008 -4.975 2.650 1.00 0.00 H new ATOM 0 HB3 ASP A 90 -12.902 -6.512 1.814 1.00 0.00 H new ATOM 864 N SER A 91 -14.568 -5.778 -0.218 1.00 0.00 N ATOM 865 CA SER A 91 -15.954 -5.770 -0.670 1.00 0.00 C ATOM 866 C SER A 91 -16.908 -5.581 0.506 1.00 0.00 C ATOM 867 O SER A 91 -18.062 -5.194 0.328 1.00 0.00 O ATOM 868 CB SER A 91 -16.282 -7.073 -1.402 1.00 0.00 C ATOM 869 OG SER A 91 -15.490 -7.216 -2.568 1.00 0.00 O ATOM 0 H SER A 91 -14.140 -6.703 -0.186 1.00 0.00 H new ATOM 0 HA SER A 91 -16.081 -4.933 -1.357 1.00 0.00 H new ATOM 0 HB2 SER A 91 -16.112 -7.920 -0.737 1.00 0.00 H new ATOM 0 HB3 SER A 91 -17.338 -7.086 -1.672 1.00 0.00 H new ATOM 0 HG SER A 91 -15.717 -8.057 -3.017 1.00 0.00 H new ATOM 875 N ASN A 92 -16.415 -5.856 1.709 1.00 0.00 N ATOM 876 CA ASN A 92 -17.222 -5.718 2.916 1.00 0.00 C ATOM 877 C ASN A 92 -17.061 -4.326 3.521 1.00 0.00 C ATOM 878 O ASN A 92 -16.884 -4.181 4.731 1.00 0.00 O ATOM 879 CB ASN A 92 -16.828 -6.781 3.943 1.00 0.00 C ATOM 880 CG ASN A 92 -17.635 -8.056 3.793 1.00 0.00 C ATOM 881 OD1 ASN A 92 -18.866 -8.031 3.811 1.00 0.00 O ATOM 882 ND2 ASN A 92 -16.944 -9.180 3.645 1.00 0.00 N ATOM 0 H ASN A 92 -15.461 -6.176 1.874 1.00 0.00 H new ATOM 0 HA ASN A 92 -18.268 -5.858 2.642 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -15.768 -7.010 3.836 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -16.968 -6.382 4.947 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -17.433 -10.069 3.540 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -15.924 -9.154 3.636 1.00 0.00 H new ATOM 889 N ARG A 93 -17.124 -3.306 2.671 1.00 0.00 N ATOM 890 CA ARG A 93 -16.985 -1.927 3.122 1.00 0.00 C ATOM 891 C ARG A 93 -15.910 -1.812 4.199 1.00 0.00 C ATOM 892 O ARG A 93 -16.093 -1.123 5.202 1.00 0.00 O ATOM 893 CB ARG A 93 -18.319 -1.407 3.660 1.00 0.00 C ATOM 894 CG ARG A 93 -19.463 -1.520 2.666 1.00 0.00 C ATOM 895 CD ARG A 93 -20.799 -1.693 3.371 1.00 0.00 C ATOM 896 NE ARG A 93 -21.400 -0.411 3.727 1.00 0.00 N ATOM 897 CZ ARG A 93 -22.683 -0.262 4.037 1.00 0.00 C ATOM 898 NH1 ARG A 93 -23.495 -1.310 4.035 1.00 0.00 N ATOM 899 NH2 ARG A 93 -23.157 0.938 4.351 1.00 0.00 N ATOM 0 H ARG A 93 -17.270 -3.409 1.667 1.00 0.00 H new ATOM 0 HA ARG A 93 -16.684 -1.321 2.268 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -18.577 -1.961 4.563 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -18.202 -0.363 3.949 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -19.493 -0.627 2.041 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -19.288 -2.367 2.003 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -21.481 -2.246 2.725 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -20.659 -2.290 4.272 1.00 0.00 H new ATOM 0 HE ARG A 93 -20.802 0.415 3.738 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -23.135 -2.234 3.795 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -24.480 -1.193 4.273 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -22.536 1.747 4.354 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -24.142 1.051 4.589 1.00 0.00 H new ATOM 913 N PHE A 94 -14.789 -2.493 3.983 1.00 0.00 N ATOM 914 CA PHE A 94 -13.685 -2.469 4.936 1.00 0.00 C ATOM 915 C PHE A 94 -12.353 -2.272 4.219 1.00 0.00 C ATOM 916 O PHE A 94 -11.954 -3.091 3.390 1.00 0.00 O ATOM 917 CB PHE A 94 -13.655 -3.766 5.746 1.00 0.00 C ATOM 918 CG PHE A 94 -14.938 -4.048 6.474 1.00 0.00 C ATOM 919 CD1 PHE A 94 -15.643 -3.024 7.085 1.00 0.00 C ATOM 920 CD2 PHE A 94 -15.439 -5.338 6.548 1.00 0.00 C ATOM 921 CE1 PHE A 94 -16.824 -3.280 7.756 1.00 0.00 C ATOM 922 CE2 PHE A 94 -16.620 -5.600 7.216 1.00 0.00 C ATOM 923 CZ PHE A 94 -17.313 -4.570 7.822 1.00 0.00 C ATOM 0 H PHE A 94 -14.621 -3.068 3.157 1.00 0.00 H new ATOM 0 HA PHE A 94 -13.840 -1.630 5.614 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -13.436 -4.598 5.077 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -12.840 -3.715 6.468 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -15.265 -2.013 7.036 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -14.900 -6.148 6.078 1.00 0.00 H new ATOM 0 HE1 PHE A 94 -17.364 -2.472 8.228 1.00 0.00 H new ATOM 0 HE2 PHE A 94 -17.001 -6.609 7.264 1.00 0.00 H new ATOM 0 HZ PHE A 94 -18.235 -4.773 8.346 1.00 0.00 H new ATOM 933 N PHE A 95 -11.668 -1.181 4.544 1.00 0.00 N ATOM 934 CA PHE A 95 -10.381 -0.874 3.931 1.00 0.00 C ATOM 935 C PHE A 95 -9.234 -1.451 4.756 1.00 0.00 C ATOM 936 O PHE A 95 -9.422 -1.856 5.904 1.00 0.00 O ATOM 937 CB PHE A 95 -10.208 0.639 3.785 1.00 0.00 C ATOM 938 CG PHE A 95 -11.288 1.289 2.969 1.00 0.00 C ATOM 939 CD1 PHE A 95 -12.547 1.503 3.506 1.00 0.00 C ATOM 940 CD2 PHE A 95 -11.044 1.686 1.664 1.00 0.00 C ATOM 941 CE1 PHE A 95 -13.543 2.102 2.757 1.00 0.00 C ATOM 942 CE2 PHE A 95 -12.036 2.286 0.911 1.00 0.00 C ATOM 943 CZ PHE A 95 -13.287 2.493 1.457 1.00 0.00 C ATOM 0 H PHE A 95 -11.983 -0.494 5.229 1.00 0.00 H new ATOM 0 HA PHE A 95 -10.360 -1.332 2.942 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -10.190 1.092 4.776 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -9.242 0.843 3.323 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -12.753 1.198 4.521 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.068 1.525 1.230 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -14.520 2.264 3.188 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -11.832 2.593 -0.104 1.00 0.00 H new ATOM 0 HZ PHE A 95 -14.064 2.960 0.869 1.00 0.00 H new ATOM 953 N THR A 96 -8.045 -1.486 4.163 1.00 0.00 N ATOM 954 CA THR A 96 -6.868 -2.014 4.842 1.00 0.00 C ATOM 955 C THR A 96 -5.610 -1.260 4.427 1.00 0.00 C ATOM 956 O THR A 96 -5.269 -1.205 3.245 1.00 0.00 O ATOM 957 CB THR A 96 -6.675 -3.514 4.546 1.00 0.00 C ATOM 958 OG1 THR A 96 -7.920 -4.206 4.692 1.00 0.00 O ATOM 959 CG2 THR A 96 -5.639 -4.120 5.480 1.00 0.00 C ATOM 0 H THR A 96 -7.871 -1.155 3.214 1.00 0.00 H new ATOM 0 HA THR A 96 -7.033 -1.880 5.911 1.00 0.00 H new ATOM 0 HB THR A 96 -6.321 -3.617 3.520 1.00 0.00 H new ATOM 0 HG1 THR A 96 -7.889 -4.770 5.493 1.00 0.00 H new ATOM 0 HG21 THR A 96 -5.519 -5.179 5.253 1.00 0.00 H new ATOM 0 HG22 THR A 96 -4.685 -3.610 5.345 1.00 0.00 H new ATOM 0 HG23 THR A 96 -5.969 -4.006 6.513 1.00 0.00 H new ATOM 967 N CYS A 97 -4.923 -0.681 5.405 1.00 0.00 N ATOM 968 CA CYS A 97 -3.702 0.071 5.141 1.00 0.00 C ATOM 969 C CYS A 97 -2.492 -0.857 5.096 1.00 0.00 C ATOM 970 O CYS A 97 -1.996 -1.297 6.134 1.00 0.00 O ATOM 971 CB CYS A 97 -3.497 1.144 6.211 1.00 0.00 C ATOM 972 SG CYS A 97 -4.557 2.595 6.013 1.00 0.00 S ATOM 0 H CYS A 97 -5.191 -0.718 6.388 1.00 0.00 H new ATOM 0 HA CYS A 97 -3.805 0.553 4.169 1.00 0.00 H new ATOM 0 HB2 CYS A 97 -3.681 0.704 7.191 1.00 0.00 H new ATOM 0 HB3 CYS A 97 -2.455 1.464 6.195 1.00 0.00 H new ATOM 0 HG CYS A 97 -5.326 2.716 7.054 1.00 0.00 H new ATOM 978 N TRP A 98 -2.022 -1.150 3.889 1.00 0.00 N ATOM 979 CA TRP A 98 -0.871 -2.028 3.709 1.00 0.00 C ATOM 980 C TRP A 98 0.432 -1.240 3.795 1.00 0.00 C ATOM 981 O TRP A 98 0.702 -0.378 2.961 1.00 0.00 O ATOM 982 CB TRP A 98 -0.958 -2.748 2.363 1.00 0.00 C ATOM 983 CG TRP A 98 0.309 -3.453 1.983 1.00 0.00 C ATOM 984 CD1 TRP A 98 1.206 -3.067 1.028 1.00 0.00 C ATOM 985 CD2 TRP A 98 0.817 -4.665 2.549 1.00 0.00 C ATOM 986 NE1 TRP A 98 2.242 -3.968 0.967 1.00 0.00 N ATOM 987 CE2 TRP A 98 2.028 -4.957 1.890 1.00 0.00 C ATOM 988 CE3 TRP A 98 0.370 -5.532 3.549 1.00 0.00 C ATOM 989 CZ2 TRP A 98 2.792 -6.079 2.199 1.00 0.00 C ATOM 990 CZ3 TRP A 98 1.129 -6.645 3.855 1.00 0.00 C ATOM 991 CH2 TRP A 98 2.330 -6.910 3.183 1.00 0.00 C ATOM 0 H TRP A 98 -2.420 -0.793 3.020 1.00 0.00 H new ATOM 0 HA TRP A 98 -0.881 -2.768 4.509 1.00 0.00 H new ATOM 0 HB2 TRP A 98 -1.772 -3.472 2.399 1.00 0.00 H new ATOM 0 HB3 TRP A 98 -1.209 -2.024 1.588 1.00 0.00 H new ATOM 0 HD1 TRP A 98 1.115 -2.185 0.412 1.00 0.00 H new ATOM 0 HE1 TRP A 98 3.041 -3.910 0.336 1.00 0.00 H new ATOM 0 HE3 TRP A 98 -0.553 -5.336 4.074 1.00 0.00 H new ATOM 0 HZ2 TRP A 98 3.716 -6.286 1.680 1.00 0.00 H new ATOM 0 HZ3 TRP A 98 0.791 -7.322 4.625 1.00 0.00 H new ATOM 0 HH2 TRP A 98 2.902 -7.787 3.447 1.00 0.00 H new ATOM 1002 N ASN A 99 1.236 -1.543 4.809 1.00 0.00 N ATOM 1003 CA ASN A 99 2.511 -0.863 5.004 1.00 0.00 C ATOM 1004 C ASN A 99 3.662 -1.864 5.040 1.00 0.00 C ATOM 1005 O ASN A 99 3.687 -2.766 5.878 1.00 0.00 O ATOM 1006 CB ASN A 99 2.486 -0.049 6.299 1.00 0.00 C ATOM 1007 CG ASN A 99 1.130 0.576 6.564 1.00 0.00 C ATOM 1008 OD1 ASN A 99 0.566 0.427 7.648 1.00 0.00 O ATOM 1009 ND2 ASN A 99 0.600 1.281 5.571 1.00 0.00 N ATOM 0 H ASN A 99 1.027 -2.255 5.509 1.00 0.00 H new ATOM 0 HA ASN A 99 2.667 -0.188 4.162 1.00 0.00 H new ATOM 0 HB2 ASN A 99 2.755 -0.694 7.135 1.00 0.00 H new ATOM 0 HB3 ASN A 99 3.240 0.736 6.246 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -0.310 1.725 5.690 1.00 0.00 H new ATOM 0 HD22 ASN A 99 1.103 1.378 4.689 1.00 0.00 H new ATOM 1016 N ARG A 100 4.613 -1.697 4.127 1.00 0.00 N ATOM 1017 CA ARG A 100 5.766 -2.586 4.054 1.00 0.00 C ATOM 1018 C ARG A 100 7.063 -1.787 3.963 1.00 0.00 C ATOM 1019 O ARG A 100 7.278 -1.041 3.008 1.00 0.00 O ATOM 1020 CB ARG A 100 5.643 -3.518 2.848 1.00 0.00 C ATOM 1021 CG ARG A 100 6.856 -4.410 2.641 1.00 0.00 C ATOM 1022 CD ARG A 100 6.586 -5.485 1.599 1.00 0.00 C ATOM 1023 NE ARG A 100 6.403 -4.920 0.265 1.00 0.00 N ATOM 1024 CZ ARG A 100 7.399 -4.711 -0.588 1.00 0.00 C ATOM 1025 NH1 ARG A 100 8.643 -5.020 -0.247 1.00 0.00 N ATOM 1026 NH2 ARG A 100 7.153 -4.194 -1.784 1.00 0.00 N ATOM 0 H ARG A 100 4.608 -0.954 3.428 1.00 0.00 H new ATOM 0 HA ARG A 100 5.791 -3.184 4.965 1.00 0.00 H new ATOM 0 HB2 ARG A 100 4.759 -4.144 2.972 1.00 0.00 H new ATOM 0 HB3 ARG A 100 5.486 -2.919 1.951 1.00 0.00 H new ATOM 0 HG2 ARG A 100 7.706 -3.803 2.328 1.00 0.00 H new ATOM 0 HG3 ARG A 100 7.130 -4.879 3.586 1.00 0.00 H new ATOM 0 HD2 ARG A 100 7.416 -6.191 1.583 1.00 0.00 H new ATOM 0 HD3 ARG A 100 5.695 -6.047 1.880 1.00 0.00 H new ATOM 0 HE ARG A 100 5.458 -4.672 -0.028 1.00 0.00 H new ATOM 0 HH11 ARG A 100 8.836 -5.419 0.672 1.00 0.00 H new ATOM 0 HH12 ARG A 100 9.407 -4.859 -0.904 1.00 0.00 H new ATOM 0 HH21 ARG A 100 6.197 -3.956 -2.050 1.00 0.00 H new ATOM 0 HH22 ARG A 100 7.919 -4.034 -2.438 1.00 0.00 H new ATOM 1040 N TRP A 101 7.923 -1.949 4.962 1.00 0.00 N ATOM 1041 CA TRP A 101 9.199 -1.243 4.994 1.00 0.00 C ATOM 1042 C TRP A 101 10.355 -2.216 5.197 1.00 0.00 C ATOM 1043 O TRP A 101 10.150 -3.368 5.578 1.00 0.00 O ATOM 1044 CB TRP A 101 9.196 -0.195 6.108 1.00 0.00 C ATOM 1045 CG TRP A 101 9.165 -0.790 7.484 1.00 0.00 C ATOM 1046 CD1 TRP A 101 10.232 -1.252 8.201 1.00 0.00 C ATOM 1047 CD2 TRP A 101 8.010 -0.990 8.305 1.00 0.00 C ATOM 1048 NE1 TRP A 101 9.809 -1.726 9.419 1.00 0.00 N ATOM 1049 CE2 TRP A 101 8.450 -1.576 9.508 1.00 0.00 C ATOM 1050 CE3 TRP A 101 6.647 -0.728 8.143 1.00 0.00 C ATOM 1051 CZ2 TRP A 101 7.575 -1.905 10.540 1.00 0.00 C ATOM 1052 CZ3 TRP A 101 5.779 -1.055 9.168 1.00 0.00 C ATOM 1053 CH2 TRP A 101 6.246 -1.638 10.354 1.00 0.00 C ATOM 0 H TRP A 101 7.760 -2.563 5.760 1.00 0.00 H new ATOM 0 HA TRP A 101 9.334 -0.744 4.035 1.00 0.00 H new ATOM 0 HB2 TRP A 101 10.083 0.431 6.011 1.00 0.00 H new ATOM 0 HB3 TRP A 101 8.331 0.456 5.982 1.00 0.00 H new ATOM 0 HD1 TRP A 101 11.257 -1.246 7.861 1.00 0.00 H new ATOM 0 HE1 TRP A 101 10.410 -2.125 10.140 1.00 0.00 H new ATOM 0 HE3 TRP A 101 6.278 -0.278 7.233 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 7.933 -2.355 11.454 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 4.723 -0.858 9.053 1.00 0.00 H new ATOM 0 HH2 TRP A 101 5.543 -1.881 11.137 1.00 0.00 H new ATOM 1064 N GLY A 102 11.571 -1.745 4.940 1.00 0.00 N ATOM 1065 CA GLY A 102 12.742 -2.587 5.100 1.00 0.00 C ATOM 1066 C GLY A 102 13.884 -2.171 4.195 1.00 0.00 C ATOM 1067 O GLY A 102 13.948 -1.024 3.752 1.00 0.00 O ATOM 0 H GLY A 102 11.766 -0.795 4.624 1.00 0.00 H new ATOM 0 HA2 GLY A 102 13.073 -2.550 6.138 1.00 0.00 H new ATOM 0 HA3 GLY A 102 12.473 -3.622 4.888 1.00 0.00 H new ATOM 1071 N ARG A 103 14.790 -3.104 3.920 1.00 0.00 N ATOM 1072 CA ARG A 103 15.937 -2.827 3.063 1.00 0.00 C ATOM 1073 C ARG A 103 15.563 -2.969 1.591 1.00 0.00 C ATOM 1074 O ARG A 103 14.880 -3.916 1.201 1.00 0.00 O ATOM 1075 CB ARG A 103 17.092 -3.772 3.401 1.00 0.00 C ATOM 1076 CG ARG A 103 18.030 -3.230 4.467 1.00 0.00 C ATOM 1077 CD ARG A 103 19.260 -4.110 4.625 1.00 0.00 C ATOM 1078 NE ARG A 103 19.802 -4.054 5.980 1.00 0.00 N ATOM 1079 CZ ARG A 103 20.655 -4.948 6.469 1.00 0.00 C ATOM 1080 NH1 ARG A 103 21.060 -5.962 5.716 1.00 0.00 N ATOM 1081 NH2 ARG A 103 21.103 -4.829 7.712 1.00 0.00 N ATOM 0 H ARG A 103 14.752 -4.058 4.278 1.00 0.00 H new ATOM 0 HA ARG A 103 16.253 -1.799 3.242 1.00 0.00 H new ATOM 0 HB2 ARG A 103 16.684 -4.725 3.738 1.00 0.00 H new ATOM 0 HB3 ARG A 103 17.663 -3.973 2.495 1.00 0.00 H new ATOM 0 HG2 ARG A 103 18.337 -2.218 4.203 1.00 0.00 H new ATOM 0 HG3 ARG A 103 17.503 -3.165 5.419 1.00 0.00 H new ATOM 0 HD2 ARG A 103 19.003 -5.140 4.380 1.00 0.00 H new ATOM 0 HD3 ARG A 103 20.025 -3.795 3.915 1.00 0.00 H new ATOM 0 HE ARG A 103 19.510 -3.286 6.584 1.00 0.00 H new ATOM 0 HH11 ARG A 103 20.717 -6.056 4.760 1.00 0.00 H new ATOM 0 HH12 ARG A 103 21.715 -6.647 6.093 1.00 0.00 H new ATOM 0 HH21 ARG A 103 20.793 -4.051 8.294 1.00 0.00 H new ATOM 0 HH22 ARG A 103 21.758 -5.516 8.086 1.00 0.00 H new ATOM 1095 N VAL A 104 16.015 -2.020 0.777 1.00 0.00 N ATOM 1096 CA VAL A 104 15.729 -2.039 -0.653 1.00 0.00 C ATOM 1097 C VAL A 104 16.130 -3.372 -1.276 1.00 0.00 C ATOM 1098 O VAL A 104 17.268 -3.816 -1.138 1.00 0.00 O ATOM 1099 CB VAL A 104 16.462 -0.901 -1.387 1.00 0.00 C ATOM 1100 CG1 VAL A 104 16.277 -1.029 -2.891 1.00 0.00 C ATOM 1101 CG2 VAL A 104 15.972 0.453 -0.895 1.00 0.00 C ATOM 0 H VAL A 104 16.581 -1.228 1.083 1.00 0.00 H new ATOM 0 HA VAL A 104 14.654 -1.899 -0.763 1.00 0.00 H new ATOM 0 HB VAL A 104 17.527 -0.978 -1.168 1.00 0.00 H new ATOM 0 HG11 VAL A 104 16.802 -0.216 -3.393 1.00 0.00 H new ATOM 0 HG12 VAL A 104 16.681 -1.984 -3.227 1.00 0.00 H new ATOM 0 HG13 VAL A 104 15.215 -0.979 -3.133 1.00 0.00 H new ATOM 0 HG21 VAL A 104 16.501 1.246 -1.424 1.00 0.00 H new ATOM 0 HG22 VAL A 104 14.902 0.543 -1.082 1.00 0.00 H new ATOM 0 HG23 VAL A 104 16.162 0.542 0.175 1.00 0.00 H new ATOM 1111 N GLY A 105 15.184 -4.006 -1.963 1.00 0.00 N ATOM 1112 CA GLY A 105 15.458 -5.282 -2.597 1.00 0.00 C ATOM 1113 C GLY A 105 14.853 -6.447 -1.840 1.00 0.00 C ATOM 1114 O GLY A 105 14.326 -7.381 -2.445 1.00 0.00 O ATOM 0 H GLY A 105 14.234 -3.659 -2.091 1.00 0.00 H new ATOM 0 HA2 GLY A 105 15.066 -5.271 -3.614 1.00 0.00 H new ATOM 0 HA3 GLY A 105 16.536 -5.423 -2.673 1.00 0.00 H new ATOM 1118 N GLU A 106 14.929 -6.394 -0.514 1.00 0.00 N ATOM 1119 CA GLU A 106 14.387 -7.456 0.325 1.00 0.00 C ATOM 1120 C GLU A 106 12.994 -7.091 0.831 1.00 0.00 C ATOM 1121 O GLU A 106 12.741 -5.950 1.219 1.00 0.00 O ATOM 1122 CB GLU A 106 15.317 -7.726 1.509 1.00 0.00 C ATOM 1123 CG GLU A 106 15.275 -6.644 2.576 1.00 0.00 C ATOM 1124 CD GLU A 106 15.929 -7.078 3.873 1.00 0.00 C ATOM 1125 OE1 GLU A 106 17.013 -7.695 3.813 1.00 0.00 O ATOM 1126 OE2 GLU A 106 15.356 -6.801 4.948 1.00 0.00 O ATOM 0 H GLU A 106 15.360 -5.627 0.002 1.00 0.00 H new ATOM 0 HA GLU A 106 14.310 -8.359 -0.280 1.00 0.00 H new ATOM 0 HB2 GLU A 106 15.048 -8.681 1.961 1.00 0.00 H new ATOM 0 HB3 GLU A 106 16.339 -7.824 1.143 1.00 0.00 H new ATOM 0 HG2 GLU A 106 15.776 -5.751 2.202 1.00 0.00 H new ATOM 0 HG3 GLU A 106 14.238 -6.371 2.770 1.00 0.00 H new ATOM 1133 N VAL A 107 12.093 -8.068 0.824 1.00 0.00 N ATOM 1134 CA VAL A 107 10.726 -7.852 1.282 1.00 0.00 C ATOM 1135 C VAL A 107 10.696 -6.966 2.522 1.00 0.00 C ATOM 1136 O VAL A 107 9.830 -6.104 2.661 1.00 0.00 O ATOM 1137 CB VAL A 107 10.023 -9.185 1.599 1.00 0.00 C ATOM 1138 CG1 VAL A 107 8.610 -8.936 2.105 1.00 0.00 C ATOM 1139 CG2 VAL A 107 10.008 -10.084 0.373 1.00 0.00 C ATOM 0 H VAL A 107 12.286 -9.018 0.506 1.00 0.00 H new ATOM 0 HA VAL A 107 10.195 -7.354 0.471 1.00 0.00 H new ATOM 0 HB VAL A 107 10.581 -9.692 2.386 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.129 -9.889 2.324 1.00 0.00 H new ATOM 0 HG12 VAL A 107 8.649 -8.333 3.012 1.00 0.00 H new ATOM 0 HG13 VAL A 107 8.038 -8.407 1.342 1.00 0.00 H new ATOM 0 HG21 VAL A 107 9.507 -11.021 0.615 1.00 0.00 H new ATOM 0 HG22 VAL A 107 9.474 -9.586 -0.437 1.00 0.00 H new ATOM 0 HG23 VAL A 107 11.032 -10.290 0.060 1.00 0.00 H new ATOM 1149 N GLY A 108 11.650 -7.185 3.422 1.00 0.00 N ATOM 1150 CA GLY A 108 11.716 -6.398 4.640 1.00 0.00 C ATOM 1151 C GLY A 108 10.628 -6.768 5.629 1.00 0.00 C ATOM 1152 O GLY A 108 10.161 -7.907 5.649 1.00 0.00 O ATOM 0 H GLY A 108 12.378 -7.893 3.329 1.00 0.00 H new ATOM 0 HA2 GLY A 108 12.691 -6.539 5.107 1.00 0.00 H new ATOM 0 HA3 GLY A 108 11.632 -5.340 4.391 1.00 0.00 H new ATOM 1156 N GLN A 109 10.224 -5.805 6.450 1.00 0.00 N ATOM 1157 CA GLN A 109 9.186 -6.037 7.447 1.00 0.00 C ATOM 1158 C GLN A 109 7.798 -5.911 6.828 1.00 0.00 C ATOM 1159 O GLN A 109 7.617 -5.227 5.820 1.00 0.00 O ATOM 1160 CB GLN A 109 9.332 -5.049 8.606 1.00 0.00 C ATOM 1161 CG GLN A 109 10.251 -5.541 9.713 1.00 0.00 C ATOM 1162 CD GLN A 109 9.961 -4.883 11.047 1.00 0.00 C ATOM 1163 OE1 GLN A 109 8.805 -4.754 11.451 1.00 0.00 O ATOM 1164 NE2 GLN A 109 11.013 -4.462 11.741 1.00 0.00 N ATOM 0 H GLN A 109 10.599 -4.857 6.445 1.00 0.00 H new ATOM 0 HA GLN A 109 9.303 -7.052 7.827 1.00 0.00 H new ATOM 0 HB2 GLN A 109 9.715 -4.104 8.221 1.00 0.00 H new ATOM 0 HB3 GLN A 109 8.347 -4.847 9.026 1.00 0.00 H new ATOM 0 HG2 GLN A 109 10.146 -6.621 9.814 1.00 0.00 H new ATOM 0 HG3 GLN A 109 11.287 -5.347 9.434 1.00 0.00 H new ATOM 0 HE21 GLN A 109 11.954 -4.589 11.368 1.00 0.00 H new ATOM 0 HE22 GLN A 109 10.880 -4.012 12.646 1.00 0.00 H new ATOM 1173 N SER A 110 6.820 -6.574 7.437 1.00 0.00 N ATOM 1174 CA SER A 110 5.449 -6.539 6.942 1.00 0.00 C ATOM 1175 C SER A 110 4.495 -6.035 8.021 1.00 0.00 C ATOM 1176 O SER A 110 4.462 -6.562 9.133 1.00 0.00 O ATOM 1177 CB SER A 110 5.018 -7.931 6.474 1.00 0.00 C ATOM 1178 OG SER A 110 4.836 -8.805 7.574 1.00 0.00 O ATOM 0 H SER A 110 6.952 -7.142 8.274 1.00 0.00 H new ATOM 0 HA SER A 110 5.411 -5.851 6.097 1.00 0.00 H new ATOM 0 HB2 SER A 110 4.090 -7.856 5.907 1.00 0.00 H new ATOM 0 HB3 SER A 110 5.771 -8.341 5.800 1.00 0.00 H new ATOM 0 HG SER A 110 4.728 -8.280 8.395 1.00 0.00 H new ATOM 1184 N LYS A 111 3.721 -5.009 7.684 1.00 0.00 N ATOM 1185 CA LYS A 111 2.764 -4.432 8.621 1.00 0.00 C ATOM 1186 C LYS A 111 1.456 -4.084 7.918 1.00 0.00 C ATOM 1187 O LYS A 111 1.431 -3.254 7.008 1.00 0.00 O ATOM 1188 CB LYS A 111 3.352 -3.180 9.275 1.00 0.00 C ATOM 1189 CG LYS A 111 2.363 -2.428 10.148 1.00 0.00 C ATOM 1190 CD LYS A 111 2.078 -3.176 11.440 1.00 0.00 C ATOM 1191 CE LYS A 111 3.200 -2.990 12.451 1.00 0.00 C ATOM 1192 NZ LYS A 111 3.242 -1.599 12.982 1.00 0.00 N ATOM 0 H LYS A 111 3.738 -4.560 6.768 1.00 0.00 H new ATOM 0 HA LYS A 111 2.555 -5.174 9.392 1.00 0.00 H new ATOM 0 HB2 LYS A 111 4.213 -3.466 9.879 1.00 0.00 H new ATOM 0 HB3 LYS A 111 3.718 -2.511 8.496 1.00 0.00 H new ATOM 0 HG2 LYS A 111 2.759 -1.439 10.379 1.00 0.00 H new ATOM 0 HG3 LYS A 111 1.433 -2.279 9.600 1.00 0.00 H new ATOM 0 HD2 LYS A 111 1.140 -2.822 11.867 1.00 0.00 H new ATOM 0 HD3 LYS A 111 1.951 -4.237 11.227 1.00 0.00 H new ATOM 0 HE2 LYS A 111 3.066 -3.690 13.276 1.00 0.00 H new ATOM 0 HE3 LYS A 111 4.155 -3.229 11.982 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 3.779 -1.583 13.872 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 3.703 -0.976 12.288 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 2.273 -1.265 13.157 1.00 0.00 H new ATOM 1206 N ILE A 112 0.372 -4.722 8.345 1.00 0.00 N ATOM 1207 CA ILE A 112 -0.940 -4.477 7.758 1.00 0.00 C ATOM 1208 C ILE A 112 -1.933 -3.997 8.811 1.00 0.00 C ATOM 1209 O ILE A 112 -1.934 -4.479 9.943 1.00 0.00 O ATOM 1210 CB ILE A 112 -1.498 -5.742 7.080 1.00 0.00 C ATOM 1211 CG1 ILE A 112 -2.667 -5.380 6.161 1.00 0.00 C ATOM 1212 CG2 ILE A 112 -1.935 -6.755 8.128 1.00 0.00 C ATOM 1213 CD1 ILE A 112 -2.929 -6.410 5.084 1.00 0.00 C ATOM 0 H ILE A 112 0.376 -5.413 9.096 1.00 0.00 H new ATOM 0 HA ILE A 112 -0.809 -3.699 7.006 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.710 -6.191 6.475 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -3.568 -5.258 6.763 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -2.465 -4.418 5.691 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -2.327 -7.644 7.634 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -1.081 -7.031 8.746 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -2.711 -6.317 8.756 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -3.770 -6.089 4.470 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -2.043 -6.516 4.458 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -3.163 -7.369 5.547 1.00 0.00 H new ATOM 1225 N ASN A 113 -2.778 -3.045 8.429 1.00 0.00 N ATOM 1226 CA ASN A 113 -3.778 -2.500 9.340 1.00 0.00 C ATOM 1227 C ASN A 113 -5.166 -2.532 8.707 1.00 0.00 C ATOM 1228 O ASN A 113 -5.324 -2.251 7.518 1.00 0.00 O ATOM 1229 CB ASN A 113 -3.415 -1.066 9.730 1.00 0.00 C ATOM 1230 CG ASN A 113 -1.926 -0.885 9.948 1.00 0.00 C ATOM 1231 OD1 ASN A 113 -1.224 -0.338 9.096 1.00 0.00 O ATOM 1232 ND2 ASN A 113 -1.435 -1.344 11.093 1.00 0.00 N ATOM 0 H ASN A 113 -2.790 -2.635 7.495 1.00 0.00 H new ATOM 0 HA ASN A 113 -3.793 -3.120 10.236 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -3.750 -0.384 8.949 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -3.948 -0.794 10.641 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -0.440 -1.250 11.295 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -2.053 -1.790 11.770 1.00 0.00 H new ATOM 1239 N HIS A 114 -6.168 -2.875 9.509 1.00 0.00 N ATOM 1240 CA HIS A 114 -7.544 -2.942 9.028 1.00 0.00 C ATOM 1241 C HIS A 114 -8.408 -1.881 9.702 1.00 0.00 C ATOM 1242 O HIS A 114 -8.416 -1.759 10.927 1.00 0.00 O ATOM 1243 CB HIS A 114 -8.129 -4.331 9.284 1.00 0.00 C ATOM 1244 CG HIS A 114 -7.245 -5.448 8.820 1.00 0.00 C ATOM 1245 ND1 HIS A 114 -7.297 -5.969 7.545 1.00 0.00 N ATOM 1246 CD2 HIS A 114 -6.282 -6.143 9.470 1.00 0.00 C ATOM 1247 CE1 HIS A 114 -6.405 -6.937 7.430 1.00 0.00 C ATOM 1248 NE2 HIS A 114 -5.776 -7.062 8.585 1.00 0.00 N ATOM 0 H HIS A 114 -6.054 -3.111 10.495 1.00 0.00 H new ATOM 0 HA HIS A 114 -7.537 -2.751 7.955 1.00 0.00 H new ATOM 0 HB2 HIS A 114 -8.316 -4.446 10.352 1.00 0.00 H new ATOM 0 HB3 HIS A 114 -9.093 -4.409 8.781 1.00 0.00 H new ATOM 0 HD2 HIS A 114 -5.970 -6.001 10.494 1.00 0.00 H new ATOM 0 HE1 HIS A 114 -6.221 -7.526 6.543 1.00 0.00 H new ATOM 0 HE2 HIS A 114 -5.034 -7.733 8.786 1.00 0.00 H new ATOM 1256 N PHE A 115 -9.133 -1.114 8.894 1.00 0.00 N ATOM 1257 CA PHE A 115 -10.000 -0.062 9.413 1.00 0.00 C ATOM 1258 C PHE A 115 -11.433 -0.248 8.926 1.00 0.00 C ATOM 1259 O PHE A 115 -11.671 -0.528 7.750 1.00 0.00 O ATOM 1260 CB PHE A 115 -9.479 1.313 8.988 1.00 0.00 C ATOM 1261 CG PHE A 115 -8.107 1.623 9.514 1.00 0.00 C ATOM 1262 CD1 PHE A 115 -7.935 2.079 10.811 1.00 0.00 C ATOM 1263 CD2 PHE A 115 -6.989 1.459 8.712 1.00 0.00 C ATOM 1264 CE1 PHE A 115 -6.674 2.366 11.298 1.00 0.00 C ATOM 1265 CE2 PHE A 115 -5.725 1.744 9.193 1.00 0.00 C ATOM 1266 CZ PHE A 115 -5.567 2.197 10.488 1.00 0.00 C ATOM 0 H PHE A 115 -9.137 -1.201 7.878 1.00 0.00 H new ATOM 0 HA PHE A 115 -9.994 -0.125 10.501 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -9.463 1.366 7.899 1.00 0.00 H new ATOM 0 HB3 PHE A 115 -10.174 2.079 9.334 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -8.796 2.212 11.449 1.00 0.00 H new ATOM 0 HD2 PHE A 115 -7.107 1.104 7.699 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -6.554 2.722 12.311 1.00 0.00 H new ATOM 0 HE2 PHE A 115 -4.862 1.613 8.557 1.00 0.00 H new ATOM 0 HZ PHE A 115 -4.580 2.419 10.867 1.00 0.00 H new ATOM 1276 N THR A 116 -12.388 -0.092 9.838 1.00 0.00 N ATOM 1277 CA THR A 116 -13.798 -0.244 9.504 1.00 0.00 C ATOM 1278 C THR A 116 -14.315 0.968 8.738 1.00 0.00 C ATOM 1279 O THR A 116 -15.050 0.830 7.760 1.00 0.00 O ATOM 1280 CB THR A 116 -14.656 -0.444 10.766 1.00 0.00 C ATOM 1281 OG1 THR A 116 -14.545 0.699 11.621 1.00 0.00 O ATOM 1282 CG2 THR A 116 -14.225 -1.693 11.522 1.00 0.00 C ATOM 0 H THR A 116 -12.209 0.140 10.815 1.00 0.00 H new ATOM 0 HA THR A 116 -13.880 -1.130 8.875 1.00 0.00 H new ATOM 0 HB THR A 116 -15.694 -0.566 10.456 1.00 0.00 H new ATOM 0 HG1 THR A 116 -15.095 0.564 12.421 1.00 0.00 H new ATOM 0 HG21 THR A 116 -14.846 -1.813 12.410 1.00 0.00 H new ATOM 0 HG22 THR A 116 -14.339 -2.565 10.879 1.00 0.00 H new ATOM 0 HG23 THR A 116 -13.181 -1.596 11.820 1.00 0.00 H new ATOM 1290 N ARG A 117 -13.927 2.157 9.189 1.00 0.00 N ATOM 1291 CA ARG A 117 -14.353 3.394 8.546 1.00 0.00 C ATOM 1292 C ARG A 117 -13.344 3.832 7.488 1.00 0.00 C ATOM 1293 O ARG A 117 -12.146 3.579 7.615 1.00 0.00 O ATOM 1294 CB ARG A 117 -14.529 4.501 9.588 1.00 0.00 C ATOM 1295 CG ARG A 117 -15.931 4.572 10.170 1.00 0.00 C ATOM 1296 CD ARG A 117 -16.885 5.300 9.237 1.00 0.00 C ATOM 1297 NE ARG A 117 -18.282 5.077 9.600 1.00 0.00 N ATOM 1298 CZ ARG A 117 -19.283 5.842 9.178 1.00 0.00 C ATOM 1299 NH1 ARG A 117 -19.042 6.875 8.382 1.00 0.00 N ATOM 1300 NH2 ARG A 117 -20.528 5.575 9.552 1.00 0.00 N ATOM 0 H ARG A 117 -13.319 2.289 9.997 1.00 0.00 H new ATOM 0 HA ARG A 117 -15.309 3.209 8.057 1.00 0.00 H new ATOM 0 HB2 ARG A 117 -13.816 4.343 10.397 1.00 0.00 H new ATOM 0 HB3 ARG A 117 -14.285 5.460 9.131 1.00 0.00 H new ATOM 0 HG2 ARG A 117 -16.301 3.563 10.356 1.00 0.00 H new ATOM 0 HG3 ARG A 117 -15.901 5.083 11.133 1.00 0.00 H new ATOM 0 HD2 ARG A 117 -16.670 6.368 9.261 1.00 0.00 H new ATOM 0 HD3 ARG A 117 -16.718 4.964 8.214 1.00 0.00 H new ATOM 0 HE ARG A 117 -18.501 4.290 10.211 1.00 0.00 H new ATOM 0 HH11 ARG A 117 -18.086 7.084 8.092 1.00 0.00 H new ATOM 0 HH12 ARG A 117 -19.812 7.461 8.059 1.00 0.00 H new ATOM 0 HH21 ARG A 117 -20.718 4.782 10.164 1.00 0.00 H new ATOM 0 HH22 ARG A 117 -21.295 6.163 9.227 1.00 0.00 H new ATOM 1314 N LEU A 118 -13.837 4.490 6.445 1.00 0.00 N ATOM 1315 CA LEU A 118 -12.980 4.963 5.364 1.00 0.00 C ATOM 1316 C LEU A 118 -12.146 6.158 5.814 1.00 0.00 C ATOM 1317 O LEU A 118 -10.921 6.150 5.700 1.00 0.00 O ATOM 1318 CB LEU A 118 -13.824 5.345 4.146 1.00 0.00 C ATOM 1319 CG LEU A 118 -13.097 6.108 3.039 1.00 0.00 C ATOM 1320 CD1 LEU A 118 -11.988 5.256 2.441 1.00 0.00 C ATOM 1321 CD2 LEU A 118 -14.078 6.544 1.959 1.00 0.00 C ATOM 0 H LEU A 118 -14.826 4.708 6.325 1.00 0.00 H new ATOM 0 HA LEU A 118 -12.304 4.154 5.089 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -14.241 4.434 3.718 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -14.664 5.951 4.486 1.00 0.00 H new ATOM 0 HG LEU A 118 -12.646 7.000 3.475 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -11.482 5.817 1.655 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -11.271 4.994 3.219 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -12.415 4.346 2.020 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -13.543 7.086 1.179 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -14.558 5.666 1.527 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -14.836 7.193 2.397 1.00 0.00 H new ATOM 1333 N GLU A 119 -12.819 7.183 6.327 1.00 0.00 N ATOM 1334 CA GLU A 119 -12.139 8.385 6.795 1.00 0.00 C ATOM 1335 C GLU A 119 -10.996 8.030 7.742 1.00 0.00 C ATOM 1336 O GLU A 119 -9.900 8.582 7.644 1.00 0.00 O ATOM 1337 CB GLU A 119 -13.129 9.316 7.499 1.00 0.00 C ATOM 1338 CG GLU A 119 -13.967 10.149 6.544 1.00 0.00 C ATOM 1339 CD GLU A 119 -14.437 11.450 7.163 1.00 0.00 C ATOM 1340 OE1 GLU A 119 -15.361 11.409 8.002 1.00 0.00 O ATOM 1341 OE2 GLU A 119 -13.881 12.511 6.807 1.00 0.00 O ATOM 0 H GLU A 119 -13.834 7.205 6.429 1.00 0.00 H new ATOM 0 HA GLU A 119 -11.723 8.897 5.928 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -13.792 8.720 8.126 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -12.578 9.983 8.162 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -13.383 10.367 5.650 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -14.833 9.569 6.226 1.00 0.00 H new ATOM 1348 N ASP A 120 -11.261 7.105 8.658 1.00 0.00 N ATOM 1349 CA ASP A 120 -10.256 6.675 9.623 1.00 0.00 C ATOM 1350 C ASP A 120 -9.003 6.170 8.914 1.00 0.00 C ATOM 1351 O ASP A 120 -7.883 6.497 9.304 1.00 0.00 O ATOM 1352 CB ASP A 120 -10.822 5.579 10.527 1.00 0.00 C ATOM 1353 CG ASP A 120 -10.048 5.440 11.823 1.00 0.00 C ATOM 1354 OD1 ASP A 120 -10.282 6.251 12.744 1.00 0.00 O ATOM 1355 OD2 ASP A 120 -9.209 4.520 11.917 1.00 0.00 O ATOM 0 H ASP A 120 -12.163 6.639 8.753 1.00 0.00 H new ATOM 0 HA ASP A 120 -9.984 7.535 10.235 1.00 0.00 H new ATOM 0 HB2 ASP A 120 -11.865 5.801 10.752 1.00 0.00 H new ATOM 0 HB3 ASP A 120 -10.806 4.628 9.994 1.00 0.00 H new ATOM 1360 N ALA A 121 -9.202 5.370 7.871 1.00 0.00 N ATOM 1361 CA ALA A 121 -8.089 4.821 7.107 1.00 0.00 C ATOM 1362 C ALA A 121 -7.320 5.923 6.387 1.00 0.00 C ATOM 1363 O ALA A 121 -6.089 5.912 6.347 1.00 0.00 O ATOM 1364 CB ALA A 121 -8.592 3.787 6.110 1.00 0.00 C ATOM 0 H ALA A 121 -10.123 5.088 7.536 1.00 0.00 H new ATOM 0 HA ALA A 121 -7.407 4.335 7.805 1.00 0.00 H new ATOM 0 HB1 ALA A 121 -7.750 3.385 5.546 1.00 0.00 H new ATOM 0 HB2 ALA A 121 -9.090 2.978 6.645 1.00 0.00 H new ATOM 0 HB3 ALA A 121 -9.297 4.256 5.424 1.00 0.00 H new ATOM 1370 N LYS A 122 -8.053 6.874 5.818 1.00 0.00 N ATOM 1371 CA LYS A 122 -7.441 7.985 5.098 1.00 0.00 C ATOM 1372 C LYS A 122 -6.542 8.801 6.021 1.00 0.00 C ATOM 1373 O LYS A 122 -5.419 9.152 5.660 1.00 0.00 O ATOM 1374 CB LYS A 122 -8.521 8.885 4.494 1.00 0.00 C ATOM 1375 CG LYS A 122 -9.485 8.149 3.580 1.00 0.00 C ATOM 1376 CD LYS A 122 -10.617 9.052 3.119 1.00 0.00 C ATOM 1377 CE LYS A 122 -11.197 8.586 1.792 1.00 0.00 C ATOM 1378 NZ LYS A 122 -12.467 9.291 1.464 1.00 0.00 N ATOM 0 H LYS A 122 -9.072 6.898 5.841 1.00 0.00 H new ATOM 0 HA LYS A 122 -6.830 7.573 4.295 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -9.085 9.354 5.301 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -8.042 9.687 3.932 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -8.946 7.768 2.712 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -9.897 7.286 4.103 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -11.402 9.068 3.875 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.251 10.074 3.018 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -10.471 8.758 0.998 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -11.378 7.512 1.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -12.813 8.970 0.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -13.179 9.079 2.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -12.297 10.317 1.434 1.00 0.00 H new ATOM 1392 N LYS A 123 -7.042 9.099 7.215 1.00 0.00 N ATOM 1393 CA LYS A 123 -6.284 9.872 8.192 1.00 0.00 C ATOM 1394 C LYS A 123 -4.956 9.192 8.511 1.00 0.00 C ATOM 1395 O LYS A 123 -3.919 9.849 8.603 1.00 0.00 O ATOM 1396 CB LYS A 123 -7.099 10.050 9.475 1.00 0.00 C ATOM 1397 CG LYS A 123 -8.355 10.882 9.287 1.00 0.00 C ATOM 1398 CD LYS A 123 -9.309 10.725 10.460 1.00 0.00 C ATOM 1399 CE LYS A 123 -8.875 11.570 11.648 1.00 0.00 C ATOM 1400 NZ LYS A 123 -9.077 13.024 11.398 1.00 0.00 N ATOM 0 H LYS A 123 -7.970 8.817 7.530 1.00 0.00 H new ATOM 0 HA LYS A 123 -6.077 10.852 7.762 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -7.378 9.068 9.858 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -6.471 10.521 10.232 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -8.084 11.932 9.175 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -8.856 10.583 8.367 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -10.314 11.015 10.154 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -9.355 9.677 10.755 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -9.440 11.272 12.531 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -7.823 11.381 11.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -9.049 13.539 12.301 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -8.323 13.377 10.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -10.000 13.173 10.943 1.00 0.00 H new ATOM 1414 N ASP A 124 -4.996 7.875 8.677 1.00 0.00 N ATOM 1415 CA ASP A 124 -3.795 7.106 8.983 1.00 0.00 C ATOM 1416 C ASP A 124 -2.869 7.040 7.772 1.00 0.00 C ATOM 1417 O ASP A 124 -1.700 7.417 7.851 1.00 0.00 O ATOM 1418 CB ASP A 124 -4.169 5.693 9.432 1.00 0.00 C ATOM 1419 CG ASP A 124 -2.989 4.741 9.392 1.00 0.00 C ATOM 1420 OD1 ASP A 124 -2.520 4.426 8.279 1.00 0.00 O ATOM 1421 OD2 ASP A 124 -2.536 4.311 10.474 1.00 0.00 O ATOM 0 H ASP A 124 -5.847 7.317 8.605 1.00 0.00 H new ATOM 0 HA ASP A 124 -3.268 7.609 9.794 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.567 5.731 10.446 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -4.963 5.310 8.791 1.00 0.00 H new ATOM 1426 N PHE A 125 -3.400 6.558 6.653 1.00 0.00 N ATOM 1427 CA PHE A 125 -2.621 6.440 5.426 1.00 0.00 C ATOM 1428 C PHE A 125 -1.943 7.763 5.084 1.00 0.00 C ATOM 1429 O PHE A 125 -0.752 7.800 4.774 1.00 0.00 O ATOM 1430 CB PHE A 125 -3.518 5.999 4.268 1.00 0.00 C ATOM 1431 CG PHE A 125 -2.866 6.132 2.921 1.00 0.00 C ATOM 1432 CD1 PHE A 125 -2.595 7.382 2.389 1.00 0.00 C ATOM 1433 CD2 PHE A 125 -2.525 5.007 2.188 1.00 0.00 C ATOM 1434 CE1 PHE A 125 -1.997 7.507 1.149 1.00 0.00 C ATOM 1435 CE2 PHE A 125 -1.926 5.126 0.948 1.00 0.00 C ATOM 1436 CZ PHE A 125 -1.660 6.378 0.428 1.00 0.00 C ATOM 0 H PHE A 125 -4.367 6.243 6.571 1.00 0.00 H new ATOM 0 HA PHE A 125 -1.849 5.687 5.585 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.810 4.960 4.420 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -4.432 6.592 4.281 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -2.854 8.268 2.949 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -2.730 4.026 2.590 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -1.793 8.487 0.744 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -1.666 4.241 0.386 1.00 0.00 H new ATOM 0 HZ PHE A 125 -1.190 6.474 -0.540 1.00 0.00 H new ATOM 1446 N GLU A 126 -2.710 8.847 5.141 1.00 0.00 N ATOM 1447 CA GLU A 126 -2.184 10.172 4.836 1.00 0.00 C ATOM 1448 C GLU A 126 -1.224 10.641 5.925 1.00 0.00 C ATOM 1449 O GLU A 126 -0.061 10.944 5.656 1.00 0.00 O ATOM 1450 CB GLU A 126 -3.328 11.177 4.682 1.00 0.00 C ATOM 1451 CG GLU A 126 -4.045 11.083 3.346 1.00 0.00 C ATOM 1452 CD GLU A 126 -5.439 11.678 3.389 1.00 0.00 C ATOM 1453 OE1 GLU A 126 -6.077 11.615 4.461 1.00 0.00 O ATOM 1454 OE2 GLU A 126 -5.892 12.206 2.352 1.00 0.00 O ATOM 0 H GLU A 126 -3.698 8.834 5.396 1.00 0.00 H new ATOM 0 HA GLU A 126 -1.636 10.109 3.896 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -4.049 11.019 5.484 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -2.933 12.186 4.803 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -3.458 11.598 2.586 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -4.109 10.037 3.045 1.00 0.00 H new ATOM 1461 N LYS A 127 -1.718 10.698 7.157 1.00 0.00 N ATOM 1462 CA LYS A 127 -0.907 11.129 8.289 1.00 0.00 C ATOM 1463 C LYS A 127 0.506 10.560 8.193 1.00 0.00 C ATOM 1464 O LYS A 127 1.488 11.300 8.241 1.00 0.00 O ATOM 1465 CB LYS A 127 -1.556 10.692 9.604 1.00 0.00 C ATOM 1466 CG LYS A 127 -0.738 11.048 10.834 1.00 0.00 C ATOM 1467 CD LYS A 127 0.227 9.935 11.204 1.00 0.00 C ATOM 1468 CE LYS A 127 -0.431 8.905 12.110 1.00 0.00 C ATOM 1469 NZ LYS A 127 -0.323 9.282 13.547 1.00 0.00 N ATOM 0 H LYS A 127 -2.678 10.451 7.397 1.00 0.00 H new ATOM 0 HA LYS A 127 -0.845 12.217 8.266 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -2.539 11.155 9.686 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -1.712 9.613 9.582 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -0.181 11.966 10.648 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -1.407 11.244 11.672 1.00 0.00 H new ATOM 0 HD2 LYS A 127 0.586 9.447 10.298 1.00 0.00 H new ATOM 0 HD3 LYS A 127 1.098 10.358 11.705 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -1.482 8.802 11.839 1.00 0.00 H new ATOM 0 HE3 LYS A 127 0.036 7.932 11.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -0.783 8.556 14.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 0.680 9.356 13.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -0.790 10.198 13.702 1.00 0.00 H new ATOM 1483 N LYS A 128 0.600 9.242 8.057 1.00 0.00 N ATOM 1484 CA LYS A 128 1.891 8.574 7.952 1.00 0.00 C ATOM 1485 C LYS A 128 2.744 9.208 6.858 1.00 0.00 C ATOM 1486 O LYS A 128 3.892 9.586 7.093 1.00 0.00 O ATOM 1487 CB LYS A 128 1.695 7.084 7.661 1.00 0.00 C ATOM 1488 CG LYS A 128 2.997 6.321 7.493 1.00 0.00 C ATOM 1489 CD LYS A 128 3.763 6.228 8.802 1.00 0.00 C ATOM 1490 CE LYS A 128 3.124 5.225 9.751 1.00 0.00 C ATOM 1491 NZ LYS A 128 4.083 4.754 10.789 1.00 0.00 N ATOM 0 H LYS A 128 -0.203 8.615 8.017 1.00 0.00 H new ATOM 0 HA LYS A 128 2.409 8.687 8.904 1.00 0.00 H new ATOM 0 HB2 LYS A 128 1.123 6.636 8.474 1.00 0.00 H new ATOM 0 HB3 LYS A 128 1.100 6.975 6.754 1.00 0.00 H new ATOM 0 HG2 LYS A 128 2.786 5.318 7.122 1.00 0.00 H new ATOM 0 HG3 LYS A 128 3.615 6.815 6.743 1.00 0.00 H new ATOM 0 HD2 LYS A 128 4.794 5.936 8.602 1.00 0.00 H new ATOM 0 HD3 LYS A 128 3.796 7.209 9.276 1.00 0.00 H new ATOM 0 HE2 LYS A 128 2.261 5.682 10.235 1.00 0.00 H new ATOM 0 HE3 LYS A 128 2.756 4.371 9.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 3.609 4.072 11.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 4.895 4.295 10.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 4.415 5.565 11.348 1.00 0.00 H new ATOM 1505 N PHE A 129 2.176 9.321 5.662 1.00 0.00 N ATOM 1506 CA PHE A 129 2.885 9.910 4.532 1.00 0.00 C ATOM 1507 C PHE A 129 3.304 11.345 4.840 1.00 0.00 C ATOM 1508 O PHE A 129 4.490 11.675 4.817 1.00 0.00 O ATOM 1509 CB PHE A 129 2.005 9.882 3.280 1.00 0.00 C ATOM 1510 CG PHE A 129 2.401 10.898 2.247 1.00 0.00 C ATOM 1511 CD1 PHE A 129 1.920 12.195 2.312 1.00 0.00 C ATOM 1512 CD2 PHE A 129 3.253 10.555 1.209 1.00 0.00 C ATOM 1513 CE1 PHE A 129 2.281 13.133 1.363 1.00 0.00 C ATOM 1514 CE2 PHE A 129 3.619 11.488 0.258 1.00 0.00 C ATOM 1515 CZ PHE A 129 3.131 12.778 0.334 1.00 0.00 C ATOM 0 H PHE A 129 1.227 9.013 5.450 1.00 0.00 H new ATOM 0 HA PHE A 129 3.783 9.319 4.351 1.00 0.00 H new ATOM 0 HB2 PHE A 129 2.050 8.888 2.836 1.00 0.00 H new ATOM 0 HB3 PHE A 129 0.969 10.055 3.570 1.00 0.00 H new ATOM 0 HD1 PHE A 129 1.254 12.477 3.114 1.00 0.00 H new ATOM 0 HD2 PHE A 129 3.635 9.547 1.143 1.00 0.00 H new ATOM 0 HE1 PHE A 129 1.899 14.141 1.426 1.00 0.00 H new ATOM 0 HE2 PHE A 129 4.286 11.209 -0.544 1.00 0.00 H new ATOM 0 HZ PHE A 129 3.414 13.508 -0.410 1.00 0.00 H new ATOM 1525 N ARG A 130 2.322 12.193 5.129 1.00 0.00 N ATOM 1526 CA ARG A 130 2.587 13.592 5.440 1.00 0.00 C ATOM 1527 C ARG A 130 3.655 13.715 6.524 1.00 0.00 C ATOM 1528 O ARG A 130 4.430 14.670 6.538 1.00 0.00 O ATOM 1529 CB ARG A 130 1.303 14.288 5.894 1.00 0.00 C ATOM 1530 CG ARG A 130 1.546 15.589 6.640 1.00 0.00 C ATOM 1531 CD ARG A 130 0.295 16.452 6.679 1.00 0.00 C ATOM 1532 NE ARG A 130 -0.776 15.829 7.452 1.00 0.00 N ATOM 1533 CZ ARG A 130 -0.870 15.910 8.774 1.00 0.00 C ATOM 1534 NH1 ARG A 130 0.037 16.583 9.467 1.00 0.00 N ATOM 1535 NH2 ARG A 130 -1.874 15.316 9.407 1.00 0.00 N ATOM 0 H ARG A 130 1.335 11.935 5.154 1.00 0.00 H new ATOM 0 HA ARG A 130 2.954 14.076 4.535 1.00 0.00 H new ATOM 0 HB2 ARG A 130 0.682 14.490 5.022 1.00 0.00 H new ATOM 0 HB3 ARG A 130 0.740 13.611 6.536 1.00 0.00 H new ATOM 0 HG2 ARG A 130 1.870 15.371 7.657 1.00 0.00 H new ATOM 0 HG3 ARG A 130 2.354 16.140 6.159 1.00 0.00 H new ATOM 0 HD2 ARG A 130 0.537 17.422 7.112 1.00 0.00 H new ATOM 0 HD3 ARG A 130 -0.051 16.635 5.662 1.00 0.00 H new ATOM 0 HE ARG A 130 -1.491 15.303 6.949 1.00 0.00 H new ATOM 0 HH11 ARG A 130 0.811 17.041 8.985 1.00 0.00 H new ATOM 0 HH12 ARG A 130 -0.038 16.643 10.482 1.00 0.00 H new ATOM 0 HH21 ARG A 130 -2.574 14.797 8.878 1.00 0.00 H new ATOM 0 HH22 ARG A 130 -1.945 15.379 10.423 1.00 0.00 H new ATOM 1549 N GLU A 131 3.687 12.741 7.428 1.00 0.00 N ATOM 1550 CA GLU A 131 4.659 12.742 8.516 1.00 0.00 C ATOM 1551 C GLU A 131 6.031 12.293 8.020 1.00 0.00 C ATOM 1552 O GLU A 131 7.062 12.713 8.546 1.00 0.00 O ATOM 1553 CB GLU A 131 4.190 11.827 9.649 1.00 0.00 C ATOM 1554 CG GLU A 131 3.245 12.506 10.627 1.00 0.00 C ATOM 1555 CD GLU A 131 3.756 13.856 11.090 1.00 0.00 C ATOM 1556 OE1 GLU A 131 4.987 14.002 11.247 1.00 0.00 O ATOM 1557 OE2 GLU A 131 2.926 14.766 11.296 1.00 0.00 O ATOM 0 H GLU A 131 3.052 11.942 7.429 1.00 0.00 H new ATOM 0 HA GLU A 131 4.743 13.761 8.893 1.00 0.00 H new ATOM 0 HB2 GLU A 131 3.692 10.957 9.220 1.00 0.00 H new ATOM 0 HB3 GLU A 131 5.061 11.460 10.193 1.00 0.00 H new ATOM 0 HG2 GLU A 131 2.270 12.633 10.156 1.00 0.00 H new ATOM 0 HG3 GLU A 131 3.099 11.860 11.493 1.00 0.00 H new ATOM 1564 N LYS A 132 6.035 11.437 7.004 1.00 0.00 N ATOM 1565 CA LYS A 132 7.278 10.930 6.435 1.00 0.00 C ATOM 1566 C LYS A 132 7.808 11.872 5.359 1.00 0.00 C ATOM 1567 O LYS A 132 8.997 11.860 5.039 1.00 0.00 O ATOM 1568 CB LYS A 132 7.062 9.535 5.845 1.00 0.00 C ATOM 1569 CG LYS A 132 7.000 8.435 6.890 1.00 0.00 C ATOM 1570 CD LYS A 132 8.382 7.888 7.207 1.00 0.00 C ATOM 1571 CE LYS A 132 8.317 6.773 8.240 1.00 0.00 C ATOM 1572 NZ LYS A 132 9.672 6.370 8.706 1.00 0.00 N ATOM 0 H LYS A 132 5.191 11.080 6.557 1.00 0.00 H new ATOM 0 HA LYS A 132 8.016 10.869 7.235 1.00 0.00 H new ATOM 0 HB2 LYS A 132 6.135 9.532 5.271 1.00 0.00 H new ATOM 0 HB3 LYS A 132 7.870 9.316 5.147 1.00 0.00 H new ATOM 0 HG2 LYS A 132 6.543 8.823 7.801 1.00 0.00 H new ATOM 0 HG3 LYS A 132 6.361 7.627 6.532 1.00 0.00 H new ATOM 0 HD2 LYS A 132 8.844 7.513 6.294 1.00 0.00 H new ATOM 0 HD3 LYS A 132 9.017 8.693 7.578 1.00 0.00 H new ATOM 0 HE2 LYS A 132 7.723 7.102 9.092 1.00 0.00 H new ATOM 0 HE3 LYS A 132 7.809 5.909 7.811 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 9.633 5.407 9.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 10.335 6.392 7.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 9.996 7.029 9.442 1.00 0.00 H new ATOM 1586 N THR A 133 6.918 12.690 4.804 1.00 0.00 N ATOM 1587 CA THR A 133 7.296 13.639 3.765 1.00 0.00 C ATOM 1588 C THR A 133 7.086 15.075 4.229 1.00 0.00 C ATOM 1589 O THR A 133 7.386 16.024 3.503 1.00 0.00 O ATOM 1590 CB THR A 133 6.492 13.406 2.472 1.00 0.00 C ATOM 1591 OG1 THR A 133 5.121 13.765 2.676 1.00 0.00 O ATOM 1592 CG2 THR A 133 6.581 11.951 2.034 1.00 0.00 C ATOM 0 H THR A 133 5.930 12.714 5.057 1.00 0.00 H new ATOM 0 HA THR A 133 8.354 13.478 3.560 1.00 0.00 H new ATOM 0 HB THR A 133 6.918 14.032 1.688 1.00 0.00 H new ATOM 0 HG1 THR A 133 4.574 13.393 1.953 1.00 0.00 H new ATOM 0 HG21 THR A 133 6.006 11.811 1.119 1.00 0.00 H new ATOM 0 HG22 THR A 133 7.623 11.689 1.851 1.00 0.00 H new ATOM 0 HG23 THR A 133 6.178 11.310 2.818 1.00 0.00 H new ATOM 1600 N LYS A 134 6.567 15.230 5.442 1.00 0.00 N ATOM 1601 CA LYS A 134 6.318 16.552 6.006 1.00 0.00 C ATOM 1602 C LYS A 134 5.567 17.433 5.013 1.00 0.00 C ATOM 1603 O LYS A 134 5.857 18.622 4.881 1.00 0.00 O ATOM 1604 CB LYS A 134 7.638 17.219 6.399 1.00 0.00 C ATOM 1605 CG LYS A 134 8.315 16.569 7.593 1.00 0.00 C ATOM 1606 CD LYS A 134 9.682 17.177 7.858 1.00 0.00 C ATOM 1607 CE LYS A 134 9.576 18.447 8.688 1.00 0.00 C ATOM 1608 NZ LYS A 134 10.806 19.280 8.588 1.00 0.00 N ATOM 0 H LYS A 134 6.310 14.456 6.054 1.00 0.00 H new ATOM 0 HA LYS A 134 5.701 16.430 6.896 1.00 0.00 H new ATOM 0 HB2 LYS A 134 8.317 17.191 5.547 1.00 0.00 H new ATOM 0 HB3 LYS A 134 7.452 18.269 6.624 1.00 0.00 H new ATOM 0 HG2 LYS A 134 7.687 16.685 8.476 1.00 0.00 H new ATOM 0 HG3 LYS A 134 8.420 15.499 7.415 1.00 0.00 H new ATOM 0 HD2 LYS A 134 10.309 16.453 8.378 1.00 0.00 H new ATOM 0 HD3 LYS A 134 10.172 17.400 6.910 1.00 0.00 H new ATOM 0 HE2 LYS A 134 8.716 19.028 8.355 1.00 0.00 H new ATOM 0 HE3 LYS A 134 9.399 18.185 9.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 10.681 20.152 9.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 11.617 18.747 8.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 10.980 19.523 7.592 1.00 0.00 H new ATOM 1622 N ASN A 135 4.601 16.843 4.317 1.00 0.00 N ATOM 1623 CA ASN A 135 3.808 17.575 3.337 1.00 0.00 C ATOM 1624 C ASN A 135 2.419 16.960 3.191 1.00 0.00 C ATOM 1625 O ASN A 135 2.255 15.745 3.286 1.00 0.00 O ATOM 1626 CB ASN A 135 4.518 17.587 1.981 1.00 0.00 C ATOM 1627 CG ASN A 135 5.508 18.728 1.857 1.00 0.00 C ATOM 1628 OD1 ASN A 135 5.184 19.791 1.327 1.00 0.00 O ATOM 1629 ND2 ASN A 135 6.724 18.513 2.347 1.00 0.00 N ATOM 0 H ASN A 135 4.349 15.859 4.414 1.00 0.00 H new ATOM 0 HA ASN A 135 3.696 18.600 3.690 1.00 0.00 H new ATOM 0 HB2 ASN A 135 5.039 16.640 1.838 1.00 0.00 H new ATOM 0 HB3 ASN A 135 3.776 17.665 1.186 1.00 0.00 H new ATOM 0 HD21 ASN A 135 7.433 19.245 2.292 1.00 0.00 H new ATOM 0 HD22 ASN A 135 6.949 17.616 2.778 1.00 0.00 H new ATOM 1636 N ASN A 136 1.423 17.809 2.959 1.00 0.00 N ATOM 1637 CA ASN A 136 0.048 17.349 2.799 1.00 0.00 C ATOM 1638 C ASN A 136 -0.122 16.587 1.489 1.00 0.00 C ATOM 1639 O ASN A 136 0.429 16.974 0.458 1.00 0.00 O ATOM 1640 CB ASN A 136 -0.917 18.535 2.841 1.00 0.00 C ATOM 1641 CG ASN A 136 -0.998 19.166 4.218 1.00 0.00 C ATOM 1642 OD1 ASN A 136 0.007 19.288 4.918 1.00 0.00 O ATOM 1643 ND2 ASN A 136 -2.200 19.569 4.614 1.00 0.00 N ATOM 0 H ASN A 136 1.542 18.819 2.878 1.00 0.00 H new ATOM 0 HA ASN A 136 -0.181 16.674 3.624 1.00 0.00 H new ATOM 0 HB2 ASN A 136 -0.597 19.286 2.118 1.00 0.00 H new ATOM 0 HB3 ASN A 136 -1.910 18.203 2.537 1.00 0.00 H new ATOM 0 HD21 ASN A 136 -2.317 19.999 5.531 1.00 0.00 H new ATOM 0 HD22 ASN A 136 -3.006 19.448 4.001 1.00 0.00 H new ATOM 1650 N TRP A 137 -0.888 15.503 1.536 1.00 0.00 N ATOM 1651 CA TRP A 137 -1.131 14.687 0.352 1.00 0.00 C ATOM 1652 C TRP A 137 -1.874 15.483 -0.715 1.00 0.00 C ATOM 1653 O TRP A 137 -1.620 15.326 -1.909 1.00 0.00 O ATOM 1654 CB TRP A 137 -1.933 13.438 0.724 1.00 0.00 C ATOM 1655 CG TRP A 137 -2.265 12.573 -0.453 1.00 0.00 C ATOM 1656 CD1 TRP A 137 -3.482 12.444 -1.059 1.00 0.00 C ATOM 1657 CD2 TRP A 137 -1.367 11.714 -1.166 1.00 0.00 C ATOM 1658 NE1 TRP A 137 -3.396 11.557 -2.105 1.00 0.00 N ATOM 1659 CE2 TRP A 137 -2.109 11.097 -2.192 1.00 0.00 C ATOM 1660 CE3 TRP A 137 -0.010 11.410 -1.039 1.00 0.00 C ATOM 1661 CZ2 TRP A 137 -1.537 10.192 -3.083 1.00 0.00 C ATOM 1662 CZ3 TRP A 137 0.557 10.511 -1.924 1.00 0.00 C ATOM 1663 CH2 TRP A 137 -0.205 9.912 -2.935 1.00 0.00 C ATOM 0 H TRP A 137 -1.351 15.169 2.381 1.00 0.00 H new ATOM 0 HA TRP A 137 -0.166 14.384 -0.054 1.00 0.00 H new ATOM 0 HB2 TRP A 137 -1.365 12.853 1.447 1.00 0.00 H new ATOM 0 HB3 TRP A 137 -2.858 13.742 1.215 1.00 0.00 H new ATOM 0 HD1 TRP A 137 -4.381 12.963 -0.760 1.00 0.00 H new ATOM 0 HE1 TRP A 137 -4.165 11.285 -2.717 1.00 0.00 H new ATOM 0 HE3 TRP A 137 0.586 11.869 -0.264 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 -2.123 9.728 -3.862 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 1.605 10.267 -1.834 1.00 0.00 H new ATOM 0 HH2 TRP A 137 0.268 9.215 -3.611 1.00 0.00 H new ATOM 1674 N ALA A 138 -2.792 16.338 -0.277 1.00 0.00 N ATOM 1675 CA ALA A 138 -3.570 17.161 -1.195 1.00 0.00 C ATOM 1676 C ALA A 138 -2.701 18.236 -1.839 1.00 0.00 C ATOM 1677 O ALA A 138 -2.835 18.525 -3.027 1.00 0.00 O ATOM 1678 CB ALA A 138 -4.747 17.795 -0.469 1.00 0.00 C ATOM 0 H ALA A 138 -3.015 16.479 0.708 1.00 0.00 H new ATOM 0 HA ALA A 138 -3.952 16.517 -1.987 1.00 0.00 H new ATOM 0 HB1 ALA A 138 -5.319 18.407 -1.167 1.00 0.00 H new ATOM 0 HB2 ALA A 138 -5.388 17.013 -0.063 1.00 0.00 H new ATOM 0 HB3 ALA A 138 -4.379 18.421 0.344 1.00 0.00 H new ATOM 1684 N GLU A 139 -1.812 18.825 -1.046 1.00 0.00 N ATOM 1685 CA GLU A 139 -0.923 19.870 -1.540 1.00 0.00 C ATOM 1686 C GLU A 139 0.389 19.275 -2.043 1.00 0.00 C ATOM 1687 O GLU A 139 1.458 19.857 -1.859 1.00 0.00 O ATOM 1688 CB GLU A 139 -0.641 20.894 -0.438 1.00 0.00 C ATOM 1689 CG GLU A 139 -1.898 21.466 0.196 1.00 0.00 C ATOM 1690 CD GLU A 139 -1.685 22.859 0.758 1.00 0.00 C ATOM 1691 OE1 GLU A 139 -1.026 22.980 1.811 1.00 0.00 O ATOM 1692 OE2 GLU A 139 -2.178 23.827 0.142 1.00 0.00 O ATOM 0 H GLU A 139 -1.688 18.597 -0.060 1.00 0.00 H new ATOM 0 HA GLU A 139 -1.419 20.369 -2.372 1.00 0.00 H new ATOM 0 HB2 GLU A 139 -0.035 20.424 0.337 1.00 0.00 H new ATOM 0 HB3 GLU A 139 -0.050 21.710 -0.854 1.00 0.00 H new ATOM 0 HG2 GLU A 139 -2.694 21.496 -0.548 1.00 0.00 H new ATOM 0 HG3 GLU A 139 -2.232 20.803 0.994 1.00 0.00 H new ATOM 1699 N ARG A 140 0.299 18.111 -2.679 1.00 0.00 N ATOM 1700 CA ARG A 140 1.478 17.436 -3.208 1.00 0.00 C ATOM 1701 C ARG A 140 2.169 18.295 -4.263 1.00 0.00 C ATOM 1702 O ARG A 140 3.345 18.094 -4.567 1.00 0.00 O ATOM 1703 CB ARG A 140 1.090 16.084 -3.809 1.00 0.00 C ATOM 1704 CG ARG A 140 0.112 16.190 -4.967 1.00 0.00 C ATOM 1705 CD ARG A 140 -0.627 14.881 -5.195 1.00 0.00 C ATOM 1706 NE ARG A 140 0.278 13.801 -5.580 1.00 0.00 N ATOM 1707 CZ ARG A 140 0.799 13.678 -6.795 1.00 0.00 C ATOM 1708 NH1 ARG A 140 0.507 14.563 -7.739 1.00 0.00 N ATOM 1709 NH2 ARG A 140 1.615 12.668 -7.069 1.00 0.00 N ATOM 0 H ARG A 140 -0.578 17.616 -2.840 1.00 0.00 H new ATOM 0 HA ARG A 140 2.174 17.274 -2.385 1.00 0.00 H new ATOM 0 HB2 ARG A 140 1.992 15.576 -4.151 1.00 0.00 H new ATOM 0 HB3 ARG A 140 0.650 15.462 -3.029 1.00 0.00 H new ATOM 0 HG2 ARG A 140 -0.607 16.984 -4.766 1.00 0.00 H new ATOM 0 HG3 ARG A 140 0.649 16.468 -5.874 1.00 0.00 H new ATOM 0 HD2 ARG A 140 -1.158 14.602 -4.285 1.00 0.00 H new ATOM 0 HD3 ARG A 140 -1.378 15.019 -5.973 1.00 0.00 H new ATOM 0 HE ARG A 140 0.523 13.103 -4.877 1.00 0.00 H new ATOM 0 HH11 ARG A 140 -0.120 15.341 -7.532 1.00 0.00 H new ATOM 0 HH12 ARG A 140 0.909 14.466 -8.671 1.00 0.00 H new ATOM 0 HH21 ARG A 140 1.842 11.985 -6.346 1.00 0.00 H new ATOM 0 HH22 ARG A 140 2.015 12.574 -8.003 1.00 0.00 H new ATOM 1723 N ASP A 141 1.431 19.250 -4.817 1.00 0.00 N ATOM 1724 CA ASP A 141 1.973 20.140 -5.837 1.00 0.00 C ATOM 1725 C ASP A 141 3.250 20.815 -5.346 1.00 0.00 C ATOM 1726 O ASP A 141 4.243 20.890 -6.071 1.00 0.00 O ATOM 1727 CB ASP A 141 0.938 21.198 -6.223 1.00 0.00 C ATOM 1728 CG ASP A 141 1.380 22.034 -7.408 1.00 0.00 C ATOM 1729 OD1 ASP A 141 1.815 21.447 -8.420 1.00 0.00 O ATOM 1730 OD2 ASP A 141 1.288 23.277 -7.323 1.00 0.00 O ATOM 0 H ASP A 141 0.456 19.428 -4.577 1.00 0.00 H new ATOM 0 HA ASP A 141 2.214 19.542 -6.715 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -0.007 20.709 -6.459 1.00 0.00 H new ATOM 0 HB3 ASP A 141 0.754 21.851 -5.370 1.00 0.00 H new ATOM 1735 N HIS A 142 3.217 21.307 -4.112 1.00 0.00 N ATOM 1736 CA HIS A 142 4.371 21.977 -3.525 1.00 0.00 C ATOM 1737 C HIS A 142 5.141 21.030 -2.609 1.00 0.00 C ATOM 1738 O HIS A 142 5.605 21.425 -1.539 1.00 0.00 O ATOM 1739 CB HIS A 142 3.927 23.213 -2.742 1.00 0.00 C ATOM 1740 CG HIS A 142 3.076 22.894 -1.552 1.00 0.00 C ATOM 1741 ND1 HIS A 142 2.290 23.832 -0.915 1.00 0.00 N ATOM 1742 CD2 HIS A 142 2.888 21.732 -0.883 1.00 0.00 C ATOM 1743 CE1 HIS A 142 1.658 23.261 0.095 1.00 0.00 C ATOM 1744 NE2 HIS A 142 2.003 21.987 0.136 1.00 0.00 N ATOM 0 H HIS A 142 2.403 21.254 -3.499 1.00 0.00 H new ATOM 0 HA HIS A 142 5.030 22.287 -4.335 1.00 0.00 H new ATOM 0 HB2 HIS A 142 4.810 23.760 -2.411 1.00 0.00 H new ATOM 0 HB3 HIS A 142 3.373 23.875 -3.408 1.00 0.00 H new ATOM 0 HD1 HIS A 142 2.209 24.813 -1.182 1.00 0.00 H new ATOM 0 HD2 HIS A 142 3.348 20.781 -1.109 1.00 0.00 H new ATOM 0 HE1 HIS A 142 0.975 23.753 0.772 1.00 0.00 H new ATOM 1752 N PHE A 143 5.273 19.779 -3.036 1.00 0.00 N ATOM 1753 CA PHE A 143 5.985 18.775 -2.253 1.00 0.00 C ATOM 1754 C PHE A 143 7.403 19.239 -1.935 1.00 0.00 C ATOM 1755 O PHE A 143 8.258 19.311 -2.818 1.00 0.00 O ATOM 1756 CB PHE A 143 6.028 17.445 -3.009 1.00 0.00 C ATOM 1757 CG PHE A 143 6.694 16.340 -2.240 1.00 0.00 C ATOM 1758 CD1 PHE A 143 8.063 16.144 -2.328 1.00 0.00 C ATOM 1759 CD2 PHE A 143 5.952 15.498 -1.429 1.00 0.00 C ATOM 1760 CE1 PHE A 143 8.679 15.128 -1.622 1.00 0.00 C ATOM 1761 CE2 PHE A 143 6.562 14.481 -0.719 1.00 0.00 C ATOM 1762 CZ PHE A 143 7.927 14.295 -0.817 1.00 0.00 C ATOM 0 H PHE A 143 4.897 19.436 -3.920 1.00 0.00 H new ATOM 0 HA PHE A 143 5.449 18.634 -1.314 1.00 0.00 H new ATOM 0 HB2 PHE A 143 5.010 17.143 -3.255 1.00 0.00 H new ATOM 0 HB3 PHE A 143 6.555 17.589 -3.952 1.00 0.00 H new ATOM 0 HD1 PHE A 143 8.656 16.793 -2.956 1.00 0.00 H new ATOM 0 HD2 PHE A 143 4.884 15.638 -1.350 1.00 0.00 H new ATOM 0 HE1 PHE A 143 9.747 14.986 -1.700 1.00 0.00 H new ATOM 0 HE2 PHE A 143 5.972 13.833 -0.088 1.00 0.00 H new ATOM 0 HZ PHE A 143 8.406 13.500 -0.265 1.00 0.00 H new ATOM 1772 N VAL A 144 7.646 19.554 -0.667 1.00 0.00 N ATOM 1773 CA VAL A 144 8.960 20.011 -0.230 1.00 0.00 C ATOM 1774 C VAL A 144 9.765 18.868 0.377 1.00 0.00 C ATOM 1775 O VAL A 144 9.515 18.452 1.509 1.00 0.00 O ATOM 1776 CB VAL A 144 8.845 21.148 0.801 1.00 0.00 C ATOM 1777 CG1 VAL A 144 10.208 21.473 1.393 1.00 0.00 C ATOM 1778 CG2 VAL A 144 8.223 22.383 0.165 1.00 0.00 C ATOM 0 H VAL A 144 6.950 19.501 0.076 1.00 0.00 H new ATOM 0 HA VAL A 144 9.475 20.385 -1.115 1.00 0.00 H new ATOM 0 HB VAL A 144 8.194 20.816 1.610 1.00 0.00 H new ATOM 0 HG11 VAL A 144 10.106 22.279 2.120 1.00 0.00 H new ATOM 0 HG12 VAL A 144 10.611 20.588 1.886 1.00 0.00 H new ATOM 0 HG13 VAL A 144 10.885 21.785 0.598 1.00 0.00 H new ATOM 0 HG21 VAL A 144 8.149 23.177 0.908 1.00 0.00 H new ATOM 0 HG22 VAL A 144 8.846 22.719 -0.664 1.00 0.00 H new ATOM 0 HG23 VAL A 144 7.227 22.139 -0.205 1.00 0.00 H new ATOM 1788 N SER A 145 10.734 18.364 -0.381 1.00 0.00 N ATOM 1789 CA SER A 145 11.574 17.266 0.081 1.00 0.00 C ATOM 1790 C SER A 145 12.605 17.760 1.092 1.00 0.00 C ATOM 1791 O SER A 145 13.638 18.318 0.721 1.00 0.00 O ATOM 1792 CB SER A 145 12.282 16.604 -1.103 1.00 0.00 C ATOM 1793 OG SER A 145 13.129 17.523 -1.770 1.00 0.00 O ATOM 0 H SER A 145 10.956 18.699 -1.318 1.00 0.00 H new ATOM 0 HA SER A 145 10.933 16.532 0.569 1.00 0.00 H new ATOM 0 HB2 SER A 145 12.867 15.754 -0.752 1.00 0.00 H new ATOM 0 HB3 SER A 145 11.542 16.214 -1.802 1.00 0.00 H new ATOM 0 HG SER A 145 13.599 18.073 -1.109 1.00 0.00 H new ATOM 1799 N HIS A 146 12.316 17.549 2.373 1.00 0.00 N ATOM 1800 CA HIS A 146 13.217 17.972 3.439 1.00 0.00 C ATOM 1801 C HIS A 146 14.420 17.039 3.535 1.00 0.00 C ATOM 1802 O HIS A 146 14.325 15.836 3.289 1.00 0.00 O ATOM 1803 CB HIS A 146 12.477 18.008 4.776 1.00 0.00 C ATOM 1804 CG HIS A 146 11.337 18.980 4.804 1.00 0.00 C ATOM 1805 ND1 HIS A 146 11.472 20.286 5.226 1.00 0.00 N ATOM 1806 CD2 HIS A 146 10.038 18.830 4.457 1.00 0.00 C ATOM 1807 CE1 HIS A 146 10.304 20.897 5.139 1.00 0.00 C ATOM 1808 NE2 HIS A 146 9.416 20.035 4.675 1.00 0.00 N ATOM 0 H HIS A 146 11.466 17.088 2.697 1.00 0.00 H new ATOM 0 HA HIS A 146 13.575 18.974 3.203 1.00 0.00 H new ATOM 0 HB2 HIS A 146 12.099 17.010 4.999 1.00 0.00 H new ATOM 0 HB3 HIS A 146 13.183 18.266 5.566 1.00 0.00 H new ATOM 0 HD2 HIS A 146 9.576 17.930 4.079 1.00 0.00 H new ATOM 0 HE1 HIS A 146 10.108 21.926 5.402 1.00 0.00 H new ATOM 0 HE2 HIS A 146 8.430 20.232 4.506 1.00 0.00 H new ATOM 1816 N PRO A 147 15.580 17.604 3.901 1.00 0.00 N ATOM 1817 CA PRO A 147 16.824 16.840 4.038 1.00 0.00 C ATOM 1818 C PRO A 147 16.796 15.895 5.233 1.00 0.00 C ATOM 1819 O PRO A 147 16.637 16.326 6.375 1.00 0.00 O ATOM 1820 CB PRO A 147 17.886 17.925 4.239 1.00 0.00 C ATOM 1821 CG PRO A 147 17.142 19.080 4.816 1.00 0.00 C ATOM 1822 CD PRO A 147 15.767 19.032 4.209 1.00 0.00 C ATOM 0 HA PRO A 147 17.006 16.200 3.175 1.00 0.00 H new ATOM 0 HB2 PRO A 147 18.675 17.587 4.911 1.00 0.00 H new ATOM 0 HB3 PRO A 147 18.363 18.192 3.296 1.00 0.00 H new ATOM 0 HG2 PRO A 147 17.092 19.008 5.902 1.00 0.00 H new ATOM 0 HG3 PRO A 147 17.639 20.021 4.581 1.00 0.00 H new ATOM 0 HD2 PRO A 147 15.009 19.396 4.902 1.00 0.00 H new ATOM 0 HD3 PRO A 147 15.702 19.648 3.312 1.00 0.00 H new ATOM 1830 N GLY A 148 16.951 14.602 4.964 1.00 0.00 N ATOM 1831 CA GLY A 148 16.940 13.615 6.028 1.00 0.00 C ATOM 1832 C GLY A 148 15.685 12.765 6.017 1.00 0.00 C ATOM 1833 O GLY A 148 15.746 11.552 6.222 1.00 0.00 O ATOM 0 H GLY A 148 17.084 14.220 4.027 1.00 0.00 H new ATOM 0 HA2 GLY A 148 17.813 12.970 5.930 1.00 0.00 H new ATOM 0 HA3 GLY A 148 17.024 14.121 6.990 1.00 0.00 H new ATOM 1837 N LYS A 149 14.543 13.400 5.778 1.00 0.00 N ATOM 1838 CA LYS A 149 13.268 12.695 5.742 1.00 0.00 C ATOM 1839 C LYS A 149 13.136 11.875 4.462 1.00 0.00 C ATOM 1840 O LYS A 149 14.056 11.829 3.646 1.00 0.00 O ATOM 1841 CB LYS A 149 12.109 13.689 5.844 1.00 0.00 C ATOM 1842 CG LYS A 149 12.164 14.562 7.086 1.00 0.00 C ATOM 1843 CD LYS A 149 11.881 13.760 8.345 1.00 0.00 C ATOM 1844 CE LYS A 149 10.408 13.398 8.456 1.00 0.00 C ATOM 1845 NZ LYS A 149 10.106 12.096 7.799 1.00 0.00 N ATOM 0 H LYS A 149 14.475 14.403 5.606 1.00 0.00 H new ATOM 0 HA LYS A 149 13.233 12.016 6.594 1.00 0.00 H new ATOM 0 HB2 LYS A 149 12.110 14.328 4.961 1.00 0.00 H new ATOM 0 HB3 LYS A 149 11.168 13.139 5.838 1.00 0.00 H new ATOM 0 HG2 LYS A 149 13.147 15.026 7.162 1.00 0.00 H new ATOM 0 HG3 LYS A 149 11.437 15.369 6.997 1.00 0.00 H new ATOM 0 HD2 LYS A 149 12.481 12.850 8.341 1.00 0.00 H new ATOM 0 HD3 LYS A 149 12.182 14.336 9.220 1.00 0.00 H new ATOM 0 HE2 LYS A 149 10.124 13.349 9.507 1.00 0.00 H new ATOM 0 HE3 LYS A 149 9.806 14.183 8.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 9.390 11.585 8.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 9.744 12.267 6.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 10.974 11.525 7.745 1.00 0.00 H new ATOM 1859 N TYR A 150 11.987 11.230 4.294 1.00 0.00 N ATOM 1860 CA TYR A 150 11.736 10.410 3.115 1.00 0.00 C ATOM 1861 C TYR A 150 11.516 11.283 1.882 1.00 0.00 C ATOM 1862 O TYR A 150 11.482 12.510 1.973 1.00 0.00 O ATOM 1863 CB TYR A 150 10.519 9.512 3.341 1.00 0.00 C ATOM 1864 CG TYR A 150 10.843 8.226 4.069 1.00 0.00 C ATOM 1865 CD1 TYR A 150 11.105 8.224 5.433 1.00 0.00 C ATOM 1866 CD2 TYR A 150 10.888 7.014 3.391 1.00 0.00 C ATOM 1867 CE1 TYR A 150 11.402 7.052 6.102 1.00 0.00 C ATOM 1868 CE2 TYR A 150 11.182 5.837 4.052 1.00 0.00 C ATOM 1869 CZ TYR A 150 11.439 5.861 5.407 1.00 0.00 C ATOM 1870 OH TYR A 150 11.734 4.691 6.068 1.00 0.00 O ATOM 0 H TYR A 150 11.215 11.259 4.960 1.00 0.00 H new ATOM 0 HA TYR A 150 12.613 9.785 2.945 1.00 0.00 H new ATOM 0 HB2 TYR A 150 9.771 10.064 3.911 1.00 0.00 H new ATOM 0 HB3 TYR A 150 10.071 9.271 2.377 1.00 0.00 H new ATOM 0 HD1 TYR A 150 11.076 9.155 5.980 1.00 0.00 H new ATOM 0 HD2 TYR A 150 10.690 6.992 2.330 1.00 0.00 H new ATOM 0 HE1 TYR A 150 11.604 7.068 7.163 1.00 0.00 H new ATOM 0 HE2 TYR A 150 11.210 4.903 3.511 1.00 0.00 H new ATOM 0 HH TYR A 150 11.718 3.944 5.434 1.00 0.00 H new ATOM 1880 N THR A 151 11.365 10.639 0.729 1.00 0.00 N ATOM 1881 CA THR A 151 11.149 11.353 -0.523 1.00 0.00 C ATOM 1882 C THR A 151 9.955 10.784 -1.281 1.00 0.00 C ATOM 1883 O THR A 151 9.494 9.679 -0.994 1.00 0.00 O ATOM 1884 CB THR A 151 12.394 11.292 -1.427 1.00 0.00 C ATOM 1885 OG1 THR A 151 12.924 9.962 -1.442 1.00 0.00 O ATOM 1886 CG2 THR A 151 13.461 12.264 -0.946 1.00 0.00 C ATOM 0 H THR A 151 11.388 9.623 0.636 1.00 0.00 H new ATOM 0 HA THR A 151 10.949 12.393 -0.264 1.00 0.00 H new ATOM 0 HB THR A 151 12.097 11.575 -2.437 1.00 0.00 H new ATOM 0 HG1 THR A 151 13.714 9.931 -2.020 1.00 0.00 H new ATOM 0 HG21 THR A 151 14.331 12.203 -1.600 1.00 0.00 H new ATOM 0 HG22 THR A 151 13.064 13.279 -0.965 1.00 0.00 H new ATOM 0 HG23 THR A 151 13.754 12.008 0.072 1.00 0.00 H new ATOM 1894 N LEU A 152 9.459 11.545 -2.251 1.00 0.00 N ATOM 1895 CA LEU A 152 8.319 11.115 -3.052 1.00 0.00 C ATOM 1896 C LEU A 152 8.766 10.663 -4.439 1.00 0.00 C ATOM 1897 O LEU A 152 9.207 11.474 -5.254 1.00 0.00 O ATOM 1898 CB LEU A 152 7.302 12.251 -3.178 1.00 0.00 C ATOM 1899 CG LEU A 152 6.134 12.005 -4.134 1.00 0.00 C ATOM 1900 CD1 LEU A 152 5.328 10.794 -3.690 1.00 0.00 C ATOM 1901 CD2 LEU A 152 5.246 13.237 -4.220 1.00 0.00 C ATOM 0 H LEU A 152 9.829 12.462 -2.501 1.00 0.00 H new ATOM 0 HA LEU A 152 7.851 10.269 -2.548 1.00 0.00 H new ATOM 0 HB2 LEU A 152 6.897 12.460 -2.188 1.00 0.00 H new ATOM 0 HB3 LEU A 152 7.828 13.148 -3.503 1.00 0.00 H new ATOM 0 HG LEU A 152 6.538 11.804 -5.126 1.00 0.00 H new ATOM 0 HD11 LEU A 152 4.501 10.634 -4.382 1.00 0.00 H new ATOM 0 HD12 LEU A 152 5.970 9.913 -3.682 1.00 0.00 H new ATOM 0 HD13 LEU A 152 4.935 10.966 -2.688 1.00 0.00 H new ATOM 0 HD21 LEU A 152 4.420 13.043 -4.905 1.00 0.00 H new ATOM 0 HD22 LEU A 152 4.850 13.470 -3.231 1.00 0.00 H new ATOM 0 HD23 LEU A 152 5.830 14.082 -4.586 1.00 0.00 H new ATOM 1913 N ILE A 153 8.649 9.365 -4.698 1.00 0.00 N ATOM 1914 CA ILE A 153 9.039 8.806 -5.987 1.00 0.00 C ATOM 1915 C ILE A 153 7.849 8.160 -6.688 1.00 0.00 C ATOM 1916 O ILE A 153 6.772 8.026 -6.107 1.00 0.00 O ATOM 1917 CB ILE A 153 10.159 7.761 -5.831 1.00 0.00 C ATOM 1918 CG1 ILE A 153 9.978 6.977 -4.530 1.00 0.00 C ATOM 1919 CG2 ILE A 153 11.522 8.436 -5.865 1.00 0.00 C ATOM 1920 CD1 ILE A 153 10.514 7.697 -3.312 1.00 0.00 C ATOM 0 H ILE A 153 8.288 8.681 -4.033 1.00 0.00 H new ATOM 0 HA ILE A 153 9.408 9.634 -6.592 1.00 0.00 H new ATOM 0 HB ILE A 153 10.101 7.061 -6.665 1.00 0.00 H new ATOM 0 HG12 ILE A 153 8.918 6.772 -4.383 1.00 0.00 H new ATOM 0 HG13 ILE A 153 10.480 6.014 -4.623 1.00 0.00 H new ATOM 0 HG21 ILE A 153 12.303 7.684 -5.754 1.00 0.00 H new ATOM 0 HG22 ILE A 153 11.649 8.953 -6.816 1.00 0.00 H new ATOM 0 HG23 ILE A 153 11.592 9.156 -5.049 1.00 0.00 H new ATOM 0 HD11 ILE A 153 10.352 7.083 -2.426 1.00 0.00 H new ATOM 0 HD12 ILE A 153 11.581 7.879 -3.437 1.00 0.00 H new ATOM 0 HD13 ILE A 153 9.995 8.648 -3.194 1.00 0.00 H new ATOM 1932 N GLU A 154 8.052 7.760 -7.939 1.00 0.00 N ATOM 1933 CA GLU A 154 6.996 7.126 -8.719 1.00 0.00 C ATOM 1934 C GLU A 154 7.414 5.728 -9.167 1.00 0.00 C ATOM 1935 O GLU A 154 6.818 5.151 -10.077 1.00 0.00 O ATOM 1936 CB GLU A 154 6.649 7.981 -9.939 1.00 0.00 C ATOM 1937 CG GLU A 154 7.842 8.285 -10.829 1.00 0.00 C ATOM 1938 CD GLU A 154 7.497 9.224 -11.968 1.00 0.00 C ATOM 1939 OE1 GLU A 154 6.616 8.872 -12.780 1.00 0.00 O ATOM 1940 OE2 GLU A 154 8.107 10.311 -12.048 1.00 0.00 O ATOM 0 H GLU A 154 8.938 7.864 -8.434 1.00 0.00 H new ATOM 0 HA GLU A 154 6.115 7.037 -8.084 1.00 0.00 H new ATOM 0 HB2 GLU A 154 5.889 7.467 -10.528 1.00 0.00 H new ATOM 0 HB3 GLU A 154 6.210 8.920 -9.601 1.00 0.00 H new ATOM 0 HG2 GLU A 154 8.636 8.727 -10.227 1.00 0.00 H new ATOM 0 HG3 GLU A 154 8.233 7.353 -11.237 1.00 0.00 H new ATOM 1947 N VAL A 155 8.443 5.189 -8.520 1.00 0.00 N ATOM 1948 CA VAL A 155 8.941 3.859 -8.850 1.00 0.00 C ATOM 1949 C VAL A 155 9.184 3.719 -10.349 1.00 0.00 C ATOM 1950 O VAL A 155 8.841 4.608 -11.128 1.00 0.00 O ATOM 1951 CB VAL A 155 7.959 2.763 -8.396 1.00 0.00 C ATOM 1952 CG1 VAL A 155 6.749 2.715 -9.317 1.00 0.00 C ATOM 1953 CG2 VAL A 155 8.655 1.412 -8.346 1.00 0.00 C ATOM 0 H VAL A 155 8.948 5.653 -7.765 1.00 0.00 H new ATOM 0 HA VAL A 155 9.884 3.734 -8.319 1.00 0.00 H new ATOM 0 HB VAL A 155 7.611 3.004 -7.391 1.00 0.00 H new ATOM 0 HG11 VAL A 155 6.066 1.935 -8.981 1.00 0.00 H new ATOM 0 HG12 VAL A 155 6.238 3.678 -9.297 1.00 0.00 H new ATOM 0 HG13 VAL A 155 7.075 2.498 -10.334 1.00 0.00 H new ATOM 0 HG21 VAL A 155 7.946 0.649 -8.023 1.00 0.00 H new ATOM 0 HG22 VAL A 155 9.033 1.160 -9.337 1.00 0.00 H new ATOM 0 HG23 VAL A 155 9.486 1.457 -7.642 1.00 0.00 H new ATOM 1963 N GLN A 156 9.777 2.598 -10.744 1.00 0.00 N ATOM 1964 CA GLN A 156 10.066 2.342 -12.150 1.00 0.00 C ATOM 1965 C GLN A 156 10.039 0.846 -12.449 1.00 0.00 C ATOM 1966 O GLN A 156 10.862 0.087 -11.938 1.00 0.00 O ATOM 1967 CB GLN A 156 11.430 2.924 -12.527 1.00 0.00 C ATOM 1968 CG GLN A 156 11.377 4.393 -12.917 1.00 0.00 C ATOM 1969 CD GLN A 156 10.701 4.617 -14.256 1.00 0.00 C ATOM 1970 OE1 GLN A 156 10.824 3.802 -15.171 1.00 0.00 O ATOM 1971 NE2 GLN A 156 9.980 5.725 -14.377 1.00 0.00 N ATOM 0 H GLN A 156 10.067 1.853 -10.111 1.00 0.00 H new ATOM 0 HA GLN A 156 9.294 2.827 -12.747 1.00 0.00 H new ATOM 0 HB2 GLN A 156 12.112 2.804 -11.685 1.00 0.00 H new ATOM 0 HB3 GLN A 156 11.844 2.351 -13.357 1.00 0.00 H new ATOM 0 HG2 GLN A 156 10.844 4.950 -12.147 1.00 0.00 H new ATOM 0 HG3 GLN A 156 12.391 4.792 -12.955 1.00 0.00 H new ATOM 0 HE21 GLN A 156 9.905 6.373 -13.593 1.00 0.00 H new ATOM 0 HE22 GLN A 156 9.501 5.928 -15.254 1.00 0.00 H new ATOM 1980 N ALA A 157 9.087 0.431 -13.278 1.00 0.00 N ATOM 1981 CA ALA A 157 8.954 -0.974 -13.645 1.00 0.00 C ATOM 1982 C ALA A 157 9.051 -1.874 -12.418 1.00 0.00 C ATOM 1983 O ALA A 157 8.059 -2.103 -11.725 1.00 0.00 O ATOM 1984 CB ALA A 157 10.016 -1.355 -14.666 1.00 0.00 C ATOM 0 H ALA A 157 8.397 1.047 -13.708 1.00 0.00 H new ATOM 0 HA ALA A 157 7.969 -1.116 -14.090 1.00 0.00 H new ATOM 0 HB1 ALA A 157 9.905 -2.406 -14.931 1.00 0.00 H new ATOM 0 HB2 ALA A 157 9.899 -0.741 -15.559 1.00 0.00 H new ATOM 0 HB3 ALA A 157 11.006 -1.191 -14.240 1.00 0.00 H new TER 1990 ALA A 157