USER MOD reduce.3.24.130724 H: found=0, std=0, add=1318, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1314 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 22 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 62 TYR OH : rot 106:sc= -2.82! USER MOD Single : A 1 SER OG : rot 44:sc= 0.0709 USER MOD Single : A 5 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.295 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 83:sc= 0.158 USER MOD Single : A 29 GLN : amide:sc= -0.225 K(o=-0.23,f=-0.82) USER MOD Single : A 34 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 81:sc= 1.11 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 48 GLN : amide:sc= -0.399 X(o=-0.4,f=-0.45) USER MOD Single : A 53 MET CE :methyl -163:sc= -2.68! (180deg=-2.81!) USER MOD Single : A 54 GLN : amide:sc= -0.0415 K(o=-0.042,f=-3!) USER MOD Single : A 56 HIS : no HE2:sc= -2.47! C(o=-2.5!,f=-3.4!) USER MOD Single : A 57 HIS : no HD1:sc= -6.56! C(o=-6.6!,f=-8.4!) USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=-0.0082) USER MOD Single : A 60 SER OG : rot -51:sc= 0.759 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 103:sc= 1.07 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ -166:sc= -0.521 (180deg=-0.953) USER MOD Single : A 71 LYS NZ :NH3+ 136:sc= -0.0525 (180deg=-0.281) USER MOD Single : A 74 SER OG : rot 180:sc= 0.0383 USER MOD Single : A 75 LYS NZ :NH3+ 147:sc= 0.0573 (180deg=-0.0379) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 TYR OH : rot 141:sc= 1.3 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ -119:sc=-0.00539 (180deg=-0.0487) USER MOD Single : A 97 LYS NZ :NH3+ -149:sc= 0 (180deg=-0.0425) USER MOD Single : A 98 THR OG1 : rot 180:sc= 0.0545 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 GLN : amide:sc= -0.0378 X(o=-0.038,f=0) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 114 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= 0 X(o=0,f=0.044) USER MOD Single : A 116 ASN : amide:sc= 0 X(o=0,f=-0.089) USER MOD Single : A 118 SER OG : rot 180:sc= -0.0257 USER MOD Single : A 119 THR OG1 : rot -41:sc= -1.52! USER MOD Single : A 128 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 135 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.156) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.111 USER MOD Single : A 139 GLN : amide:sc= 0 X(o=0,f=-0.087) USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 HIS : no HD1:sc= -0.376 X(o=-0.38,f=-0.14) USER MOD Single : A 144 GLN : amide:sc= -1.5 K(o=-1.5,f=-2.2!) USER MOD Single : A 147 HIS : no HD1:sc= -1.06 K(o=-1.1,f=-0.52) USER MOD Single : A 155 SER OG : rot 180:sc= 0.302 USER MOD Single : A 156 THR OG1 : rot 180:sc= 0.051 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 -48.228 -20.326 25.465 1.00 0.00 N ATOM 2 CA GLY A -1 -47.279 -20.100 24.338 1.00 0.00 C ATOM 3 C GLY A -1 -45.905 -19.700 24.896 1.00 0.00 C ATOM 4 O GLY A -1 -45.782 -18.707 25.589 1.00 0.00 O ATOM 0 H1 GLY A -1 -49.158 -20.597 25.087 1.00 0.00 H new ATOM 0 H2 GLY A -1 -47.867 -21.087 26.075 1.00 0.00 H new ATOM 0 H3 GLY A -1 -48.321 -19.452 26.021 1.00 0.00 H new ATOM 0 HA2 GLY A -1 -47.190 -21.005 23.737 1.00 0.00 H new ATOM 0 HA3 GLY A -1 -47.658 -19.317 23.681 1.00 0.00 H new ATOM 10 N GLY A 0 -44.869 -20.459 24.600 1.00 0.00 N ATOM 11 CA GLY A 0 -43.514 -20.110 25.119 1.00 0.00 C ATOM 12 C GLY A 0 -42.905 -18.996 24.255 1.00 0.00 C ATOM 13 O GLY A 0 -43.539 -18.506 23.338 1.00 0.00 O ATOM 0 H GLY A 0 -44.910 -21.300 24.024 1.00 0.00 H new ATOM 0 HA2 GLY A 0 -43.584 -19.783 26.156 1.00 0.00 H new ATOM 0 HA3 GLY A 0 -42.870 -20.989 25.104 1.00 0.00 H new ATOM 17 N SER A 1 -41.683 -18.589 24.534 1.00 0.00 N ATOM 18 CA SER A 1 -41.051 -17.508 23.720 1.00 0.00 C ATOM 19 C SER A 1 -39.630 -17.926 23.297 1.00 0.00 C ATOM 20 O SER A 1 -38.860 -18.377 24.122 1.00 0.00 O ATOM 21 CB SER A 1 -40.995 -16.298 24.650 1.00 0.00 C ATOM 22 OG SER A 1 -40.558 -16.714 25.937 1.00 0.00 O ATOM 0 H SER A 1 -41.104 -18.960 25.287 1.00 0.00 H new ATOM 0 HA SER A 1 -41.608 -17.297 22.807 1.00 0.00 H new ATOM 0 HB2 SER A 1 -40.315 -15.547 24.248 1.00 0.00 H new ATOM 0 HB3 SER A 1 -41.978 -15.833 24.720 1.00 0.00 H new ATOM 0 HG SER A 1 -39.806 -17.336 25.842 1.00 0.00 H new ATOM 28 N PRO A 2 -39.315 -17.767 22.025 1.00 0.00 N ATOM 29 CA PRO A 2 -37.963 -18.145 21.539 1.00 0.00 C ATOM 30 C PRO A 2 -36.921 -17.113 22.001 1.00 0.00 C ATOM 31 O PRO A 2 -36.514 -16.258 21.236 1.00 0.00 O ATOM 32 CB PRO A 2 -38.106 -18.130 20.020 1.00 0.00 C ATOM 33 CG PRO A 2 -39.239 -17.193 19.744 1.00 0.00 C ATOM 34 CD PRO A 2 -40.156 -17.236 20.938 1.00 0.00 C ATOM 0 HA PRO A 2 -37.627 -19.110 21.919 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -37.188 -17.790 19.541 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -38.316 -19.127 19.634 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -38.869 -16.181 19.579 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -39.771 -17.489 18.840 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -40.540 -16.245 21.180 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -41.019 -17.876 20.754 1.00 0.00 H new ATOM 42 N ARG A 3 -36.486 -17.182 23.244 1.00 0.00 N ATOM 43 CA ARG A 3 -35.473 -16.201 23.737 1.00 0.00 C ATOM 44 C ARG A 3 -34.267 -16.936 24.340 1.00 0.00 C ATOM 45 O ARG A 3 -34.373 -17.546 25.388 1.00 0.00 O ATOM 46 CB ARG A 3 -36.199 -15.391 24.811 1.00 0.00 C ATOM 47 CG ARG A 3 -35.329 -14.204 25.231 1.00 0.00 C ATOM 48 CD ARG A 3 -35.654 -13.818 26.677 1.00 0.00 C ATOM 49 NE ARG A 3 -37.080 -13.370 26.645 1.00 0.00 N ATOM 50 CZ ARG A 3 -37.423 -12.203 26.124 1.00 0.00 C ATOM 51 NH1 ARG A 3 -36.525 -11.390 25.613 1.00 0.00 N ATOM 52 NH2 ARG A 3 -38.681 -11.843 26.113 1.00 0.00 N ATOM 0 H ARG A 3 -36.790 -17.873 23.930 1.00 0.00 H new ATOM 0 HA ARG A 3 -35.089 -15.568 22.937 1.00 0.00 H new ATOM 0 HB2 ARG A 3 -37.156 -15.037 24.429 1.00 0.00 H new ATOM 0 HB3 ARG A 3 -36.414 -16.021 25.674 1.00 0.00 H new ATOM 0 HG2 ARG A 3 -34.274 -14.463 25.141 1.00 0.00 H new ATOM 0 HG3 ARG A 3 -35.507 -13.357 24.569 1.00 0.00 H new ATOM 0 HD2 ARG A 3 -35.521 -14.664 27.351 1.00 0.00 H new ATOM 0 HD3 ARG A 3 -34.998 -13.023 27.030 1.00 0.00 H new ATOM 0 HE ARG A 3 -37.803 -13.976 27.033 1.00 0.00 H new ATOM 0 HH11 ARG A 3 -35.540 -11.654 25.613 1.00 0.00 H new ATOM 0 HH12 ARG A 3 -36.814 -10.495 25.217 1.00 0.00 H new ATOM 0 HH21 ARG A 3 -39.392 -12.461 26.505 1.00 0.00 H new ATOM 0 HH22 ARG A 3 -38.951 -10.945 25.713 1.00 0.00 H new ATOM 66 N ILE A 4 -33.121 -16.888 23.691 1.00 0.00 N ATOM 67 CA ILE A 4 -31.918 -17.590 24.243 1.00 0.00 C ATOM 68 C ILE A 4 -30.621 -16.966 23.691 1.00 0.00 C ATOM 69 O ILE A 4 -29.842 -17.630 23.034 1.00 0.00 O ATOM 70 CB ILE A 4 -32.067 -19.049 23.789 1.00 0.00 C ATOM 71 CG1 ILE A 4 -30.910 -19.882 24.354 1.00 0.00 C ATOM 72 CG2 ILE A 4 -32.057 -19.129 22.258 1.00 0.00 C ATOM 73 CD1 ILE A 4 -31.360 -20.577 25.641 1.00 0.00 C ATOM 0 H ILE A 4 -32.971 -16.396 22.810 1.00 0.00 H new ATOM 0 HA ILE A 4 -31.856 -17.508 25.328 1.00 0.00 H new ATOM 0 HB ILE A 4 -33.015 -19.441 24.158 1.00 0.00 H new ATOM 0 HG12 ILE A 4 -30.590 -20.623 23.621 1.00 0.00 H new ATOM 0 HG13 ILE A 4 -30.051 -19.241 24.556 1.00 0.00 H new ATOM 0 HG21 ILE A 4 -32.163 -20.168 21.947 1.00 0.00 H new ATOM 0 HG22 ILE A 4 -32.885 -18.544 21.858 1.00 0.00 H new ATOM 0 HG23 ILE A 4 -31.115 -18.731 21.879 1.00 0.00 H new ATOM 0 HD11 ILE A 4 -30.537 -21.169 26.042 1.00 0.00 H new ATOM 0 HD12 ILE A 4 -31.659 -19.828 26.374 1.00 0.00 H new ATOM 0 HD13 ILE A 4 -32.205 -21.230 25.425 1.00 0.00 H new ATOM 85 N LYS A 5 -30.384 -15.695 23.950 1.00 0.00 N ATOM 86 CA LYS A 5 -29.140 -15.045 23.434 1.00 0.00 C ATOM 87 C LYS A 5 -28.660 -13.955 24.408 1.00 0.00 C ATOM 88 O LYS A 5 -29.415 -13.496 25.245 1.00 0.00 O ATOM 89 CB LYS A 5 -29.545 -14.427 22.094 1.00 0.00 C ATOM 90 CG LYS A 5 -28.423 -14.633 21.073 1.00 0.00 C ATOM 91 CD LYS A 5 -28.378 -13.442 20.115 1.00 0.00 C ATOM 92 CE LYS A 5 -27.245 -13.639 19.105 1.00 0.00 C ATOM 93 NZ LYS A 5 -27.140 -12.340 18.386 1.00 0.00 N ATOM 0 H LYS A 5 -30.997 -15.088 24.493 1.00 0.00 H new ATOM 0 HA LYS A 5 -28.319 -15.754 23.327 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -30.466 -14.885 21.734 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -29.746 -13.363 22.219 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -27.466 -14.738 21.585 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -28.589 -15.555 20.516 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -29.331 -13.345 19.594 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -28.225 -12.519 20.673 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -26.310 -13.890 19.605 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -27.467 -14.454 18.417 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -26.383 -12.397 17.675 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -28.043 -12.131 17.914 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -26.921 -11.584 19.066 1.00 0.00 H new ATOM 107 N THR A 6 -27.415 -13.536 24.308 1.00 0.00 N ATOM 108 CA THR A 6 -26.904 -12.480 25.233 1.00 0.00 C ATOM 109 C THR A 6 -25.898 -11.572 24.507 1.00 0.00 C ATOM 110 O THR A 6 -24.833 -11.288 25.022 1.00 0.00 O ATOM 111 CB THR A 6 -26.216 -13.243 26.366 1.00 0.00 C ATOM 112 OG1 THR A 6 -26.949 -14.426 26.650 1.00 0.00 O ATOM 113 CG2 THR A 6 -26.158 -12.364 27.616 1.00 0.00 C ATOM 0 H THR A 6 -26.738 -13.881 23.628 1.00 0.00 H new ATOM 0 HA THR A 6 -27.703 -11.835 25.600 1.00 0.00 H new ATOM 0 HB THR A 6 -25.202 -13.506 26.064 1.00 0.00 H new ATOM 0 HG1 THR A 6 -26.509 -14.917 27.375 1.00 0.00 H new ATOM 0 HG21 THR A 6 -25.667 -12.910 28.422 1.00 0.00 H new ATOM 0 HG22 THR A 6 -25.595 -11.457 27.397 1.00 0.00 H new ATOM 0 HG23 THR A 6 -27.170 -12.098 27.921 1.00 0.00 H new ATOM 121 N ARG A 7 -26.223 -11.113 23.314 1.00 0.00 N ATOM 122 CA ARG A 7 -25.278 -10.226 22.570 1.00 0.00 C ATOM 123 C ARG A 7 -26.052 -9.093 21.878 1.00 0.00 C ATOM 124 O ARG A 7 -27.035 -9.336 21.202 1.00 0.00 O ATOM 125 CB ARG A 7 -24.610 -11.138 21.530 1.00 0.00 C ATOM 126 CG ARG A 7 -23.088 -10.988 21.610 1.00 0.00 C ATOM 127 CD ARG A 7 -22.691 -9.566 21.205 1.00 0.00 C ATOM 128 NE ARG A 7 -21.197 -9.557 21.243 1.00 0.00 N ATOM 129 CZ ARG A 7 -20.538 -9.539 22.391 1.00 0.00 C ATOM 130 NH1 ARG A 7 -21.169 -9.524 23.544 1.00 0.00 N ATOM 131 NH2 ARG A 7 -19.230 -9.535 22.386 1.00 0.00 N ATOM 0 H ARG A 7 -27.098 -11.316 22.831 1.00 0.00 H new ATOM 0 HA ARG A 7 -24.546 -9.756 23.227 1.00 0.00 H new ATOM 0 HB2 ARG A 7 -24.892 -12.176 21.708 1.00 0.00 H new ATOM 0 HB3 ARG A 7 -24.958 -10.880 20.530 1.00 0.00 H new ATOM 0 HG2 ARG A 7 -22.744 -11.198 22.623 1.00 0.00 H new ATOM 0 HG3 ARG A 7 -22.606 -11.712 20.953 1.00 0.00 H new ATOM 0 HD2 ARG A 7 -23.062 -9.321 20.210 1.00 0.00 H new ATOM 0 HD3 ARG A 7 -23.108 -8.829 21.891 1.00 0.00 H new ATOM 0 HE ARG A 7 -20.675 -9.565 20.367 1.00 0.00 H new ATOM 0 HH11 ARG A 7 -22.189 -9.526 23.567 1.00 0.00 H new ATOM 0 HH12 ARG A 7 -20.639 -9.510 24.415 1.00 0.00 H new ATOM 0 HH21 ARG A 7 -18.723 -9.546 21.501 1.00 0.00 H new ATOM 0 HH22 ARG A 7 -18.717 -9.521 23.267 1.00 0.00 H new ATOM 145 N ARG A 8 -25.623 -7.856 22.040 1.00 0.00 N ATOM 146 CA ARG A 8 -26.347 -6.723 21.388 1.00 0.00 C ATOM 147 C ARG A 8 -25.404 -5.968 20.436 1.00 0.00 C ATOM 148 O ARG A 8 -25.646 -5.906 19.245 1.00 0.00 O ATOM 149 CB ARG A 8 -26.790 -5.817 22.541 1.00 0.00 C ATOM 150 CG ARG A 8 -28.236 -5.367 22.317 1.00 0.00 C ATOM 151 CD ARG A 8 -28.451 -3.995 22.960 1.00 0.00 C ATOM 152 NE ARG A 8 -29.906 -3.952 23.300 1.00 0.00 N ATOM 153 CZ ARG A 8 -30.828 -3.810 22.360 1.00 0.00 C ATOM 154 NH1 ARG A 8 -30.502 -3.693 21.093 1.00 0.00 N ATOM 155 NH2 ARG A 8 -32.093 -3.780 22.694 1.00 0.00 N ATOM 0 H ARG A 8 -24.808 -7.590 22.593 1.00 0.00 H new ATOM 0 HA ARG A 8 -27.194 -7.062 20.791 1.00 0.00 H new ATOM 0 HB2 ARG A 8 -26.708 -6.351 23.488 1.00 0.00 H new ATOM 0 HB3 ARG A 8 -26.135 -4.949 22.606 1.00 0.00 H new ATOM 0 HG2 ARG A 8 -28.451 -5.318 21.250 1.00 0.00 H new ATOM 0 HG3 ARG A 8 -28.925 -6.094 22.748 1.00 0.00 H new ATOM 0 HD2 ARG A 8 -27.834 -3.875 23.850 1.00 0.00 H new ATOM 0 HD3 ARG A 8 -28.182 -3.191 22.275 1.00 0.00 H new ATOM 0 HE ARG A 8 -30.194 -4.034 24.275 1.00 0.00 H new ATOM 0 HH11 ARG A 8 -29.521 -3.711 20.815 1.00 0.00 H new ATOM 0 HH12 ARG A 8 -31.230 -3.585 20.387 1.00 0.00 H new ATOM 0 HH21 ARG A 8 -32.364 -3.866 23.674 1.00 0.00 H new ATOM 0 HH22 ARG A 8 -32.808 -3.671 21.975 1.00 0.00 H new ATOM 169 N SER A 9 -24.333 -5.392 20.946 1.00 0.00 N ATOM 170 CA SER A 9 -23.391 -4.644 20.053 1.00 0.00 C ATOM 171 C SER A 9 -21.981 -4.594 20.668 1.00 0.00 C ATOM 172 O SER A 9 -21.607 -3.611 21.280 1.00 0.00 O ATOM 173 CB SER A 9 -23.979 -3.238 19.951 1.00 0.00 C ATOM 174 OG SER A 9 -23.598 -2.659 18.709 1.00 0.00 O ATOM 0 H SER A 9 -24.076 -5.409 21.933 1.00 0.00 H new ATOM 0 HA SER A 9 -23.289 -5.120 19.078 1.00 0.00 H new ATOM 0 HB2 SER A 9 -25.065 -3.279 20.028 1.00 0.00 H new ATOM 0 HB3 SER A 9 -23.624 -2.622 20.777 1.00 0.00 H new ATOM 0 HG SER A 9 -23.975 -1.757 18.639 1.00 0.00 H new ATOM 180 N LYS A 10 -21.197 -5.641 20.513 1.00 0.00 N ATOM 181 CA LYS A 10 -19.819 -5.637 21.093 1.00 0.00 C ATOM 182 C LYS A 10 -18.844 -6.364 20.149 1.00 0.00 C ATOM 183 O LYS A 10 -18.289 -7.385 20.506 1.00 0.00 O ATOM 184 CB LYS A 10 -19.948 -6.383 22.422 1.00 0.00 C ATOM 185 CG LYS A 10 -20.152 -5.376 23.556 1.00 0.00 C ATOM 186 CD LYS A 10 -18.842 -4.630 23.819 1.00 0.00 C ATOM 187 CE LYS A 10 -17.971 -5.449 24.775 1.00 0.00 C ATOM 188 NZ LYS A 10 -16.694 -4.689 24.878 1.00 0.00 N ATOM 0 H LYS A 10 -21.454 -6.491 20.012 1.00 0.00 H new ATOM 0 HA LYS A 10 -19.429 -4.629 21.231 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -20.788 -7.076 22.382 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -19.053 -6.977 22.606 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -20.938 -4.669 23.292 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -20.477 -5.891 24.460 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -18.312 -4.462 22.881 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -19.049 -3.650 24.248 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -18.447 -5.555 25.750 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -17.802 -6.455 24.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -16.043 -5.188 25.518 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -16.260 -4.609 23.936 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -16.885 -3.738 25.252 1.00 0.00 H new ATOM 202 N PRO A 11 -18.661 -5.816 18.965 1.00 0.00 N ATOM 203 CA PRO A 11 -17.739 -6.440 17.984 1.00 0.00 C ATOM 204 C PRO A 11 -16.278 -6.229 18.404 1.00 0.00 C ATOM 205 O PRO A 11 -15.967 -5.316 19.142 1.00 0.00 O ATOM 206 CB PRO A 11 -18.038 -5.701 16.684 1.00 0.00 C ATOM 207 CG PRO A 11 -18.592 -4.378 17.106 1.00 0.00 C ATOM 208 CD PRO A 11 -19.278 -4.588 18.431 1.00 0.00 C ATOM 0 HA PRO A 11 -17.878 -7.518 17.899 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -17.136 -5.577 16.084 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -18.754 -6.251 16.073 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -17.796 -3.638 17.197 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -19.295 -4.000 16.364 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -19.123 -3.741 19.099 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -20.355 -4.704 18.308 1.00 0.00 H new ATOM 216 N ALA A 12 -15.375 -7.068 17.929 1.00 0.00 N ATOM 217 CA ALA A 12 -13.922 -6.931 18.288 1.00 0.00 C ATOM 218 C ALA A 12 -13.718 -7.099 19.807 1.00 0.00 C ATOM 219 O ALA A 12 -14.566 -6.719 20.587 1.00 0.00 O ATOM 220 CB ALA A 12 -13.505 -5.525 17.836 1.00 0.00 C ATOM 0 H ALA A 12 -15.587 -7.846 17.304 1.00 0.00 H new ATOM 0 HA ALA A 12 -13.319 -7.699 17.804 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.453 -5.364 18.071 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -13.655 -5.429 16.761 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -14.110 -4.782 18.355 1.00 0.00 H new ATOM 226 N PRO A 13 -12.591 -7.669 20.185 1.00 0.00 N ATOM 227 CA PRO A 13 -12.303 -7.875 21.627 1.00 0.00 C ATOM 228 C PRO A 13 -11.944 -6.544 22.299 1.00 0.00 C ATOM 229 O PRO A 13 -11.620 -5.576 21.637 1.00 0.00 O ATOM 230 CB PRO A 13 -11.105 -8.820 21.626 1.00 0.00 C ATOM 231 CG PRO A 13 -10.433 -8.597 20.310 1.00 0.00 C ATOM 232 CD PRO A 13 -11.498 -8.169 19.333 1.00 0.00 C ATOM 0 HA PRO A 13 -13.155 -8.275 22.178 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -10.431 -8.603 22.454 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -11.421 -9.857 21.736 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -9.661 -7.833 20.397 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -9.942 -9.509 19.969 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -11.132 -7.394 18.659 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -11.827 -9.002 18.712 1.00 0.00 H new ATOM 240 N ASP A 14 -12.002 -6.486 23.615 1.00 0.00 N ATOM 241 CA ASP A 14 -11.661 -5.198 24.338 1.00 0.00 C ATOM 242 C ASP A 14 -10.326 -4.610 23.837 1.00 0.00 C ATOM 243 O ASP A 14 -10.150 -3.407 23.816 1.00 0.00 O ATOM 244 CB ASP A 14 -11.548 -5.550 25.829 1.00 0.00 C ATOM 245 CG ASP A 14 -12.941 -5.539 26.463 1.00 0.00 C ATOM 246 OD1 ASP A 14 -13.414 -4.462 26.789 1.00 0.00 O ATOM 247 OD2 ASP A 14 -13.512 -6.607 26.612 1.00 0.00 O ATOM 0 H ASP A 14 -12.267 -7.264 24.219 1.00 0.00 H new ATOM 0 HA ASP A 14 -12.430 -4.447 24.156 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -11.090 -6.532 25.948 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -10.901 -4.833 26.335 1.00 0.00 H new ATOM 252 N GLY A 15 -9.385 -5.442 23.432 1.00 0.00 N ATOM 253 CA GLY A 15 -8.073 -4.919 22.934 1.00 0.00 C ATOM 254 C GLY A 15 -8.294 -3.891 21.806 1.00 0.00 C ATOM 255 O GLY A 15 -7.548 -2.937 21.687 1.00 0.00 O ATOM 0 H GLY A 15 -9.474 -6.458 23.427 1.00 0.00 H new ATOM 0 HA2 GLY A 15 -7.525 -4.455 23.754 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -7.462 -5.744 22.568 1.00 0.00 H new ATOM 259 N PHE A 16 -9.308 -4.069 20.975 1.00 0.00 N ATOM 260 CA PHE A 16 -9.548 -3.075 19.862 1.00 0.00 C ATOM 261 C PHE A 16 -9.667 -1.646 20.421 1.00 0.00 C ATOM 262 O PHE A 16 -9.292 -0.692 19.765 1.00 0.00 O ATOM 263 CB PHE A 16 -10.864 -3.480 19.178 1.00 0.00 C ATOM 264 CG PHE A 16 -11.094 -2.608 17.965 1.00 0.00 C ATOM 265 CD1 PHE A 16 -10.099 -2.488 16.985 1.00 0.00 C ATOM 266 CD2 PHE A 16 -12.304 -1.917 17.820 1.00 0.00 C ATOM 267 CE1 PHE A 16 -10.314 -1.679 15.864 1.00 0.00 C ATOM 268 CE2 PHE A 16 -12.518 -1.108 16.699 1.00 0.00 C ATOM 269 CZ PHE A 16 -11.523 -0.989 15.720 1.00 0.00 C ATOM 0 H PHE A 16 -9.969 -4.845 21.017 1.00 0.00 H new ATOM 0 HA PHE A 16 -8.716 -3.083 19.158 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -10.824 -4.528 18.883 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -11.695 -3.377 19.876 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -9.166 -3.020 17.095 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -13.072 -2.009 18.574 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -9.547 -1.587 15.110 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -13.451 -0.575 16.588 1.00 0.00 H new ATOM 0 HZ PHE A 16 -11.689 -0.365 14.854 1.00 0.00 H new ATOM 279 N GLU A 17 -10.181 -1.480 21.627 1.00 0.00 N ATOM 280 CA GLU A 17 -10.308 -0.089 22.206 1.00 0.00 C ATOM 281 C GLU A 17 -8.947 0.627 22.177 1.00 0.00 C ATOM 282 O GLU A 17 -8.874 1.814 21.917 1.00 0.00 O ATOM 283 CB GLU A 17 -10.787 -0.254 23.657 1.00 0.00 C ATOM 284 CG GLU A 17 -11.053 1.124 24.267 1.00 0.00 C ATOM 285 CD GLU A 17 -10.822 1.067 25.778 1.00 0.00 C ATOM 286 OE1 GLU A 17 -11.763 0.754 26.489 1.00 0.00 O ATOM 287 OE2 GLU A 17 -9.709 1.335 26.199 1.00 0.00 O ATOM 0 H GLU A 17 -10.514 -2.234 22.228 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.010 0.511 21.627 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -11.694 -0.857 23.685 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -10.034 -0.783 24.242 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -10.395 1.866 23.816 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -12.076 1.435 24.056 1.00 0.00 H new ATOM 294 N LYS A 18 -7.867 -0.085 22.433 1.00 0.00 N ATOM 295 CA LYS A 18 -6.512 0.579 22.406 1.00 0.00 C ATOM 296 C LYS A 18 -6.247 1.185 21.018 1.00 0.00 C ATOM 297 O LYS A 18 -5.671 2.251 20.906 1.00 0.00 O ATOM 298 CB LYS A 18 -5.474 -0.513 22.713 1.00 0.00 C ATOM 299 CG LYS A 18 -5.571 -0.907 24.189 1.00 0.00 C ATOM 300 CD LYS A 18 -4.203 -1.382 24.682 1.00 0.00 C ATOM 301 CE LYS A 18 -4.122 -1.217 26.200 1.00 0.00 C ATOM 302 NZ LYS A 18 -3.608 0.166 26.410 1.00 0.00 N ATOM 0 H LYS A 18 -7.862 -1.080 22.656 1.00 0.00 H new ATOM 0 HA LYS A 18 -6.458 1.386 23.137 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -5.648 -1.384 22.081 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -4.471 -0.151 22.487 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -5.908 -0.057 24.782 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -6.310 -1.698 24.317 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -4.049 -2.426 24.410 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -3.412 -0.808 24.200 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -5.099 -1.350 26.664 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -3.456 -1.957 26.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -3.525 0.354 27.429 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -2.674 0.261 25.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -4.266 0.849 25.984 1.00 0.00 H new ATOM 316 N ILE A 19 -6.667 0.522 19.959 1.00 0.00 N ATOM 317 CA ILE A 19 -6.439 1.078 18.586 1.00 0.00 C ATOM 318 C ILE A 19 -7.786 1.389 17.898 1.00 0.00 C ATOM 319 O ILE A 19 -7.923 1.220 16.702 1.00 0.00 O ATOM 320 CB ILE A 19 -5.661 -0.015 17.822 1.00 0.00 C ATOM 321 CG1 ILE A 19 -6.514 -1.293 17.689 1.00 0.00 C ATOM 322 CG2 ILE A 19 -4.360 -0.346 18.572 1.00 0.00 C ATOM 323 CD1 ILE A 19 -6.435 -1.827 16.254 1.00 0.00 C ATOM 0 H ILE A 19 -7.154 -0.374 19.989 1.00 0.00 H new ATOM 0 HA ILE A 19 -5.883 2.015 18.612 1.00 0.00 H new ATOM 0 HB ILE A 19 -5.426 0.359 16.825 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -6.160 -2.051 18.388 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -7.550 -1.078 17.949 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -3.814 -1.118 18.030 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -3.744 0.550 18.646 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -4.598 -0.706 19.573 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -7.040 -2.730 16.168 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -6.810 -1.072 15.564 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -5.399 -2.060 16.009 1.00 0.00 H new ATOM 335 N LYS A 20 -8.787 1.823 18.644 1.00 0.00 N ATOM 336 CA LYS A 20 -10.126 2.114 18.011 1.00 0.00 C ATOM 337 C LYS A 20 -10.228 3.535 17.407 1.00 0.00 C ATOM 338 O LYS A 20 -10.770 3.682 16.328 1.00 0.00 O ATOM 339 CB LYS A 20 -11.171 1.950 19.127 1.00 0.00 C ATOM 340 CG LYS A 20 -12.554 1.697 18.509 1.00 0.00 C ATOM 341 CD LYS A 20 -13.594 2.601 19.176 1.00 0.00 C ATOM 342 CE LYS A 20 -13.635 3.951 18.454 1.00 0.00 C ATOM 343 NZ LYS A 20 -13.961 4.943 19.515 1.00 0.00 N ATOM 0 H LYS A 20 -8.736 1.986 19.650 1.00 0.00 H new ATOM 0 HA LYS A 20 -10.282 1.430 17.177 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -10.895 1.120 19.777 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -11.198 2.846 19.748 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -12.524 1.891 17.437 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -12.833 0.651 18.636 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -14.576 2.129 19.143 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -13.345 2.746 20.227 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -12.678 4.176 17.983 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -14.387 3.955 17.665 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -14.007 5.895 19.098 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -14.880 4.707 19.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -13.224 4.922 20.248 1.00 0.00 H new ATOM 357 N PRO A 21 -9.751 4.551 18.108 1.00 0.00 N ATOM 358 CA PRO A 21 -9.874 5.936 17.582 1.00 0.00 C ATOM 359 C PRO A 21 -8.880 6.208 16.440 1.00 0.00 C ATOM 360 O PRO A 21 -9.190 6.945 15.523 1.00 0.00 O ATOM 361 CB PRO A 21 -9.577 6.814 18.792 1.00 0.00 C ATOM 362 CG PRO A 21 -8.746 5.970 19.701 1.00 0.00 C ATOM 363 CD PRO A 21 -9.069 4.525 19.411 1.00 0.00 C ATOM 0 HA PRO A 21 -10.857 6.126 17.151 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -9.044 7.719 18.499 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -10.497 7.131 19.283 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.686 6.164 19.540 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -8.959 6.207 20.743 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -8.165 3.917 19.373 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.708 4.099 20.184 1.00 0.00 H new ATOM 371 N THR A 22 -7.694 5.632 16.475 1.00 0.00 N ATOM 372 CA THR A 22 -6.717 5.900 15.356 1.00 0.00 C ATOM 373 C THR A 22 -7.298 5.400 14.029 1.00 0.00 C ATOM 374 O THR A 22 -7.291 6.112 13.040 1.00 0.00 O ATOM 375 CB THR A 22 -5.421 5.143 15.692 1.00 0.00 C ATOM 376 OG1 THR A 22 -4.935 5.575 16.960 1.00 0.00 O ATOM 377 CG2 THR A 22 -4.366 5.432 14.618 1.00 0.00 C ATOM 0 H THR A 22 -7.365 5.004 17.208 1.00 0.00 H new ATOM 0 HA THR A 22 -6.520 6.967 15.255 1.00 0.00 H new ATOM 0 HB THR A 22 -5.624 4.073 15.724 1.00 0.00 H new ATOM 0 HG1 THR A 22 -4.110 5.092 17.176 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.448 4.895 14.856 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.736 5.104 13.647 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.163 6.502 14.586 1.00 0.00 H new ATOM 385 N LEU A 23 -7.814 4.191 13.996 1.00 0.00 N ATOM 386 CA LEU A 23 -8.407 3.673 12.712 1.00 0.00 C ATOM 387 C LEU A 23 -9.599 4.552 12.306 1.00 0.00 C ATOM 388 O LEU A 23 -9.779 4.852 11.141 1.00 0.00 O ATOM 389 CB LEU A 23 -8.866 2.232 12.982 1.00 0.00 C ATOM 390 CG LEU A 23 -7.636 1.340 13.164 1.00 0.00 C ATOM 391 CD1 LEU A 23 -7.953 0.214 14.156 1.00 0.00 C ATOM 392 CD2 LEU A 23 -7.238 0.742 11.812 1.00 0.00 C ATOM 0 H LEU A 23 -7.852 3.548 14.787 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.682 3.696 11.899 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.491 2.197 13.874 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.474 1.870 12.153 1.00 0.00 H new ATOM 0 HG LEU A 23 -6.811 1.936 13.555 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -7.074 -0.418 14.282 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -8.231 0.644 15.118 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -8.779 -0.386 13.774 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.362 0.106 11.939 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.064 0.148 11.420 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.005 1.545 11.113 1.00 0.00 H new ATOM 404 N THR A 24 -10.411 4.981 13.256 1.00 0.00 N ATOM 405 CA THR A 24 -11.583 5.861 12.894 1.00 0.00 C ATOM 406 C THR A 24 -11.094 7.122 12.159 1.00 0.00 C ATOM 407 O THR A 24 -11.760 7.615 11.268 1.00 0.00 O ATOM 408 CB THR A 24 -12.270 6.251 14.214 1.00 0.00 C ATOM 409 OG1 THR A 24 -12.272 5.134 15.093 1.00 0.00 O ATOM 410 CG2 THR A 24 -13.711 6.684 13.934 1.00 0.00 C ATOM 0 H THR A 24 -10.316 4.765 14.248 1.00 0.00 H new ATOM 0 HA THR A 24 -12.274 5.338 12.232 1.00 0.00 H new ATOM 0 HB THR A 24 -11.728 7.077 14.675 1.00 0.00 H new ATOM 0 HG1 THR A 24 -11.408 5.077 15.552 1.00 0.00 H new ATOM 0 HG21 THR A 24 -14.196 6.960 14.870 1.00 0.00 H new ATOM 0 HG22 THR A 24 -13.709 7.541 13.260 1.00 0.00 H new ATOM 0 HG23 THR A 24 -14.255 5.860 13.472 1.00 0.00 H new ATOM 418 N ASP A 25 -9.935 7.648 12.516 1.00 0.00 N ATOM 419 CA ASP A 25 -9.423 8.880 11.809 1.00 0.00 C ATOM 420 C ASP A 25 -9.326 8.624 10.295 1.00 0.00 C ATOM 421 O ASP A 25 -9.607 9.502 9.500 1.00 0.00 O ATOM 422 CB ASP A 25 -8.026 9.174 12.385 1.00 0.00 C ATOM 423 CG ASP A 25 -7.485 10.470 11.779 1.00 0.00 C ATOM 424 OD1 ASP A 25 -8.058 11.512 12.050 1.00 0.00 O ATOM 425 OD2 ASP A 25 -6.507 10.398 11.052 1.00 0.00 O ATOM 0 H ASP A 25 -9.331 7.285 13.253 1.00 0.00 H new ATOM 0 HA ASP A 25 -10.096 9.724 11.960 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -8.080 9.263 13.470 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -7.350 8.348 12.166 1.00 0.00 H new ATOM 430 N PHE A 26 -8.941 7.429 9.885 1.00 0.00 N ATOM 431 CA PHE A 26 -8.845 7.143 8.406 1.00 0.00 C ATOM 432 C PHE A 26 -10.198 7.406 7.724 1.00 0.00 C ATOM 433 O PHE A 26 -10.246 7.897 6.612 1.00 0.00 O ATOM 434 CB PHE A 26 -8.468 5.660 8.264 1.00 0.00 C ATOM 435 CG PHE A 26 -6.970 5.523 8.322 1.00 0.00 C ATOM 436 CD1 PHE A 26 -6.326 5.414 9.560 1.00 0.00 C ATOM 437 CD2 PHE A 26 -6.222 5.511 7.140 1.00 0.00 C ATOM 438 CE1 PHE A 26 -4.934 5.291 9.615 1.00 0.00 C ATOM 439 CE2 PHE A 26 -4.830 5.389 7.195 1.00 0.00 C ATOM 440 CZ PHE A 26 -4.187 5.279 8.433 1.00 0.00 C ATOM 0 H PHE A 26 -8.693 6.652 10.498 1.00 0.00 H new ATOM 0 HA PHE A 26 -8.102 7.786 7.934 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -8.930 5.077 9.061 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -8.845 5.265 7.321 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -6.904 5.425 10.472 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -6.719 5.596 6.185 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -4.436 5.205 10.570 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -4.252 5.380 6.283 1.00 0.00 H new ATOM 0 HZ PHE A 26 -3.112 5.185 8.476 1.00 0.00 H new ATOM 450 N GLU A 27 -11.298 7.087 8.379 1.00 0.00 N ATOM 451 CA GLU A 27 -12.642 7.336 7.742 1.00 0.00 C ATOM 452 C GLU A 27 -12.801 8.816 7.352 1.00 0.00 C ATOM 453 O GLU A 27 -13.517 9.127 6.420 1.00 0.00 O ATOM 454 CB GLU A 27 -13.708 6.945 8.778 1.00 0.00 C ATOM 455 CG GLU A 27 -13.693 5.429 8.979 1.00 0.00 C ATOM 456 CD GLU A 27 -15.079 4.960 9.428 1.00 0.00 C ATOM 457 OE1 GLU A 27 -15.616 5.558 10.346 1.00 0.00 O ATOM 458 OE2 GLU A 27 -15.579 4.011 8.847 1.00 0.00 O ATOM 0 H GLU A 27 -11.325 6.672 9.311 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.744 6.749 6.829 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -13.513 7.450 9.724 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -14.693 7.268 8.441 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -13.412 4.931 8.051 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.946 5.158 9.725 1.00 0.00 H new ATOM 465 N ILE A 28 -12.141 9.732 8.040 1.00 0.00 N ATOM 466 CA ILE A 28 -12.279 11.184 7.657 1.00 0.00 C ATOM 467 C ILE A 28 -11.415 11.470 6.412 1.00 0.00 C ATOM 468 O ILE A 28 -11.810 12.238 5.554 1.00 0.00 O ATOM 469 CB ILE A 28 -11.828 12.011 8.888 1.00 0.00 C ATOM 470 CG1 ILE A 28 -12.929 11.970 9.953 1.00 0.00 C ATOM 471 CG2 ILE A 28 -11.581 13.478 8.500 1.00 0.00 C ATOM 472 CD1 ILE A 28 -12.814 10.683 10.771 1.00 0.00 C ATOM 0 H ILE A 28 -11.527 9.543 8.832 1.00 0.00 H new ATOM 0 HA ILE A 28 -13.303 11.449 7.395 1.00 0.00 H new ATOM 0 HB ILE A 28 -10.902 11.581 9.271 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -12.845 12.837 10.609 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -13.909 12.023 9.478 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -11.266 14.039 9.380 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -10.802 13.527 7.740 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -12.501 13.910 8.105 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -13.600 10.660 11.526 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -12.920 9.822 10.111 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -11.840 10.648 11.259 1.00 0.00 H new ATOM 484 N GLN A 29 -10.261 10.847 6.286 1.00 0.00 N ATOM 485 CA GLN A 29 -9.428 11.090 5.061 1.00 0.00 C ATOM 486 C GLN A 29 -9.993 10.246 3.909 1.00 0.00 C ATOM 487 O GLN A 29 -10.074 10.705 2.784 1.00 0.00 O ATOM 488 CB GLN A 29 -7.994 10.656 5.401 1.00 0.00 C ATOM 489 CG GLN A 29 -7.006 11.413 4.512 1.00 0.00 C ATOM 490 CD GLN A 29 -6.878 12.860 5.005 1.00 0.00 C ATOM 491 OE1 GLN A 29 -7.603 13.727 4.561 1.00 0.00 O ATOM 492 NE2 GLN A 29 -5.981 13.164 5.912 1.00 0.00 N ATOM 0 H GLN A 29 -9.868 10.194 6.964 1.00 0.00 H new ATOM 0 HA GLN A 29 -9.439 12.137 4.758 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -7.782 10.856 6.451 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -7.883 9.582 5.253 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -6.033 10.923 4.533 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -7.348 11.399 3.477 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -5.370 12.439 6.288 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.895 14.125 6.242 1.00 0.00 H new ATOM 501 N LEU A 30 -10.404 9.020 4.180 1.00 0.00 N ATOM 502 CA LEU A 30 -10.983 8.171 3.081 1.00 0.00 C ATOM 503 C LEU A 30 -12.350 8.722 2.643 1.00 0.00 C ATOM 504 O LEU A 30 -12.692 8.647 1.477 1.00 0.00 O ATOM 505 CB LEU A 30 -11.140 6.751 3.652 1.00 0.00 C ATOM 506 CG LEU A 30 -10.875 5.723 2.552 1.00 0.00 C ATOM 507 CD1 LEU A 30 -9.418 5.826 2.097 1.00 0.00 C ATOM 508 CD2 LEU A 30 -11.139 4.317 3.092 1.00 0.00 C ATOM 0 H LEU A 30 -10.364 8.579 5.099 1.00 0.00 H new ATOM 0 HA LEU A 30 -10.333 8.171 2.206 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -10.445 6.602 4.478 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -12.145 6.619 4.053 1.00 0.00 H new ATOM 0 HG LEU A 30 -11.536 5.919 1.707 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -9.229 5.093 1.313 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -9.227 6.827 1.711 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -8.758 5.631 2.942 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -10.950 3.584 2.307 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -10.479 4.122 3.937 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -12.177 4.241 3.417 1.00 0.00 H new ATOM 520 N ARG A 31 -13.136 9.284 3.548 1.00 0.00 N ATOM 521 CA ARG A 31 -14.470 9.832 3.112 1.00 0.00 C ATOM 522 C ARG A 31 -14.263 11.109 2.276 1.00 0.00 C ATOM 523 O ARG A 31 -14.989 11.350 1.329 1.00 0.00 O ATOM 524 CB ARG A 31 -15.293 10.115 4.391 1.00 0.00 C ATOM 525 CG ARG A 31 -14.724 11.313 5.159 1.00 0.00 C ATOM 526 CD ARG A 31 -15.567 11.564 6.413 1.00 0.00 C ATOM 527 NE ARG A 31 -16.940 11.870 5.904 1.00 0.00 N ATOM 528 CZ ARG A 31 -17.225 13.042 5.357 1.00 0.00 C ATOM 529 NH1 ARG A 31 -16.316 13.984 5.242 1.00 0.00 N ATOM 530 NH2 ARG A 31 -18.436 13.273 4.921 1.00 0.00 N ATOM 0 H ARG A 31 -12.918 9.384 4.539 1.00 0.00 H new ATOM 0 HA ARG A 31 -15.005 9.121 2.483 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -16.331 10.311 4.123 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -15.290 9.233 5.032 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -13.688 11.121 5.437 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -14.725 12.199 4.524 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -15.574 10.690 7.065 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -15.169 12.394 6.996 1.00 0.00 H new ATOM 0 HE ARG A 31 -17.671 11.162 5.980 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -15.367 13.820 5.578 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -16.560 14.879 4.817 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -19.154 12.553 5.003 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -18.663 14.173 4.499 1.00 0.00 H new ATOM 544 N ASP A 32 -13.275 11.924 2.604 1.00 0.00 N ATOM 545 CA ASP A 32 -13.049 13.171 1.792 1.00 0.00 C ATOM 546 C ASP A 32 -12.627 12.789 0.366 1.00 0.00 C ATOM 547 O ASP A 32 -13.069 13.397 -0.590 1.00 0.00 O ATOM 548 CB ASP A 32 -11.930 13.965 2.487 1.00 0.00 C ATOM 549 CG ASP A 32 -12.490 14.651 3.734 1.00 0.00 C ATOM 550 OD1 ASP A 32 -13.582 15.189 3.651 1.00 0.00 O ATOM 551 OD2 ASP A 32 -11.818 14.626 4.752 1.00 0.00 O ATOM 0 H ASP A 32 -12.630 11.782 3.381 1.00 0.00 H new ATOM 0 HA ASP A 32 -13.958 13.769 1.725 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -11.113 13.298 2.762 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -11.519 14.708 1.804 1.00 0.00 H new ATOM 556 N ALA A 33 -11.793 11.777 0.207 1.00 0.00 N ATOM 557 CA ALA A 33 -11.386 11.374 -1.184 1.00 0.00 C ATOM 558 C ALA A 33 -12.568 10.679 -1.869 1.00 0.00 C ATOM 559 O ALA A 33 -12.851 10.928 -3.027 1.00 0.00 O ATOM 560 CB ALA A 33 -10.202 10.406 -1.045 1.00 0.00 C ATOM 0 H ALA A 33 -11.386 11.226 0.962 1.00 0.00 H new ATOM 0 HA ALA A 33 -11.100 12.237 -1.785 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -9.874 10.088 -2.035 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -9.380 10.908 -0.534 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -10.510 9.535 -0.467 1.00 0.00 H new ATOM 566 N GLN A 34 -13.276 9.820 -1.160 1.00 0.00 N ATOM 567 CA GLN A 34 -14.457 9.131 -1.790 1.00 0.00 C ATOM 568 C GLN A 34 -15.525 10.171 -2.181 1.00 0.00 C ATOM 569 O GLN A 34 -16.208 10.008 -3.175 1.00 0.00 O ATOM 570 CB GLN A 34 -15.022 8.162 -0.739 1.00 0.00 C ATOM 571 CG GLN A 34 -14.267 6.833 -0.810 1.00 0.00 C ATOM 572 CD GLN A 34 -15.212 5.688 -0.426 1.00 0.00 C ATOM 573 OE1 GLN A 34 -15.295 4.699 -1.128 1.00 0.00 O ATOM 574 NE2 GLN A 34 -15.934 5.773 0.665 1.00 0.00 N ATOM 0 H GLN A 34 -13.091 9.570 -0.189 1.00 0.00 H new ATOM 0 HA GLN A 34 -14.163 8.596 -2.693 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.926 8.594 0.257 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -16.085 7.998 -0.915 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -13.879 6.676 -1.816 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -13.410 6.853 -0.137 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -15.868 6.601 1.257 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -16.562 5.011 0.922 1.00 0.00 H new ATOM 583 N LYS A 35 -15.679 11.239 -1.415 1.00 0.00 N ATOM 584 CA LYS A 35 -16.713 12.273 -1.777 1.00 0.00 C ATOM 585 C LYS A 35 -16.149 13.274 -2.803 1.00 0.00 C ATOM 586 O LYS A 35 -16.876 13.772 -3.641 1.00 0.00 O ATOM 587 CB LYS A 35 -17.081 12.997 -0.474 1.00 0.00 C ATOM 588 CG LYS A 35 -17.917 12.066 0.408 1.00 0.00 C ATOM 589 CD LYS A 35 -19.382 12.127 -0.031 1.00 0.00 C ATOM 590 CE LYS A 35 -20.228 11.245 0.889 1.00 0.00 C ATOM 591 NZ LYS A 35 -21.453 10.932 0.102 1.00 0.00 N ATOM 0 H LYS A 35 -15.142 11.435 -0.570 1.00 0.00 H new ATOM 0 HA LYS A 35 -17.587 11.806 -2.231 1.00 0.00 H new ATOM 0 HB2 LYS A 35 -16.177 13.301 0.054 1.00 0.00 H new ATOM 0 HB3 LYS A 35 -17.641 13.905 -0.696 1.00 0.00 H new ATOM 0 HG2 LYS A 35 -17.545 11.044 0.331 1.00 0.00 H new ATOM 0 HG3 LYS A 35 -17.827 12.360 1.454 1.00 0.00 H new ATOM 0 HD2 LYS A 35 -19.740 13.156 0.004 1.00 0.00 H new ATOM 0 HD3 LYS A 35 -19.478 11.791 -1.063 1.00 0.00 H new ATOM 0 HE2 LYS A 35 -19.694 10.336 1.166 1.00 0.00 H new ATOM 0 HE3 LYS A 35 -20.476 11.764 1.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 -22.084 10.329 0.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 -21.945 11.816 -0.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 -21.187 10.432 -0.770 1.00 0.00 H new ATOM 605 N ASP A 36 -14.864 13.574 -2.753 1.00 0.00 N ATOM 606 CA ASP A 36 -14.283 14.551 -3.749 1.00 0.00 C ATOM 607 C ASP A 36 -14.584 14.093 -5.188 1.00 0.00 C ATOM 608 O ASP A 36 -14.835 14.907 -6.058 1.00 0.00 O ATOM 609 CB ASP A 36 -12.763 14.573 -3.512 1.00 0.00 C ATOM 610 CG ASP A 36 -12.118 15.619 -4.424 1.00 0.00 C ATOM 611 OD1 ASP A 36 -12.142 15.422 -5.628 1.00 0.00 O ATOM 612 OD2 ASP A 36 -11.612 16.600 -3.904 1.00 0.00 O ATOM 0 H ASP A 36 -14.201 13.193 -2.078 1.00 0.00 H new ATOM 0 HA ASP A 36 -14.718 15.542 -3.620 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -12.551 14.805 -2.468 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -12.339 13.589 -3.713 1.00 0.00 H new ATOM 617 N LYS A 37 -14.564 12.798 -5.450 1.00 0.00 N ATOM 618 CA LYS A 37 -14.857 12.311 -6.852 1.00 0.00 C ATOM 619 C LYS A 37 -16.212 12.858 -7.338 1.00 0.00 C ATOM 620 O LYS A 37 -16.361 13.211 -8.493 1.00 0.00 O ATOM 621 CB LYS A 37 -14.906 10.775 -6.785 1.00 0.00 C ATOM 622 CG LYS A 37 -15.083 10.208 -8.194 1.00 0.00 C ATOM 623 CD LYS A 37 -15.787 8.851 -8.114 1.00 0.00 C ATOM 624 CE LYS A 37 -14.746 7.750 -7.895 1.00 0.00 C ATOM 625 NZ LYS A 37 -15.532 6.485 -7.839 1.00 0.00 N ATOM 0 H LYS A 37 -14.361 12.067 -4.768 1.00 0.00 H new ATOM 0 HA LYS A 37 -14.092 12.653 -7.549 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -13.989 10.390 -6.339 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -15.729 10.454 -6.146 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -15.667 10.897 -8.804 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -14.112 10.098 -8.678 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -16.509 8.851 -7.298 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -16.344 8.663 -9.032 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -14.018 7.727 -8.706 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -14.189 7.911 -6.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -14.888 5.682 -7.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -16.212 6.533 -7.053 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -16.046 6.356 -8.734 1.00 0.00 H new ATOM 639 N SER A 38 -17.205 12.937 -6.469 1.00 0.00 N ATOM 640 CA SER A 38 -18.547 13.465 -6.886 1.00 0.00 C ATOM 641 C SER A 38 -19.072 12.711 -8.121 1.00 0.00 C ATOM 642 O SER A 38 -18.548 11.676 -8.487 1.00 0.00 O ATOM 643 CB SER A 38 -18.318 14.942 -7.217 1.00 0.00 C ATOM 644 OG SER A 38 -17.508 15.530 -6.206 1.00 0.00 O ATOM 0 H SER A 38 -17.139 12.657 -5.490 1.00 0.00 H new ATOM 0 HA SER A 38 -19.292 13.334 -6.101 1.00 0.00 H new ATOM 0 HB2 SER A 38 -17.834 15.038 -8.189 1.00 0.00 H new ATOM 0 HB3 SER A 38 -19.273 15.464 -7.284 1.00 0.00 H new ATOM 0 HG SER A 38 -16.566 15.319 -6.377 1.00 0.00 H new ATOM 650 N SER A 39 -20.102 13.222 -8.768 1.00 0.00 N ATOM 651 CA SER A 39 -20.648 12.527 -9.977 1.00 0.00 C ATOM 652 C SER A 39 -20.355 13.352 -11.240 1.00 0.00 C ATOM 653 O SER A 39 -19.778 12.850 -12.187 1.00 0.00 O ATOM 654 CB SER A 39 -22.156 12.426 -9.738 1.00 0.00 C ATOM 655 OG SER A 39 -22.783 11.915 -10.907 1.00 0.00 O ATOM 0 H SER A 39 -20.582 14.084 -8.510 1.00 0.00 H new ATOM 0 HA SER A 39 -20.197 11.546 -10.126 1.00 0.00 H new ATOM 0 HB2 SER A 39 -22.358 11.774 -8.888 1.00 0.00 H new ATOM 0 HB3 SER A 39 -22.563 13.407 -9.492 1.00 0.00 H new ATOM 0 HG SER A 39 -23.749 11.847 -10.757 1.00 0.00 H new ATOM 661 N LYS A 40 -20.738 14.613 -11.263 1.00 0.00 N ATOM 662 CA LYS A 40 -20.465 15.455 -12.471 1.00 0.00 C ATOM 663 C LYS A 40 -19.360 16.475 -12.154 1.00 0.00 C ATOM 664 O LYS A 40 -19.621 17.656 -12.017 1.00 0.00 O ATOM 665 CB LYS A 40 -21.787 16.167 -12.781 1.00 0.00 C ATOM 666 CG LYS A 40 -22.531 15.410 -13.884 1.00 0.00 C ATOM 667 CD LYS A 40 -21.877 15.702 -15.235 1.00 0.00 C ATOM 668 CE LYS A 40 -22.519 16.945 -15.855 1.00 0.00 C ATOM 669 NZ LYS A 40 -21.886 17.075 -17.198 1.00 0.00 N ATOM 0 H LYS A 40 -21.223 15.088 -10.502 1.00 0.00 H new ATOM 0 HA LYS A 40 -20.124 14.862 -13.320 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -22.403 16.220 -11.883 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -21.594 17.193 -13.096 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -22.510 14.339 -13.682 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -23.579 15.711 -13.903 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -20.806 15.859 -15.106 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -21.996 14.847 -15.901 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -23.600 16.832 -15.937 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -22.337 17.830 -15.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -22.275 17.907 -17.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -20.858 17.188 -17.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -22.082 16.221 -17.758 1.00 0.00 H new ATOM 683 N LEU A 41 -18.124 16.030 -12.031 1.00 0.00 N ATOM 684 CA LEU A 41 -17.012 16.983 -11.717 1.00 0.00 C ATOM 685 C LEU A 41 -15.644 16.325 -11.971 1.00 0.00 C ATOM 686 O LEU A 41 -15.099 15.670 -11.101 1.00 0.00 O ATOM 687 CB LEU A 41 -17.182 17.304 -10.231 1.00 0.00 C ATOM 688 CG LEU A 41 -16.464 18.614 -9.904 1.00 0.00 C ATOM 689 CD1 LEU A 41 -17.454 19.776 -10.001 1.00 0.00 C ATOM 690 CD2 LEU A 41 -15.899 18.544 -8.482 1.00 0.00 C ATOM 0 H LEU A 41 -17.844 15.055 -12.134 1.00 0.00 H new ATOM 0 HA LEU A 41 -17.049 17.876 -12.341 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -18.241 17.387 -9.985 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -16.776 16.494 -9.625 1.00 0.00 H new ATOM 0 HG LEU A 41 -15.650 18.769 -10.612 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -16.943 20.710 -9.768 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -17.858 19.826 -11.012 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -18.267 19.621 -9.292 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -15.387 19.477 -8.248 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -16.713 18.389 -7.774 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -15.194 17.716 -8.411 1.00 0.00 H new ATOM 702 N ALA A 42 -15.083 16.492 -13.152 1.00 0.00 N ATOM 703 CA ALA A 42 -13.751 15.867 -13.439 1.00 0.00 C ATOM 704 C ALA A 42 -12.636 16.921 -13.356 1.00 0.00 C ATOM 705 O ALA A 42 -12.489 17.745 -14.239 1.00 0.00 O ATOM 706 CB ALA A 42 -13.849 15.304 -14.861 1.00 0.00 C ATOM 0 H ALA A 42 -15.487 17.029 -13.920 1.00 0.00 H new ATOM 0 HA ALA A 42 -13.511 15.088 -12.716 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -12.904 14.832 -15.132 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -14.649 14.565 -14.905 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -14.063 16.113 -15.559 1.00 0.00 H new ATOM 712 N ALA A 43 -11.847 16.904 -12.300 1.00 0.00 N ATOM 713 CA ALA A 43 -10.743 17.911 -12.169 1.00 0.00 C ATOM 714 C ALA A 43 -9.797 17.534 -11.013 1.00 0.00 C ATOM 715 O ALA A 43 -10.168 17.614 -9.857 1.00 0.00 O ATOM 716 CB ALA A 43 -11.448 19.235 -11.871 1.00 0.00 C ATOM 0 H ALA A 43 -11.921 16.240 -11.530 1.00 0.00 H new ATOM 0 HA ALA A 43 -10.131 17.964 -13.070 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -10.706 20.026 -11.761 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -12.122 19.481 -12.692 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -12.020 19.143 -10.948 1.00 0.00 H new ATOM 722 N LYS A 44 -8.579 17.117 -11.310 1.00 0.00 N ATOM 723 CA LYS A 44 -7.619 16.731 -10.221 1.00 0.00 C ATOM 724 C LYS A 44 -8.259 15.690 -9.285 1.00 0.00 C ATOM 725 O LYS A 44 -8.111 15.764 -8.080 1.00 0.00 O ATOM 726 CB LYS A 44 -7.318 18.027 -9.462 1.00 0.00 C ATOM 727 CG LYS A 44 -6.199 18.789 -10.176 1.00 0.00 C ATOM 728 CD LYS A 44 -6.426 20.294 -10.020 1.00 0.00 C ATOM 729 CE LYS A 44 -6.139 20.707 -8.574 1.00 0.00 C ATOM 730 NZ LYS A 44 -6.916 21.962 -8.373 1.00 0.00 N ATOM 0 H LYS A 44 -8.213 17.029 -12.258 1.00 0.00 H new ATOM 0 HA LYS A 44 -6.711 16.280 -10.621 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -8.214 18.645 -9.406 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -7.022 17.801 -8.438 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -5.231 18.511 -9.758 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -6.179 18.521 -11.232 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -5.777 20.843 -10.702 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -7.453 20.547 -10.285 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -6.450 19.933 -7.873 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -5.073 20.872 -8.414 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -6.771 22.309 -7.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -6.593 22.682 -9.050 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -7.927 21.772 -8.525 1.00 0.00 H new ATOM 744 N SER A 45 -8.970 14.722 -9.830 1.00 0.00 N ATOM 745 CA SER A 45 -9.615 13.683 -8.955 1.00 0.00 C ATOM 746 C SER A 45 -8.728 12.430 -8.847 1.00 0.00 C ATOM 747 O SER A 45 -8.673 11.802 -7.807 1.00 0.00 O ATOM 748 CB SER A 45 -10.950 13.337 -9.622 1.00 0.00 C ATOM 749 OG SER A 45 -11.324 12.013 -9.267 1.00 0.00 O ATOM 0 H SER A 45 -9.129 14.608 -10.831 1.00 0.00 H new ATOM 0 HA SER A 45 -9.758 14.057 -7.941 1.00 0.00 H new ATOM 0 HB2 SER A 45 -11.720 14.041 -9.307 1.00 0.00 H new ATOM 0 HB3 SER A 45 -10.862 13.424 -10.705 1.00 0.00 H new ATOM 0 HG SER A 45 -12.179 11.790 -9.691 1.00 0.00 H new ATOM 755 N ASN A 46 -8.030 12.057 -9.904 1.00 0.00 N ATOM 756 CA ASN A 46 -7.149 10.833 -9.826 1.00 0.00 C ATOM 757 C ASN A 46 -6.150 10.973 -8.664 1.00 0.00 C ATOM 758 O ASN A 46 -5.874 10.015 -7.965 1.00 0.00 O ATOM 759 CB ASN A 46 -6.392 10.745 -11.162 1.00 0.00 C ATOM 760 CG ASN A 46 -7.314 10.154 -12.235 1.00 0.00 C ATOM 761 OD1 ASN A 46 -7.794 9.046 -12.090 1.00 0.00 O ATOM 762 ND2 ASN A 46 -7.587 10.844 -13.315 1.00 0.00 N ATOM 0 H ASN A 46 -8.031 12.538 -10.804 1.00 0.00 H new ATOM 0 HA ASN A 46 -7.742 9.936 -9.650 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -6.052 11.735 -11.465 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -5.504 10.124 -11.048 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -8.200 10.451 -14.030 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -7.187 11.774 -13.441 1.00 0.00 H new ATOM 769 N GLU A 47 -5.612 12.157 -8.445 1.00 0.00 N ATOM 770 CA GLU A 47 -4.636 12.330 -7.310 1.00 0.00 C ATOM 771 C GLU A 47 -5.337 12.035 -5.976 1.00 0.00 C ATOM 772 O GLU A 47 -4.774 11.390 -5.110 1.00 0.00 O ATOM 773 CB GLU A 47 -4.164 13.793 -7.347 1.00 0.00 C ATOM 774 CG GLU A 47 -3.364 14.037 -8.627 1.00 0.00 C ATOM 775 CD GLU A 47 -2.356 15.163 -8.395 1.00 0.00 C ATOM 776 OE1 GLU A 47 -1.480 14.985 -7.564 1.00 0.00 O ATOM 777 OE2 GLU A 47 -2.478 16.186 -9.048 1.00 0.00 O ATOM 0 H GLU A 47 -5.802 12.997 -8.992 1.00 0.00 H new ATOM 0 HA GLU A 47 -3.792 11.647 -7.407 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -5.022 14.464 -7.308 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -3.549 14.010 -6.474 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -2.845 13.125 -8.923 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -4.036 14.300 -9.444 1.00 0.00 H new ATOM 784 N GLN A 48 -6.563 12.492 -5.800 1.00 0.00 N ATOM 785 CA GLN A 48 -7.280 12.212 -4.505 1.00 0.00 C ATOM 786 C GLN A 48 -7.457 10.697 -4.329 1.00 0.00 C ATOM 787 O GLN A 48 -7.295 10.177 -3.240 1.00 0.00 O ATOM 788 CB GLN A 48 -8.654 12.895 -4.596 1.00 0.00 C ATOM 789 CG GLN A 48 -9.239 13.064 -3.191 1.00 0.00 C ATOM 790 CD GLN A 48 -8.346 13.998 -2.364 1.00 0.00 C ATOM 791 OE1 GLN A 48 -8.053 15.100 -2.784 1.00 0.00 O ATOM 792 NE2 GLN A 48 -7.898 13.606 -1.196 1.00 0.00 N ATOM 0 H GLN A 48 -7.089 13.037 -6.483 1.00 0.00 H new ATOM 0 HA GLN A 48 -6.715 12.590 -3.653 1.00 0.00 H new ATOM 0 HB2 GLN A 48 -8.557 13.867 -5.079 1.00 0.00 H new ATOM 0 HB3 GLN A 48 -9.327 12.299 -5.212 1.00 0.00 H new ATOM 0 HG2 GLN A 48 -10.248 13.472 -3.254 1.00 0.00 H new ATOM 0 HG3 GLN A 48 -9.318 12.094 -2.701 1.00 0.00 H new ATOM 0 HE21 GLN A 48 -8.142 12.682 -0.840 1.00 0.00 H new ATOM 0 HE22 GLN A 48 -7.306 14.225 -0.643 1.00 0.00 H new ATOM 801 N LEU A 49 -7.784 9.979 -5.387 1.00 0.00 N ATOM 802 CA LEU A 49 -7.959 8.487 -5.250 1.00 0.00 C ATOM 803 C LEU A 49 -6.661 7.852 -4.730 1.00 0.00 C ATOM 804 O LEU A 49 -6.698 6.952 -3.912 1.00 0.00 O ATOM 805 CB LEU A 49 -8.294 7.943 -6.649 1.00 0.00 C ATOM 806 CG LEU A 49 -9.812 7.951 -6.853 1.00 0.00 C ATOM 807 CD1 LEU A 49 -10.136 7.513 -8.282 1.00 0.00 C ATOM 808 CD2 LEU A 49 -10.467 6.983 -5.864 1.00 0.00 C ATOM 0 H LEU A 49 -7.935 10.353 -6.324 1.00 0.00 H new ATOM 0 HA LEU A 49 -8.754 8.250 -4.543 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -7.811 8.553 -7.413 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -7.907 6.930 -6.758 1.00 0.00 H new ATOM 0 HG LEU A 49 -10.195 8.957 -6.684 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -11.216 7.518 -8.428 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -9.671 8.201 -8.988 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -9.752 6.507 -8.450 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -11.547 6.989 -6.010 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -10.084 5.976 -6.032 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -10.237 7.293 -4.845 1.00 0.00 H new ATOM 820 N TRP A 50 -5.509 8.318 -5.183 1.00 0.00 N ATOM 821 CA TRP A 50 -4.219 7.721 -4.678 1.00 0.00 C ATOM 822 C TRP A 50 -4.139 7.869 -3.152 1.00 0.00 C ATOM 823 O TRP A 50 -3.670 6.976 -2.470 1.00 0.00 O ATOM 824 CB TRP A 50 -3.069 8.478 -5.374 1.00 0.00 C ATOM 825 CG TRP A 50 -3.150 8.307 -6.872 1.00 0.00 C ATOM 826 CD1 TRP A 50 -3.878 7.363 -7.533 1.00 0.00 C ATOM 827 CD2 TRP A 50 -2.478 9.088 -7.904 1.00 0.00 C ATOM 828 NE1 TRP A 50 -3.698 7.531 -8.894 1.00 0.00 N ATOM 829 CE2 TRP A 50 -2.847 8.577 -9.171 1.00 0.00 C ATOM 830 CE3 TRP A 50 -1.595 10.182 -7.866 1.00 0.00 C ATOM 831 CZ2 TRP A 50 -2.362 9.129 -10.352 1.00 0.00 C ATOM 832 CZ3 TRP A 50 -1.101 10.738 -9.057 1.00 0.00 C ATOM 833 CH2 TRP A 50 -1.486 10.212 -10.299 1.00 0.00 C ATOM 0 H TRP A 50 -5.408 9.069 -5.865 1.00 0.00 H new ATOM 0 HA TRP A 50 -4.157 6.656 -4.903 1.00 0.00 H new ATOM 0 HB2 TRP A 50 -3.118 9.537 -5.120 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -2.110 8.107 -5.012 1.00 0.00 H new ATOM 0 HD1 TRP A 50 -4.495 6.607 -7.070 1.00 0.00 H new ATOM 0 HE1 TRP A 50 -4.142 6.951 -9.606 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -1.295 10.597 -6.915 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 -2.663 8.720 -11.305 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -0.421 11.576 -9.017 1.00 0.00 H new ATOM 0 HH2 TRP A 50 -1.105 10.645 -11.212 1.00 0.00 H new ATOM 844 N GLU A 51 -4.618 8.968 -2.600 1.00 0.00 N ATOM 845 CA GLU A 51 -4.583 9.114 -1.102 1.00 0.00 C ATOM 846 C GLU A 51 -5.409 7.988 -0.450 1.00 0.00 C ATOM 847 O GLU A 51 -5.100 7.556 0.646 1.00 0.00 O ATOM 848 CB GLU A 51 -5.195 10.484 -0.771 1.00 0.00 C ATOM 849 CG GLU A 51 -4.188 11.588 -1.100 1.00 0.00 C ATOM 850 CD GLU A 51 -4.792 12.951 -0.755 1.00 0.00 C ATOM 851 OE1 GLU A 51 -5.214 13.119 0.378 1.00 0.00 O ATOM 852 OE2 GLU A 51 -4.822 13.801 -1.628 1.00 0.00 O ATOM 0 H GLU A 51 -5.023 9.753 -3.109 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.564 9.046 -0.722 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.112 10.632 -1.342 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -5.466 10.527 0.284 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.267 11.434 -0.538 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.926 11.552 -2.157 1.00 0.00 H new ATOM 859 N ILE A 52 -6.446 7.492 -1.111 1.00 0.00 N ATOM 860 CA ILE A 52 -7.251 6.381 -0.496 1.00 0.00 C ATOM 861 C ILE A 52 -6.417 5.095 -0.517 1.00 0.00 C ATOM 862 O ILE A 52 -6.108 4.547 0.526 1.00 0.00 O ATOM 863 CB ILE A 52 -8.534 6.235 -1.338 1.00 0.00 C ATOM 864 CG1 ILE A 52 -9.321 7.558 -1.259 1.00 0.00 C ATOM 865 CG2 ILE A 52 -9.385 5.074 -0.791 1.00 0.00 C ATOM 866 CD1 ILE A 52 -10.704 7.414 -1.908 1.00 0.00 C ATOM 0 H ILE A 52 -6.760 7.804 -2.030 1.00 0.00 H new ATOM 0 HA ILE A 52 -7.515 6.589 0.541 1.00 0.00 H new ATOM 0 HB ILE A 52 -8.282 6.018 -2.376 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -9.434 7.857 -0.217 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -8.761 8.349 -1.759 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -10.291 4.974 -1.389 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -8.813 4.148 -0.842 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -9.655 5.277 0.245 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -11.239 8.361 -1.839 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -10.587 7.139 -2.956 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -11.270 6.639 -1.391 1.00 0.00 H new ATOM 878 N MET A 53 -6.021 4.613 -1.685 1.00 0.00 N ATOM 879 CA MET A 53 -5.173 3.364 -1.700 1.00 0.00 C ATOM 880 C MET A 53 -3.861 3.615 -0.930 1.00 0.00 C ATOM 881 O MET A 53 -3.310 2.702 -0.344 1.00 0.00 O ATOM 882 CB MET A 53 -4.895 2.970 -3.168 1.00 0.00 C ATOM 883 CG MET A 53 -4.267 4.131 -3.955 1.00 0.00 C ATOM 884 SD MET A 53 -5.143 4.336 -5.533 1.00 0.00 S ATOM 885 CE MET A 53 -4.765 2.706 -6.217 1.00 0.00 C ATOM 0 H MET A 53 -6.239 5.014 -2.597 1.00 0.00 H new ATOM 0 HA MET A 53 -5.696 2.544 -1.208 1.00 0.00 H new ATOM 0 HB2 MET A 53 -4.228 2.109 -3.194 1.00 0.00 H new ATOM 0 HB3 MET A 53 -5.826 2.667 -3.647 1.00 0.00 H new ATOM 0 HG2 MET A 53 -4.323 5.051 -3.373 1.00 0.00 H new ATOM 0 HG3 MET A 53 -3.211 3.932 -4.136 1.00 0.00 H new ATOM 0 HE1 MET A 53 -4.942 2.713 -7.292 1.00 0.00 H new ATOM 0 HE2 MET A 53 -3.720 2.463 -6.023 1.00 0.00 H new ATOM 0 HE3 MET A 53 -5.404 1.958 -5.748 1.00 0.00 H new ATOM 895 N GLN A 54 -3.369 4.846 -0.888 1.00 0.00 N ATOM 896 CA GLN A 54 -2.113 5.111 -0.102 1.00 0.00 C ATOM 897 C GLN A 54 -2.440 5.036 1.400 1.00 0.00 C ATOM 898 O GLN A 54 -1.669 4.505 2.176 1.00 0.00 O ATOM 899 CB GLN A 54 -1.637 6.523 -0.480 1.00 0.00 C ATOM 900 CG GLN A 54 -0.925 6.476 -1.835 1.00 0.00 C ATOM 901 CD GLN A 54 -0.485 7.890 -2.232 1.00 0.00 C ATOM 902 OE1 GLN A 54 -1.313 8.750 -2.459 1.00 0.00 O ATOM 903 NE2 GLN A 54 0.791 8.176 -2.328 1.00 0.00 N ATOM 0 H GLN A 54 -3.775 5.657 -1.354 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.335 4.379 -0.321 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -2.487 7.204 -0.527 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -0.962 6.908 0.284 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -0.059 5.816 -1.780 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -1.591 6.065 -2.593 1.00 0.00 H new ATOM 0 HE21 GLN A 54 1.490 7.458 -2.139 1.00 0.00 H new ATOM 0 HE22 GLN A 54 1.084 9.117 -2.592 1.00 0.00 H new ATOM 912 N LEU A 55 -3.591 5.544 1.818 1.00 0.00 N ATOM 913 CA LEU A 55 -3.960 5.466 3.282 1.00 0.00 C ATOM 914 C LEU A 55 -3.882 4.009 3.775 1.00 0.00 C ATOM 915 O LEU A 55 -3.537 3.758 4.914 1.00 0.00 O ATOM 916 CB LEU A 55 -5.411 5.970 3.407 1.00 0.00 C ATOM 917 CG LEU A 55 -5.426 7.481 3.646 1.00 0.00 C ATOM 918 CD1 LEU A 55 -6.846 8.019 3.436 1.00 0.00 C ATOM 919 CD2 LEU A 55 -4.981 7.773 5.082 1.00 0.00 C ATOM 0 H LEU A 55 -4.279 6.001 1.219 1.00 0.00 H new ATOM 0 HA LEU A 55 -3.276 6.066 3.882 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -5.966 5.732 2.499 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -5.912 5.459 4.230 1.00 0.00 H new ATOM 0 HG LEU A 55 -4.746 7.966 2.946 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -6.856 9.096 3.606 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -7.167 7.810 2.415 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -7.526 7.534 4.137 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -4.991 8.849 5.254 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -5.663 7.287 5.780 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -3.972 7.390 5.235 1.00 0.00 H new ATOM 931 N HIS A 56 -4.200 3.043 2.929 1.00 0.00 N ATOM 932 CA HIS A 56 -4.137 1.606 3.379 1.00 0.00 C ATOM 933 C HIS A 56 -2.726 1.264 3.889 1.00 0.00 C ATOM 934 O HIS A 56 -2.578 0.506 4.829 1.00 0.00 O ATOM 935 CB HIS A 56 -4.484 0.749 2.152 1.00 0.00 C ATOM 936 CG HIS A 56 -5.087 -0.551 2.603 1.00 0.00 C ATOM 937 ND1 HIS A 56 -6.366 -0.624 3.135 1.00 0.00 N ATOM 938 CD2 HIS A 56 -4.605 -1.834 2.611 1.00 0.00 C ATOM 939 CE1 HIS A 56 -6.607 -1.912 3.436 1.00 0.00 C ATOM 940 NE2 HIS A 56 -5.565 -2.694 3.137 1.00 0.00 N ATOM 0 H HIS A 56 -4.495 3.186 1.963 1.00 0.00 H new ATOM 0 HA HIS A 56 -4.832 1.420 4.198 1.00 0.00 H new ATOM 0 HB2 HIS A 56 -5.183 1.283 1.508 1.00 0.00 H new ATOM 0 HB3 HIS A 56 -3.587 0.561 1.561 1.00 0.00 H new ATOM 0 HD1 HIS A 56 -7.007 0.157 3.273 1.00 0.00 H new ATOM 0 HD2 HIS A 56 -3.628 -2.133 2.262 1.00 0.00 H new ATOM 0 HE1 HIS A 56 -7.530 -2.271 3.867 1.00 0.00 H new ATOM 948 N HIS A 57 -1.684 1.822 3.293 1.00 0.00 N ATOM 949 CA HIS A 57 -0.293 1.511 3.789 1.00 0.00 C ATOM 950 C HIS A 57 -0.158 1.951 5.249 1.00 0.00 C ATOM 951 O HIS A 57 0.260 1.182 6.095 1.00 0.00 O ATOM 952 CB HIS A 57 0.688 2.303 2.910 1.00 0.00 C ATOM 953 CG HIS A 57 1.090 1.469 1.727 1.00 0.00 C ATOM 954 ND1 HIS A 57 2.219 1.752 0.977 1.00 0.00 N ATOM 955 CD2 HIS A 57 0.532 0.351 1.161 1.00 0.00 C ATOM 956 CE1 HIS A 57 2.305 0.822 0.010 1.00 0.00 C ATOM 957 NE2 HIS A 57 1.303 -0.056 0.077 1.00 0.00 N ATOM 0 H HIS A 57 -1.735 2.465 2.503 1.00 0.00 H new ATOM 0 HA HIS A 57 -0.086 0.442 3.733 1.00 0.00 H new ATOM 0 HB2 HIS A 57 0.224 3.230 2.573 1.00 0.00 H new ATOM 0 HB3 HIS A 57 1.569 2.580 3.489 1.00 0.00 H new ATOM 0 HD2 HIS A 57 -0.368 -0.138 1.504 1.00 0.00 H new ATOM 0 HE1 HIS A 57 3.090 0.790 -0.731 1.00 0.00 H new ATOM 0 HE2 HIS A 57 1.138 -0.855 -0.535 1.00 0.00 H new ATOM 965 N GLN A 58 -0.525 3.179 5.560 1.00 0.00 N ATOM 966 CA GLN A 58 -0.425 3.644 6.991 1.00 0.00 C ATOM 967 C GLN A 58 -1.277 2.730 7.892 1.00 0.00 C ATOM 968 O GLN A 58 -0.899 2.440 9.012 1.00 0.00 O ATOM 969 CB GLN A 58 -0.954 5.085 7.028 1.00 0.00 C ATOM 970 CG GLN A 58 -0.678 5.696 8.404 1.00 0.00 C ATOM 971 CD GLN A 58 0.741 6.280 8.431 1.00 0.00 C ATOM 972 OE1 GLN A 58 1.677 5.601 8.804 1.00 0.00 O ATOM 973 NE2 GLN A 58 0.946 7.517 8.050 1.00 0.00 N ATOM 0 H GLN A 58 -0.883 3.869 4.899 1.00 0.00 H new ATOM 0 HA GLN A 58 0.602 3.605 7.353 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -0.473 5.680 6.251 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -2.024 5.096 6.822 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -1.408 6.476 8.620 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -0.785 4.937 9.179 1.00 0.00 H new ATOM 0 HE21 GLN A 58 0.163 8.090 7.736 1.00 0.00 H new ATOM 0 HE22 GLN A 58 1.889 7.906 8.067 1.00 0.00 H new ATOM 982 N ARG A 59 -2.415 2.256 7.411 1.00 0.00 N ATOM 983 CA ARG A 59 -3.255 1.342 8.264 1.00 0.00 C ATOM 984 C ARG A 59 -2.520 0.006 8.447 1.00 0.00 C ATOM 985 O ARG A 59 -2.368 -0.469 9.557 1.00 0.00 O ATOM 986 CB ARG A 59 -4.586 1.125 7.521 1.00 0.00 C ATOM 987 CG ARG A 59 -5.732 1.076 8.533 1.00 0.00 C ATOM 988 CD ARG A 59 -6.179 2.501 8.865 1.00 0.00 C ATOM 989 NE ARG A 59 -7.667 2.421 8.990 1.00 0.00 N ATOM 990 CZ ARG A 59 -8.437 2.223 7.932 1.00 0.00 C ATOM 991 NH1 ARG A 59 -7.927 2.088 6.728 1.00 0.00 N ATOM 992 NH2 ARG A 59 -9.735 2.160 8.080 1.00 0.00 N ATOM 0 H ARG A 59 -2.790 2.459 6.484 1.00 0.00 H new ATOM 0 HA ARG A 59 -3.437 1.770 9.250 1.00 0.00 H new ATOM 0 HB2 ARG A 59 -4.752 1.931 6.806 1.00 0.00 H new ATOM 0 HB3 ARG A 59 -4.550 0.197 6.951 1.00 0.00 H new ATOM 0 HG2 ARG A 59 -6.567 0.507 8.125 1.00 0.00 H new ATOM 0 HG3 ARG A 59 -5.409 0.564 9.440 1.00 0.00 H new ATOM 0 HD2 ARG A 59 -5.724 2.852 9.791 1.00 0.00 H new ATOM 0 HD3 ARG A 59 -5.886 3.199 8.081 1.00 0.00 H new ATOM 0 HE ARG A 59 -8.097 2.521 9.909 1.00 0.00 H new ATOM 0 HH11 ARG A 59 -6.917 2.135 6.594 1.00 0.00 H new ATOM 0 HH12 ARG A 59 -8.541 1.936 5.928 1.00 0.00 H new ATOM 0 HH21 ARG A 59 -10.148 2.263 9.007 1.00 0.00 H new ATOM 0 HH22 ARG A 59 -10.334 2.008 7.269 1.00 0.00 H new ATOM 1006 N SER A 60 -2.044 -0.599 7.372 1.00 0.00 N ATOM 1007 CA SER A 60 -1.301 -1.897 7.521 1.00 0.00 C ATOM 1008 C SER A 60 -0.043 -1.668 8.365 1.00 0.00 C ATOM 1009 O SER A 60 0.304 -2.492 9.179 1.00 0.00 O ATOM 1010 CB SER A 60 -0.920 -2.366 6.108 1.00 0.00 C ATOM 1011 OG SER A 60 0.189 -1.606 5.646 1.00 0.00 O ATOM 0 H SER A 60 -2.137 -0.255 6.416 1.00 0.00 H new ATOM 0 HA SER A 60 -1.912 -2.650 8.018 1.00 0.00 H new ATOM 0 HB2 SER A 60 -0.670 -3.427 6.119 1.00 0.00 H new ATOM 0 HB3 SER A 60 -1.766 -2.245 5.431 1.00 0.00 H new ATOM 0 HG SER A 60 0.003 -0.651 5.763 1.00 0.00 H new ATOM 1017 N ARG A 61 0.637 -0.549 8.195 1.00 0.00 N ATOM 1018 CA ARG A 61 1.865 -0.300 9.033 1.00 0.00 C ATOM 1019 C ARG A 61 1.456 -0.162 10.510 1.00 0.00 C ATOM 1020 O ARG A 61 2.147 -0.637 11.390 1.00 0.00 O ATOM 1021 CB ARG A 61 2.494 1.010 8.528 1.00 0.00 C ATOM 1022 CG ARG A 61 3.835 1.236 9.231 1.00 0.00 C ATOM 1023 CD ARG A 61 4.649 2.274 8.455 1.00 0.00 C ATOM 1024 NE ARG A 61 5.691 2.744 9.419 1.00 0.00 N ATOM 1025 CZ ARG A 61 5.375 3.497 10.461 1.00 0.00 C ATOM 1026 NH1 ARG A 61 4.134 3.862 10.691 1.00 0.00 N ATOM 1027 NH2 ARG A 61 6.314 3.890 11.283 1.00 0.00 N ATOM 0 H ARG A 61 0.402 0.187 7.529 1.00 0.00 H new ATOM 0 HA ARG A 61 2.576 -1.122 8.953 1.00 0.00 H new ATOM 0 HB2 ARG A 61 2.640 0.963 7.449 1.00 0.00 H new ATOM 0 HB3 ARG A 61 1.823 1.847 8.723 1.00 0.00 H new ATOM 0 HG2 ARG A 61 3.669 1.578 10.253 1.00 0.00 H new ATOM 0 HG3 ARG A 61 4.387 0.298 9.294 1.00 0.00 H new ATOM 0 HD2 ARG A 61 5.102 1.836 7.566 1.00 0.00 H new ATOM 0 HD3 ARG A 61 4.020 3.099 8.119 1.00 0.00 H new ATOM 0 HE ARG A 61 6.665 2.479 9.271 1.00 0.00 H new ATOM 0 HH11 ARG A 61 3.390 3.565 10.060 1.00 0.00 H new ATOM 0 HH12 ARG A 61 3.915 4.443 11.501 1.00 0.00 H new ATOM 0 HH21 ARG A 61 7.283 3.616 11.119 1.00 0.00 H new ATOM 0 HH22 ARG A 61 6.077 4.470 12.088 1.00 0.00 H new ATOM 1041 N TYR A 62 0.331 0.473 10.790 1.00 0.00 N ATOM 1042 CA TYR A 62 -0.110 0.617 12.226 1.00 0.00 C ATOM 1043 C TYR A 62 -0.296 -0.779 12.845 1.00 0.00 C ATOM 1044 O TYR A 62 0.217 -1.059 13.915 1.00 0.00 O ATOM 1045 CB TYR A 62 -1.450 1.376 12.197 1.00 0.00 C ATOM 1046 CG TYR A 62 -1.965 1.573 13.603 1.00 0.00 C ATOM 1047 CD1 TYR A 62 -2.639 0.532 14.251 1.00 0.00 C ATOM 1048 CD2 TYR A 62 -1.776 2.798 14.253 1.00 0.00 C ATOM 1049 CE1 TYR A 62 -3.126 0.714 15.551 1.00 0.00 C ATOM 1050 CE2 TYR A 62 -2.260 2.981 15.554 1.00 0.00 C ATOM 1051 CZ TYR A 62 -2.935 1.939 16.203 1.00 0.00 C ATOM 1052 OH TYR A 62 -3.413 2.122 17.484 1.00 0.00 O ATOM 0 H TYR A 62 -0.291 0.891 10.098 1.00 0.00 H new ATOM 0 HA TYR A 62 0.626 1.154 12.824 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -1.319 2.343 11.711 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -2.180 0.819 11.609 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -2.784 -0.413 13.748 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -1.257 3.602 13.751 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -3.648 -0.089 16.050 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -2.113 3.925 16.057 1.00 0.00 H new ATOM 0 HH TYR A 62 -2.665 2.107 18.117 1.00 0.00 H new ATOM 1062 N ILE A 63 -1.005 -1.665 12.172 1.00 0.00 N ATOM 1063 CA ILE A 63 -1.192 -3.047 12.736 1.00 0.00 C ATOM 1064 C ILE A 63 0.105 -3.847 12.532 1.00 0.00 C ATOM 1065 O ILE A 63 0.575 -4.519 13.430 1.00 0.00 O ATOM 1066 CB ILE A 63 -2.355 -3.685 11.959 1.00 0.00 C ATOM 1067 CG1 ILE A 63 -3.624 -2.855 12.172 1.00 0.00 C ATOM 1068 CG2 ILE A 63 -2.593 -5.108 12.464 1.00 0.00 C ATOM 1069 CD1 ILE A 63 -4.725 -3.355 11.236 1.00 0.00 C ATOM 0 H ILE A 63 -1.455 -1.494 11.272 1.00 0.00 H new ATOM 0 HA ILE A 63 -1.415 -3.029 13.803 1.00 0.00 H new ATOM 0 HB ILE A 63 -2.107 -3.713 10.898 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -3.951 -2.931 13.209 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -3.419 -1.802 11.979 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -3.418 -5.557 11.911 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -1.691 -5.702 12.316 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -2.840 -5.081 13.525 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -5.628 -2.764 11.388 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -4.396 -3.256 10.202 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -4.937 -4.403 11.450 1.00 0.00 H new ATOM 1081 N TYR A 64 0.698 -3.760 11.360 1.00 0.00 N ATOM 1082 CA TYR A 64 1.986 -4.501 11.109 1.00 0.00 C ATOM 1083 C TYR A 64 3.065 -4.054 12.111 1.00 0.00 C ATOM 1084 O TYR A 64 3.978 -4.800 12.400 1.00 0.00 O ATOM 1085 CB TYR A 64 2.425 -4.146 9.678 1.00 0.00 C ATOM 1086 CG TYR A 64 3.579 -5.024 9.265 1.00 0.00 C ATOM 1087 CD1 TYR A 64 3.402 -6.406 9.173 1.00 0.00 C ATOM 1088 CD2 TYR A 64 4.824 -4.456 8.968 1.00 0.00 C ATOM 1089 CE1 TYR A 64 4.464 -7.224 8.786 1.00 0.00 C ATOM 1090 CE2 TYR A 64 5.890 -5.275 8.578 1.00 0.00 C ATOM 1091 CZ TYR A 64 5.710 -6.660 8.486 1.00 0.00 C ATOM 1092 OH TYR A 64 6.761 -7.469 8.102 1.00 0.00 O ATOM 0 H TYR A 64 0.351 -3.214 10.572 1.00 0.00 H new ATOM 0 HA TYR A 64 1.846 -5.575 11.228 1.00 0.00 H new ATOM 0 HB2 TYR A 64 1.591 -4.278 8.989 1.00 0.00 H new ATOM 0 HB3 TYR A 64 2.718 -3.097 9.627 1.00 0.00 H new ATOM 0 HD1 TYR A 64 2.441 -6.843 9.402 1.00 0.00 H new ATOM 0 HD2 TYR A 64 4.962 -3.387 9.040 1.00 0.00 H new ATOM 0 HE1 TYR A 64 4.325 -8.293 8.718 1.00 0.00 H new ATOM 0 HE2 TYR A 64 6.851 -4.839 8.348 1.00 0.00 H new ATOM 0 HH TYR A 64 7.553 -6.917 7.930 1.00 0.00 H new ATOM 1102 N THR A 65 2.981 -2.851 12.647 1.00 0.00 N ATOM 1103 CA THR A 65 4.027 -2.410 13.628 1.00 0.00 C ATOM 1104 C THR A 65 3.646 -2.849 15.049 1.00 0.00 C ATOM 1105 O THR A 65 4.507 -3.186 15.838 1.00 0.00 O ATOM 1106 CB THR A 65 4.094 -0.877 13.536 1.00 0.00 C ATOM 1107 OG1 THR A 65 4.387 -0.498 12.198 1.00 0.00 O ATOM 1108 CG2 THR A 65 5.189 -0.350 14.467 1.00 0.00 C ATOM 0 H THR A 65 2.247 -2.170 12.451 1.00 0.00 H new ATOM 0 HA THR A 65 4.994 -2.858 13.401 1.00 0.00 H new ATOM 0 HB THR A 65 3.135 -0.455 13.835 1.00 0.00 H new ATOM 0 HG1 THR A 65 3.568 -0.186 11.760 1.00 0.00 H new ATOM 0 HG21 THR A 65 5.233 0.737 14.398 1.00 0.00 H new ATOM 0 HG22 THR A 65 4.965 -0.640 15.493 1.00 0.00 H new ATOM 0 HG23 THR A 65 6.150 -0.771 14.173 1.00 0.00 H new ATOM 1116 N LEU A 66 2.373 -2.837 15.401 1.00 0.00 N ATOM 1117 CA LEU A 66 2.001 -3.251 16.798 1.00 0.00 C ATOM 1118 C LEU A 66 1.893 -4.787 16.947 1.00 0.00 C ATOM 1119 O LEU A 66 2.184 -5.318 18.003 1.00 0.00 O ATOM 1120 CB LEU A 66 0.664 -2.549 17.134 1.00 0.00 C ATOM 1121 CG LEU A 66 -0.504 -3.155 16.341 1.00 0.00 C ATOM 1122 CD1 LEU A 66 -1.062 -4.376 17.087 1.00 0.00 C ATOM 1123 CD2 LEU A 66 -1.610 -2.100 16.185 1.00 0.00 C ATOM 0 H LEU A 66 1.596 -2.566 14.798 1.00 0.00 H new ATOM 0 HA LEU A 66 2.781 -2.951 17.497 1.00 0.00 H new ATOM 0 HB2 LEU A 66 0.464 -2.636 18.202 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.744 -1.485 16.910 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.151 -3.467 15.358 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -1.890 -4.802 16.520 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -0.277 -5.124 17.199 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -1.416 -4.070 18.072 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -2.442 -2.525 15.623 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -1.959 -1.790 17.170 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.215 -1.235 15.651 1.00 0.00 H new ATOM 1135 N TYR A 67 1.469 -5.508 15.923 1.00 0.00 N ATOM 1136 CA TYR A 67 1.346 -7.008 16.071 1.00 0.00 C ATOM 1137 C TYR A 67 2.675 -7.728 15.763 1.00 0.00 C ATOM 1138 O TYR A 67 2.965 -8.750 16.356 1.00 0.00 O ATOM 1139 CB TYR A 67 0.248 -7.462 15.084 1.00 0.00 C ATOM 1140 CG TYR A 67 0.069 -8.970 15.168 1.00 0.00 C ATOM 1141 CD1 TYR A 67 0.952 -9.815 14.484 1.00 0.00 C ATOM 1142 CD2 TYR A 67 -0.969 -9.521 15.936 1.00 0.00 C ATOM 1143 CE1 TYR A 67 0.800 -11.205 14.567 1.00 0.00 C ATOM 1144 CE2 TYR A 67 -1.122 -10.912 16.017 1.00 0.00 C ATOM 1145 CZ TYR A 67 -0.236 -11.753 15.333 1.00 0.00 C ATOM 1146 OH TYR A 67 -0.384 -13.123 15.413 1.00 0.00 O ATOM 0 H TYR A 67 1.208 -5.134 15.011 1.00 0.00 H new ATOM 0 HA TYR A 67 1.091 -7.262 17.100 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.692 -6.962 15.317 1.00 0.00 H new ATOM 0 HB3 TYR A 67 0.519 -7.175 14.068 1.00 0.00 H new ATOM 0 HD1 TYR A 67 1.751 -9.394 13.892 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.651 -8.872 16.465 1.00 0.00 H new ATOM 0 HE1 TYR A 67 1.483 -11.855 14.040 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -1.922 -11.334 16.606 1.00 0.00 H new ATOM 0 HH TYR A 67 -1.150 -13.336 15.985 1.00 0.00 H new ATOM 1156 N TYR A 68 3.467 -7.239 14.829 1.00 0.00 N ATOM 1157 CA TYR A 68 4.747 -7.965 14.498 1.00 0.00 C ATOM 1158 C TYR A 68 5.974 -7.390 15.236 1.00 0.00 C ATOM 1159 O TYR A 68 6.965 -8.082 15.389 1.00 0.00 O ATOM 1160 CB TYR A 68 4.921 -7.837 12.978 1.00 0.00 C ATOM 1161 CG TYR A 68 4.175 -8.955 12.284 1.00 0.00 C ATOM 1162 CD1 TYR A 68 4.545 -10.286 12.512 1.00 0.00 C ATOM 1163 CD2 TYR A 68 3.116 -8.661 11.410 1.00 0.00 C ATOM 1164 CE1 TYR A 68 3.859 -11.323 11.868 1.00 0.00 C ATOM 1165 CE2 TYR A 68 2.432 -9.700 10.768 1.00 0.00 C ATOM 1166 CZ TYR A 68 2.803 -11.030 10.996 1.00 0.00 C ATOM 1167 OH TYR A 68 2.128 -12.053 10.363 1.00 0.00 O ATOM 0 H TYR A 68 3.290 -6.390 14.293 1.00 0.00 H new ATOM 0 HA TYR A 68 4.681 -9.004 14.822 1.00 0.00 H new ATOM 0 HB2 TYR A 68 4.546 -6.871 12.639 1.00 0.00 H new ATOM 0 HB3 TYR A 68 5.979 -7.877 12.719 1.00 0.00 H new ATOM 0 HD1 TYR A 68 5.359 -10.513 13.184 1.00 0.00 H new ATOM 0 HD2 TYR A 68 2.830 -7.635 11.233 1.00 0.00 H new ATOM 0 HE1 TYR A 68 4.144 -12.350 12.044 1.00 0.00 H new ATOM 0 HE2 TYR A 68 1.617 -9.475 10.096 1.00 0.00 H new ATOM 0 HH TYR A 68 1.424 -11.678 9.794 1.00 0.00 H new ATOM 1177 N LYS A 69 5.944 -6.152 15.692 1.00 0.00 N ATOM 1178 CA LYS A 69 7.147 -5.599 16.403 1.00 0.00 C ATOM 1179 C LYS A 69 6.843 -5.354 17.891 1.00 0.00 C ATOM 1180 O LYS A 69 7.510 -5.893 18.754 1.00 0.00 O ATOM 1181 CB LYS A 69 7.477 -4.272 15.714 1.00 0.00 C ATOM 1182 CG LYS A 69 7.696 -4.485 14.213 1.00 0.00 C ATOM 1183 CD LYS A 69 7.442 -3.168 13.475 1.00 0.00 C ATOM 1184 CE LYS A 69 8.773 -2.454 13.225 1.00 0.00 C ATOM 1185 NZ LYS A 69 8.434 -1.004 13.218 1.00 0.00 N ATOM 0 H LYS A 69 5.154 -5.513 15.604 1.00 0.00 H new ATOM 0 HA LYS A 69 7.981 -6.300 16.356 1.00 0.00 H new ATOM 0 HB2 LYS A 69 6.665 -3.562 15.872 1.00 0.00 H new ATOM 0 HB3 LYS A 69 8.372 -3.837 16.160 1.00 0.00 H new ATOM 0 HG2 LYS A 69 8.713 -4.829 14.027 1.00 0.00 H new ATOM 0 HG3 LYS A 69 7.024 -5.259 13.842 1.00 0.00 H new ATOM 0 HD2 LYS A 69 6.938 -3.362 12.528 1.00 0.00 H new ATOM 0 HD3 LYS A 69 6.781 -2.531 14.063 1.00 0.00 H new ATOM 0 HE2 LYS A 69 9.499 -2.686 14.004 1.00 0.00 H new ATOM 0 HE3 LYS A 69 9.214 -2.761 12.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 9.230 -0.463 12.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 7.587 -0.848 12.636 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 8.249 -0.686 14.191 1.00 0.00 H new ATOM 1199 N ARG A 70 5.851 -4.542 18.203 1.00 0.00 N ATOM 1200 CA ARG A 70 5.537 -4.276 19.655 1.00 0.00 C ATOM 1201 C ARG A 70 4.896 -5.511 20.314 1.00 0.00 C ATOM 1202 O ARG A 70 5.040 -5.717 21.504 1.00 0.00 O ATOM 1203 CB ARG A 70 4.555 -3.094 19.689 1.00 0.00 C ATOM 1204 CG ARG A 70 5.190 -1.876 19.010 1.00 0.00 C ATOM 1205 CD ARG A 70 5.822 -0.971 20.070 1.00 0.00 C ATOM 1206 NE ARG A 70 4.738 -0.018 20.459 1.00 0.00 N ATOM 1207 CZ ARG A 70 4.377 0.976 19.661 1.00 0.00 C ATOM 1208 NH1 ARG A 70 4.956 1.165 18.497 1.00 0.00 N ATOM 1209 NH2 ARG A 70 3.423 1.790 20.034 1.00 0.00 N ATOM 0 H ARG A 70 5.255 -4.060 17.530 1.00 0.00 H new ATOM 0 HA ARG A 70 6.450 -4.050 20.207 1.00 0.00 H new ATOM 0 HB2 ARG A 70 3.629 -3.364 19.182 1.00 0.00 H new ATOM 0 HB3 ARG A 70 4.296 -2.854 20.720 1.00 0.00 H new ATOM 0 HG2 ARG A 70 5.946 -2.199 18.295 1.00 0.00 H new ATOM 0 HG3 ARG A 70 4.435 -1.325 18.449 1.00 0.00 H new ATOM 0 HD2 ARG A 70 6.167 -1.549 20.928 1.00 0.00 H new ATOM 0 HD3 ARG A 70 6.689 -0.443 19.672 1.00 0.00 H new ATOM 0 HE ARG A 70 4.267 -0.135 21.356 1.00 0.00 H new ATOM 0 HH11 ARG A 70 5.701 0.539 18.190 1.00 0.00 H new ATOM 0 HH12 ARG A 70 4.661 1.937 17.900 1.00 0.00 H new ATOM 0 HH21 ARG A 70 2.962 1.657 20.934 1.00 0.00 H new ATOM 0 HH22 ARG A 70 3.140 2.557 19.425 1.00 0.00 H new ATOM 1223 N LYS A 71 4.179 -6.333 19.566 1.00 0.00 N ATOM 1224 CA LYS A 71 3.529 -7.541 20.172 1.00 0.00 C ATOM 1225 C LYS A 71 2.568 -7.113 21.292 1.00 0.00 C ATOM 1226 O LYS A 71 2.529 -7.717 22.348 1.00 0.00 O ATOM 1227 CB LYS A 71 4.673 -8.409 20.727 1.00 0.00 C ATOM 1228 CG LYS A 71 4.724 -9.743 19.976 1.00 0.00 C ATOM 1229 CD LYS A 71 6.076 -10.416 20.221 1.00 0.00 C ATOM 1230 CE LYS A 71 5.994 -11.288 21.476 1.00 0.00 C ATOM 1231 NZ LYS A 71 6.567 -10.450 22.565 1.00 0.00 N ATOM 0 H LYS A 71 4.020 -6.215 18.565 1.00 0.00 H new ATOM 0 HA LYS A 71 2.941 -8.096 19.441 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.623 -7.885 20.621 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.523 -8.586 21.792 1.00 0.00 H new ATOM 0 HG2 LYS A 71 3.916 -10.393 20.312 1.00 0.00 H new ATOM 0 HG3 LYS A 71 4.576 -9.577 18.909 1.00 0.00 H new ATOM 0 HD2 LYS A 71 6.352 -11.025 19.360 1.00 0.00 H new ATOM 0 HD3 LYS A 71 6.853 -9.661 20.340 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.964 -11.569 21.695 1.00 0.00 H new ATOM 0 HE3 LYS A 71 6.557 -12.213 21.352 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 5.970 -10.527 23.413 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 7.528 -10.780 22.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 6.604 -9.458 22.256 1.00 0.00 H new ATOM 1245 N ALA A 72 1.779 -6.083 21.063 1.00 0.00 N ATOM 1246 CA ALA A 72 0.808 -5.634 22.108 1.00 0.00 C ATOM 1247 C ALA A 72 -0.629 -5.952 21.656 1.00 0.00 C ATOM 1248 O ALA A 72 -1.548 -5.204 21.932 1.00 0.00 O ATOM 1249 CB ALA A 72 1.013 -4.122 22.231 1.00 0.00 C ATOM 0 H ALA A 72 1.769 -5.539 20.200 1.00 0.00 H new ATOM 0 HA ALA A 72 0.965 -6.137 23.062 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.332 -3.722 22.982 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.042 -3.917 22.528 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.812 -3.648 21.270 1.00 0.00 H new ATOM 1255 N ILE A 73 -0.830 -7.055 20.960 1.00 0.00 N ATOM 1256 CA ILE A 73 -2.205 -7.414 20.490 1.00 0.00 C ATOM 1257 C ILE A 73 -2.319 -8.942 20.330 1.00 0.00 C ATOM 1258 O ILE A 73 -1.317 -9.630 20.270 1.00 0.00 O ATOM 1259 CB ILE A 73 -2.362 -6.701 19.136 1.00 0.00 C ATOM 1260 CG1 ILE A 73 -3.736 -7.023 18.537 1.00 0.00 C ATOM 1261 CG2 ILE A 73 -1.265 -7.161 18.170 1.00 0.00 C ATOM 1262 CD1 ILE A 73 -3.948 -6.203 17.260 1.00 0.00 C ATOM 0 H ILE A 73 -0.099 -7.717 20.700 1.00 0.00 H new ATOM 0 HA ILE A 73 -2.983 -7.112 21.192 1.00 0.00 H new ATOM 0 HB ILE A 73 -2.276 -5.626 19.292 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -3.805 -8.087 18.313 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -4.520 -6.798 19.260 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -1.384 -6.651 17.214 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -0.288 -6.922 18.589 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -1.342 -8.238 18.019 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -4.926 -6.434 16.837 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -3.898 -5.140 17.497 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -3.172 -6.450 16.536 1.00 0.00 H new ATOM 1274 N SER A 74 -3.517 -9.480 20.264 1.00 0.00 N ATOM 1275 CA SER A 74 -3.655 -10.963 20.110 1.00 0.00 C ATOM 1276 C SER A 74 -4.122 -11.313 18.689 1.00 0.00 C ATOM 1277 O SER A 74 -4.866 -10.568 18.080 1.00 0.00 O ATOM 1278 CB SER A 74 -4.706 -11.386 21.140 1.00 0.00 C ATOM 1279 OG SER A 74 -5.802 -10.482 21.091 1.00 0.00 O ATOM 0 H SER A 74 -4.394 -8.962 20.310 1.00 0.00 H new ATOM 0 HA SER A 74 -2.707 -11.476 20.268 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.047 -12.400 20.933 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.270 -11.394 22.139 1.00 0.00 H new ATOM 0 HG SER A 74 -6.478 -10.751 21.748 1.00 0.00 H new ATOM 1285 N LYS A 75 -3.687 -12.441 18.151 1.00 0.00 N ATOM 1286 CA LYS A 75 -4.112 -12.843 16.752 1.00 0.00 C ATOM 1287 C LYS A 75 -5.632 -12.670 16.552 1.00 0.00 C ATOM 1288 O LYS A 75 -6.075 -12.361 15.464 1.00 0.00 O ATOM 1289 CB LYS A 75 -3.734 -14.324 16.586 1.00 0.00 C ATOM 1290 CG LYS A 75 -3.483 -14.623 15.105 1.00 0.00 C ATOM 1291 CD LYS A 75 -4.790 -15.067 14.444 1.00 0.00 C ATOM 1292 CE LYS A 75 -4.720 -14.790 12.940 1.00 0.00 C ATOM 1293 NZ LYS A 75 -5.652 -15.775 12.325 1.00 0.00 N ATOM 0 H LYS A 75 -3.060 -13.098 18.615 1.00 0.00 H new ATOM 0 HA LYS A 75 -3.617 -12.212 16.014 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -2.842 -14.551 17.170 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -4.534 -14.960 16.966 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -3.094 -13.736 14.605 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -2.729 -15.403 15.004 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -4.957 -16.129 14.622 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -5.632 -14.533 14.884 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -5.020 -13.767 12.712 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -3.706 -14.917 12.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -6.094 -15.356 11.482 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -5.124 -16.628 12.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -6.390 -16.030 13.012 1.00 0.00 H new ATOM 1307 N ASP A 76 -6.437 -12.857 17.585 1.00 0.00 N ATOM 1308 CA ASP A 76 -7.922 -12.680 17.402 1.00 0.00 C ATOM 1309 C ASP A 76 -8.214 -11.228 16.998 1.00 0.00 C ATOM 1310 O ASP A 76 -8.906 -10.984 16.026 1.00 0.00 O ATOM 1311 CB ASP A 76 -8.584 -13.002 18.753 1.00 0.00 C ATOM 1312 CG ASP A 76 -8.544 -14.512 18.994 1.00 0.00 C ATOM 1313 OD1 ASP A 76 -8.827 -15.249 18.063 1.00 0.00 O ATOM 1314 OD2 ASP A 76 -8.230 -14.906 20.106 1.00 0.00 O ATOM 0 H ASP A 76 -6.137 -13.118 18.524 1.00 0.00 H new ATOM 0 HA ASP A 76 -8.309 -13.336 16.622 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -8.065 -12.481 19.558 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -9.615 -12.649 18.758 1.00 0.00 H new ATOM 1319 N LEU A 77 -7.676 -10.260 17.716 1.00 0.00 N ATOM 1320 CA LEU A 77 -7.926 -8.829 17.323 1.00 0.00 C ATOM 1321 C LEU A 77 -7.232 -8.563 15.980 1.00 0.00 C ATOM 1322 O LEU A 77 -7.803 -7.953 15.095 1.00 0.00 O ATOM 1323 CB LEU A 77 -7.323 -7.941 18.428 1.00 0.00 C ATOM 1324 CG LEU A 77 -7.541 -6.464 18.079 1.00 0.00 C ATOM 1325 CD1 LEU A 77 -9.032 -6.129 18.160 1.00 0.00 C ATOM 1326 CD2 LEU A 77 -6.765 -5.582 19.067 1.00 0.00 C ATOM 0 H LEU A 77 -7.088 -10.395 18.538 1.00 0.00 H new ATOM 0 HA LEU A 77 -8.990 -8.617 17.214 1.00 0.00 H new ATOM 0 HB2 LEU A 77 -7.788 -8.171 19.387 1.00 0.00 H new ATOM 0 HB3 LEU A 77 -6.258 -8.147 18.533 1.00 0.00 H new ATOM 0 HG LEU A 77 -7.183 -6.278 17.066 1.00 0.00 H new ATOM 0 HD11 LEU A 77 -9.183 -5.079 17.911 1.00 0.00 H new ATOM 0 HD12 LEU A 77 -9.584 -6.752 17.456 1.00 0.00 H new ATOM 0 HD13 LEU A 77 -9.393 -6.318 19.171 1.00 0.00 H new ATOM 0 HD21 LEU A 77 -6.921 -4.532 18.818 1.00 0.00 H new ATOM 0 HD22 LEU A 77 -7.120 -5.771 20.080 1.00 0.00 H new ATOM 0 HD23 LEU A 77 -5.702 -5.815 19.006 1.00 0.00 H new ATOM 1338 N TYR A 78 -6.011 -9.032 15.811 1.00 0.00 N ATOM 1339 CA TYR A 78 -5.303 -8.811 14.500 1.00 0.00 C ATOM 1340 C TYR A 78 -6.095 -9.492 13.369 1.00 0.00 C ATOM 1341 O TYR A 78 -6.222 -8.947 12.286 1.00 0.00 O ATOM 1342 CB TYR A 78 -3.896 -9.433 14.645 1.00 0.00 C ATOM 1343 CG TYR A 78 -3.123 -9.307 13.346 1.00 0.00 C ATOM 1344 CD1 TYR A 78 -3.125 -8.098 12.635 1.00 0.00 C ATOM 1345 CD2 TYR A 78 -2.397 -10.400 12.859 1.00 0.00 C ATOM 1346 CE1 TYR A 78 -2.405 -7.986 11.438 1.00 0.00 C ATOM 1347 CE2 TYR A 78 -1.677 -10.287 11.663 1.00 0.00 C ATOM 1348 CZ TYR A 78 -1.681 -9.080 10.953 1.00 0.00 C ATOM 1349 OH TYR A 78 -0.970 -8.971 9.775 1.00 0.00 O ATOM 0 H TYR A 78 -5.481 -9.550 16.512 1.00 0.00 H new ATOM 0 HA TYR A 78 -5.224 -7.752 14.255 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -3.353 -8.935 15.448 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -3.983 -10.483 14.923 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -3.682 -7.252 13.010 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -2.392 -11.331 13.406 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -2.409 -7.055 10.890 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -1.118 -11.132 11.288 1.00 0.00 H new ATOM 0 HH TYR A 78 -0.523 -9.822 9.583 1.00 0.00 H new ATOM 1359 N ASP A 79 -6.653 -10.666 13.610 1.00 0.00 N ATOM 1360 CA ASP A 79 -7.454 -11.343 12.528 1.00 0.00 C ATOM 1361 C ASP A 79 -8.780 -10.593 12.345 1.00 0.00 C ATOM 1362 O ASP A 79 -9.213 -10.356 11.232 1.00 0.00 O ATOM 1363 CB ASP A 79 -7.714 -12.783 13.001 1.00 0.00 C ATOM 1364 CG ASP A 79 -8.118 -13.648 11.805 1.00 0.00 C ATOM 1365 OD1 ASP A 79 -7.399 -13.634 10.820 1.00 0.00 O ATOM 1366 OD2 ASP A 79 -9.139 -14.308 11.895 1.00 0.00 O ATOM 0 H ASP A 79 -6.590 -11.175 14.492 1.00 0.00 H new ATOM 0 HA ASP A 79 -6.926 -11.345 11.574 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -6.819 -13.190 13.472 1.00 0.00 H new ATOM 0 HB3 ASP A 79 -8.502 -12.793 13.754 1.00 0.00 H new ATOM 1371 N TRP A 80 -9.425 -10.199 13.429 1.00 0.00 N ATOM 1372 CA TRP A 80 -10.724 -9.441 13.295 1.00 0.00 C ATOM 1373 C TRP A 80 -10.496 -8.163 12.466 1.00 0.00 C ATOM 1374 O TRP A 80 -11.340 -7.777 11.679 1.00 0.00 O ATOM 1375 CB TRP A 80 -11.169 -9.081 14.725 1.00 0.00 C ATOM 1376 CG TRP A 80 -12.480 -8.362 14.688 1.00 0.00 C ATOM 1377 CD1 TRP A 80 -13.690 -8.955 14.568 1.00 0.00 C ATOM 1378 CD2 TRP A 80 -12.733 -6.930 14.775 1.00 0.00 C ATOM 1379 NE1 TRP A 80 -14.669 -7.977 14.575 1.00 0.00 N ATOM 1380 CE2 TRP A 80 -14.128 -6.713 14.700 1.00 0.00 C ATOM 1381 CE3 TRP A 80 -11.894 -5.809 14.910 1.00 0.00 C ATOM 1382 CZ2 TRP A 80 -14.673 -5.429 14.756 1.00 0.00 C ATOM 1383 CZ3 TRP A 80 -12.438 -4.516 14.968 1.00 0.00 C ATOM 1384 CH2 TRP A 80 -13.825 -4.325 14.890 1.00 0.00 C ATOM 0 H TRP A 80 -9.114 -10.366 14.386 1.00 0.00 H new ATOM 0 HA TRP A 80 -11.485 -10.035 12.788 1.00 0.00 H new ATOM 0 HB2 TRP A 80 -11.258 -9.986 15.325 1.00 0.00 H new ATOM 0 HB3 TRP A 80 -10.415 -8.455 15.202 1.00 0.00 H new ATOM 0 HD1 TRP A 80 -13.863 -10.017 14.481 1.00 0.00 H new ATOM 0 HE1 TRP A 80 -15.668 -8.167 14.497 1.00 0.00 H new ATOM 0 HE3 TRP A 80 -10.824 -5.944 14.969 1.00 0.00 H new ATOM 0 HZ2 TRP A 80 -15.742 -5.289 14.696 1.00 0.00 H new ATOM 0 HZ3 TRP A 80 -11.784 -3.663 15.073 1.00 0.00 H new ATOM 0 HH2 TRP A 80 -14.237 -3.328 14.933 1.00 0.00 H new ATOM 1395 N LEU A 81 -9.358 -7.510 12.622 1.00 0.00 N ATOM 1396 CA LEU A 81 -9.099 -6.266 11.814 1.00 0.00 C ATOM 1397 C LEU A 81 -8.918 -6.653 10.339 1.00 0.00 C ATOM 1398 O LEU A 81 -9.493 -6.038 9.460 1.00 0.00 O ATOM 1399 CB LEU A 81 -7.805 -5.640 12.359 1.00 0.00 C ATOM 1400 CG LEU A 81 -8.003 -5.229 13.821 1.00 0.00 C ATOM 1401 CD1 LEU A 81 -6.639 -5.054 14.490 1.00 0.00 C ATOM 1402 CD2 LEU A 81 -8.768 -3.908 13.879 1.00 0.00 C ATOM 0 H LEU A 81 -8.611 -7.780 13.262 1.00 0.00 H new ATOM 0 HA LEU A 81 -9.927 -5.561 11.887 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -6.984 -6.353 12.280 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -7.531 -4.771 11.761 1.00 0.00 H new ATOM 0 HG LEU A 81 -8.569 -6.002 14.342 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -6.779 -4.761 15.531 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -6.090 -5.995 14.448 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -6.075 -4.281 13.969 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -8.909 -3.615 14.919 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -8.201 -3.136 13.358 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -9.740 -4.029 13.401 1.00 0.00 H new ATOM 1414 N ILE A 82 -8.134 -7.678 10.058 1.00 0.00 N ATOM 1415 CA ILE A 82 -7.940 -8.098 8.621 1.00 0.00 C ATOM 1416 C ILE A 82 -9.304 -8.453 7.985 1.00 0.00 C ATOM 1417 O ILE A 82 -9.505 -8.243 6.802 1.00 0.00 O ATOM 1418 CB ILE A 82 -7.006 -9.334 8.637 1.00 0.00 C ATOM 1419 CG1 ILE A 82 -5.608 -8.932 9.143 1.00 0.00 C ATOM 1420 CG2 ILE A 82 -6.878 -9.927 7.226 1.00 0.00 C ATOM 1421 CD1 ILE A 82 -5.000 -7.849 8.242 1.00 0.00 C ATOM 0 H ILE A 82 -7.628 -8.234 10.748 1.00 0.00 H new ATOM 0 HA ILE A 82 -7.502 -7.294 8.030 1.00 0.00 H new ATOM 0 HB ILE A 82 -7.437 -10.081 9.304 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.677 -8.565 10.167 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -4.957 -9.806 9.161 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -6.219 -10.794 7.254 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -7.862 -10.231 6.868 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -6.463 -9.177 6.553 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -4.012 -7.578 8.615 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -4.912 -8.230 7.224 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.644 -6.969 8.246 1.00 0.00 H new ATOM 1433 N LYS A 83 -10.241 -8.989 8.748 1.00 0.00 N ATOM 1434 CA LYS A 83 -11.577 -9.345 8.148 1.00 0.00 C ATOM 1435 C LYS A 83 -12.581 -8.169 8.212 1.00 0.00 C ATOM 1436 O LYS A 83 -13.645 -8.251 7.626 1.00 0.00 O ATOM 1437 CB LYS A 83 -12.106 -10.534 8.964 1.00 0.00 C ATOM 1438 CG LYS A 83 -11.289 -11.784 8.631 1.00 0.00 C ATOM 1439 CD LYS A 83 -11.958 -12.538 7.481 1.00 0.00 C ATOM 1440 CE LYS A 83 -10.912 -13.379 6.745 1.00 0.00 C ATOM 1441 NZ LYS A 83 -11.006 -14.733 7.359 1.00 0.00 N ATOM 0 H LYS A 83 -10.140 -9.192 9.743 1.00 0.00 H new ATOM 0 HA LYS A 83 -11.461 -9.587 7.091 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -12.039 -10.316 10.030 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -13.159 -10.704 8.739 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.273 -11.504 8.354 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -11.215 -12.427 9.508 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -12.751 -13.179 7.865 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -12.424 -11.833 6.792 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -11.116 -13.416 5.675 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -9.913 -12.960 6.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -10.318 -15.368 6.906 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -10.800 -14.668 8.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -11.966 -15.110 7.224 1.00 0.00 H new ATOM 1455 N GLU A 84 -12.276 -7.083 8.904 1.00 0.00 N ATOM 1456 CA GLU A 84 -13.253 -5.944 8.964 1.00 0.00 C ATOM 1457 C GLU A 84 -12.732 -4.692 8.218 1.00 0.00 C ATOM 1458 O GLU A 84 -13.180 -3.592 8.475 1.00 0.00 O ATOM 1459 CB GLU A 84 -13.405 -5.639 10.446 1.00 0.00 C ATOM 1460 CG GLU A 84 -14.050 -6.825 11.158 1.00 0.00 C ATOM 1461 CD GLU A 84 -15.482 -7.012 10.652 1.00 0.00 C ATOM 1462 OE1 GLU A 84 -16.202 -6.028 10.593 1.00 0.00 O ATOM 1463 OE2 GLU A 84 -15.836 -8.135 10.333 1.00 0.00 O ATOM 0 H GLU A 84 -11.407 -6.942 9.420 1.00 0.00 H new ATOM 0 HA GLU A 84 -14.194 -6.210 8.484 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -12.430 -5.427 10.884 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -14.016 -4.746 10.582 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -13.469 -7.730 10.978 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -14.053 -6.657 12.235 1.00 0.00 H new ATOM 1470 N LYS A 85 -11.794 -4.848 7.293 1.00 0.00 N ATOM 1471 CA LYS A 85 -11.233 -3.688 6.506 1.00 0.00 C ATOM 1472 C LYS A 85 -10.292 -2.835 7.360 1.00 0.00 C ATOM 1473 O LYS A 85 -10.656 -1.774 7.829 1.00 0.00 O ATOM 1474 CB LYS A 85 -12.422 -2.857 5.992 1.00 0.00 C ATOM 1475 CG LYS A 85 -12.065 -2.237 4.640 1.00 0.00 C ATOM 1476 CD LYS A 85 -13.343 -1.780 3.933 1.00 0.00 C ATOM 1477 CE LYS A 85 -13.645 -0.329 4.314 1.00 0.00 C ATOM 1478 NZ LYS A 85 -14.667 0.121 3.329 1.00 0.00 N ATOM 0 H LYS A 85 -11.388 -5.751 7.049 1.00 0.00 H new ATOM 0 HA LYS A 85 -10.639 -4.057 5.670 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -13.305 -3.489 5.893 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -12.669 -2.074 6.709 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -11.393 -1.390 4.782 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -11.536 -2.964 4.023 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -13.225 -1.867 2.853 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -14.177 -2.423 4.215 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -14.022 -0.259 5.334 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -12.748 0.288 4.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -14.926 1.109 3.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -14.278 0.049 2.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -15.512 -0.480 3.406 1.00 0.00 H new ATOM 1492 N TYR A 86 -9.074 -3.297 7.562 1.00 0.00 N ATOM 1493 CA TYR A 86 -8.097 -2.527 8.379 1.00 0.00 C ATOM 1494 C TYR A 86 -6.725 -2.552 7.694 1.00 0.00 C ATOM 1495 O TYR A 86 -6.209 -1.528 7.287 1.00 0.00 O ATOM 1496 CB TYR A 86 -8.044 -3.266 9.716 1.00 0.00 C ATOM 1497 CG TYR A 86 -9.236 -2.876 10.550 1.00 0.00 C ATOM 1498 CD1 TYR A 86 -10.509 -3.392 10.258 1.00 0.00 C ATOM 1499 CD2 TYR A 86 -9.064 -1.995 11.622 1.00 0.00 C ATOM 1500 CE1 TYR A 86 -11.605 -3.015 11.049 1.00 0.00 C ATOM 1501 CE2 TYR A 86 -10.158 -1.623 12.409 1.00 0.00 C ATOM 1502 CZ TYR A 86 -11.428 -2.133 12.122 1.00 0.00 C ATOM 1503 OH TYR A 86 -12.510 -1.768 12.898 1.00 0.00 O ATOM 0 H TYR A 86 -8.722 -4.179 7.190 1.00 0.00 H new ATOM 0 HA TYR A 86 -8.377 -1.481 8.503 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -8.040 -4.343 9.549 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -7.122 -3.022 10.243 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -10.643 -4.074 9.431 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -8.083 -1.601 11.843 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -12.588 -3.406 10.830 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -10.022 -0.943 13.237 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.237 -1.721 13.838 1.00 0.00 H new ATOM 1513 N ALA A 87 -6.137 -3.718 7.552 1.00 0.00 N ATOM 1514 CA ALA A 87 -4.808 -3.817 6.881 1.00 0.00 C ATOM 1515 C ALA A 87 -4.886 -4.844 5.741 1.00 0.00 C ATOM 1516 O ALA A 87 -5.905 -5.481 5.554 1.00 0.00 O ATOM 1517 CB ALA A 87 -3.845 -4.289 7.970 1.00 0.00 C ATOM 0 H ALA A 87 -6.524 -4.605 7.874 1.00 0.00 H new ATOM 0 HA ALA A 87 -4.485 -2.872 6.445 1.00 0.00 H new ATOM 0 HB1 ALA A 87 -2.843 -4.386 7.552 1.00 0.00 H new ATOM 0 HB2 ALA A 87 -3.831 -3.563 8.783 1.00 0.00 H new ATOM 0 HB3 ALA A 87 -4.174 -5.255 8.353 1.00 0.00 H new ATOM 1523 N ASP A 88 -3.827 -5.013 4.975 1.00 0.00 N ATOM 1524 CA ASP A 88 -3.870 -6.001 3.856 1.00 0.00 C ATOM 1525 C ASP A 88 -2.857 -7.130 4.096 1.00 0.00 C ATOM 1526 O ASP A 88 -1.666 -6.939 3.935 1.00 0.00 O ATOM 1527 CB ASP A 88 -3.495 -5.205 2.606 1.00 0.00 C ATOM 1528 CG ASP A 88 -3.916 -5.984 1.358 1.00 0.00 C ATOM 1529 OD1 ASP A 88 -3.752 -7.194 1.356 1.00 0.00 O ATOM 1530 OD2 ASP A 88 -4.395 -5.358 0.427 1.00 0.00 O ATOM 0 H ASP A 88 -2.945 -4.511 5.080 1.00 0.00 H new ATOM 0 HA ASP A 88 -4.850 -6.470 3.764 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -3.984 -4.231 2.622 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -2.421 -5.022 2.588 1.00 0.00 H new ATOM 1535 N LYS A 89 -3.316 -8.308 4.474 1.00 0.00 N ATOM 1536 CA LYS A 89 -2.350 -9.439 4.711 1.00 0.00 C ATOM 1537 C LYS A 89 -1.598 -9.758 3.409 1.00 0.00 C ATOM 1538 O LYS A 89 -0.410 -10.025 3.429 1.00 0.00 O ATOM 1539 CB LYS A 89 -3.182 -10.653 5.153 1.00 0.00 C ATOM 1540 CG LYS A 89 -3.346 -10.630 6.675 1.00 0.00 C ATOM 1541 CD LYS A 89 -2.170 -11.360 7.327 1.00 0.00 C ATOM 1542 CE LYS A 89 -2.365 -12.872 7.189 1.00 0.00 C ATOM 1543 NZ LYS A 89 -1.234 -13.477 7.943 1.00 0.00 N ATOM 0 H LYS A 89 -4.299 -8.532 4.626 1.00 0.00 H new ATOM 0 HA LYS A 89 -1.614 -9.177 5.471 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -4.159 -10.633 4.671 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -2.692 -11.576 4.843 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -3.391 -9.601 7.031 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -4.285 -11.106 6.957 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -1.235 -11.059 6.855 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -2.098 -11.087 8.380 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -3.325 -13.185 7.599 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -2.350 -13.178 6.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -1.299 -14.514 7.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -0.333 -13.167 7.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -1.278 -13.174 8.937 1.00 0.00 H new ATOM 1557 N LEU A 90 -2.272 -9.731 2.274 1.00 0.00 N ATOM 1558 CA LEU A 90 -1.561 -10.033 0.979 1.00 0.00 C ATOM 1559 C LEU A 90 -0.433 -9.012 0.758 1.00 0.00 C ATOM 1560 O LEU A 90 0.658 -9.374 0.358 1.00 0.00 O ATOM 1561 CB LEU A 90 -2.606 -9.921 -0.143 1.00 0.00 C ATOM 1562 CG LEU A 90 -2.007 -10.437 -1.452 1.00 0.00 C ATOM 1563 CD1 LEU A 90 -1.798 -11.950 -1.356 1.00 0.00 C ATOM 1564 CD2 LEU A 90 -2.961 -10.126 -2.610 1.00 0.00 C ATOM 0 H LEU A 90 -3.266 -9.517 2.188 1.00 0.00 H new ATOM 0 HA LEU A 90 -1.117 -11.029 0.995 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -3.495 -10.497 0.115 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -2.921 -8.884 -0.259 1.00 0.00 H new ATOM 0 HG LEU A 90 -1.049 -9.948 -1.630 1.00 0.00 H new ATOM 0 HD11 LEU A 90 -1.371 -12.318 -2.289 1.00 0.00 H new ATOM 0 HD12 LEU A 90 -1.118 -12.172 -0.533 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -2.756 -12.439 -1.177 1.00 0.00 H new ATOM 0 HD21 LEU A 90 -2.533 -10.494 -3.543 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -3.919 -10.614 -2.433 1.00 0.00 H new ATOM 0 HD23 LEU A 90 -3.110 -9.048 -2.679 1.00 0.00 H new ATOM 1576 N LEU A 91 -0.678 -7.741 1.024 1.00 0.00 N ATOM 1577 CA LEU A 91 0.416 -6.723 0.830 1.00 0.00 C ATOM 1578 C LEU A 91 1.518 -6.968 1.864 1.00 0.00 C ATOM 1579 O LEU A 91 2.681 -7.062 1.517 1.00 0.00 O ATOM 1580 CB LEU A 91 -0.215 -5.335 1.034 1.00 0.00 C ATOM 1581 CG LEU A 91 0.812 -4.246 0.706 1.00 0.00 C ATOM 1582 CD1 LEU A 91 1.237 -4.349 -0.762 1.00 0.00 C ATOM 1583 CD2 LEU A 91 0.184 -2.873 0.954 1.00 0.00 C ATOM 0 H LEU A 91 -1.568 -7.372 1.359 1.00 0.00 H new ATOM 0 HA LEU A 91 0.858 -6.794 -0.164 1.00 0.00 H new ATOM 0 HB2 LEU A 91 -1.091 -5.226 0.395 1.00 0.00 H new ATOM 0 HB3 LEU A 91 -0.556 -5.228 2.064 1.00 0.00 H new ATOM 0 HG LEU A 91 1.688 -4.376 1.341 1.00 0.00 H new ATOM 0 HD11 LEU A 91 1.967 -3.571 -0.985 1.00 0.00 H new ATOM 0 HD12 LEU A 91 1.682 -5.327 -0.944 1.00 0.00 H new ATOM 0 HD13 LEU A 91 0.365 -4.223 -1.403 1.00 0.00 H new ATOM 0 HD21 LEU A 91 0.910 -2.094 0.722 1.00 0.00 H new ATOM 0 HD22 LEU A 91 -0.692 -2.753 0.317 1.00 0.00 H new ATOM 0 HD23 LEU A 91 -0.114 -2.792 1.999 1.00 0.00 H new ATOM 1595 N ILE A 92 1.167 -7.107 3.130 1.00 0.00 N ATOM 1596 CA ILE A 92 2.230 -7.384 4.164 1.00 0.00 C ATOM 1597 C ILE A 92 2.975 -8.691 3.792 1.00 0.00 C ATOM 1598 O ILE A 92 4.148 -8.833 4.080 1.00 0.00 O ATOM 1599 CB ILE A 92 1.503 -7.494 5.531 1.00 0.00 C ATOM 1600 CG1 ILE A 92 1.061 -6.083 5.961 1.00 0.00 C ATOM 1601 CG2 ILE A 92 2.444 -8.084 6.594 1.00 0.00 C ATOM 1602 CD1 ILE A 92 0.360 -6.122 7.328 1.00 0.00 C ATOM 0 H ILE A 92 0.213 -7.043 3.486 1.00 0.00 H new ATOM 0 HA ILE A 92 2.979 -6.594 4.212 1.00 0.00 H new ATOM 0 HB ILE A 92 0.639 -8.151 5.433 1.00 0.00 H new ATOM 0 HG12 ILE A 92 1.929 -5.425 6.011 1.00 0.00 H new ATOM 0 HG13 ILE A 92 0.387 -5.665 5.214 1.00 0.00 H new ATOM 0 HG21 ILE A 92 1.919 -8.154 7.546 1.00 0.00 H new ATOM 0 HG22 ILE A 92 2.766 -9.078 6.283 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.315 -7.439 6.707 1.00 0.00 H new ATOM 0 HD11 ILE A 92 0.057 -5.114 7.610 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -0.520 -6.762 7.267 1.00 0.00 H new ATOM 0 HD13 ILE A 92 1.045 -6.518 8.077 1.00 0.00 H new ATOM 1614 N ALA A 93 2.316 -9.635 3.133 1.00 0.00 N ATOM 1615 CA ALA A 93 3.032 -10.900 2.738 1.00 0.00 C ATOM 1616 C ALA A 93 4.057 -10.582 1.637 1.00 0.00 C ATOM 1617 O ALA A 93 5.195 -11.007 1.711 1.00 0.00 O ATOM 1618 CB ALA A 93 1.963 -11.871 2.208 1.00 0.00 C ATOM 0 H ALA A 93 1.335 -9.583 2.859 1.00 0.00 H new ATOM 0 HA ALA A 93 3.564 -11.339 3.582 1.00 0.00 H new ATOM 0 HB1 ALA A 93 2.437 -12.806 1.908 1.00 0.00 H new ATOM 0 HB2 ALA A 93 1.232 -12.070 2.991 1.00 0.00 H new ATOM 0 HB3 ALA A 93 1.462 -11.426 1.348 1.00 0.00 H new ATOM 1624 N LYS A 94 3.675 -9.823 0.621 1.00 0.00 N ATOM 1625 CA LYS A 94 4.667 -9.480 -0.465 1.00 0.00 C ATOM 1626 C LYS A 94 5.885 -8.761 0.140 1.00 0.00 C ATOM 1627 O LYS A 94 7.008 -9.006 -0.260 1.00 0.00 O ATOM 1628 CB LYS A 94 3.948 -8.566 -1.476 1.00 0.00 C ATOM 1629 CG LYS A 94 3.300 -9.421 -2.573 1.00 0.00 C ATOM 1630 CD LYS A 94 1.911 -8.877 -2.903 1.00 0.00 C ATOM 1631 CE LYS A 94 1.559 -9.218 -4.352 1.00 0.00 C ATOM 1632 NZ LYS A 94 1.227 -10.671 -4.335 1.00 0.00 N ATOM 0 H LYS A 94 2.740 -9.434 0.499 1.00 0.00 H new ATOM 0 HA LYS A 94 5.026 -10.383 -0.959 1.00 0.00 H new ATOM 0 HB2 LYS A 94 3.189 -7.972 -0.968 1.00 0.00 H new ATOM 0 HB3 LYS A 94 4.658 -7.866 -1.918 1.00 0.00 H new ATOM 0 HG2 LYS A 94 3.924 -9.416 -3.467 1.00 0.00 H new ATOM 0 HG3 LYS A 94 3.225 -10.457 -2.242 1.00 0.00 H new ATOM 0 HD2 LYS A 94 1.171 -9.306 -2.227 1.00 0.00 H new ATOM 0 HD3 LYS A 94 1.888 -7.797 -2.757 1.00 0.00 H new ATOM 0 HE2 LYS A 94 0.715 -8.624 -4.704 1.00 0.00 H new ATOM 0 HE3 LYS A 94 2.395 -9.012 -5.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.886 -11.185 -4.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 1.308 -11.034 -3.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 0.254 -10.809 -4.676 1.00 0.00 H new ATOM 1646 N TRP A 95 5.680 -7.889 1.109 1.00 0.00 N ATOM 1647 CA TRP A 95 6.860 -7.184 1.730 1.00 0.00 C ATOM 1648 C TRP A 95 7.730 -8.204 2.482 1.00 0.00 C ATOM 1649 O TRP A 95 8.943 -8.144 2.431 1.00 0.00 O ATOM 1650 CB TRP A 95 6.298 -6.137 2.711 1.00 0.00 C ATOM 1651 CG TRP A 95 6.007 -4.847 1.999 1.00 0.00 C ATOM 1652 CD1 TRP A 95 6.739 -4.320 0.986 1.00 0.00 C ATOM 1653 CD2 TRP A 95 4.919 -3.908 2.242 1.00 0.00 C ATOM 1654 NE1 TRP A 95 6.166 -3.125 0.593 1.00 0.00 N ATOM 1655 CE2 TRP A 95 5.044 -2.827 1.336 1.00 0.00 C ATOM 1656 CE3 TRP A 95 3.845 -3.890 3.150 1.00 0.00 C ATOM 1657 CZ2 TRP A 95 4.137 -1.767 1.332 1.00 0.00 C ATOM 1658 CZ3 TRP A 95 2.930 -2.823 3.149 1.00 0.00 C ATOM 1659 CH2 TRP A 95 3.077 -1.765 2.240 1.00 0.00 C ATOM 0 H TRP A 95 4.768 -7.638 1.490 1.00 0.00 H new ATOM 0 HA TRP A 95 7.478 -6.704 0.971 1.00 0.00 H new ATOM 0 HB2 TRP A 95 5.387 -6.517 3.174 1.00 0.00 H new ATOM 0 HB3 TRP A 95 7.014 -5.962 3.514 1.00 0.00 H new ATOM 0 HD1 TRP A 95 7.626 -4.762 0.556 1.00 0.00 H new ATOM 0 HE1 TRP A 95 6.529 -2.535 -0.156 1.00 0.00 H new ATOM 0 HE3 TRP A 95 3.723 -4.701 3.852 1.00 0.00 H new ATOM 0 HZ2 TRP A 95 4.254 -0.954 0.631 1.00 0.00 H new ATOM 0 HZ3 TRP A 95 2.110 -2.818 3.852 1.00 0.00 H new ATOM 0 HH2 TRP A 95 2.370 -0.949 2.243 1.00 0.00 H new ATOM 1670 N ARG A 96 7.120 -9.147 3.171 1.00 0.00 N ATOM 1671 CA ARG A 96 7.933 -10.177 3.915 1.00 0.00 C ATOM 1672 C ARG A 96 8.610 -11.142 2.925 1.00 0.00 C ATOM 1673 O ARG A 96 9.702 -11.616 3.173 1.00 0.00 O ATOM 1674 CB ARG A 96 6.954 -10.945 4.819 1.00 0.00 C ATOM 1675 CG ARG A 96 6.706 -10.150 6.109 1.00 0.00 C ATOM 1676 CD ARG A 96 5.204 -10.126 6.430 1.00 0.00 C ATOM 1677 NE ARG A 96 5.068 -10.862 7.727 1.00 0.00 N ATOM 1678 CZ ARG A 96 5.056 -12.185 7.775 1.00 0.00 C ATOM 1679 NH1 ARG A 96 5.163 -12.914 6.687 1.00 0.00 N ATOM 1680 NH2 ARG A 96 4.936 -12.788 8.929 1.00 0.00 N ATOM 0 H ARG A 96 6.108 -9.249 3.251 1.00 0.00 H new ATOM 0 HA ARG A 96 8.720 -9.703 4.502 1.00 0.00 H new ATOM 0 HB2 ARG A 96 6.012 -11.109 4.295 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.360 -11.928 5.059 1.00 0.00 H new ATOM 0 HG2 ARG A 96 7.256 -10.601 6.935 1.00 0.00 H new ATOM 0 HG3 ARG A 96 7.079 -9.132 5.996 1.00 0.00 H new ATOM 0 HD2 ARG A 96 4.836 -9.104 6.517 1.00 0.00 H new ATOM 0 HD3 ARG A 96 4.625 -10.607 5.642 1.00 0.00 H new ATOM 0 HE ARG A 96 4.983 -10.331 8.594 1.00 0.00 H new ATOM 0 HH11 ARG A 96 5.258 -12.462 5.778 1.00 0.00 H new ATOM 0 HH12 ARG A 96 5.151 -13.932 6.752 1.00 0.00 H new ATOM 0 HH21 ARG A 96 4.852 -12.239 9.785 1.00 0.00 H new ATOM 0 HH22 ARG A 96 4.926 -13.807 8.973 1.00 0.00 H new ATOM 1694 N LYS A 97 7.974 -11.444 1.806 1.00 0.00 N ATOM 1695 CA LYS A 97 8.605 -12.390 0.808 1.00 0.00 C ATOM 1696 C LYS A 97 10.017 -11.913 0.426 1.00 0.00 C ATOM 1697 O LYS A 97 10.500 -10.921 0.937 1.00 0.00 O ATOM 1698 CB LYS A 97 7.708 -12.370 -0.441 1.00 0.00 C ATOM 1699 CG LYS A 97 6.629 -13.445 -0.333 1.00 0.00 C ATOM 1700 CD LYS A 97 7.281 -14.830 -0.307 1.00 0.00 C ATOM 1701 CE LYS A 97 6.289 -15.872 -0.827 1.00 0.00 C ATOM 1702 NZ LYS A 97 6.412 -15.813 -2.310 1.00 0.00 N ATOM 0 H LYS A 97 7.058 -11.083 1.542 1.00 0.00 H new ATOM 0 HA LYS A 97 8.692 -13.391 1.231 1.00 0.00 H new ATOM 0 HB2 LYS A 97 7.245 -11.389 -0.549 1.00 0.00 H new ATOM 0 HB3 LYS A 97 8.311 -12.538 -1.333 1.00 0.00 H new ATOM 0 HG2 LYS A 97 6.040 -13.293 0.571 1.00 0.00 H new ATOM 0 HG3 LYS A 97 5.943 -13.371 -1.177 1.00 0.00 H new ATOM 0 HD2 LYS A 97 8.181 -14.831 -0.922 1.00 0.00 H new ATOM 0 HD3 LYS A 97 7.588 -15.080 0.709 1.00 0.00 H new ATOM 0 HE2 LYS A 97 6.527 -16.867 -0.450 1.00 0.00 H new ATOM 0 HE3 LYS A 97 5.273 -15.645 -0.506 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 5.497 -16.048 -2.744 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 6.695 -14.854 -2.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 7.131 -16.495 -2.626 1.00 0.00 H new ATOM 1716 N THR A 98 10.678 -12.604 -0.482 1.00 0.00 N ATOM 1717 CA THR A 98 12.048 -12.173 -0.899 1.00 0.00 C ATOM 1718 C THR A 98 11.993 -11.551 -2.301 1.00 0.00 C ATOM 1719 O THR A 98 11.378 -12.096 -3.199 1.00 0.00 O ATOM 1720 CB THR A 98 12.903 -13.445 -0.904 1.00 0.00 C ATOM 1721 OG1 THR A 98 12.064 -14.582 -1.055 1.00 0.00 O ATOM 1722 CG2 THR A 98 13.674 -13.547 0.413 1.00 0.00 C ATOM 0 H THR A 98 10.326 -13.441 -0.946 1.00 0.00 H new ATOM 0 HA THR A 98 12.463 -11.422 -0.227 1.00 0.00 H new ATOM 0 HB THR A 98 13.608 -13.405 -1.734 1.00 0.00 H new ATOM 0 HG1 THR A 98 12.612 -15.395 -1.060 1.00 0.00 H new ATOM 0 HG21 THR A 98 14.282 -14.452 0.410 1.00 0.00 H new ATOM 0 HG22 THR A 98 14.320 -12.676 0.525 1.00 0.00 H new ATOM 0 HG23 THR A 98 12.970 -13.586 1.244 1.00 0.00 H new ATOM 1730 N GLY A 99 12.621 -10.410 -2.497 1.00 0.00 N ATOM 1731 CA GLY A 99 12.586 -9.758 -3.840 1.00 0.00 C ATOM 1732 C GLY A 99 11.543 -8.618 -3.884 1.00 0.00 C ATOM 1733 O GLY A 99 11.347 -8.015 -4.922 1.00 0.00 O ATOM 0 H GLY A 99 13.152 -9.909 -1.785 1.00 0.00 H new ATOM 0 HA2 GLY A 99 13.572 -9.361 -4.080 1.00 0.00 H new ATOM 0 HA3 GLY A 99 12.348 -10.501 -4.601 1.00 0.00 H new ATOM 1737 N TYR A 100 10.870 -8.302 -2.786 1.00 0.00 N ATOM 1738 CA TYR A 100 9.862 -7.194 -2.823 1.00 0.00 C ATOM 1739 C TYR A 100 10.389 -5.974 -2.051 1.00 0.00 C ATOM 1740 O TYR A 100 9.690 -5.410 -1.229 1.00 0.00 O ATOM 1741 CB TYR A 100 8.607 -7.755 -2.144 1.00 0.00 C ATOM 1742 CG TYR A 100 7.891 -8.687 -3.090 1.00 0.00 C ATOM 1743 CD1 TYR A 100 7.303 -8.184 -4.257 1.00 0.00 C ATOM 1744 CD2 TYR A 100 7.813 -10.053 -2.798 1.00 0.00 C ATOM 1745 CE1 TYR A 100 6.636 -9.050 -5.132 1.00 0.00 C ATOM 1746 CE2 TYR A 100 7.146 -10.918 -3.672 1.00 0.00 C ATOM 1747 CZ TYR A 100 6.556 -10.418 -4.839 1.00 0.00 C ATOM 1748 OH TYR A 100 5.898 -11.272 -5.702 1.00 0.00 O ATOM 0 H TYR A 100 10.979 -8.762 -1.882 1.00 0.00 H new ATOM 0 HA TYR A 100 9.655 -6.867 -3.842 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.881 -8.286 -1.233 1.00 0.00 H new ATOM 0 HB3 TYR A 100 7.945 -6.940 -1.851 1.00 0.00 H new ATOM 0 HD1 TYR A 100 7.364 -7.129 -4.482 1.00 0.00 H new ATOM 0 HD2 TYR A 100 8.268 -10.440 -1.898 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.183 -8.664 -6.033 1.00 0.00 H new ATOM 0 HE2 TYR A 100 7.086 -11.972 -3.446 1.00 0.00 H new ATOM 0 HH TYR A 100 5.937 -12.186 -5.350 1.00 0.00 H new ATOM 1758 N GLU A 101 11.614 -5.558 -2.307 1.00 0.00 N ATOM 1759 CA GLU A 101 12.162 -4.362 -1.570 1.00 0.00 C ATOM 1760 C GLU A 101 11.356 -3.107 -1.937 1.00 0.00 C ATOM 1761 O GLU A 101 11.076 -2.280 -1.089 1.00 0.00 O ATOM 1762 CB GLU A 101 13.626 -4.200 -2.010 1.00 0.00 C ATOM 1763 CG GLU A 101 14.440 -5.402 -1.526 1.00 0.00 C ATOM 1764 CD GLU A 101 15.918 -5.016 -1.422 1.00 0.00 C ATOM 1765 OE1 GLU A 101 16.191 -3.863 -1.125 1.00 0.00 O ATOM 1766 OE2 GLU A 101 16.751 -5.879 -1.640 1.00 0.00 O ATOM 0 H GLU A 101 12.249 -5.985 -2.982 1.00 0.00 H new ATOM 0 HA GLU A 101 12.094 -4.500 -0.491 1.00 0.00 H new ATOM 0 HB2 GLU A 101 13.684 -4.121 -3.096 1.00 0.00 H new ATOM 0 HB3 GLU A 101 14.040 -3.278 -1.601 1.00 0.00 H new ATOM 0 HG2 GLU A 101 14.072 -5.736 -0.556 1.00 0.00 H new ATOM 0 HG3 GLU A 101 14.320 -6.237 -2.217 1.00 0.00 H new ATOM 1773 N LYS A 102 10.975 -2.955 -3.190 1.00 0.00 N ATOM 1774 CA LYS A 102 10.187 -1.750 -3.593 1.00 0.00 C ATOM 1775 C LYS A 102 8.779 -2.170 -4.044 1.00 0.00 C ATOM 1776 O LYS A 102 8.602 -2.695 -5.128 1.00 0.00 O ATOM 1777 CB LYS A 102 10.972 -1.134 -4.754 1.00 0.00 C ATOM 1778 CG LYS A 102 12.290 -0.543 -4.230 1.00 0.00 C ATOM 1779 CD LYS A 102 12.193 0.991 -4.168 1.00 0.00 C ATOM 1780 CE LYS A 102 13.150 1.615 -5.189 1.00 0.00 C ATOM 1781 NZ LYS A 102 13.761 2.776 -4.484 1.00 0.00 N ATOM 0 H LYS A 102 11.177 -3.613 -3.943 1.00 0.00 H new ATOM 0 HA LYS A 102 10.058 -1.042 -2.775 1.00 0.00 H new ATOM 0 HB2 LYS A 102 11.177 -1.892 -5.510 1.00 0.00 H new ATOM 0 HB3 LYS A 102 10.379 -0.356 -5.235 1.00 0.00 H new ATOM 0 HG2 LYS A 102 12.508 -0.942 -3.239 1.00 0.00 H new ATOM 0 HG3 LYS A 102 13.114 -0.837 -4.880 1.00 0.00 H new ATOM 0 HD2 LYS A 102 11.171 1.308 -4.374 1.00 0.00 H new ATOM 0 HD3 LYS A 102 12.439 1.340 -3.165 1.00 0.00 H new ATOM 0 HE2 LYS A 102 13.910 0.901 -5.506 1.00 0.00 H new ATOM 0 HE3 LYS A 102 12.618 1.933 -6.086 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 14.430 3.256 -5.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 13.014 3.442 -4.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 14.266 2.442 -3.639 1.00 0.00 H new ATOM 1795 N LEU A 103 7.774 -1.954 -3.218 1.00 0.00 N ATOM 1796 CA LEU A 103 6.386 -2.351 -3.599 1.00 0.00 C ATOM 1797 C LEU A 103 5.384 -1.282 -3.106 1.00 0.00 C ATOM 1798 O LEU A 103 5.444 -0.852 -1.969 1.00 0.00 O ATOM 1799 CB LEU A 103 6.188 -3.720 -2.906 1.00 0.00 C ATOM 1800 CG LEU A 103 4.700 -4.046 -2.705 1.00 0.00 C ATOM 1801 CD1 LEU A 103 3.993 -4.089 -4.061 1.00 0.00 C ATOM 1802 CD2 LEU A 103 4.571 -5.404 -2.010 1.00 0.00 C ATOM 0 H LEU A 103 7.862 -1.520 -2.299 1.00 0.00 H new ATOM 0 HA LEU A 103 6.225 -2.427 -4.674 1.00 0.00 H new ATOM 0 HB2 LEU A 103 6.654 -4.502 -3.506 1.00 0.00 H new ATOM 0 HB3 LEU A 103 6.693 -3.715 -1.940 1.00 0.00 H new ATOM 0 HG LEU A 103 4.238 -3.276 -2.088 1.00 0.00 H new ATOM 0 HD11 LEU A 103 2.938 -4.320 -3.914 1.00 0.00 H new ATOM 0 HD12 LEU A 103 4.087 -3.120 -4.551 1.00 0.00 H new ATOM 0 HD13 LEU A 103 4.450 -4.857 -4.685 1.00 0.00 H new ATOM 0 HD21 LEU A 103 3.517 -5.640 -1.865 1.00 0.00 H new ATOM 0 HD22 LEU A 103 5.034 -6.174 -2.627 1.00 0.00 H new ATOM 0 HD23 LEU A 103 5.071 -5.366 -1.042 1.00 0.00 H new ATOM 1814 N CYS A 104 4.470 -0.847 -3.954 1.00 0.00 N ATOM 1815 CA CYS A 104 3.483 0.196 -3.516 1.00 0.00 C ATOM 1816 C CYS A 104 2.060 -0.380 -3.341 1.00 0.00 C ATOM 1817 O CYS A 104 1.362 0.010 -2.426 1.00 0.00 O ATOM 1818 CB CYS A 104 3.535 1.321 -4.570 1.00 0.00 C ATOM 1819 SG CYS A 104 3.064 0.739 -6.224 1.00 0.00 S ATOM 0 H CYS A 104 4.368 -1.166 -4.917 1.00 0.00 H new ATOM 0 HA CYS A 104 3.746 0.582 -2.531 1.00 0.00 H new ATOM 0 HB2 CYS A 104 2.869 2.129 -4.268 1.00 0.00 H new ATOM 0 HB3 CYS A 104 4.543 1.735 -4.606 1.00 0.00 H new ATOM 1824 N CYS A 105 1.613 -1.302 -4.172 1.00 0.00 N ATOM 1825 CA CYS A 105 0.232 -1.873 -3.976 1.00 0.00 C ATOM 1826 C CYS A 105 0.244 -3.384 -4.263 1.00 0.00 C ATOM 1827 O CYS A 105 1.293 -3.979 -4.413 1.00 0.00 O ATOM 1828 CB CYS A 105 -0.702 -1.186 -4.983 1.00 0.00 C ATOM 1829 SG CYS A 105 -0.421 0.605 -5.077 1.00 0.00 S ATOM 0 H CYS A 105 2.134 -1.678 -4.964 1.00 0.00 H new ATOM 0 HA CYS A 105 -0.101 -1.708 -2.951 1.00 0.00 H new ATOM 0 HB2 CYS A 105 -0.555 -1.626 -5.969 1.00 0.00 H new ATOM 0 HB3 CYS A 105 -1.738 -1.374 -4.701 1.00 0.00 H new ATOM 1834 N LEU A 106 -0.914 -4.011 -4.359 1.00 0.00 N ATOM 1835 CA LEU A 106 -0.945 -5.485 -4.655 1.00 0.00 C ATOM 1836 C LEU A 106 -1.186 -5.728 -6.159 1.00 0.00 C ATOM 1837 O LEU A 106 -0.606 -6.627 -6.737 1.00 0.00 O ATOM 1838 CB LEU A 106 -2.091 -6.064 -3.816 1.00 0.00 C ATOM 1839 CG LEU A 106 -1.644 -6.209 -2.359 1.00 0.00 C ATOM 1840 CD1 LEU A 106 -2.812 -6.741 -1.525 1.00 0.00 C ATOM 1841 CD2 LEU A 106 -0.458 -7.186 -2.267 1.00 0.00 C ATOM 0 H LEU A 106 -1.827 -3.570 -4.246 1.00 0.00 H new ATOM 0 HA LEU A 106 0.003 -5.963 -4.407 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.963 -5.413 -3.876 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -2.390 -7.034 -4.213 1.00 0.00 H new ATOM 0 HG LEU A 106 -1.332 -5.236 -1.979 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -2.499 -6.846 -0.486 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -3.648 -6.044 -1.583 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -3.122 -7.712 -1.911 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -0.146 -7.283 -1.227 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -0.760 -8.162 -2.648 1.00 0.00 H new ATOM 0 HD23 LEU A 106 0.373 -6.806 -2.861 1.00 0.00 H new ATOM 1853 N ARG A 107 -2.004 -4.918 -6.810 1.00 0.00 N ATOM 1854 CA ARG A 107 -2.226 -5.102 -8.286 1.00 0.00 C ATOM 1855 C ARG A 107 -1.426 -4.032 -9.065 1.00 0.00 C ATOM 1856 O ARG A 107 -1.849 -3.565 -10.104 1.00 0.00 O ATOM 1857 CB ARG A 107 -3.732 -4.918 -8.504 1.00 0.00 C ATOM 1858 CG ARG A 107 -4.111 -5.405 -9.905 1.00 0.00 C ATOM 1859 CD ARG A 107 -5.361 -4.661 -10.382 1.00 0.00 C ATOM 1860 NE ARG A 107 -6.509 -5.493 -9.909 1.00 0.00 N ATOM 1861 CZ ARG A 107 -6.845 -6.617 -10.525 1.00 0.00 C ATOM 1862 NH1 ARG A 107 -6.182 -7.047 -11.574 1.00 0.00 N ATOM 1863 NH2 ARG A 107 -7.859 -7.316 -10.084 1.00 0.00 N ATOM 0 H ARG A 107 -2.520 -4.147 -6.386 1.00 0.00 H new ATOM 0 HA ARG A 107 -1.894 -6.079 -8.637 1.00 0.00 H new ATOM 0 HB2 ARG A 107 -4.289 -5.475 -7.751 1.00 0.00 H new ATOM 0 HB3 ARG A 107 -4.001 -3.868 -8.388 1.00 0.00 H new ATOM 0 HG2 ARG A 107 -3.286 -5.234 -10.597 1.00 0.00 H new ATOM 0 HG3 ARG A 107 -4.297 -6.479 -9.891 1.00 0.00 H new ATOM 0 HD2 ARG A 107 -5.405 -3.655 -9.965 1.00 0.00 H new ATOM 0 HD3 ARG A 107 -5.369 -4.557 -11.467 1.00 0.00 H new ATOM 0 HE ARG A 107 -7.045 -5.189 -9.096 1.00 0.00 H new ATOM 0 HH11 ARG A 107 -5.390 -6.513 -11.931 1.00 0.00 H new ATOM 0 HH12 ARG A 107 -6.459 -7.915 -12.032 1.00 0.00 H new ATOM 0 HH21 ARG A 107 -8.385 -6.995 -9.271 1.00 0.00 H new ATOM 0 HH22 ARG A 107 -8.124 -8.182 -10.553 1.00 0.00 H new ATOM 1877 N CYS A 108 -0.280 -3.630 -8.552 1.00 0.00 N ATOM 1878 CA CYS A 108 0.555 -2.583 -9.223 1.00 0.00 C ATOM 1879 C CYS A 108 2.018 -3.105 -9.363 1.00 0.00 C ATOM 1880 O CYS A 108 2.927 -2.331 -9.583 1.00 0.00 O ATOM 1881 CB CYS A 108 0.469 -1.447 -8.191 1.00 0.00 C ATOM 1882 SG CYS A 108 0.560 0.225 -8.879 1.00 0.00 S ATOM 0 H CYS A 108 0.114 -3.991 -7.683 1.00 0.00 H new ATOM 0 HA CYS A 108 0.239 -2.296 -10.226 1.00 0.00 H new ATOM 0 HB2 CYS A 108 -0.467 -1.546 -7.642 1.00 0.00 H new ATOM 0 HB3 CYS A 108 1.277 -1.571 -7.470 1.00 0.00 H new ATOM 1887 N ILE A 109 2.252 -4.416 -9.219 1.00 0.00 N ATOM 1888 CA ILE A 109 3.648 -4.977 -9.315 1.00 0.00 C ATOM 1889 C ILE A 109 3.606 -6.489 -9.641 1.00 0.00 C ATOM 1890 O ILE A 109 4.390 -7.252 -9.106 1.00 0.00 O ATOM 1891 CB ILE A 109 4.255 -4.806 -7.904 1.00 0.00 C ATOM 1892 CG1 ILE A 109 3.319 -5.444 -6.849 1.00 0.00 C ATOM 1893 CG2 ILE A 109 4.453 -3.323 -7.585 1.00 0.00 C ATOM 1894 CD1 ILE A 109 4.096 -6.440 -5.977 1.00 0.00 C ATOM 0 H ILE A 109 1.527 -5.111 -9.039 1.00 0.00 H new ATOM 0 HA ILE A 109 4.219 -4.473 -10.095 1.00 0.00 H new ATOM 0 HB ILE A 109 5.224 -5.305 -7.878 1.00 0.00 H new ATOM 0 HG12 ILE A 109 2.883 -4.666 -6.223 1.00 0.00 H new ATOM 0 HG13 ILE A 109 2.493 -5.953 -7.346 1.00 0.00 H new ATOM 0 HG21 ILE A 109 4.881 -3.219 -6.588 1.00 0.00 H new ATOM 0 HG22 ILE A 109 5.128 -2.880 -8.318 1.00 0.00 H new ATOM 0 HG23 ILE A 109 3.491 -2.811 -7.622 1.00 0.00 H new ATOM 0 HD11 ILE A 109 3.424 -6.880 -5.240 1.00 0.00 H new ATOM 0 HD12 ILE A 109 4.511 -7.228 -6.606 1.00 0.00 H new ATOM 0 HD13 ILE A 109 4.906 -5.921 -5.465 1.00 0.00 H new ATOM 1906 N GLN A 110 2.693 -6.940 -10.480 1.00 0.00 N ATOM 1907 CA GLN A 110 2.622 -8.410 -10.775 1.00 0.00 C ATOM 1908 C GLN A 110 2.939 -8.712 -12.247 1.00 0.00 C ATOM 1909 O GLN A 110 2.385 -8.104 -13.141 1.00 0.00 O ATOM 1910 CB GLN A 110 1.179 -8.805 -10.451 1.00 0.00 C ATOM 1911 CG GLN A 110 1.097 -9.328 -9.012 1.00 0.00 C ATOM 1912 CD GLN A 110 1.096 -10.863 -9.019 1.00 0.00 C ATOM 1913 OE1 GLN A 110 0.272 -11.480 -8.371 1.00 0.00 O ATOM 1914 NE2 GLN A 110 1.986 -11.516 -9.726 1.00 0.00 N ATOM 0 H GLN A 110 2.006 -6.362 -10.964 1.00 0.00 H new ATOM 0 HA GLN A 110 3.354 -8.967 -10.190 1.00 0.00 H new ATOM 0 HB2 GLN A 110 0.520 -7.945 -10.574 1.00 0.00 H new ATOM 0 HB3 GLN A 110 0.837 -9.571 -11.147 1.00 0.00 H new ATOM 0 HG2 GLN A 110 1.942 -8.958 -8.432 1.00 0.00 H new ATOM 0 HG3 GLN A 110 0.192 -8.956 -8.531 1.00 0.00 H new ATOM 0 HE21 GLN A 110 2.679 -11.004 -10.271 1.00 0.00 H new ATOM 0 HE22 GLN A 110 1.985 -12.536 -9.731 1.00 0.00 H new ATOM 1923 N LYS A 111 3.816 -9.665 -12.505 1.00 0.00 N ATOM 1924 CA LYS A 111 4.156 -10.017 -13.918 1.00 0.00 C ATOM 1925 C LYS A 111 4.133 -11.543 -14.103 1.00 0.00 C ATOM 1926 O LYS A 111 3.781 -12.274 -13.196 1.00 0.00 O ATOM 1927 CB LYS A 111 5.569 -9.467 -14.149 1.00 0.00 C ATOM 1928 CG LYS A 111 6.543 -10.075 -13.134 1.00 0.00 C ATOM 1929 CD LYS A 111 7.981 -9.782 -13.566 1.00 0.00 C ATOM 1930 CE LYS A 111 8.308 -8.313 -13.294 1.00 0.00 C ATOM 1931 NZ LYS A 111 9.195 -7.901 -14.417 1.00 0.00 N ATOM 0 H LYS A 111 4.306 -10.209 -11.795 1.00 0.00 H new ATOM 0 HA LYS A 111 3.442 -9.598 -14.627 1.00 0.00 H new ATOM 0 HB2 LYS A 111 5.896 -9.698 -15.163 1.00 0.00 H new ATOM 0 HB3 LYS A 111 5.565 -8.381 -14.055 1.00 0.00 H new ATOM 0 HG2 LYS A 111 6.358 -9.660 -12.143 1.00 0.00 H new ATOM 0 HG3 LYS A 111 6.386 -11.151 -13.063 1.00 0.00 H new ATOM 0 HD2 LYS A 111 8.673 -10.426 -13.023 1.00 0.00 H new ATOM 0 HD3 LYS A 111 8.105 -10.003 -14.626 1.00 0.00 H new ATOM 0 HE2 LYS A 111 7.403 -7.706 -13.263 1.00 0.00 H new ATOM 0 HE3 LYS A 111 8.806 -8.191 -12.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 9.462 -6.903 -14.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 10.051 -8.491 -14.417 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 8.692 -8.021 -15.319 1.00 0.00 H new ATOM 1945 N ASN A 112 4.505 -12.034 -15.269 1.00 0.00 N ATOM 1946 CA ASN A 112 4.499 -13.513 -15.495 1.00 0.00 C ATOM 1947 C ASN A 112 5.635 -13.915 -16.451 1.00 0.00 C ATOM 1948 O ASN A 112 6.245 -13.071 -17.082 1.00 0.00 O ATOM 1949 CB ASN A 112 3.138 -13.810 -16.125 1.00 0.00 C ATOM 1950 CG ASN A 112 2.135 -14.180 -15.026 1.00 0.00 C ATOM 1951 OD1 ASN A 112 1.385 -13.340 -14.571 1.00 0.00 O ATOM 1952 ND2 ASN A 112 2.084 -15.409 -14.573 1.00 0.00 N ATOM 0 H ASN A 112 4.810 -11.474 -16.066 1.00 0.00 H new ATOM 0 HA ASN A 112 4.654 -14.071 -14.571 1.00 0.00 H new ATOM 0 HB2 ASN A 112 2.784 -12.940 -16.677 1.00 0.00 H new ATOM 0 HB3 ASN A 112 3.227 -14.627 -16.841 1.00 0.00 H new ATOM 0 HD21 ASN A 112 1.417 -15.656 -13.842 1.00 0.00 H new ATOM 0 HD22 ASN A 112 2.711 -16.118 -14.952 1.00 0.00 H new ATOM 1959 N GLU A 113 5.925 -15.195 -16.566 1.00 0.00 N ATOM 1960 CA GLU A 113 7.019 -15.637 -17.483 1.00 0.00 C ATOM 1961 C GLU A 113 6.449 -16.530 -18.595 1.00 0.00 C ATOM 1962 O GLU A 113 5.796 -17.519 -18.324 1.00 0.00 O ATOM 1963 CB GLU A 113 7.981 -16.431 -16.598 1.00 0.00 C ATOM 1964 CG GLU A 113 9.412 -16.249 -17.106 1.00 0.00 C ATOM 1965 CD GLU A 113 10.327 -17.277 -16.437 1.00 0.00 C ATOM 1966 OE1 GLU A 113 10.778 -17.010 -15.336 1.00 0.00 O ATOM 1967 OE2 GLU A 113 10.561 -18.312 -17.038 1.00 0.00 O ATOM 0 H GLU A 113 5.450 -15.946 -16.064 1.00 0.00 H new ATOM 0 HA GLU A 113 7.514 -14.797 -17.971 1.00 0.00 H new ATOM 0 HB2 GLU A 113 7.905 -16.092 -15.565 1.00 0.00 H new ATOM 0 HB3 GLU A 113 7.712 -17.487 -16.607 1.00 0.00 H new ATOM 0 HG2 GLU A 113 9.443 -16.370 -18.189 1.00 0.00 H new ATOM 0 HG3 GLU A 113 9.761 -15.240 -16.888 1.00 0.00 H new ATOM 1974 N THR A 114 6.686 -16.194 -19.851 1.00 0.00 N ATOM 1975 CA THR A 114 6.153 -17.029 -20.979 1.00 0.00 C ATOM 1976 C THR A 114 4.636 -17.245 -20.825 1.00 0.00 C ATOM 1977 O THR A 114 4.132 -18.319 -21.096 1.00 0.00 O ATOM 1978 CB THR A 114 6.901 -18.367 -20.887 1.00 0.00 C ATOM 1979 OG1 THR A 114 8.251 -18.148 -20.459 1.00 0.00 O ATOM 1980 CG2 THR A 114 6.885 -19.058 -22.257 1.00 0.00 C ATOM 0 H THR A 114 7.226 -15.378 -20.139 1.00 0.00 H new ATOM 0 HA THR A 114 6.304 -16.547 -21.945 1.00 0.00 H new ATOM 0 HB THR A 114 6.405 -19.007 -20.157 1.00 0.00 H new ATOM 0 HG1 THR A 114 8.719 -19.007 -20.402 1.00 0.00 H new ATOM 0 HG21 THR A 114 7.416 -20.008 -22.192 1.00 0.00 H new ATOM 0 HG22 THR A 114 5.854 -19.239 -22.561 1.00 0.00 H new ATOM 0 HG23 THR A 114 7.374 -18.419 -22.993 1.00 0.00 H new ATOM 1988 N ASN A 115 3.905 -16.237 -20.391 1.00 0.00 N ATOM 1989 CA ASN A 115 2.430 -16.399 -20.223 1.00 0.00 C ATOM 1990 C ASN A 115 1.707 -15.097 -20.607 1.00 0.00 C ATOM 1991 O ASN A 115 2.316 -14.178 -21.118 1.00 0.00 O ATOM 1992 CB ASN A 115 2.235 -16.705 -18.736 1.00 0.00 C ATOM 1993 CG ASN A 115 2.064 -18.216 -18.539 1.00 0.00 C ATOM 1994 OD1 ASN A 115 2.938 -18.870 -18.004 1.00 0.00 O ATOM 1995 ND2 ASN A 115 0.969 -18.810 -18.949 1.00 0.00 N ATOM 0 H ASN A 115 4.270 -15.316 -20.149 1.00 0.00 H new ATOM 0 HA ASN A 115 2.023 -17.186 -20.858 1.00 0.00 H new ATOM 0 HB2 ASN A 115 3.093 -16.349 -18.166 1.00 0.00 H new ATOM 0 HB3 ASN A 115 1.359 -16.177 -18.358 1.00 0.00 H new ATOM 0 HD21 ASN A 115 0.854 -19.815 -18.818 1.00 0.00 H new ATOM 0 HD22 ASN A 115 0.232 -18.267 -19.399 1.00 0.00 H new ATOM 2002 N ASN A 116 0.414 -15.008 -20.364 1.00 0.00 N ATOM 2003 CA ASN A 116 -0.329 -13.759 -20.719 1.00 0.00 C ATOM 2004 C ASN A 116 -0.815 -13.051 -19.444 1.00 0.00 C ATOM 2005 O ASN A 116 -1.992 -13.063 -19.135 1.00 0.00 O ATOM 2006 CB ASN A 116 -1.517 -14.225 -21.567 1.00 0.00 C ATOM 2007 CG ASN A 116 -1.003 -14.923 -22.832 1.00 0.00 C ATOM 2008 OD1 ASN A 116 -0.780 -16.117 -22.827 1.00 0.00 O ATOM 2009 ND2 ASN A 116 -0.803 -14.229 -23.926 1.00 0.00 N ATOM 0 H ASN A 116 -0.150 -15.743 -19.938 1.00 0.00 H new ATOM 0 HA ASN A 116 0.296 -13.047 -21.258 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -2.142 -14.907 -20.991 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -2.140 -13.373 -21.837 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -0.462 -14.692 -24.768 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -0.989 -13.226 -23.935 1.00 0.00 H new ATOM 2016 N GLY A 117 0.080 -12.433 -18.699 1.00 0.00 N ATOM 2017 CA GLY A 117 -0.342 -11.729 -17.451 1.00 0.00 C ATOM 2018 C GLY A 117 -0.271 -10.211 -17.669 1.00 0.00 C ATOM 2019 O GLY A 117 -0.098 -9.752 -18.783 1.00 0.00 O ATOM 0 H GLY A 117 1.078 -12.389 -18.905 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -1.357 -12.021 -17.182 1.00 0.00 H new ATOM 0 HA3 GLY A 117 0.304 -12.018 -16.622 1.00 0.00 H new ATOM 2023 N SER A 118 -0.405 -9.424 -16.620 1.00 0.00 N ATOM 2024 CA SER A 118 -0.345 -7.940 -16.786 1.00 0.00 C ATOM 2025 C SER A 118 0.334 -7.292 -15.567 1.00 0.00 C ATOM 2026 O SER A 118 0.010 -7.605 -14.437 1.00 0.00 O ATOM 2027 CB SER A 118 -1.803 -7.494 -16.886 1.00 0.00 C ATOM 2028 OG SER A 118 -2.378 -8.036 -18.068 1.00 0.00 O ATOM 0 H SER A 118 -0.552 -9.748 -15.664 1.00 0.00 H new ATOM 0 HA SER A 118 0.233 -7.647 -17.662 1.00 0.00 H new ATOM 0 HB2 SER A 118 -2.359 -7.829 -16.010 1.00 0.00 H new ATOM 0 HB3 SER A 118 -1.862 -6.406 -16.904 1.00 0.00 H new ATOM 0 HG SER A 118 -3.314 -7.754 -18.136 1.00 0.00 H new ATOM 2034 N THR A 119 1.271 -6.390 -15.785 1.00 0.00 N ATOM 2035 CA THR A 119 1.957 -5.731 -14.634 1.00 0.00 C ATOM 2036 C THR A 119 1.842 -4.206 -14.751 1.00 0.00 C ATOM 2037 O THR A 119 1.461 -3.690 -15.786 1.00 0.00 O ATOM 2038 CB THR A 119 3.425 -6.147 -14.746 1.00 0.00 C ATOM 2039 OG1 THR A 119 3.504 -7.505 -15.159 1.00 0.00 O ATOM 2040 CG2 THR A 119 4.109 -5.980 -13.386 1.00 0.00 C ATOM 0 H THR A 119 1.584 -6.088 -16.707 1.00 0.00 H new ATOM 0 HA THR A 119 1.516 -6.022 -13.680 1.00 0.00 H new ATOM 0 HB THR A 119 3.926 -5.517 -15.481 1.00 0.00 H new ATOM 0 HG1 THR A 119 2.817 -8.028 -14.696 1.00 0.00 H new ATOM 0 HG21 THR A 119 5.155 -6.276 -13.466 1.00 0.00 H new ATOM 0 HG22 THR A 119 4.050 -4.937 -13.075 1.00 0.00 H new ATOM 0 HG23 THR A 119 3.609 -6.608 -12.648 1.00 0.00 H new ATOM 2048 N CYS A 120 2.188 -3.477 -13.710 1.00 0.00 N ATOM 2049 CA CYS A 120 2.117 -1.984 -13.796 1.00 0.00 C ATOM 2050 C CYS A 120 3.480 -1.443 -14.255 1.00 0.00 C ATOM 2051 O CYS A 120 4.495 -2.086 -14.060 1.00 0.00 O ATOM 2052 CB CYS A 120 1.778 -1.484 -12.388 1.00 0.00 C ATOM 2053 SG CYS A 120 1.532 0.302 -12.452 1.00 0.00 S ATOM 0 H CYS A 120 2.512 -3.849 -12.817 1.00 0.00 H new ATOM 0 HA CYS A 120 1.365 -1.648 -14.510 1.00 0.00 H new ATOM 0 HB2 CYS A 120 0.878 -1.976 -12.019 1.00 0.00 H new ATOM 0 HB3 CYS A 120 2.583 -1.730 -11.696 1.00 0.00 H new ATOM 2058 N ILE A 121 3.519 -0.281 -14.875 1.00 0.00 N ATOM 2059 CA ILE A 121 4.843 0.260 -15.351 1.00 0.00 C ATOM 2060 C ILE A 121 5.710 0.716 -14.161 1.00 0.00 C ATOM 2061 O ILE A 121 6.918 0.569 -14.193 1.00 0.00 O ATOM 2062 CB ILE A 121 4.519 1.432 -16.312 1.00 0.00 C ATOM 2063 CG1 ILE A 121 5.778 1.819 -17.120 1.00 0.00 C ATOM 2064 CG2 ILE A 121 3.978 2.647 -15.541 1.00 0.00 C ATOM 2065 CD1 ILE A 121 6.854 2.472 -16.232 1.00 0.00 C ATOM 0 H ILE A 121 2.709 0.307 -15.070 1.00 0.00 H new ATOM 0 HA ILE A 121 5.422 -0.505 -15.867 1.00 0.00 H new ATOM 0 HB ILE A 121 3.743 1.103 -17.003 1.00 0.00 H new ATOM 0 HG12 ILE A 121 6.191 0.930 -17.596 1.00 0.00 H new ATOM 0 HG13 ILE A 121 5.500 2.507 -17.918 1.00 0.00 H new ATOM 0 HG21 ILE A 121 3.759 3.454 -16.240 1.00 0.00 H new ATOM 0 HG22 ILE A 121 3.066 2.367 -15.014 1.00 0.00 H new ATOM 0 HG23 ILE A 121 4.724 2.983 -14.821 1.00 0.00 H new ATOM 0 HD11 ILE A 121 7.721 2.728 -16.840 1.00 0.00 H new ATOM 0 HD12 ILE A 121 6.450 3.376 -15.777 1.00 0.00 H new ATOM 0 HD13 ILE A 121 7.153 1.774 -15.450 1.00 0.00 H new ATOM 2077 N CYS A 122 5.124 1.280 -13.120 1.00 0.00 N ATOM 2078 CA CYS A 122 5.974 1.748 -11.963 1.00 0.00 C ATOM 2079 C CYS A 122 6.844 0.595 -11.418 1.00 0.00 C ATOM 2080 O CYS A 122 7.970 0.816 -11.012 1.00 0.00 O ATOM 2081 CB CYS A 122 5.012 2.346 -10.899 1.00 0.00 C ATOM 2082 SG CYS A 122 4.210 1.062 -9.885 1.00 0.00 S ATOM 0 H CYS A 122 4.121 1.434 -13.021 1.00 0.00 H new ATOM 0 HA CYS A 122 6.681 2.517 -12.274 1.00 0.00 H new ATOM 0 HB2 CYS A 122 5.568 3.022 -10.250 1.00 0.00 H new ATOM 0 HB3 CYS A 122 4.247 2.941 -11.398 1.00 0.00 H new ATOM 2087 N ARG A 123 6.355 -0.631 -11.433 1.00 0.00 N ATOM 2088 CA ARG A 123 7.208 -1.774 -10.937 1.00 0.00 C ATOM 2089 C ARG A 123 8.498 -1.858 -11.773 1.00 0.00 C ATOM 2090 O ARG A 123 9.552 -2.179 -11.256 1.00 0.00 O ATOM 2091 CB ARG A 123 6.387 -3.059 -11.120 1.00 0.00 C ATOM 2092 CG ARG A 123 6.847 -4.107 -10.104 1.00 0.00 C ATOM 2093 CD ARG A 123 6.709 -5.504 -10.713 1.00 0.00 C ATOM 2094 NE ARG A 123 8.070 -5.832 -11.238 1.00 0.00 N ATOM 2095 CZ ARG A 123 9.072 -6.117 -10.422 1.00 0.00 C ATOM 2096 NH1 ARG A 123 8.913 -6.125 -9.118 1.00 0.00 N ATOM 2097 NH2 ARG A 123 10.250 -6.397 -10.918 1.00 0.00 N ATOM 0 H ARG A 123 5.423 -0.888 -11.759 1.00 0.00 H new ATOM 0 HA ARG A 123 7.484 -1.632 -9.892 1.00 0.00 H new ATOM 0 HB2 ARG A 123 5.326 -2.848 -10.986 1.00 0.00 H new ATOM 0 HB3 ARG A 123 6.510 -3.441 -12.133 1.00 0.00 H new ATOM 0 HG2 ARG A 123 7.883 -3.923 -9.820 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.250 -4.034 -9.195 1.00 0.00 H new ATOM 0 HD2 ARG A 123 6.388 -6.230 -9.966 1.00 0.00 H new ATOM 0 HD3 ARG A 123 5.965 -5.516 -11.510 1.00 0.00 H new ATOM 0 HE ARG A 123 8.229 -5.836 -12.245 1.00 0.00 H new ATOM 0 HH11 ARG A 123 8.002 -5.908 -8.714 1.00 0.00 H new ATOM 0 HH12 ARG A 123 9.701 -6.348 -8.510 1.00 0.00 H new ATOM 0 HH21 ARG A 123 10.392 -6.395 -11.928 1.00 0.00 H new ATOM 0 HH22 ARG A 123 11.027 -6.618 -10.295 1.00 0.00 H new ATOM 2111 N VAL A 124 8.428 -1.567 -13.062 1.00 0.00 N ATOM 2112 CA VAL A 124 9.668 -1.631 -13.909 1.00 0.00 C ATOM 2113 C VAL A 124 10.518 -0.366 -13.687 1.00 0.00 C ATOM 2114 O VAL A 124 10.025 0.732 -13.858 1.00 0.00 O ATOM 2115 CB VAL A 124 9.195 -1.697 -15.373 1.00 0.00 C ATOM 2116 CG1 VAL A 124 10.408 -1.815 -16.299 1.00 0.00 C ATOM 2117 CG2 VAL A 124 8.286 -2.916 -15.568 1.00 0.00 C ATOM 0 H VAL A 124 7.577 -1.293 -13.554 1.00 0.00 H new ATOM 0 HA VAL A 124 10.279 -2.496 -13.653 1.00 0.00 H new ATOM 0 HB VAL A 124 8.641 -0.790 -15.612 1.00 0.00 H new ATOM 0 HG11 VAL A 124 10.072 -1.862 -17.335 1.00 0.00 H new ATOM 0 HG12 VAL A 124 11.053 -0.947 -16.166 1.00 0.00 H new ATOM 0 HG13 VAL A 124 10.964 -2.721 -16.057 1.00 0.00 H new ATOM 0 HG21 VAL A 124 7.953 -2.960 -16.605 1.00 0.00 H new ATOM 0 HG22 VAL A 124 8.838 -3.824 -15.326 1.00 0.00 H new ATOM 0 HG23 VAL A 124 7.419 -2.832 -14.912 1.00 0.00 H new ATOM 2127 N PRO A 125 11.772 -0.544 -13.323 1.00 0.00 N ATOM 2128 CA PRO A 125 12.664 0.625 -13.100 1.00 0.00 C ATOM 2129 C PRO A 125 12.893 1.393 -14.412 1.00 0.00 C ATOM 2130 O PRO A 125 12.446 0.975 -15.463 1.00 0.00 O ATOM 2131 CB PRO A 125 13.963 -0.003 -12.592 1.00 0.00 C ATOM 2132 CG PRO A 125 13.927 -1.404 -13.105 1.00 0.00 C ATOM 2133 CD PRO A 125 12.480 -1.813 -13.089 1.00 0.00 C ATOM 0 HA PRO A 125 12.249 1.351 -12.401 1.00 0.00 H new ATOM 0 HB2 PRO A 125 14.835 0.534 -12.965 1.00 0.00 H new ATOM 0 HB3 PRO A 125 14.016 0.020 -11.504 1.00 0.00 H new ATOM 0 HG2 PRO A 125 14.338 -1.461 -14.113 1.00 0.00 H new ATOM 0 HG3 PRO A 125 14.526 -2.065 -12.479 1.00 0.00 H new ATOM 0 HD2 PRO A 125 12.260 -2.546 -13.865 1.00 0.00 H new ATOM 0 HD3 PRO A 125 12.198 -2.262 -12.137 1.00 0.00 H new ATOM 2141 N ARG A 126 13.582 2.518 -14.361 1.00 0.00 N ATOM 2142 CA ARG A 126 13.824 3.304 -15.624 1.00 0.00 C ATOM 2143 C ARG A 126 14.898 2.624 -16.491 1.00 0.00 C ATOM 2144 O ARG A 126 14.812 2.643 -17.705 1.00 0.00 O ATOM 2145 CB ARG A 126 14.301 4.699 -15.189 1.00 0.00 C ATOM 2146 CG ARG A 126 14.400 5.610 -16.415 1.00 0.00 C ATOM 2147 CD ARG A 126 12.995 6.034 -16.851 1.00 0.00 C ATOM 2148 NE ARG A 126 13.211 6.934 -18.025 1.00 0.00 N ATOM 2149 CZ ARG A 126 13.662 8.170 -17.870 1.00 0.00 C ATOM 2150 NH1 ARG A 126 13.937 8.655 -16.679 1.00 0.00 N ATOM 2151 NH2 ARG A 126 13.838 8.929 -18.920 1.00 0.00 N ATOM 0 H ARG A 126 13.981 2.921 -13.513 1.00 0.00 H new ATOM 0 HA ARG A 126 12.915 3.364 -16.222 1.00 0.00 H new ATOM 0 HB2 ARG A 126 13.607 5.122 -14.463 1.00 0.00 H new ATOM 0 HB3 ARG A 126 15.271 4.626 -14.697 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.000 6.489 -16.181 1.00 0.00 H new ATOM 0 HG3 ARG A 126 14.903 5.088 -17.229 1.00 0.00 H new ATOM 0 HD2 ARG A 126 12.388 5.170 -17.122 1.00 0.00 H new ATOM 0 HD3 ARG A 126 12.472 6.552 -16.047 1.00 0.00 H new ATOM 0 HE ARG A 126 13.007 6.590 -18.963 1.00 0.00 H new ATOM 0 HH11 ARG A 126 13.804 8.076 -15.850 1.00 0.00 H new ATOM 0 HH12 ARG A 126 14.283 9.610 -16.585 1.00 0.00 H new ATOM 0 HH21 ARG A 126 13.628 8.568 -19.851 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.185 9.882 -18.808 1.00 0.00 H new ATOM 2165 N ALA A 127 15.912 2.028 -15.890 1.00 0.00 N ATOM 2166 CA ALA A 127 16.982 1.359 -16.721 1.00 0.00 C ATOM 2167 C ALA A 127 16.351 0.291 -17.629 1.00 0.00 C ATOM 2168 O ALA A 127 16.718 0.167 -18.783 1.00 0.00 O ATOM 2169 CB ALA A 127 17.967 0.706 -15.739 1.00 0.00 C ATOM 0 H ALA A 127 16.045 1.975 -14.880 1.00 0.00 H new ATOM 0 HA ALA A 127 17.491 2.081 -17.359 1.00 0.00 H new ATOM 0 HB1 ALA A 127 18.761 0.209 -16.297 1.00 0.00 H new ATOM 0 HB2 ALA A 127 18.401 1.472 -15.095 1.00 0.00 H new ATOM 0 HB3 ALA A 127 17.440 -0.026 -15.127 1.00 0.00 H new ATOM 2175 N GLN A 128 15.401 -0.470 -17.126 1.00 0.00 N ATOM 2176 CA GLN A 128 14.752 -1.512 -17.997 1.00 0.00 C ATOM 2177 C GLN A 128 13.895 -0.818 -19.064 1.00 0.00 C ATOM 2178 O GLN A 128 13.899 -1.211 -20.217 1.00 0.00 O ATOM 2179 CB GLN A 128 13.874 -2.379 -17.081 1.00 0.00 C ATOM 2180 CG GLN A 128 13.498 -3.672 -17.808 1.00 0.00 C ATOM 2181 CD GLN A 128 14.588 -4.726 -17.575 1.00 0.00 C ATOM 2182 OE1 GLN A 128 14.537 -5.458 -16.607 1.00 0.00 O ATOM 2183 NE2 GLN A 128 15.581 -4.838 -18.423 1.00 0.00 N ATOM 0 H GLN A 128 15.052 -0.418 -16.169 1.00 0.00 H new ATOM 0 HA GLN A 128 15.494 -2.128 -18.506 1.00 0.00 H new ATOM 0 HB2 GLN A 128 14.408 -2.610 -16.159 1.00 0.00 H new ATOM 0 HB3 GLN A 128 12.974 -1.833 -16.799 1.00 0.00 H new ATOM 0 HG2 GLN A 128 12.538 -4.040 -17.445 1.00 0.00 H new ATOM 0 HG3 GLN A 128 13.384 -3.482 -18.875 1.00 0.00 H new ATOM 0 HE21 GLN A 128 15.628 -4.225 -19.237 1.00 0.00 H new ATOM 0 HE22 GLN A 128 16.307 -5.538 -18.269 1.00 0.00 H new ATOM 2192 N LEU A 129 13.171 0.224 -18.699 1.00 0.00 N ATOM 2193 CA LEU A 129 12.334 0.941 -19.724 1.00 0.00 C ATOM 2194 C LEU A 129 13.251 1.602 -20.766 1.00 0.00 C ATOM 2195 O LEU A 129 12.947 1.603 -21.944 1.00 0.00 O ATOM 2196 CB LEU A 129 11.527 2.012 -18.971 1.00 0.00 C ATOM 2197 CG LEU A 129 10.265 1.380 -18.381 1.00 0.00 C ATOM 2198 CD1 LEU A 129 9.939 2.041 -17.041 1.00 0.00 C ATOM 2199 CD2 LEU A 129 9.094 1.581 -19.347 1.00 0.00 C ATOM 0 H LEU A 129 13.124 0.602 -17.753 1.00 0.00 H new ATOM 0 HA LEU A 129 11.669 0.253 -20.246 1.00 0.00 H new ATOM 0 HB2 LEU A 129 12.133 2.448 -18.177 1.00 0.00 H new ATOM 0 HB3 LEU A 129 11.258 2.823 -19.648 1.00 0.00 H new ATOM 0 HG LEU A 129 10.432 0.314 -18.228 1.00 0.00 H new ATOM 0 HD11 LEU A 129 9.040 1.590 -16.622 1.00 0.00 H new ATOM 0 HD12 LEU A 129 10.772 1.898 -16.352 1.00 0.00 H new ATOM 0 HD13 LEU A 129 9.773 3.108 -17.192 1.00 0.00 H new ATOM 0 HD21 LEU A 129 8.195 1.131 -18.927 1.00 0.00 H new ATOM 0 HD22 LEU A 129 8.928 2.647 -19.501 1.00 0.00 H new ATOM 0 HD23 LEU A 129 9.325 1.108 -20.302 1.00 0.00 H new ATOM 2211 N GLU A 130 14.376 2.157 -20.349 1.00 0.00 N ATOM 2212 CA GLU A 130 15.298 2.805 -21.351 1.00 0.00 C ATOM 2213 C GLU A 130 15.779 1.758 -22.367 1.00 0.00 C ATOM 2214 O GLU A 130 15.876 2.041 -23.547 1.00 0.00 O ATOM 2215 CB GLU A 130 16.493 3.364 -20.560 1.00 0.00 C ATOM 2216 CG GLU A 130 16.180 4.790 -20.099 1.00 0.00 C ATOM 2217 CD GLU A 130 16.749 5.791 -21.106 1.00 0.00 C ATOM 2218 OE1 GLU A 130 17.931 6.082 -21.019 1.00 0.00 O ATOM 2219 OE2 GLU A 130 15.994 6.249 -21.947 1.00 0.00 O ATOM 0 H GLU A 130 14.690 2.189 -19.379 1.00 0.00 H new ATOM 0 HA GLU A 130 14.790 3.598 -21.900 1.00 0.00 H new ATOM 0 HB2 GLU A 130 16.701 2.730 -19.698 1.00 0.00 H new ATOM 0 HB3 GLU A 130 17.388 3.360 -21.182 1.00 0.00 H new ATOM 0 HG2 GLU A 130 15.102 4.925 -20.006 1.00 0.00 H new ATOM 0 HG3 GLU A 130 16.609 4.967 -19.113 1.00 0.00 H new ATOM 2226 N GLU A 131 16.080 0.551 -21.927 1.00 0.00 N ATOM 2227 CA GLU A 131 16.552 -0.500 -22.902 1.00 0.00 C ATOM 2228 C GLU A 131 15.487 -0.742 -23.983 1.00 0.00 C ATOM 2229 O GLU A 131 15.812 -0.962 -25.135 1.00 0.00 O ATOM 2230 CB GLU A 131 16.783 -1.787 -22.092 1.00 0.00 C ATOM 2231 CG GLU A 131 17.690 -2.732 -22.883 1.00 0.00 C ATOM 2232 CD GLU A 131 19.131 -2.222 -22.827 1.00 0.00 C ATOM 2233 OE1 GLU A 131 19.824 -2.566 -21.884 1.00 0.00 O ATOM 2234 OE2 GLU A 131 19.518 -1.497 -23.728 1.00 0.00 O ATOM 0 H GLU A 131 16.021 0.251 -20.954 1.00 0.00 H new ATOM 0 HA GLU A 131 17.466 -0.182 -23.403 1.00 0.00 H new ATOM 0 HB2 GLU A 131 17.239 -1.548 -21.131 1.00 0.00 H new ATOM 0 HB3 GLU A 131 15.830 -2.272 -21.881 1.00 0.00 H new ATOM 0 HG2 GLU A 131 17.633 -3.739 -22.469 1.00 0.00 H new ATOM 0 HG3 GLU A 131 17.355 -2.793 -23.918 1.00 0.00 H new ATOM 2241 N GLU A 132 14.217 -0.706 -23.628 1.00 0.00 N ATOM 2242 CA GLU A 132 13.148 -0.941 -24.664 1.00 0.00 C ATOM 2243 C GLU A 132 13.227 0.136 -25.756 1.00 0.00 C ATOM 2244 O GLU A 132 13.150 -0.169 -26.931 1.00 0.00 O ATOM 2245 CB GLU A 132 11.796 -0.857 -23.936 1.00 0.00 C ATOM 2246 CG GLU A 132 11.518 -2.180 -23.220 1.00 0.00 C ATOM 2247 CD GLU A 132 10.653 -1.922 -21.986 1.00 0.00 C ATOM 2248 OE1 GLU A 132 9.706 -1.160 -22.099 1.00 0.00 O ATOM 2249 OE2 GLU A 132 10.951 -2.490 -20.947 1.00 0.00 O ATOM 0 H GLU A 132 13.878 -0.527 -22.683 1.00 0.00 H new ATOM 0 HA GLU A 132 13.274 -1.912 -25.143 1.00 0.00 H new ATOM 0 HB2 GLU A 132 11.809 -0.038 -23.217 1.00 0.00 H new ATOM 0 HB3 GLU A 132 11.000 -0.643 -24.649 1.00 0.00 H new ATOM 0 HG2 GLU A 132 11.011 -2.871 -23.894 1.00 0.00 H new ATOM 0 HG3 GLU A 132 12.456 -2.651 -22.927 1.00 0.00 H new ATOM 2256 N ALA A 133 13.377 1.394 -25.385 1.00 0.00 N ATOM 2257 CA ALA A 133 13.457 2.471 -26.438 1.00 0.00 C ATOM 2258 C ALA A 133 14.666 2.221 -27.351 1.00 0.00 C ATOM 2259 O ALA A 133 14.573 2.371 -28.557 1.00 0.00 O ATOM 2260 CB ALA A 133 13.618 3.808 -25.698 1.00 0.00 C ATOM 0 H ALA A 133 13.446 1.717 -24.420 1.00 0.00 H new ATOM 0 HA ALA A 133 12.563 2.478 -27.061 1.00 0.00 H new ATOM 0 HB1 ALA A 133 13.680 4.620 -26.423 1.00 0.00 H new ATOM 0 HB2 ALA A 133 12.759 3.969 -25.046 1.00 0.00 H new ATOM 0 HB3 ALA A 133 14.529 3.785 -25.099 1.00 0.00 H new ATOM 2266 N ARG A 134 15.799 1.835 -26.797 1.00 0.00 N ATOM 2267 CA ARG A 134 17.003 1.574 -27.667 1.00 0.00 C ATOM 2268 C ARG A 134 16.689 0.468 -28.690 1.00 0.00 C ATOM 2269 O ARG A 134 17.140 0.522 -29.819 1.00 0.00 O ATOM 2270 CB ARG A 134 18.137 1.121 -26.733 1.00 0.00 C ATOM 2271 CG ARG A 134 18.816 2.347 -26.120 1.00 0.00 C ATOM 2272 CD ARG A 134 19.669 1.912 -24.917 1.00 0.00 C ATOM 2273 NE ARG A 134 20.900 2.783 -24.932 1.00 0.00 N ATOM 2274 CZ ARG A 134 22.033 2.378 -24.374 1.00 0.00 C ATOM 2275 NH1 ARG A 134 22.121 1.223 -23.753 1.00 0.00 N ATOM 2276 NH2 ARG A 134 23.089 3.149 -24.424 1.00 0.00 N ATOM 0 H ARG A 134 15.942 1.691 -25.797 1.00 0.00 H new ATOM 0 HA ARG A 134 17.285 2.469 -28.221 1.00 0.00 H new ATOM 0 HB2 ARG A 134 17.740 0.481 -25.945 1.00 0.00 H new ATOM 0 HB3 ARG A 134 18.865 0.529 -27.288 1.00 0.00 H new ATOM 0 HG2 ARG A 134 19.442 2.840 -26.864 1.00 0.00 H new ATOM 0 HG3 ARG A 134 18.066 3.072 -25.804 1.00 0.00 H new ATOM 0 HD2 ARG A 134 19.117 2.035 -23.985 1.00 0.00 H new ATOM 0 HD3 ARG A 134 19.938 0.858 -24.992 1.00 0.00 H new ATOM 0 HE ARG A 134 20.861 3.699 -25.379 1.00 0.00 H new ATOM 0 HH11 ARG A 134 21.305 0.614 -23.691 1.00 0.00 H new ATOM 0 HH12 ARG A 134 23.005 0.936 -23.333 1.00 0.00 H new ATOM 0 HH21 ARG A 134 23.037 4.055 -24.890 1.00 0.00 H new ATOM 0 HH22 ARG A 134 23.964 2.844 -23.997 1.00 0.00 H new ATOM 2290 N LYS A 135 15.923 -0.539 -28.309 1.00 0.00 N ATOM 2291 CA LYS A 135 15.600 -1.643 -29.286 1.00 0.00 C ATOM 2292 C LYS A 135 14.738 -1.112 -30.446 1.00 0.00 C ATOM 2293 O LYS A 135 14.861 -1.578 -31.564 1.00 0.00 O ATOM 2294 CB LYS A 135 14.826 -2.715 -28.503 1.00 0.00 C ATOM 2295 CG LYS A 135 15.800 -3.514 -27.634 1.00 0.00 C ATOM 2296 CD LYS A 135 15.083 -4.733 -27.051 1.00 0.00 C ATOM 2297 CE LYS A 135 15.816 -5.204 -25.793 1.00 0.00 C ATOM 2298 NZ LYS A 135 17.096 -5.785 -26.288 1.00 0.00 N ATOM 0 H LYS A 135 15.514 -0.644 -27.381 1.00 0.00 H new ATOM 0 HA LYS A 135 16.513 -2.050 -29.720 1.00 0.00 H new ATOM 0 HB2 LYS A 135 14.065 -2.246 -27.879 1.00 0.00 H new ATOM 0 HB3 LYS A 135 14.307 -3.381 -29.193 1.00 0.00 H new ATOM 0 HG2 LYS A 135 16.657 -3.833 -28.228 1.00 0.00 H new ATOM 0 HG3 LYS A 135 16.185 -2.887 -26.830 1.00 0.00 H new ATOM 0 HD2 LYS A 135 14.051 -4.480 -26.810 1.00 0.00 H new ATOM 0 HD3 LYS A 135 15.051 -5.536 -27.788 1.00 0.00 H new ATOM 0 HE2 LYS A 135 15.997 -4.376 -25.108 1.00 0.00 H new ATOM 0 HE3 LYS A 135 15.230 -5.945 -25.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 135 17.518 -6.378 -25.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 135 16.911 -6.365 -27.131 1.00 0.00 H new ATOM 0 HZ3 LYS A 135 17.754 -5.018 -26.534 1.00 0.00 H new ATOM 2312 N LYS A 136 13.864 -0.152 -30.203 1.00 0.00 N ATOM 2313 CA LYS A 136 13.011 0.374 -31.322 1.00 0.00 C ATOM 2314 C LYS A 136 13.477 1.768 -31.796 1.00 0.00 C ATOM 2315 O LYS A 136 12.708 2.500 -32.391 1.00 0.00 O ATOM 2316 CB LYS A 136 11.593 0.452 -30.749 1.00 0.00 C ATOM 2317 CG LYS A 136 10.870 -0.873 -30.996 1.00 0.00 C ATOM 2318 CD LYS A 136 9.413 -0.754 -30.543 1.00 0.00 C ATOM 2319 CE LYS A 136 9.361 -0.612 -29.021 1.00 0.00 C ATOM 2320 NZ LYS A 136 7.959 -0.948 -28.651 1.00 0.00 N ATOM 0 H LYS A 136 13.708 0.282 -29.293 1.00 0.00 H new ATOM 0 HA LYS A 136 13.072 -0.275 -32.196 1.00 0.00 H new ATOM 0 HB2 LYS A 136 11.632 0.664 -29.680 1.00 0.00 H new ATOM 0 HB3 LYS A 136 11.045 1.270 -31.216 1.00 0.00 H new ATOM 0 HG2 LYS A 136 10.913 -1.131 -32.054 1.00 0.00 H new ATOM 0 HG3 LYS A 136 11.366 -1.677 -30.452 1.00 0.00 H new ATOM 0 HD2 LYS A 136 8.944 0.109 -31.015 1.00 0.00 H new ATOM 0 HD3 LYS A 136 8.851 -1.634 -30.856 1.00 0.00 H new ATOM 0 HE2 LYS A 136 10.069 -1.285 -28.537 1.00 0.00 H new ATOM 0 HE3 LYS A 136 9.620 0.400 -28.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 7.845 -0.873 -27.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 7.308 -0.287 -29.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 7.743 -1.919 -28.953 1.00 0.00 H new ATOM 2334 N GLY A 137 14.723 2.147 -31.562 1.00 0.00 N ATOM 2335 CA GLY A 137 15.210 3.487 -32.026 1.00 0.00 C ATOM 2336 C GLY A 137 14.260 4.606 -31.559 1.00 0.00 C ATOM 2337 O GLY A 137 13.901 5.474 -32.333 1.00 0.00 O ATOM 0 H GLY A 137 15.417 1.583 -31.071 1.00 0.00 H new ATOM 0 HA2 GLY A 137 16.212 3.669 -31.638 1.00 0.00 H new ATOM 0 HA3 GLY A 137 15.283 3.496 -33.114 1.00 0.00 H new ATOM 2341 N THR A 138 13.856 4.600 -30.306 1.00 0.00 N ATOM 2342 CA THR A 138 12.940 5.674 -29.813 1.00 0.00 C ATOM 2343 C THR A 138 13.366 6.127 -28.406 1.00 0.00 C ATOM 2344 O THR A 138 14.474 5.857 -27.980 1.00 0.00 O ATOM 2345 CB THR A 138 11.545 5.036 -29.793 1.00 0.00 C ATOM 2346 OG1 THR A 138 10.598 5.993 -29.340 1.00 0.00 O ATOM 2347 CG2 THR A 138 11.533 3.825 -28.858 1.00 0.00 C ATOM 0 H THR A 138 14.121 3.902 -29.611 1.00 0.00 H new ATOM 0 HA THR A 138 12.961 6.562 -30.445 1.00 0.00 H new ATOM 0 HB THR A 138 11.287 4.709 -30.800 1.00 0.00 H new ATOM 0 HG1 THR A 138 9.705 5.589 -29.328 1.00 0.00 H new ATOM 0 HG21 THR A 138 10.538 3.380 -28.852 1.00 0.00 H new ATOM 0 HG22 THR A 138 12.257 3.089 -29.207 1.00 0.00 H new ATOM 0 HG23 THR A 138 11.795 4.142 -27.849 1.00 0.00 H new ATOM 2355 N GLN A 139 12.506 6.814 -27.680 1.00 0.00 N ATOM 2356 CA GLN A 139 12.886 7.275 -26.311 1.00 0.00 C ATOM 2357 C GLN A 139 11.714 7.088 -25.334 1.00 0.00 C ATOM 2358 O GLN A 139 10.564 7.221 -25.710 1.00 0.00 O ATOM 2359 CB GLN A 139 13.216 8.759 -26.470 1.00 0.00 C ATOM 2360 CG GLN A 139 14.703 8.921 -26.792 1.00 0.00 C ATOM 2361 CD GLN A 139 15.213 10.243 -26.203 1.00 0.00 C ATOM 2362 OE1 GLN A 139 15.167 10.439 -25.004 1.00 0.00 O ATOM 2363 NE2 GLN A 139 15.704 11.166 -26.994 1.00 0.00 N ATOM 0 H GLN A 139 11.565 7.071 -27.979 1.00 0.00 H new ATOM 0 HA GLN A 139 13.725 6.709 -25.908 1.00 0.00 H new ATOM 0 HB2 GLN A 139 12.611 9.193 -27.266 1.00 0.00 H new ATOM 0 HB3 GLN A 139 12.971 9.297 -25.554 1.00 0.00 H new ATOM 0 HG2 GLN A 139 15.268 8.085 -26.380 1.00 0.00 H new ATOM 0 HG3 GLN A 139 14.856 8.908 -27.871 1.00 0.00 H new ATOM 0 HE21 GLN A 139 15.745 11.006 -28.001 1.00 0.00 H new ATOM 0 HE22 GLN A 139 16.045 12.044 -26.603 1.00 0.00 H new ATOM 2372 N VAL A 140 11.992 6.789 -24.081 1.00 0.00 N ATOM 2373 CA VAL A 140 10.890 6.605 -23.089 1.00 0.00 C ATOM 2374 C VAL A 140 11.190 7.424 -21.822 1.00 0.00 C ATOM 2375 O VAL A 140 12.320 7.814 -21.590 1.00 0.00 O ATOM 2376 CB VAL A 140 10.871 5.102 -22.778 1.00 0.00 C ATOM 2377 CG1 VAL A 140 12.227 4.661 -22.206 1.00 0.00 C ATOM 2378 CG2 VAL A 140 9.762 4.812 -21.760 1.00 0.00 C ATOM 0 H VAL A 140 12.934 6.666 -23.709 1.00 0.00 H new ATOM 0 HA VAL A 140 9.926 6.944 -23.469 1.00 0.00 H new ATOM 0 HB VAL A 140 10.682 4.547 -23.697 1.00 0.00 H new ATOM 0 HG11 VAL A 140 12.201 3.593 -21.990 1.00 0.00 H new ATOM 0 HG12 VAL A 140 13.012 4.864 -22.934 1.00 0.00 H new ATOM 0 HG13 VAL A 140 12.431 5.212 -21.288 1.00 0.00 H new ATOM 0 HG21 VAL A 140 9.744 3.746 -21.535 1.00 0.00 H new ATOM 0 HG22 VAL A 140 9.953 5.372 -20.845 1.00 0.00 H new ATOM 0 HG23 VAL A 140 8.800 5.112 -22.175 1.00 0.00 H new ATOM 2388 N SER A 141 10.194 7.692 -21.000 1.00 0.00 N ATOM 2389 CA SER A 141 10.454 8.492 -19.759 1.00 0.00 C ATOM 2390 C SER A 141 9.263 8.417 -18.785 1.00 0.00 C ATOM 2391 O SER A 141 8.423 9.297 -18.763 1.00 0.00 O ATOM 2392 CB SER A 141 10.648 9.918 -20.262 1.00 0.00 C ATOM 2393 OG SER A 141 10.931 10.771 -19.160 1.00 0.00 O ATOM 0 H SER A 141 9.228 7.395 -21.135 1.00 0.00 H new ATOM 0 HA SER A 141 11.317 8.120 -19.206 1.00 0.00 H new ATOM 0 HB2 SER A 141 11.465 9.953 -20.983 1.00 0.00 H new ATOM 0 HB3 SER A 141 9.751 10.259 -20.779 1.00 0.00 H new ATOM 0 HG SER A 141 11.058 11.688 -19.481 1.00 0.00 H new ATOM 2399 N PHE A 142 9.189 7.380 -17.976 1.00 0.00 N ATOM 2400 CA PHE A 142 8.054 7.267 -17.003 1.00 0.00 C ATOM 2401 C PHE A 142 8.476 7.833 -15.629 1.00 0.00 C ATOM 2402 O PHE A 142 9.649 7.964 -15.336 1.00 0.00 O ATOM 2403 CB PHE A 142 7.741 5.757 -16.917 1.00 0.00 C ATOM 2404 CG PHE A 142 6.883 5.452 -15.701 1.00 0.00 C ATOM 2405 CD1 PHE A 142 5.498 5.662 -15.727 1.00 0.00 C ATOM 2406 CD2 PHE A 142 7.491 4.973 -14.539 1.00 0.00 C ATOM 2407 CE1 PHE A 142 4.728 5.385 -14.586 1.00 0.00 C ATOM 2408 CE2 PHE A 142 6.728 4.704 -13.410 1.00 0.00 C ATOM 2409 CZ PHE A 142 5.349 4.904 -13.425 1.00 0.00 C ATOM 0 H PHE A 142 9.862 6.614 -17.949 1.00 0.00 H new ATOM 0 HA PHE A 142 7.178 7.834 -17.317 1.00 0.00 H new ATOM 0 HB2 PHE A 142 7.225 5.436 -17.822 1.00 0.00 H new ATOM 0 HB3 PHE A 142 8.671 5.191 -16.863 1.00 0.00 H new ATOM 0 HD1 PHE A 142 5.024 6.036 -16.622 1.00 0.00 H new ATOM 0 HD2 PHE A 142 8.559 4.811 -14.518 1.00 0.00 H new ATOM 0 HE1 PHE A 142 3.660 5.542 -14.603 1.00 0.00 H new ATOM 0 HE2 PHE A 142 7.207 4.337 -12.514 1.00 0.00 H new ATOM 0 HZ PHE A 142 4.761 4.689 -12.545 1.00 0.00 H new ATOM 2419 N HIS A 143 7.516 8.148 -14.786 1.00 0.00 N ATOM 2420 CA HIS A 143 7.840 8.681 -13.428 1.00 0.00 C ATOM 2421 C HIS A 143 6.865 8.079 -12.403 1.00 0.00 C ATOM 2422 O HIS A 143 7.267 7.386 -11.489 1.00 0.00 O ATOM 2423 CB HIS A 143 7.653 10.197 -13.535 1.00 0.00 C ATOM 2424 CG HIS A 143 8.784 10.900 -12.834 1.00 0.00 C ATOM 2425 ND1 HIS A 143 8.599 12.078 -12.127 1.00 0.00 N ATOM 2426 CD2 HIS A 143 10.120 10.601 -12.721 1.00 0.00 C ATOM 2427 CE1 HIS A 143 9.794 12.443 -11.626 1.00 0.00 C ATOM 2428 NE2 HIS A 143 10.756 11.577 -11.959 1.00 0.00 N ATOM 0 H HIS A 143 6.520 8.057 -14.985 1.00 0.00 H new ATOM 0 HA HIS A 143 8.850 8.430 -13.104 1.00 0.00 H new ATOM 0 HB2 HIS A 143 7.620 10.496 -14.583 1.00 0.00 H new ATOM 0 HB3 HIS A 143 6.701 10.488 -13.091 1.00 0.00 H new ATOM 0 HD2 HIS A 143 10.604 9.739 -13.157 1.00 0.00 H new ATOM 0 HE1 HIS A 143 9.956 13.328 -11.028 1.00 0.00 H new ATOM 0 HE2 HIS A 143 11.744 11.622 -11.709 1.00 0.00 H new ATOM 2436 N GLN A 144 5.583 8.322 -12.567 1.00 0.00 N ATOM 2437 CA GLN A 144 4.575 7.749 -11.627 1.00 0.00 C ATOM 2438 C GLN A 144 3.458 7.070 -12.433 1.00 0.00 C ATOM 2439 O GLN A 144 3.183 7.460 -13.553 1.00 0.00 O ATOM 2440 CB GLN A 144 4.029 8.943 -10.828 1.00 0.00 C ATOM 2441 CG GLN A 144 3.426 9.989 -11.778 1.00 0.00 C ATOM 2442 CD GLN A 144 4.390 11.173 -11.930 1.00 0.00 C ATOM 2443 OE1 GLN A 144 4.747 11.535 -13.033 1.00 0.00 O ATOM 2444 NE2 GLN A 144 4.829 11.801 -10.865 1.00 0.00 N ATOM 0 H GLN A 144 5.195 8.895 -13.316 1.00 0.00 H new ATOM 0 HA GLN A 144 5.001 6.997 -10.963 1.00 0.00 H new ATOM 0 HB2 GLN A 144 3.271 8.602 -10.123 1.00 0.00 H new ATOM 0 HB3 GLN A 144 4.830 9.393 -10.241 1.00 0.00 H new ATOM 0 HG2 GLN A 144 3.232 9.540 -12.752 1.00 0.00 H new ATOM 0 HG3 GLN A 144 2.468 10.336 -11.390 1.00 0.00 H new ATOM 0 HE21 GLN A 144 4.532 11.500 -9.937 1.00 0.00 H new ATOM 0 HE22 GLN A 144 5.468 12.590 -10.965 1.00 0.00 H new ATOM 2453 N CYS A 145 2.816 6.057 -11.888 1.00 0.00 N ATOM 2454 CA CYS A 145 1.725 5.375 -12.665 1.00 0.00 C ATOM 2455 C CYS A 145 0.342 5.915 -12.266 1.00 0.00 C ATOM 2456 O CYS A 145 0.157 6.415 -11.172 1.00 0.00 O ATOM 2457 CB CYS A 145 1.847 3.863 -12.384 1.00 0.00 C ATOM 2458 SG CYS A 145 1.471 3.464 -10.649 1.00 0.00 S ATOM 0 H CYS A 145 2.996 5.679 -10.958 1.00 0.00 H new ATOM 0 HA CYS A 145 1.830 5.570 -13.732 1.00 0.00 H new ATOM 0 HB2 CYS A 145 1.168 3.316 -13.038 1.00 0.00 H new ATOM 0 HB3 CYS A 145 2.857 3.529 -12.623 1.00 0.00 H new ATOM 2463 N VAL A 146 -0.629 5.828 -13.155 1.00 0.00 N ATOM 2464 CA VAL A 146 -2.001 6.355 -12.819 1.00 0.00 C ATOM 2465 C VAL A 146 -2.741 5.429 -11.833 1.00 0.00 C ATOM 2466 O VAL A 146 -3.635 5.876 -11.138 1.00 0.00 O ATOM 2467 CB VAL A 146 -2.780 6.467 -14.148 1.00 0.00 C ATOM 2468 CG1 VAL A 146 -1.998 7.352 -15.123 1.00 0.00 C ATOM 2469 CG2 VAL A 146 -2.982 5.075 -14.768 1.00 0.00 C ATOM 0 H VAL A 146 -0.534 5.421 -14.086 1.00 0.00 H new ATOM 0 HA VAL A 146 -1.919 7.325 -12.329 1.00 0.00 H new ATOM 0 HB VAL A 146 -3.756 6.909 -13.950 1.00 0.00 H new ATOM 0 HG11 VAL A 146 -2.546 7.432 -16.062 1.00 0.00 H new ATOM 0 HG12 VAL A 146 -1.871 8.345 -14.691 1.00 0.00 H new ATOM 0 HG13 VAL A 146 -1.020 6.910 -15.311 1.00 0.00 H new ATOM 0 HG21 VAL A 146 -3.532 5.170 -15.704 1.00 0.00 H new ATOM 0 HG22 VAL A 146 -2.011 4.619 -14.963 1.00 0.00 H new ATOM 0 HG23 VAL A 146 -3.546 4.448 -14.078 1.00 0.00 H new ATOM 2479 N HIS A 147 -2.394 4.150 -11.752 1.00 0.00 N ATOM 2480 CA HIS A 147 -3.116 3.238 -10.782 1.00 0.00 C ATOM 2481 C HIS A 147 -3.122 3.866 -9.374 1.00 0.00 C ATOM 2482 O HIS A 147 -4.160 3.997 -8.755 1.00 0.00 O ATOM 2483 CB HIS A 147 -2.342 1.904 -10.760 1.00 0.00 C ATOM 2484 CG HIS A 147 -2.381 1.228 -12.116 1.00 0.00 C ATOM 2485 ND1 HIS A 147 -3.190 1.664 -13.164 1.00 0.00 N ATOM 2486 CD2 HIS A 147 -1.705 0.132 -12.605 1.00 0.00 C ATOM 2487 CE1 HIS A 147 -2.979 0.841 -14.208 1.00 0.00 C ATOM 2488 NE2 HIS A 147 -2.085 -0.107 -13.921 1.00 0.00 N ATOM 0 H HIS A 147 -1.659 3.707 -12.303 1.00 0.00 H new ATOM 0 HA HIS A 147 -4.151 3.084 -11.087 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -1.307 2.085 -10.470 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -2.772 1.243 -10.008 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -0.988 -0.454 -12.050 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -3.474 0.937 -15.163 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -1.751 -0.849 -14.536 1.00 0.00 H new ATOM 2496 N CYS A 148 -1.971 4.259 -8.871 1.00 0.00 N ATOM 2497 CA CYS A 148 -1.911 4.877 -7.518 1.00 0.00 C ATOM 2498 C CYS A 148 -1.039 6.150 -7.543 1.00 0.00 C ATOM 2499 O CYS A 148 -0.712 6.661 -8.598 1.00 0.00 O ATOM 2500 CB CYS A 148 -1.283 3.785 -6.644 1.00 0.00 C ATOM 2501 SG CYS A 148 0.448 3.488 -7.125 1.00 0.00 S ATOM 0 H CYS A 148 -1.073 4.175 -9.346 1.00 0.00 H new ATOM 0 HA CYS A 148 -2.886 5.193 -7.147 1.00 0.00 H new ATOM 0 HB2 CYS A 148 -1.328 4.081 -5.596 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -1.855 2.862 -6.740 1.00 0.00 H new ATOM 2506 N GLY A 149 -0.634 6.644 -6.390 1.00 0.00 N ATOM 2507 CA GLY A 149 0.242 7.851 -6.355 1.00 0.00 C ATOM 2508 C GLY A 149 1.685 7.381 -6.123 1.00 0.00 C ATOM 2509 O GLY A 149 2.328 7.783 -5.172 1.00 0.00 O ATOM 0 H GLY A 149 -0.876 6.259 -5.477 1.00 0.00 H new ATOM 0 HA2 GLY A 149 0.167 8.404 -7.291 1.00 0.00 H new ATOM 0 HA3 GLY A 149 -0.072 8.527 -5.559 1.00 0.00 H new ATOM 2513 N CYS A 150 2.193 6.513 -6.977 1.00 0.00 N ATOM 2514 CA CYS A 150 3.589 5.998 -6.793 1.00 0.00 C ATOM 2515 C CYS A 150 4.546 6.725 -7.752 1.00 0.00 C ATOM 2516 O CYS A 150 4.189 7.030 -8.872 1.00 0.00 O ATOM 2517 CB CYS A 150 3.485 4.494 -7.120 1.00 0.00 C ATOM 2518 SG CYS A 150 5.117 3.707 -7.217 1.00 0.00 S ATOM 0 H CYS A 150 1.700 6.143 -7.789 1.00 0.00 H new ATOM 0 HA CYS A 150 3.983 6.164 -5.790 1.00 0.00 H new ATOM 0 HB2 CYS A 150 2.887 3.997 -6.356 1.00 0.00 H new ATOM 0 HB3 CYS A 150 2.963 4.364 -8.068 1.00 0.00 H new ATOM 2523 N ARG A 151 5.766 6.989 -7.326 1.00 0.00 N ATOM 2524 CA ARG A 151 6.738 7.682 -8.233 1.00 0.00 C ATOM 2525 C ARG A 151 7.665 6.644 -8.881 1.00 0.00 C ATOM 2526 O ARG A 151 8.874 6.787 -8.861 1.00 0.00 O ATOM 2527 CB ARG A 151 7.538 8.641 -7.342 1.00 0.00 C ATOM 2528 CG ARG A 151 7.912 9.891 -8.144 1.00 0.00 C ATOM 2529 CD ARG A 151 9.268 10.416 -7.670 1.00 0.00 C ATOM 2530 NE ARG A 151 9.017 10.949 -6.296 1.00 0.00 N ATOM 2531 CZ ARG A 151 8.348 12.076 -6.107 1.00 0.00 C ATOM 2532 NH1 ARG A 151 7.878 12.771 -7.118 1.00 0.00 N ATOM 2533 NH2 ARG A 151 8.147 12.512 -4.891 1.00 0.00 N ATOM 0 H ARG A 151 6.124 6.756 -6.400 1.00 0.00 H new ATOM 0 HA ARG A 151 6.236 8.222 -9.036 1.00 0.00 H new ATOM 0 HB2 ARG A 151 6.949 8.919 -6.468 1.00 0.00 H new ATOM 0 HB3 ARG A 151 8.438 8.148 -6.976 1.00 0.00 H new ATOM 0 HG2 ARG A 151 7.953 9.655 -9.207 1.00 0.00 H new ATOM 0 HG3 ARG A 151 7.149 10.659 -8.018 1.00 0.00 H new ATOM 0 HD2 ARG A 151 10.015 9.623 -7.655 1.00 0.00 H new ATOM 0 HD3 ARG A 151 9.643 11.195 -8.333 1.00 0.00 H new ATOM 0 HE ARG A 151 9.368 10.434 -5.488 1.00 0.00 H new ATOM 0 HH11 ARG A 151 8.025 12.445 -8.073 1.00 0.00 H new ATOM 0 HH12 ARG A 151 7.366 13.636 -6.948 1.00 0.00 H new ATOM 0 HH21 ARG A 151 8.505 11.985 -4.095 1.00 0.00 H new ATOM 0 HH22 ARG A 151 7.632 13.379 -4.739 1.00 0.00 H new ATOM 2547 N GLY A 152 7.111 5.596 -9.457 1.00 0.00 N ATOM 2548 CA GLY A 152 7.956 4.556 -10.103 1.00 0.00 C ATOM 2549 C GLY A 152 8.725 3.771 -9.032 1.00 0.00 C ATOM 2550 O GLY A 152 9.752 4.214 -8.553 1.00 0.00 O ATOM 0 H GLY A 152 6.107 5.424 -9.503 1.00 0.00 H new ATOM 0 HA2 GLY A 152 7.332 3.878 -10.686 1.00 0.00 H new ATOM 0 HA3 GLY A 152 8.655 5.022 -10.797 1.00 0.00 H new ATOM 2554 N CYS A 153 8.242 2.603 -8.654 1.00 0.00 N ATOM 2555 CA CYS A 153 8.959 1.798 -7.620 1.00 0.00 C ATOM 2556 C CYS A 153 9.564 0.531 -8.256 1.00 0.00 C ATOM 2557 O CYS A 153 8.884 -0.210 -8.939 1.00 0.00 O ATOM 2558 CB CYS A 153 7.905 1.462 -6.543 1.00 0.00 C ATOM 2559 SG CYS A 153 6.636 0.321 -7.176 1.00 0.00 S ATOM 0 H CYS A 153 7.388 2.181 -9.018 1.00 0.00 H new ATOM 0 HA CYS A 153 9.794 2.341 -7.178 1.00 0.00 H new ATOM 0 HB2 CYS A 153 8.397 1.016 -5.679 1.00 0.00 H new ATOM 0 HB3 CYS A 153 7.430 2.381 -6.200 1.00 0.00 H new ATOM 2564 N ALA A 154 10.841 0.283 -8.048 1.00 0.00 N ATOM 2565 CA ALA A 154 11.477 -0.929 -8.651 1.00 0.00 C ATOM 2566 C ALA A 154 12.539 -1.500 -7.699 1.00 0.00 C ATOM 2567 O ALA A 154 13.309 -0.760 -7.114 1.00 0.00 O ATOM 2568 CB ALA A 154 12.128 -0.428 -9.939 1.00 0.00 C ATOM 0 H ALA A 154 11.463 0.867 -7.489 1.00 0.00 H new ATOM 0 HA ALA A 154 10.757 -1.726 -8.838 1.00 0.00 H new ATOM 0 HB1 ALA A 154 12.619 -1.259 -10.445 1.00 0.00 H new ATOM 0 HB2 ALA A 154 11.364 -0.005 -10.592 1.00 0.00 H new ATOM 0 HB3 ALA A 154 12.865 0.338 -9.700 1.00 0.00 H new ATOM 2574 N SER A 155 12.592 -2.807 -7.537 1.00 0.00 N ATOM 2575 CA SER A 155 13.616 -3.402 -6.613 1.00 0.00 C ATOM 2576 C SER A 155 14.857 -3.856 -7.402 1.00 0.00 C ATOM 2577 O SER A 155 15.972 -3.705 -6.939 1.00 0.00 O ATOM 2578 CB SER A 155 12.935 -4.603 -5.946 1.00 0.00 C ATOM 2579 OG SER A 155 11.539 -4.354 -5.843 1.00 0.00 O ATOM 0 H SER A 155 11.978 -3.478 -7.999 1.00 0.00 H new ATOM 0 HA SER A 155 13.956 -2.675 -5.875 1.00 0.00 H new ATOM 0 HB2 SER A 155 13.113 -5.507 -6.529 1.00 0.00 H new ATOM 0 HB3 SER A 155 13.360 -4.773 -4.957 1.00 0.00 H new ATOM 0 HG SER A 155 11.100 -5.121 -5.419 1.00 0.00 H new ATOM 2585 N THR A 156 14.682 -4.412 -8.587 1.00 0.00 N ATOM 2586 CA THR A 156 15.882 -4.869 -9.385 1.00 0.00 C ATOM 2587 C THR A 156 16.872 -3.709 -9.582 1.00 0.00 C ATOM 2588 O THR A 156 18.071 -3.901 -9.527 1.00 0.00 O ATOM 2589 CB THR A 156 15.352 -5.345 -10.748 1.00 0.00 C ATOM 2590 OG1 THR A 156 14.130 -6.045 -10.562 1.00 0.00 O ATOM 2591 CG2 THR A 156 16.379 -6.272 -11.401 1.00 0.00 C ATOM 0 H THR A 156 13.777 -4.568 -9.031 1.00 0.00 H new ATOM 0 HA THR A 156 16.411 -5.668 -8.865 1.00 0.00 H new ATOM 0 HB THR A 156 15.182 -4.483 -11.393 1.00 0.00 H new ATOM 0 HG1 THR A 156 13.791 -6.347 -11.430 1.00 0.00 H new ATOM 0 HG21 THR A 156 16.003 -6.609 -12.367 1.00 0.00 H new ATOM 0 HG22 THR A 156 17.316 -5.734 -11.544 1.00 0.00 H new ATOM 0 HG23 THR A 156 16.551 -7.135 -10.758 1.00 0.00 H new ATOM 2599 N ASP A 157 16.383 -2.509 -9.808 1.00 0.00 N ATOM 2600 CA ASP A 157 17.303 -1.348 -10.005 1.00 0.00 C ATOM 2601 C ASP A 157 16.929 -0.210 -9.051 1.00 0.00 C ATOM 2602 O ASP A 157 17.572 0.825 -9.115 1.00 0.00 O ATOM 2603 CB ASP A 157 17.098 -0.919 -11.458 1.00 0.00 C ATOM 2604 CG ASP A 157 17.983 -1.769 -12.372 1.00 0.00 C ATOM 2605 OD1 ASP A 157 19.187 -1.579 -12.341 1.00 0.00 O ATOM 2606 OD2 ASP A 157 17.440 -2.594 -13.088 1.00 0.00 O ATOM 2607 OXT ASP A 157 16.007 -0.393 -8.274 1.00 0.00 O ATOM 0 H ASP A 157 15.389 -2.288 -9.864 1.00 0.00 H new ATOM 0 HA ASP A 157 18.342 -1.606 -9.801 1.00 0.00 H new ATOM 0 HB2 ASP A 157 16.051 -1.035 -11.738 1.00 0.00 H new ATOM 0 HB3 ASP A 157 17.344 0.136 -11.575 1.00 0.00 H new TER 2612 ASP A 157 HETATM 2613 ZN ZN A1000 0.912 1.259 -6.849 1.00 0.00 ZN HETATM 2614 ZN ZN A1001 4.710 1.480 -7.664 1.00 0.00 ZN HETATM 2615 ZN ZN A1002 1.971 1.221 -10.403 1.00 0.00 ZN