USER MOD reduce.3.24.130724 H: found=0, std=0, add=959, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 960 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 150 HIS : no HE2:sc= -0.219 K(o=0.87,f=-6.7!) USER MOD Set 1.2: A 154 TYR OH : rot 110:sc= 1.09 USER MOD Set 2.1: A 118 HIS : no HD1:sc= -0.667 K(o=-0.67,f=-2.1) USER MOD Set 2.2: A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot -32:sc= 0.00806 USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 83 GLN : amide:sc= -0.908 K(o=-0.91,f=-3.5!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 GLN : amide:sc= -0.945 K(o=-0.95,f=-2.5!) USER MOD Single : A 103 TYR OH : rot -105:sc= -0.14 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 ASN : amide:sc= -5.62! C(o=-5.6!,f=-4.5!) USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 THR OG1 : rot 55:sc= 1.27 USER MOD Single : A 134 SER OG : rot -22:sc= 0.742 USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 HIS : no HD1:sc= -0.488 X(o=-0.49,f=-0.19) USER MOD Single : A 142 THR OG1 : rot -134:sc= 1.09 USER MOD Single : A 147 THR OG1 : rot -170:sc= -1.78 USER MOD Single : A 148 THR OG1 : rot 60:sc= -0.926! USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 SER OG : rot -30:sc= -2.25 USER MOD Single : A 161 ASN : amide:sc= -0.613 K(o=-0.61,f=-1.7) USER MOD Single : A 164 HIS : no HD1:sc= -0.873 K(o=-0.87,f=-3!) USER MOD Single : A 166 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 170 THR OG1 : rot 180:sc= 0 USER MOD Single : A 171 THR OG1 : rot -60:sc= 0.566 USER MOD Single : A 178 ASN : amide:sc= -0.0285 X(o=-0.029,f=-0.24) USER MOD Single : A 180 ASN : amide:sc= -0.0307 X(o=-0.031,f=-0.13) USER MOD Single : A 183 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 70 -17.914 11.672 10.197 1.00 0.00 N ATOM 2 CA THR A 70 -17.528 10.495 9.377 1.00 0.00 C ATOM 3 C THR A 70 -16.712 10.916 8.159 1.00 0.00 C ATOM 4 O THR A 70 -16.743 12.075 7.749 1.00 0.00 O ATOM 5 CB THR A 70 -18.800 9.770 8.934 1.00 0.00 C ATOM 6 OG1 THR A 70 -19.519 10.547 7.994 1.00 0.00 O ATOM 7 CG2 THR A 70 -19.737 9.454 10.080 1.00 0.00 C ATOM 0 HA THR A 70 -16.906 9.830 9.976 1.00 0.00 H new ATOM 0 HB THR A 70 -18.460 8.833 8.493 1.00 0.00 H new ATOM 0 HG1 THR A 70 -19.385 11.499 8.185 1.00 0.00 H new ATOM 0 HG21 THR A 70 -20.619 8.940 9.698 1.00 0.00 H new ATOM 0 HG22 THR A 70 -19.228 8.814 10.800 1.00 0.00 H new ATOM 0 HG23 THR A 70 -20.040 10.380 10.568 1.00 0.00 H new ATOM 15 N ALA A 71 -15.982 9.965 7.585 1.00 0.00 N ATOM 16 CA ALA A 71 -15.158 10.237 6.414 1.00 0.00 C ATOM 17 C ALA A 71 -15.378 9.186 5.331 1.00 0.00 C ATOM 18 O ALA A 71 -14.844 8.080 5.408 1.00 0.00 O ATOM 19 CB ALA A 71 -13.689 10.294 6.805 1.00 0.00 C ATOM 0 H ALA A 71 -15.945 9.000 7.912 1.00 0.00 H new ATOM 0 HA ALA A 71 -15.454 11.205 6.009 1.00 0.00 H new ATOM 0 HB1 ALA A 71 -13.085 10.498 5.921 1.00 0.00 H new ATOM 0 HB2 ALA A 71 -13.538 11.086 7.538 1.00 0.00 H new ATOM 0 HB3 ALA A 71 -13.390 9.339 7.236 1.00 0.00 H new ATOM 25 N SER A 72 -16.168 9.540 4.323 1.00 0.00 N ATOM 26 CA SER A 72 -16.461 8.628 3.223 1.00 0.00 C ATOM 27 C SER A 72 -15.846 9.131 1.921 1.00 0.00 C ATOM 28 O SER A 72 -16.228 10.182 1.408 1.00 0.00 O ATOM 29 CB SER A 72 -17.972 8.463 3.056 1.00 0.00 C ATOM 30 OG SER A 72 -18.285 7.241 2.412 1.00 0.00 O ATOM 0 H SER A 72 -16.617 10.452 4.245 1.00 0.00 H new ATOM 0 HA SER A 72 -16.022 7.659 3.462 1.00 0.00 H new ATOM 0 HB2 SER A 72 -18.454 8.496 4.033 1.00 0.00 H new ATOM 0 HB3 SER A 72 -18.370 9.295 2.475 1.00 0.00 H new ATOM 0 HG SER A 72 -19.257 7.160 2.319 1.00 0.00 H new ATOM 36 N GLY A 73 -14.891 8.372 1.392 1.00 0.00 N ATOM 37 CA GLY A 73 -14.239 8.757 0.154 1.00 0.00 C ATOM 38 C GLY A 73 -14.671 7.902 -1.020 1.00 0.00 C ATOM 39 O GLY A 73 -13.872 7.605 -1.908 1.00 0.00 O ATOM 0 H GLY A 73 -14.557 7.498 1.798 1.00 0.00 H new ATOM 0 HA2 GLY A 73 -14.462 9.802 -0.060 1.00 0.00 H new ATOM 0 HA3 GLY A 73 -13.159 8.680 0.277 1.00 0.00 H new ATOM 43 N GLY A 74 -15.939 7.504 -1.025 1.00 0.00 N ATOM 44 CA GLY A 74 -16.454 6.681 -2.104 1.00 0.00 C ATOM 45 C GLY A 74 -17.380 7.448 -3.028 1.00 0.00 C ATOM 46 O GLY A 74 -18.288 8.141 -2.571 1.00 0.00 O ATOM 0 H GLY A 74 -16.619 7.737 -0.301 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -15.620 6.280 -2.681 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -16.989 5.829 -1.684 1.00 0.00 H new ATOM 50 N GLU A 75 -17.147 7.325 -4.330 1.00 0.00 N ATOM 51 CA GLU A 75 -17.967 8.011 -5.322 1.00 0.00 C ATOM 52 C GLU A 75 -17.876 9.525 -5.150 1.00 0.00 C ATOM 53 O GLU A 75 -17.604 10.019 -4.056 1.00 0.00 O ATOM 54 CB GLU A 75 -19.425 7.561 -5.211 1.00 0.00 C ATOM 55 CG GLU A 75 -20.155 7.528 -6.544 1.00 0.00 C ATOM 56 CD GLU A 75 -21.343 6.587 -6.535 1.00 0.00 C ATOM 57 OE1 GLU A 75 -21.127 5.358 -6.525 1.00 0.00 O1- ATOM 58 OE2 GLU A 75 -22.491 7.080 -6.541 1.00 0.00 O ATOM 0 H GLU A 75 -16.397 6.757 -4.723 1.00 0.00 H new ATOM 0 HA GLU A 75 -17.589 7.751 -6.311 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -19.457 6.567 -4.764 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -19.953 8.232 -4.534 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -20.495 8.533 -6.793 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -19.461 7.223 -7.327 1.00 0.00 H new ATOM 65 N ASN A 76 -18.106 10.253 -6.236 1.00 0.00 N ATOM 66 CA ASN A 76 -18.051 11.711 -6.205 1.00 0.00 C ATOM 67 C ASN A 76 -19.000 12.313 -7.237 1.00 0.00 C ATOM 68 O ASN A 76 -19.987 12.957 -6.885 1.00 0.00 O ATOM 69 CB ASN A 76 -16.623 12.193 -6.467 1.00 0.00 C ATOM 70 CG ASN A 76 -16.275 13.431 -5.663 1.00 0.00 C ATOM 71 OD1 ASN A 76 -16.363 13.434 -4.436 1.00 0.00 O ATOM 72 ND2 ASN A 76 -15.878 14.493 -6.355 1.00 0.00 N ATOM 0 H ASN A 76 -18.332 9.859 -7.149 1.00 0.00 H new ATOM 0 HA ASN A 76 -18.363 12.041 -5.214 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -15.922 11.395 -6.222 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -16.504 12.407 -7.529 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -15.632 15.355 -5.869 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -15.820 14.446 -7.372 1.00 0.00 H new ATOM 79 N GLU A 77 -18.692 12.099 -8.512 1.00 0.00 N ATOM 80 CA GLU A 77 -19.517 12.621 -9.595 1.00 0.00 C ATOM 81 C GLU A 77 -19.592 14.143 -9.538 1.00 0.00 C ATOM 82 O GLU A 77 -19.324 14.749 -8.500 1.00 0.00 O ATOM 83 CB GLU A 77 -20.925 12.027 -9.523 1.00 0.00 C ATOM 84 CG GLU A 77 -21.060 10.692 -10.238 1.00 0.00 C ATOM 85 CD GLU A 77 -20.767 9.512 -9.331 1.00 0.00 C ATOM 86 OE1 GLU A 77 -21.684 9.083 -8.600 1.00 0.00 O1- ATOM 87 OE2 GLU A 77 -19.620 9.019 -9.352 1.00 0.00 O ATOM 0 H GLU A 77 -17.878 11.568 -8.820 1.00 0.00 H new ATOM 0 HA GLU A 77 -19.056 12.333 -10.540 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -21.203 11.899 -8.477 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -21.631 12.735 -9.956 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -22.070 10.598 -10.636 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -20.379 10.669 -11.089 1.00 0.00 H new ATOM 94 N ARG A 78 -19.958 14.756 -10.659 1.00 0.00 N ATOM 95 CA ARG A 78 -20.069 16.208 -10.736 1.00 0.00 C ATOM 96 C ARG A 78 -21.063 16.620 -11.815 1.00 0.00 C ATOM 97 O ARG A 78 -22.134 17.150 -11.518 1.00 0.00 O ATOM 98 CB ARG A 78 -18.700 16.830 -11.020 1.00 0.00 C ATOM 99 CG ARG A 78 -18.466 18.142 -10.291 1.00 0.00 C ATOM 100 CD ARG A 78 -17.378 18.966 -10.961 1.00 0.00 C ATOM 101 NE ARG A 78 -16.163 18.186 -11.186 1.00 0.00 N ATOM 102 CZ ARG A 78 -15.309 17.848 -10.223 1.00 0.00 C ATOM 103 NH1 ARG A 78 -15.533 18.219 -8.968 1.00 0.00 N1+ ATOM 104 NH2 ARG A 78 -14.228 17.137 -10.515 1.00 0.00 N ATOM 0 H ARG A 78 -20.183 14.270 -11.527 1.00 0.00 H new ATOM 0 HA ARG A 78 -20.433 16.572 -9.775 1.00 0.00 H new ATOM 0 HB2 ARG A 78 -17.922 16.122 -10.735 1.00 0.00 H new ATOM 0 HB3 ARG A 78 -18.601 16.997 -12.093 1.00 0.00 H new ATOM 0 HG2 ARG A 78 -19.393 18.715 -10.264 1.00 0.00 H new ATOM 0 HG3 ARG A 78 -18.186 17.940 -9.257 1.00 0.00 H new ATOM 0 HD2 ARG A 78 -17.746 19.347 -11.914 1.00 0.00 H new ATOM 0 HD3 ARG A 78 -17.144 19.831 -10.341 1.00 0.00 H new ATOM 0 HE ARG A 78 -15.957 17.883 -12.138 1.00 0.00 H new ATOM 0 HH11 ARG A 78 -16.363 18.766 -8.738 1.00 0.00 H new ATOM 0 HH12 ARG A 78 -14.875 17.957 -8.234 1.00 0.00 H new ATOM 0 HH21 ARG A 78 -14.051 16.849 -11.478 1.00 0.00 H new ATOM 0 HH22 ARG A 78 -13.573 16.878 -9.777 1.00 0.00 H new ATOM 118 N GLU A 79 -20.702 16.371 -13.068 1.00 0.00 N ATOM 119 CA GLU A 79 -21.559 16.711 -14.195 1.00 0.00 C ATOM 120 C GLU A 79 -21.054 16.040 -15.465 1.00 0.00 C ATOM 121 O GLU A 79 -21.286 16.525 -16.573 1.00 0.00 O ATOM 122 CB GLU A 79 -21.609 18.228 -14.389 1.00 0.00 C ATOM 123 CG GLU A 79 -22.957 18.736 -14.870 1.00 0.00 C ATOM 124 CD GLU A 79 -22.989 18.980 -16.366 1.00 0.00 C ATOM 125 OE1 GLU A 79 -22.150 19.763 -16.858 1.00 0.00 O1- ATOM 126 OE2 GLU A 79 -23.853 18.387 -17.046 1.00 0.00 O ATOM 0 H GLU A 79 -19.818 15.933 -13.329 1.00 0.00 H new ATOM 0 HA GLU A 79 -22.566 16.351 -13.983 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -21.362 18.715 -13.445 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -20.843 18.519 -15.108 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -23.729 18.012 -14.607 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -23.199 19.663 -14.349 1.00 0.00 H new ATOM 133 N ASP A 80 -20.360 14.917 -15.296 1.00 0.00 N ATOM 134 CA ASP A 80 -19.821 14.176 -16.427 1.00 0.00 C ATOM 135 C ASP A 80 -19.070 12.935 -15.956 1.00 0.00 C ATOM 136 O ASP A 80 -19.147 11.876 -16.580 1.00 0.00 O ATOM 137 CB ASP A 80 -18.891 15.064 -17.256 1.00 0.00 C ATOM 138 CG ASP A 80 -19.003 14.789 -18.742 1.00 0.00 C ATOM 139 OD1 ASP A 80 -20.140 14.649 -19.237 1.00 0.00 O1- ATOM 140 OD2 ASP A 80 -17.951 14.713 -19.412 1.00 0.00 O ATOM 0 H ASP A 80 -20.159 14.503 -14.386 1.00 0.00 H new ATOM 0 HA ASP A 80 -20.657 13.860 -17.050 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -19.126 16.111 -17.064 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -17.861 14.905 -16.936 1.00 0.00 H new ATOM 145 N LEU A 81 -18.342 13.072 -14.852 1.00 0.00 N ATOM 146 CA LEU A 81 -17.577 11.962 -14.297 1.00 0.00 C ATOM 147 C LEU A 81 -18.489 10.791 -13.946 1.00 0.00 C ATOM 148 O LEU A 81 -18.959 10.675 -12.814 1.00 0.00 O ATOM 149 CB LEU A 81 -16.809 12.417 -13.053 1.00 0.00 C ATOM 150 CG LEU A 81 -15.427 13.011 -13.328 1.00 0.00 C ATOM 151 CD1 LEU A 81 -14.564 12.023 -14.097 1.00 0.00 C ATOM 152 CD2 LEU A 81 -15.553 14.320 -14.093 1.00 0.00 C ATOM 0 H LEU A 81 -18.266 13.942 -14.324 1.00 0.00 H new ATOM 0 HA LEU A 81 -16.867 11.629 -15.054 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -17.408 13.159 -12.526 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -16.695 11.565 -12.383 1.00 0.00 H new ATOM 0 HG LEU A 81 -14.944 13.216 -12.373 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -13.585 12.464 -14.283 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -14.446 11.111 -13.512 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -15.042 11.786 -15.048 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -14.560 14.729 -14.280 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -16.056 14.139 -15.043 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -16.133 15.031 -13.505 1.00 0.00 H new ATOM 164 N GLU A 82 -18.734 9.925 -14.924 1.00 0.00 N ATOM 165 CA GLU A 82 -19.589 8.762 -14.719 1.00 0.00 C ATOM 166 C GLU A 82 -18.856 7.477 -15.090 1.00 0.00 C ATOM 167 O GLU A 82 -19.470 6.505 -15.529 1.00 0.00 O ATOM 168 CB GLU A 82 -20.868 8.891 -15.547 1.00 0.00 C ATOM 169 CG GLU A 82 -21.890 9.842 -14.945 1.00 0.00 C ATOM 170 CD GLU A 82 -23.315 9.355 -15.120 1.00 0.00 C ATOM 171 OE1 GLU A 82 -23.589 8.186 -14.777 1.00 0.00 O1- ATOM 172 OE2 GLU A 82 -24.156 10.143 -15.602 1.00 0.00 O ATOM 0 H GLU A 82 -18.352 10.007 -15.866 1.00 0.00 H new ATOM 0 HA GLU A 82 -19.852 8.717 -13.662 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -20.609 9.235 -16.548 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -21.321 7.906 -15.656 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -21.681 9.968 -13.883 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -21.786 10.823 -15.409 1.00 0.00 H new ATOM 179 N GLN A 83 -17.539 7.480 -14.911 1.00 0.00 N ATOM 180 CA GLN A 83 -16.722 6.315 -15.227 1.00 0.00 C ATOM 181 C GLN A 83 -15.588 6.157 -14.220 1.00 0.00 C ATOM 182 O GLN A 83 -15.257 7.093 -13.490 1.00 0.00 O ATOM 183 CB GLN A 83 -16.151 6.433 -16.642 1.00 0.00 C ATOM 184 CG GLN A 83 -15.723 5.102 -17.239 1.00 0.00 C ATOM 185 CD GLN A 83 -16.828 4.065 -17.202 1.00 0.00 C ATOM 186 OE1 GLN A 83 -17.079 3.445 -16.168 1.00 0.00 O ATOM 187 NE2 GLN A 83 -17.494 3.868 -18.334 1.00 0.00 N ATOM 0 H GLN A 83 -17.015 8.277 -14.549 1.00 0.00 H new ATOM 0 HA GLN A 83 -17.358 5.431 -15.173 1.00 0.00 H new ATOM 0 HB2 GLN A 83 -16.900 6.888 -17.290 1.00 0.00 H new ATOM 0 HB3 GLN A 83 -15.294 7.106 -16.624 1.00 0.00 H new ATOM 0 HG2 GLN A 83 -15.408 5.255 -18.271 1.00 0.00 H new ATOM 0 HG3 GLN A 83 -14.857 4.725 -16.694 1.00 0.00 H new ATOM 0 HE21 GLN A 83 -17.253 4.404 -19.168 1.00 0.00 H new ATOM 0 HE22 GLN A 83 -18.247 3.181 -18.370 1.00 0.00 H new ATOM 196 N GLU A 84 -14.995 4.968 -14.184 1.00 0.00 N ATOM 197 CA GLU A 84 -13.898 4.688 -13.266 1.00 0.00 C ATOM 198 C GLU A 84 -12.588 5.269 -13.788 1.00 0.00 C ATOM 199 O GLU A 84 -12.417 5.458 -14.991 1.00 0.00 O ATOM 200 CB GLU A 84 -13.752 3.179 -13.058 1.00 0.00 C ATOM 201 CG GLU A 84 -12.824 2.809 -11.913 1.00 0.00 C ATOM 202 CD GLU A 84 -12.472 1.334 -11.901 1.00 0.00 C ATOM 203 OE1 GLU A 84 -13.394 0.503 -12.034 1.00 0.00 O1- ATOM 204 OE2 GLU A 84 -11.274 1.011 -11.759 1.00 0.00 O ATOM 0 H GLU A 84 -15.256 4.183 -14.780 1.00 0.00 H new ATOM 0 HA GLU A 84 -14.128 5.160 -12.311 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -14.736 2.750 -12.870 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -13.378 2.729 -13.977 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -11.909 3.397 -11.988 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -13.297 3.074 -10.967 1.00 0.00 H new ATOM 211 N TRP A 85 -11.665 5.549 -12.872 1.00 0.00 N ATOM 212 CA TRP A 85 -10.368 6.106 -13.236 1.00 0.00 C ATOM 213 C TRP A 85 -9.639 5.187 -14.216 1.00 0.00 C ATOM 214 O TRP A 85 -9.801 3.968 -14.176 1.00 0.00 O ATOM 215 CB TRP A 85 -9.522 6.331 -11.977 1.00 0.00 C ATOM 216 CG TRP A 85 -8.084 6.636 -12.264 1.00 0.00 C ATOM 217 CD1 TRP A 85 -7.578 7.780 -12.813 1.00 0.00 C ATOM 218 CD2 TRP A 85 -6.964 5.781 -12.017 1.00 0.00 C ATOM 219 NE1 TRP A 85 -6.211 7.684 -12.924 1.00 0.00 N ATOM 220 CE2 TRP A 85 -5.814 6.468 -12.446 1.00 0.00 C ATOM 221 CE3 TRP A 85 -6.820 4.499 -11.476 1.00 0.00 C ATOM 222 CZ2 TRP A 85 -4.543 5.919 -12.353 1.00 0.00 C ATOM 223 CZ3 TRP A 85 -5.551 3.961 -11.385 1.00 0.00 C ATOM 224 CH2 TRP A 85 -4.436 4.668 -11.822 1.00 0.00 C ATOM 0 H TRP A 85 -11.793 5.399 -11.871 1.00 0.00 H new ATOM 0 HA TRP A 85 -10.527 7.065 -13.729 1.00 0.00 H new ATOM 0 HB2 TRP A 85 -9.951 7.153 -11.404 1.00 0.00 H new ATOM 0 HB3 TRP A 85 -9.577 5.442 -11.349 1.00 0.00 H new ATOM 0 HD1 TRP A 85 -8.165 8.634 -13.115 1.00 0.00 H new ATOM 0 HE1 TRP A 85 -5.594 8.403 -13.302 1.00 0.00 H new ATOM 0 HE3 TRP A 85 -7.681 3.943 -11.137 1.00 0.00 H new ATOM 0 HZ2 TRP A 85 -3.672 6.462 -12.688 1.00 0.00 H new ATOM 0 HZ3 TRP A 85 -5.422 2.974 -10.967 1.00 0.00 H new ATOM 0 HH2 TRP A 85 -3.460 4.214 -11.738 1.00 0.00 H new ATOM 235 N LYS A 86 -8.850 5.785 -15.103 1.00 0.00 N ATOM 236 CA LYS A 86 -8.112 5.037 -16.101 1.00 0.00 C ATOM 237 C LYS A 86 -6.965 4.244 -15.473 1.00 0.00 C ATOM 238 O LYS A 86 -6.417 4.640 -14.445 1.00 0.00 O ATOM 239 CB LYS A 86 -7.567 5.981 -17.174 1.00 0.00 C ATOM 240 CG LYS A 86 -8.478 6.118 -18.383 1.00 0.00 C ATOM 241 CD LYS A 86 -9.377 7.339 -18.269 1.00 0.00 C ATOM 242 CE LYS A 86 -10.776 7.050 -18.786 1.00 0.00 C ATOM 243 NZ LYS A 86 -11.821 7.738 -17.977 1.00 0.00 N1+ ATOM 0 H LYS A 86 -8.708 6.794 -15.146 1.00 0.00 H new ATOM 0 HA LYS A 86 -8.801 4.328 -16.560 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -7.410 6.966 -16.734 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -6.592 5.620 -17.503 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -7.875 6.193 -19.288 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -9.091 5.222 -18.481 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -9.431 7.656 -17.228 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -8.943 8.165 -18.832 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -10.852 7.370 -19.825 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -10.954 5.975 -18.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -12.761 7.515 -18.362 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -11.765 7.414 -16.990 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -11.667 8.766 -18.013 1.00 0.00 H new ATOM 257 N PRO A 87 -6.588 3.105 -16.087 1.00 0.00 N ATOM 258 CA PRO A 87 -5.506 2.253 -15.587 1.00 0.00 C ATOM 259 C PRO A 87 -4.122 2.845 -15.853 1.00 0.00 C ATOM 260 O PRO A 87 -3.925 3.572 -16.827 1.00 0.00 O ATOM 261 CB PRO A 87 -5.678 0.937 -16.369 1.00 0.00 C ATOM 262 CG PRO A 87 -6.952 1.079 -17.139 1.00 0.00 C ATOM 263 CD PRO A 87 -7.182 2.551 -17.307 1.00 0.00 C ATOM 0 HA PRO A 87 -5.564 2.132 -14.505 1.00 0.00 H new ATOM 0 HB2 PRO A 87 -4.834 0.768 -17.038 1.00 0.00 H new ATOM 0 HB3 PRO A 87 -5.724 0.084 -15.692 1.00 0.00 H new ATOM 0 HG2 PRO A 87 -6.878 0.584 -18.107 1.00 0.00 H new ATOM 0 HG3 PRO A 87 -7.782 0.614 -16.606 1.00 0.00 H new ATOM 0 HD2 PRO A 87 -6.700 2.937 -18.205 1.00 0.00 H new ATOM 0 HD3 PRO A 87 -8.243 2.790 -17.387 1.00 0.00 H new ATOM 271 N PRO A 88 -3.142 2.541 -14.982 1.00 0.00 N ATOM 272 CA PRO A 88 -1.775 3.039 -15.114 1.00 0.00 C ATOM 273 C PRO A 88 -0.900 2.121 -15.965 1.00 0.00 C ATOM 274 O PRO A 88 -1.405 1.257 -16.682 1.00 0.00 O ATOM 275 CB PRO A 88 -1.298 3.041 -13.666 1.00 0.00 C ATOM 276 CG PRO A 88 -1.991 1.875 -13.041 1.00 0.00 C ATOM 277 CD PRO A 88 -3.291 1.687 -13.790 1.00 0.00 C ATOM 0 HA PRO A 88 -1.724 4.008 -15.611 1.00 0.00 H new ATOM 0 HB2 PRO A 88 -0.215 2.938 -13.605 1.00 0.00 H new ATOM 0 HB3 PRO A 88 -1.558 3.973 -13.164 1.00 0.00 H new ATOM 0 HG2 PRO A 88 -1.374 0.979 -13.106 1.00 0.00 H new ATOM 0 HG3 PRO A 88 -2.177 2.058 -11.983 1.00 0.00 H new ATOM 0 HD2 PRO A 88 -3.447 0.643 -14.064 1.00 0.00 H new ATOM 0 HD3 PRO A 88 -4.147 1.990 -13.187 1.00 0.00 H new ATOM 285 N ASP A 89 0.416 2.305 -15.872 1.00 0.00 N ATOM 286 CA ASP A 89 1.357 1.495 -16.615 1.00 0.00 C ATOM 287 C ASP A 89 2.268 0.740 -15.659 1.00 0.00 C ATOM 288 O ASP A 89 2.721 1.291 -14.656 1.00 0.00 O ATOM 289 CB ASP A 89 2.188 2.367 -17.559 1.00 0.00 C ATOM 290 CG ASP A 89 1.325 3.189 -18.497 1.00 0.00 C ATOM 291 OD1 ASP A 89 0.685 4.151 -18.024 1.00 0.00 O1- ATOM 292 OD2 ASP A 89 1.290 2.869 -19.704 1.00 0.00 O ATOM 0 H ASP A 89 0.849 3.016 -15.282 1.00 0.00 H new ATOM 0 HA ASP A 89 0.798 0.775 -17.212 1.00 0.00 H new ATOM 0 HB2 ASP A 89 2.819 3.034 -16.972 1.00 0.00 H new ATOM 0 HB3 ASP A 89 2.853 1.732 -18.144 1.00 0.00 H new ATOM 297 N GLU A 90 2.533 -0.522 -15.973 1.00 0.00 N ATOM 298 CA GLU A 90 3.384 -1.360 -15.149 1.00 0.00 C ATOM 299 C GLU A 90 4.700 -0.668 -14.810 1.00 0.00 C ATOM 300 O GLU A 90 5.371 -1.036 -13.846 1.00 0.00 O ATOM 301 CB GLU A 90 3.657 -2.673 -15.868 1.00 0.00 C ATOM 302 CG GLU A 90 4.211 -2.497 -17.272 1.00 0.00 C ATOM 303 CD GLU A 90 4.075 -3.752 -18.114 1.00 0.00 C ATOM 304 OE1 GLU A 90 4.793 -4.735 -17.835 1.00 0.00 O1- ATOM 305 OE2 GLU A 90 3.250 -3.750 -19.052 1.00 0.00 O ATOM 0 H GLU A 90 2.165 -0.988 -16.802 1.00 0.00 H new ATOM 0 HA GLU A 90 2.862 -1.553 -14.212 1.00 0.00 H new ATOM 0 HB2 GLU A 90 4.363 -3.259 -15.279 1.00 0.00 H new ATOM 0 HB3 GLU A 90 2.732 -3.247 -15.921 1.00 0.00 H new ATOM 0 HG2 GLU A 90 3.690 -1.676 -17.764 1.00 0.00 H new ATOM 0 HG3 GLU A 90 5.263 -2.217 -17.211 1.00 0.00 H new ATOM 312 N GLU A 91 5.063 0.341 -15.597 1.00 0.00 N ATOM 313 CA GLU A 91 6.295 1.080 -15.358 1.00 0.00 C ATOM 314 C GLU A 91 6.289 1.661 -13.953 1.00 0.00 C ATOM 315 O GLU A 91 7.208 1.440 -13.161 1.00 0.00 O ATOM 316 CB GLU A 91 6.435 2.210 -16.377 1.00 0.00 C ATOM 317 CG GLU A 91 6.240 1.762 -17.816 1.00 0.00 C ATOM 318 CD GLU A 91 7.298 2.318 -18.749 1.00 0.00 C ATOM 319 OE1 GLU A 91 8.488 1.981 -18.566 1.00 0.00 O ATOM 320 OE2 GLU A 91 6.938 3.090 -19.663 1.00 0.00 O1- ATOM 0 H GLU A 91 4.524 0.663 -16.401 1.00 0.00 H new ATOM 0 HA GLU A 91 7.138 0.397 -15.462 1.00 0.00 H new ATOM 0 HB2 GLU A 91 5.707 2.988 -16.146 1.00 0.00 H new ATOM 0 HB3 GLU A 91 7.423 2.658 -16.276 1.00 0.00 H new ATOM 0 HG2 GLU A 91 6.259 0.673 -17.859 1.00 0.00 H new ATOM 0 HG3 GLU A 91 5.255 2.078 -18.160 1.00 0.00 H new ATOM 327 N LEU A 92 5.232 2.399 -13.657 1.00 0.00 N ATOM 328 CA LEU A 92 5.074 3.021 -12.354 1.00 0.00 C ATOM 329 C LEU A 92 4.661 1.989 -11.306 1.00 0.00 C ATOM 330 O LEU A 92 4.833 2.210 -10.107 1.00 0.00 O ATOM 331 CB LEU A 92 4.041 4.144 -12.437 1.00 0.00 C ATOM 332 CG LEU A 92 4.132 5.206 -11.338 1.00 0.00 C ATOM 333 CD1 LEU A 92 3.634 4.653 -10.014 1.00 0.00 C ATOM 334 CD2 LEU A 92 5.560 5.716 -11.202 1.00 0.00 C ATOM 0 H LEU A 92 4.467 2.582 -14.306 1.00 0.00 H new ATOM 0 HA LEU A 92 6.032 3.443 -12.050 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.143 4.637 -13.404 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.045 3.701 -12.408 1.00 0.00 H new ATOM 0 HG LEU A 92 3.494 6.044 -11.620 1.00 0.00 H new ATOM 0 HD11 LEU A 92 3.707 5.424 -9.247 1.00 0.00 H new ATOM 0 HD12 LEU A 92 2.594 4.342 -10.118 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.242 3.796 -9.726 1.00 0.00 H new ATOM 0 HD21 LEU A 92 5.604 6.470 -10.416 1.00 0.00 H new ATOM 0 HD22 LEU A 92 6.220 4.887 -10.947 1.00 0.00 H new ATOM 0 HD23 LEU A 92 5.880 6.157 -12.146 1.00 0.00 H new ATOM 346 N ILE A 93 4.122 0.858 -11.761 1.00 0.00 N ATOM 347 CA ILE A 93 3.700 -0.197 -10.853 1.00 0.00 C ATOM 348 C ILE A 93 4.902 -0.934 -10.279 1.00 0.00 C ATOM 349 O ILE A 93 4.947 -1.236 -9.086 1.00 0.00 O ATOM 350 CB ILE A 93 2.778 -1.201 -11.563 1.00 0.00 C ATOM 351 CG1 ILE A 93 1.621 -0.463 -12.233 1.00 0.00 C ATOM 352 CG2 ILE A 93 2.259 -2.237 -10.579 1.00 0.00 C ATOM 353 CD1 ILE A 93 0.700 -1.364 -13.021 1.00 0.00 C ATOM 0 H ILE A 93 3.970 0.654 -12.749 1.00 0.00 H new ATOM 0 HA ILE A 93 3.150 0.276 -10.040 1.00 0.00 H new ATOM 0 HB ILE A 93 3.350 -1.722 -12.331 1.00 0.00 H new ATOM 0 HG12 ILE A 93 1.041 0.055 -11.469 1.00 0.00 H new ATOM 0 HG13 ILE A 93 2.025 0.300 -12.898 1.00 0.00 H new ATOM 0 HG21 ILE A 93 1.608 -2.939 -11.100 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.099 -2.777 -10.142 1.00 0.00 H new ATOM 0 HG23 ILE A 93 1.697 -1.739 -9.789 1.00 0.00 H new ATOM 0 HD11 ILE A 93 -0.097 -0.769 -13.467 1.00 0.00 H new ATOM 0 HD12 ILE A 93 1.265 -1.863 -13.808 1.00 0.00 H new ATOM 0 HD13 ILE A 93 0.266 -2.111 -12.357 1.00 0.00 H new ATOM 365 N LYS A 94 5.878 -1.219 -11.134 1.00 0.00 N ATOM 366 CA LYS A 94 7.082 -1.917 -10.705 1.00 0.00 C ATOM 367 C LYS A 94 7.859 -1.074 -9.702 1.00 0.00 C ATOM 368 O LYS A 94 8.438 -1.600 -8.752 1.00 0.00 O ATOM 369 CB LYS A 94 7.965 -2.251 -11.910 1.00 0.00 C ATOM 370 CG LYS A 94 7.700 -3.628 -12.494 1.00 0.00 C ATOM 371 CD LYS A 94 8.451 -3.833 -13.800 1.00 0.00 C ATOM 372 CE LYS A 94 8.966 -5.258 -13.928 1.00 0.00 C ATOM 373 NZ LYS A 94 9.646 -5.488 -15.233 1.00 0.00 N1+ ATOM 0 H LYS A 94 5.858 -0.978 -12.125 1.00 0.00 H new ATOM 0 HA LYS A 94 6.785 -2.848 -10.221 1.00 0.00 H new ATOM 0 HB2 LYS A 94 7.808 -1.500 -12.685 1.00 0.00 H new ATOM 0 HB3 LYS A 94 9.012 -2.187 -11.612 1.00 0.00 H new ATOM 0 HG2 LYS A 94 8.000 -4.392 -11.777 1.00 0.00 H new ATOM 0 HG3 LYS A 94 6.631 -3.752 -12.665 1.00 0.00 H new ATOM 0 HD2 LYS A 94 7.793 -3.606 -14.639 1.00 0.00 H new ATOM 0 HD3 LYS A 94 9.288 -3.136 -13.853 1.00 0.00 H new ATOM 0 HE2 LYS A 94 9.661 -5.467 -13.115 1.00 0.00 H new ATOM 0 HE3 LYS A 94 8.135 -5.955 -13.824 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 9.982 -6.471 -15.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 8.976 -5.313 -16.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 10.455 -4.841 -15.322 1.00 0.00 H new ATOM 387 N LYS A 95 7.861 0.240 -9.909 1.00 0.00 N ATOM 388 CA LYS A 95 8.559 1.146 -9.006 1.00 0.00 C ATOM 389 C LYS A 95 7.919 1.105 -7.622 1.00 0.00 C ATOM 390 O LYS A 95 8.607 0.988 -6.606 1.00 0.00 O ATOM 391 CB LYS A 95 8.533 2.574 -9.554 1.00 0.00 C ATOM 392 CG LYS A 95 9.365 2.757 -10.814 1.00 0.00 C ATOM 393 CD LYS A 95 8.774 3.824 -11.721 1.00 0.00 C ATOM 394 CE LYS A 95 9.841 4.468 -12.591 1.00 0.00 C ATOM 395 NZ LYS A 95 10.275 3.568 -13.695 1.00 0.00 N1+ ATOM 0 H LYS A 95 7.390 0.698 -10.689 1.00 0.00 H new ATOM 0 HA LYS A 95 9.597 0.823 -8.926 1.00 0.00 H new ATOM 0 HB2 LYS A 95 7.501 2.854 -9.766 1.00 0.00 H new ATOM 0 HB3 LYS A 95 8.897 3.256 -8.786 1.00 0.00 H new ATOM 0 HG2 LYS A 95 10.384 3.033 -10.542 1.00 0.00 H new ATOM 0 HG3 LYS A 95 9.424 1.811 -11.353 1.00 0.00 H new ATOM 0 HD2 LYS A 95 8.006 3.380 -12.354 1.00 0.00 H new ATOM 0 HD3 LYS A 95 8.286 4.588 -11.116 1.00 0.00 H new ATOM 0 HE2 LYS A 95 9.455 5.397 -13.010 1.00 0.00 H new ATOM 0 HE3 LYS A 95 10.702 4.729 -11.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 11.003 4.044 -14.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 10.667 2.692 -13.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 9.459 3.339 -14.297 1.00 0.00 H new ATOM 409 N LEU A 96 6.594 1.195 -7.596 1.00 0.00 N ATOM 410 CA LEU A 96 5.842 1.161 -6.348 1.00 0.00 C ATOM 411 C LEU A 96 6.105 -0.131 -5.588 1.00 0.00 C ATOM 412 O LEU A 96 6.617 -0.121 -4.469 1.00 0.00 O ATOM 413 CB LEU A 96 4.347 1.269 -6.640 1.00 0.00 C ATOM 414 CG LEU A 96 3.720 2.622 -6.340 1.00 0.00 C ATOM 415 CD1 LEU A 96 2.868 3.074 -7.513 1.00 0.00 C ATOM 416 CD2 LEU A 96 2.893 2.553 -5.065 1.00 0.00 C ATOM 0 H LEU A 96 6.016 1.293 -8.431 1.00 0.00 H new ATOM 0 HA LEU A 96 6.166 2.003 -5.736 1.00 0.00 H new ATOM 0 HB2 LEU A 96 4.182 1.036 -7.692 1.00 0.00 H new ATOM 0 HB3 LEU A 96 3.825 0.509 -6.059 1.00 0.00 H new ATOM 0 HG LEU A 96 4.514 3.353 -6.189 1.00 0.00 H new ATOM 0 HD11 LEU A 96 2.424 4.044 -7.288 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.491 3.158 -8.404 1.00 0.00 H new ATOM 0 HD13 LEU A 96 2.077 2.345 -7.691 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.451 3.529 -4.865 1.00 0.00 H new ATOM 0 HD22 LEU A 96 2.101 1.814 -5.185 1.00 0.00 H new ATOM 0 HD23 LEU A 96 3.534 2.266 -4.231 1.00 0.00 H new ATOM 428 N VAL A 97 5.732 -1.244 -6.209 1.00 0.00 N ATOM 429 CA VAL A 97 5.904 -2.557 -5.610 1.00 0.00 C ATOM 430 C VAL A 97 7.319 -2.751 -5.074 1.00 0.00 C ATOM 431 O VAL A 97 7.534 -3.498 -4.119 1.00 0.00 O ATOM 432 CB VAL A 97 5.572 -3.669 -6.623 1.00 0.00 C ATOM 433 CG1 VAL A 97 6.640 -3.763 -7.703 1.00 0.00 C ATOM 434 CG2 VAL A 97 5.397 -4.999 -5.913 1.00 0.00 C ATOM 0 H VAL A 97 5.305 -1.260 -7.135 1.00 0.00 H new ATOM 0 HA VAL A 97 5.211 -2.620 -4.771 1.00 0.00 H new ATOM 0 HB VAL A 97 4.631 -3.415 -7.111 1.00 0.00 H new ATOM 0 HG11 VAL A 97 6.380 -4.556 -8.404 1.00 0.00 H new ATOM 0 HG12 VAL A 97 6.703 -2.814 -8.236 1.00 0.00 H new ATOM 0 HG13 VAL A 97 7.603 -3.986 -7.244 1.00 0.00 H new ATOM 0 HG21 VAL A 97 5.163 -5.773 -6.644 1.00 0.00 H new ATOM 0 HG22 VAL A 97 6.319 -5.258 -5.393 1.00 0.00 H new ATOM 0 HG23 VAL A 97 4.583 -4.922 -5.192 1.00 0.00 H new ATOM 444 N ASP A 98 8.278 -2.066 -5.686 1.00 0.00 N ATOM 445 CA ASP A 98 9.668 -2.158 -5.261 1.00 0.00 C ATOM 446 C ASP A 98 9.858 -1.482 -3.908 1.00 0.00 C ATOM 447 O ASP A 98 10.732 -1.862 -3.128 1.00 0.00 O ATOM 448 CB ASP A 98 10.587 -1.514 -6.301 1.00 0.00 C ATOM 449 CG ASP A 98 11.947 -2.183 -6.364 1.00 0.00 C ATOM 450 OD1 ASP A 98 11.998 -3.429 -6.302 1.00 0.00 O ATOM 451 OD2 ASP A 98 12.959 -1.461 -6.475 1.00 0.00 O1- ATOM 0 H ASP A 98 8.118 -1.442 -6.477 1.00 0.00 H new ATOM 0 HA ASP A 98 9.928 -3.212 -5.166 1.00 0.00 H new ATOM 0 HB2 ASP A 98 10.114 -1.566 -7.282 1.00 0.00 H new ATOM 0 HB3 ASP A 98 10.715 -0.458 -6.064 1.00 0.00 H new ATOM 456 N GLN A 99 9.030 -0.477 -3.633 1.00 0.00 N ATOM 457 CA GLN A 99 9.104 0.253 -2.374 1.00 0.00 C ATOM 458 C GLN A 99 8.611 -0.607 -1.214 1.00 0.00 C ATOM 459 O GLN A 99 9.165 -0.554 -0.115 1.00 0.00 O ATOM 460 CB GLN A 99 8.284 1.543 -2.458 1.00 0.00 C ATOM 461 CG GLN A 99 9.133 2.795 -2.606 1.00 0.00 C ATOM 462 CD GLN A 99 9.663 2.978 -4.015 1.00 0.00 C ATOM 463 OE1 GLN A 99 8.920 2.857 -4.989 1.00 0.00 O ATOM 464 NE2 GLN A 99 10.952 3.271 -4.129 1.00 0.00 N ATOM 0 H GLN A 99 8.300 -0.151 -4.267 1.00 0.00 H new ATOM 0 HA GLN A 99 10.148 0.508 -2.192 1.00 0.00 H new ATOM 0 HB2 GLN A 99 7.601 1.475 -3.305 1.00 0.00 H new ATOM 0 HB3 GLN A 99 7.671 1.633 -1.561 1.00 0.00 H new ATOM 0 HG2 GLN A 99 8.540 3.666 -2.329 1.00 0.00 H new ATOM 0 HG3 GLN A 99 9.971 2.746 -1.910 1.00 0.00 H new ATOM 0 HE21 GLN A 99 11.530 3.362 -3.294 1.00 0.00 H new ATOM 0 HE22 GLN A 99 11.365 3.406 -5.052 1.00 0.00 H new ATOM 473 N ILE A 100 7.568 -1.397 -1.458 1.00 0.00 N ATOM 474 CA ILE A 100 7.013 -2.258 -0.423 1.00 0.00 C ATOM 475 C ILE A 100 8.011 -3.319 -0.013 1.00 0.00 C ATOM 476 O ILE A 100 8.469 -3.355 1.129 1.00 0.00 O ATOM 477 CB ILE A 100 5.725 -2.966 -0.878 1.00 0.00 C ATOM 478 CG1 ILE A 100 4.899 -2.079 -1.809 1.00 0.00 C ATOM 479 CG2 ILE A 100 4.905 -3.357 0.335 1.00 0.00 C ATOM 480 CD1 ILE A 100 4.662 -0.697 -1.254 1.00 0.00 C ATOM 0 H ILE A 100 7.094 -1.457 -2.359 1.00 0.00 H new ATOM 0 HA ILE A 100 6.780 -1.606 0.419 1.00 0.00 H new ATOM 0 HB ILE A 100 6.004 -3.861 -1.435 1.00 0.00 H new ATOM 0 HG12 ILE A 100 5.409 -1.996 -2.769 1.00 0.00 H new ATOM 0 HG13 ILE A 100 3.938 -2.557 -1.999 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.993 -3.858 0.011 1.00 0.00 H new ATOM 0 HG22 ILE A 100 5.486 -4.031 0.965 1.00 0.00 H new ATOM 0 HG23 ILE A 100 4.646 -2.463 0.902 1.00 0.00 H new ATOM 0 HD11 ILE A 100 4.070 -0.117 -1.962 1.00 0.00 H new ATOM 0 HD12 ILE A 100 4.126 -0.772 -0.308 1.00 0.00 H new ATOM 0 HD13 ILE A 100 5.619 -0.202 -1.090 1.00 0.00 H new ATOM 492 N GLU A 101 8.357 -4.177 -0.962 1.00 0.00 N ATOM 493 CA GLU A 101 9.323 -5.241 -0.709 1.00 0.00 C ATOM 494 C GLU A 101 10.571 -4.670 -0.045 1.00 0.00 C ATOM 495 O GLU A 101 11.304 -5.378 0.647 1.00 0.00 O ATOM 496 CB GLU A 101 9.697 -5.946 -2.015 1.00 0.00 C ATOM 497 CG GLU A 101 10.502 -7.219 -1.810 1.00 0.00 C ATOM 498 CD GLU A 101 11.523 -7.446 -2.906 1.00 0.00 C ATOM 499 OE1 GLU A 101 11.229 -7.107 -4.073 1.00 0.00 O ATOM 500 OE2 GLU A 101 12.618 -7.963 -2.600 1.00 0.00 O1- ATOM 0 H GLU A 101 7.986 -4.159 -1.912 1.00 0.00 H new ATOM 0 HA GLU A 101 8.868 -5.970 -0.039 1.00 0.00 H new ATOM 0 HB2 GLU A 101 8.786 -6.187 -2.562 1.00 0.00 H new ATOM 0 HB3 GLU A 101 10.271 -5.259 -2.637 1.00 0.00 H new ATOM 0 HG2 GLU A 101 11.012 -7.171 -0.848 1.00 0.00 H new ATOM 0 HG3 GLU A 101 9.823 -8.071 -1.769 1.00 0.00 H new ATOM 507 N PHE A 102 10.788 -3.373 -0.245 1.00 0.00 N ATOM 508 CA PHE A 102 11.922 -2.679 0.344 1.00 0.00 C ATOM 509 C PHE A 102 11.570 -2.236 1.757 1.00 0.00 C ATOM 510 O PHE A 102 12.351 -2.395 2.694 1.00 0.00 O ATOM 511 CB PHE A 102 12.284 -1.464 -0.515 1.00 0.00 C ATOM 512 CG PHE A 102 13.138 -0.444 0.187 1.00 0.00 C ATOM 513 CD1 PHE A 102 12.564 0.484 1.040 1.00 0.00 C ATOM 514 CD2 PHE A 102 14.509 -0.414 -0.008 1.00 0.00 C ATOM 515 CE1 PHE A 102 13.344 1.425 1.686 1.00 0.00 C ATOM 516 CE2 PHE A 102 15.294 0.525 0.635 1.00 0.00 C ATOM 517 CZ PHE A 102 14.710 1.446 1.483 1.00 0.00 C ATOM 0 H PHE A 102 10.186 -2.780 -0.816 1.00 0.00 H new ATOM 0 HA PHE A 102 12.779 -3.351 0.386 1.00 0.00 H new ATOM 0 HB2 PHE A 102 12.807 -1.807 -1.407 1.00 0.00 H new ATOM 0 HB3 PHE A 102 11.365 -0.983 -0.850 1.00 0.00 H new ATOM 0 HD1 PHE A 102 11.496 0.472 1.202 1.00 0.00 H new ATOM 0 HD2 PHE A 102 14.970 -1.132 -0.670 1.00 0.00 H new ATOM 0 HE1 PHE A 102 12.885 2.143 2.349 1.00 0.00 H new ATOM 0 HE2 PHE A 102 16.362 0.538 0.475 1.00 0.00 H new ATOM 0 HZ PHE A 102 15.320 2.181 1.986 1.00 0.00 H new ATOM 527 N TYR A 103 10.375 -1.676 1.884 1.00 0.00 N ATOM 528 CA TYR A 103 9.874 -1.194 3.161 1.00 0.00 C ATOM 529 C TYR A 103 9.899 -2.300 4.216 1.00 0.00 C ATOM 530 O TYR A 103 10.491 -2.143 5.281 1.00 0.00 O ATOM 531 CB TYR A 103 8.451 -0.653 2.975 1.00 0.00 C ATOM 532 CG TYR A 103 7.391 -1.403 3.751 1.00 0.00 C ATOM 533 CD1 TYR A 103 7.228 -1.178 5.108 1.00 0.00 C ATOM 534 CD2 TYR A 103 6.554 -2.329 3.134 1.00 0.00 C ATOM 535 CE1 TYR A 103 6.264 -1.845 5.832 1.00 0.00 C ATOM 536 CE2 TYR A 103 5.586 -3.001 3.853 1.00 0.00 C ATOM 537 CZ TYR A 103 5.444 -2.755 5.203 1.00 0.00 C ATOM 538 OH TYR A 103 4.479 -3.421 5.922 1.00 0.00 O ATOM 0 H TYR A 103 9.728 -1.544 1.106 1.00 0.00 H new ATOM 0 HA TYR A 103 10.522 -0.392 3.514 1.00 0.00 H new ATOM 0 HB2 TYR A 103 8.431 0.394 3.276 1.00 0.00 H new ATOM 0 HB3 TYR A 103 8.199 -0.685 1.915 1.00 0.00 H new ATOM 0 HD1 TYR A 103 7.868 -0.466 5.608 1.00 0.00 H new ATOM 0 HD2 TYR A 103 6.664 -2.524 2.077 1.00 0.00 H new ATOM 0 HE1 TYR A 103 6.152 -1.655 6.889 1.00 0.00 H new ATOM 0 HE2 TYR A 103 4.943 -3.716 3.361 1.00 0.00 H new ATOM 0 HH TYR A 103 4.762 -4.348 6.069 1.00 0.00 H new ATOM 548 N PHE A 104 9.238 -3.412 3.914 1.00 0.00 N ATOM 549 CA PHE A 104 9.178 -4.538 4.845 1.00 0.00 C ATOM 550 C PHE A 104 10.514 -5.285 4.939 1.00 0.00 C ATOM 551 O PHE A 104 10.607 -6.308 5.616 1.00 0.00 O ATOM 552 CB PHE A 104 8.065 -5.512 4.440 1.00 0.00 C ATOM 553 CG PHE A 104 7.230 -5.996 5.597 1.00 0.00 C ATOM 554 CD1 PHE A 104 7.805 -6.699 6.645 1.00 0.00 C ATOM 555 CD2 PHE A 104 5.867 -5.745 5.636 1.00 0.00 C ATOM 556 CE1 PHE A 104 7.039 -7.142 7.706 1.00 0.00 C ATOM 557 CE2 PHE A 104 5.096 -6.184 6.696 1.00 0.00 C ATOM 558 CZ PHE A 104 5.683 -6.883 7.731 1.00 0.00 C ATOM 0 H PHE A 104 8.738 -3.560 3.037 1.00 0.00 H new ATOM 0 HA PHE A 104 8.959 -4.125 5.830 1.00 0.00 H new ATOM 0 HB2 PHE A 104 7.415 -5.024 3.714 1.00 0.00 H new ATOM 0 HB3 PHE A 104 8.511 -6.372 3.941 1.00 0.00 H new ATOM 0 HD1 PHE A 104 8.866 -6.903 6.632 1.00 0.00 H new ATOM 0 HD2 PHE A 104 5.402 -5.200 4.828 1.00 0.00 H new ATOM 0 HE1 PHE A 104 7.500 -7.690 8.514 1.00 0.00 H new ATOM 0 HE2 PHE A 104 4.036 -5.980 6.714 1.00 0.00 H new ATOM 0 HZ PHE A 104 5.082 -7.227 8.560 1.00 0.00 H new ATOM 568 N SER A 105 11.552 -4.778 4.279 1.00 0.00 N ATOM 569 CA SER A 105 12.860 -5.423 4.337 1.00 0.00 C ATOM 570 C SER A 105 13.347 -5.489 5.783 1.00 0.00 C ATOM 571 O SER A 105 13.141 -4.552 6.554 1.00 0.00 O ATOM 572 CB SER A 105 13.872 -4.667 3.473 1.00 0.00 C ATOM 573 OG SER A 105 14.983 -5.488 3.155 1.00 0.00 O ATOM 0 H SER A 105 11.515 -3.935 3.706 1.00 0.00 H new ATOM 0 HA SER A 105 12.765 -6.437 3.948 1.00 0.00 H new ATOM 0 HB2 SER A 105 13.391 -4.329 2.555 1.00 0.00 H new ATOM 0 HB3 SER A 105 14.213 -3.776 4.001 1.00 0.00 H new ATOM 0 HG SER A 105 15.615 -4.983 2.601 1.00 0.00 H new ATOM 579 N ASP A 106 13.978 -6.602 6.150 1.00 0.00 N ATOM 580 CA ASP A 106 14.480 -6.797 7.514 1.00 0.00 C ATOM 581 C ASP A 106 15.110 -5.520 8.074 1.00 0.00 C ATOM 582 O ASP A 106 14.650 -4.968 9.073 1.00 0.00 O ATOM 583 CB ASP A 106 15.518 -7.923 7.554 1.00 0.00 C ATOM 584 CG ASP A 106 16.363 -7.995 6.294 1.00 0.00 C ATOM 585 OD1 ASP A 106 15.787 -8.173 5.200 1.00 0.00 O ATOM 586 OD2 ASP A 106 17.601 -7.871 6.403 1.00 0.00 O1- ATOM 0 H ASP A 106 14.156 -7.386 5.522 1.00 0.00 H new ATOM 0 HA ASP A 106 13.622 -7.064 8.132 1.00 0.00 H new ATOM 0 HB2 ASP A 106 16.171 -7.778 8.415 1.00 0.00 H new ATOM 0 HB3 ASP A 106 15.008 -8.875 7.698 1.00 0.00 H new ATOM 591 N GLU A 107 16.170 -5.065 7.418 1.00 0.00 N ATOM 592 CA GLU A 107 16.885 -3.862 7.833 1.00 0.00 C ATOM 593 C GLU A 107 16.003 -2.624 7.747 1.00 0.00 C ATOM 594 O GLU A 107 16.308 -1.589 8.340 1.00 0.00 O ATOM 595 CB GLU A 107 18.105 -3.665 6.947 1.00 0.00 C ATOM 596 CG GLU A 107 19.120 -4.786 7.062 1.00 0.00 C ATOM 597 CD GLU A 107 19.891 -4.744 8.368 1.00 0.00 C ATOM 598 OE1 GLU A 107 20.766 -3.867 8.513 1.00 0.00 O ATOM 599 OE2 GLU A 107 19.618 -5.590 9.245 1.00 0.00 O1- ATOM 0 H GLU A 107 16.557 -5.515 6.589 1.00 0.00 H new ATOM 0 HA GLU A 107 17.185 -3.995 8.872 1.00 0.00 H new ATOM 0 HB2 GLU A 107 17.782 -3.583 5.909 1.00 0.00 H new ATOM 0 HB3 GLU A 107 18.585 -2.722 7.207 1.00 0.00 H new ATOM 0 HG2 GLU A 107 18.608 -5.745 6.977 1.00 0.00 H new ATOM 0 HG3 GLU A 107 19.820 -4.724 6.229 1.00 0.00 H new ATOM 606 N ASN A 108 14.920 -2.737 7.001 1.00 0.00 N ATOM 607 CA ASN A 108 13.994 -1.628 6.825 1.00 0.00 C ATOM 608 C ASN A 108 12.898 -1.664 7.883 1.00 0.00 C ATOM 609 O ASN A 108 12.213 -0.669 8.116 1.00 0.00 O ATOM 610 CB ASN A 108 13.385 -1.663 5.423 1.00 0.00 C ATOM 611 CG ASN A 108 12.889 -0.302 4.975 1.00 0.00 C ATOM 612 OD1 ASN A 108 13.556 0.392 4.208 1.00 0.00 O ATOM 613 ND2 ASN A 108 11.714 0.088 5.452 1.00 0.00 N ATOM 0 H ASN A 108 14.657 -3.588 6.504 1.00 0.00 H new ATOM 0 HA ASN A 108 14.548 -0.697 6.942 1.00 0.00 H new ATOM 0 HB2 ASN A 108 14.130 -2.026 4.715 1.00 0.00 H new ATOM 0 HB3 ASN A 108 12.557 -2.372 5.407 1.00 0.00 H new ATOM 0 HD21 ASN A 108 11.331 0.995 5.185 1.00 0.00 H new ATOM 0 HD22 ASN A 108 11.194 -0.519 6.086 1.00 0.00 H new ATOM 620 N LEU A 109 12.754 -2.813 8.535 1.00 0.00 N ATOM 621 CA LEU A 109 11.772 -2.981 9.578 1.00 0.00 C ATOM 622 C LEU A 109 12.199 -2.207 10.796 1.00 0.00 C ATOM 623 O LEU A 109 11.455 -1.379 11.322 1.00 0.00 O ATOM 624 CB LEU A 109 11.653 -4.450 9.921 1.00 0.00 C ATOM 625 CG LEU A 109 10.586 -5.204 9.149 1.00 0.00 C ATOM 626 CD1 LEU A 109 9.353 -5.345 10.012 1.00 0.00 C ATOM 627 CD2 LEU A 109 10.237 -4.506 7.845 1.00 0.00 C ATOM 0 H LEU A 109 13.315 -3.644 8.350 1.00 0.00 H new ATOM 0 HA LEU A 109 10.806 -2.610 9.237 1.00 0.00 H new ATOM 0 HB2 LEU A 109 12.616 -4.929 9.742 1.00 0.00 H new ATOM 0 HB3 LEU A 109 11.443 -4.543 10.987 1.00 0.00 H new ATOM 0 HG LEU A 109 10.977 -6.190 8.896 1.00 0.00 H new ATOM 0 HD11 LEU A 109 8.583 -5.886 9.461 1.00 0.00 H new ATOM 0 HD12 LEU A 109 9.605 -5.895 10.919 1.00 0.00 H new ATOM 0 HD13 LEU A 109 8.981 -4.356 10.279 1.00 0.00 H new ATOM 0 HD21 LEU A 109 9.470 -5.076 7.321 1.00 0.00 H new ATOM 0 HD22 LEU A 109 9.863 -3.504 8.057 1.00 0.00 H new ATOM 0 HD23 LEU A 109 11.127 -4.436 7.220 1.00 0.00 H new ATOM 639 N GLU A 110 13.423 -2.471 11.225 1.00 0.00 N ATOM 640 CA GLU A 110 13.982 -1.787 12.370 1.00 0.00 C ATOM 641 C GLU A 110 13.868 -0.272 12.197 1.00 0.00 C ATOM 642 O GLU A 110 14.026 0.487 13.153 1.00 0.00 O ATOM 643 CB GLU A 110 15.450 -2.164 12.603 1.00 0.00 C ATOM 644 CG GLU A 110 16.011 -3.172 11.621 1.00 0.00 C ATOM 645 CD GLU A 110 17.525 -3.252 11.673 1.00 0.00 C ATOM 646 OE1 GLU A 110 18.066 -3.568 12.753 1.00 0.00 O ATOM 647 OE2 GLU A 110 18.168 -3.000 10.633 1.00 0.00 O1- ATOM 0 H GLU A 110 14.045 -3.155 10.794 1.00 0.00 H new ATOM 0 HA GLU A 110 13.408 -2.102 13.241 1.00 0.00 H new ATOM 0 HB2 GLU A 110 16.055 -1.258 12.557 1.00 0.00 H new ATOM 0 HB3 GLU A 110 15.552 -2.565 13.611 1.00 0.00 H new ATOM 0 HG2 GLU A 110 15.591 -4.155 11.834 1.00 0.00 H new ATOM 0 HG3 GLU A 110 15.699 -2.904 10.612 1.00 0.00 H new ATOM 654 N LYS A 111 13.625 0.157 10.958 1.00 0.00 N ATOM 655 CA LYS A 111 13.526 1.570 10.638 1.00 0.00 C ATOM 656 C LYS A 111 12.140 1.962 10.120 1.00 0.00 C ATOM 657 O LYS A 111 11.861 3.147 9.941 1.00 0.00 O ATOM 658 CB LYS A 111 14.578 1.908 9.587 1.00 0.00 C ATOM 659 CG LYS A 111 15.911 2.333 10.178 1.00 0.00 C ATOM 660 CD LYS A 111 15.786 3.626 10.968 1.00 0.00 C ATOM 661 CE LYS A 111 15.883 3.379 12.465 1.00 0.00 C ATOM 662 NZ LYS A 111 15.361 4.530 13.254 1.00 0.00 N1+ ATOM 0 H LYS A 111 13.493 -0.463 10.159 1.00 0.00 H new ATOM 0 HA LYS A 111 13.694 2.133 11.556 1.00 0.00 H new ATOM 0 HB2 LYS A 111 14.734 1.039 8.948 1.00 0.00 H new ATOM 0 HB3 LYS A 111 14.200 2.708 8.951 1.00 0.00 H new ATOM 0 HG2 LYS A 111 16.290 1.544 10.828 1.00 0.00 H new ATOM 0 HG3 LYS A 111 16.639 2.464 9.378 1.00 0.00 H new ATOM 0 HD2 LYS A 111 16.571 4.318 10.661 1.00 0.00 H new ATOM 0 HD3 LYS A 111 14.833 4.103 10.738 1.00 0.00 H new ATOM 0 HE2 LYS A 111 15.323 2.480 12.721 1.00 0.00 H new ATOM 0 HE3 LYS A 111 16.923 3.195 12.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 15.445 4.321 14.269 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 15.911 5.383 13.029 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 14.362 4.690 13.015 1.00 0.00 H new ATOM 676 N ASP A 112 11.284 0.979 9.848 1.00 0.00 N ATOM 677 CA ASP A 112 9.954 1.274 9.317 1.00 0.00 C ATOM 678 C ASP A 112 8.842 0.806 10.240 1.00 0.00 C ATOM 679 O ASP A 112 8.039 -0.059 9.888 1.00 0.00 O ATOM 680 CB ASP A 112 9.793 0.643 7.946 1.00 0.00 C ATOM 681 CG ASP A 112 8.578 1.166 7.209 1.00 0.00 C ATOM 682 OD1 ASP A 112 7.484 1.194 7.811 1.00 0.00 O1- ATOM 683 OD2 ASP A 112 8.719 1.547 6.027 1.00 0.00 O ATOM 0 H ASP A 112 11.482 -0.012 9.983 1.00 0.00 H new ATOM 0 HA ASP A 112 9.870 2.358 9.238 1.00 0.00 H new ATOM 0 HB2 ASP A 112 10.686 0.837 7.352 1.00 0.00 H new ATOM 0 HB3 ASP A 112 9.711 -0.439 8.054 1.00 0.00 H new ATOM 688 N ALA A 113 8.793 1.407 11.410 1.00 0.00 N ATOM 689 CA ALA A 113 7.766 1.090 12.397 1.00 0.00 C ATOM 690 C ALA A 113 6.447 1.797 12.069 1.00 0.00 C ATOM 691 O ALA A 113 5.434 1.574 12.731 1.00 0.00 O ATOM 692 CB ALA A 113 8.240 1.471 13.790 1.00 0.00 C ATOM 0 H ALA A 113 9.455 2.124 11.708 1.00 0.00 H new ATOM 0 HA ALA A 113 7.587 0.015 12.367 1.00 0.00 H new ATOM 0 HB1 ALA A 113 7.465 1.229 14.517 1.00 0.00 H new ATOM 0 HB2 ALA A 113 9.148 0.917 14.030 1.00 0.00 H new ATOM 0 HB3 ALA A 113 8.448 2.540 13.824 1.00 0.00 H new ATOM 698 N PHE A 114 6.472 2.664 11.056 1.00 0.00 N ATOM 699 CA PHE A 114 5.288 3.420 10.653 1.00 0.00 C ATOM 700 C PHE A 114 4.392 2.623 9.705 1.00 0.00 C ATOM 701 O PHE A 114 3.168 2.635 9.837 1.00 0.00 O ATOM 702 CB PHE A 114 5.712 4.729 9.971 1.00 0.00 C ATOM 703 CG PHE A 114 6.743 4.534 8.893 1.00 0.00 C ATOM 704 CD1 PHE A 114 6.384 4.023 7.656 1.00 0.00 C ATOM 705 CD2 PHE A 114 8.075 4.840 9.124 1.00 0.00 C ATOM 706 CE1 PHE A 114 7.329 3.821 6.670 1.00 0.00 C ATOM 707 CE2 PHE A 114 9.025 4.645 8.140 1.00 0.00 C ATOM 708 CZ PHE A 114 8.652 4.134 6.912 1.00 0.00 C ATOM 0 H PHE A 114 7.303 2.860 10.498 1.00 0.00 H new ATOM 0 HA PHE A 114 4.715 3.633 11.556 1.00 0.00 H new ATOM 0 HB2 PHE A 114 4.832 5.207 9.540 1.00 0.00 H new ATOM 0 HB3 PHE A 114 6.108 5.410 10.724 1.00 0.00 H new ATOM 0 HD1 PHE A 114 5.350 3.779 7.460 1.00 0.00 H new ATOM 0 HD2 PHE A 114 8.374 5.235 10.084 1.00 0.00 H new ATOM 0 HE1 PHE A 114 7.034 3.419 5.712 1.00 0.00 H new ATOM 0 HE2 PHE A 114 10.059 4.892 8.331 1.00 0.00 H new ATOM 0 HZ PHE A 114 9.394 3.980 6.142 1.00 0.00 H new ATOM 718 N LEU A 115 5.006 1.949 8.739 1.00 0.00 N ATOM 719 CA LEU A 115 4.267 1.167 7.754 1.00 0.00 C ATOM 720 C LEU A 115 3.939 -0.224 8.291 1.00 0.00 C ATOM 721 O LEU A 115 2.962 -0.848 7.872 1.00 0.00 O ATOM 722 CB LEU A 115 5.078 1.066 6.455 1.00 0.00 C ATOM 723 CG LEU A 115 4.262 1.007 5.153 1.00 0.00 C ATOM 724 CD1 LEU A 115 5.116 0.489 4.000 1.00 0.00 C ATOM 725 CD2 LEU A 115 3.030 0.132 5.321 1.00 0.00 C ATOM 0 H LEU A 115 6.018 1.928 8.617 1.00 0.00 H new ATOM 0 HA LEU A 115 3.324 1.674 7.546 1.00 0.00 H new ATOM 0 HB2 LEU A 115 5.749 1.924 6.401 1.00 0.00 H new ATOM 0 HB3 LEU A 115 5.703 0.175 6.509 1.00 0.00 H new ATOM 0 HG LEU A 115 3.938 2.021 4.920 1.00 0.00 H new ATOM 0 HD11 LEU A 115 4.517 0.456 3.090 1.00 0.00 H new ATOM 0 HD12 LEU A 115 5.967 1.153 3.851 1.00 0.00 H new ATOM 0 HD13 LEU A 115 5.475 -0.513 4.235 1.00 0.00 H new ATOM 0 HD21 LEU A 115 2.471 0.107 4.386 1.00 0.00 H new ATOM 0 HD22 LEU A 115 3.336 -0.880 5.588 1.00 0.00 H new ATOM 0 HD23 LEU A 115 2.399 0.540 6.110 1.00 0.00 H new ATOM 737 N LEU A 116 4.758 -0.706 9.220 1.00 0.00 N ATOM 738 CA LEU A 116 4.555 -2.024 9.811 1.00 0.00 C ATOM 739 C LEU A 116 3.542 -1.967 10.953 1.00 0.00 C ATOM 740 O LEU A 116 2.492 -2.605 10.894 1.00 0.00 O ATOM 741 CB LEU A 116 5.883 -2.588 10.319 1.00 0.00 C ATOM 742 CG LEU A 116 6.247 -3.968 9.775 1.00 0.00 C ATOM 743 CD1 LEU A 116 5.116 -4.955 10.022 1.00 0.00 C ATOM 744 CD2 LEU A 116 6.570 -3.884 8.291 1.00 0.00 C ATOM 0 H LEU A 116 5.569 -0.203 9.580 1.00 0.00 H new ATOM 0 HA LEU A 116 4.160 -2.681 9.036 1.00 0.00 H new ATOM 0 HB2 LEU A 116 6.680 -1.890 10.061 1.00 0.00 H new ATOM 0 HB3 LEU A 116 5.846 -2.641 11.407 1.00 0.00 H new ATOM 0 HG LEU A 116 7.132 -4.325 10.301 1.00 0.00 H new ATOM 0 HD11 LEU A 116 5.394 -5.933 9.628 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.930 -5.035 11.093 1.00 0.00 H new ATOM 0 HD13 LEU A 116 4.212 -4.605 9.522 1.00 0.00 H new ATOM 0 HD21 LEU A 116 6.827 -4.875 7.918 1.00 0.00 H new ATOM 0 HD22 LEU A 116 5.702 -3.507 7.750 1.00 0.00 H new ATOM 0 HD23 LEU A 116 7.413 -3.209 8.140 1.00 0.00 H new ATOM 756 N LYS A 117 3.871 -1.204 11.992 1.00 0.00 N ATOM 757 CA LYS A 117 2.999 -1.067 13.158 1.00 0.00 C ATOM 758 C LYS A 117 1.547 -0.822 12.753 1.00 0.00 C ATOM 759 O LYS A 117 0.623 -1.164 13.489 1.00 0.00 O ATOM 760 CB LYS A 117 3.488 0.078 14.048 1.00 0.00 C ATOM 761 CG LYS A 117 2.919 0.035 15.459 1.00 0.00 C ATOM 762 CD LYS A 117 4.016 0.125 16.508 1.00 0.00 C ATOM 763 CE LYS A 117 3.534 -0.366 17.863 1.00 0.00 C ATOM 764 NZ LYS A 117 4.587 -1.137 18.582 1.00 0.00 N1+ ATOM 0 H LYS A 117 4.738 -0.669 12.051 1.00 0.00 H new ATOM 0 HA LYS A 117 3.039 -2.005 13.712 1.00 0.00 H new ATOM 0 HB2 LYS A 117 4.576 0.046 14.102 1.00 0.00 H new ATOM 0 HB3 LYS A 117 3.220 1.028 13.585 1.00 0.00 H new ATOM 0 HG2 LYS A 117 2.217 0.858 15.594 1.00 0.00 H new ATOM 0 HG3 LYS A 117 2.357 -0.889 15.597 1.00 0.00 H new ATOM 0 HD2 LYS A 117 4.874 -0.467 16.190 1.00 0.00 H new ATOM 0 HD3 LYS A 117 4.355 1.157 16.594 1.00 0.00 H new ATOM 0 HE2 LYS A 117 3.230 0.486 18.471 1.00 0.00 H new ATOM 0 HE3 LYS A 117 2.653 -0.993 17.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 4.218 -1.454 19.501 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 4.860 -1.965 18.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 5.419 -0.531 18.733 1.00 0.00 H new ATOM 778 N HIS A 118 1.353 -0.225 11.580 1.00 0.00 N ATOM 779 CA HIS A 118 0.011 0.068 11.081 1.00 0.00 C ATOM 780 C HIS A 118 -0.893 -1.163 11.150 1.00 0.00 C ATOM 781 O HIS A 118 -2.115 -1.040 11.245 1.00 0.00 O ATOM 782 CB HIS A 118 0.083 0.578 9.640 1.00 0.00 C ATOM 783 CG HIS A 118 -1.171 1.256 9.184 1.00 0.00 C ATOM 784 ND1 HIS A 118 -1.824 0.924 8.016 1.00 0.00 N ATOM 785 CD2 HIS A 118 -1.894 2.254 9.747 1.00 0.00 C ATOM 786 CE1 HIS A 118 -2.893 1.689 7.880 1.00 0.00 C ATOM 787 NE2 HIS A 118 -2.958 2.503 8.916 1.00 0.00 N ATOM 0 H HIS A 118 2.107 0.065 10.957 1.00 0.00 H new ATOM 0 HA HIS A 118 -0.419 0.841 11.719 1.00 0.00 H new ATOM 0 HB2 HIS A 118 0.917 1.275 9.551 1.00 0.00 H new ATOM 0 HB3 HIS A 118 0.296 -0.260 8.976 1.00 0.00 H new ATOM 0 HD2 HIS A 118 -1.674 2.759 10.676 1.00 0.00 H new ATOM 0 HE1 HIS A 118 -3.595 1.654 7.060 1.00 0.00 H new ATOM 0 HE2 HIS A 118 -3.682 3.204 9.074 1.00 0.00 H new ATOM 796 N VAL A 119 -0.290 -2.348 11.101 1.00 0.00 N ATOM 797 CA VAL A 119 -1.051 -3.592 11.155 1.00 0.00 C ATOM 798 C VAL A 119 -1.587 -3.854 12.561 1.00 0.00 C ATOM 799 O VAL A 119 -2.738 -4.254 12.731 1.00 0.00 O ATOM 800 CB VAL A 119 -0.202 -4.797 10.703 1.00 0.00 C ATOM 801 CG1 VAL A 119 0.285 -4.600 9.275 1.00 0.00 C ATOM 802 CG2 VAL A 119 0.971 -5.018 11.646 1.00 0.00 C ATOM 0 H VAL A 119 0.719 -2.472 11.024 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.890 -3.475 10.469 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.830 -5.687 10.733 1.00 0.00 H new ATOM 0 HG11 VAL A 119 0.883 -5.460 8.972 1.00 0.00 H new ATOM 0 HG12 VAL A 119 -0.572 -4.501 8.609 1.00 0.00 H new ATOM 0 HG13 VAL A 119 0.894 -3.698 9.219 1.00 0.00 H new ATOM 0 HG21 VAL A 119 1.555 -5.873 11.306 1.00 0.00 H new ATOM 0 HG22 VAL A 119 1.602 -4.129 11.657 1.00 0.00 H new ATOM 0 HG23 VAL A 119 0.598 -5.210 12.652 1.00 0.00 H new ATOM 812 N ARG A 120 -0.744 -3.626 13.564 1.00 0.00 N ATOM 813 CA ARG A 120 -1.135 -3.838 14.955 1.00 0.00 C ATOM 814 C ARG A 120 -1.645 -5.261 15.172 1.00 0.00 C ATOM 815 O ARG A 120 -2.730 -5.466 15.717 1.00 0.00 O ATOM 816 CB ARG A 120 -2.209 -2.827 15.363 1.00 0.00 C ATOM 817 CG ARG A 120 -2.085 -2.356 16.803 1.00 0.00 C ATOM 818 CD ARG A 120 -0.964 -1.343 16.962 1.00 0.00 C ATOM 819 NE ARG A 120 -0.736 -0.994 18.363 1.00 0.00 N ATOM 820 CZ ARG A 120 -1.567 -0.246 19.085 1.00 0.00 C ATOM 821 NH1 ARG A 120 -2.679 0.236 18.544 1.00 0.00 N1+ ATOM 822 NH2 ARG A 120 -1.284 0.023 20.353 1.00 0.00 N ATOM 0 H ARG A 120 0.213 -3.295 13.440 1.00 0.00 H new ATOM 0 HA ARG A 120 -0.253 -3.693 15.579 1.00 0.00 H new ATOM 0 HB2 ARG A 120 -2.153 -1.963 14.701 1.00 0.00 H new ATOM 0 HB3 ARG A 120 -3.192 -3.276 15.220 1.00 0.00 H new ATOM 0 HG2 ARG A 120 -3.027 -1.911 17.124 1.00 0.00 H new ATOM 0 HG3 ARG A 120 -1.899 -3.212 17.452 1.00 0.00 H new ATOM 0 HD2 ARG A 120 -0.046 -1.748 16.535 1.00 0.00 H new ATOM 0 HD3 ARG A 120 -1.207 -0.442 16.399 1.00 0.00 H new ATOM 0 HE ARG A 120 0.109 -1.344 18.814 1.00 0.00 H new ATOM 0 HH11 ARG A 120 -2.901 0.034 17.569 1.00 0.00 H new ATOM 0 HH12 ARG A 120 -3.311 0.809 19.103 1.00 0.00 H new ATOM 0 HH21 ARG A 120 -0.430 -0.343 20.774 1.00 0.00 H new ATOM 0 HH22 ARG A 120 -1.920 0.596 20.907 1.00 0.00 H new ATOM 836 N ARG A 121 -0.855 -6.240 14.743 1.00 0.00 N ATOM 837 CA ARG A 121 -1.227 -7.643 14.891 1.00 0.00 C ATOM 838 C ARG A 121 -0.126 -8.558 14.366 1.00 0.00 C ATOM 839 O ARG A 121 0.905 -8.091 13.879 1.00 0.00 O ATOM 840 CB ARG A 121 -2.538 -7.926 14.153 1.00 0.00 C ATOM 841 CG ARG A 121 -3.477 -8.850 14.912 1.00 0.00 C ATOM 842 CD ARG A 121 -4.516 -8.064 15.695 1.00 0.00 C ATOM 843 NE ARG A 121 -5.369 -7.262 14.821 1.00 0.00 N ATOM 844 CZ ARG A 121 -6.541 -6.753 15.193 1.00 0.00 C ATOM 845 NH1 ARG A 121 -7.004 -6.961 16.419 1.00 0.00 N1+ ATOM 846 NH2 ARG A 121 -7.253 -6.034 14.336 1.00 0.00 N ATOM 0 H ARG A 121 0.046 -6.088 14.290 1.00 0.00 H new ATOM 0 HA ARG A 121 -1.365 -7.845 15.953 1.00 0.00 H new ATOM 0 HB2 ARG A 121 -3.048 -6.982 13.961 1.00 0.00 H new ATOM 0 HB3 ARG A 121 -2.311 -8.369 13.183 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -3.977 -9.519 14.211 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -2.901 -9.475 15.594 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -5.133 -8.753 16.271 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -4.014 -7.412 16.410 1.00 0.00 H new ATOM 0 HE ARG A 121 -5.047 -7.082 13.870 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -6.461 -7.514 17.082 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -7.903 -6.568 16.698 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -6.902 -5.871 13.392 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -8.151 -5.644 14.621 1.00 0.00 H new ATOM 860 N ASN A 122 -0.350 -9.865 14.467 1.00 0.00 N ATOM 861 CA ASN A 122 0.623 -10.847 14.002 1.00 0.00 C ATOM 862 C ASN A 122 -0.066 -11.983 13.253 1.00 0.00 C ATOM 863 O ASN A 122 0.402 -13.122 13.265 1.00 0.00 O ATOM 864 CB ASN A 122 1.418 -11.407 15.183 1.00 0.00 C ATOM 865 CG ASN A 122 2.862 -11.697 14.821 1.00 0.00 C ATOM 866 OD1 ASN A 122 3.690 -10.790 14.747 1.00 0.00 O ATOM 867 ND2 ASN A 122 3.170 -12.969 14.593 1.00 0.00 N ATOM 0 H ASN A 122 -1.197 -10.268 14.867 1.00 0.00 H new ATOM 0 HA ASN A 122 1.308 -10.347 13.317 1.00 0.00 H new ATOM 0 HB2 ASN A 122 1.389 -10.695 16.008 1.00 0.00 H new ATOM 0 HB3 ASN A 122 0.943 -12.323 15.536 1.00 0.00 H new ATOM 0 HD21 ASN A 122 4.126 -13.226 14.345 1.00 0.00 H new ATOM 0 HD22 ASN A 122 2.451 -13.689 14.666 1.00 0.00 H new ATOM 874 N LYS A 123 -1.181 -11.667 12.603 1.00 0.00 N ATOM 875 CA LYS A 123 -1.936 -12.661 11.848 1.00 0.00 C ATOM 876 C LYS A 123 -3.006 -11.992 10.993 1.00 0.00 C ATOM 877 O LYS A 123 -2.949 -12.034 9.763 1.00 0.00 O ATOM 878 CB LYS A 123 -2.578 -13.674 12.799 1.00 0.00 C ATOM 879 CG LYS A 123 -2.094 -15.099 12.586 1.00 0.00 C ATOM 880 CD LYS A 123 -2.712 -16.054 13.595 1.00 0.00 C ATOM 881 CE LYS A 123 -1.704 -17.088 14.071 1.00 0.00 C ATOM 882 NZ LYS A 123 -1.660 -18.276 13.175 1.00 0.00 N1+ ATOM 0 H LYS A 123 -1.582 -10.729 12.584 1.00 0.00 H new ATOM 0 HA LYS A 123 -1.246 -13.185 11.187 1.00 0.00 H new ATOM 0 HB2 LYS A 123 -2.369 -13.378 13.827 1.00 0.00 H new ATOM 0 HB3 LYS A 123 -3.660 -13.644 12.672 1.00 0.00 H new ATOM 0 HG2 LYS A 123 -2.345 -15.423 11.576 1.00 0.00 H new ATOM 0 HG3 LYS A 123 -1.008 -15.132 12.670 1.00 0.00 H new ATOM 0 HD2 LYS A 123 -3.088 -15.490 14.449 1.00 0.00 H new ATOM 0 HD3 LYS A 123 -3.567 -16.558 13.145 1.00 0.00 H new ATOM 0 HE2 LYS A 123 -0.714 -16.634 14.120 1.00 0.00 H new ATOM 0 HE3 LYS A 123 -1.960 -17.405 15.082 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 -0.961 -18.956 13.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 -2.598 -18.725 13.148 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 -1.391 -17.978 12.216 1.00 0.00 H new ATOM 896 N LEU A 124 -3.980 -11.371 11.651 1.00 0.00 N ATOM 897 CA LEU A 124 -5.062 -10.690 10.951 1.00 0.00 C ATOM 898 C LEU A 124 -4.791 -9.190 10.862 1.00 0.00 C ATOM 899 O LEU A 124 -5.719 -8.387 10.758 1.00 0.00 O ATOM 900 CB LEU A 124 -6.396 -10.942 11.660 1.00 0.00 C ATOM 901 CG LEU A 124 -7.319 -11.942 10.963 1.00 0.00 C ATOM 902 CD1 LEU A 124 -8.139 -12.714 11.985 1.00 0.00 C ATOM 903 CD2 LEU A 124 -8.230 -11.226 9.978 1.00 0.00 C ATOM 0 H LEU A 124 -4.042 -11.326 12.668 1.00 0.00 H new ATOM 0 HA LEU A 124 -5.118 -11.091 9.939 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -6.192 -11.301 12.669 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -6.922 -9.993 11.760 1.00 0.00 H new ATOM 0 HG LEU A 124 -6.704 -12.652 10.410 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -8.790 -13.421 11.470 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -7.470 -13.257 12.653 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -8.745 -12.019 12.565 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -8.881 -11.952 9.490 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -8.838 -10.494 10.510 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -7.626 -10.718 9.226 1.00 0.00 H new ATOM 915 N GLY A 125 -3.515 -8.819 10.903 1.00 0.00 N ATOM 916 CA GLY A 125 -3.146 -7.418 10.826 1.00 0.00 C ATOM 917 C GLY A 125 -2.560 -7.046 9.478 1.00 0.00 C ATOM 918 O GLY A 125 -1.372 -7.254 9.233 1.00 0.00 O ATOM 0 H GLY A 125 -2.730 -9.464 10.988 1.00 0.00 H new ATOM 0 HA2 GLY A 125 -4.025 -6.803 11.019 1.00 0.00 H new ATOM 0 HA3 GLY A 125 -2.421 -7.193 11.608 1.00 0.00 H new ATOM 922 N TYR A 126 -3.395 -6.497 8.604 1.00 0.00 N ATOM 923 CA TYR A 126 -2.954 -6.095 7.273 1.00 0.00 C ATOM 924 C TYR A 126 -2.733 -4.588 7.207 1.00 0.00 C ATOM 925 O TYR A 126 -3.216 -3.844 8.060 1.00 0.00 O ATOM 926 CB TYR A 126 -3.985 -6.517 6.225 1.00 0.00 C ATOM 927 CG TYR A 126 -5.412 -6.199 6.613 1.00 0.00 C ATOM 928 CD1 TYR A 126 -5.827 -4.885 6.791 1.00 0.00 C ATOM 929 CD2 TYR A 126 -6.342 -7.213 6.803 1.00 0.00 C ATOM 930 CE1 TYR A 126 -7.129 -4.591 7.146 1.00 0.00 C ATOM 931 CE2 TYR A 126 -7.647 -6.926 7.158 1.00 0.00 C ATOM 932 CZ TYR A 126 -8.035 -5.614 7.329 1.00 0.00 C ATOM 933 OH TYR A 126 -9.333 -5.325 7.682 1.00 0.00 O ATOM 0 H TYR A 126 -4.382 -6.320 8.793 1.00 0.00 H new ATOM 0 HA TYR A 126 -2.007 -6.593 7.063 1.00 0.00 H new ATOM 0 HB2 TYR A 126 -3.755 -6.021 5.282 1.00 0.00 H new ATOM 0 HB3 TYR A 126 -3.895 -7.589 6.051 1.00 0.00 H new ATOM 0 HD1 TYR A 126 -5.120 -4.081 6.650 1.00 0.00 H new ATOM 0 HD2 TYR A 126 -6.041 -8.242 6.671 1.00 0.00 H new ATOM 0 HE1 TYR A 126 -7.436 -3.564 7.280 1.00 0.00 H new ATOM 0 HE2 TYR A 126 -8.359 -7.725 7.301 1.00 0.00 H new ATOM 0 HH TYR A 126 -9.841 -6.158 7.770 1.00 0.00 H new ATOM 943 N VAL A 127 -2.009 -4.142 6.185 1.00 0.00 N ATOM 944 CA VAL A 127 -1.736 -2.726 6.009 1.00 0.00 C ATOM 945 C VAL A 127 -2.684 -2.134 4.979 1.00 0.00 C ATOM 946 O VAL A 127 -3.010 -2.778 3.987 1.00 0.00 O ATOM 947 CB VAL A 127 -0.286 -2.494 5.552 1.00 0.00 C ATOM 948 CG1 VAL A 127 -0.020 -1.016 5.317 1.00 0.00 C ATOM 949 CG2 VAL A 127 0.689 -3.071 6.564 1.00 0.00 C ATOM 0 H VAL A 127 -1.602 -4.743 5.468 1.00 0.00 H new ATOM 0 HA VAL A 127 -1.884 -2.236 6.972 1.00 0.00 H new ATOM 0 HB VAL A 127 -0.138 -3.012 4.604 1.00 0.00 H new ATOM 0 HG11 VAL A 127 1.012 -0.879 4.995 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -0.694 -0.643 4.545 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -0.187 -0.465 6.242 1.00 0.00 H new ATOM 0 HG21 VAL A 127 1.710 -2.898 6.225 1.00 0.00 H new ATOM 0 HG22 VAL A 127 0.540 -2.587 7.529 1.00 0.00 H new ATOM 0 HG23 VAL A 127 0.517 -4.143 6.665 1.00 0.00 H new ATOM 959 N SER A 128 -3.129 -0.910 5.217 1.00 0.00 N ATOM 960 CA SER A 128 -4.040 -0.258 4.293 1.00 0.00 C ATOM 961 C SER A 128 -3.270 0.476 3.199 1.00 0.00 C ATOM 962 O SER A 128 -2.421 1.326 3.481 1.00 0.00 O ATOM 963 CB SER A 128 -4.954 0.716 5.039 1.00 0.00 C ATOM 964 OG SER A 128 -5.394 0.165 6.267 1.00 0.00 O ATOM 0 H SER A 128 -2.877 -0.354 6.034 1.00 0.00 H new ATOM 0 HA SER A 128 -4.655 -1.027 3.825 1.00 0.00 H new ATOM 0 HB2 SER A 128 -4.421 1.649 5.226 1.00 0.00 H new ATOM 0 HB3 SER A 128 -5.815 0.960 4.417 1.00 0.00 H new ATOM 0 HG SER A 128 -5.975 0.808 6.725 1.00 0.00 H new ATOM 970 N VAL A 129 -3.567 0.143 1.947 1.00 0.00 N ATOM 971 CA VAL A 129 -2.897 0.775 0.820 1.00 0.00 C ATOM 972 C VAL A 129 -3.027 2.294 0.891 1.00 0.00 C ATOM 973 O VAL A 129 -2.142 3.024 0.444 1.00 0.00 O ATOM 974 CB VAL A 129 -3.446 0.269 -0.531 1.00 0.00 C ATOM 975 CG1 VAL A 129 -4.785 0.918 -0.858 1.00 0.00 C ATOM 976 CG2 VAL A 129 -2.431 0.521 -1.637 1.00 0.00 C ATOM 0 H VAL A 129 -4.263 -0.557 1.690 1.00 0.00 H new ATOM 0 HA VAL A 129 -1.844 0.502 0.884 1.00 0.00 H new ATOM 0 HB VAL A 129 -3.614 -0.805 -0.454 1.00 0.00 H new ATOM 0 HG11 VAL A 129 -5.147 0.543 -1.815 1.00 0.00 H new ATOM 0 HG12 VAL A 129 -5.506 0.677 -0.077 1.00 0.00 H new ATOM 0 HG13 VAL A 129 -4.661 1.999 -0.916 1.00 0.00 H new ATOM 0 HG21 VAL A 129 -2.829 0.160 -2.585 1.00 0.00 H new ATOM 0 HG22 VAL A 129 -2.231 1.590 -1.711 1.00 0.00 H new ATOM 0 HG23 VAL A 129 -1.505 -0.006 -1.408 1.00 0.00 H new ATOM 986 N LYS A 130 -4.130 2.762 1.472 1.00 0.00 N ATOM 987 CA LYS A 130 -4.366 4.194 1.617 1.00 0.00 C ATOM 988 C LYS A 130 -3.172 4.856 2.293 1.00 0.00 C ATOM 989 O LYS A 130 -2.852 6.014 2.026 1.00 0.00 O ATOM 990 CB LYS A 130 -5.637 4.448 2.431 1.00 0.00 C ATOM 991 CG LYS A 130 -6.297 5.782 2.128 1.00 0.00 C ATOM 992 CD LYS A 130 -7.618 5.931 2.864 1.00 0.00 C ATOM 993 CE LYS A 130 -7.463 6.765 4.126 1.00 0.00 C ATOM 994 NZ LYS A 130 -8.593 6.555 5.073 1.00 0.00 N1+ ATOM 0 H LYS A 130 -4.871 2.171 1.848 1.00 0.00 H new ATOM 0 HA LYS A 130 -4.496 4.626 0.625 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -6.350 3.647 2.235 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -5.393 4.406 3.493 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -5.627 6.593 2.413 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -6.466 5.870 1.055 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -8.351 6.398 2.206 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -8.004 4.945 3.123 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -6.525 6.508 4.618 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -7.405 7.820 3.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -8.450 7.141 5.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -9.486 6.824 4.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -8.634 5.553 5.348 1.00 0.00 H new ATOM 1008 N LEU A 131 -2.506 4.099 3.160 1.00 0.00 N ATOM 1009 CA LEU A 131 -1.337 4.587 3.865 1.00 0.00 C ATOM 1010 C LEU A 131 -0.129 4.585 2.934 1.00 0.00 C ATOM 1011 O LEU A 131 0.665 5.525 2.925 1.00 0.00 O ATOM 1012 CB LEU A 131 -1.071 3.722 5.101 1.00 0.00 C ATOM 1013 CG LEU A 131 0.402 3.547 5.465 1.00 0.00 C ATOM 1014 CD1 LEU A 131 1.028 4.889 5.801 1.00 0.00 C ATOM 1015 CD2 LEU A 131 0.559 2.568 6.619 1.00 0.00 C ATOM 0 H LEU A 131 -2.763 3.139 3.389 1.00 0.00 H new ATOM 0 HA LEU A 131 -1.518 5.610 4.194 1.00 0.00 H new ATOM 0 HB2 LEU A 131 -1.590 4.163 5.952 1.00 0.00 H new ATOM 0 HB3 LEU A 131 -1.508 2.737 4.937 1.00 0.00 H new ATOM 0 HG LEU A 131 0.924 3.134 4.602 1.00 0.00 H new ATOM 0 HD11 LEU A 131 2.078 4.747 6.058 1.00 0.00 H new ATOM 0 HD12 LEU A 131 0.952 5.552 4.939 1.00 0.00 H new ATOM 0 HD13 LEU A 131 0.504 5.333 6.647 1.00 0.00 H new ATOM 0 HD21 LEU A 131 1.616 2.458 6.862 1.00 0.00 H new ATOM 0 HD22 LEU A 131 0.024 2.944 7.491 1.00 0.00 H new ATOM 0 HD23 LEU A 131 0.150 1.599 6.332 1.00 0.00 H new ATOM 1027 N LEU A 132 0.001 3.518 2.149 1.00 0.00 N ATOM 1028 CA LEU A 132 1.112 3.393 1.212 1.00 0.00 C ATOM 1029 C LEU A 132 1.186 4.603 0.286 1.00 0.00 C ATOM 1030 O LEU A 132 2.265 4.991 -0.158 1.00 0.00 O ATOM 1031 CB LEU A 132 0.964 2.119 0.382 1.00 0.00 C ATOM 1032 CG LEU A 132 1.563 0.862 1.011 1.00 0.00 C ATOM 1033 CD1 LEU A 132 1.024 0.661 2.419 1.00 0.00 C ATOM 1034 CD2 LEU A 132 1.264 -0.350 0.148 1.00 0.00 C ATOM 0 H LEU A 132 -0.647 2.731 2.144 1.00 0.00 H new ATOM 0 HA LEU A 132 2.034 3.342 1.790 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -0.096 1.945 0.198 1.00 0.00 H new ATOM 0 HB3 LEU A 132 1.433 2.280 -0.589 1.00 0.00 H new ATOM 0 HG LEU A 132 2.644 0.986 1.074 1.00 0.00 H new ATOM 0 HD11 LEU A 132 1.462 -0.239 2.851 1.00 0.00 H new ATOM 0 HD12 LEU A 132 1.284 1.522 3.034 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -0.060 0.555 2.382 1.00 0.00 H new ATOM 0 HD21 LEU A 132 1.696 -1.239 0.607 1.00 0.00 H new ATOM 0 HD22 LEU A 132 0.185 -0.476 0.059 1.00 0.00 H new ATOM 0 HD23 LEU A 132 1.696 -0.207 -0.843 1.00 0.00 H new ATOM 1046 N THR A 133 0.032 5.197 0.000 1.00 0.00 N ATOM 1047 CA THR A 133 -0.033 6.361 -0.870 1.00 0.00 C ATOM 1048 C THR A 133 0.515 7.590 -0.160 1.00 0.00 C ATOM 1049 O THR A 133 1.284 8.364 -0.730 1.00 0.00 O ATOM 1050 CB THR A 133 -1.476 6.608 -1.304 1.00 0.00 C ATOM 1051 OG1 THR A 133 -2.385 5.977 -0.415 1.00 0.00 O ATOM 1052 CG2 THR A 133 -1.766 6.105 -2.697 1.00 0.00 C ATOM 0 H THR A 133 -0.871 4.889 0.360 1.00 0.00 H new ATOM 0 HA THR A 133 0.578 6.170 -1.752 1.00 0.00 H new ATOM 0 HB THR A 133 -1.606 7.690 -1.290 1.00 0.00 H new ATOM 0 HG1 THR A 133 -2.207 6.275 0.501 1.00 0.00 H new ATOM 0 HG21 THR A 133 -2.807 6.309 -2.948 1.00 0.00 H new ATOM 0 HG22 THR A 133 -1.115 6.611 -3.410 1.00 0.00 H new ATOM 0 HG23 THR A 133 -1.586 5.031 -2.741 1.00 0.00 H new ATOM 1060 N SER A 134 0.120 7.751 1.094 1.00 0.00 N ATOM 1061 CA SER A 134 0.575 8.874 1.904 1.00 0.00 C ATOM 1062 C SER A 134 1.970 8.602 2.460 1.00 0.00 C ATOM 1063 O SER A 134 2.563 9.452 3.125 1.00 0.00 O ATOM 1064 CB SER A 134 -0.404 9.137 3.049 1.00 0.00 C ATOM 1065 OG SER A 134 0.079 10.152 3.912 1.00 0.00 O ATOM 0 H SER A 134 -0.517 7.116 1.575 1.00 0.00 H new ATOM 0 HA SER A 134 0.619 9.759 1.269 1.00 0.00 H new ATOM 0 HB2 SER A 134 -1.372 9.431 2.643 1.00 0.00 H new ATOM 0 HB3 SER A 134 -0.561 8.219 3.615 1.00 0.00 H new ATOM 0 HG SER A 134 1.052 10.222 3.823 1.00 0.00 H new ATOM 1071 N PHE A 135 2.487 7.410 2.177 1.00 0.00 N ATOM 1072 CA PHE A 135 3.810 7.015 2.638 1.00 0.00 C ATOM 1073 C PHE A 135 4.876 7.962 2.091 1.00 0.00 C ATOM 1074 O PHE A 135 5.111 8.014 0.886 1.00 0.00 O ATOM 1075 CB PHE A 135 4.093 5.573 2.212 1.00 0.00 C ATOM 1076 CG PHE A 135 5.448 5.059 2.623 1.00 0.00 C ATOM 1077 CD1 PHE A 135 6.171 5.677 3.633 1.00 0.00 C ATOM 1078 CD2 PHE A 135 5.994 3.947 2.000 1.00 0.00 C ATOM 1079 CE1 PHE A 135 7.410 5.197 4.011 1.00 0.00 C ATOM 1080 CE2 PHE A 135 7.233 3.463 2.373 1.00 0.00 C ATOM 1081 CZ PHE A 135 7.942 4.089 3.381 1.00 0.00 C ATOM 0 H PHE A 135 2.005 6.699 1.627 1.00 0.00 H new ATOM 0 HA PHE A 135 3.840 7.073 3.726 1.00 0.00 H new ATOM 0 HB2 PHE A 135 3.327 4.924 2.637 1.00 0.00 H new ATOM 0 HB3 PHE A 135 4.004 5.503 1.128 1.00 0.00 H new ATOM 0 HD1 PHE A 135 5.760 6.544 4.130 1.00 0.00 H new ATOM 0 HD2 PHE A 135 5.444 3.453 1.213 1.00 0.00 H new ATOM 0 HE1 PHE A 135 7.962 5.688 4.799 1.00 0.00 H new ATOM 0 HE2 PHE A 135 7.647 2.597 1.878 1.00 0.00 H new ATOM 0 HZ PHE A 135 8.910 3.712 3.675 1.00 0.00 H new ATOM 1091 N LYS A 136 5.495 8.726 2.989 1.00 0.00 N ATOM 1092 CA LYS A 136 6.527 9.703 2.623 1.00 0.00 C ATOM 1093 C LYS A 136 7.453 9.201 1.511 1.00 0.00 C ATOM 1094 O LYS A 136 7.939 9.991 0.701 1.00 0.00 O ATOM 1095 CB LYS A 136 7.355 10.073 3.856 1.00 0.00 C ATOM 1096 CG LYS A 136 7.070 11.472 4.379 1.00 0.00 C ATOM 1097 CD LYS A 136 7.214 11.540 5.891 1.00 0.00 C ATOM 1098 CE LYS A 136 7.858 12.845 6.331 1.00 0.00 C ATOM 1099 NZ LYS A 136 9.318 12.689 6.579 1.00 0.00 N1+ ATOM 0 H LYS A 136 5.298 8.688 3.989 1.00 0.00 H new ATOM 0 HA LYS A 136 6.010 10.582 2.238 1.00 0.00 H new ATOM 0 HB2 LYS A 136 7.157 9.350 4.647 1.00 0.00 H new ATOM 0 HB3 LYS A 136 8.414 9.994 3.610 1.00 0.00 H new ATOM 0 HG2 LYS A 136 7.755 12.182 3.915 1.00 0.00 H new ATOM 0 HG3 LYS A 136 6.061 11.770 4.095 1.00 0.00 H new ATOM 0 HD2 LYS A 136 6.233 11.442 6.356 1.00 0.00 H new ATOM 0 HD3 LYS A 136 7.816 10.701 6.238 1.00 0.00 H new ATOM 0 HE2 LYS A 136 7.699 13.604 5.565 1.00 0.00 H new ATOM 0 HE3 LYS A 136 7.372 13.201 7.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 136 9.719 13.601 6.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 136 9.469 11.983 7.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 136 9.787 12.374 5.706 1.00 0.00 H new ATOM 1113 N LYS A 137 7.702 7.897 1.476 1.00 0.00 N ATOM 1114 CA LYS A 137 8.579 7.320 0.461 1.00 0.00 C ATOM 1115 C LYS A 137 7.830 7.101 -0.848 1.00 0.00 C ATOM 1116 O LYS A 137 8.419 7.156 -1.928 1.00 0.00 O ATOM 1117 CB LYS A 137 9.167 5.998 0.954 1.00 0.00 C ATOM 1118 CG LYS A 137 10.156 6.161 2.096 1.00 0.00 C ATOM 1119 CD LYS A 137 11.478 6.730 1.611 1.00 0.00 C ATOM 1120 CE LYS A 137 12.551 6.641 2.684 1.00 0.00 C ATOM 1121 NZ LYS A 137 13.731 7.490 2.362 1.00 0.00 N1+ ATOM 0 H LYS A 137 7.312 7.222 2.134 1.00 0.00 H new ATOM 0 HA LYS A 137 9.391 8.024 0.279 1.00 0.00 H new ATOM 0 HB2 LYS A 137 8.355 5.347 1.278 1.00 0.00 H new ATOM 0 HB3 LYS A 137 9.664 5.498 0.122 1.00 0.00 H new ATOM 0 HG2 LYS A 137 9.732 6.819 2.855 1.00 0.00 H new ATOM 0 HG3 LYS A 137 10.327 5.195 2.571 1.00 0.00 H new ATOM 0 HD2 LYS A 137 11.804 6.188 0.723 1.00 0.00 H new ATOM 0 HD3 LYS A 137 11.341 7.771 1.317 1.00 0.00 H new ATOM 0 HE2 LYS A 137 12.133 6.949 3.642 1.00 0.00 H new ATOM 0 HE3 LYS A 137 12.869 5.604 2.794 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 14.439 7.401 3.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 14.146 7.180 1.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 13.433 8.483 2.282 1.00 0.00 H new ATOM 1135 N VAL A 138 6.531 6.853 -0.745 1.00 0.00 N ATOM 1136 CA VAL A 138 5.702 6.628 -1.914 1.00 0.00 C ATOM 1137 C VAL A 138 5.213 7.950 -2.497 1.00 0.00 C ATOM 1138 O VAL A 138 5.307 8.184 -3.700 1.00 0.00 O ATOM 1139 CB VAL A 138 4.489 5.736 -1.574 1.00 0.00 C ATOM 1140 CG1 VAL A 138 3.507 5.681 -2.734 1.00 0.00 C ATOM 1141 CG2 VAL A 138 4.949 4.336 -1.192 1.00 0.00 C ATOM 0 H VAL A 138 6.030 6.803 0.142 1.00 0.00 H new ATOM 0 HA VAL A 138 6.317 6.117 -2.655 1.00 0.00 H new ATOM 0 HB VAL A 138 3.973 6.177 -0.721 1.00 0.00 H new ATOM 0 HG11 VAL A 138 2.663 5.046 -2.466 1.00 0.00 H new ATOM 0 HG12 VAL A 138 3.149 6.686 -2.955 1.00 0.00 H new ATOM 0 HG13 VAL A 138 4.005 5.271 -3.613 1.00 0.00 H new ATOM 0 HG21 VAL A 138 4.082 3.720 -0.955 1.00 0.00 H new ATOM 0 HG22 VAL A 138 5.493 3.892 -2.025 1.00 0.00 H new ATOM 0 HG23 VAL A 138 5.602 4.393 -0.321 1.00 0.00 H new ATOM 1151 N LYS A 139 4.679 8.811 -1.638 1.00 0.00 N ATOM 1152 CA LYS A 139 4.171 10.101 -2.083 1.00 0.00 C ATOM 1153 C LYS A 139 5.241 10.893 -2.825 1.00 0.00 C ATOM 1154 O LYS A 139 4.927 11.747 -3.654 1.00 0.00 O ATOM 1155 CB LYS A 139 3.642 10.923 -0.913 1.00 0.00 C ATOM 1156 CG LYS A 139 4.643 11.118 0.212 1.00 0.00 C ATOM 1157 CD LYS A 139 4.020 11.858 1.386 1.00 0.00 C ATOM 1158 CE LYS A 139 4.558 13.276 1.502 1.00 0.00 C ATOM 1159 NZ LYS A 139 3.619 14.276 0.922 1.00 0.00 N1+ ATOM 0 H LYS A 139 4.587 8.640 -0.637 1.00 0.00 H new ATOM 0 HA LYS A 139 3.348 9.899 -2.768 1.00 0.00 H new ATOM 0 HB2 LYS A 139 3.331 11.901 -1.281 1.00 0.00 H new ATOM 0 HB3 LYS A 139 2.753 10.435 -0.513 1.00 0.00 H new ATOM 0 HG2 LYS A 139 5.012 10.148 0.545 1.00 0.00 H new ATOM 0 HG3 LYS A 139 5.503 11.676 -0.157 1.00 0.00 H new ATOM 0 HD2 LYS A 139 2.937 11.888 1.265 1.00 0.00 H new ATOM 0 HD3 LYS A 139 4.223 11.314 2.309 1.00 0.00 H new ATOM 0 HE2 LYS A 139 4.737 13.512 2.551 1.00 0.00 H new ATOM 0 HE3 LYS A 139 5.519 13.342 0.992 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 4.023 15.229 1.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 3.468 14.067 -0.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 2.710 14.231 1.425 1.00 0.00 H new ATOM 1173 N HIS A 140 6.504 10.596 -2.537 1.00 0.00 N ATOM 1174 CA HIS A 140 7.609 11.276 -3.200 1.00 0.00 C ATOM 1175 C HIS A 140 7.739 10.797 -4.646 1.00 0.00 C ATOM 1176 O HIS A 140 8.622 11.239 -5.380 1.00 0.00 O ATOM 1177 CB HIS A 140 8.917 11.027 -2.447 1.00 0.00 C ATOM 1178 CG HIS A 140 9.808 12.229 -2.382 1.00 0.00 C ATOM 1179 ND1 HIS A 140 11.125 12.169 -1.977 1.00 0.00 N ATOM 1180 CD2 HIS A 140 9.566 13.528 -2.676 1.00 0.00 C ATOM 1181 CE1 HIS A 140 11.654 13.379 -2.023 1.00 0.00 C ATOM 1182 NE2 HIS A 140 10.729 14.221 -2.445 1.00 0.00 N ATOM 0 H HIS A 140 6.786 9.894 -1.853 1.00 0.00 H new ATOM 0 HA HIS A 140 7.403 12.346 -3.202 1.00 0.00 H new ATOM 0 HB2 HIS A 140 8.687 10.700 -1.433 1.00 0.00 H new ATOM 0 HB3 HIS A 140 9.455 10.211 -2.930 1.00 0.00 H new ATOM 0 HD2 HIS A 140 8.632 13.942 -3.027 1.00 0.00 H new ATOM 0 HE1 HIS A 140 12.670 13.635 -1.760 1.00 0.00 H new ATOM 0 HE2 HIS A 140 10.857 15.224 -2.578 1.00 0.00 H new ATOM 1191 N LEU A 141 6.850 9.888 -5.044 1.00 0.00 N ATOM 1192 CA LEU A 141 6.857 9.340 -6.393 1.00 0.00 C ATOM 1193 C LEU A 141 6.132 10.265 -7.364 1.00 0.00 C ATOM 1194 O LEU A 141 6.756 10.932 -8.187 1.00 0.00 O ATOM 1195 CB LEU A 141 6.193 7.963 -6.391 1.00 0.00 C ATOM 1196 CG LEU A 141 6.872 6.921 -5.504 1.00 0.00 C ATOM 1197 CD1 LEU A 141 5.951 5.734 -5.277 1.00 0.00 C ATOM 1198 CD2 LEU A 141 8.188 6.478 -6.118 1.00 0.00 C ATOM 0 H LEU A 141 6.113 9.516 -4.445 1.00 0.00 H new ATOM 0 HA LEU A 141 7.892 9.247 -6.722 1.00 0.00 H new ATOM 0 HB2 LEU A 141 5.158 8.075 -6.067 1.00 0.00 H new ATOM 0 HB3 LEU A 141 6.168 7.587 -7.414 1.00 0.00 H new ATOM 0 HG LEU A 141 7.085 7.374 -4.536 1.00 0.00 H new ATOM 0 HD11 LEU A 141 6.451 5.002 -4.643 1.00 0.00 H new ATOM 0 HD12 LEU A 141 5.036 6.071 -4.790 1.00 0.00 H new ATOM 0 HD13 LEU A 141 5.704 5.276 -6.235 1.00 0.00 H new ATOM 0 HD21 LEU A 141 8.659 5.736 -5.473 1.00 0.00 H new ATOM 0 HD22 LEU A 141 8.003 6.041 -7.099 1.00 0.00 H new ATOM 0 HD23 LEU A 141 8.849 7.339 -6.223 1.00 0.00 H new ATOM 1210 N THR A 142 4.807 10.296 -7.262 1.00 0.00 N ATOM 1211 CA THR A 142 3.991 11.134 -8.130 1.00 0.00 C ATOM 1212 C THR A 142 2.733 11.597 -7.405 1.00 0.00 C ATOM 1213 O THR A 142 2.487 11.218 -6.260 1.00 0.00 O ATOM 1214 CB THR A 142 3.605 10.364 -9.399 1.00 0.00 C ATOM 1215 OG1 THR A 142 3.042 11.238 -10.363 1.00 0.00 O ATOM 1216 CG2 THR A 142 2.606 9.253 -9.151 1.00 0.00 C ATOM 0 H THR A 142 4.276 9.749 -6.585 1.00 0.00 H new ATOM 0 HA THR A 142 4.577 12.011 -8.407 1.00 0.00 H new ATOM 0 HB THR A 142 4.534 9.920 -9.758 1.00 0.00 H new ATOM 0 HG1 THR A 142 2.229 10.836 -10.733 1.00 0.00 H new ATOM 0 HG21 THR A 142 2.379 8.751 -10.092 1.00 0.00 H new ATOM 0 HG22 THR A 142 3.028 8.534 -8.449 1.00 0.00 H new ATOM 0 HG23 THR A 142 1.691 9.673 -8.734 1.00 0.00 H new ATOM 1224 N ARG A 143 1.931 12.408 -8.086 1.00 0.00 N ATOM 1225 CA ARG A 143 0.688 12.908 -7.514 1.00 0.00 C ATOM 1226 C ARG A 143 -0.488 12.073 -8.007 1.00 0.00 C ATOM 1227 O ARG A 143 -1.599 12.578 -8.172 1.00 0.00 O ATOM 1228 CB ARG A 143 0.484 14.379 -7.885 1.00 0.00 C ATOM 1229 CG ARG A 143 -0.072 15.221 -6.749 1.00 0.00 C ATOM 1230 CD ARG A 143 0.362 16.673 -6.868 1.00 0.00 C ATOM 1231 NE ARG A 143 -0.578 17.462 -7.660 1.00 0.00 N ATOM 1232 CZ ARG A 143 -0.280 18.636 -8.212 1.00 0.00 C ATOM 1233 NH1 ARG A 143 0.930 19.160 -8.061 1.00 0.00 N1+ ATOM 1234 NH2 ARG A 143 -1.194 19.287 -8.918 1.00 0.00 N ATOM 0 H ARG A 143 2.120 12.733 -9.034 1.00 0.00 H new ATOM 0 HA ARG A 143 0.746 12.829 -6.428 1.00 0.00 H new ATOM 0 HB2 ARG A 143 1.437 14.800 -8.205 1.00 0.00 H new ATOM 0 HB3 ARG A 143 -0.194 14.440 -8.737 1.00 0.00 H new ATOM 0 HG2 ARG A 143 -1.161 15.164 -6.752 1.00 0.00 H new ATOM 0 HG3 ARG A 143 0.266 14.816 -5.795 1.00 0.00 H new ATOM 0 HD2 ARG A 143 0.451 17.107 -5.872 1.00 0.00 H new ATOM 0 HD3 ARG A 143 1.350 16.720 -7.326 1.00 0.00 H new ATOM 0 HE ARG A 143 -1.518 17.092 -7.798 1.00 0.00 H new ATOM 0 HH11 ARG A 143 1.637 18.663 -7.520 1.00 0.00 H new ATOM 0 HH12 ARG A 143 1.153 20.060 -8.486 1.00 0.00 H new ATOM 0 HH21 ARG A 143 -2.125 18.888 -9.038 1.00 0.00 H new ATOM 0 HH22 ARG A 143 -0.966 20.187 -9.341 1.00 0.00 H new ATOM 1248 N ASP A 144 -0.229 10.791 -8.249 1.00 0.00 N ATOM 1249 CA ASP A 144 -1.253 9.877 -8.735 1.00 0.00 C ATOM 1250 C ASP A 144 -1.427 8.696 -7.793 1.00 0.00 C ATOM 1251 O ASP A 144 -1.084 7.562 -8.125 1.00 0.00 O ATOM 1252 CB ASP A 144 -0.900 9.389 -10.141 1.00 0.00 C ATOM 1253 CG ASP A 144 -0.432 10.514 -11.045 1.00 0.00 C ATOM 1254 OD1 ASP A 144 0.573 11.172 -10.702 1.00 0.00 O1- ATOM 1255 OD2 ASP A 144 -1.071 10.737 -12.095 1.00 0.00 O ATOM 0 H ASP A 144 0.687 10.362 -8.115 1.00 0.00 H new ATOM 0 HA ASP A 144 -2.199 10.417 -8.774 1.00 0.00 H new ATOM 0 HB2 ASP A 144 -0.119 8.632 -10.074 1.00 0.00 H new ATOM 0 HB3 ASP A 144 -1.772 8.909 -10.585 1.00 0.00 H new ATOM 1260 N TRP A 145 -1.979 8.968 -6.616 1.00 0.00 N ATOM 1261 CA TRP A 145 -2.217 7.932 -5.633 1.00 0.00 C ATOM 1262 C TRP A 145 -3.214 6.908 -6.167 1.00 0.00 C ATOM 1263 O TRP A 145 -3.291 5.785 -5.669 1.00 0.00 O ATOM 1264 CB TRP A 145 -2.700 8.559 -4.325 1.00 0.00 C ATOM 1265 CG TRP A 145 -1.570 9.125 -3.515 1.00 0.00 C ATOM 1266 CD1 TRP A 145 -0.235 8.973 -3.765 1.00 0.00 C ATOM 1267 CD2 TRP A 145 -1.668 9.930 -2.334 1.00 0.00 C ATOM 1268 NE1 TRP A 145 0.503 9.630 -2.815 1.00 0.00 N ATOM 1269 CE2 TRP A 145 -0.353 10.226 -1.924 1.00 0.00 C ATOM 1270 CE3 TRP A 145 -2.737 10.429 -1.584 1.00 0.00 C ATOM 1271 CZ2 TRP A 145 -0.081 10.999 -0.797 1.00 0.00 C ATOM 1272 CZ3 TRP A 145 -2.464 11.196 -0.466 1.00 0.00 C ATOM 1273 CH2 TRP A 145 -1.146 11.474 -0.082 1.00 0.00 C ATOM 0 H TRP A 145 -2.269 9.901 -6.324 1.00 0.00 H new ATOM 0 HA TRP A 145 -1.284 7.405 -5.432 1.00 0.00 H new ATOM 0 HB2 TRP A 145 -3.417 9.349 -4.546 1.00 0.00 H new ATOM 0 HB3 TRP A 145 -3.226 7.807 -3.736 1.00 0.00 H new ATOM 0 HD1 TRP A 145 0.179 8.415 -4.592 1.00 0.00 H new ATOM 0 HE1 TRP A 145 1.522 9.669 -2.777 1.00 0.00 H new ATOM 0 HE3 TRP A 145 -3.757 10.220 -1.872 1.00 0.00 H new ATOM 0 HZ2 TRP A 145 0.934 11.215 -0.499 1.00 0.00 H new ATOM 0 HZ3 TRP A 145 -3.281 11.587 0.121 1.00 0.00 H new ATOM 0 HH2 TRP A 145 -0.967 12.076 0.797 1.00 0.00 H new ATOM 1284 N ARG A 146 -3.952 7.289 -7.210 1.00 0.00 N ATOM 1285 CA ARG A 146 -4.909 6.383 -7.832 1.00 0.00 C ATOM 1286 C ARG A 146 -4.161 5.198 -8.431 1.00 0.00 C ATOM 1287 O ARG A 146 -4.464 4.044 -8.131 1.00 0.00 O ATOM 1288 CB ARG A 146 -5.735 7.098 -8.910 1.00 0.00 C ATOM 1289 CG ARG A 146 -4.977 8.181 -9.666 1.00 0.00 C ATOM 1290 CD ARG A 146 -5.390 9.572 -9.213 1.00 0.00 C ATOM 1291 NE ARG A 146 -6.294 10.213 -10.166 1.00 0.00 N ATOM 1292 CZ ARG A 146 -6.513 11.524 -10.217 1.00 0.00 C ATOM 1293 NH1 ARG A 146 -5.898 12.339 -9.368 1.00 0.00 N1+ ATOM 1294 NH2 ARG A 146 -7.349 12.023 -11.116 1.00 0.00 N ATOM 0 H ARG A 146 -3.904 8.214 -7.638 1.00 0.00 H new ATOM 0 HA ARG A 146 -5.604 6.030 -7.070 1.00 0.00 H new ATOM 0 HB2 ARG A 146 -6.096 6.358 -9.624 1.00 0.00 H new ATOM 0 HB3 ARG A 146 -6.612 7.544 -8.442 1.00 0.00 H new ATOM 0 HG2 ARG A 146 -3.906 8.051 -9.513 1.00 0.00 H new ATOM 0 HG3 ARG A 146 -5.161 8.076 -10.735 1.00 0.00 H new ATOM 0 HD2 ARG A 146 -5.876 9.507 -8.240 1.00 0.00 H new ATOM 0 HD3 ARG A 146 -4.501 10.190 -9.084 1.00 0.00 H new ATOM 0 HE ARG A 146 -6.787 9.619 -10.833 1.00 0.00 H new ATOM 0 HH11 ARG A 146 -5.255 11.960 -8.673 1.00 0.00 H new ATOM 0 HH12 ARG A 146 -6.069 13.344 -9.411 1.00 0.00 H new ATOM 0 HH21 ARG A 146 -7.825 11.402 -11.770 1.00 0.00 H new ATOM 0 HH22 ARG A 146 -7.516 13.028 -11.154 1.00 0.00 H new ATOM 1308 N THR A 147 -3.155 5.494 -9.254 1.00 0.00 N ATOM 1309 CA THR A 147 -2.338 4.450 -9.859 1.00 0.00 C ATOM 1310 C THR A 147 -1.554 3.748 -8.785 1.00 0.00 C ATOM 1311 O THR A 147 -1.307 2.546 -8.865 1.00 0.00 O ATOM 1312 CB THR A 147 -1.391 5.027 -10.915 1.00 0.00 C ATOM 1313 OG1 THR A 147 -0.404 4.079 -11.284 1.00 0.00 O ATOM 1314 CG2 THR A 147 -0.676 6.270 -10.452 1.00 0.00 C ATOM 0 H THR A 147 -2.890 6.444 -9.514 1.00 0.00 H new ATOM 0 HA THR A 147 -2.996 3.739 -10.358 1.00 0.00 H new ATOM 0 HB THR A 147 -2.027 5.281 -11.763 1.00 0.00 H new ATOM 0 HG1 THR A 147 0.279 4.515 -11.835 1.00 0.00 H new ATOM 0 HG21 THR A 147 -0.020 6.629 -11.245 1.00 0.00 H new ATOM 0 HG22 THR A 147 -1.407 7.041 -10.208 1.00 0.00 H new ATOM 0 HG23 THR A 147 -0.082 6.040 -9.567 1.00 0.00 H new ATOM 1322 N THR A 148 -1.182 4.498 -7.761 1.00 0.00 N ATOM 1323 CA THR A 148 -0.448 3.920 -6.658 1.00 0.00 C ATOM 1324 C THR A 148 -1.199 2.697 -6.128 1.00 0.00 C ATOM 1325 O THR A 148 -0.595 1.723 -5.666 1.00 0.00 O ATOM 1326 CB THR A 148 -0.254 4.956 -5.549 1.00 0.00 C ATOM 1327 OG1 THR A 148 0.350 6.128 -6.065 1.00 0.00 O ATOM 1328 CG2 THR A 148 0.610 4.466 -4.408 1.00 0.00 C ATOM 0 H THR A 148 -1.375 5.496 -7.674 1.00 0.00 H new ATOM 0 HA THR A 148 0.536 3.607 -7.006 1.00 0.00 H new ATOM 0 HB THR A 148 -1.254 5.155 -5.164 1.00 0.00 H new ATOM 0 HG1 THR A 148 -0.221 6.510 -6.764 1.00 0.00 H new ATOM 0 HG21 THR A 148 0.704 5.252 -3.659 1.00 0.00 H new ATOM 0 HG22 THR A 148 0.151 3.587 -3.956 1.00 0.00 H new ATOM 0 HG23 THR A 148 1.598 4.205 -4.786 1.00 0.00 H new ATOM 1336 N ALA A 149 -2.528 2.750 -6.227 1.00 0.00 N ATOM 1337 CA ALA A 149 -3.371 1.650 -5.772 1.00 0.00 C ATOM 1338 C ALA A 149 -3.486 0.567 -6.834 1.00 0.00 C ATOM 1339 O ALA A 149 -3.088 -0.576 -6.613 1.00 0.00 O ATOM 1340 CB ALA A 149 -4.748 2.161 -5.378 1.00 0.00 C ATOM 0 H ALA A 149 -3.040 3.541 -6.617 1.00 0.00 H new ATOM 0 HA ALA A 149 -2.900 1.208 -4.894 1.00 0.00 H new ATOM 0 HB1 ALA A 149 -5.363 1.327 -5.041 1.00 0.00 H new ATOM 0 HB2 ALA A 149 -4.649 2.888 -4.572 1.00 0.00 H new ATOM 0 HB3 ALA A 149 -5.220 2.636 -6.238 1.00 0.00 H new ATOM 1346 N HIS A 150 -4.028 0.937 -7.991 1.00 0.00 N ATOM 1347 CA HIS A 150 -4.189 -0.006 -9.091 1.00 0.00 C ATOM 1348 C HIS A 150 -2.855 -0.657 -9.430 1.00 0.00 C ATOM 1349 O HIS A 150 -2.808 -1.781 -9.925 1.00 0.00 O ATOM 1350 CB HIS A 150 -4.763 0.698 -10.318 1.00 0.00 C ATOM 1351 CG HIS A 150 -5.486 -0.223 -11.251 1.00 0.00 C ATOM 1352 ND1 HIS A 150 -6.010 0.189 -12.459 1.00 0.00 N ATOM 1353 CD2 HIS A 150 -5.775 -1.542 -11.148 1.00 0.00 C ATOM 1354 CE1 HIS A 150 -6.591 -0.835 -13.057 1.00 0.00 C ATOM 1355 NE2 HIS A 150 -6.462 -1.897 -12.284 1.00 0.00 N ATOM 0 H HIS A 150 -4.362 1.880 -8.190 1.00 0.00 H new ATOM 0 HA HIS A 150 -4.887 -0.784 -8.780 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -5.447 1.481 -9.991 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -3.953 1.187 -10.859 1.00 0.00 H new ATOM 0 HD1 HIS A 150 -5.957 1.137 -12.832 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -5.514 -2.193 -10.327 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -7.087 -0.808 -14.016 1.00 0.00 H new ATOM 1364 N ALA A 151 -1.769 0.053 -9.140 1.00 0.00 N ATOM 1365 CA ALA A 151 -0.437 -0.464 -9.395 1.00 0.00 C ATOM 1366 C ALA A 151 -0.180 -1.684 -8.525 1.00 0.00 C ATOM 1367 O ALA A 151 0.117 -2.769 -9.027 1.00 0.00 O ATOM 1368 CB ALA A 151 0.609 0.607 -9.128 1.00 0.00 C ATOM 0 H ALA A 151 -1.789 0.986 -8.729 1.00 0.00 H new ATOM 0 HA ALA A 151 -0.368 -0.757 -10.443 1.00 0.00 H new ATOM 0 HB1 ALA A 151 1.602 0.203 -9.324 1.00 0.00 H new ATOM 0 HB2 ALA A 151 0.430 1.461 -9.781 1.00 0.00 H new ATOM 0 HB3 ALA A 151 0.546 0.926 -8.088 1.00 0.00 H new ATOM 1374 N LEU A 152 -0.306 -1.501 -7.216 1.00 0.00 N ATOM 1375 CA LEU A 152 -0.096 -2.589 -6.273 1.00 0.00 C ATOM 1376 C LEU A 152 -1.023 -3.754 -6.560 1.00 0.00 C ATOM 1377 O LEU A 152 -0.672 -4.911 -6.343 1.00 0.00 O ATOM 1378 CB LEU A 152 -0.299 -2.073 -4.861 1.00 0.00 C ATOM 1379 CG LEU A 152 0.986 -1.718 -4.133 1.00 0.00 C ATOM 1380 CD1 LEU A 152 2.049 -1.216 -5.109 1.00 0.00 C ATOM 1381 CD2 LEU A 152 0.715 -0.681 -3.058 1.00 0.00 C ATOM 0 H LEU A 152 -0.552 -0.610 -6.785 1.00 0.00 H new ATOM 0 HA LEU A 152 0.925 -2.956 -6.380 1.00 0.00 H new ATOM 0 HB2 LEU A 152 -0.937 -1.190 -4.898 1.00 0.00 H new ATOM 0 HB3 LEU A 152 -0.833 -2.828 -4.284 1.00 0.00 H new ATOM 0 HG LEU A 152 1.368 -2.621 -3.657 1.00 0.00 H new ATOM 0 HD11 LEU A 152 2.958 -0.969 -4.561 1.00 0.00 H new ATOM 0 HD12 LEU A 152 2.266 -1.993 -5.842 1.00 0.00 H new ATOM 0 HD13 LEU A 152 1.682 -0.327 -5.622 1.00 0.00 H new ATOM 0 HD21 LEU A 152 1.645 -0.437 -2.545 1.00 0.00 H new ATOM 0 HD22 LEU A 152 0.306 0.220 -3.516 1.00 0.00 H new ATOM 0 HD23 LEU A 152 -0.001 -1.080 -2.340 1.00 0.00 H new ATOM 1393 N LYS A 153 -2.199 -3.444 -7.068 1.00 0.00 N ATOM 1394 CA LYS A 153 -3.167 -4.478 -7.417 1.00 0.00 C ATOM 1395 C LYS A 153 -2.501 -5.527 -8.308 1.00 0.00 C ATOM 1396 O LYS A 153 -2.887 -6.695 -8.313 1.00 0.00 O ATOM 1397 CB LYS A 153 -4.377 -3.871 -8.128 1.00 0.00 C ATOM 1398 CG LYS A 153 -5.166 -2.900 -7.264 1.00 0.00 C ATOM 1399 CD LYS A 153 -6.591 -2.739 -7.767 1.00 0.00 C ATOM 1400 CE LYS A 153 -7.533 -2.325 -6.647 1.00 0.00 C ATOM 1401 NZ LYS A 153 -8.768 -1.676 -7.171 1.00 0.00 N1+ ATOM 0 H LYS A 153 -2.512 -2.490 -7.250 1.00 0.00 H new ATOM 0 HA LYS A 153 -3.516 -4.954 -6.501 1.00 0.00 H new ATOM 0 HB2 LYS A 153 -4.039 -3.353 -9.026 1.00 0.00 H new ATOM 0 HB3 LYS A 153 -5.038 -4.675 -8.453 1.00 0.00 H new ATOM 0 HG2 LYS A 153 -5.181 -3.257 -6.234 1.00 0.00 H new ATOM 0 HG3 LYS A 153 -4.669 -1.930 -7.258 1.00 0.00 H new ATOM 0 HD2 LYS A 153 -6.616 -1.992 -8.560 1.00 0.00 H new ATOM 0 HD3 LYS A 153 -6.933 -3.678 -8.203 1.00 0.00 H new ATOM 0 HE2 LYS A 153 -7.805 -3.201 -6.059 1.00 0.00 H new ATOM 0 HE3 LYS A 153 -7.019 -1.638 -5.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 153 -9.384 -1.409 -6.376 1.00 0.00 H new ATOM 0 HZ2 LYS A 153 -8.511 -0.825 -7.711 1.00 0.00 H new ATOM 0 HZ3 LYS A 153 -9.273 -2.340 -7.792 1.00 0.00 H new ATOM 1415 N TYR A 154 -1.476 -5.091 -9.043 1.00 0.00 N ATOM 1416 CA TYR A 154 -0.718 -5.975 -9.925 1.00 0.00 C ATOM 1417 C TYR A 154 0.609 -6.356 -9.273 1.00 0.00 C ATOM 1418 O TYR A 154 1.557 -6.753 -9.950 1.00 0.00 O ATOM 1419 CB TYR A 154 -0.450 -5.292 -11.267 1.00 0.00 C ATOM 1420 CG TYR A 154 -1.696 -4.792 -11.961 1.00 0.00 C ATOM 1421 CD1 TYR A 154 -2.524 -5.663 -12.656 1.00 0.00 C ATOM 1422 CD2 TYR A 154 -2.041 -3.447 -11.923 1.00 0.00 C ATOM 1423 CE1 TYR A 154 -3.662 -5.208 -13.295 1.00 0.00 C ATOM 1424 CE2 TYR A 154 -3.176 -2.984 -12.558 1.00 0.00 C ATOM 1425 CZ TYR A 154 -3.984 -3.868 -13.243 1.00 0.00 C ATOM 1426 OH TYR A 154 -5.115 -3.411 -13.879 1.00 0.00 O ATOM 0 H TYR A 154 -1.152 -4.124 -9.043 1.00 0.00 H new ATOM 0 HA TYR A 154 -1.308 -6.875 -10.097 1.00 0.00 H new ATOM 0 HB2 TYR A 154 0.226 -4.452 -11.107 1.00 0.00 H new ATOM 0 HB3 TYR A 154 0.063 -5.994 -11.924 1.00 0.00 H new ATOM 0 HD1 TYR A 154 -2.275 -6.713 -12.698 1.00 0.00 H new ATOM 0 HD2 TYR A 154 -1.411 -2.752 -11.388 1.00 0.00 H new ATOM 0 HE1 TYR A 154 -4.296 -5.898 -13.832 1.00 0.00 H new ATOM 0 HE2 TYR A 154 -3.430 -1.935 -12.519 1.00 0.00 H new ATOM 0 HH TYR A 154 -5.782 -3.147 -13.211 1.00 0.00 H new ATOM 1436 N SER A 155 0.661 -6.231 -7.952 1.00 0.00 N ATOM 1437 CA SER A 155 1.850 -6.555 -7.183 1.00 0.00 C ATOM 1438 C SER A 155 1.586 -7.783 -6.337 1.00 0.00 C ATOM 1439 O SER A 155 0.967 -7.701 -5.276 1.00 0.00 O ATOM 1440 CB SER A 155 2.241 -5.379 -6.288 1.00 0.00 C ATOM 1441 OG SER A 155 2.619 -4.253 -7.060 1.00 0.00 O ATOM 0 H SER A 155 -0.122 -5.902 -7.387 1.00 0.00 H new ATOM 0 HA SER A 155 2.673 -6.757 -7.869 1.00 0.00 H new ATOM 0 HB2 SER A 155 1.404 -5.116 -5.642 1.00 0.00 H new ATOM 0 HB3 SER A 155 3.066 -5.671 -5.638 1.00 0.00 H new ATOM 0 HG SER A 155 3.009 -4.553 -7.907 1.00 0.00 H new ATOM 1447 N VAL A 156 2.038 -8.923 -6.822 1.00 0.00 N ATOM 1448 CA VAL A 156 1.832 -10.173 -6.123 1.00 0.00 C ATOM 1449 C VAL A 156 3.022 -10.522 -5.236 1.00 0.00 C ATOM 1450 O VAL A 156 3.058 -11.591 -4.624 1.00 0.00 O ATOM 1451 CB VAL A 156 1.553 -11.302 -7.124 1.00 0.00 C ATOM 1452 CG1 VAL A 156 2.800 -11.635 -7.931 1.00 0.00 C ATOM 1453 CG2 VAL A 156 1.015 -12.534 -6.411 1.00 0.00 C ATOM 0 H VAL A 156 2.551 -9.008 -7.699 1.00 0.00 H new ATOM 0 HA VAL A 156 0.964 -10.055 -5.474 1.00 0.00 H new ATOM 0 HB VAL A 156 0.789 -10.957 -7.821 1.00 0.00 H new ATOM 0 HG11 VAL A 156 2.575 -12.438 -8.633 1.00 0.00 H new ATOM 0 HG12 VAL A 156 3.124 -10.752 -8.482 1.00 0.00 H new ATOM 0 HG13 VAL A 156 3.595 -11.954 -7.257 1.00 0.00 H new ATOM 0 HG21 VAL A 156 0.824 -13.322 -7.140 1.00 0.00 H new ATOM 0 HG22 VAL A 156 1.748 -12.882 -5.683 1.00 0.00 H new ATOM 0 HG23 VAL A 156 0.087 -12.281 -5.898 1.00 0.00 H new ATOM 1463 N VAL A 157 3.985 -9.606 -5.148 1.00 0.00 N ATOM 1464 CA VAL A 157 5.153 -9.819 -4.311 1.00 0.00 C ATOM 1465 C VAL A 157 4.740 -9.801 -2.846 1.00 0.00 C ATOM 1466 O VAL A 157 5.230 -10.586 -2.034 1.00 0.00 O ATOM 1467 CB VAL A 157 6.230 -8.744 -4.552 1.00 0.00 C ATOM 1468 CG1 VAL A 157 7.475 -9.036 -3.728 1.00 0.00 C ATOM 1469 CG2 VAL A 157 6.571 -8.654 -6.032 1.00 0.00 C ATOM 0 H VAL A 157 3.975 -8.715 -5.645 1.00 0.00 H new ATOM 0 HA VAL A 157 5.579 -10.788 -4.571 1.00 0.00 H new ATOM 0 HB VAL A 157 5.832 -7.781 -4.233 1.00 0.00 H new ATOM 0 HG11 VAL A 157 8.223 -8.265 -3.913 1.00 0.00 H new ATOM 0 HG12 VAL A 157 7.217 -9.044 -2.669 1.00 0.00 H new ATOM 0 HG13 VAL A 157 7.879 -10.008 -4.011 1.00 0.00 H new ATOM 0 HG21 VAL A 157 7.333 -7.890 -6.184 1.00 0.00 H new ATOM 0 HG22 VAL A 157 6.948 -9.616 -6.378 1.00 0.00 H new ATOM 0 HG23 VAL A 157 5.676 -8.391 -6.596 1.00 0.00 H new ATOM 1479 N LEU A 158 3.810 -8.904 -2.527 1.00 0.00 N ATOM 1480 CA LEU A 158 3.287 -8.775 -1.177 1.00 0.00 C ATOM 1481 C LEU A 158 1.838 -9.242 -1.169 1.00 0.00 C ATOM 1482 O LEU A 158 1.226 -9.377 -2.228 1.00 0.00 O ATOM 1483 CB LEU A 158 3.359 -7.315 -0.703 1.00 0.00 C ATOM 1484 CG LEU A 158 4.763 -6.703 -0.589 1.00 0.00 C ATOM 1485 CD1 LEU A 158 5.488 -7.231 0.638 1.00 0.00 C ATOM 1486 CD2 LEU A 158 5.579 -6.964 -1.847 1.00 0.00 C ATOM 0 H LEU A 158 3.402 -8.251 -3.196 1.00 0.00 H new ATOM 0 HA LEU A 158 3.886 -9.385 -0.501 1.00 0.00 H new ATOM 0 HB2 LEU A 158 2.774 -6.703 -1.390 1.00 0.00 H new ATOM 0 HB3 LEU A 158 2.877 -7.248 0.272 1.00 0.00 H new ATOM 0 HG LEU A 158 4.647 -5.625 -0.479 1.00 0.00 H new ATOM 0 HD11 LEU A 158 6.480 -6.782 0.696 1.00 0.00 H new ATOM 0 HD12 LEU A 158 4.921 -6.976 1.533 1.00 0.00 H new ATOM 0 HD13 LEU A 158 5.584 -8.314 0.566 1.00 0.00 H new ATOM 0 HD21 LEU A 158 6.568 -6.519 -1.738 1.00 0.00 H new ATOM 0 HD22 LEU A 158 5.679 -8.039 -1.999 1.00 0.00 H new ATOM 0 HD23 LEU A 158 5.075 -6.521 -2.706 1.00 0.00 H new ATOM 1498 N GLU A 159 1.278 -9.477 0.010 1.00 0.00 N ATOM 1499 CA GLU A 159 -0.108 -9.910 0.093 1.00 0.00 C ATOM 1500 C GLU A 159 -1.005 -8.712 0.380 1.00 0.00 C ATOM 1501 O GLU A 159 -0.984 -8.157 1.470 1.00 0.00 O ATOM 1502 CB GLU A 159 -0.268 -10.989 1.173 1.00 0.00 C ATOM 1503 CG GLU A 159 -1.685 -11.127 1.709 1.00 0.00 C ATOM 1504 CD GLU A 159 -2.684 -11.493 0.628 1.00 0.00 C ATOM 1505 OE1 GLU A 159 -2.301 -12.221 -0.311 1.00 0.00 O ATOM 1506 OE2 GLU A 159 -3.849 -11.053 0.724 1.00 0.00 O1- ATOM 0 H GLU A 159 1.753 -9.377 0.907 1.00 0.00 H new ATOM 0 HA GLU A 159 -0.405 -10.345 -0.861 1.00 0.00 H new ATOM 0 HB2 GLU A 159 0.049 -11.948 0.763 1.00 0.00 H new ATOM 0 HB3 GLU A 159 0.402 -10.760 2.002 1.00 0.00 H new ATOM 0 HG2 GLU A 159 -1.702 -11.889 2.488 1.00 0.00 H new ATOM 0 HG3 GLU A 159 -1.986 -10.189 2.175 1.00 0.00 H new ATOM 1513 N LEU A 160 -1.788 -8.324 -0.614 1.00 0.00 N ATOM 1514 CA LEU A 160 -2.697 -7.191 -0.499 1.00 0.00 C ATOM 1515 C LEU A 160 -4.068 -7.654 -0.024 1.00 0.00 C ATOM 1516 O LEU A 160 -4.466 -8.782 -0.314 1.00 0.00 O ATOM 1517 CB LEU A 160 -2.878 -6.563 -1.881 1.00 0.00 C ATOM 1518 CG LEU A 160 -1.783 -5.626 -2.374 1.00 0.00 C ATOM 1519 CD1 LEU A 160 -2.308 -4.202 -2.505 1.00 0.00 C ATOM 1520 CD2 LEU A 160 -0.564 -5.700 -1.474 1.00 0.00 C ATOM 0 H LEU A 160 -1.812 -8.785 -1.524 1.00 0.00 H new ATOM 0 HA LEU A 160 -2.278 -6.480 0.213 1.00 0.00 H new ATOM 0 HB2 LEU A 160 -2.983 -7.370 -2.606 1.00 0.00 H new ATOM 0 HB3 LEU A 160 -3.818 -6.011 -1.880 1.00 0.00 H new ATOM 0 HG LEU A 160 -1.472 -5.950 -3.367 1.00 0.00 H new ATOM 0 HD11 LEU A 160 -1.509 -3.551 -2.858 1.00 0.00 H new ATOM 0 HD12 LEU A 160 -3.133 -4.183 -3.217 1.00 0.00 H new ATOM 0 HD13 LEU A 160 -2.658 -3.852 -1.534 1.00 0.00 H new ATOM 0 HD21 LEU A 160 0.205 -5.022 -1.846 1.00 0.00 H new ATOM 0 HD22 LEU A 160 -0.842 -5.412 -0.460 1.00 0.00 H new ATOM 0 HD23 LEU A 160 -0.177 -6.719 -1.468 1.00 0.00 H new ATOM 1532 N ASN A 161 -4.833 -6.779 0.635 1.00 0.00 N ATOM 1533 CA ASN A 161 -6.191 -7.181 1.023 1.00 0.00 C ATOM 1534 C ASN A 161 -6.917 -7.428 -0.269 1.00 0.00 C ATOM 1535 O ASN A 161 -6.508 -6.841 -1.267 1.00 0.00 O ATOM 1536 CB ASN A 161 -6.949 -6.115 1.831 1.00 0.00 C ATOM 1537 CG ASN A 161 -8.452 -6.333 1.829 1.00 0.00 C ATOM 1538 OD1 ASN A 161 -9.169 -5.787 0.992 1.00 0.00 O ATOM 1539 ND2 ASN A 161 -8.934 -7.135 2.772 1.00 0.00 N ATOM 0 H ASN A 161 -4.556 -5.834 0.901 1.00 0.00 H new ATOM 0 HA ASN A 161 -6.135 -8.054 1.674 1.00 0.00 H new ATOM 0 HB2 ASN A 161 -6.587 -6.120 2.859 1.00 0.00 H new ATOM 0 HB3 ASN A 161 -6.729 -5.130 1.420 1.00 0.00 H new ATOM 0 HD21 ASN A 161 -9.936 -7.319 2.822 1.00 0.00 H new ATOM 0 HD22 ASN A 161 -8.302 -7.567 3.446 1.00 0.00 H new ATOM 1546 N GLU A 162 -7.963 -8.271 -0.205 1.00 0.00 N ATOM 1547 CA GLU A 162 -8.785 -8.715 -1.340 1.00 0.00 C ATOM 1548 C GLU A 162 -9.034 -7.681 -2.426 1.00 0.00 C ATOM 1549 O GLU A 162 -8.775 -7.949 -3.599 1.00 0.00 O ATOM 1550 CB GLU A 162 -10.129 -9.195 -0.807 1.00 0.00 C ATOM 1551 CG GLU A 162 -10.906 -10.002 -1.819 1.00 0.00 C ATOM 1552 CD GLU A 162 -12.356 -9.569 -1.932 1.00 0.00 C ATOM 1553 OE1 GLU A 162 -12.616 -8.348 -1.875 1.00 0.00 O ATOM 1554 OE2 GLU A 162 -13.229 -10.449 -2.078 1.00 0.00 O1- ATOM 0 H GLU A 162 -8.270 -8.678 0.678 1.00 0.00 H new ATOM 0 HA GLU A 162 -8.209 -9.505 -1.822 1.00 0.00 H new ATOM 0 HB2 GLU A 162 -9.966 -9.800 0.085 1.00 0.00 H new ATOM 0 HB3 GLU A 162 -10.723 -8.333 -0.503 1.00 0.00 H new ATOM 0 HG2 GLU A 162 -10.428 -9.910 -2.794 1.00 0.00 H new ATOM 0 HG3 GLU A 162 -10.867 -11.056 -1.543 1.00 0.00 H new ATOM 1561 N ASP A 163 -9.502 -6.510 -2.063 1.00 0.00 N ATOM 1562 CA ASP A 163 -9.732 -5.470 -3.056 1.00 0.00 C ATOM 1563 C ASP A 163 -8.412 -4.776 -3.303 1.00 0.00 C ATOM 1564 O ASP A 163 -8.356 -3.586 -3.613 1.00 0.00 O ATOM 1565 CB ASP A 163 -10.782 -4.471 -2.568 1.00 0.00 C ATOM 1566 CG ASP A 163 -12.197 -4.983 -2.753 1.00 0.00 C ATOM 1567 OD1 ASP A 163 -12.537 -5.393 -3.882 1.00 0.00 O1- ATOM 1568 OD2 ASP A 163 -12.966 -4.973 -1.768 1.00 0.00 O ATOM 0 H ASP A 163 -9.730 -6.249 -1.104 1.00 0.00 H new ATOM 0 HA ASP A 163 -10.112 -5.909 -3.979 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -10.612 -4.255 -1.513 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -10.665 -3.532 -3.109 1.00 0.00 H new ATOM 1573 N HIS A 164 -7.344 -5.542 -3.084 1.00 0.00 N ATOM 1574 CA HIS A 164 -5.992 -5.061 -3.181 1.00 0.00 C ATOM 1575 C HIS A 164 -5.901 -3.694 -2.565 1.00 0.00 C ATOM 1576 O HIS A 164 -5.121 -2.836 -2.977 1.00 0.00 O ATOM 1577 CB HIS A 164 -5.472 -5.115 -4.606 1.00 0.00 C ATOM 1578 CG HIS A 164 -5.320 -6.529 -5.065 1.00 0.00 C ATOM 1579 ND1 HIS A 164 -5.014 -6.887 -6.360 1.00 0.00 N ATOM 1580 CD2 HIS A 164 -5.436 -7.690 -4.367 1.00 0.00 C ATOM 1581 CE1 HIS A 164 -4.948 -8.206 -6.444 1.00 0.00 C ATOM 1582 NE2 HIS A 164 -5.199 -8.715 -5.250 1.00 0.00 N ATOM 0 H HIS A 164 -7.409 -6.528 -2.831 1.00 0.00 H new ATOM 0 HA HIS A 164 -5.335 -5.722 -2.616 1.00 0.00 H new ATOM 0 HB2 HIS A 164 -6.157 -4.585 -5.268 1.00 0.00 H new ATOM 0 HB3 HIS A 164 -4.511 -4.604 -4.666 1.00 0.00 H new ATOM 0 HD2 HIS A 164 -5.670 -7.788 -3.317 1.00 0.00 H new ATOM 0 HE1 HIS A 164 -4.726 -8.771 -7.337 1.00 0.00 H new ATOM 0 HE2 HIS A 164 -5.214 -9.709 -5.021 1.00 0.00 H new ATOM 1591 N ARG A 165 -6.719 -3.532 -1.534 1.00 0.00 N ATOM 1592 CA ARG A 165 -6.772 -2.317 -0.786 1.00 0.00 C ATOM 1593 C ARG A 165 -5.787 -2.395 0.350 1.00 0.00 C ATOM 1594 O ARG A 165 -5.427 -1.365 0.921 1.00 0.00 O ATOM 1595 CB ARG A 165 -8.185 -2.070 -0.248 1.00 0.00 C ATOM 1596 CG ARG A 165 -9.187 -1.663 -1.319 1.00 0.00 C ATOM 1597 CD ARG A 165 -8.676 -0.497 -2.152 1.00 0.00 C ATOM 1598 NE ARG A 165 -9.698 0.531 -2.337 1.00 0.00 N ATOM 1599 CZ ARG A 165 -10.766 0.384 -3.117 1.00 0.00 C ATOM 1600 NH1 ARG A 165 -10.958 -0.747 -3.785 1.00 0.00 N1+ ATOM 1601 NH2 ARG A 165 -11.646 1.369 -3.227 1.00 0.00 N ATOM 0 H ARG A 165 -7.361 -4.253 -1.204 1.00 0.00 H new ATOM 0 HA ARG A 165 -6.513 -1.484 -1.439 1.00 0.00 H new ATOM 0 HB2 ARG A 165 -8.540 -2.976 0.243 1.00 0.00 H new ATOM 0 HB3 ARG A 165 -8.143 -1.290 0.512 1.00 0.00 H new ATOM 0 HG2 ARG A 165 -9.390 -2.514 -1.969 1.00 0.00 H new ATOM 0 HG3 ARG A 165 -10.131 -1.388 -0.849 1.00 0.00 H new ATOM 0 HD2 ARG A 165 -7.804 -0.059 -1.666 1.00 0.00 H new ATOM 0 HD3 ARG A 165 -8.349 -0.862 -3.125 1.00 0.00 H new ATOM 0 HE ARG A 165 -9.586 1.414 -1.839 1.00 0.00 H new ATOM 0 HH11 ARG A 165 -10.285 -1.509 -3.702 1.00 0.00 H new ATOM 0 HH12 ARG A 165 -11.779 -0.854 -4.381 1.00 0.00 H new ATOM 0 HH21 ARG A 165 -11.504 2.239 -2.714 1.00 0.00 H new ATOM 0 HH22 ARG A 165 -12.465 1.257 -3.825 1.00 0.00 H new ATOM 1615 N LYS A 166 -5.322 -3.611 0.690 1.00 0.00 N ATOM 1616 CA LYS A 166 -4.347 -3.687 1.792 1.00 0.00 C ATOM 1617 C LYS A 166 -3.018 -4.228 1.318 1.00 0.00 C ATOM 1618 O LYS A 166 -2.829 -4.504 0.137 1.00 0.00 O ATOM 1619 CB LYS A 166 -4.840 -4.545 2.963 1.00 0.00 C ATOM 1620 CG LYS A 166 -5.958 -3.926 3.805 1.00 0.00 C ATOM 1621 CD LYS A 166 -6.857 -2.993 3.008 1.00 0.00 C ATOM 1622 CE LYS A 166 -8.098 -2.610 3.799 1.00 0.00 C ATOM 1623 NZ LYS A 166 -9.133 -3.679 3.761 1.00 0.00 N1+ ATOM 0 H LYS A 166 -5.582 -4.496 0.254 1.00 0.00 H new ATOM 0 HA LYS A 166 -4.224 -2.663 2.144 1.00 0.00 H new ATOM 0 HB2 LYS A 166 -5.190 -5.499 2.570 1.00 0.00 H new ATOM 0 HB3 LYS A 166 -3.994 -4.760 3.615 1.00 0.00 H new ATOM 0 HG2 LYS A 166 -6.563 -4.723 4.237 1.00 0.00 H new ATOM 0 HG3 LYS A 166 -5.517 -3.375 4.635 1.00 0.00 H new ATOM 0 HD2 LYS A 166 -6.303 -2.094 2.739 1.00 0.00 H new ATOM 0 HD3 LYS A 166 -7.152 -3.477 2.077 1.00 0.00 H new ATOM 0 HE2 LYS A 166 -7.821 -2.410 4.834 1.00 0.00 H new ATOM 0 HE3 LYS A 166 -8.515 -1.687 3.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 166 -9.962 -3.379 4.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 166 -9.416 -3.853 2.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 166 -8.744 -4.553 4.169 1.00 0.00 H new ATOM 1637 N VAL A 167 -2.106 -4.386 2.260 1.00 0.00 N ATOM 1638 CA VAL A 167 -0.796 -4.910 1.964 1.00 0.00 C ATOM 1639 C VAL A 167 -0.176 -5.503 3.215 1.00 0.00 C ATOM 1640 O VAL A 167 0.535 -4.842 3.968 1.00 0.00 O ATOM 1641 CB VAL A 167 0.107 -3.833 1.334 1.00 0.00 C ATOM 1642 CG1 VAL A 167 -0.023 -2.507 2.077 1.00 0.00 C ATOM 1643 CG2 VAL A 167 1.562 -4.281 1.270 1.00 0.00 C ATOM 0 H VAL A 167 -2.256 -4.155 3.242 1.00 0.00 H new ATOM 0 HA VAL A 167 -0.898 -5.707 1.227 1.00 0.00 H new ATOM 0 HB VAL A 167 -0.233 -3.684 0.309 1.00 0.00 H new ATOM 0 HG11 VAL A 167 0.625 -1.764 1.612 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -1.057 -2.165 2.033 1.00 0.00 H new ATOM 0 HG13 VAL A 167 0.270 -2.643 3.118 1.00 0.00 H new ATOM 0 HG21 VAL A 167 2.166 -3.493 0.819 1.00 0.00 H new ATOM 0 HG22 VAL A 167 1.925 -4.485 2.278 1.00 0.00 H new ATOM 0 HG23 VAL A 167 1.638 -5.186 0.667 1.00 0.00 H new ATOM 1653 N ARG A 168 -0.477 -6.771 3.417 1.00 0.00 N ATOM 1654 CA ARG A 168 0.025 -7.516 4.566 1.00 0.00 C ATOM 1655 C ARG A 168 1.098 -8.510 4.132 1.00 0.00 C ATOM 1656 O ARG A 168 1.080 -8.999 3.004 1.00 0.00 O ATOM 1657 CB ARG A 168 -1.118 -8.258 5.258 1.00 0.00 C ATOM 1658 CG ARG A 168 -0.749 -8.806 6.628 1.00 0.00 C ATOM 1659 CD ARG A 168 -0.682 -10.325 6.623 1.00 0.00 C ATOM 1660 NE ARG A 168 0.178 -10.839 7.687 1.00 0.00 N ATOM 1661 CZ ARG A 168 0.356 -12.135 7.934 1.00 0.00 C ATOM 1662 NH1 ARG A 168 -0.262 -13.050 7.198 1.00 0.00 N1+ ATOM 1663 NH2 ARG A 168 1.156 -12.517 8.920 1.00 0.00 N ATOM 0 H ARG A 168 -1.074 -7.316 2.795 1.00 0.00 H new ATOM 0 HA ARG A 168 0.465 -6.807 5.267 1.00 0.00 H new ATOM 0 HB2 ARG A 168 -1.967 -7.583 5.363 1.00 0.00 H new ATOM 0 HB3 ARG A 168 -1.443 -9.082 4.622 1.00 0.00 H new ATOM 0 HG2 ARG A 168 0.214 -8.400 6.936 1.00 0.00 H new ATOM 0 HG3 ARG A 168 -1.484 -8.476 7.363 1.00 0.00 H new ATOM 0 HD2 ARG A 168 -1.686 -10.732 6.740 1.00 0.00 H new ATOM 0 HD3 ARG A 168 -0.309 -10.668 5.658 1.00 0.00 H new ATOM 0 HE ARG A 168 0.670 -10.166 8.274 1.00 0.00 H new ATOM 0 HH11 ARG A 168 -0.878 -12.762 6.438 1.00 0.00 H new ATOM 0 HH12 ARG A 168 -0.121 -14.041 7.393 1.00 0.00 H new ATOM 0 HH21 ARG A 168 1.634 -11.818 9.488 1.00 0.00 H new ATOM 0 HH22 ARG A 168 1.293 -13.510 9.110 1.00 0.00 H new ATOM 1677 N ARG A 169 2.031 -8.807 5.032 1.00 0.00 N ATOM 1678 CA ARG A 169 3.104 -9.749 4.729 1.00 0.00 C ATOM 1679 C ARG A 169 2.892 -11.069 5.461 1.00 0.00 C ATOM 1680 O ARG A 169 2.540 -11.089 6.640 1.00 0.00 O ATOM 1681 CB ARG A 169 4.463 -9.154 5.106 1.00 0.00 C ATOM 1682 CG ARG A 169 5.261 -8.664 3.908 1.00 0.00 C ATOM 1683 CD ARG A 169 6.392 -9.619 3.561 1.00 0.00 C ATOM 1684 NE ARG A 169 7.588 -8.912 3.113 1.00 0.00 N ATOM 1685 CZ ARG A 169 8.769 -9.497 2.921 1.00 0.00 C ATOM 1686 NH1 ARG A 169 8.914 -10.798 3.138 1.00 0.00 N1+ ATOM 1687 NH2 ARG A 169 9.806 -8.778 2.512 1.00 0.00 N ATOM 0 H ARG A 169 2.066 -8.412 5.972 1.00 0.00 H new ATOM 0 HA ARG A 169 3.088 -9.942 3.656 1.00 0.00 H new ATOM 0 HB2 ARG A 169 4.309 -8.323 5.795 1.00 0.00 H new ATOM 0 HB3 ARG A 169 5.046 -9.906 5.638 1.00 0.00 H new ATOM 0 HG2 ARG A 169 4.599 -8.555 3.049 1.00 0.00 H new ATOM 0 HG3 ARG A 169 5.670 -7.677 4.122 1.00 0.00 H new ATOM 0 HD2 ARG A 169 6.635 -10.225 4.434 1.00 0.00 H new ATOM 0 HD3 ARG A 169 6.062 -10.303 2.780 1.00 0.00 H new ATOM 0 HE ARG A 169 7.515 -7.910 2.936 1.00 0.00 H new ATOM 0 HH11 ARG A 169 8.119 -11.354 3.453 1.00 0.00 H new ATOM 0 HH12 ARG A 169 9.820 -11.242 2.990 1.00 0.00 H new ATOM 0 HH21 ARG A 169 9.699 -7.778 2.345 1.00 0.00 H new ATOM 0 HH22 ARG A 169 10.711 -9.226 2.365 1.00 0.00 H new ATOM 1701 N THR A 170 3.111 -12.172 4.754 1.00 0.00 N ATOM 1702 CA THR A 170 2.945 -13.498 5.334 1.00 0.00 C ATOM 1703 C THR A 170 4.298 -14.146 5.631 1.00 0.00 C ATOM 1704 O THR A 170 4.359 -15.242 6.189 1.00 0.00 O ATOM 1705 CB THR A 170 2.140 -14.392 4.389 1.00 0.00 C ATOM 1706 OG1 THR A 170 2.946 -14.837 3.313 1.00 0.00 O ATOM 1707 CG2 THR A 170 0.928 -13.702 3.801 1.00 0.00 C ATOM 0 H THR A 170 3.404 -12.173 3.777 1.00 0.00 H new ATOM 0 HA THR A 170 2.405 -13.386 6.274 1.00 0.00 H new ATOM 0 HB THR A 170 1.801 -15.228 5.000 1.00 0.00 H new ATOM 0 HG1 THR A 170 2.414 -15.409 2.721 1.00 0.00 H new ATOM 0 HG21 THR A 170 0.402 -14.391 3.140 1.00 0.00 H new ATOM 0 HG22 THR A 170 0.261 -13.390 4.605 1.00 0.00 H new ATOM 0 HG23 THR A 170 1.247 -12.828 3.234 1.00 0.00 H new ATOM 1715 N THR A 171 5.380 -13.466 5.257 1.00 0.00 N ATOM 1716 CA THR A 171 6.723 -13.988 5.485 1.00 0.00 C ATOM 1717 C THR A 171 7.713 -12.857 5.768 1.00 0.00 C ATOM 1718 O THR A 171 8.622 -12.605 4.976 1.00 0.00 O ATOM 1719 CB THR A 171 7.186 -14.796 4.273 1.00 0.00 C ATOM 1720 OG1 THR A 171 8.538 -15.192 4.421 1.00 0.00 O ATOM 1721 CG2 THR A 171 7.071 -14.034 2.970 1.00 0.00 C ATOM 0 H THR A 171 5.352 -12.556 4.797 1.00 0.00 H new ATOM 0 HA THR A 171 6.689 -14.638 6.359 1.00 0.00 H new ATOM 0 HB THR A 171 6.524 -15.661 4.231 1.00 0.00 H new ATOM 0 HG1 THR A 171 9.105 -14.397 4.500 1.00 0.00 H new ATOM 0 HG21 THR A 171 7.415 -14.663 2.149 1.00 0.00 H new ATOM 0 HG22 THR A 171 6.031 -13.755 2.802 1.00 0.00 H new ATOM 0 HG23 THR A 171 7.684 -13.134 3.019 1.00 0.00 H new ATOM 1729 N PRO A 172 7.553 -12.163 6.907 1.00 0.00 N ATOM 1730 CA PRO A 172 8.441 -11.061 7.291 1.00 0.00 C ATOM 1731 C PRO A 172 9.808 -11.562 7.746 1.00 0.00 C ATOM 1732 O PRO A 172 9.957 -12.725 8.121 1.00 0.00 O ATOM 1733 CB PRO A 172 7.698 -10.401 8.452 1.00 0.00 C ATOM 1734 CG PRO A 172 6.887 -11.496 9.052 1.00 0.00 C ATOM 1735 CD PRO A 172 6.497 -12.399 7.912 1.00 0.00 C ATOM 0 HA PRO A 172 8.645 -10.385 6.461 1.00 0.00 H new ATOM 0 HB2 PRO A 172 8.393 -9.979 9.178 1.00 0.00 H new ATOM 0 HB3 PRO A 172 7.065 -9.584 8.104 1.00 0.00 H new ATOM 0 HG2 PRO A 172 7.461 -12.040 9.802 1.00 0.00 H new ATOM 0 HG3 PRO A 172 6.005 -11.098 9.553 1.00 0.00 H new ATOM 0 HD2 PRO A 172 6.464 -13.444 8.221 1.00 0.00 H new ATOM 0 HD3 PRO A 172 5.510 -12.150 7.523 1.00 0.00 H new ATOM 1743 N VAL A 173 10.803 -10.680 7.714 1.00 0.00 N ATOM 1744 CA VAL A 173 12.150 -11.042 8.126 1.00 0.00 C ATOM 1745 C VAL A 173 12.571 -10.205 9.335 1.00 0.00 C ATOM 1746 O VAL A 173 12.177 -9.045 9.458 1.00 0.00 O ATOM 1747 CB VAL A 173 13.143 -10.850 6.963 1.00 0.00 C ATOM 1748 CG1 VAL A 173 13.058 -9.436 6.415 1.00 0.00 C ATOM 1749 CG2 VAL A 173 14.565 -11.187 7.388 1.00 0.00 C ATOM 0 H VAL A 173 10.700 -9.713 7.407 1.00 0.00 H new ATOM 0 HA VAL A 173 12.158 -12.095 8.409 1.00 0.00 H new ATOM 0 HB VAL A 173 12.866 -11.542 6.167 1.00 0.00 H new ATOM 0 HG11 VAL A 173 13.767 -9.320 5.595 1.00 0.00 H new ATOM 0 HG12 VAL A 173 12.048 -9.247 6.051 1.00 0.00 H new ATOM 0 HG13 VAL A 173 13.298 -8.725 7.205 1.00 0.00 H new ATOM 0 HG21 VAL A 173 15.241 -11.041 6.545 1.00 0.00 H new ATOM 0 HG22 VAL A 173 14.863 -10.535 8.209 1.00 0.00 H new ATOM 0 HG23 VAL A 173 14.611 -12.226 7.714 1.00 0.00 H new ATOM 1759 N PRO A 174 13.353 -10.786 10.263 1.00 0.00 N ATOM 1760 CA PRO A 174 13.784 -10.083 11.477 1.00 0.00 C ATOM 1761 C PRO A 174 14.508 -8.771 11.186 1.00 0.00 C ATOM 1762 O PRO A 174 15.317 -8.679 10.264 1.00 0.00 O ATOM 1763 CB PRO A 174 14.733 -11.078 12.149 1.00 0.00 C ATOM 1764 CG PRO A 174 14.302 -12.410 11.642 1.00 0.00 C ATOM 1765 CD PRO A 174 13.842 -12.179 10.232 1.00 0.00 C ATOM 0 HA PRO A 174 12.932 -9.796 12.093 1.00 0.00 H new ATOM 0 HB2 PRO A 174 15.772 -10.872 11.890 1.00 0.00 H new ATOM 0 HB3 PRO A 174 14.659 -11.024 13.235 1.00 0.00 H new ATOM 0 HG2 PRO A 174 15.124 -13.125 11.673 1.00 0.00 H new ATOM 0 HG3 PRO A 174 13.499 -12.820 12.254 1.00 0.00 H new ATOM 0 HD2 PRO A 174 14.655 -12.305 9.517 1.00 0.00 H new ATOM 0 HD3 PRO A 174 13.055 -12.876 9.945 1.00 0.00 H new ATOM 1773 N LEU A 175 14.202 -7.762 11.997 1.00 0.00 N ATOM 1774 CA LEU A 175 14.786 -6.456 11.880 1.00 0.00 C ATOM 1775 C LEU A 175 16.089 -6.397 12.664 1.00 0.00 C ATOM 1776 O LEU A 175 17.067 -5.790 12.232 1.00 0.00 O ATOM 1777 CB LEU A 175 13.822 -5.388 12.418 1.00 0.00 C ATOM 1778 CG LEU A 175 12.572 -5.862 13.169 1.00 0.00 C ATOM 1779 CD1 LEU A 175 11.642 -6.587 12.224 1.00 0.00 C ATOM 1780 CD2 LEU A 175 12.904 -6.724 14.387 1.00 0.00 C ATOM 0 H LEU A 175 13.530 -7.844 12.760 1.00 0.00 H new ATOM 0 HA LEU A 175 14.984 -6.260 10.826 1.00 0.00 H new ATOM 0 HB2 LEU A 175 14.385 -4.735 13.085 1.00 0.00 H new ATOM 0 HB3 LEU A 175 13.495 -4.778 11.576 1.00 0.00 H new ATOM 0 HG LEU A 175 12.068 -4.975 13.553 1.00 0.00 H new ATOM 0 HD11 LEU A 175 10.758 -6.919 12.768 1.00 0.00 H new ATOM 0 HD12 LEU A 175 11.343 -5.914 11.421 1.00 0.00 H new ATOM 0 HD13 LEU A 175 12.154 -7.451 11.801 1.00 0.00 H new ATOM 0 HD21 LEU A 175 11.981 -7.030 14.879 1.00 0.00 H new ATOM 0 HD22 LEU A 175 13.455 -7.608 14.068 1.00 0.00 H new ATOM 0 HD23 LEU A 175 13.513 -6.149 15.085 1.00 0.00 H new ATOM 1792 N PHE A 176 16.088 -7.057 13.812 1.00 0.00 N ATOM 1793 CA PHE A 176 17.262 -7.113 14.667 1.00 0.00 C ATOM 1794 C PHE A 176 17.337 -8.473 15.336 1.00 0.00 C ATOM 1795 O PHE A 176 16.624 -8.750 16.299 1.00 0.00 O ATOM 1796 CB PHE A 176 17.177 -6.019 15.741 1.00 0.00 C ATOM 1797 CG PHE A 176 15.788 -5.493 15.980 1.00 0.00 C ATOM 1798 CD1 PHE A 176 15.200 -4.612 15.089 1.00 0.00 C ATOM 1799 CD2 PHE A 176 15.070 -5.889 17.097 1.00 0.00 C ATOM 1800 CE1 PHE A 176 13.917 -4.138 15.306 1.00 0.00 C ATOM 1801 CE2 PHE A 176 13.790 -5.417 17.320 1.00 0.00 C ATOM 1802 CZ PHE A 176 13.212 -4.543 16.422 1.00 0.00 C ATOM 0 H PHE A 176 15.281 -7.564 14.174 1.00 0.00 H new ATOM 0 HA PHE A 176 18.154 -6.954 14.062 1.00 0.00 H new ATOM 0 HB2 PHE A 176 17.569 -6.415 16.678 1.00 0.00 H new ATOM 0 HB3 PHE A 176 17.822 -5.190 15.450 1.00 0.00 H new ATOM 0 HD1 PHE A 176 15.748 -4.291 14.215 1.00 0.00 H new ATOM 0 HD2 PHE A 176 15.516 -6.575 17.802 1.00 0.00 H new ATOM 0 HE1 PHE A 176 13.468 -3.452 14.603 1.00 0.00 H new ATOM 0 HE2 PHE A 176 13.243 -5.732 18.196 1.00 0.00 H new ATOM 0 HZ PHE A 176 12.210 -4.177 16.592 1.00 0.00 H new ATOM 1812 N PRO A 177 18.212 -9.336 14.823 1.00 0.00 N ATOM 1813 CA PRO A 177 18.421 -10.687 15.336 1.00 0.00 C ATOM 1814 C PRO A 177 19.230 -10.716 16.627 1.00 0.00 C ATOM 1815 O PRO A 177 18.920 -11.469 17.551 1.00 0.00 O ATOM 1816 CB PRO A 177 19.167 -11.379 14.180 1.00 0.00 C ATOM 1817 CG PRO A 177 19.014 -10.432 13.034 1.00 0.00 C ATOM 1818 CD PRO A 177 19.075 -9.093 13.669 1.00 0.00 C ATOM 0 HA PRO A 177 17.486 -11.177 15.609 1.00 0.00 H new ATOM 0 HB2 PRO A 177 20.216 -11.544 14.424 1.00 0.00 H new ATOM 0 HB3 PRO A 177 18.735 -12.354 13.953 1.00 0.00 H new ATOM 0 HG2 PRO A 177 19.808 -10.562 12.299 1.00 0.00 H new ATOM 0 HG3 PRO A 177 18.069 -10.585 12.513 1.00 0.00 H new ATOM 0 HD2 PRO A 177 20.088 -8.811 13.955 1.00 0.00 H new ATOM 0 HD3 PRO A 177 18.695 -8.304 13.020 1.00 0.00 H new ATOM 1826 N ASN A 178 20.286 -9.905 16.672 1.00 0.00 N ATOM 1827 CA ASN A 178 21.161 -9.855 17.843 1.00 0.00 C ATOM 1828 C ASN A 178 20.867 -8.649 18.721 1.00 0.00 C ATOM 1829 O ASN A 178 21.101 -8.673 19.929 1.00 0.00 O ATOM 1830 CB ASN A 178 22.626 -9.835 17.403 1.00 0.00 C ATOM 1831 CG ASN A 178 23.478 -10.816 18.183 1.00 0.00 C ATOM 1832 OD1 ASN A 178 23.112 -11.980 18.349 1.00 0.00 O ATOM 1833 ND2 ASN A 178 24.624 -10.350 18.668 1.00 0.00 N ATOM 0 H ASN A 178 20.556 -9.276 15.915 1.00 0.00 H new ATOM 0 HA ASN A 178 20.969 -10.750 18.435 1.00 0.00 H new ATOM 0 HB2 ASN A 178 22.686 -10.071 16.340 1.00 0.00 H new ATOM 0 HB3 ASN A 178 23.027 -8.829 17.530 1.00 0.00 H new ATOM 0 HD21 ASN A 178 25.239 -10.964 19.202 1.00 0.00 H new ATOM 0 HD22 ASN A 178 24.888 -9.378 18.507 1.00 0.00 H new ATOM 1840 N GLU A 179 20.372 -7.589 18.102 1.00 0.00 N ATOM 1841 CA GLU A 179 20.062 -6.362 18.819 1.00 0.00 C ATOM 1842 C GLU A 179 18.862 -6.544 19.737 1.00 0.00 C ATOM 1843 O GLU A 179 18.671 -5.790 20.691 1.00 0.00 O ATOM 1844 CB GLU A 179 19.811 -5.246 17.814 1.00 0.00 C ATOM 1845 CG GLU A 179 19.377 -3.931 18.444 1.00 0.00 C ATOM 1846 CD GLU A 179 19.517 -2.757 17.495 1.00 0.00 C ATOM 1847 OE1 GLU A 179 18.631 -2.583 16.633 1.00 0.00 O1- ATOM 1848 OE2 GLU A 179 20.512 -2.013 17.614 1.00 0.00 O ATOM 0 H GLU A 179 20.176 -7.554 17.102 1.00 0.00 H new ATOM 0 HA GLU A 179 20.911 -6.098 19.449 1.00 0.00 H new ATOM 0 HB2 GLU A 179 20.721 -5.078 17.238 1.00 0.00 H new ATOM 0 HB3 GLU A 179 19.044 -5.570 17.111 1.00 0.00 H new ATOM 0 HG2 GLU A 179 18.339 -4.012 18.766 1.00 0.00 H new ATOM 0 HG3 GLU A 179 19.974 -3.745 19.337 1.00 0.00 H new ATOM 1855 N ASN A 180 18.065 -7.554 19.443 1.00 0.00 N ATOM 1856 CA ASN A 180 16.880 -7.858 20.237 1.00 0.00 C ATOM 1857 C ASN A 180 16.192 -9.121 19.727 1.00 0.00 C ATOM 1858 O ASN A 180 15.752 -9.180 18.578 1.00 0.00 O ATOM 1859 CB ASN A 180 15.905 -6.679 20.214 1.00 0.00 C ATOM 1860 CG ASN A 180 15.510 -6.228 21.607 1.00 0.00 C ATOM 1861 OD1 ASN A 180 15.298 -7.048 22.501 1.00 0.00 O ATOM 1862 ND2 ASN A 180 15.410 -4.917 21.799 1.00 0.00 N ATOM 0 H ASN A 180 18.215 -8.184 18.655 1.00 0.00 H new ATOM 0 HA ASN A 180 17.197 -8.032 21.265 1.00 0.00 H new ATOM 0 HB2 ASN A 180 16.361 -5.845 19.681 1.00 0.00 H new ATOM 0 HB3 ASN A 180 15.010 -6.962 19.659 1.00 0.00 H new ATOM 0 HD21 ASN A 180 15.149 -4.554 22.716 1.00 0.00 H new ATOM 0 HD22 ASN A 180 15.595 -4.273 21.030 1.00 0.00 H new ATOM 1869 N LEU A 181 16.104 -10.130 20.589 1.00 0.00 N ATOM 1870 CA LEU A 181 15.471 -11.394 20.227 1.00 0.00 C ATOM 1871 C LEU A 181 14.053 -11.170 19.702 1.00 0.00 C ATOM 1872 O LEU A 181 13.182 -10.697 20.432 1.00 0.00 O ATOM 1873 CB LEU A 181 15.433 -12.330 21.438 1.00 0.00 C ATOM 1874 CG LEU A 181 15.259 -13.812 21.105 1.00 0.00 C ATOM 1875 CD1 LEU A 181 15.973 -14.678 22.131 1.00 0.00 C ATOM 1876 CD2 LEU A 181 13.782 -14.173 21.037 1.00 0.00 C ATOM 0 H LEU A 181 16.463 -10.097 21.543 1.00 0.00 H new ATOM 0 HA LEU A 181 16.062 -11.852 19.434 1.00 0.00 H new ATOM 0 HB2 LEU A 181 16.357 -12.206 22.003 1.00 0.00 H new ATOM 0 HB3 LEU A 181 14.616 -12.022 22.091 1.00 0.00 H new ATOM 0 HG LEU A 181 15.705 -13.999 20.128 1.00 0.00 H new ATOM 0 HD11 LEU A 181 15.838 -15.729 21.877 1.00 0.00 H new ATOM 0 HD12 LEU A 181 17.036 -14.439 22.132 1.00 0.00 H new ATOM 0 HD13 LEU A 181 15.557 -14.487 23.120 1.00 0.00 H new ATOM 0 HD21 LEU A 181 13.677 -15.231 20.799 1.00 0.00 H new ATOM 0 HD22 LEU A 181 13.313 -13.969 22.000 1.00 0.00 H new ATOM 0 HD23 LEU A 181 13.297 -13.577 20.264 1.00 0.00 H new ATOM 1888 N PRO A 182 13.799 -11.506 18.422 1.00 0.00 N ATOM 1889 CA PRO A 182 12.475 -11.334 17.811 1.00 0.00 C ATOM 1890 C PRO A 182 11.379 -12.047 18.596 1.00 0.00 C ATOM 1891 O PRO A 182 11.593 -12.474 19.731 1.00 0.00 O ATOM 1892 CB PRO A 182 12.633 -11.966 16.424 1.00 0.00 C ATOM 1893 CG PRO A 182 14.095 -11.915 16.144 1.00 0.00 C ATOM 1894 CD PRO A 182 14.774 -12.076 17.475 1.00 0.00 C ATOM 0 HA PRO A 182 12.174 -10.287 17.784 1.00 0.00 H new ATOM 0 HB2 PRO A 182 12.264 -12.992 16.413 1.00 0.00 H new ATOM 0 HB3 PRO A 182 12.067 -11.416 15.672 1.00 0.00 H new ATOM 0 HG2 PRO A 182 14.389 -12.708 15.457 1.00 0.00 H new ATOM 0 HG3 PRO A 182 14.371 -10.970 15.676 1.00 0.00 H new ATOM 0 HD2 PRO A 182 14.985 -13.122 17.695 1.00 0.00 H new ATOM 0 HD3 PRO A 182 15.725 -11.545 17.508 1.00 0.00 H new ATOM 1902 N SER A 183 10.202 -12.164 17.984 1.00 0.00 N ATOM 1903 CA SER A 183 9.060 -12.815 18.613 1.00 0.00 C ATOM 1904 C SER A 183 9.472 -14.087 19.351 1.00 0.00 C ATOM 1905 O SER A 183 9.457 -14.078 20.600 1.00 0.00 O ATOM 1906 CB SER A 183 7.998 -13.145 17.564 1.00 0.00 C ATOM 1907 OG SER A 183 6.916 -13.856 18.139 1.00 0.00 O ATOM 1908 OXT SER A 183 9.806 -15.081 18.673 1.00 0.00 O ATOM 0 H SER A 183 10.016 -11.812 17.045 1.00 0.00 H new ATOM 0 HA SER A 183 8.646 -12.121 19.345 1.00 0.00 H new ATOM 0 HB2 SER A 183 7.632 -12.224 17.111 1.00 0.00 H new ATOM 0 HB3 SER A 183 8.443 -13.738 16.765 1.00 0.00 H new ATOM 0 HG SER A 183 6.250 -14.053 17.448 1.00 0.00 H new TER 1914 SER A 183