USER MOD reduce.3.24.130724 H: found=0, std=0, add=1109, rem=0, adj=37 USER MOD reduce.3.24.130724 removed 1107 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 84 THR OG1 : rot 180:sc= -0.206 USER MOD Set 1.2: A 87 GLN : amide:sc=-0.000869 X(o=-0.21,f=-0.38) USER MOD Set 2.1: A 71 THR OG1 : rot -130:sc=-0.00473 USER MOD Set 2.2: A 110 MET CE :methyl 176:sc= -11.1! (180deg=-11.3!) USER MOD Set 3.1: A 16 THR OG1 : rot 180:sc= -0.0276 USER MOD Set 3.2: A 39 GLN : amide:sc= -3.47! C(o=-3.5!,f=-4.5!) USER MOD Single : A 1 GLY N :NH3+ -139:sc= 0.0043 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.167 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0.833 K(o=0.83,f=-5!) USER MOD Single : A 11 SER OG : rot 53:sc= 1 USER MOD Single : A 15 MET CE :methyl 174:sc= -1.5 (180deg=-1.56!) USER MOD Single : A 18 GLN : amide:sc= 0 X(o=0,f=-0.065) USER MOD Single : A 21 CYS SG : rot 16:sc= 0.492 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0.172 USER MOD Single : A 33 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ -144:sc= 0 (180deg=-0.0212) USER MOD Single : A 43 MET CE :methyl 166:sc= -7.51! (180deg=-7.9!) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 CYS SG : rot 180:sc= 0 USER MOD Single : A 55 GLN : amide:sc= 0 K(o=0,f=-0.97) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 ASN : amide:sc= 0.454 K(o=0.45,f=-6.3!) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= -1.56! X(o=-1.6!,f=-1.1) USER MOD Single : A 70 GLN : amide:sc= -0.307 X(o=-0.31,f=-0.31) USER MOD Single : A 75 HIS : no HE2:sc= -2.68! X(o=-2.7!,f=-2.2) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -26:sc= 0.299 USER MOD Single : A 89 TYR OH : rot -12:sc= -0.384 USER MOD Single : A 90 GLN : amide:sc= -0.262 X(o=-0.26,f=-0.26) USER MOD Single : A 94 GLN :FLIP amide:sc= -0.403 F(o=-1,f=-0.4) USER MOD Single : A 97 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0184) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 134 LYS NZ :NH3+ -165:sc= -0.0289 (180deg=-0.273) USER MOD Single : A 135 THR OG1 : rot 180:sc= 0 USER MOD Single : A 136 GLN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 142 SER OG : rot -80:sc= 0.165 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 16.899 -7.205 3.482 1.00 0.00 N ATOM 2 CA GLY A 1 16.701 -5.846 3.010 1.00 0.00 C ATOM 3 C GLY A 1 18.005 -5.165 2.643 1.00 0.00 C ATOM 4 O GLY A 1 18.881 -5.774 2.030 1.00 0.00 O ATOM 0 H1 GLY A 1 16.160 -7.821 3.087 1.00 0.00 H new ATOM 0 H2 GLY A 1 17.833 -7.546 3.178 1.00 0.00 H new ATOM 0 H3 GLY A 1 16.845 -7.223 4.520 1.00 0.00 H new ATOM 0 HA2 GLY A 1 16.044 -5.859 2.141 1.00 0.00 H new ATOM 0 HA3 GLY A 1 16.196 -5.266 3.783 1.00 0.00 H new ATOM 8 N SER A 2 18.134 -3.896 3.018 1.00 0.00 N ATOM 9 CA SER A 2 19.338 -3.129 2.721 1.00 0.00 C ATOM 10 C SER A 2 20.547 -3.713 3.445 1.00 0.00 C ATOM 11 O SER A 2 20.767 -3.445 4.625 1.00 0.00 O ATOM 12 CB SER A 2 19.147 -1.665 3.122 1.00 0.00 C ATOM 13 OG SER A 2 18.223 -1.018 2.266 1.00 0.00 O ATOM 0 H SER A 2 17.419 -3.377 3.528 1.00 0.00 H new ATOM 0 HA SER A 2 19.518 -3.184 1.647 1.00 0.00 H new ATOM 0 HB2 SER A 2 18.794 -1.610 4.152 1.00 0.00 H new ATOM 0 HB3 SER A 2 20.105 -1.147 3.086 1.00 0.00 H new ATOM 0 HG SER A 2 18.117 -0.084 2.545 1.00 0.00 H new ATOM 19 N SER A 3 21.328 -4.515 2.726 1.00 0.00 N ATOM 20 CA SER A 3 22.514 -5.141 3.301 1.00 0.00 C ATOM 21 C SER A 3 23.560 -5.410 2.224 1.00 0.00 C ATOM 22 O SER A 3 23.284 -5.296 1.030 1.00 0.00 O ATOM 23 CB SER A 3 22.137 -6.449 3.999 1.00 0.00 C ATOM 24 OG SER A 3 23.058 -6.759 5.031 1.00 0.00 O ATOM 0 H SER A 3 21.161 -4.746 1.747 1.00 0.00 H new ATOM 0 HA SER A 3 22.939 -4.455 4.034 1.00 0.00 H new ATOM 0 HB2 SER A 3 21.133 -6.367 4.416 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.115 -7.260 3.271 1.00 0.00 H new ATOM 0 HG SER A 3 22.795 -7.598 5.463 1.00 0.00 H new ATOM 30 N GLY A 4 24.766 -5.766 2.656 1.00 0.00 N ATOM 31 CA GLY A 4 25.837 -6.045 1.718 1.00 0.00 C ATOM 32 C GLY A 4 26.449 -7.417 1.926 1.00 0.00 C ATOM 33 O GLY A 4 26.470 -7.930 3.044 1.00 0.00 O ATOM 0 H GLY A 4 25.020 -5.866 3.639 1.00 0.00 H new ATOM 0 HA2 GLY A 4 25.452 -5.973 0.701 1.00 0.00 H new ATOM 0 HA3 GLY A 4 26.612 -5.286 1.820 1.00 0.00 H new ATOM 37 N SER A 5 26.945 -8.013 0.846 1.00 0.00 N ATOM 38 CA SER A 5 27.553 -9.336 0.914 1.00 0.00 C ATOM 39 C SER A 5 28.508 -9.556 -0.255 1.00 0.00 C ATOM 40 O SER A 5 28.079 -9.773 -1.388 1.00 0.00 O ATOM 41 CB SER A 5 26.473 -10.419 0.917 1.00 0.00 C ATOM 42 OG SER A 5 25.645 -10.311 2.062 1.00 0.00 O ATOM 0 H SER A 5 26.937 -7.600 -0.087 1.00 0.00 H new ATOM 0 HA SER A 5 28.122 -9.399 1.842 1.00 0.00 H new ATOM 0 HB2 SER A 5 25.866 -10.334 0.016 1.00 0.00 H new ATOM 0 HB3 SER A 5 26.941 -11.403 0.894 1.00 0.00 H new ATOM 0 HG SER A 5 24.962 -11.013 2.039 1.00 0.00 H new ATOM 48 N SER A 6 29.806 -9.497 0.029 1.00 0.00 N ATOM 49 CA SER A 6 30.822 -9.686 -0.999 1.00 0.00 C ATOM 50 C SER A 6 31.229 -11.154 -1.098 1.00 0.00 C ATOM 51 O SER A 6 31.428 -11.823 -0.086 1.00 0.00 O ATOM 52 CB SER A 6 32.049 -8.824 -0.697 1.00 0.00 C ATOM 53 OG SER A 6 31.762 -7.448 -0.875 1.00 0.00 O ATOM 0 H SER A 6 30.178 -9.320 0.962 1.00 0.00 H new ATOM 0 HA SER A 6 30.398 -9.380 -1.955 1.00 0.00 H new ATOM 0 HB2 SER A 6 32.378 -9.001 0.327 1.00 0.00 H new ATOM 0 HB3 SER A 6 32.871 -9.115 -1.351 1.00 0.00 H new ATOM 0 HG SER A 6 32.562 -6.918 -0.674 1.00 0.00 H new ATOM 59 N GLY A 7 31.349 -11.647 -2.327 1.00 0.00 N ATOM 60 CA GLY A 7 31.731 -13.030 -2.537 1.00 0.00 C ATOM 61 C GLY A 7 30.783 -13.758 -3.471 1.00 0.00 C ATOM 62 O GLY A 7 29.566 -13.617 -3.362 1.00 0.00 O ATOM 0 H GLY A 7 31.188 -11.113 -3.181 1.00 0.00 H new ATOM 0 HA2 GLY A 7 32.740 -13.067 -2.947 1.00 0.00 H new ATOM 0 HA3 GLY A 7 31.758 -13.546 -1.577 1.00 0.00 H new ATOM 66 N GLN A 8 31.343 -14.538 -4.390 1.00 0.00 N ATOM 67 CA GLN A 8 30.540 -15.288 -5.348 1.00 0.00 C ATOM 68 C GLN A 8 30.113 -16.631 -4.765 1.00 0.00 C ATOM 69 O GLN A 8 30.048 -17.635 -5.477 1.00 0.00 O ATOM 70 CB GLN A 8 31.322 -15.505 -6.643 1.00 0.00 C ATOM 71 CG GLN A 8 32.504 -16.449 -6.489 1.00 0.00 C ATOM 72 CD GLN A 8 33.782 -15.728 -6.108 1.00 0.00 C ATOM 73 OE1 GLN A 8 33.934 -15.265 -4.977 1.00 0.00 O ATOM 74 NE2 GLN A 8 34.710 -15.628 -7.054 1.00 0.00 N ATOM 0 H GLN A 8 32.350 -14.667 -4.491 1.00 0.00 H new ATOM 0 HA GLN A 8 29.645 -14.707 -5.568 1.00 0.00 H new ATOM 0 HB2 GLN A 8 30.648 -15.901 -7.403 1.00 0.00 H new ATOM 0 HB3 GLN A 8 31.681 -14.542 -7.006 1.00 0.00 H new ATOM 0 HG2 GLN A 8 32.272 -17.195 -5.729 1.00 0.00 H new ATOM 0 HG3 GLN A 8 32.660 -16.986 -7.425 1.00 0.00 H new ATOM 0 HE21 GLN A 8 34.542 -16.027 -7.978 1.00 0.00 H new ATOM 0 HE22 GLN A 8 35.591 -15.153 -6.856 1.00 0.00 H new ATOM 83 N ARG A 9 29.824 -16.644 -3.468 1.00 0.00 N ATOM 84 CA ARG A 9 29.405 -17.865 -2.791 1.00 0.00 C ATOM 85 C ARG A 9 27.970 -17.742 -2.285 1.00 0.00 C ATOM 86 O ARG A 9 27.706 -17.045 -1.306 1.00 0.00 O ATOM 87 CB ARG A 9 30.344 -18.173 -1.622 1.00 0.00 C ATOM 88 CG ARG A 9 29.829 -19.265 -0.699 1.00 0.00 C ATOM 89 CD ARG A 9 29.042 -18.685 0.465 1.00 0.00 C ATOM 90 NE ARG A 9 29.151 -19.510 1.665 1.00 0.00 N ATOM 91 CZ ARG A 9 28.467 -20.633 1.850 1.00 0.00 C ATOM 92 NH1 ARG A 9 27.628 -21.063 0.918 1.00 0.00 N ATOM 93 NH2 ARG A 9 28.621 -21.329 2.970 1.00 0.00 N ATOM 0 H ARG A 9 29.872 -15.823 -2.865 1.00 0.00 H new ATOM 0 HA ARG A 9 29.450 -18.683 -3.510 1.00 0.00 H new ATOM 0 HB2 ARG A 9 31.316 -18.470 -2.016 1.00 0.00 H new ATOM 0 HB3 ARG A 9 30.500 -17.263 -1.043 1.00 0.00 H new ATOM 0 HG2 ARG A 9 29.196 -19.950 -1.262 1.00 0.00 H new ATOM 0 HG3 ARG A 9 30.668 -19.847 -0.318 1.00 0.00 H new ATOM 0 HD2 ARG A 9 29.404 -17.680 0.682 1.00 0.00 H new ATOM 0 HD3 ARG A 9 27.993 -18.592 0.183 1.00 0.00 H new ATOM 0 HE ARG A 9 29.788 -19.207 2.402 1.00 0.00 H new ATOM 0 HH11 ARG A 9 27.507 -20.531 0.056 1.00 0.00 H new ATOM 0 HH12 ARG A 9 27.104 -21.926 1.063 1.00 0.00 H new ATOM 0 HH21 ARG A 9 29.265 -21.001 3.690 1.00 0.00 H new ATOM 0 HH22 ARG A 9 28.095 -22.191 3.111 1.00 0.00 H new ATOM 107 N ILE A 10 27.051 -18.422 -2.960 1.00 0.00 N ATOM 108 CA ILE A 10 25.644 -18.389 -2.579 1.00 0.00 C ATOM 109 C ILE A 10 25.474 -18.628 -1.084 1.00 0.00 C ATOM 110 O ILE A 10 26.091 -19.528 -0.514 1.00 0.00 O ATOM 111 CB ILE A 10 24.826 -19.441 -3.352 1.00 0.00 C ATOM 112 CG1 ILE A 10 23.342 -19.326 -2.998 1.00 0.00 C ATOM 113 CG2 ILE A 10 25.342 -20.839 -3.049 1.00 0.00 C ATOM 114 CD1 ILE A 10 22.442 -20.148 -3.893 1.00 0.00 C ATOM 0 H ILE A 10 27.254 -19.003 -3.774 1.00 0.00 H new ATOM 0 HA ILE A 10 25.273 -17.396 -2.830 1.00 0.00 H new ATOM 0 HB ILE A 10 24.940 -19.256 -4.420 1.00 0.00 H new ATOM 0 HG12 ILE A 10 23.198 -19.640 -1.964 1.00 0.00 H new ATOM 0 HG13 ILE A 10 23.043 -18.280 -3.058 1.00 0.00 H new ATOM 0 HG21 ILE A 10 24.754 -21.572 -3.602 1.00 0.00 H new ATOM 0 HG22 ILE A 10 26.388 -20.913 -3.347 1.00 0.00 H new ATOM 0 HG23 ILE A 10 25.254 -21.036 -1.980 1.00 0.00 H new ATOM 0 HD11 ILE A 10 21.405 -20.018 -3.584 1.00 0.00 H new ATOM 0 HD12 ILE A 10 22.557 -19.819 -4.926 1.00 0.00 H new ATOM 0 HD13 ILE A 10 22.715 -21.200 -3.815 1.00 0.00 H new ATOM 126 N SER A 11 24.632 -17.816 -0.452 1.00 0.00 N ATOM 127 CA SER A 11 24.382 -17.938 0.979 1.00 0.00 C ATOM 128 C SER A 11 23.131 -18.771 1.243 1.00 0.00 C ATOM 129 O SER A 11 22.007 -18.293 1.085 1.00 0.00 O ATOM 130 CB SER A 11 24.228 -16.553 1.611 1.00 0.00 C ATOM 131 OG SER A 11 23.006 -15.949 1.227 1.00 0.00 O ATOM 0 H SER A 11 24.112 -17.067 -0.909 1.00 0.00 H new ATOM 0 HA SER A 11 25.236 -18.443 1.430 1.00 0.00 H new ATOM 0 HB2 SER A 11 24.269 -16.639 2.697 1.00 0.00 H new ATOM 0 HB3 SER A 11 25.061 -15.918 1.310 1.00 0.00 H new ATOM 0 HG SER A 11 22.265 -16.563 1.412 1.00 0.00 H new ATOM 137 N LEU A 12 23.335 -20.020 1.647 1.00 0.00 N ATOM 138 CA LEU A 12 22.224 -20.922 1.935 1.00 0.00 C ATOM 139 C LEU A 12 21.473 -20.479 3.186 1.00 0.00 C ATOM 140 O LEU A 12 20.275 -20.726 3.321 1.00 0.00 O ATOM 141 CB LEU A 12 22.736 -22.352 2.111 1.00 0.00 C ATOM 142 CG LEU A 12 23.465 -22.647 3.422 1.00 0.00 C ATOM 143 CD1 LEU A 12 22.484 -23.110 4.487 1.00 0.00 C ATOM 144 CD2 LEU A 12 24.552 -23.690 3.205 1.00 0.00 C ATOM 0 H LEU A 12 24.258 -20.431 1.783 1.00 0.00 H new ATOM 0 HA LEU A 12 21.534 -20.891 1.091 1.00 0.00 H new ATOM 0 HB2 LEU A 12 21.889 -23.033 2.029 1.00 0.00 H new ATOM 0 HB3 LEU A 12 23.409 -22.580 1.285 1.00 0.00 H new ATOM 0 HG LEU A 12 23.936 -21.727 3.768 1.00 0.00 H new ATOM 0 HD11 LEU A 12 23.022 -23.315 5.413 1.00 0.00 H new ATOM 0 HD12 LEU A 12 21.743 -22.330 4.663 1.00 0.00 H new ATOM 0 HD13 LEU A 12 21.983 -24.017 4.150 1.00 0.00 H new ATOM 0 HD21 LEU A 12 25.060 -23.887 4.149 1.00 0.00 H new ATOM 0 HD22 LEU A 12 24.103 -24.612 2.835 1.00 0.00 H new ATOM 0 HD23 LEU A 12 25.272 -23.319 2.476 1.00 0.00 H new ATOM 156 N GLU A 13 22.185 -19.824 4.096 1.00 0.00 N ATOM 157 CA GLU A 13 21.584 -19.346 5.337 1.00 0.00 C ATOM 158 C GLU A 13 20.211 -18.734 5.075 1.00 0.00 C ATOM 159 O GLU A 13 19.972 -18.147 4.020 1.00 0.00 O ATOM 160 CB GLU A 13 22.495 -18.314 6.006 1.00 0.00 C ATOM 161 CG GLU A 13 21.882 -17.672 7.239 1.00 0.00 C ATOM 162 CD GLU A 13 22.013 -18.540 8.476 1.00 0.00 C ATOM 163 OE1 GLU A 13 23.114 -18.569 9.065 1.00 0.00 O ATOM 164 OE2 GLU A 13 21.016 -19.189 8.854 1.00 0.00 O ATOM 0 H GLU A 13 23.178 -19.612 3.999 1.00 0.00 H new ATOM 0 HA GLU A 13 21.462 -20.199 6.004 1.00 0.00 H new ATOM 0 HB2 GLU A 13 23.432 -18.795 6.285 1.00 0.00 H new ATOM 0 HB3 GLU A 13 22.739 -17.535 5.284 1.00 0.00 H new ATOM 0 HG2 GLU A 13 22.364 -16.711 7.421 1.00 0.00 H new ATOM 0 HG3 GLU A 13 20.827 -17.469 7.052 1.00 0.00 H new ATOM 171 N ILE A 14 19.312 -18.878 6.044 1.00 0.00 N ATOM 172 CA ILE A 14 17.963 -18.340 5.919 1.00 0.00 C ATOM 173 C ILE A 14 17.993 -16.858 5.561 1.00 0.00 C ATOM 174 O ILE A 14 18.820 -16.102 6.072 1.00 0.00 O ATOM 175 CB ILE A 14 17.160 -18.526 7.220 1.00 0.00 C ATOM 176 CG1 ILE A 14 17.127 -20.004 7.617 1.00 0.00 C ATOM 177 CG2 ILE A 14 15.748 -17.986 7.053 1.00 0.00 C ATOM 178 CD1 ILE A 14 16.901 -20.226 9.096 1.00 0.00 C ATOM 0 H ILE A 14 19.494 -19.362 6.923 1.00 0.00 H new ATOM 0 HA ILE A 14 17.475 -18.895 5.118 1.00 0.00 H new ATOM 0 HB ILE A 14 17.651 -17.965 8.016 1.00 0.00 H new ATOM 0 HG12 ILE A 14 16.337 -20.505 7.058 1.00 0.00 H new ATOM 0 HG13 ILE A 14 18.068 -20.471 7.327 1.00 0.00 H new ATOM 0 HG21 ILE A 14 15.193 -18.125 7.981 1.00 0.00 H new ATOM 0 HG22 ILE A 14 15.791 -16.924 6.811 1.00 0.00 H new ATOM 0 HG23 ILE A 14 15.247 -18.522 6.247 1.00 0.00 H new ATOM 0 HD11 ILE A 14 16.889 -21.296 9.306 1.00 0.00 H new ATOM 0 HD12 ILE A 14 17.704 -19.754 9.662 1.00 0.00 H new ATOM 0 HD13 ILE A 14 15.946 -19.788 9.388 1.00 0.00 H new ATOM 190 N MET A 15 17.086 -16.449 4.681 1.00 0.00 N ATOM 191 CA MET A 15 17.006 -15.055 4.257 1.00 0.00 C ATOM 192 C MET A 15 15.603 -14.500 4.478 1.00 0.00 C ATOM 193 O MET A 15 14.607 -15.180 4.229 1.00 0.00 O ATOM 194 CB MET A 15 17.393 -14.926 2.783 1.00 0.00 C ATOM 195 CG MET A 15 16.335 -15.454 1.828 1.00 0.00 C ATOM 196 SD MET A 15 16.730 -15.124 0.100 1.00 0.00 S ATOM 197 CE MET A 15 16.397 -16.723 -0.635 1.00 0.00 C ATOM 0 H MET A 15 16.396 -17.062 4.247 1.00 0.00 H new ATOM 0 HA MET A 15 17.705 -14.476 4.860 1.00 0.00 H new ATOM 0 HB2 MET A 15 17.584 -13.877 2.557 1.00 0.00 H new ATOM 0 HB3 MET A 15 18.326 -15.464 2.612 1.00 0.00 H new ATOM 0 HG2 MET A 15 16.225 -16.529 1.972 1.00 0.00 H new ATOM 0 HG3 MET A 15 15.374 -15.000 2.070 1.00 0.00 H new ATOM 0 HE1 MET A 15 16.492 -16.652 -1.719 1.00 0.00 H new ATOM 0 HE2 MET A 15 17.111 -17.454 -0.255 1.00 0.00 H new ATOM 0 HE3 MET A 15 15.385 -17.037 -0.379 1.00 0.00 H new ATOM 207 N THR A 16 15.531 -13.257 4.946 1.00 0.00 N ATOM 208 CA THR A 16 14.250 -12.610 5.201 1.00 0.00 C ATOM 209 C THR A 16 13.878 -11.661 4.068 1.00 0.00 C ATOM 210 O THR A 16 14.429 -10.565 3.956 1.00 0.00 O ATOM 211 CB THR A 16 14.271 -11.826 6.526 1.00 0.00 C ATOM 212 OG1 THR A 16 14.890 -12.612 7.551 1.00 0.00 O ATOM 213 CG2 THR A 16 12.861 -11.448 6.954 1.00 0.00 C ATOM 0 H THR A 16 16.345 -12.679 5.156 1.00 0.00 H new ATOM 0 HA THR A 16 13.504 -13.402 5.268 1.00 0.00 H new ATOM 0 HB THR A 16 14.845 -10.912 6.372 1.00 0.00 H new ATOM 0 HG1 THR A 16 14.901 -12.106 8.390 1.00 0.00 H new ATOM 0 HG21 THR A 16 12.902 -10.895 7.892 1.00 0.00 H new ATOM 0 HG22 THR A 16 12.402 -10.826 6.186 1.00 0.00 H new ATOM 0 HG23 THR A 16 12.268 -12.352 7.091 1.00 0.00 H new ATOM 221 N LEU A 17 12.939 -12.086 3.230 1.00 0.00 N ATOM 222 CA LEU A 17 12.493 -11.272 2.104 1.00 0.00 C ATOM 223 C LEU A 17 11.171 -10.582 2.423 1.00 0.00 C ATOM 224 O LEU A 17 10.194 -11.231 2.793 1.00 0.00 O ATOM 225 CB LEU A 17 12.340 -12.138 0.852 1.00 0.00 C ATOM 226 CG LEU A 17 13.610 -12.829 0.355 1.00 0.00 C ATOM 227 CD1 LEU A 17 13.285 -13.796 -0.772 1.00 0.00 C ATOM 228 CD2 LEU A 17 14.633 -11.798 -0.103 1.00 0.00 C ATOM 0 H LEU A 17 12.472 -12.989 3.309 1.00 0.00 H new ATOM 0 HA LEU A 17 13.247 -10.507 1.919 1.00 0.00 H new ATOM 0 HB2 LEU A 17 11.589 -12.902 1.053 1.00 0.00 H new ATOM 0 HB3 LEU A 17 11.952 -11.513 0.048 1.00 0.00 H new ATOM 0 HG LEU A 17 14.039 -13.397 1.181 1.00 0.00 H new ATOM 0 HD11 LEU A 17 14.201 -14.278 -1.113 1.00 0.00 H new ATOM 0 HD12 LEU A 17 12.588 -14.553 -0.412 1.00 0.00 H new ATOM 0 HD13 LEU A 17 12.832 -13.251 -1.600 1.00 0.00 H new ATOM 0 HD21 LEU A 17 15.531 -12.307 -0.454 1.00 0.00 H new ATOM 0 HD22 LEU A 17 14.213 -11.204 -0.914 1.00 0.00 H new ATOM 0 HD23 LEU A 17 14.889 -11.144 0.731 1.00 0.00 H new ATOM 240 N GLN A 18 11.149 -9.260 2.275 1.00 0.00 N ATOM 241 CA GLN A 18 9.946 -8.482 2.546 1.00 0.00 C ATOM 242 C GLN A 18 9.285 -8.032 1.247 1.00 0.00 C ATOM 243 O GLN A 18 9.670 -7.032 0.640 1.00 0.00 O ATOM 244 CB GLN A 18 10.284 -7.265 3.409 1.00 0.00 C ATOM 245 CG GLN A 18 10.859 -7.624 4.769 1.00 0.00 C ATOM 246 CD GLN A 18 11.621 -6.477 5.402 1.00 0.00 C ATOM 247 OE1 GLN A 18 11.208 -5.320 5.318 1.00 0.00 O ATOM 248 NE2 GLN A 18 12.742 -6.792 6.040 1.00 0.00 N ATOM 0 H GLN A 18 11.950 -8.707 1.969 1.00 0.00 H new ATOM 0 HA GLN A 18 9.246 -9.119 3.087 1.00 0.00 H new ATOM 0 HB2 GLN A 18 10.999 -6.639 2.875 1.00 0.00 H new ATOM 0 HB3 GLN A 18 9.382 -6.669 3.551 1.00 0.00 H new ATOM 0 HG2 GLN A 18 10.049 -7.927 5.433 1.00 0.00 H new ATOM 0 HG3 GLN A 18 11.523 -8.482 4.663 1.00 0.00 H new ATOM 0 HE21 GLN A 18 13.047 -7.764 6.085 1.00 0.00 H new ATOM 0 HE22 GLN A 18 13.298 -6.062 6.485 1.00 0.00 H new ATOM 257 N PRO A 19 8.266 -8.785 0.809 1.00 0.00 N ATOM 258 CA PRO A 19 7.530 -8.483 -0.422 1.00 0.00 C ATOM 259 C PRO A 19 6.674 -7.228 -0.292 1.00 0.00 C ATOM 260 O PRO A 19 5.490 -7.304 0.037 1.00 0.00 O ATOM 261 CB PRO A 19 6.645 -9.717 -0.618 1.00 0.00 C ATOM 262 CG PRO A 19 6.472 -10.279 0.751 1.00 0.00 C ATOM 263 CD PRO A 19 7.754 -9.991 1.482 1.00 0.00 C ATOM 0 HA PRO A 19 8.199 -8.285 -1.259 1.00 0.00 H new ATOM 0 HB2 PRO A 19 5.685 -9.450 -1.061 1.00 0.00 H new ATOM 0 HB3 PRO A 19 7.114 -10.439 -1.286 1.00 0.00 H new ATOM 0 HG2 PRO A 19 5.623 -9.820 1.257 1.00 0.00 H new ATOM 0 HG3 PRO A 19 6.278 -11.351 0.711 1.00 0.00 H new ATOM 0 HD2 PRO A 19 7.581 -9.816 2.544 1.00 0.00 H new ATOM 0 HD3 PRO A 19 8.455 -10.822 1.406 1.00 0.00 H new ATOM 271 N ARG A 20 7.281 -6.075 -0.554 1.00 0.00 N ATOM 272 CA ARG A 20 6.573 -4.802 -0.465 1.00 0.00 C ATOM 273 C ARG A 20 6.053 -4.373 -1.834 1.00 0.00 C ATOM 274 O ARG A 20 6.790 -4.382 -2.820 1.00 0.00 O ATOM 275 CB ARG A 20 7.494 -3.721 0.104 1.00 0.00 C ATOM 276 CG ARG A 20 7.026 -2.306 -0.191 1.00 0.00 C ATOM 277 CD ARG A 20 7.930 -1.272 0.461 1.00 0.00 C ATOM 278 NE ARG A 20 9.097 -0.969 -0.362 1.00 0.00 N ATOM 279 CZ ARG A 20 9.984 -0.026 -0.062 1.00 0.00 C ATOM 280 NH1 ARG A 20 9.837 0.700 1.037 1.00 0.00 N ATOM 281 NH2 ARG A 20 11.021 0.191 -0.862 1.00 0.00 N ATOM 0 H ARG A 20 8.260 -5.995 -0.829 1.00 0.00 H new ATOM 0 HA ARG A 20 5.722 -4.934 0.203 1.00 0.00 H new ATOM 0 HB2 ARG A 20 7.570 -3.852 1.183 1.00 0.00 H new ATOM 0 HB3 ARG A 20 8.495 -3.856 -0.305 1.00 0.00 H new ATOM 0 HG2 ARG A 20 7.007 -2.146 -1.269 1.00 0.00 H new ATOM 0 HG3 ARG A 20 6.005 -2.177 0.169 1.00 0.00 H new ATOM 0 HD2 ARG A 20 7.365 -0.357 0.639 1.00 0.00 H new ATOM 0 HD3 ARG A 20 8.258 -1.639 1.434 1.00 0.00 H new ATOM 0 HE ARG A 20 9.239 -1.511 -1.214 1.00 0.00 H new ATOM 0 HH11 ARG A 20 9.042 0.535 1.654 1.00 0.00 H new ATOM 0 HH12 ARG A 20 10.519 1.423 1.265 1.00 0.00 H new ATOM 0 HH21 ARG A 20 11.138 -0.366 -1.708 1.00 0.00 H new ATOM 0 HH22 ARG A 20 11.701 0.915 -0.630 1.00 0.00 H new ATOM 295 N CYS A 21 4.779 -4.000 -1.885 1.00 0.00 N ATOM 296 CA CYS A 21 4.159 -3.568 -3.133 1.00 0.00 C ATOM 297 C CYS A 21 3.569 -2.170 -2.992 1.00 0.00 C ATOM 298 O CYS A 21 2.735 -1.923 -2.121 1.00 0.00 O ATOM 299 CB CYS A 21 3.068 -4.556 -3.553 1.00 0.00 C ATOM 300 SG CYS A 21 1.533 -4.404 -2.611 1.00 0.00 S ATOM 0 H CYS A 21 4.156 -3.988 -1.078 1.00 0.00 H new ATOM 0 HA CYS A 21 4.930 -3.540 -3.903 1.00 0.00 H new ATOM 0 HB2 CYS A 21 2.849 -4.410 -4.611 1.00 0.00 H new ATOM 0 HB3 CYS A 21 3.450 -5.571 -3.443 1.00 0.00 H new ATOM 0 HG CYS A 21 1.520 -3.266 -1.984 1.00 0.00 H new ATOM 306 N GLU A 22 4.008 -1.258 -3.854 1.00 0.00 N ATOM 307 CA GLU A 22 3.524 0.118 -3.822 1.00 0.00 C ATOM 308 C GLU A 22 2.940 0.520 -5.174 1.00 0.00 C ATOM 309 O GLU A 22 3.454 0.134 -6.224 1.00 0.00 O ATOM 310 CB GLU A 22 4.657 1.072 -3.440 1.00 0.00 C ATOM 311 CG GLU A 22 5.837 1.031 -4.397 1.00 0.00 C ATOM 312 CD GLU A 22 6.781 -0.121 -4.111 1.00 0.00 C ATOM 313 OE1 GLU A 22 7.278 -0.210 -2.968 1.00 0.00 O ATOM 314 OE2 GLU A 22 7.020 -0.933 -5.029 1.00 0.00 O ATOM 0 H GLU A 22 4.697 -1.446 -4.582 1.00 0.00 H new ATOM 0 HA GLU A 22 2.736 0.182 -3.071 1.00 0.00 H new ATOM 0 HB2 GLU A 22 4.267 2.089 -3.401 1.00 0.00 H new ATOM 0 HB3 GLU A 22 5.005 0.826 -2.437 1.00 0.00 H new ATOM 0 HG2 GLU A 22 5.468 0.948 -5.419 1.00 0.00 H new ATOM 0 HG3 GLU A 22 6.386 1.970 -4.331 1.00 0.00 H new ATOM 321 N ASP A 23 1.863 1.297 -5.139 1.00 0.00 N ATOM 322 CA ASP A 23 1.209 1.753 -6.360 1.00 0.00 C ATOM 323 C ASP A 23 0.526 0.592 -7.076 1.00 0.00 C ATOM 324 O ASP A 23 0.683 0.416 -8.284 1.00 0.00 O ATOM 325 CB ASP A 23 2.225 2.416 -7.291 1.00 0.00 C ATOM 326 CG ASP A 23 1.564 3.281 -8.346 1.00 0.00 C ATOM 327 OD1 ASP A 23 1.013 4.341 -7.984 1.00 0.00 O ATOM 328 OD2 ASP A 23 1.600 2.898 -9.535 1.00 0.00 O ATOM 0 H ASP A 23 1.424 1.624 -4.278 1.00 0.00 H new ATOM 0 HA ASP A 23 0.449 2.484 -6.085 1.00 0.00 H new ATOM 0 HB2 ASP A 23 2.910 3.026 -6.702 1.00 0.00 H new ATOM 0 HB3 ASP A 23 2.823 1.646 -7.779 1.00 0.00 H new ATOM 333 N VAL A 24 -0.232 -0.198 -6.321 1.00 0.00 N ATOM 334 CA VAL A 24 -0.940 -1.342 -6.884 1.00 0.00 C ATOM 335 C VAL A 24 -2.449 -1.161 -6.777 1.00 0.00 C ATOM 336 O VAL A 24 -3.024 -1.286 -5.696 1.00 0.00 O ATOM 337 CB VAL A 24 -0.539 -2.651 -6.179 1.00 0.00 C ATOM 338 CG1 VAL A 24 0.946 -2.926 -6.364 1.00 0.00 C ATOM 339 CG2 VAL A 24 -0.898 -2.592 -4.702 1.00 0.00 C ATOM 0 H VAL A 24 -0.371 -0.067 -5.319 1.00 0.00 H new ATOM 0 HA VAL A 24 -0.659 -1.403 -7.935 1.00 0.00 H new ATOM 0 HB VAL A 24 -1.095 -3.472 -6.633 1.00 0.00 H new ATOM 0 HG11 VAL A 24 1.210 -3.855 -5.859 1.00 0.00 H new ATOM 0 HG12 VAL A 24 1.170 -3.015 -7.427 1.00 0.00 H new ATOM 0 HG13 VAL A 24 1.524 -2.105 -5.939 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -0.608 -3.525 -4.219 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -0.371 -1.761 -4.232 1.00 0.00 H new ATOM 0 HG23 VAL A 24 -1.973 -2.447 -4.594 1.00 0.00 H new ATOM 349 N GLU A 25 -3.086 -0.867 -7.906 1.00 0.00 N ATOM 350 CA GLU A 25 -4.531 -0.669 -7.939 1.00 0.00 C ATOM 351 C GLU A 25 -5.262 -1.924 -7.471 1.00 0.00 C ATOM 352 O GLU A 25 -4.952 -3.035 -7.901 1.00 0.00 O ATOM 353 CB GLU A 25 -4.984 -0.296 -9.351 1.00 0.00 C ATOM 354 CG GLU A 25 -4.514 1.078 -9.800 1.00 0.00 C ATOM 355 CD GLU A 25 -5.396 1.671 -10.881 1.00 0.00 C ATOM 356 OE1 GLU A 25 -5.507 1.055 -11.961 1.00 0.00 O ATOM 357 OE2 GLU A 25 -5.975 2.754 -10.647 1.00 0.00 O ATOM 0 H GLU A 25 -2.625 -0.761 -8.810 1.00 0.00 H new ATOM 0 HA GLU A 25 -4.777 0.147 -7.260 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -4.613 -1.044 -10.052 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -6.073 -0.330 -9.395 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -4.496 1.750 -8.942 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -3.491 1.005 -10.170 1.00 0.00 H new ATOM 364 N THR A 26 -6.237 -1.738 -6.586 1.00 0.00 N ATOM 365 CA THR A 26 -7.013 -2.853 -6.059 1.00 0.00 C ATOM 366 C THR A 26 -8.150 -3.228 -7.002 1.00 0.00 C ATOM 367 O THR A 26 -8.272 -2.672 -8.093 1.00 0.00 O ATOM 368 CB THR A 26 -7.599 -2.524 -4.673 1.00 0.00 C ATOM 369 OG1 THR A 26 -8.419 -1.353 -4.753 1.00 0.00 O ATOM 370 CG2 THR A 26 -6.490 -2.303 -3.655 1.00 0.00 C ATOM 0 H THR A 26 -6.508 -0.825 -6.220 1.00 0.00 H new ATOM 0 HA THR A 26 -6.329 -3.697 -5.966 1.00 0.00 H new ATOM 0 HB THR A 26 -8.205 -3.370 -4.349 1.00 0.00 H new ATOM 0 HG1 THR A 26 -8.789 -1.152 -3.868 1.00 0.00 H new ATOM 0 HG21 THR A 26 -6.928 -2.072 -2.684 1.00 0.00 H new ATOM 0 HG22 THR A 26 -5.885 -3.206 -3.575 1.00 0.00 H new ATOM 0 HG23 THR A 26 -5.862 -1.472 -3.976 1.00 0.00 H new ATOM 378 N ALA A 27 -8.981 -4.173 -6.575 1.00 0.00 N ATOM 379 CA ALA A 27 -10.109 -4.620 -7.381 1.00 0.00 C ATOM 380 C ALA A 27 -10.820 -3.438 -8.034 1.00 0.00 C ATOM 381 O ALA A 27 -11.019 -3.415 -9.247 1.00 0.00 O ATOM 382 CB ALA A 27 -11.083 -5.420 -6.529 1.00 0.00 C ATOM 0 H ALA A 27 -8.894 -4.644 -5.674 1.00 0.00 H new ATOM 0 HA ALA A 27 -9.725 -5.262 -8.174 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -11.921 -5.747 -7.145 1.00 0.00 H new ATOM 0 HB2 ALA A 27 -10.574 -6.291 -6.116 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -11.453 -4.796 -5.716 1.00 0.00 H new ATOM 388 N GLU A 28 -11.201 -2.460 -7.218 1.00 0.00 N ATOM 389 CA GLU A 28 -11.891 -1.277 -7.716 1.00 0.00 C ATOM 390 C GLU A 28 -10.949 -0.403 -8.540 1.00 0.00 C ATOM 391 O GLU A 28 -11.315 0.092 -9.605 1.00 0.00 O ATOM 392 CB GLU A 28 -12.467 -0.467 -6.553 1.00 0.00 C ATOM 393 CG GLU A 28 -12.936 -1.324 -5.389 1.00 0.00 C ATOM 394 CD GLU A 28 -14.053 -0.672 -4.597 1.00 0.00 C ATOM 395 OE1 GLU A 28 -15.215 -0.733 -5.053 1.00 0.00 O ATOM 396 OE2 GLU A 28 -13.767 -0.102 -3.524 1.00 0.00 O ATOM 0 H GLU A 28 -11.043 -2.464 -6.210 1.00 0.00 H new ATOM 0 HA GLU A 28 -12.707 -1.609 -8.358 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -11.710 0.231 -6.197 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -13.305 0.129 -6.916 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -13.278 -2.287 -5.767 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -12.094 -1.522 -4.726 1.00 0.00 H new ATOM 403 N GLY A 29 -9.731 -0.219 -8.037 1.00 0.00 N ATOM 404 CA GLY A 29 -8.754 0.594 -8.738 1.00 0.00 C ATOM 405 C GLY A 29 -8.019 1.543 -7.812 1.00 0.00 C ATOM 406 O GLY A 29 -7.584 2.617 -8.229 1.00 0.00 O ATOM 0 H GLY A 29 -9.404 -0.618 -7.157 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -8.033 -0.056 -9.234 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -9.255 1.167 -9.518 1.00 0.00 H new ATOM 410 N VAL A 30 -7.881 1.149 -6.551 1.00 0.00 N ATOM 411 CA VAL A 30 -7.194 1.971 -5.562 1.00 0.00 C ATOM 412 C VAL A 30 -5.757 1.502 -5.360 1.00 0.00 C ATOM 413 O VAL A 30 -5.504 0.314 -5.166 1.00 0.00 O ATOM 414 CB VAL A 30 -7.926 1.950 -4.207 1.00 0.00 C ATOM 415 CG1 VAL A 30 -7.391 3.043 -3.294 1.00 0.00 C ATOM 416 CG2 VAL A 30 -9.425 2.099 -4.410 1.00 0.00 C ATOM 0 H VAL A 30 -8.236 0.264 -6.189 1.00 0.00 H new ATOM 0 HA VAL A 30 -7.189 2.991 -5.947 1.00 0.00 H new ATOM 0 HB VAL A 30 -7.741 0.988 -3.728 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -7.920 3.013 -2.341 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -6.326 2.885 -3.123 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -7.543 4.015 -3.763 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -9.927 2.082 -3.442 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -9.632 3.045 -4.910 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -9.793 1.277 -5.024 1.00 0.00 H new ATOM 426 N ALA A 31 -4.821 2.445 -5.405 1.00 0.00 N ATOM 427 CA ALA A 31 -3.410 2.128 -5.224 1.00 0.00 C ATOM 428 C ALA A 31 -3.034 2.122 -3.746 1.00 0.00 C ATOM 429 O ALA A 31 -3.023 3.165 -3.092 1.00 0.00 O ATOM 430 CB ALA A 31 -2.545 3.121 -5.986 1.00 0.00 C ATOM 0 H ALA A 31 -5.015 3.434 -5.565 1.00 0.00 H new ATOM 0 HA ALA A 31 -3.233 1.128 -5.621 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -1.493 2.873 -5.842 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -2.787 3.074 -7.048 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -2.734 4.128 -5.615 1.00 0.00 H new ATOM 436 N LEU A 32 -2.728 0.939 -3.224 1.00 0.00 N ATOM 437 CA LEU A 32 -2.353 0.796 -1.822 1.00 0.00 C ATOM 438 C LEU A 32 -0.872 0.456 -1.687 1.00 0.00 C ATOM 439 O LEU A 32 -0.217 0.086 -2.661 1.00 0.00 O ATOM 440 CB LEU A 32 -3.199 -0.290 -1.155 1.00 0.00 C ATOM 441 CG LEU A 32 -4.504 0.178 -0.509 1.00 0.00 C ATOM 442 CD1 LEU A 32 -4.218 1.124 0.646 1.00 0.00 C ATOM 443 CD2 LEU A 32 -5.400 0.847 -1.541 1.00 0.00 C ATOM 0 H LEU A 32 -2.732 0.065 -3.751 1.00 0.00 H new ATOM 0 HA LEU A 32 -2.536 1.748 -1.324 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -3.438 -1.047 -1.902 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -2.593 -0.777 -0.391 1.00 0.00 H new ATOM 0 HG LEU A 32 -5.026 -0.694 -0.116 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -5.158 1.447 1.093 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -3.616 0.611 1.396 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -3.674 1.994 0.278 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -6.324 1.174 -1.064 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -4.886 1.710 -1.965 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -5.633 0.138 -2.335 1.00 0.00 H new ATOM 455 N THR A 33 -0.349 0.585 -0.471 1.00 0.00 N ATOM 456 CA THR A 33 1.054 0.292 -0.207 1.00 0.00 C ATOM 457 C THR A 33 1.204 -0.668 0.967 1.00 0.00 C ATOM 458 O THR A 33 0.987 -0.293 2.119 1.00 0.00 O ATOM 459 CB THR A 33 1.850 1.576 0.089 1.00 0.00 C ATOM 460 OG1 THR A 33 1.328 2.665 -0.680 1.00 0.00 O ATOM 461 CG2 THR A 33 3.325 1.385 -0.231 1.00 0.00 C ATOM 0 H THR A 33 -0.877 0.891 0.347 1.00 0.00 H new ATOM 0 HA THR A 33 1.454 -0.175 -1.107 1.00 0.00 H new ATOM 0 HB THR A 33 1.751 1.801 1.151 1.00 0.00 H new ATOM 0 HG1 THR A 33 1.839 3.478 -0.484 1.00 0.00 H new ATOM 0 HG21 THR A 33 3.867 2.306 -0.014 1.00 0.00 H new ATOM 0 HG22 THR A 33 3.727 0.575 0.377 1.00 0.00 H new ATOM 0 HG23 THR A 33 3.439 1.137 -1.286 1.00 0.00 H new ATOM 469 N VAL A 34 1.578 -1.908 0.669 1.00 0.00 N ATOM 470 CA VAL A 34 1.759 -2.922 1.701 1.00 0.00 C ATOM 471 C VAL A 34 3.193 -3.440 1.717 1.00 0.00 C ATOM 472 O VAL A 34 3.679 -3.988 0.728 1.00 0.00 O ATOM 473 CB VAL A 34 0.799 -4.109 1.496 1.00 0.00 C ATOM 474 CG1 VAL A 34 1.063 -5.193 2.529 1.00 0.00 C ATOM 475 CG2 VAL A 34 -0.647 -3.641 1.560 1.00 0.00 C ATOM 0 H VAL A 34 1.762 -2.235 -0.280 1.00 0.00 H new ATOM 0 HA VAL A 34 1.537 -2.445 2.656 1.00 0.00 H new ATOM 0 HB VAL A 34 0.977 -4.532 0.507 1.00 0.00 H new ATOM 0 HG11 VAL A 34 0.376 -6.024 2.369 1.00 0.00 H new ATOM 0 HG12 VAL A 34 2.089 -5.547 2.431 1.00 0.00 H new ATOM 0 HG13 VAL A 34 0.914 -4.786 3.529 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -1.312 -4.492 1.413 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -0.841 -3.192 2.534 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -0.825 -2.902 0.778 1.00 0.00 H new ATOM 485 N THR A 35 3.867 -3.261 2.850 1.00 0.00 N ATOM 486 CA THR A 35 5.246 -3.710 2.996 1.00 0.00 C ATOM 487 C THR A 35 5.332 -5.232 2.995 1.00 0.00 C ATOM 488 O THR A 35 6.064 -5.821 2.200 1.00 0.00 O ATOM 489 CB THR A 35 5.876 -3.172 4.295 1.00 0.00 C ATOM 490 OG1 THR A 35 5.997 -1.747 4.227 1.00 0.00 O ATOM 491 CG2 THR A 35 7.246 -3.791 4.528 1.00 0.00 C ATOM 0 H THR A 35 3.480 -2.809 3.678 1.00 0.00 H new ATOM 0 HA THR A 35 5.799 -3.318 2.142 1.00 0.00 H new ATOM 0 HB THR A 35 5.226 -3.442 5.127 1.00 0.00 H new ATOM 0 HG1 THR A 35 6.397 -1.413 5.057 1.00 0.00 H new ATOM 0 HG21 THR A 35 7.671 -3.396 5.451 1.00 0.00 H new ATOM 0 HG22 THR A 35 7.147 -4.874 4.608 1.00 0.00 H new ATOM 0 HG23 THR A 35 7.902 -3.547 3.693 1.00 0.00 H new ATOM 499 N GLY A 36 4.581 -5.864 3.892 1.00 0.00 N ATOM 500 CA GLY A 36 4.588 -7.312 3.976 1.00 0.00 C ATOM 501 C GLY A 36 5.919 -7.860 4.449 1.00 0.00 C ATOM 502 O GLY A 36 6.975 -7.336 4.092 1.00 0.00 O ATOM 0 H GLY A 36 3.968 -5.399 4.562 1.00 0.00 H new ATOM 0 HA2 GLY A 36 3.802 -7.637 4.658 1.00 0.00 H new ATOM 0 HA3 GLY A 36 4.354 -7.731 2.997 1.00 0.00 H new ATOM 506 N VAL A 37 5.872 -8.916 5.254 1.00 0.00 N ATOM 507 CA VAL A 37 7.085 -9.535 5.777 1.00 0.00 C ATOM 508 C VAL A 37 6.961 -11.053 5.800 1.00 0.00 C ATOM 509 O VAL A 37 6.010 -11.601 6.357 1.00 0.00 O ATOM 510 CB VAL A 37 7.402 -9.034 7.199 1.00 0.00 C ATOM 511 CG1 VAL A 37 8.523 -9.857 7.816 1.00 0.00 C ATOM 512 CG2 VAL A 37 7.764 -7.557 7.175 1.00 0.00 C ATOM 0 H VAL A 37 5.007 -9.362 5.559 1.00 0.00 H new ATOM 0 HA VAL A 37 7.899 -9.251 5.110 1.00 0.00 H new ATOM 0 HB VAL A 37 6.512 -9.156 7.816 1.00 0.00 H new ATOM 0 HG11 VAL A 37 8.734 -9.489 8.820 1.00 0.00 H new ATOM 0 HG12 VAL A 37 8.220 -10.903 7.868 1.00 0.00 H new ATOM 0 HG13 VAL A 37 9.419 -9.769 7.202 1.00 0.00 H new ATOM 0 HG21 VAL A 37 7.985 -7.220 8.188 1.00 0.00 H new ATOM 0 HG22 VAL A 37 8.640 -7.407 6.544 1.00 0.00 H new ATOM 0 HG23 VAL A 37 6.927 -6.984 6.776 1.00 0.00 H new ATOM 522 N ALA A 38 7.929 -11.730 5.190 1.00 0.00 N ATOM 523 CA ALA A 38 7.930 -13.187 5.142 1.00 0.00 C ATOM 524 C ALA A 38 9.348 -13.739 5.244 1.00 0.00 C ATOM 525 O ALA A 38 10.298 -13.121 4.766 1.00 0.00 O ATOM 526 CB ALA A 38 7.262 -13.674 3.865 1.00 0.00 C ATOM 0 H ALA A 38 8.723 -11.292 4.722 1.00 0.00 H new ATOM 0 HA ALA A 38 7.363 -13.554 5.998 1.00 0.00 H new ATOM 0 HB1 ALA A 38 7.270 -14.764 3.843 1.00 0.00 H new ATOM 0 HB2 ALA A 38 6.232 -13.318 3.835 1.00 0.00 H new ATOM 0 HB3 ALA A 38 7.804 -13.290 3.001 1.00 0.00 H new ATOM 532 N GLN A 39 9.481 -14.904 5.869 1.00 0.00 N ATOM 533 CA GLN A 39 10.785 -15.537 6.033 1.00 0.00 C ATOM 534 C GLN A 39 10.957 -16.691 5.050 1.00 0.00 C ATOM 535 O GLN A 39 10.070 -17.532 4.902 1.00 0.00 O ATOM 536 CB GLN A 39 10.952 -16.044 7.467 1.00 0.00 C ATOM 537 CG GLN A 39 12.386 -16.400 7.823 1.00 0.00 C ATOM 538 CD GLN A 39 13.204 -15.189 8.229 1.00 0.00 C ATOM 539 OE1 GLN A 39 12.688 -14.072 8.299 1.00 0.00 O ATOM 540 NE2 GLN A 39 14.486 -15.404 8.501 1.00 0.00 N ATOM 0 H GLN A 39 8.703 -15.428 6.270 1.00 0.00 H new ATOM 0 HA GLN A 39 11.552 -14.791 5.827 1.00 0.00 H new ATOM 0 HB2 GLN A 39 10.594 -15.280 8.158 1.00 0.00 H new ATOM 0 HB3 GLN A 39 10.322 -16.922 7.609 1.00 0.00 H new ATOM 0 HG2 GLN A 39 12.385 -17.123 8.638 1.00 0.00 H new ATOM 0 HG3 GLN A 39 12.859 -16.884 6.968 1.00 0.00 H new ATOM 0 HE21 GLN A 39 14.871 -16.346 8.430 1.00 0.00 H new ATOM 0 HE22 GLN A 39 15.085 -14.627 8.781 1.00 0.00 H new ATOM 549 N VAL A 40 12.105 -16.724 4.380 1.00 0.00 N ATOM 550 CA VAL A 40 12.393 -17.776 3.411 1.00 0.00 C ATOM 551 C VAL A 40 13.813 -18.306 3.583 1.00 0.00 C ATOM 552 O VAL A 40 14.691 -17.607 4.090 1.00 0.00 O ATOM 553 CB VAL A 40 12.216 -17.272 1.967 1.00 0.00 C ATOM 554 CG1 VAL A 40 13.320 -16.289 1.605 1.00 0.00 C ATOM 555 CG2 VAL A 40 12.192 -18.441 0.994 1.00 0.00 C ATOM 0 H VAL A 40 12.850 -16.036 4.490 1.00 0.00 H new ATOM 0 HA VAL A 40 11.682 -18.581 3.596 1.00 0.00 H new ATOM 0 HB VAL A 40 11.261 -16.751 1.897 1.00 0.00 H new ATOM 0 HG11 VAL A 40 13.178 -15.944 0.581 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.285 -15.437 2.283 1.00 0.00 H new ATOM 0 HG13 VAL A 40 14.288 -16.782 1.691 1.00 0.00 H new ATOM 0 HG21 VAL A 40 12.066 -18.066 -0.022 1.00 0.00 H new ATOM 0 HG22 VAL A 40 13.130 -18.992 1.064 1.00 0.00 H new ATOM 0 HG23 VAL A 40 11.363 -19.104 1.242 1.00 0.00 H new ATOM 565 N LYS A 41 14.031 -19.545 3.156 1.00 0.00 N ATOM 566 CA LYS A 41 15.344 -20.171 3.260 1.00 0.00 C ATOM 567 C LYS A 41 15.615 -21.069 2.058 1.00 0.00 C ATOM 568 O LYS A 41 14.690 -21.621 1.464 1.00 0.00 O ATOM 569 CB LYS A 41 15.443 -20.985 4.552 1.00 0.00 C ATOM 570 CG LYS A 41 14.432 -22.114 4.638 1.00 0.00 C ATOM 571 CD LYS A 41 14.974 -23.290 5.432 1.00 0.00 C ATOM 572 CE LYS A 41 13.863 -24.238 5.856 1.00 0.00 C ATOM 573 NZ LYS A 41 13.095 -23.707 7.016 1.00 0.00 N ATOM 0 H LYS A 41 13.315 -20.136 2.734 1.00 0.00 H new ATOM 0 HA LYS A 41 16.095 -19.381 3.278 1.00 0.00 H new ATOM 0 HB2 LYS A 41 16.447 -21.401 4.633 1.00 0.00 H new ATOM 0 HB3 LYS A 41 15.304 -20.318 5.403 1.00 0.00 H new ATOM 0 HG2 LYS A 41 13.517 -21.749 5.105 1.00 0.00 H new ATOM 0 HG3 LYS A 41 14.167 -22.444 3.633 1.00 0.00 H new ATOM 0 HD2 LYS A 41 15.705 -23.831 4.830 1.00 0.00 H new ATOM 0 HD3 LYS A 41 15.497 -22.923 6.315 1.00 0.00 H new ATOM 0 HE2 LYS A 41 13.187 -24.403 5.017 1.00 0.00 H new ATOM 0 HE3 LYS A 41 14.291 -25.206 6.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 12.819 -24.493 7.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 13.687 -23.037 7.547 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 12.242 -23.220 6.674 1.00 0.00 H new ATOM 587 N ILE A 42 16.889 -21.210 1.707 1.00 0.00 N ATOM 588 CA ILE A 42 17.281 -22.044 0.577 1.00 0.00 C ATOM 589 C ILE A 42 17.190 -23.525 0.929 1.00 0.00 C ATOM 590 O ILE A 42 18.051 -24.061 1.627 1.00 0.00 O ATOM 591 CB ILE A 42 18.714 -21.725 0.113 1.00 0.00 C ATOM 592 CG1 ILE A 42 18.828 -20.254 -0.292 1.00 0.00 C ATOM 593 CG2 ILE A 42 19.110 -22.630 -1.044 1.00 0.00 C ATOM 594 CD1 ILE A 42 17.908 -19.868 -1.430 1.00 0.00 C ATOM 0 H ILE A 42 17.667 -20.758 2.188 1.00 0.00 H new ATOM 0 HA ILE A 42 16.587 -21.823 -0.234 1.00 0.00 H new ATOM 0 HB ILE A 42 19.397 -21.908 0.943 1.00 0.00 H new ATOM 0 HG12 ILE A 42 18.605 -19.629 0.573 1.00 0.00 H new ATOM 0 HG13 ILE A 42 19.858 -20.044 -0.581 1.00 0.00 H new ATOM 0 HG21 ILE A 42 20.125 -22.392 -1.361 1.00 0.00 H new ATOM 0 HG22 ILE A 42 19.064 -23.671 -0.724 1.00 0.00 H new ATOM 0 HG23 ILE A 42 18.425 -22.476 -1.877 1.00 0.00 H new ATOM 0 HD11 ILE A 42 18.042 -18.812 -1.664 1.00 0.00 H new ATOM 0 HD12 ILE A 42 18.145 -20.467 -2.309 1.00 0.00 H new ATOM 0 HD13 ILE A 42 16.873 -20.046 -1.138 1.00 0.00 H new ATOM 606 N MET A 43 16.143 -24.181 0.440 1.00 0.00 N ATOM 607 CA MET A 43 15.942 -25.601 0.700 1.00 0.00 C ATOM 608 C MET A 43 17.254 -26.368 0.575 1.00 0.00 C ATOM 609 O MET A 43 18.157 -25.959 -0.155 1.00 0.00 O ATOM 610 CB MET A 43 14.906 -26.178 -0.267 1.00 0.00 C ATOM 611 CG MET A 43 13.473 -26.033 0.219 1.00 0.00 C ATOM 612 SD MET A 43 12.340 -27.159 -0.615 1.00 0.00 S ATOM 613 CE MET A 43 11.256 -25.998 -1.443 1.00 0.00 C ATOM 0 H MET A 43 15.421 -23.752 -0.138 1.00 0.00 H new ATOM 0 HA MET A 43 15.575 -25.709 1.721 1.00 0.00 H new ATOM 0 HB2 MET A 43 15.006 -25.681 -1.232 1.00 0.00 H new ATOM 0 HB3 MET A 43 15.121 -27.234 -0.429 1.00 0.00 H new ATOM 0 HG2 MET A 43 13.437 -26.217 1.293 1.00 0.00 H new ATOM 0 HG3 MET A 43 13.142 -25.007 0.060 1.00 0.00 H new ATOM 0 HE1 MET A 43 10.663 -26.524 -2.191 1.00 0.00 H new ATOM 0 HE2 MET A 43 10.592 -25.536 -0.713 1.00 0.00 H new ATOM 0 HE3 MET A 43 11.853 -25.227 -1.930 1.00 0.00 H new ATOM 623 N THR A 44 17.353 -27.484 1.291 1.00 0.00 N ATOM 624 CA THR A 44 18.556 -28.307 1.261 1.00 0.00 C ATOM 625 C THR A 44 18.417 -29.448 0.258 1.00 0.00 C ATOM 626 O THR A 44 17.306 -29.862 -0.072 1.00 0.00 O ATOM 627 CB THR A 44 18.869 -28.896 2.649 1.00 0.00 C ATOM 628 OG1 THR A 44 18.381 -28.021 3.674 1.00 0.00 O ATOM 629 CG2 THR A 44 20.366 -29.104 2.824 1.00 0.00 C ATOM 0 H THR A 44 16.614 -27.839 1.899 1.00 0.00 H new ATOM 0 HA THR A 44 19.376 -27.656 0.957 1.00 0.00 H new ATOM 0 HB THR A 44 18.372 -29.863 2.729 1.00 0.00 H new ATOM 0 HG1 THR A 44 18.582 -28.403 4.554 1.00 0.00 H new ATOM 0 HG21 THR A 44 20.562 -29.521 3.812 1.00 0.00 H new ATOM 0 HG22 THR A 44 20.729 -29.792 2.061 1.00 0.00 H new ATOM 0 HG23 THR A 44 20.880 -28.148 2.725 1.00 0.00 H new ATOM 637 N GLU A 45 19.550 -29.949 -0.221 1.00 0.00 N ATOM 638 CA GLU A 45 19.553 -31.042 -1.187 1.00 0.00 C ATOM 639 C GLU A 45 19.001 -32.321 -0.563 1.00 0.00 C ATOM 640 O GLU A 45 19.659 -32.956 0.263 1.00 0.00 O ATOM 641 CB GLU A 45 20.970 -31.286 -1.710 1.00 0.00 C ATOM 642 CG GLU A 45 22.053 -31.045 -0.671 1.00 0.00 C ATOM 643 CD GLU A 45 23.363 -31.720 -1.028 1.00 0.00 C ATOM 644 OE1 GLU A 45 23.359 -32.951 -1.232 1.00 0.00 O ATOM 645 OE2 GLU A 45 24.392 -31.016 -1.101 1.00 0.00 O ATOM 0 H GLU A 45 20.477 -29.616 0.043 1.00 0.00 H new ATOM 0 HA GLU A 45 18.910 -30.758 -2.020 1.00 0.00 H new ATOM 0 HB2 GLU A 45 21.044 -32.313 -2.068 1.00 0.00 H new ATOM 0 HB3 GLU A 45 21.149 -30.636 -2.566 1.00 0.00 H new ATOM 0 HG2 GLU A 45 22.218 -29.973 -0.565 1.00 0.00 H new ATOM 0 HG3 GLU A 45 21.711 -31.412 0.297 1.00 0.00 H new ATOM 652 N LYS A 46 17.791 -32.693 -0.963 1.00 0.00 N ATOM 653 CA LYS A 46 17.150 -33.896 -0.445 1.00 0.00 C ATOM 654 C LYS A 46 16.960 -34.931 -1.551 1.00 0.00 C ATOM 655 O LYS A 46 17.024 -36.134 -1.303 1.00 0.00 O ATOM 656 CB LYS A 46 15.797 -33.548 0.180 1.00 0.00 C ATOM 657 CG LYS A 46 15.906 -32.944 1.570 1.00 0.00 C ATOM 658 CD LYS A 46 16.204 -34.004 2.617 1.00 0.00 C ATOM 659 CE LYS A 46 15.763 -33.558 4.003 1.00 0.00 C ATOM 660 NZ LYS A 46 16.578 -32.417 4.503 1.00 0.00 N ATOM 0 H LYS A 46 17.233 -32.179 -1.645 1.00 0.00 H new ATOM 0 HA LYS A 46 17.798 -34.323 0.320 1.00 0.00 H new ATOM 0 HB2 LYS A 46 15.275 -32.847 -0.472 1.00 0.00 H new ATOM 0 HB3 LYS A 46 15.187 -34.450 0.232 1.00 0.00 H new ATOM 0 HG2 LYS A 46 16.694 -32.190 1.579 1.00 0.00 H new ATOM 0 HG3 LYS A 46 14.975 -32.435 1.821 1.00 0.00 H new ATOM 0 HD2 LYS A 46 15.695 -34.931 2.353 1.00 0.00 H new ATOM 0 HD3 LYS A 46 17.273 -34.218 2.625 1.00 0.00 H new ATOM 0 HE2 LYS A 46 14.712 -33.269 3.974 1.00 0.00 H new ATOM 0 HE3 LYS A 46 15.845 -34.395 4.697 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 16.247 -32.142 5.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 17.577 -32.700 4.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 16.480 -31.610 3.854 1.00 0.00 H new ATOM 674 N GLU A 47 16.727 -34.452 -2.769 1.00 0.00 N ATOM 675 CA GLU A 47 16.529 -35.336 -3.911 1.00 0.00 C ATOM 676 C GLU A 47 16.577 -34.554 -5.220 1.00 0.00 C ATOM 677 O GLU A 47 15.695 -33.742 -5.504 1.00 0.00 O ATOM 678 CB GLU A 47 15.190 -36.068 -3.792 1.00 0.00 C ATOM 679 CG GLU A 47 15.068 -37.268 -4.717 1.00 0.00 C ATOM 680 CD GLU A 47 15.892 -38.452 -4.249 1.00 0.00 C ATOM 681 OE1 GLU A 47 17.101 -38.494 -4.561 1.00 0.00 O ATOM 682 OE2 GLU A 47 15.327 -39.336 -3.573 1.00 0.00 O ATOM 0 H GLU A 47 16.671 -33.458 -2.990 1.00 0.00 H new ATOM 0 HA GLU A 47 17.337 -36.068 -3.915 1.00 0.00 H new ATOM 0 HB2 GLU A 47 15.057 -36.399 -2.762 1.00 0.00 H new ATOM 0 HB3 GLU A 47 14.383 -35.369 -4.009 1.00 0.00 H new ATOM 0 HG2 GLU A 47 14.021 -37.564 -4.786 1.00 0.00 H new ATOM 0 HG3 GLU A 47 15.386 -36.983 -5.720 1.00 0.00 H new ATOM 689 N LEU A 48 17.614 -34.803 -6.014 1.00 0.00 N ATOM 690 CA LEU A 48 17.779 -34.122 -7.293 1.00 0.00 C ATOM 691 C LEU A 48 17.681 -32.609 -7.121 1.00 0.00 C ATOM 692 O LEU A 48 16.901 -31.945 -7.805 1.00 0.00 O ATOM 693 CB LEU A 48 16.721 -34.602 -8.289 1.00 0.00 C ATOM 694 CG LEU A 48 16.669 -36.110 -8.537 1.00 0.00 C ATOM 695 CD1 LEU A 48 15.420 -36.479 -9.323 1.00 0.00 C ATOM 696 CD2 LEU A 48 17.920 -36.574 -9.269 1.00 0.00 C ATOM 0 H LEU A 48 18.352 -35.471 -5.794 1.00 0.00 H new ATOM 0 HA LEU A 48 18.769 -34.362 -7.679 1.00 0.00 H new ATOM 0 HB2 LEU A 48 15.743 -34.278 -7.934 1.00 0.00 H new ATOM 0 HB3 LEU A 48 16.895 -34.103 -9.242 1.00 0.00 H new ATOM 0 HG LEU A 48 16.629 -36.616 -7.573 1.00 0.00 H new ATOM 0 HD11 LEU A 48 15.400 -37.556 -9.490 1.00 0.00 H new ATOM 0 HD12 LEU A 48 14.535 -36.183 -8.760 1.00 0.00 H new ATOM 0 HD13 LEU A 48 15.429 -35.963 -10.283 1.00 0.00 H new ATOM 0 HD21 LEU A 48 17.865 -37.650 -9.437 1.00 0.00 H new ATOM 0 HD22 LEU A 48 17.992 -36.060 -10.228 1.00 0.00 H new ATOM 0 HD23 LEU A 48 18.800 -36.345 -8.667 1.00 0.00 H new ATOM 708 N LEU A 49 18.480 -32.071 -6.206 1.00 0.00 N ATOM 709 CA LEU A 49 18.486 -30.635 -5.946 1.00 0.00 C ATOM 710 C LEU A 49 18.927 -29.860 -7.184 1.00 0.00 C ATOM 711 O LEU A 49 18.720 -28.651 -7.277 1.00 0.00 O ATOM 712 CB LEU A 49 19.413 -30.315 -4.772 1.00 0.00 C ATOM 713 CG LEU A 49 19.059 -29.069 -3.959 1.00 0.00 C ATOM 714 CD1 LEU A 49 19.293 -27.811 -4.780 1.00 0.00 C ATOM 715 CD2 LEU A 49 17.616 -29.135 -3.481 1.00 0.00 C ATOM 0 H LEU A 49 19.131 -32.607 -5.632 1.00 0.00 H new ATOM 0 HA LEU A 49 17.470 -30.331 -5.693 1.00 0.00 H new ATOM 0 HB2 LEU A 49 19.424 -31.173 -4.099 1.00 0.00 H new ATOM 0 HB3 LEU A 49 20.426 -30.198 -5.156 1.00 0.00 H new ATOM 0 HG LEU A 49 19.709 -29.034 -3.085 1.00 0.00 H new ATOM 0 HD11 LEU A 49 19.036 -26.935 -4.185 1.00 0.00 H new ATOM 0 HD12 LEU A 49 20.342 -27.756 -5.071 1.00 0.00 H new ATOM 0 HD13 LEU A 49 18.669 -27.838 -5.674 1.00 0.00 H new ATOM 0 HD21 LEU A 49 17.382 -28.240 -2.904 1.00 0.00 H new ATOM 0 HD22 LEU A 49 16.950 -29.196 -4.342 1.00 0.00 H new ATOM 0 HD23 LEU A 49 17.480 -30.016 -2.854 1.00 0.00 H new ATOM 727 N ALA A 50 19.535 -30.564 -8.132 1.00 0.00 N ATOM 728 CA ALA A 50 20.002 -29.943 -9.365 1.00 0.00 C ATOM 729 C ALA A 50 18.974 -28.953 -9.903 1.00 0.00 C ATOM 730 O ALA A 50 19.319 -28.010 -10.615 1.00 0.00 O ATOM 731 CB ALA A 50 20.309 -31.007 -10.408 1.00 0.00 C ATOM 0 H ALA A 50 19.716 -31.566 -8.070 1.00 0.00 H new ATOM 0 HA ALA A 50 20.917 -29.393 -9.143 1.00 0.00 H new ATOM 0 HB1 ALA A 50 20.657 -30.529 -11.324 1.00 0.00 H new ATOM 0 HB2 ALA A 50 21.084 -31.674 -10.030 1.00 0.00 H new ATOM 0 HB3 ALA A 50 19.407 -31.581 -10.618 1.00 0.00 H new ATOM 737 N VAL A 51 17.709 -29.174 -9.559 1.00 0.00 N ATOM 738 CA VAL A 51 16.632 -28.301 -10.007 1.00 0.00 C ATOM 739 C VAL A 51 16.942 -26.840 -9.698 1.00 0.00 C ATOM 740 O VAL A 51 16.702 -25.957 -10.520 1.00 0.00 O ATOM 741 CB VAL A 51 15.292 -28.679 -9.348 1.00 0.00 C ATOM 742 CG1 VAL A 51 15.478 -28.920 -7.857 1.00 0.00 C ATOM 743 CG2 VAL A 51 14.252 -27.596 -9.595 1.00 0.00 C ATOM 0 H VAL A 51 17.406 -29.951 -8.971 1.00 0.00 H new ATOM 0 HA VAL A 51 16.549 -28.431 -11.086 1.00 0.00 H new ATOM 0 HB VAL A 51 14.934 -29.604 -9.799 1.00 0.00 H new ATOM 0 HG11 VAL A 51 14.520 -29.186 -7.409 1.00 0.00 H new ATOM 0 HG12 VAL A 51 16.188 -29.733 -7.706 1.00 0.00 H new ATOM 0 HG13 VAL A 51 15.859 -28.014 -7.387 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.312 -27.880 -9.122 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.601 -26.654 -9.172 1.00 0.00 H new ATOM 0 HG23 VAL A 51 14.098 -27.478 -10.668 1.00 0.00 H new ATOM 753 N ALA A 52 17.480 -26.595 -8.508 1.00 0.00 N ATOM 754 CA ALA A 52 17.827 -25.241 -8.091 1.00 0.00 C ATOM 755 C ALA A 52 19.339 -25.044 -8.071 1.00 0.00 C ATOM 756 O ALA A 52 19.833 -23.937 -8.288 1.00 0.00 O ATOM 757 CB ALA A 52 17.235 -24.942 -6.722 1.00 0.00 C ATOM 0 H ALA A 52 17.685 -27.315 -7.816 1.00 0.00 H new ATOM 0 HA ALA A 52 17.406 -24.545 -8.816 1.00 0.00 H new ATOM 0 HB1 ALA A 52 17.502 -23.928 -6.424 1.00 0.00 H new ATOM 0 HB2 ALA A 52 16.150 -25.033 -6.767 1.00 0.00 H new ATOM 0 HB3 ALA A 52 17.628 -25.650 -5.993 1.00 0.00 H new ATOM 763 N CYS A 53 20.068 -26.123 -7.809 1.00 0.00 N ATOM 764 CA CYS A 53 21.524 -26.068 -7.758 1.00 0.00 C ATOM 765 C CYS A 53 22.076 -25.225 -8.903 1.00 0.00 C ATOM 766 O CYS A 53 22.609 -24.137 -8.684 1.00 0.00 O ATOM 767 CB CYS A 53 22.112 -27.479 -7.818 1.00 0.00 C ATOM 768 SG CYS A 53 23.747 -27.630 -7.062 1.00 0.00 S ATOM 0 H CYS A 53 19.674 -27.047 -7.629 1.00 0.00 H new ATOM 0 HA CYS A 53 21.812 -25.603 -6.816 1.00 0.00 H new ATOM 0 HB2 CYS A 53 21.429 -28.167 -7.321 1.00 0.00 H new ATOM 0 HB3 CYS A 53 22.175 -27.791 -8.861 1.00 0.00 H new ATOM 0 HG CYS A 53 24.159 -28.859 -7.160 1.00 0.00 H new ATOM 774 N GLU A 54 21.947 -25.736 -10.123 1.00 0.00 N ATOM 775 CA GLU A 54 22.436 -25.031 -11.302 1.00 0.00 C ATOM 776 C GLU A 54 21.645 -23.746 -11.534 1.00 0.00 C ATOM 777 O GLU A 54 22.183 -22.756 -12.028 1.00 0.00 O ATOM 778 CB GLU A 54 22.342 -25.930 -12.537 1.00 0.00 C ATOM 779 CG GLU A 54 23.194 -27.185 -12.442 1.00 0.00 C ATOM 780 CD GLU A 54 23.030 -28.094 -13.644 1.00 0.00 C ATOM 781 OE1 GLU A 54 22.065 -28.887 -13.661 1.00 0.00 O ATOM 782 OE2 GLU A 54 23.866 -28.012 -14.568 1.00 0.00 O ATOM 0 H GLU A 54 21.508 -26.635 -10.321 1.00 0.00 H new ATOM 0 HA GLU A 54 23.480 -24.769 -11.130 1.00 0.00 H new ATOM 0 HB2 GLU A 54 21.302 -26.218 -12.688 1.00 0.00 H new ATOM 0 HB3 GLU A 54 22.646 -25.360 -13.415 1.00 0.00 H new ATOM 0 HG2 GLU A 54 24.242 -26.902 -12.346 1.00 0.00 H new ATOM 0 HG3 GLU A 54 22.928 -27.733 -11.538 1.00 0.00 H new ATOM 789 N GLN A 55 20.366 -23.773 -11.174 1.00 0.00 N ATOM 790 CA GLN A 55 19.502 -22.610 -11.344 1.00 0.00 C ATOM 791 C GLN A 55 20.050 -21.408 -10.583 1.00 0.00 C ATOM 792 O GLN A 55 19.768 -20.260 -10.929 1.00 0.00 O ATOM 793 CB GLN A 55 18.084 -22.929 -10.865 1.00 0.00 C ATOM 794 CG GLN A 55 17.036 -21.954 -11.377 1.00 0.00 C ATOM 795 CD GLN A 55 16.434 -22.386 -12.700 1.00 0.00 C ATOM 796 OE1 GLN A 55 17.109 -22.988 -13.535 1.00 0.00 O ATOM 797 NE2 GLN A 55 15.157 -22.079 -12.897 1.00 0.00 N ATOM 0 H GLN A 55 19.906 -24.585 -10.764 1.00 0.00 H new ATOM 0 HA GLN A 55 19.473 -22.362 -12.405 1.00 0.00 H new ATOM 0 HB2 GLN A 55 17.819 -23.936 -11.186 1.00 0.00 H new ATOM 0 HB3 GLN A 55 18.068 -22.927 -9.775 1.00 0.00 H new ATOM 0 HG2 GLN A 55 16.243 -21.857 -10.636 1.00 0.00 H new ATOM 0 HG3 GLN A 55 17.487 -20.969 -11.492 1.00 0.00 H new ATOM 0 HE21 GLN A 55 14.636 -21.579 -12.177 1.00 0.00 H new ATOM 0 HE22 GLN A 55 14.697 -22.343 -13.768 1.00 0.00 H new ATOM 806 N PHE A 56 20.835 -21.678 -9.546 1.00 0.00 N ATOM 807 CA PHE A 56 21.421 -20.618 -8.734 1.00 0.00 C ATOM 808 C PHE A 56 22.910 -20.465 -9.034 1.00 0.00 C ATOM 809 O PHE A 56 23.403 -19.355 -9.240 1.00 0.00 O ATOM 810 CB PHE A 56 21.217 -20.912 -7.246 1.00 0.00 C ATOM 811 CG PHE A 56 19.774 -20.904 -6.828 1.00 0.00 C ATOM 812 CD1 PHE A 56 18.917 -19.909 -7.268 1.00 0.00 C ATOM 813 CD2 PHE A 56 19.276 -21.891 -5.992 1.00 0.00 C ATOM 814 CE1 PHE A 56 17.589 -19.899 -6.884 1.00 0.00 C ATOM 815 CE2 PHE A 56 17.950 -21.887 -5.606 1.00 0.00 C ATOM 816 CZ PHE A 56 17.105 -20.889 -6.051 1.00 0.00 C ATOM 0 H PHE A 56 21.080 -22.622 -9.248 1.00 0.00 H new ATOM 0 HA PHE A 56 20.919 -19.684 -8.984 1.00 0.00 H new ATOM 0 HB2 PHE A 56 21.650 -21.885 -7.013 1.00 0.00 H new ATOM 0 HB3 PHE A 56 21.762 -20.172 -6.659 1.00 0.00 H new ATOM 0 HD1 PHE A 56 19.290 -19.132 -7.919 1.00 0.00 H new ATOM 0 HD2 PHE A 56 19.933 -22.672 -5.638 1.00 0.00 H new ATOM 0 HE1 PHE A 56 16.931 -19.118 -7.235 1.00 0.00 H new ATOM 0 HE2 PHE A 56 17.574 -22.664 -4.957 1.00 0.00 H new ATOM 0 HZ PHE A 56 16.068 -20.883 -5.748 1.00 0.00 H new ATOM 826 N LEU A 57 23.621 -21.587 -9.055 1.00 0.00 N ATOM 827 CA LEU A 57 25.054 -21.579 -9.328 1.00 0.00 C ATOM 828 C LEU A 57 25.406 -20.514 -10.362 1.00 0.00 C ATOM 829 O LEU A 57 24.574 -20.135 -11.185 1.00 0.00 O ATOM 830 CB LEU A 57 25.507 -22.955 -9.822 1.00 0.00 C ATOM 831 CG LEU A 57 25.792 -23.996 -8.740 1.00 0.00 C ATOM 832 CD1 LEU A 57 25.923 -25.382 -9.354 1.00 0.00 C ATOM 833 CD2 LEU A 57 27.052 -23.632 -7.969 1.00 0.00 C ATOM 0 H LEU A 57 23.229 -22.513 -8.886 1.00 0.00 H new ATOM 0 HA LEU A 57 25.574 -21.343 -8.399 1.00 0.00 H new ATOM 0 HB2 LEU A 57 24.739 -23.351 -10.486 1.00 0.00 H new ATOM 0 HB3 LEU A 57 26.409 -22.825 -10.420 1.00 0.00 H new ATOM 0 HG LEU A 57 24.954 -24.007 -8.043 1.00 0.00 H new ATOM 0 HD11 LEU A 57 26.126 -26.110 -8.569 1.00 0.00 H new ATOM 0 HD12 LEU A 57 24.995 -25.644 -9.861 1.00 0.00 H new ATOM 0 HD13 LEU A 57 26.743 -25.386 -10.073 1.00 0.00 H new ATOM 0 HD21 LEU A 57 27.240 -24.384 -7.203 1.00 0.00 H new ATOM 0 HD22 LEU A 57 27.899 -23.593 -8.654 1.00 0.00 H new ATOM 0 HD23 LEU A 57 26.921 -22.658 -7.497 1.00 0.00 H new ATOM 845 N GLY A 58 26.646 -20.036 -10.313 1.00 0.00 N ATOM 846 CA GLY A 58 27.086 -19.020 -11.251 1.00 0.00 C ATOM 847 C GLY A 58 26.658 -17.626 -10.840 1.00 0.00 C ATOM 848 O GLY A 58 27.428 -16.672 -10.954 1.00 0.00 O ATOM 0 H GLY A 58 27.353 -20.334 -9.641 1.00 0.00 H new ATOM 0 HA2 GLY A 58 28.172 -19.053 -11.334 1.00 0.00 H new ATOM 0 HA3 GLY A 58 26.684 -19.244 -12.239 1.00 0.00 H new ATOM 852 N LYS A 59 25.425 -17.505 -10.360 1.00 0.00 N ATOM 853 CA LYS A 59 24.894 -16.216 -9.930 1.00 0.00 C ATOM 854 C LYS A 59 25.226 -15.953 -8.466 1.00 0.00 C ATOM 855 O LYS A 59 25.617 -16.862 -7.735 1.00 0.00 O ATOM 856 CB LYS A 59 23.378 -16.172 -10.136 1.00 0.00 C ATOM 857 CG LYS A 59 22.934 -16.677 -11.499 1.00 0.00 C ATOM 858 CD LYS A 59 21.552 -17.307 -11.437 1.00 0.00 C ATOM 859 CE LYS A 59 20.459 -16.273 -11.661 1.00 0.00 C ATOM 860 NZ LYS A 59 20.145 -16.105 -13.107 1.00 0.00 N ATOM 0 H LYS A 59 24.774 -18.284 -10.259 1.00 0.00 H new ATOM 0 HA LYS A 59 25.360 -15.438 -10.535 1.00 0.00 H new ATOM 0 HB2 LYS A 59 22.897 -16.770 -9.362 1.00 0.00 H new ATOM 0 HB3 LYS A 59 23.032 -15.146 -10.007 1.00 0.00 H new ATOM 0 HG2 LYS A 59 22.927 -15.851 -12.210 1.00 0.00 H new ATOM 0 HG3 LYS A 59 23.652 -17.409 -11.869 1.00 0.00 H new ATOM 0 HD2 LYS A 59 21.474 -18.090 -12.191 1.00 0.00 H new ATOM 0 HD3 LYS A 59 21.411 -17.783 -10.467 1.00 0.00 H new ATOM 0 HE2 LYS A 59 19.558 -16.574 -11.126 1.00 0.00 H new ATOM 0 HE3 LYS A 59 20.773 -15.316 -11.244 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 19.396 -15.392 -13.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 20.998 -15.793 -13.614 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 19.821 -17.012 -13.500 1.00 0.00 H new ATOM 874 N ASN A 60 25.067 -14.703 -8.043 1.00 0.00 N ATOM 875 CA ASN A 60 25.349 -14.320 -6.664 1.00 0.00 C ATOM 876 C ASN A 60 24.062 -14.235 -5.849 1.00 0.00 C ATOM 877 O ASN A 60 22.967 -14.435 -6.374 1.00 0.00 O ATOM 878 CB ASN A 60 26.080 -12.976 -6.626 1.00 0.00 C ATOM 879 CG ASN A 60 27.043 -12.875 -5.459 1.00 0.00 C ATOM 880 OD1 ASN A 60 26.894 -13.572 -4.454 1.00 0.00 O ATOM 881 ND2 ASN A 60 28.037 -12.005 -5.586 1.00 0.00 N ATOM 0 H ASN A 60 24.744 -13.938 -8.635 1.00 0.00 H new ATOM 0 HA ASN A 60 25.987 -15.086 -6.223 1.00 0.00 H new ATOM 0 HB2 ASN A 60 26.627 -12.837 -7.558 1.00 0.00 H new ATOM 0 HB3 ASN A 60 25.349 -12.170 -6.562 1.00 0.00 H new ATOM 0 HD21 ASN A 60 28.716 -11.893 -4.833 1.00 0.00 H new ATOM 0 HD22 ASN A 60 28.122 -11.448 -6.436 1.00 0.00 H new ATOM 888 N VAL A 61 24.203 -13.938 -4.561 1.00 0.00 N ATOM 889 CA VAL A 61 23.053 -13.826 -3.672 1.00 0.00 C ATOM 890 C VAL A 61 22.019 -12.855 -4.232 1.00 0.00 C ATOM 891 O VAL A 61 20.816 -13.053 -4.066 1.00 0.00 O ATOM 892 CB VAL A 61 23.473 -13.355 -2.267 1.00 0.00 C ATOM 893 CG1 VAL A 61 24.022 -14.520 -1.455 1.00 0.00 C ATOM 894 CG2 VAL A 61 24.496 -12.234 -2.365 1.00 0.00 C ATOM 0 H VAL A 61 25.102 -13.771 -4.110 1.00 0.00 H new ATOM 0 HA VAL A 61 22.613 -14.820 -3.598 1.00 0.00 H new ATOM 0 HB VAL A 61 22.592 -12.968 -1.754 1.00 0.00 H new ATOM 0 HG11 VAL A 61 24.314 -14.168 -0.465 1.00 0.00 H new ATOM 0 HG12 VAL A 61 23.255 -15.288 -1.356 1.00 0.00 H new ATOM 0 HG13 VAL A 61 24.891 -14.939 -1.962 1.00 0.00 H new ATOM 0 HG21 VAL A 61 24.782 -11.913 -1.363 1.00 0.00 H new ATOM 0 HG22 VAL A 61 25.378 -12.592 -2.897 1.00 0.00 H new ATOM 0 HG23 VAL A 61 24.063 -11.392 -2.906 1.00 0.00 H new ATOM 904 N GLN A 62 22.496 -11.809 -4.897 1.00 0.00 N ATOM 905 CA GLN A 62 21.612 -10.807 -5.481 1.00 0.00 C ATOM 906 C GLN A 62 20.582 -11.460 -6.397 1.00 0.00 C ATOM 907 O GLN A 62 19.400 -11.115 -6.362 1.00 0.00 O ATOM 908 CB GLN A 62 22.424 -9.773 -6.263 1.00 0.00 C ATOM 909 CG GLN A 62 22.910 -8.611 -5.412 1.00 0.00 C ATOM 910 CD GLN A 62 23.754 -7.627 -6.196 1.00 0.00 C ATOM 911 OE1 GLN A 62 23.402 -7.239 -7.311 1.00 0.00 O ATOM 912 NE2 GLN A 62 24.875 -7.213 -5.616 1.00 0.00 N ATOM 0 H GLN A 62 23.490 -11.633 -5.045 1.00 0.00 H new ATOM 0 HA GLN A 62 21.085 -10.306 -4.669 1.00 0.00 H new ATOM 0 HB2 GLN A 62 23.284 -10.266 -6.716 1.00 0.00 H new ATOM 0 HB3 GLN A 62 21.814 -9.385 -7.078 1.00 0.00 H new ATOM 0 HG2 GLN A 62 22.050 -8.091 -4.989 1.00 0.00 H new ATOM 0 HG3 GLN A 62 23.492 -8.997 -4.575 1.00 0.00 H new ATOM 0 HE21 GLN A 62 25.129 -7.560 -4.691 1.00 0.00 H new ATOM 0 HE22 GLN A 62 25.482 -6.548 -6.096 1.00 0.00 H new ATOM 921 N ASP A 63 21.037 -12.403 -7.215 1.00 0.00 N ATOM 922 CA ASP A 63 20.154 -13.104 -8.139 1.00 0.00 C ATOM 923 C ASP A 63 19.092 -13.897 -7.382 1.00 0.00 C ATOM 924 O ASP A 63 17.899 -13.781 -7.664 1.00 0.00 O ATOM 925 CB ASP A 63 20.962 -14.041 -9.039 1.00 0.00 C ATOM 926 CG ASP A 63 21.520 -13.333 -10.258 1.00 0.00 C ATOM 927 OD1 ASP A 63 20.759 -13.129 -11.225 1.00 0.00 O ATOM 928 OD2 ASP A 63 22.720 -12.985 -10.245 1.00 0.00 O ATOM 0 H ASP A 63 22.012 -12.699 -7.257 1.00 0.00 H new ATOM 0 HA ASP A 63 19.653 -12.360 -8.758 1.00 0.00 H new ATOM 0 HB2 ASP A 63 21.782 -14.473 -8.466 1.00 0.00 H new ATOM 0 HB3 ASP A 63 20.328 -14.867 -9.361 1.00 0.00 H new ATOM 933 N ILE A 64 19.536 -14.701 -6.423 1.00 0.00 N ATOM 934 CA ILE A 64 18.623 -15.512 -5.625 1.00 0.00 C ATOM 935 C ILE A 64 17.627 -14.639 -4.871 1.00 0.00 C ATOM 936 O ILE A 64 16.416 -14.760 -5.053 1.00 0.00 O ATOM 937 CB ILE A 64 19.387 -16.391 -4.616 1.00 0.00 C ATOM 938 CG1 ILE A 64 20.253 -17.414 -5.351 1.00 0.00 C ATOM 939 CG2 ILE A 64 18.413 -17.088 -3.679 1.00 0.00 C ATOM 940 CD1 ILE A 64 21.640 -16.908 -5.681 1.00 0.00 C ATOM 0 H ILE A 64 20.520 -14.809 -6.179 1.00 0.00 H new ATOM 0 HA ILE A 64 18.083 -16.156 -6.320 1.00 0.00 H new ATOM 0 HB ILE A 64 20.040 -15.753 -4.021 1.00 0.00 H new ATOM 0 HG12 ILE A 64 20.339 -18.312 -4.739 1.00 0.00 H new ATOM 0 HG13 ILE A 64 19.752 -17.705 -6.274 1.00 0.00 H new ATOM 0 HG21 ILE A 64 18.967 -17.705 -2.972 1.00 0.00 H new ATOM 0 HG22 ILE A 64 17.835 -16.342 -3.134 1.00 0.00 H new ATOM 0 HG23 ILE A 64 17.738 -17.717 -4.259 1.00 0.00 H new ATOM 0 HD11 ILE A 64 22.197 -17.687 -6.202 1.00 0.00 H new ATOM 0 HD12 ILE A 64 21.564 -16.028 -6.320 1.00 0.00 H new ATOM 0 HD13 ILE A 64 22.160 -16.644 -4.760 1.00 0.00 H new ATOM 952 N LYS A 65 18.146 -13.756 -4.024 1.00 0.00 N ATOM 953 CA LYS A 65 17.303 -12.859 -3.243 1.00 0.00 C ATOM 954 C LYS A 65 16.185 -12.277 -4.102 1.00 0.00 C ATOM 955 O LYS A 65 15.059 -12.106 -3.639 1.00 0.00 O ATOM 956 CB LYS A 65 18.143 -11.728 -2.645 1.00 0.00 C ATOM 957 CG LYS A 65 18.811 -12.095 -1.331 1.00 0.00 C ATOM 958 CD LYS A 65 19.531 -10.905 -0.719 1.00 0.00 C ATOM 959 CE LYS A 65 19.640 -11.035 0.792 1.00 0.00 C ATOM 960 NZ LYS A 65 20.839 -10.332 1.324 1.00 0.00 N ATOM 0 H LYS A 65 19.147 -13.643 -3.861 1.00 0.00 H new ATOM 0 HA LYS A 65 16.853 -13.436 -2.435 1.00 0.00 H new ATOM 0 HB2 LYS A 65 18.909 -11.437 -3.364 1.00 0.00 H new ATOM 0 HB3 LYS A 65 17.506 -10.858 -2.488 1.00 0.00 H new ATOM 0 HG2 LYS A 65 18.061 -12.466 -0.632 1.00 0.00 H new ATOM 0 HG3 LYS A 65 19.521 -12.905 -1.497 1.00 0.00 H new ATOM 0 HD2 LYS A 65 20.528 -10.821 -1.151 1.00 0.00 H new ATOM 0 HD3 LYS A 65 18.997 -9.988 -0.969 1.00 0.00 H new ATOM 0 HE2 LYS A 65 18.743 -10.626 1.257 1.00 0.00 H new ATOM 0 HE3 LYS A 65 19.687 -12.090 1.063 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 20.877 -10.444 2.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 21.697 -10.739 0.899 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 20.782 -9.321 1.088 1.00 0.00 H new ATOM 974 N ASN A 66 16.506 -11.973 -5.356 1.00 0.00 N ATOM 975 CA ASN A 66 15.528 -11.411 -6.280 1.00 0.00 C ATOM 976 C ASN A 66 14.591 -12.494 -6.806 1.00 0.00 C ATOM 977 O ASN A 66 13.385 -12.459 -6.562 1.00 0.00 O ATOM 978 CB ASN A 66 16.236 -10.722 -7.448 1.00 0.00 C ATOM 979 CG ASN A 66 16.856 -9.397 -7.048 1.00 0.00 C ATOM 980 OD1 ASN A 66 16.198 -8.548 -6.446 1.00 0.00 O ATOM 981 ND2 ASN A 66 18.127 -9.213 -7.383 1.00 0.00 N ATOM 0 H ASN A 66 17.435 -12.106 -5.755 1.00 0.00 H new ATOM 0 HA ASN A 66 14.935 -10.674 -5.738 1.00 0.00 H new ATOM 0 HB2 ASN A 66 17.012 -11.380 -7.838 1.00 0.00 H new ATOM 0 HB3 ASN A 66 15.523 -10.557 -8.255 1.00 0.00 H new ATOM 0 HD21 ASN A 66 18.597 -8.340 -7.142 1.00 0.00 H new ATOM 0 HD22 ASN A 66 18.634 -9.944 -7.882 1.00 0.00 H new ATOM 988 N VAL A 67 15.155 -13.457 -7.529 1.00 0.00 N ATOM 989 CA VAL A 67 14.371 -14.551 -8.089 1.00 0.00 C ATOM 990 C VAL A 67 13.262 -14.978 -7.133 1.00 0.00 C ATOM 991 O VAL A 67 12.125 -15.204 -7.546 1.00 0.00 O ATOM 992 CB VAL A 67 15.257 -15.770 -8.407 1.00 0.00 C ATOM 993 CG1 VAL A 67 14.418 -16.909 -8.967 1.00 0.00 C ATOM 994 CG2 VAL A 67 16.363 -15.385 -9.377 1.00 0.00 C ATOM 0 H VAL A 67 16.152 -13.501 -7.740 1.00 0.00 H new ATOM 0 HA VAL A 67 13.927 -14.182 -9.014 1.00 0.00 H new ATOM 0 HB VAL A 67 15.719 -16.113 -7.481 1.00 0.00 H new ATOM 0 HG11 VAL A 67 15.061 -17.761 -9.186 1.00 0.00 H new ATOM 0 HG12 VAL A 67 13.665 -17.201 -8.234 1.00 0.00 H new ATOM 0 HG13 VAL A 67 13.925 -16.582 -9.883 1.00 0.00 H new ATOM 0 HG21 VAL A 67 16.980 -16.258 -9.591 1.00 0.00 H new ATOM 0 HG22 VAL A 67 15.922 -15.016 -10.303 1.00 0.00 H new ATOM 0 HG23 VAL A 67 16.981 -14.604 -8.933 1.00 0.00 H new ATOM 1004 N VAL A 68 13.602 -15.085 -5.852 1.00 0.00 N ATOM 1005 CA VAL A 68 12.635 -15.483 -4.836 1.00 0.00 C ATOM 1006 C VAL A 68 11.690 -14.336 -4.497 1.00 0.00 C ATOM 1007 O VAL A 68 10.479 -14.434 -4.699 1.00 0.00 O ATOM 1008 CB VAL A 68 13.336 -15.954 -3.548 1.00 0.00 C ATOM 1009 CG1 VAL A 68 12.313 -16.424 -2.524 1.00 0.00 C ATOM 1010 CG2 VAL A 68 14.336 -17.056 -3.860 1.00 0.00 C ATOM 0 H VAL A 68 14.539 -14.902 -5.494 1.00 0.00 H new ATOM 0 HA VAL A 68 12.061 -16.311 -5.252 1.00 0.00 H new ATOM 0 HB VAL A 68 13.880 -15.111 -3.121 1.00 0.00 H new ATOM 0 HG11 VAL A 68 12.827 -16.753 -1.621 1.00 0.00 H new ATOM 0 HG12 VAL A 68 11.639 -15.603 -2.279 1.00 0.00 H new ATOM 0 HG13 VAL A 68 11.739 -17.253 -2.937 1.00 0.00 H new ATOM 0 HG21 VAL A 68 14.822 -17.377 -2.939 1.00 0.00 H new ATOM 0 HG22 VAL A 68 13.817 -17.902 -4.310 1.00 0.00 H new ATOM 0 HG23 VAL A 68 15.087 -16.680 -4.555 1.00 0.00 H new ATOM 1020 N LEU A 69 12.250 -13.247 -3.981 1.00 0.00 N ATOM 1021 CA LEU A 69 11.458 -12.079 -3.614 1.00 0.00 C ATOM 1022 C LEU A 69 10.409 -11.776 -4.679 1.00 0.00 C ATOM 1023 O LEU A 69 9.314 -11.308 -4.369 1.00 0.00 O ATOM 1024 CB LEU A 69 12.366 -10.864 -3.416 1.00 0.00 C ATOM 1025 CG LEU A 69 11.660 -9.519 -3.249 1.00 0.00 C ATOM 1026 CD1 LEU A 69 11.177 -9.344 -1.818 1.00 0.00 C ATOM 1027 CD2 LEU A 69 12.586 -8.378 -3.645 1.00 0.00 C ATOM 0 H LEU A 69 13.250 -13.149 -3.807 1.00 0.00 H new ATOM 0 HA LEU A 69 10.945 -12.298 -2.677 1.00 0.00 H new ATOM 0 HB2 LEU A 69 12.986 -11.038 -2.536 1.00 0.00 H new ATOM 0 HB3 LEU A 69 13.039 -10.795 -4.271 1.00 0.00 H new ATOM 0 HG LEU A 69 10.792 -9.501 -3.908 1.00 0.00 H new ATOM 0 HD11 LEU A 69 10.677 -8.381 -1.718 1.00 0.00 H new ATOM 0 HD12 LEU A 69 10.479 -10.143 -1.569 1.00 0.00 H new ATOM 0 HD13 LEU A 69 12.029 -9.383 -1.139 1.00 0.00 H new ATOM 0 HD21 LEU A 69 12.067 -7.428 -3.520 1.00 0.00 H new ATOM 0 HD22 LEU A 69 13.473 -8.393 -3.012 1.00 0.00 H new ATOM 0 HD23 LEU A 69 12.882 -8.495 -4.687 1.00 0.00 H new ATOM 1039 N GLN A 70 10.752 -12.049 -5.934 1.00 0.00 N ATOM 1040 CA GLN A 70 9.837 -11.806 -7.044 1.00 0.00 C ATOM 1041 C GLN A 70 8.640 -12.748 -6.979 1.00 0.00 C ATOM 1042 O GLN A 70 7.499 -12.337 -7.199 1.00 0.00 O ATOM 1043 CB GLN A 70 10.565 -11.980 -8.379 1.00 0.00 C ATOM 1044 CG GLN A 70 11.569 -10.876 -8.672 1.00 0.00 C ATOM 1045 CD GLN A 70 10.988 -9.490 -8.468 1.00 0.00 C ATOM 1046 OE1 GLN A 70 10.084 -9.072 -9.191 1.00 0.00 O ATOM 1047 NE2 GLN A 70 11.506 -8.770 -7.481 1.00 0.00 N ATOM 0 H GLN A 70 11.655 -12.438 -6.207 1.00 0.00 H new ATOM 0 HA GLN A 70 9.474 -10.781 -6.966 1.00 0.00 H new ATOM 0 HB2 GLN A 70 11.082 -12.940 -8.379 1.00 0.00 H new ATOM 0 HB3 GLN A 70 9.830 -12.014 -9.183 1.00 0.00 H new ATOM 0 HG2 GLN A 70 12.438 -11.000 -8.026 1.00 0.00 H new ATOM 0 HG3 GLN A 70 11.919 -10.972 -9.700 1.00 0.00 H new ATOM 0 HE21 GLN A 70 12.255 -9.157 -6.906 1.00 0.00 H new ATOM 0 HE22 GLN A 70 11.155 -7.830 -7.297 1.00 0.00 H new ATOM 1056 N THR A 71 8.906 -14.015 -6.675 1.00 0.00 N ATOM 1057 CA THR A 71 7.850 -15.016 -6.583 1.00 0.00 C ATOM 1058 C THR A 71 6.755 -14.572 -5.621 1.00 0.00 C ATOM 1059 O THR A 71 5.578 -14.523 -5.983 1.00 0.00 O ATOM 1060 CB THR A 71 8.405 -16.376 -6.120 1.00 0.00 C ATOM 1061 OG1 THR A 71 9.558 -16.725 -6.894 1.00 0.00 O ATOM 1062 CG2 THR A 71 7.350 -17.465 -6.252 1.00 0.00 C ATOM 0 H THR A 71 9.843 -14.372 -6.488 1.00 0.00 H new ATOM 0 HA THR A 71 7.429 -15.125 -7.582 1.00 0.00 H new ATOM 0 HB THR A 71 8.686 -16.290 -5.070 1.00 0.00 H new ATOM 0 HG1 THR A 71 9.461 -17.640 -7.232 1.00 0.00 H new ATOM 0 HG21 THR A 71 7.765 -18.416 -5.919 1.00 0.00 H new ATOM 0 HG22 THR A 71 6.486 -17.211 -5.637 1.00 0.00 H new ATOM 0 HG23 THR A 71 7.042 -17.549 -7.294 1.00 0.00 H new ATOM 1070 N LEU A 72 7.146 -14.249 -4.394 1.00 0.00 N ATOM 1071 CA LEU A 72 6.197 -13.808 -3.378 1.00 0.00 C ATOM 1072 C LEU A 72 5.623 -12.438 -3.727 1.00 0.00 C ATOM 1073 O LEU A 72 4.409 -12.235 -3.689 1.00 0.00 O ATOM 1074 CB LEU A 72 6.873 -13.754 -2.007 1.00 0.00 C ATOM 1075 CG LEU A 72 7.420 -15.080 -1.478 1.00 0.00 C ATOM 1076 CD1 LEU A 72 8.327 -14.844 -0.279 1.00 0.00 C ATOM 1077 CD2 LEU A 72 6.280 -16.018 -1.109 1.00 0.00 C ATOM 0 H LEU A 72 8.115 -14.284 -4.078 1.00 0.00 H new ATOM 0 HA LEU A 72 5.379 -14.528 -3.345 1.00 0.00 H new ATOM 0 HB2 LEU A 72 7.694 -13.039 -2.056 1.00 0.00 H new ATOM 0 HB3 LEU A 72 6.155 -13.366 -1.285 1.00 0.00 H new ATOM 0 HG LEU A 72 8.009 -15.548 -2.267 1.00 0.00 H new ATOM 0 HD11 LEU A 72 8.707 -15.799 0.084 1.00 0.00 H new ATOM 0 HD12 LEU A 72 9.163 -14.210 -0.574 1.00 0.00 H new ATOM 0 HD13 LEU A 72 7.762 -14.354 0.514 1.00 0.00 H new ATOM 0 HD21 LEU A 72 6.688 -16.957 -0.734 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.664 -15.556 -0.337 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.670 -16.214 -1.991 1.00 0.00 H new ATOM 1089 N GLU A 73 6.503 -11.504 -4.071 1.00 0.00 N ATOM 1090 CA GLU A 73 6.083 -10.154 -4.429 1.00 0.00 C ATOM 1091 C GLU A 73 4.992 -10.189 -5.496 1.00 0.00 C ATOM 1092 O GLU A 73 3.891 -9.680 -5.291 1.00 0.00 O ATOM 1093 CB GLU A 73 7.277 -9.341 -4.932 1.00 0.00 C ATOM 1094 CG GLU A 73 8.069 -8.671 -3.821 1.00 0.00 C ATOM 1095 CD GLU A 73 7.381 -7.433 -3.279 1.00 0.00 C ATOM 1096 OE1 GLU A 73 6.160 -7.496 -3.025 1.00 0.00 O ATOM 1097 OE2 GLU A 73 8.065 -6.403 -3.108 1.00 0.00 O ATOM 0 H GLU A 73 7.511 -11.657 -4.110 1.00 0.00 H new ATOM 0 HA GLU A 73 5.679 -9.678 -3.536 1.00 0.00 H new ATOM 0 HB2 GLU A 73 7.941 -9.997 -5.495 1.00 0.00 H new ATOM 0 HB3 GLU A 73 6.921 -8.578 -5.624 1.00 0.00 H new ATOM 0 HG2 GLU A 73 8.222 -9.382 -3.009 1.00 0.00 H new ATOM 0 HG3 GLU A 73 9.056 -8.399 -4.196 1.00 0.00 H new ATOM 1104 N GLY A 74 5.308 -10.793 -6.638 1.00 0.00 N ATOM 1105 CA GLY A 74 4.346 -10.883 -7.720 1.00 0.00 C ATOM 1106 C GLY A 74 2.986 -11.361 -7.249 1.00 0.00 C ATOM 1107 O GLY A 74 1.969 -10.720 -7.514 1.00 0.00 O ATOM 0 H GLY A 74 6.213 -11.221 -6.832 1.00 0.00 H new ATOM 0 HA2 GLY A 74 4.241 -9.906 -8.191 1.00 0.00 H new ATOM 0 HA3 GLY A 74 4.724 -11.565 -8.482 1.00 0.00 H new ATOM 1111 N HIS A 75 2.968 -12.491 -6.551 1.00 0.00 N ATOM 1112 CA HIS A 75 1.722 -13.056 -6.043 1.00 0.00 C ATOM 1113 C HIS A 75 0.938 -12.014 -5.249 1.00 0.00 C ATOM 1114 O HIS A 75 -0.283 -11.912 -5.377 1.00 0.00 O ATOM 1115 CB HIS A 75 2.010 -14.273 -5.164 1.00 0.00 C ATOM 1116 CG HIS A 75 2.483 -15.468 -5.932 1.00 0.00 C ATOM 1117 ND1 HIS A 75 1.818 -15.967 -7.032 1.00 0.00 N ATOM 1118 CD2 HIS A 75 3.565 -16.263 -5.755 1.00 0.00 C ATOM 1119 CE1 HIS A 75 2.469 -17.019 -7.498 1.00 0.00 C ATOM 1120 NE2 HIS A 75 3.533 -17.219 -6.740 1.00 0.00 N ATOM 0 H HIS A 75 3.801 -13.034 -6.324 1.00 0.00 H new ATOM 0 HA HIS A 75 1.119 -13.368 -6.895 1.00 0.00 H new ATOM 0 HB2 HIS A 75 2.764 -14.006 -4.423 1.00 0.00 H new ATOM 0 HB3 HIS A 75 1.105 -14.538 -4.617 1.00 0.00 H new ATOM 0 HD1 HIS A 75 0.958 -15.584 -7.425 1.00 0.00 H new ATOM 0 HD2 HIS A 75 4.314 -16.164 -4.983 1.00 0.00 H new ATOM 0 HE1 HIS A 75 2.181 -17.613 -8.352 1.00 0.00 H new ATOM 1129 N LEU A 76 1.646 -11.245 -4.430 1.00 0.00 N ATOM 1130 CA LEU A 76 1.016 -10.213 -3.615 1.00 0.00 C ATOM 1131 C LEU A 76 0.141 -9.302 -4.470 1.00 0.00 C ATOM 1132 O LEU A 76 -1.046 -9.127 -4.194 1.00 0.00 O ATOM 1133 CB LEU A 76 2.081 -9.384 -2.893 1.00 0.00 C ATOM 1134 CG LEU A 76 1.623 -8.658 -1.628 1.00 0.00 C ATOM 1135 CD1 LEU A 76 1.247 -9.656 -0.545 1.00 0.00 C ATOM 1136 CD2 LEU A 76 2.708 -7.713 -1.133 1.00 0.00 C ATOM 0 H LEU A 76 2.657 -11.317 -4.313 1.00 0.00 H new ATOM 0 HA LEU A 76 0.384 -10.705 -2.876 1.00 0.00 H new ATOM 0 HB2 LEU A 76 2.909 -10.043 -2.630 1.00 0.00 H new ATOM 0 HB3 LEU A 76 2.472 -8.644 -3.591 1.00 0.00 H new ATOM 0 HG LEU A 76 0.739 -8.068 -1.871 1.00 0.00 H new ATOM 0 HD11 LEU A 76 0.924 -9.120 0.347 1.00 0.00 H new ATOM 0 HD12 LEU A 76 0.436 -10.291 -0.901 1.00 0.00 H new ATOM 0 HD13 LEU A 76 2.112 -10.274 -0.304 1.00 0.00 H new ATOM 0 HD21 LEU A 76 2.365 -7.205 -0.232 1.00 0.00 H new ATOM 0 HD22 LEU A 76 3.610 -8.281 -0.908 1.00 0.00 H new ATOM 0 HD23 LEU A 76 2.927 -6.975 -1.905 1.00 0.00 H new ATOM 1148 N ARG A 77 0.734 -8.726 -5.511 1.00 0.00 N ATOM 1149 CA ARG A 77 0.009 -7.834 -6.407 1.00 0.00 C ATOM 1150 C ARG A 77 -1.229 -8.523 -6.974 1.00 0.00 C ATOM 1151 O ARG A 77 -2.301 -7.925 -7.057 1.00 0.00 O ATOM 1152 CB ARG A 77 0.917 -7.374 -7.549 1.00 0.00 C ATOM 1153 CG ARG A 77 0.434 -6.111 -8.240 1.00 0.00 C ATOM 1154 CD ARG A 77 1.530 -5.487 -9.092 1.00 0.00 C ATOM 1155 NE ARG A 77 1.533 -6.015 -10.453 1.00 0.00 N ATOM 1156 CZ ARG A 77 2.639 -6.213 -11.162 1.00 0.00 C ATOM 1157 NH1 ARG A 77 3.824 -5.927 -10.640 1.00 0.00 N ATOM 1158 NH2 ARG A 77 2.561 -6.698 -12.394 1.00 0.00 N ATOM 0 H ARG A 77 1.715 -8.862 -5.754 1.00 0.00 H new ATOM 0 HA ARG A 77 -0.310 -6.964 -5.833 1.00 0.00 H new ATOM 0 HB2 ARG A 77 1.920 -7.203 -7.158 1.00 0.00 H new ATOM 0 HB3 ARG A 77 0.994 -8.174 -8.285 1.00 0.00 H new ATOM 0 HG2 ARG A 77 -0.427 -6.344 -8.867 1.00 0.00 H new ATOM 0 HG3 ARG A 77 0.099 -5.392 -7.493 1.00 0.00 H new ATOM 0 HD2 ARG A 77 1.394 -4.406 -9.123 1.00 0.00 H new ATOM 0 HD3 ARG A 77 2.499 -5.673 -8.629 1.00 0.00 H new ATOM 0 HE ARG A 77 0.637 -6.244 -10.883 1.00 0.00 H new ATOM 0 HH11 ARG A 77 3.887 -5.554 -9.693 1.00 0.00 H new ATOM 0 HH12 ARG A 77 4.672 -6.080 -11.186 1.00 0.00 H new ATOM 0 HH21 ARG A 77 1.651 -6.919 -12.798 1.00 0.00 H new ATOM 0 HH22 ARG A 77 3.411 -6.849 -12.937 1.00 0.00 H new ATOM 1172 N SER A 78 -1.072 -9.784 -7.363 1.00 0.00 N ATOM 1173 CA SER A 78 -2.176 -10.553 -7.926 1.00 0.00 C ATOM 1174 C SER A 78 -3.307 -10.703 -6.912 1.00 0.00 C ATOM 1175 O SER A 78 -4.438 -10.286 -7.163 1.00 0.00 O ATOM 1176 CB SER A 78 -1.689 -11.934 -8.371 1.00 0.00 C ATOM 1177 OG SER A 78 -2.746 -12.690 -8.936 1.00 0.00 O ATOM 0 H SER A 78 -0.192 -10.295 -7.299 1.00 0.00 H new ATOM 0 HA SER A 78 -2.557 -10.013 -8.793 1.00 0.00 H new ATOM 0 HB2 SER A 78 -0.887 -11.822 -9.101 1.00 0.00 H new ATOM 0 HB3 SER A 78 -1.271 -12.468 -7.518 1.00 0.00 H new ATOM 0 HG SER A 78 -2.409 -13.567 -9.214 1.00 0.00 H new ATOM 1183 N ILE A 79 -2.992 -11.301 -5.768 1.00 0.00 N ATOM 1184 CA ILE A 79 -3.980 -11.504 -4.717 1.00 0.00 C ATOM 1185 C ILE A 79 -4.546 -10.175 -4.230 1.00 0.00 C ATOM 1186 O ILE A 79 -5.693 -10.102 -3.786 1.00 0.00 O ATOM 1187 CB ILE A 79 -3.378 -12.263 -3.518 1.00 0.00 C ATOM 1188 CG1 ILE A 79 -2.668 -13.532 -3.994 1.00 0.00 C ATOM 1189 CG2 ILE A 79 -4.464 -12.604 -2.508 1.00 0.00 C ATOM 1190 CD1 ILE A 79 -3.581 -14.502 -4.710 1.00 0.00 C ATOM 0 H ILE A 79 -2.061 -11.653 -5.546 1.00 0.00 H new ATOM 0 HA ILE A 79 -4.783 -12.101 -5.150 1.00 0.00 H new ATOM 0 HB ILE A 79 -2.645 -11.620 -3.031 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -1.852 -13.254 -4.661 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -2.221 -14.033 -3.135 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -4.024 -13.140 -1.667 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -4.929 -11.686 -2.150 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -5.218 -13.231 -2.983 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -3.011 -15.378 -5.019 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -4.383 -14.810 -4.039 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -4.008 -14.019 -5.589 1.00 0.00 H new ATOM 1202 N LEU A 80 -3.737 -9.126 -4.317 1.00 0.00 N ATOM 1203 CA LEU A 80 -4.158 -7.796 -3.887 1.00 0.00 C ATOM 1204 C LEU A 80 -5.098 -7.167 -4.910 1.00 0.00 C ATOM 1205 O LEU A 80 -5.954 -6.352 -4.563 1.00 0.00 O ATOM 1206 CB LEU A 80 -2.939 -6.897 -3.676 1.00 0.00 C ATOM 1207 CG LEU A 80 -3.154 -5.674 -2.783 1.00 0.00 C ATOM 1208 CD1 LEU A 80 -1.823 -5.145 -2.273 1.00 0.00 C ATOM 1209 CD2 LEU A 80 -3.908 -4.589 -3.539 1.00 0.00 C ATOM 0 H LEU A 80 -2.785 -9.169 -4.681 1.00 0.00 H new ATOM 0 HA LEU A 80 -4.693 -7.898 -2.943 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -2.138 -7.499 -3.247 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -2.592 -6.554 -4.651 1.00 0.00 H new ATOM 0 HG LEU A 80 -3.754 -5.975 -1.924 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -1.996 -4.275 -1.640 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -1.321 -5.921 -1.695 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -1.197 -4.860 -3.118 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -4.053 -3.726 -2.889 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -3.334 -4.291 -4.416 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -4.878 -4.972 -3.854 1.00 0.00 H new ATOM 1221 N GLY A 81 -4.935 -7.551 -6.172 1.00 0.00 N ATOM 1222 CA GLY A 81 -5.778 -7.014 -7.225 1.00 0.00 C ATOM 1223 C GLY A 81 -7.224 -7.446 -7.087 1.00 0.00 C ATOM 1224 O GLY A 81 -8.129 -6.611 -7.039 1.00 0.00 O ATOM 0 H GLY A 81 -4.235 -8.224 -6.484 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -5.724 -5.925 -7.210 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -5.396 -7.338 -8.193 1.00 0.00 H new ATOM 1228 N THR A 82 -7.446 -8.756 -7.024 1.00 0.00 N ATOM 1229 CA THR A 82 -8.792 -9.298 -6.895 1.00 0.00 C ATOM 1230 C THR A 82 -9.399 -8.943 -5.542 1.00 0.00 C ATOM 1231 O THR A 82 -10.599 -9.114 -5.325 1.00 0.00 O ATOM 1232 CB THR A 82 -8.800 -10.829 -7.061 1.00 0.00 C ATOM 1233 OG1 THR A 82 -10.147 -11.316 -7.054 1.00 0.00 O ATOM 1234 CG2 THR A 82 -8.006 -11.499 -5.950 1.00 0.00 C ATOM 0 H THR A 82 -6.710 -9.461 -7.060 1.00 0.00 H new ATOM 0 HA THR A 82 -9.390 -8.851 -7.689 1.00 0.00 H new ATOM 0 HB THR A 82 -8.332 -11.071 -8.015 1.00 0.00 H new ATOM 0 HG1 THR A 82 -10.716 -10.698 -6.550 1.00 0.00 H new ATOM 0 HG21 THR A 82 -8.026 -12.580 -6.089 1.00 0.00 H new ATOM 0 HG22 THR A 82 -6.974 -11.149 -5.978 1.00 0.00 H new ATOM 0 HG23 THR A 82 -8.448 -11.249 -4.985 1.00 0.00 H new ATOM 1242 N LEU A 83 -8.565 -8.447 -4.636 1.00 0.00 N ATOM 1243 CA LEU A 83 -9.019 -8.066 -3.303 1.00 0.00 C ATOM 1244 C LEU A 83 -9.153 -6.552 -3.185 1.00 0.00 C ATOM 1245 O LEU A 83 -8.261 -5.805 -3.591 1.00 0.00 O ATOM 1246 CB LEU A 83 -8.049 -8.589 -2.242 1.00 0.00 C ATOM 1247 CG LEU A 83 -8.659 -8.925 -0.881 1.00 0.00 C ATOM 1248 CD1 LEU A 83 -9.575 -10.134 -0.991 1.00 0.00 C ATOM 1249 CD2 LEU A 83 -7.565 -9.173 0.147 1.00 0.00 C ATOM 0 H LEU A 83 -7.569 -8.299 -4.800 1.00 0.00 H new ATOM 0 HA LEU A 83 -10.000 -8.512 -3.140 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -7.565 -9.484 -2.631 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -7.268 -7.843 -2.093 1.00 0.00 H new ATOM 0 HG LEU A 83 -9.254 -8.074 -0.550 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -10.000 -10.359 -0.013 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -10.379 -9.919 -1.695 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -9.004 -10.992 -1.344 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -8.017 -9.411 1.110 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -6.943 -10.007 -0.178 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -6.950 -8.279 0.246 1.00 0.00 H new ATOM 1261 N THR A 84 -10.270 -6.102 -2.624 1.00 0.00 N ATOM 1262 CA THR A 84 -10.521 -4.677 -2.451 1.00 0.00 C ATOM 1263 C THR A 84 -9.680 -4.106 -1.313 1.00 0.00 C ATOM 1264 O THR A 84 -9.375 -4.801 -0.345 1.00 0.00 O ATOM 1265 CB THR A 84 -12.008 -4.398 -2.165 1.00 0.00 C ATOM 1266 OG1 THR A 84 -12.430 -5.125 -1.006 1.00 0.00 O ATOM 1267 CG2 THR A 84 -12.870 -4.787 -3.357 1.00 0.00 C ATOM 0 H THR A 84 -11.017 -6.706 -2.281 1.00 0.00 H new ATOM 0 HA THR A 84 -10.242 -4.191 -3.386 1.00 0.00 H new ATOM 0 HB THR A 84 -12.126 -3.330 -1.984 1.00 0.00 H new ATOM 0 HG1 THR A 84 -13.376 -4.940 -0.831 1.00 0.00 H new ATOM 0 HG21 THR A 84 -13.916 -4.581 -3.132 1.00 0.00 H new ATOM 0 HG22 THR A 84 -12.566 -4.209 -4.230 1.00 0.00 H new ATOM 0 HG23 THR A 84 -12.746 -5.850 -3.564 1.00 0.00 H new ATOM 1275 N VAL A 85 -9.311 -2.835 -1.438 1.00 0.00 N ATOM 1276 CA VAL A 85 -8.508 -2.170 -0.419 1.00 0.00 C ATOM 1277 C VAL A 85 -9.077 -2.413 0.975 1.00 0.00 C ATOM 1278 O VAL A 85 -8.331 -2.584 1.938 1.00 0.00 O ATOM 1279 CB VAL A 85 -8.426 -0.653 -0.671 1.00 0.00 C ATOM 1280 CG1 VAL A 85 -9.800 -0.092 -1.006 1.00 0.00 C ATOM 1281 CG2 VAL A 85 -7.833 0.057 0.537 1.00 0.00 C ATOM 0 H VAL A 85 -9.555 -2.246 -2.234 1.00 0.00 H new ATOM 0 HA VAL A 85 -7.506 -2.595 -0.478 1.00 0.00 H new ATOM 0 HB VAL A 85 -7.770 -0.480 -1.524 1.00 0.00 H new ATOM 0 HG11 VAL A 85 -9.722 0.981 -1.181 1.00 0.00 H new ATOM 0 HG12 VAL A 85 -10.183 -0.579 -1.903 1.00 0.00 H new ATOM 0 HG13 VAL A 85 -10.481 -0.276 -0.175 1.00 0.00 H new ATOM 0 HG21 VAL A 85 -7.783 1.128 0.341 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -8.461 -0.123 1.409 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -6.830 -0.325 0.727 1.00 0.00 H new ATOM 1291 N GLU A 86 -10.402 -2.427 1.073 1.00 0.00 N ATOM 1292 CA GLU A 86 -11.071 -2.650 2.349 1.00 0.00 C ATOM 1293 C GLU A 86 -10.769 -4.046 2.885 1.00 0.00 C ATOM 1294 O GLU A 86 -10.125 -4.197 3.923 1.00 0.00 O ATOM 1295 CB GLU A 86 -12.582 -2.464 2.198 1.00 0.00 C ATOM 1296 CG GLU A 86 -13.028 -1.013 2.267 1.00 0.00 C ATOM 1297 CD GLU A 86 -14.533 -0.860 2.175 1.00 0.00 C ATOM 1298 OE1 GLU A 86 -15.162 -1.625 1.415 1.00 0.00 O ATOM 1299 OE2 GLU A 86 -15.083 0.025 2.864 1.00 0.00 O ATOM 0 H GLU A 86 -11.033 -2.287 0.284 1.00 0.00 H new ATOM 0 HA GLU A 86 -10.692 -1.917 3.061 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -12.898 -2.887 1.244 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -13.089 -3.028 2.981 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -12.678 -0.574 3.201 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -12.560 -0.454 1.457 1.00 0.00 H new ATOM 1306 N GLN A 87 -11.240 -5.062 2.171 1.00 0.00 N ATOM 1307 CA GLN A 87 -11.023 -6.446 2.575 1.00 0.00 C ATOM 1308 C GLN A 87 -9.622 -6.632 3.149 1.00 0.00 C ATOM 1309 O GLN A 87 -9.457 -7.143 4.257 1.00 0.00 O ATOM 1310 CB GLN A 87 -11.229 -7.385 1.386 1.00 0.00 C ATOM 1311 CG GLN A 87 -12.691 -7.633 1.052 1.00 0.00 C ATOM 1312 CD GLN A 87 -12.876 -8.729 0.021 1.00 0.00 C ATOM 1313 OE1 GLN A 87 -12.533 -9.887 0.260 1.00 0.00 O ATOM 1314 NE2 GLN A 87 -13.423 -8.369 -1.135 1.00 0.00 N ATOM 0 H GLN A 87 -11.775 -4.953 1.309 1.00 0.00 H new ATOM 0 HA GLN A 87 -11.749 -6.690 3.351 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -10.732 -6.965 0.512 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -10.747 -8.339 1.599 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -13.227 -7.901 1.962 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -13.136 -6.710 0.680 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -13.693 -7.398 -1.291 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -13.573 -9.064 -1.866 1.00 0.00 H new ATOM 1323 N ILE A 88 -8.617 -6.213 2.388 1.00 0.00 N ATOM 1324 CA ILE A 88 -7.230 -6.334 2.821 1.00 0.00 C ATOM 1325 C ILE A 88 -7.088 -6.012 4.305 1.00 0.00 C ATOM 1326 O ILE A 88 -6.401 -6.721 5.041 1.00 0.00 O ATOM 1327 CB ILE A 88 -6.306 -5.402 2.015 1.00 0.00 C ATOM 1328 CG1 ILE A 88 -6.184 -5.893 0.571 1.00 0.00 C ATOM 1329 CG2 ILE A 88 -4.935 -5.320 2.669 1.00 0.00 C ATOM 1330 CD1 ILE A 88 -5.742 -4.818 -0.398 1.00 0.00 C ATOM 0 H ILE A 88 -8.737 -5.787 1.469 1.00 0.00 H new ATOM 0 HA ILE A 88 -6.933 -7.368 2.645 1.00 0.00 H new ATOM 0 HB ILE A 88 -6.742 -4.403 2.004 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -5.472 -6.718 0.535 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -7.147 -6.289 0.248 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -4.294 -4.658 2.088 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -5.038 -4.929 3.681 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -4.490 -6.314 2.707 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -5.677 -5.237 -1.402 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -6.465 -4.003 -0.391 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -4.765 -4.439 -0.100 1.00 0.00 H new ATOM 1342 N TYR A 89 -7.743 -4.940 4.738 1.00 0.00 N ATOM 1343 CA TYR A 89 -7.690 -4.524 6.134 1.00 0.00 C ATOM 1344 C TYR A 89 -8.516 -5.458 7.013 1.00 0.00 C ATOM 1345 O TYR A 89 -8.045 -5.933 8.046 1.00 0.00 O ATOM 1346 CB TYR A 89 -8.196 -3.088 6.280 1.00 0.00 C ATOM 1347 CG TYR A 89 -7.260 -2.054 5.696 1.00 0.00 C ATOM 1348 CD1 TYR A 89 -5.998 -1.845 6.239 1.00 0.00 C ATOM 1349 CD2 TYR A 89 -7.637 -1.287 4.601 1.00 0.00 C ATOM 1350 CE1 TYR A 89 -5.141 -0.901 5.710 1.00 0.00 C ATOM 1351 CE2 TYR A 89 -6.785 -0.341 4.064 1.00 0.00 C ATOM 1352 CZ TYR A 89 -5.538 -0.152 4.622 1.00 0.00 C ATOM 1353 OH TYR A 89 -4.686 0.789 4.091 1.00 0.00 O ATOM 0 H TYR A 89 -8.317 -4.344 4.142 1.00 0.00 H new ATOM 0 HA TYR A 89 -6.651 -4.571 6.461 1.00 0.00 H new ATOM 0 HB2 TYR A 89 -9.167 -3.003 5.793 1.00 0.00 H new ATOM 0 HB3 TYR A 89 -8.349 -2.871 7.337 1.00 0.00 H new ATOM 0 HD1 TYR A 89 -5.682 -2.431 7.089 1.00 0.00 H new ATOM 0 HD2 TYR A 89 -8.613 -1.433 4.162 1.00 0.00 H new ATOM 0 HE1 TYR A 89 -4.165 -0.750 6.146 1.00 0.00 H new ATOM 0 HE2 TYR A 89 -7.094 0.247 3.212 1.00 0.00 H new ATOM 0 HH TYR A 89 -3.936 0.935 4.705 1.00 0.00 H new ATOM 1363 N GLN A 90 -9.750 -5.717 6.593 1.00 0.00 N ATOM 1364 CA GLN A 90 -10.643 -6.594 7.341 1.00 0.00 C ATOM 1365 C GLN A 90 -9.865 -7.730 7.998 1.00 0.00 C ATOM 1366 O GLN A 90 -9.811 -7.829 9.224 1.00 0.00 O ATOM 1367 CB GLN A 90 -11.722 -7.165 6.420 1.00 0.00 C ATOM 1368 CG GLN A 90 -12.969 -6.299 6.332 1.00 0.00 C ATOM 1369 CD GLN A 90 -13.693 -6.185 7.659 1.00 0.00 C ATOM 1370 OE1 GLN A 90 -13.690 -5.129 8.292 1.00 0.00 O ATOM 1371 NE2 GLN A 90 -14.320 -7.274 8.087 1.00 0.00 N ATOM 0 H GLN A 90 -10.154 -5.332 5.739 1.00 0.00 H new ATOM 0 HA GLN A 90 -11.119 -6.004 8.124 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -11.306 -7.290 5.420 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -12.003 -8.157 6.775 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -12.692 -5.303 5.987 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -13.646 -6.718 5.587 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -14.296 -8.128 7.530 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -14.825 -7.257 8.973 1.00 0.00 H new ATOM 1380 N ASP A 91 -9.267 -8.583 7.175 1.00 0.00 N ATOM 1381 CA ASP A 91 -8.492 -9.712 7.676 1.00 0.00 C ATOM 1382 C ASP A 91 -7.114 -9.759 7.022 1.00 0.00 C ATOM 1383 O ASP A 91 -6.927 -10.406 5.992 1.00 0.00 O ATOM 1384 CB ASP A 91 -9.236 -11.024 7.420 1.00 0.00 C ATOM 1385 CG ASP A 91 -10.737 -10.878 7.576 1.00 0.00 C ATOM 1386 OD1 ASP A 91 -11.169 -10.103 8.454 1.00 0.00 O ATOM 1387 OD2 ASP A 91 -11.480 -11.538 6.820 1.00 0.00 O ATOM 0 H ASP A 91 -9.304 -8.515 6.158 1.00 0.00 H new ATOM 0 HA ASP A 91 -8.361 -9.581 8.750 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -9.011 -11.376 6.413 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -8.874 -11.785 8.112 1.00 0.00 H new ATOM 1392 N ARG A 92 -6.154 -9.068 7.628 1.00 0.00 N ATOM 1393 CA ARG A 92 -4.794 -9.029 7.102 1.00 0.00 C ATOM 1394 C ARG A 92 -4.174 -10.423 7.095 1.00 0.00 C ATOM 1395 O ARG A 92 -3.740 -10.916 6.053 1.00 0.00 O ATOM 1396 CB ARG A 92 -3.931 -8.079 7.934 1.00 0.00 C ATOM 1397 CG ARG A 92 -4.293 -6.613 7.756 1.00 0.00 C ATOM 1398 CD ARG A 92 -3.166 -5.701 8.216 1.00 0.00 C ATOM 1399 NE ARG A 92 -2.821 -5.923 9.618 1.00 0.00 N ATOM 1400 CZ ARG A 92 -2.062 -5.097 10.328 1.00 0.00 C ATOM 1401 NH1 ARG A 92 -1.572 -3.998 9.771 1.00 0.00 N ATOM 1402 NH2 ARG A 92 -1.792 -5.367 11.598 1.00 0.00 N ATOM 0 H ARG A 92 -6.292 -8.528 8.482 1.00 0.00 H new ATOM 0 HA ARG A 92 -4.838 -8.665 6.076 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -4.027 -8.343 8.987 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -2.885 -8.221 7.664 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -4.516 -6.417 6.707 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -5.198 -6.389 8.322 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -2.286 -5.870 7.595 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -3.461 -4.661 8.075 1.00 0.00 H new ATOM 0 HE ARG A 92 -3.183 -6.759 10.077 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -1.778 -3.786 8.795 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -0.989 -3.365 10.319 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -2.168 -6.211 12.031 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -1.209 -4.731 12.142 1.00 0.00 H new ATOM 1416 N ASP A 93 -4.134 -11.053 8.264 1.00 0.00 N ATOM 1417 CA ASP A 93 -3.567 -12.391 8.393 1.00 0.00 C ATOM 1418 C ASP A 93 -4.071 -13.304 7.280 1.00 0.00 C ATOM 1419 O ASP A 93 -3.307 -14.081 6.708 1.00 0.00 O ATOM 1420 CB ASP A 93 -3.917 -12.986 9.757 1.00 0.00 C ATOM 1421 CG ASP A 93 -2.944 -12.565 10.841 1.00 0.00 C ATOM 1422 OD1 ASP A 93 -1.778 -13.010 10.798 1.00 0.00 O ATOM 1423 OD2 ASP A 93 -3.348 -11.788 11.731 1.00 0.00 O ATOM 0 H ASP A 93 -4.487 -10.659 9.136 1.00 0.00 H new ATOM 0 HA ASP A 93 -2.483 -12.310 8.308 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -4.924 -12.677 10.037 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -3.926 -14.074 9.684 1.00 0.00 H new ATOM 1428 N GLN A 94 -5.362 -13.205 6.981 1.00 0.00 N ATOM 1429 CA GLN A 94 -5.968 -14.025 5.937 1.00 0.00 C ATOM 1430 C GLN A 94 -5.327 -13.743 4.582 1.00 0.00 C ATOM 1431 O GLN A 94 -4.942 -14.665 3.863 1.00 0.00 O ATOM 1432 CB GLN A 94 -7.474 -13.765 5.866 1.00 0.00 C ATOM 1433 CG GLN A 94 -8.253 -14.881 5.189 1.00 0.00 C ATOM 1434 CD GLN A 94 -7.956 -16.244 5.785 1.00 0.00 C ATOM 1435 OE1 GLN A 94 -7.326 -17.109 4.998 1.00 0.00 O flip ATOM 1436 NE2 GLN A 94 -8.290 -16.516 6.938 1.00 0.00 N flip ATOM 0 H GLN A 94 -6.008 -12.567 7.445 1.00 0.00 H new ATOM 0 HA GLN A 94 -5.798 -15.072 6.188 1.00 0.00 H new ATOM 0 HB2 GLN A 94 -7.858 -13.626 6.877 1.00 0.00 H new ATOM 0 HB3 GLN A 94 -7.648 -12.833 5.328 1.00 0.00 H new ATOM 0 HG2 GLN A 94 -9.320 -14.677 5.273 1.00 0.00 H new ATOM 0 HG3 GLN A 94 -8.013 -14.893 4.126 1.00 0.00 H new ATOM 0 HE21 GLN A 94 -8.772 -15.820 7.507 1.00 0.00 H new ATOM 0 HE22 GLN A 94 -8.084 -17.437 7.325 1.00 0.00 H new ATOM 1445 N PHE A 95 -5.216 -12.464 4.240 1.00 0.00 N ATOM 1446 CA PHE A 95 -4.623 -12.061 2.971 1.00 0.00 C ATOM 1447 C PHE A 95 -3.272 -12.740 2.762 1.00 0.00 C ATOM 1448 O PHE A 95 -3.091 -13.507 1.816 1.00 0.00 O ATOM 1449 CB PHE A 95 -4.454 -10.541 2.922 1.00 0.00 C ATOM 1450 CG PHE A 95 -3.870 -10.043 1.631 1.00 0.00 C ATOM 1451 CD1 PHE A 95 -4.384 -10.464 0.414 1.00 0.00 C ATOM 1452 CD2 PHE A 95 -2.806 -9.156 1.633 1.00 0.00 C ATOM 1453 CE1 PHE A 95 -3.849 -10.008 -0.776 1.00 0.00 C ATOM 1454 CE2 PHE A 95 -2.266 -8.696 0.446 1.00 0.00 C ATOM 1455 CZ PHE A 95 -2.788 -9.124 -0.759 1.00 0.00 C ATOM 0 H PHE A 95 -5.529 -11.689 4.824 1.00 0.00 H new ATOM 0 HA PHE A 95 -5.295 -12.371 2.171 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -5.425 -10.071 3.077 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -3.813 -10.228 3.746 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -5.212 -11.157 0.396 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -2.393 -8.820 2.573 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -4.260 -10.342 -1.717 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -1.438 -8.003 0.461 1.00 0.00 H new ATOM 0 HZ PHE A 95 -2.367 -8.768 -1.687 1.00 0.00 H new ATOM 1465 N ALA A 96 -2.327 -12.453 3.651 1.00 0.00 N ATOM 1466 CA ALA A 96 -0.995 -13.036 3.566 1.00 0.00 C ATOM 1467 C ALA A 96 -1.068 -14.547 3.369 1.00 0.00 C ATOM 1468 O ALA A 96 -0.350 -15.111 2.544 1.00 0.00 O ATOM 1469 CB ALA A 96 -0.192 -12.703 4.815 1.00 0.00 C ATOM 0 H ALA A 96 -2.460 -11.819 4.439 1.00 0.00 H new ATOM 0 HA ALA A 96 -0.493 -12.607 2.699 1.00 0.00 H new ATOM 0 HB1 ALA A 96 0.801 -13.145 4.738 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -0.101 -11.621 4.911 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -0.700 -13.104 5.692 1.00 0.00 H new ATOM 1475 N LYS A 97 -1.940 -15.196 4.132 1.00 0.00 N ATOM 1476 CA LYS A 97 -2.108 -16.642 4.041 1.00 0.00 C ATOM 1477 C LYS A 97 -2.292 -17.078 2.591 1.00 0.00 C ATOM 1478 O LYS A 97 -1.777 -18.117 2.175 1.00 0.00 O ATOM 1479 CB LYS A 97 -3.311 -17.089 4.876 1.00 0.00 C ATOM 1480 CG LYS A 97 -3.197 -18.513 5.391 1.00 0.00 C ATOM 1481 CD LYS A 97 -4.477 -18.963 6.077 1.00 0.00 C ATOM 1482 CE LYS A 97 -4.648 -18.289 7.430 1.00 0.00 C ATOM 1483 NZ LYS A 97 -3.757 -18.885 8.463 1.00 0.00 N ATOM 0 H LYS A 97 -2.542 -14.744 4.821 1.00 0.00 H new ATOM 0 HA LYS A 97 -1.206 -17.113 4.432 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -3.426 -16.413 5.723 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -4.215 -17.001 4.273 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -2.973 -19.184 4.562 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -2.364 -18.582 6.091 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -5.332 -18.731 5.443 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -4.461 -20.045 6.207 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -4.433 -17.225 7.335 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -5.686 -18.377 7.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -3.975 -18.469 9.391 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -3.908 -19.913 8.500 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -2.765 -18.689 8.220 1.00 0.00 H new ATOM 1497 N LEU A 98 -3.028 -16.279 1.826 1.00 0.00 N ATOM 1498 CA LEU A 98 -3.278 -16.582 0.422 1.00 0.00 C ATOM 1499 C LEU A 98 -2.006 -16.421 -0.405 1.00 0.00 C ATOM 1500 O LEU A 98 -1.693 -17.258 -1.251 1.00 0.00 O ATOM 1501 CB LEU A 98 -4.377 -15.671 -0.129 1.00 0.00 C ATOM 1502 CG LEU A 98 -5.633 -15.539 0.732 1.00 0.00 C ATOM 1503 CD1 LEU A 98 -6.665 -14.661 0.040 1.00 0.00 C ATOM 1504 CD2 LEU A 98 -6.216 -16.910 1.039 1.00 0.00 C ATOM 0 H LEU A 98 -3.462 -15.416 2.155 1.00 0.00 H new ATOM 0 HA LEU A 98 -3.606 -17.619 0.353 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -3.956 -14.676 -0.277 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -4.671 -16.043 -1.111 1.00 0.00 H new ATOM 0 HG LEU A 98 -5.356 -15.065 1.674 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.552 -14.579 0.668 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -6.245 -13.669 -0.127 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -6.938 -15.106 -0.917 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -7.110 -16.796 1.653 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -6.477 -17.411 0.107 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -5.479 -17.506 1.577 1.00 0.00 H new ATOM 1516 N VAL A 99 -1.276 -15.339 -0.153 1.00 0.00 N ATOM 1517 CA VAL A 99 -0.036 -15.069 -0.872 1.00 0.00 C ATOM 1518 C VAL A 99 0.988 -16.174 -0.635 1.00 0.00 C ATOM 1519 O VAL A 99 1.697 -16.584 -1.554 1.00 0.00 O ATOM 1520 CB VAL A 99 0.575 -13.720 -0.451 1.00 0.00 C ATOM 1521 CG1 VAL A 99 1.865 -13.456 -1.213 1.00 0.00 C ATOM 1522 CG2 VAL A 99 -0.424 -12.593 -0.669 1.00 0.00 C ATOM 0 H VAL A 99 -1.522 -14.635 0.543 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.287 -15.031 -1.932 1.00 0.00 H new ATOM 0 HB VAL A 99 0.813 -13.764 0.612 1.00 0.00 H new ATOM 0 HG11 VAL A 99 2.282 -12.498 -0.902 1.00 0.00 H new ATOM 0 HG12 VAL A 99 2.582 -14.250 -1.001 1.00 0.00 H new ATOM 0 HG13 VAL A 99 1.657 -13.431 -2.283 1.00 0.00 H new ATOM 0 HG21 VAL A 99 0.024 -11.646 -0.366 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -0.695 -12.546 -1.724 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -1.318 -12.779 -0.073 1.00 0.00 H new ATOM 1532 N ARG A 100 1.059 -16.652 0.603 1.00 0.00 N ATOM 1533 CA ARG A 100 1.997 -17.710 0.961 1.00 0.00 C ATOM 1534 C ARG A 100 1.501 -19.066 0.469 1.00 0.00 C ATOM 1535 O ARG A 100 2.293 -19.920 0.070 1.00 0.00 O ATOM 1536 CB ARG A 100 2.199 -17.748 2.477 1.00 0.00 C ATOM 1537 CG ARG A 100 1.167 -18.592 3.208 1.00 0.00 C ATOM 1538 CD ARG A 100 1.549 -18.800 4.665 1.00 0.00 C ATOM 1539 NE ARG A 100 1.268 -17.621 5.479 1.00 0.00 N ATOM 1540 CZ ARG A 100 1.110 -17.659 6.797 1.00 0.00 C ATOM 1541 NH1 ARG A 100 1.206 -18.811 7.447 1.00 0.00 N ATOM 1542 NH2 ARG A 100 0.855 -16.543 7.468 1.00 0.00 N ATOM 0 H ARG A 100 0.479 -16.324 1.375 1.00 0.00 H new ATOM 0 HA ARG A 100 2.951 -17.495 0.479 1.00 0.00 H new ATOM 0 HB2 ARG A 100 3.194 -18.138 2.693 1.00 0.00 H new ATOM 0 HB3 ARG A 100 2.164 -16.730 2.865 1.00 0.00 H new ATOM 0 HG2 ARG A 100 0.193 -18.107 3.152 1.00 0.00 H new ATOM 0 HG3 ARG A 100 1.070 -19.559 2.714 1.00 0.00 H new ATOM 0 HD2 ARG A 100 1.003 -19.655 5.064 1.00 0.00 H new ATOM 0 HD3 ARG A 100 2.610 -19.041 4.731 1.00 0.00 H new ATOM 0 HE ARG A 100 1.189 -16.719 5.010 1.00 0.00 H new ATOM 0 HH11 ARG A 100 1.402 -19.671 6.935 1.00 0.00 H new ATOM 0 HH12 ARG A 100 1.084 -18.837 8.459 1.00 0.00 H new ATOM 0 HH21 ARG A 100 0.780 -15.655 6.971 1.00 0.00 H new ATOM 0 HH22 ARG A 100 0.734 -16.573 8.480 1.00 0.00 H new ATOM 1556 N GLU A 101 0.186 -19.256 0.499 1.00 0.00 N ATOM 1557 CA GLU A 101 -0.414 -20.509 0.057 1.00 0.00 C ATOM 1558 C GLU A 101 -0.260 -20.685 -1.451 1.00 0.00 C ATOM 1559 O GLU A 101 0.049 -21.775 -1.932 1.00 0.00 O ATOM 1560 CB GLU A 101 -1.896 -20.553 0.437 1.00 0.00 C ATOM 1561 CG GLU A 101 -2.150 -21.081 1.839 1.00 0.00 C ATOM 1562 CD GLU A 101 -3.622 -21.312 2.118 1.00 0.00 C ATOM 1563 OE1 GLU A 101 -4.460 -20.678 1.443 1.00 0.00 O ATOM 1564 OE2 GLU A 101 -3.937 -22.126 3.011 1.00 0.00 O ATOM 0 H GLU A 101 -0.484 -18.559 0.824 1.00 0.00 H new ATOM 0 HA GLU A 101 0.107 -21.326 0.556 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -2.313 -19.549 0.355 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -2.428 -21.179 -0.280 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -1.607 -22.017 1.975 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -1.753 -20.374 2.567 1.00 0.00 H new ATOM 1571 N VAL A 102 -0.476 -19.602 -2.192 1.00 0.00 N ATOM 1572 CA VAL A 102 -0.360 -19.634 -3.645 1.00 0.00 C ATOM 1573 C VAL A 102 1.101 -19.640 -4.080 1.00 0.00 C ATOM 1574 O VAL A 102 1.436 -20.124 -5.162 1.00 0.00 O ATOM 1575 CB VAL A 102 -1.072 -18.432 -4.292 1.00 0.00 C ATOM 1576 CG1 VAL A 102 -0.436 -17.127 -3.837 1.00 0.00 C ATOM 1577 CG2 VAL A 102 -1.043 -18.549 -5.808 1.00 0.00 C ATOM 0 H VAL A 102 -0.732 -18.692 -1.809 1.00 0.00 H new ATOM 0 HA VAL A 102 -0.839 -20.554 -3.980 1.00 0.00 H new ATOM 0 HB VAL A 102 -2.114 -18.432 -3.971 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -0.952 -16.288 -4.304 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -0.514 -17.043 -2.753 1.00 0.00 H new ATOM 0 HG13 VAL A 102 0.615 -17.114 -4.127 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -1.551 -17.691 -6.249 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -0.009 -18.574 -6.151 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -1.549 -19.465 -6.112 1.00 0.00 H new ATOM 1587 N ALA A 103 1.968 -19.101 -3.229 1.00 0.00 N ATOM 1588 CA ALA A 103 3.395 -19.047 -3.524 1.00 0.00 C ATOM 1589 C ALA A 103 4.096 -20.326 -3.080 1.00 0.00 C ATOM 1590 O ALA A 103 5.060 -20.766 -3.706 1.00 0.00 O ATOM 1591 CB ALA A 103 4.026 -17.835 -2.853 1.00 0.00 C ATOM 0 H ALA A 103 1.707 -18.696 -2.330 1.00 0.00 H new ATOM 0 HA ALA A 103 3.516 -18.955 -4.603 1.00 0.00 H new ATOM 0 HB1 ALA A 103 5.091 -17.806 -3.081 1.00 0.00 H new ATOM 0 HB2 ALA A 103 3.551 -16.926 -3.223 1.00 0.00 H new ATOM 0 HB3 ALA A 103 3.888 -17.903 -1.774 1.00 0.00 H new ATOM 1597 N ALA A 104 3.608 -20.917 -1.995 1.00 0.00 N ATOM 1598 CA ALA A 104 4.188 -22.146 -1.468 1.00 0.00 C ATOM 1599 C ALA A 104 4.456 -23.149 -2.585 1.00 0.00 C ATOM 1600 O ALA A 104 5.580 -23.616 -2.776 1.00 0.00 O ATOM 1601 CB ALA A 104 3.270 -22.756 -0.419 1.00 0.00 C ATOM 0 H ALA A 104 2.812 -20.565 -1.463 1.00 0.00 H new ATOM 0 HA ALA A 104 5.141 -21.897 -1.001 1.00 0.00 H new ATOM 0 HB1 ALA A 104 3.716 -23.673 -0.034 1.00 0.00 H new ATOM 0 HB2 ALA A 104 3.132 -22.049 0.399 1.00 0.00 H new ATOM 0 HB3 ALA A 104 2.304 -22.983 -0.869 1.00 0.00 H new ATOM 1607 N PRO A 105 3.403 -23.490 -3.342 1.00 0.00 N ATOM 1608 CA PRO A 105 3.501 -24.441 -4.453 1.00 0.00 C ATOM 1609 C PRO A 105 4.289 -23.877 -5.631 1.00 0.00 C ATOM 1610 O PRO A 105 4.775 -24.625 -6.479 1.00 0.00 O ATOM 1611 CB PRO A 105 2.042 -24.675 -4.849 1.00 0.00 C ATOM 1612 CG PRO A 105 1.328 -23.443 -4.413 1.00 0.00 C ATOM 1613 CD PRO A 105 2.034 -22.972 -3.172 1.00 0.00 C ATOM 0 HA PRO A 105 4.030 -25.350 -4.166 1.00 0.00 H new ATOM 0 HB2 PRO A 105 1.944 -24.830 -5.923 1.00 0.00 H new ATOM 0 HB3 PRO A 105 1.637 -25.561 -4.361 1.00 0.00 H new ATOM 0 HG2 PRO A 105 1.356 -22.680 -5.191 1.00 0.00 H new ATOM 0 HG3 PRO A 105 0.278 -23.652 -4.209 1.00 0.00 H new ATOM 0 HD2 PRO A 105 2.023 -21.885 -3.091 1.00 0.00 H new ATOM 0 HD3 PRO A 105 1.565 -23.364 -2.269 1.00 0.00 H new ATOM 1621 N ASP A 106 4.411 -22.555 -5.676 1.00 0.00 N ATOM 1622 CA ASP A 106 5.141 -21.892 -6.750 1.00 0.00 C ATOM 1623 C ASP A 106 6.646 -21.977 -6.516 1.00 0.00 C ATOM 1624 O ASP A 106 7.379 -22.546 -7.325 1.00 0.00 O ATOM 1625 CB ASP A 106 4.711 -20.428 -6.859 1.00 0.00 C ATOM 1626 CG ASP A 106 3.487 -20.248 -7.735 1.00 0.00 C ATOM 1627 OD1 ASP A 106 2.384 -20.637 -7.298 1.00 0.00 O ATOM 1628 OD2 ASP A 106 3.632 -19.719 -8.857 1.00 0.00 O ATOM 0 H ASP A 106 4.014 -21.922 -4.982 1.00 0.00 H new ATOM 0 HA ASP A 106 4.907 -22.402 -7.685 1.00 0.00 H new ATOM 0 HB2 ASP A 106 4.502 -20.039 -5.863 1.00 0.00 H new ATOM 0 HB3 ASP A 106 5.534 -19.840 -7.265 1.00 0.00 H new ATOM 1633 N VAL A 107 7.101 -21.407 -5.405 1.00 0.00 N ATOM 1634 CA VAL A 107 8.519 -21.418 -5.064 1.00 0.00 C ATOM 1635 C VAL A 107 9.112 -22.812 -5.229 1.00 0.00 C ATOM 1636 O VAL A 107 10.244 -22.967 -5.683 1.00 0.00 O ATOM 1637 CB VAL A 107 8.753 -20.939 -3.619 1.00 0.00 C ATOM 1638 CG1 VAL A 107 8.601 -19.428 -3.526 1.00 0.00 C ATOM 1639 CG2 VAL A 107 7.796 -21.638 -2.665 1.00 0.00 C ATOM 0 H VAL A 107 6.508 -20.931 -4.725 1.00 0.00 H new ATOM 0 HA VAL A 107 9.015 -20.732 -5.750 1.00 0.00 H new ATOM 0 HB VAL A 107 9.772 -21.197 -3.330 1.00 0.00 H new ATOM 0 HG11 VAL A 107 8.770 -19.108 -2.498 1.00 0.00 H new ATOM 0 HG12 VAL A 107 9.329 -18.948 -4.180 1.00 0.00 H new ATOM 0 HG13 VAL A 107 7.595 -19.144 -3.834 1.00 0.00 H new ATOM 0 HG21 VAL A 107 7.975 -21.288 -1.648 1.00 0.00 H new ATOM 0 HG22 VAL A 107 6.768 -21.413 -2.951 1.00 0.00 H new ATOM 0 HG23 VAL A 107 7.958 -22.715 -2.712 1.00 0.00 H new ATOM 1649 N GLY A 108 8.338 -23.827 -4.855 1.00 0.00 N ATOM 1650 CA GLY A 108 8.805 -25.197 -4.969 1.00 0.00 C ATOM 1651 C GLY A 108 9.403 -25.494 -6.329 1.00 0.00 C ATOM 1652 O GLY A 108 10.284 -26.345 -6.455 1.00 0.00 O ATOM 0 H GLY A 108 7.397 -23.725 -4.475 1.00 0.00 H new ATOM 0 HA2 GLY A 108 9.551 -25.389 -4.198 1.00 0.00 H new ATOM 0 HA3 GLY A 108 7.974 -25.878 -4.785 1.00 0.00 H new ATOM 1656 N ARG A 109 8.923 -24.793 -7.352 1.00 0.00 N ATOM 1657 CA ARG A 109 9.414 -24.989 -8.710 1.00 0.00 C ATOM 1658 C ARG A 109 10.910 -24.700 -8.794 1.00 0.00 C ATOM 1659 O ARG A 109 11.668 -25.467 -9.385 1.00 0.00 O ATOM 1660 CB ARG A 109 8.654 -24.088 -9.685 1.00 0.00 C ATOM 1661 CG ARG A 109 7.219 -24.527 -9.927 1.00 0.00 C ATOM 1662 CD ARG A 109 6.507 -23.595 -10.897 1.00 0.00 C ATOM 1663 NE ARG A 109 5.319 -24.213 -11.477 1.00 0.00 N ATOM 1664 CZ ARG A 109 5.356 -25.069 -12.492 1.00 0.00 C ATOM 1665 NH1 ARG A 109 6.517 -25.407 -13.036 1.00 0.00 N ATOM 1666 NH2 ARG A 109 4.230 -25.589 -12.964 1.00 0.00 N ATOM 0 H ARG A 109 8.195 -24.084 -7.265 1.00 0.00 H new ATOM 0 HA ARG A 109 9.247 -26.031 -8.983 1.00 0.00 H new ATOM 0 HB2 ARG A 109 8.653 -23.069 -9.299 1.00 0.00 H new ATOM 0 HB3 ARG A 109 9.184 -24.068 -10.637 1.00 0.00 H new ATOM 0 HG2 ARG A 109 7.210 -25.542 -10.323 1.00 0.00 H new ATOM 0 HG3 ARG A 109 6.680 -24.550 -8.980 1.00 0.00 H new ATOM 0 HD2 ARG A 109 6.223 -22.680 -10.378 1.00 0.00 H new ATOM 0 HD3 ARG A 109 7.193 -23.309 -11.694 1.00 0.00 H new ATOM 0 HE ARG A 109 4.410 -23.974 -11.081 1.00 0.00 H new ATOM 0 HH11 ARG A 109 7.384 -25.009 -12.675 1.00 0.00 H new ATOM 0 HH12 ARG A 109 6.543 -26.065 -13.815 1.00 0.00 H new ATOM 0 HH21 ARG A 109 3.335 -25.331 -12.547 1.00 0.00 H new ATOM 0 HH22 ARG A 109 4.259 -26.246 -13.743 1.00 0.00 H new ATOM 1680 N MET A 110 11.326 -23.586 -8.200 1.00 0.00 N ATOM 1681 CA MET A 110 12.731 -23.196 -8.207 1.00 0.00 C ATOM 1682 C MET A 110 13.526 -24.002 -7.183 1.00 0.00 C ATOM 1683 O MET A 110 14.696 -24.313 -7.397 1.00 0.00 O ATOM 1684 CB MET A 110 12.869 -21.701 -7.913 1.00 0.00 C ATOM 1685 CG MET A 110 12.035 -21.235 -6.731 1.00 0.00 C ATOM 1686 SD MET A 110 12.433 -19.551 -6.221 1.00 0.00 S ATOM 1687 CE MET A 110 11.002 -19.153 -5.220 1.00 0.00 C ATOM 0 H MET A 110 10.711 -22.938 -7.708 1.00 0.00 H new ATOM 0 HA MET A 110 13.134 -23.404 -9.198 1.00 0.00 H new ATOM 0 HB2 MET A 110 13.917 -21.472 -7.720 1.00 0.00 H new ATOM 0 HB3 MET A 110 12.577 -21.136 -8.798 1.00 0.00 H new ATOM 0 HG2 MET A 110 10.978 -21.291 -6.992 1.00 0.00 H new ATOM 0 HG3 MET A 110 12.192 -21.912 -5.891 1.00 0.00 H new ATOM 0 HE1 MET A 110 11.133 -18.167 -4.774 1.00 0.00 H new ATOM 0 HE2 MET A 110 10.109 -19.153 -5.845 1.00 0.00 H new ATOM 0 HE3 MET A 110 10.892 -19.897 -4.431 1.00 0.00 H new ATOM 1697 N GLY A 111 12.879 -24.338 -6.071 1.00 0.00 N ATOM 1698 CA GLY A 111 13.540 -25.105 -5.032 1.00 0.00 C ATOM 1699 C GLY A 111 13.669 -24.332 -3.734 1.00 0.00 C ATOM 1700 O GLY A 111 14.681 -24.437 -3.040 1.00 0.00 O ATOM 0 H GLY A 111 11.909 -24.093 -5.872 1.00 0.00 H new ATOM 0 HA2 GLY A 111 12.981 -26.023 -4.851 1.00 0.00 H new ATOM 0 HA3 GLY A 111 14.532 -25.399 -5.377 1.00 0.00 H new ATOM 1704 N ILE A 112 12.644 -23.553 -3.407 1.00 0.00 N ATOM 1705 CA ILE A 112 12.648 -22.759 -2.184 1.00 0.00 C ATOM 1706 C ILE A 112 11.449 -23.098 -1.305 1.00 0.00 C ATOM 1707 O ILE A 112 10.363 -23.390 -1.805 1.00 0.00 O ATOM 1708 CB ILE A 112 12.633 -21.250 -2.492 1.00 0.00 C ATOM 1709 CG1 ILE A 112 13.843 -20.871 -3.351 1.00 0.00 C ATOM 1710 CG2 ILE A 112 12.620 -20.446 -1.202 1.00 0.00 C ATOM 1711 CD1 ILE A 112 15.112 -20.675 -2.551 1.00 0.00 C ATOM 0 H ILE A 112 11.800 -23.454 -3.971 1.00 0.00 H new ATOM 0 HA ILE A 112 13.567 -23.004 -1.652 1.00 0.00 H new ATOM 0 HB ILE A 112 11.727 -21.017 -3.051 1.00 0.00 H new ATOM 0 HG12 ILE A 112 14.009 -21.650 -4.095 1.00 0.00 H new ATOM 0 HG13 ILE A 112 13.620 -19.953 -3.894 1.00 0.00 H new ATOM 0 HG21 ILE A 112 12.610 -19.382 -1.437 1.00 0.00 H new ATOM 0 HG22 ILE A 112 11.731 -20.699 -0.625 1.00 0.00 H new ATOM 0 HG23 ILE A 112 13.510 -20.680 -0.618 1.00 0.00 H new ATOM 0 HD11 ILE A 112 15.928 -20.408 -3.223 1.00 0.00 H new ATOM 0 HD12 ILE A 112 14.964 -19.876 -1.824 1.00 0.00 H new ATOM 0 HD13 ILE A 112 15.359 -21.599 -2.029 1.00 0.00 H new ATOM 1723 N GLU A 113 11.654 -23.056 0.008 1.00 0.00 N ATOM 1724 CA GLU A 113 10.588 -23.358 0.957 1.00 0.00 C ATOM 1725 C GLU A 113 10.255 -22.136 1.807 1.00 0.00 C ATOM 1726 O GLU A 113 11.144 -21.495 2.368 1.00 0.00 O ATOM 1727 CB GLU A 113 10.996 -24.525 1.859 1.00 0.00 C ATOM 1728 CG GLU A 113 10.054 -24.743 3.032 1.00 0.00 C ATOM 1729 CD GLU A 113 10.085 -26.170 3.546 1.00 0.00 C ATOM 1730 OE1 GLU A 113 11.098 -26.553 4.169 1.00 0.00 O ATOM 1731 OE2 GLU A 113 9.098 -26.903 3.327 1.00 0.00 O ATOM 0 H GLU A 113 12.547 -22.816 0.438 1.00 0.00 H new ATOM 0 HA GLU A 113 9.699 -23.638 0.391 1.00 0.00 H new ATOM 0 HB2 GLU A 113 11.039 -25.437 1.263 1.00 0.00 H new ATOM 0 HB3 GLU A 113 12.002 -24.346 2.239 1.00 0.00 H new ATOM 0 HG2 GLU A 113 10.323 -24.063 3.841 1.00 0.00 H new ATOM 0 HG3 GLU A 113 9.038 -24.492 2.729 1.00 0.00 H new ATOM 1738 N ILE A 114 8.968 -21.817 1.895 1.00 0.00 N ATOM 1739 CA ILE A 114 8.515 -20.673 2.676 1.00 0.00 C ATOM 1740 C ILE A 114 8.346 -21.042 4.146 1.00 0.00 C ATOM 1741 O ILE A 114 7.870 -22.130 4.473 1.00 0.00 O ATOM 1742 CB ILE A 114 7.182 -20.117 2.141 1.00 0.00 C ATOM 1743 CG1 ILE A 114 6.057 -21.129 2.365 1.00 0.00 C ATOM 1744 CG2 ILE A 114 7.306 -19.773 0.665 1.00 0.00 C ATOM 1745 CD1 ILE A 114 5.323 -20.938 3.674 1.00 0.00 C ATOM 0 H ILE A 114 8.220 -22.336 1.434 1.00 0.00 H new ATOM 0 HA ILE A 114 9.283 -19.905 2.583 1.00 0.00 H new ATOM 0 HB ILE A 114 6.940 -19.205 2.687 1.00 0.00 H new ATOM 0 HG12 ILE A 114 5.344 -21.055 1.544 1.00 0.00 H new ATOM 0 HG13 ILE A 114 6.474 -22.136 2.335 1.00 0.00 H new ATOM 0 HG21 ILE A 114 6.356 -19.381 0.302 1.00 0.00 H new ATOM 0 HG22 ILE A 114 8.084 -19.021 0.531 1.00 0.00 H new ATOM 0 HG23 ILE A 114 7.568 -20.670 0.103 1.00 0.00 H new ATOM 0 HD11 ILE A 114 4.540 -21.690 3.765 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.024 -21.042 4.503 1.00 0.00 H new ATOM 0 HD13 ILE A 114 4.876 -19.944 3.699 1.00 0.00 H new ATOM 1757 N LEU A 115 8.738 -20.129 5.028 1.00 0.00 N ATOM 1758 CA LEU A 115 8.628 -20.358 6.465 1.00 0.00 C ATOM 1759 C LEU A 115 7.337 -19.762 7.013 1.00 0.00 C ATOM 1760 O LEU A 115 6.568 -20.440 7.694 1.00 0.00 O ATOM 1761 CB LEU A 115 9.831 -19.753 7.191 1.00 0.00 C ATOM 1762 CG LEU A 115 11.166 -20.472 6.991 1.00 0.00 C ATOM 1763 CD1 LEU A 115 11.600 -20.398 5.536 1.00 0.00 C ATOM 1764 CD2 LEU A 115 12.234 -19.878 7.899 1.00 0.00 C ATOM 0 H LEU A 115 9.134 -19.224 4.774 1.00 0.00 H new ATOM 0 HA LEU A 115 8.611 -21.434 6.637 1.00 0.00 H new ATOM 0 HB2 LEU A 115 9.945 -18.719 6.864 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.611 -19.728 8.258 1.00 0.00 H new ATOM 0 HG LEU A 115 11.034 -21.521 7.256 1.00 0.00 H new ATOM 0 HD11 LEU A 115 12.552 -20.915 5.413 1.00 0.00 H new ATOM 0 HD12 LEU A 115 10.846 -20.871 4.907 1.00 0.00 H new ATOM 0 HD13 LEU A 115 11.714 -19.354 5.243 1.00 0.00 H new ATOM 0 HD21 LEU A 115 13.177 -20.402 7.743 1.00 0.00 H new ATOM 0 HD22 LEU A 115 12.363 -18.821 7.666 1.00 0.00 H new ATOM 0 HD23 LEU A 115 11.927 -19.985 8.940 1.00 0.00 H new ATOM 1776 N SER A 116 7.104 -18.488 6.713 1.00 0.00 N ATOM 1777 CA SER A 116 5.906 -17.799 7.178 1.00 0.00 C ATOM 1778 C SER A 116 5.681 -16.510 6.392 1.00 0.00 C ATOM 1779 O SER A 116 6.627 -15.901 5.892 1.00 0.00 O ATOM 1780 CB SER A 116 6.018 -17.487 8.670 1.00 0.00 C ATOM 1781 OG SER A 116 4.740 -17.453 9.283 1.00 0.00 O ATOM 0 H SER A 116 7.730 -17.912 6.150 1.00 0.00 H new ATOM 0 HA SER A 116 5.052 -18.457 7.015 1.00 0.00 H new ATOM 0 HB2 SER A 116 6.638 -18.240 9.156 1.00 0.00 H new ATOM 0 HB3 SER A 116 6.516 -16.527 8.807 1.00 0.00 H new ATOM 0 HG SER A 116 4.840 -17.253 10.237 1.00 0.00 H new ATOM 1787 N PHE A 117 4.421 -16.100 6.289 1.00 0.00 N ATOM 1788 CA PHE A 117 4.070 -14.884 5.564 1.00 0.00 C ATOM 1789 C PHE A 117 3.161 -13.993 6.405 1.00 0.00 C ATOM 1790 O PHE A 117 1.978 -14.288 6.587 1.00 0.00 O ATOM 1791 CB PHE A 117 3.382 -15.233 4.243 1.00 0.00 C ATOM 1792 CG PHE A 117 3.551 -14.183 3.183 1.00 0.00 C ATOM 1793 CD1 PHE A 117 3.221 -12.861 3.440 1.00 0.00 C ATOM 1794 CD2 PHE A 117 4.040 -14.516 1.930 1.00 0.00 C ATOM 1795 CE1 PHE A 117 3.375 -11.892 2.466 1.00 0.00 C ATOM 1796 CE2 PHE A 117 4.196 -13.550 0.953 1.00 0.00 C ATOM 1797 CZ PHE A 117 3.865 -12.238 1.221 1.00 0.00 C ATOM 0 H PHE A 117 3.626 -16.592 6.698 1.00 0.00 H new ATOM 0 HA PHE A 117 4.990 -14.338 5.353 1.00 0.00 H new ATOM 0 HB2 PHE A 117 3.780 -16.178 3.874 1.00 0.00 H new ATOM 0 HB3 PHE A 117 2.318 -15.385 4.426 1.00 0.00 H new ATOM 0 HD1 PHE A 117 2.839 -12.585 4.412 1.00 0.00 H new ATOM 0 HD2 PHE A 117 4.302 -15.541 1.714 1.00 0.00 H new ATOM 0 HE1 PHE A 117 3.113 -10.866 2.678 1.00 0.00 H new ATOM 0 HE2 PHE A 117 4.577 -13.823 -0.020 1.00 0.00 H new ATOM 0 HZ PHE A 117 3.989 -11.482 0.459 1.00 0.00 H new ATOM 1807 N THR A 118 3.720 -12.901 6.917 1.00 0.00 N ATOM 1808 CA THR A 118 2.962 -11.968 7.739 1.00 0.00 C ATOM 1809 C THR A 118 2.944 -10.576 7.118 1.00 0.00 C ATOM 1810 O THR A 118 3.676 -10.301 6.167 1.00 0.00 O ATOM 1811 CB THR A 118 3.542 -11.874 9.163 1.00 0.00 C ATOM 1812 OG1 THR A 118 4.024 -13.155 9.581 1.00 0.00 O ATOM 1813 CG2 THR A 118 2.492 -11.376 10.144 1.00 0.00 C ATOM 0 H THR A 118 4.696 -12.641 6.776 1.00 0.00 H new ATOM 0 HA THR A 118 1.943 -12.352 7.794 1.00 0.00 H new ATOM 0 HB THR A 118 4.368 -11.163 9.149 1.00 0.00 H new ATOM 0 HG1 THR A 118 4.393 -13.086 10.486 1.00 0.00 H new ATOM 0 HG21 THR A 118 2.925 -11.318 11.142 1.00 0.00 H new ATOM 0 HG22 THR A 118 2.149 -10.387 9.839 1.00 0.00 H new ATOM 0 HG23 THR A 118 1.648 -12.065 10.154 1.00 0.00 H new ATOM 1821 N ILE A 119 2.103 -9.701 7.661 1.00 0.00 N ATOM 1822 CA ILE A 119 1.992 -8.337 7.159 1.00 0.00 C ATOM 1823 C ILE A 119 2.702 -7.352 8.082 1.00 0.00 C ATOM 1824 O ILE A 119 2.618 -7.461 9.306 1.00 0.00 O ATOM 1825 CB ILE A 119 0.519 -7.911 7.007 1.00 0.00 C ATOM 1826 CG1 ILE A 119 -0.208 -8.850 6.043 1.00 0.00 C ATOM 1827 CG2 ILE A 119 0.431 -6.472 6.522 1.00 0.00 C ATOM 1828 CD1 ILE A 119 0.324 -8.794 4.628 1.00 0.00 C ATOM 0 H ILE A 119 1.489 -9.913 8.448 1.00 0.00 H new ATOM 0 HA ILE A 119 2.469 -8.322 6.179 1.00 0.00 H new ATOM 0 HB ILE A 119 0.035 -7.975 7.981 1.00 0.00 H new ATOM 0 HG12 ILE A 119 -0.126 -9.872 6.413 1.00 0.00 H new ATOM 0 HG13 ILE A 119 -1.269 -8.598 6.034 1.00 0.00 H new ATOM 0 HG21 ILE A 119 -0.616 -6.186 6.420 1.00 0.00 H new ATOM 0 HG22 ILE A 119 0.918 -5.815 7.242 1.00 0.00 H new ATOM 0 HG23 ILE A 119 0.928 -6.383 5.556 1.00 0.00 H new ATOM 0 HD11 ILE A 119 -0.238 -9.485 4.000 1.00 0.00 H new ATOM 0 HD12 ILE A 119 0.217 -7.781 4.239 1.00 0.00 H new ATOM 0 HD13 ILE A 119 1.377 -9.075 4.624 1.00 0.00 H new ATOM 1840 N LYS A 120 3.399 -6.391 7.488 1.00 0.00 N ATOM 1841 CA LYS A 120 4.121 -5.383 8.255 1.00 0.00 C ATOM 1842 C LYS A 120 3.277 -4.124 8.431 1.00 0.00 C ATOM 1843 O LYS A 120 2.784 -3.843 9.523 1.00 0.00 O ATOM 1844 CB LYS A 120 5.440 -5.034 7.563 1.00 0.00 C ATOM 1845 CG LYS A 120 6.127 -3.810 8.145 1.00 0.00 C ATOM 1846 CD LYS A 120 7.026 -4.179 9.314 1.00 0.00 C ATOM 1847 CE LYS A 120 8.458 -4.420 8.863 1.00 0.00 C ATOM 1848 NZ LYS A 120 9.440 -4.079 9.928 1.00 0.00 N ATOM 0 H LYS A 120 3.480 -6.288 6.476 1.00 0.00 H new ATOM 0 HA LYS A 120 4.334 -5.796 9.241 1.00 0.00 H new ATOM 0 HB2 LYS A 120 6.115 -5.887 7.634 1.00 0.00 H new ATOM 0 HB3 LYS A 120 5.251 -4.865 6.503 1.00 0.00 H new ATOM 0 HG2 LYS A 120 6.718 -3.320 7.371 1.00 0.00 H new ATOM 0 HG3 LYS A 120 5.376 -3.092 8.475 1.00 0.00 H new ATOM 0 HD2 LYS A 120 7.007 -3.380 10.055 1.00 0.00 H new ATOM 0 HD3 LYS A 120 6.641 -5.075 9.801 1.00 0.00 H new ATOM 0 HE2 LYS A 120 8.578 -5.466 8.580 1.00 0.00 H new ATOM 0 HE3 LYS A 120 8.664 -3.823 7.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 10.404 -4.257 9.581 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 9.343 -3.075 10.181 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 9.260 -4.666 10.767 1.00 0.00 H new ATOM 1862 N ASP A 121 3.116 -3.370 7.349 1.00 0.00 N ATOM 1863 CA ASP A 121 2.331 -2.143 7.382 1.00 0.00 C ATOM 1864 C ASP A 121 1.652 -1.895 6.039 1.00 0.00 C ATOM 1865 O ASP A 121 2.215 -2.186 4.984 1.00 0.00 O ATOM 1866 CB ASP A 121 3.219 -0.952 7.746 1.00 0.00 C ATOM 1867 CG ASP A 121 2.462 0.129 8.492 1.00 0.00 C ATOM 1868 OD1 ASP A 121 1.590 -0.217 9.316 1.00 0.00 O ATOM 1869 OD2 ASP A 121 2.744 1.322 8.253 1.00 0.00 O ATOM 0 H ASP A 121 3.519 -3.588 6.438 1.00 0.00 H new ATOM 0 HA ASP A 121 1.559 -2.256 8.143 1.00 0.00 H new ATOM 0 HB2 ASP A 121 4.051 -1.297 8.359 1.00 0.00 H new ATOM 0 HB3 ASP A 121 3.647 -0.530 6.836 1.00 0.00 H new ATOM 1874 N VAL A 122 0.438 -1.355 6.086 1.00 0.00 N ATOM 1875 CA VAL A 122 -0.318 -1.068 4.873 1.00 0.00 C ATOM 1876 C VAL A 122 -0.883 0.348 4.899 1.00 0.00 C ATOM 1877 O VAL A 122 -1.720 0.678 5.740 1.00 0.00 O ATOM 1878 CB VAL A 122 -1.476 -2.067 4.683 1.00 0.00 C ATOM 1879 CG1 VAL A 122 -2.258 -2.230 5.977 1.00 0.00 C ATOM 1880 CG2 VAL A 122 -2.387 -1.616 3.552 1.00 0.00 C ATOM 0 H VAL A 122 -0.043 -1.108 6.951 1.00 0.00 H new ATOM 0 HA VAL A 122 0.376 -1.164 4.038 1.00 0.00 H new ATOM 0 HB VAL A 122 -1.057 -3.037 4.416 1.00 0.00 H new ATOM 0 HG11 VAL A 122 -3.072 -2.939 5.824 1.00 0.00 H new ATOM 0 HG12 VAL A 122 -1.595 -2.602 6.758 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -2.669 -1.266 6.278 1.00 0.00 H new ATOM 0 HG21 VAL A 122 -3.199 -2.333 3.431 1.00 0.00 H new ATOM 0 HG22 VAL A 122 -2.800 -0.635 3.787 1.00 0.00 H new ATOM 0 HG23 VAL A 122 -1.815 -1.556 2.626 1.00 0.00 H new ATOM 1890 N TYR A 123 -0.421 1.180 3.973 1.00 0.00 N ATOM 1891 CA TYR A 123 -0.879 2.562 3.891 1.00 0.00 C ATOM 1892 C TYR A 123 -1.260 2.926 2.459 1.00 0.00 C ATOM 1893 O TYR A 123 -1.067 2.136 1.534 1.00 0.00 O ATOM 1894 CB TYR A 123 0.208 3.512 4.398 1.00 0.00 C ATOM 1895 CG TYR A 123 1.590 3.181 3.885 1.00 0.00 C ATOM 1896 CD1 TYR A 123 2.371 2.213 4.506 1.00 0.00 C ATOM 1897 CD2 TYR A 123 2.117 3.835 2.778 1.00 0.00 C ATOM 1898 CE1 TYR A 123 3.634 1.907 4.040 1.00 0.00 C ATOM 1899 CE2 TYR A 123 3.380 3.535 2.305 1.00 0.00 C ATOM 1900 CZ TYR A 123 4.134 2.570 2.939 1.00 0.00 C ATOM 1901 OH TYR A 123 5.394 2.269 2.471 1.00 0.00 O ATOM 0 H TYR A 123 0.270 0.922 3.269 1.00 0.00 H new ATOM 0 HA TYR A 123 -1.764 2.663 4.520 1.00 0.00 H new ATOM 0 HB2 TYR A 123 -0.045 4.530 4.103 1.00 0.00 H new ATOM 0 HB3 TYR A 123 0.219 3.489 5.488 1.00 0.00 H new ATOM 0 HD1 TYR A 123 1.983 1.691 5.368 1.00 0.00 H new ATOM 0 HD2 TYR A 123 1.529 4.591 2.279 1.00 0.00 H new ATOM 0 HE1 TYR A 123 4.227 1.152 4.535 1.00 0.00 H new ATOM 0 HE2 TYR A 123 3.775 4.053 1.444 1.00 0.00 H new ATOM 0 HH TYR A 123 5.594 2.825 1.689 1.00 0.00 H new ATOM 1911 N ASP A 124 -1.799 4.127 2.285 1.00 0.00 N ATOM 1912 CA ASP A 124 -2.206 4.598 0.966 1.00 0.00 C ATOM 1913 C ASP A 124 -1.542 5.931 0.636 1.00 0.00 C ATOM 1914 O ASP A 124 -1.500 6.839 1.468 1.00 0.00 O ATOM 1915 CB ASP A 124 -3.727 4.741 0.898 1.00 0.00 C ATOM 1916 CG ASP A 124 -4.272 4.487 -0.493 1.00 0.00 C ATOM 1917 OD1 ASP A 124 -3.687 5.011 -1.465 1.00 0.00 O ATOM 1918 OD2 ASP A 124 -5.282 3.764 -0.612 1.00 0.00 O ATOM 0 H ASP A 124 -1.964 4.792 3.040 1.00 0.00 H new ATOM 0 HA ASP A 124 -1.885 3.861 0.230 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -4.186 4.043 1.598 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -4.009 5.744 1.218 1.00 0.00 H new ATOM 1923 N LYS A 125 -1.023 6.043 -0.582 1.00 0.00 N ATOM 1924 CA LYS A 125 -0.361 7.265 -1.022 1.00 0.00 C ATOM 1925 C LYS A 125 -1.278 8.473 -0.855 1.00 0.00 C ATOM 1926 O LYS A 125 -0.897 9.476 -0.252 1.00 0.00 O ATOM 1927 CB LYS A 125 0.069 7.138 -2.485 1.00 0.00 C ATOM 1928 CG LYS A 125 1.479 6.600 -2.661 1.00 0.00 C ATOM 1929 CD LYS A 125 2.136 7.155 -3.914 1.00 0.00 C ATOM 1930 CE LYS A 125 3.645 7.256 -3.753 1.00 0.00 C ATOM 1931 NZ LYS A 125 4.280 7.948 -4.908 1.00 0.00 N ATOM 0 H LYS A 125 -1.048 5.302 -1.282 1.00 0.00 H new ATOM 0 HA LYS A 125 0.522 7.413 -0.400 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -0.629 6.481 -3.004 1.00 0.00 H new ATOM 0 HB3 LYS A 125 0.000 8.116 -2.961 1.00 0.00 H new ATOM 0 HG2 LYS A 125 2.080 6.859 -1.789 1.00 0.00 H new ATOM 0 HG3 LYS A 125 1.450 5.512 -2.716 1.00 0.00 H new ATOM 0 HD2 LYS A 125 1.902 6.514 -4.764 1.00 0.00 H new ATOM 0 HD3 LYS A 125 1.726 8.140 -4.136 1.00 0.00 H new ATOM 0 HE2 LYS A 125 3.877 7.795 -2.834 1.00 0.00 H new ATOM 0 HE3 LYS A 125 4.067 6.256 -3.652 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 5.308 7.997 -4.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 4.080 7.420 -5.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 3.896 8.911 -4.990 1.00 0.00 H new ATOM 1945 N VAL A 126 -2.492 8.367 -1.390 1.00 0.00 N ATOM 1946 CA VAL A 126 -3.464 9.449 -1.297 1.00 0.00 C ATOM 1947 C VAL A 126 -3.986 9.598 0.127 1.00 0.00 C ATOM 1948 O VAL A 126 -4.815 10.463 0.409 1.00 0.00 O ATOM 1949 CB VAL A 126 -4.654 9.217 -2.247 1.00 0.00 C ATOM 1950 CG1 VAL A 126 -4.184 9.182 -3.693 1.00 0.00 C ATOM 1951 CG2 VAL A 126 -5.382 7.931 -1.883 1.00 0.00 C ATOM 0 H VAL A 126 -2.824 7.543 -1.891 1.00 0.00 H new ATOM 0 HA VAL A 126 -2.948 10.364 -1.589 1.00 0.00 H new ATOM 0 HB VAL A 126 -5.352 10.047 -2.137 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -5.038 9.017 -4.349 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -3.711 10.131 -3.945 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -3.466 8.373 -3.823 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -6.220 7.782 -2.564 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -4.695 7.089 -1.963 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -5.753 8.000 -0.860 1.00 0.00 H new ATOM 1961 N ASP A 127 -3.495 8.749 1.023 1.00 0.00 N ATOM 1962 CA ASP A 127 -3.911 8.786 2.420 1.00 0.00 C ATOM 1963 C ASP A 127 -5.406 9.067 2.536 1.00 0.00 C ATOM 1964 O ASP A 127 -5.836 9.856 3.376 1.00 0.00 O ATOM 1965 CB ASP A 127 -3.119 9.851 3.182 1.00 0.00 C ATOM 1966 CG ASP A 127 -1.622 9.703 2.996 1.00 0.00 C ATOM 1967 OD1 ASP A 127 -1.035 8.792 3.617 1.00 0.00 O ATOM 1968 OD2 ASP A 127 -1.038 10.496 2.230 1.00 0.00 O ATOM 0 H ASP A 127 -2.808 8.027 0.807 1.00 0.00 H new ATOM 0 HA ASP A 127 -3.709 7.809 2.859 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -3.428 10.840 2.844 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -3.358 9.787 4.243 1.00 0.00 H new ATOM 1973 N TYR A 128 -6.192 8.416 1.685 1.00 0.00 N ATOM 1974 CA TYR A 128 -7.638 8.598 1.689 1.00 0.00 C ATOM 1975 C TYR A 128 -8.268 7.937 2.911 1.00 0.00 C ATOM 1976 O TYR A 128 -9.092 8.538 3.601 1.00 0.00 O ATOM 1977 CB TYR A 128 -8.250 8.020 0.411 1.00 0.00 C ATOM 1978 CG TYR A 128 -9.653 7.490 0.597 1.00 0.00 C ATOM 1979 CD1 TYR A 128 -9.875 6.185 1.017 1.00 0.00 C ATOM 1980 CD2 TYR A 128 -10.759 8.296 0.351 1.00 0.00 C ATOM 1981 CE1 TYR A 128 -11.156 5.697 1.188 1.00 0.00 C ATOM 1982 CE2 TYR A 128 -12.043 7.817 0.521 1.00 0.00 C ATOM 1983 CZ TYR A 128 -12.236 6.517 0.939 1.00 0.00 C ATOM 1984 OH TYR A 128 -13.514 6.035 1.108 1.00 0.00 O ATOM 0 H TYR A 128 -5.852 7.758 0.984 1.00 0.00 H new ATOM 0 HA TYR A 128 -7.843 9.668 1.731 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -8.262 8.793 -0.358 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -7.612 7.215 0.045 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -9.031 5.540 1.213 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -10.611 9.314 0.021 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -11.311 4.679 1.515 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -12.891 8.457 0.328 1.00 0.00 H new ATOM 0 HH TYR A 128 -14.160 6.739 0.892 1.00 0.00 H new ATOM 1994 N LEU A 129 -7.872 6.695 3.173 1.00 0.00 N ATOM 1995 CA LEU A 129 -8.396 5.950 4.313 1.00 0.00 C ATOM 1996 C LEU A 129 -7.654 6.321 5.593 1.00 0.00 C ATOM 1997 O LEU A 129 -8.258 6.446 6.658 1.00 0.00 O ATOM 1998 CB LEU A 129 -8.280 4.447 4.060 1.00 0.00 C ATOM 1999 CG LEU A 129 -6.880 3.927 3.729 1.00 0.00 C ATOM 2000 CD1 LEU A 129 -6.155 3.505 4.998 1.00 0.00 C ATOM 2001 CD2 LEU A 129 -6.960 2.767 2.748 1.00 0.00 C ATOM 0 H LEU A 129 -7.191 6.184 2.612 1.00 0.00 H new ATOM 0 HA LEU A 129 -9.447 6.212 4.436 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -8.641 3.921 4.944 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -8.947 4.185 3.238 1.00 0.00 H new ATOM 0 HG LEU A 129 -6.314 4.733 3.262 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -5.161 3.138 4.744 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -6.066 4.360 5.668 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -6.718 2.714 5.493 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -5.955 2.410 2.524 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -7.543 1.958 3.188 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -7.440 3.101 1.828 1.00 0.00 H new ATOM 2013 N SER A 130 -6.342 6.499 5.480 1.00 0.00 N ATOM 2014 CA SER A 130 -5.517 6.855 6.629 1.00 0.00 C ATOM 2015 C SER A 130 -5.899 8.230 7.166 1.00 0.00 C ATOM 2016 O SER A 130 -6.048 8.418 8.374 1.00 0.00 O ATOM 2017 CB SER A 130 -4.037 6.837 6.245 1.00 0.00 C ATOM 2018 OG SER A 130 -3.476 5.549 6.435 1.00 0.00 O ATOM 0 H SER A 130 -5.827 6.403 4.605 1.00 0.00 H new ATOM 0 HA SER A 130 -5.690 6.118 7.413 1.00 0.00 H new ATOM 0 HB2 SER A 130 -3.925 7.136 5.203 1.00 0.00 H new ATOM 0 HB3 SER A 130 -3.493 7.566 6.846 1.00 0.00 H new ATOM 0 HG SER A 130 -2.530 5.564 6.181 1.00 0.00 H new ATOM 2024 N SER A 131 -6.054 9.191 6.260 1.00 0.00 N ATOM 2025 CA SER A 131 -6.415 10.551 6.642 1.00 0.00 C ATOM 2026 C SER A 131 -7.861 10.856 6.266 1.00 0.00 C ATOM 2027 O SER A 131 -8.136 11.797 5.518 1.00 0.00 O ATOM 2028 CB SER A 131 -5.478 11.557 5.971 1.00 0.00 C ATOM 2029 OG SER A 131 -4.342 11.814 6.778 1.00 0.00 O ATOM 0 H SER A 131 -5.935 9.052 5.256 1.00 0.00 H new ATOM 0 HA SER A 131 -6.314 10.637 7.724 1.00 0.00 H new ATOM 0 HB2 SER A 131 -5.160 11.172 5.002 1.00 0.00 H new ATOM 0 HB3 SER A 131 -6.013 12.488 5.784 1.00 0.00 H new ATOM 0 HG SER A 131 -3.759 12.459 6.326 1.00 0.00 H new ATOM 2035 N LEU A 132 -8.784 10.055 6.786 1.00 0.00 N ATOM 2036 CA LEU A 132 -10.204 10.238 6.505 1.00 0.00 C ATOM 2037 C LEU A 132 -10.742 11.481 7.206 1.00 0.00 C ATOM 2038 O LEU A 132 -11.643 12.149 6.701 1.00 0.00 O ATOM 2039 CB LEU A 132 -10.995 9.006 6.949 1.00 0.00 C ATOM 2040 CG LEU A 132 -11.093 7.869 5.931 1.00 0.00 C ATOM 2041 CD1 LEU A 132 -11.297 6.537 6.637 1.00 0.00 C ATOM 2042 CD2 LEU A 132 -12.224 8.131 4.947 1.00 0.00 C ATOM 0 H LEU A 132 -8.575 9.272 7.405 1.00 0.00 H new ATOM 0 HA LEU A 132 -10.322 10.370 5.429 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -10.539 8.614 7.858 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -12.005 9.322 7.209 1.00 0.00 H new ATOM 0 HG LEU A 132 -10.157 7.823 5.375 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -11.365 5.740 5.897 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -10.455 6.345 7.302 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -12.218 6.571 7.219 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -12.279 7.312 4.230 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -13.167 8.204 5.488 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -12.036 9.065 4.417 1.00 0.00 H new ATOM 2054 N GLY A 133 -10.181 11.786 8.372 1.00 0.00 N ATOM 2055 CA GLY A 133 -10.615 12.951 9.122 1.00 0.00 C ATOM 2056 C GLY A 133 -9.457 13.701 9.749 1.00 0.00 C ATOM 2057 O GLY A 133 -8.918 14.636 9.154 1.00 0.00 O ATOM 0 H GLY A 133 -9.434 11.248 8.811 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -11.163 13.622 8.460 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -11.308 12.639 9.904 1.00 0.00 H new ATOM 2061 N LYS A 134 -9.074 13.296 10.954 1.00 0.00 N ATOM 2062 CA LYS A 134 -7.973 13.936 11.665 1.00 0.00 C ATOM 2063 C LYS A 134 -6.842 14.293 10.705 1.00 0.00 C ATOM 2064 O LYS A 134 -6.390 13.455 9.924 1.00 0.00 O ATOM 2065 CB LYS A 134 -7.449 13.017 12.770 1.00 0.00 C ATOM 2066 CG LYS A 134 -6.913 13.765 13.979 1.00 0.00 C ATOM 2067 CD LYS A 134 -5.824 12.976 14.685 1.00 0.00 C ATOM 2068 CE LYS A 134 -5.223 13.765 15.838 1.00 0.00 C ATOM 2069 NZ LYS A 134 -4.527 14.994 15.366 1.00 0.00 N ATOM 0 H LYS A 134 -9.510 12.526 11.460 1.00 0.00 H new ATOM 0 HA LYS A 134 -8.348 14.855 12.115 1.00 0.00 H new ATOM 0 HB2 LYS A 134 -8.252 12.353 13.090 1.00 0.00 H new ATOM 0 HB3 LYS A 134 -6.658 12.387 12.363 1.00 0.00 H new ATOM 0 HG2 LYS A 134 -6.518 14.731 13.665 1.00 0.00 H new ATOM 0 HG3 LYS A 134 -7.728 13.965 14.675 1.00 0.00 H new ATOM 0 HD2 LYS A 134 -6.237 12.039 15.060 1.00 0.00 H new ATOM 0 HD3 LYS A 134 -5.041 12.717 13.973 1.00 0.00 H new ATOM 0 HE2 LYS A 134 -6.011 14.040 16.539 1.00 0.00 H new ATOM 0 HE3 LYS A 134 -4.519 13.135 16.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 -3.923 15.365 16.127 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 -3.940 14.764 14.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 -5.231 15.712 15.102 1.00 0.00 H new ATOM 2083 N THR A 135 -6.386 15.540 10.771 1.00 0.00 N ATOM 2084 CA THR A 135 -5.308 16.006 9.909 1.00 0.00 C ATOM 2085 C THR A 135 -4.713 17.309 10.430 1.00 0.00 C ATOM 2086 O THR A 135 -5.431 18.172 10.936 1.00 0.00 O ATOM 2087 CB THR A 135 -5.795 16.219 8.464 1.00 0.00 C ATOM 2088 OG1 THR A 135 -4.751 16.802 7.676 1.00 0.00 O ATOM 2089 CG2 THR A 135 -7.023 17.117 8.434 1.00 0.00 C ATOM 0 H THR A 135 -6.747 16.245 11.413 1.00 0.00 H new ATOM 0 HA THR A 135 -4.542 15.231 9.915 1.00 0.00 H new ATOM 0 HB THR A 135 -6.064 15.248 8.048 1.00 0.00 H new ATOM 0 HG1 THR A 135 -5.068 16.933 6.758 1.00 0.00 H new ATOM 0 HG21 THR A 135 -7.349 17.253 7.403 1.00 0.00 H new ATOM 0 HG22 THR A 135 -7.825 16.656 9.010 1.00 0.00 H new ATOM 0 HG23 THR A 135 -6.776 18.086 8.867 1.00 0.00 H new ATOM 2097 N GLN A 136 -3.397 17.446 10.302 1.00 0.00 N ATOM 2098 CA GLN A 136 -2.706 18.647 10.760 1.00 0.00 C ATOM 2099 C GLN A 136 -2.590 19.671 9.636 1.00 0.00 C ATOM 2100 O GLN A 136 -1.874 19.457 8.658 1.00 0.00 O ATOM 2101 CB GLN A 136 -1.315 18.290 11.286 1.00 0.00 C ATOM 2102 CG GLN A 136 -0.503 19.497 11.725 1.00 0.00 C ATOM 2103 CD GLN A 136 -1.044 20.139 12.987 1.00 0.00 C ATOM 2104 OE1 GLN A 136 -1.937 20.985 12.933 1.00 0.00 O ATOM 2105 NE2 GLN A 136 -0.505 19.739 14.133 1.00 0.00 N ATOM 0 H GLN A 136 -2.788 16.742 9.886 1.00 0.00 H new ATOM 0 HA GLN A 136 -3.291 19.087 11.568 1.00 0.00 H new ATOM 0 HB2 GLN A 136 -1.419 17.606 12.129 1.00 0.00 H new ATOM 0 HB3 GLN A 136 -0.767 17.757 10.509 1.00 0.00 H new ATOM 0 HG2 GLN A 136 0.531 19.193 11.891 1.00 0.00 H new ATOM 0 HG3 GLN A 136 -0.493 20.235 10.923 1.00 0.00 H new ATOM 0 HE21 GLN A 136 0.233 19.035 14.131 1.00 0.00 H new ATOM 0 HE22 GLN A 136 -0.829 20.136 15.015 1.00 0.00 H new ATOM 2114 N THR A 137 -3.300 20.785 9.781 1.00 0.00 N ATOM 2115 CA THR A 137 -3.278 21.842 8.778 1.00 0.00 C ATOM 2116 C THR A 137 -2.254 22.915 9.132 1.00 0.00 C ATOM 2117 O THR A 137 -1.303 23.147 8.386 1.00 0.00 O ATOM 2118 CB THR A 137 -4.662 22.500 8.625 1.00 0.00 C ATOM 2119 OG1 THR A 137 -5.653 21.501 8.354 1.00 0.00 O ATOM 2120 CG2 THR A 137 -4.652 23.528 7.504 1.00 0.00 C ATOM 0 H THR A 137 -3.898 20.979 10.584 1.00 0.00 H new ATOM 0 HA THR A 137 -2.999 21.375 7.833 1.00 0.00 H new ATOM 0 HB THR A 137 -4.903 23.007 9.559 1.00 0.00 H new ATOM 0 HG1 THR A 137 -6.530 21.928 8.260 1.00 0.00 H new ATOM 0 HG21 THR A 137 -5.640 23.979 7.415 1.00 0.00 H new ATOM 0 HG22 THR A 137 -3.918 24.303 7.727 1.00 0.00 H new ATOM 0 HG23 THR A 137 -4.390 23.040 6.565 1.00 0.00 H new ATOM 2128 N SER A 138 -2.457 23.565 10.274 1.00 0.00 N ATOM 2129 CA SER A 138 -1.551 24.616 10.725 1.00 0.00 C ATOM 2130 C SER A 138 -1.046 24.329 12.135 1.00 0.00 C ATOM 2131 O SER A 138 -1.824 24.270 13.086 1.00 0.00 O ATOM 2132 CB SER A 138 -2.255 25.974 10.689 1.00 0.00 C ATOM 2133 OG SER A 138 -1.318 27.032 10.598 1.00 0.00 O ATOM 0 H SER A 138 -3.239 23.383 10.903 1.00 0.00 H new ATOM 0 HA SER A 138 -0.696 24.640 10.050 1.00 0.00 H new ATOM 0 HB2 SER A 138 -2.935 26.012 9.838 1.00 0.00 H new ATOM 0 HB3 SER A 138 -2.861 26.097 11.587 1.00 0.00 H new ATOM 0 HG SER A 138 -1.793 27.889 10.575 1.00 0.00 H new ATOM 2139 N GLY A 139 0.266 24.150 12.261 1.00 0.00 N ATOM 2140 CA GLY A 139 0.854 23.871 13.559 1.00 0.00 C ATOM 2141 C GLY A 139 2.342 24.157 13.594 1.00 0.00 C ATOM 2142 O GLY A 139 3.164 23.260 13.782 1.00 0.00 O ATOM 0 H GLY A 139 0.931 24.193 11.489 1.00 0.00 H new ATOM 0 HA2 GLY A 139 0.354 24.472 14.318 1.00 0.00 H new ATOM 0 HA3 GLY A 139 0.682 22.826 13.816 1.00 0.00 H new ATOM 2146 N PRO A 140 2.708 25.434 13.407 1.00 0.00 N ATOM 2147 CA PRO A 140 4.109 25.866 13.412 1.00 0.00 C ATOM 2148 C PRO A 140 4.734 25.787 14.800 1.00 0.00 C ATOM 2149 O PRO A 140 4.498 26.650 15.647 1.00 0.00 O ATOM 2150 CB PRO A 140 4.034 27.320 12.940 1.00 0.00 C ATOM 2151 CG PRO A 140 2.662 27.767 13.307 1.00 0.00 C ATOM 2152 CD PRO A 140 1.782 26.555 13.176 1.00 0.00 C ATOM 0 HA PRO A 140 4.734 25.232 12.783 1.00 0.00 H new ATOM 0 HB2 PRO A 140 4.793 27.933 13.425 1.00 0.00 H new ATOM 0 HB3 PRO A 140 4.201 27.397 11.866 1.00 0.00 H new ATOM 0 HG2 PRO A 140 2.638 28.158 14.324 1.00 0.00 H new ATOM 0 HG3 PRO A 140 2.324 28.568 12.649 1.00 0.00 H new ATOM 0 HD2 PRO A 140 0.973 26.565 13.907 1.00 0.00 H new ATOM 0 HD3 PRO A 140 1.320 26.498 12.190 1.00 0.00 H new ATOM 2160 N SER A 141 5.533 24.749 15.028 1.00 0.00 N ATOM 2161 CA SER A 141 6.189 24.557 16.315 1.00 0.00 C ATOM 2162 C SER A 141 6.731 25.879 16.852 1.00 0.00 C ATOM 2163 O SER A 141 7.569 26.522 16.218 1.00 0.00 O ATOM 2164 CB SER A 141 7.328 23.543 16.185 1.00 0.00 C ATOM 2165 OG SER A 141 7.637 22.960 17.439 1.00 0.00 O ATOM 0 H SER A 141 5.741 24.028 14.337 1.00 0.00 H new ATOM 0 HA SER A 141 5.449 24.175 17.018 1.00 0.00 H new ATOM 0 HB2 SER A 141 7.046 22.763 15.477 1.00 0.00 H new ATOM 0 HB3 SER A 141 8.213 24.035 15.781 1.00 0.00 H new ATOM 0 HG SER A 141 8.366 22.315 17.329 1.00 0.00 H new ATOM 2171 N SER A 142 6.245 26.280 18.023 1.00 0.00 N ATOM 2172 CA SER A 142 6.675 27.526 18.643 1.00 0.00 C ATOM 2173 C SER A 142 6.243 27.583 20.105 1.00 0.00 C ATOM 2174 O SER A 142 5.194 27.056 20.475 1.00 0.00 O ATOM 2175 CB SER A 142 6.104 28.724 17.882 1.00 0.00 C ATOM 2176 OG SER A 142 4.687 28.725 17.926 1.00 0.00 O ATOM 0 H SER A 142 5.553 25.759 18.561 1.00 0.00 H new ATOM 0 HA SER A 142 7.764 27.566 18.603 1.00 0.00 H new ATOM 0 HB2 SER A 142 6.485 29.649 18.314 1.00 0.00 H new ATOM 0 HB3 SER A 142 6.439 28.694 16.845 1.00 0.00 H new ATOM 0 HG SER A 142 4.339 28.093 17.263 1.00 0.00 H new ATOM 2182 N GLY A 143 7.060 28.228 20.933 1.00 0.00 N ATOM 2183 CA GLY A 143 6.744 28.342 22.345 1.00 0.00 C ATOM 2184 C GLY A 143 7.165 27.118 23.134 1.00 0.00 C ATOM 2185 O GLY A 143 7.566 26.108 22.558 1.00 0.00 O ATOM 0 H GLY A 143 7.934 28.673 20.651 1.00 0.00 H new ATOM 0 HA2 GLY A 143 7.239 29.223 22.755 1.00 0.00 H new ATOM 0 HA3 GLY A 143 5.671 28.495 22.463 1.00 0.00 H new TER 2189 GLY A 143