USER MOD reduce.3.24.130724 H: found=0, std=0, add=892, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 890 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 99 GLN : amide:sc= -0.317 K(o=0.046,f=-1.1) USER MOD Set 1.2: A 102 TYR OH : rot 180:sc= 0.363 USER MOD Set 2.1: A 30 SER OG : rot 151:sc= 0.0335 USER MOD Set 2.2: A 33 THR OG1 : rot 180:sc= -0.985 USER MOD Single : A 1 GLY N :NH3+ -126:sc= 0.0758 (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 USER MOD Single : A 6 SER OG : rot 65:sc= 0.18 USER MOD Single : A 8 GLN : amide:sc= -0.349 X(o=-0.35,f=-0.35) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -140:sc= -1.06 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 152:sc= -0.136 (180deg=-0.677) USER MOD Single : A 31 GLN : amide:sc= -1.52! C(o=-1.5!,f=-1.3!) USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -154:sc= 0.187 (180deg=0.0413) USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -0.627 K(o=-0.63,f=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 17:sc= 0.0345 USER MOD Single : A 44 HIS : no HD1:sc= -1.64 K(o=-1.6,f=-5.6!) USER MOD Single : A 50 HIS : no HD1:sc= -0.138 X(o=-0.14,f=0) USER MOD Single : A 51 HIS : no HD1:sc= -0.169 K(o=-0.17,f=-0.89) USER MOD Single : A 52 TYR OH : rot 42:sc= -1.1 USER MOD Single : A 53 GLN : amide:sc= -0.184 K(o=-0.18,f=-2.8!) USER MOD Single : A 57 LYS NZ :NH3+ 150:sc= -0.0781 (180deg=-1.4!) USER MOD Single : A 61 SER OG : rot 180:sc= 0.0463 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 SER OG : rot -130:sc= -0.7 USER MOD Single : A 70 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 73 GLN : amide:sc= -1.94! C(o=-1.9!,f=-1.8!) USER MOD Single : A 74 THR OG1 : rot 142:sc= 1.12 USER MOD Single : A 75 MET CE :methyl 145:sc= -0.454 (180deg=-2.03!) USER MOD Single : A 79 ASN : amide:sc= -1.15 K(o=-1.1,f=-0.27) USER MOD Single : A 80 ASN : amide:sc=-0.00543 K(o=-0.0054,f=-0.99) USER MOD Single : A 84 ASN : amide:sc= -1.69 K(o=-1.7,f=-3.6!) USER MOD Single : A 85 THR OG1 : rot 61:sc= 0.136 USER MOD Single : A 86 THR OG1 : rot 180:sc= 0 USER MOD Single : A 87 TYR OH : rot 32:sc= -0.353 USER MOD Single : A 95 ASN : amide:sc= -8.27! C(o=-8.3!,f=-24!) USER MOD Single : A 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 110 THR OG1 : rot -144:sc= 1.62 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= -0.18 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -35.144 -23.493 6.346 1.00 0.00 N ATOM 2 CA GLY A 1 -34.709 -24.306 5.225 1.00 0.00 C ATOM 3 C GLY A 1 -33.967 -25.553 5.666 1.00 0.00 C ATOM 4 O GLY A 1 -34.060 -25.961 6.824 1.00 0.00 O ATOM 0 H1 GLY A 1 -36.167 -23.319 6.272 1.00 0.00 H new ATOM 0 H2 GLY A 1 -34.941 -23.992 7.236 1.00 0.00 H new ATOM 0 H3 GLY A 1 -34.636 -22.585 6.334 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -35.576 -24.594 4.631 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -34.063 -23.712 4.579 1.00 0.00 H new ATOM 8 N SER A 2 -33.231 -26.160 4.742 1.00 0.00 N ATOM 9 CA SER A 2 -32.475 -27.371 5.041 1.00 0.00 C ATOM 10 C SER A 2 -31.238 -27.473 4.152 1.00 0.00 C ATOM 11 O SER A 2 -31.301 -27.215 2.951 1.00 0.00 O ATOM 12 CB SER A 2 -33.356 -28.607 4.850 1.00 0.00 C ATOM 13 OG SER A 2 -33.534 -28.900 3.476 1.00 0.00 O ATOM 0 H SER A 2 -33.142 -25.834 3.780 1.00 0.00 H new ATOM 0 HA SER A 2 -32.151 -27.320 6.081 1.00 0.00 H new ATOM 0 HB2 SER A 2 -32.902 -29.462 5.351 1.00 0.00 H new ATOM 0 HB3 SER A 2 -34.326 -28.441 5.318 1.00 0.00 H new ATOM 0 HG SER A 2 -34.099 -29.695 3.382 1.00 0.00 H new ATOM 19 N SER A 3 -30.114 -27.848 4.754 1.00 0.00 N ATOM 20 CA SER A 3 -28.861 -27.980 4.021 1.00 0.00 C ATOM 21 C SER A 3 -28.927 -29.144 3.037 1.00 0.00 C ATOM 22 O SER A 3 -29.252 -30.270 3.412 1.00 0.00 O ATOM 23 CB SER A 3 -27.696 -28.183 4.991 1.00 0.00 C ATOM 24 OG SER A 3 -27.478 -27.023 5.776 1.00 0.00 O ATOM 0 H SER A 3 -30.046 -28.066 5.748 1.00 0.00 H new ATOM 0 HA SER A 3 -28.700 -27.060 3.459 1.00 0.00 H new ATOM 0 HB2 SER A 3 -27.904 -29.032 5.642 1.00 0.00 H new ATOM 0 HB3 SER A 3 -26.791 -28.423 4.433 1.00 0.00 H new ATOM 0 HG SER A 3 -26.729 -27.179 6.389 1.00 0.00 H new ATOM 30 N GLY A 4 -28.618 -28.863 1.775 1.00 0.00 N ATOM 31 CA GLY A 4 -28.648 -29.896 0.756 1.00 0.00 C ATOM 32 C GLY A 4 -28.512 -29.333 -0.645 1.00 0.00 C ATOM 33 O GLY A 4 -27.487 -29.520 -1.299 1.00 0.00 O ATOM 0 H GLY A 4 -28.347 -27.938 1.440 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -27.841 -30.606 0.939 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -29.584 -30.450 0.832 1.00 0.00 H new ATOM 37 N SER A 5 -29.549 -28.642 -1.106 1.00 0.00 N ATOM 38 CA SER A 5 -29.544 -28.054 -2.440 1.00 0.00 C ATOM 39 C SER A 5 -28.437 -27.012 -2.571 1.00 0.00 C ATOM 40 O SER A 5 -28.690 -25.809 -2.503 1.00 0.00 O ATOM 41 CB SER A 5 -30.900 -27.415 -2.745 1.00 0.00 C ATOM 42 OG SER A 5 -30.922 -26.863 -4.051 1.00 0.00 O ATOM 0 H SER A 5 -30.404 -28.475 -0.575 1.00 0.00 H new ATOM 0 HA SER A 5 -29.356 -28.851 -3.160 1.00 0.00 H new ATOM 0 HB2 SER A 5 -31.687 -28.163 -2.650 1.00 0.00 H new ATOM 0 HB3 SER A 5 -31.111 -26.635 -2.013 1.00 0.00 H new ATOM 0 HG SER A 5 -31.800 -26.462 -4.222 1.00 0.00 H new ATOM 48 N SER A 6 -27.208 -27.484 -2.758 1.00 0.00 N ATOM 49 CA SER A 6 -26.061 -26.595 -2.894 1.00 0.00 C ATOM 50 C SER A 6 -25.829 -26.227 -4.357 1.00 0.00 C ATOM 51 O SER A 6 -26.112 -27.013 -5.258 1.00 0.00 O ATOM 52 CB SER A 6 -24.806 -27.255 -2.319 1.00 0.00 C ATOM 53 OG SER A 6 -25.012 -27.654 -0.974 1.00 0.00 O ATOM 0 H SER A 6 -26.982 -28.477 -2.819 1.00 0.00 H new ATOM 0 HA SER A 6 -26.272 -25.683 -2.336 1.00 0.00 H new ATOM 0 HB2 SER A 6 -24.538 -28.122 -2.922 1.00 0.00 H new ATOM 0 HB3 SER A 6 -23.969 -26.559 -2.371 1.00 0.00 H new ATOM 0 HG SER A 6 -25.697 -28.354 -0.942 1.00 0.00 H new ATOM 59 N GLY A 7 -25.312 -25.022 -4.581 1.00 0.00 N ATOM 60 CA GLY A 7 -25.051 -24.569 -5.935 1.00 0.00 C ATOM 61 C GLY A 7 -24.294 -23.256 -5.971 1.00 0.00 C ATOM 62 O GLY A 7 -23.109 -23.208 -5.644 1.00 0.00 O ATOM 0 H GLY A 7 -25.070 -24.353 -3.850 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -24.478 -25.330 -6.465 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -25.996 -24.454 -6.465 1.00 0.00 H new ATOM 66 N GLN A 8 -24.979 -22.190 -6.371 1.00 0.00 N ATOM 67 CA GLN A 8 -24.361 -20.872 -6.451 1.00 0.00 C ATOM 68 C GLN A 8 -23.405 -20.647 -5.285 1.00 0.00 C ATOM 69 O GLN A 8 -22.458 -19.869 -5.388 1.00 0.00 O ATOM 70 CB GLN A 8 -25.435 -19.783 -6.463 1.00 0.00 C ATOM 71 CG GLN A 8 -25.971 -19.472 -7.851 1.00 0.00 C ATOM 72 CD GLN A 8 -26.723 -20.638 -8.461 1.00 0.00 C ATOM 73 OE1 GLN A 8 -27.930 -20.785 -8.263 1.00 0.00 O ATOM 74 NE2 GLN A 8 -26.014 -21.475 -9.208 1.00 0.00 N ATOM 0 H GLN A 8 -25.961 -22.213 -6.645 1.00 0.00 H new ATOM 0 HA GLN A 8 -23.791 -20.821 -7.379 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -26.262 -20.093 -5.824 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -25.022 -18.872 -6.030 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -26.632 -18.607 -7.796 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -25.142 -19.198 -8.503 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -25.016 -21.315 -9.346 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -26.467 -22.278 -9.644 1.00 0.00 H new ATOM 83 N GLU A 9 -23.661 -21.334 -4.176 1.00 0.00 N ATOM 84 CA GLU A 9 -22.823 -21.208 -2.989 1.00 0.00 C ATOM 85 C GLU A 9 -21.580 -22.085 -3.105 1.00 0.00 C ATOM 86 O GLU A 9 -21.143 -22.693 -2.127 1.00 0.00 O ATOM 87 CB GLU A 9 -23.614 -21.588 -1.736 1.00 0.00 C ATOM 88 CG GLU A 9 -24.384 -20.428 -1.126 1.00 0.00 C ATOM 89 CD GLU A 9 -25.791 -20.309 -1.676 1.00 0.00 C ATOM 90 OE1 GLU A 9 -26.493 -21.340 -1.739 1.00 0.00 O ATOM 91 OE2 GLU A 9 -26.192 -19.184 -2.042 1.00 0.00 O ATOM 0 H GLU A 9 -24.441 -21.983 -4.075 1.00 0.00 H new ATOM 0 HA GLU A 9 -22.506 -20.168 -2.908 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -24.314 -22.386 -1.986 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -22.927 -21.989 -0.991 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -24.430 -20.556 -0.045 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -23.845 -19.500 -1.314 1.00 0.00 H new ATOM 98 N TYR A 10 -21.016 -22.147 -4.306 1.00 0.00 N ATOM 99 CA TYR A 10 -19.826 -22.952 -4.552 1.00 0.00 C ATOM 100 C TYR A 10 -18.602 -22.333 -3.884 1.00 0.00 C ATOM 101 O TYR A 10 -17.928 -22.976 -3.079 1.00 0.00 O ATOM 102 CB TYR A 10 -19.582 -23.095 -6.055 1.00 0.00 C ATOM 103 CG TYR A 10 -19.793 -21.813 -6.828 1.00 0.00 C ATOM 104 CD1 TYR A 10 -21.052 -21.461 -7.299 1.00 0.00 C ATOM 105 CD2 TYR A 10 -18.733 -20.952 -7.084 1.00 0.00 C ATOM 106 CE1 TYR A 10 -21.248 -20.291 -8.006 1.00 0.00 C ATOM 107 CE2 TYR A 10 -18.921 -19.778 -7.789 1.00 0.00 C ATOM 108 CZ TYR A 10 -20.180 -19.452 -8.249 1.00 0.00 C ATOM 109 OH TYR A 10 -20.371 -18.285 -8.951 1.00 0.00 O ATOM 0 H TYR A 10 -21.364 -21.649 -5.125 1.00 0.00 H new ATOM 0 HA TYR A 10 -19.992 -23.940 -4.122 1.00 0.00 H new ATOM 0 HB2 TYR A 10 -18.562 -23.443 -6.217 1.00 0.00 H new ATOM 0 HB3 TYR A 10 -20.248 -23.862 -6.451 1.00 0.00 H new ATOM 0 HD1 TYR A 10 -21.891 -22.113 -7.109 1.00 0.00 H new ATOM 0 HD2 TYR A 10 -17.746 -21.204 -6.726 1.00 0.00 H new ATOM 0 HE1 TYR A 10 -22.233 -20.034 -8.367 1.00 0.00 H new ATOM 0 HE2 TYR A 10 -18.086 -19.119 -7.979 1.00 0.00 H new ATOM 0 HH TYR A 10 -19.518 -17.810 -9.034 1.00 0.00 H new ATOM 119 N ILE A 11 -18.321 -21.080 -4.224 1.00 0.00 N ATOM 120 CA ILE A 11 -17.180 -20.371 -3.657 1.00 0.00 C ATOM 121 C ILE A 11 -17.619 -19.084 -2.968 1.00 0.00 C ATOM 122 O ILE A 11 -17.030 -18.668 -1.970 1.00 0.00 O ATOM 123 CB ILE A 11 -16.134 -20.033 -4.736 1.00 0.00 C ATOM 124 CG1 ILE A 11 -15.509 -21.314 -5.291 1.00 0.00 C ATOM 125 CG2 ILE A 11 -15.062 -19.117 -4.165 1.00 0.00 C ATOM 126 CD1 ILE A 11 -14.925 -21.151 -6.677 1.00 0.00 C ATOM 0 H ILE A 11 -18.868 -20.534 -4.890 1.00 0.00 H new ATOM 0 HA ILE A 11 -16.728 -21.037 -2.922 1.00 0.00 H new ATOM 0 HB ILE A 11 -16.632 -19.512 -5.554 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -14.725 -21.649 -4.612 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -16.267 -22.097 -5.315 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -14.330 -18.887 -4.939 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -15.522 -18.193 -3.814 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -14.565 -19.614 -3.332 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -14.500 -22.099 -7.006 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -15.710 -20.846 -7.369 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -14.144 -20.391 -6.656 1.00 0.00 H new ATOM 138 N LEU A 12 -18.659 -18.456 -3.508 1.00 0.00 N ATOM 139 CA LEU A 12 -19.179 -17.214 -2.945 1.00 0.00 C ATOM 140 C LEU A 12 -19.611 -17.413 -1.496 1.00 0.00 C ATOM 141 O LEU A 12 -19.730 -16.453 -0.736 1.00 0.00 O ATOM 142 CB LEU A 12 -20.359 -16.709 -3.776 1.00 0.00 C ATOM 143 CG LEU A 12 -20.043 -16.311 -5.219 1.00 0.00 C ATOM 144 CD1 LEU A 12 -21.324 -16.150 -6.022 1.00 0.00 C ATOM 145 CD2 LEU A 12 -19.226 -15.027 -5.250 1.00 0.00 C ATOM 0 H LEU A 12 -19.158 -18.786 -4.334 1.00 0.00 H new ATOM 0 HA LEU A 12 -18.382 -16.471 -2.969 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -21.124 -17.485 -3.794 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -20.792 -15.847 -3.269 1.00 0.00 H new ATOM 0 HG LEU A 12 -19.452 -17.106 -5.674 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -21.079 -15.867 -7.046 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -21.871 -17.093 -6.028 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -21.942 -15.375 -5.569 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -19.010 -14.758 -6.284 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -19.792 -14.224 -4.777 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -18.291 -15.178 -4.711 1.00 0.00 H new ATOM 157 N ALA A 13 -19.843 -18.666 -1.120 1.00 0.00 N ATOM 158 CA ALA A 13 -20.258 -18.992 0.239 1.00 0.00 C ATOM 159 C ALA A 13 -19.073 -18.962 1.197 1.00 0.00 C ATOM 160 O ALA A 13 -19.211 -18.581 2.361 1.00 0.00 O ATOM 161 CB ALA A 13 -20.932 -20.356 0.273 1.00 0.00 C ATOM 0 H ALA A 13 -19.751 -19.473 -1.738 1.00 0.00 H new ATOM 0 HA ALA A 13 -20.974 -18.237 0.564 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -21.236 -20.586 1.294 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -21.810 -20.344 -0.373 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -20.233 -21.116 -0.077 1.00 0.00 H new ATOM 167 N LEU A 14 -17.907 -19.364 0.702 1.00 0.00 N ATOM 168 CA LEU A 14 -16.696 -19.383 1.515 1.00 0.00 C ATOM 169 C LEU A 14 -15.835 -18.155 1.238 1.00 0.00 C ATOM 170 O LEU A 14 -14.727 -18.032 1.759 1.00 0.00 O ATOM 171 CB LEU A 14 -15.894 -20.656 1.240 1.00 0.00 C ATOM 172 CG LEU A 14 -16.682 -21.966 1.266 1.00 0.00 C ATOM 173 CD1 LEU A 14 -15.988 -23.024 0.424 1.00 0.00 C ATOM 174 CD2 LEU A 14 -16.861 -22.452 2.697 1.00 0.00 C ATOM 0 H LEU A 14 -17.775 -19.681 -0.258 1.00 0.00 H new ATOM 0 HA LEU A 14 -16.991 -19.367 2.564 1.00 0.00 H new ATOM 0 HB2 LEU A 14 -15.421 -20.559 0.263 1.00 0.00 H new ATOM 0 HB3 LEU A 14 -15.093 -20.723 1.976 1.00 0.00 H new ATOM 0 HG LEU A 14 -17.668 -21.783 0.840 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -16.564 -23.949 0.455 1.00 0.00 H new ATOM 0 HD12 LEU A 14 -15.913 -22.677 -0.607 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -14.988 -23.205 0.819 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -17.424 -23.385 2.697 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -15.884 -22.618 3.150 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -17.404 -21.701 3.271 1.00 0.00 H new ATOM 186 N ALA A 15 -16.353 -17.249 0.417 1.00 0.00 N ATOM 187 CA ALA A 15 -15.633 -16.028 0.074 1.00 0.00 C ATOM 188 C ALA A 15 -15.726 -15.002 1.197 1.00 0.00 C ATOM 189 O ALA A 15 -16.809 -14.511 1.515 1.00 0.00 O ATOM 190 CB ALA A 15 -16.174 -15.444 -1.223 1.00 0.00 C ATOM 0 H ALA A 15 -17.269 -17.337 -0.024 1.00 0.00 H new ATOM 0 HA ALA A 15 -14.582 -16.282 -0.064 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -15.628 -14.533 -1.467 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -16.050 -16.168 -2.028 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -17.232 -15.212 -1.104 1.00 0.00 H new ATOM 196 N ASP A 16 -14.584 -14.684 1.797 1.00 0.00 N ATOM 197 CA ASP A 16 -14.536 -13.715 2.886 1.00 0.00 C ATOM 198 C ASP A 16 -14.002 -12.372 2.397 1.00 0.00 C ATOM 199 O ASP A 16 -14.758 -11.417 2.225 1.00 0.00 O ATOM 200 CB ASP A 16 -13.663 -14.241 4.027 1.00 0.00 C ATOM 201 CG ASP A 16 -14.377 -15.277 4.872 1.00 0.00 C ATOM 202 OD1 ASP A 16 -14.411 -16.456 4.462 1.00 0.00 O ATOM 203 OD2 ASP A 16 -14.904 -14.909 5.943 1.00 0.00 O ATOM 0 H ASP A 16 -13.679 -15.083 1.548 1.00 0.00 H new ATOM 0 HA ASP A 16 -15.552 -13.569 3.254 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -12.754 -14.678 3.613 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -13.357 -13.408 4.660 1.00 0.00 H new ATOM 208 N VAL A 17 -12.693 -12.308 2.176 1.00 0.00 N ATOM 209 CA VAL A 17 -12.056 -11.083 1.707 1.00 0.00 C ATOM 210 C VAL A 17 -10.569 -11.300 1.450 1.00 0.00 C ATOM 211 O VAL A 17 -9.959 -12.245 1.950 1.00 0.00 O ATOM 212 CB VAL A 17 -12.229 -9.937 2.721 1.00 0.00 C ATOM 213 CG1 VAL A 17 -13.483 -9.134 2.412 1.00 0.00 C ATOM 214 CG2 VAL A 17 -12.273 -10.483 4.140 1.00 0.00 C ATOM 0 H VAL A 17 -12.053 -13.090 2.314 1.00 0.00 H new ATOM 0 HA VAL A 17 -12.546 -10.809 0.773 1.00 0.00 H new ATOM 0 HB VAL A 17 -11.370 -9.271 2.638 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -13.588 -8.329 3.139 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -13.406 -8.711 1.411 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -14.355 -9.786 2.464 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -12.396 -9.659 4.843 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -13.112 -11.172 4.239 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -11.343 -11.009 4.356 1.00 0.00 H new ATOM 224 N PRO A 18 -9.970 -10.405 0.651 1.00 0.00 N ATOM 225 CA PRO A 18 -8.546 -10.476 0.310 1.00 0.00 C ATOM 226 C PRO A 18 -7.648 -10.160 1.502 1.00 0.00 C ATOM 227 O PRO A 18 -7.979 -9.315 2.334 1.00 0.00 O ATOM 228 CB PRO A 18 -8.388 -9.409 -0.776 1.00 0.00 C ATOM 229 CG PRO A 18 -9.492 -8.442 -0.521 1.00 0.00 C ATOM 230 CD PRO A 18 -10.636 -9.253 0.020 1.00 0.00 C ATOM 0 HA PRO A 18 -8.253 -11.476 -0.010 1.00 0.00 H new ATOM 0 HB2 PRO A 18 -7.414 -8.923 -0.715 1.00 0.00 H new ATOM 0 HB3 PRO A 18 -8.465 -9.844 -1.772 1.00 0.00 H new ATOM 0 HG2 PRO A 18 -9.184 -7.677 0.192 1.00 0.00 H new ATOM 0 HG3 PRO A 18 -9.778 -7.926 -1.438 1.00 0.00 H new ATOM 0 HD2 PRO A 18 -11.225 -8.686 0.740 1.00 0.00 H new ATOM 0 HD3 PRO A 18 -11.316 -9.566 -0.772 1.00 0.00 H new ATOM 238 N SER A 19 -6.511 -10.844 1.577 1.00 0.00 N ATOM 239 CA SER A 19 -5.566 -10.638 2.669 1.00 0.00 C ATOM 240 C SER A 19 -4.715 -9.396 2.424 1.00 0.00 C ATOM 241 O SER A 19 -4.644 -8.888 1.304 1.00 0.00 O ATOM 242 CB SER A 19 -4.665 -11.864 2.830 1.00 0.00 C ATOM 243 OG SER A 19 -4.084 -11.904 4.121 1.00 0.00 O ATOM 0 H SER A 19 -6.222 -11.545 0.895 1.00 0.00 H new ATOM 0 HA SER A 19 -6.136 -10.492 3.587 1.00 0.00 H new ATOM 0 HB2 SER A 19 -5.246 -12.771 2.661 1.00 0.00 H new ATOM 0 HB3 SER A 19 -3.879 -11.843 2.075 1.00 0.00 H new ATOM 0 HG SER A 19 -3.514 -12.698 4.199 1.00 0.00 H new ATOM 249 N SER A 20 -4.069 -8.912 3.480 1.00 0.00 N ATOM 250 CA SER A 20 -3.225 -7.726 3.382 1.00 0.00 C ATOM 251 C SER A 20 -2.065 -7.963 2.418 1.00 0.00 C ATOM 252 O SER A 20 -1.449 -9.029 2.398 1.00 0.00 O ATOM 253 CB SER A 20 -2.686 -7.343 4.761 1.00 0.00 C ATOM 254 OG SER A 20 -1.408 -6.738 4.660 1.00 0.00 O ATOM 0 H SER A 20 -4.114 -9.322 4.413 1.00 0.00 H new ATOM 0 HA SER A 20 -3.834 -6.908 2.997 1.00 0.00 H new ATOM 0 HB2 SER A 20 -3.379 -6.657 5.248 1.00 0.00 H new ATOM 0 HB3 SER A 20 -2.623 -8.231 5.390 1.00 0.00 H new ATOM 0 HG SER A 20 -0.836 -7.057 5.389 1.00 0.00 H new ATOM 260 N PRO A 21 -1.760 -6.945 1.600 1.00 0.00 N ATOM 261 CA PRO A 21 -0.674 -7.017 0.619 1.00 0.00 C ATOM 262 C PRO A 21 0.701 -7.029 1.277 1.00 0.00 C ATOM 263 O PRO A 21 0.814 -7.008 2.503 1.00 0.00 O ATOM 264 CB PRO A 21 -0.860 -5.743 -0.210 1.00 0.00 C ATOM 265 CG PRO A 21 -1.565 -4.799 0.701 1.00 0.00 C ATOM 266 CD PRO A 21 -2.453 -5.646 1.569 1.00 0.00 C ATOM 0 HA PRO A 21 -0.715 -7.934 0.031 1.00 0.00 H new ATOM 0 HB2 PRO A 21 0.099 -5.338 -0.535 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -1.445 -5.937 -1.109 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -0.854 -4.234 1.304 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -2.150 -4.074 0.135 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -2.560 -5.223 2.568 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -3.456 -5.735 1.152 1.00 0.00 H new ATOM 274 N TYR A 22 1.745 -7.061 0.456 1.00 0.00 N ATOM 275 CA TYR A 22 3.114 -7.077 0.959 1.00 0.00 C ATOM 276 C TYR A 22 4.061 -6.389 -0.019 1.00 0.00 C ATOM 277 O TYR A 22 3.673 -6.029 -1.129 1.00 0.00 O ATOM 278 CB TYR A 22 3.572 -8.515 1.204 1.00 0.00 C ATOM 279 CG TYR A 22 3.412 -9.416 -0.001 1.00 0.00 C ATOM 280 CD1 TYR A 22 2.217 -10.087 -0.236 1.00 0.00 C ATOM 281 CD2 TYR A 22 4.453 -9.597 -0.902 1.00 0.00 C ATOM 282 CE1 TYR A 22 2.066 -10.911 -1.334 1.00 0.00 C ATOM 283 CE2 TYR A 22 4.310 -10.418 -2.004 1.00 0.00 C ATOM 284 CZ TYR A 22 3.115 -11.073 -2.215 1.00 0.00 C ATOM 285 OH TYR A 22 2.969 -11.893 -3.311 1.00 0.00 O ATOM 0 H TYR A 22 1.669 -7.076 -0.561 1.00 0.00 H new ATOM 0 HA TYR A 22 3.135 -6.531 1.902 1.00 0.00 H new ATOM 0 HB2 TYR A 22 4.620 -8.507 1.505 1.00 0.00 H new ATOM 0 HB3 TYR A 22 3.004 -8.931 2.036 1.00 0.00 H new ATOM 0 HD1 TYR A 22 1.393 -9.962 0.451 1.00 0.00 H new ATOM 0 HD2 TYR A 22 5.391 -9.087 -0.738 1.00 0.00 H new ATOM 0 HE1 TYR A 22 1.132 -11.426 -1.502 1.00 0.00 H new ATOM 0 HE2 TYR A 22 5.129 -10.546 -2.696 1.00 0.00 H new ATOM 0 HH TYR A 22 3.800 -11.896 -3.830 1.00 0.00 H new ATOM 295 N GLY A 23 5.309 -6.210 0.403 1.00 0.00 N ATOM 296 CA GLY A 23 6.294 -5.566 -0.445 1.00 0.00 C ATOM 297 C GLY A 23 6.115 -4.062 -0.505 1.00 0.00 C ATOM 298 O GLY A 23 6.971 -3.347 -1.025 1.00 0.00 O ATOM 0 H GLY A 23 5.655 -6.500 1.318 1.00 0.00 H new ATOM 0 HA2 GLY A 23 7.293 -5.795 -0.074 1.00 0.00 H new ATOM 0 HA3 GLY A 23 6.226 -5.977 -1.452 1.00 0.00 H new ATOM 302 N VAL A 24 4.998 -3.579 0.029 1.00 0.00 N ATOM 303 CA VAL A 24 4.708 -2.151 0.035 1.00 0.00 C ATOM 304 C VAL A 24 5.935 -1.343 0.439 1.00 0.00 C ATOM 305 O VAL A 24 6.485 -1.528 1.526 1.00 0.00 O ATOM 306 CB VAL A 24 3.548 -1.817 0.992 1.00 0.00 C ATOM 307 CG1 VAL A 24 3.651 -2.644 2.265 1.00 0.00 C ATOM 308 CG2 VAL A 24 3.534 -0.330 1.313 1.00 0.00 C ATOM 0 H VAL A 24 4.278 -4.157 0.464 1.00 0.00 H new ATOM 0 HA VAL A 24 4.419 -1.883 -0.981 1.00 0.00 H new ATOM 0 HB VAL A 24 2.609 -2.068 0.499 1.00 0.00 H new ATOM 0 HG11 VAL A 24 2.823 -2.395 2.929 1.00 0.00 H new ATOM 0 HG12 VAL A 24 3.609 -3.704 2.015 1.00 0.00 H new ATOM 0 HG13 VAL A 24 4.595 -2.427 2.765 1.00 0.00 H new ATOM 0 HG21 VAL A 24 2.708 -0.112 1.990 1.00 0.00 H new ATOM 0 HG22 VAL A 24 4.475 -0.051 1.787 1.00 0.00 H new ATOM 0 HG23 VAL A 24 3.409 0.240 0.392 1.00 0.00 H new ATOM 318 N LYS A 25 6.361 -0.444 -0.441 1.00 0.00 N ATOM 319 CA LYS A 25 7.523 0.396 -0.177 1.00 0.00 C ATOM 320 C LYS A 25 7.476 1.670 -1.014 1.00 0.00 C ATOM 321 O LYS A 25 6.959 1.671 -2.132 1.00 0.00 O ATOM 322 CB LYS A 25 8.812 -0.374 -0.473 1.00 0.00 C ATOM 323 CG LYS A 25 8.790 -1.111 -1.800 1.00 0.00 C ATOM 324 CD LYS A 25 9.317 -0.241 -2.930 1.00 0.00 C ATOM 325 CE LYS A 25 10.820 -0.401 -3.102 1.00 0.00 C ATOM 326 NZ LYS A 25 11.191 -1.791 -3.483 1.00 0.00 N ATOM 0 H LYS A 25 5.918 -0.278 -1.345 1.00 0.00 H new ATOM 0 HA LYS A 25 7.507 0.674 0.877 1.00 0.00 H new ATOM 0 HB2 LYS A 25 9.650 0.323 -0.468 1.00 0.00 H new ATOM 0 HB3 LYS A 25 8.989 -1.091 0.328 1.00 0.00 H new ATOM 0 HG2 LYS A 25 9.393 -2.016 -1.725 1.00 0.00 H new ATOM 0 HG3 LYS A 25 7.771 -1.425 -2.026 1.00 0.00 H new ATOM 0 HD2 LYS A 25 8.813 -0.506 -3.860 1.00 0.00 H new ATOM 0 HD3 LYS A 25 9.082 0.804 -2.726 1.00 0.00 H new ATOM 0 HE2 LYS A 25 11.174 0.291 -3.866 1.00 0.00 H new ATOM 0 HE3 LYS A 25 11.322 -0.133 -2.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 12.074 -1.776 -4.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 11.328 -2.362 -2.624 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 10.431 -2.208 -4.058 1.00 0.00 H new ATOM 340 N ILE A 26 8.020 2.752 -0.468 1.00 0.00 N ATOM 341 CA ILE A 26 8.043 4.031 -1.167 1.00 0.00 C ATOM 342 C ILE A 26 9.237 4.121 -2.111 1.00 0.00 C ATOM 343 O ILE A 26 10.376 4.285 -1.673 1.00 0.00 O ATOM 344 CB ILE A 26 8.092 5.212 -0.179 1.00 0.00 C ATOM 345 CG1 ILE A 26 7.219 4.920 1.042 1.00 0.00 C ATOM 346 CG2 ILE A 26 7.645 6.494 -0.864 1.00 0.00 C ATOM 347 CD1 ILE A 26 5.801 4.528 0.691 1.00 0.00 C ATOM 0 H ILE A 26 8.451 2.769 0.456 1.00 0.00 H new ATOM 0 HA ILE A 26 7.121 4.091 -1.746 1.00 0.00 H new ATOM 0 HB ILE A 26 9.120 5.343 0.157 1.00 0.00 H new ATOM 0 HG12 ILE A 26 7.676 4.118 1.622 1.00 0.00 H new ATOM 0 HG13 ILE A 26 7.196 5.802 1.681 1.00 0.00 H new ATOM 0 HG21 ILE A 26 7.685 7.319 -0.153 1.00 0.00 H new ATOM 0 HG22 ILE A 26 8.305 6.707 -1.705 1.00 0.00 H new ATOM 0 HG23 ILE A 26 6.624 6.376 -1.226 1.00 0.00 H new ATOM 0 HD11 ILE A 26 5.240 4.336 1.605 1.00 0.00 H new ATOM 0 HD12 ILE A 26 5.326 5.338 0.137 1.00 0.00 H new ATOM 0 HD13 ILE A 26 5.814 3.627 0.077 1.00 0.00 H new ATOM 359 N ILE A 27 8.968 4.016 -3.409 1.00 0.00 N ATOM 360 CA ILE A 27 10.020 4.090 -4.414 1.00 0.00 C ATOM 361 C ILE A 27 10.395 5.537 -4.713 1.00 0.00 C ATOM 362 O ILE A 27 11.572 5.863 -4.869 1.00 0.00 O ATOM 363 CB ILE A 27 9.596 3.400 -5.724 1.00 0.00 C ATOM 364 CG1 ILE A 27 8.297 4.014 -6.252 1.00 0.00 C ATOM 365 CG2 ILE A 27 9.429 1.904 -5.505 1.00 0.00 C ATOM 366 CD1 ILE A 27 7.877 3.474 -7.601 1.00 0.00 C ATOM 0 H ILE A 27 8.031 3.880 -3.788 1.00 0.00 H new ATOM 0 HA ILE A 27 10.886 3.571 -4.003 1.00 0.00 H new ATOM 0 HB ILE A 27 10.378 3.554 -6.468 1.00 0.00 H new ATOM 0 HG12 ILE A 27 7.499 3.831 -5.532 1.00 0.00 H new ATOM 0 HG13 ILE A 27 8.419 5.095 -6.324 1.00 0.00 H new ATOM 0 HG21 ILE A 27 9.129 1.431 -6.440 1.00 0.00 H new ATOM 0 HG22 ILE A 27 10.374 1.478 -5.169 1.00 0.00 H new ATOM 0 HG23 ILE A 27 8.664 1.730 -4.749 1.00 0.00 H new ATOM 0 HD11 ILE A 27 6.949 3.954 -7.912 1.00 0.00 H new ATOM 0 HD12 ILE A 27 8.656 3.681 -8.334 1.00 0.00 H new ATOM 0 HD13 ILE A 27 7.722 2.397 -7.530 1.00 0.00 H new ATOM 378 N GLU A 28 9.388 6.400 -4.789 1.00 0.00 N ATOM 379 CA GLU A 28 9.613 7.813 -5.069 1.00 0.00 C ATOM 380 C GLU A 28 9.087 8.683 -3.931 1.00 0.00 C ATOM 381 O GLU A 28 7.926 9.097 -3.935 1.00 0.00 O ATOM 382 CB GLU A 28 8.937 8.210 -6.383 1.00 0.00 C ATOM 383 CG GLU A 28 9.472 7.463 -7.593 1.00 0.00 C ATOM 384 CD GLU A 28 9.339 8.260 -8.877 1.00 0.00 C ATOM 385 OE1 GLU A 28 9.749 9.440 -8.887 1.00 0.00 O ATOM 386 OE2 GLU A 28 8.825 7.705 -9.870 1.00 0.00 O ATOM 0 H GLU A 28 8.409 6.146 -4.661 1.00 0.00 H new ATOM 0 HA GLU A 28 10.687 7.972 -5.159 1.00 0.00 H new ATOM 0 HB2 GLU A 28 7.865 8.029 -6.300 1.00 0.00 H new ATOM 0 HB3 GLU A 28 9.068 9.281 -6.540 1.00 0.00 H new ATOM 0 HG2 GLU A 28 10.521 7.218 -7.429 1.00 0.00 H new ATOM 0 HG3 GLU A 28 8.937 6.519 -7.699 1.00 0.00 H new ATOM 393 N LEU A 29 9.948 8.956 -2.957 1.00 0.00 N ATOM 394 CA LEU A 29 9.572 9.776 -1.811 1.00 0.00 C ATOM 395 C LEU A 29 9.984 11.230 -2.022 1.00 0.00 C ATOM 396 O LEU A 29 11.145 11.520 -2.311 1.00 0.00 O ATOM 397 CB LEU A 29 10.216 9.231 -0.535 1.00 0.00 C ATOM 398 CG LEU A 29 9.435 9.455 0.760 1.00 0.00 C ATOM 399 CD1 LEU A 29 10.258 9.021 1.962 1.00 0.00 C ATOM 400 CD2 LEU A 29 9.025 10.915 0.891 1.00 0.00 C ATOM 0 H LEU A 29 10.911 8.621 -2.938 1.00 0.00 H new ATOM 0 HA LEU A 29 8.488 9.737 -1.708 1.00 0.00 H new ATOM 0 HB2 LEU A 29 10.373 8.160 -0.660 1.00 0.00 H new ATOM 0 HB3 LEU A 29 11.200 9.687 -0.426 1.00 0.00 H new ATOM 0 HG LEU A 29 8.531 8.847 0.726 1.00 0.00 H new ATOM 0 HD11 LEU A 29 9.686 9.188 2.874 1.00 0.00 H new ATOM 0 HD12 LEU A 29 10.500 7.962 1.874 1.00 0.00 H new ATOM 0 HD13 LEU A 29 11.180 9.602 2.001 1.00 0.00 H new ATOM 0 HD21 LEU A 29 8.470 11.055 1.819 1.00 0.00 H new ATOM 0 HD22 LEU A 29 9.916 11.543 0.902 1.00 0.00 H new ATOM 0 HD23 LEU A 29 8.395 11.193 0.046 1.00 0.00 H new ATOM 412 N SER A 30 9.028 12.140 -1.873 1.00 0.00 N ATOM 413 CA SER A 30 9.291 13.563 -2.049 1.00 0.00 C ATOM 414 C SER A 30 8.989 14.334 -0.768 1.00 0.00 C ATOM 415 O SER A 30 8.659 13.744 0.260 1.00 0.00 O ATOM 416 CB SER A 30 8.453 14.119 -3.202 1.00 0.00 C ATOM 417 OG SER A 30 8.546 13.290 -4.348 1.00 0.00 O ATOM 0 H SER A 30 8.063 11.917 -1.630 1.00 0.00 H new ATOM 0 HA SER A 30 10.348 13.685 -2.285 1.00 0.00 H new ATOM 0 HB2 SER A 30 7.411 14.200 -2.892 1.00 0.00 H new ATOM 0 HB3 SER A 30 8.791 15.125 -3.449 1.00 0.00 H new ATOM 0 HG SER A 30 7.716 13.353 -4.865 1.00 0.00 H new ATOM 423 N GLN A 31 9.106 15.656 -0.839 1.00 0.00 N ATOM 424 CA GLN A 31 8.847 16.508 0.316 1.00 0.00 C ATOM 425 C GLN A 31 7.361 16.836 0.427 1.00 0.00 C ATOM 426 O GLN A 31 6.848 17.078 1.520 1.00 0.00 O ATOM 427 CB GLN A 31 9.659 17.800 0.216 1.00 0.00 C ATOM 428 CG GLN A 31 9.656 18.415 -1.174 1.00 0.00 C ATOM 429 CD GLN A 31 10.793 17.910 -2.039 1.00 0.00 C ATOM 430 OE1 GLN A 31 10.577 17.440 -3.157 1.00 0.00 O ATOM 431 NE2 GLN A 31 12.015 18.006 -1.528 1.00 0.00 N ATOM 0 H GLN A 31 9.378 16.160 -1.683 1.00 0.00 H new ATOM 0 HA GLN A 31 9.150 15.965 1.211 1.00 0.00 H new ATOM 0 HB2 GLN A 31 9.261 18.525 0.926 1.00 0.00 H new ATOM 0 HB3 GLN A 31 10.688 17.596 0.512 1.00 0.00 H new ATOM 0 HG2 GLN A 31 8.707 18.194 -1.663 1.00 0.00 H new ATOM 0 HG3 GLN A 31 9.725 19.499 -1.087 1.00 0.00 H new ATOM 0 HE21 GLN A 31 12.149 18.402 -0.598 1.00 0.00 H new ATOM 0 HE22 GLN A 31 12.819 17.684 -2.066 1.00 0.00 H new ATOM 440 N THR A 32 6.674 16.844 -0.711 1.00 0.00 N ATOM 441 CA THR A 32 5.248 17.144 -0.741 1.00 0.00 C ATOM 442 C THR A 32 4.460 16.006 -1.382 1.00 0.00 C ATOM 443 O THR A 32 3.234 16.056 -1.465 1.00 0.00 O ATOM 444 CB THR A 32 4.964 18.446 -1.511 1.00 0.00 C ATOM 445 OG1 THR A 32 5.527 18.371 -2.826 1.00 0.00 O ATOM 446 CG2 THR A 32 5.542 19.647 -0.776 1.00 0.00 C ATOM 0 H THR A 32 7.082 16.646 -1.624 1.00 0.00 H new ATOM 0 HA THR A 32 4.929 17.266 0.294 1.00 0.00 H new ATOM 0 HB THR A 32 3.883 18.569 -1.585 1.00 0.00 H new ATOM 0 HG1 THR A 32 5.340 19.203 -3.310 1.00 0.00 H new ATOM 0 HG21 THR A 32 5.329 20.555 -1.339 1.00 0.00 H new ATOM 0 HG22 THR A 32 5.091 19.719 0.214 1.00 0.00 H new ATOM 0 HG23 THR A 32 6.621 19.527 -0.675 1.00 0.00 H new ATOM 454 N THR A 33 5.174 14.979 -1.834 1.00 0.00 N ATOM 455 CA THR A 33 4.542 13.829 -2.468 1.00 0.00 C ATOM 456 C THR A 33 5.219 12.529 -2.047 1.00 0.00 C ATOM 457 O THR A 33 6.392 12.520 -1.679 1.00 0.00 O ATOM 458 CB THR A 33 4.582 13.942 -4.003 1.00 0.00 C ATOM 459 OG1 THR A 33 5.806 14.556 -4.418 1.00 0.00 O ATOM 460 CG2 THR A 33 3.402 14.754 -4.516 1.00 0.00 C ATOM 0 H THR A 33 6.190 14.921 -1.772 1.00 0.00 H new ATOM 0 HA THR A 33 3.503 13.817 -2.139 1.00 0.00 H new ATOM 0 HB THR A 33 4.521 12.937 -4.421 1.00 0.00 H new ATOM 0 HG1 THR A 33 5.824 14.622 -5.396 1.00 0.00 H new ATOM 0 HG21 THR A 33 3.451 14.821 -5.603 1.00 0.00 H new ATOM 0 HG22 THR A 33 2.471 14.268 -4.224 1.00 0.00 H new ATOM 0 HG23 THR A 33 3.437 15.756 -4.089 1.00 0.00 H new ATOM 468 N ALA A 34 4.471 11.432 -2.107 1.00 0.00 N ATOM 469 CA ALA A 34 5.000 10.125 -1.736 1.00 0.00 C ATOM 470 C ALA A 34 4.365 9.019 -2.570 1.00 0.00 C ATOM 471 O ALA A 34 3.148 8.835 -2.554 1.00 0.00 O ATOM 472 CB ALA A 34 4.775 9.867 -0.254 1.00 0.00 C ATOM 0 H ALA A 34 3.497 11.422 -2.409 1.00 0.00 H new ATOM 0 HA ALA A 34 6.072 10.124 -1.935 1.00 0.00 H new ATOM 0 HB1 ALA A 34 5.175 8.888 0.010 1.00 0.00 H new ATOM 0 HB2 ALA A 34 5.282 10.635 0.330 1.00 0.00 H new ATOM 0 HB3 ALA A 34 3.707 9.893 -0.038 1.00 0.00 H new ATOM 478 N LYS A 35 5.197 8.284 -3.301 1.00 0.00 N ATOM 479 CA LYS A 35 4.718 7.194 -4.142 1.00 0.00 C ATOM 480 C LYS A 35 4.840 5.855 -3.421 1.00 0.00 C ATOM 481 O LYS A 35 5.943 5.380 -3.156 1.00 0.00 O ATOM 482 CB LYS A 35 5.506 7.151 -5.454 1.00 0.00 C ATOM 483 CG LYS A 35 4.942 6.172 -6.470 1.00 0.00 C ATOM 484 CD LYS A 35 5.592 6.348 -7.833 1.00 0.00 C ATOM 485 CE LYS A 35 4.887 7.418 -8.652 1.00 0.00 C ATOM 486 NZ LYS A 35 5.649 7.768 -9.882 1.00 0.00 N ATOM 0 H LYS A 35 6.207 8.424 -3.328 1.00 0.00 H new ATOM 0 HA LYS A 35 3.666 7.374 -4.362 1.00 0.00 H new ATOM 0 HB2 LYS A 35 5.520 8.149 -5.892 1.00 0.00 H new ATOM 0 HB3 LYS A 35 6.540 6.883 -5.238 1.00 0.00 H new ATOM 0 HG2 LYS A 35 5.099 5.152 -6.120 1.00 0.00 H new ATOM 0 HG3 LYS A 35 3.865 6.317 -6.558 1.00 0.00 H new ATOM 0 HD2 LYS A 35 6.640 6.618 -7.705 1.00 0.00 H new ATOM 0 HD3 LYS A 35 5.570 5.401 -8.373 1.00 0.00 H new ATOM 0 HE2 LYS A 35 3.893 7.067 -8.929 1.00 0.00 H new ATOM 0 HE3 LYS A 35 4.752 8.311 -8.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 35 5.416 8.740 -10.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 35 6.669 7.699 -9.690 1.00 0.00 H new ATOM 0 HZ3 LYS A 35 5.396 7.110 -10.646 1.00 0.00 H new ATOM 500 N VAL A 36 3.698 5.252 -3.107 1.00 0.00 N ATOM 501 CA VAL A 36 3.676 3.967 -2.418 1.00 0.00 C ATOM 502 C VAL A 36 3.461 2.821 -3.400 1.00 0.00 C ATOM 503 O VAL A 36 2.374 2.663 -3.955 1.00 0.00 O ATOM 504 CB VAL A 36 2.573 3.924 -1.345 1.00 0.00 C ATOM 505 CG1 VAL A 36 1.198 4.038 -1.987 1.00 0.00 C ATOM 506 CG2 VAL A 36 2.681 2.650 -0.521 1.00 0.00 C ATOM 0 H VAL A 36 2.776 5.633 -3.319 1.00 0.00 H new ATOM 0 HA VAL A 36 4.646 3.850 -1.935 1.00 0.00 H new ATOM 0 HB VAL A 36 2.707 4.775 -0.677 1.00 0.00 H new ATOM 0 HG11 VAL A 36 0.431 4.006 -1.213 1.00 0.00 H new ATOM 0 HG12 VAL A 36 1.127 4.981 -2.529 1.00 0.00 H new ATOM 0 HG13 VAL A 36 1.050 3.209 -2.679 1.00 0.00 H new ATOM 0 HG21 VAL A 36 1.894 2.636 0.233 1.00 0.00 H new ATOM 0 HG22 VAL A 36 2.573 1.784 -1.174 1.00 0.00 H new ATOM 0 HG23 VAL A 36 3.654 2.615 -0.030 1.00 0.00 H new ATOM 516 N SER A 37 4.503 2.024 -3.609 1.00 0.00 N ATOM 517 CA SER A 37 4.429 0.892 -4.527 1.00 0.00 C ATOM 518 C SER A 37 4.379 -0.426 -3.761 1.00 0.00 C ATOM 519 O SER A 37 5.272 -0.734 -2.973 1.00 0.00 O ATOM 520 CB SER A 37 5.629 0.900 -5.475 1.00 0.00 C ATOM 521 OG SER A 37 5.565 -0.184 -6.387 1.00 0.00 O ATOM 0 H SER A 37 5.409 2.140 -3.155 1.00 0.00 H new ATOM 0 HA SER A 37 3.513 0.987 -5.110 1.00 0.00 H new ATOM 0 HB2 SER A 37 5.656 1.841 -6.025 1.00 0.00 H new ATOM 0 HB3 SER A 37 6.552 0.841 -4.899 1.00 0.00 H new ATOM 0 HG SER A 37 6.342 -0.156 -6.983 1.00 0.00 H new ATOM 527 N PHE A 38 3.326 -1.200 -3.999 1.00 0.00 N ATOM 528 CA PHE A 38 3.157 -2.487 -3.332 1.00 0.00 C ATOM 529 C PHE A 38 2.839 -3.585 -4.342 1.00 0.00 C ATOM 530 O PHE A 38 2.726 -3.329 -5.540 1.00 0.00 O ATOM 531 CB PHE A 38 2.043 -2.400 -2.287 1.00 0.00 C ATOM 532 CG PHE A 38 0.770 -1.802 -2.816 1.00 0.00 C ATOM 533 CD1 PHE A 38 0.633 -0.429 -2.937 1.00 0.00 C ATOM 534 CD2 PHE A 38 -0.289 -2.614 -3.190 1.00 0.00 C ATOM 535 CE1 PHE A 38 -0.537 0.125 -3.423 1.00 0.00 C ATOM 536 CE2 PHE A 38 -1.461 -2.065 -3.678 1.00 0.00 C ATOM 537 CZ PHE A 38 -1.585 -0.695 -3.793 1.00 0.00 C ATOM 0 H PHE A 38 2.577 -0.960 -4.648 1.00 0.00 H new ATOM 0 HA PHE A 38 4.094 -2.737 -2.834 1.00 0.00 H new ATOM 0 HB2 PHE A 38 1.834 -3.400 -1.906 1.00 0.00 H new ATOM 0 HB3 PHE A 38 2.392 -1.804 -1.444 1.00 0.00 H new ATOM 0 HD1 PHE A 38 1.449 0.216 -2.648 1.00 0.00 H new ATOM 0 HD2 PHE A 38 -0.198 -3.686 -3.099 1.00 0.00 H new ATOM 0 HE1 PHE A 38 -0.631 1.197 -3.513 1.00 0.00 H new ATOM 0 HE2 PHE A 38 -2.279 -2.708 -3.969 1.00 0.00 H new ATOM 0 HZ PHE A 38 -2.500 -0.265 -4.172 1.00 0.00 H new ATOM 547 N ASN A 39 2.694 -4.811 -3.849 1.00 0.00 N ATOM 548 CA ASN A 39 2.391 -5.950 -4.707 1.00 0.00 C ATOM 549 C ASN A 39 1.031 -6.548 -4.356 1.00 0.00 C ATOM 550 O ASN A 39 0.412 -6.169 -3.362 1.00 0.00 O ATOM 551 CB ASN A 39 3.479 -7.018 -4.577 1.00 0.00 C ATOM 552 CG ASN A 39 4.833 -6.523 -5.048 1.00 0.00 C ATOM 553 OD1 ASN A 39 5.065 -6.361 -6.246 1.00 0.00 O ATOM 554 ND2 ASN A 39 5.734 -6.282 -4.103 1.00 0.00 N ATOM 0 H ASN A 39 2.782 -5.041 -2.859 1.00 0.00 H new ATOM 0 HA ASN A 39 2.359 -5.598 -5.738 1.00 0.00 H new ATOM 0 HB2 ASN A 39 3.552 -7.334 -3.536 1.00 0.00 H new ATOM 0 HB3 ASN A 39 3.194 -7.896 -5.157 1.00 0.00 H new ATOM 0 HD21 ASN A 39 6.663 -5.948 -4.358 1.00 0.00 H new ATOM 0 HD22 ASN A 39 5.497 -6.431 -3.122 1.00 0.00 H new ATOM 561 N LYS A 40 0.573 -7.486 -5.179 1.00 0.00 N ATOM 562 CA LYS A 40 -0.712 -8.138 -4.956 1.00 0.00 C ATOM 563 C LYS A 40 -0.667 -9.017 -3.711 1.00 0.00 C ATOM 564 O LYS A 40 0.378 -9.548 -3.334 1.00 0.00 O ATOM 565 CB LYS A 40 -1.096 -8.981 -6.174 1.00 0.00 C ATOM 566 CG LYS A 40 -1.262 -8.170 -7.448 1.00 0.00 C ATOM 567 CD LYS A 40 -2.691 -7.684 -7.617 1.00 0.00 C ATOM 568 CE LYS A 40 -3.561 -8.736 -8.290 1.00 0.00 C ATOM 569 NZ LYS A 40 -4.704 -8.124 -9.023 1.00 0.00 N ATOM 0 H LYS A 40 1.073 -7.811 -6.006 1.00 0.00 H new ATOM 0 HA LYS A 40 -1.464 -7.363 -4.805 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -0.332 -9.741 -6.334 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -2.028 -9.505 -5.963 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -0.586 -7.315 -7.427 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -0.980 -8.778 -8.307 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -3.109 -7.434 -6.642 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -2.698 -6.770 -8.211 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -2.955 -9.319 -8.984 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -3.940 -9.428 -7.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -5.272 -8.873 -9.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -5.297 -7.589 -8.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -4.342 -7.482 -9.757 1.00 0.00 H new ATOM 583 N PRO A 41 -1.826 -9.174 -3.055 1.00 0.00 N ATOM 584 CA PRO A 41 -1.945 -9.990 -1.843 1.00 0.00 C ATOM 585 C PRO A 41 -1.790 -11.480 -2.129 1.00 0.00 C ATOM 586 O PRO A 41 -1.959 -11.925 -3.265 1.00 0.00 O ATOM 587 CB PRO A 41 -3.361 -9.686 -1.348 1.00 0.00 C ATOM 588 CG PRO A 41 -4.108 -9.273 -2.569 1.00 0.00 C ATOM 589 CD PRO A 41 -3.111 -8.570 -3.447 1.00 0.00 C ATOM 0 HA PRO A 41 -1.165 -9.757 -1.118 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -3.815 -10.562 -0.884 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -3.357 -8.894 -0.599 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -4.534 -10.138 -3.077 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -4.937 -8.613 -2.314 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -3.324 -8.729 -4.504 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -3.117 -7.493 -3.279 1.00 0.00 H new ATOM 597 N ASP A 42 -1.468 -12.247 -1.092 1.00 0.00 N ATOM 598 CA ASP A 42 -1.292 -13.687 -1.232 1.00 0.00 C ATOM 599 C ASP A 42 -2.576 -14.346 -1.727 1.00 0.00 C ATOM 600 O ASP A 42 -2.538 -15.388 -2.382 1.00 0.00 O ATOM 601 CB ASP A 42 -0.869 -14.303 0.102 1.00 0.00 C ATOM 602 CG ASP A 42 -0.576 -15.786 -0.012 1.00 0.00 C ATOM 603 OD1 ASP A 42 -1.537 -16.584 0.006 1.00 0.00 O ATOM 604 OD2 ASP A 42 0.614 -16.148 -0.119 1.00 0.00 O ATOM 0 H ASP A 42 -1.324 -11.895 -0.146 1.00 0.00 H new ATOM 0 HA ASP A 42 -0.508 -13.862 -1.969 1.00 0.00 H new ATOM 0 HB2 ASP A 42 0.018 -13.788 0.472 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -1.658 -14.147 0.837 1.00 0.00 H new ATOM 609 N SER A 43 -3.712 -13.733 -1.408 1.00 0.00 N ATOM 610 CA SER A 43 -5.008 -14.262 -1.815 1.00 0.00 C ATOM 611 C SER A 43 -5.963 -13.132 -2.187 1.00 0.00 C ATOM 612 O SER A 43 -5.607 -11.956 -2.120 1.00 0.00 O ATOM 613 CB SER A 43 -5.612 -15.108 -0.693 1.00 0.00 C ATOM 614 OG SER A 43 -5.051 -16.410 -0.677 1.00 0.00 O ATOM 0 H SER A 43 -3.760 -12.869 -0.868 1.00 0.00 H new ATOM 0 HA SER A 43 -4.857 -14.890 -2.693 1.00 0.00 H new ATOM 0 HB2 SER A 43 -5.438 -14.622 0.267 1.00 0.00 H new ATOM 0 HB3 SER A 43 -6.692 -15.176 -0.825 1.00 0.00 H new ATOM 0 HG SER A 43 -4.218 -16.414 -1.193 1.00 0.00 H new ATOM 620 N HIS A 44 -7.179 -13.499 -2.578 1.00 0.00 N ATOM 621 CA HIS A 44 -8.188 -12.518 -2.960 1.00 0.00 C ATOM 622 C HIS A 44 -9.472 -12.719 -2.161 1.00 0.00 C ATOM 623 O HIS A 44 -10.197 -11.765 -1.881 1.00 0.00 O ATOM 624 CB HIS A 44 -8.484 -12.617 -4.457 1.00 0.00 C ATOM 625 CG HIS A 44 -8.697 -14.020 -4.935 1.00 0.00 C ATOM 626 ND1 HIS A 44 -9.866 -14.719 -4.720 1.00 0.00 N ATOM 627 CD2 HIS A 44 -7.881 -14.855 -5.621 1.00 0.00 C ATOM 628 CE1 HIS A 44 -9.760 -15.924 -5.252 1.00 0.00 C ATOM 629 NE2 HIS A 44 -8.565 -16.031 -5.806 1.00 0.00 N ATOM 0 H HIS A 44 -7.489 -14.469 -2.639 1.00 0.00 H new ATOM 0 HA HIS A 44 -7.796 -11.525 -2.739 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -9.372 -12.026 -4.683 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -7.657 -12.175 -5.012 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -6.879 -14.637 -5.960 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -10.520 -16.691 -5.237 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -8.209 -16.854 -6.292 1.00 0.00 H new ATOM 638 N GLY A 45 -9.748 -13.968 -1.797 1.00 0.00 N ATOM 639 CA GLY A 45 -10.945 -14.271 -1.035 1.00 0.00 C ATOM 640 C GLY A 45 -12.093 -14.725 -1.914 1.00 0.00 C ATOM 641 O GLY A 45 -13.240 -14.337 -1.699 1.00 0.00 O ATOM 0 H GLY A 45 -9.164 -14.775 -2.016 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -10.720 -15.049 -0.306 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -11.248 -13.387 -0.474 1.00 0.00 H new ATOM 645 N GLY A 46 -11.783 -15.551 -2.909 1.00 0.00 N ATOM 646 CA GLY A 46 -12.808 -16.044 -3.811 1.00 0.00 C ATOM 647 C GLY A 46 -13.007 -15.141 -5.012 1.00 0.00 C ATOM 648 O GLY A 46 -12.798 -15.557 -6.151 1.00 0.00 O ATOM 0 H GLY A 46 -10.841 -15.887 -3.106 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -12.537 -17.043 -4.152 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -13.750 -16.137 -3.270 1.00 0.00 H new ATOM 652 N VAL A 47 -13.412 -13.901 -4.758 1.00 0.00 N ATOM 653 CA VAL A 47 -13.640 -12.936 -5.828 1.00 0.00 C ATOM 654 C VAL A 47 -12.395 -12.094 -6.082 1.00 0.00 C ATOM 655 O VAL A 47 -11.564 -11.887 -5.197 1.00 0.00 O ATOM 656 CB VAL A 47 -14.820 -12.003 -5.500 1.00 0.00 C ATOM 657 CG1 VAL A 47 -16.135 -12.768 -5.545 1.00 0.00 C ATOM 658 CG2 VAL A 47 -14.621 -11.349 -4.142 1.00 0.00 C ATOM 0 H VAL A 47 -13.589 -13.540 -3.820 1.00 0.00 H new ATOM 0 HA VAL A 47 -13.878 -13.508 -6.725 1.00 0.00 H new ATOM 0 HB VAL A 47 -14.859 -11.217 -6.254 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -16.957 -12.092 -5.311 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -16.280 -13.184 -6.542 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -16.111 -13.577 -4.815 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -15.465 -10.693 -3.927 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -14.555 -12.119 -3.373 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -13.701 -10.765 -4.151 1.00 0.00 H new ATOM 668 N PRO A 48 -12.262 -11.594 -7.319 1.00 0.00 N ATOM 669 CA PRO A 48 -11.121 -10.764 -7.719 1.00 0.00 C ATOM 670 C PRO A 48 -11.146 -9.389 -7.060 1.00 0.00 C ATOM 671 O PRO A 48 -12.206 -8.892 -6.679 1.00 0.00 O ATOM 672 CB PRO A 48 -11.291 -10.635 -9.235 1.00 0.00 C ATOM 673 CG PRO A 48 -12.750 -10.825 -9.470 1.00 0.00 C ATOM 674 CD PRO A 48 -13.214 -11.800 -8.423 1.00 0.00 C ATOM 0 HA PRO A 48 -10.170 -11.205 -7.419 1.00 0.00 H new ATOM 0 HB2 PRO A 48 -10.957 -9.660 -9.589 1.00 0.00 H new ATOM 0 HB3 PRO A 48 -10.704 -11.385 -9.765 1.00 0.00 H new ATOM 0 HG2 PRO A 48 -13.285 -9.879 -9.387 1.00 0.00 H new ATOM 0 HG3 PRO A 48 -12.937 -11.210 -10.472 1.00 0.00 H new ATOM 0 HD2 PRO A 48 -14.239 -11.598 -8.112 1.00 0.00 H new ATOM 0 HD3 PRO A 48 -13.188 -12.826 -8.790 1.00 0.00 H new ATOM 682 N ILE A 49 -9.972 -8.779 -6.931 1.00 0.00 N ATOM 683 CA ILE A 49 -9.861 -7.461 -6.320 1.00 0.00 C ATOM 684 C ILE A 49 -10.309 -6.368 -7.284 1.00 0.00 C ATOM 685 O ILE A 49 -9.845 -6.301 -8.422 1.00 0.00 O ATOM 686 CB ILE A 49 -8.417 -7.170 -5.868 1.00 0.00 C ATOM 687 CG1 ILE A 49 -7.984 -8.171 -4.794 1.00 0.00 C ATOM 688 CG2 ILE A 49 -8.301 -5.745 -5.349 1.00 0.00 C ATOM 689 CD1 ILE A 49 -6.484 -8.337 -4.694 1.00 0.00 C ATOM 0 H ILE A 49 -9.085 -9.177 -7.241 1.00 0.00 H new ATOM 0 HA ILE A 49 -10.514 -7.462 -5.447 1.00 0.00 H new ATOM 0 HB ILE A 49 -7.755 -7.278 -6.727 1.00 0.00 H new ATOM 0 HG12 ILE A 49 -8.371 -7.846 -3.828 1.00 0.00 H new ATOM 0 HG13 ILE A 49 -8.435 -9.140 -5.008 1.00 0.00 H new ATOM 0 HG21 ILE A 49 -7.275 -5.555 -5.034 1.00 0.00 H new ATOM 0 HG22 ILE A 49 -8.573 -5.046 -6.140 1.00 0.00 H new ATOM 0 HG23 ILE A 49 -8.972 -5.611 -4.501 1.00 0.00 H new ATOM 0 HD11 ILE A 49 -6.249 -9.061 -3.913 1.00 0.00 H new ATOM 0 HD12 ILE A 49 -6.093 -8.692 -5.647 1.00 0.00 H new ATOM 0 HD13 ILE A 49 -6.027 -7.378 -4.449 1.00 0.00 H new ATOM 701 N HIS A 50 -11.215 -5.513 -6.820 1.00 0.00 N ATOM 702 CA HIS A 50 -11.726 -4.420 -7.640 1.00 0.00 C ATOM 703 C HIS A 50 -10.767 -3.233 -7.623 1.00 0.00 C ATOM 704 O HIS A 50 -10.466 -2.650 -8.666 1.00 0.00 O ATOM 705 CB HIS A 50 -13.104 -3.983 -7.145 1.00 0.00 C ATOM 706 CG HIS A 50 -13.947 -3.344 -8.205 1.00 0.00 C ATOM 707 ND1 HIS A 50 -14.738 -2.238 -7.973 1.00 0.00 N ATOM 708 CD2 HIS A 50 -14.118 -3.660 -9.511 1.00 0.00 C ATOM 709 CE1 HIS A 50 -15.360 -1.903 -9.089 1.00 0.00 C ATOM 710 NE2 HIS A 50 -15.001 -2.749 -10.037 1.00 0.00 N ATOM 0 H HIS A 50 -11.610 -5.556 -5.881 1.00 0.00 H new ATOM 0 HA HIS A 50 -11.814 -4.779 -8.665 1.00 0.00 H new ATOM 0 HB2 HIS A 50 -13.630 -4.851 -6.748 1.00 0.00 H new ATOM 0 HB3 HIS A 50 -12.979 -3.282 -6.320 1.00 0.00 H new ATOM 0 HD2 HIS A 50 -13.648 -4.476 -10.040 1.00 0.00 H new ATOM 0 HE1 HIS A 50 -16.046 -1.077 -9.206 1.00 0.00 H new ATOM 0 HE2 HIS A 50 -15.327 -2.729 -11.003 1.00 0.00 H new ATOM 719 N HIS A 51 -10.290 -2.881 -6.434 1.00 0.00 N ATOM 720 CA HIS A 51 -9.364 -1.765 -6.281 1.00 0.00 C ATOM 721 C HIS A 51 -8.682 -1.806 -4.917 1.00 0.00 C ATOM 722 O HIS A 51 -8.947 -2.694 -4.107 1.00 0.00 O ATOM 723 CB HIS A 51 -10.103 -0.436 -6.454 1.00 0.00 C ATOM 724 CG HIS A 51 -11.015 -0.104 -5.313 1.00 0.00 C ATOM 725 ND1 HIS A 51 -12.190 -0.783 -5.068 1.00 0.00 N ATOM 726 CD2 HIS A 51 -10.917 0.838 -4.347 1.00 0.00 C ATOM 727 CE1 HIS A 51 -12.777 -0.270 -4.001 1.00 0.00 C ATOM 728 NE2 HIS A 51 -12.025 0.715 -3.544 1.00 0.00 N ATOM 0 H HIS A 51 -10.529 -3.353 -5.562 1.00 0.00 H new ATOM 0 HA HIS A 51 -8.599 -1.852 -7.052 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -9.372 0.364 -6.569 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -10.685 -0.471 -7.375 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -10.117 1.554 -4.229 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -13.713 -0.600 -3.575 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -12.233 1.291 -2.728 1.00 0.00 H new ATOM 737 N TYR A 52 -7.802 -0.842 -4.672 1.00 0.00 N ATOM 738 CA TYR A 52 -7.079 -0.771 -3.408 1.00 0.00 C ATOM 739 C TYR A 52 -7.536 0.429 -2.585 1.00 0.00 C ATOM 740 O TYR A 52 -8.061 1.402 -3.126 1.00 0.00 O ATOM 741 CB TYR A 52 -5.573 -0.685 -3.663 1.00 0.00 C ATOM 742 CG TYR A 52 -4.964 -1.984 -4.142 1.00 0.00 C ATOM 743 CD1 TYR A 52 -4.641 -2.995 -3.246 1.00 0.00 C ATOM 744 CD2 TYR A 52 -4.711 -2.199 -5.491 1.00 0.00 C ATOM 745 CE1 TYR A 52 -4.084 -4.183 -3.679 1.00 0.00 C ATOM 746 CE2 TYR A 52 -4.157 -3.383 -5.934 1.00 0.00 C ATOM 747 CZ TYR A 52 -3.844 -4.372 -5.024 1.00 0.00 C ATOM 748 OH TYR A 52 -3.291 -5.554 -5.461 1.00 0.00 O ATOM 0 H TYR A 52 -7.572 -0.099 -5.332 1.00 0.00 H new ATOM 0 HA TYR A 52 -7.295 -1.678 -2.844 1.00 0.00 H new ATOM 0 HB2 TYR A 52 -5.382 0.091 -4.404 1.00 0.00 H new ATOM 0 HB3 TYR A 52 -5.074 -0.377 -2.744 1.00 0.00 H new ATOM 0 HD1 TYR A 52 -4.829 -2.850 -2.192 1.00 0.00 H new ATOM 0 HD2 TYR A 52 -4.952 -1.426 -6.206 1.00 0.00 H new ATOM 0 HE1 TYR A 52 -3.838 -4.959 -2.969 1.00 0.00 H new ATOM 0 HE2 TYR A 52 -3.970 -3.535 -6.987 1.00 0.00 H new ATOM 0 HH TYR A 52 -3.704 -6.304 -4.985 1.00 0.00 H new ATOM 758 N GLN A 53 -7.332 0.352 -1.274 1.00 0.00 N ATOM 759 CA GLN A 53 -7.722 1.432 -0.376 1.00 0.00 C ATOM 760 C GLN A 53 -6.560 1.840 0.524 1.00 0.00 C ATOM 761 O GLN A 53 -6.104 1.059 1.358 1.00 0.00 O ATOM 762 CB GLN A 53 -8.918 1.005 0.478 1.00 0.00 C ATOM 763 CG GLN A 53 -9.663 2.172 1.107 1.00 0.00 C ATOM 764 CD GLN A 53 -11.138 1.880 1.309 1.00 0.00 C ATOM 765 OE1 GLN A 53 -11.721 1.052 0.609 1.00 0.00 O ATOM 766 NE2 GLN A 53 -11.749 2.561 2.271 1.00 0.00 N ATOM 0 H GLN A 53 -6.899 -0.447 -0.810 1.00 0.00 H new ATOM 0 HA GLN A 53 -8.005 2.291 -0.984 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -9.610 0.434 -0.140 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -8.571 0.338 1.267 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -9.209 2.413 2.068 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -9.554 3.052 0.473 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -11.227 3.238 2.827 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -12.741 2.407 2.454 1.00 0.00 H new ATOM 775 N VAL A 54 -6.085 3.069 0.347 1.00 0.00 N ATOM 776 CA VAL A 54 -4.976 3.581 1.143 1.00 0.00 C ATOM 777 C VAL A 54 -5.448 4.658 2.114 1.00 0.00 C ATOM 778 O VAL A 54 -6.409 5.378 1.840 1.00 0.00 O ATOM 779 CB VAL A 54 -3.866 4.164 0.249 1.00 0.00 C ATOM 780 CG1 VAL A 54 -2.718 4.690 1.097 1.00 0.00 C ATOM 781 CG2 VAL A 54 -3.374 3.116 -0.738 1.00 0.00 C ATOM 0 H VAL A 54 -6.451 3.728 -0.340 1.00 0.00 H new ATOM 0 HA VAL A 54 -4.575 2.738 1.706 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.279 4.999 -0.317 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -1.943 5.098 0.448 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.085 5.473 1.761 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -2.302 3.876 1.691 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.590 3.544 -1.362 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -2.977 2.260 -0.192 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.203 2.792 -1.368 1.00 0.00 H new ATOM 791 N ASP A 55 -4.767 4.762 3.250 1.00 0.00 N ATOM 792 CA ASP A 55 -5.115 5.752 4.262 1.00 0.00 C ATOM 793 C ASP A 55 -3.861 6.366 4.877 1.00 0.00 C ATOM 794 O ASP A 55 -3.084 5.680 5.542 1.00 0.00 O ATOM 795 CB ASP A 55 -5.975 5.115 5.355 1.00 0.00 C ATOM 796 CG ASP A 55 -6.947 6.100 5.975 1.00 0.00 C ATOM 797 OD1 ASP A 55 -6.951 7.275 5.553 1.00 0.00 O ATOM 798 OD2 ASP A 55 -7.704 5.694 6.881 1.00 0.00 O ATOM 0 H ASP A 55 -3.971 4.173 3.493 1.00 0.00 H new ATOM 0 HA ASP A 55 -5.685 6.545 3.778 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -6.531 4.277 4.934 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -5.328 4.710 6.133 1.00 0.00 H new ATOM 803 N VAL A 56 -3.668 7.660 4.649 1.00 0.00 N ATOM 804 CA VAL A 56 -2.508 8.366 5.180 1.00 0.00 C ATOM 805 C VAL A 56 -2.932 9.518 6.084 1.00 0.00 C ATOM 806 O VAL A 56 -3.973 10.140 5.870 1.00 0.00 O ATOM 807 CB VAL A 56 -1.620 8.917 4.049 1.00 0.00 C ATOM 808 CG1 VAL A 56 -2.349 10.008 3.279 1.00 0.00 C ATOM 809 CG2 VAL A 56 -0.305 9.437 4.609 1.00 0.00 C ATOM 0 H VAL A 56 -4.300 8.242 4.100 1.00 0.00 H new ATOM 0 HA VAL A 56 -1.937 7.642 5.761 1.00 0.00 H new ATOM 0 HB VAL A 56 -1.398 8.104 3.357 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -1.705 10.385 2.484 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -3.261 9.599 2.844 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -2.604 10.823 3.956 1.00 0.00 H new ATOM 0 HG21 VAL A 56 0.310 9.822 3.796 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -0.504 10.236 5.323 1.00 0.00 H new ATOM 0 HG23 VAL A 56 0.223 8.626 5.110 1.00 0.00 H new ATOM 819 N LYS A 57 -2.118 9.798 7.096 1.00 0.00 N ATOM 820 CA LYS A 57 -2.406 10.877 8.034 1.00 0.00 C ATOM 821 C LYS A 57 -1.220 11.124 8.961 1.00 0.00 C ATOM 822 O LYS A 57 -0.465 10.204 9.276 1.00 0.00 O ATOM 823 CB LYS A 57 -3.651 10.543 8.860 1.00 0.00 C ATOM 824 CG LYS A 57 -3.824 11.426 10.084 1.00 0.00 C ATOM 825 CD LYS A 57 -4.853 10.854 11.044 1.00 0.00 C ATOM 826 CE LYS A 57 -4.236 9.816 11.968 1.00 0.00 C ATOM 827 NZ LYS A 57 -5.048 9.618 13.201 1.00 0.00 N ATOM 0 H LYS A 57 -1.253 9.292 7.288 1.00 0.00 H new ATOM 0 HA LYS A 57 -2.590 11.785 7.459 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -4.533 10.638 8.227 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -3.597 9.502 9.178 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -2.867 11.532 10.596 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -4.131 12.424 9.773 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -5.286 11.659 11.637 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -5.668 10.401 10.479 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -4.143 8.868 11.438 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -3.228 10.128 12.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -4.936 8.640 13.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -4.726 10.277 13.938 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -6.050 9.799 12.989 1.00 0.00 H new ATOM 841 N GLU A 58 -1.064 12.370 9.395 1.00 0.00 N ATOM 842 CA GLU A 58 0.031 12.736 10.287 1.00 0.00 C ATOM 843 C GLU A 58 -0.064 11.975 11.606 1.00 0.00 C ATOM 844 O GLU A 58 -1.149 11.804 12.160 1.00 0.00 O ATOM 845 CB GLU A 58 0.020 14.242 10.553 1.00 0.00 C ATOM 846 CG GLU A 58 0.846 15.042 9.560 1.00 0.00 C ATOM 847 CD GLU A 58 0.330 16.457 9.378 1.00 0.00 C ATOM 848 OE1 GLU A 58 -0.626 16.646 8.598 1.00 0.00 O ATOM 849 OE2 GLU A 58 0.884 17.376 10.018 1.00 0.00 O ATOM 0 H GLU A 58 -1.681 13.143 9.144 1.00 0.00 H new ATOM 0 HA GLU A 58 0.968 12.467 9.799 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -1.009 14.599 10.527 1.00 0.00 H new ATOM 0 HB3 GLU A 58 0.397 14.427 11.559 1.00 0.00 H new ATOM 0 HG2 GLU A 58 1.881 15.078 9.900 1.00 0.00 H new ATOM 0 HG3 GLU A 58 0.844 14.532 8.597 1.00 0.00 H new ATOM 856 N VAL A 59 1.081 11.518 12.103 1.00 0.00 N ATOM 857 CA VAL A 59 1.129 10.775 13.356 1.00 0.00 C ATOM 858 C VAL A 59 0.509 11.578 14.495 1.00 0.00 C ATOM 859 O VAL A 59 0.237 11.043 15.569 1.00 0.00 O ATOM 860 CB VAL A 59 2.575 10.402 13.734 1.00 0.00 C ATOM 861 CG1 VAL A 59 3.476 11.626 13.669 1.00 0.00 C ATOM 862 CG2 VAL A 59 2.618 9.771 15.117 1.00 0.00 C ATOM 0 H VAL A 59 1.988 11.650 11.656 1.00 0.00 H new ATOM 0 HA VAL A 59 0.555 9.861 13.204 1.00 0.00 H new ATOM 0 HB VAL A 59 2.943 9.671 13.015 1.00 0.00 H new ATOM 0 HG11 VAL A 59 4.494 11.344 13.939 1.00 0.00 H new ATOM 0 HG12 VAL A 59 3.468 12.030 12.657 1.00 0.00 H new ATOM 0 HG13 VAL A 59 3.113 12.383 14.365 1.00 0.00 H new ATOM 0 HG21 VAL A 59 3.647 9.514 15.368 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.231 10.478 15.851 1.00 0.00 H new ATOM 0 HG23 VAL A 59 2.006 8.869 15.124 1.00 0.00 H new ATOM 872 N ALA A 60 0.288 12.865 14.251 1.00 0.00 N ATOM 873 CA ALA A 60 -0.303 13.742 15.254 1.00 0.00 C ATOM 874 C ALA A 60 -1.766 14.034 14.935 1.00 0.00 C ATOM 875 O ALA A 60 -2.600 14.133 15.836 1.00 0.00 O ATOM 876 CB ALA A 60 0.487 15.038 15.354 1.00 0.00 C ATOM 0 H ALA A 60 0.509 13.324 13.367 1.00 0.00 H new ATOM 0 HA ALA A 60 -0.264 13.231 16.216 1.00 0.00 H new ATOM 0 HB1 ALA A 60 0.034 15.683 16.107 1.00 0.00 H new ATOM 0 HB2 ALA A 60 1.516 14.816 15.638 1.00 0.00 H new ATOM 0 HB3 ALA A 60 0.478 15.545 14.389 1.00 0.00 H new ATOM 882 N SER A 61 -2.070 14.172 13.649 1.00 0.00 N ATOM 883 CA SER A 61 -3.431 14.458 13.212 1.00 0.00 C ATOM 884 C SER A 61 -4.381 13.337 13.625 1.00 0.00 C ATOM 885 O SER A 61 -3.948 12.235 13.963 1.00 0.00 O ATOM 886 CB SER A 61 -3.474 14.645 11.695 1.00 0.00 C ATOM 887 OG SER A 61 -4.803 14.831 11.240 1.00 0.00 O ATOM 0 H SER A 61 -1.392 14.090 12.891 1.00 0.00 H new ATOM 0 HA SER A 61 -3.754 15.381 13.694 1.00 0.00 H new ATOM 0 HB2 SER A 61 -2.867 15.506 11.415 1.00 0.00 H new ATOM 0 HB3 SER A 61 -3.038 13.774 11.206 1.00 0.00 H new ATOM 0 HG SER A 61 -4.802 14.950 10.267 1.00 0.00 H new ATOM 893 N GLU A 62 -5.678 13.627 13.594 1.00 0.00 N ATOM 894 CA GLU A 62 -6.689 12.645 13.966 1.00 0.00 C ATOM 895 C GLU A 62 -7.626 12.360 12.796 1.00 0.00 C ATOM 896 O GLU A 62 -8.605 11.625 12.936 1.00 0.00 O ATOM 897 CB GLU A 62 -7.494 13.139 15.170 1.00 0.00 C ATOM 898 CG GLU A 62 -6.690 13.194 16.458 1.00 0.00 C ATOM 899 CD GLU A 62 -7.419 13.924 17.570 1.00 0.00 C ATOM 900 OE1 GLU A 62 -7.528 15.165 17.492 1.00 0.00 O ATOM 901 OE2 GLU A 62 -7.879 13.253 18.518 1.00 0.00 O ATOM 0 H GLU A 62 -6.053 14.534 13.315 1.00 0.00 H new ATOM 0 HA GLU A 62 -6.179 11.720 14.235 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -7.884 14.133 14.952 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -8.353 12.484 15.315 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -6.462 12.179 16.783 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -5.738 13.689 16.267 1.00 0.00 H new ATOM 908 N ILE A 63 -7.320 12.946 11.644 1.00 0.00 N ATOM 909 CA ILE A 63 -8.135 12.755 10.449 1.00 0.00 C ATOM 910 C ILE A 63 -7.416 11.880 9.429 1.00 0.00 C ATOM 911 O ILE A 63 -6.318 12.207 8.979 1.00 0.00 O ATOM 912 CB ILE A 63 -8.494 14.100 9.793 1.00 0.00 C ATOM 913 CG1 ILE A 63 -9.361 14.938 10.735 1.00 0.00 C ATOM 914 CG2 ILE A 63 -9.211 13.870 8.471 1.00 0.00 C ATOM 915 CD1 ILE A 63 -9.275 16.425 10.475 1.00 0.00 C ATOM 0 H ILE A 63 -6.514 13.557 11.512 1.00 0.00 H new ATOM 0 HA ILE A 63 -9.052 12.259 10.767 1.00 0.00 H new ATOM 0 HB ILE A 63 -7.572 14.647 9.595 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -10.399 14.620 10.639 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -9.061 14.740 11.764 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -9.458 14.831 8.019 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -8.563 13.309 7.798 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -10.127 13.305 8.647 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -9.915 16.955 11.180 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -8.244 16.757 10.600 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -9.603 16.636 9.457 1.00 0.00 H new ATOM 927 N TRP A 64 -8.045 10.767 9.065 1.00 0.00 N ATOM 928 CA TRP A 64 -7.465 9.845 8.095 1.00 0.00 C ATOM 929 C TRP A 64 -7.976 10.142 6.689 1.00 0.00 C ATOM 930 O TRP A 64 -9.182 10.254 6.466 1.00 0.00 O ATOM 931 CB TRP A 64 -7.794 8.401 8.475 1.00 0.00 C ATOM 932 CG TRP A 64 -6.939 7.869 9.586 1.00 0.00 C ATOM 933 CD1 TRP A 64 -7.182 7.968 10.926 1.00 0.00 C ATOM 934 CD2 TRP A 64 -5.704 7.159 9.451 1.00 0.00 C ATOM 935 NE1 TRP A 64 -6.172 7.361 11.633 1.00 0.00 N ATOM 936 CE2 TRP A 64 -5.253 6.856 10.751 1.00 0.00 C ATOM 937 CE3 TRP A 64 -4.935 6.746 8.360 1.00 0.00 C ATOM 938 CZ2 TRP A 64 -4.069 6.162 10.985 1.00 0.00 C ATOM 939 CZ3 TRP A 64 -3.760 6.058 8.594 1.00 0.00 C ATOM 940 CH2 TRP A 64 -3.337 5.771 9.898 1.00 0.00 C ATOM 0 H TRP A 64 -8.955 10.482 9.427 1.00 0.00 H new ATOM 0 HA TRP A 64 -6.383 9.979 8.104 1.00 0.00 H new ATOM 0 HB2 TRP A 64 -8.841 8.340 8.771 1.00 0.00 H new ATOM 0 HB3 TRP A 64 -7.674 7.766 7.598 1.00 0.00 H new ATOM 0 HD1 TRP A 64 -8.042 8.452 11.366 1.00 0.00 H new ATOM 0 HE1 TRP A 64 -6.116 7.297 12.649 1.00 0.00 H new ATOM 0 HE3 TRP A 64 -5.254 6.961 7.351 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 -3.740 5.940 11.990 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 -3.158 5.736 7.757 1.00 0.00 H new ATOM 0 HH2 TRP A 64 -2.414 5.230 10.048 1.00 0.00 H new ATOM 951 N LYS A 65 -7.052 10.271 5.744 1.00 0.00 N ATOM 952 CA LYS A 65 -7.408 10.555 4.359 1.00 0.00 C ATOM 953 C LYS A 65 -7.319 9.294 3.505 1.00 0.00 C ATOM 954 O LYS A 65 -6.284 8.626 3.474 1.00 0.00 O ATOM 955 CB LYS A 65 -6.491 11.637 3.786 1.00 0.00 C ATOM 956 CG LYS A 65 -6.827 13.037 4.269 1.00 0.00 C ATOM 957 CD LYS A 65 -6.194 14.099 3.385 1.00 0.00 C ATOM 958 CE LYS A 65 -7.079 14.429 2.192 1.00 0.00 C ATOM 959 NZ LYS A 65 -6.677 15.707 1.542 1.00 0.00 N ATOM 0 H LYS A 65 -6.050 10.183 5.912 1.00 0.00 H new ATOM 0 HA LYS A 65 -8.437 10.913 4.341 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -5.460 11.407 4.054 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -6.550 11.613 2.698 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -7.909 13.169 4.280 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -6.480 13.162 5.295 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -6.017 15.002 3.969 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -5.223 13.751 3.034 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -7.026 13.619 1.465 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -8.117 14.497 2.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -7.303 15.897 0.734 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -6.752 16.484 2.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -5.695 15.633 1.209 1.00 0.00 H new ATOM 973 N ILE A 66 -8.407 8.975 2.813 1.00 0.00 N ATOM 974 CA ILE A 66 -8.449 7.795 1.957 1.00 0.00 C ATOM 975 C ILE A 66 -8.169 8.160 0.504 1.00 0.00 C ATOM 976 O ILE A 66 -8.769 9.087 -0.041 1.00 0.00 O ATOM 977 CB ILE A 66 -9.814 7.086 2.043 1.00 0.00 C ATOM 978 CG1 ILE A 66 -10.062 6.580 3.465 1.00 0.00 C ATOM 979 CG2 ILE A 66 -9.877 5.937 1.048 1.00 0.00 C ATOM 980 CD1 ILE A 66 -9.160 5.434 3.865 1.00 0.00 C ATOM 0 H ILE A 66 -9.271 9.517 2.828 1.00 0.00 H new ATOM 0 HA ILE A 66 -7.674 7.118 2.315 1.00 0.00 H new ATOM 0 HB ILE A 66 -10.596 7.803 1.791 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -9.921 7.404 4.165 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -11.101 6.262 3.553 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -10.847 5.446 1.121 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -9.740 6.323 0.038 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -9.089 5.218 1.272 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -9.392 5.127 4.885 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -9.317 4.594 3.189 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -8.119 5.754 3.810 1.00 0.00 H new ATOM 992 N VAL A 67 -7.254 7.425 -0.120 1.00 0.00 N ATOM 993 CA VAL A 67 -6.896 7.669 -1.512 1.00 0.00 C ATOM 994 C VAL A 67 -6.820 6.364 -2.296 1.00 0.00 C ATOM 995 O VAL A 67 -5.852 5.613 -2.178 1.00 0.00 O ATOM 996 CB VAL A 67 -5.546 8.403 -1.624 1.00 0.00 C ATOM 997 CG1 VAL A 67 -5.188 8.643 -3.083 1.00 0.00 C ATOM 998 CG2 VAL A 67 -5.587 9.714 -0.854 1.00 0.00 C ATOM 0 H VAL A 67 -6.747 6.655 0.317 1.00 0.00 H new ATOM 0 HA VAL A 67 -7.679 8.298 -1.935 1.00 0.00 H new ATOM 0 HB VAL A 67 -4.772 7.774 -1.184 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -4.232 9.162 -3.142 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -5.115 7.687 -3.602 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -5.961 9.252 -3.552 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -4.625 10.219 -0.944 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -6.371 10.351 -1.262 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -5.794 9.512 0.197 1.00 0.00 H new ATOM 1008 N ARG A 68 -7.845 6.103 -3.099 1.00 0.00 N ATOM 1009 CA ARG A 68 -7.896 4.888 -3.904 1.00 0.00 C ATOM 1010 C ARG A 68 -7.379 5.149 -5.316 1.00 0.00 C ATOM 1011 O ARG A 68 -7.240 6.299 -5.734 1.00 0.00 O ATOM 1012 CB ARG A 68 -9.326 4.349 -3.965 1.00 0.00 C ATOM 1013 CG ARG A 68 -10.320 5.326 -4.570 1.00 0.00 C ATOM 1014 CD ARG A 68 -11.671 4.670 -4.811 1.00 0.00 C ATOM 1015 NE ARG A 68 -12.507 5.457 -5.713 1.00 0.00 N ATOM 1016 CZ ARG A 68 -12.405 5.413 -7.037 1.00 0.00 C ATOM 1017 NH1 ARG A 68 -11.506 4.625 -7.609 1.00 0.00 N ATOM 1018 NH2 ARG A 68 -13.203 6.159 -7.790 1.00 0.00 N ATOM 0 H ARG A 68 -8.652 6.717 -3.210 1.00 0.00 H new ATOM 0 HA ARG A 68 -7.255 4.143 -3.432 1.00 0.00 H new ATOM 0 HB2 ARG A 68 -9.334 3.428 -4.548 1.00 0.00 H new ATOM 0 HB3 ARG A 68 -9.651 4.091 -2.957 1.00 0.00 H new ATOM 0 HG2 ARG A 68 -10.443 6.180 -3.904 1.00 0.00 H new ATOM 0 HG3 ARG A 68 -9.927 5.709 -5.512 1.00 0.00 H new ATOM 0 HD2 ARG A 68 -11.521 3.675 -5.230 1.00 0.00 H new ATOM 0 HD3 ARG A 68 -12.186 4.540 -3.859 1.00 0.00 H new ATOM 0 HE ARG A 68 -13.208 6.075 -5.304 1.00 0.00 H new ATOM 0 HH11 ARG A 68 -10.891 4.051 -7.033 1.00 0.00 H new ATOM 0 HH12 ARG A 68 -11.429 4.593 -8.626 1.00 0.00 H new ATOM 0 HH21 ARG A 68 -13.895 6.767 -7.353 1.00 0.00 H new ATOM 0 HH22 ARG A 68 -13.124 6.125 -8.806 1.00 0.00 H new ATOM 1032 N SER A 69 -7.096 4.075 -6.045 1.00 0.00 N ATOM 1033 CA SER A 69 -6.591 4.188 -7.409 1.00 0.00 C ATOM 1034 C SER A 69 -7.710 3.964 -8.423 1.00 0.00 C ATOM 1035 O SER A 69 -8.798 3.507 -8.073 1.00 0.00 O ATOM 1036 CB SER A 69 -5.465 3.178 -7.644 1.00 0.00 C ATOM 1037 OG SER A 69 -5.983 1.877 -7.857 1.00 0.00 O ATOM 0 H SER A 69 -7.208 3.116 -5.715 1.00 0.00 H new ATOM 0 HA SER A 69 -6.199 5.196 -7.543 1.00 0.00 H new ATOM 0 HB2 SER A 69 -4.873 3.483 -8.507 1.00 0.00 H new ATOM 0 HB3 SER A 69 -4.795 3.170 -6.785 1.00 0.00 H new ATOM 0 HG SER A 69 -5.518 1.240 -7.275 1.00 0.00 H new ATOM 1043 N HIS A 70 -7.431 4.290 -9.682 1.00 0.00 N ATOM 1044 CA HIS A 70 -8.413 4.125 -10.748 1.00 0.00 C ATOM 1045 C HIS A 70 -8.234 2.781 -11.447 1.00 0.00 C ATOM 1046 O HIS A 70 -8.094 2.718 -12.668 1.00 0.00 O ATOM 1047 CB HIS A 70 -8.290 5.261 -11.763 1.00 0.00 C ATOM 1048 CG HIS A 70 -8.687 6.598 -11.216 1.00 0.00 C ATOM 1049 ND1 HIS A 70 -9.978 7.077 -11.263 1.00 0.00 N ATOM 1050 CD2 HIS A 70 -7.952 7.559 -10.607 1.00 0.00 C ATOM 1051 CE1 HIS A 70 -10.022 8.275 -10.707 1.00 0.00 C ATOM 1052 NE2 HIS A 70 -8.805 8.590 -10.301 1.00 0.00 N ATOM 0 H HIS A 70 -6.535 4.669 -9.988 1.00 0.00 H new ATOM 0 HA HIS A 70 -9.407 4.153 -10.301 1.00 0.00 H new ATOM 0 HB2 HIS A 70 -7.260 5.313 -12.115 1.00 0.00 H new ATOM 0 HB3 HIS A 70 -8.912 5.033 -12.629 1.00 0.00 H new ATOM 0 HD2 HIS A 70 -6.893 7.521 -10.401 1.00 0.00 H new ATOM 0 HE1 HIS A 70 -10.903 8.891 -10.602 1.00 0.00 H new ATOM 0 HE2 HIS A 70 -8.542 9.459 -9.836 1.00 0.00 H new ATOM 1061 N GLY A 71 -8.239 1.706 -10.664 1.00 0.00 N ATOM 1062 CA GLY A 71 -8.076 0.377 -11.226 1.00 0.00 C ATOM 1063 C GLY A 71 -7.478 -0.602 -10.235 1.00 0.00 C ATOM 1064 O GLY A 71 -7.570 -0.403 -9.023 1.00 0.00 O ATOM 0 H GLY A 71 -8.353 1.732 -9.651 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -9.045 0.005 -11.559 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -7.436 0.434 -12.107 1.00 0.00 H new ATOM 1068 N VAL A 72 -6.867 -1.664 -10.750 1.00 0.00 N ATOM 1069 CA VAL A 72 -6.253 -2.678 -9.902 1.00 0.00 C ATOM 1070 C VAL A 72 -4.748 -2.466 -9.792 1.00 0.00 C ATOM 1071 O VAL A 72 -3.985 -3.422 -9.652 1.00 0.00 O ATOM 1072 CB VAL A 72 -6.523 -4.097 -10.439 1.00 0.00 C ATOM 1073 CG1 VAL A 72 -8.014 -4.395 -10.432 1.00 0.00 C ATOM 1074 CG2 VAL A 72 -5.945 -4.256 -11.836 1.00 0.00 C ATOM 0 H VAL A 72 -6.784 -1.844 -11.751 1.00 0.00 H new ATOM 0 HA VAL A 72 -6.703 -2.579 -8.914 1.00 0.00 H new ATOM 0 HB VAL A 72 -6.031 -4.815 -9.784 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -8.186 -5.401 -10.814 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -8.394 -4.324 -9.413 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -8.532 -3.673 -11.064 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -6.145 -5.264 -12.200 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -6.407 -3.530 -12.506 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -4.868 -4.088 -11.806 1.00 0.00 H new ATOM 1084 N GLN A 73 -4.326 -1.207 -9.860 1.00 0.00 N ATOM 1085 CA GLN A 73 -2.910 -0.870 -9.768 1.00 0.00 C ATOM 1086 C GLN A 73 -2.441 -0.880 -8.317 1.00 0.00 C ATOM 1087 O GLN A 73 -3.172 -0.475 -7.414 1.00 0.00 O ATOM 1088 CB GLN A 73 -2.651 0.503 -10.392 1.00 0.00 C ATOM 1089 CG GLN A 73 -3.255 1.653 -9.601 1.00 0.00 C ATOM 1090 CD GLN A 73 -3.598 2.843 -10.475 1.00 0.00 C ATOM 1091 OE1 GLN A 73 -4.323 2.715 -11.461 1.00 0.00 O ATOM 1092 NE2 GLN A 73 -3.080 4.012 -10.115 1.00 0.00 N ATOM 0 H GLN A 73 -4.944 -0.404 -9.978 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.346 -1.624 -10.317 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -1.575 0.657 -10.478 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -3.057 0.516 -11.404 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -4.156 1.307 -9.094 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -2.554 1.965 -8.827 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -2.484 4.073 -9.290 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -3.279 4.849 -10.664 1.00 0.00 H new ATOM 1101 N THR A 74 -1.215 -1.347 -8.101 1.00 0.00 N ATOM 1102 CA THR A 74 -0.648 -1.412 -6.760 1.00 0.00 C ATOM 1103 C THR A 74 0.319 -0.259 -6.515 1.00 0.00 C ATOM 1104 O THR A 74 1.180 -0.334 -5.639 1.00 0.00 O ATOM 1105 CB THR A 74 0.091 -2.744 -6.527 1.00 0.00 C ATOM 1106 OG1 THR A 74 1.207 -2.848 -7.417 1.00 0.00 O ATOM 1107 CG2 THR A 74 -0.845 -3.925 -6.736 1.00 0.00 C ATOM 0 H THR A 74 -0.596 -1.686 -8.838 1.00 0.00 H new ATOM 0 HA THR A 74 -1.481 -1.339 -6.061 1.00 0.00 H new ATOM 0 HB THR A 74 0.447 -2.761 -5.497 1.00 0.00 H new ATOM 0 HG1 THR A 74 1.961 -3.263 -6.949 1.00 0.00 H new ATOM 0 HG21 THR A 74 -0.302 -4.854 -6.566 1.00 0.00 H new ATOM 0 HG22 THR A 74 -1.677 -3.858 -6.035 1.00 0.00 H new ATOM 0 HG23 THR A 74 -1.228 -3.910 -7.756 1.00 0.00 H new ATOM 1115 N MET A 75 0.170 0.807 -7.294 1.00 0.00 N ATOM 1116 CA MET A 75 1.029 1.978 -7.159 1.00 0.00 C ATOM 1117 C MET A 75 0.203 3.260 -7.144 1.00 0.00 C ATOM 1118 O MET A 75 -0.555 3.533 -8.076 1.00 0.00 O ATOM 1119 CB MET A 75 2.044 2.026 -8.303 1.00 0.00 C ATOM 1120 CG MET A 75 3.253 2.899 -8.006 1.00 0.00 C ATOM 1121 SD MET A 75 4.677 2.487 -9.033 1.00 0.00 S ATOM 1122 CE MET A 75 4.576 3.769 -10.280 1.00 0.00 C ATOM 0 H MET A 75 -0.537 0.884 -8.025 1.00 0.00 H new ATOM 0 HA MET A 75 1.562 1.899 -6.212 1.00 0.00 H new ATOM 0 HB2 MET A 75 2.382 1.013 -8.521 1.00 0.00 H new ATOM 0 HB3 MET A 75 1.550 2.397 -9.201 1.00 0.00 H new ATOM 0 HG2 MET A 75 2.988 3.945 -8.162 1.00 0.00 H new ATOM 0 HG3 MET A 75 3.524 2.792 -6.956 1.00 0.00 H new ATOM 0 HE1 MET A 75 5.581 4.067 -10.578 1.00 0.00 H new ATOM 0 HE2 MET A 75 4.038 3.390 -11.149 1.00 0.00 H new ATOM 0 HE3 MET A 75 4.047 4.631 -9.873 1.00 0.00 H new ATOM 1132 N VAL A 76 0.352 4.044 -6.081 1.00 0.00 N ATOM 1133 CA VAL A 76 -0.380 5.297 -5.944 1.00 0.00 C ATOM 1134 C VAL A 76 0.498 6.382 -5.331 1.00 0.00 C ATOM 1135 O VAL A 76 1.282 6.119 -4.419 1.00 0.00 O ATOM 1136 CB VAL A 76 -1.640 5.120 -5.078 1.00 0.00 C ATOM 1137 CG1 VAL A 76 -2.403 6.431 -4.971 1.00 0.00 C ATOM 1138 CG2 VAL A 76 -2.527 4.023 -5.645 1.00 0.00 C ATOM 0 H VAL A 76 0.974 3.833 -5.301 1.00 0.00 H new ATOM 0 HA VAL A 76 -0.679 5.600 -6.947 1.00 0.00 H new ATOM 0 HB VAL A 76 -1.331 4.824 -4.075 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -3.291 6.286 -4.355 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.764 7.188 -4.515 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.702 6.760 -5.966 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -3.413 3.912 -5.020 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -2.829 4.287 -6.659 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -1.976 3.083 -5.664 1.00 0.00 H new ATOM 1148 N VAL A 77 0.361 7.604 -5.837 1.00 0.00 N ATOM 1149 CA VAL A 77 1.140 8.730 -5.338 1.00 0.00 C ATOM 1150 C VAL A 77 0.289 9.640 -4.458 1.00 0.00 C ATOM 1151 O VAL A 77 -0.879 9.894 -4.755 1.00 0.00 O ATOM 1152 CB VAL A 77 1.733 9.558 -6.493 1.00 0.00 C ATOM 1153 CG1 VAL A 77 0.686 10.503 -7.064 1.00 0.00 C ATOM 1154 CG2 VAL A 77 2.957 10.328 -6.022 1.00 0.00 C ATOM 0 H VAL A 77 -0.283 7.839 -6.593 1.00 0.00 H new ATOM 0 HA VAL A 77 1.954 8.314 -4.745 1.00 0.00 H new ATOM 0 HB VAL A 77 2.043 8.876 -7.285 1.00 0.00 H new ATOM 0 HG11 VAL A 77 1.123 11.080 -7.879 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -0.159 9.926 -7.440 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.343 11.181 -6.283 1.00 0.00 H new ATOM 0 HG21 VAL A 77 3.363 10.908 -6.851 1.00 0.00 H new ATOM 0 HG22 VAL A 77 2.674 11.001 -5.213 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.712 9.628 -5.664 1.00 0.00 H new ATOM 1164 N LEU A 78 0.882 10.128 -3.374 1.00 0.00 N ATOM 1165 CA LEU A 78 0.179 11.011 -2.450 1.00 0.00 C ATOM 1166 C LEU A 78 0.655 12.453 -2.607 1.00 0.00 C ATOM 1167 O LEU A 78 1.797 12.701 -2.989 1.00 0.00 O ATOM 1168 CB LEU A 78 0.390 10.546 -1.009 1.00 0.00 C ATOM 1169 CG LEU A 78 -0.169 9.166 -0.661 1.00 0.00 C ATOM 1170 CD1 LEU A 78 0.327 8.718 0.704 1.00 0.00 C ATOM 1171 CD2 LEU A 78 -1.690 9.182 -0.699 1.00 0.00 C ATOM 0 H LEU A 78 1.848 9.927 -3.113 1.00 0.00 H new ATOM 0 HA LEU A 78 -0.885 10.971 -2.685 1.00 0.00 H new ATOM 0 HB2 LEU A 78 1.460 10.545 -0.801 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -0.064 11.279 -0.342 1.00 0.00 H new ATOM 0 HG LEU A 78 0.186 8.453 -1.405 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -0.081 7.734 0.934 1.00 0.00 H new ATOM 0 HD12 LEU A 78 1.416 8.667 0.697 1.00 0.00 H new ATOM 0 HD13 LEU A 78 0.003 9.432 1.461 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -2.071 8.192 -0.449 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -2.064 9.908 0.023 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -2.026 9.458 -1.698 1.00 0.00 H new ATOM 1183 N ASN A 79 -0.230 13.398 -2.306 1.00 0.00 N ATOM 1184 CA ASN A 79 0.101 14.815 -2.411 1.00 0.00 C ATOM 1185 C ASN A 79 -0.451 15.591 -1.219 1.00 0.00 C ATOM 1186 O ASN A 79 -1.003 15.008 -0.287 1.00 0.00 O ATOM 1187 CB ASN A 79 -0.455 15.395 -3.713 1.00 0.00 C ATOM 1188 CG ASN A 79 -1.865 14.915 -4.003 1.00 0.00 C ATOM 1189 OD1 ASN A 79 -2.825 15.678 -3.894 1.00 0.00 O ATOM 1190 ND2 ASN A 79 -1.995 13.648 -4.375 1.00 0.00 N ATOM 0 H ASN A 79 -1.180 13.209 -1.988 1.00 0.00 H new ATOM 0 HA ASN A 79 1.187 14.910 -2.414 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -0.449 16.483 -3.655 1.00 0.00 H new ATOM 0 HB3 ASN A 79 0.198 15.117 -4.540 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -2.919 13.270 -4.584 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -1.171 13.052 -4.452 1.00 0.00 H new ATOM 1197 N ASN A 80 -0.296 16.911 -1.256 1.00 0.00 N ATOM 1198 CA ASN A 80 -0.778 17.768 -0.180 1.00 0.00 C ATOM 1199 C ASN A 80 -0.121 17.398 1.146 1.00 0.00 C ATOM 1200 O ASN A 80 -0.783 17.326 2.182 1.00 0.00 O ATOM 1201 CB ASN A 80 -2.298 17.660 -0.056 1.00 0.00 C ATOM 1202 CG ASN A 80 -3.011 18.023 -1.344 1.00 0.00 C ATOM 1203 OD1 ASN A 80 -2.426 18.631 -2.241 1.00 0.00 O ATOM 1204 ND2 ASN A 80 -4.282 17.650 -1.443 1.00 0.00 N ATOM 0 H ASN A 80 0.160 17.410 -2.020 1.00 0.00 H new ATOM 0 HA ASN A 80 -0.512 18.797 -0.422 1.00 0.00 H new ATOM 0 HB2 ASN A 80 -2.565 16.642 0.229 1.00 0.00 H new ATOM 0 HB3 ASN A 80 -2.642 18.316 0.744 1.00 0.00 H new ATOM 0 HD21 ASN A 80 -4.813 17.866 -2.287 1.00 0.00 H new ATOM 0 HD22 ASN A 80 -4.727 17.148 -0.675 1.00 0.00 H new ATOM 1211 N LEU A 81 1.187 17.164 1.107 1.00 0.00 N ATOM 1212 CA LEU A 81 1.935 16.801 2.305 1.00 0.00 C ATOM 1213 C LEU A 81 2.954 17.880 2.659 1.00 0.00 C ATOM 1214 O LEU A 81 3.475 18.566 1.779 1.00 0.00 O ATOM 1215 CB LEU A 81 2.645 15.461 2.103 1.00 0.00 C ATOM 1216 CG LEU A 81 1.839 14.378 1.385 1.00 0.00 C ATOM 1217 CD1 LEU A 81 2.746 13.235 0.954 1.00 0.00 C ATOM 1218 CD2 LEU A 81 0.720 13.864 2.280 1.00 0.00 C ATOM 0 H LEU A 81 1.751 17.219 0.259 1.00 0.00 H new ATOM 0 HA LEU A 81 1.228 16.709 3.129 1.00 0.00 H new ATOM 0 HB2 LEU A 81 3.561 15.639 1.539 1.00 0.00 H new ATOM 0 HB3 LEU A 81 2.941 15.078 3.080 1.00 0.00 H new ATOM 0 HG LEU A 81 1.392 14.817 0.493 1.00 0.00 H new ATOM 0 HD11 LEU A 81 2.155 12.474 0.445 1.00 0.00 H new ATOM 0 HD12 LEU A 81 3.511 13.614 0.277 1.00 0.00 H new ATOM 0 HD13 LEU A 81 3.222 12.798 1.832 1.00 0.00 H new ATOM 0 HD21 LEU A 81 0.157 13.094 1.753 1.00 0.00 H new ATOM 0 HD22 LEU A 81 1.147 13.442 3.190 1.00 0.00 H new ATOM 0 HD23 LEU A 81 0.054 14.687 2.539 1.00 0.00 H new ATOM 1230 N GLU A 82 3.234 18.023 3.950 1.00 0.00 N ATOM 1231 CA GLU A 82 4.192 19.018 4.419 1.00 0.00 C ATOM 1232 C GLU A 82 5.587 18.413 4.542 1.00 0.00 C ATOM 1233 O GLU A 82 5.759 17.253 4.916 1.00 0.00 O ATOM 1234 CB GLU A 82 3.750 19.588 5.767 1.00 0.00 C ATOM 1235 CG GLU A 82 2.517 20.472 5.681 1.00 0.00 C ATOM 1236 CD GLU A 82 2.850 21.904 5.312 1.00 0.00 C ATOM 1237 OE1 GLU A 82 3.622 22.543 6.057 1.00 0.00 O ATOM 1238 OE2 GLU A 82 2.340 22.386 4.279 1.00 0.00 O ATOM 0 H GLU A 82 2.811 17.463 4.690 1.00 0.00 H new ATOM 0 HA GLU A 82 4.228 19.825 3.687 1.00 0.00 H new ATOM 0 HB2 GLU A 82 3.549 18.764 6.452 1.00 0.00 H new ATOM 0 HB3 GLU A 82 4.570 20.164 6.195 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.831 20.060 4.941 1.00 0.00 H new ATOM 0 HG3 GLU A 82 1.998 20.459 6.639 1.00 0.00 H new ATOM 1245 N PRO A 83 6.611 19.218 4.219 1.00 0.00 N ATOM 1246 CA PRO A 83 8.010 18.785 4.286 1.00 0.00 C ATOM 1247 C PRO A 83 8.489 18.588 5.721 1.00 0.00 C ATOM 1248 O PRO A 83 7.954 19.190 6.651 1.00 0.00 O ATOM 1249 CB PRO A 83 8.769 19.936 3.622 1.00 0.00 C ATOM 1250 CG PRO A 83 7.894 21.127 3.811 1.00 0.00 C ATOM 1251 CD PRO A 83 6.481 20.613 3.766 1.00 0.00 C ATOM 0 HA PRO A 83 8.162 17.820 3.802 1.00 0.00 H new ATOM 0 HB2 PRO A 83 9.745 20.085 4.084 1.00 0.00 H new ATOM 0 HB3 PRO A 83 8.944 19.737 2.565 1.00 0.00 H new ATOM 0 HG2 PRO A 83 8.101 21.617 4.763 1.00 0.00 H new ATOM 0 HG3 PRO A 83 8.066 21.866 3.028 1.00 0.00 H new ATOM 0 HD2 PRO A 83 5.823 21.188 4.418 1.00 0.00 H new ATOM 0 HD3 PRO A 83 6.064 20.672 2.761 1.00 0.00 H new ATOM 1259 N ASN A 84 9.499 17.742 5.892 1.00 0.00 N ATOM 1260 CA ASN A 84 10.050 17.466 7.213 1.00 0.00 C ATOM 1261 C ASN A 84 8.961 16.978 8.164 1.00 0.00 C ATOM 1262 O ASN A 84 9.021 17.220 9.371 1.00 0.00 O ATOM 1263 CB ASN A 84 10.716 18.720 7.783 1.00 0.00 C ATOM 1264 CG ASN A 84 11.525 18.429 9.032 1.00 0.00 C ATOM 1265 OD1 ASN A 84 11.427 17.347 9.610 1.00 0.00 O ATOM 1266 ND2 ASN A 84 12.332 19.396 9.454 1.00 0.00 N ATOM 0 H ASN A 84 9.953 17.235 5.132 1.00 0.00 H new ATOM 0 HA ASN A 84 10.798 16.680 7.111 1.00 0.00 H new ATOM 0 HB2 ASN A 84 11.367 19.158 7.026 1.00 0.00 H new ATOM 0 HB3 ASN A 84 9.951 19.461 8.014 1.00 0.00 H new ATOM 0 HD21 ASN A 84 12.902 19.257 10.288 1.00 0.00 H new ATOM 0 HD22 ASN A 84 12.382 20.278 8.944 1.00 0.00 H new ATOM 1273 N THR A 85 7.967 16.289 7.613 1.00 0.00 N ATOM 1274 CA THR A 85 6.864 15.767 8.412 1.00 0.00 C ATOM 1275 C THR A 85 6.702 14.265 8.208 1.00 0.00 C ATOM 1276 O THR A 85 7.101 13.720 7.178 1.00 0.00 O ATOM 1277 CB THR A 85 5.539 16.468 8.065 1.00 0.00 C ATOM 1278 OG1 THR A 85 5.628 17.864 8.367 1.00 0.00 O ATOM 1279 CG2 THR A 85 4.381 15.850 8.836 1.00 0.00 C ATOM 0 H THR A 85 7.903 16.079 6.617 1.00 0.00 H new ATOM 0 HA THR A 85 7.107 15.965 9.456 1.00 0.00 H new ATOM 0 HB THR A 85 5.355 16.339 6.998 1.00 0.00 H new ATOM 0 HG1 THR A 85 6.347 18.268 7.838 1.00 0.00 H new ATOM 0 HG21 THR A 85 3.455 16.362 8.574 1.00 0.00 H new ATOM 0 HG22 THR A 85 4.296 14.794 8.581 1.00 0.00 H new ATOM 0 HG23 THR A 85 4.561 15.951 9.906 1.00 0.00 H new ATOM 1287 N THR A 86 6.110 13.598 9.195 1.00 0.00 N ATOM 1288 CA THR A 86 5.895 12.159 9.124 1.00 0.00 C ATOM 1289 C THR A 86 4.412 11.832 8.986 1.00 0.00 C ATOM 1290 O THR A 86 3.557 12.552 9.500 1.00 0.00 O ATOM 1291 CB THR A 86 6.453 11.444 10.370 1.00 0.00 C ATOM 1292 OG1 THR A 86 7.829 11.791 10.557 1.00 0.00 O ATOM 1293 CG2 THR A 86 6.318 9.936 10.233 1.00 0.00 C ATOM 0 H THR A 86 5.771 14.033 10.053 1.00 0.00 H new ATOM 0 HA THR A 86 6.427 11.803 8.242 1.00 0.00 H new ATOM 0 HB THR A 86 5.877 11.766 11.237 1.00 0.00 H new ATOM 0 HG1 THR A 86 8.176 11.334 11.351 1.00 0.00 H new ATOM 0 HG21 THR A 86 6.718 9.452 11.124 1.00 0.00 H new ATOM 0 HG22 THR A 86 5.266 9.674 10.119 1.00 0.00 H new ATOM 0 HG23 THR A 86 6.873 9.599 9.357 1.00 0.00 H new ATOM 1301 N TYR A 87 4.115 10.740 8.290 1.00 0.00 N ATOM 1302 CA TYR A 87 2.734 10.319 8.083 1.00 0.00 C ATOM 1303 C TYR A 87 2.628 8.796 8.053 1.00 0.00 C ATOM 1304 O TYR A 87 3.513 8.113 7.538 1.00 0.00 O ATOM 1305 CB TYR A 87 2.190 10.905 6.780 1.00 0.00 C ATOM 1306 CG TYR A 87 2.479 12.380 6.612 1.00 0.00 C ATOM 1307 CD1 TYR A 87 3.782 12.841 6.477 1.00 0.00 C ATOM 1308 CD2 TYR A 87 1.448 13.311 6.587 1.00 0.00 C ATOM 1309 CE1 TYR A 87 4.051 14.187 6.325 1.00 0.00 C ATOM 1310 CE2 TYR A 87 1.707 14.659 6.433 1.00 0.00 C ATOM 1311 CZ TYR A 87 3.011 15.093 6.302 1.00 0.00 C ATOM 1312 OH TYR A 87 3.274 16.434 6.149 1.00 0.00 O ATOM 0 H TYR A 87 4.811 10.131 7.860 1.00 0.00 H new ATOM 0 HA TYR A 87 2.138 10.691 8.917 1.00 0.00 H new ATOM 0 HB2 TYR A 87 2.620 10.361 5.939 1.00 0.00 H new ATOM 0 HB3 TYR A 87 1.112 10.748 6.743 1.00 0.00 H new ATOM 0 HD1 TYR A 87 4.599 12.135 6.491 1.00 0.00 H new ATOM 0 HD2 TYR A 87 0.427 12.975 6.690 1.00 0.00 H new ATOM 0 HE1 TYR A 87 5.071 14.529 6.225 1.00 0.00 H new ATOM 0 HE2 TYR A 87 0.894 15.370 6.415 1.00 0.00 H new ATOM 0 HH TYR A 87 4.072 16.549 5.592 1.00 0.00 H new ATOM 1322 N GLU A 88 1.538 8.274 8.606 1.00 0.00 N ATOM 1323 CA GLU A 88 1.317 6.834 8.643 1.00 0.00 C ATOM 1324 C GLU A 88 0.378 6.399 7.522 1.00 0.00 C ATOM 1325 O GLU A 88 -0.761 6.860 7.438 1.00 0.00 O ATOM 1326 CB GLU A 88 0.737 6.419 9.998 1.00 0.00 C ATOM 1327 CG GLU A 88 1.530 6.941 11.184 1.00 0.00 C ATOM 1328 CD GLU A 88 1.332 6.104 12.433 1.00 0.00 C ATOM 1329 OE1 GLU A 88 1.631 4.892 12.388 1.00 0.00 O ATOM 1330 OE2 GLU A 88 0.876 6.661 13.454 1.00 0.00 O ATOM 0 H GLU A 88 0.795 8.826 9.034 1.00 0.00 H new ATOM 0 HA GLU A 88 2.279 6.341 8.501 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -0.289 6.780 10.071 1.00 0.00 H new ATOM 0 HB3 GLU A 88 0.697 5.331 10.049 1.00 0.00 H new ATOM 0 HG2 GLU A 88 2.589 6.960 10.928 1.00 0.00 H new ATOM 0 HG3 GLU A 88 1.234 7.970 11.390 1.00 0.00 H new ATOM 1337 N ILE A 89 0.864 5.510 6.662 1.00 0.00 N ATOM 1338 CA ILE A 89 0.069 5.013 5.546 1.00 0.00 C ATOM 1339 C ILE A 89 -0.140 3.507 5.648 1.00 0.00 C ATOM 1340 O ILE A 89 0.713 2.785 6.165 1.00 0.00 O ATOM 1341 CB ILE A 89 0.731 5.338 4.195 1.00 0.00 C ATOM 1342 CG1 ILE A 89 0.232 4.378 3.113 1.00 0.00 C ATOM 1343 CG2 ILE A 89 2.246 5.266 4.315 1.00 0.00 C ATOM 1344 CD1 ILE A 89 0.594 4.808 1.708 1.00 0.00 C ATOM 0 H ILE A 89 1.805 5.119 6.717 1.00 0.00 H new ATOM 0 HA ILE A 89 -0.897 5.515 5.598 1.00 0.00 H new ATOM 0 HB ILE A 89 0.456 6.353 3.909 1.00 0.00 H new ATOM 0 HG12 ILE A 89 0.646 3.387 3.299 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -0.852 4.290 3.189 1.00 0.00 H new ATOM 0 HG21 ILE A 89 2.699 5.498 3.351 1.00 0.00 H new ATOM 0 HG22 ILE A 89 2.587 5.986 5.059 1.00 0.00 H new ATOM 0 HG23 ILE A 89 2.539 4.262 4.621 1.00 0.00 H new ATOM 0 HD11 ILE A 89 0.208 4.080 0.994 1.00 0.00 H new ATOM 0 HD12 ILE A 89 0.157 5.785 1.503 1.00 0.00 H new ATOM 0 HD13 ILE A 89 1.678 4.869 1.614 1.00 0.00 H new ATOM 1356 N ARG A 90 -1.279 3.037 5.149 1.00 0.00 N ATOM 1357 CA ARG A 90 -1.600 1.615 5.184 1.00 0.00 C ATOM 1358 C ARG A 90 -2.273 1.179 3.885 1.00 0.00 C ATOM 1359 O ARG A 90 -3.188 1.839 3.396 1.00 0.00 O ATOM 1360 CB ARG A 90 -2.513 1.306 6.372 1.00 0.00 C ATOM 1361 CG ARG A 90 -3.736 2.203 6.451 1.00 0.00 C ATOM 1362 CD ARG A 90 -4.525 1.959 7.728 1.00 0.00 C ATOM 1363 NE ARG A 90 -5.799 2.674 7.730 1.00 0.00 N ATOM 1364 CZ ARG A 90 -6.557 2.822 8.811 1.00 0.00 C ATOM 1365 NH1 ARG A 90 -6.171 2.307 9.970 1.00 0.00 N ATOM 1366 NH2 ARG A 90 -7.703 3.487 8.734 1.00 0.00 N ATOM 0 H ARG A 90 -1.995 3.620 4.716 1.00 0.00 H new ATOM 0 HA ARG A 90 -0.669 1.060 5.296 1.00 0.00 H new ATOM 0 HB2 ARG A 90 -2.838 0.268 6.309 1.00 0.00 H new ATOM 0 HB3 ARG A 90 -1.941 1.405 7.294 1.00 0.00 H new ATOM 0 HG2 ARG A 90 -3.426 3.247 6.408 1.00 0.00 H new ATOM 0 HG3 ARG A 90 -4.376 2.024 5.587 1.00 0.00 H new ATOM 0 HD2 ARG A 90 -4.709 0.891 7.842 1.00 0.00 H new ATOM 0 HD3 ARG A 90 -3.931 2.274 8.586 1.00 0.00 H new ATOM 0 HE ARG A 90 -6.124 3.082 6.854 1.00 0.00 H new ATOM 0 HH11 ARG A 90 -5.291 1.796 10.033 1.00 0.00 H new ATOM 0 HH12 ARG A 90 -6.754 2.422 10.799 1.00 0.00 H new ATOM 0 HH21 ARG A 90 -8.003 3.885 7.844 1.00 0.00 H new ATOM 0 HH22 ARG A 90 -8.284 3.600 9.565 1.00 0.00 H new ATOM 1380 N VAL A 91 -1.811 0.061 3.333 1.00 0.00 N ATOM 1381 CA VAL A 91 -2.367 -0.465 2.092 1.00 0.00 C ATOM 1382 C VAL A 91 -3.345 -1.601 2.366 1.00 0.00 C ATOM 1383 O VAL A 91 -3.051 -2.513 3.140 1.00 0.00 O ATOM 1384 CB VAL A 91 -1.259 -0.972 1.151 1.00 0.00 C ATOM 1385 CG1 VAL A 91 -1.859 -1.517 -0.136 1.00 0.00 C ATOM 1386 CG2 VAL A 91 -0.262 0.138 0.856 1.00 0.00 C ATOM 0 H VAL A 91 -1.053 -0.498 3.726 1.00 0.00 H new ATOM 0 HA VAL A 91 -2.896 0.357 1.609 1.00 0.00 H new ATOM 0 HB VAL A 91 -0.728 -1.784 1.648 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -1.061 -1.871 -0.788 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -2.530 -2.344 0.097 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -2.417 -0.728 -0.640 1.00 0.00 H new ATOM 0 HG21 VAL A 91 0.514 -0.238 0.189 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -0.777 0.972 0.379 1.00 0.00 H new ATOM 0 HG23 VAL A 91 0.192 0.476 1.787 1.00 0.00 H new ATOM 1396 N ALA A 92 -4.509 -1.541 1.728 1.00 0.00 N ATOM 1397 CA ALA A 92 -5.529 -2.567 1.901 1.00 0.00 C ATOM 1398 C ALA A 92 -6.156 -2.948 0.565 1.00 0.00 C ATOM 1399 O ALA A 92 -6.321 -2.106 -0.318 1.00 0.00 O ATOM 1400 CB ALA A 92 -6.600 -2.087 2.871 1.00 0.00 C ATOM 0 H ALA A 92 -4.769 -0.792 1.086 1.00 0.00 H new ATOM 0 HA ALA A 92 -5.050 -3.455 2.314 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -7.356 -2.863 2.991 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -6.145 -1.871 3.838 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -7.067 -1.183 2.479 1.00 0.00 H new ATOM 1406 N ALA A 93 -6.504 -4.223 0.421 1.00 0.00 N ATOM 1407 CA ALA A 93 -7.114 -4.716 -0.807 1.00 0.00 C ATOM 1408 C ALA A 93 -8.629 -4.813 -0.667 1.00 0.00 C ATOM 1409 O ALA A 93 -9.141 -5.253 0.362 1.00 0.00 O ATOM 1410 CB ALA A 93 -6.528 -6.070 -1.181 1.00 0.00 C ATOM 0 H ALA A 93 -6.373 -4.934 1.141 1.00 0.00 H new ATOM 0 HA ALA A 93 -6.894 -4.005 -1.603 1.00 0.00 H new ATOM 0 HB1 ALA A 93 -6.993 -6.426 -2.100 1.00 0.00 H new ATOM 0 HB2 ALA A 93 -5.453 -5.972 -1.332 1.00 0.00 H new ATOM 0 HB3 ALA A 93 -6.718 -6.783 -0.379 1.00 0.00 H new ATOM 1416 N VAL A 94 -9.343 -4.398 -1.710 1.00 0.00 N ATOM 1417 CA VAL A 94 -10.800 -4.439 -1.702 1.00 0.00 C ATOM 1418 C VAL A 94 -11.334 -5.235 -2.889 1.00 0.00 C ATOM 1419 O VAL A 94 -11.083 -4.891 -4.043 1.00 0.00 O ATOM 1420 CB VAL A 94 -11.401 -3.021 -1.738 1.00 0.00 C ATOM 1421 CG1 VAL A 94 -12.913 -3.086 -1.892 1.00 0.00 C ATOM 1422 CG2 VAL A 94 -11.017 -2.248 -0.485 1.00 0.00 C ATOM 0 H VAL A 94 -8.936 -4.030 -2.570 1.00 0.00 H new ATOM 0 HA VAL A 94 -11.098 -4.929 -0.775 1.00 0.00 H new ATOM 0 HB VAL A 94 -10.994 -2.494 -2.601 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -13.320 -2.075 -1.915 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -13.162 -3.599 -2.821 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -13.341 -3.630 -1.050 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -11.450 -1.249 -0.527 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -11.394 -2.770 0.394 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -9.931 -2.171 -0.423 1.00 0.00 H new ATOM 1432 N ASN A 95 -12.070 -6.301 -2.596 1.00 0.00 N ATOM 1433 CA ASN A 95 -12.639 -7.147 -3.638 1.00 0.00 C ATOM 1434 C ASN A 95 -14.151 -6.965 -3.722 1.00 0.00 C ATOM 1435 O ASN A 95 -14.744 -6.233 -2.930 1.00 0.00 O ATOM 1436 CB ASN A 95 -12.305 -8.616 -3.372 1.00 0.00 C ATOM 1437 CG ASN A 95 -13.134 -9.203 -2.246 1.00 0.00 C ATOM 1438 OD1 ASN A 95 -13.933 -8.505 -1.621 1.00 0.00 O ATOM 1439 ND2 ASN A 95 -12.946 -10.490 -1.981 1.00 0.00 N ATOM 0 H ASN A 95 -12.287 -6.600 -1.645 1.00 0.00 H new ATOM 0 HA ASN A 95 -12.202 -6.849 -4.591 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -12.471 -9.194 -4.281 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -11.247 -8.706 -3.126 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -13.475 -10.939 -1.233 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -12.273 -11.030 -2.525 1.00 0.00 H new ATOM 1446 N GLY A 96 -14.771 -7.638 -4.686 1.00 0.00 N ATOM 1447 CA GLY A 96 -16.209 -7.538 -4.855 1.00 0.00 C ATOM 1448 C GLY A 96 -16.961 -7.756 -3.557 1.00 0.00 C ATOM 1449 O GLY A 96 -18.135 -7.401 -3.444 1.00 0.00 O ATOM 0 H GLY A 96 -14.303 -8.251 -5.353 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -16.457 -6.555 -5.255 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -16.538 -8.273 -5.590 1.00 0.00 H new ATOM 1453 N LYS A 97 -16.286 -8.344 -2.576 1.00 0.00 N ATOM 1454 CA LYS A 97 -16.898 -8.610 -1.279 1.00 0.00 C ATOM 1455 C LYS A 97 -16.804 -7.387 -0.372 1.00 0.00 C ATOM 1456 O LYS A 97 -17.820 -6.853 0.072 1.00 0.00 O ATOM 1457 CB LYS A 97 -16.220 -9.808 -0.609 1.00 0.00 C ATOM 1458 CG LYS A 97 -17.150 -10.612 0.282 1.00 0.00 C ATOM 1459 CD LYS A 97 -17.881 -11.689 -0.503 1.00 0.00 C ATOM 1460 CE LYS A 97 -18.614 -11.105 -1.701 1.00 0.00 C ATOM 1461 NZ LYS A 97 -19.421 -12.135 -2.413 1.00 0.00 N ATOM 0 H LYS A 97 -15.315 -8.646 -2.654 1.00 0.00 H new ATOM 0 HA LYS A 97 -17.951 -8.840 -1.442 1.00 0.00 H new ATOM 0 HB2 LYS A 97 -15.813 -10.462 -1.380 1.00 0.00 H new ATOM 0 HB3 LYS A 97 -15.378 -9.453 -0.015 1.00 0.00 H new ATOM 0 HG2 LYS A 97 -16.577 -11.073 1.086 1.00 0.00 H new ATOM 0 HG3 LYS A 97 -17.875 -9.945 0.749 1.00 0.00 H new ATOM 0 HD2 LYS A 97 -17.168 -12.441 -0.842 1.00 0.00 H new ATOM 0 HD3 LYS A 97 -18.593 -12.196 0.149 1.00 0.00 H new ATOM 0 HE2 LYS A 97 -19.267 -10.298 -1.369 1.00 0.00 H new ATOM 0 HE3 LYS A 97 -17.892 -10.668 -2.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 97 -19.905 -11.698 -3.223 1.00 0.00 H new ATOM 0 HZ2 LYS A 97 -18.795 -12.893 -2.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 97 -20.127 -12.534 -1.762 1.00 0.00 H new ATOM 1475 N GLY A 98 -15.579 -6.948 -0.102 1.00 0.00 N ATOM 1476 CA GLY A 98 -15.376 -5.790 0.750 1.00 0.00 C ATOM 1477 C GLY A 98 -13.910 -5.518 1.018 1.00 0.00 C ATOM 1478 O GLY A 98 -13.042 -5.972 0.274 1.00 0.00 O ATOM 0 H GLY A 98 -14.723 -7.373 -0.458 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -15.825 -4.914 0.281 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -15.893 -5.945 1.697 1.00 0.00 H new ATOM 1482 N GLN A 99 -13.634 -4.774 2.084 1.00 0.00 N ATOM 1483 CA GLN A 99 -12.261 -4.439 2.448 1.00 0.00 C ATOM 1484 C GLN A 99 -11.728 -5.402 3.502 1.00 0.00 C ATOM 1485 O GLN A 99 -12.163 -5.382 4.653 1.00 0.00 O ATOM 1486 CB GLN A 99 -12.183 -3.002 2.965 1.00 0.00 C ATOM 1487 CG GLN A 99 -10.764 -2.527 3.231 1.00 0.00 C ATOM 1488 CD GLN A 99 -10.720 -1.167 3.898 1.00 0.00 C ATOM 1489 OE1 GLN A 99 -11.677 -0.751 4.552 1.00 0.00 O ATOM 1490 NE2 GLN A 99 -9.606 -0.463 3.735 1.00 0.00 N ATOM 0 H GLN A 99 -14.342 -4.392 2.711 1.00 0.00 H new ATOM 0 HA GLN A 99 -11.643 -4.529 1.555 1.00 0.00 H new ATOM 0 HB2 GLN A 99 -12.649 -2.337 2.238 1.00 0.00 H new ATOM 0 HB3 GLN A 99 -12.762 -2.924 3.885 1.00 0.00 H new ATOM 0 HG2 GLN A 99 -10.254 -3.254 3.863 1.00 0.00 H new ATOM 0 HG3 GLN A 99 -10.217 -2.484 2.289 1.00 0.00 H new ATOM 0 HE21 GLN A 99 -8.837 -0.846 3.185 1.00 0.00 H new ATOM 0 HE22 GLN A 99 -9.519 0.460 4.160 1.00 0.00 H new ATOM 1499 N GLY A 100 -10.781 -6.246 3.103 1.00 0.00 N ATOM 1500 CA GLY A 100 -10.204 -7.206 4.026 1.00 0.00 C ATOM 1501 C GLY A 100 -9.612 -6.544 5.255 1.00 0.00 C ATOM 1502 O GLY A 100 -10.339 -5.995 6.084 1.00 0.00 O ATOM 0 H GLY A 100 -10.403 -6.282 2.156 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -10.971 -7.916 4.334 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -9.428 -7.776 3.515 1.00 0.00 H new ATOM 1506 N ASP A 101 -8.290 -6.596 5.375 1.00 0.00 N ATOM 1507 CA ASP A 101 -7.601 -5.997 6.512 1.00 0.00 C ATOM 1508 C ASP A 101 -6.432 -5.135 6.046 1.00 0.00 C ATOM 1509 O ASP A 101 -5.785 -5.436 5.043 1.00 0.00 O ATOM 1510 CB ASP A 101 -7.101 -7.086 7.463 1.00 0.00 C ATOM 1511 CG ASP A 101 -8.182 -7.576 8.403 1.00 0.00 C ATOM 1512 OD1 ASP A 101 -8.918 -6.729 8.953 1.00 0.00 O ATOM 1513 OD2 ASP A 101 -8.294 -8.805 8.592 1.00 0.00 O ATOM 0 H ASP A 101 -7.674 -7.047 4.699 1.00 0.00 H new ATOM 0 HA ASP A 101 -8.310 -5.360 7.041 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -6.722 -7.926 6.881 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -6.265 -6.699 8.046 1.00 0.00 H new ATOM 1518 N TYR A 102 -6.169 -4.059 6.780 1.00 0.00 N ATOM 1519 CA TYR A 102 -5.080 -3.150 6.440 1.00 0.00 C ATOM 1520 C TYR A 102 -3.726 -3.794 6.718 1.00 0.00 C ATOM 1521 O TYR A 102 -3.568 -4.541 7.683 1.00 0.00 O ATOM 1522 CB TYR A 102 -5.210 -1.847 7.231 1.00 0.00 C ATOM 1523 CG TYR A 102 -6.080 -0.812 6.554 1.00 0.00 C ATOM 1524 CD1 TYR A 102 -5.644 -0.148 5.413 1.00 0.00 C ATOM 1525 CD2 TYR A 102 -7.337 -0.497 7.054 1.00 0.00 C ATOM 1526 CE1 TYR A 102 -6.435 0.799 4.792 1.00 0.00 C ATOM 1527 CE2 TYR A 102 -8.136 0.448 6.439 1.00 0.00 C ATOM 1528 CZ TYR A 102 -7.679 1.094 5.309 1.00 0.00 C ATOM 1529 OH TYR A 102 -8.470 2.036 4.692 1.00 0.00 O ATOM 0 H TYR A 102 -6.694 -3.795 7.613 1.00 0.00 H new ATOM 0 HA TYR A 102 -5.144 -2.929 5.375 1.00 0.00 H new ATOM 0 HB2 TYR A 102 -5.623 -2.069 8.215 1.00 0.00 H new ATOM 0 HB3 TYR A 102 -4.217 -1.427 7.389 1.00 0.00 H new ATOM 0 HD1 TYR A 102 -4.670 -0.376 5.005 1.00 0.00 H new ATOM 0 HD2 TYR A 102 -7.697 -1.000 7.940 1.00 0.00 H new ATOM 0 HE1 TYR A 102 -6.081 1.306 3.906 1.00 0.00 H new ATOM 0 HE2 TYR A 102 -9.112 0.679 6.840 1.00 0.00 H new ATOM 0 HH TYR A 102 -9.315 2.125 5.181 1.00 0.00 H new ATOM 1539 N SER A 103 -2.751 -3.498 5.864 1.00 0.00 N ATOM 1540 CA SER A 103 -1.410 -4.049 6.014 1.00 0.00 C ATOM 1541 C SER A 103 -0.684 -3.402 7.190 1.00 0.00 C ATOM 1542 O SER A 103 -1.186 -2.457 7.800 1.00 0.00 O ATOM 1543 CB SER A 103 -0.606 -3.847 4.729 1.00 0.00 C ATOM 1544 OG SER A 103 0.077 -2.604 4.745 1.00 0.00 O ATOM 0 H SER A 103 -2.865 -2.879 5.061 1.00 0.00 H new ATOM 0 HA SER A 103 -1.503 -5.117 6.211 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.112 -4.659 4.614 1.00 0.00 H new ATOM 0 HB3 SER A 103 -1.274 -3.888 3.868 1.00 0.00 H new ATOM 0 HG SER A 103 0.585 -2.499 3.914 1.00 0.00 H new ATOM 1550 N LYS A 104 0.500 -3.916 7.502 1.00 0.00 N ATOM 1551 CA LYS A 104 1.298 -3.388 8.603 1.00 0.00 C ATOM 1552 C LYS A 104 1.492 -1.882 8.461 1.00 0.00 C ATOM 1553 O LYS A 104 2.196 -1.420 7.563 1.00 0.00 O ATOM 1554 CB LYS A 104 2.659 -4.087 8.653 1.00 0.00 C ATOM 1555 CG LYS A 104 3.322 -4.027 10.019 1.00 0.00 C ATOM 1556 CD LYS A 104 4.684 -4.699 10.006 1.00 0.00 C ATOM 1557 CE LYS A 104 5.705 -3.875 9.236 1.00 0.00 C ATOM 1558 NZ LYS A 104 6.986 -4.613 9.049 1.00 0.00 N ATOM 0 H LYS A 104 0.929 -4.698 7.008 1.00 0.00 H new ATOM 0 HA LYS A 104 0.763 -3.581 9.533 1.00 0.00 H new ATOM 0 HB2 LYS A 104 2.533 -5.131 8.365 1.00 0.00 H new ATOM 0 HB3 LYS A 104 3.320 -3.630 7.917 1.00 0.00 H new ATOM 0 HG2 LYS A 104 3.431 -2.987 10.326 1.00 0.00 H new ATOM 0 HG3 LYS A 104 2.683 -4.512 10.757 1.00 0.00 H new ATOM 0 HD2 LYS A 104 5.029 -4.844 11.030 1.00 0.00 H new ATOM 0 HD3 LYS A 104 4.599 -5.688 9.556 1.00 0.00 H new ATOM 0 HE2 LYS A 104 5.295 -3.606 8.262 1.00 0.00 H new ATOM 0 HE3 LYS A 104 5.897 -2.944 9.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 7.655 -4.018 8.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 7.390 -4.847 9.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 6.807 -5.489 8.518 1.00 0.00 H new ATOM 1572 N ILE A 105 0.865 -1.123 9.353 1.00 0.00 N ATOM 1573 CA ILE A 105 0.973 0.331 9.328 1.00 0.00 C ATOM 1574 C ILE A 105 2.371 0.772 8.908 1.00 0.00 C ATOM 1575 O ILE A 105 3.368 0.345 9.489 1.00 0.00 O ATOM 1576 CB ILE A 105 0.645 0.943 10.702 1.00 0.00 C ATOM 1577 CG1 ILE A 105 -0.789 0.599 11.110 1.00 0.00 C ATOM 1578 CG2 ILE A 105 0.846 2.451 10.672 1.00 0.00 C ATOM 1579 CD1 ILE A 105 -1.834 1.164 10.173 1.00 0.00 C ATOM 0 H ILE A 105 0.277 -1.490 10.102 1.00 0.00 H new ATOM 0 HA ILE A 105 0.248 0.689 8.597 1.00 0.00 H new ATOM 0 HB ILE A 105 1.324 0.520 11.442 1.00 0.00 H new ATOM 0 HG12 ILE A 105 -0.897 -0.485 11.151 1.00 0.00 H new ATOM 0 HG13 ILE A 105 -0.973 0.976 12.116 1.00 0.00 H new ATOM 0 HG21 ILE A 105 0.610 2.869 11.651 1.00 0.00 H new ATOM 0 HG22 ILE A 105 1.883 2.675 10.422 1.00 0.00 H new ATOM 0 HG23 ILE A 105 0.189 2.891 9.922 1.00 0.00 H new ATOM 0 HD11 ILE A 105 -2.827 0.881 10.523 1.00 0.00 H new ATOM 0 HD12 ILE A 105 -1.753 2.251 10.150 1.00 0.00 H new ATOM 0 HD13 ILE A 105 -1.676 0.767 9.170 1.00 0.00 H new ATOM 1591 N GLU A 106 2.436 1.629 7.894 1.00 0.00 N ATOM 1592 CA GLU A 106 3.712 2.129 7.397 1.00 0.00 C ATOM 1593 C GLU A 106 3.927 3.583 7.812 1.00 0.00 C ATOM 1594 O GLU A 106 2.982 4.371 7.857 1.00 0.00 O ATOM 1595 CB GLU A 106 3.774 2.008 5.872 1.00 0.00 C ATOM 1596 CG GLU A 106 3.824 0.572 5.379 1.00 0.00 C ATOM 1597 CD GLU A 106 5.202 -0.044 5.516 1.00 0.00 C ATOM 1598 OE1 GLU A 106 5.596 -0.370 6.655 1.00 0.00 O ATOM 1599 OE2 GLU A 106 5.887 -0.202 4.483 1.00 0.00 O ATOM 0 H GLU A 106 1.620 1.991 7.401 1.00 0.00 H new ATOM 0 HA GLU A 106 4.505 1.523 7.835 1.00 0.00 H new ATOM 0 HB2 GLU A 106 2.903 2.502 5.441 1.00 0.00 H new ATOM 0 HB3 GLU A 106 4.654 2.539 5.509 1.00 0.00 H new ATOM 0 HG2 GLU A 106 3.106 -0.026 5.940 1.00 0.00 H new ATOM 0 HG3 GLU A 106 3.518 0.540 4.333 1.00 0.00 H new ATOM 1606 N ILE A 107 5.173 3.928 8.113 1.00 0.00 N ATOM 1607 CA ILE A 107 5.512 5.285 8.522 1.00 0.00 C ATOM 1608 C ILE A 107 6.612 5.868 7.641 1.00 0.00 C ATOM 1609 O ILE A 107 7.749 5.398 7.657 1.00 0.00 O ATOM 1610 CB ILE A 107 5.969 5.331 9.992 1.00 0.00 C ATOM 1611 CG1 ILE A 107 4.926 4.670 10.895 1.00 0.00 C ATOM 1612 CG2 ILE A 107 6.218 6.769 10.425 1.00 0.00 C ATOM 1613 CD1 ILE A 107 5.428 4.391 12.295 1.00 0.00 C ATOM 0 H ILE A 107 5.965 3.287 8.081 1.00 0.00 H new ATOM 0 HA ILE A 107 4.607 5.883 8.411 1.00 0.00 H new ATOM 0 HB ILE A 107 6.904 4.778 10.083 1.00 0.00 H new ATOM 0 HG12 ILE A 107 4.048 5.314 10.954 1.00 0.00 H new ATOM 0 HG13 ILE A 107 4.604 3.733 10.440 1.00 0.00 H new ATOM 0 HG21 ILE A 107 6.540 6.785 11.466 1.00 0.00 H new ATOM 0 HG22 ILE A 107 6.994 7.209 9.798 1.00 0.00 H new ATOM 0 HG23 ILE A 107 5.298 7.345 10.321 1.00 0.00 H new ATOM 0 HD11 ILE A 107 4.636 3.922 12.879 1.00 0.00 H new ATOM 0 HD12 ILE A 107 6.288 3.722 12.247 1.00 0.00 H new ATOM 0 HD13 ILE A 107 5.723 5.327 12.769 1.00 0.00 H new ATOM 1625 N PHE A 108 6.264 6.895 6.873 1.00 0.00 N ATOM 1626 CA PHE A 108 7.222 7.543 5.985 1.00 0.00 C ATOM 1627 C PHE A 108 7.315 9.037 6.283 1.00 0.00 C ATOM 1628 O PHE A 108 6.305 9.694 6.534 1.00 0.00 O ATOM 1629 CB PHE A 108 6.822 7.327 4.524 1.00 0.00 C ATOM 1630 CG PHE A 108 5.590 8.088 4.121 1.00 0.00 C ATOM 1631 CD1 PHE A 108 5.619 9.468 4.003 1.00 0.00 C ATOM 1632 CD2 PHE A 108 4.403 7.423 3.862 1.00 0.00 C ATOM 1633 CE1 PHE A 108 4.489 10.171 3.632 1.00 0.00 C ATOM 1634 CE2 PHE A 108 3.268 8.120 3.490 1.00 0.00 C ATOM 1635 CZ PHE A 108 3.311 9.495 3.376 1.00 0.00 C ATOM 0 H PHE A 108 5.327 7.296 6.848 1.00 0.00 H new ATOM 0 HA PHE A 108 8.200 7.094 6.157 1.00 0.00 H new ATOM 0 HB2 PHE A 108 7.650 7.625 3.881 1.00 0.00 H new ATOM 0 HB3 PHE A 108 6.654 6.263 4.355 1.00 0.00 H new ATOM 0 HD1 PHE A 108 6.537 10.001 4.204 1.00 0.00 H new ATOM 0 HD2 PHE A 108 4.363 6.347 3.952 1.00 0.00 H new ATOM 0 HE1 PHE A 108 4.526 11.247 3.542 1.00 0.00 H new ATOM 0 HE2 PHE A 108 2.349 7.589 3.289 1.00 0.00 H new ATOM 0 HZ PHE A 108 2.425 10.042 3.087 1.00 0.00 H new ATOM 1645 N GLN A 109 8.534 9.565 6.253 1.00 0.00 N ATOM 1646 CA GLN A 109 8.760 10.980 6.521 1.00 0.00 C ATOM 1647 C GLN A 109 9.177 11.716 5.251 1.00 0.00 C ATOM 1648 O GLN A 109 10.137 11.328 4.584 1.00 0.00 O ATOM 1649 CB GLN A 109 9.832 11.152 7.599 1.00 0.00 C ATOM 1650 CG GLN A 109 10.133 12.605 7.931 1.00 0.00 C ATOM 1651 CD GLN A 109 11.304 12.755 8.884 1.00 0.00 C ATOM 1652 OE1 GLN A 109 11.441 11.994 9.842 1.00 0.00 O ATOM 1653 NE2 GLN A 109 12.156 13.740 8.622 1.00 0.00 N ATOM 0 H GLN A 109 9.380 9.034 6.046 1.00 0.00 H new ATOM 0 HA GLN A 109 7.824 11.410 6.877 1.00 0.00 H new ATOM 0 HB2 GLN A 109 9.509 10.640 8.506 1.00 0.00 H new ATOM 0 HB3 GLN A 109 10.750 10.666 7.268 1.00 0.00 H new ATOM 0 HG2 GLN A 109 10.347 13.147 7.010 1.00 0.00 H new ATOM 0 HG3 GLN A 109 9.248 13.064 8.373 1.00 0.00 H new ATOM 0 HE21 GLN A 109 12.002 14.346 7.816 1.00 0.00 H new ATOM 0 HE22 GLN A 109 12.964 13.890 9.226 1.00 0.00 H new ATOM 1662 N THR A 110 8.450 12.778 4.923 1.00 0.00 N ATOM 1663 CA THR A 110 8.743 13.566 3.732 1.00 0.00 C ATOM 1664 C THR A 110 10.127 14.202 3.820 1.00 0.00 C ATOM 1665 O THR A 110 10.618 14.494 4.911 1.00 0.00 O ATOM 1666 CB THR A 110 7.695 14.675 3.520 1.00 0.00 C ATOM 1667 OG1 THR A 110 7.648 15.532 4.667 1.00 0.00 O ATOM 1668 CG2 THR A 110 6.318 14.077 3.271 1.00 0.00 C ATOM 0 H THR A 110 7.654 13.113 5.465 1.00 0.00 H new ATOM 0 HA THR A 110 8.713 12.881 2.885 1.00 0.00 H new ATOM 0 HB THR A 110 7.986 15.256 2.645 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.725 15.822 4.821 1.00 0.00 H new ATOM 0 HG21 THR A 110 5.594 14.879 3.124 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.350 13.449 2.381 1.00 0.00 H new ATOM 0 HG23 THR A 110 6.022 13.474 4.130 1.00 0.00 H new ATOM 1676 N LEU A 111 10.749 14.413 2.666 1.00 0.00 N ATOM 1677 CA LEU A 111 12.077 15.016 2.612 1.00 0.00 C ATOM 1678 C LEU A 111 12.025 16.486 3.015 1.00 0.00 C ATOM 1679 O LEU A 111 11.096 17.216 2.671 1.00 0.00 O ATOM 1680 CB LEU A 111 12.663 14.880 1.206 1.00 0.00 C ATOM 1681 CG LEU A 111 12.878 13.452 0.703 1.00 0.00 C ATOM 1682 CD1 LEU A 111 13.277 13.457 -0.765 1.00 0.00 C ATOM 1683 CD2 LEU A 111 13.932 12.743 1.542 1.00 0.00 C ATOM 0 H LEU A 111 10.356 14.176 1.755 1.00 0.00 H new ATOM 0 HA LEU A 111 12.718 14.488 3.318 1.00 0.00 H new ATOM 0 HB2 LEU A 111 12.003 15.394 0.508 1.00 0.00 H new ATOM 0 HB3 LEU A 111 13.620 15.400 1.181 1.00 0.00 H new ATOM 0 HG LEU A 111 11.939 12.908 0.801 1.00 0.00 H new ATOM 0 HD11 LEU A 111 13.426 12.432 -1.105 1.00 0.00 H new ATOM 0 HD12 LEU A 111 12.488 13.924 -1.355 1.00 0.00 H new ATOM 0 HD13 LEU A 111 14.203 14.018 -0.888 1.00 0.00 H new ATOM 0 HD21 LEU A 111 14.072 11.728 1.169 1.00 0.00 H new ATOM 0 HD22 LEU A 111 14.875 13.286 1.477 1.00 0.00 H new ATOM 0 HD23 LEU A 111 13.605 12.706 2.581 1.00 0.00 H new ATOM 1695 N PRO A 112 13.048 16.932 3.759 1.00 0.00 N ATOM 1696 CA PRO A 112 13.143 18.320 4.222 1.00 0.00 C ATOM 1697 C PRO A 112 13.420 19.294 3.081 1.00 0.00 C ATOM 1698 O PRO A 112 14.453 19.210 2.418 1.00 0.00 O ATOM 1699 CB PRO A 112 14.322 18.289 5.196 1.00 0.00 C ATOM 1700 CG PRO A 112 15.153 17.136 4.749 1.00 0.00 C ATOM 1701 CD PRO A 112 14.190 16.117 4.206 1.00 0.00 C ATOM 0 HA PRO A 112 12.211 18.665 4.670 1.00 0.00 H new ATOM 0 HB2 PRO A 112 14.887 19.220 5.163 1.00 0.00 H new ATOM 0 HB3 PRO A 112 13.983 18.158 6.224 1.00 0.00 H new ATOM 0 HG2 PRO A 112 15.868 17.443 3.986 1.00 0.00 H new ATOM 0 HG3 PRO A 112 15.729 16.725 5.578 1.00 0.00 H new ATOM 0 HD2 PRO A 112 14.626 15.550 3.383 1.00 0.00 H new ATOM 0 HD3 PRO A 112 13.895 15.396 4.969 1.00 0.00 H new ATOM 1709 N VAL A 113 12.490 20.217 2.859 1.00 0.00 N ATOM 1710 CA VAL A 113 12.636 21.208 1.799 1.00 0.00 C ATOM 1711 C VAL A 113 14.094 21.616 1.624 1.00 0.00 C ATOM 1712 O VAL A 113 14.705 22.176 2.535 1.00 0.00 O ATOM 1713 CB VAL A 113 11.792 22.465 2.087 1.00 0.00 C ATOM 1714 CG1 VAL A 113 11.960 23.487 0.972 1.00 0.00 C ATOM 1715 CG2 VAL A 113 10.328 22.094 2.264 1.00 0.00 C ATOM 0 H VAL A 113 11.628 20.299 3.398 1.00 0.00 H new ATOM 0 HA VAL A 113 12.280 20.743 0.879 1.00 0.00 H new ATOM 0 HB VAL A 113 12.144 22.914 3.016 1.00 0.00 H new ATOM 0 HG11 VAL A 113 11.357 24.368 1.192 1.00 0.00 H new ATOM 0 HG12 VAL A 113 13.009 23.775 0.897 1.00 0.00 H new ATOM 0 HG13 VAL A 113 11.635 23.051 0.027 1.00 0.00 H new ATOM 0 HG21 VAL A 113 9.747 22.993 2.467 1.00 0.00 H new ATOM 0 HG22 VAL A 113 9.960 21.621 1.353 1.00 0.00 H new ATOM 0 HG23 VAL A 113 10.227 21.401 3.099 1.00 0.00 H new ATOM 1725 N SER A 114 14.645 21.334 0.449 1.00 0.00 N ATOM 1726 CA SER A 114 16.034 21.670 0.155 1.00 0.00 C ATOM 1727 C SER A 114 16.206 23.177 -0.008 1.00 0.00 C ATOM 1728 O SER A 114 17.047 23.792 0.647 1.00 0.00 O ATOM 1729 CB SER A 114 16.497 20.952 -1.113 1.00 0.00 C ATOM 1730 OG SER A 114 16.985 19.655 -0.817 1.00 0.00 O ATOM 0 H SER A 114 14.152 20.874 -0.316 1.00 0.00 H new ATOM 0 HA SER A 114 16.647 21.341 0.994 1.00 0.00 H new ATOM 0 HB2 SER A 114 15.668 20.880 -1.817 1.00 0.00 H new ATOM 0 HB3 SER A 114 17.278 21.535 -1.600 1.00 0.00 H new ATOM 0 HG SER A 114 17.273 19.217 -1.645 1.00 0.00 H new ATOM 1736 N GLY A 115 15.402 23.767 -0.888 1.00 0.00 N ATOM 1737 CA GLY A 115 15.480 25.197 -1.123 1.00 0.00 C ATOM 1738 C GLY A 115 14.208 25.754 -1.730 1.00 0.00 C ATOM 1739 O GLY A 115 13.149 25.129 -1.687 1.00 0.00 O ATOM 0 H GLY A 115 14.698 23.280 -1.442 1.00 0.00 H new ATOM 0 HA2 GLY A 115 15.683 25.706 -0.181 1.00 0.00 H new ATOM 0 HA3 GLY A 115 16.319 25.408 -1.787 1.00 0.00 H new ATOM 1743 N PRO A 116 14.304 26.961 -2.309 1.00 0.00 N ATOM 1744 CA PRO A 116 13.162 27.630 -2.936 1.00 0.00 C ATOM 1745 C PRO A 116 12.719 26.940 -4.222 1.00 0.00 C ATOM 1746 O PRO A 116 13.518 26.744 -5.139 1.00 0.00 O ATOM 1747 CB PRO A 116 13.695 29.034 -3.239 1.00 0.00 C ATOM 1748 CG PRO A 116 15.170 28.861 -3.356 1.00 0.00 C ATOM 1749 CD PRO A 116 15.537 27.763 -2.395 1.00 0.00 C ATOM 0 HA PRO A 116 12.282 27.622 -2.292 1.00 0.00 H new ATOM 0 HB2 PRO A 116 13.268 29.429 -4.161 1.00 0.00 H new ATOM 0 HB3 PRO A 116 13.440 29.735 -2.444 1.00 0.00 H new ATOM 0 HG2 PRO A 116 15.452 28.598 -4.375 1.00 0.00 H new ATOM 0 HG3 PRO A 116 15.692 29.786 -3.110 1.00 0.00 H new ATOM 0 HD2 PRO A 116 16.376 27.172 -2.761 1.00 0.00 H new ATOM 0 HD3 PRO A 116 15.827 28.160 -1.422 1.00 0.00 H new ATOM 1757 N SER A 117 11.443 26.574 -4.282 1.00 0.00 N ATOM 1758 CA SER A 117 10.896 25.903 -5.455 1.00 0.00 C ATOM 1759 C SER A 117 10.381 26.917 -6.472 1.00 0.00 C ATOM 1760 O SER A 117 9.879 27.980 -6.105 1.00 0.00 O ATOM 1761 CB SER A 117 9.766 24.955 -5.046 1.00 0.00 C ATOM 1762 OG SER A 117 9.445 24.061 -6.097 1.00 0.00 O ATOM 0 H SER A 117 10.769 26.731 -3.533 1.00 0.00 H new ATOM 0 HA SER A 117 11.696 25.326 -5.918 1.00 0.00 H new ATOM 0 HB2 SER A 117 10.063 24.390 -4.162 1.00 0.00 H new ATOM 0 HB3 SER A 117 8.883 25.533 -4.774 1.00 0.00 H new ATOM 0 HG SER A 117 8.722 23.465 -5.810 1.00 0.00 H new ATOM 1768 N SER A 118 10.510 26.580 -7.752 1.00 0.00 N ATOM 1769 CA SER A 118 10.062 27.463 -8.823 1.00 0.00 C ATOM 1770 C SER A 118 8.769 26.947 -9.447 1.00 0.00 C ATOM 1771 O SER A 118 7.816 27.700 -9.640 1.00 0.00 O ATOM 1772 CB SER A 118 11.145 27.588 -9.896 1.00 0.00 C ATOM 1773 OG SER A 118 11.315 26.367 -10.594 1.00 0.00 O ATOM 0 H SER A 118 10.921 25.703 -8.072 1.00 0.00 H new ATOM 0 HA SER A 118 9.871 28.446 -8.394 1.00 0.00 H new ATOM 0 HB2 SER A 118 10.876 28.377 -10.598 1.00 0.00 H new ATOM 0 HB3 SER A 118 12.088 27.880 -9.433 1.00 0.00 H new ATOM 0 HG SER A 118 12.011 26.474 -11.275 1.00 0.00 H new ATOM 1779 N GLY A 119 8.745 25.655 -9.760 1.00 0.00 N ATOM 1780 CA GLY A 119 7.566 25.058 -10.359 1.00 0.00 C ATOM 1781 C GLY A 119 7.789 23.617 -10.770 1.00 0.00 C ATOM 1782 O GLY A 119 6.970 22.746 -10.475 1.00 0.00 O ATOM 0 H GLY A 119 9.522 25.011 -9.609 1.00 0.00 H new ATOM 0 HA2 GLY A 119 6.739 25.106 -9.651 1.00 0.00 H new ATOM 0 HA3 GLY A 119 7.272 25.640 -11.233 1.00 0.00 H new TER 1786 GLY A 119