USER MOD reduce.3.24.130724 H: found=0, std=0, add=744, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 739 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 54 HIS : no HD1:sc= 0.862 K(o=0.62,f=-4.4!) USER MOD Set 1.2: A 91 SER OG : rot -104:sc= -0.238 USER MOD Set 2.1: A 63 ASN : amide:sc= 1.05 K(o=2.1,f=-3.2!) USER MOD Set 2.2: A 71 LYS NZ :NH3+ -171:sc= 1.08 (180deg=-0.00513) USER MOD Set 3.1: A 17 SER OG : rot 180:sc= 0 USER MOD Set 3.2: A 20 GLN : amide:sc= -0.596 K(o=-0.6,f=-6.3!) USER MOD Single : A 1 GLY N :NH3+ -136:sc= 0.072 (180deg=0) USER MOD Single : A 3 MET CE :methyl 154:sc= -0.212 (180deg=-1.02) USER MOD Single : A 6 LYS NZ :NH3+ -165:sc= 0 (180deg=-0.012) USER MOD Single : A 7 SER OG : rot 180:sc= -0.0901 USER MOD Single : A 8 LYS NZ :NH3+ 162:sc= 1.07 (180deg=0.373) USER MOD Single : A 15 LYS NZ :NH3+ -149:sc= 0.359 (180deg=-1.96!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 HIS :FLIP no HD1:sc= -0.469 F(o=-1.3,f=-0.47) USER MOD Single : A 28 LYS NZ :NH3+ 148:sc= 1.27 (180deg=-0.337!) USER MOD Single : A 33 ASN : amide:sc= 1.14 K(o=1.1,f=-0.11) USER MOD Single : A 39 LYS NZ :NH3+ -171:sc= 0.731 (180deg=0.666) USER MOD Single : A 43 TYR OH : rot 0:sc= -0.708 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -136:sc= 1.29 (180deg=0.76) USER MOD Single : A 49 LYS NZ :NH3+ -149:sc= 1.14 (180deg=0.353) USER MOD Single : A 50 THR OG1 : rot 123:sc= 1.26 USER MOD Single : A 56 LYS NZ :NH3+ -157:sc= 1.14 (180deg=0.721) USER MOD Single : A 57 SER OG : rot 70:sc= 1.26 USER MOD Single : A 61 LYS NZ :NH3+ -111:sc= 0.348 (180deg=-0.724) USER MOD Single : A 65 ASN : amide:sc= 0.0572 K(o=0.057,f=-3.7!) USER MOD Single : A 69 GLN :FLIP amide:sc= -0.0387 F(o=-0.95,f=-0.039) USER MOD Single : A 70 GLN : amide:sc= 1.28 K(o=1.3,f=-0.55) USER MOD Single : A 72 THR OG1 : rot 98:sc= 1.23 USER MOD Single : A 73 THR OG1 : rot 67:sc= 0.787 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= 0.177 K(o=0.18,f=-1.5!) USER MOD Single : A 83 SER OG : rot 84:sc= 1.27 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 93 ASN : amide:sc= 0 X(o=0,f=-0.34) USER MOD Single : A 96 THR OG1 : rot -168:sc= 0.783 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0.0233 USER MOD Single : A 100 ASN : amide:sc= 0.0235 K(o=0.024,f=-2.3!) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 11.551 0.039 -7.904 1.00 0.00 N ATOM 2 CA GLY A 1 10.105 -0.247 -7.745 1.00 0.00 C ATOM 3 C GLY A 1 9.525 0.451 -6.537 1.00 0.00 C ATOM 4 O GLY A 1 10.135 1.373 -5.994 1.00 0.00 O ATOM 0 H1 GLY A 1 11.757 0.243 -8.903 1.00 0.00 H new ATOM 0 H2 GLY A 1 11.808 0.862 -7.323 1.00 0.00 H new ATOM 0 H3 GLY A 1 12.104 -0.787 -7.598 1.00 0.00 H new ATOM 0 HA2 GLY A 1 9.571 0.071 -8.640 1.00 0.00 H new ATOM 0 HA3 GLY A 1 9.955 -1.323 -7.650 1.00 0.00 H new ATOM 7 N ALA A 2 8.349 0.018 -6.109 1.00 0.00 N ATOM 8 CA ALA A 2 7.706 0.613 -4.948 1.00 0.00 C ATOM 9 C ALA A 2 8.087 -0.145 -3.681 1.00 0.00 C ATOM 10 O ALA A 2 8.950 0.296 -2.922 1.00 0.00 O ATOM 11 CB ALA A 2 6.199 0.640 -5.131 1.00 0.00 C ATOM 0 H ALA A 2 7.823 -0.739 -6.545 1.00 0.00 H new ATOM 0 HA ALA A 2 8.054 1.641 -4.846 1.00 0.00 H new ATOM 0 HB1 ALA A 2 5.734 1.088 -4.253 1.00 0.00 H new ATOM 0 HB2 ALA A 2 5.950 1.229 -6.014 1.00 0.00 H new ATOM 0 HB3 ALA A 2 5.830 -0.378 -5.258 1.00 0.00 H new ATOM 17 N MET A 3 7.451 -1.289 -3.464 1.00 0.00 N ATOM 18 CA MET A 3 7.770 -2.136 -2.318 1.00 0.00 C ATOM 19 C MET A 3 8.788 -3.193 -2.720 1.00 0.00 C ATOM 20 O MET A 3 9.602 -3.637 -1.910 1.00 0.00 O ATOM 21 CB MET A 3 6.513 -2.822 -1.759 1.00 0.00 C ATOM 22 CG MET A 3 5.481 -1.865 -1.176 1.00 0.00 C ATOM 23 SD MET A 3 4.570 -0.949 -2.437 1.00 0.00 S ATOM 24 CE MET A 3 3.766 -2.286 -3.318 1.00 0.00 C ATOM 0 H MET A 3 6.712 -1.653 -4.065 1.00 0.00 H new ATOM 0 HA MET A 3 8.187 -1.498 -1.539 1.00 0.00 H new ATOM 0 HB2 MET A 3 6.045 -3.401 -2.555 1.00 0.00 H new ATOM 0 HB3 MET A 3 6.813 -3.529 -0.985 1.00 0.00 H new ATOM 0 HG2 MET A 3 4.776 -2.429 -0.565 1.00 0.00 H new ATOM 0 HG3 MET A 3 5.983 -1.159 -0.514 1.00 0.00 H new ATOM 0 HE1 MET A 3 2.855 -1.916 -3.788 1.00 0.00 H new ATOM 0 HE2 MET A 3 4.438 -2.673 -4.084 1.00 0.00 H new ATOM 0 HE3 MET A 3 3.515 -3.083 -2.619 1.00 0.00 H new ATOM 34 N GLY A 4 8.739 -3.587 -3.982 1.00 0.00 N ATOM 35 CA GLY A 4 9.643 -4.595 -4.481 1.00 0.00 C ATOM 36 C GLY A 4 9.102 -5.266 -5.724 1.00 0.00 C ATOM 37 O GLY A 4 8.284 -4.678 -6.433 1.00 0.00 O ATOM 0 H GLY A 4 8.083 -3.222 -4.673 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.608 -4.140 -4.704 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.815 -5.344 -3.708 1.00 0.00 H new ATOM 41 N PRO A 5 9.529 -6.501 -6.003 1.00 0.00 N ATOM 42 CA PRO A 5 9.091 -7.247 -7.183 1.00 0.00 C ATOM 43 C PRO A 5 7.715 -7.876 -6.995 1.00 0.00 C ATOM 44 O PRO A 5 6.931 -7.453 -6.140 1.00 0.00 O ATOM 45 CB PRO A 5 10.165 -8.326 -7.318 1.00 0.00 C ATOM 46 CG PRO A 5 10.621 -8.582 -5.923 1.00 0.00 C ATOM 47 CD PRO A 5 10.474 -7.279 -5.179 1.00 0.00 C ATOM 0 HA PRO A 5 8.987 -6.611 -8.062 1.00 0.00 H new ATOM 0 HB2 PRO A 5 9.763 -9.230 -7.775 1.00 0.00 H new ATOM 0 HB3 PRO A 5 10.988 -7.989 -7.948 1.00 0.00 H new ATOM 0 HG2 PRO A 5 10.023 -9.365 -5.457 1.00 0.00 H new ATOM 0 HG3 PRO A 5 11.657 -8.922 -5.910 1.00 0.00 H new ATOM 0 HD2 PRO A 5 10.089 -7.436 -4.171 1.00 0.00 H new ATOM 0 HD3 PRO A 5 11.431 -6.767 -5.078 1.00 0.00 H new ATOM 55 N LYS A 6 7.427 -8.869 -7.822 1.00 0.00 N ATOM 56 CA LYS A 6 6.194 -9.635 -7.728 1.00 0.00 C ATOM 57 C LYS A 6 6.039 -10.257 -6.344 1.00 0.00 C ATOM 58 O LYS A 6 7.011 -10.732 -5.749 1.00 0.00 O ATOM 59 CB LYS A 6 6.174 -10.718 -8.800 1.00 0.00 C ATOM 60 CG LYS A 6 7.402 -11.605 -8.787 1.00 0.00 C ATOM 61 CD LYS A 6 7.278 -12.725 -9.794 1.00 0.00 C ATOM 62 CE LYS A 6 8.530 -13.582 -9.815 1.00 0.00 C ATOM 63 NZ LYS A 6 8.366 -14.801 -10.654 1.00 0.00 N ATOM 0 H LYS A 6 8.043 -9.167 -8.579 1.00 0.00 H new ATOM 0 HA LYS A 6 5.355 -8.958 -7.887 1.00 0.00 H new ATOM 0 HB2 LYS A 6 5.287 -11.337 -8.663 1.00 0.00 H new ATOM 0 HB3 LYS A 6 6.086 -10.247 -9.779 1.00 0.00 H new ATOM 0 HG2 LYS A 6 8.287 -11.009 -9.010 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.542 -12.023 -7.790 1.00 0.00 H new ATOM 0 HD2 LYS A 6 6.414 -13.344 -9.550 1.00 0.00 H new ATOM 0 HD3 LYS A 6 7.102 -12.309 -10.786 1.00 0.00 H new ATOM 0 HE2 LYS A 6 9.365 -12.992 -10.194 1.00 0.00 H new ATOM 0 HE3 LYS A 6 8.784 -13.876 -8.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 9.131 -15.473 -10.443 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 7.448 -15.244 -10.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 8.404 -14.538 -11.659 1.00 0.00 H new ATOM 77 N SER A 7 4.819 -10.247 -5.836 1.00 0.00 N ATOM 78 CA SER A 7 4.535 -10.789 -4.526 1.00 0.00 C ATOM 79 C SER A 7 4.115 -12.250 -4.646 1.00 0.00 C ATOM 80 O SER A 7 4.023 -12.790 -5.752 1.00 0.00 O ATOM 81 CB SER A 7 3.441 -9.961 -3.838 1.00 0.00 C ATOM 82 OG SER A 7 3.213 -10.399 -2.506 1.00 0.00 O ATOM 0 H SER A 7 4.005 -9.865 -6.318 1.00 0.00 H new ATOM 0 HA SER A 7 5.436 -10.739 -3.915 1.00 0.00 H new ATOM 0 HB2 SER A 7 3.729 -8.910 -3.832 1.00 0.00 H new ATOM 0 HB3 SER A 7 2.515 -10.034 -4.409 1.00 0.00 H new ATOM 0 HG SER A 7 2.512 -9.850 -2.096 1.00 0.00 H new ATOM 88 N LYS A 8 3.858 -12.885 -3.511 1.00 0.00 N ATOM 89 CA LYS A 8 3.424 -14.273 -3.496 1.00 0.00 C ATOM 90 C LYS A 8 2.086 -14.414 -4.204 1.00 0.00 C ATOM 91 O LYS A 8 1.787 -15.457 -4.787 1.00 0.00 O ATOM 92 CB LYS A 8 3.313 -14.789 -2.063 1.00 0.00 C ATOM 93 CG LYS A 8 4.647 -14.903 -1.345 1.00 0.00 C ATOM 94 CD LYS A 8 4.454 -15.305 0.105 1.00 0.00 C ATOM 95 CE LYS A 8 5.780 -15.473 0.826 1.00 0.00 C ATOM 96 NZ LYS A 8 5.586 -15.632 2.291 1.00 0.00 N ATOM 0 H LYS A 8 3.943 -12.459 -2.588 1.00 0.00 H new ATOM 0 HA LYS A 8 4.169 -14.869 -4.023 1.00 0.00 H new ATOM 0 HB2 LYS A 8 2.662 -14.123 -1.497 1.00 0.00 H new ATOM 0 HB3 LYS A 8 2.833 -15.768 -2.076 1.00 0.00 H new ATOM 0 HG2 LYS A 8 5.273 -15.639 -1.849 1.00 0.00 H new ATOM 0 HG3 LYS A 8 5.173 -13.949 -1.394 1.00 0.00 H new ATOM 0 HD2 LYS A 8 3.856 -14.549 0.615 1.00 0.00 H new ATOM 0 HD3 LYS A 8 3.894 -16.239 0.152 1.00 0.00 H new ATOM 0 HE2 LYS A 8 6.303 -16.344 0.430 1.00 0.00 H new ATOM 0 HE3 LYS A 8 6.413 -14.607 0.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 6.444 -16.041 2.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 5.399 -14.703 2.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 4.779 -16.263 2.468 1.00 0.00 H new ATOM 110 N GLU A 9 1.285 -13.350 -4.166 1.00 0.00 N ATOM 111 CA GLU A 9 0.002 -13.358 -4.842 1.00 0.00 C ATOM 112 C GLU A 9 0.210 -13.460 -6.347 1.00 0.00 C ATOM 113 O GLU A 9 -0.496 -14.203 -7.014 1.00 0.00 O ATOM 114 CB GLU A 9 -0.835 -12.117 -4.502 1.00 0.00 C ATOM 115 CG GLU A 9 -0.282 -10.814 -5.054 1.00 0.00 C ATOM 116 CD GLU A 9 -1.314 -9.705 -5.073 1.00 0.00 C ATOM 117 OE1 GLU A 9 -2.318 -9.827 -5.806 1.00 0.00 O ATOM 118 OE2 GLU A 9 -1.122 -8.694 -4.367 1.00 0.00 O ATOM 0 H GLU A 9 1.505 -12.482 -3.677 1.00 0.00 H new ATOM 0 HA GLU A 9 -0.553 -14.228 -4.492 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -1.845 -12.260 -4.885 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.914 -12.033 -3.418 1.00 0.00 H new ATOM 0 HG2 GLU A 9 0.571 -10.501 -4.452 1.00 0.00 H new ATOM 0 HG3 GLU A 9 0.086 -10.980 -6.066 1.00 0.00 H new ATOM 125 N GLU A 10 1.217 -12.754 -6.865 1.00 0.00 N ATOM 126 CA GLU A 10 1.508 -12.760 -8.286 1.00 0.00 C ATOM 127 C GLU A 10 1.768 -14.177 -8.774 1.00 0.00 C ATOM 128 O GLU A 10 1.389 -14.544 -9.882 1.00 0.00 O ATOM 129 CB GLU A 10 2.728 -11.885 -8.572 1.00 0.00 C ATOM 130 CG GLU A 10 2.396 -10.464 -9.002 1.00 0.00 C ATOM 131 CD GLU A 10 1.842 -9.620 -7.877 1.00 0.00 C ATOM 132 OE1 GLU A 10 2.618 -9.257 -6.970 1.00 0.00 O ATOM 133 OE2 GLU A 10 0.639 -9.304 -7.903 1.00 0.00 O ATOM 0 H GLU A 10 1.844 -12.170 -6.311 1.00 0.00 H new ATOM 0 HA GLU A 10 0.644 -12.361 -8.817 1.00 0.00 H new ATOM 0 HB2 GLU A 10 3.349 -11.845 -7.677 1.00 0.00 H new ATOM 0 HB3 GLU A 10 3.324 -12.358 -9.353 1.00 0.00 H new ATOM 0 HG2 GLU A 10 3.295 -9.990 -9.395 1.00 0.00 H new ATOM 0 HG3 GLU A 10 1.671 -10.497 -9.815 1.00 0.00 H new ATOM 140 N LEU A 11 2.395 -14.970 -7.918 1.00 0.00 N ATOM 141 CA LEU A 11 2.733 -16.346 -8.247 1.00 0.00 C ATOM 142 C LEU A 11 1.511 -17.242 -8.094 1.00 0.00 C ATOM 143 O LEU A 11 1.252 -18.108 -8.928 1.00 0.00 O ATOM 144 CB LEU A 11 3.854 -16.841 -7.328 1.00 0.00 C ATOM 145 CG LEU A 11 5.011 -15.862 -7.124 1.00 0.00 C ATOM 146 CD1 LEU A 11 6.050 -16.451 -6.184 1.00 0.00 C ATOM 147 CD2 LEU A 11 5.644 -15.497 -8.457 1.00 0.00 C ATOM 0 H LEU A 11 2.682 -14.681 -6.983 1.00 0.00 H new ATOM 0 HA LEU A 11 3.071 -16.385 -9.282 1.00 0.00 H new ATOM 0 HB2 LEU A 11 3.425 -17.079 -6.355 1.00 0.00 H new ATOM 0 HB3 LEU A 11 4.253 -17.770 -7.736 1.00 0.00 H new ATOM 0 HG LEU A 11 4.615 -14.953 -6.672 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.865 -15.740 -6.051 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.590 -16.660 -5.218 1.00 0.00 H new ATOM 0 HD13 LEU A 11 6.441 -17.376 -6.607 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.465 -14.800 -8.291 1.00 0.00 H new ATOM 0 HD22 LEU A 11 6.025 -16.398 -8.938 1.00 0.00 H new ATOM 0 HD23 LEU A 11 4.897 -15.031 -9.099 1.00 0.00 H new ATOM 159 N LEU A 12 0.759 -17.024 -7.023 1.00 0.00 N ATOM 160 CA LEU A 12 -0.419 -17.826 -6.732 1.00 0.00 C ATOM 161 C LEU A 12 -1.511 -17.597 -7.776 1.00 0.00 C ATOM 162 O LEU A 12 -2.171 -18.541 -8.210 1.00 0.00 O ATOM 163 CB LEU A 12 -0.944 -17.490 -5.334 1.00 0.00 C ATOM 164 CG LEU A 12 -2.172 -18.283 -4.888 1.00 0.00 C ATOM 165 CD1 LEU A 12 -1.854 -19.768 -4.797 1.00 0.00 C ATOM 166 CD2 LEU A 12 -2.682 -17.757 -3.556 1.00 0.00 C ATOM 0 H LEU A 12 0.947 -16.292 -6.338 1.00 0.00 H new ATOM 0 HA LEU A 12 -0.136 -18.878 -6.766 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -0.143 -17.657 -4.614 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.186 -16.428 -5.301 1.00 0.00 H new ATOM 0 HG LEU A 12 -2.956 -18.154 -5.634 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.743 -20.312 -4.478 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -1.537 -20.133 -5.774 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -1.054 -19.925 -4.074 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -3.557 -18.330 -3.249 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.901 -17.856 -2.802 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -2.955 -16.707 -3.660 1.00 0.00 H new ATOM 178 N ARG A 13 -1.682 -16.343 -8.188 1.00 0.00 N ATOM 179 CA ARG A 13 -2.714 -15.977 -9.156 1.00 0.00 C ATOM 180 C ARG A 13 -2.492 -16.686 -10.486 1.00 0.00 C ATOM 181 O ARG A 13 -3.439 -16.939 -11.224 1.00 0.00 O ATOM 182 CB ARG A 13 -2.743 -14.460 -9.362 1.00 0.00 C ATOM 183 CG ARG A 13 -3.103 -13.697 -8.101 1.00 0.00 C ATOM 184 CD ARG A 13 -2.891 -12.201 -8.250 1.00 0.00 C ATOM 185 NE ARG A 13 -3.948 -11.574 -9.039 1.00 0.00 N ATOM 186 CZ ARG A 13 -4.685 -10.542 -8.623 1.00 0.00 C ATOM 187 NH1 ARG A 13 -4.434 -9.957 -7.457 1.00 0.00 N ATOM 188 NH2 ARG A 13 -5.664 -10.079 -9.386 1.00 0.00 N ATOM 0 H ARG A 13 -1.116 -15.559 -7.864 1.00 0.00 H new ATOM 0 HA ARG A 13 -3.677 -16.295 -8.757 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -1.766 -14.128 -9.714 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -3.463 -14.219 -10.144 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -4.145 -13.890 -7.848 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -2.500 -14.066 -7.271 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -2.854 -11.740 -7.263 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -1.927 -12.017 -8.724 1.00 0.00 H new ATOM 0 HE ARG A 13 -4.135 -11.949 -9.969 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -3.672 -10.296 -6.870 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -5.004 -9.169 -7.149 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -5.854 -10.511 -10.290 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -6.228 -9.290 -9.069 1.00 0.00 H new ATOM 202 N GLU A 14 -1.238 -17.016 -10.778 1.00 0.00 N ATOM 203 CA GLU A 14 -0.905 -17.763 -11.986 1.00 0.00 C ATOM 204 C GLU A 14 -1.606 -19.122 -11.999 1.00 0.00 C ATOM 205 O GLU A 14 -1.962 -19.639 -13.059 1.00 0.00 O ATOM 206 CB GLU A 14 0.605 -17.977 -12.089 1.00 0.00 C ATOM 207 CG GLU A 14 1.419 -16.692 -12.113 1.00 0.00 C ATOM 208 CD GLU A 14 2.894 -16.946 -12.348 1.00 0.00 C ATOM 209 OE1 GLU A 14 3.703 -16.705 -11.429 1.00 0.00 O ATOM 210 OE2 GLU A 14 3.251 -17.406 -13.456 1.00 0.00 O ATOM 0 H GLU A 14 -0.436 -16.778 -10.195 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.247 -17.177 -12.839 1.00 0.00 H new ATOM 0 HB2 GLU A 14 0.932 -18.585 -11.246 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.819 -18.546 -12.994 1.00 0.00 H new ATOM 0 HG2 GLU A 14 1.037 -16.038 -12.896 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.290 -16.166 -11.167 1.00 0.00 H new ATOM 217 N LYS A 15 -1.804 -19.688 -10.813 1.00 0.00 N ATOM 218 CA LYS A 15 -2.377 -21.018 -10.677 1.00 0.00 C ATOM 219 C LYS A 15 -3.873 -20.963 -10.363 1.00 0.00 C ATOM 220 O LYS A 15 -4.538 -21.997 -10.302 1.00 0.00 O ATOM 221 CB LYS A 15 -1.651 -21.766 -9.570 1.00 0.00 C ATOM 222 CG LYS A 15 -0.150 -21.791 -9.760 1.00 0.00 C ATOM 223 CD LYS A 15 0.540 -22.515 -8.626 1.00 0.00 C ATOM 224 CE LYS A 15 0.713 -24.002 -8.910 1.00 0.00 C ATOM 225 NZ LYS A 15 -0.585 -24.722 -9.017 1.00 0.00 N ATOM 0 H LYS A 15 -1.573 -19.240 -9.926 1.00 0.00 H new ATOM 0 HA LYS A 15 -2.256 -21.537 -11.628 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -1.883 -21.301 -8.612 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -2.023 -22.789 -9.526 1.00 0.00 H new ATOM 0 HG2 LYS A 15 0.090 -22.279 -10.704 1.00 0.00 H new ATOM 0 HG3 LYS A 15 0.227 -20.770 -9.824 1.00 0.00 H new ATOM 0 HD2 LYS A 15 1.517 -22.065 -8.451 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -0.038 -22.387 -7.711 1.00 0.00 H new ATOM 0 HE2 LYS A 15 1.271 -24.128 -9.838 1.00 0.00 H new ATOM 0 HE3 LYS A 15 1.309 -24.452 -8.116 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -0.466 -25.702 -8.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -1.297 -24.244 -8.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -0.901 -24.723 -10.008 1.00 0.00 H new ATOM 239 N LEU A 16 -4.393 -19.759 -10.160 1.00 0.00 N ATOM 240 CA LEU A 16 -5.795 -19.579 -9.801 1.00 0.00 C ATOM 241 C LEU A 16 -6.657 -19.375 -11.042 1.00 0.00 C ATOM 242 O LEU A 16 -6.147 -19.091 -12.127 1.00 0.00 O ATOM 243 CB LEU A 16 -5.964 -18.380 -8.864 1.00 0.00 C ATOM 244 CG LEU A 16 -5.249 -18.490 -7.517 1.00 0.00 C ATOM 245 CD1 LEU A 16 -5.454 -17.221 -6.709 1.00 0.00 C ATOM 246 CD2 LEU A 16 -5.743 -19.700 -6.740 1.00 0.00 C ATOM 0 H LEU A 16 -3.864 -18.890 -10.238 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.121 -20.485 -9.290 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.603 -17.488 -9.375 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.028 -18.233 -8.680 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.183 -18.619 -7.703 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -4.940 -17.312 -5.752 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -5.050 -16.371 -7.258 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -6.519 -17.068 -6.536 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.220 -19.758 -5.785 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -6.814 -19.606 -6.562 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.549 -20.606 -7.315 1.00 0.00 H new ATOM 258 N SER A 17 -7.963 -19.518 -10.874 1.00 0.00 N ATOM 259 CA SER A 17 -8.904 -19.302 -11.964 1.00 0.00 C ATOM 260 C SER A 17 -9.268 -17.823 -12.055 1.00 0.00 C ATOM 261 O SER A 17 -8.811 -17.019 -11.240 1.00 0.00 O ATOM 262 CB SER A 17 -10.159 -20.157 -11.763 1.00 0.00 C ATOM 263 OG SER A 17 -10.751 -19.912 -10.498 1.00 0.00 O ATOM 0 H SER A 17 -8.397 -19.784 -9.990 1.00 0.00 H new ATOM 0 HA SER A 17 -8.434 -19.602 -12.901 1.00 0.00 H new ATOM 0 HB2 SER A 17 -10.879 -19.941 -12.552 1.00 0.00 H new ATOM 0 HB3 SER A 17 -9.900 -21.212 -11.848 1.00 0.00 H new ATOM 0 HG SER A 17 -11.550 -20.470 -10.397 1.00 0.00 H new ATOM 269 N GLU A 18 -10.104 -17.474 -13.029 1.00 0.00 N ATOM 270 CA GLU A 18 -10.460 -16.078 -13.281 1.00 0.00 C ATOM 271 C GLU A 18 -11.091 -15.451 -12.046 1.00 0.00 C ATOM 272 O GLU A 18 -10.706 -14.362 -11.615 1.00 0.00 O ATOM 273 CB GLU A 18 -11.437 -15.983 -14.456 1.00 0.00 C ATOM 274 CG GLU A 18 -10.842 -16.389 -15.791 1.00 0.00 C ATOM 275 CD GLU A 18 -9.741 -15.452 -16.243 1.00 0.00 C ATOM 276 OE1 GLU A 18 -8.609 -15.923 -16.470 1.00 0.00 O ATOM 277 OE2 GLU A 18 -10.004 -14.236 -16.371 1.00 0.00 O ATOM 0 H GLU A 18 -10.550 -18.140 -13.660 1.00 0.00 H new ATOM 0 HA GLU A 18 -9.547 -15.536 -13.525 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -12.301 -16.615 -14.248 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -11.802 -14.958 -14.529 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -10.445 -17.401 -15.716 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -11.629 -16.410 -16.545 1.00 0.00 H new ATOM 284 N ASP A 19 -12.051 -16.165 -11.483 1.00 0.00 N ATOM 285 CA ASP A 19 -12.771 -15.721 -10.295 1.00 0.00 C ATOM 286 C ASP A 19 -11.814 -15.477 -9.137 1.00 0.00 C ATOM 287 O ASP A 19 -11.785 -14.398 -8.547 1.00 0.00 O ATOM 288 CB ASP A 19 -13.784 -16.789 -9.881 1.00 0.00 C ATOM 289 CG ASP A 19 -14.826 -17.059 -10.941 1.00 0.00 C ATOM 290 OD1 ASP A 19 -14.700 -18.079 -11.650 1.00 0.00 O ATOM 291 OD2 ASP A 19 -15.773 -16.258 -11.074 1.00 0.00 O ATOM 0 H ASP A 19 -12.356 -17.072 -11.836 1.00 0.00 H new ATOM 0 HA ASP A 19 -13.280 -14.788 -10.535 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -13.255 -17.715 -9.655 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -14.281 -16.474 -8.963 1.00 0.00 H new ATOM 296 N GLN A 20 -11.004 -16.489 -8.854 1.00 0.00 N ATOM 297 CA GLN A 20 -10.151 -16.503 -7.675 1.00 0.00 C ATOM 298 C GLN A 20 -9.099 -15.398 -7.711 1.00 0.00 C ATOM 299 O GLN A 20 -8.635 -14.954 -6.667 1.00 0.00 O ATOM 300 CB GLN A 20 -9.494 -17.875 -7.548 1.00 0.00 C ATOM 301 CG GLN A 20 -10.499 -18.988 -7.303 1.00 0.00 C ATOM 302 CD GLN A 20 -9.927 -20.369 -7.552 1.00 0.00 C ATOM 303 OE1 GLN A 20 -9.029 -20.543 -8.377 1.00 0.00 O ATOM 304 NE2 GLN A 20 -10.457 -21.360 -6.858 1.00 0.00 N ATOM 0 H GLN A 20 -10.921 -17.323 -9.436 1.00 0.00 H new ATOM 0 HA GLN A 20 -10.773 -16.311 -6.801 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -8.934 -18.091 -8.458 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -8.775 -17.854 -6.729 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -10.855 -18.928 -6.274 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -11.364 -18.837 -7.949 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -11.199 -21.171 -6.184 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -10.124 -22.314 -6.996 1.00 0.00 H new ATOM 313 N LYS A 21 -8.731 -14.947 -8.906 1.00 0.00 N ATOM 314 CA LYS A 21 -7.755 -13.870 -9.039 1.00 0.00 C ATOM 315 C LYS A 21 -8.315 -12.558 -8.497 1.00 0.00 C ATOM 316 O LYS A 21 -7.651 -11.853 -7.739 1.00 0.00 O ATOM 317 CB LYS A 21 -7.340 -13.697 -10.501 1.00 0.00 C ATOM 318 CG LYS A 21 -6.642 -14.916 -11.075 1.00 0.00 C ATOM 319 CD LYS A 21 -6.217 -14.696 -12.515 1.00 0.00 C ATOM 320 CE LYS A 21 -5.618 -15.958 -13.105 1.00 0.00 C ATOM 321 NZ LYS A 21 -5.016 -15.726 -14.442 1.00 0.00 N ATOM 0 H LYS A 21 -9.090 -15.307 -9.790 1.00 0.00 H new ATOM 0 HA LYS A 21 -6.876 -14.140 -8.453 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -8.225 -13.478 -11.099 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -6.678 -12.835 -10.584 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -5.767 -15.152 -10.470 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -7.309 -15.776 -11.020 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -7.077 -14.386 -13.108 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -5.488 -13.887 -12.563 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -4.856 -16.346 -12.429 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -6.392 -16.721 -13.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -4.620 -16.617 -14.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -5.747 -15.381 -15.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -4.259 -15.017 -14.364 1.00 0.00 H new ATOM 335 N THR A 22 -9.547 -12.246 -8.871 1.00 0.00 N ATOM 336 CA THR A 22 -10.171 -10.999 -8.458 1.00 0.00 C ATOM 337 C THR A 22 -10.650 -11.072 -7.006 1.00 0.00 C ATOM 338 O THR A 22 -10.559 -10.091 -6.264 1.00 0.00 O ATOM 339 CB THR A 22 -11.335 -10.633 -9.397 1.00 0.00 C ATOM 340 OG1 THR A 22 -10.839 -10.539 -10.740 1.00 0.00 O ATOM 341 CG2 THR A 22 -11.970 -9.309 -9.002 1.00 0.00 C ATOM 0 H THR A 22 -10.133 -12.839 -9.459 1.00 0.00 H new ATOM 0 HA THR A 22 -9.418 -10.214 -8.522 1.00 0.00 H new ATOM 0 HB THR A 22 -12.096 -11.410 -9.323 1.00 0.00 H new ATOM 0 HG1 THR A 22 -11.575 -10.308 -11.345 1.00 0.00 H new ATOM 0 HG21 THR A 22 -12.788 -9.080 -9.685 1.00 0.00 H new ATOM 0 HG22 THR A 22 -12.355 -9.379 -7.985 1.00 0.00 H new ATOM 0 HG23 THR A 22 -11.222 -8.517 -9.053 1.00 0.00 H new ATOM 349 N HIS A 23 -11.131 -12.240 -6.590 1.00 0.00 N ATOM 350 CA HIS A 23 -11.518 -12.441 -5.195 1.00 0.00 C ATOM 351 C HIS A 23 -10.299 -12.385 -4.283 1.00 0.00 C ATOM 352 O HIS A 23 -10.412 -12.085 -3.093 1.00 0.00 O ATOM 353 CB HIS A 23 -12.257 -13.766 -5.007 1.00 0.00 C ATOM 354 CG HIS A 23 -13.706 -13.687 -5.366 1.00 0.00 C ATOM 355 ND1 HIS A 23 -14.712 -13.038 -4.730 1.00 0.00 N flip ATOM 356 CD2 HIS A 23 -14.210 -14.324 -6.471 1.00 0.00 C flip ATOM 357 CE1 HIS A 23 -15.851 -13.272 -5.455 1.00 0.00 C flip ATOM 358 NE2 HIS A 23 -15.500 -14.048 -6.489 1.00 0.00 N flip ATOM 0 H HIS A 23 -11.262 -13.054 -7.190 1.00 0.00 H new ATOM 0 HA HIS A 23 -12.197 -11.633 -4.923 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -11.779 -14.531 -5.618 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -12.163 -14.083 -3.968 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -13.663 -14.927 -7.181 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -16.841 -12.902 -5.235 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -16.149 -14.383 -7.201 1.00 0.00 H new ATOM 366 N LEU A 24 -9.135 -12.664 -4.850 1.00 0.00 N ATOM 367 CA LEU A 24 -7.889 -12.585 -4.109 1.00 0.00 C ATOM 368 C LEU A 24 -7.561 -11.121 -3.806 1.00 0.00 C ATOM 369 O LEU A 24 -7.083 -10.789 -2.721 1.00 0.00 O ATOM 370 CB LEU A 24 -6.757 -13.250 -4.898 1.00 0.00 C ATOM 371 CG LEU A 24 -5.457 -13.452 -4.125 1.00 0.00 C ATOM 372 CD1 LEU A 24 -5.709 -14.266 -2.864 1.00 0.00 C ATOM 373 CD2 LEU A 24 -4.416 -14.134 -4.994 1.00 0.00 C ATOM 0 H LEU A 24 -9.029 -12.948 -5.824 1.00 0.00 H new ATOM 0 HA LEU A 24 -7.998 -13.119 -3.165 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -7.104 -14.220 -5.253 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.546 -12.645 -5.780 1.00 0.00 H new ATOM 0 HG LEU A 24 -5.076 -12.472 -3.837 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -4.771 -14.401 -2.325 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -6.421 -13.740 -2.228 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.115 -15.241 -3.135 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -3.497 -14.268 -4.423 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -4.790 -15.107 -5.314 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -4.213 -13.518 -5.870 1.00 0.00 H new ATOM 385 N ASP A 25 -7.835 -10.250 -4.775 1.00 0.00 N ATOM 386 CA ASP A 25 -7.725 -8.807 -4.574 1.00 0.00 C ATOM 387 C ASP A 25 -8.654 -8.353 -3.461 1.00 0.00 C ATOM 388 O ASP A 25 -8.242 -7.619 -2.561 1.00 0.00 O ATOM 389 CB ASP A 25 -8.066 -8.042 -5.855 1.00 0.00 C ATOM 390 CG ASP A 25 -6.983 -8.137 -6.900 1.00 0.00 C ATOM 391 OD1 ASP A 25 -7.299 -8.464 -8.062 1.00 0.00 O ATOM 392 OD2 ASP A 25 -5.804 -7.893 -6.562 1.00 0.00 O ATOM 0 H ASP A 25 -8.136 -10.520 -5.711 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.692 -8.592 -4.299 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -8.997 -8.430 -6.267 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -8.238 -6.994 -5.611 1.00 0.00 H new ATOM 397 N TRP A 26 -9.906 -8.800 -3.533 1.00 0.00 N ATOM 398 CA TRP A 26 -10.904 -8.498 -2.511 1.00 0.00 C ATOM 399 C TRP A 26 -10.381 -8.887 -1.134 1.00 0.00 C ATOM 400 O TRP A 26 -10.458 -8.109 -0.182 1.00 0.00 O ATOM 401 CB TRP A 26 -12.209 -9.248 -2.813 1.00 0.00 C ATOM 402 CG TRP A 26 -13.305 -9.001 -1.817 1.00 0.00 C ATOM 403 CD1 TRP A 26 -14.291 -8.060 -1.901 1.00 0.00 C ATOM 404 CD2 TRP A 26 -13.532 -9.709 -0.590 1.00 0.00 C ATOM 405 NE1 TRP A 26 -15.113 -8.140 -0.802 1.00 0.00 N ATOM 406 CE2 TRP A 26 -14.665 -9.142 0.017 1.00 0.00 C ATOM 407 CE3 TRP A 26 -12.883 -10.767 0.054 1.00 0.00 C ATOM 408 CZ2 TRP A 26 -15.164 -9.598 1.232 1.00 0.00 C ATOM 409 CZ3 TRP A 26 -13.377 -11.215 1.262 1.00 0.00 C ATOM 410 CH2 TRP A 26 -14.508 -10.630 1.840 1.00 0.00 C ATOM 0 H TRP A 26 -10.255 -9.378 -4.297 1.00 0.00 H new ATOM 0 HA TRP A 26 -11.103 -7.426 -2.519 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -12.561 -8.958 -3.803 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -12.000 -10.317 -2.849 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -14.408 -7.356 -2.712 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -15.925 -7.549 -0.625 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -12.010 -11.226 -0.387 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -16.040 -9.152 1.679 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -12.882 -12.030 1.769 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -14.870 -11.002 2.787 1.00 0.00 H new ATOM 421 N LEU A 27 -9.837 -10.096 -1.047 1.00 0.00 N ATOM 422 CA LEU A 27 -9.267 -10.600 0.192 1.00 0.00 C ATOM 423 C LEU A 27 -8.160 -9.677 0.687 1.00 0.00 C ATOM 424 O LEU A 27 -8.145 -9.270 1.843 1.00 0.00 O ATOM 425 CB LEU A 27 -8.713 -12.008 -0.022 1.00 0.00 C ATOM 426 CG LEU A 27 -8.112 -12.664 1.217 1.00 0.00 C ATOM 427 CD1 LEU A 27 -9.187 -12.930 2.253 1.00 0.00 C ATOM 428 CD2 LEU A 27 -7.402 -13.949 0.847 1.00 0.00 C ATOM 0 H LEU A 27 -9.780 -10.748 -1.829 1.00 0.00 H new ATOM 0 HA LEU A 27 -10.054 -10.635 0.945 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -9.515 -12.644 -0.397 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -7.949 -11.967 -0.798 1.00 0.00 H new ATOM 0 HG LEU A 27 -7.381 -11.979 1.647 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -8.739 -13.398 3.130 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -9.654 -11.989 2.543 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.941 -13.595 1.832 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -6.980 -14.403 1.744 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -8.112 -14.639 0.391 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -6.602 -13.732 0.139 1.00 0.00 H new ATOM 440 N LYS A 28 -7.248 -9.339 -0.208 1.00 0.00 N ATOM 441 CA LYS A 28 -6.131 -8.459 0.111 1.00 0.00 C ATOM 442 C LYS A 28 -6.615 -7.127 0.658 1.00 0.00 C ATOM 443 O LYS A 28 -6.144 -6.666 1.696 1.00 0.00 O ATOM 444 CB LYS A 28 -5.297 -8.243 -1.146 1.00 0.00 C ATOM 445 CG LYS A 28 -4.243 -7.152 -1.036 1.00 0.00 C ATOM 446 CD LYS A 28 -3.357 -7.123 -2.274 1.00 0.00 C ATOM 447 CE LYS A 28 -4.162 -7.373 -3.541 1.00 0.00 C ATOM 448 NZ LYS A 28 -3.336 -7.255 -4.770 1.00 0.00 N ATOM 0 H LYS A 28 -7.258 -9.664 -1.175 1.00 0.00 H new ATOM 0 HA LYS A 28 -5.523 -8.928 0.884 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -4.803 -9.180 -1.402 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -5.966 -7.999 -1.971 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -4.728 -6.184 -0.909 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -3.631 -7.321 -0.150 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -2.858 -6.156 -2.343 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -2.577 -7.879 -2.182 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -4.603 -8.369 -3.497 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -4.986 -6.661 -3.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -3.696 -7.909 -5.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -3.385 -6.280 -5.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -2.348 -7.494 -4.549 1.00 0.00 H new ATOM 462 N GLU A 29 -7.550 -6.517 -0.053 1.00 0.00 N ATOM 463 CA GLU A 29 -8.129 -5.250 0.376 1.00 0.00 C ATOM 464 C GLU A 29 -8.822 -5.397 1.728 1.00 0.00 C ATOM 465 O GLU A 29 -8.808 -4.474 2.542 1.00 0.00 O ATOM 466 CB GLU A 29 -9.117 -4.716 -0.663 1.00 0.00 C ATOM 467 CG GLU A 29 -8.480 -4.402 -2.007 1.00 0.00 C ATOM 468 CD GLU A 29 -9.440 -3.720 -2.960 1.00 0.00 C ATOM 469 OE1 GLU A 29 -9.458 -2.472 -2.999 1.00 0.00 O ATOM 470 OE2 GLU A 29 -10.188 -4.426 -3.666 1.00 0.00 O ATOM 0 H GLU A 29 -7.925 -6.877 -0.930 1.00 0.00 H new ATOM 0 HA GLU A 29 -7.313 -4.534 0.478 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -9.909 -5.450 -0.809 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -9.587 -3.813 -0.274 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -7.611 -3.762 -1.853 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -8.120 -5.326 -2.459 1.00 0.00 H new ATOM 477 N ALA A 30 -9.422 -6.557 1.959 1.00 0.00 N ATOM 478 CA ALA A 30 -10.080 -6.847 3.226 1.00 0.00 C ATOM 479 C ALA A 30 -9.070 -6.874 4.371 1.00 0.00 C ATOM 480 O ALA A 30 -9.223 -6.162 5.364 1.00 0.00 O ATOM 481 CB ALA A 30 -10.815 -8.175 3.138 1.00 0.00 C ATOM 0 H ALA A 30 -9.467 -7.317 1.280 1.00 0.00 H new ATOM 0 HA ALA A 30 -10.801 -6.055 3.429 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -11.304 -8.384 4.089 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -11.565 -8.124 2.348 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.104 -8.970 2.913 1.00 0.00 H new ATOM 487 N LEU A 31 -8.048 -7.711 4.221 1.00 0.00 N ATOM 488 CA LEU A 31 -6.986 -7.841 5.209 1.00 0.00 C ATOM 489 C LEU A 31 -6.239 -6.526 5.411 1.00 0.00 C ATOM 490 O LEU A 31 -6.035 -6.086 6.541 1.00 0.00 O ATOM 491 CB LEU A 31 -6.017 -8.953 4.784 1.00 0.00 C ATOM 492 CG LEU A 31 -6.485 -10.378 5.102 1.00 0.00 C ATOM 493 CD1 LEU A 31 -7.751 -10.741 4.355 1.00 0.00 C ATOM 494 CD2 LEU A 31 -5.389 -11.386 4.805 1.00 0.00 C ATOM 0 H LEU A 31 -7.934 -8.318 3.409 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.441 -8.104 6.164 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -5.846 -8.874 3.710 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -5.058 -8.784 5.273 1.00 0.00 H new ATOM 0 HG LEU A 31 -6.712 -10.409 6.168 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -8.045 -11.759 4.611 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -8.548 -10.052 4.634 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -7.572 -10.674 3.282 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -5.745 -12.390 5.039 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.121 -11.332 3.750 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -4.513 -11.161 5.413 1.00 0.00 H new ATOM 506 N GLY A 32 -5.832 -5.901 4.320 1.00 0.00 N ATOM 507 CA GLY A 32 -5.143 -4.632 4.411 1.00 0.00 C ATOM 508 C GLY A 32 -3.636 -4.788 4.465 1.00 0.00 C ATOM 509 O GLY A 32 -2.928 -4.341 3.562 1.00 0.00 O ATOM 0 H GLY A 32 -5.966 -6.250 3.371 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -5.410 -4.016 3.553 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -5.482 -4.102 5.301 1.00 0.00 H new ATOM 513 N ASN A 33 -3.138 -5.433 5.514 1.00 0.00 N ATOM 514 CA ASN A 33 -1.700 -5.598 5.687 1.00 0.00 C ATOM 515 C ASN A 33 -1.171 -6.694 4.784 1.00 0.00 C ATOM 516 O ASN A 33 -1.732 -7.795 4.725 1.00 0.00 O ATOM 517 CB ASN A 33 -1.333 -5.936 7.136 1.00 0.00 C ATOM 518 CG ASN A 33 -1.762 -4.872 8.119 1.00 0.00 C ATOM 519 OD1 ASN A 33 -1.055 -3.887 8.346 1.00 0.00 O ATOM 520 ND2 ASN A 33 -2.899 -5.089 8.743 1.00 0.00 N ATOM 0 H ASN A 33 -3.705 -5.848 6.253 1.00 0.00 H new ATOM 0 HA ASN A 33 -1.243 -4.645 5.422 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -1.796 -6.884 7.410 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -0.254 -6.076 7.208 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -3.228 -4.429 9.447 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -3.451 -5.918 8.523 1.00 0.00 H new ATOM 527 N ASP A 34 -0.084 -6.389 4.090 1.00 0.00 N ATOM 528 CA ASP A 34 0.601 -7.366 3.254 1.00 0.00 C ATOM 529 C ASP A 34 1.051 -8.549 4.092 1.00 0.00 C ATOM 530 O ASP A 34 1.049 -9.683 3.628 1.00 0.00 O ATOM 531 CB ASP A 34 1.814 -6.736 2.558 1.00 0.00 C ATOM 532 CG ASP A 34 2.921 -6.325 3.513 1.00 0.00 C ATOM 533 OD1 ASP A 34 3.894 -7.086 3.671 1.00 0.00 O ATOM 534 OD2 ASP A 34 2.821 -5.232 4.109 1.00 0.00 O ATOM 0 H ASP A 34 0.346 -5.464 4.090 1.00 0.00 H new ATOM 0 HA ASP A 34 -0.099 -7.708 2.492 1.00 0.00 H new ATOM 0 HB2 ASP A 34 2.215 -7.445 1.834 1.00 0.00 H new ATOM 0 HB3 ASP A 34 1.486 -5.860 1.998 1.00 0.00 H new ATOM 539 N GLY A 35 1.409 -8.267 5.334 1.00 0.00 N ATOM 540 CA GLY A 35 1.879 -9.301 6.240 1.00 0.00 C ATOM 541 C GLY A 35 0.825 -10.353 6.524 1.00 0.00 C ATOM 542 O GLY A 35 1.136 -11.540 6.641 1.00 0.00 O ATOM 0 H GLY A 35 1.383 -7.331 5.737 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.759 -9.781 5.812 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.191 -8.842 7.178 1.00 0.00 H new ATOM 546 N GLU A 36 -0.426 -9.924 6.622 1.00 0.00 N ATOM 547 CA GLU A 36 -1.523 -10.839 6.900 1.00 0.00 C ATOM 548 C GLU A 36 -1.932 -11.566 5.629 1.00 0.00 C ATOM 549 O GLU A 36 -2.215 -12.764 5.647 1.00 0.00 O ATOM 550 CB GLU A 36 -2.717 -10.077 7.475 1.00 0.00 C ATOM 551 CG GLU A 36 -2.381 -9.260 8.711 1.00 0.00 C ATOM 552 CD GLU A 36 -3.576 -8.503 9.250 1.00 0.00 C ATOM 553 OE1 GLU A 36 -4.020 -7.537 8.591 1.00 0.00 O ATOM 554 OE2 GLU A 36 -4.068 -8.857 10.343 1.00 0.00 O ATOM 0 H GLU A 36 -0.706 -8.949 6.513 1.00 0.00 H new ATOM 0 HA GLU A 36 -1.189 -11.571 7.635 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -3.116 -9.413 6.709 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.505 -10.788 7.723 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -1.995 -9.922 9.486 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -1.586 -8.554 8.470 1.00 0.00 H new ATOM 561 N PHE A 37 -1.947 -10.830 4.522 1.00 0.00 N ATOM 562 CA PHE A 37 -2.281 -11.396 3.222 1.00 0.00 C ATOM 563 C PHE A 37 -1.229 -12.430 2.826 1.00 0.00 C ATOM 564 O PHE A 37 -1.536 -13.451 2.208 1.00 0.00 O ATOM 565 CB PHE A 37 -2.369 -10.271 2.185 1.00 0.00 C ATOM 566 CG PHE A 37 -2.938 -10.687 0.862 1.00 0.00 C ATOM 567 CD1 PHE A 37 -4.155 -11.344 0.795 1.00 0.00 C ATOM 568 CD2 PHE A 37 -2.272 -10.394 -0.318 1.00 0.00 C ATOM 569 CE1 PHE A 37 -4.697 -11.700 -0.421 1.00 0.00 C ATOM 570 CE2 PHE A 37 -2.808 -10.753 -1.537 1.00 0.00 C ATOM 571 CZ PHE A 37 -4.022 -11.406 -1.588 1.00 0.00 C ATOM 0 H PHE A 37 -1.730 -9.834 4.501 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.248 -11.897 3.271 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.981 -9.466 2.592 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.371 -9.863 2.025 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -4.685 -11.580 1.706 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -1.323 -9.879 -0.282 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -5.649 -12.209 -0.461 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -2.278 -10.523 -2.450 1.00 0.00 H new ATOM 0 HZ PHE A 37 -4.444 -11.687 -2.541 1.00 0.00 H new ATOM 581 N ASP A 38 0.009 -12.149 3.219 1.00 0.00 N ATOM 582 CA ASP A 38 1.140 -13.054 3.025 1.00 0.00 C ATOM 583 C ASP A 38 0.843 -14.441 3.564 1.00 0.00 C ATOM 584 O ASP A 38 1.040 -15.446 2.879 1.00 0.00 O ATOM 585 CB ASP A 38 2.357 -12.501 3.760 1.00 0.00 C ATOM 586 CG ASP A 38 3.561 -13.416 3.687 1.00 0.00 C ATOM 587 OD1 ASP A 38 3.795 -14.179 4.654 1.00 0.00 O ATOM 588 OD2 ASP A 38 4.285 -13.377 2.678 1.00 0.00 O ATOM 0 H ASP A 38 0.260 -11.278 3.686 1.00 0.00 H new ATOM 0 HA ASP A 38 1.330 -13.129 1.954 1.00 0.00 H new ATOM 0 HB2 ASP A 38 2.619 -11.531 3.338 1.00 0.00 H new ATOM 0 HB3 ASP A 38 2.098 -12.334 4.805 1.00 0.00 H new ATOM 593 N LYS A 39 0.380 -14.472 4.803 1.00 0.00 N ATOM 594 CA LYS A 39 0.106 -15.726 5.497 1.00 0.00 C ATOM 595 C LYS A 39 -0.833 -16.618 4.686 1.00 0.00 C ATOM 596 O LYS A 39 -0.634 -17.833 4.613 1.00 0.00 O ATOM 597 CB LYS A 39 -0.478 -15.448 6.886 1.00 0.00 C ATOM 598 CG LYS A 39 -0.635 -16.695 7.742 1.00 0.00 C ATOM 599 CD LYS A 39 -0.960 -16.349 9.188 1.00 0.00 C ATOM 600 CE LYS A 39 -1.089 -17.603 10.040 1.00 0.00 C ATOM 601 NZ LYS A 39 -1.222 -17.292 11.488 1.00 0.00 N ATOM 0 H LYS A 39 0.184 -13.637 5.355 1.00 0.00 H new ATOM 0 HA LYS A 39 1.049 -16.260 5.614 1.00 0.00 H new ATOM 0 HB2 LYS A 39 0.166 -14.739 7.406 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -1.451 -14.971 6.773 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -1.427 -17.321 7.331 1.00 0.00 H new ATOM 0 HG3 LYS A 39 0.284 -17.279 7.706 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -0.178 -15.708 9.596 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -1.890 -15.782 9.228 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -1.958 -18.174 9.712 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -0.215 -18.236 9.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -1.154 -18.171 12.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -0.462 -16.643 11.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -2.144 -16.844 11.664 1.00 0.00 H new ATOM 615 N PHE A 40 -1.832 -16.008 4.056 1.00 0.00 N ATOM 616 CA PHE A 40 -2.798 -16.741 3.247 1.00 0.00 C ATOM 617 C PHE A 40 -2.149 -17.304 1.983 1.00 0.00 C ATOM 618 O PHE A 40 -2.411 -18.439 1.584 1.00 0.00 O ATOM 619 CB PHE A 40 -3.957 -15.820 2.862 1.00 0.00 C ATOM 620 CG PHE A 40 -4.965 -16.454 1.941 1.00 0.00 C ATOM 621 CD1 PHE A 40 -5.996 -17.230 2.444 1.00 0.00 C ATOM 622 CD2 PHE A 40 -4.879 -16.271 0.570 1.00 0.00 C ATOM 623 CE1 PHE A 40 -6.924 -17.810 1.599 1.00 0.00 C ATOM 624 CE2 PHE A 40 -5.803 -16.848 -0.280 1.00 0.00 C ATOM 625 CZ PHE A 40 -6.825 -17.618 0.236 1.00 0.00 C ATOM 0 H PHE A 40 -1.994 -15.002 4.091 1.00 0.00 H new ATOM 0 HA PHE A 40 -3.171 -17.576 3.840 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -4.465 -15.494 3.770 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -3.554 -14.927 2.383 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -6.076 -17.384 3.510 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -4.080 -15.670 0.161 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -7.724 -18.412 2.004 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -5.725 -16.697 -1.347 1.00 0.00 H new ATOM 0 HZ PHE A 40 -7.548 -18.071 -0.427 1.00 0.00 H new ATOM 635 N LEU A 41 -1.291 -16.501 1.371 1.00 0.00 N ATOM 636 CA LEU A 41 -0.673 -16.846 0.092 1.00 0.00 C ATOM 637 C LEU A 41 0.256 -18.055 0.218 1.00 0.00 C ATOM 638 O LEU A 41 0.576 -18.708 -0.776 1.00 0.00 O ATOM 639 CB LEU A 41 0.106 -15.642 -0.442 1.00 0.00 C ATOM 640 CG LEU A 41 -0.724 -14.371 -0.621 1.00 0.00 C ATOM 641 CD1 LEU A 41 0.170 -13.196 -0.974 1.00 0.00 C ATOM 642 CD2 LEU A 41 -1.788 -14.575 -1.689 1.00 0.00 C ATOM 0 H LEU A 41 -1.002 -15.596 1.742 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.468 -17.112 -0.605 1.00 0.00 H new ATOM 0 HB2 LEU A 41 0.930 -15.429 0.239 1.00 0.00 H new ATOM 0 HB3 LEU A 41 0.548 -15.909 -1.402 1.00 0.00 H new ATOM 0 HG LEU A 41 -1.223 -14.150 0.322 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -0.438 -12.300 -1.098 1.00 0.00 H new ATOM 0 HD12 LEU A 41 0.893 -13.036 -0.174 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.698 -13.407 -1.904 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -2.369 -13.660 -1.803 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -1.310 -14.821 -2.637 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -2.449 -15.390 -1.393 1.00 0.00 H new ATOM 654 N GLY A 42 0.674 -18.355 1.441 1.00 0.00 N ATOM 655 CA GLY A 42 1.591 -19.457 1.661 1.00 0.00 C ATOM 656 C GLY A 42 0.912 -20.690 2.224 1.00 0.00 C ATOM 657 O GLY A 42 1.523 -21.452 2.975 1.00 0.00 O ATOM 0 H GLY A 42 0.394 -17.855 2.285 1.00 0.00 H new ATOM 0 HA2 GLY A 42 2.074 -19.714 0.718 1.00 0.00 H new ATOM 0 HA3 GLY A 42 2.377 -19.137 2.345 1.00 0.00 H new ATOM 661 N TYR A 43 -0.348 -20.889 1.867 1.00 0.00 N ATOM 662 CA TYR A 43 -1.093 -22.049 2.334 1.00 0.00 C ATOM 663 C TYR A 43 -1.212 -23.112 1.256 1.00 0.00 C ATOM 664 O TYR A 43 -0.659 -22.977 0.161 1.00 0.00 O ATOM 665 CB TYR A 43 -2.492 -21.648 2.801 1.00 0.00 C ATOM 666 CG TYR A 43 -2.524 -21.093 4.200 1.00 0.00 C ATOM 667 CD1 TYR A 43 -3.117 -19.869 4.476 1.00 0.00 C ATOM 668 CD2 TYR A 43 -1.972 -21.808 5.251 1.00 0.00 C ATOM 669 CE1 TYR A 43 -3.157 -19.372 5.762 1.00 0.00 C ATOM 670 CE2 TYR A 43 -2.005 -21.318 6.537 1.00 0.00 C ATOM 671 CZ TYR A 43 -2.601 -20.100 6.789 1.00 0.00 C ATOM 672 OH TYR A 43 -2.645 -19.611 8.073 1.00 0.00 O ATOM 0 H TYR A 43 -0.875 -20.264 1.257 1.00 0.00 H new ATOM 0 HA TYR A 43 -0.535 -22.465 3.173 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -2.896 -20.904 2.114 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -3.147 -22.518 2.749 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -3.554 -19.297 3.671 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -1.509 -22.764 5.058 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -3.622 -18.418 5.962 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -1.566 -21.885 7.345 1.00 0.00 H new ATOM 0 HH TYR A 43 -3.106 -18.746 8.078 1.00 0.00 H new ATOM 682 N ASP A 44 -1.922 -24.182 1.591 1.00 0.00 N ATOM 683 CA ASP A 44 -2.226 -25.244 0.658 1.00 0.00 C ATOM 684 C ASP A 44 -3.172 -24.737 -0.418 1.00 0.00 C ATOM 685 O ASP A 44 -4.174 -24.096 -0.103 1.00 0.00 O ATOM 686 CB ASP A 44 -2.893 -26.395 1.406 1.00 0.00 C ATOM 687 CG ASP A 44 -2.067 -26.923 2.560 1.00 0.00 C ATOM 688 OD1 ASP A 44 -1.457 -28.001 2.421 1.00 0.00 O ATOM 689 OD2 ASP A 44 -2.043 -26.270 3.624 1.00 0.00 O ATOM 0 H ASP A 44 -2.303 -24.332 2.525 1.00 0.00 H new ATOM 0 HA ASP A 44 -1.301 -25.586 0.193 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -3.859 -26.061 1.784 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -3.088 -27.208 0.707 1.00 0.00 H new ATOM 694 N GLU A 45 -2.876 -25.037 -1.675 1.00 0.00 N ATOM 695 CA GLU A 45 -3.703 -24.588 -2.785 1.00 0.00 C ATOM 696 C GLU A 45 -5.147 -25.057 -2.644 1.00 0.00 C ATOM 697 O GLU A 45 -6.078 -24.291 -2.880 1.00 0.00 O ATOM 698 CB GLU A 45 -3.126 -25.077 -4.105 1.00 0.00 C ATOM 699 CG GLU A 45 -1.965 -24.242 -4.609 1.00 0.00 C ATOM 700 CD GLU A 45 -1.527 -24.654 -5.996 1.00 0.00 C ATOM 701 OE1 GLU A 45 -0.446 -25.256 -6.129 1.00 0.00 O ATOM 702 OE2 GLU A 45 -2.269 -24.381 -6.964 1.00 0.00 O ATOM 0 H GLU A 45 -2.066 -25.592 -1.952 1.00 0.00 H new ATOM 0 HA GLU A 45 -3.704 -23.498 -2.771 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -2.796 -26.109 -3.987 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.914 -25.079 -4.858 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -2.252 -23.191 -4.618 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -1.125 -24.337 -3.921 1.00 0.00 H new ATOM 709 N SER A 46 -5.325 -26.308 -2.235 1.00 0.00 N ATOM 710 CA SER A 46 -6.656 -26.878 -2.058 1.00 0.00 C ATOM 711 C SER A 46 -7.435 -26.129 -0.980 1.00 0.00 C ATOM 712 O SER A 46 -8.663 -26.127 -0.975 1.00 0.00 O ATOM 713 CB SER A 46 -6.554 -28.362 -1.702 1.00 0.00 C ATOM 714 OG SER A 46 -5.924 -29.091 -2.742 1.00 0.00 O ATOM 0 H SER A 46 -4.562 -26.949 -2.019 1.00 0.00 H new ATOM 0 HA SER A 46 -7.196 -26.776 -2.999 1.00 0.00 H new ATOM 0 HB2 SER A 46 -5.990 -28.480 -0.777 1.00 0.00 H new ATOM 0 HB3 SER A 46 -7.550 -28.766 -1.522 1.00 0.00 H new ATOM 0 HG SER A 46 -5.868 -30.037 -2.491 1.00 0.00 H new ATOM 720 N LYS A 47 -6.714 -25.478 -0.078 1.00 0.00 N ATOM 721 CA LYS A 47 -7.343 -24.706 0.980 1.00 0.00 C ATOM 722 C LYS A 47 -7.555 -23.273 0.514 1.00 0.00 C ATOM 723 O LYS A 47 -8.604 -22.682 0.757 1.00 0.00 O ATOM 724 CB LYS A 47 -6.485 -24.753 2.248 1.00 0.00 C ATOM 725 CG LYS A 47 -6.349 -26.156 2.817 1.00 0.00 C ATOM 726 CD LYS A 47 -5.457 -26.198 4.046 1.00 0.00 C ATOM 727 CE LYS A 47 -5.224 -27.632 4.498 1.00 0.00 C ATOM 728 NZ LYS A 47 -4.276 -27.720 5.638 1.00 0.00 N ATOM 0 H LYS A 47 -5.694 -25.470 -0.059 1.00 0.00 H new ATOM 0 HA LYS A 47 -8.315 -25.138 1.215 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -5.494 -24.359 2.025 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.925 -24.101 3.003 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -7.337 -26.538 3.075 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -5.941 -26.817 2.053 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -4.502 -25.723 3.823 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -5.916 -25.628 4.854 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -6.176 -28.079 4.785 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -4.838 -28.215 3.662 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -3.603 -28.495 5.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -3.756 -26.824 5.727 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -4.804 -27.903 6.515 1.00 0.00 H new ATOM 742 N ILE A 48 -6.559 -22.740 -0.183 1.00 0.00 N ATOM 743 CA ILE A 48 -6.617 -21.383 -0.717 1.00 0.00 C ATOM 744 C ILE A 48 -7.774 -21.221 -1.697 1.00 0.00 C ATOM 745 O ILE A 48 -8.612 -20.331 -1.549 1.00 0.00 O ATOM 746 CB ILE A 48 -5.298 -21.021 -1.430 1.00 0.00 C ATOM 747 CG1 ILE A 48 -4.156 -20.948 -0.417 1.00 0.00 C ATOM 748 CG2 ILE A 48 -5.427 -19.709 -2.194 1.00 0.00 C ATOM 749 CD1 ILE A 48 -2.804 -20.691 -1.044 1.00 0.00 C ATOM 0 H ILE A 48 -5.691 -23.233 -0.394 1.00 0.00 H new ATOM 0 HA ILE A 48 -6.772 -20.711 0.127 1.00 0.00 H new ATOM 0 HB ILE A 48 -5.074 -21.804 -2.154 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -4.370 -20.157 0.302 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -4.116 -21.884 0.141 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -4.482 -19.480 -2.686 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -6.213 -19.800 -2.943 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -5.678 -18.907 -1.500 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -2.043 -20.652 -0.265 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -2.568 -21.494 -1.742 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -2.825 -19.741 -1.578 1.00 0.00 H new ATOM 761 N LYS A 49 -7.820 -22.099 -2.686 1.00 0.00 N ATOM 762 CA LYS A 49 -8.825 -22.025 -3.735 1.00 0.00 C ATOM 763 C LYS A 49 -10.226 -22.232 -3.172 1.00 0.00 C ATOM 764 O LYS A 49 -11.174 -21.568 -3.592 1.00 0.00 O ATOM 765 CB LYS A 49 -8.510 -23.059 -4.813 1.00 0.00 C ATOM 766 CG LYS A 49 -7.167 -22.818 -5.481 1.00 0.00 C ATOM 767 CD LYS A 49 -6.764 -23.969 -6.381 1.00 0.00 C ATOM 768 CE LYS A 49 -5.365 -23.760 -6.936 1.00 0.00 C ATOM 769 NZ LYS A 49 -4.877 -24.950 -7.677 1.00 0.00 N ATOM 0 H LYS A 49 -7.168 -22.877 -2.785 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.800 -21.029 -4.178 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -8.517 -24.054 -4.369 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -9.296 -23.041 -5.568 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -7.213 -21.900 -6.066 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -6.404 -22.671 -4.717 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -6.802 -24.904 -5.821 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -7.475 -24.060 -7.202 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -5.363 -22.895 -7.599 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -4.680 -23.536 -6.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -3.843 -25.016 -7.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -5.315 -25.807 -7.284 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -5.130 -24.861 -8.682 1.00 0.00 H new ATOM 783 N THR A 50 -10.349 -23.137 -2.209 1.00 0.00 N ATOM 784 CA THR A 50 -11.620 -23.370 -1.548 1.00 0.00 C ATOM 785 C THR A 50 -12.026 -22.154 -0.720 1.00 0.00 C ATOM 786 O THR A 50 -13.190 -21.758 -0.720 1.00 0.00 O ATOM 787 CB THR A 50 -11.554 -24.622 -0.652 1.00 0.00 C ATOM 788 OG1 THR A 50 -11.222 -25.765 -1.452 1.00 0.00 O ATOM 789 CG2 THR A 50 -12.876 -24.865 0.059 1.00 0.00 C ATOM 0 H THR A 50 -9.583 -23.719 -1.871 1.00 0.00 H new ATOM 0 HA THR A 50 -12.372 -23.537 -2.319 1.00 0.00 H new ATOM 0 HB THR A 50 -10.787 -24.459 0.105 1.00 0.00 H new ATOM 0 HG1 THR A 50 -10.414 -26.190 -1.096 1.00 0.00 H new ATOM 0 HG21 THR A 50 -12.795 -25.755 0.683 1.00 0.00 H new ATOM 0 HG22 THR A 50 -13.117 -24.005 0.684 1.00 0.00 H new ATOM 0 HG23 THR A 50 -13.665 -25.009 -0.679 1.00 0.00 H new ATOM 797 N ALA A 51 -11.057 -21.546 -0.041 1.00 0.00 N ATOM 798 CA ALA A 51 -11.313 -20.346 0.743 1.00 0.00 C ATOM 799 C ALA A 51 -11.848 -19.228 -0.144 1.00 0.00 C ATOM 800 O ALA A 51 -12.854 -18.597 0.177 1.00 0.00 O ATOM 801 CB ALA A 51 -10.047 -19.895 1.458 1.00 0.00 C ATOM 0 H ALA A 51 -10.089 -21.866 -0.019 1.00 0.00 H new ATOM 0 HA ALA A 51 -12.069 -20.583 1.492 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.257 -18.997 2.039 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.704 -20.686 2.125 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -9.272 -19.678 0.723 1.00 0.00 H new ATOM 807 N LEU A 52 -11.181 -19.007 -1.270 1.00 0.00 N ATOM 808 CA LEU A 52 -11.571 -17.957 -2.203 1.00 0.00 C ATOM 809 C LEU A 52 -12.945 -18.228 -2.808 1.00 0.00 C ATOM 810 O LEU A 52 -13.772 -17.323 -2.919 1.00 0.00 O ATOM 811 CB LEU A 52 -10.528 -17.818 -3.313 1.00 0.00 C ATOM 812 CG LEU A 52 -9.143 -17.363 -2.844 1.00 0.00 C ATOM 813 CD1 LEU A 52 -8.169 -17.338 -4.010 1.00 0.00 C ATOM 814 CD2 LEU A 52 -9.225 -15.991 -2.192 1.00 0.00 C ATOM 0 H LEU A 52 -10.364 -19.544 -1.560 1.00 0.00 H new ATOM 0 HA LEU A 52 -11.628 -17.023 -1.645 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.427 -18.778 -3.819 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -10.897 -17.106 -4.051 1.00 0.00 H new ATOM 0 HG LEU A 52 -8.779 -18.076 -2.104 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.190 -17.012 -3.659 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -8.088 -18.337 -4.438 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.530 -16.646 -4.771 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -8.232 -15.684 -1.865 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -9.610 -15.269 -2.912 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -9.892 -16.036 -1.331 1.00 0.00 H new ATOM 826 N ASP A 53 -13.195 -19.473 -3.192 1.00 0.00 N ATOM 827 CA ASP A 53 -14.470 -19.830 -3.811 1.00 0.00 C ATOM 828 C ASP A 53 -15.599 -19.827 -2.783 1.00 0.00 C ATOM 829 O ASP A 53 -16.751 -19.558 -3.117 1.00 0.00 O ATOM 830 CB ASP A 53 -14.381 -21.190 -4.508 1.00 0.00 C ATOM 831 CG ASP A 53 -15.644 -21.528 -5.280 1.00 0.00 C ATOM 832 OD1 ASP A 53 -15.948 -20.837 -6.279 1.00 0.00 O ATOM 833 OD2 ASP A 53 -16.332 -22.497 -4.905 1.00 0.00 O ATOM 0 H ASP A 53 -12.540 -20.248 -3.088 1.00 0.00 H new ATOM 0 HA ASP A 53 -14.695 -19.075 -4.565 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -13.530 -21.191 -5.190 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -14.194 -21.965 -3.764 1.00 0.00 H new ATOM 838 N HIS A 54 -15.266 -20.111 -1.528 1.00 0.00 N ATOM 839 CA HIS A 54 -16.238 -20.021 -0.442 1.00 0.00 C ATOM 840 C HIS A 54 -16.625 -18.562 -0.211 1.00 0.00 C ATOM 841 O HIS A 54 -17.801 -18.242 -0.026 1.00 0.00 O ATOM 842 CB HIS A 54 -15.674 -20.637 0.842 1.00 0.00 C ATOM 843 CG HIS A 54 -16.570 -20.485 2.032 1.00 0.00 C ATOM 844 ND1 HIS A 54 -17.660 -21.298 2.227 1.00 0.00 N ATOM 845 CD2 HIS A 54 -16.499 -19.590 3.037 1.00 0.00 C ATOM 846 CE1 HIS A 54 -18.225 -20.874 3.346 1.00 0.00 C ATOM 847 NE2 HIS A 54 -17.557 -19.839 3.869 1.00 0.00 N ATOM 0 H HIS A 54 -14.333 -20.405 -1.237 1.00 0.00 H new ATOM 0 HA HIS A 54 -17.129 -20.582 -0.723 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -15.487 -21.698 0.673 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -14.712 -20.175 1.063 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -15.750 -18.822 3.162 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -19.113 -21.308 3.782 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -17.791 -19.333 4.723 1.00 0.00 H new ATOM 855 N ILE A 55 -15.625 -17.684 -0.227 1.00 0.00 N ATOM 856 CA ILE A 55 -15.864 -16.246 -0.173 1.00 0.00 C ATOM 857 C ILE A 55 -16.824 -15.840 -1.289 1.00 0.00 C ATOM 858 O ILE A 55 -17.825 -15.160 -1.059 1.00 0.00 O ATOM 859 CB ILE A 55 -14.541 -15.460 -0.318 1.00 0.00 C ATOM 860 CG1 ILE A 55 -13.625 -15.737 0.872 1.00 0.00 C ATOM 861 CG2 ILE A 55 -14.805 -13.968 -0.438 1.00 0.00 C ATOM 862 CD1 ILE A 55 -12.257 -15.099 0.750 1.00 0.00 C ATOM 0 H ILE A 55 -14.640 -17.945 -0.277 1.00 0.00 H new ATOM 0 HA ILE A 55 -16.304 -16.008 0.796 1.00 0.00 H new ATOM 0 HB ILE A 55 -14.047 -15.795 -1.230 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -14.105 -15.374 1.781 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -13.505 -16.815 0.983 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -13.858 -13.438 -0.539 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -15.423 -13.777 -1.315 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -15.324 -13.617 0.454 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -11.663 -15.340 1.632 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.756 -15.480 -0.140 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -12.366 -14.017 0.670 1.00 0.00 H new ATOM 874 N LYS A 56 -16.513 -16.303 -2.490 1.00 0.00 N ATOM 875 CA LYS A 56 -17.353 -16.104 -3.664 1.00 0.00 C ATOM 876 C LYS A 56 -18.765 -16.647 -3.432 1.00 0.00 C ATOM 877 O LYS A 56 -19.751 -16.026 -3.829 1.00 0.00 O ATOM 878 CB LYS A 56 -16.680 -16.791 -4.862 1.00 0.00 C ATOM 879 CG LYS A 56 -17.583 -17.076 -6.051 1.00 0.00 C ATOM 880 CD LYS A 56 -16.767 -17.615 -7.217 1.00 0.00 C ATOM 881 CE LYS A 56 -17.614 -18.440 -8.172 1.00 0.00 C ATOM 882 NZ LYS A 56 -18.136 -19.680 -7.529 1.00 0.00 N ATOM 0 H LYS A 56 -15.662 -16.833 -2.680 1.00 0.00 H new ATOM 0 HA LYS A 56 -17.457 -15.038 -3.866 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -15.853 -16.165 -5.199 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -16.249 -17.733 -4.522 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -18.349 -17.799 -5.770 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -18.100 -16.164 -6.351 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -16.316 -16.784 -7.759 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -15.950 -18.228 -6.835 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -18.449 -17.837 -8.528 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -17.019 -18.708 -9.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -18.359 -20.383 -8.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -17.416 -20.067 -6.886 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -18.997 -19.456 -6.991 1.00 0.00 H new ATOM 896 N SER A 57 -18.855 -17.790 -2.761 1.00 0.00 N ATOM 897 CA SER A 57 -20.140 -18.412 -2.464 1.00 0.00 C ATOM 898 C SER A 57 -20.981 -17.521 -1.548 1.00 0.00 C ATOM 899 O SER A 57 -22.166 -17.301 -1.796 1.00 0.00 O ATOM 900 CB SER A 57 -19.933 -19.789 -1.819 1.00 0.00 C ATOM 901 OG SER A 57 -19.201 -20.656 -2.676 1.00 0.00 O ATOM 0 H SER A 57 -18.048 -18.307 -2.411 1.00 0.00 H new ATOM 0 HA SER A 57 -20.677 -18.541 -3.404 1.00 0.00 H new ATOM 0 HB2 SER A 57 -19.402 -19.674 -0.874 1.00 0.00 H new ATOM 0 HB3 SER A 57 -20.901 -20.234 -1.588 1.00 0.00 H new ATOM 0 HG SER A 57 -18.271 -20.352 -2.732 1.00 0.00 H new ATOM 907 N GLU A 58 -20.365 -17.000 -0.493 1.00 0.00 N ATOM 908 CA GLU A 58 -21.075 -16.156 0.458 1.00 0.00 C ATOM 909 C GLU A 58 -21.421 -14.796 -0.150 1.00 0.00 C ATOM 910 O GLU A 58 -22.524 -14.287 0.047 1.00 0.00 O ATOM 911 CB GLU A 58 -20.251 -15.973 1.733 1.00 0.00 C ATOM 912 CG GLU A 58 -20.063 -17.261 2.517 1.00 0.00 C ATOM 913 CD GLU A 58 -21.379 -17.942 2.833 1.00 0.00 C ATOM 914 OE1 GLU A 58 -21.707 -18.942 2.161 1.00 0.00 O ATOM 915 OE2 GLU A 58 -22.094 -17.475 3.741 1.00 0.00 O ATOM 0 H GLU A 58 -19.379 -17.147 -0.276 1.00 0.00 H new ATOM 0 HA GLU A 58 -22.009 -16.657 0.711 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -19.273 -15.570 1.471 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -20.739 -15.236 2.370 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -19.433 -17.942 1.946 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -19.537 -17.044 3.447 1.00 0.00 H new ATOM 922 N LEU A 59 -20.488 -14.229 -0.906 1.00 0.00 N ATOM 923 CA LEU A 59 -20.684 -12.918 -1.527 1.00 0.00 C ATOM 924 C LEU A 59 -21.857 -12.922 -2.505 1.00 0.00 C ATOM 925 O LEU A 59 -22.473 -11.880 -2.755 1.00 0.00 O ATOM 926 CB LEU A 59 -19.404 -12.477 -2.241 1.00 0.00 C ATOM 927 CG LEU A 59 -18.285 -11.992 -1.316 1.00 0.00 C ATOM 928 CD1 LEU A 59 -17.031 -11.681 -2.116 1.00 0.00 C ATOM 929 CD2 LEU A 59 -18.736 -10.766 -0.536 1.00 0.00 C ATOM 0 H LEU A 59 -19.584 -14.656 -1.106 1.00 0.00 H new ATOM 0 HA LEU A 59 -20.919 -12.209 -0.733 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -19.030 -13.312 -2.833 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -19.652 -11.677 -2.938 1.00 0.00 H new ATOM 0 HG LEU A 59 -18.053 -12.787 -0.607 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -16.246 -11.338 -1.443 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -16.697 -12.580 -2.634 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -17.249 -10.902 -2.846 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -17.929 -10.433 0.117 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -18.993 -9.967 -1.231 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -19.609 -11.018 0.066 1.00 0.00 H new ATOM 941 N ASP A 60 -22.165 -14.095 -3.038 1.00 0.00 N ATOM 942 CA ASP A 60 -23.259 -14.256 -3.992 1.00 0.00 C ATOM 943 C ASP A 60 -24.621 -14.071 -3.320 1.00 0.00 C ATOM 944 O ASP A 60 -25.599 -13.690 -3.965 1.00 0.00 O ATOM 945 CB ASP A 60 -23.176 -15.641 -4.639 1.00 0.00 C ATOM 946 CG ASP A 60 -24.315 -15.912 -5.598 1.00 0.00 C ATOM 947 OD1 ASP A 60 -24.261 -15.415 -6.741 1.00 0.00 O ATOM 948 OD2 ASP A 60 -25.262 -16.628 -5.214 1.00 0.00 O ATOM 0 H ASP A 60 -21.668 -14.960 -2.825 1.00 0.00 H new ATOM 0 HA ASP A 60 -23.160 -13.486 -4.757 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -22.230 -15.731 -5.172 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -23.176 -16.402 -3.858 1.00 0.00 H new ATOM 953 N LYS A 61 -24.676 -14.323 -2.021 1.00 0.00 N ATOM 954 CA LYS A 61 -25.929 -14.243 -1.277 1.00 0.00 C ATOM 955 C LYS A 61 -26.366 -12.799 -1.022 1.00 0.00 C ATOM 956 O LYS A 61 -27.560 -12.517 -0.931 1.00 0.00 O ATOM 957 CB LYS A 61 -25.781 -14.981 0.049 1.00 0.00 C ATOM 958 CG LYS A 61 -25.451 -16.449 -0.122 1.00 0.00 C ATOM 959 CD LYS A 61 -25.048 -17.082 1.192 1.00 0.00 C ATOM 960 CE LYS A 61 -24.773 -18.564 1.031 1.00 0.00 C ATOM 961 NZ LYS A 61 -23.744 -18.839 -0.003 1.00 0.00 N ATOM 0 H LYS A 61 -23.867 -14.585 -1.457 1.00 0.00 H new ATOM 0 HA LYS A 61 -26.703 -14.711 -1.885 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -24.997 -14.505 0.638 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -26.707 -14.887 0.616 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -26.316 -16.973 -0.530 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -24.642 -16.560 -0.844 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -24.158 -16.585 1.579 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -25.840 -16.935 1.926 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -24.444 -18.976 1.985 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -25.698 -19.076 0.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -24.189 -19.300 -0.822 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -23.307 -17.945 -0.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -23.014 -19.465 0.392 1.00 0.00 H new ATOM 975 N CYS A 62 -25.412 -11.887 -0.920 1.00 0.00 N ATOM 976 CA CYS A 62 -25.726 -10.514 -0.546 1.00 0.00 C ATOM 977 C CYS A 62 -25.537 -9.581 -1.733 1.00 0.00 C ATOM 978 O CYS A 62 -24.425 -9.114 -1.997 1.00 0.00 O ATOM 979 CB CYS A 62 -24.839 -10.075 0.617 1.00 0.00 C ATOM 980 SG CYS A 62 -24.519 -11.401 1.825 1.00 0.00 S ATOM 0 H CYS A 62 -24.423 -12.068 -1.089 1.00 0.00 H new ATOM 0 HA CYS A 62 -26.769 -10.467 -0.234 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -23.888 -9.715 0.223 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -25.311 -9.235 1.127 1.00 0.00 H new ATOM 985 N ASN A 63 -26.616 -9.336 -2.466 1.00 0.00 N ATOM 986 CA ASN A 63 -26.561 -8.465 -3.633 1.00 0.00 C ATOM 987 C ASN A 63 -27.823 -7.618 -3.748 1.00 0.00 C ATOM 988 O ASN A 63 -28.225 -7.235 -4.846 1.00 0.00 O ATOM 989 CB ASN A 63 -26.354 -9.275 -4.921 1.00 0.00 C ATOM 990 CG ASN A 63 -24.952 -9.850 -5.030 1.00 0.00 C ATOM 991 OD1 ASN A 63 -24.016 -9.159 -5.429 1.00 0.00 O ATOM 992 ND2 ASN A 63 -24.794 -11.122 -4.700 1.00 0.00 N ATOM 0 H ASN A 63 -27.538 -9.727 -2.273 1.00 0.00 H new ATOM 0 HA ASN A 63 -25.708 -7.800 -3.501 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -27.080 -10.088 -4.956 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -26.549 -8.637 -5.783 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -23.875 -11.557 -4.773 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -25.592 -11.667 -4.373 1.00 0.00 H new ATOM 999 N GLY A 64 -28.436 -7.312 -2.612 1.00 0.00 N ATOM 1000 CA GLY A 64 -29.606 -6.455 -2.618 1.00 0.00 C ATOM 1001 C GLY A 64 -29.247 -5.027 -2.259 1.00 0.00 C ATOM 1002 O GLY A 64 -28.290 -4.468 -2.797 1.00 0.00 O ATOM 0 H GLY A 64 -28.146 -7.640 -1.691 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -30.071 -6.478 -3.604 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -30.342 -6.836 -1.910 1.00 0.00 H new ATOM 1006 N ASN A 65 -29.998 -4.438 -1.336 1.00 0.00 N ATOM 1007 CA ASN A 65 -29.691 -3.098 -0.832 1.00 0.00 C ATOM 1008 C ASN A 65 -28.621 -3.193 0.247 1.00 0.00 C ATOM 1009 O ASN A 65 -28.111 -2.191 0.745 1.00 0.00 O ATOM 1010 CB ASN A 65 -30.946 -2.422 -0.259 1.00 0.00 C ATOM 1011 CG ASN A 65 -31.489 -3.122 0.979 1.00 0.00 C ATOM 1012 OD1 ASN A 65 -31.432 -4.348 1.098 1.00 0.00 O ATOM 1013 ND2 ASN A 65 -32.019 -2.347 1.912 1.00 0.00 N ATOM 0 H ASN A 65 -30.825 -4.865 -0.919 1.00 0.00 H new ATOM 0 HA ASN A 65 -29.327 -2.493 -1.662 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -30.712 -1.387 -0.011 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -31.721 -2.399 -1.025 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -32.398 -2.761 2.764 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -32.049 -1.336 1.779 1.00 0.00 H new ATOM 1020 N ASP A 66 -28.298 -4.426 0.592 1.00 0.00 N ATOM 1021 CA ASP A 66 -27.332 -4.733 1.630 1.00 0.00 C ATOM 1022 C ASP A 66 -25.977 -5.045 1.020 1.00 0.00 C ATOM 1023 O ASP A 66 -24.985 -5.179 1.730 1.00 0.00 O ATOM 1024 CB ASP A 66 -27.811 -5.958 2.411 1.00 0.00 C ATOM 1025 CG ASP A 66 -27.877 -7.199 1.532 1.00 0.00 C ATOM 1026 OD1 ASP A 66 -27.186 -8.189 1.837 1.00 0.00 O ATOM 1027 OD2 ASP A 66 -28.610 -7.173 0.512 1.00 0.00 O ATOM 0 H ASP A 66 -28.704 -5.252 0.154 1.00 0.00 H new ATOM 0 HA ASP A 66 -27.238 -3.870 2.289 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -27.138 -6.141 3.248 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -28.796 -5.758 2.832 1.00 0.00 H new ATOM 1032 N ALA A 67 -25.944 -5.119 -0.304 1.00 0.00 N ATOM 1033 CA ALA A 67 -24.811 -5.684 -1.023 1.00 0.00 C ATOM 1034 C ALA A 67 -23.508 -4.993 -0.667 1.00 0.00 C ATOM 1035 O ALA A 67 -22.601 -5.611 -0.116 1.00 0.00 O ATOM 1036 CB ALA A 67 -25.051 -5.612 -2.519 1.00 0.00 C ATOM 0 H ALA A 67 -26.698 -4.791 -0.907 1.00 0.00 H new ATOM 0 HA ALA A 67 -24.720 -6.727 -0.721 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -24.197 -6.038 -3.045 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -25.950 -6.175 -2.771 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -25.179 -4.571 -2.817 1.00 0.00 H new ATOM 1042 N ASP A 68 -23.435 -3.706 -0.955 1.00 0.00 N ATOM 1043 CA ASP A 68 -22.205 -2.945 -0.783 1.00 0.00 C ATOM 1044 C ASP A 68 -21.758 -2.929 0.680 1.00 0.00 C ATOM 1045 O ASP A 68 -20.564 -2.908 0.975 1.00 0.00 O ATOM 1046 CB ASP A 68 -22.413 -1.523 -1.299 1.00 0.00 C ATOM 1047 CG ASP A 68 -21.129 -0.716 -1.351 1.00 0.00 C ATOM 1048 OD1 ASP A 68 -20.326 -0.931 -2.288 1.00 0.00 O ATOM 1049 OD2 ASP A 68 -20.929 0.150 -0.470 1.00 0.00 O ATOM 0 H ASP A 68 -24.219 -3.160 -1.312 1.00 0.00 H new ATOM 0 HA ASP A 68 -21.414 -3.427 -1.358 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -22.850 -1.565 -2.297 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -23.131 -1.011 -0.658 1.00 0.00 H new ATOM 1054 N GLN A 69 -22.719 -2.981 1.592 1.00 0.00 N ATOM 1055 CA GLN A 69 -22.416 -2.954 3.017 1.00 0.00 C ATOM 1056 C GLN A 69 -21.951 -4.324 3.509 1.00 0.00 C ATOM 1057 O GLN A 69 -20.947 -4.429 4.215 1.00 0.00 O ATOM 1058 CB GLN A 69 -23.637 -2.482 3.814 1.00 0.00 C ATOM 1059 CG GLN A 69 -23.434 -2.503 5.325 1.00 0.00 C ATOM 1060 CD GLN A 69 -22.226 -1.702 5.780 1.00 0.00 C ATOM 1061 OE1 GLN A 69 -21.906 -0.635 5.070 1.00 0.00 O flip ATOM 1062 NE2 GLN A 69 -21.593 -2.036 6.779 1.00 0.00 N flip ATOM 0 H GLN A 69 -23.713 -3.042 1.372 1.00 0.00 H new ATOM 0 HA GLN A 69 -21.601 -2.248 3.175 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -23.890 -1.468 3.505 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -24.489 -3.114 3.563 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -24.327 -2.108 5.810 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -23.322 -3.536 5.655 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -21.869 -2.866 7.303 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -20.792 -1.483 7.084 1.00 0.00 H new ATOM 1071 N GLN A 70 -22.671 -5.369 3.131 1.00 0.00 N ATOM 1072 CA GLN A 70 -22.329 -6.721 3.544 1.00 0.00 C ATOM 1073 C GLN A 70 -21.019 -7.184 2.919 1.00 0.00 C ATOM 1074 O GLN A 70 -20.240 -7.883 3.558 1.00 0.00 O ATOM 1075 CB GLN A 70 -23.461 -7.675 3.188 1.00 0.00 C ATOM 1076 CG GLN A 70 -24.738 -7.378 3.948 1.00 0.00 C ATOM 1077 CD GLN A 70 -24.595 -7.631 5.435 1.00 0.00 C ATOM 1078 OE1 GLN A 70 -24.197 -6.748 6.190 1.00 0.00 O ATOM 1079 NE2 GLN A 70 -24.915 -8.840 5.867 1.00 0.00 N ATOM 0 H GLN A 70 -23.498 -5.306 2.537 1.00 0.00 H new ATOM 0 HA GLN A 70 -22.191 -6.720 4.625 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -23.658 -7.615 2.118 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -23.148 -8.698 3.398 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -25.022 -6.338 3.784 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -25.545 -7.995 3.553 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -25.242 -9.547 5.208 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -24.835 -9.065 6.859 1.00 0.00 H new ATOM 1088 N LYS A 71 -20.767 -6.779 1.681 1.00 0.00 N ATOM 1089 CA LYS A 71 -19.499 -7.096 1.025 1.00 0.00 C ATOM 1090 C LYS A 71 -18.349 -6.400 1.752 1.00 0.00 C ATOM 1091 O LYS A 71 -17.201 -6.839 1.694 1.00 0.00 O ATOM 1092 CB LYS A 71 -19.519 -6.681 -0.448 1.00 0.00 C ATOM 1093 CG LYS A 71 -20.565 -7.407 -1.283 1.00 0.00 C ATOM 1094 CD LYS A 71 -20.553 -6.925 -2.727 1.00 0.00 C ATOM 1095 CE LYS A 71 -21.778 -7.396 -3.499 1.00 0.00 C ATOM 1096 NZ LYS A 71 -21.859 -8.879 -3.597 1.00 0.00 N ATOM 0 H LYS A 71 -21.416 -6.235 1.112 1.00 0.00 H new ATOM 0 HA LYS A 71 -19.353 -8.175 1.069 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -19.701 -5.608 -0.510 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -18.535 -6.863 -0.879 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -20.376 -8.480 -1.254 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -21.553 -7.246 -0.852 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -20.511 -5.836 -2.745 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -19.652 -7.287 -3.222 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -22.677 -7.018 -3.012 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -21.756 -6.970 -4.502 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -22.619 -9.142 -4.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -20.954 -9.254 -3.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -22.061 -9.278 -2.658 1.00 0.00 H new ATOM 1110 N THR A 72 -18.676 -5.312 2.441 1.00 0.00 N ATOM 1111 CA THR A 72 -17.707 -4.595 3.256 1.00 0.00 C ATOM 1112 C THR A 72 -17.570 -5.249 4.632 1.00 0.00 C ATOM 1113 O THR A 72 -16.470 -5.364 5.172 1.00 0.00 O ATOM 1114 CB THR A 72 -18.115 -3.115 3.418 1.00 0.00 C ATOM 1115 OG1 THR A 72 -18.178 -2.492 2.129 1.00 0.00 O ATOM 1116 CG2 THR A 72 -17.133 -2.361 4.303 1.00 0.00 C ATOM 0 H THR A 72 -19.612 -4.907 2.450 1.00 0.00 H new ATOM 0 HA THR A 72 -16.744 -4.639 2.747 1.00 0.00 H new ATOM 0 HB THR A 72 -19.094 -3.083 3.896 1.00 0.00 H new ATOM 0 HG1 THR A 72 -19.107 -2.477 1.818 1.00 0.00 H new ATOM 0 HG21 THR A 72 -17.450 -1.322 4.396 1.00 0.00 H new ATOM 0 HG22 THR A 72 -17.105 -2.822 5.291 1.00 0.00 H new ATOM 0 HG23 THR A 72 -16.139 -2.398 3.857 1.00 0.00 H new ATOM 1124 N THR A 73 -18.690 -5.694 5.181 1.00 0.00 N ATOM 1125 CA THR A 73 -18.701 -6.342 6.485 1.00 0.00 C ATOM 1126 C THR A 73 -18.008 -7.701 6.420 1.00 0.00 C ATOM 1127 O THR A 73 -17.294 -8.096 7.344 1.00 0.00 O ATOM 1128 CB THR A 73 -20.146 -6.518 6.996 1.00 0.00 C ATOM 1129 OG1 THR A 73 -20.825 -5.254 6.975 1.00 0.00 O ATOM 1130 CG2 THR A 73 -20.161 -7.078 8.412 1.00 0.00 C ATOM 0 H THR A 73 -19.607 -5.618 4.742 1.00 0.00 H new ATOM 0 HA THR A 73 -18.157 -5.702 7.180 1.00 0.00 H new ATOM 0 HB THR A 73 -20.656 -7.223 6.339 1.00 0.00 H new ATOM 0 HG1 THR A 73 -20.945 -4.963 6.047 1.00 0.00 H new ATOM 0 HG21 THR A 73 -21.192 -7.192 8.747 1.00 0.00 H new ATOM 0 HG22 THR A 73 -19.666 -8.049 8.425 1.00 0.00 H new ATOM 0 HG23 THR A 73 -19.636 -6.394 9.079 1.00 0.00 H new ATOM 1138 N PHE A 74 -18.198 -8.392 5.301 1.00 0.00 N ATOM 1139 CA PHE A 74 -17.640 -9.722 5.105 1.00 0.00 C ATOM 1140 C PHE A 74 -16.114 -9.673 5.098 1.00 0.00 C ATOM 1141 O PHE A 74 -15.452 -10.644 5.467 1.00 0.00 O ATOM 1142 CB PHE A 74 -18.167 -10.319 3.796 1.00 0.00 C ATOM 1143 CG PHE A 74 -17.889 -11.786 3.627 1.00 0.00 C ATOM 1144 CD1 PHE A 74 -17.441 -12.279 2.415 1.00 0.00 C ATOM 1145 CD2 PHE A 74 -18.082 -12.672 4.676 1.00 0.00 C ATOM 1146 CE1 PHE A 74 -17.191 -13.624 2.247 1.00 0.00 C ATOM 1147 CE2 PHE A 74 -17.831 -14.020 4.515 1.00 0.00 C ATOM 1148 CZ PHE A 74 -17.386 -14.498 3.297 1.00 0.00 C ATOM 0 H PHE A 74 -18.740 -8.047 4.509 1.00 0.00 H new ATOM 0 HA PHE A 74 -17.951 -10.358 5.933 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -19.244 -10.157 3.745 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -17.723 -9.779 2.960 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -17.285 -11.601 1.589 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -18.432 -12.304 5.629 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -16.843 -13.994 1.294 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -17.982 -14.700 5.340 1.00 0.00 H new ATOM 0 HZ PHE A 74 -17.191 -15.552 3.167 1.00 0.00 H new ATOM 1158 N LYS A 75 -15.565 -8.525 4.698 1.00 0.00 N ATOM 1159 CA LYS A 75 -14.125 -8.308 4.720 1.00 0.00 C ATOM 1160 C LYS A 75 -13.565 -8.544 6.115 1.00 0.00 C ATOM 1161 O LYS A 75 -12.528 -9.182 6.284 1.00 0.00 O ATOM 1162 CB LYS A 75 -13.798 -6.879 4.286 1.00 0.00 C ATOM 1163 CG LYS A 75 -14.137 -6.574 2.839 1.00 0.00 C ATOM 1164 CD LYS A 75 -13.937 -5.099 2.533 1.00 0.00 C ATOM 1165 CE LYS A 75 -14.068 -4.810 1.048 1.00 0.00 C ATOM 1166 NZ LYS A 75 -13.873 -3.367 0.745 1.00 0.00 N ATOM 0 H LYS A 75 -16.103 -7.730 4.354 1.00 0.00 H new ATOM 0 HA LYS A 75 -13.669 -9.015 4.027 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -14.339 -6.184 4.928 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -12.735 -6.698 4.444 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -13.509 -7.174 2.180 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -15.171 -6.854 2.637 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -14.670 -4.510 3.084 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -12.952 -4.786 2.879 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -13.335 -5.399 0.497 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -15.053 -5.124 0.702 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -13.970 -3.211 -0.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -14.589 -2.806 1.250 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -12.924 -3.073 1.051 1.00 0.00 H new ATOM 1180 N GLN A 76 -14.284 -8.040 7.110 1.00 0.00 N ATOM 1181 CA GLN A 76 -13.867 -8.119 8.490 1.00 0.00 C ATOM 1182 C GLN A 76 -13.970 -9.549 9.007 1.00 0.00 C ATOM 1183 O GLN A 76 -13.142 -9.993 9.803 1.00 0.00 O ATOM 1184 CB GLN A 76 -14.732 -7.178 9.319 1.00 0.00 C ATOM 1185 CG GLN A 76 -14.385 -5.711 9.117 1.00 0.00 C ATOM 1186 CD GLN A 76 -15.434 -4.767 9.671 1.00 0.00 C ATOM 1187 OE1 GLN A 76 -15.399 -4.395 10.845 1.00 0.00 O ATOM 1188 NE2 GLN A 76 -16.366 -4.357 8.824 1.00 0.00 N ATOM 0 H GLN A 76 -15.176 -7.564 6.974 1.00 0.00 H new ATOM 0 HA GLN A 76 -12.822 -7.818 8.572 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -15.779 -7.336 9.061 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -14.622 -7.429 10.374 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -13.428 -5.502 9.595 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -14.258 -5.518 8.052 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -16.360 -4.689 7.859 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -17.090 -3.710 9.136 1.00 0.00 H new ATOM 1197 N THR A 77 -14.984 -10.266 8.537 1.00 0.00 N ATOM 1198 CA THR A 77 -15.182 -11.659 8.909 1.00 0.00 C ATOM 1199 C THR A 77 -14.050 -12.534 8.371 1.00 0.00 C ATOM 1200 O THR A 77 -13.395 -13.257 9.126 1.00 0.00 O ATOM 1201 CB THR A 77 -16.525 -12.181 8.370 1.00 0.00 C ATOM 1202 OG1 THR A 77 -17.592 -11.356 8.853 1.00 0.00 O ATOM 1203 CG2 THR A 77 -16.761 -13.626 8.788 1.00 0.00 C ATOM 0 H THR A 77 -15.686 -9.901 7.893 1.00 0.00 H new ATOM 0 HA THR A 77 -15.186 -11.711 9.998 1.00 0.00 H new ATOM 0 HB THR A 77 -16.495 -12.143 7.281 1.00 0.00 H new ATOM 0 HG1 THR A 77 -18.446 -11.690 8.507 1.00 0.00 H new ATOM 0 HG21 THR A 77 -17.718 -13.968 8.393 1.00 0.00 H new ATOM 0 HG22 THR A 77 -15.961 -14.254 8.395 1.00 0.00 H new ATOM 0 HG23 THR A 77 -16.773 -13.693 9.876 1.00 0.00 H new ATOM 1211 N VAL A 78 -13.822 -12.457 7.063 1.00 0.00 N ATOM 1212 CA VAL A 78 -12.784 -13.242 6.415 1.00 0.00 C ATOM 1213 C VAL A 78 -11.409 -12.882 6.974 1.00 0.00 C ATOM 1214 O VAL A 78 -10.555 -13.750 7.140 1.00 0.00 O ATOM 1215 CB VAL A 78 -12.803 -13.031 4.886 1.00 0.00 C ATOM 1216 CG1 VAL A 78 -11.766 -13.897 4.200 1.00 0.00 C ATOM 1217 CG2 VAL A 78 -14.181 -13.328 4.326 1.00 0.00 C ATOM 0 H VAL A 78 -14.348 -11.854 6.430 1.00 0.00 H new ATOM 0 HA VAL A 78 -12.984 -14.293 6.621 1.00 0.00 H new ATOM 0 HB VAL A 78 -12.558 -11.987 4.691 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -11.804 -13.726 3.124 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -10.774 -13.642 4.573 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.973 -14.947 4.408 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -14.176 -13.174 3.247 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -14.447 -14.362 4.544 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -14.911 -12.661 4.784 1.00 0.00 H new ATOM 1227 N GLN A 79 -11.215 -11.603 7.281 1.00 0.00 N ATOM 1228 CA GLN A 79 -9.989 -11.116 7.872 1.00 0.00 C ATOM 1229 C GLN A 79 -9.560 -11.968 9.070 1.00 0.00 C ATOM 1230 O GLN A 79 -8.412 -12.404 9.152 1.00 0.00 O ATOM 1231 CB GLN A 79 -10.230 -9.678 8.303 1.00 0.00 C ATOM 1232 CG GLN A 79 -9.002 -8.811 8.271 1.00 0.00 C ATOM 1233 CD GLN A 79 -8.084 -9.043 9.456 1.00 0.00 C ATOM 1234 OE1 GLN A 79 -8.539 -9.392 10.547 1.00 0.00 O ATOM 1235 NE2 GLN A 79 -6.791 -8.852 9.252 1.00 0.00 N ATOM 0 H GLN A 79 -11.913 -10.877 7.123 1.00 0.00 H new ATOM 0 HA GLN A 79 -9.182 -11.174 7.142 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -10.988 -9.239 7.655 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -10.636 -9.677 9.315 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -8.452 -9.002 7.349 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -9.303 -7.764 8.251 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -6.457 -8.563 8.333 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -6.128 -8.994 10.014 1.00 0.00 H new ATOM 1244 N GLY A 80 -10.495 -12.230 9.977 1.00 0.00 N ATOM 1245 CA GLY A 80 -10.167 -12.958 11.190 1.00 0.00 C ATOM 1246 C GLY A 80 -9.950 -14.437 10.940 1.00 0.00 C ATOM 1247 O GLY A 80 -9.333 -15.128 11.753 1.00 0.00 O ATOM 0 H GLY A 80 -11.473 -11.952 9.895 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -9.267 -12.532 11.633 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -10.971 -12.830 11.915 1.00 0.00 H new ATOM 1251 N ALA A 81 -10.443 -14.918 9.810 1.00 0.00 N ATOM 1252 CA ALA A 81 -10.348 -16.330 9.469 1.00 0.00 C ATOM 1253 C ALA A 81 -8.908 -16.732 9.149 1.00 0.00 C ATOM 1254 O ALA A 81 -8.344 -17.619 9.791 1.00 0.00 O ATOM 1255 CB ALA A 81 -11.269 -16.653 8.301 1.00 0.00 C ATOM 0 H ALA A 81 -10.916 -14.348 9.109 1.00 0.00 H new ATOM 0 HA ALA A 81 -10.665 -16.908 10.337 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -11.188 -17.712 8.056 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -12.298 -16.421 8.574 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -10.981 -16.057 7.435 1.00 0.00 H new ATOM 1261 N LEU A 82 -8.308 -16.061 8.173 1.00 0.00 N ATOM 1262 CA LEU A 82 -6.988 -16.438 7.684 1.00 0.00 C ATOM 1263 C LEU A 82 -5.880 -15.939 8.589 1.00 0.00 C ATOM 1264 O LEU A 82 -4.708 -16.269 8.404 1.00 0.00 O ATOM 1265 CB LEU A 82 -6.792 -15.936 6.257 1.00 0.00 C ATOM 1266 CG LEU A 82 -7.835 -16.443 5.265 1.00 0.00 C ATOM 1267 CD1 LEU A 82 -8.065 -17.932 5.439 1.00 0.00 C ATOM 1268 CD2 LEU A 82 -9.119 -15.656 5.380 1.00 0.00 C ATOM 0 H LEU A 82 -8.716 -15.252 7.704 1.00 0.00 H new ATOM 0 HA LEU A 82 -6.933 -17.527 7.687 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -6.811 -14.846 6.262 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -5.803 -16.236 5.911 1.00 0.00 H new ATOM 0 HG LEU A 82 -7.453 -16.289 4.256 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -8.812 -18.271 4.721 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.130 -18.467 5.270 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -8.418 -18.130 6.451 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -9.845 -16.038 4.662 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -9.519 -15.757 6.389 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -8.921 -14.605 5.172 1.00 0.00 H new ATOM 1280 N SER A 83 -6.262 -15.166 9.578 1.00 0.00 N ATOM 1281 CA SER A 83 -5.320 -14.697 10.576 1.00 0.00 C ATOM 1282 C SER A 83 -5.015 -15.824 11.558 1.00 0.00 C ATOM 1283 O SER A 83 -3.867 -16.021 11.967 1.00 0.00 O ATOM 1284 CB SER A 83 -5.881 -13.478 11.311 1.00 0.00 C ATOM 1285 OG SER A 83 -6.064 -12.385 10.424 1.00 0.00 O ATOM 0 H SER A 83 -7.221 -14.846 9.716 1.00 0.00 H new ATOM 0 HA SER A 83 -4.396 -14.397 10.082 1.00 0.00 H new ATOM 0 HB2 SER A 83 -6.833 -13.736 11.776 1.00 0.00 H new ATOM 0 HB3 SER A 83 -5.202 -13.189 12.113 1.00 0.00 H new ATOM 0 HG SER A 83 -6.928 -12.474 9.969 1.00 0.00 H new ATOM 1291 N GLY A 84 -6.051 -16.584 11.902 1.00 0.00 N ATOM 1292 CA GLY A 84 -5.891 -17.696 12.814 1.00 0.00 C ATOM 1293 C GLY A 84 -5.455 -18.962 12.106 1.00 0.00 C ATOM 1294 O GLY A 84 -4.595 -19.688 12.599 1.00 0.00 O ATOM 0 H GLY A 84 -7.002 -16.446 11.561 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -5.155 -17.436 13.575 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -6.833 -17.878 13.331 1.00 0.00 H new ATOM 1298 N GLY A 85 -6.041 -19.227 10.946 1.00 0.00 N ATOM 1299 CA GLY A 85 -5.690 -20.410 10.201 1.00 0.00 C ATOM 1300 C GLY A 85 -6.699 -20.712 9.119 1.00 0.00 C ATOM 1301 O GLY A 85 -7.898 -20.510 9.304 1.00 0.00 O ATOM 0 H GLY A 85 -6.753 -18.641 10.511 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -4.705 -20.278 9.753 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -5.620 -21.260 10.880 1.00 0.00 H new ATOM 1305 N ILE A 86 -6.218 -21.199 7.989 1.00 0.00 N ATOM 1306 CA ILE A 86 -7.086 -21.521 6.867 1.00 0.00 C ATOM 1307 C ILE A 86 -7.619 -22.941 7.023 1.00 0.00 C ATOM 1308 O ILE A 86 -8.557 -23.354 6.343 1.00 0.00 O ATOM 1309 CB ILE A 86 -6.323 -21.396 5.535 1.00 0.00 C ATOM 1310 CG1 ILE A 86 -7.285 -21.398 4.348 1.00 0.00 C ATOM 1311 CG2 ILE A 86 -5.315 -22.528 5.405 1.00 0.00 C ATOM 1312 CD1 ILE A 86 -6.615 -21.063 3.033 1.00 0.00 C ATOM 0 H ILE A 86 -5.228 -21.381 7.822 1.00 0.00 H new ATOM 0 HA ILE A 86 -7.918 -20.817 6.857 1.00 0.00 H new ATOM 0 HB ILE A 86 -5.791 -20.445 5.532 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -7.752 -22.380 4.270 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -8.083 -20.679 4.535 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.780 -22.432 4.460 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -4.605 -22.480 6.231 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -5.837 -23.485 5.431 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -7.355 -21.082 2.233 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -6.171 -20.069 3.094 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.836 -21.796 2.824 1.00 0.00 H new ATOM 1324 N ASP A 87 -7.013 -23.676 7.951 1.00 0.00 N ATOM 1325 CA ASP A 87 -7.371 -25.067 8.202 1.00 0.00 C ATOM 1326 C ASP A 87 -8.803 -25.166 8.719 1.00 0.00 C ATOM 1327 O ASP A 87 -9.441 -26.212 8.619 1.00 0.00 O ATOM 1328 CB ASP A 87 -6.396 -25.681 9.209 1.00 0.00 C ATOM 1329 CG ASP A 87 -6.234 -27.174 9.028 1.00 0.00 C ATOM 1330 OD1 ASP A 87 -6.754 -27.949 9.858 1.00 0.00 O ATOM 1331 OD2 ASP A 87 -5.570 -27.582 8.048 1.00 0.00 O ATOM 0 H ASP A 87 -6.263 -23.325 8.547 1.00 0.00 H new ATOM 0 HA ASP A 87 -7.308 -25.621 7.265 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.424 -25.199 9.107 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -6.748 -25.478 10.220 1.00 0.00 H new ATOM 1336 N GLY A 88 -9.302 -24.065 9.266 1.00 0.00 N ATOM 1337 CA GLY A 88 -10.667 -24.025 9.743 1.00 0.00 C ATOM 1338 C GLY A 88 -11.494 -22.981 9.018 1.00 0.00 C ATOM 1339 O GLY A 88 -12.478 -22.474 9.560 1.00 0.00 O ATOM 0 H GLY A 88 -8.781 -23.196 9.387 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -11.125 -25.005 9.612 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.671 -23.812 10.812 1.00 0.00 H new ATOM 1343 N PHE A 89 -11.100 -22.656 7.791 1.00 0.00 N ATOM 1344 CA PHE A 89 -11.818 -21.675 7.004 1.00 0.00 C ATOM 1345 C PHE A 89 -13.028 -22.323 6.356 1.00 0.00 C ATOM 1346 O PHE A 89 -12.957 -23.436 5.833 1.00 0.00 O ATOM 1347 CB PHE A 89 -10.914 -21.059 5.928 1.00 0.00 C ATOM 1348 CG PHE A 89 -11.526 -19.874 5.218 1.00 0.00 C ATOM 1349 CD1 PHE A 89 -12.499 -20.050 4.246 1.00 0.00 C ATOM 1350 CD2 PHE A 89 -11.128 -18.583 5.526 1.00 0.00 C ATOM 1351 CE1 PHE A 89 -13.061 -18.963 3.599 1.00 0.00 C ATOM 1352 CE2 PHE A 89 -11.683 -17.496 4.880 1.00 0.00 C ATOM 1353 CZ PHE A 89 -12.651 -17.686 3.916 1.00 0.00 C ATOM 0 H PHE A 89 -10.287 -23.060 7.325 1.00 0.00 H new ATOM 0 HA PHE A 89 -12.145 -20.876 7.669 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -9.976 -20.749 6.389 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -10.669 -21.824 5.192 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -12.823 -21.048 3.990 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -10.373 -18.425 6.282 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -13.820 -19.116 2.846 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -11.359 -16.497 5.130 1.00 0.00 H new ATOM 0 HZ PHE A 89 -13.086 -16.836 3.411 1.00 0.00 H new ATOM 1363 N GLY A 90 -14.133 -21.615 6.404 1.00 0.00 N ATOM 1364 CA GLY A 90 -15.357 -22.098 5.817 1.00 0.00 C ATOM 1365 C GLY A 90 -16.554 -21.449 6.459 1.00 0.00 C ATOM 1366 O GLY A 90 -16.441 -20.349 7.007 1.00 0.00 O ATOM 0 H GLY A 90 -14.207 -20.699 6.846 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -15.357 -21.892 4.747 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -15.419 -23.180 5.934 1.00 0.00 H new ATOM 1370 N SER A 91 -17.684 -22.140 6.427 1.00 0.00 N ATOM 1371 CA SER A 91 -18.926 -21.627 6.991 1.00 0.00 C ATOM 1372 C SER A 91 -18.849 -21.583 8.518 1.00 0.00 C ATOM 1373 O SER A 91 -19.776 -21.134 9.189 1.00 0.00 O ATOM 1374 CB SER A 91 -20.093 -22.505 6.543 1.00 0.00 C ATOM 1375 OG SER A 91 -19.989 -22.822 5.164 1.00 0.00 O ATOM 0 H SER A 91 -17.767 -23.068 6.012 1.00 0.00 H new ATOM 0 HA SER A 91 -19.083 -20.610 6.631 1.00 0.00 H new ATOM 0 HB2 SER A 91 -20.109 -23.423 7.131 1.00 0.00 H new ATOM 0 HB3 SER A 91 -21.035 -21.989 6.731 1.00 0.00 H new ATOM 0 HG SER A 91 -20.628 -22.281 4.655 1.00 0.00 H new ATOM 1381 N ASN A 92 -17.728 -22.051 9.050 1.00 0.00 N ATOM 1382 CA ASN A 92 -17.466 -22.006 10.477 1.00 0.00 C ATOM 1383 C ASN A 92 -17.220 -20.567 10.904 1.00 0.00 C ATOM 1384 O ASN A 92 -17.684 -20.128 11.954 1.00 0.00 O ATOM 1385 CB ASN A 92 -16.242 -22.866 10.816 1.00 0.00 C ATOM 1386 CG ASN A 92 -15.879 -22.820 12.288 1.00 0.00 C ATOM 1387 OD1 ASN A 92 -16.747 -22.714 13.154 1.00 0.00 O ATOM 1388 ND2 ASN A 92 -14.590 -22.886 12.584 1.00 0.00 N ATOM 0 H ASN A 92 -16.977 -22.472 8.503 1.00 0.00 H new ATOM 0 HA ASN A 92 -18.331 -22.399 11.011 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -16.438 -23.899 10.527 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -15.391 -22.526 10.226 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -14.288 -22.849 13.557 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -13.899 -22.974 11.839 1.00 0.00 H new ATOM 1395 N ASN A 93 -16.502 -19.831 10.063 1.00 0.00 N ATOM 1396 CA ASN A 93 -16.154 -18.451 10.370 1.00 0.00 C ATOM 1397 C ASN A 93 -16.781 -17.498 9.369 1.00 0.00 C ATOM 1398 O ASN A 93 -17.546 -16.603 9.731 1.00 0.00 O ATOM 1399 CB ASN A 93 -14.636 -18.237 10.344 1.00 0.00 C ATOM 1400 CG ASN A 93 -13.875 -19.097 11.327 1.00 0.00 C ATOM 1401 OD1 ASN A 93 -14.377 -19.456 12.393 1.00 0.00 O ATOM 1402 ND2 ASN A 93 -12.645 -19.424 10.968 1.00 0.00 N ATOM 0 H ASN A 93 -16.151 -20.167 9.166 1.00 0.00 H new ATOM 0 HA ASN A 93 -16.535 -18.248 11.371 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -14.268 -18.441 9.338 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -14.424 -17.189 10.554 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -12.069 -19.997 11.585 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -12.272 -19.103 10.075 1.00 0.00 H new ATOM 1409 N ALA A 94 -16.451 -17.704 8.102 1.00 0.00 N ATOM 1410 CA ALA A 94 -16.826 -16.777 7.052 1.00 0.00 C ATOM 1411 C ALA A 94 -18.186 -17.119 6.476 1.00 0.00 C ATOM 1412 O ALA A 94 -18.315 -17.999 5.631 1.00 0.00 O ATOM 1413 CB ALA A 94 -15.766 -16.752 5.960 1.00 0.00 C ATOM 0 H ALA A 94 -15.920 -18.512 7.778 1.00 0.00 H new ATOM 0 HA ALA A 94 -16.894 -15.781 7.490 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -16.064 -16.051 5.180 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -14.813 -16.438 6.385 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -15.662 -17.749 5.531 1.00 0.00 H new ATOM 1419 N VAL A 95 -19.199 -16.438 6.969 1.00 0.00 N ATOM 1420 CA VAL A 95 -20.538 -16.554 6.426 1.00 0.00 C ATOM 1421 C VAL A 95 -21.154 -15.180 6.268 1.00 0.00 C ATOM 1422 O VAL A 95 -21.022 -14.328 7.150 1.00 0.00 O ATOM 1423 CB VAL A 95 -21.463 -17.417 7.312 1.00 0.00 C ATOM 1424 CG1 VAL A 95 -21.170 -18.895 7.118 1.00 0.00 C ATOM 1425 CG2 VAL A 95 -21.327 -17.035 8.783 1.00 0.00 C ATOM 0 H VAL A 95 -19.119 -15.791 7.754 1.00 0.00 H new ATOM 0 HA VAL A 95 -20.444 -17.046 5.458 1.00 0.00 H new ATOM 0 HB VAL A 95 -22.491 -17.226 7.005 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -21.833 -19.484 7.752 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -21.332 -19.164 6.074 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -20.134 -19.099 7.389 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -21.989 -17.658 9.384 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -20.296 -17.186 9.104 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -21.598 -15.987 8.913 1.00 0.00 H new ATOM 1435 N THR A 96 -21.800 -14.948 5.145 1.00 0.00 N ATOM 1436 CA THR A 96 -22.509 -13.707 4.948 1.00 0.00 C ATOM 1437 C THR A 96 -23.848 -13.759 5.659 1.00 0.00 C ATOM 1438 O THR A 96 -24.777 -14.439 5.215 1.00 0.00 O ATOM 1439 CB THR A 96 -22.713 -13.400 3.461 1.00 0.00 C ATOM 1440 OG1 THR A 96 -23.006 -14.606 2.746 1.00 0.00 O ATOM 1441 CG2 THR A 96 -21.483 -12.728 2.872 1.00 0.00 C ATOM 0 H THR A 96 -21.848 -15.599 4.361 1.00 0.00 H new ATOM 0 HA THR A 96 -21.903 -12.905 5.370 1.00 0.00 H new ATOM 0 HB THR A 96 -23.555 -12.715 3.365 1.00 0.00 H new ATOM 0 HG1 THR A 96 -22.953 -14.436 1.782 1.00 0.00 H new ATOM 0 HG21 THR A 96 -21.653 -12.520 1.816 1.00 0.00 H new ATOM 0 HG22 THR A 96 -21.291 -11.794 3.399 1.00 0.00 H new ATOM 0 HG23 THR A 96 -20.622 -13.388 2.978 1.00 0.00 H new ATOM 1449 N THR A 97 -23.922 -13.081 6.796 1.00 0.00 N ATOM 1450 CA THR A 97 -25.153 -12.994 7.560 1.00 0.00 C ATOM 1451 C THR A 97 -26.176 -12.105 6.850 1.00 0.00 C ATOM 1452 O THR A 97 -26.532 -11.025 7.326 1.00 0.00 O ATOM 1453 CB THR A 97 -24.877 -12.478 8.988 1.00 0.00 C ATOM 1454 OG1 THR A 97 -23.949 -11.380 8.953 1.00 0.00 O ATOM 1455 CG2 THR A 97 -24.317 -13.593 9.857 1.00 0.00 C ATOM 0 H THR A 97 -23.136 -12.580 7.210 1.00 0.00 H new ATOM 0 HA THR A 97 -25.573 -13.997 7.636 1.00 0.00 H new ATOM 0 HB THR A 97 -25.819 -12.135 9.415 1.00 0.00 H new ATOM 0 HG1 THR A 97 -23.784 -11.062 9.865 1.00 0.00 H new ATOM 0 HG21 THR A 97 -24.128 -13.212 10.861 1.00 0.00 H new ATOM 0 HG22 THR A 97 -25.036 -14.410 9.909 1.00 0.00 H new ATOM 0 HG23 THR A 97 -23.385 -13.957 9.426 1.00 0.00 H new ATOM 1463 N CYS A 98 -26.616 -12.565 5.690 1.00 0.00 N ATOM 1464 CA CYS A 98 -27.602 -11.859 4.893 1.00 0.00 C ATOM 1465 C CYS A 98 -28.851 -12.716 4.770 1.00 0.00 C ATOM 1466 O CYS A 98 -28.902 -13.642 3.958 1.00 0.00 O ATOM 1467 CB CYS A 98 -27.035 -11.553 3.504 1.00 0.00 C ATOM 1468 SG CYS A 98 -25.398 -10.759 3.535 1.00 0.00 S ATOM 0 H CYS A 98 -26.298 -13.441 5.275 1.00 0.00 H new ATOM 0 HA CYS A 98 -27.854 -10.917 5.379 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -26.967 -12.482 2.937 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -27.732 -10.905 2.972 1.00 0.00 H new ATOM 1473 N GLY A 99 -29.841 -12.432 5.598 1.00 0.00 N ATOM 1474 CA GLY A 99 -31.048 -13.217 5.598 1.00 0.00 C ATOM 1475 C GLY A 99 -32.266 -12.344 5.708 1.00 0.00 C ATOM 1476 O GLY A 99 -32.199 -11.249 6.273 1.00 0.00 O ATOM 0 H GLY A 99 -29.827 -11.667 6.273 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -31.101 -13.806 4.682 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -31.026 -13.921 6.429 1.00 0.00 H new ATOM 1480 N ASN A 100 -33.375 -12.803 5.169 1.00 0.00 N ATOM 1481 CA ASN A 100 -34.593 -12.018 5.197 1.00 0.00 C ATOM 1482 C ASN A 100 -35.739 -12.833 5.777 1.00 0.00 C ATOM 1483 O ASN A 100 -35.793 -14.052 5.613 1.00 0.00 O ATOM 1484 CB ASN A 100 -34.962 -11.516 3.794 1.00 0.00 C ATOM 1485 CG ASN A 100 -35.345 -12.636 2.840 1.00 0.00 C ATOM 1486 OD1 ASN A 100 -36.509 -13.031 2.768 1.00 0.00 O ATOM 1487 ND2 ASN A 100 -34.375 -13.148 2.100 1.00 0.00 N ATOM 0 H ASN A 100 -33.460 -13.709 4.709 1.00 0.00 H new ATOM 0 HA ASN A 100 -34.416 -11.152 5.834 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -35.792 -10.814 3.873 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -34.118 -10.966 3.378 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -34.579 -13.898 1.440 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -33.423 -12.792 2.190 1.00 0.00 H new ATOM 1494 N GLY A 101 -36.634 -12.158 6.476 1.00 0.00 N ATOM 1495 CA GLY A 101 -37.813 -12.811 7.003 1.00 0.00 C ATOM 1496 C GLY A 101 -39.050 -12.417 6.231 1.00 0.00 C ATOM 1497 O GLY A 101 -40.068 -12.045 6.814 1.00 0.00 O ATOM 0 H GLY A 101 -36.565 -11.163 6.690 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -37.683 -13.892 6.958 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -37.938 -12.548 8.053 1.00 0.00 H new ATOM 1501 N SER A 102 -38.954 -12.473 4.911 1.00 0.00 N ATOM 1502 CA SER A 102 -40.050 -12.073 4.049 1.00 0.00 C ATOM 1503 C SER A 102 -40.714 -13.299 3.427 1.00 0.00 C ATOM 1504 O SER A 102 -41.697 -13.802 4.014 1.00 0.00 O ATOM 1505 CB SER A 102 -39.529 -11.126 2.970 1.00 0.00 C ATOM 1506 OG SER A 102 -38.808 -10.051 3.554 1.00 0.00 O ATOM 0 H SER A 102 -38.123 -12.794 4.414 1.00 0.00 H new ATOM 0 HA SER A 102 -40.803 -11.551 4.640 1.00 0.00 H new ATOM 0 HB2 SER A 102 -38.884 -11.671 2.280 1.00 0.00 H new ATOM 0 HB3 SER A 102 -40.363 -10.737 2.386 1.00 0.00 H new ATOM 0 HG SER A 102 -38.480 -9.455 2.848 1.00 0.00 H new TER 1512 SER A 102