USER MOD reduce.3.24.130724 H: found=0, std=0, add=968, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 961 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 57 LYS NZ :NH3+ -163:sc= 2.72 (180deg=0.814) USER MOD Set 1.2: A 110 HIS : no HE2:sc= -0.744 K(o=2,f=-12!) USER MOD Set 2.1: A 12 HIS : no HD1:sc= -0.0923 K(o=0.21,f=-0.4) USER MOD Set 2.2: A 79 THR OG1 : rot 37:sc= 0.306 USER MOD Set 3.1: A 31 HIS : no HE2:sc= 1.11 K(o=-0.23,f=-9.2!) USER MOD Set 3.2: A 34 GLN : amide:sc= -1.34! K(o=-0.23!,f=-2.1) USER MOD Set 4.1: A 24 HIS : no HE2:sc= 1.08 K(o=0.79,f=-3.6!) USER MOD Set 4.2: A 28 GLN : amide:sc= -0.283 X(o=0.79,f=0.8) USER MOD Single : A 1 GLY N :NH3+ -140:sc= 0.108 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 ASN : amide:sc= 0.0545 K(o=0.054,f=-1) USER MOD Single : A 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 35:sc= 1.23 USER MOD Single : A 10 LYS NZ :NH3+ 144:sc= 1.33 (180deg=-0.0676) USER MOD Single : A 13 MET CE :methyl -168:sc= 0 (180deg=-0.233) USER MOD Single : A 14 LYS NZ :NH3+ 140:sc= 0.971 (180deg=0.196) USER MOD Single : A 15 LYS NZ :NH3+ -133:sc= 0.355 (180deg=-0.759!) USER MOD Single : A 16 MET CE :methyl 159:sc= 0 (180deg=-0.0381) USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ -176:sc= 0.701 (180deg=0.682) USER MOD Single : A 29 SER OG : rot -39:sc= 1.23 USER MOD Single : A 38 HIS : no HE2:sc= -0.476 K(o=-0.48,f=-2.9!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 GLN : amide:sc= 0 K(o=0,f=-0.87) USER MOD Single : A 44 HIS : no HD1:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0.26 USER MOD Single : A 51 LYS NZ :NH3+ -175:sc= 1.25 (180deg=1.23) USER MOD Single : A 53 HIS : no HE2:sc= -0.682 X(o=-0.68,f=-0.61) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 ASN : amide:sc=-0.00823 K(o=-0.0082,f=-0.7) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= 0.00481 X(o=0.0048,f=0) USER MOD Single : A 70 GLN : amide:sc= 0.694 K(o=0.69,f=-0.12) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 ASN : amide:sc= -0.15 K(o=-0.15,f=-7.8!) USER MOD Single : A 84 SER OG : rot 180:sc= 0.0772 USER MOD Single : A 86 GLN : amide:sc= -0.637 K(o=-0.64,f=-2.3!) USER MOD Single : A 87 LYS NZ :NH3+ 176:sc= 1.27 (180deg=1.19) USER MOD Single : A 88 TYR OH : rot 4:sc= 1.32 USER MOD Single : A 95 GLN : amide:sc= 0.344 X(o=0.34,f=-0.099) USER MOD Single : A 102 LYS NZ :NH3+ 171:sc= -0.235 (180deg=-0.319) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot -23:sc= 1.24 USER MOD Single : A 111 SER OG : rot -80:sc= 1.12 USER MOD Single : A 112 SER OG : rot 47:sc= 1.29 USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 2.508 38.560 -1.804 1.00 0.00 N ATOM 2 CA GLY A 1 2.466 37.203 -2.391 1.00 0.00 C ATOM 3 C GLY A 1 3.461 36.290 -1.731 1.00 0.00 C ATOM 4 O GLY A 1 3.837 36.551 -0.599 1.00 0.00 O ATOM 0 H1 GLY A 1 1.540 38.929 -1.714 1.00 0.00 H new ATOM 0 H2 GLY A 1 2.951 38.518 -0.864 1.00 0.00 H new ATOM 0 H3 GLY A 1 3.062 39.188 -2.420 1.00 0.00 H new ATOM 0 HA2 GLY A 1 1.463 36.789 -2.284 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.675 37.260 -3.459 1.00 0.00 H new ATOM 10 N SER A 2 3.882 35.246 -2.435 1.00 0.00 N ATOM 11 CA SER A 2 4.900 34.299 -1.954 1.00 0.00 C ATOM 12 C SER A 2 4.716 33.692 -0.556 1.00 0.00 C ATOM 13 O SER A 2 5.570 33.863 0.316 1.00 0.00 O ATOM 14 CB SER A 2 6.276 34.961 -2.031 1.00 0.00 C ATOM 15 OG SER A 2 6.515 35.407 -3.353 1.00 0.00 O ATOM 0 H SER A 2 3.528 35.025 -3.365 1.00 0.00 H new ATOM 0 HA SER A 2 4.789 33.445 -2.622 1.00 0.00 H new ATOM 0 HB2 SER A 2 6.326 35.801 -1.338 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.049 34.253 -1.730 1.00 0.00 H new ATOM 0 HG SER A 2 7.397 35.832 -3.400 1.00 0.00 H new ATOM 21 N PRO A 3 3.605 32.962 -0.322 1.00 0.00 N ATOM 22 CA PRO A 3 3.584 32.279 0.980 1.00 0.00 C ATOM 23 C PRO A 3 4.611 31.134 1.008 1.00 0.00 C ATOM 24 O PRO A 3 5.314 30.931 2.010 1.00 0.00 O ATOM 25 CB PRO A 3 2.142 31.768 1.076 1.00 0.00 C ATOM 26 CG PRO A 3 1.710 31.581 -0.338 1.00 0.00 C ATOM 27 CD PRO A 3 2.398 32.669 -1.122 1.00 0.00 C ATOM 0 HA PRO A 3 3.854 32.919 1.820 1.00 0.00 H new ATOM 0 HB2 PRO A 3 2.090 30.832 1.633 1.00 0.00 H new ATOM 0 HB3 PRO A 3 1.503 32.483 1.594 1.00 0.00 H new ATOM 0 HG2 PRO A 3 1.992 30.595 -0.706 1.00 0.00 H new ATOM 0 HG3 PRO A 3 0.627 31.658 -0.430 1.00 0.00 H new ATOM 0 HD2 PRO A 3 2.654 32.337 -2.128 1.00 0.00 H new ATOM 0 HD3 PRO A 3 1.764 33.549 -1.228 1.00 0.00 H new ATOM 35 N GLU A 4 4.689 30.430 -0.117 1.00 0.00 N ATOM 36 CA GLU A 4 5.628 29.342 -0.376 1.00 0.00 C ATOM 37 C GLU A 4 5.763 28.276 0.725 1.00 0.00 C ATOM 38 O GLU A 4 4.982 28.231 1.680 1.00 0.00 O ATOM 39 CB GLU A 4 6.980 29.966 -0.779 1.00 0.00 C ATOM 40 CG GLU A 4 7.162 30.070 -2.307 1.00 0.00 C ATOM 41 CD GLU A 4 6.272 31.138 -2.966 1.00 0.00 C ATOM 42 OE1 GLU A 4 6.825 32.115 -3.513 1.00 0.00 O ATOM 43 OE2 GLU A 4 5.022 31.001 -2.948 1.00 0.00 O ATOM 0 H GLU A 4 4.072 30.610 -0.909 1.00 0.00 H new ATOM 0 HA GLU A 4 5.213 28.752 -1.193 1.00 0.00 H new ATOM 0 HB2 GLU A 4 7.060 30.961 -0.340 1.00 0.00 H new ATOM 0 HB3 GLU A 4 7.790 29.367 -0.362 1.00 0.00 H new ATOM 0 HG2 GLU A 4 8.206 30.295 -2.525 1.00 0.00 H new ATOM 0 HG3 GLU A 4 6.944 29.101 -2.756 1.00 0.00 H new ATOM 50 N PHE A 5 6.756 27.407 0.575 1.00 0.00 N ATOM 51 CA PHE A 5 6.995 26.313 1.514 1.00 0.00 C ATOM 52 C PHE A 5 7.063 26.823 2.946 1.00 0.00 C ATOM 53 O PHE A 5 6.621 26.156 3.866 1.00 0.00 O ATOM 54 CB PHE A 5 8.307 25.610 1.158 1.00 0.00 C ATOM 55 CG PHE A 5 8.661 24.480 2.087 1.00 0.00 C ATOM 56 CD1 PHE A 5 9.534 24.694 3.172 1.00 0.00 C ATOM 57 CD2 PHE A 5 8.125 23.195 1.886 1.00 0.00 C ATOM 58 CE1 PHE A 5 9.879 23.633 4.044 1.00 0.00 C ATOM 59 CE2 PHE A 5 8.465 22.127 2.752 1.00 0.00 C ATOM 60 CZ PHE A 5 9.345 22.346 3.826 1.00 0.00 C ATOM 0 H PHE A 5 7.419 27.439 -0.200 1.00 0.00 H new ATOM 0 HA PHE A 5 6.165 25.611 1.440 1.00 0.00 H new ATOM 0 HB2 PHE A 5 8.237 25.224 0.141 1.00 0.00 H new ATOM 0 HB3 PHE A 5 9.115 26.342 1.167 1.00 0.00 H new ATOM 0 HD1 PHE A 5 9.945 25.679 3.341 1.00 0.00 H new ATOM 0 HD2 PHE A 5 7.447 23.021 1.063 1.00 0.00 H new ATOM 0 HE1 PHE A 5 10.549 23.809 4.873 1.00 0.00 H new ATOM 0 HE2 PHE A 5 8.048 21.144 2.587 1.00 0.00 H new ATOM 0 HZ PHE A 5 9.611 21.531 4.482 1.00 0.00 H new ATOM 70 N ASN A 6 7.602 28.016 3.133 1.00 0.00 N ATOM 71 CA ASN A 6 7.711 28.600 4.461 1.00 0.00 C ATOM 72 C ASN A 6 6.343 28.743 5.138 1.00 0.00 C ATOM 73 O ASN A 6 6.119 28.184 6.211 1.00 0.00 O ATOM 74 CB ASN A 6 8.393 29.970 4.376 1.00 0.00 C ATOM 75 CG ASN A 6 9.764 29.890 3.758 1.00 0.00 C ATOM 76 OD1 ASN A 6 9.898 29.799 2.551 1.00 0.00 O ATOM 77 ND2 ASN A 6 10.781 29.913 4.575 1.00 0.00 N ATOM 0 H ASN A 6 7.971 28.600 2.383 1.00 0.00 H new ATOM 0 HA ASN A 6 8.313 27.925 5.068 1.00 0.00 H new ATOM 0 HB2 ASN A 6 7.772 30.647 3.789 1.00 0.00 H new ATOM 0 HB3 ASN A 6 8.472 30.396 5.376 1.00 0.00 H new ATOM 0 HD21 ASN A 6 11.731 29.854 4.209 1.00 0.00 H new ATOM 0 HD22 ASN A 6 10.626 29.990 5.580 1.00 0.00 H new ATOM 84 N ARG A 7 5.409 29.469 4.532 1.00 0.00 N ATOM 85 CA ARG A 7 4.113 29.677 5.192 1.00 0.00 C ATOM 86 C ARG A 7 3.217 28.463 5.028 1.00 0.00 C ATOM 87 O ARG A 7 2.180 28.356 5.689 1.00 0.00 O ATOM 88 CB ARG A 7 3.418 30.941 4.687 1.00 0.00 C ATOM 89 CG ARG A 7 4.256 32.199 4.899 1.00 0.00 C ATOM 90 CD ARG A 7 3.447 33.459 4.660 1.00 0.00 C ATOM 91 NE ARG A 7 4.325 34.640 4.594 1.00 0.00 N ATOM 92 CZ ARG A 7 3.919 35.904 4.616 1.00 0.00 C ATOM 93 NH1 ARG A 7 2.654 36.232 4.718 1.00 0.00 N ATOM 94 NH2 ARG A 7 4.806 36.857 4.538 1.00 0.00 N ATOM 0 H ARG A 7 5.512 29.911 3.619 1.00 0.00 H new ATOM 0 HA ARG A 7 4.308 29.814 6.256 1.00 0.00 H new ATOM 0 HB2 ARG A 7 3.199 30.830 3.625 1.00 0.00 H new ATOM 0 HB3 ARG A 7 2.463 31.055 5.200 1.00 0.00 H new ATOM 0 HG2 ARG A 7 4.650 32.207 5.915 1.00 0.00 H new ATOM 0 HG3 ARG A 7 5.113 32.183 4.225 1.00 0.00 H new ATOM 0 HD2 ARG A 7 2.886 33.365 3.730 1.00 0.00 H new ATOM 0 HD3 ARG A 7 2.719 33.586 5.461 1.00 0.00 H new ATOM 0 HE ARG A 7 5.329 34.473 4.526 1.00 0.00 H new ATOM 0 HH11 ARG A 7 1.942 35.504 4.784 1.00 0.00 H new ATOM 0 HH12 ARG A 7 2.381 37.215 4.732 1.00 0.00 H new ATOM 0 HH21 ARG A 7 5.797 36.627 4.461 1.00 0.00 H new ATOM 0 HH22 ARG A 7 4.509 37.833 4.554 1.00 0.00 H new ATOM 108 N TYR A 8 3.623 27.532 4.182 1.00 0.00 N ATOM 109 CA TYR A 8 2.876 26.294 4.031 1.00 0.00 C ATOM 110 C TYR A 8 3.342 25.278 5.062 1.00 0.00 C ATOM 111 O TYR A 8 2.625 24.336 5.330 1.00 0.00 O ATOM 112 CB TYR A 8 3.083 25.674 2.643 1.00 0.00 C ATOM 113 CG TYR A 8 2.484 26.442 1.472 1.00 0.00 C ATOM 114 CD1 TYR A 8 2.960 26.213 0.163 1.00 0.00 C ATOM 115 CD2 TYR A 8 1.440 27.384 1.649 1.00 0.00 C ATOM 116 CE1 TYR A 8 2.409 26.905 -0.944 1.00 0.00 C ATOM 117 CE2 TYR A 8 0.893 28.076 0.539 1.00 0.00 C ATOM 118 CZ TYR A 8 1.383 27.828 -0.743 1.00 0.00 C ATOM 119 OH TYR A 8 0.851 28.495 -1.818 1.00 0.00 O ATOM 0 H TYR A 8 4.454 27.607 3.596 1.00 0.00 H new ATOM 0 HA TYR A 8 1.822 26.537 4.167 1.00 0.00 H new ATOM 0 HB2 TYR A 8 4.154 25.566 2.471 1.00 0.00 H new ATOM 0 HB3 TYR A 8 2.658 24.670 2.648 1.00 0.00 H new ATOM 0 HD1 TYR A 8 3.755 25.500 0.003 1.00 0.00 H new ATOM 0 HD2 TYR A 8 1.057 27.577 2.640 1.00 0.00 H new ATOM 0 HE1 TYR A 8 2.782 26.718 -1.940 1.00 0.00 H new ATOM 0 HE2 TYR A 8 0.099 28.793 0.686 1.00 0.00 H new ATOM 0 HH TYR A 8 0.145 29.101 -1.510 1.00 0.00 H new ATOM 129 N SER A 9 4.527 25.467 5.647 1.00 0.00 N ATOM 130 CA SER A 9 5.136 24.448 6.528 1.00 0.00 C ATOM 131 C SER A 9 4.189 23.830 7.556 1.00 0.00 C ATOM 132 O SER A 9 4.268 22.645 7.822 1.00 0.00 O ATOM 133 CB SER A 9 6.353 25.025 7.255 1.00 0.00 C ATOM 134 OG SER A 9 7.396 25.341 6.346 1.00 0.00 O ATOM 0 H SER A 9 5.088 26.311 5.532 1.00 0.00 H new ATOM 0 HA SER A 9 5.424 23.641 5.855 1.00 0.00 H new ATOM 0 HB2 SER A 9 6.061 25.921 7.802 1.00 0.00 H new ATOM 0 HB3 SER A 9 6.714 24.306 7.990 1.00 0.00 H new ATOM 0 HG SER A 9 7.010 25.665 5.505 1.00 0.00 H new ATOM 140 N LYS A 10 3.281 24.617 8.113 1.00 0.00 N ATOM 141 CA LYS A 10 2.286 24.094 9.058 1.00 0.00 C ATOM 142 C LYS A 10 1.512 22.877 8.502 1.00 0.00 C ATOM 143 O LYS A 10 1.584 21.771 9.050 1.00 0.00 O ATOM 144 CB LYS A 10 1.303 25.215 9.471 1.00 0.00 C ATOM 145 CG LYS A 10 0.860 26.187 8.331 1.00 0.00 C ATOM 146 CD LYS A 10 -0.653 26.144 8.102 1.00 0.00 C ATOM 147 CE LYS A 10 -1.086 27.076 6.961 1.00 0.00 C ATOM 148 NZ LYS A 10 -0.390 26.780 5.663 1.00 0.00 N ATOM 0 H LYS A 10 3.206 25.618 7.933 1.00 0.00 H new ATOM 0 HA LYS A 10 2.832 23.745 9.934 1.00 0.00 H new ATOM 0 HB2 LYS A 10 0.412 24.752 9.895 1.00 0.00 H new ATOM 0 HB3 LYS A 10 1.765 25.803 10.264 1.00 0.00 H new ATOM 0 HG2 LYS A 10 1.160 27.204 8.583 1.00 0.00 H new ATOM 0 HG3 LYS A 10 1.375 25.922 7.407 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -0.956 25.123 7.872 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -1.167 26.430 9.019 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -2.163 26.989 6.817 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -0.885 28.108 7.247 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -1.049 26.933 4.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 0.430 27.411 5.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -0.069 25.791 5.659 1.00 0.00 H new ATOM 162 N GLU A 11 0.768 23.078 7.426 1.00 0.00 N ATOM 163 CA GLU A 11 -0.058 22.009 6.881 1.00 0.00 C ATOM 164 C GLU A 11 0.791 21.117 5.999 1.00 0.00 C ATOM 165 O GLU A 11 0.518 19.944 5.886 1.00 0.00 O ATOM 166 CB GLU A 11 -1.261 22.567 6.115 1.00 0.00 C ATOM 167 CG GLU A 11 -2.292 21.508 5.717 1.00 0.00 C ATOM 168 CD GLU A 11 -2.831 20.737 6.919 1.00 0.00 C ATOM 169 OE1 GLU A 11 -3.378 21.365 7.856 1.00 0.00 O ATOM 170 OE2 GLU A 11 -2.703 19.494 6.942 1.00 0.00 O ATOM 0 H GLU A 11 0.718 23.960 6.917 1.00 0.00 H new ATOM 0 HA GLU A 11 -0.456 21.417 7.705 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -1.751 23.323 6.729 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -0.905 23.069 5.215 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -3.120 21.989 5.197 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -1.838 20.809 5.015 1.00 0.00 H new ATOM 177 N HIS A 12 1.839 21.663 5.400 1.00 0.00 N ATOM 178 CA HIS A 12 2.748 20.860 4.591 1.00 0.00 C ATOM 179 C HIS A 12 3.273 19.726 5.460 1.00 0.00 C ATOM 180 O HIS A 12 3.192 18.579 5.078 1.00 0.00 O ATOM 181 CB HIS A 12 3.911 21.708 4.062 1.00 0.00 C ATOM 182 CG HIS A 12 4.697 21.050 2.970 1.00 0.00 C ATOM 183 ND1 HIS A 12 5.325 19.833 3.080 1.00 0.00 N ATOM 184 CD2 HIS A 12 4.958 21.465 1.699 1.00 0.00 C ATOM 185 CE1 HIS A 12 5.924 19.567 1.922 1.00 0.00 C ATOM 186 NE2 HIS A 12 5.741 20.534 1.046 1.00 0.00 N ATOM 0 H HIS A 12 2.081 22.652 5.457 1.00 0.00 H new ATOM 0 HA HIS A 12 2.217 20.463 3.726 1.00 0.00 H new ATOM 0 HB2 HIS A 12 3.518 22.655 3.693 1.00 0.00 H new ATOM 0 HB3 HIS A 12 4.582 21.942 4.888 1.00 0.00 H new ATOM 0 HD2 HIS A 12 4.604 22.388 1.265 1.00 0.00 H new ATOM 0 HE1 HIS A 12 6.490 18.669 1.724 1.00 0.00 H new ATOM 0 HE2 HIS A 12 6.100 20.584 0.093 1.00 0.00 H new ATOM 194 N MET A 13 3.794 20.033 6.642 1.00 0.00 N ATOM 195 CA MET A 13 4.303 18.983 7.524 1.00 0.00 C ATOM 196 C MET A 13 3.171 18.132 8.088 1.00 0.00 C ATOM 197 O MET A 13 3.307 16.919 8.169 1.00 0.00 O ATOM 198 CB MET A 13 5.112 19.566 8.688 1.00 0.00 C ATOM 199 CG MET A 13 6.593 19.805 8.373 1.00 0.00 C ATOM 200 SD MET A 13 6.893 21.013 7.062 1.00 0.00 S ATOM 201 CE MET A 13 8.628 21.359 7.298 1.00 0.00 C ATOM 0 H MET A 13 3.876 20.981 7.009 1.00 0.00 H new ATOM 0 HA MET A 13 4.955 18.358 6.914 1.00 0.00 H new ATOM 0 HB2 MET A 13 4.661 20.511 8.991 1.00 0.00 H new ATOM 0 HB3 MET A 13 5.039 18.890 9.540 1.00 0.00 H new ATOM 0 HG2 MET A 13 7.095 20.140 9.281 1.00 0.00 H new ATOM 0 HG3 MET A 13 7.049 18.857 8.088 1.00 0.00 H new ATOM 0 HE1 MET A 13 8.908 22.234 6.711 1.00 0.00 H new ATOM 0 HE2 MET A 13 8.820 21.553 8.353 1.00 0.00 H new ATOM 0 HE3 MET A 13 9.217 20.501 6.974 1.00 0.00 H new ATOM 211 N LYS A 14 2.055 18.745 8.468 1.00 0.00 N ATOM 212 CA LYS A 14 0.931 17.972 9.029 1.00 0.00 C ATOM 213 C LYS A 14 0.379 16.943 8.031 1.00 0.00 C ATOM 214 O LYS A 14 0.197 15.767 8.362 1.00 0.00 O ATOM 215 CB LYS A 14 -0.176 18.935 9.466 1.00 0.00 C ATOM 216 CG LYS A 14 -1.420 18.265 10.021 1.00 0.00 C ATOM 217 CD LYS A 14 -2.371 19.317 10.587 1.00 0.00 C ATOM 218 CE LYS A 14 -3.822 18.853 10.539 1.00 0.00 C ATOM 219 NZ LYS A 14 -4.341 18.910 9.131 1.00 0.00 N ATOM 0 H LYS A 14 1.897 19.751 8.404 1.00 0.00 H new ATOM 0 HA LYS A 14 1.301 17.414 9.889 1.00 0.00 H new ATOM 0 HB2 LYS A 14 0.226 19.608 10.223 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -0.462 19.550 8.612 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -1.919 17.697 9.235 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -1.144 17.555 10.801 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -2.095 19.540 11.618 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -2.267 20.243 10.022 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -3.898 17.835 10.921 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -4.434 19.483 11.185 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -4.935 18.076 8.946 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -4.907 19.773 9.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -3.541 18.920 8.466 1.00 0.00 H new ATOM 233 N LYS A 15 0.124 17.382 6.811 1.00 0.00 N ATOM 234 CA LYS A 15 -0.403 16.517 5.761 1.00 0.00 C ATOM 235 C LYS A 15 0.665 15.517 5.338 1.00 0.00 C ATOM 236 O LYS A 15 0.369 14.343 5.175 1.00 0.00 O ATOM 237 CB LYS A 15 -0.875 17.389 4.588 1.00 0.00 C ATOM 238 CG LYS A 15 -1.484 16.662 3.396 1.00 0.00 C ATOM 239 CD LYS A 15 -2.758 15.898 3.718 1.00 0.00 C ATOM 240 CE LYS A 15 -3.465 15.483 2.422 1.00 0.00 C ATOM 241 NZ LYS A 15 -2.594 14.682 1.504 1.00 0.00 N ATOM 0 H LYS A 15 0.275 18.347 6.517 1.00 0.00 H new ATOM 0 HA LYS A 15 -1.258 15.947 6.125 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -1.611 18.098 4.966 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -0.025 17.971 4.233 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -1.697 17.388 2.612 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -0.748 15.966 2.994 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -2.522 15.015 4.311 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -3.421 16.519 4.321 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -4.352 14.900 2.670 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -3.806 16.377 1.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -2.671 15.057 0.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -1.606 14.744 1.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -2.900 13.688 1.515 1.00 0.00 H new ATOM 255 N MET A 16 1.907 15.968 5.191 1.00 0.00 N ATOM 256 CA MET A 16 3.006 15.069 4.816 1.00 0.00 C ATOM 257 C MET A 16 3.146 13.966 5.846 1.00 0.00 C ATOM 258 O MET A 16 3.370 12.825 5.488 1.00 0.00 O ATOM 259 CB MET A 16 4.330 15.831 4.703 1.00 0.00 C ATOM 260 CG MET A 16 5.528 14.963 4.363 1.00 0.00 C ATOM 261 SD MET A 16 7.061 15.917 4.245 1.00 0.00 S ATOM 262 CE MET A 16 7.424 16.236 5.990 1.00 0.00 C ATOM 0 H MET A 16 2.182 16.941 5.323 1.00 0.00 H new ATOM 0 HA MET A 16 2.771 14.638 3.843 1.00 0.00 H new ATOM 0 HB2 MET A 16 4.227 16.602 3.939 1.00 0.00 H new ATOM 0 HB3 MET A 16 4.523 16.341 5.647 1.00 0.00 H new ATOM 0 HG2 MET A 16 5.641 14.191 5.124 1.00 0.00 H new ATOM 0 HG3 MET A 16 5.347 14.453 3.417 1.00 0.00 H new ATOM 0 HE1 MET A 16 8.482 16.470 6.105 1.00 0.00 H new ATOM 0 HE2 MET A 16 6.826 17.079 6.338 1.00 0.00 H new ATOM 0 HE3 MET A 16 7.182 15.352 6.580 1.00 0.00 H new ATOM 272 N MET A 17 3.005 14.291 7.124 1.00 0.00 N ATOM 273 CA MET A 17 3.075 13.261 8.153 1.00 0.00 C ATOM 274 C MET A 17 1.934 12.281 7.934 1.00 0.00 C ATOM 275 O MET A 17 2.164 11.097 7.849 1.00 0.00 O ATOM 276 CB MET A 17 3.005 13.851 9.562 1.00 0.00 C ATOM 277 CG MET A 17 3.144 12.788 10.644 1.00 0.00 C ATOM 278 SD MET A 17 3.078 13.462 12.308 1.00 0.00 S ATOM 279 CE MET A 17 3.301 11.934 13.264 1.00 0.00 C ATOM 0 H MET A 17 2.845 15.238 7.469 1.00 0.00 H new ATOM 0 HA MET A 17 4.035 12.752 8.072 1.00 0.00 H new ATOM 0 HB2 MET A 17 3.794 14.593 9.682 1.00 0.00 H new ATOM 0 HB3 MET A 17 2.056 14.372 9.688 1.00 0.00 H new ATOM 0 HG2 MET A 17 2.349 12.051 10.525 1.00 0.00 H new ATOM 0 HG3 MET A 17 4.089 12.262 10.509 1.00 0.00 H new ATOM 0 HE1 MET A 17 3.286 12.166 14.329 1.00 0.00 H new ATOM 0 HE2 MET A 17 2.494 11.239 13.032 1.00 0.00 H new ATOM 0 HE3 MET A 17 4.257 11.479 13.005 1.00 0.00 H new ATOM 289 N LYS A 18 0.706 12.773 7.812 1.00 0.00 N ATOM 290 CA LYS A 18 -0.450 11.890 7.577 1.00 0.00 C ATOM 291 C LYS A 18 -0.235 11.019 6.334 1.00 0.00 C ATOM 292 O LYS A 18 -0.595 9.838 6.311 1.00 0.00 O ATOM 293 CB LYS A 18 -1.724 12.741 7.425 1.00 0.00 C ATOM 294 CG LYS A 18 -2.985 11.949 7.029 1.00 0.00 C ATOM 295 CD LYS A 18 -3.473 12.332 5.619 1.00 0.00 C ATOM 296 CE LYS A 18 -3.978 11.122 4.828 1.00 0.00 C ATOM 297 NZ LYS A 18 -2.836 10.350 4.231 1.00 0.00 N ATOM 0 H LYS A 18 0.478 13.765 7.870 1.00 0.00 H new ATOM 0 HA LYS A 18 -0.561 11.224 8.433 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -1.915 13.255 8.367 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -1.543 13.510 6.673 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -2.771 10.881 7.063 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -3.777 12.138 7.753 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -4.273 13.068 5.702 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -2.658 12.806 5.072 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -4.557 10.472 5.483 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -4.649 11.456 4.036 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -3.209 9.576 3.645 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -2.259 10.984 3.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -2.248 9.955 4.993 1.00 0.00 H new ATOM 311 N ASP A 19 0.339 11.593 5.295 1.00 0.00 N ATOM 312 CA ASP A 19 0.581 10.854 4.061 1.00 0.00 C ATOM 313 C ASP A 19 1.676 9.804 4.235 1.00 0.00 C ATOM 314 O ASP A 19 1.591 8.724 3.666 1.00 0.00 O ATOM 315 CB ASP A 19 0.944 11.821 2.942 1.00 0.00 C ATOM 316 CG ASP A 19 -0.177 12.797 2.629 1.00 0.00 C ATOM 317 OD1 ASP A 19 0.125 13.892 2.131 1.00 0.00 O ATOM 318 OD2 ASP A 19 -1.373 12.481 2.891 1.00 0.00 O ATOM 0 H ASP A 19 0.647 12.565 5.275 1.00 0.00 H new ATOM 0 HA ASP A 19 -0.336 10.326 3.799 1.00 0.00 H new ATOM 0 HB2 ASP A 19 1.838 12.378 3.223 1.00 0.00 H new ATOM 0 HB3 ASP A 19 1.190 11.255 2.043 1.00 0.00 H new ATOM 323 N LEU A 20 2.695 10.104 5.025 1.00 0.00 N ATOM 324 CA LEU A 20 3.778 9.149 5.260 1.00 0.00 C ATOM 325 C LEU A 20 3.416 8.095 6.298 1.00 0.00 C ATOM 326 O LEU A 20 3.930 6.990 6.239 1.00 0.00 O ATOM 327 CB LEU A 20 5.069 9.865 5.653 1.00 0.00 C ATOM 328 CG LEU A 20 5.748 10.636 4.505 1.00 0.00 C ATOM 329 CD1 LEU A 20 7.026 11.287 5.032 1.00 0.00 C ATOM 330 CD2 LEU A 20 6.080 9.716 3.310 1.00 0.00 C ATOM 0 H LEU A 20 2.799 10.993 5.513 1.00 0.00 H new ATOM 0 HA LEU A 20 3.939 8.628 4.316 1.00 0.00 H new ATOM 0 HB2 LEU A 20 4.851 10.562 6.462 1.00 0.00 H new ATOM 0 HB3 LEU A 20 5.772 9.130 6.046 1.00 0.00 H new ATOM 0 HG LEU A 20 5.055 11.397 4.146 1.00 0.00 H new ATOM 0 HD11 LEU A 20 7.514 11.835 4.226 1.00 0.00 H new ATOM 0 HD12 LEU A 20 6.777 11.975 5.840 1.00 0.00 H new ATOM 0 HD13 LEU A 20 7.700 10.516 5.406 1.00 0.00 H new ATOM 0 HD21 LEU A 20 6.557 10.300 2.523 1.00 0.00 H new ATOM 0 HD22 LEU A 20 6.756 8.925 3.636 1.00 0.00 H new ATOM 0 HD23 LEU A 20 5.161 9.272 2.926 1.00 0.00 H new ATOM 342 N GLU A 21 2.510 8.406 7.215 1.00 0.00 N ATOM 343 CA GLU A 21 1.976 7.383 8.121 1.00 0.00 C ATOM 344 C GLU A 21 1.228 6.411 7.208 1.00 0.00 C ATOM 345 O GLU A 21 1.226 5.200 7.411 1.00 0.00 O ATOM 346 CB GLU A 21 0.996 7.969 9.153 1.00 0.00 C ATOM 347 CG GLU A 21 1.613 8.879 10.228 1.00 0.00 C ATOM 348 CD GLU A 21 2.675 8.196 11.069 1.00 0.00 C ATOM 349 OE1 GLU A 21 3.708 8.845 11.352 1.00 0.00 O ATOM 350 OE2 GLU A 21 2.481 7.027 11.458 1.00 0.00 O ATOM 0 H GLU A 21 2.130 9.342 7.355 1.00 0.00 H new ATOM 0 HA GLU A 21 2.778 6.917 8.694 1.00 0.00 H new ATOM 0 HB2 GLU A 21 0.234 8.536 8.619 1.00 0.00 H new ATOM 0 HB3 GLU A 21 0.488 7.144 9.652 1.00 0.00 H new ATOM 0 HG2 GLU A 21 2.051 9.752 9.744 1.00 0.00 H new ATOM 0 HG3 GLU A 21 0.821 9.241 10.883 1.00 0.00 H new ATOM 357 N GLY A 22 0.610 6.966 6.171 1.00 0.00 N ATOM 358 CA GLY A 22 -0.066 6.146 5.183 1.00 0.00 C ATOM 359 C GLY A 22 0.928 5.326 4.381 1.00 0.00 C ATOM 360 O GLY A 22 0.672 4.174 4.089 1.00 0.00 O ATOM 0 H GLY A 22 0.565 7.970 5.997 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -0.773 5.482 5.680 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -0.643 6.782 4.512 1.00 0.00 H new ATOM 364 N LEU A 23 2.069 5.903 4.032 1.00 0.00 N ATOM 365 CA LEU A 23 3.099 5.173 3.283 1.00 0.00 C ATOM 366 C LEU A 23 3.626 4.015 4.144 1.00 0.00 C ATOM 367 O LEU A 23 3.830 2.899 3.660 1.00 0.00 O ATOM 368 CB LEU A 23 4.221 6.131 2.857 1.00 0.00 C ATOM 369 CG LEU A 23 4.914 5.786 1.525 1.00 0.00 C ATOM 370 CD1 LEU A 23 5.718 6.980 1.030 1.00 0.00 C ATOM 371 CD2 LEU A 23 5.843 4.577 1.650 1.00 0.00 C ATOM 0 H LEU A 23 2.311 6.869 4.251 1.00 0.00 H new ATOM 0 HA LEU A 23 2.672 4.752 2.373 1.00 0.00 H new ATOM 0 HB2 LEU A 23 3.808 7.137 2.782 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.975 6.154 3.644 1.00 0.00 H new ATOM 0 HG LEU A 23 4.128 5.536 0.813 1.00 0.00 H new ATOM 0 HD11 LEU A 23 6.204 6.726 0.088 1.00 0.00 H new ATOM 0 HD12 LEU A 23 5.052 7.829 0.877 1.00 0.00 H new ATOM 0 HD13 LEU A 23 6.475 7.241 1.770 1.00 0.00 H new ATOM 0 HD21 LEU A 23 6.308 4.374 0.685 1.00 0.00 H new ATOM 0 HD22 LEU A 23 6.617 4.788 2.388 1.00 0.00 H new ATOM 0 HD23 LEU A 23 5.267 3.707 1.966 1.00 0.00 H new ATOM 383 N HIS A 24 3.811 4.262 5.431 1.00 0.00 N ATOM 384 CA HIS A 24 4.215 3.195 6.334 1.00 0.00 C ATOM 385 C HIS A 24 3.106 2.147 6.376 1.00 0.00 C ATOM 386 O HIS A 24 3.376 0.954 6.371 1.00 0.00 O ATOM 387 CB HIS A 24 4.501 3.725 7.736 1.00 0.00 C ATOM 388 CG HIS A 24 5.016 2.674 8.669 1.00 0.00 C ATOM 389 ND1 HIS A 24 6.080 1.850 8.394 1.00 0.00 N ATOM 390 CD2 HIS A 24 4.581 2.288 9.900 1.00 0.00 C ATOM 391 CE1 HIS A 24 6.256 1.037 9.427 1.00 0.00 C ATOM 392 NE2 HIS A 24 5.365 1.255 10.375 1.00 0.00 N ATOM 0 H HIS A 24 3.691 5.175 5.869 1.00 0.00 H new ATOM 0 HA HIS A 24 5.139 2.749 5.966 1.00 0.00 H new ATOM 0 HB2 HIS A 24 5.230 4.533 7.671 1.00 0.00 H new ATOM 0 HB3 HIS A 24 3.588 4.153 8.149 1.00 0.00 H new ATOM 0 HD1 HIS A 24 6.639 1.861 7.541 1.00 0.00 H new ATOM 0 HD2 HIS A 24 3.746 2.725 10.427 1.00 0.00 H new ATOM 0 HE1 HIS A 24 7.033 0.289 9.485 1.00 0.00 H new ATOM 400 N ARG A 25 1.849 2.577 6.383 1.00 0.00 N ATOM 401 CA ARG A 25 0.737 1.624 6.314 1.00 0.00 C ATOM 402 C ARG A 25 0.779 0.846 4.997 1.00 0.00 C ATOM 403 O ARG A 25 0.349 -0.288 4.971 1.00 0.00 O ATOM 404 CB ARG A 25 -0.627 2.318 6.498 1.00 0.00 C ATOM 405 CG ARG A 25 -1.838 1.352 6.542 1.00 0.00 C ATOM 406 CD ARG A 25 -1.774 0.412 7.751 1.00 0.00 C ATOM 407 NE ARG A 25 -2.872 -0.573 7.773 1.00 0.00 N ATOM 408 CZ ARG A 25 -2.804 -1.820 7.303 1.00 0.00 C ATOM 409 NH1 ARG A 25 -1.744 -2.307 6.719 1.00 0.00 N ATOM 410 NH2 ARG A 25 -3.833 -2.601 7.440 1.00 0.00 N ATOM 0 H ARG A 25 1.573 3.558 6.435 1.00 0.00 H new ATOM 0 HA ARG A 25 0.855 0.921 7.139 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -0.605 2.895 7.422 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -0.773 3.027 5.683 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -2.762 1.929 6.579 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.867 0.763 5.625 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -0.820 -0.115 7.744 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -1.805 1.003 8.666 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.758 -0.276 8.182 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -0.913 -1.727 6.604 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -1.746 -3.268 6.378 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -4.676 -2.258 7.901 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -3.798 -3.557 7.087 1.00 0.00 H new ATOM 424 N ALA A 26 1.310 1.424 3.927 1.00 0.00 N ATOM 425 CA ALA A 26 1.471 0.696 2.664 1.00 0.00 C ATOM 426 C ALA A 26 2.583 -0.365 2.787 1.00 0.00 C ATOM 427 O ALA A 26 2.500 -1.422 2.171 1.00 0.00 O ATOM 428 CB ALA A 26 1.758 1.654 1.506 1.00 0.00 C ATOM 0 H ALA A 26 1.637 2.390 3.903 1.00 0.00 H new ATOM 0 HA ALA A 26 0.532 0.186 2.448 1.00 0.00 H new ATOM 0 HB1 ALA A 26 1.873 1.085 0.583 1.00 0.00 H new ATOM 0 HB2 ALA A 26 0.930 2.355 1.400 1.00 0.00 H new ATOM 0 HB3 ALA A 26 2.676 2.205 1.709 1.00 0.00 H new ATOM 434 N GLU A 27 3.604 -0.120 3.597 1.00 0.00 N ATOM 435 CA GLU A 27 4.610 -1.173 3.866 1.00 0.00 C ATOM 436 C GLU A 27 3.893 -2.289 4.662 1.00 0.00 C ATOM 437 O GLU A 27 4.026 -3.514 4.429 1.00 0.00 O ATOM 438 CB GLU A 27 5.793 -0.611 4.667 1.00 0.00 C ATOM 439 CG GLU A 27 6.534 0.513 3.942 1.00 0.00 C ATOM 440 CD GLU A 27 7.667 1.098 4.772 1.00 0.00 C ATOM 441 OE1 GLU A 27 8.807 1.167 4.261 1.00 0.00 O ATOM 442 OE2 GLU A 27 7.420 1.501 5.934 1.00 0.00 O ATOM 0 H GLU A 27 3.768 0.767 4.073 1.00 0.00 H new ATOM 0 HA GLU A 27 5.017 -1.562 2.932 1.00 0.00 H new ATOM 0 HB2 GLU A 27 5.430 -0.239 5.625 1.00 0.00 H new ATOM 0 HB3 GLU A 27 6.493 -1.418 4.883 1.00 0.00 H new ATOM 0 HG2 GLU A 27 6.936 0.132 3.003 1.00 0.00 H new ATOM 0 HG3 GLU A 27 5.828 1.304 3.689 1.00 0.00 H new ATOM 449 N GLN A 28 3.076 -1.849 5.595 1.00 0.00 N ATOM 450 CA GLN A 28 2.261 -2.775 6.348 1.00 0.00 C ATOM 451 C GLN A 28 1.227 -3.428 5.424 1.00 0.00 C ATOM 452 O GLN A 28 0.684 -4.437 5.782 1.00 0.00 O ATOM 453 CB GLN A 28 1.603 -2.110 7.563 1.00 0.00 C ATOM 454 CG GLN A 28 2.602 -1.517 8.565 1.00 0.00 C ATOM 455 CD GLN A 28 3.679 -2.501 8.976 1.00 0.00 C ATOM 456 OE1 GLN A 28 3.397 -3.601 9.418 1.00 0.00 O ATOM 457 NE2 GLN A 28 4.916 -2.110 8.819 1.00 0.00 N ATOM 0 H GLN A 28 2.960 -0.868 5.848 1.00 0.00 H new ATOM 0 HA GLN A 28 2.910 -3.555 6.747 1.00 0.00 H new ATOM 0 HB2 GLN A 28 0.939 -1.319 7.216 1.00 0.00 H new ATOM 0 HB3 GLN A 28 0.983 -2.845 8.076 1.00 0.00 H new ATOM 0 HG2 GLN A 28 3.070 -0.636 8.126 1.00 0.00 H new ATOM 0 HG3 GLN A 28 2.064 -1.183 9.452 1.00 0.00 H new ATOM 0 HE21 GLN A 28 5.114 -1.182 8.446 1.00 0.00 H new ATOM 0 HE22 GLN A 28 5.684 -2.733 9.070 1.00 0.00 H new ATOM 466 N SER A 29 0.947 -2.857 4.253 1.00 0.00 N ATOM 467 CA SER A 29 -0.004 -3.457 3.307 1.00 0.00 C ATOM 468 C SER A 29 0.658 -4.568 2.491 1.00 0.00 C ATOM 469 O SER A 29 0.018 -5.562 2.216 1.00 0.00 O ATOM 470 CB SER A 29 -0.650 -2.423 2.372 1.00 0.00 C ATOM 471 OG SER A 29 0.176 -2.115 1.266 1.00 0.00 O ATOM 0 H SER A 29 1.362 -1.982 3.934 1.00 0.00 H new ATOM 0 HA SER A 29 -0.803 -3.887 3.911 1.00 0.00 H new ATOM 0 HB2 SER A 29 -1.606 -2.806 2.014 1.00 0.00 H new ATOM 0 HB3 SER A 29 -0.861 -1.511 2.931 1.00 0.00 H new ATOM 0 HG SER A 29 1.110 -2.067 1.559 1.00 0.00 H new ATOM 477 N LEU A 30 1.938 -4.435 2.134 1.00 0.00 N ATOM 478 CA LEU A 30 2.656 -5.556 1.489 1.00 0.00 C ATOM 479 C LEU A 30 2.721 -6.628 2.581 1.00 0.00 C ATOM 480 O LEU A 30 2.464 -7.815 2.323 1.00 0.00 O ATOM 481 CB LEU A 30 4.063 -5.191 0.959 1.00 0.00 C ATOM 482 CG LEU A 30 4.879 -3.990 1.462 1.00 0.00 C ATOM 483 CD1 LEU A 30 6.153 -4.505 2.132 1.00 0.00 C ATOM 484 CD2 LEU A 30 5.249 -2.972 0.372 1.00 0.00 C ATOM 0 H LEU A 30 2.493 -3.590 2.272 1.00 0.00 H new ATOM 0 HA LEU A 30 2.136 -5.884 0.589 1.00 0.00 H new ATOM 0 HB2 LEU A 30 4.686 -6.071 1.115 1.00 0.00 H new ATOM 0 HB3 LEU A 30 3.960 -5.061 -0.118 1.00 0.00 H new ATOM 0 HG LEU A 30 4.241 -3.454 2.165 1.00 0.00 H new ATOM 0 HD11 LEU A 30 6.741 -3.661 2.493 1.00 0.00 H new ATOM 0 HD12 LEU A 30 5.888 -5.148 2.971 1.00 0.00 H new ATOM 0 HD13 LEU A 30 6.740 -5.073 1.410 1.00 0.00 H new ATOM 0 HD21 LEU A 30 5.823 -2.158 0.814 1.00 0.00 H new ATOM 0 HD22 LEU A 30 5.847 -3.463 -0.396 1.00 0.00 H new ATOM 0 HD23 LEU A 30 4.339 -2.572 -0.076 1.00 0.00 H new ATOM 496 N HIS A 31 3.028 -6.224 3.812 1.00 0.00 N ATOM 497 CA HIS A 31 3.052 -7.214 4.898 1.00 0.00 C ATOM 498 C HIS A 31 1.672 -7.840 5.194 1.00 0.00 C ATOM 499 O HIS A 31 1.584 -9.038 5.477 1.00 0.00 O ATOM 500 CB HIS A 31 3.682 -6.622 6.147 1.00 0.00 C ATOM 501 CG HIS A 31 5.129 -6.279 5.966 1.00 0.00 C ATOM 502 ND1 HIS A 31 5.991 -6.962 5.135 1.00 0.00 N ATOM 503 CD2 HIS A 31 5.881 -5.289 6.519 1.00 0.00 C ATOM 504 CE1 HIS A 31 7.188 -6.390 5.222 1.00 0.00 C ATOM 505 NE2 HIS A 31 7.181 -5.366 6.053 1.00 0.00 N ATOM 0 H HIS A 31 3.254 -5.266 4.080 1.00 0.00 H new ATOM 0 HA HIS A 31 3.674 -8.040 4.553 1.00 0.00 H new ATOM 0 HB2 HIS A 31 3.134 -5.724 6.433 1.00 0.00 H new ATOM 0 HB3 HIS A 31 3.582 -7.331 6.969 1.00 0.00 H new ATOM 0 HD1 HIS A 31 5.752 -7.766 4.555 1.00 0.00 H new ATOM 0 HD2 HIS A 31 5.516 -4.552 7.219 1.00 0.00 H new ATOM 0 HE1 HIS A 31 8.060 -6.723 4.678 1.00 0.00 H new ATOM 513 N ASP A 32 0.606 -7.057 5.100 1.00 0.00 N ATOM 514 CA ASP A 32 -0.760 -7.575 5.251 1.00 0.00 C ATOM 515 C ASP A 32 -0.976 -8.580 4.145 1.00 0.00 C ATOM 516 O ASP A 32 -1.470 -9.661 4.372 1.00 0.00 O ATOM 517 CB ASP A 32 -1.806 -6.463 5.072 1.00 0.00 C ATOM 518 CG ASP A 32 -2.722 -6.302 6.271 1.00 0.00 C ATOM 519 OD1 ASP A 32 -3.299 -7.299 6.752 1.00 0.00 O ATOM 520 OD2 ASP A 32 -2.884 -5.144 6.726 1.00 0.00 O ATOM 0 H ASP A 32 0.655 -6.054 4.919 1.00 0.00 H new ATOM 0 HA ASP A 32 -0.871 -8.004 6.247 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -1.294 -5.519 4.885 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -2.408 -6.679 4.190 1.00 0.00 H new ATOM 525 N LEU A 33 -0.587 -8.212 2.934 1.00 0.00 N ATOM 526 CA LEU A 33 -0.782 -9.074 1.784 1.00 0.00 C ATOM 527 C LEU A 33 -0.108 -10.421 2.004 1.00 0.00 C ATOM 528 O LEU A 33 -0.764 -11.442 1.832 1.00 0.00 O ATOM 529 CB LEU A 33 -0.301 -8.381 0.500 1.00 0.00 C ATOM 530 CG LEU A 33 -1.391 -7.496 -0.137 1.00 0.00 C ATOM 531 CD1 LEU A 33 -0.781 -6.418 -1.036 1.00 0.00 C ATOM 532 CD2 LEU A 33 -2.380 -8.359 -0.946 1.00 0.00 C ATOM 0 H LEU A 33 -0.135 -7.322 2.725 1.00 0.00 H new ATOM 0 HA LEU A 33 -1.848 -9.266 1.662 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.573 -7.770 0.726 1.00 0.00 H new ATOM 0 HB3 LEU A 33 0.016 -9.136 -0.220 1.00 0.00 H new ATOM 0 HG LEU A 33 -1.928 -6.999 0.671 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -1.577 -5.812 -1.469 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -0.121 -5.782 -0.445 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -0.210 -6.891 -1.835 1.00 0.00 H new ATOM 0 HD21 LEU A 33 -3.143 -7.719 -1.389 1.00 0.00 H new ATOM 0 HD22 LEU A 33 -1.843 -8.884 -1.736 1.00 0.00 H new ATOM 0 HD23 LEU A 33 -2.854 -9.085 -0.285 1.00 0.00 H new ATOM 544 N GLN A 34 1.158 -10.468 2.409 1.00 0.00 N ATOM 545 CA GLN A 34 1.757 -11.796 2.661 1.00 0.00 C ATOM 546 C GLN A 34 1.152 -12.511 3.888 1.00 0.00 C ATOM 547 O GLN A 34 0.920 -13.732 3.839 1.00 0.00 O ATOM 548 CB GLN A 34 3.296 -11.783 2.778 1.00 0.00 C ATOM 549 CG GLN A 34 3.922 -10.598 3.530 1.00 0.00 C ATOM 550 CD GLN A 34 4.759 -9.649 2.664 1.00 0.00 C ATOM 551 OE1 GLN A 34 5.582 -8.893 3.193 1.00 0.00 O ATOM 552 NE2 GLN A 34 4.562 -9.666 1.366 1.00 0.00 N ATOM 0 H GLN A 34 1.765 -9.664 2.565 1.00 0.00 H new ATOM 0 HA GLN A 34 1.501 -12.363 1.766 1.00 0.00 H new ATOM 0 HB2 GLN A 34 3.607 -12.703 3.273 1.00 0.00 H new ATOM 0 HB3 GLN A 34 3.714 -11.806 1.772 1.00 0.00 H new ATOM 0 HG2 GLN A 34 3.124 -10.025 4.003 1.00 0.00 H new ATOM 0 HG3 GLN A 34 4.552 -10.987 4.330 1.00 0.00 H new ATOM 0 HE21 GLN A 34 3.875 -10.303 0.963 1.00 0.00 H new ATOM 0 HE22 GLN A 34 5.096 -9.042 0.761 1.00 0.00 H new ATOM 561 N GLU A 35 0.891 -11.796 4.980 1.00 0.00 N ATOM 562 CA GLU A 35 0.354 -12.450 6.185 1.00 0.00 C ATOM 563 C GLU A 35 -1.015 -13.041 5.906 1.00 0.00 C ATOM 564 O GLU A 35 -1.276 -14.210 6.197 1.00 0.00 O ATOM 565 CB GLU A 35 0.235 -11.468 7.364 1.00 0.00 C ATOM 566 CG GLU A 35 -0.137 -12.150 8.704 1.00 0.00 C ATOM 567 CD GLU A 35 -1.609 -11.951 9.125 1.00 0.00 C ATOM 568 OE1 GLU A 35 -2.529 -12.446 8.433 1.00 0.00 O ATOM 569 OE2 GLU A 35 -1.835 -11.309 10.173 1.00 0.00 O ATOM 0 H GLU A 35 1.036 -10.790 5.063 1.00 0.00 H new ATOM 0 HA GLU A 35 1.055 -13.240 6.454 1.00 0.00 H new ATOM 0 HB2 GLU A 35 1.182 -10.942 7.484 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -0.519 -10.718 7.126 1.00 0.00 H new ATOM 0 HG2 GLU A 35 0.066 -13.218 8.624 1.00 0.00 H new ATOM 0 HG3 GLU A 35 0.510 -11.760 9.490 1.00 0.00 H new ATOM 576 N ARG A 36 -1.887 -12.234 5.330 1.00 0.00 N ATOM 577 CA ARG A 36 -3.255 -12.650 5.081 1.00 0.00 C ATOM 578 C ARG A 36 -3.281 -13.689 3.981 1.00 0.00 C ATOM 579 O ARG A 36 -4.162 -14.523 3.965 1.00 0.00 O ATOM 580 CB ARG A 36 -4.130 -11.445 4.735 1.00 0.00 C ATOM 581 CG ARG A 36 -4.086 -10.298 5.783 1.00 0.00 C ATOM 582 CD ARG A 36 -5.187 -10.338 6.848 1.00 0.00 C ATOM 583 NE ARG A 36 -6.515 -9.963 6.315 1.00 0.00 N ATOM 584 CZ ARG A 36 -6.903 -8.724 6.005 1.00 0.00 C ATOM 585 NH1 ARG A 36 -6.126 -7.677 6.125 1.00 0.00 N ATOM 586 NH2 ARG A 36 -8.105 -8.536 5.531 1.00 0.00 N ATOM 0 H ARG A 36 -1.672 -11.285 5.025 1.00 0.00 H new ATOM 0 HA ARG A 36 -3.664 -13.100 5.986 1.00 0.00 H new ATOM 0 HB2 ARG A 36 -3.817 -11.050 3.768 1.00 0.00 H new ATOM 0 HB3 ARG A 36 -5.161 -11.780 4.624 1.00 0.00 H new ATOM 0 HG2 ARG A 36 -3.118 -10.324 6.284 1.00 0.00 H new ATOM 0 HG3 ARG A 36 -4.147 -9.345 5.257 1.00 0.00 H new ATOM 0 HD2 ARG A 36 -5.241 -11.341 7.271 1.00 0.00 H new ATOM 0 HD3 ARG A 36 -4.923 -9.663 7.662 1.00 0.00 H new ATOM 0 HE ARG A 36 -7.191 -10.714 6.172 1.00 0.00 H new ATOM 0 HH11 ARG A 36 -5.172 -7.786 6.470 1.00 0.00 H new ATOM 0 HH12 ARG A 36 -6.474 -6.752 5.873 1.00 0.00 H new ATOM 0 HH21 ARG A 36 -8.732 -9.330 5.402 1.00 0.00 H new ATOM 0 HH22 ARG A 36 -8.417 -7.595 5.289 1.00 0.00 H new ATOM 600 N LEU A 37 -2.307 -13.673 3.077 1.00 0.00 N ATOM 601 CA LEU A 37 -2.190 -14.740 2.074 1.00 0.00 C ATOM 602 C LEU A 37 -1.804 -16.030 2.792 1.00 0.00 C ATOM 603 O LEU A 37 -2.406 -17.092 2.564 1.00 0.00 O ATOM 604 CB LEU A 37 -1.131 -14.378 1.018 1.00 0.00 C ATOM 605 CG LEU A 37 -0.778 -15.362 -0.113 1.00 0.00 C ATOM 606 CD1 LEU A 37 0.284 -16.386 0.313 1.00 0.00 C ATOM 607 CD2 LEU A 37 -2.019 -16.070 -0.654 1.00 0.00 C ATOM 0 H LEU A 37 -1.594 -12.947 3.013 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.142 -14.868 1.558 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -1.453 -13.450 0.546 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -0.207 -14.160 1.553 1.00 0.00 H new ATOM 0 HG LEU A 37 -0.351 -14.762 -0.916 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.498 -17.056 -0.519 1.00 0.00 H new ATOM 0 HD12 LEU A 37 1.196 -15.865 0.603 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -0.087 -16.965 1.159 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -1.729 -16.756 -1.450 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -2.498 -16.629 0.150 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -2.717 -15.331 -1.048 1.00 0.00 H new ATOM 619 N HIS A 38 -0.813 -15.945 3.671 1.00 0.00 N ATOM 620 CA HIS A 38 -0.373 -17.123 4.424 1.00 0.00 C ATOM 621 C HIS A 38 -1.561 -17.698 5.191 1.00 0.00 C ATOM 622 O HIS A 38 -1.784 -18.906 5.203 1.00 0.00 O ATOM 623 CB HIS A 38 0.761 -16.741 5.382 1.00 0.00 C ATOM 624 CG HIS A 38 1.476 -17.917 5.969 1.00 0.00 C ATOM 625 ND1 HIS A 38 0.997 -18.656 7.054 1.00 0.00 N ATOM 626 CD2 HIS A 38 2.652 -18.513 5.641 1.00 0.00 C ATOM 627 CE1 HIS A 38 1.867 -19.615 7.335 1.00 0.00 C ATOM 628 NE2 HIS A 38 2.866 -19.547 6.499 1.00 0.00 N ATOM 0 H HIS A 38 -0.302 -15.088 3.881 1.00 0.00 H new ATOM 0 HA HIS A 38 0.006 -17.880 3.737 1.00 0.00 H new ATOM 0 HB2 HIS A 38 1.480 -16.119 4.849 1.00 0.00 H new ATOM 0 HB3 HIS A 38 0.353 -16.135 6.191 1.00 0.00 H new ATOM 0 HD1 HIS A 38 0.121 -18.485 7.548 1.00 0.00 H new ATOM 0 HD2 HIS A 38 3.307 -18.216 4.835 1.00 0.00 H new ATOM 0 HE1 HIS A 38 1.765 -20.338 8.130 1.00 0.00 H new ATOM 636 N LYS A 39 -2.335 -16.820 5.810 1.00 0.00 N ATOM 637 CA LYS A 39 -3.531 -17.220 6.543 1.00 0.00 C ATOM 638 C LYS A 39 -4.605 -17.780 5.606 1.00 0.00 C ATOM 639 O LYS A 39 -5.252 -18.765 5.923 1.00 0.00 O ATOM 640 CB LYS A 39 -4.068 -16.013 7.306 1.00 0.00 C ATOM 641 CG LYS A 39 -5.163 -16.354 8.276 1.00 0.00 C ATOM 642 CD LYS A 39 -5.596 -15.124 9.032 1.00 0.00 C ATOM 643 CE LYS A 39 -6.657 -15.488 10.043 1.00 0.00 C ATOM 644 NZ LYS A 39 -7.089 -14.304 10.826 1.00 0.00 N ATOM 0 H LYS A 39 -2.155 -15.816 5.820 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.266 -18.015 7.241 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -3.248 -15.542 7.848 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -4.442 -15.279 6.592 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -6.013 -16.778 7.741 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -4.815 -17.115 8.975 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -4.740 -14.676 9.536 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -5.983 -14.378 8.338 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -7.516 -15.920 9.531 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -6.271 -16.252 10.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -7.818 -14.588 11.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -6.273 -13.907 11.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -7.479 -13.586 10.183 1.00 0.00 H new ATOM 658 N ALA A 40 -4.784 -17.165 4.446 1.00 0.00 N ATOM 659 CA ALA A 40 -5.755 -17.642 3.464 1.00 0.00 C ATOM 660 C ALA A 40 -5.345 -19.028 2.984 1.00 0.00 C ATOM 661 O ALA A 40 -6.193 -19.862 2.692 1.00 0.00 O ATOM 662 CB ALA A 40 -5.861 -16.672 2.285 1.00 0.00 C ATOM 0 H ALA A 40 -4.270 -16.332 4.159 1.00 0.00 H new ATOM 0 HA ALA A 40 -6.737 -17.699 3.934 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.590 -17.049 1.568 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -6.180 -15.694 2.646 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -4.889 -16.581 1.800 1.00 0.00 H new ATOM 668 N GLN A 41 -4.055 -19.313 2.914 1.00 0.00 N ATOM 669 CA GLN A 41 -3.688 -20.686 2.613 1.00 0.00 C ATOM 670 C GLN A 41 -4.122 -21.549 3.811 1.00 0.00 C ATOM 671 O GLN A 41 -4.976 -22.423 3.679 1.00 0.00 O ATOM 672 CB GLN A 41 -2.177 -20.828 2.389 1.00 0.00 C ATOM 673 CG GLN A 41 -1.664 -20.149 1.130 1.00 0.00 C ATOM 674 CD GLN A 41 -0.164 -20.290 0.984 1.00 0.00 C ATOM 675 OE1 GLN A 41 0.603 -19.814 1.807 1.00 0.00 O ATOM 676 NE2 GLN A 41 0.261 -20.957 -0.057 1.00 0.00 N ATOM 0 H GLN A 41 -3.286 -18.657 3.052 1.00 0.00 H new ATOM 0 HA GLN A 41 -4.181 -21.005 1.695 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -1.653 -20.413 3.250 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -1.926 -21.888 2.344 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -2.156 -20.581 0.258 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -1.929 -19.092 1.154 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -0.408 -21.341 -0.725 1.00 0.00 H new ATOM 0 HE22 GLN A 41 1.261 -21.093 -0.202 1.00 0.00 H new ATOM 685 N GLU A 42 -3.554 -21.276 4.978 1.00 0.00 N ATOM 686 CA GLU A 42 -3.768 -22.115 6.168 1.00 0.00 C ATOM 687 C GLU A 42 -5.224 -22.410 6.503 1.00 0.00 C ATOM 688 O GLU A 42 -5.551 -23.525 6.909 1.00 0.00 O ATOM 689 CB GLU A 42 -3.089 -21.466 7.376 1.00 0.00 C ATOM 690 CG GLU A 42 -1.573 -21.552 7.301 1.00 0.00 C ATOM 691 CD GLU A 42 -0.879 -20.768 8.399 1.00 0.00 C ATOM 692 OE1 GLU A 42 -1.176 -19.562 8.566 1.00 0.00 O ATOM 693 OE2 GLU A 42 -0.003 -21.346 9.080 1.00 0.00 O ATOM 0 H GLU A 42 -2.938 -20.478 5.135 1.00 0.00 H new ATOM 0 HA GLU A 42 -3.325 -23.081 5.926 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -3.389 -20.420 7.440 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -3.434 -21.953 8.289 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -1.271 -22.597 7.362 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -1.241 -21.180 6.332 1.00 0.00 H new ATOM 700 N GLU A 43 -6.094 -21.432 6.326 1.00 0.00 N ATOM 701 CA GLU A 43 -7.512 -21.622 6.594 1.00 0.00 C ATOM 702 C GLU A 43 -8.324 -21.980 5.345 1.00 0.00 C ATOM 703 O GLU A 43 -9.169 -22.873 5.389 1.00 0.00 O ATOM 704 CB GLU A 43 -8.091 -20.323 7.175 1.00 0.00 C ATOM 705 CG GLU A 43 -7.465 -19.882 8.502 1.00 0.00 C ATOM 706 CD GLU A 43 -8.045 -18.563 9.013 1.00 0.00 C ATOM 707 OE1 GLU A 43 -8.038 -18.343 10.248 1.00 0.00 O ATOM 708 OE2 GLU A 43 -8.496 -17.733 8.188 1.00 0.00 O ATOM 0 H GLU A 43 -5.846 -20.498 5.998 1.00 0.00 H new ATOM 0 HA GLU A 43 -7.588 -22.456 7.292 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -7.961 -19.525 6.444 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -9.164 -20.452 7.320 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -7.623 -20.659 9.250 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -6.388 -19.776 8.374 1.00 0.00 H new ATOM 715 N HIS A 44 -8.108 -21.255 4.252 1.00 0.00 N ATOM 716 CA HIS A 44 -9.005 -21.364 3.077 1.00 0.00 C ATOM 717 C HIS A 44 -8.466 -22.217 1.945 1.00 0.00 C ATOM 718 O HIS A 44 -9.225 -22.678 1.095 1.00 0.00 O ATOM 719 CB HIS A 44 -9.392 -19.970 2.556 1.00 0.00 C ATOM 720 CG HIS A 44 -10.218 -19.178 3.523 1.00 0.00 C ATOM 721 ND1 HIS A 44 -9.714 -18.491 4.601 1.00 0.00 N ATOM 722 CD2 HIS A 44 -11.563 -18.970 3.571 1.00 0.00 C ATOM 723 CE1 HIS A 44 -10.727 -17.922 5.244 1.00 0.00 C ATOM 724 NE2 HIS A 44 -11.880 -18.175 4.657 1.00 0.00 N ATOM 0 H HIS A 44 -7.339 -20.594 4.143 1.00 0.00 H new ATOM 0 HA HIS A 44 -9.890 -21.885 3.442 1.00 0.00 H new ATOM 0 HB2 HIS A 44 -8.484 -19.413 2.324 1.00 0.00 H new ATOM 0 HB3 HIS A 44 -9.945 -20.080 1.623 1.00 0.00 H new ATOM 0 HD2 HIS A 44 -12.277 -19.367 2.865 1.00 0.00 H new ATOM 0 HE1 HIS A 44 -10.620 -17.325 6.138 1.00 0.00 H new ATOM 0 HE2 HIS A 44 -12.805 -17.854 4.942 1.00 0.00 H new ATOM 732 N ARG A 45 -7.155 -22.428 1.952 1.00 0.00 N ATOM 733 CA ARG A 45 -6.437 -23.292 0.989 1.00 0.00 C ATOM 734 C ARG A 45 -6.908 -23.197 -0.465 1.00 0.00 C ATOM 735 O ARG A 45 -7.064 -24.204 -1.152 1.00 0.00 O ATOM 736 CB ARG A 45 -6.435 -24.754 1.497 1.00 0.00 C ATOM 737 CG ARG A 45 -7.799 -25.472 1.558 1.00 0.00 C ATOM 738 CD ARG A 45 -7.661 -26.789 2.271 1.00 0.00 C ATOM 739 NE ARG A 45 -8.876 -27.609 2.137 1.00 0.00 N ATOM 740 CZ ARG A 45 -9.204 -28.623 2.924 1.00 0.00 C ATOM 741 NH1 ARG A 45 -8.466 -28.977 3.950 1.00 0.00 N ATOM 742 NH2 ARG A 45 -10.287 -29.297 2.682 1.00 0.00 N ATOM 0 H ARG A 45 -6.536 -21.998 2.639 1.00 0.00 H new ATOM 0 HA ARG A 45 -5.418 -22.907 0.951 1.00 0.00 H new ATOM 0 HB2 ARG A 45 -5.774 -25.336 0.855 1.00 0.00 H new ATOM 0 HB3 ARG A 45 -6.000 -24.766 2.496 1.00 0.00 H new ATOM 0 HG2 ARG A 45 -8.526 -24.845 2.075 1.00 0.00 H new ATOM 0 HG3 ARG A 45 -8.178 -25.634 0.549 1.00 0.00 H new ATOM 0 HD2 ARG A 45 -6.808 -27.334 1.867 1.00 0.00 H new ATOM 0 HD3 ARG A 45 -7.456 -26.612 3.327 1.00 0.00 H new ATOM 0 HE ARG A 45 -9.517 -27.378 1.378 1.00 0.00 H new ATOM 0 HH11 ARG A 45 -7.609 -28.466 4.163 1.00 0.00 H new ATOM 0 HH12 ARG A 45 -8.749 -29.763 4.535 1.00 0.00 H new ATOM 0 HH21 ARG A 45 -10.879 -29.045 1.890 1.00 0.00 H new ATOM 0 HH22 ARG A 45 -10.546 -30.079 3.283 1.00 0.00 H new ATOM 756 N THR A 46 -7.118 -21.975 -0.930 1.00 0.00 N ATOM 757 CA THR A 46 -7.578 -21.745 -2.296 1.00 0.00 C ATOM 758 C THR A 46 -6.831 -22.509 -3.398 1.00 0.00 C ATOM 759 O THR A 46 -5.599 -22.655 -3.394 1.00 0.00 O ATOM 760 CB THR A 46 -7.589 -20.228 -2.625 1.00 0.00 C ATOM 761 OG1 THR A 46 -8.018 -20.029 -3.975 1.00 0.00 O ATOM 762 CG2 THR A 46 -6.206 -19.590 -2.444 1.00 0.00 C ATOM 0 H THR A 46 -6.978 -21.125 -0.383 1.00 0.00 H new ATOM 0 HA THR A 46 -8.588 -22.154 -2.304 1.00 0.00 H new ATOM 0 HB THR A 46 -8.279 -19.750 -1.930 1.00 0.00 H new ATOM 0 HG1 THR A 46 -8.025 -19.070 -4.178 1.00 0.00 H new ATOM 0 HG21 THR A 46 -6.261 -18.528 -2.685 1.00 0.00 H new ATOM 0 HG22 THR A 46 -5.882 -19.711 -1.410 1.00 0.00 H new ATOM 0 HG23 THR A 46 -5.491 -20.076 -3.108 1.00 0.00 H new ATOM 770 N VAL A 47 -7.619 -22.976 -4.363 1.00 0.00 N ATOM 771 CA VAL A 47 -7.129 -23.705 -5.540 1.00 0.00 C ATOM 772 C VAL A 47 -6.245 -22.786 -6.399 1.00 0.00 C ATOM 773 O VAL A 47 -5.596 -23.204 -7.349 1.00 0.00 O ATOM 774 CB VAL A 47 -8.343 -24.264 -6.357 1.00 0.00 C ATOM 775 CG1 VAL A 47 -9.058 -23.144 -7.139 1.00 0.00 C ATOM 776 CG2 VAL A 47 -7.913 -25.396 -7.298 1.00 0.00 C ATOM 0 H VAL A 47 -8.632 -22.859 -4.353 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.518 -24.549 -5.221 1.00 0.00 H new ATOM 0 HB VAL A 47 -9.052 -24.677 -5.639 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -9.895 -23.566 -7.695 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -9.427 -22.392 -6.442 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -8.357 -22.681 -7.834 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -8.780 -25.760 -7.849 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -7.168 -25.022 -8.000 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -7.485 -26.211 -6.715 1.00 0.00 H new ATOM 786 N GLU A 48 -6.199 -21.517 -6.023 1.00 0.00 N ATOM 787 CA GLU A 48 -5.335 -20.533 -6.656 1.00 0.00 C ATOM 788 C GLU A 48 -3.858 -20.785 -6.280 1.00 0.00 C ATOM 789 O GLU A 48 -2.975 -20.001 -6.634 1.00 0.00 O ATOM 790 CB GLU A 48 -5.792 -19.138 -6.219 1.00 0.00 C ATOM 791 CG GLU A 48 -5.292 -18.025 -7.091 1.00 0.00 C ATOM 792 CD GLU A 48 -6.104 -16.765 -6.940 1.00 0.00 C ATOM 793 OE1 GLU A 48 -6.329 -16.313 -5.799 1.00 0.00 O ATOM 794 OE2 GLU A 48 -6.513 -16.216 -7.994 1.00 0.00 O ATOM 0 H GLU A 48 -6.765 -21.138 -5.264 1.00 0.00 H new ATOM 0 HA GLU A 48 -5.407 -20.613 -7.741 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -6.882 -19.113 -6.206 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -5.457 -18.962 -5.197 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -4.251 -17.814 -6.845 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -5.315 -18.345 -8.133 1.00 0.00 H new ATOM 801 N VAL A 49 -3.594 -21.887 -5.583 1.00 0.00 N ATOM 802 CA VAL A 49 -2.235 -22.285 -5.188 1.00 0.00 C ATOM 803 C VAL A 49 -1.227 -22.209 -6.360 1.00 0.00 C ATOM 804 O VAL A 49 -0.072 -21.828 -6.165 1.00 0.00 O ATOM 805 CB VAL A 49 -2.253 -23.701 -4.507 1.00 0.00 C ATOM 806 CG1 VAL A 49 -2.673 -24.809 -5.484 1.00 0.00 C ATOM 807 CG2 VAL A 49 -0.892 -24.025 -3.879 1.00 0.00 C ATOM 0 H VAL A 49 -4.317 -22.536 -5.272 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.882 -21.563 -4.452 1.00 0.00 H new ATOM 0 HB VAL A 49 -3.002 -23.663 -3.716 1.00 0.00 H new ATOM 0 HG11 VAL A 49 -2.671 -25.769 -4.968 1.00 0.00 H new ATOM 0 HG12 VAL A 49 -3.675 -24.602 -5.860 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -1.972 -24.844 -6.318 1.00 0.00 H new ATOM 0 HG21 VAL A 49 -0.931 -25.010 -3.414 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -0.124 -24.019 -4.652 1.00 0.00 H new ATOM 0 HG23 VAL A 49 -0.653 -23.277 -3.123 1.00 0.00 H new ATOM 817 N GLU A 50 -1.666 -22.528 -7.573 1.00 0.00 N ATOM 818 CA GLU A 50 -0.805 -22.448 -8.762 1.00 0.00 C ATOM 819 C GLU A 50 -0.354 -21.021 -9.113 1.00 0.00 C ATOM 820 O GLU A 50 0.659 -20.841 -9.776 1.00 0.00 O ATOM 821 CB GLU A 50 -1.534 -23.047 -9.966 1.00 0.00 C ATOM 822 CG GLU A 50 -1.139 -24.490 -10.243 1.00 0.00 C ATOM 823 CD GLU A 50 -1.553 -25.428 -9.123 1.00 0.00 C ATOM 824 OE1 GLU A 50 -2.765 -25.524 -8.843 1.00 0.00 O ATOM 825 OE2 GLU A 50 -0.663 -26.062 -8.515 1.00 0.00 O ATOM 0 H GLU A 50 -2.616 -22.846 -7.766 1.00 0.00 H new ATOM 0 HA GLU A 50 0.095 -23.013 -8.520 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -2.609 -22.997 -9.794 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -1.324 -22.443 -10.848 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -1.598 -24.817 -11.176 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -0.059 -24.548 -10.382 1.00 0.00 H new ATOM 832 N LYS A 51 -1.093 -20.014 -8.663 1.00 0.00 N ATOM 833 CA LYS A 51 -0.724 -18.603 -8.887 1.00 0.00 C ATOM 834 C LYS A 51 -0.106 -18.045 -7.613 1.00 0.00 C ATOM 835 O LYS A 51 0.696 -17.117 -7.643 1.00 0.00 O ATOM 836 CB LYS A 51 -1.955 -17.742 -9.192 1.00 0.00 C ATOM 837 CG LYS A 51 -2.873 -18.241 -10.299 1.00 0.00 C ATOM 838 CD LYS A 51 -4.011 -17.229 -10.479 1.00 0.00 C ATOM 839 CE LYS A 51 -5.306 -17.888 -10.944 1.00 0.00 C ATOM 840 NZ LYS A 51 -6.471 -16.954 -10.716 1.00 0.00 N ATOM 0 H LYS A 51 -1.958 -20.140 -8.137 1.00 0.00 H new ATOM 0 HA LYS A 51 -0.034 -18.573 -9.730 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -2.542 -17.649 -8.278 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -1.615 -16.741 -9.456 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -2.317 -18.356 -11.230 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -3.275 -19.222 -10.045 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -4.187 -16.713 -9.535 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.710 -16.473 -11.204 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -5.235 -18.143 -12.001 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -5.465 -18.820 -10.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -7.358 -17.441 -10.956 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -6.494 -16.665 -9.717 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -6.364 -16.113 -11.318 1.00 0.00 H new ATOM 854 N VAL A 52 -0.522 -18.624 -6.496 1.00 0.00 N ATOM 855 CA VAL A 52 -0.090 -18.218 -5.157 1.00 0.00 C ATOM 856 C VAL A 52 1.383 -18.592 -4.884 1.00 0.00 C ATOM 857 O VAL A 52 1.977 -18.110 -3.922 1.00 0.00 O ATOM 858 CB VAL A 52 -1.105 -18.791 -4.097 1.00 0.00 C ATOM 859 CG1 VAL A 52 -0.563 -18.818 -2.671 1.00 0.00 C ATOM 860 CG2 VAL A 52 -2.407 -17.966 -4.128 1.00 0.00 C ATOM 0 H VAL A 52 -1.181 -19.403 -6.489 1.00 0.00 H new ATOM 0 HA VAL A 52 -0.108 -17.131 -5.077 1.00 0.00 H new ATOM 0 HB VAL A 52 -1.287 -19.827 -4.381 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -1.321 -19.225 -2.001 1.00 0.00 H new ATOM 0 HG12 VAL A 52 0.329 -19.443 -2.633 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -0.310 -17.805 -2.359 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -3.108 -18.364 -3.394 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -2.184 -16.926 -3.890 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.851 -18.024 -5.122 1.00 0.00 H new ATOM 870 N HIS A 53 1.977 -19.435 -5.726 1.00 0.00 N ATOM 871 CA HIS A 53 3.391 -19.817 -5.562 1.00 0.00 C ATOM 872 C HIS A 53 4.303 -18.626 -5.171 1.00 0.00 C ATOM 873 O HIS A 53 4.348 -17.573 -5.824 1.00 0.00 O ATOM 874 CB HIS A 53 3.922 -20.585 -6.788 1.00 0.00 C ATOM 875 CG HIS A 53 3.682 -19.912 -8.109 1.00 0.00 C ATOM 876 ND1 HIS A 53 3.780 -20.555 -9.318 1.00 0.00 N ATOM 877 CD2 HIS A 53 3.342 -18.630 -8.423 1.00 0.00 C ATOM 878 CE1 HIS A 53 3.518 -19.679 -10.281 1.00 0.00 C ATOM 879 NE2 HIS A 53 3.249 -18.485 -9.795 1.00 0.00 N ATOM 0 H HIS A 53 1.512 -19.867 -6.524 1.00 0.00 H new ATOM 0 HA HIS A 53 3.425 -20.502 -4.715 1.00 0.00 H new ATOM 0 HB2 HIS A 53 4.994 -20.740 -6.665 1.00 0.00 H new ATOM 0 HB3 HIS A 53 3.458 -21.571 -6.810 1.00 0.00 H new ATOM 0 HD1 HIS A 53 4.014 -21.538 -9.454 1.00 0.00 H new ATOM 0 HD2 HIS A 53 3.170 -17.842 -7.705 1.00 0.00 H new ATOM 0 HE1 HIS A 53 3.525 -19.917 -11.334 1.00 0.00 H new ATOM 887 N LEU A 54 4.985 -18.829 -4.048 1.00 0.00 N ATOM 888 CA LEU A 54 5.696 -17.780 -3.305 1.00 0.00 C ATOM 889 C LEU A 54 6.395 -16.660 -4.059 1.00 0.00 C ATOM 890 O LEU A 54 6.090 -15.504 -3.828 1.00 0.00 O ATOM 891 CB LEU A 54 6.719 -18.426 -2.359 1.00 0.00 C ATOM 892 CG LEU A 54 6.159 -19.339 -1.254 1.00 0.00 C ATOM 893 CD1 LEU A 54 7.319 -20.020 -0.530 1.00 0.00 C ATOM 894 CD2 LEU A 54 5.309 -18.558 -0.247 1.00 0.00 C ATOM 0 H LEU A 54 5.064 -19.749 -3.614 1.00 0.00 H new ATOM 0 HA LEU A 54 4.871 -17.268 -2.809 1.00 0.00 H new ATOM 0 HB2 LEU A 54 7.418 -19.008 -2.960 1.00 0.00 H new ATOM 0 HB3 LEU A 54 7.293 -17.630 -1.884 1.00 0.00 H new ATOM 0 HG LEU A 54 5.515 -20.084 -1.722 1.00 0.00 H new ATOM 0 HD11 LEU A 54 6.928 -20.668 0.254 1.00 0.00 H new ATOM 0 HD12 LEU A 54 7.892 -20.615 -1.241 1.00 0.00 H new ATOM 0 HD13 LEU A 54 7.966 -19.263 -0.086 1.00 0.00 H new ATOM 0 HD21 LEU A 54 4.932 -19.239 0.517 1.00 0.00 H new ATOM 0 HD22 LEU A 54 5.919 -17.787 0.223 1.00 0.00 H new ATOM 0 HD23 LEU A 54 4.470 -18.092 -0.763 1.00 0.00 H new ATOM 906 N GLU A 55 7.336 -16.972 -4.937 1.00 0.00 N ATOM 907 CA GLU A 55 8.110 -15.911 -5.586 1.00 0.00 C ATOM 908 C GLU A 55 7.234 -14.922 -6.341 1.00 0.00 C ATOM 909 O GLU A 55 7.313 -13.700 -6.122 1.00 0.00 O ATOM 910 CB GLU A 55 9.119 -16.495 -6.571 1.00 0.00 C ATOM 911 CG GLU A 55 10.358 -17.096 -5.934 1.00 0.00 C ATOM 912 CD GLU A 55 11.562 -17.004 -6.866 1.00 0.00 C ATOM 913 OE1 GLU A 55 12.686 -16.796 -6.372 1.00 0.00 O ATOM 914 OE2 GLU A 55 11.379 -17.109 -8.099 1.00 0.00 O ATOM 0 H GLU A 55 7.582 -17.922 -5.215 1.00 0.00 H new ATOM 0 HA GLU A 55 8.621 -15.384 -4.780 1.00 0.00 H new ATOM 0 HB2 GLU A 55 8.623 -17.264 -7.164 1.00 0.00 H new ATOM 0 HB3 GLU A 55 9.427 -15.710 -7.261 1.00 0.00 H new ATOM 0 HG2 GLU A 55 10.578 -16.577 -5.001 1.00 0.00 H new ATOM 0 HG3 GLU A 55 10.170 -18.140 -5.682 1.00 0.00 H new ATOM 921 N LYS A 56 6.404 -15.441 -7.238 1.00 0.00 N ATOM 922 CA LYS A 56 5.561 -14.575 -8.047 1.00 0.00 C ATOM 923 C LYS A 56 4.617 -13.825 -7.145 1.00 0.00 C ATOM 924 O LYS A 56 4.474 -12.627 -7.285 1.00 0.00 O ATOM 925 CB LYS A 56 4.734 -15.361 -9.063 1.00 0.00 C ATOM 926 CG LYS A 56 3.943 -14.440 -9.996 1.00 0.00 C ATOM 927 CD LYS A 56 2.779 -15.140 -10.642 1.00 0.00 C ATOM 928 CE LYS A 56 1.925 -14.119 -11.377 1.00 0.00 C ATOM 929 NZ LYS A 56 0.660 -14.728 -11.871 1.00 0.00 N ATOM 0 H LYS A 56 6.298 -16.439 -7.420 1.00 0.00 H new ATOM 0 HA LYS A 56 6.215 -13.895 -8.592 1.00 0.00 H new ATOM 0 HB2 LYS A 56 5.394 -15.995 -9.654 1.00 0.00 H new ATOM 0 HB3 LYS A 56 4.045 -16.021 -8.536 1.00 0.00 H new ATOM 0 HG2 LYS A 56 3.579 -13.581 -9.432 1.00 0.00 H new ATOM 0 HG3 LYS A 56 4.607 -14.055 -10.770 1.00 0.00 H new ATOM 0 HD2 LYS A 56 3.137 -15.900 -11.337 1.00 0.00 H new ATOM 0 HD3 LYS A 56 2.184 -15.653 -9.887 1.00 0.00 H new ATOM 0 HE2 LYS A 56 1.695 -13.287 -10.711 1.00 0.00 H new ATOM 0 HE3 LYS A 56 2.486 -13.709 -12.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 0.099 -14.007 -12.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 0.881 -15.506 -12.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 0.115 -15.097 -11.066 1.00 0.00 H new ATOM 943 N LYS A 57 3.968 -14.530 -6.230 1.00 0.00 N ATOM 944 CA LYS A 57 2.976 -13.896 -5.372 1.00 0.00 C ATOM 945 C LYS A 57 3.578 -12.749 -4.590 1.00 0.00 C ATOM 946 O LYS A 57 3.035 -11.655 -4.601 1.00 0.00 O ATOM 947 CB LYS A 57 2.361 -14.915 -4.423 1.00 0.00 C ATOM 948 CG LYS A 57 0.858 -14.767 -4.261 1.00 0.00 C ATOM 949 CD LYS A 57 0.467 -13.459 -3.609 1.00 0.00 C ATOM 950 CE LYS A 57 -1.012 -13.419 -3.407 1.00 0.00 C ATOM 951 NZ LYS A 57 -1.495 -12.179 -2.715 1.00 0.00 N ATOM 0 H LYS A 57 4.107 -15.527 -6.063 1.00 0.00 H new ATOM 0 HA LYS A 57 2.192 -13.493 -6.013 1.00 0.00 H new ATOM 0 HB2 LYS A 57 2.581 -15.918 -4.788 1.00 0.00 H new ATOM 0 HB3 LYS A 57 2.834 -14.820 -3.446 1.00 0.00 H new ATOM 0 HG2 LYS A 57 0.383 -14.837 -5.239 1.00 0.00 H new ATOM 0 HG3 LYS A 57 0.478 -15.595 -3.662 1.00 0.00 H new ATOM 0 HD2 LYS A 57 0.977 -13.352 -2.652 1.00 0.00 H new ATOM 0 HD3 LYS A 57 0.781 -12.622 -4.233 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -1.504 -13.498 -4.376 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -1.314 -14.290 -2.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -2.457 -12.336 -2.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -0.860 -11.954 -1.923 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -1.503 -11.387 -3.388 1.00 0.00 H new ATOM 965 N LEU A 58 4.704 -12.990 -3.936 1.00 0.00 N ATOM 966 CA LEU A 58 5.357 -11.944 -3.163 1.00 0.00 C ATOM 967 C LEU A 58 5.695 -10.787 -4.088 1.00 0.00 C ATOM 968 O LEU A 58 5.387 -9.636 -3.791 1.00 0.00 O ATOM 969 CB LEU A 58 6.643 -12.469 -2.508 1.00 0.00 C ATOM 970 CG LEU A 58 6.464 -13.435 -1.322 1.00 0.00 C ATOM 971 CD1 LEU A 58 7.789 -14.145 -1.036 1.00 0.00 C ATOM 972 CD2 LEU A 58 5.997 -12.702 -0.072 1.00 0.00 C ATOM 0 H LEU A 58 5.181 -13.891 -3.924 1.00 0.00 H new ATOM 0 HA LEU A 58 4.681 -11.613 -2.374 1.00 0.00 H new ATOM 0 HB2 LEU A 58 7.234 -12.973 -3.273 1.00 0.00 H new ATOM 0 HB3 LEU A 58 7.226 -11.614 -2.167 1.00 0.00 H new ATOM 0 HG LEU A 58 5.700 -14.164 -1.591 1.00 0.00 H new ATOM 0 HD11 LEU A 58 7.662 -14.829 -0.197 1.00 0.00 H new ATOM 0 HD12 LEU A 58 8.099 -14.707 -1.917 1.00 0.00 H new ATOM 0 HD13 LEU A 58 8.552 -13.406 -0.790 1.00 0.00 H new ATOM 0 HD21 LEU A 58 5.881 -13.414 0.745 1.00 0.00 H new ATOM 0 HD22 LEU A 58 6.734 -11.949 0.205 1.00 0.00 H new ATOM 0 HD23 LEU A 58 5.041 -12.218 -0.270 1.00 0.00 H new ATOM 984 N ARG A 59 6.320 -11.076 -5.222 1.00 0.00 N ATOM 985 CA ARG A 59 6.717 -9.992 -6.125 1.00 0.00 C ATOM 986 C ARG A 59 5.520 -9.185 -6.627 1.00 0.00 C ATOM 987 O ARG A 59 5.612 -7.971 -6.720 1.00 0.00 O ATOM 988 CB ARG A 59 7.543 -10.540 -7.290 1.00 0.00 C ATOM 989 CG ARG A 59 8.940 -10.975 -6.842 1.00 0.00 C ATOM 990 CD ARG A 59 9.641 -11.851 -7.868 1.00 0.00 C ATOM 991 NE ARG A 59 10.868 -12.421 -7.283 1.00 0.00 N ATOM 992 CZ ARG A 59 11.459 -13.546 -7.670 1.00 0.00 C ATOM 993 NH1 ARG A 59 11.012 -14.270 -8.663 1.00 0.00 N ATOM 994 NH2 ARG A 59 12.508 -13.962 -7.020 1.00 0.00 N ATOM 0 H ARG A 59 6.559 -12.017 -5.536 1.00 0.00 H new ATOM 0 HA ARG A 59 7.338 -9.303 -5.552 1.00 0.00 H new ATOM 0 HB2 ARG A 59 7.024 -11.388 -7.736 1.00 0.00 H new ATOM 0 HB3 ARG A 59 7.631 -9.777 -8.064 1.00 0.00 H new ATOM 0 HG2 ARG A 59 9.547 -10.090 -6.651 1.00 0.00 H new ATOM 0 HG3 ARG A 59 8.862 -11.518 -5.900 1.00 0.00 H new ATOM 0 HD2 ARG A 59 8.976 -12.651 -8.192 1.00 0.00 H new ATOM 0 HD3 ARG A 59 9.888 -11.264 -8.753 1.00 0.00 H new ATOM 0 HE ARG A 59 11.300 -11.908 -6.515 1.00 0.00 H new ATOM 0 HH11 ARG A 59 10.179 -13.977 -9.173 1.00 0.00 H new ATOM 0 HH12 ARG A 59 11.497 -15.128 -8.927 1.00 0.00 H new ATOM 0 HH21 ARG A 59 12.863 -13.426 -6.228 1.00 0.00 H new ATOM 0 HH22 ARG A 59 12.975 -14.824 -7.303 1.00 0.00 H new ATOM 1008 N ASP A 60 4.412 -9.839 -6.937 1.00 0.00 N ATOM 1009 CA ASP A 60 3.227 -9.144 -7.452 1.00 0.00 C ATOM 1010 C ASP A 60 2.480 -8.352 -6.375 1.00 0.00 C ATOM 1011 O ASP A 60 2.101 -7.210 -6.600 1.00 0.00 O ATOM 1012 CB ASP A 60 2.253 -10.151 -8.090 1.00 0.00 C ATOM 1013 CG ASP A 60 1.920 -9.817 -9.543 1.00 0.00 C ATOM 1014 OD1 ASP A 60 1.965 -8.626 -9.928 1.00 0.00 O ATOM 1015 OD2 ASP A 60 1.621 -10.769 -10.311 1.00 0.00 O ATOM 0 H ASP A 60 4.301 -10.849 -6.844 1.00 0.00 H new ATOM 0 HA ASP A 60 3.590 -8.434 -8.195 1.00 0.00 H new ATOM 0 HB2 ASP A 60 2.688 -11.149 -8.042 1.00 0.00 H new ATOM 0 HB3 ASP A 60 1.332 -10.176 -7.508 1.00 0.00 H new ATOM 1020 N GLU A 61 2.261 -8.938 -5.207 1.00 0.00 N ATOM 1021 CA GLU A 61 1.495 -8.256 -4.156 1.00 0.00 C ATOM 1022 C GLU A 61 2.290 -7.054 -3.607 1.00 0.00 C ATOM 1023 O GLU A 61 1.759 -5.938 -3.438 1.00 0.00 O ATOM 1024 CB GLU A 61 1.087 -9.263 -3.058 1.00 0.00 C ATOM 1025 CG GLU A 61 2.198 -9.682 -2.092 1.00 0.00 C ATOM 1026 CD GLU A 61 1.829 -10.870 -1.224 1.00 0.00 C ATOM 1027 OE1 GLU A 61 2.729 -11.361 -0.511 1.00 0.00 O ATOM 1028 OE2 GLU A 61 0.662 -11.325 -1.252 1.00 0.00 O ATOM 0 H GLU A 61 2.594 -9.870 -4.958 1.00 0.00 H new ATOM 0 HA GLU A 61 0.573 -7.854 -4.575 1.00 0.00 H new ATOM 0 HB2 GLU A 61 0.272 -8.829 -2.478 1.00 0.00 H new ATOM 0 HB3 GLU A 61 0.694 -10.158 -3.540 1.00 0.00 H new ATOM 0 HG2 GLU A 61 3.094 -9.924 -2.664 1.00 0.00 H new ATOM 0 HG3 GLU A 61 2.448 -8.837 -1.450 1.00 0.00 H new ATOM 1035 N ILE A 62 3.576 -7.266 -3.370 1.00 0.00 N ATOM 1036 CA ILE A 62 4.454 -6.193 -2.948 1.00 0.00 C ATOM 1037 C ILE A 62 4.511 -5.150 -4.074 1.00 0.00 C ATOM 1038 O ILE A 62 4.619 -3.971 -3.796 1.00 0.00 O ATOM 1039 CB ILE A 62 5.862 -6.741 -2.542 1.00 0.00 C ATOM 1040 CG1 ILE A 62 5.705 -7.750 -1.376 1.00 0.00 C ATOM 1041 CG2 ILE A 62 6.787 -5.610 -2.071 1.00 0.00 C ATOM 1042 CD1 ILE A 62 6.987 -8.470 -0.967 1.00 0.00 C ATOM 0 H ILE A 62 4.032 -8.174 -3.464 1.00 0.00 H new ATOM 0 HA ILE A 62 4.066 -5.710 -2.051 1.00 0.00 H new ATOM 0 HB ILE A 62 6.299 -7.219 -3.419 1.00 0.00 H new ATOM 0 HG12 ILE A 62 5.311 -7.221 -0.508 1.00 0.00 H new ATOM 0 HG13 ILE A 62 4.962 -8.496 -1.659 1.00 0.00 H new ATOM 0 HG21 ILE A 62 7.757 -6.024 -1.796 1.00 0.00 H new ATOM 0 HG22 ILE A 62 6.916 -4.886 -2.876 1.00 0.00 H new ATOM 0 HG23 ILE A 62 6.345 -5.115 -1.206 1.00 0.00 H new ATOM 0 HD11 ILE A 62 6.774 -9.153 -0.145 1.00 0.00 H new ATOM 0 HD12 ILE A 62 7.375 -9.033 -1.816 1.00 0.00 H new ATOM 0 HD13 ILE A 62 7.729 -7.738 -0.648 1.00 0.00 H new ATOM 1054 N ASN A 63 4.405 -5.550 -5.338 1.00 0.00 N ATOM 1055 CA ASN A 63 4.353 -4.561 -6.430 1.00 0.00 C ATOM 1056 C ASN A 63 3.045 -3.750 -6.400 1.00 0.00 C ATOM 1057 O ASN A 63 3.037 -2.577 -6.764 1.00 0.00 O ATOM 1058 CB ASN A 63 4.502 -5.226 -7.800 1.00 0.00 C ATOM 1059 CG ASN A 63 4.565 -4.226 -8.922 1.00 0.00 C ATOM 1060 OD1 ASN A 63 5.377 -3.302 -8.910 1.00 0.00 O ATOM 1061 ND2 ASN A 63 3.723 -4.403 -9.902 1.00 0.00 N ATOM 0 H ASN A 63 4.354 -6.524 -5.635 1.00 0.00 H new ATOM 0 HA ASN A 63 5.192 -3.884 -6.272 1.00 0.00 H new ATOM 0 HB2 ASN A 63 5.406 -5.834 -7.809 1.00 0.00 H new ATOM 0 HB3 ASN A 63 3.662 -5.901 -7.966 1.00 0.00 H new ATOM 0 HD21 ASN A 63 3.723 -3.763 -10.696 1.00 0.00 H new ATOM 0 HD22 ASN A 63 3.065 -5.182 -9.875 1.00 0.00 H new ATOM 1068 N LEU A 64 1.944 -4.346 -5.963 1.00 0.00 N ATOM 1069 CA LEU A 64 0.683 -3.602 -5.825 1.00 0.00 C ATOM 1070 C LEU A 64 0.842 -2.610 -4.677 1.00 0.00 C ATOM 1071 O LEU A 64 0.507 -1.421 -4.795 1.00 0.00 O ATOM 1072 CB LEU A 64 -0.496 -4.539 -5.520 1.00 0.00 C ATOM 1073 CG LEU A 64 -0.922 -5.521 -6.622 1.00 0.00 C ATOM 1074 CD1 LEU A 64 -1.921 -6.519 -6.043 1.00 0.00 C ATOM 1075 CD2 LEU A 64 -1.545 -4.787 -7.815 1.00 0.00 C ATOM 0 H LEU A 64 1.890 -5.330 -5.699 1.00 0.00 H new ATOM 0 HA LEU A 64 0.470 -3.092 -6.764 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -0.245 -5.118 -4.631 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -1.359 -3.923 -5.266 1.00 0.00 H new ATOM 0 HG LEU A 64 -0.037 -6.045 -6.982 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -2.228 -7.219 -6.820 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.455 -7.067 -5.224 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.795 -5.985 -5.671 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -1.835 -5.511 -8.576 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -2.425 -4.236 -7.484 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -0.818 -4.091 -8.234 1.00 0.00 H new ATOM 1087 N ALA A 65 1.374 -3.093 -3.564 1.00 0.00 N ATOM 1088 CA ALA A 65 1.601 -2.225 -2.409 1.00 0.00 C ATOM 1089 C ALA A 65 2.629 -1.119 -2.741 1.00 0.00 C ATOM 1090 O ALA A 65 2.556 -0.001 -2.239 1.00 0.00 O ATOM 1091 CB ALA A 65 2.059 -3.054 -1.249 1.00 0.00 C ATOM 0 H ALA A 65 1.654 -4.065 -3.432 1.00 0.00 H new ATOM 0 HA ALA A 65 0.666 -1.730 -2.146 1.00 0.00 H new ATOM 0 HB1 ALA A 65 2.229 -2.410 -0.386 1.00 0.00 H new ATOM 0 HB2 ALA A 65 1.295 -3.793 -1.006 1.00 0.00 H new ATOM 0 HB3 ALA A 65 2.986 -3.564 -1.510 1.00 0.00 H new ATOM 1097 N LYS A 66 3.576 -1.434 -3.611 1.00 0.00 N ATOM 1098 CA LYS A 66 4.564 -0.463 -4.091 1.00 0.00 C ATOM 1099 C LYS A 66 3.863 0.643 -4.864 1.00 0.00 C ATOM 1100 O LYS A 66 4.248 1.804 -4.762 1.00 0.00 O ATOM 1101 CB LYS A 66 5.576 -1.169 -4.999 1.00 0.00 C ATOM 1102 CG LYS A 66 6.593 -0.272 -5.679 1.00 0.00 C ATOM 1103 CD LYS A 66 7.290 -1.066 -6.764 1.00 0.00 C ATOM 1104 CE LYS A 66 8.166 -0.181 -7.624 1.00 0.00 C ATOM 1105 NZ LYS A 66 8.632 -0.958 -8.820 1.00 0.00 N ATOM 0 H LYS A 66 3.687 -2.367 -4.008 1.00 0.00 H new ATOM 0 HA LYS A 66 5.086 -0.027 -3.239 1.00 0.00 H new ATOM 0 HB2 LYS A 66 6.112 -1.910 -4.406 1.00 0.00 H new ATOM 0 HB3 LYS A 66 5.028 -1.713 -5.768 1.00 0.00 H new ATOM 0 HG2 LYS A 66 6.101 0.601 -6.107 1.00 0.00 H new ATOM 0 HG3 LYS A 66 7.319 0.095 -4.953 1.00 0.00 H new ATOM 0 HD2 LYS A 66 7.897 -1.849 -6.310 1.00 0.00 H new ATOM 0 HD3 LYS A 66 6.546 -1.561 -7.389 1.00 0.00 H new ATOM 0 HE2 LYS A 66 7.610 0.701 -7.943 1.00 0.00 H new ATOM 0 HE3 LYS A 66 9.022 0.172 -7.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 9.235 -0.353 -9.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 9.176 -1.786 -8.505 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 7.809 -1.274 -9.371 1.00 0.00 H new ATOM 1119 N GLN A 67 2.835 0.300 -5.627 1.00 0.00 N ATOM 1120 CA GLN A 67 2.079 1.316 -6.355 1.00 0.00 C ATOM 1121 C GLN A 67 1.369 2.177 -5.324 1.00 0.00 C ATOM 1122 O GLN A 67 1.423 3.395 -5.413 1.00 0.00 O ATOM 1123 CB GLN A 67 1.079 0.695 -7.334 1.00 0.00 C ATOM 1124 CG GLN A 67 1.745 0.016 -8.517 1.00 0.00 C ATOM 1125 CD GLN A 67 0.788 -0.862 -9.284 1.00 0.00 C ATOM 1126 OE1 GLN A 67 -0.178 -0.393 -9.866 1.00 0.00 O ATOM 1127 NE2 GLN A 67 1.050 -2.142 -9.289 1.00 0.00 N ATOM 0 H GLN A 67 2.507 -0.657 -5.759 1.00 0.00 H new ATOM 0 HA GLN A 67 2.758 1.917 -6.960 1.00 0.00 H new ATOM 0 HB2 GLN A 67 0.465 -0.033 -6.804 1.00 0.00 H new ATOM 0 HB3 GLN A 67 0.408 1.472 -7.700 1.00 0.00 H new ATOM 0 HG2 GLN A 67 2.155 0.774 -9.185 1.00 0.00 H new ATOM 0 HG3 GLN A 67 2.583 -0.585 -8.164 1.00 0.00 H new ATOM 0 HE21 GLN A 67 1.866 -2.497 -8.791 1.00 0.00 H new ATOM 0 HE22 GLN A 67 0.438 -2.786 -9.791 1.00 0.00 H new ATOM 1136 N GLU A 68 0.733 1.560 -4.332 1.00 0.00 N ATOM 1137 CA GLU A 68 0.132 2.338 -3.240 1.00 0.00 C ATOM 1138 C GLU A 68 1.173 3.261 -2.574 1.00 0.00 C ATOM 1139 O GLU A 68 0.920 4.443 -2.361 1.00 0.00 O ATOM 1140 CB GLU A 68 -0.483 1.404 -2.192 1.00 0.00 C ATOM 1141 CG GLU A 68 -1.381 2.128 -1.213 1.00 0.00 C ATOM 1142 CD GLU A 68 -2.054 1.192 -0.221 1.00 0.00 C ATOM 1143 OE1 GLU A 68 -1.855 1.371 1.000 1.00 0.00 O ATOM 1144 OE2 GLU A 68 -2.790 0.285 -0.663 1.00 0.00 O ATOM 0 H GLU A 68 0.619 0.549 -4.256 1.00 0.00 H new ATOM 0 HA GLU A 68 -0.654 2.960 -3.669 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -1.057 0.627 -2.697 1.00 0.00 H new ATOM 0 HB3 GLU A 68 0.316 0.905 -1.644 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.794 2.866 -0.667 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -2.146 2.674 -1.765 1.00 0.00 H new ATOM 1151 N ALA A 69 2.349 2.731 -2.264 1.00 0.00 N ATOM 1152 CA ALA A 69 3.410 3.523 -1.636 1.00 0.00 C ATOM 1153 C ALA A 69 3.864 4.715 -2.507 1.00 0.00 C ATOM 1154 O ALA A 69 4.094 5.824 -2.003 1.00 0.00 O ATOM 1155 CB ALA A 69 4.602 2.614 -1.317 1.00 0.00 C ATOM 0 H ALA A 69 2.597 1.756 -2.435 1.00 0.00 H new ATOM 0 HA ALA A 69 3.003 3.947 -0.718 1.00 0.00 H new ATOM 0 HB1 ALA A 69 5.393 3.201 -0.850 1.00 0.00 H new ATOM 0 HB2 ALA A 69 4.285 1.824 -0.636 1.00 0.00 H new ATOM 0 HB3 ALA A 69 4.977 2.169 -2.239 1.00 0.00 H new ATOM 1161 N GLN A 70 4.001 4.494 -3.808 1.00 0.00 N ATOM 1162 CA GLN A 70 4.408 5.565 -4.718 1.00 0.00 C ATOM 1163 C GLN A 70 3.346 6.653 -4.706 1.00 0.00 C ATOM 1164 O GLN A 70 3.662 7.839 -4.676 1.00 0.00 O ATOM 1165 CB GLN A 70 4.590 5.038 -6.146 1.00 0.00 C ATOM 1166 CG GLN A 70 5.148 6.096 -7.103 1.00 0.00 C ATOM 1167 CD GLN A 70 5.316 5.580 -8.514 1.00 0.00 C ATOM 1168 OE1 GLN A 70 5.827 4.483 -8.732 1.00 0.00 O ATOM 1169 NE2 GLN A 70 4.903 6.360 -9.473 1.00 0.00 N ATOM 0 H GLN A 70 3.839 3.593 -4.257 1.00 0.00 H new ATOM 0 HA GLN A 70 5.364 5.966 -4.382 1.00 0.00 H new ATOM 0 HB2 GLN A 70 5.262 4.180 -6.129 1.00 0.00 H new ATOM 0 HB3 GLN A 70 3.630 4.684 -6.523 1.00 0.00 H new ATOM 0 HG2 GLN A 70 4.481 6.958 -7.113 1.00 0.00 H new ATOM 0 HG3 GLN A 70 6.112 6.443 -6.731 1.00 0.00 H new ATOM 0 HE21 GLN A 70 4.484 7.263 -9.251 1.00 0.00 H new ATOM 0 HE22 GLN A 70 4.999 6.067 -10.445 1.00 0.00 H new ATOM 1178 N ARG A 71 2.089 6.239 -4.706 1.00 0.00 N ATOM 1179 CA ARG A 71 0.976 7.179 -4.676 1.00 0.00 C ATOM 1180 C ARG A 71 1.009 7.991 -3.391 1.00 0.00 C ATOM 1181 O ARG A 71 0.736 9.176 -3.407 1.00 0.00 O ATOM 1182 CB ARG A 71 -0.344 6.418 -4.819 1.00 0.00 C ATOM 1183 CG ARG A 71 -0.534 5.865 -6.213 1.00 0.00 C ATOM 1184 CD ARG A 71 -1.604 4.810 -6.304 1.00 0.00 C ATOM 1185 NE ARG A 71 -1.771 4.448 -7.720 1.00 0.00 N ATOM 1186 CZ ARG A 71 -2.556 3.488 -8.191 1.00 0.00 C ATOM 1187 NH1 ARG A 71 -3.302 2.745 -7.417 1.00 0.00 N ATOM 1188 NH2 ARG A 71 -2.593 3.281 -9.476 1.00 0.00 N ATOM 0 H ARG A 71 1.812 5.258 -4.726 1.00 0.00 H new ATOM 0 HA ARG A 71 1.064 7.874 -5.511 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -0.370 5.600 -4.099 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -1.173 7.083 -4.577 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -0.784 6.683 -6.888 1.00 0.00 H new ATOM 0 HG3 ARG A 71 0.410 5.444 -6.559 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -1.326 3.934 -5.718 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -2.542 5.183 -5.894 1.00 0.00 H new ATOM 0 HE ARG A 71 -1.234 4.984 -8.402 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -3.295 2.893 -6.408 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -3.891 2.017 -7.822 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -2.025 3.852 -10.101 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -3.190 2.547 -9.857 1.00 0.00 H new ATOM 1202 N LEU A 72 1.374 7.369 -2.277 1.00 0.00 N ATOM 1203 CA LEU A 72 1.470 8.080 -1.005 1.00 0.00 C ATOM 1204 C LEU A 72 2.681 9.004 -1.015 1.00 0.00 C ATOM 1205 O LEU A 72 2.690 10.039 -0.349 1.00 0.00 O ATOM 1206 CB LEU A 72 1.517 7.085 0.151 1.00 0.00 C ATOM 1207 CG LEU A 72 0.123 6.479 0.376 1.00 0.00 C ATOM 1208 CD1 LEU A 72 0.193 5.063 0.851 1.00 0.00 C ATOM 1209 CD2 LEU A 72 -0.687 7.318 1.364 1.00 0.00 C ATOM 0 H LEU A 72 1.608 6.377 -2.227 1.00 0.00 H new ATOM 0 HA LEU A 72 0.585 8.700 -0.865 1.00 0.00 H new ATOM 0 HB2 LEU A 72 2.236 6.295 -0.067 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.857 7.584 1.058 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.379 6.483 -0.592 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -0.816 4.678 0.996 1.00 0.00 H new ATOM 0 HD12 LEU A 72 0.710 4.455 0.109 1.00 0.00 H new ATOM 0 HD13 LEU A 72 0.736 5.022 1.795 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.669 6.867 1.505 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -0.165 7.358 2.320 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -0.805 8.328 0.972 1.00 0.00 H new ATOM 1221 N LYS A 73 3.700 8.657 -1.789 1.00 0.00 N ATOM 1222 CA LYS A 73 4.862 9.538 -1.927 1.00 0.00 C ATOM 1223 C LYS A 73 4.530 10.755 -2.794 1.00 0.00 C ATOM 1224 O LYS A 73 4.854 11.881 -2.438 1.00 0.00 O ATOM 1225 CB LYS A 73 6.042 8.784 -2.532 1.00 0.00 C ATOM 1226 CG LYS A 73 7.349 9.573 -2.475 1.00 0.00 C ATOM 1227 CD LYS A 73 8.457 8.889 -3.263 1.00 0.00 C ATOM 1228 CE LYS A 73 8.847 7.546 -2.644 1.00 0.00 C ATOM 1229 NZ LYS A 73 10.000 6.938 -3.379 1.00 0.00 N ATOM 0 H LYS A 73 3.751 7.790 -2.324 1.00 0.00 H new ATOM 0 HA LYS A 73 5.134 9.883 -0.929 1.00 0.00 H new ATOM 0 HB2 LYS A 73 6.171 7.839 -2.004 1.00 0.00 H new ATOM 0 HB3 LYS A 73 5.816 8.540 -3.570 1.00 0.00 H new ATOM 0 HG2 LYS A 73 7.186 10.575 -2.872 1.00 0.00 H new ATOM 0 HG3 LYS A 73 7.659 9.688 -1.436 1.00 0.00 H new ATOM 0 HD2 LYS A 73 8.130 8.734 -4.291 1.00 0.00 H new ATOM 0 HD3 LYS A 73 9.331 9.539 -3.301 1.00 0.00 H new ATOM 0 HE2 LYS A 73 9.111 7.686 -1.596 1.00 0.00 H new ATOM 0 HE3 LYS A 73 7.995 6.867 -2.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 10.248 6.027 -2.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 9.736 6.785 -4.373 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 10.818 7.579 -3.333 1.00 0.00 H new ATOM 1243 N GLU A 74 3.886 10.554 -3.927 1.00 0.00 N ATOM 1244 CA GLU A 74 3.560 11.695 -4.785 1.00 0.00 C ATOM 1245 C GLU A 74 2.525 12.575 -4.073 1.00 0.00 C ATOM 1246 O GLU A 74 2.553 13.800 -4.186 1.00 0.00 O ATOM 1247 CB GLU A 74 3.128 11.222 -6.177 1.00 0.00 C ATOM 1248 CG GLU A 74 4.314 10.554 -6.907 1.00 0.00 C ATOM 1249 CD GLU A 74 4.082 10.310 -8.393 1.00 0.00 C ATOM 1250 OE1 GLU A 74 3.782 11.283 -9.125 1.00 0.00 O ATOM 1251 OE2 GLU A 74 4.237 9.145 -8.837 1.00 0.00 O ATOM 0 H GLU A 74 3.582 9.644 -4.274 1.00 0.00 H new ATOM 0 HA GLU A 74 4.442 12.313 -4.955 1.00 0.00 H new ATOM 0 HB2 GLU A 74 2.302 10.516 -6.089 1.00 0.00 H new ATOM 0 HB3 GLU A 74 2.763 12.068 -6.759 1.00 0.00 H new ATOM 0 HG2 GLU A 74 5.198 11.181 -6.788 1.00 0.00 H new ATOM 0 HG3 GLU A 74 4.532 9.601 -6.424 1.00 0.00 H new ATOM 1258 N LEU A 75 1.653 11.952 -3.291 1.00 0.00 N ATOM 1259 CA LEU A 75 0.710 12.676 -2.437 1.00 0.00 C ATOM 1260 C LEU A 75 1.464 13.530 -1.403 1.00 0.00 C ATOM 1261 O LEU A 75 1.187 14.727 -1.257 1.00 0.00 O ATOM 1262 CB LEU A 75 -0.189 11.661 -1.720 1.00 0.00 C ATOM 1263 CG LEU A 75 -1.222 12.148 -0.698 1.00 0.00 C ATOM 1264 CD1 LEU A 75 -2.371 12.872 -1.330 1.00 0.00 C ATOM 1265 CD2 LEU A 75 -1.745 10.933 0.056 1.00 0.00 C ATOM 0 H LEU A 75 1.576 10.937 -3.228 1.00 0.00 H new ATOM 0 HA LEU A 75 0.104 13.341 -3.052 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -0.728 11.105 -2.487 1.00 0.00 H new ATOM 0 HB3 LEU A 75 0.463 10.952 -1.211 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.732 12.858 -0.032 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -3.069 13.192 -0.556 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.000 13.744 -1.868 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -2.882 12.207 -2.026 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -2.484 11.251 0.792 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.208 10.240 -0.647 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.918 10.436 0.564 1.00 0.00 H new ATOM 1277 N ARG A 76 2.424 12.935 -0.692 1.00 0.00 N ATOM 1278 CA ARG A 76 3.174 13.674 0.344 1.00 0.00 C ATOM 1279 C ARG A 76 4.063 14.768 -0.243 1.00 0.00 C ATOM 1280 O ARG A 76 4.544 15.632 0.485 1.00 0.00 O ATOM 1281 CB ARG A 76 3.997 12.725 1.244 1.00 0.00 C ATOM 1282 CG ARG A 76 5.358 12.311 0.694 1.00 0.00 C ATOM 1283 CD ARG A 76 6.513 13.047 1.344 1.00 0.00 C ATOM 1284 NE ARG A 76 7.685 13.055 0.455 1.00 0.00 N ATOM 1285 CZ ARG A 76 8.850 13.627 0.722 1.00 0.00 C ATOM 1286 NH1 ARG A 76 9.084 14.245 1.855 1.00 0.00 N ATOM 1287 NH2 ARG A 76 9.794 13.583 -0.174 1.00 0.00 N ATOM 0 H ARG A 76 2.702 11.960 -0.806 1.00 0.00 H new ATOM 0 HA ARG A 76 2.425 14.165 0.965 1.00 0.00 H new ATOM 0 HB2 ARG A 76 4.147 13.208 2.210 1.00 0.00 H new ATOM 0 HB3 ARG A 76 3.409 11.825 1.426 1.00 0.00 H new ATOM 0 HG2 ARG A 76 5.491 11.239 0.839 1.00 0.00 H new ATOM 0 HG3 ARG A 76 5.379 12.492 -0.381 1.00 0.00 H new ATOM 0 HD2 ARG A 76 6.216 14.070 1.574 1.00 0.00 H new ATOM 0 HD3 ARG A 76 6.770 12.570 2.290 1.00 0.00 H new ATOM 0 HE ARG A 76 7.593 12.580 -0.443 1.00 0.00 H new ATOM 0 HH11 ARG A 76 8.356 14.297 2.567 1.00 0.00 H new ATOM 0 HH12 ARG A 76 9.994 14.673 2.024 1.00 0.00 H new ATOM 0 HH21 ARG A 76 9.630 13.113 -1.065 1.00 0.00 H new ATOM 0 HH22 ARG A 76 10.697 14.018 0.015 1.00 0.00 H new ATOM 1301 N GLU A 77 4.276 14.745 -1.551 1.00 0.00 N ATOM 1302 CA GLU A 77 5.048 15.802 -2.213 1.00 0.00 C ATOM 1303 C GLU A 77 4.112 16.845 -2.844 1.00 0.00 C ATOM 1304 O GLU A 77 4.564 17.832 -3.431 1.00 0.00 O ATOM 1305 CB GLU A 77 6.030 15.186 -3.220 1.00 0.00 C ATOM 1306 CG GLU A 77 7.105 14.390 -2.473 1.00 0.00 C ATOM 1307 CD GLU A 77 8.144 13.708 -3.346 1.00 0.00 C ATOM 1308 OE1 GLU A 77 8.264 14.008 -4.547 1.00 0.00 O ATOM 1309 OE2 GLU A 77 8.873 12.843 -2.780 1.00 0.00 O ATOM 0 H GLU A 77 3.931 14.016 -2.175 1.00 0.00 H new ATOM 0 HA GLU A 77 5.645 16.335 -1.473 1.00 0.00 H new ATOM 0 HB2 GLU A 77 5.496 14.534 -3.911 1.00 0.00 H new ATOM 0 HB3 GLU A 77 6.494 15.971 -3.817 1.00 0.00 H new ATOM 0 HG2 GLU A 77 7.619 15.063 -1.787 1.00 0.00 H new ATOM 0 HG3 GLU A 77 6.613 13.631 -1.865 1.00 0.00 H new ATOM 1316 N GLY A 78 2.806 16.634 -2.697 1.00 0.00 N ATOM 1317 CA GLY A 78 1.813 17.567 -3.219 1.00 0.00 C ATOM 1318 C GLY A 78 1.006 18.256 -2.130 1.00 0.00 C ATOM 1319 O GLY A 78 -0.068 18.809 -2.385 1.00 0.00 O ATOM 0 H GLY A 78 2.411 15.824 -2.220 1.00 0.00 H new ATOM 0 HA2 GLY A 78 2.316 18.323 -3.822 1.00 0.00 H new ATOM 0 HA3 GLY A 78 1.133 17.031 -3.881 1.00 0.00 H new ATOM 1323 N THR A 79 1.509 18.218 -0.907 1.00 0.00 N ATOM 1324 CA THR A 79 0.806 18.794 0.241 1.00 0.00 C ATOM 1325 C THR A 79 0.699 20.317 0.165 1.00 0.00 C ATOM 1326 O THR A 79 1.693 21.004 -0.066 1.00 0.00 O ATOM 1327 CB THR A 79 1.530 18.425 1.531 1.00 0.00 C ATOM 1328 OG1 THR A 79 2.857 18.940 1.489 1.00 0.00 O ATOM 1329 CG2 THR A 79 1.634 16.936 1.666 1.00 0.00 C ATOM 0 H THR A 79 2.407 17.793 -0.677 1.00 0.00 H new ATOM 0 HA THR A 79 -0.203 18.382 0.227 1.00 0.00 H new ATOM 0 HB THR A 79 0.969 18.840 2.368 1.00 0.00 H new ATOM 0 HG1 THR A 79 2.854 19.815 1.049 1.00 0.00 H new ATOM 0 HG21 THR A 79 2.153 16.690 2.592 1.00 0.00 H new ATOM 0 HG22 THR A 79 0.634 16.502 1.684 1.00 0.00 H new ATOM 0 HG23 THR A 79 2.190 16.532 0.820 1.00 0.00 H new ATOM 1337 N GLU A 80 -0.521 20.819 0.350 1.00 0.00 N ATOM 1338 CA GLU A 80 -0.847 22.258 0.238 1.00 0.00 C ATOM 1339 C GLU A 80 -0.296 22.820 -1.086 1.00 0.00 C ATOM 1340 O GLU A 80 0.203 23.943 -1.166 1.00 0.00 O ATOM 1341 CB GLU A 80 -0.375 23.065 1.471 1.00 0.00 C ATOM 1342 CG GLU A 80 -1.175 24.383 1.664 1.00 0.00 C ATOM 1343 CD GLU A 80 -0.792 25.177 2.916 1.00 0.00 C ATOM 1344 OE1 GLU A 80 -1.318 26.305 3.086 1.00 0.00 O ATOM 1345 OE2 GLU A 80 0.013 24.699 3.745 1.00 0.00 O ATOM 0 H GLU A 80 -1.327 20.239 0.585 1.00 0.00 H new ATOM 0 HA GLU A 80 -1.932 22.364 0.222 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -0.476 22.449 2.364 1.00 0.00 H new ATOM 0 HB3 GLU A 80 0.684 23.299 1.364 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -1.027 25.015 0.788 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -2.238 24.145 1.710 1.00 0.00 H new ATOM 1352 N ASN A 81 -0.387 21.999 -2.125 1.00 0.00 N ATOM 1353 CA ASN A 81 0.106 22.363 -3.447 1.00 0.00 C ATOM 1354 C ASN A 81 -1.050 22.405 -4.452 1.00 0.00 C ATOM 1355 O ASN A 81 -1.588 23.478 -4.709 1.00 0.00 O ATOM 1356 CB ASN A 81 1.205 21.375 -3.865 1.00 0.00 C ATOM 1357 CG ASN A 81 1.970 21.833 -5.065 1.00 0.00 C ATOM 1358 OD1 ASN A 81 1.404 22.295 -6.043 1.00 0.00 O ATOM 1359 ND2 ASN A 81 3.266 21.701 -5.009 1.00 0.00 N ATOM 0 H ASN A 81 -0.802 21.068 -2.076 1.00 0.00 H new ATOM 0 HA ASN A 81 0.541 23.362 -3.423 1.00 0.00 H new ATOM 0 HB2 ASN A 81 1.895 21.232 -3.033 1.00 0.00 H new ATOM 0 HB3 ASN A 81 0.754 20.405 -4.075 1.00 0.00 H new ATOM 0 HD21 ASN A 81 3.843 21.988 -5.800 1.00 0.00 H new ATOM 0 HD22 ASN A 81 3.703 21.311 -4.174 1.00 0.00 H new ATOM 1366 N GLU A 82 -1.411 21.250 -5.014 1.00 0.00 N ATOM 1367 CA GLU A 82 -2.486 21.129 -6.023 1.00 0.00 C ATOM 1368 C GLU A 82 -2.390 22.194 -7.144 1.00 0.00 C ATOM 1369 O GLU A 82 -3.393 22.631 -7.713 1.00 0.00 O ATOM 1370 CB GLU A 82 -3.863 21.148 -5.334 1.00 0.00 C ATOM 1371 CG GLU A 82 -4.218 19.821 -4.623 1.00 0.00 C ATOM 1372 CD GLU A 82 -4.567 18.696 -5.610 1.00 0.00 C ATOM 1373 OE1 GLU A 82 -4.003 17.580 -5.503 1.00 0.00 O ATOM 1374 OE2 GLU A 82 -5.405 18.940 -6.502 1.00 0.00 O ATOM 0 H GLU A 82 -0.967 20.360 -4.786 1.00 0.00 H new ATOM 0 HA GLU A 82 -2.356 20.169 -6.522 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -3.884 21.958 -4.605 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -4.629 21.368 -6.078 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -3.377 19.508 -4.004 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -5.062 19.986 -3.953 1.00 0.00 H new ATOM 1381 N ARG A 83 -1.167 22.608 -7.471 1.00 0.00 N ATOM 1382 CA ARG A 83 -0.950 23.598 -8.533 1.00 0.00 C ATOM 1383 C ARG A 83 -1.260 22.954 -9.885 1.00 0.00 C ATOM 1384 O ARG A 83 -1.512 21.768 -9.964 1.00 0.00 O ATOM 1385 CB ARG A 83 0.493 24.112 -8.453 1.00 0.00 C ATOM 1386 CG ARG A 83 0.735 25.496 -9.035 1.00 0.00 C ATOM 1387 CD ARG A 83 2.120 25.978 -8.627 1.00 0.00 C ATOM 1388 NE ARG A 83 2.357 27.379 -9.015 1.00 0.00 N ATOM 1389 CZ ARG A 83 3.432 28.090 -8.687 1.00 0.00 C ATOM 1390 NH1 ARG A 83 4.406 27.593 -7.965 1.00 0.00 N ATOM 1391 NH2 ARG A 83 3.523 29.329 -9.085 1.00 0.00 N ATOM 0 H ARG A 83 -0.313 22.278 -7.021 1.00 0.00 H new ATOM 0 HA ARG A 83 -1.614 24.454 -8.411 1.00 0.00 H new ATOM 0 HB2 ARG A 83 0.799 24.120 -7.407 1.00 0.00 H new ATOM 0 HB3 ARG A 83 1.141 23.403 -8.969 1.00 0.00 H new ATOM 0 HG2 ARG A 83 0.653 25.466 -10.122 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -0.025 26.191 -8.678 1.00 0.00 H new ATOM 0 HD2 ARG A 83 2.235 25.877 -7.548 1.00 0.00 H new ATOM 0 HD3 ARG A 83 2.875 25.342 -9.089 1.00 0.00 H new ATOM 0 HE ARG A 83 1.642 27.839 -9.578 1.00 0.00 H new ATOM 0 HH11 ARG A 83 4.355 26.629 -7.634 1.00 0.00 H new ATOM 0 HH12 ARG A 83 5.215 28.170 -7.734 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.775 29.742 -9.641 1.00 0.00 H new ATOM 0 HH22 ARG A 83 4.343 29.885 -8.840 1.00 0.00 H new ATOM 1405 N SER A 84 -1.229 23.734 -10.955 1.00 0.00 N ATOM 1406 CA SER A 84 -1.574 23.257 -12.301 1.00 0.00 C ATOM 1407 C SER A 84 -0.908 21.965 -12.813 1.00 0.00 C ATOM 1408 O SER A 84 -1.416 21.358 -13.746 1.00 0.00 O ATOM 1409 CB SER A 84 -1.277 24.380 -13.285 1.00 0.00 C ATOM 1410 OG SER A 84 -1.582 25.632 -12.686 1.00 0.00 O ATOM 0 H SER A 84 -0.964 24.719 -10.923 1.00 0.00 H new ATOM 0 HA SER A 84 -2.626 22.984 -12.225 1.00 0.00 H new ATOM 0 HB2 SER A 84 -0.228 24.352 -13.578 1.00 0.00 H new ATOM 0 HB3 SER A 84 -1.865 24.247 -14.193 1.00 0.00 H new ATOM 0 HG SER A 84 -1.389 26.354 -13.320 1.00 0.00 H new ATOM 1416 N ARG A 85 0.202 21.539 -12.217 1.00 0.00 N ATOM 1417 CA ARG A 85 0.858 20.278 -12.608 1.00 0.00 C ATOM 1418 C ARG A 85 0.979 19.331 -11.418 1.00 0.00 C ATOM 1419 O ARG A 85 1.638 18.314 -11.501 1.00 0.00 O ATOM 1420 CB ARG A 85 2.252 20.546 -13.182 1.00 0.00 C ATOM 1421 CG ARG A 85 2.247 21.290 -14.503 1.00 0.00 C ATOM 1422 CD ARG A 85 3.650 21.303 -15.089 1.00 0.00 C ATOM 1423 NE ARG A 85 3.696 21.973 -16.398 1.00 0.00 N ATOM 1424 CZ ARG A 85 4.772 22.058 -17.175 1.00 0.00 C ATOM 1425 NH1 ARG A 85 5.926 21.536 -16.832 1.00 0.00 N ATOM 1426 NH2 ARG A 85 4.685 22.679 -18.318 1.00 0.00 N ATOM 0 H ARG A 85 0.671 22.041 -11.463 1.00 0.00 H new ATOM 0 HA ARG A 85 0.237 19.811 -13.372 1.00 0.00 H new ATOM 0 HB2 ARG A 85 2.827 21.121 -12.456 1.00 0.00 H new ATOM 0 HB3 ARG A 85 2.767 19.595 -13.315 1.00 0.00 H new ATOM 0 HG2 ARG A 85 1.557 20.812 -15.198 1.00 0.00 H new ATOM 0 HG3 ARG A 85 1.895 22.311 -14.355 1.00 0.00 H new ATOM 0 HD2 ARG A 85 4.326 21.809 -14.399 1.00 0.00 H new ATOM 0 HD3 ARG A 85 4.008 20.279 -15.193 1.00 0.00 H new ATOM 0 HE ARG A 85 2.836 22.406 -16.736 1.00 0.00 H new ATOM 0 HH11 ARG A 85 6.019 21.045 -15.943 1.00 0.00 H new ATOM 0 HH12 ARG A 85 6.730 21.621 -17.454 1.00 0.00 H new ATOM 0 HH21 ARG A 85 3.799 23.093 -18.607 1.00 0.00 H new ATOM 0 HH22 ARG A 85 5.503 22.751 -18.923 1.00 0.00 H new ATOM 1440 N GLN A 86 0.345 19.693 -10.314 1.00 0.00 N ATOM 1441 CA GLN A 86 0.399 18.919 -9.073 1.00 0.00 C ATOM 1442 C GLN A 86 -1.019 18.683 -8.564 1.00 0.00 C ATOM 1443 O GLN A 86 -1.215 18.264 -7.434 1.00 0.00 O ATOM 1444 CB GLN A 86 1.202 19.685 -8.013 1.00 0.00 C ATOM 1445 CG GLN A 86 2.723 19.639 -8.193 1.00 0.00 C ATOM 1446 CD GLN A 86 3.229 20.408 -9.401 1.00 0.00 C ATOM 1447 OE1 GLN A 86 2.779 21.515 -9.709 1.00 0.00 O ATOM 1448 NE2 GLN A 86 4.177 19.830 -10.089 1.00 0.00 N ATOM 0 H GLN A 86 -0.226 20.536 -10.248 1.00 0.00 H new ATOM 0 HA GLN A 86 0.885 17.963 -9.266 1.00 0.00 H new ATOM 0 HB2 GLN A 86 0.882 20.727 -8.020 1.00 0.00 H new ATOM 0 HB3 GLN A 86 0.955 19.282 -7.031 1.00 0.00 H new ATOM 0 HG2 GLN A 86 3.196 20.040 -7.297 1.00 0.00 H new ATOM 0 HG3 GLN A 86 3.036 18.599 -8.281 1.00 0.00 H new ATOM 0 HE21 GLN A 86 4.526 18.914 -9.807 1.00 0.00 H new ATOM 0 HE22 GLN A 86 4.568 20.294 -10.909 1.00 0.00 H new ATOM 1457 N LYS A 87 -2.006 18.954 -9.411 1.00 0.00 N ATOM 1458 CA LYS A 87 -3.429 18.806 -9.059 1.00 0.00 C ATOM 1459 C LYS A 87 -3.882 17.352 -9.000 1.00 0.00 C ATOM 1460 O LYS A 87 -5.059 17.052 -9.144 1.00 0.00 O ATOM 1461 CB LYS A 87 -4.310 19.557 -10.071 1.00 0.00 C ATOM 1462 CG LYS A 87 -4.240 19.001 -11.512 1.00 0.00 C ATOM 1463 CD LYS A 87 -5.612 19.033 -12.221 1.00 0.00 C ATOM 1464 CE LYS A 87 -6.277 17.632 -12.311 1.00 0.00 C ATOM 1465 NZ LYS A 87 -7.028 17.210 -11.062 1.00 0.00 N ATOM 0 H LYS A 87 -1.851 19.283 -10.364 1.00 0.00 H new ATOM 0 HA LYS A 87 -3.540 19.230 -8.061 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -5.345 19.522 -9.730 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -4.014 20.606 -10.084 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -3.522 19.583 -12.089 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -3.871 17.976 -11.486 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -6.276 19.712 -11.686 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -5.487 19.436 -13.226 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -6.967 17.625 -13.154 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -5.506 16.891 -12.524 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -7.496 16.297 -11.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -6.360 17.116 -10.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -7.743 17.928 -10.828 1.00 0.00 H new ATOM 1479 N TYR A 88 -2.940 16.449 -8.828 1.00 0.00 N ATOM 1480 CA TYR A 88 -3.232 15.034 -8.833 1.00 0.00 C ATOM 1481 C TYR A 88 -2.744 14.414 -7.541 1.00 0.00 C ATOM 1482 O TYR A 88 -2.743 13.210 -7.402 1.00 0.00 O ATOM 1483 CB TYR A 88 -2.585 14.359 -10.050 1.00 0.00 C ATOM 1484 CG TYR A 88 -1.076 14.242 -9.970 1.00 0.00 C ATOM 1485 CD1 TYR A 88 -0.477 13.034 -9.557 1.00 0.00 C ATOM 1486 CD2 TYR A 88 -0.233 15.322 -10.314 1.00 0.00 C ATOM 1487 CE1 TYR A 88 0.928 12.903 -9.476 1.00 0.00 C ATOM 1488 CE2 TYR A 88 1.184 15.190 -10.234 1.00 0.00 C ATOM 1489 CZ TYR A 88 1.747 13.978 -9.814 1.00 0.00 C ATOM 1490 OH TYR A 88 3.108 13.841 -9.746 1.00 0.00 O ATOM 0 H TYR A 88 -1.956 16.675 -8.682 1.00 0.00 H new ATOM 0 HA TYR A 88 -4.309 14.886 -8.906 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -3.009 13.362 -10.166 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -2.847 14.923 -10.945 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -1.103 12.193 -9.298 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -0.666 16.256 -10.641 1.00 0.00 H new ATOM 0 HE1 TYR A 88 1.366 11.970 -9.152 1.00 0.00 H new ATOM 0 HE2 TYR A 88 1.821 16.021 -10.496 1.00 0.00 H new ATOM 0 HH TYR A 88 3.332 12.918 -9.505 1.00 0.00 H new ATOM 1500 N ALA A 89 -2.336 15.237 -6.586 1.00 0.00 N ATOM 1501 CA ALA A 89 -1.850 14.698 -5.330 1.00 0.00 C ATOM 1502 C ALA A 89 -3.016 13.993 -4.646 1.00 0.00 C ATOM 1503 O ALA A 89 -2.942 12.812 -4.352 1.00 0.00 O ATOM 1504 CB ALA A 89 -1.291 15.817 -4.448 1.00 0.00 C ATOM 0 H ALA A 89 -2.332 16.255 -6.655 1.00 0.00 H new ATOM 0 HA ALA A 89 -1.039 13.991 -5.506 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -0.931 15.395 -3.510 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -0.467 16.310 -4.964 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -2.076 16.544 -4.241 1.00 0.00 H new ATOM 1510 N GLU A 90 -4.110 14.702 -4.416 1.00 0.00 N ATOM 1511 CA GLU A 90 -5.253 14.082 -3.739 1.00 0.00 C ATOM 1512 C GLU A 90 -5.912 13.026 -4.645 1.00 0.00 C ATOM 1513 O GLU A 90 -6.562 12.097 -4.170 1.00 0.00 O ATOM 1514 CB GLU A 90 -6.255 15.141 -3.276 1.00 0.00 C ATOM 1515 CG GLU A 90 -5.649 16.194 -2.314 1.00 0.00 C ATOM 1516 CD GLU A 90 -4.981 15.589 -1.064 1.00 0.00 C ATOM 1517 OE1 GLU A 90 -5.595 14.746 -0.373 1.00 0.00 O ATOM 1518 OE2 GLU A 90 -3.828 15.977 -0.759 1.00 0.00 O ATOM 0 H GLU A 90 -4.237 15.680 -4.677 1.00 0.00 H new ATOM 0 HA GLU A 90 -4.891 13.570 -2.847 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -6.661 15.651 -4.150 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -7.090 14.646 -2.780 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -4.912 16.786 -2.857 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -6.436 16.878 -1.998 1.00 0.00 H new ATOM 1525 N GLU A 91 -5.707 13.143 -5.951 1.00 0.00 N ATOM 1526 CA GLU A 91 -6.173 12.110 -6.882 1.00 0.00 C ATOM 1527 C GLU A 91 -5.415 10.824 -6.550 1.00 0.00 C ATOM 1528 O GLU A 91 -5.986 9.749 -6.573 1.00 0.00 O ATOM 1529 CB GLU A 91 -5.915 12.521 -8.340 1.00 0.00 C ATOM 1530 CG GLU A 91 -6.230 11.452 -9.400 1.00 0.00 C ATOM 1531 CD GLU A 91 -7.716 11.209 -9.588 1.00 0.00 C ATOM 1532 OE1 GLU A 91 -8.448 12.184 -9.883 1.00 0.00 O ATOM 1533 OE2 GLU A 91 -8.154 10.041 -9.458 1.00 0.00 O ATOM 0 H GLU A 91 -5.228 13.929 -6.390 1.00 0.00 H new ATOM 0 HA GLU A 91 -7.248 11.967 -6.776 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -6.509 13.409 -8.558 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -4.867 12.806 -8.438 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -5.796 11.756 -10.352 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -5.750 10.516 -9.115 1.00 0.00 H new ATOM 1540 N GLU A 92 -4.134 10.922 -6.216 1.00 0.00 N ATOM 1541 CA GLU A 92 -3.370 9.723 -5.880 1.00 0.00 C ATOM 1542 C GLU A 92 -3.914 9.096 -4.600 1.00 0.00 C ATOM 1543 O GLU A 92 -3.791 7.903 -4.411 1.00 0.00 O ATOM 1544 CB GLU A 92 -1.869 10.016 -5.747 1.00 0.00 C ATOM 1545 CG GLU A 92 -1.168 10.283 -7.080 1.00 0.00 C ATOM 1546 CD GLU A 92 -0.869 9.007 -7.860 1.00 0.00 C ATOM 1547 OE1 GLU A 92 -1.814 8.378 -8.397 1.00 0.00 O ATOM 1548 OE2 GLU A 92 0.317 8.622 -7.929 1.00 0.00 O ATOM 0 H GLU A 92 -3.611 11.796 -6.170 1.00 0.00 H new ATOM 0 HA GLU A 92 -3.486 9.015 -6.700 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -1.734 10.881 -5.097 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -1.386 9.171 -5.257 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -1.793 10.937 -7.689 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -0.236 10.816 -6.894 1.00 0.00 H new ATOM 1555 N LEU A 93 -4.545 9.878 -3.731 1.00 0.00 N ATOM 1556 CA LEU A 93 -5.170 9.321 -2.523 1.00 0.00 C ATOM 1557 C LEU A 93 -6.418 8.516 -2.920 1.00 0.00 C ATOM 1558 O LEU A 93 -6.714 7.462 -2.336 1.00 0.00 O ATOM 1559 CB LEU A 93 -5.542 10.433 -1.534 1.00 0.00 C ATOM 1560 CG LEU A 93 -6.129 9.997 -0.179 1.00 0.00 C ATOM 1561 CD1 LEU A 93 -5.188 9.067 0.604 1.00 0.00 C ATOM 1562 CD2 LEU A 93 -6.423 11.246 0.653 1.00 0.00 C ATOM 0 H LEU A 93 -4.640 10.888 -3.832 1.00 0.00 H new ATOM 0 HA LEU A 93 -4.456 8.662 -2.029 1.00 0.00 H new ATOM 0 HB2 LEU A 93 -4.649 11.027 -1.341 1.00 0.00 H new ATOM 0 HB3 LEU A 93 -6.263 11.091 -2.019 1.00 0.00 H new ATOM 0 HG LEU A 93 -7.041 9.434 -0.376 1.00 0.00 H new ATOM 0 HD11 LEU A 93 -5.653 8.792 1.551 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -4.996 8.168 0.019 1.00 0.00 H new ATOM 0 HD13 LEU A 93 -4.247 9.581 0.798 1.00 0.00 H new ATOM 0 HD21 LEU A 93 -6.840 10.952 1.616 1.00 0.00 H new ATOM 0 HD22 LEU A 93 -5.500 11.803 0.812 1.00 0.00 H new ATOM 0 HD23 LEU A 93 -7.140 11.875 0.125 1.00 0.00 H new ATOM 1574 N GLU A 94 -7.139 8.982 -3.931 1.00 0.00 N ATOM 1575 CA GLU A 94 -8.281 8.218 -4.448 1.00 0.00 C ATOM 1576 C GLU A 94 -7.731 6.900 -5.019 1.00 0.00 C ATOM 1577 O GLU A 94 -8.295 5.815 -4.820 1.00 0.00 O ATOM 1578 CB GLU A 94 -9.027 8.997 -5.548 1.00 0.00 C ATOM 1579 CG GLU A 94 -9.633 10.327 -5.088 1.00 0.00 C ATOM 1580 CD GLU A 94 -10.777 10.131 -4.111 1.00 0.00 C ATOM 1581 OE1 GLU A 94 -10.684 10.587 -2.953 1.00 0.00 O ATOM 1582 OE2 GLU A 94 -11.786 9.497 -4.492 1.00 0.00 O ATOM 0 H GLU A 94 -6.964 9.867 -4.406 1.00 0.00 H new ATOM 0 HA GLU A 94 -8.994 8.033 -3.645 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -8.337 9.192 -6.369 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -9.824 8.367 -5.944 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -8.858 10.934 -4.620 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -9.990 10.881 -5.956 1.00 0.00 H new ATOM 1589 N GLN A 95 -6.603 6.997 -5.708 1.00 0.00 N ATOM 1590 CA GLN A 95 -5.954 5.820 -6.276 1.00 0.00 C ATOM 1591 C GLN A 95 -5.368 4.911 -5.177 1.00 0.00 C ATOM 1592 O GLN A 95 -5.227 3.714 -5.383 1.00 0.00 O ATOM 1593 CB GLN A 95 -4.860 6.229 -7.271 1.00 0.00 C ATOM 1594 CG GLN A 95 -5.343 7.066 -8.465 1.00 0.00 C ATOM 1595 CD GLN A 95 -6.448 6.399 -9.250 1.00 0.00 C ATOM 1596 OE1 GLN A 95 -6.364 5.219 -9.586 1.00 0.00 O ATOM 1597 NE2 GLN A 95 -7.484 7.141 -9.556 1.00 0.00 N ATOM 0 H GLN A 95 -6.118 7.876 -5.888 1.00 0.00 H new ATOM 0 HA GLN A 95 -6.716 5.251 -6.809 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -4.097 6.795 -6.736 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -4.380 5.327 -7.650 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -5.695 8.033 -8.104 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -4.501 7.260 -9.129 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -7.518 8.116 -9.260 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -8.256 6.743 -10.090 1.00 0.00 H new ATOM 1606 N VAL A 96 -5.048 5.458 -4.010 1.00 0.00 N ATOM 1607 CA VAL A 96 -4.604 4.648 -2.861 1.00 0.00 C ATOM 1608 C VAL A 96 -5.801 3.854 -2.371 1.00 0.00 C ATOM 1609 O VAL A 96 -5.680 2.669 -2.040 1.00 0.00 O ATOM 1610 CB VAL A 96 -4.042 5.538 -1.699 1.00 0.00 C ATOM 1611 CG1 VAL A 96 -4.024 4.793 -0.348 1.00 0.00 C ATOM 1612 CG2 VAL A 96 -2.646 6.010 -2.034 1.00 0.00 C ATOM 0 H VAL A 96 -5.085 6.460 -3.825 1.00 0.00 H new ATOM 0 HA VAL A 96 -3.794 3.990 -3.176 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.710 6.393 -1.598 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -3.627 5.451 0.425 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.038 4.494 -0.084 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -3.394 3.907 -0.429 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -2.266 6.627 -1.220 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.993 5.148 -2.171 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -2.671 6.596 -2.953 1.00 0.00 H new ATOM 1622 N ARG A 97 -6.974 4.479 -2.345 1.00 0.00 N ATOM 1623 CA ARG A 97 -8.176 3.745 -1.946 1.00 0.00 C ATOM 1624 C ARG A 97 -8.368 2.590 -2.912 1.00 0.00 C ATOM 1625 O ARG A 97 -8.692 1.487 -2.498 1.00 0.00 O ATOM 1626 CB ARG A 97 -9.421 4.631 -1.953 1.00 0.00 C ATOM 1627 CG ARG A 97 -10.631 3.960 -1.296 1.00 0.00 C ATOM 1628 CD ARG A 97 -11.937 4.653 -1.656 1.00 0.00 C ATOM 1629 NE ARG A 97 -11.928 6.077 -1.283 1.00 0.00 N ATOM 1630 CZ ARG A 97 -11.833 7.095 -2.134 1.00 0.00 C ATOM 1631 NH1 ARG A 97 -11.751 6.930 -3.428 1.00 0.00 N ATOM 1632 NH2 ARG A 97 -11.823 8.305 -1.661 1.00 0.00 N ATOM 0 H ARG A 97 -7.120 5.459 -2.586 1.00 0.00 H new ATOM 0 HA ARG A 97 -8.042 3.387 -0.925 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -9.201 5.563 -1.432 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -9.670 4.892 -2.982 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -10.678 2.916 -1.606 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -10.505 3.966 -0.213 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -12.113 4.560 -2.728 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -12.764 4.152 -1.153 1.00 0.00 H new ATOM 0 HE ARG A 97 -12.001 6.302 -0.291 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -11.758 5.990 -3.824 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -11.680 7.741 -4.042 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -11.887 8.460 -0.655 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -11.751 9.100 -2.296 1.00 0.00 H new ATOM 1646 N GLU A 98 -8.153 2.832 -4.196 1.00 0.00 N ATOM 1647 CA GLU A 98 -8.280 1.758 -5.187 1.00 0.00 C ATOM 1648 C GLU A 98 -7.162 0.708 -5.056 1.00 0.00 C ATOM 1649 O GLU A 98 -7.385 -0.467 -5.327 1.00 0.00 O ATOM 1650 CB GLU A 98 -8.317 2.335 -6.602 1.00 0.00 C ATOM 1651 CG GLU A 98 -9.607 3.105 -6.896 1.00 0.00 C ATOM 1652 CD GLU A 98 -10.853 2.236 -6.715 1.00 0.00 C ATOM 1653 OE1 GLU A 98 -11.712 2.568 -5.869 1.00 0.00 O ATOM 1654 OE2 GLU A 98 -10.977 1.205 -7.413 1.00 0.00 O ATOM 0 H GLU A 98 -7.894 3.742 -4.578 1.00 0.00 H new ATOM 0 HA GLU A 98 -9.222 1.247 -4.990 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -7.464 2.999 -6.741 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -8.211 1.524 -7.323 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -9.670 3.970 -6.236 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -9.576 3.485 -7.917 1.00 0.00 H new ATOM 1661 N ALA A 99 -5.976 1.116 -4.621 1.00 0.00 N ATOM 1662 CA ALA A 99 -4.872 0.179 -4.384 1.00 0.00 C ATOM 1663 C ALA A 99 -5.255 -0.750 -3.223 1.00 0.00 C ATOM 1664 O ALA A 99 -5.118 -1.972 -3.319 1.00 0.00 O ATOM 1665 CB ALA A 99 -3.596 0.935 -4.066 1.00 0.00 C ATOM 0 H ALA A 99 -5.749 2.090 -4.423 1.00 0.00 H new ATOM 0 HA ALA A 99 -4.693 -0.414 -5.281 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -2.787 0.226 -3.893 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -3.338 1.582 -4.904 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -3.745 1.541 -3.172 1.00 0.00 H new ATOM 1671 N LEU A 100 -5.756 -0.171 -2.140 1.00 0.00 N ATOM 1672 CA LEU A 100 -6.194 -0.962 -0.986 1.00 0.00 C ATOM 1673 C LEU A 100 -7.365 -1.866 -1.376 1.00 0.00 C ATOM 1674 O LEU A 100 -7.437 -3.030 -0.983 1.00 0.00 O ATOM 1675 CB LEU A 100 -6.605 -0.026 0.156 1.00 0.00 C ATOM 1676 CG LEU A 100 -7.032 -0.708 1.469 1.00 0.00 C ATOM 1677 CD1 LEU A 100 -5.900 -1.539 2.078 1.00 0.00 C ATOM 1678 CD2 LEU A 100 -7.480 0.364 2.463 1.00 0.00 C ATOM 0 H LEU A 100 -5.871 0.837 -2.031 1.00 0.00 H new ATOM 0 HA LEU A 100 -5.368 -1.591 -0.652 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -5.770 0.640 0.371 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -7.429 0.597 -0.191 1.00 0.00 H new ATOM 0 HG LEU A 100 -7.853 -1.390 1.247 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -6.245 -2.002 3.002 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -5.599 -2.315 1.374 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -5.049 -0.893 2.292 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -7.784 -0.110 3.396 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -6.654 1.049 2.656 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -8.321 0.918 2.046 1.00 0.00 H new ATOM 1690 N ARG A 101 -8.278 -1.327 -2.173 1.00 0.00 N ATOM 1691 CA ARG A 101 -9.438 -2.079 -2.664 1.00 0.00 C ATOM 1692 C ARG A 101 -8.973 -3.275 -3.485 1.00 0.00 C ATOM 1693 O ARG A 101 -9.549 -4.356 -3.406 1.00 0.00 O ATOM 1694 CB ARG A 101 -10.293 -1.149 -3.528 1.00 0.00 C ATOM 1695 CG ARG A 101 -11.615 -1.703 -3.998 1.00 0.00 C ATOM 1696 CD ARG A 101 -12.213 -0.708 -4.975 1.00 0.00 C ATOM 1697 NE ARG A 101 -13.572 -1.067 -5.406 1.00 0.00 N ATOM 1698 CZ ARG A 101 -14.278 -0.398 -6.312 1.00 0.00 C ATOM 1699 NH1 ARG A 101 -13.811 0.654 -6.935 1.00 0.00 N ATOM 1700 NH2 ARG A 101 -15.486 -0.801 -6.599 1.00 0.00 N ATOM 0 H ARG A 101 -8.241 -0.361 -2.499 1.00 0.00 H new ATOM 0 HA ARG A 101 -10.026 -2.446 -1.823 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -10.485 -0.237 -2.963 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -9.710 -0.864 -4.404 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -11.475 -2.672 -4.477 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -12.286 -1.859 -3.153 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -12.234 0.279 -4.512 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -11.568 -0.636 -5.851 1.00 0.00 H new ATOM 0 HE ARG A 101 -14.003 -1.887 -4.980 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -12.870 0.991 -6.732 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -14.388 1.137 -7.623 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -15.876 -1.619 -6.130 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -16.040 -0.298 -7.292 1.00 0.00 H new ATOM 1714 N LYS A 102 -7.921 -3.083 -4.267 1.00 0.00 N ATOM 1715 CA LYS A 102 -7.357 -4.159 -5.077 1.00 0.00 C ATOM 1716 C LYS A 102 -6.738 -5.224 -4.173 1.00 0.00 C ATOM 1717 O LYS A 102 -6.880 -6.415 -4.448 1.00 0.00 O ATOM 1718 CB LYS A 102 -6.316 -3.582 -6.058 1.00 0.00 C ATOM 1719 CG LYS A 102 -5.454 -4.617 -6.775 1.00 0.00 C ATOM 1720 CD LYS A 102 -6.256 -5.516 -7.724 1.00 0.00 C ATOM 1721 CE LYS A 102 -5.421 -6.712 -8.157 1.00 0.00 C ATOM 1722 NZ LYS A 102 -5.177 -7.599 -6.980 1.00 0.00 N ATOM 0 H LYS A 102 -7.437 -2.190 -4.360 1.00 0.00 H new ATOM 0 HA LYS A 102 -8.148 -4.631 -5.659 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -6.838 -2.986 -6.807 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -5.661 -2.904 -5.510 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -4.676 -4.104 -7.341 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -4.951 -5.238 -6.034 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -7.164 -5.859 -7.229 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -6.566 -4.946 -8.599 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -5.937 -7.265 -8.942 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -4.472 -6.375 -8.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -4.741 -8.487 -7.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -4.540 -7.121 -6.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -6.080 -7.807 -6.509 1.00 0.00 H new ATOM 1736 N ALA A 103 -6.070 -4.811 -3.106 1.00 0.00 N ATOM 1737 CA ALA A 103 -5.462 -5.757 -2.171 1.00 0.00 C ATOM 1738 C ALA A 103 -6.543 -6.558 -1.429 1.00 0.00 C ATOM 1739 O ALA A 103 -6.487 -7.789 -1.356 1.00 0.00 O ATOM 1740 CB ALA A 103 -4.570 -5.003 -1.171 1.00 0.00 C ATOM 0 H ALA A 103 -5.933 -3.830 -2.863 1.00 0.00 H new ATOM 0 HA ALA A 103 -4.847 -6.459 -2.734 1.00 0.00 H new ATOM 0 HB1 ALA A 103 -4.120 -5.713 -0.477 1.00 0.00 H new ATOM 0 HB2 ALA A 103 -3.784 -4.475 -1.711 1.00 0.00 H new ATOM 0 HB3 ALA A 103 -5.173 -4.285 -0.615 1.00 0.00 H new ATOM 1746 N GLU A 104 -7.533 -5.860 -0.890 1.00 0.00 N ATOM 1747 CA GLU A 104 -8.615 -6.526 -0.163 1.00 0.00 C ATOM 1748 C GLU A 104 -9.408 -7.451 -1.087 1.00 0.00 C ATOM 1749 O GLU A 104 -9.870 -8.495 -0.656 1.00 0.00 O ATOM 1750 CB GLU A 104 -9.543 -5.501 0.497 1.00 0.00 C ATOM 1751 CG GLU A 104 -8.982 -4.905 1.809 1.00 0.00 C ATOM 1752 CD GLU A 104 -8.865 -5.938 2.950 1.00 0.00 C ATOM 1753 OE1 GLU A 104 -7.828 -5.953 3.653 1.00 0.00 O ATOM 1754 OE2 GLU A 104 -9.813 -6.724 3.151 1.00 0.00 O ATOM 0 H GLU A 104 -7.613 -4.844 -0.939 1.00 0.00 H new ATOM 0 HA GLU A 104 -8.164 -7.134 0.622 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -9.733 -4.691 -0.207 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -10.503 -5.974 0.705 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -7.999 -4.477 1.614 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -9.627 -4.088 2.133 1.00 0.00 H new ATOM 1761 N LYS A 105 -9.562 -7.111 -2.363 1.00 0.00 N ATOM 1762 CA LYS A 105 -10.257 -8.035 -3.267 1.00 0.00 C ATOM 1763 C LYS A 105 -9.355 -9.199 -3.692 1.00 0.00 C ATOM 1764 O LYS A 105 -9.830 -10.271 -4.042 1.00 0.00 O ATOM 1765 CB LYS A 105 -10.860 -7.337 -4.484 1.00 0.00 C ATOM 1766 CG LYS A 105 -11.987 -8.192 -5.047 1.00 0.00 C ATOM 1767 CD LYS A 105 -12.736 -7.598 -6.199 1.00 0.00 C ATOM 1768 CE LYS A 105 -13.877 -8.559 -6.519 1.00 0.00 C ATOM 1769 NZ LYS A 105 -14.699 -8.167 -7.691 1.00 0.00 N ATOM 0 H LYS A 105 -9.233 -6.243 -2.786 1.00 0.00 H new ATOM 0 HA LYS A 105 -11.090 -8.444 -2.695 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -11.239 -6.354 -4.203 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -10.094 -7.178 -5.243 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -11.570 -9.149 -5.362 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -12.695 -8.401 -4.245 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -13.121 -6.611 -5.943 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -12.082 -7.471 -7.062 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -13.461 -9.551 -6.698 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -14.525 -8.638 -5.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -15.450 -8.871 -7.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -15.127 -7.235 -7.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -14.097 -8.120 -8.537 1.00 0.00 H new ATOM 1783 N GLU A 106 -8.049 -9.011 -3.645 1.00 0.00 N ATOM 1784 CA GLU A 106 -7.140 -10.124 -3.908 1.00 0.00 C ATOM 1785 C GLU A 106 -7.324 -11.076 -2.723 1.00 0.00 C ATOM 1786 O GLU A 106 -7.430 -12.297 -2.878 1.00 0.00 O ATOM 1787 CB GLU A 106 -5.696 -9.624 -4.036 1.00 0.00 C ATOM 1788 CG GLU A 106 -4.703 -10.703 -4.382 1.00 0.00 C ATOM 1789 CD GLU A 106 -3.491 -10.174 -5.133 1.00 0.00 C ATOM 1790 OE1 GLU A 106 -2.372 -10.210 -4.579 1.00 0.00 O ATOM 1791 OE2 GLU A 106 -3.657 -9.727 -6.293 1.00 0.00 O ATOM 0 H GLU A 106 -7.596 -8.122 -3.433 1.00 0.00 H new ATOM 0 HA GLU A 106 -7.356 -10.628 -4.850 1.00 0.00 H new ATOM 0 HB2 GLU A 106 -5.657 -8.849 -4.802 1.00 0.00 H new ATOM 0 HB3 GLU A 106 -5.399 -9.159 -3.096 1.00 0.00 H new ATOM 0 HG2 GLU A 106 -4.371 -11.192 -3.466 1.00 0.00 H new ATOM 0 HG3 GLU A 106 -5.196 -11.463 -4.988 1.00 0.00 H new ATOM 1798 N LEU A 107 -7.412 -10.493 -1.537 1.00 0.00 N ATOM 1799 CA LEU A 107 -7.674 -11.255 -0.320 1.00 0.00 C ATOM 1800 C LEU A 107 -9.009 -12.007 -0.407 1.00 0.00 C ATOM 1801 O LEU A 107 -9.107 -13.172 -0.014 1.00 0.00 O ATOM 1802 CB LEU A 107 -7.703 -10.279 0.844 1.00 0.00 C ATOM 1803 CG LEU A 107 -6.899 -10.661 2.076 1.00 0.00 C ATOM 1804 CD1 LEU A 107 -6.461 -9.361 2.723 1.00 0.00 C ATOM 1805 CD2 LEU A 107 -7.744 -11.519 3.024 1.00 0.00 C ATOM 0 H LEU A 107 -7.306 -9.489 -1.389 1.00 0.00 H new ATOM 0 HA LEU A 107 -6.890 -12.000 -0.183 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -7.342 -9.314 0.488 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -8.741 -10.139 1.145 1.00 0.00 H new ATOM 0 HG LEU A 107 -6.029 -11.264 1.818 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -5.877 -9.578 3.617 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -5.851 -8.792 2.021 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -7.340 -8.777 2.997 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -7.152 -11.783 3.900 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -8.624 -10.957 3.336 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -8.057 -12.428 2.510 1.00 0.00 H new ATOM 1817 N GLU A 108 -10.022 -11.339 -0.940 1.00 0.00 N ATOM 1818 CA GLU A 108 -11.341 -11.941 -1.158 1.00 0.00 C ATOM 1819 C GLU A 108 -11.170 -13.174 -2.041 1.00 0.00 C ATOM 1820 O GLU A 108 -11.644 -14.257 -1.703 1.00 0.00 O ATOM 1821 CB GLU A 108 -12.277 -10.919 -1.837 1.00 0.00 C ATOM 1822 CG GLU A 108 -13.656 -11.434 -2.257 1.00 0.00 C ATOM 1823 CD GLU A 108 -14.294 -10.531 -3.323 1.00 0.00 C ATOM 1824 OE1 GLU A 108 -14.787 -9.430 -2.984 1.00 0.00 O ATOM 1825 OE2 GLU A 108 -14.290 -10.919 -4.517 1.00 0.00 O ATOM 0 H GLU A 108 -9.959 -10.365 -1.235 1.00 0.00 H new ATOM 0 HA GLU A 108 -11.785 -12.231 -0.206 1.00 0.00 H new ATOM 0 HB2 GLU A 108 -12.418 -10.080 -1.156 1.00 0.00 H new ATOM 0 HB3 GLU A 108 -11.773 -10.530 -2.722 1.00 0.00 H new ATOM 0 HG2 GLU A 108 -13.564 -12.448 -2.646 1.00 0.00 H new ATOM 0 HG3 GLU A 108 -14.308 -11.485 -1.385 1.00 0.00 H new ATOM 1832 N SER A 109 -10.480 -13.015 -3.165 1.00 0.00 N ATOM 1833 CA SER A 109 -10.283 -14.119 -4.105 1.00 0.00 C ATOM 1834 C SER A 109 -9.505 -15.280 -3.489 1.00 0.00 C ATOM 1835 O SER A 109 -9.734 -16.440 -3.837 1.00 0.00 O ATOM 1836 CB SER A 109 -9.590 -13.625 -5.382 1.00 0.00 C ATOM 1837 OG SER A 109 -8.273 -13.148 -5.154 1.00 0.00 O ATOM 0 H SER A 109 -10.048 -12.136 -3.449 1.00 0.00 H new ATOM 0 HA SER A 109 -11.273 -14.498 -4.361 1.00 0.00 H new ATOM 0 HB2 SER A 109 -9.555 -14.439 -6.107 1.00 0.00 H new ATOM 0 HB3 SER A 109 -10.186 -12.828 -5.826 1.00 0.00 H new ATOM 0 HG SER A 109 -8.181 -12.877 -4.217 1.00 0.00 H new ATOM 1843 N HIS A 110 -8.606 -14.992 -2.557 1.00 0.00 N ATOM 1844 CA HIS A 110 -7.846 -16.056 -1.905 1.00 0.00 C ATOM 1845 C HIS A 110 -8.682 -16.764 -0.842 1.00 0.00 C ATOM 1846 O HIS A 110 -8.374 -17.883 -0.443 1.00 0.00 O ATOM 1847 CB HIS A 110 -6.612 -15.492 -1.214 1.00 0.00 C ATOM 1848 CG HIS A 110 -5.640 -14.833 -2.138 1.00 0.00 C ATOM 1849 ND1 HIS A 110 -5.541 -15.073 -3.491 1.00 0.00 N ATOM 1850 CD2 HIS A 110 -4.685 -13.904 -1.876 1.00 0.00 C ATOM 1851 CE1 HIS A 110 -4.562 -14.323 -3.970 1.00 0.00 C ATOM 1852 NE2 HIS A 110 -3.997 -13.596 -3.026 1.00 0.00 N ATOM 0 H HIS A 110 -8.386 -14.049 -2.238 1.00 0.00 H new ATOM 0 HA HIS A 110 -7.560 -16.760 -2.686 1.00 0.00 H new ATOM 0 HB2 HIS A 110 -6.929 -14.769 -0.462 1.00 0.00 H new ATOM 0 HB3 HIS A 110 -6.104 -16.299 -0.686 1.00 0.00 H new ATOM 0 HD1 HIS A 110 -6.121 -15.716 -4.029 1.00 0.00 H new ATOM 0 HD2 HIS A 110 -4.494 -13.470 -0.906 1.00 0.00 H new ATOM 0 HE1 HIS A 110 -4.262 -14.308 -5.007 1.00 0.00 H new ATOM 1860 N SER A 111 -9.732 -16.105 -0.378 1.00 0.00 N ATOM 1861 CA SER A 111 -10.608 -16.665 0.650 1.00 0.00 C ATOM 1862 C SER A 111 -11.937 -17.144 0.066 1.00 0.00 C ATOM 1863 O SER A 111 -12.790 -17.654 0.780 1.00 0.00 O ATOM 1864 CB SER A 111 -10.881 -15.594 1.699 1.00 0.00 C ATOM 1865 OG SER A 111 -11.358 -14.414 1.067 1.00 0.00 O ATOM 0 H SER A 111 -10.003 -15.175 -0.697 1.00 0.00 H new ATOM 0 HA SER A 111 -10.107 -17.526 1.092 1.00 0.00 H new ATOM 0 HB2 SER A 111 -11.616 -15.955 2.418 1.00 0.00 H new ATOM 0 HB3 SER A 111 -9.970 -15.377 2.256 1.00 0.00 H new ATOM 0 HG SER A 111 -10.602 -13.914 0.694 1.00 0.00 H new ATOM 1871 N SER A 112 -12.101 -16.995 -1.243 1.00 0.00 N ATOM 1872 CA SER A 112 -13.321 -17.432 -1.944 1.00 0.00 C ATOM 1873 C SER A 112 -13.423 -18.959 -2.081 1.00 0.00 C ATOM 1874 O SER A 112 -14.277 -19.470 -2.807 1.00 0.00 O ATOM 1875 CB SER A 112 -13.367 -16.812 -3.342 1.00 0.00 C ATOM 1876 OG SER A 112 -13.504 -15.403 -3.271 1.00 0.00 O ATOM 0 H SER A 112 -11.402 -16.571 -1.853 1.00 0.00 H new ATOM 0 HA SER A 112 -14.162 -17.096 -1.338 1.00 0.00 H new ATOM 0 HB2 SER A 112 -12.457 -17.065 -3.886 1.00 0.00 H new ATOM 0 HB3 SER A 112 -14.201 -17.234 -3.903 1.00 0.00 H new ATOM 0 HG SER A 112 -12.869 -15.045 -2.616 1.00 0.00 H new ATOM 1882 N TRP A 113 -12.547 -19.681 -1.401 1.00 0.00 N ATOM 1883 CA TRP A 113 -12.497 -21.134 -1.476 1.00 0.00 C ATOM 1884 C TRP A 113 -12.707 -21.719 -0.085 1.00 0.00 C ATOM 1885 O TRP A 113 -12.240 -21.161 0.900 1.00 0.00 O ATOM 1886 CB TRP A 113 -11.142 -21.549 -2.024 1.00 0.00 C ATOM 1887 CG TRP A 113 -11.032 -23.010 -2.306 1.00 0.00 C ATOM 1888 CD1 TRP A 113 -10.546 -23.966 -1.482 1.00 0.00 C ATOM 1889 CD2 TRP A 113 -11.406 -23.700 -3.512 1.00 0.00 C ATOM 1890 NE1 TRP A 113 -10.585 -25.195 -2.057 1.00 0.00 N ATOM 1891 CE2 TRP A 113 -11.101 -25.079 -3.317 1.00 0.00 C ATOM 1892 CE3 TRP A 113 -11.973 -23.297 -4.739 1.00 0.00 C ATOM 1893 CZ2 TRP A 113 -11.336 -26.054 -4.308 1.00 0.00 C ATOM 1894 CZ3 TRP A 113 -12.220 -24.276 -5.737 1.00 0.00 C ATOM 1895 CH2 TRP A 113 -11.891 -25.646 -5.508 1.00 0.00 C ATOM 0 H TRP A 113 -11.848 -19.275 -0.779 1.00 0.00 H new ATOM 0 HA TRP A 113 -13.282 -21.506 -2.135 1.00 0.00 H new ATOM 0 HB2 TRP A 113 -10.946 -20.995 -2.942 1.00 0.00 H new ATOM 0 HB3 TRP A 113 -10.369 -21.266 -1.310 1.00 0.00 H new ATOM 0 HD1 TRP A 113 -10.172 -23.775 -0.487 1.00 0.00 H new ATOM 0 HE1 TRP A 113 -10.279 -26.064 -1.620 1.00 0.00 H new ATOM 0 HE3 TRP A 113 -12.216 -22.260 -4.917 1.00 0.00 H new ATOM 0 HZ2 TRP A 113 -11.089 -27.091 -4.135 1.00 0.00 H new ATOM 0 HZ3 TRP A 113 -12.661 -23.982 -6.678 1.00 0.00 H new ATOM 0 HH2 TRP A 113 -12.078 -26.375 -6.283 1.00 0.00 H new ATOM 1906 N TYR A 114 -13.418 -22.836 -0.013 1.00 0.00 N ATOM 1907 CA TYR A 114 -13.735 -23.472 1.268 1.00 0.00 C ATOM 1908 C TYR A 114 -13.965 -24.981 1.080 1.00 0.00 C ATOM 1909 O TYR A 114 -14.921 -25.552 1.608 1.00 0.00 O ATOM 1910 CB TYR A 114 -14.979 -22.796 1.864 1.00 0.00 C ATOM 1911 CG TYR A 114 -14.995 -22.785 3.377 1.00 0.00 C ATOM 1912 CD1 TYR A 114 -14.268 -21.813 4.095 1.00 0.00 C ATOM 1913 CD2 TYR A 114 -15.732 -23.743 4.104 1.00 0.00 C ATOM 1914 CE1 TYR A 114 -14.287 -21.788 5.515 1.00 0.00 C ATOM 1915 CE2 TYR A 114 -15.753 -23.722 5.525 1.00 0.00 C ATOM 1916 CZ TYR A 114 -15.034 -22.739 6.215 1.00 0.00 C ATOM 1917 OH TYR A 114 -15.065 -22.715 7.586 1.00 0.00 O ATOM 0 H TYR A 114 -13.789 -23.325 -0.827 1.00 0.00 H new ATOM 0 HA TYR A 114 -12.897 -23.351 1.955 1.00 0.00 H new ATOM 0 HB2 TYR A 114 -15.034 -21.770 1.501 1.00 0.00 H new ATOM 0 HB3 TYR A 114 -15.870 -23.310 1.503 1.00 0.00 H new ATOM 0 HD1 TYR A 114 -13.688 -21.077 3.557 1.00 0.00 H new ATOM 0 HD2 TYR A 114 -16.288 -24.502 3.574 1.00 0.00 H new ATOM 0 HE1 TYR A 114 -13.726 -21.037 6.052 1.00 0.00 H new ATOM 0 HE2 TYR A 114 -16.321 -24.461 6.070 1.00 0.00 H new ATOM 0 HH TYR A 114 -15.632 -23.444 7.913 1.00 0.00 H new ATOM 1927 N ALA A 115 -13.094 -25.618 0.306 1.00 0.00 N ATOM 1928 CA ALA A 115 -13.222 -27.047 0.000 1.00 0.00 C ATOM 1929 C ALA A 115 -11.884 -27.764 0.181 1.00 0.00 C ATOM 1930 O ALA A 115 -10.834 -27.094 0.103 1.00 0.00 O ATOM 1931 CB ALA A 115 -13.747 -27.231 -1.436 1.00 0.00 C ATOM 1932 OXT ALA A 115 -11.901 -28.986 0.409 1.00 0.00 O ATOM 0 H ALA A 115 -12.286 -25.169 -0.125 1.00 0.00 H new ATOM 0 HA ALA A 115 -13.935 -27.490 0.695 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -13.839 -28.295 -1.656 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -14.723 -26.755 -1.530 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -13.051 -26.774 -2.139 1.00 0.00 H new TER 1938 ALA A 115