USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1666 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 74 ASN : amide:sc= 0.994 K(o=1.5,f=-8.3!) USER MOD Set 1.2: B 85 LYS NZ :NH3+ -134:sc= 0.522 (180deg=-0.875) USER MOD Set 2.1: B 36 ASN : amide:sc= 0.641 K(o=3,f=-7.8!) USER MOD Set 2.2: B 39 LYS NZ :NH3+ -137:sc= 2.37 (180deg=0.443) USER MOD Set 3.1: B 1 MET N :NH3+ -163:sc= 1.84 (180deg=-0.0751) USER MOD Set 3.2: B 7 THR OG1 : rot 74:sc= 2.03 USER MOD Set 4.1: A 55 SER OG : rot 64:sc= 1.1 USER MOD Set 4.2: A 85 LYS NZ :NH3+ -151:sc= 1.13 (180deg=-1.29) USER MOD Set 5.1: A 44 GLN : amide:sc= 0.29 K(o=-0.38,f=-1.9) USER MOD Set 5.2: A 45 GLN : amide:sc= -0.67 K(o=-0.38,f=-2) USER MOD Set 6.1: A 36 ASN : amide:sc= -0.75 K(o=-1.1,f=-10!) USER MOD Set 6.2: A 39 LYS NZ :NH3+ -164:sc= -0.395 (180deg=-0.007) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -114:sc= 0.226 (180deg=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= -0.0143 USER MOD Single : A 12 SER OG : rot 160:sc= 0 USER MOD Single : A 15 THR OG1 : rot 164:sc= 1.25 USER MOD Single : A 18 THR OG1 : rot 136:sc= 1.25 USER MOD Single : A 19 THR OG1 : rot 81:sc= 1.18 USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= 1.61 K(o=1.6,f=-8.8!) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot -55:sc= -0.0139 USER MOD Single : A 34 SER OG : rot 90:sc= 1.28 USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 HIS : no HE2:sc= -0.0182 K(o=-0.018,f=-4.7!) USER MOD Single : A 51 LYS NZ :NH3+ 167:sc= 1.23 (180deg=1.23) USER MOD Single : A 59 LYS NZ :NH3+ -157:sc= -0.837 (180deg=-2.88!) USER MOD Single : A 60 MET CE :methyl 177:sc= 0 (180deg=-0.0196) USER MOD Single : A 61 LYS NZ :NH3+ -150:sc= 1.83 (180deg=-0.165!) USER MOD Single : A 62 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -0.278 X(o=-0.28,f=-0.0073) USER MOD Single : A 67 GLN : amide:sc= -0.0306 K(o=-0.031,f=-2.7) USER MOD Single : A 69 SER OG : rot 85:sc= 1.1 USER MOD Single : A 72 LYS NZ :NH3+ -143:sc= 0.545 (180deg=-0.0331) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -150:sc= 2.11 (180deg=-0.302) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 LYS NZ :NH3+ 174:sc= 1.22 (180deg=1.09) USER MOD Single : A 98 LYS NZ :NH3+ -164:sc= 0.941 (180deg=0.793) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 12 SER OG : rot 68:sc= 1.09 USER MOD Single : B 15 THR OG1 : rot -47:sc= 1.26 USER MOD Single : B 18 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 81:sc= 0.643 USER MOD Single : B 22 THR OG1 : rot 159:sc= 1.13 USER MOD Single : B 26 GLN : amide:sc= -0.594 X(o=-0.59,f=-0.61) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0.778 (180deg=0.778) USER MOD Single : B 32 SER OG : rot 170:sc= 0.597 USER MOD Single : B 34 SER OG : rot 180:sc= 0.153 USER MOD Single : B 43 THR OG1 : rot 74:sc= 1.23 USER MOD Single : B 44 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 45 GLN : amide:sc= -0.565 K(o=-0.57,f=-3.8!) USER MOD Single : B 48 HIS : no HE2:sc= -1.18 K(o=-1.2,f=-7.6!) USER MOD Single : B 51 LYS NZ :NH3+ 179:sc= 2.47 (180deg=2.39) USER MOD Single : B 55 SER OG : rot 169:sc= 1.06 USER MOD Single : B 59 LYS NZ :NH3+ -173:sc= 2.22 (180deg=2.02) USER MOD Single : B 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 61 LYS NZ :NH3+ 172:sc= 0.29 (180deg=0.148) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= -0.0571 K(o=-0.057,f=-0.57) USER MOD Single : B 67 GLN : amide:sc= -0.673 K(o=-0.67,f=-3.5!) USER MOD Single : B 69 SER OG : rot 180:sc= 0.1 USER MOD Single : B 72 LYS NZ :NH3+ -177:sc= 1.2 (180deg=1.08) USER MOD Single : B 74 ASN : amide:sc= 1.1 K(o=1.1,f=-0.21) USER MOD Single : B 76 TYR OH : rot 30:sc= -0.0793 USER MOD Single : B 89 LYS NZ :NH3+ 140:sc= -0.204 (180deg=-4.36!) USER MOD Single : B 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 91 LYS NZ :NH3+ -163:sc= 1.18 (180deg=0.658) USER MOD Single : B 94 LYS NZ :NH3+ 160:sc= 1.32 (180deg=0.55!) USER MOD Single : B 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 98 LYS NZ :NH3+ 165:sc= 0.0721 (180deg=0.0274) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.563 -15.500 16.297 1.00 4.95 N ATOM 2 CA MET A 1 -9.638 -15.996 15.419 1.00 3.86 C ATOM 3 C MET A 1 -9.730 -15.031 14.244 1.00 3.02 C ATOM 4 O MET A 1 -9.252 -13.907 14.384 1.00 3.06 O ATOM 5 CB MET A 1 -10.988 -16.035 16.149 1.00 4.40 C ATOM 6 CG MET A 1 -11.069 -17.089 17.258 1.00 5.07 C ATOM 7 SD MET A 1 -12.684 -17.139 18.074 1.00 6.30 S ATOM 8 CE MET A 1 -12.407 -18.466 19.266 1.00 6.74 C ATOM 0 H1 MET A 1 -7.777 -16.181 16.302 1.00 4.95 H new ATOM 0 H2 MET A 1 -8.224 -14.582 15.946 1.00 4.95 H new ATOM 0 H3 MET A 1 -8.929 -15.387 17.264 1.00 4.95 H new ATOM 0 HA MET A 1 -9.412 -17.012 15.096 1.00 3.86 H new ATOM 0 HB2 MET A 1 -11.184 -15.053 16.580 1.00 4.40 H new ATOM 0 HB3 MET A 1 -11.777 -16.227 15.422 1.00 4.40 H new ATOM 0 HG2 MET A 1 -10.852 -18.070 16.835 1.00 5.07 H new ATOM 0 HG3 MET A 1 -10.299 -16.885 18.002 1.00 5.07 H new ATOM 0 HE1 MET A 1 -13.312 -18.623 19.852 1.00 6.74 H new ATOM 0 HE2 MET A 1 -12.154 -19.384 18.736 1.00 6.74 H new ATOM 0 HE3 MET A 1 -11.587 -18.193 19.931 1.00 6.74 H new ATOM 20 N ALA A 2 -10.335 -15.444 13.129 1.00 2.74 N ATOM 21 CA ALA A 2 -10.631 -14.565 12.011 1.00 2.22 C ATOM 22 C ALA A 2 -11.804 -15.160 11.244 1.00 1.99 C ATOM 23 O ALA A 2 -11.734 -16.327 10.870 1.00 2.36 O ATOM 24 CB ALA A 2 -9.400 -14.423 11.109 1.00 2.65 C ATOM 0 H ALA A 2 -10.634 -16.408 12.981 1.00 2.74 H new ATOM 0 HA ALA A 2 -10.892 -13.568 12.367 1.00 2.22 H new ATOM 0 HB1 ALA A 2 -9.635 -13.762 10.275 1.00 2.65 H new ATOM 0 HB2 ALA A 2 -8.574 -14.003 11.684 1.00 2.65 H new ATOM 0 HB3 ALA A 2 -9.114 -15.403 10.726 1.00 2.65 H new ATOM 30 N ALA A 3 -12.889 -14.399 11.056 1.00 1.76 N ATOM 31 CA ALA A 3 -14.033 -14.893 10.290 1.00 1.83 C ATOM 32 C ALA A 3 -14.863 -13.744 9.714 1.00 1.58 C ATOM 33 O ALA A 3 -16.075 -13.679 9.936 1.00 1.83 O ATOM 34 CB ALA A 3 -14.884 -15.814 11.177 1.00 2.39 C ATOM 0 H ALA A 3 -12.996 -13.452 11.419 1.00 1.76 H new ATOM 0 HA ALA A 3 -13.664 -15.467 9.440 1.00 1.83 H new ATOM 0 HB1 ALA A 3 -15.737 -16.182 10.607 1.00 2.39 H new ATOM 0 HB2 ALA A 3 -14.280 -16.657 11.511 1.00 2.39 H new ATOM 0 HB3 ALA A 3 -15.241 -15.257 12.043 1.00 2.39 H new ATOM 40 N GLU A 4 -14.220 -12.882 8.923 1.00 1.32 N ATOM 41 CA GLU A 4 -14.835 -11.770 8.210 1.00 1.18 C ATOM 42 C GLU A 4 -14.910 -12.091 6.718 1.00 1.17 C ATOM 43 O GLU A 4 -14.150 -12.937 6.248 1.00 1.20 O ATOM 44 CB GLU A 4 -14.039 -10.486 8.492 1.00 1.10 C ATOM 45 CG GLU A 4 -12.530 -10.660 8.338 1.00 1.55 C ATOM 46 CD GLU A 4 -11.766 -9.353 8.165 1.00 3.02 C ATOM 47 OE1 GLU A 4 -12.370 -8.292 8.401 1.00 3.87 O ATOM 48 OE2 GLU A 4 -10.553 -9.441 7.877 1.00 4.34 O ATOM 0 H GLU A 4 -13.216 -12.946 8.758 1.00 1.32 H new ATOM 0 HA GLU A 4 -15.856 -11.612 8.558 1.00 1.18 H new ATOM 0 HB2 GLU A 4 -14.377 -9.702 7.815 1.00 1.10 H new ATOM 0 HB3 GLU A 4 -14.256 -10.148 9.505 1.00 1.10 H new ATOM 0 HG2 GLU A 4 -12.144 -11.180 9.215 1.00 1.55 H new ATOM 0 HG3 GLU A 4 -12.335 -11.299 7.477 1.00 1.55 H new ATOM 55 N PRO A 5 -15.810 -11.456 5.950 1.00 1.27 N ATOM 56 CA PRO A 5 -15.991 -11.776 4.544 1.00 1.39 C ATOM 57 C PRO A 5 -14.930 -11.052 3.704 1.00 1.25 C ATOM 58 O PRO A 5 -15.268 -10.359 2.745 1.00 1.36 O ATOM 59 CB PRO A 5 -17.421 -11.313 4.239 1.00 1.66 C ATOM 60 CG PRO A 5 -17.564 -10.071 5.117 1.00 1.68 C ATOM 61 CD PRO A 5 -16.760 -10.431 6.367 1.00 1.41 C ATOM 0 HA PRO A 5 -15.867 -12.833 4.309 1.00 1.39 H new ATOM 0 HB2 PRO A 5 -17.555 -11.080 3.183 1.00 1.66 H new ATOM 0 HB3 PRO A 5 -18.157 -12.076 4.493 1.00 1.66 H new ATOM 0 HG2 PRO A 5 -17.167 -9.183 4.625 1.00 1.68 H new ATOM 0 HG3 PRO A 5 -18.607 -9.864 5.355 1.00 1.68 H new ATOM 0 HD2 PRO A 5 -16.243 -9.557 6.764 1.00 1.41 H new ATOM 0 HD3 PRO A 5 -17.412 -10.802 7.158 1.00 1.41 H new ATOM 69 N LEU A 6 -13.649 -11.203 4.064 1.00 1.13 N ATOM 70 CA LEU A 6 -12.592 -10.382 3.481 1.00 1.07 C ATOM 71 C LEU A 6 -12.116 -10.892 2.115 1.00 1.03 C ATOM 72 O LEU A 6 -12.499 -11.973 1.672 1.00 1.33 O ATOM 73 CB LEU A 6 -11.464 -10.150 4.506 1.00 1.11 C ATOM 74 CG LEU A 6 -10.418 -11.260 4.743 1.00 1.06 C ATOM 75 CD1 LEU A 6 -10.999 -12.667 4.914 1.00 2.50 C ATOM 76 CD2 LEU A 6 -9.325 -11.275 3.671 1.00 2.30 C ATOM 0 H LEU A 6 -13.326 -11.883 4.752 1.00 1.13 H new ATOM 0 HA LEU A 6 -13.011 -9.402 3.252 1.00 1.07 H new ATOM 0 HB2 LEU A 6 -10.926 -9.252 4.203 1.00 1.11 H new ATOM 0 HB3 LEU A 6 -11.933 -9.932 5.465 1.00 1.11 H new ATOM 0 HG LEU A 6 -9.975 -10.990 5.702 1.00 1.06 H new ATOM 0 HD11 LEU A 6 -10.189 -13.378 5.075 1.00 2.50 H new ATOM 0 HD12 LEU A 6 -11.671 -12.681 5.772 1.00 2.50 H new ATOM 0 HD13 LEU A 6 -11.552 -12.944 4.016 1.00 2.50 H new ATOM 0 HD21 LEU A 6 -8.616 -12.074 3.886 1.00 2.30 H new ATOM 0 HD22 LEU A 6 -9.777 -11.443 2.693 1.00 2.30 H new ATOM 0 HD23 LEU A 6 -8.803 -10.318 3.670 1.00 2.30 H new ATOM 88 N THR A 7 -11.316 -10.077 1.420 1.00 0.86 N ATOM 89 CA THR A 7 -10.992 -10.226 0.003 1.00 0.83 C ATOM 90 C THR A 7 -9.585 -9.695 -0.275 1.00 0.75 C ATOM 91 O THR A 7 -9.015 -9.016 0.574 1.00 0.77 O ATOM 92 CB THR A 7 -12.034 -9.444 -0.812 1.00 0.99 C ATOM 93 OG1 THR A 7 -11.858 -9.589 -2.208 1.00 2.09 O ATOM 94 CG2 THR A 7 -12.056 -7.968 -0.437 1.00 2.93 C ATOM 0 H THR A 7 -10.862 -9.269 1.846 1.00 0.86 H new ATOM 0 HA THR A 7 -11.014 -11.278 -0.280 1.00 0.83 H new ATOM 0 HB THR A 7 -12.998 -9.882 -0.555 1.00 0.99 H new ATOM 0 HG1 THR A 7 -12.546 -9.074 -2.680 1.00 2.09 H new ATOM 0 HG21 THR A 7 -12.806 -7.452 -1.036 1.00 2.93 H new ATOM 0 HG22 THR A 7 -12.302 -7.865 0.620 1.00 2.93 H new ATOM 0 HG23 THR A 7 -11.076 -7.530 -0.626 1.00 2.93 H new ATOM 102 N GLU A 8 -9.060 -9.956 -1.479 1.00 0.84 N ATOM 103 CA GLU A 8 -7.708 -9.609 -1.912 1.00 0.94 C ATOM 104 C GLU A 8 -7.265 -8.204 -1.479 1.00 0.87 C ATOM 105 O GLU A 8 -6.237 -8.044 -0.822 1.00 0.85 O ATOM 106 CB GLU A 8 -7.598 -9.732 -3.438 1.00 1.26 C ATOM 107 CG GLU A 8 -7.873 -11.131 -4.001 1.00 1.35 C ATOM 108 CD GLU A 8 -7.656 -11.143 -5.512 1.00 1.98 C ATOM 109 OE1 GLU A 8 -6.483 -11.249 -5.942 1.00 3.26 O ATOM 110 OE2 GLU A 8 -8.678 -11.013 -6.218 1.00 2.70 O ATOM 0 H GLU A 8 -9.592 -10.435 -2.206 1.00 0.84 H new ATOM 0 HA GLU A 8 -7.040 -10.316 -1.420 1.00 0.94 H new ATOM 0 HB2 GLU A 8 -8.296 -9.030 -3.894 1.00 1.26 H new ATOM 0 HB3 GLU A 8 -6.596 -9.427 -3.740 1.00 1.26 H new ATOM 0 HG2 GLU A 8 -7.214 -11.858 -3.526 1.00 1.35 H new ATOM 0 HG3 GLU A 8 -8.896 -11.429 -3.771 1.00 1.35 H new ATOM 117 N LEU A 9 -8.002 -7.156 -1.869 1.00 0.87 N ATOM 118 CA LEU A 9 -7.535 -5.804 -1.572 1.00 0.82 C ATOM 119 C LEU A 9 -7.501 -5.618 -0.054 1.00 0.79 C ATOM 120 O LEU A 9 -6.491 -5.200 0.516 1.00 0.84 O ATOM 121 CB LEU A 9 -8.429 -4.744 -2.232 1.00 0.95 C ATOM 122 CG LEU A 9 -8.247 -4.554 -3.749 1.00 1.02 C ATOM 123 CD1 LEU A 9 -6.908 -3.897 -4.086 1.00 2.20 C ATOM 124 CD2 LEU A 9 -8.409 -5.832 -4.581 1.00 1.47 C ATOM 0 H LEU A 9 -8.888 -7.215 -2.371 1.00 0.87 H new ATOM 0 HA LEU A 9 -6.533 -5.675 -1.981 1.00 0.82 H new ATOM 0 HB2 LEU A 9 -9.470 -5.006 -2.041 1.00 0.95 H new ATOM 0 HB3 LEU A 9 -8.246 -3.788 -1.742 1.00 0.95 H new ATOM 0 HG LEU A 9 -9.066 -3.892 -4.028 1.00 1.02 H new ATOM 0 HD11 LEU A 9 -6.821 -3.782 -5.166 1.00 2.20 H new ATOM 0 HD12 LEU A 9 -6.854 -2.917 -3.611 1.00 2.20 H new ATOM 0 HD13 LEU A 9 -6.094 -4.523 -3.721 1.00 2.20 H new ATOM 0 HD21 LEU A 9 -8.264 -5.600 -5.636 1.00 1.47 H new ATOM 0 HD22 LEU A 9 -7.669 -6.568 -4.266 1.00 1.47 H new ATOM 0 HD23 LEU A 9 -9.410 -6.238 -4.433 1.00 1.47 H new ATOM 136 N GLU A 10 -8.619 -5.954 0.592 1.00 0.75 N ATOM 137 CA GLU A 10 -8.811 -5.799 2.020 1.00 0.81 C ATOM 138 C GLU A 10 -7.703 -6.507 2.804 1.00 0.80 C ATOM 139 O GLU A 10 -7.155 -5.918 3.738 1.00 0.94 O ATOM 140 CB GLU A 10 -10.208 -6.301 2.401 1.00 0.94 C ATOM 141 CG GLU A 10 -10.708 -5.595 3.660 1.00 1.42 C ATOM 142 CD GLU A 10 -12.132 -5.989 4.018 1.00 2.24 C ATOM 143 OE1 GLU A 10 -12.463 -7.165 3.783 1.00 3.25 O ATOM 144 OE2 GLU A 10 -12.864 -5.097 4.502 1.00 3.29 O ATOM 0 H GLU A 10 -9.431 -6.350 0.118 1.00 0.75 H new ATOM 0 HA GLU A 10 -8.746 -4.744 2.284 1.00 0.81 H new ATOM 0 HB2 GLU A 10 -10.901 -6.124 1.579 1.00 0.94 H new ATOM 0 HB3 GLU A 10 -10.180 -7.378 2.568 1.00 0.94 H new ATOM 0 HG2 GLU A 10 -10.047 -5.833 4.494 1.00 1.42 H new ATOM 0 HG3 GLU A 10 -10.659 -4.516 3.512 1.00 1.42 H new ATOM 151 N GLU A 11 -7.367 -7.733 2.398 1.00 0.76 N ATOM 152 CA GLU A 11 -6.236 -8.501 2.893 1.00 0.76 C ATOM 153 C GLU A 11 -4.962 -7.681 2.733 1.00 0.74 C ATOM 154 O GLU A 11 -4.263 -7.422 3.709 1.00 0.86 O ATOM 155 CB GLU A 11 -6.153 -9.838 2.132 1.00 0.84 C ATOM 156 CG GLU A 11 -4.942 -10.703 2.522 1.00 1.19 C ATOM 157 CD GLU A 11 -3.661 -10.267 1.816 1.00 2.92 C ATOM 158 OE1 GLU A 11 -3.663 -10.311 0.567 1.00 4.09 O ATOM 159 OE2 GLU A 11 -2.721 -9.864 2.534 1.00 4.09 O ATOM 0 H GLU A 11 -7.900 -8.233 1.687 1.00 0.76 H new ATOM 0 HA GLU A 11 -6.363 -8.725 3.952 1.00 0.76 H new ATOM 0 HB2 GLU A 11 -7.066 -10.405 2.313 1.00 0.84 H new ATOM 0 HB3 GLU A 11 -6.112 -9.634 1.062 1.00 0.84 H new ATOM 0 HG2 GLU A 11 -4.794 -10.651 3.601 1.00 1.19 H new ATOM 0 HG3 GLU A 11 -5.150 -11.745 2.279 1.00 1.19 H new ATOM 166 N SER A 12 -4.673 -7.227 1.513 1.00 0.70 N ATOM 167 CA SER A 12 -3.352 -6.691 1.207 1.00 0.73 C ATOM 168 C SER A 12 -3.105 -5.483 2.111 1.00 0.68 C ATOM 169 O SER A 12 -2.048 -5.294 2.712 1.00 0.74 O ATOM 170 CB SER A 12 -3.303 -6.346 -0.283 1.00 0.88 C ATOM 171 OG SER A 12 -1.985 -6.024 -0.671 1.00 1.44 O ATOM 0 H SER A 12 -5.328 -7.220 0.731 1.00 0.70 H new ATOM 0 HA SER A 12 -2.558 -7.413 1.399 1.00 0.73 H new ATOM 0 HB2 SER A 12 -3.666 -7.190 -0.870 1.00 0.88 H new ATOM 0 HB3 SER A 12 -3.965 -5.505 -0.490 1.00 0.88 H new ATOM 0 HG SER A 12 -1.897 -6.120 -1.642 1.00 1.44 H new ATOM 177 N ILE A 13 -4.164 -4.694 2.263 1.00 0.63 N ATOM 178 CA ILE A 13 -4.195 -3.553 3.146 1.00 0.58 C ATOM 179 C ILE A 13 -4.062 -3.988 4.608 1.00 0.55 C ATOM 180 O ILE A 13 -3.281 -3.389 5.349 1.00 0.56 O ATOM 181 CB ILE A 13 -5.517 -2.828 2.897 1.00 0.57 C ATOM 182 CG1 ILE A 13 -5.543 -2.310 1.449 1.00 0.73 C ATOM 183 CG2 ILE A 13 -5.799 -1.659 3.858 1.00 0.52 C ATOM 184 CD1 ILE A 13 -6.975 -2.059 1.034 1.00 0.57 C ATOM 0 H ILE A 13 -5.040 -4.841 1.761 1.00 0.63 H new ATOM 0 HA ILE A 13 -3.356 -2.887 2.946 1.00 0.58 H new ATOM 0 HB ILE A 13 -6.302 -3.562 3.079 1.00 0.57 H new ATOM 0 HG12 ILE A 13 -4.963 -1.391 1.369 1.00 0.73 H new ATOM 0 HG13 ILE A 13 -5.081 -3.038 0.782 1.00 0.73 H new ATOM 0 HG21 ILE A 13 -6.757 -1.204 3.607 1.00 0.52 H new ATOM 0 HG22 ILE A 13 -5.831 -2.030 4.882 1.00 0.52 H new ATOM 0 HG23 ILE A 13 -5.009 -0.914 3.766 1.00 0.52 H new ATOM 0 HD11 ILE A 13 -6.997 -1.692 0.008 1.00 0.57 H new ATOM 0 HD12 ILE A 13 -7.541 -2.988 1.099 1.00 0.57 H new ATOM 0 HD13 ILE A 13 -7.421 -1.316 1.695 1.00 0.57 H new ATOM 196 N GLU A 14 -4.874 -4.959 5.060 1.00 0.55 N ATOM 197 CA GLU A 14 -4.861 -5.337 6.470 1.00 0.61 C ATOM 198 C GLU A 14 -3.451 -5.783 6.865 1.00 0.60 C ATOM 199 O GLU A 14 -2.916 -5.332 7.871 1.00 0.68 O ATOM 200 CB GLU A 14 -6.003 -6.280 6.882 1.00 0.78 C ATOM 201 CG GLU A 14 -5.769 -7.776 6.681 1.00 1.23 C ATOM 202 CD GLU A 14 -5.248 -8.466 7.941 1.00 2.30 C ATOM 203 OE1 GLU A 14 -4.346 -7.899 8.594 1.00 2.94 O ATOM 204 OE2 GLU A 14 -5.863 -9.493 8.303 1.00 3.12 O ATOM 0 H GLU A 14 -5.530 -5.481 4.480 1.00 0.55 H new ATOM 0 HA GLU A 14 -5.092 -4.456 7.070 1.00 0.61 H new ATOM 0 HB2 GLU A 14 -6.221 -6.109 7.936 1.00 0.78 H new ATOM 0 HB3 GLU A 14 -6.895 -5.998 6.323 1.00 0.78 H new ATOM 0 HG2 GLU A 14 -6.702 -8.247 6.373 1.00 1.23 H new ATOM 0 HG3 GLU A 14 -5.055 -7.922 5.870 1.00 1.23 H new ATOM 211 N THR A 15 -2.815 -6.568 6.001 1.00 0.58 N ATOM 212 CA THR A 15 -1.453 -7.041 6.157 1.00 0.61 C ATOM 213 C THR A 15 -0.494 -5.881 6.440 1.00 0.57 C ATOM 214 O THR A 15 0.307 -5.973 7.370 1.00 0.64 O ATOM 215 CB THR A 15 -1.067 -7.891 4.938 1.00 0.69 C ATOM 216 OG1 THR A 15 -1.952 -8.992 4.908 1.00 0.82 O ATOM 217 CG2 THR A 15 0.368 -8.412 5.052 1.00 0.77 C ATOM 0 H THR A 15 -3.254 -6.902 5.143 1.00 0.58 H new ATOM 0 HA THR A 15 -1.378 -7.688 7.031 1.00 0.61 H new ATOM 0 HB THR A 15 -1.131 -7.287 4.033 1.00 0.69 H new ATOM 0 HG1 THR A 15 -1.916 -9.417 4.026 1.00 0.82 H new ATOM 0 HG21 THR A 15 0.609 -9.010 4.173 1.00 0.77 H new ATOM 0 HG22 THR A 15 1.057 -7.570 5.118 1.00 0.77 H new ATOM 0 HG23 THR A 15 0.461 -9.028 5.946 1.00 0.77 H new ATOM 225 N VAL A 16 -0.580 -4.769 5.701 1.00 0.52 N ATOM 226 CA VAL A 16 0.255 -3.609 5.974 1.00 0.51 C ATOM 227 C VAL A 16 -0.003 -3.083 7.390 1.00 0.51 C ATOM 228 O VAL A 16 0.930 -2.965 8.185 1.00 0.56 O ATOM 229 CB VAL A 16 0.022 -2.525 4.909 1.00 0.52 C ATOM 230 CG1 VAL A 16 0.720 -1.231 5.327 1.00 0.57 C ATOM 231 CG2 VAL A 16 0.564 -2.967 3.546 1.00 0.58 C ATOM 0 H VAL A 16 -1.219 -4.655 4.914 1.00 0.52 H new ATOM 0 HA VAL A 16 1.303 -3.904 5.923 1.00 0.51 H new ATOM 0 HB VAL A 16 -1.052 -2.361 4.824 1.00 0.52 H new ATOM 0 HG11 VAL A 16 0.552 -0.466 4.569 1.00 0.57 H new ATOM 0 HG12 VAL A 16 0.316 -0.892 6.281 1.00 0.57 H new ATOM 0 HG13 VAL A 16 1.790 -1.411 5.429 1.00 0.57 H new ATOM 0 HG21 VAL A 16 0.386 -2.182 2.812 1.00 0.58 H new ATOM 0 HG22 VAL A 16 1.635 -3.155 3.624 1.00 0.58 H new ATOM 0 HG23 VAL A 16 0.057 -3.879 3.231 1.00 0.58 H new ATOM 241 N VAL A 17 -1.257 -2.740 7.710 1.00 0.50 N ATOM 242 CA VAL A 17 -1.564 -2.150 9.013 1.00 0.54 C ATOM 243 C VAL A 17 -1.137 -3.082 10.158 1.00 0.59 C ATOM 244 O VAL A 17 -0.500 -2.646 11.116 1.00 0.73 O ATOM 245 CB VAL A 17 -3.019 -1.652 9.123 1.00 0.53 C ATOM 246 CG1 VAL A 17 -3.270 -0.488 8.155 1.00 0.56 C ATOM 247 CG2 VAL A 17 -4.049 -2.738 8.824 1.00 0.55 C ATOM 0 H VAL A 17 -2.061 -2.859 7.094 1.00 0.50 H new ATOM 0 HA VAL A 17 -0.963 -1.246 9.111 1.00 0.54 H new ATOM 0 HB VAL A 17 -3.140 -1.334 10.158 1.00 0.53 H new ATOM 0 HG11 VAL A 17 -4.303 -0.152 8.249 1.00 0.56 H new ATOM 0 HG12 VAL A 17 -2.597 0.336 8.394 1.00 0.56 H new ATOM 0 HG13 VAL A 17 -3.088 -0.819 7.133 1.00 0.56 H new ATOM 0 HG21 VAL A 17 -5.053 -2.323 8.919 1.00 0.55 H new ATOM 0 HG22 VAL A 17 -3.903 -3.108 7.809 1.00 0.55 H new ATOM 0 HG23 VAL A 17 -3.928 -3.559 9.531 1.00 0.55 H new ATOM 257 N THR A 18 -1.437 -4.372 10.015 1.00 0.60 N ATOM 258 CA THR A 18 -0.961 -5.458 10.854 1.00 0.74 C ATOM 259 C THR A 18 0.552 -5.355 11.018 1.00 0.72 C ATOM 260 O THR A 18 1.063 -5.335 12.136 1.00 0.77 O ATOM 261 CB THR A 18 -1.396 -6.791 10.212 1.00 0.97 C ATOM 262 OG1 THR A 18 -2.745 -7.048 10.556 1.00 1.90 O ATOM 263 CG2 THR A 18 -0.500 -7.972 10.595 1.00 0.93 C ATOM 0 H THR A 18 -2.052 -4.699 9.270 1.00 0.60 H new ATOM 0 HA THR A 18 -1.392 -5.403 11.854 1.00 0.74 H new ATOM 0 HB THR A 18 -1.294 -6.686 9.132 1.00 0.97 H new ATOM 0 HG1 THR A 18 -3.233 -7.351 9.762 1.00 1.90 H new ATOM 0 HG21 THR A 18 -0.863 -8.877 10.109 1.00 0.93 H new ATOM 0 HG22 THR A 18 0.522 -7.773 10.273 1.00 0.93 H new ATOM 0 HG23 THR A 18 -0.520 -8.108 11.676 1.00 0.93 H new ATOM 271 N THR A 19 1.282 -5.291 9.906 1.00 0.68 N ATOM 272 CA THR A 19 2.732 -5.351 9.911 1.00 0.72 C ATOM 273 C THR A 19 3.371 -4.217 10.727 1.00 0.70 C ATOM 274 O THR A 19 4.447 -4.413 11.285 1.00 0.87 O ATOM 275 CB THR A 19 3.225 -5.468 8.466 1.00 0.79 C ATOM 276 OG1 THR A 19 2.856 -6.734 7.964 1.00 1.37 O ATOM 277 CG2 THR A 19 4.738 -5.326 8.310 1.00 0.92 C ATOM 0 H THR A 19 0.877 -5.196 8.975 1.00 0.68 H new ATOM 0 HA THR A 19 3.064 -6.245 10.440 1.00 0.72 H new ATOM 0 HB THR A 19 2.765 -4.646 7.917 1.00 0.79 H new ATOM 0 HG1 THR A 19 1.921 -6.710 7.671 1.00 1.37 H new ATOM 0 HG21 THR A 19 5.006 -5.421 7.258 1.00 0.92 H new ATOM 0 HG22 THR A 19 5.052 -4.349 8.678 1.00 0.92 H new ATOM 0 HG23 THR A 19 5.238 -6.107 8.883 1.00 0.92 H new ATOM 285 N PHE A 20 2.725 -3.052 10.876 1.00 0.64 N ATOM 286 CA PHE A 20 3.220 -2.046 11.821 1.00 0.70 C ATOM 287 C PHE A 20 3.326 -2.595 13.252 1.00 0.84 C ATOM 288 O PHE A 20 4.244 -2.225 13.982 1.00 0.96 O ATOM 289 CB PHE A 20 2.344 -0.789 11.820 1.00 0.75 C ATOM 290 CG PHE A 20 2.260 -0.051 10.501 1.00 0.66 C ATOM 291 CD1 PHE A 20 3.425 0.352 9.825 1.00 1.48 C ATOM 292 CD2 PHE A 20 1.002 0.274 9.969 1.00 1.62 C ATOM 293 CE1 PHE A 20 3.327 1.007 8.586 1.00 1.38 C ATOM 294 CE2 PHE A 20 0.906 0.829 8.683 1.00 1.86 C ATOM 295 CZ PHE A 20 2.069 1.221 8.000 1.00 1.00 C ATOM 0 H PHE A 20 1.881 -2.789 10.368 1.00 0.64 H new ATOM 0 HA PHE A 20 4.221 -1.780 11.480 1.00 0.70 H new ATOM 0 HB2 PHE A 20 1.336 -1.071 12.123 1.00 0.75 H new ATOM 0 HB3 PHE A 20 2.724 -0.102 12.576 1.00 0.75 H new ATOM 0 HD1 PHE A 20 4.395 0.158 10.258 1.00 1.48 H new ATOM 0 HD2 PHE A 20 0.108 0.097 10.549 1.00 1.62 H new ATOM 0 HE1 PHE A 20 4.221 1.346 8.083 1.00 1.38 H new ATOM 0 HE2 PHE A 20 -0.061 0.954 8.219 1.00 1.86 H new ATOM 0 HZ PHE A 20 1.996 1.685 7.028 1.00 1.00 H new ATOM 305 N PHE A 21 2.379 -3.444 13.660 1.00 0.89 N ATOM 306 CA PHE A 21 2.380 -4.119 14.953 1.00 1.06 C ATOM 307 C PHE A 21 3.325 -5.323 14.878 1.00 1.17 C ATOM 308 O PHE A 21 4.281 -5.445 15.647 1.00 1.50 O ATOM 309 CB PHE A 21 0.935 -4.516 15.292 1.00 1.05 C ATOM 310 CG PHE A 21 0.724 -5.175 16.640 1.00 1.41 C ATOM 311 CD1 PHE A 21 0.814 -6.575 16.754 1.00 2.67 C ATOM 312 CD2 PHE A 21 0.255 -4.417 17.731 1.00 2.25 C ATOM 313 CE1 PHE A 21 0.409 -7.216 17.936 1.00 3.26 C ATOM 314 CE2 PHE A 21 -0.179 -5.062 18.902 1.00 2.74 C ATOM 315 CZ PHE A 21 -0.117 -6.463 18.999 1.00 2.82 C ATOM 0 H PHE A 21 1.572 -3.684 13.084 1.00 0.89 H new ATOM 0 HA PHE A 21 2.742 -3.470 15.751 1.00 1.06 H new ATOM 0 HB2 PHE A 21 0.314 -3.622 15.246 1.00 1.05 H new ATOM 0 HB3 PHE A 21 0.575 -5.194 14.518 1.00 1.05 H new ATOM 0 HD1 PHE A 21 1.196 -7.158 15.929 1.00 2.67 H new ATOM 0 HD2 PHE A 21 0.229 -3.339 17.668 1.00 2.25 H new ATOM 0 HE1 PHE A 21 0.502 -8.288 18.028 1.00 3.26 H new ATOM 0 HE2 PHE A 21 -0.561 -4.481 19.728 1.00 2.74 H new ATOM 0 HZ PHE A 21 -0.473 -6.960 19.889 1.00 2.82 H new ATOM 325 N THR A 22 3.109 -6.191 13.886 1.00 1.16 N ATOM 326 CA THR A 22 3.899 -7.394 13.667 1.00 1.54 C ATOM 327 C THR A 22 5.171 -7.007 12.904 1.00 1.73 C ATOM 328 O THR A 22 5.413 -7.456 11.787 1.00 2.09 O ATOM 329 CB THR A 22 3.034 -8.416 12.907 1.00 2.02 C ATOM 330 OG1 THR A 22 1.747 -8.465 13.494 1.00 2.83 O ATOM 331 CG2 THR A 22 3.635 -9.825 12.935 1.00 2.33 C ATOM 0 H THR A 22 2.363 -6.070 13.201 1.00 1.16 H new ATOM 0 HA THR A 22 4.205 -7.857 14.605 1.00 1.54 H new ATOM 0 HB THR A 22 2.984 -8.090 11.868 1.00 2.02 H new ATOM 0 HG1 THR A 22 1.192 -9.113 13.012 1.00 2.83 H new ATOM 0 HG21 THR A 22 2.987 -10.508 12.385 1.00 2.33 H new ATOM 0 HG22 THR A 22 4.622 -9.809 12.472 1.00 2.33 H new ATOM 0 HG23 THR A 22 3.724 -10.162 13.968 1.00 2.33 H new ATOM 339 N PHE A 23 5.972 -6.146 13.538 1.00 1.96 N ATOM 340 CA PHE A 23 7.142 -5.503 12.957 1.00 2.35 C ATOM 341 C PHE A 23 8.408 -6.111 13.556 1.00 2.54 C ATOM 342 O PHE A 23 9.308 -6.541 12.843 1.00 3.42 O ATOM 343 CB PHE A 23 7.048 -4.002 13.250 1.00 2.83 C ATOM 344 CG PHE A 23 7.951 -3.121 12.414 1.00 3.53 C ATOM 345 CD1 PHE A 23 7.447 -2.539 11.236 1.00 4.86 C ATOM 346 CD2 PHE A 23 9.218 -2.742 12.896 1.00 4.05 C ATOM 347 CE1 PHE A 23 8.178 -1.538 10.576 1.00 6.01 C ATOM 348 CE2 PHE A 23 9.962 -1.762 12.217 1.00 5.17 C ATOM 349 CZ PHE A 23 9.440 -1.154 11.061 1.00 5.96 C ATOM 0 H PHE A 23 5.812 -5.871 14.507 1.00 1.96 H new ATOM 0 HA PHE A 23 7.181 -5.656 11.879 1.00 2.35 H new ATOM 0 HB2 PHE A 23 6.017 -3.683 13.099 1.00 2.83 H new ATOM 0 HB3 PHE A 23 7.282 -3.839 14.302 1.00 2.83 H new ATOM 0 HD1 PHE A 23 6.496 -2.863 10.839 1.00 4.86 H new ATOM 0 HD2 PHE A 23 9.618 -3.204 13.787 1.00 4.05 H new ATOM 0 HE1 PHE A 23 7.770 -1.063 9.696 1.00 6.01 H new ATOM 0 HE2 PHE A 23 10.937 -1.475 12.584 1.00 5.17 H new ATOM 0 HZ PHE A 23 10.008 -0.393 10.547 1.00 5.96 H new ATOM 359 N ALA A 24 8.465 -6.137 14.890 1.00 2.45 N ATOM 360 CA ALA A 24 9.568 -6.689 15.662 1.00 2.74 C ATOM 361 C ALA A 24 9.052 -6.967 17.073 1.00 3.08 C ATOM 362 O ALA A 24 9.487 -6.338 18.033 1.00 3.59 O ATOM 363 CB ALA A 24 10.749 -5.710 15.662 1.00 3.18 C ATOM 0 H ALA A 24 7.719 -5.761 15.475 1.00 2.45 H new ATOM 0 HA ALA A 24 9.931 -7.619 15.225 1.00 2.74 H new ATOM 0 HB1 ALA A 24 11.570 -6.131 16.242 1.00 3.18 H new ATOM 0 HB2 ALA A 24 11.079 -5.538 14.637 1.00 3.18 H new ATOM 0 HB3 ALA A 24 10.438 -4.765 16.107 1.00 3.18 H new ATOM 369 N ARG A 25 8.079 -7.882 17.168 1.00 3.37 N ATOM 370 CA ARG A 25 7.279 -8.161 18.360 1.00 4.06 C ATOM 371 C ARG A 25 6.920 -6.878 19.124 1.00 3.82 C ATOM 372 O ARG A 25 7.193 -6.752 20.317 1.00 4.19 O ATOM 373 CB ARG A 25 7.950 -9.234 19.242 1.00 4.99 C ATOM 374 CG ARG A 25 9.379 -8.892 19.696 1.00 5.08 C ATOM 375 CD ARG A 25 9.877 -9.903 20.737 1.00 6.01 C ATOM 376 NE ARG A 25 11.212 -9.543 21.245 1.00 6.51 N ATOM 377 CZ ARG A 25 12.379 -9.768 20.617 1.00 7.34 C ATOM 378 NH1 ARG A 25 12.386 -10.362 19.420 1.00 7.96 N ATOM 379 NH2 ARG A 25 13.531 -9.399 21.189 1.00 8.13 N ATOM 0 H ARG A 25 7.819 -8.473 16.378 1.00 3.37 H new ATOM 0 HA ARG A 25 6.327 -8.582 18.037 1.00 4.06 H new ATOM 0 HB2 ARG A 25 7.332 -9.397 20.125 1.00 4.99 H new ATOM 0 HB3 ARG A 25 7.974 -10.174 18.691 1.00 4.99 H new ATOM 0 HG2 ARG A 25 10.048 -8.890 18.835 1.00 5.08 H new ATOM 0 HG3 ARG A 25 9.400 -7.888 20.119 1.00 5.08 H new ATOM 0 HD2 ARG A 25 9.172 -9.950 21.567 1.00 6.01 H new ATOM 0 HD3 ARG A 25 9.912 -10.897 20.292 1.00 6.01 H new ATOM 0 HE ARG A 25 11.255 -9.082 22.154 1.00 6.51 H new ATOM 0 HH11 ARG A 25 11.507 -10.643 18.985 1.00 7.96 H new ATOM 0 HH12 ARG A 25 13.270 -10.534 18.941 1.00 7.96 H new ATOM 0 HH21 ARG A 25 13.525 -8.946 22.103 1.00 8.13 H new ATOM 0 HH22 ARG A 25 14.416 -9.571 20.711 1.00 8.13 H new ATOM 393 N GLN A 26 6.256 -5.940 18.442 1.00 4.04 N ATOM 394 CA GLN A 26 5.824 -4.691 19.044 1.00 4.29 C ATOM 395 C GLN A 26 4.360 -4.839 19.436 1.00 4.50 C ATOM 396 O GLN A 26 3.464 -4.507 18.660 1.00 5.42 O ATOM 397 CB GLN A 26 6.070 -3.519 18.088 1.00 5.49 C ATOM 398 CG GLN A 26 7.572 -3.354 17.825 1.00 6.00 C ATOM 399 CD GLN A 26 7.878 -2.032 17.131 1.00 7.67 C ATOM 400 OE1 GLN A 26 7.232 -1.670 16.150 1.00 8.74 O ATOM 401 NE2 GLN A 26 8.863 -1.287 17.622 1.00 8.37 N ATOM 0 H GLN A 26 6.006 -6.032 17.457 1.00 4.04 H new ATOM 0 HA GLN A 26 6.402 -4.470 19.941 1.00 4.29 H new ATOM 0 HB2 GLN A 26 5.546 -3.691 17.148 1.00 5.49 H new ATOM 0 HB3 GLN A 26 5.665 -2.601 18.515 1.00 5.49 H new ATOM 0 HG2 GLN A 26 8.115 -3.404 18.769 1.00 6.00 H new ATOM 0 HG3 GLN A 26 7.927 -4.180 17.209 1.00 6.00 H new ATOM 0 HE21 GLN A 26 9.386 -1.606 18.437 1.00 8.37 H new ATOM 0 HE22 GLN A 26 9.096 -0.396 17.184 1.00 8.37 H new ATOM 410 N GLU A 27 4.118 -5.327 20.656 1.00 4.40 N ATOM 411 CA GLU A 27 2.778 -5.603 21.147 1.00 5.23 C ATOM 412 C GLU A 27 2.183 -4.277 21.636 1.00 4.83 C ATOM 413 O GLU A 27 2.004 -4.039 22.828 1.00 5.43 O ATOM 414 CB GLU A 27 2.850 -6.688 22.232 1.00 6.41 C ATOM 415 CG GLU A 27 1.474 -7.310 22.509 1.00 7.91 C ATOM 416 CD GLU A 27 1.530 -8.390 23.584 1.00 9.38 C ATOM 417 OE1 GLU A 27 2.653 -8.848 23.884 1.00 9.60 O ATOM 418 OE2 GLU A 27 0.437 -8.745 24.075 1.00 10.62 O ATOM 0 H GLU A 27 4.854 -5.540 21.329 1.00 4.40 H new ATOM 0 HA GLU A 27 2.122 -5.996 20.370 1.00 5.23 H new ATOM 0 HB2 GLU A 27 3.545 -7.468 21.921 1.00 6.41 H new ATOM 0 HB3 GLU A 27 3.246 -6.257 23.152 1.00 6.41 H new ATOM 0 HG2 GLU A 27 0.781 -6.528 22.819 1.00 7.91 H new ATOM 0 HG3 GLU A 27 1.080 -7.738 21.588 1.00 7.91 H new ATOM 425 N GLY A 28 1.935 -3.387 20.674 1.00 4.40 N ATOM 426 CA GLY A 28 1.634 -1.985 20.884 1.00 3.89 C ATOM 427 C GLY A 28 2.498 -1.165 19.927 1.00 3.13 C ATOM 428 O GLY A 28 3.710 -1.360 19.860 1.00 3.52 O ATOM 0 H GLY A 28 1.941 -3.643 19.687 1.00 4.40 H new ATOM 0 HA2 GLY A 28 0.577 -1.792 20.703 1.00 3.89 H new ATOM 0 HA3 GLY A 28 1.837 -1.703 21.917 1.00 3.89 H new ATOM 432 N ARG A 29 1.873 -0.268 19.163 1.00 2.52 N ATOM 433 CA ARG A 29 2.522 0.591 18.187 1.00 2.02 C ATOM 434 C ARG A 29 1.617 1.812 18.023 1.00 1.75 C ATOM 435 O ARG A 29 0.415 1.702 18.263 1.00 1.92 O ATOM 436 CB ARG A 29 2.701 -0.193 16.871 1.00 2.12 C ATOM 437 CG ARG A 29 3.107 0.644 15.648 1.00 2.87 C ATOM 438 CD ARG A 29 4.516 1.246 15.740 1.00 4.93 C ATOM 439 NE ARG A 29 5.533 0.308 15.237 1.00 6.24 N ATOM 440 CZ ARG A 29 6.023 0.260 13.988 1.00 7.90 C ATOM 441 NH1 ARG A 29 5.521 1.017 13.007 1.00 8.39 N ATOM 442 NH2 ARG A 29 7.043 -0.560 13.739 1.00 9.57 N ATOM 0 H ARG A 29 0.865 -0.119 19.213 1.00 2.52 H new ATOM 0 HA ARG A 29 3.515 0.915 18.498 1.00 2.02 H new ATOM 0 HB2 ARG A 29 3.456 -0.963 17.028 1.00 2.12 H new ATOM 0 HB3 ARG A 29 1.766 -0.705 16.644 1.00 2.12 H new ATOM 0 HG2 ARG A 29 3.048 0.018 14.757 1.00 2.87 H new ATOM 0 HG3 ARG A 29 2.386 1.451 15.518 1.00 2.87 H new ATOM 0 HD2 ARG A 29 4.556 2.172 15.166 1.00 4.93 H new ATOM 0 HD3 ARG A 29 4.737 1.504 16.776 1.00 4.93 H new ATOM 0 HE ARG A 29 5.901 -0.372 15.902 1.00 6.24 H new ATOM 0 HH11 ARG A 29 4.746 1.652 13.198 1.00 8.39 H new ATOM 0 HH12 ARG A 29 5.913 0.960 12.067 1.00 8.39 H new ATOM 0 HH21 ARG A 29 7.432 -1.132 14.489 1.00 9.57 H new ATOM 0 HH22 ARG A 29 7.435 -0.616 12.799 1.00 9.57 H new ATOM 456 N LYS A 30 2.187 2.956 17.627 1.00 1.74 N ATOM 457 CA LYS A 30 1.413 4.090 17.143 1.00 1.97 C ATOM 458 C LYS A 30 1.028 3.808 15.684 1.00 1.78 C ATOM 459 O LYS A 30 0.005 3.177 15.427 1.00 2.71 O ATOM 460 CB LYS A 30 2.220 5.393 17.282 1.00 2.47 C ATOM 461 CG LYS A 30 2.389 5.882 18.725 1.00 2.98 C ATOM 462 CD LYS A 30 2.738 7.383 18.753 1.00 3.62 C ATOM 463 CE LYS A 30 4.002 7.733 17.943 1.00 3.78 C ATOM 464 NZ LYS A 30 4.249 9.192 17.868 1.00 4.91 N ATOM 0 H LYS A 30 3.194 3.115 17.635 1.00 1.74 H new ATOM 0 HA LYS A 30 0.508 4.220 17.736 1.00 1.97 H new ATOM 0 HB2 LYS A 30 3.207 5.243 16.844 1.00 2.47 H new ATOM 0 HB3 LYS A 30 1.729 6.174 16.702 1.00 2.47 H new ATOM 0 HG2 LYS A 30 1.470 5.707 19.284 1.00 2.98 H new ATOM 0 HG3 LYS A 30 3.176 5.311 19.218 1.00 2.98 H new ATOM 0 HD2 LYS A 30 1.895 7.952 18.361 1.00 3.62 H new ATOM 0 HD3 LYS A 30 2.880 7.696 19.787 1.00 3.62 H new ATOM 0 HE2 LYS A 30 4.865 7.246 18.396 1.00 3.78 H new ATOM 0 HE3 LYS A 30 3.904 7.333 16.934 1.00 3.78 H new ATOM 0 HZ1 LYS A 30 5.110 9.370 17.313 1.00 4.91 H new ATOM 0 HZ2 LYS A 30 3.439 9.658 17.411 1.00 4.91 H new ATOM 0 HZ3 LYS A 30 4.371 9.573 18.828 1.00 4.91 H new ATOM 478 N ASP A 31 1.881 4.228 14.743 1.00 1.16 N ATOM 479 CA ASP A 31 1.618 4.203 13.315 1.00 1.17 C ATOM 480 C ASP A 31 2.870 3.650 12.624 1.00 1.21 C ATOM 481 O ASP A 31 3.294 2.524 12.898 1.00 1.90 O ATOM 482 CB ASP A 31 1.270 5.632 12.841 1.00 1.34 C ATOM 483 CG ASP A 31 0.041 6.231 13.515 1.00 1.58 C ATOM 484 OD1 ASP A 31 0.187 6.667 14.678 1.00 2.91 O ATOM 485 OD2 ASP A 31 -1.003 6.282 12.834 1.00 2.22 O ATOM 0 H ASP A 31 2.801 4.605 14.970 1.00 1.16 H new ATOM 0 HA ASP A 31 0.770 3.565 13.067 1.00 1.17 H new ATOM 0 HB2 ASP A 31 2.125 6.282 13.025 1.00 1.34 H new ATOM 0 HB3 ASP A 31 1.108 5.616 11.763 1.00 1.34 H new ATOM 490 N SER A 32 3.489 4.459 11.764 1.00 1.27 N ATOM 491 CA SER A 32 4.730 4.169 11.068 1.00 1.16 C ATOM 492 C SER A 32 5.919 4.527 11.976 1.00 1.00 C ATOM 493 O SER A 32 5.856 4.263 13.176 1.00 1.20 O ATOM 494 CB SER A 32 4.674 4.924 9.732 1.00 1.17 C ATOM 495 OG SER A 32 3.515 4.511 9.040 1.00 2.08 O ATOM 0 H SER A 32 3.115 5.378 11.526 1.00 1.27 H new ATOM 0 HA SER A 32 4.865 3.112 10.840 1.00 1.16 H new ATOM 0 HB2 SER A 32 4.651 6.000 9.904 1.00 1.17 H new ATOM 0 HB3 SER A 32 5.565 4.715 9.140 1.00 1.17 H new ATOM 0 HG SER A 32 3.522 3.536 8.943 1.00 2.08 H new ATOM 501 N LEU A 33 7.010 5.059 11.413 1.00 0.92 N ATOM 502 CA LEU A 33 8.251 5.368 12.120 1.00 0.85 C ATOM 503 C LEU A 33 8.540 6.866 11.948 1.00 0.80 C ATOM 504 O LEU A 33 7.639 7.624 11.595 1.00 0.89 O ATOM 505 CB LEU A 33 9.409 4.528 11.546 1.00 0.98 C ATOM 506 CG LEU A 33 9.276 2.999 11.486 1.00 1.02 C ATOM 507 CD1 LEU A 33 8.912 2.386 12.842 1.00 1.28 C ATOM 508 CD2 LEU A 33 8.337 2.541 10.370 1.00 1.19 C ATOM 0 H LEU A 33 7.051 5.292 10.421 1.00 0.92 H new ATOM 0 HA LEU A 33 8.152 5.128 13.179 1.00 0.85 H new ATOM 0 HB2 LEU A 33 9.596 4.880 10.531 1.00 0.98 H new ATOM 0 HB3 LEU A 33 10.300 4.756 12.132 1.00 0.98 H new ATOM 0 HG LEU A 33 10.265 2.617 11.235 1.00 1.02 H new ATOM 0 HD11 LEU A 33 8.831 1.304 12.742 1.00 1.28 H new ATOM 0 HD12 LEU A 33 9.687 2.626 13.570 1.00 1.28 H new ATOM 0 HD13 LEU A 33 7.959 2.792 13.180 1.00 1.28 H new ATOM 0 HD21 LEU A 33 8.277 1.453 10.369 1.00 1.19 H new ATOM 0 HD22 LEU A 33 7.344 2.959 10.535 1.00 1.19 H new ATOM 0 HD23 LEU A 33 8.720 2.884 9.409 1.00 1.19 H new ATOM 520 N SER A 34 9.792 7.293 12.133 1.00 0.76 N ATOM 521 CA SER A 34 10.254 8.589 11.645 1.00 0.74 C ATOM 522 C SER A 34 10.471 8.495 10.129 1.00 0.73 C ATOM 523 O SER A 34 10.383 7.408 9.555 1.00 0.83 O ATOM 524 CB SER A 34 11.516 9.036 12.397 1.00 0.82 C ATOM 525 OG SER A 34 11.431 8.668 13.759 1.00 1.37 O ATOM 0 H SER A 34 10.506 6.753 12.621 1.00 0.76 H new ATOM 0 HA SER A 34 9.502 9.354 11.836 1.00 0.74 H new ATOM 0 HB2 SER A 34 12.397 8.581 11.945 1.00 0.82 H new ATOM 0 HB3 SER A 34 11.635 10.116 12.312 1.00 0.82 H new ATOM 0 HG SER A 34 11.818 7.776 13.882 1.00 1.37 H new ATOM 531 N VAL A 35 10.740 9.609 9.447 1.00 0.69 N ATOM 532 CA VAL A 35 10.678 9.628 7.988 1.00 0.71 C ATOM 533 C VAL A 35 11.898 8.923 7.375 1.00 0.67 C ATOM 534 O VAL A 35 11.769 7.955 6.624 1.00 0.67 O ATOM 535 CB VAL A 35 10.538 11.075 7.503 1.00 0.80 C ATOM 536 CG1 VAL A 35 10.263 11.108 6.006 1.00 0.88 C ATOM 537 CG2 VAL A 35 9.387 11.825 8.186 1.00 0.93 C ATOM 0 H VAL A 35 10.999 10.498 9.875 1.00 0.69 H new ATOM 0 HA VAL A 35 9.802 9.072 7.654 1.00 0.71 H new ATOM 0 HB VAL A 35 11.481 11.562 7.752 1.00 0.80 H new ATOM 0 HG11 VAL A 35 10.166 12.143 5.677 1.00 0.88 H new ATOM 0 HG12 VAL A 35 11.088 10.634 5.474 1.00 0.88 H new ATOM 0 HG13 VAL A 35 9.338 10.572 5.794 1.00 0.88 H new ATOM 0 HG21 VAL A 35 9.338 12.844 7.802 1.00 0.93 H new ATOM 0 HG22 VAL A 35 8.447 11.314 7.980 1.00 0.93 H new ATOM 0 HG23 VAL A 35 9.558 11.851 9.262 1.00 0.93 H new ATOM 547 N ASN A 36 13.102 9.411 7.684 1.00 0.76 N ATOM 548 CA ASN A 36 14.339 8.774 7.236 1.00 0.81 C ATOM 549 C ASN A 36 14.381 7.327 7.728 1.00 0.73 C ATOM 550 O ASN A 36 14.598 6.408 6.944 1.00 0.75 O ATOM 551 CB ASN A 36 15.579 9.540 7.728 1.00 1.04 C ATOM 552 CG ASN A 36 16.466 9.978 6.568 1.00 2.14 C ATOM 553 OD1 ASN A 36 16.685 9.234 5.612 1.00 3.13 O ATOM 554 ND2 ASN A 36 16.938 11.221 6.599 1.00 2.34 N ATOM 0 H ASN A 36 13.245 10.250 8.246 1.00 0.76 H new ATOM 0 HA ASN A 36 14.354 8.789 6.146 1.00 0.81 H new ATOM 0 HB2 ASN A 36 15.265 10.415 8.297 1.00 1.04 H new ATOM 0 HB3 ASN A 36 16.152 8.908 8.406 1.00 1.04 H new ATOM 0 HD21 ASN A 36 17.494 11.575 5.820 1.00 2.34 H new ATOM 0 HD22 ASN A 36 16.744 11.820 7.401 1.00 2.34 H new ATOM 561 N GLU A 37 14.101 7.143 9.025 1.00 0.78 N ATOM 562 CA GLU A 37 13.964 5.847 9.675 1.00 0.85 C ATOM 563 C GLU A 37 13.121 4.910 8.804 1.00 0.78 C ATOM 564 O GLU A 37 13.580 3.839 8.419 1.00 0.83 O ATOM 565 CB GLU A 37 13.347 6.069 11.063 1.00 1.05 C ATOM 566 CG GLU A 37 13.221 4.798 11.911 1.00 1.24 C ATOM 567 CD GLU A 37 12.596 5.078 13.273 1.00 2.45 C ATOM 568 OE1 GLU A 37 11.882 6.104 13.370 1.00 3.96 O ATOM 569 OE2 GLU A 37 12.789 4.238 14.173 1.00 3.02 O ATOM 0 H GLU A 37 13.960 7.923 9.666 1.00 0.78 H new ATOM 0 HA GLU A 37 14.935 5.368 9.800 1.00 0.85 H new ATOM 0 HB2 GLU A 37 13.954 6.794 11.605 1.00 1.05 H new ATOM 0 HB3 GLU A 37 12.357 6.509 10.941 1.00 1.05 H new ATOM 0 HG2 GLU A 37 12.615 4.066 11.378 1.00 1.24 H new ATOM 0 HG3 GLU A 37 14.207 4.355 12.049 1.00 1.24 H new ATOM 576 N PHE A 38 11.902 5.328 8.448 1.00 0.75 N ATOM 577 CA PHE A 38 11.056 4.602 7.512 1.00 0.72 C ATOM 578 C PHE A 38 11.843 4.192 6.262 1.00 0.65 C ATOM 579 O PHE A 38 11.877 3.003 5.947 1.00 0.71 O ATOM 580 CB PHE A 38 9.802 5.418 7.165 1.00 0.71 C ATOM 581 CG PHE A 38 9.240 5.146 5.784 1.00 0.72 C ATOM 582 CD1 PHE A 38 8.492 3.983 5.552 1.00 2.02 C ATOM 583 CD2 PHE A 38 9.633 5.947 4.694 1.00 2.23 C ATOM 584 CE1 PHE A 38 8.042 3.683 4.255 1.00 2.02 C ATOM 585 CE2 PHE A 38 9.339 5.542 3.383 1.00 2.34 C ATOM 586 CZ PHE A 38 8.512 4.427 3.163 1.00 1.03 C ATOM 0 H PHE A 38 11.478 6.184 8.806 1.00 0.75 H new ATOM 0 HA PHE A 38 10.721 3.683 7.992 1.00 0.72 H new ATOM 0 HB2 PHE A 38 9.030 5.208 7.906 1.00 0.71 H new ATOM 0 HB3 PHE A 38 10.040 6.479 7.245 1.00 0.71 H new ATOM 0 HD1 PHE A 38 8.262 3.317 6.371 1.00 2.02 H new ATOM 0 HD2 PHE A 38 10.161 6.873 4.867 1.00 2.23 H new ATOM 0 HE1 PHE A 38 7.336 2.881 4.099 1.00 2.02 H new ATOM 0 HE2 PHE A 38 9.748 6.086 2.544 1.00 2.34 H new ATOM 0 HZ PHE A 38 8.240 4.144 2.157 1.00 1.03 H new ATOM 596 N LYS A 39 12.466 5.152 5.562 1.00 0.62 N ATOM 597 CA LYS A 39 13.225 4.871 4.345 1.00 0.63 C ATOM 598 C LYS A 39 14.224 3.737 4.602 1.00 0.68 C ATOM 599 O LYS A 39 14.317 2.783 3.826 1.00 0.72 O ATOM 600 CB LYS A 39 13.909 6.143 3.796 1.00 0.71 C ATOM 601 CG LYS A 39 14.743 5.845 2.535 1.00 0.95 C ATOM 602 CD LYS A 39 16.221 5.531 2.847 1.00 1.66 C ATOM 603 CE LYS A 39 17.163 6.724 2.640 1.00 2.19 C ATOM 604 NZ LYS A 39 16.764 7.916 3.415 1.00 3.57 N ATOM 0 H LYS A 39 12.455 6.137 5.826 1.00 0.62 H new ATOM 0 HA LYS A 39 12.534 4.540 3.570 1.00 0.63 H new ATOM 0 HB2 LYS A 39 13.151 6.891 3.562 1.00 0.71 H new ATOM 0 HB3 LYS A 39 14.553 6.570 4.565 1.00 0.71 H new ATOM 0 HG2 LYS A 39 14.302 5.000 2.006 1.00 0.95 H new ATOM 0 HG3 LYS A 39 14.694 6.702 1.863 1.00 0.95 H new ATOM 0 HD2 LYS A 39 16.301 5.192 3.880 1.00 1.66 H new ATOM 0 HD3 LYS A 39 16.549 4.706 2.214 1.00 1.66 H new ATOM 0 HE2 LYS A 39 18.175 6.435 2.924 1.00 2.19 H new ATOM 0 HE3 LYS A 39 17.190 6.979 1.581 1.00 2.19 H new ATOM 0 HZ1 LYS A 39 17.255 8.753 3.042 1.00 3.57 H new ATOM 0 HZ2 LYS A 39 15.736 8.054 3.336 1.00 3.57 H new ATOM 0 HZ3 LYS A 39 17.019 7.782 4.414 1.00 3.57 H new ATOM 618 N GLU A 40 14.980 3.871 5.689 1.00 0.74 N ATOM 619 CA GLU A 40 16.023 2.941 6.078 1.00 0.87 C ATOM 620 C GLU A 40 15.423 1.550 6.326 1.00 0.85 C ATOM 621 O GLU A 40 15.856 0.569 5.721 1.00 0.94 O ATOM 622 CB GLU A 40 16.778 3.532 7.275 1.00 1.16 C ATOM 623 CG GLU A 40 17.522 4.808 6.833 1.00 1.15 C ATOM 624 CD GLU A 40 17.835 5.736 7.997 1.00 2.30 C ATOM 625 OE1 GLU A 40 18.225 5.206 9.058 1.00 2.89 O ATOM 626 OE2 GLU A 40 17.680 6.960 7.790 1.00 3.25 O ATOM 0 H GLU A 40 14.877 4.652 6.337 1.00 0.74 H new ATOM 0 HA GLU A 40 16.753 2.799 5.281 1.00 0.87 H new ATOM 0 HB2 GLU A 40 16.081 3.765 8.080 1.00 1.16 H new ATOM 0 HB3 GLU A 40 17.486 2.803 7.668 1.00 1.16 H new ATOM 0 HG2 GLU A 40 18.451 4.529 6.336 1.00 1.15 H new ATOM 0 HG3 GLU A 40 16.917 5.342 6.100 1.00 1.15 H new ATOM 633 N LEU A 41 14.397 1.454 7.172 1.00 0.85 N ATOM 634 CA LEU A 41 13.760 0.177 7.464 1.00 0.90 C ATOM 635 C LEU A 41 13.181 -0.459 6.196 1.00 0.91 C ATOM 636 O LEU A 41 13.416 -1.644 5.966 1.00 1.05 O ATOM 637 CB LEU A 41 12.709 0.300 8.582 1.00 1.03 C ATOM 638 CG LEU A 41 13.252 0.227 10.027 1.00 1.30 C ATOM 639 CD1 LEU A 41 13.987 -1.083 10.343 1.00 2.35 C ATOM 640 CD2 LEU A 41 14.151 1.405 10.404 1.00 2.53 C ATOM 0 H LEU A 41 13.991 2.249 7.666 1.00 0.85 H new ATOM 0 HA LEU A 41 14.533 -0.494 7.838 1.00 0.90 H new ATOM 0 HB2 LEU A 41 12.184 1.247 8.459 1.00 1.03 H new ATOM 0 HB3 LEU A 41 11.972 -0.492 8.451 1.00 1.03 H new ATOM 0 HG LEU A 41 12.349 0.272 10.636 1.00 1.30 H new ATOM 0 HD11 LEU A 41 14.340 -1.063 11.374 1.00 2.35 H new ATOM 0 HD12 LEU A 41 13.306 -1.924 10.209 1.00 2.35 H new ATOM 0 HD13 LEU A 41 14.838 -1.194 9.671 1.00 2.35 H new ATOM 0 HD21 LEU A 41 14.495 1.286 11.432 1.00 2.53 H new ATOM 0 HD22 LEU A 41 15.011 1.435 9.735 1.00 2.53 H new ATOM 0 HD23 LEU A 41 13.589 2.335 10.315 1.00 2.53 H new ATOM 652 N VAL A 42 12.444 0.283 5.354 1.00 0.84 N ATOM 653 CA VAL A 42 11.934 -0.331 4.129 1.00 0.85 C ATOM 654 C VAL A 42 13.097 -0.829 3.268 1.00 0.89 C ATOM 655 O VAL A 42 13.108 -2.007 2.930 1.00 1.07 O ATOM 656 CB VAL A 42 10.908 0.510 3.342 1.00 0.80 C ATOM 657 CG1 VAL A 42 9.661 0.760 4.190 1.00 1.73 C ATOM 658 CG2 VAL A 42 11.430 1.829 2.769 1.00 1.32 C ATOM 0 H VAL A 42 12.199 1.263 5.492 1.00 0.84 H new ATOM 0 HA VAL A 42 11.339 -1.188 4.444 1.00 0.85 H new ATOM 0 HB VAL A 42 10.667 -0.097 2.469 1.00 0.80 H new ATOM 0 HG11 VAL A 42 8.947 1.355 3.620 1.00 1.73 H new ATOM 0 HG12 VAL A 42 9.206 -0.194 4.459 1.00 1.73 H new ATOM 0 HG13 VAL A 42 9.939 1.297 5.097 1.00 1.73 H new ATOM 0 HG21 VAL A 42 10.626 2.338 2.236 1.00 1.32 H new ATOM 0 HG22 VAL A 42 11.785 2.463 3.581 1.00 1.32 H new ATOM 0 HG23 VAL A 42 12.251 1.627 2.081 1.00 1.32 H new ATOM 668 N THR A 43 14.096 0.007 2.941 1.00 0.78 N ATOM 669 CA THR A 43 15.178 -0.451 2.065 1.00 0.81 C ATOM 670 C THR A 43 15.858 -1.700 2.647 1.00 0.87 C ATOM 671 O THR A 43 16.132 -2.650 1.920 1.00 1.06 O ATOM 672 CB THR A 43 16.147 0.679 1.667 1.00 0.79 C ATOM 673 OG1 THR A 43 16.931 0.291 0.558 1.00 1.21 O ATOM 674 CG2 THR A 43 17.108 1.103 2.774 1.00 1.11 C ATOM 0 H THR A 43 14.175 0.973 3.260 1.00 0.78 H new ATOM 0 HA THR A 43 14.738 -0.759 1.116 1.00 0.81 H new ATOM 0 HB THR A 43 15.502 1.527 1.436 1.00 0.79 H new ATOM 0 HG1 THR A 43 17.540 1.020 0.317 1.00 1.21 H new ATOM 0 HG21 THR A 43 17.754 1.902 2.409 1.00 1.11 H new ATOM 0 HG22 THR A 43 16.539 1.460 3.633 1.00 1.11 H new ATOM 0 HG23 THR A 43 17.719 0.251 3.072 1.00 1.11 H new ATOM 682 N GLN A 44 16.046 -1.737 3.971 1.00 0.87 N ATOM 683 CA GLN A 44 16.561 -2.907 4.675 1.00 1.03 C ATOM 684 C GLN A 44 15.674 -4.125 4.393 1.00 1.03 C ATOM 685 O GLN A 44 16.169 -5.176 3.994 1.00 1.12 O ATOM 686 CB GLN A 44 16.665 -2.609 6.181 1.00 1.11 C ATOM 687 CG GLN A 44 17.728 -3.446 6.907 1.00 1.54 C ATOM 688 CD GLN A 44 17.518 -4.958 6.854 1.00 2.40 C ATOM 689 OE1 GLN A 44 18.458 -5.700 6.588 1.00 3.56 O ATOM 690 NE2 GLN A 44 16.310 -5.444 7.119 1.00 3.46 N ATOM 0 H GLN A 44 15.842 -0.948 4.585 1.00 0.87 H new ATOM 0 HA GLN A 44 17.562 -3.140 4.313 1.00 1.03 H new ATOM 0 HB2 GLN A 44 16.893 -1.552 6.318 1.00 1.11 H new ATOM 0 HB3 GLN A 44 15.695 -2.789 6.645 1.00 1.11 H new ATOM 0 HG2 GLN A 44 18.703 -3.216 6.478 1.00 1.54 H new ATOM 0 HG3 GLN A 44 17.759 -3.137 7.952 1.00 1.54 H new ATOM 0 HE21 GLN A 44 15.542 -4.810 7.338 1.00 3.46 H new ATOM 0 HE22 GLN A 44 16.151 -6.451 7.104 1.00 3.46 H new ATOM 699 N GLN A 45 14.359 -3.977 4.587 1.00 0.98 N ATOM 700 CA GLN A 45 13.393 -5.030 4.295 1.00 0.97 C ATOM 701 C GLN A 45 13.381 -5.419 2.821 1.00 1.01 C ATOM 702 O GLN A 45 12.876 -6.493 2.519 1.00 1.06 O ATOM 703 CB GLN A 45 11.972 -4.623 4.710 1.00 0.92 C ATOM 704 CG GLN A 45 11.659 -5.037 6.156 1.00 1.13 C ATOM 705 CD GLN A 45 12.493 -4.336 7.232 1.00 1.15 C ATOM 706 OE1 GLN A 45 13.700 -4.526 7.337 1.00 2.06 O ATOM 707 NE2 GLN A 45 11.846 -3.564 8.100 1.00 2.18 N ATOM 0 H GLN A 45 13.939 -3.122 4.951 1.00 0.98 H new ATOM 0 HA GLN A 45 13.712 -5.892 4.880 1.00 0.97 H new ATOM 0 HB2 GLN A 45 11.859 -3.544 4.608 1.00 0.92 H new ATOM 0 HB3 GLN A 45 11.250 -5.084 4.036 1.00 0.92 H new ATOM 0 HG2 GLN A 45 10.605 -4.842 6.352 1.00 1.13 H new ATOM 0 HG3 GLN A 45 11.807 -6.113 6.249 1.00 1.13 H new ATOM 0 HE21 GLN A 45 10.842 -3.415 8.000 1.00 2.18 H new ATOM 0 HE22 GLN A 45 12.354 -3.121 8.866 1.00 2.18 H new ATOM 716 N LEU A 46 13.890 -4.553 1.939 1.00 1.06 N ATOM 717 CA LEU A 46 13.850 -4.669 0.489 1.00 1.06 C ATOM 718 C LEU A 46 15.214 -5.076 -0.109 1.00 1.08 C ATOM 719 O LEU A 46 15.766 -4.342 -0.930 1.00 1.21 O ATOM 720 CB LEU A 46 13.327 -3.314 -0.050 1.00 1.29 C ATOM 721 CG LEU A 46 11.804 -3.279 -0.264 1.00 1.12 C ATOM 722 CD1 LEU A 46 11.149 -2.017 0.299 1.00 1.28 C ATOM 723 CD2 LEU A 46 11.474 -3.360 -1.761 1.00 1.66 C ATOM 0 H LEU A 46 14.368 -3.704 2.242 1.00 1.06 H new ATOM 0 HA LEU A 46 13.182 -5.474 0.184 1.00 1.06 H new ATOM 0 HB2 LEU A 46 13.605 -2.524 0.648 1.00 1.29 H new ATOM 0 HB3 LEU A 46 13.823 -3.093 -0.995 1.00 1.29 H new ATOM 0 HG LEU A 46 11.406 -4.140 0.273 1.00 1.12 H new ATOM 0 HD11 LEU A 46 10.075 -2.052 0.117 1.00 1.28 H new ATOM 0 HD12 LEU A 46 11.333 -1.959 1.372 1.00 1.28 H new ATOM 0 HD13 LEU A 46 11.571 -1.139 -0.190 1.00 1.28 H new ATOM 0 HD21 LEU A 46 10.393 -3.334 -1.897 1.00 1.66 H new ATOM 0 HD22 LEU A 46 11.925 -2.514 -2.279 1.00 1.66 H new ATOM 0 HD23 LEU A 46 11.869 -4.289 -2.171 1.00 1.66 H new ATOM 735 N PRO A 47 15.794 -6.251 0.198 1.00 1.11 N ATOM 736 CA PRO A 47 17.071 -6.655 -0.371 1.00 1.17 C ATOM 737 C PRO A 47 16.885 -7.264 -1.771 1.00 1.20 C ATOM 738 O PRO A 47 17.420 -8.338 -2.041 1.00 1.59 O ATOM 739 CB PRO A 47 17.613 -7.682 0.629 1.00 1.36 C ATOM 740 CG PRO A 47 16.338 -8.414 1.043 1.00 1.42 C ATOM 741 CD PRO A 47 15.333 -7.269 1.128 1.00 1.23 C ATOM 0 HA PRO A 47 17.755 -5.818 -0.512 1.00 1.17 H new ATOM 0 HB2 PRO A 47 18.340 -8.353 0.173 1.00 1.36 H new ATOM 0 HB3 PRO A 47 18.106 -7.207 1.477 1.00 1.36 H new ATOM 0 HG2 PRO A 47 16.041 -9.165 0.310 1.00 1.42 H new ATOM 0 HG3 PRO A 47 16.453 -8.928 1.997 1.00 1.42 H new ATOM 0 HD2 PRO A 47 14.332 -7.610 0.866 1.00 1.23 H new ATOM 0 HD3 PRO A 47 15.279 -6.873 2.142 1.00 1.23 H new ATOM 749 N HIS A 48 16.128 -6.610 -2.660 1.00 1.16 N ATOM 750 CA HIS A 48 16.015 -7.028 -4.055 1.00 1.25 C ATOM 751 C HIS A 48 17.195 -6.479 -4.876 1.00 1.48 C ATOM 752 O HIS A 48 18.355 -6.748 -4.553 1.00 2.63 O ATOM 753 CB HIS A 48 14.602 -6.745 -4.600 1.00 1.34 C ATOM 754 CG HIS A 48 14.293 -7.476 -5.887 1.00 1.97 C ATOM 755 ND1 HIS A 48 14.463 -8.821 -6.120 1.00 3.04 N ATOM 756 CD2 HIS A 48 13.801 -6.928 -7.039 1.00 2.54 C ATOM 757 CE1 HIS A 48 14.134 -9.063 -7.398 1.00 3.90 C ATOM 758 NE2 HIS A 48 13.710 -7.937 -8.001 1.00 3.58 N ATOM 0 H HIS A 48 15.581 -5.781 -2.430 1.00 1.16 H new ATOM 0 HA HIS A 48 16.110 -8.110 -4.144 1.00 1.25 H new ATOM 0 HB2 HIS A 48 13.867 -7.027 -3.846 1.00 1.34 H new ATOM 0 HB3 HIS A 48 14.493 -5.673 -4.765 1.00 1.34 H new ATOM 0 HD1 HIS A 48 14.783 -9.512 -5.441 1.00 3.04 H new ATOM 0 HD2 HIS A 48 13.529 -5.892 -7.181 1.00 2.54 H new ATOM 0 HE1 HIS A 48 14.200 -10.029 -7.877 1.00 3.90 H new ATOM 766 N LEU A 49 16.918 -5.701 -5.930 1.00 1.08 N ATOM 767 CA LEU A 49 17.930 -4.963 -6.684 1.00 1.10 C ATOM 768 C LEU A 49 18.009 -3.531 -6.147 1.00 1.01 C ATOM 769 O LEU A 49 19.085 -3.069 -5.782 1.00 1.12 O ATOM 770 CB LEU A 49 17.605 -4.970 -8.189 1.00 1.17 C ATOM 771 CG LEU A 49 18.114 -6.197 -8.969 1.00 1.83 C ATOM 772 CD1 LEU A 49 19.644 -6.203 -9.100 1.00 2.63 C ATOM 773 CD2 LEU A 49 17.631 -7.526 -8.382 1.00 3.59 C ATOM 0 H LEU A 49 15.971 -5.567 -6.285 1.00 1.08 H new ATOM 0 HA LEU A 49 18.898 -5.447 -6.558 1.00 1.10 H new ATOM 0 HB2 LEU A 49 16.524 -4.907 -8.310 1.00 1.17 H new ATOM 0 HB3 LEU A 49 18.029 -4.073 -8.639 1.00 1.17 H new ATOM 0 HG LEU A 49 17.680 -6.104 -9.965 1.00 1.83 H new ATOM 0 HD11 LEU A 49 19.958 -7.086 -9.657 1.00 2.63 H new ATOM 0 HD12 LEU A 49 19.967 -5.306 -9.629 1.00 2.63 H new ATOM 0 HD13 LEU A 49 20.094 -6.221 -8.107 1.00 2.63 H new ATOM 0 HD21 LEU A 49 18.024 -8.351 -8.977 1.00 3.59 H new ATOM 0 HD22 LEU A 49 17.983 -7.619 -7.355 1.00 3.59 H new ATOM 0 HD23 LEU A 49 16.541 -7.555 -8.396 1.00 3.59 H new ATOM 785 N LEU A 50 16.868 -2.833 -6.112 1.00 1.02 N ATOM 786 CA LEU A 50 16.731 -1.485 -5.562 1.00 1.05 C ATOM 787 C LEU A 50 17.581 -0.507 -6.378 1.00 1.02 C ATOM 788 O LEU A 50 18.438 0.214 -5.876 1.00 1.18 O ATOM 789 CB LEU A 50 16.977 -1.446 -4.041 1.00 1.32 C ATOM 790 CG LEU A 50 15.778 -1.931 -3.200 1.00 1.76 C ATOM 791 CD1 LEU A 50 14.661 -0.884 -3.135 1.00 2.88 C ATOM 792 CD2 LEU A 50 15.201 -3.260 -3.697 1.00 2.62 C ATOM 0 H LEU A 50 15.991 -3.204 -6.477 1.00 1.02 H new ATOM 0 HA LEU A 50 15.697 -1.155 -5.662 1.00 1.05 H new ATOM 0 HB2 LEU A 50 17.845 -2.063 -3.808 1.00 1.32 H new ATOM 0 HB3 LEU A 50 17.224 -0.425 -3.749 1.00 1.32 H new ATOM 0 HG LEU A 50 16.176 -2.089 -2.198 1.00 1.76 H new ATOM 0 HD11 LEU A 50 13.837 -1.268 -2.533 1.00 2.88 H new ATOM 0 HD12 LEU A 50 15.045 0.031 -2.683 1.00 2.88 H new ATOM 0 HD13 LEU A 50 14.305 -0.669 -4.142 1.00 2.88 H new ATOM 0 HD21 LEU A 50 14.361 -3.550 -3.067 1.00 2.62 H new ATOM 0 HD22 LEU A 50 14.860 -3.147 -4.726 1.00 2.62 H new ATOM 0 HD23 LEU A 50 15.971 -4.030 -3.652 1.00 2.62 H new ATOM 804 N LYS A 51 17.308 -0.525 -7.683 1.00 1.05 N ATOM 805 CA LYS A 51 17.946 0.286 -8.710 1.00 1.15 C ATOM 806 C LYS A 51 17.530 1.762 -8.606 1.00 1.08 C ATOM 807 O LYS A 51 18.289 2.662 -8.952 1.00 1.15 O ATOM 808 CB LYS A 51 17.592 -0.338 -10.068 1.00 1.30 C ATOM 809 CG LYS A 51 16.084 -0.370 -10.396 1.00 1.31 C ATOM 810 CD LYS A 51 15.586 0.976 -10.942 1.00 1.31 C ATOM 811 CE LYS A 51 14.634 0.843 -12.134 1.00 1.39 C ATOM 812 NZ LYS A 51 13.722 2.003 -12.191 1.00 2.99 N ATOM 0 H LYS A 51 16.594 -1.143 -8.069 1.00 1.05 H new ATOM 0 HA LYS A 51 19.028 0.290 -8.582 1.00 1.15 H new ATOM 0 HB2 LYS A 51 18.108 0.217 -10.852 1.00 1.30 H new ATOM 0 HB3 LYS A 51 17.976 -1.358 -10.094 1.00 1.30 H new ATOM 0 HG2 LYS A 51 15.889 -1.153 -11.129 1.00 1.31 H new ATOM 0 HG3 LYS A 51 15.523 -0.627 -9.498 1.00 1.31 H new ATOM 0 HD2 LYS A 51 15.080 1.517 -10.143 1.00 1.31 H new ATOM 0 HD3 LYS A 51 16.445 1.577 -11.240 1.00 1.31 H new ATOM 0 HE2 LYS A 51 15.206 0.775 -13.059 1.00 1.39 H new ATOM 0 HE3 LYS A 51 14.058 -0.078 -12.047 1.00 1.39 H new ATOM 0 HZ1 LYS A 51 13.237 2.018 -13.111 1.00 2.99 H new ATOM 0 HZ2 LYS A 51 13.018 1.929 -11.429 1.00 2.99 H new ATOM 0 HZ3 LYS A 51 14.268 2.880 -12.073 1.00 2.99 H new ATOM 826 N ASP A 52 16.283 1.955 -8.178 1.00 1.02 N ATOM 827 CA ASP A 52 15.623 3.126 -7.636 1.00 1.00 C ATOM 828 C ASP A 52 16.120 4.486 -8.120 1.00 0.97 C ATOM 829 O ASP A 52 17.056 5.049 -7.561 1.00 1.31 O ATOM 830 CB ASP A 52 15.503 2.977 -6.116 1.00 1.46 C ATOM 831 CG ASP A 52 14.681 1.749 -5.730 1.00 1.98 C ATOM 832 OD1 ASP A 52 14.630 0.811 -6.562 1.00 3.12 O ATOM 833 OD2 ASP A 52 14.091 1.772 -4.632 1.00 2.46 O ATOM 0 H ASP A 52 15.626 1.176 -8.212 1.00 1.02 H new ATOM 0 HA ASP A 52 14.621 3.147 -8.065 1.00 1.00 H new ATOM 0 HB2 ASP A 52 16.498 2.900 -5.679 1.00 1.46 H new ATOM 0 HB3 ASP A 52 15.039 3.871 -5.699 1.00 1.46 H new ATOM 838 N VAL A 53 15.463 5.018 -9.160 1.00 1.00 N ATOM 839 CA VAL A 53 15.699 6.361 -9.662 1.00 1.20 C ATOM 840 C VAL A 53 14.371 7.033 -10.035 1.00 0.99 C ATOM 841 O VAL A 53 13.395 6.345 -10.349 1.00 1.59 O ATOM 842 CB VAL A 53 16.714 6.303 -10.821 1.00 2.12 C ATOM 843 CG1 VAL A 53 16.205 5.468 -12.005 1.00 2.46 C ATOM 844 CG2 VAL A 53 17.115 7.702 -11.305 1.00 2.96 C ATOM 0 H VAL A 53 14.744 4.513 -9.677 1.00 1.00 H new ATOM 0 HA VAL A 53 16.140 6.987 -8.886 1.00 1.20 H new ATOM 0 HB VAL A 53 17.597 5.810 -10.415 1.00 2.12 H new ATOM 0 HG11 VAL A 53 16.957 5.459 -12.794 1.00 2.46 H new ATOM 0 HG12 VAL A 53 16.014 4.447 -11.675 1.00 2.46 H new ATOM 0 HG13 VAL A 53 15.282 5.904 -12.388 1.00 2.46 H new ATOM 0 HG21 VAL A 53 17.831 7.613 -12.122 1.00 2.96 H new ATOM 0 HG22 VAL A 53 16.230 8.234 -11.655 1.00 2.96 H new ATOM 0 HG23 VAL A 53 17.569 8.255 -10.483 1.00 2.96 H new ATOM 854 N GLY A 54 14.325 8.367 -9.984 1.00 1.00 N ATOM 855 CA GLY A 54 13.220 9.194 -10.440 1.00 1.10 C ATOM 856 C GLY A 54 12.240 9.421 -9.297 1.00 1.00 C ATOM 857 O GLY A 54 12.272 10.444 -8.614 1.00 1.07 O ATOM 0 H GLY A 54 15.095 8.919 -9.605 1.00 1.00 H new ATOM 0 HA2 GLY A 54 13.596 10.150 -10.805 1.00 1.10 H new ATOM 0 HA3 GLY A 54 12.713 8.711 -11.275 1.00 1.10 H new ATOM 861 N SER A 55 11.366 8.442 -9.061 1.00 1.00 N ATOM 862 CA SER A 55 10.495 8.482 -7.898 1.00 1.05 C ATOM 863 C SER A 55 11.328 8.401 -6.617 1.00 0.90 C ATOM 864 O SER A 55 10.946 8.975 -5.598 1.00 0.93 O ATOM 865 CB SER A 55 9.409 7.408 -7.992 1.00 1.25 C ATOM 866 OG SER A 55 9.626 6.542 -9.100 1.00 2.51 O ATOM 0 H SER A 55 11.247 7.622 -9.656 1.00 1.00 H new ATOM 0 HA SER A 55 9.966 9.435 -7.868 1.00 1.05 H new ATOM 0 HB2 SER A 55 9.392 6.825 -7.071 1.00 1.25 H new ATOM 0 HB3 SER A 55 8.433 7.884 -8.086 1.00 1.25 H new ATOM 0 HG SER A 55 10.464 6.051 -8.972 1.00 2.51 H new ATOM 872 N LEU A 56 12.496 7.750 -6.696 1.00 0.81 N ATOM 873 CA LEU A 56 13.485 7.761 -5.633 1.00 0.79 C ATOM 874 C LEU A 56 13.727 9.202 -5.245 1.00 0.82 C ATOM 875 O LEU A 56 13.489 9.562 -4.102 1.00 0.83 O ATOM 876 CB LEU A 56 14.778 7.080 -6.091 1.00 0.87 C ATOM 877 CG LEU A 56 15.924 7.054 -5.061 1.00 1.41 C ATOM 878 CD1 LEU A 56 16.698 8.373 -4.926 1.00 1.51 C ATOM 879 CD2 LEU A 56 15.474 6.540 -3.689 1.00 2.75 C ATOM 0 H LEU A 56 12.774 7.200 -7.509 1.00 0.81 H new ATOM 0 HA LEU A 56 13.125 7.202 -4.769 1.00 0.79 H new ATOM 0 HB2 LEU A 56 14.545 6.053 -6.373 1.00 0.87 H new ATOM 0 HB3 LEU A 56 15.134 7.585 -6.989 1.00 0.87 H new ATOM 0 HG LEU A 56 16.631 6.337 -5.478 1.00 1.41 H new ATOM 0 HD11 LEU A 56 17.484 8.259 -4.179 1.00 1.51 H new ATOM 0 HD12 LEU A 56 17.144 8.633 -5.886 1.00 1.51 H new ATOM 0 HD13 LEU A 56 16.016 9.165 -4.617 1.00 1.51 H new ATOM 0 HD21 LEU A 56 16.321 6.543 -3.003 1.00 2.75 H new ATOM 0 HD22 LEU A 56 14.688 7.187 -3.298 1.00 2.75 H new ATOM 0 HD23 LEU A 56 15.092 5.524 -3.789 1.00 2.75 H new ATOM 891 N ASP A 57 14.161 10.024 -6.197 1.00 0.95 N ATOM 892 CA ASP A 57 14.494 11.417 -5.985 1.00 1.09 C ATOM 893 C ASP A 57 13.278 12.168 -5.423 1.00 1.11 C ATOM 894 O ASP A 57 13.375 12.866 -4.408 1.00 1.13 O ATOM 895 CB ASP A 57 14.987 12.018 -7.312 1.00 1.38 C ATOM 896 CG ASP A 57 16.042 11.151 -7.996 1.00 3.45 C ATOM 897 OD1 ASP A 57 15.668 10.021 -8.399 1.00 4.88 O ATOM 898 OD2 ASP A 57 17.193 11.618 -8.093 1.00 4.31 O ATOM 0 H ASP A 57 14.292 9.724 -7.163 1.00 0.95 H new ATOM 0 HA ASP A 57 15.294 11.511 -5.251 1.00 1.09 H new ATOM 0 HB2 ASP A 57 14.139 12.149 -7.984 1.00 1.38 H new ATOM 0 HB3 ASP A 57 15.402 13.009 -7.126 1.00 1.38 H new ATOM 903 N GLU A 58 12.121 11.982 -6.078 1.00 1.22 N ATOM 904 CA GLU A 58 10.823 12.526 -5.666 1.00 1.41 C ATOM 905 C GLU A 58 10.590 12.265 -4.170 1.00 1.29 C ATOM 906 O GLU A 58 10.189 13.163 -3.429 1.00 1.48 O ATOM 907 CB GLU A 58 9.696 11.932 -6.541 1.00 1.60 C ATOM 908 CG GLU A 58 8.537 12.879 -6.916 1.00 1.83 C ATOM 909 CD GLU A 58 7.505 13.132 -5.819 1.00 2.75 C ATOM 910 OE1 GLU A 58 6.512 12.368 -5.747 1.00 4.07 O ATOM 911 OE2 GLU A 58 7.706 14.137 -5.101 1.00 3.27 O ATOM 0 H GLU A 58 12.064 11.432 -6.935 1.00 1.22 H new ATOM 0 HA GLU A 58 10.818 13.606 -5.814 1.00 1.41 H new ATOM 0 HB2 GLU A 58 10.142 11.559 -7.463 1.00 1.60 H new ATOM 0 HB3 GLU A 58 9.277 11.072 -6.018 1.00 1.60 H new ATOM 0 HG2 GLU A 58 8.959 13.837 -7.220 1.00 1.83 H new ATOM 0 HG3 GLU A 58 8.023 12.467 -7.785 1.00 1.83 H new ATOM 918 N LYS A 59 10.876 11.051 -3.709 1.00 1.04 N ATOM 919 CA LYS A 59 10.665 10.657 -2.330 1.00 1.02 C ATOM 920 C LYS A 59 11.782 11.196 -1.431 1.00 0.95 C ATOM 921 O LYS A 59 11.520 11.752 -0.369 1.00 1.04 O ATOM 922 CB LYS A 59 10.599 9.129 -2.284 1.00 0.95 C ATOM 923 CG LYS A 59 9.986 8.626 -0.976 1.00 0.66 C ATOM 924 CD LYS A 59 9.538 7.164 -1.055 1.00 0.66 C ATOM 925 CE LYS A 59 10.605 6.092 -1.280 1.00 0.72 C ATOM 926 NZ LYS A 59 11.183 6.159 -2.636 1.00 0.95 N ATOM 0 H LYS A 59 11.264 10.310 -4.292 1.00 1.04 H new ATOM 0 HA LYS A 59 9.732 11.078 -1.955 1.00 1.02 H new ATOM 0 HB2 LYS A 59 10.009 8.765 -3.125 1.00 0.95 H new ATOM 0 HB3 LYS A 59 11.602 8.718 -2.397 1.00 0.95 H new ATOM 0 HG2 LYS A 59 10.715 8.735 -0.173 1.00 0.66 H new ATOM 0 HG3 LYS A 59 9.131 9.250 -0.717 1.00 0.66 H new ATOM 0 HD2 LYS A 59 9.016 6.925 -0.128 1.00 0.66 H new ATOM 0 HD3 LYS A 59 8.809 7.082 -1.861 1.00 0.66 H new ATOM 0 HE2 LYS A 59 11.398 6.211 -0.542 1.00 0.72 H new ATOM 0 HE3 LYS A 59 10.167 5.107 -1.122 1.00 0.72 H new ATOM 0 HZ1 LYS A 59 11.586 5.234 -2.888 1.00 0.95 H new ATOM 0 HZ2 LYS A 59 10.439 6.410 -3.318 1.00 0.95 H new ATOM 0 HZ3 LYS A 59 11.932 6.880 -2.659 1.00 0.95 H new ATOM 940 N MET A 60 13.033 11.009 -1.849 1.00 0.86 N ATOM 941 CA MET A 60 14.242 11.309 -1.104 1.00 0.86 C ATOM 942 C MET A 60 14.222 12.756 -0.646 1.00 0.86 C ATOM 943 O MET A 60 14.453 13.020 0.530 1.00 0.89 O ATOM 944 CB MET A 60 15.469 10.995 -1.969 1.00 0.94 C ATOM 945 CG MET A 60 16.787 11.240 -1.223 1.00 1.09 C ATOM 946 SD MET A 60 18.284 10.666 -2.072 1.00 1.82 S ATOM 947 CE MET A 60 18.284 11.724 -3.536 1.00 3.20 C ATOM 0 H MET A 60 13.235 10.621 -2.771 1.00 0.86 H new ATOM 0 HA MET A 60 14.295 10.685 -0.212 1.00 0.86 H new ATOM 0 HB2 MET A 60 15.426 9.955 -2.293 1.00 0.94 H new ATOM 0 HB3 MET A 60 15.444 11.610 -2.868 1.00 0.94 H new ATOM 0 HG2 MET A 60 16.884 12.309 -1.035 1.00 1.09 H new ATOM 0 HG3 MET A 60 16.731 10.749 -0.251 1.00 1.09 H new ATOM 0 HE1 MET A 60 19.176 11.524 -4.129 1.00 3.20 H new ATOM 0 HE2 MET A 60 17.396 11.518 -4.134 1.00 3.20 H new ATOM 0 HE3 MET A 60 18.279 12.770 -3.229 1.00 3.20 H new ATOM 957 N LYS A 61 13.919 13.685 -1.560 1.00 0.91 N ATOM 958 CA LYS A 61 13.808 15.088 -1.180 1.00 1.00 C ATOM 959 C LYS A 61 12.760 15.229 -0.068 1.00 0.98 C ATOM 960 O LYS A 61 13.015 15.805 0.984 1.00 1.01 O ATOM 961 CB LYS A 61 13.511 15.959 -2.413 1.00 1.19 C ATOM 962 CG LYS A 61 12.075 15.792 -2.926 1.00 1.50 C ATOM 963 CD LYS A 61 11.916 16.281 -4.360 1.00 1.70 C ATOM 964 CE LYS A 61 10.459 16.517 -4.806 1.00 3.03 C ATOM 965 NZ LYS A 61 9.485 15.634 -4.130 1.00 4.38 N ATOM 0 H LYS A 61 13.750 13.492 -2.547 1.00 0.91 H new ATOM 0 HA LYS A 61 14.756 15.449 -0.780 1.00 1.00 H new ATOM 0 HB2 LYS A 61 13.683 17.006 -2.163 1.00 1.19 H new ATOM 0 HB3 LYS A 61 14.209 15.703 -3.210 1.00 1.19 H new ATOM 0 HG2 LYS A 61 11.790 14.741 -2.868 1.00 1.50 H new ATOM 0 HG3 LYS A 61 11.393 16.343 -2.278 1.00 1.50 H new ATOM 0 HD2 LYS A 61 12.471 17.212 -4.475 1.00 1.70 H new ATOM 0 HD3 LYS A 61 12.373 15.552 -5.030 1.00 1.70 H new ATOM 0 HE2 LYS A 61 10.192 17.556 -4.612 1.00 3.03 H new ATOM 0 HE3 LYS A 61 10.388 16.366 -5.883 1.00 3.03 H new ATOM 0 HZ1 LYS A 61 8.680 15.456 -4.764 1.00 4.38 H new ATOM 0 HZ2 LYS A 61 9.943 14.732 -3.890 1.00 4.38 H new ATOM 0 HZ3 LYS A 61 9.146 16.092 -3.260 1.00 4.38 H new ATOM 979 N SER A 62 11.576 14.656 -0.302 1.00 1.00 N ATOM 980 CA SER A 62 10.460 14.687 0.633 1.00 1.12 C ATOM 981 C SER A 62 10.879 14.176 2.014 1.00 1.11 C ATOM 982 O SER A 62 10.482 14.755 3.022 1.00 1.22 O ATOM 983 CB SER A 62 9.262 13.897 0.084 1.00 1.26 C ATOM 984 OG SER A 62 8.064 14.364 0.675 1.00 1.61 O ATOM 0 H SER A 62 11.368 14.150 -1.163 1.00 1.00 H new ATOM 0 HA SER A 62 10.149 15.725 0.749 1.00 1.12 H new ATOM 0 HB2 SER A 62 9.210 14.006 -0.999 1.00 1.26 H new ATOM 0 HB3 SER A 62 9.390 12.835 0.292 1.00 1.26 H new ATOM 0 HG SER A 62 7.304 13.857 0.319 1.00 1.61 H new ATOM 990 N LEU A 63 11.669 13.096 2.068 1.00 1.06 N ATOM 991 CA LEU A 63 12.235 12.625 3.322 1.00 1.15 C ATOM 992 C LEU A 63 13.153 13.699 3.896 1.00 1.11 C ATOM 993 O LEU A 63 12.905 14.187 4.994 1.00 1.22 O ATOM 994 CB LEU A 63 12.955 11.268 3.171 1.00 1.20 C ATOM 995 CG LEU A 63 12.074 10.005 3.062 1.00 1.56 C ATOM 996 CD1 LEU A 63 10.611 10.230 2.651 1.00 1.78 C ATOM 997 CD2 LEU A 63 12.699 9.058 2.031 1.00 2.21 C ATOM 0 H LEU A 63 11.926 12.538 1.254 1.00 1.06 H new ATOM 0 HA LEU A 63 11.420 12.446 4.023 1.00 1.15 H new ATOM 0 HB2 LEU A 63 13.584 11.318 2.282 1.00 1.20 H new ATOM 0 HB3 LEU A 63 13.620 11.142 4.026 1.00 1.20 H new ATOM 0 HG LEU A 63 12.044 9.601 4.074 1.00 1.56 H new ATOM 0 HD11 LEU A 63 10.094 9.272 2.608 1.00 1.78 H new ATOM 0 HD12 LEU A 63 10.123 10.874 3.382 1.00 1.78 H new ATOM 0 HD13 LEU A 63 10.577 10.704 1.670 1.00 1.78 H new ATOM 0 HD21 LEU A 63 12.087 8.160 1.943 1.00 2.21 H new ATOM 0 HD22 LEU A 63 12.752 9.557 1.063 1.00 2.21 H new ATOM 0 HD23 LEU A 63 13.703 8.782 2.352 1.00 2.21 H new ATOM 1009 N ASP A 64 14.198 14.066 3.152 1.00 1.02 N ATOM 1010 CA ASP A 64 15.243 14.974 3.605 1.00 1.10 C ATOM 1011 C ASP A 64 14.672 16.239 4.259 1.00 1.13 C ATOM 1012 O ASP A 64 15.058 16.582 5.376 1.00 1.28 O ATOM 1013 CB ASP A 64 16.148 15.319 2.419 1.00 1.12 C ATOM 1014 CG ASP A 64 17.276 16.240 2.851 1.00 1.34 C ATOM 1015 OD1 ASP A 64 18.253 15.702 3.415 1.00 2.52 O ATOM 1016 OD2 ASP A 64 17.140 17.456 2.601 1.00 1.78 O ATOM 0 H ASP A 64 14.341 13.731 2.199 1.00 1.02 H new ATOM 0 HA ASP A 64 15.827 14.474 4.378 1.00 1.10 H new ATOM 0 HB2 ASP A 64 16.562 14.405 1.994 1.00 1.12 H new ATOM 0 HB3 ASP A 64 15.561 15.798 1.635 1.00 1.12 H new ATOM 1021 N VAL A 65 13.713 16.875 3.574 1.00 1.07 N ATOM 1022 CA VAL A 65 13.158 18.195 3.890 1.00 1.19 C ATOM 1023 C VAL A 65 12.989 18.411 5.389 1.00 1.18 C ATOM 1024 O VAL A 65 13.561 19.332 5.966 1.00 1.35 O ATOM 1025 CB VAL A 65 11.807 18.348 3.163 1.00 1.26 C ATOM 1026 CG1 VAL A 65 10.878 19.428 3.734 1.00 1.72 C ATOM 1027 CG2 VAL A 65 12.075 18.709 1.709 1.00 2.22 C ATOM 0 H VAL A 65 13.284 16.463 2.746 1.00 1.07 H new ATOM 0 HA VAL A 65 13.860 18.955 3.548 1.00 1.19 H new ATOM 0 HB VAL A 65 11.299 17.392 3.290 1.00 1.26 H new ATOM 0 HG11 VAL A 65 9.955 19.457 3.155 1.00 1.72 H new ATOM 0 HG12 VAL A 65 10.647 19.196 4.774 1.00 1.72 H new ATOM 0 HG13 VAL A 65 11.372 20.398 3.680 1.00 1.72 H new ATOM 0 HG21 VAL A 65 11.128 18.821 1.181 1.00 2.22 H new ATOM 0 HG22 VAL A 65 12.629 19.647 1.663 1.00 2.22 H new ATOM 0 HG23 VAL A 65 12.661 17.918 1.240 1.00 2.22 H new ATOM 1037 N ASN A 66 12.161 17.569 6.000 1.00 1.08 N ATOM 1038 CA ASN A 66 11.935 17.584 7.447 1.00 1.11 C ATOM 1039 C ASN A 66 11.793 16.156 7.968 1.00 1.02 C ATOM 1040 O ASN A 66 10.782 15.797 8.574 1.00 1.04 O ATOM 1041 CB ASN A 66 10.723 18.457 7.815 1.00 1.24 C ATOM 1042 CG ASN A 66 11.036 19.951 7.767 1.00 1.87 C ATOM 1043 OD1 ASN A 66 11.830 20.449 8.557 1.00 2.36 O ATOM 1044 ND2 ASN A 66 10.392 20.695 6.872 1.00 2.87 N ATOM 0 H ASN A 66 11.625 16.854 5.507 1.00 1.08 H new ATOM 0 HA ASN A 66 12.801 18.035 7.933 1.00 1.11 H new ATOM 0 HB2 ASN A 66 9.903 18.240 7.131 1.00 1.24 H new ATOM 0 HB3 ASN A 66 10.381 18.194 8.816 1.00 1.24 H new ATOM 0 HD21 ASN A 66 10.555 21.701 6.833 1.00 2.87 H new ATOM 0 HD22 ASN A 66 9.736 20.259 6.224 1.00 2.87 H new ATOM 1051 N GLN A 67 12.835 15.347 7.758 1.00 0.99 N ATOM 1052 CA GLN A 67 12.821 13.934 8.110 1.00 0.96 C ATOM 1053 C GLN A 67 12.435 13.660 9.567 1.00 1.06 C ATOM 1054 O GLN A 67 11.857 12.621 9.890 1.00 1.14 O ATOM 1055 CB GLN A 67 14.168 13.278 7.781 1.00 0.99 C ATOM 1056 CG GLN A 67 15.393 13.991 8.393 1.00 1.10 C ATOM 1057 CD GLN A 67 15.601 13.640 9.865 1.00 2.42 C ATOM 1058 OE1 GLN A 67 15.438 12.486 10.249 1.00 3.82 O ATOM 1059 NE2 GLN A 67 15.923 14.632 10.687 1.00 3.05 N ATOM 0 H GLN A 67 13.711 15.659 7.338 1.00 0.99 H new ATOM 0 HA GLN A 67 12.037 13.485 7.500 1.00 0.96 H new ATOM 0 HB2 GLN A 67 14.151 12.246 8.132 1.00 0.99 H new ATOM 0 HB3 GLN A 67 14.287 13.244 6.698 1.00 0.99 H new ATOM 0 HG2 GLN A 67 16.286 13.721 7.829 1.00 1.10 H new ATOM 0 HG3 GLN A 67 15.268 15.069 8.294 1.00 1.10 H new ATOM 0 HE21 GLN A 67 16.048 15.576 10.322 1.00 3.05 H new ATOM 0 HE22 GLN A 67 16.045 14.450 11.683 1.00 3.05 H new ATOM 1068 N ASP A 68 12.814 14.587 10.444 1.00 1.14 N ATOM 1069 CA ASP A 68 12.711 14.441 11.886 1.00 1.20 C ATOM 1070 C ASP A 68 11.261 14.258 12.345 1.00 1.22 C ATOM 1071 O ASP A 68 11.019 13.646 13.380 1.00 1.38 O ATOM 1072 CB ASP A 68 13.356 15.667 12.558 1.00 1.29 C ATOM 1073 CG ASP A 68 14.311 15.255 13.669 1.00 2.01 C ATOM 1074 OD1 ASP A 68 15.364 14.684 13.304 1.00 2.92 O ATOM 1075 OD2 ASP A 68 13.991 15.543 14.840 1.00 2.86 O ATOM 0 H ASP A 68 13.211 15.482 10.159 1.00 1.14 H new ATOM 0 HA ASP A 68 13.242 13.537 12.184 1.00 1.20 H new ATOM 0 HB2 ASP A 68 13.894 16.251 11.812 1.00 1.29 H new ATOM 0 HB3 ASP A 68 12.577 16.311 12.966 1.00 1.29 H new ATOM 1080 N SER A 69 10.305 14.819 11.591 1.00 1.17 N ATOM 1081 CA SER A 69 8.939 15.063 12.046 1.00 1.42 C ATOM 1082 C SER A 69 8.280 13.839 12.702 1.00 1.80 C ATOM 1083 O SER A 69 8.062 13.832 13.911 1.00 3.54 O ATOM 1084 CB SER A 69 8.099 15.611 10.881 1.00 1.29 C ATOM 1085 OG SER A 69 8.761 16.697 10.258 1.00 2.37 O ATOM 0 H SER A 69 10.468 15.120 10.630 1.00 1.17 H new ATOM 0 HA SER A 69 8.988 15.811 12.838 1.00 1.42 H new ATOM 0 HB2 SER A 69 7.919 14.821 10.152 1.00 1.29 H new ATOM 0 HB3 SER A 69 7.125 15.934 11.248 1.00 1.29 H new ATOM 0 HG SER A 69 9.391 16.356 9.590 1.00 2.37 H new ATOM 1091 N GLU A 70 7.936 12.843 11.881 1.00 1.04 N ATOM 1092 CA GLU A 70 7.272 11.576 12.169 1.00 0.98 C ATOM 1093 C GLU A 70 6.768 11.075 10.815 1.00 0.89 C ATOM 1094 O GLU A 70 6.856 11.806 9.827 1.00 1.44 O ATOM 1095 CB GLU A 70 6.104 11.685 13.170 1.00 1.44 C ATOM 1096 CG GLU A 70 4.957 12.565 12.657 1.00 3.28 C ATOM 1097 CD GLU A 70 3.792 12.653 13.634 1.00 3.61 C ATOM 1098 OE1 GLU A 70 3.802 11.917 14.646 1.00 3.02 O ATOM 1099 OE2 GLU A 70 2.861 13.416 13.290 1.00 5.20 O ATOM 0 H GLU A 70 8.142 12.918 10.885 1.00 1.04 H new ATOM 0 HA GLU A 70 7.975 10.896 12.651 1.00 0.98 H new ATOM 0 HB2 GLU A 70 5.722 10.687 13.384 1.00 1.44 H new ATOM 0 HB3 GLU A 70 6.475 12.093 14.110 1.00 1.44 H new ATOM 0 HG2 GLU A 70 5.336 13.568 12.460 1.00 3.28 H new ATOM 0 HG3 GLU A 70 4.598 12.168 11.707 1.00 3.28 H new ATOM 1106 N LEU A 71 6.198 9.874 10.771 1.00 0.89 N ATOM 1107 CA LEU A 71 5.498 9.360 9.607 1.00 0.87 C ATOM 1108 C LEU A 71 4.299 8.552 10.098 1.00 0.79 C ATOM 1109 O LEU A 71 4.319 8.035 11.217 1.00 0.87 O ATOM 1110 CB LEU A 71 6.464 8.503 8.774 1.00 1.18 C ATOM 1111 CG LEU A 71 6.001 8.271 7.327 1.00 1.21 C ATOM 1112 CD1 LEU A 71 6.121 9.556 6.499 1.00 2.38 C ATOM 1113 CD2 LEU A 71 6.883 7.197 6.690 1.00 1.82 C ATOM 0 H LEU A 71 6.212 9.224 11.557 1.00 0.89 H new ATOM 0 HA LEU A 71 5.140 10.167 8.967 1.00 0.87 H new ATOM 0 HB2 LEU A 71 7.442 8.985 8.759 1.00 1.18 H new ATOM 0 HB3 LEU A 71 6.592 7.537 9.263 1.00 1.18 H new ATOM 0 HG LEU A 71 4.957 7.958 7.344 1.00 1.21 H new ATOM 0 HD11 LEU A 71 5.787 9.364 5.479 1.00 2.38 H new ATOM 0 HD12 LEU A 71 5.501 10.335 6.944 1.00 2.38 H new ATOM 0 HD13 LEU A 71 7.160 9.884 6.485 1.00 2.38 H new ATOM 0 HD21 LEU A 71 6.562 7.025 5.663 1.00 1.82 H new ATOM 0 HD22 LEU A 71 7.921 7.529 6.695 1.00 1.82 H new ATOM 0 HD23 LEU A 71 6.795 6.270 7.257 1.00 1.82 H new ATOM 1125 N LYS A 72 3.260 8.442 9.271 1.00 0.75 N ATOM 1126 CA LYS A 72 2.022 7.733 9.555 1.00 0.76 C ATOM 1127 C LYS A 72 1.708 6.799 8.392 1.00 0.70 C ATOM 1128 O LYS A 72 2.258 6.939 7.297 1.00 0.67 O ATOM 1129 CB LYS A 72 0.862 8.718 9.756 1.00 0.86 C ATOM 1130 CG LYS A 72 1.234 9.850 10.716 1.00 1.02 C ATOM 1131 CD LYS A 72 0.086 10.859 10.815 1.00 1.79 C ATOM 1132 CE LYS A 72 0.482 12.034 11.717 1.00 2.24 C ATOM 1133 NZ LYS A 72 1.582 12.838 11.147 1.00 2.96 N ATOM 0 H LYS A 72 3.263 8.866 8.343 1.00 0.75 H new ATOM 0 HA LYS A 72 2.145 7.160 10.474 1.00 0.76 H new ATOM 0 HB2 LYS A 72 0.572 9.139 8.793 1.00 0.86 H new ATOM 0 HB3 LYS A 72 -0.005 8.183 10.144 1.00 0.86 H new ATOM 0 HG2 LYS A 72 1.455 9.442 11.702 1.00 1.02 H new ATOM 0 HG3 LYS A 72 2.138 10.350 10.368 1.00 1.02 H new ATOM 0 HD2 LYS A 72 -0.171 11.226 9.821 1.00 1.79 H new ATOM 0 HD3 LYS A 72 -0.803 10.370 11.214 1.00 1.79 H new ATOM 0 HE2 LYS A 72 -0.386 12.674 11.877 1.00 2.24 H new ATOM 0 HE3 LYS A 72 0.782 11.653 12.693 1.00 2.24 H new ATOM 0 HZ1 LYS A 72 2.211 13.156 11.911 1.00 2.96 H new ATOM 0 HZ2 LYS A 72 2.122 12.259 10.473 1.00 2.96 H new ATOM 0 HZ3 LYS A 72 1.188 13.666 10.655 1.00 2.96 H new ATOM 1147 N PHE A 73 0.797 5.858 8.633 1.00 0.73 N ATOM 1148 CA PHE A 73 0.520 4.762 7.720 1.00 0.75 C ATOM 1149 C PHE A 73 0.118 5.251 6.328 1.00 0.61 C ATOM 1150 O PHE A 73 0.546 4.672 5.334 1.00 0.56 O ATOM 1151 CB PHE A 73 -0.505 3.810 8.333 1.00 1.01 C ATOM 1152 CG PHE A 73 -1.793 4.457 8.784 1.00 0.83 C ATOM 1153 CD1 PHE A 73 -1.927 4.930 10.102 1.00 1.85 C ATOM 1154 CD2 PHE A 73 -2.889 4.510 7.909 1.00 2.17 C ATOM 1155 CE1 PHE A 73 -3.140 5.492 10.533 1.00 2.34 C ATOM 1156 CE2 PHE A 73 -4.118 5.004 8.365 1.00 2.72 C ATOM 1157 CZ PHE A 73 -4.244 5.516 9.667 1.00 2.35 C ATOM 0 H PHE A 73 0.227 5.839 9.478 1.00 0.73 H new ATOM 0 HA PHE A 73 1.443 4.202 7.572 1.00 0.75 H new ATOM 0 HB2 PHE A 73 -0.742 3.037 7.602 1.00 1.01 H new ATOM 0 HB3 PHE A 73 -0.048 3.311 9.188 1.00 1.01 H new ATOM 0 HD1 PHE A 73 -1.094 4.861 10.785 1.00 1.85 H new ATOM 0 HD2 PHE A 73 -2.785 4.171 6.889 1.00 2.17 H new ATOM 0 HE1 PHE A 73 -3.223 5.904 11.528 1.00 2.34 H new ATOM 0 HE2 PHE A 73 -4.976 4.991 7.710 1.00 2.72 H new ATOM 0 HZ PHE A 73 -5.186 5.926 10.000 1.00 2.35 H new ATOM 1167 N ASN A 74 -0.686 6.314 6.238 1.00 0.66 N ATOM 1168 CA ASN A 74 -1.056 6.890 4.948 1.00 0.70 C ATOM 1169 C ASN A 74 0.181 7.393 4.190 1.00 0.61 C ATOM 1170 O ASN A 74 0.353 7.047 3.022 1.00 0.69 O ATOM 1171 CB ASN A 74 -2.133 7.970 5.103 1.00 0.89 C ATOM 1172 CG ASN A 74 -1.680 9.095 6.019 1.00 1.77 C ATOM 1173 OD1 ASN A 74 -1.869 9.014 7.231 1.00 2.89 O ATOM 1174 ND2 ASN A 74 -1.094 10.148 5.474 1.00 2.79 N ATOM 0 H ASN A 74 -1.091 6.791 7.044 1.00 0.66 H new ATOM 0 HA ASN A 74 -1.497 6.100 4.340 1.00 0.70 H new ATOM 0 HB2 ASN A 74 -2.382 8.378 4.123 1.00 0.89 H new ATOM 0 HB3 ASN A 74 -3.043 7.521 5.502 1.00 0.89 H new ATOM 0 HD21 ASN A 74 -0.785 10.921 6.063 1.00 2.79 H new ATOM 0 HD22 ASN A 74 -0.951 10.187 4.465 1.00 2.79 H new ATOM 1181 N GLU A 75 1.055 8.184 4.828 1.00 0.56 N ATOM 1182 CA GLU A 75 2.259 8.694 4.176 1.00 0.57 C ATOM 1183 C GLU A 75 3.171 7.534 3.782 1.00 0.50 C ATOM 1184 O GLU A 75 3.618 7.457 2.638 1.00 0.51 O ATOM 1185 CB GLU A 75 3.020 9.673 5.075 1.00 0.71 C ATOM 1186 CG GLU A 75 2.231 10.934 5.458 1.00 1.35 C ATOM 1187 CD GLU A 75 1.789 10.946 6.916 1.00 2.68 C ATOM 1188 OE1 GLU A 75 2.623 10.575 7.770 1.00 3.74 O ATOM 1189 OE2 GLU A 75 0.623 11.339 7.143 1.00 3.54 O ATOM 0 H GLU A 75 0.946 8.482 5.797 1.00 0.56 H new ATOM 0 HA GLU A 75 1.948 9.235 3.282 1.00 0.57 H new ATOM 0 HB2 GLU A 75 3.315 9.154 5.987 1.00 0.71 H new ATOM 0 HB3 GLU A 75 3.937 9.974 4.568 1.00 0.71 H new ATOM 0 HG2 GLU A 75 2.846 11.813 5.264 1.00 1.35 H new ATOM 0 HG3 GLU A 75 1.352 11.013 4.818 1.00 1.35 H new ATOM 1196 N TYR A 76 3.431 6.630 4.734 1.00 0.48 N ATOM 1197 CA TYR A 76 4.125 5.372 4.491 1.00 0.47 C ATOM 1198 C TYR A 76 3.599 4.752 3.200 1.00 0.44 C ATOM 1199 O TYR A 76 4.379 4.436 2.307 1.00 0.44 O ATOM 1200 CB TYR A 76 3.930 4.447 5.701 1.00 0.52 C ATOM 1201 CG TYR A 76 4.385 3.010 5.526 1.00 0.67 C ATOM 1202 CD1 TYR A 76 3.571 2.080 4.848 1.00 1.75 C ATOM 1203 CD2 TYR A 76 5.563 2.568 6.150 1.00 1.88 C ATOM 1204 CE1 TYR A 76 3.982 0.743 4.724 1.00 1.85 C ATOM 1205 CE2 TYR A 76 6.001 1.241 5.982 1.00 2.03 C ATOM 1206 CZ TYR A 76 5.215 0.332 5.251 1.00 1.18 C ATOM 1207 OH TYR A 76 5.623 -0.956 5.089 1.00 1.50 O ATOM 0 H TYR A 76 3.158 6.760 5.708 1.00 0.48 H new ATOM 0 HA TYR A 76 5.196 5.536 4.368 1.00 0.47 H new ATOM 0 HB2 TYR A 76 4.465 4.875 6.549 1.00 0.52 H new ATOM 0 HB3 TYR A 76 2.872 4.442 5.961 1.00 0.52 H new ATOM 0 HD1 TYR A 76 2.630 2.396 4.423 1.00 1.75 H new ATOM 0 HD2 TYR A 76 6.135 3.250 6.762 1.00 1.88 H new ATOM 0 HE1 TYR A 76 3.347 0.029 4.221 1.00 1.85 H new ATOM 0 HE2 TYR A 76 6.938 0.922 6.413 1.00 2.03 H new ATOM 0 HH TYR A 76 6.499 -1.077 5.512 1.00 1.50 H new ATOM 1217 N TRP A 77 2.273 4.624 3.092 1.00 0.45 N ATOM 1218 CA TRP A 77 1.616 4.121 1.900 1.00 0.44 C ATOM 1219 C TRP A 77 2.140 4.821 0.644 1.00 0.41 C ATOM 1220 O TRP A 77 2.845 4.190 -0.139 1.00 0.43 O ATOM 1221 CB TRP A 77 0.098 4.250 2.029 1.00 0.47 C ATOM 1222 CG TRP A 77 -0.608 3.005 1.678 1.00 0.45 C ATOM 1223 CD1 TRP A 77 -0.983 2.694 0.429 1.00 0.45 C ATOM 1224 CD2 TRP A 77 -1.158 1.968 2.538 1.00 0.42 C ATOM 1225 NE1 TRP A 77 -1.626 1.492 0.430 1.00 0.44 N ATOM 1226 CE2 TRP A 77 -1.809 1.020 1.703 1.00 0.43 C ATOM 1227 CE3 TRP A 77 -1.270 1.776 3.930 1.00 0.41 C ATOM 1228 CZ2 TRP A 77 -2.495 -0.080 2.206 1.00 0.44 C ATOM 1229 CZ3 TRP A 77 -2.007 0.688 4.431 1.00 0.42 C ATOM 1230 CH2 TRP A 77 -2.549 -0.274 3.585 1.00 0.44 C ATOM 0 H TRP A 77 1.627 4.871 3.841 1.00 0.45 H new ATOM 0 HA TRP A 77 1.852 3.062 1.798 1.00 0.44 H new ATOM 0 HB2 TRP A 77 -0.154 4.530 3.052 1.00 0.47 H new ATOM 0 HB3 TRP A 77 -0.251 5.056 1.383 1.00 0.47 H new ATOM 0 HD1 TRP A 77 -0.803 3.303 -0.445 1.00 0.45 H new ATOM 0 HE1 TRP A 77 -1.933 1.005 -0.412 1.00 0.44 H new ATOM 0 HE3 TRP A 77 -0.790 2.464 4.611 1.00 0.41 H new ATOM 0 HZ2 TRP A 77 -2.980 -0.775 1.537 1.00 0.44 H new ATOM 0 HZ3 TRP A 77 -2.156 0.597 5.497 1.00 0.42 H new ATOM 0 HH2 TRP A 77 -3.007 -1.163 3.993 1.00 0.44 H new ATOM 1241 N ARG A 78 1.817 6.108 0.459 1.00 0.42 N ATOM 1242 CA ARG A 78 2.286 6.931 -0.653 1.00 0.50 C ATOM 1243 C ARG A 78 3.754 6.595 -0.984 1.00 0.45 C ATOM 1244 O ARG A 78 4.078 6.220 -2.111 1.00 0.49 O ATOM 1245 CB ARG A 78 2.152 8.424 -0.256 1.00 0.81 C ATOM 1246 CG ARG A 78 0.755 8.788 0.293 1.00 1.28 C ATOM 1247 CD ARG A 78 0.277 10.217 0.014 1.00 1.78 C ATOM 1248 NE ARG A 78 0.995 11.193 0.846 1.00 2.17 N ATOM 1249 CZ ARG A 78 0.534 11.816 1.949 1.00 3.22 C ATOM 1250 NH1 ARG A 78 -0.683 11.580 2.455 1.00 4.27 N ATOM 1251 NH2 ARG A 78 1.324 12.705 2.563 1.00 3.86 N ATOM 0 H ARG A 78 1.205 6.615 1.099 1.00 0.42 H new ATOM 0 HA ARG A 78 1.684 6.731 -1.540 1.00 0.50 H new ATOM 0 HB2 ARG A 78 2.904 8.661 0.497 1.00 0.81 H new ATOM 0 HB3 ARG A 78 2.366 9.045 -1.126 1.00 0.81 H new ATOM 0 HG2 ARG A 78 0.028 8.094 -0.129 1.00 1.28 H new ATOM 0 HG3 ARG A 78 0.758 8.631 1.372 1.00 1.28 H new ATOM 0 HD2 ARG A 78 0.427 10.454 -1.039 1.00 1.78 H new ATOM 0 HD3 ARG A 78 -0.793 10.289 0.207 1.00 1.78 H new ATOM 0 HE ARG A 78 1.946 11.424 0.557 1.00 2.17 H new ATOM 0 HH11 ARG A 78 -1.301 10.906 2.003 1.00 4.27 H new ATOM 0 HH12 ARG A 78 -0.992 12.074 3.292 1.00 4.27 H new ATOM 0 HH21 ARG A 78 2.255 12.900 2.195 1.00 3.86 H new ATOM 0 HH22 ARG A 78 0.995 13.188 3.399 1.00 3.86 H new ATOM 1265 N LEU A 79 4.616 6.651 0.034 1.00 0.45 N ATOM 1266 CA LEU A 79 6.046 6.408 -0.088 1.00 0.46 C ATOM 1267 C LEU A 79 6.381 4.998 -0.611 1.00 0.45 C ATOM 1268 O LEU A 79 7.212 4.869 -1.514 1.00 0.49 O ATOM 1269 CB LEU A 79 6.728 6.728 1.249 1.00 0.50 C ATOM 1270 CG LEU A 79 7.027 8.227 1.500 1.00 0.56 C ATOM 1271 CD1 LEU A 79 5.991 9.226 0.964 1.00 0.72 C ATOM 1272 CD2 LEU A 79 7.170 8.470 3.005 1.00 0.81 C ATOM 0 H LEU A 79 4.327 6.872 0.987 1.00 0.45 H new ATOM 0 HA LEU A 79 6.443 7.077 -0.851 1.00 0.46 H new ATOM 0 HB2 LEU A 79 6.096 6.361 2.057 1.00 0.50 H new ATOM 0 HB3 LEU A 79 7.665 6.174 1.301 1.00 0.50 H new ATOM 0 HG LEU A 79 7.944 8.415 0.941 1.00 0.56 H new ATOM 0 HD11 LEU A 79 6.309 10.242 1.200 1.00 0.72 H new ATOM 0 HD12 LEU A 79 5.904 9.115 -0.117 1.00 0.72 H new ATOM 0 HD13 LEU A 79 5.024 9.032 1.428 1.00 0.72 H new ATOM 0 HD21 LEU A 79 7.381 9.524 3.185 1.00 0.81 H new ATOM 0 HD22 LEU A 79 6.243 8.194 3.508 1.00 0.81 H new ATOM 0 HD23 LEU A 79 7.988 7.865 3.395 1.00 0.81 H new ATOM 1284 N ILE A 80 5.781 3.924 -0.082 1.00 0.43 N ATOM 1285 CA ILE A 80 6.042 2.601 -0.663 1.00 0.44 C ATOM 1286 C ILE A 80 5.434 2.508 -2.069 1.00 0.43 C ATOM 1287 O ILE A 80 5.962 1.818 -2.936 1.00 0.45 O ATOM 1288 CB ILE A 80 5.663 1.407 0.245 1.00 0.45 C ATOM 1289 CG1 ILE A 80 4.168 1.084 0.187 1.00 0.54 C ATOM 1290 CG2 ILE A 80 6.117 1.621 1.684 1.00 0.46 C ATOM 1291 CD1 ILE A 80 3.726 -0.201 0.891 1.00 0.42 C ATOM 0 H ILE A 80 5.140 3.939 0.711 1.00 0.43 H new ATOM 0 HA ILE A 80 7.125 2.510 -0.751 1.00 0.44 H new ATOM 0 HB ILE A 80 6.198 0.543 -0.149 1.00 0.45 H new ATOM 0 HG12 ILE A 80 3.620 1.919 0.623 1.00 0.54 H new ATOM 0 HG13 ILE A 80 3.872 1.020 -0.860 1.00 0.54 H new ATOM 0 HG21 ILE A 80 5.831 0.760 2.288 1.00 0.46 H new ATOM 0 HG22 ILE A 80 7.200 1.739 1.710 1.00 0.46 H new ATOM 0 HG23 ILE A 80 5.645 2.518 2.085 1.00 0.46 H new ATOM 0 HD11 ILE A 80 2.648 -0.323 0.782 1.00 0.42 H new ATOM 0 HD12 ILE A 80 4.235 -1.055 0.443 1.00 0.42 H new ATOM 0 HD13 ILE A 80 3.979 -0.142 1.949 1.00 0.42 H new ATOM 1303 N GLY A 81 4.325 3.212 -2.311 1.00 0.41 N ATOM 1304 CA GLY A 81 3.734 3.339 -3.632 1.00 0.41 C ATOM 1305 C GLY A 81 4.757 3.827 -4.639 1.00 0.41 C ATOM 1306 O GLY A 81 4.927 3.245 -5.710 1.00 0.49 O ATOM 0 H GLY A 81 3.813 3.712 -1.584 1.00 0.41 H new ATOM 0 HA2 GLY A 81 3.336 2.376 -3.950 1.00 0.41 H new ATOM 0 HA3 GLY A 81 2.895 4.034 -3.594 1.00 0.41 H new ATOM 1310 N GLU A 82 5.453 4.898 -4.271 1.00 0.40 N ATOM 1311 CA GLU A 82 6.561 5.408 -5.047 1.00 0.42 C ATOM 1312 C GLU A 82 7.615 4.306 -5.231 1.00 0.44 C ATOM 1313 O GLU A 82 7.987 4.005 -6.368 1.00 0.53 O ATOM 1314 CB GLU A 82 7.080 6.684 -4.383 1.00 0.43 C ATOM 1315 CG GLU A 82 6.005 7.786 -4.436 1.00 0.69 C ATOM 1316 CD GLU A 82 5.923 8.611 -3.161 1.00 1.69 C ATOM 1317 OE1 GLU A 82 6.976 8.800 -2.517 1.00 2.68 O ATOM 1318 OE2 GLU A 82 4.802 9.115 -2.901 1.00 2.83 O ATOM 0 H GLU A 82 5.259 5.432 -3.424 1.00 0.40 H new ATOM 0 HA GLU A 82 6.254 5.687 -6.055 1.00 0.42 H new ATOM 0 HB2 GLU A 82 7.351 6.479 -3.347 1.00 0.43 H new ATOM 0 HB3 GLU A 82 7.984 7.023 -4.888 1.00 0.43 H new ATOM 0 HG2 GLU A 82 6.215 8.448 -5.276 1.00 0.69 H new ATOM 0 HG3 GLU A 82 5.035 7.328 -4.627 1.00 0.69 H new ATOM 1325 N LEU A 83 8.045 3.645 -4.147 1.00 0.43 N ATOM 1326 CA LEU A 83 9.084 2.624 -4.261 1.00 0.53 C ATOM 1327 C LEU A 83 8.697 1.475 -5.201 1.00 0.52 C ATOM 1328 O LEU A 83 9.534 1.016 -5.981 1.00 0.56 O ATOM 1329 CB LEU A 83 9.716 2.254 -2.907 1.00 0.91 C ATOM 1330 CG LEU A 83 9.188 1.021 -2.157 1.00 1.39 C ATOM 1331 CD1 LEU A 83 9.735 -0.285 -2.744 1.00 2.62 C ATOM 1332 CD2 LEU A 83 9.634 1.112 -0.691 1.00 2.09 C ATOM 0 H LEU A 83 7.695 3.798 -3.201 1.00 0.43 H new ATOM 0 HA LEU A 83 9.929 3.068 -4.788 1.00 0.53 H new ATOM 0 HB2 LEU A 83 10.784 2.109 -3.070 1.00 0.91 H new ATOM 0 HB3 LEU A 83 9.608 3.114 -2.246 1.00 0.91 H new ATOM 0 HG LEU A 83 8.102 1.010 -2.249 1.00 1.39 H new ATOM 0 HD11 LEU A 83 9.336 -1.131 -2.184 1.00 2.62 H new ATOM 0 HD12 LEU A 83 9.435 -0.368 -3.789 1.00 2.62 H new ATOM 0 HD13 LEU A 83 10.823 -0.286 -2.677 1.00 2.62 H new ATOM 0 HD21 LEU A 83 9.267 0.243 -0.144 1.00 2.09 H new ATOM 0 HD22 LEU A 83 10.723 1.138 -0.643 1.00 2.09 H new ATOM 0 HD23 LEU A 83 9.230 2.020 -0.243 1.00 2.09 H new ATOM 1344 N ALA A 84 7.426 1.046 -5.208 1.00 0.53 N ATOM 1345 CA ALA A 84 6.934 0.078 -6.183 1.00 0.62 C ATOM 1346 C ALA A 84 7.216 0.472 -7.647 1.00 0.68 C ATOM 1347 O ALA A 84 7.302 -0.419 -8.501 1.00 0.80 O ATOM 1348 CB ALA A 84 5.435 -0.149 -5.967 1.00 0.62 C ATOM 0 H ALA A 84 6.721 1.361 -4.542 1.00 0.53 H new ATOM 0 HA ALA A 84 7.485 -0.847 -6.015 1.00 0.62 H new ATOM 0 HB1 ALA A 84 5.068 -0.872 -6.695 1.00 0.62 H new ATOM 0 HB2 ALA A 84 5.266 -0.531 -4.960 1.00 0.62 H new ATOM 0 HB3 ALA A 84 4.903 0.794 -6.092 1.00 0.62 H new ATOM 1354 N LYS A 85 7.343 1.773 -7.951 1.00 0.77 N ATOM 1355 CA LYS A 85 7.771 2.250 -9.267 1.00 0.97 C ATOM 1356 C LYS A 85 9.288 2.092 -9.405 1.00 1.04 C ATOM 1357 O LYS A 85 9.780 1.570 -10.407 1.00 1.34 O ATOM 1358 CB LYS A 85 7.455 3.744 -9.489 1.00 1.27 C ATOM 1359 CG LYS A 85 6.108 4.298 -9.001 1.00 1.40 C ATOM 1360 CD LYS A 85 6.211 5.812 -8.727 1.00 1.73 C ATOM 1361 CE LYS A 85 6.225 6.724 -9.963 1.00 1.85 C ATOM 1362 NZ LYS A 85 7.486 6.643 -10.726 1.00 2.73 N ATOM 0 H LYS A 85 7.150 2.522 -7.286 1.00 0.77 H new ATOM 0 HA LYS A 85 7.227 1.655 -10.001 1.00 0.97 H new ATOM 0 HB2 LYS A 85 8.243 4.323 -9.008 1.00 1.27 H new ATOM 0 HB3 LYS A 85 7.524 3.940 -10.559 1.00 1.27 H new ATOM 0 HG2 LYS A 85 5.339 4.110 -9.750 1.00 1.40 H new ATOM 0 HG3 LYS A 85 5.803 3.779 -8.093 1.00 1.40 H new ATOM 0 HD2 LYS A 85 5.372 6.104 -8.095 1.00 1.73 H new ATOM 0 HD3 LYS A 85 7.120 5.996 -8.155 1.00 1.73 H new ATOM 0 HE2 LYS A 85 5.394 6.455 -10.615 1.00 1.85 H new ATOM 0 HE3 LYS A 85 6.063 7.755 -9.649 1.00 1.85 H new ATOM 0 HZ1 LYS A 85 7.661 7.550 -11.204 1.00 2.73 H new ATOM 0 HZ2 LYS A 85 8.272 6.437 -10.077 1.00 2.73 H new ATOM 0 HZ3 LYS A 85 7.415 5.886 -11.435 1.00 2.73 H new ATOM 1376 N GLU A 86 10.007 2.642 -8.419 1.00 0.81 N ATOM 1377 CA GLU A 86 11.455 2.802 -8.367 1.00 0.76 C ATOM 1378 C GLU A 86 12.111 1.478 -8.734 1.00 0.92 C ATOM 1379 O GLU A 86 12.681 1.368 -9.824 1.00 1.06 O ATOM 1380 CB GLU A 86 11.824 3.318 -6.974 1.00 0.66 C ATOM 1381 CG GLU A 86 11.251 4.728 -6.815 1.00 0.84 C ATOM 1382 CD GLU A 86 11.233 5.201 -5.375 1.00 1.11 C ATOM 1383 OE1 GLU A 86 12.131 4.840 -4.587 1.00 2.01 O ATOM 1384 OE2 GLU A 86 10.285 5.936 -5.023 1.00 2.25 O ATOM 0 H GLU A 86 9.556 3.010 -7.582 1.00 0.81 H new ATOM 0 HA GLU A 86 11.821 3.533 -9.088 1.00 0.76 H new ATOM 0 HB2 GLU A 86 11.423 2.657 -6.206 1.00 0.66 H new ATOM 0 HB3 GLU A 86 12.907 3.332 -6.849 1.00 0.66 H new ATOM 0 HG2 GLU A 86 11.840 5.423 -7.413 1.00 0.84 H new ATOM 0 HG3 GLU A 86 10.236 4.748 -7.211 1.00 0.84 H new ATOM 1391 N ILE A 87 11.932 0.451 -7.904 1.00 0.86 N ATOM 1392 CA ILE A 87 12.321 -0.897 -8.252 1.00 0.89 C ATOM 1393 C ILE A 87 11.215 -1.482 -9.125 1.00 0.85 C ATOM 1394 O ILE A 87 10.184 -1.945 -8.637 1.00 0.82 O ATOM 1395 CB ILE A 87 12.638 -1.753 -7.009 1.00 0.89 C ATOM 1396 CG1 ILE A 87 12.951 -3.207 -7.394 1.00 1.24 C ATOM 1397 CG2 ILE A 87 11.582 -1.722 -5.892 1.00 1.08 C ATOM 1398 CD1 ILE A 87 14.009 -3.328 -8.500 1.00 1.23 C ATOM 0 H ILE A 87 11.514 0.539 -6.978 1.00 0.86 H new ATOM 0 HA ILE A 87 13.255 -0.890 -8.814 1.00 0.89 H new ATOM 0 HB ILE A 87 13.522 -1.277 -6.585 1.00 0.89 H new ATOM 0 HG12 ILE A 87 13.296 -3.743 -6.510 1.00 1.24 H new ATOM 0 HG13 ILE A 87 12.033 -3.694 -7.724 1.00 1.24 H new ATOM 0 HG21 ILE A 87 11.906 -2.357 -5.068 1.00 1.08 H new ATOM 0 HG22 ILE A 87 11.459 -0.699 -5.535 1.00 1.08 H new ATOM 0 HG23 ILE A 87 10.631 -2.087 -6.280 1.00 1.08 H new ATOM 0 HD11 ILE A 87 14.183 -4.381 -8.724 1.00 1.23 H new ATOM 0 HD12 ILE A 87 13.657 -2.820 -9.398 1.00 1.23 H new ATOM 0 HD13 ILE A 87 14.940 -2.870 -8.165 1.00 1.23 H new ATOM 1410 N ARG A 88 11.435 -1.514 -10.441 1.00 0.98 N ATOM 1411 CA ARG A 88 10.456 -2.020 -11.393 1.00 1.03 C ATOM 1412 C ARG A 88 10.544 -3.554 -11.421 1.00 0.95 C ATOM 1413 O ARG A 88 10.809 -4.152 -12.461 1.00 1.16 O ATOM 1414 CB ARG A 88 10.717 -1.389 -12.773 1.00 1.31 C ATOM 1415 CG ARG A 88 9.569 -1.650 -13.765 1.00 2.00 C ATOM 1416 CD ARG A 88 10.028 -1.466 -15.217 1.00 2.52 C ATOM 1417 NE ARG A 88 10.344 -0.061 -15.526 1.00 2.78 N ATOM 1418 CZ ARG A 88 11.019 0.358 -16.612 1.00 3.56 C ATOM 1419 NH1 ARG A 88 11.525 -0.533 -17.473 1.00 4.01 N ATOM 1420 NH2 ARG A 88 11.186 1.667 -16.834 1.00 4.55 N ATOM 0 H ARG A 88 12.300 -1.188 -10.873 1.00 0.98 H new ATOM 0 HA ARG A 88 9.442 -1.748 -11.099 1.00 1.03 H new ATOM 0 HB2 ARG A 88 10.856 -0.314 -12.657 1.00 1.31 H new ATOM 0 HB3 ARG A 88 11.645 -1.788 -13.182 1.00 1.31 H new ATOM 0 HG2 ARG A 88 9.191 -2.663 -13.627 1.00 2.00 H new ATOM 0 HG3 ARG A 88 8.743 -0.970 -13.554 1.00 2.00 H new ATOM 0 HD2 ARG A 88 10.908 -2.083 -15.399 1.00 2.52 H new ATOM 0 HD3 ARG A 88 9.247 -1.818 -15.891 1.00 2.52 H new ATOM 0 HE ARG A 88 10.027 0.649 -14.866 1.00 2.78 H new ATOM 0 HH11 ARG A 88 11.399 -1.531 -17.306 1.00 4.01 H new ATOM 0 HH12 ARG A 88 12.036 -0.214 -18.296 1.00 4.01 H new ATOM 0 HH21 ARG A 88 10.801 2.348 -16.180 1.00 4.55 H new ATOM 0 HH22 ARG A 88 11.698 1.983 -17.658 1.00 4.55 H new ATOM 1434 N LYS A 89 10.313 -4.190 -10.266 1.00 1.08 N ATOM 1435 CA LYS A 89 10.294 -5.638 -10.158 1.00 1.06 C ATOM 1436 C LYS A 89 9.250 -6.230 -11.107 1.00 1.36 C ATOM 1437 O LYS A 89 8.168 -5.652 -11.247 1.00 2.08 O ATOM 1438 CB LYS A 89 10.095 -6.087 -8.699 1.00 1.71 C ATOM 1439 CG LYS A 89 8.674 -6.087 -8.092 1.00 0.94 C ATOM 1440 CD LYS A 89 8.220 -4.848 -7.288 1.00 1.31 C ATOM 1441 CE LYS A 89 7.189 -3.916 -7.938 1.00 2.34 C ATOM 1442 NZ LYS A 89 7.776 -2.999 -8.925 1.00 4.16 N ATOM 0 H LYS A 89 10.135 -3.707 -9.385 1.00 1.08 H new ATOM 0 HA LYS A 89 11.265 -6.025 -10.466 1.00 1.06 H new ATOM 0 HB2 LYS A 89 10.488 -7.100 -8.612 1.00 1.71 H new ATOM 0 HB3 LYS A 89 10.718 -5.449 -8.073 1.00 1.71 H new ATOM 0 HG2 LYS A 89 7.965 -6.233 -8.907 1.00 0.94 H new ATOM 0 HG3 LYS A 89 8.592 -6.956 -7.439 1.00 0.94 H new ATOM 0 HD2 LYS A 89 7.808 -5.195 -6.340 1.00 1.31 H new ATOM 0 HD3 LYS A 89 9.105 -4.257 -7.053 1.00 1.31 H new ATOM 0 HE2 LYS A 89 6.420 -4.518 -8.423 1.00 2.34 H new ATOM 0 HE3 LYS A 89 6.694 -3.334 -7.160 1.00 2.34 H new ATOM 0 HZ1 LYS A 89 7.224 -2.118 -8.951 1.00 4.16 H new ATOM 0 HZ2 LYS A 89 8.758 -2.785 -8.659 1.00 4.16 H new ATOM 0 HZ3 LYS A 89 7.761 -3.445 -9.865 1.00 4.16 H new ATOM 1456 N LYS A 90 9.576 -7.352 -11.764 1.00 1.65 N ATOM 1457 CA LYS A 90 8.676 -8.008 -12.706 1.00 2.31 C ATOM 1458 C LYS A 90 9.111 -9.448 -13.014 1.00 1.98 C ATOM 1459 O LYS A 90 8.297 -10.360 -12.908 1.00 3.17 O ATOM 1460 CB LYS A 90 8.549 -7.174 -13.998 1.00 3.36 C ATOM 1461 CG LYS A 90 7.270 -7.478 -14.795 1.00 4.83 C ATOM 1462 CD LYS A 90 6.024 -6.834 -14.160 1.00 7.04 C ATOM 1463 CE LYS A 90 4.791 -7.035 -15.056 1.00 8.62 C ATOM 1464 NZ LYS A 90 3.572 -6.414 -14.490 1.00 10.36 N ATOM 0 H LYS A 90 10.473 -7.826 -11.653 1.00 1.65 H new ATOM 0 HA LYS A 90 7.695 -8.071 -12.236 1.00 2.31 H new ATOM 0 HB2 LYS A 90 8.566 -6.115 -13.741 1.00 3.36 H new ATOM 0 HB3 LYS A 90 9.416 -7.363 -14.631 1.00 3.36 H new ATOM 0 HG2 LYS A 90 7.385 -7.114 -15.816 1.00 4.83 H new ATOM 0 HG3 LYS A 90 7.129 -8.557 -14.855 1.00 4.83 H new ATOM 0 HD2 LYS A 90 5.842 -7.273 -13.179 1.00 7.04 H new ATOM 0 HD3 LYS A 90 6.198 -5.769 -14.006 1.00 7.04 H new ATOM 0 HE2 LYS A 90 4.988 -6.610 -16.040 1.00 8.62 H new ATOM 0 HE3 LYS A 90 4.619 -8.102 -15.198 1.00 8.62 H new ATOM 0 HZ1 LYS A 90 2.769 -6.577 -15.131 1.00 10.36 H new ATOM 0 HZ2 LYS A 90 3.366 -6.837 -13.562 1.00 10.36 H new ATOM 0 HZ3 LYS A 90 3.723 -5.391 -14.379 1.00 10.36 H new ATOM 1478 N LYS A 91 10.358 -9.653 -13.459 1.00 2.09 N ATOM 1479 CA LYS A 91 10.771 -10.924 -14.055 1.00 3.40 C ATOM 1480 C LYS A 91 11.094 -11.996 -13.006 1.00 3.75 C ATOM 1481 O LYS A 91 10.458 -13.046 -12.960 1.00 4.60 O ATOM 1482 CB LYS A 91 12.028 -10.692 -14.912 1.00 4.46 C ATOM 1483 CG LYS A 91 11.769 -9.945 -16.226 1.00 5.13 C ATOM 1484 CD LYS A 91 13.133 -9.619 -16.858 1.00 6.62 C ATOM 1485 CE LYS A 91 13.033 -9.088 -18.295 1.00 7.79 C ATOM 1486 NZ LYS A 91 12.686 -10.150 -19.265 1.00 8.00 N ATOM 0 H LYS A 91 11.097 -8.951 -13.416 1.00 2.09 H new ATOM 0 HA LYS A 91 9.935 -11.284 -14.654 1.00 3.40 H new ATOM 0 HB2 LYS A 91 12.754 -10.129 -14.325 1.00 4.46 H new ATOM 0 HB3 LYS A 91 12.481 -11.657 -15.140 1.00 4.46 H new ATOM 0 HG2 LYS A 91 11.171 -10.557 -16.902 1.00 5.13 H new ATOM 0 HG3 LYS A 91 11.205 -9.031 -16.041 1.00 5.13 H new ATOM 0 HD2 LYS A 91 13.643 -8.879 -16.241 1.00 6.62 H new ATOM 0 HD3 LYS A 91 13.750 -10.517 -16.854 1.00 6.62 H new ATOM 0 HE2 LYS A 91 12.280 -8.301 -18.337 1.00 7.79 H new ATOM 0 HE3 LYS A 91 13.983 -8.636 -18.580 1.00 7.79 H new ATOM 0 HZ1 LYS A 91 12.630 -9.743 -20.220 1.00 8.00 H new ATOM 0 HZ2 LYS A 91 13.417 -10.890 -19.246 1.00 8.00 H new ATOM 0 HZ3 LYS A 91 11.767 -10.565 -19.011 1.00 8.00 H new ATOM 1500 N ASP A 92 12.119 -11.738 -12.196 1.00 3.46 N ATOM 1501 CA ASP A 92 12.905 -12.731 -11.474 1.00 4.18 C ATOM 1502 C ASP A 92 12.855 -12.398 -9.987 1.00 3.19 C ATOM 1503 O ASP A 92 13.868 -12.246 -9.308 1.00 3.29 O ATOM 1504 CB ASP A 92 14.343 -12.691 -12.031 1.00 5.37 C ATOM 1505 CG ASP A 92 14.996 -11.302 -12.051 1.00 6.83 C ATOM 1506 OD1 ASP A 92 14.250 -10.299 -12.164 1.00 7.06 O ATOM 1507 OD2 ASP A 92 16.243 -11.266 -12.045 1.00 8.16 O ATOM 0 H ASP A 92 12.437 -10.785 -12.018 1.00 3.46 H new ATOM 0 HA ASP A 92 12.512 -13.740 -11.604 1.00 4.18 H new ATOM 0 HB2 ASP A 92 14.965 -13.359 -11.436 1.00 5.37 H new ATOM 0 HB3 ASP A 92 14.333 -13.085 -13.047 1.00 5.37 H new ATOM 1512 N LEU A 93 11.626 -12.317 -9.478 1.00 2.64 N ATOM 1513 CA LEU A 93 11.349 -11.474 -8.330 1.00 1.69 C ATOM 1514 C LEU A 93 11.753 -12.166 -7.029 1.00 1.33 C ATOM 1515 O LEU A 93 12.740 -11.784 -6.416 1.00 1.17 O ATOM 1516 CB LEU A 93 9.847 -11.153 -8.429 1.00 2.43 C ATOM 1517 CG LEU A 93 9.309 -10.003 -7.574 1.00 1.95 C ATOM 1518 CD1 LEU A 93 7.925 -9.660 -8.144 1.00 3.10 C ATOM 1519 CD2 LEU A 93 9.178 -10.370 -6.093 1.00 2.37 C ATOM 0 H LEU A 93 10.818 -12.822 -9.842 1.00 2.64 H new ATOM 0 HA LEU A 93 11.931 -10.552 -8.325 1.00 1.69 H new ATOM 0 HB2 LEU A 93 9.619 -10.931 -9.472 1.00 2.43 H new ATOM 0 HB3 LEU A 93 9.293 -12.054 -8.166 1.00 2.43 H new ATOM 0 HG LEU A 93 10.004 -9.164 -7.615 1.00 1.95 H new ATOM 0 HD11 LEU A 93 7.488 -8.842 -7.572 1.00 3.10 H new ATOM 0 HD12 LEU A 93 8.025 -9.360 -9.187 1.00 3.10 H new ATOM 0 HD13 LEU A 93 7.278 -10.534 -8.078 1.00 3.10 H new ATOM 0 HD21 LEU A 93 8.792 -9.514 -5.539 1.00 2.37 H new ATOM 0 HD22 LEU A 93 8.493 -11.211 -5.986 1.00 2.37 H new ATOM 0 HD23 LEU A 93 10.156 -10.646 -5.699 1.00 2.37 H new ATOM 1531 N LYS A 94 11.114 -13.288 -6.684 1.00 1.60 N ATOM 1532 CA LYS A 94 11.515 -14.080 -5.521 1.00 1.47 C ATOM 1533 C LYS A 94 12.805 -14.847 -5.818 1.00 1.54 C ATOM 1534 O LYS A 94 13.446 -15.358 -4.909 1.00 1.54 O ATOM 1535 CB LYS A 94 10.366 -14.958 -5.001 1.00 1.74 C ATOM 1536 CG LYS A 94 9.306 -14.057 -4.345 1.00 1.72 C ATOM 1537 CD LYS A 94 7.906 -14.684 -4.328 1.00 2.22 C ATOM 1538 CE LYS A 94 6.925 -13.733 -3.612 1.00 2.31 C ATOM 1539 NZ LYS A 94 5.504 -14.110 -3.772 1.00 2.91 N ATOM 0 H LYS A 94 10.317 -13.667 -7.195 1.00 1.60 H new ATOM 0 HA LYS A 94 11.742 -13.406 -4.695 1.00 1.47 H new ATOM 0 HB2 LYS A 94 9.924 -15.524 -5.821 1.00 1.74 H new ATOM 0 HB3 LYS A 94 10.743 -15.683 -4.280 1.00 1.74 H new ATOM 0 HG2 LYS A 94 9.610 -13.835 -3.322 1.00 1.72 H new ATOM 0 HG3 LYS A 94 9.265 -13.107 -4.879 1.00 1.72 H new ATOM 0 HD2 LYS A 94 7.568 -14.873 -5.347 1.00 2.22 H new ATOM 0 HD3 LYS A 94 7.933 -15.647 -3.818 1.00 2.22 H new ATOM 0 HE2 LYS A 94 7.167 -13.709 -2.550 1.00 2.31 H new ATOM 0 HE3 LYS A 94 7.068 -12.723 -3.995 1.00 2.31 H new ATOM 0 HZ1 LYS A 94 4.905 -13.428 -3.265 1.00 2.91 H new ATOM 0 HZ2 LYS A 94 5.255 -14.106 -4.782 1.00 2.91 H new ATOM 0 HZ3 LYS A 94 5.351 -15.062 -3.381 1.00 2.91 H new ATOM 1553 N ILE A 95 13.151 -14.982 -7.099 1.00 1.72 N ATOM 1554 CA ILE A 95 14.362 -15.632 -7.568 1.00 1.91 C ATOM 1555 C ILE A 95 15.628 -14.824 -7.227 1.00 1.86 C ATOM 1556 O ILE A 95 16.729 -15.361 -7.330 1.00 2.11 O ATOM 1557 CB ILE A 95 14.193 -15.951 -9.074 1.00 2.04 C ATOM 1558 CG1 ILE A 95 13.061 -16.984 -9.257 1.00 1.73 C ATOM 1559 CG2 ILE A 95 15.485 -16.468 -9.726 1.00 3.14 C ATOM 1560 CD1 ILE A 95 12.579 -17.110 -10.707 1.00 1.87 C ATOM 0 H ILE A 95 12.572 -14.627 -7.860 1.00 1.72 H new ATOM 0 HA ILE A 95 14.511 -16.575 -7.041 1.00 1.91 H new ATOM 0 HB ILE A 95 13.940 -15.017 -9.576 1.00 2.04 H new ATOM 0 HG12 ILE A 95 13.409 -17.958 -8.912 1.00 1.73 H new ATOM 0 HG13 ILE A 95 12.218 -16.704 -8.625 1.00 1.73 H new ATOM 0 HG21 ILE A 95 15.303 -16.674 -10.781 1.00 3.14 H new ATOM 0 HG22 ILE A 95 16.267 -15.714 -9.633 1.00 3.14 H new ATOM 0 HG23 ILE A 95 15.803 -17.384 -9.227 1.00 3.14 H new ATOM 0 HD11 ILE A 95 11.783 -17.853 -10.763 1.00 1.87 H new ATOM 0 HD12 ILE A 95 12.201 -16.147 -11.050 1.00 1.87 H new ATOM 0 HD13 ILE A 95 13.410 -17.420 -11.341 1.00 1.87 H new ATOM 1572 N ARG A 96 15.508 -13.528 -6.914 1.00 1.65 N ATOM 1573 CA ARG A 96 16.600 -12.563 -6.772 1.00 1.93 C ATOM 1574 C ARG A 96 17.043 -12.067 -8.148 1.00 2.18 C ATOM 1575 O ARG A 96 17.123 -10.867 -8.394 1.00 2.88 O ATOM 1576 CB ARG A 96 17.889 -13.063 -6.091 1.00 2.87 C ATOM 1577 CG ARG A 96 17.783 -13.557 -4.649 1.00 2.12 C ATOM 1578 CD ARG A 96 18.913 -12.974 -3.789 1.00 2.74 C ATOM 1579 NE ARG A 96 18.684 -11.530 -3.616 1.00 3.29 N ATOM 1580 CZ ARG A 96 19.447 -10.490 -3.974 1.00 4.42 C ATOM 1581 NH1 ARG A 96 20.720 -10.657 -4.350 1.00 5.14 N ATOM 1582 NH2 ARG A 96 18.892 -9.281 -3.952 1.00 5.52 N ATOM 0 H ARG A 96 14.596 -13.104 -6.744 1.00 1.65 H new ATOM 0 HA ARG A 96 16.160 -11.801 -6.129 1.00 1.93 H new ATOM 0 HB2 ARG A 96 18.295 -13.875 -6.695 1.00 2.87 H new ATOM 0 HB3 ARG A 96 18.618 -12.253 -6.116 1.00 2.87 H new ATOM 0 HG2 ARG A 96 16.818 -13.271 -4.232 1.00 2.12 H new ATOM 0 HG3 ARG A 96 17.829 -14.646 -4.628 1.00 2.12 H new ATOM 0 HD2 ARG A 96 18.943 -13.470 -2.819 1.00 2.74 H new ATOM 0 HD3 ARG A 96 19.878 -13.148 -4.266 1.00 2.74 H new ATOM 0 HE ARG A 96 17.810 -11.284 -3.152 1.00 3.29 H new ATOM 0 HH11 ARG A 96 21.128 -11.592 -4.368 1.00 5.14 H new ATOM 0 HH12 ARG A 96 21.283 -9.850 -4.619 1.00 5.14 H new ATOM 0 HH21 ARG A 96 17.918 -9.172 -3.669 1.00 5.52 H new ATOM 0 HH22 ARG A 96 19.440 -8.463 -4.218 1.00 5.52 H new ATOM 1596 N LYS A 97 17.510 -13.028 -8.955 1.00 2.18 N ATOM 1597 CA LYS A 97 18.479 -12.824 -10.022 1.00 2.48 C ATOM 1598 C LYS A 97 18.510 -14.083 -10.892 1.00 2.81 C ATOM 1599 O LYS A 97 18.240 -14.031 -12.088 1.00 3.12 O ATOM 1600 CB LYS A 97 19.844 -12.530 -9.358 1.00 2.65 C ATOM 1601 CG LYS A 97 21.065 -12.463 -10.298 1.00 3.25 C ATOM 1602 CD LYS A 97 21.913 -13.750 -10.318 1.00 3.58 C ATOM 1603 CE LYS A 97 22.666 -14.019 -9.001 1.00 3.80 C ATOM 1604 NZ LYS A 97 22.882 -15.465 -8.773 1.00 4.48 N ATOM 0 H LYS A 97 17.209 -13.999 -8.875 1.00 2.18 H new ATOM 0 HA LYS A 97 18.221 -11.985 -10.668 1.00 2.48 H new ATOM 0 HB2 LYS A 97 19.768 -11.580 -8.828 1.00 2.65 H new ATOM 0 HB3 LYS A 97 20.032 -13.299 -8.609 1.00 2.65 H new ATOM 0 HG2 LYS A 97 20.720 -12.252 -11.310 1.00 3.25 H new ATOM 0 HG3 LYS A 97 21.697 -11.628 -9.996 1.00 3.25 H new ATOM 0 HD2 LYS A 97 21.264 -14.598 -10.534 1.00 3.58 H new ATOM 0 HD3 LYS A 97 22.635 -13.686 -11.132 1.00 3.58 H new ATOM 0 HE2 LYS A 97 23.628 -13.507 -9.022 1.00 3.80 H new ATOM 0 HE3 LYS A 97 22.101 -13.601 -8.168 1.00 3.80 H new ATOM 0 HZ1 LYS A 97 23.478 -15.598 -7.931 1.00 4.48 H new ATOM 0 HZ2 LYS A 97 21.965 -15.934 -8.626 1.00 4.48 H new ATOM 0 HZ3 LYS A 97 23.354 -15.880 -9.601 1.00 4.48 H new ATOM 1618 N LYS A 98 18.865 -15.213 -10.271 1.00 3.04 N ATOM 1619 CA LYS A 98 19.110 -16.543 -10.812 1.00 3.63 C ATOM 1620 C LYS A 98 20.066 -17.196 -9.815 1.00 4.45 C ATOM 1621 O LYS A 98 20.434 -18.365 -10.059 1.00 5.18 O ATOM 1622 CB LYS A 98 19.735 -16.539 -12.227 1.00 4.29 C ATOM 1623 CG LYS A 98 18.727 -16.843 -13.344 1.00 4.73 C ATOM 1624 CD LYS A 98 18.118 -18.258 -13.335 1.00 5.07 C ATOM 1625 CE LYS A 98 19.149 -19.401 -13.353 1.00 5.36 C ATOM 1626 NZ LYS A 98 19.556 -19.839 -11.999 1.00 5.46 N ATOM 1627 OXT LYS A 98 20.465 -16.492 -8.858 1.00 4.98 O ATOM 0 H LYS A 98 19.002 -15.210 -9.260 1.00 3.04 H new ATOM 0 HA LYS A 98 18.167 -17.077 -10.931 1.00 3.63 H new ATOM 0 HB2 LYS A 98 20.188 -15.565 -12.413 1.00 4.29 H new ATOM 0 HB3 LYS A 98 20.538 -17.276 -12.263 1.00 4.29 H new ATOM 0 HG2 LYS A 98 17.915 -16.119 -13.281 1.00 4.73 H new ATOM 0 HG3 LYS A 98 19.220 -16.687 -14.304 1.00 4.73 H new ATOM 0 HD2 LYS A 98 17.493 -18.364 -12.448 1.00 5.07 H new ATOM 0 HD3 LYS A 98 17.464 -18.363 -14.201 1.00 5.07 H new ATOM 0 HE2 LYS A 98 18.731 -20.251 -13.893 1.00 5.36 H new ATOM 0 HE3 LYS A 98 20.032 -19.077 -13.904 1.00 5.36 H new ATOM 0 HZ1 LYS A 98 20.428 -20.402 -12.064 1.00 5.46 H new ATOM 0 HZ2 LYS A 98 19.726 -19.005 -11.401 1.00 5.46 H new ATOM 0 HZ3 LYS A 98 18.800 -20.417 -11.580 1.00 5.46 H new TER 1641 LYS A 98 ATOM 1642 N MET B 1 10.858 -12.590 5.854 1.00 3.91 N ATOM 1643 CA MET B 1 10.658 -13.687 4.878 1.00 3.58 C ATOM 1644 C MET B 1 11.932 -14.533 4.915 1.00 3.99 C ATOM 1645 O MET B 1 12.467 -14.665 6.012 1.00 4.90 O ATOM 1646 CB MET B 1 9.424 -14.510 5.279 1.00 3.94 C ATOM 1647 CG MET B 1 8.128 -13.853 4.781 1.00 4.39 C ATOM 1648 SD MET B 1 6.617 -14.692 5.314 1.00 5.70 S ATOM 1649 CE MET B 1 5.377 -13.594 4.587 1.00 6.36 C ATOM 0 H1 MET B 1 9.940 -12.159 6.085 1.00 3.91 H new ATOM 0 H2 MET B 1 11.289 -12.971 6.720 1.00 3.91 H new ATOM 0 H3 MET B 1 11.485 -11.870 5.443 1.00 3.91 H new ATOM 0 HA MET B 1 10.482 -13.314 3.869 1.00 3.58 H new ATOM 0 HB2 MET B 1 9.506 -15.516 4.867 1.00 3.94 H new ATOM 0 HB3 MET B 1 9.389 -14.612 6.364 1.00 3.94 H new ATOM 0 HG2 MET B 1 8.100 -12.821 5.131 1.00 4.39 H new ATOM 0 HG3 MET B 1 8.146 -13.820 3.692 1.00 4.39 H new ATOM 0 HE1 MET B 1 4.380 -13.966 4.821 1.00 6.36 H new ATOM 0 HE2 MET B 1 5.495 -12.591 4.996 1.00 6.36 H new ATOM 0 HE3 MET B 1 5.508 -13.562 3.505 1.00 6.36 H new ATOM 1661 N ALA B 2 12.536 -14.984 3.804 1.00 4.09 N ATOM 1662 CA ALA B 2 12.074 -15.300 2.444 1.00 3.67 C ATOM 1663 C ALA B 2 13.165 -16.186 1.820 1.00 3.86 C ATOM 1664 O ALA B 2 14.156 -16.473 2.492 1.00 4.52 O ATOM 1665 CB ALA B 2 10.733 -16.043 2.472 1.00 3.80 C ATOM 0 H ALA B 2 13.538 -15.166 3.854 1.00 4.09 H new ATOM 0 HA ALA B 2 11.914 -14.390 1.866 1.00 3.67 H new ATOM 0 HB1 ALA B 2 10.417 -16.263 1.452 1.00 3.80 H new ATOM 0 HB2 ALA B 2 10.845 -16.975 3.026 1.00 3.80 H new ATOM 0 HB3 ALA B 2 9.982 -15.420 2.958 1.00 3.80 H new ATOM 1671 N ALA B 3 12.982 -16.583 0.555 1.00 3.58 N ATOM 1672 CA ALA B 3 13.960 -17.166 -0.365 1.00 3.72 C ATOM 1673 C ALA B 3 13.519 -16.737 -1.772 1.00 2.99 C ATOM 1674 O ALA B 3 12.913 -17.552 -2.459 1.00 2.99 O ATOM 1675 CB ALA B 3 15.426 -16.852 -0.028 1.00 5.19 C ATOM 0 H ALA B 3 12.067 -16.496 0.113 1.00 3.58 H new ATOM 0 HA ALA B 3 13.962 -18.253 -0.281 1.00 3.72 H new ATOM 0 HB1 ALA B 3 16.078 -17.325 -0.763 1.00 5.19 H new ATOM 0 HB2 ALA B 3 15.581 -15.773 -0.047 1.00 5.19 H new ATOM 0 HB3 ALA B 3 15.661 -17.235 0.965 1.00 5.19 H new ATOM 1681 N GLU B 4 13.611 -15.462 -2.178 1.00 2.79 N ATOM 1682 CA GLU B 4 14.513 -14.369 -1.807 1.00 1.99 C ATOM 1683 C GLU B 4 13.989 -13.770 -0.508 1.00 1.64 C ATOM 1684 O GLU B 4 12.806 -13.992 -0.265 1.00 2.43 O ATOM 1685 CB GLU B 4 14.455 -13.306 -2.928 1.00 1.93 C ATOM 1686 CG GLU B 4 15.167 -11.988 -2.568 1.00 2.82 C ATOM 1687 CD GLU B 4 15.195 -10.955 -3.674 1.00 3.06 C ATOM 1688 OE1 GLU B 4 14.115 -10.622 -4.187 1.00 3.16 O ATOM 1689 OE2 GLU B 4 16.314 -10.493 -3.986 1.00 3.99 O ATOM 0 H GLU B 4 12.951 -15.129 -2.881 1.00 2.79 H new ATOM 0 HA GLU B 4 15.539 -14.713 -1.678 1.00 1.99 H new ATOM 0 HB2 GLU B 4 14.906 -13.718 -3.831 1.00 1.93 H new ATOM 0 HB3 GLU B 4 13.412 -13.093 -3.161 1.00 1.93 H new ATOM 0 HG2 GLU B 4 14.676 -11.553 -1.697 1.00 2.82 H new ATOM 0 HG3 GLU B 4 16.193 -12.214 -2.276 1.00 2.82 H new ATOM 1696 N PRO B 5 14.804 -13.091 0.334 1.00 1.39 N ATOM 1697 CA PRO B 5 14.460 -12.716 1.710 1.00 1.69 C ATOM 1698 C PRO B 5 13.367 -11.636 1.815 1.00 1.70 C ATOM 1699 O PRO B 5 13.537 -10.612 2.480 1.00 2.00 O ATOM 1700 CB PRO B 5 15.783 -12.306 2.376 1.00 2.32 C ATOM 1701 CG PRO B 5 16.848 -12.968 1.502 1.00 2.32 C ATOM 1702 CD PRO B 5 16.216 -12.798 0.126 1.00 1.69 C ATOM 0 HA PRO B 5 14.003 -13.560 2.227 1.00 1.69 H new ATOM 0 HB2 PRO B 5 15.901 -11.223 2.399 1.00 2.32 H new ATOM 0 HB3 PRO B 5 15.837 -12.655 3.407 1.00 2.32 H new ATOM 0 HG2 PRO B 5 17.816 -12.472 1.579 1.00 2.32 H new ATOM 0 HG3 PRO B 5 17.005 -14.015 1.760 1.00 2.32 H new ATOM 0 HD2 PRO B 5 16.360 -11.787 -0.254 1.00 1.69 H new ATOM 0 HD3 PRO B 5 16.660 -13.478 -0.601 1.00 1.69 H new ATOM 1710 N LEU B 6 12.211 -11.906 1.210 1.00 1.66 N ATOM 1711 CA LEU B 6 11.184 -10.976 0.826 1.00 1.95 C ATOM 1712 C LEU B 6 10.335 -10.724 2.055 1.00 1.93 C ATOM 1713 O LEU B 6 9.353 -11.417 2.318 1.00 2.85 O ATOM 1714 CB LEU B 6 10.384 -11.613 -0.316 1.00 2.29 C ATOM 1715 CG LEU B 6 9.502 -10.585 -1.029 1.00 2.14 C ATOM 1716 CD1 LEU B 6 10.304 -9.930 -2.160 1.00 3.54 C ATOM 1717 CD2 LEU B 6 8.293 -11.317 -1.605 1.00 2.98 C ATOM 0 H LEU B 6 11.962 -12.863 0.962 1.00 1.66 H new ATOM 0 HA LEU B 6 11.576 -10.023 0.471 1.00 1.95 H new ATOM 0 HB2 LEU B 6 11.069 -12.065 -1.033 1.00 2.29 H new ATOM 0 HB3 LEU B 6 9.761 -12.416 0.079 1.00 2.29 H new ATOM 0 HG LEU B 6 9.174 -9.811 -0.335 1.00 2.14 H new ATOM 0 HD11 LEU B 6 9.680 -9.197 -2.671 1.00 3.54 H new ATOM 0 HD12 LEU B 6 11.181 -9.433 -1.744 1.00 3.54 H new ATOM 0 HD13 LEU B 6 10.622 -10.694 -2.870 1.00 3.54 H new ATOM 0 HD21 LEU B 6 7.648 -10.605 -2.119 1.00 2.98 H new ATOM 0 HD22 LEU B 6 8.630 -12.077 -2.310 1.00 2.98 H new ATOM 0 HD23 LEU B 6 7.737 -11.793 -0.797 1.00 2.98 H new ATOM 1729 N THR B 7 10.816 -9.811 2.883 1.00 1.31 N ATOM 1730 CA THR B 7 10.345 -9.693 4.243 1.00 1.25 C ATOM 1731 C THR B 7 9.093 -8.830 4.301 1.00 1.01 C ATOM 1732 O THR B 7 8.814 -8.061 3.397 1.00 1.10 O ATOM 1733 CB THR B 7 11.543 -9.309 5.120 1.00 1.57 C ATOM 1734 OG1 THR B 7 12.416 -10.429 5.056 1.00 2.22 O ATOM 1735 CG2 THR B 7 11.229 -9.022 6.591 1.00 1.62 C ATOM 0 H THR B 7 11.539 -9.138 2.629 1.00 1.31 H new ATOM 0 HA THR B 7 9.983 -10.630 4.666 1.00 1.25 H new ATOM 0 HB THR B 7 11.953 -8.372 4.742 1.00 1.57 H new ATOM 0 HG1 THR B 7 12.852 -10.454 4.179 1.00 2.22 H new ATOM 0 HG21 THR B 7 12.148 -8.761 7.115 1.00 1.62 H new ATOM 0 HG22 THR B 7 10.525 -8.192 6.658 1.00 1.62 H new ATOM 0 HG23 THR B 7 10.789 -9.908 7.049 1.00 1.62 H new ATOM 1743 N GLU B 8 8.292 -9.055 5.334 1.00 1.03 N ATOM 1744 CA GLU B 8 6.885 -8.721 5.459 1.00 1.04 C ATOM 1745 C GLU B 8 6.515 -7.352 4.851 1.00 1.00 C ATOM 1746 O GLU B 8 5.593 -7.259 4.039 1.00 1.10 O ATOM 1747 CB GLU B 8 6.505 -8.871 6.943 1.00 1.24 C ATOM 1748 CG GLU B 8 6.675 -10.316 7.479 1.00 1.82 C ATOM 1749 CD GLU B 8 8.108 -10.750 7.798 1.00 2.74 C ATOM 1750 OE1 GLU B 8 8.790 -11.231 6.856 1.00 3.98 O ATOM 1751 OE2 GLU B 8 8.535 -10.557 8.952 1.00 3.21 O ATOM 0 H GLU B 8 8.642 -9.514 6.175 1.00 1.03 H new ATOM 0 HA GLU B 8 6.289 -9.412 4.862 1.00 1.04 H new ATOM 0 HB2 GLU B 8 7.120 -8.196 7.538 1.00 1.24 H new ATOM 0 HB3 GLU B 8 5.469 -8.561 7.078 1.00 1.24 H new ATOM 0 HG2 GLU B 8 6.075 -10.420 8.383 1.00 1.82 H new ATOM 0 HG3 GLU B 8 6.263 -11.006 6.743 1.00 1.82 H new ATOM 1758 N LEU B 9 7.251 -6.290 5.206 1.00 0.97 N ATOM 1759 CA LEU B 9 7.048 -4.962 4.624 1.00 1.06 C ATOM 1760 C LEU B 9 7.150 -5.030 3.095 1.00 1.15 C ATOM 1761 O LEU B 9 6.280 -4.532 2.384 1.00 1.32 O ATOM 1762 CB LEU B 9 8.104 -3.965 5.127 1.00 1.16 C ATOM 1763 CG LEU B 9 7.949 -3.472 6.578 1.00 1.13 C ATOM 1764 CD1 LEU B 9 8.061 -4.535 7.682 1.00 2.72 C ATOM 1765 CD2 LEU B 9 8.935 -2.325 6.825 1.00 2.20 C ATOM 0 H LEU B 9 7.998 -6.329 5.900 1.00 0.97 H new ATOM 0 HA LEU B 9 6.056 -4.626 4.926 1.00 1.06 H new ATOM 0 HB2 LEU B 9 9.085 -4.429 5.027 1.00 1.16 H new ATOM 0 HB3 LEU B 9 8.094 -3.096 4.469 1.00 1.16 H new ATOM 0 HG LEU B 9 6.914 -3.138 6.657 1.00 1.13 H new ATOM 0 HD11 LEU B 9 7.934 -4.063 8.656 1.00 2.72 H new ATOM 0 HD12 LEU B 9 7.287 -5.289 7.541 1.00 2.72 H new ATOM 0 HD13 LEU B 9 9.042 -5.008 7.633 1.00 2.72 H new ATOM 0 HD21 LEU B 9 8.831 -1.970 7.850 1.00 2.20 H new ATOM 0 HD22 LEU B 9 9.953 -2.680 6.665 1.00 2.20 H new ATOM 0 HD23 LEU B 9 8.723 -1.508 6.135 1.00 2.20 H new ATOM 1777 N GLU B 10 8.236 -5.633 2.607 1.00 1.13 N ATOM 1778 CA GLU B 10 8.490 -5.838 1.197 1.00 1.27 C ATOM 1779 C GLU B 10 7.355 -6.654 0.590 1.00 1.24 C ATOM 1780 O GLU B 10 6.659 -6.177 -0.302 1.00 1.44 O ATOM 1781 CB GLU B 10 9.849 -6.519 0.979 1.00 1.27 C ATOM 1782 CG GLU B 10 10.182 -6.498 -0.512 1.00 1.22 C ATOM 1783 CD GLU B 10 11.554 -7.070 -0.832 1.00 2.70 C ATOM 1784 OE1 GLU B 10 12.035 -7.870 -0.007 1.00 4.11 O ATOM 1785 OE2 GLU B 10 12.114 -6.682 -1.876 1.00 3.36 O ATOM 0 H GLU B 10 8.977 -5.998 3.205 1.00 1.13 H new ATOM 0 HA GLU B 10 8.531 -4.871 0.696 1.00 1.27 H new ATOM 0 HB2 GLU B 10 10.624 -6.003 1.545 1.00 1.27 H new ATOM 0 HB3 GLU B 10 9.818 -7.546 1.344 1.00 1.27 H new ATOM 0 HG2 GLU B 10 9.425 -7.065 -1.054 1.00 1.22 H new ATOM 0 HG3 GLU B 10 10.131 -5.471 -0.874 1.00 1.22 H new ATOM 1792 N GLU B 11 7.149 -7.874 1.101 1.00 1.20 N ATOM 1793 CA GLU B 11 6.159 -8.797 0.558 1.00 1.35 C ATOM 1794 C GLU B 11 4.813 -8.108 0.351 1.00 1.25 C ATOM 1795 O GLU B 11 4.173 -8.343 -0.665 1.00 1.50 O ATOM 1796 CB GLU B 11 6.043 -10.066 1.419 1.00 1.37 C ATOM 1797 CG GLU B 11 5.368 -11.233 0.667 1.00 1.98 C ATOM 1798 CD GLU B 11 3.843 -11.192 0.692 1.00 2.93 C ATOM 1799 OE1 GLU B 11 3.314 -11.218 1.821 1.00 3.42 O ATOM 1800 OE2 GLU B 11 3.241 -11.187 -0.408 1.00 4.20 O ATOM 0 H GLU B 11 7.665 -8.243 1.900 1.00 1.20 H new ATOM 0 HA GLU B 11 6.503 -9.117 -0.426 1.00 1.35 H new ATOM 0 HB2 GLU B 11 7.037 -10.374 1.742 1.00 1.37 H new ATOM 0 HB3 GLU B 11 5.471 -9.839 2.319 1.00 1.37 H new ATOM 0 HG2 GLU B 11 5.704 -11.225 -0.370 1.00 1.98 H new ATOM 0 HG3 GLU B 11 5.703 -12.174 1.104 1.00 1.98 H new ATOM 1807 N SER B 12 4.421 -7.192 1.245 1.00 1.03 N ATOM 1808 CA SER B 12 3.131 -6.521 1.138 1.00 1.00 C ATOM 1809 C SER B 12 2.968 -5.839 -0.227 1.00 0.89 C ATOM 1810 O SER B 12 1.896 -5.849 -0.834 1.00 0.96 O ATOM 1811 CB SER B 12 2.977 -5.505 2.271 1.00 1.13 C ATOM 1812 OG SER B 12 3.096 -6.122 3.541 1.00 1.94 O ATOM 0 H SER B 12 4.981 -6.903 2.047 1.00 1.03 H new ATOM 0 HA SER B 12 2.346 -7.272 1.225 1.00 1.00 H new ATOM 0 HB2 SER B 12 3.735 -4.728 2.170 1.00 1.13 H new ATOM 0 HB3 SER B 12 2.006 -5.015 2.193 1.00 1.13 H new ATOM 0 HG SER B 12 4.018 -6.427 3.672 1.00 1.94 H new ATOM 1818 N ILE B 13 4.051 -5.235 -0.721 1.00 0.81 N ATOM 1819 CA ILE B 13 4.058 -4.578 -2.016 1.00 0.77 C ATOM 1820 C ILE B 13 3.812 -5.630 -3.090 1.00 0.73 C ATOM 1821 O ILE B 13 2.980 -5.441 -3.978 1.00 0.70 O ATOM 1822 CB ILE B 13 5.404 -3.862 -2.216 1.00 0.79 C ATOM 1823 CG1 ILE B 13 5.557 -2.760 -1.157 1.00 0.97 C ATOM 1824 CG2 ILE B 13 5.624 -3.250 -3.607 1.00 0.76 C ATOM 1825 CD1 ILE B 13 7.025 -2.582 -0.833 1.00 0.92 C ATOM 0 H ILE B 13 4.944 -5.191 -0.230 1.00 0.81 H new ATOM 0 HA ILE B 13 3.271 -3.826 -2.079 1.00 0.77 H new ATOM 0 HB ILE B 13 6.161 -4.640 -2.113 1.00 0.79 H new ATOM 0 HG12 ILE B 13 5.137 -1.824 -1.526 1.00 0.97 H new ATOM 0 HG13 ILE B 13 5.003 -3.025 -0.256 1.00 0.97 H new ATOM 0 HG21 ILE B 13 6.602 -2.770 -3.643 1.00 0.76 H new ATOM 0 HG22 ILE B 13 5.578 -4.035 -4.361 1.00 0.76 H new ATOM 0 HG23 ILE B 13 4.849 -2.510 -3.806 1.00 0.76 H new ATOM 0 HD11 ILE B 13 7.140 -1.801 -0.082 1.00 0.92 H new ATOM 0 HD12 ILE B 13 7.429 -3.518 -0.448 1.00 0.92 H new ATOM 0 HD13 ILE B 13 7.565 -2.299 -1.736 1.00 0.92 H new ATOM 1837 N GLU B 14 4.526 -6.749 -2.982 1.00 0.77 N ATOM 1838 CA GLU B 14 4.425 -7.873 -3.892 1.00 0.80 C ATOM 1839 C GLU B 14 2.989 -8.408 -3.923 1.00 0.79 C ATOM 1840 O GLU B 14 2.446 -8.691 -4.995 1.00 0.83 O ATOM 1841 CB GLU B 14 5.504 -8.909 -3.566 1.00 1.03 C ATOM 1842 CG GLU B 14 6.873 -8.222 -3.389 1.00 2.38 C ATOM 1843 CD GLU B 14 7.161 -7.162 -4.450 1.00 4.40 C ATOM 1844 OE1 GLU B 14 7.050 -7.515 -5.643 1.00 5.16 O ATOM 1845 OE2 GLU B 14 7.448 -6.007 -4.071 1.00 5.85 O ATOM 0 H GLU B 14 5.207 -6.896 -2.237 1.00 0.77 H new ATOM 0 HA GLU B 14 4.628 -7.560 -4.916 1.00 0.80 H new ATOM 0 HB2 GLU B 14 5.239 -9.445 -2.655 1.00 1.03 H new ATOM 0 HB3 GLU B 14 5.561 -9.648 -4.366 1.00 1.03 H new ATOM 0 HG2 GLU B 14 6.914 -7.759 -2.403 1.00 2.38 H new ATOM 0 HG3 GLU B 14 7.657 -8.978 -3.419 1.00 2.38 H new ATOM 1852 N THR B 15 2.350 -8.468 -2.755 1.00 0.81 N ATOM 1853 CA THR B 15 0.941 -8.782 -2.630 1.00 0.89 C ATOM 1854 C THR B 15 0.117 -7.807 -3.476 1.00 0.82 C ATOM 1855 O THR B 15 -0.636 -8.236 -4.342 1.00 0.85 O ATOM 1856 CB THR B 15 0.488 -8.775 -1.163 1.00 1.03 C ATOM 1857 OG1 THR B 15 1.528 -9.138 -0.277 1.00 1.60 O ATOM 1858 CG2 THR B 15 -0.713 -9.706 -0.992 1.00 1.19 C ATOM 0 H THR B 15 2.810 -8.296 -1.861 1.00 0.81 H new ATOM 0 HA THR B 15 0.777 -9.793 -3.003 1.00 0.89 H new ATOM 0 HB THR B 15 0.200 -7.755 -0.909 1.00 1.03 H new ATOM 0 HG1 THR B 15 1.974 -9.945 -0.609 1.00 1.60 H new ATOM 0 HG21 THR B 15 -1.033 -9.700 0.050 1.00 1.19 H new ATOM 0 HG22 THR B 15 -1.532 -9.364 -1.625 1.00 1.19 H new ATOM 0 HG23 THR B 15 -0.432 -10.719 -1.279 1.00 1.19 H new ATOM 1866 N VAL B 16 0.257 -6.492 -3.272 1.00 0.75 N ATOM 1867 CA VAL B 16 -0.480 -5.519 -4.063 1.00 0.69 C ATOM 1868 C VAL B 16 -0.254 -5.736 -5.568 1.00 0.67 C ATOM 1869 O VAL B 16 -1.215 -5.887 -6.327 1.00 0.70 O ATOM 1870 CB VAL B 16 -0.104 -4.092 -3.637 1.00 0.65 C ATOM 1871 CG1 VAL B 16 -0.733 -3.103 -4.614 1.00 0.62 C ATOM 1872 CG2 VAL B 16 -0.581 -3.752 -2.222 1.00 0.86 C ATOM 0 H VAL B 16 0.873 -6.086 -2.568 1.00 0.75 H new ATOM 0 HA VAL B 16 -1.545 -5.660 -3.876 1.00 0.69 H new ATOM 0 HB VAL B 16 0.984 -4.026 -3.644 1.00 0.65 H new ATOM 0 HG11 VAL B 16 -0.472 -2.086 -4.321 1.00 0.62 H new ATOM 0 HG12 VAL B 16 -0.360 -3.298 -5.619 1.00 0.62 H new ATOM 0 HG13 VAL B 16 -1.817 -3.218 -4.601 1.00 0.62 H new ATOM 0 HG21 VAL B 16 -0.288 -2.732 -1.974 1.00 0.86 H new ATOM 0 HG22 VAL B 16 -1.666 -3.839 -2.173 1.00 0.86 H new ATOM 0 HG23 VAL B 16 -0.129 -4.442 -1.510 1.00 0.86 H new ATOM 1882 N VAL B 17 1.002 -5.705 -6.020 1.00 0.69 N ATOM 1883 CA VAL B 17 1.310 -5.770 -7.447 1.00 0.76 C ATOM 1884 C VAL B 17 0.811 -7.078 -8.072 1.00 0.73 C ATOM 1885 O VAL B 17 0.403 -7.059 -9.232 1.00 0.75 O ATOM 1886 CB VAL B 17 2.790 -5.476 -7.759 1.00 0.69 C ATOM 1887 CG1 VAL B 17 3.237 -4.108 -7.224 1.00 1.01 C ATOM 1888 CG2 VAL B 17 3.680 -6.554 -7.168 1.00 0.68 C ATOM 0 H VAL B 17 1.821 -5.635 -5.416 1.00 0.69 H new ATOM 0 HA VAL B 17 0.756 -4.963 -7.926 1.00 0.76 H new ATOM 0 HB VAL B 17 2.886 -5.464 -8.845 1.00 0.69 H new ATOM 0 HG11 VAL B 17 4.287 -3.947 -7.469 1.00 1.01 H new ATOM 0 HG12 VAL B 17 2.633 -3.324 -7.681 1.00 1.01 H new ATOM 0 HG13 VAL B 17 3.108 -4.081 -6.142 1.00 1.01 H new ATOM 0 HG21 VAL B 17 4.722 -6.332 -7.397 1.00 0.68 H new ATOM 0 HG22 VAL B 17 3.545 -6.585 -6.087 1.00 0.68 H new ATOM 0 HG23 VAL B 17 3.413 -7.521 -7.595 1.00 0.68 H new ATOM 1898 N THR B 18 0.804 -8.202 -7.340 1.00 0.76 N ATOM 1899 CA THR B 18 0.156 -9.400 -7.866 1.00 0.81 C ATOM 1900 C THR B 18 -1.370 -9.233 -7.857 1.00 0.85 C ATOM 1901 O THR B 18 -2.010 -9.544 -8.861 1.00 0.93 O ATOM 1902 CB THR B 18 0.679 -10.700 -7.226 1.00 0.95 C ATOM 1903 OG1 THR B 18 0.435 -11.788 -8.095 1.00 1.68 O ATOM 1904 CG2 THR B 18 0.094 -11.047 -5.858 1.00 1.32 C ATOM 0 H THR B 18 1.225 -8.302 -6.416 1.00 0.76 H new ATOM 0 HA THR B 18 0.438 -9.514 -8.913 1.00 0.81 H new ATOM 0 HB THR B 18 1.742 -10.518 -7.066 1.00 0.95 H new ATOM 0 HG1 THR B 18 0.770 -12.614 -7.687 1.00 1.68 H new ATOM 0 HG21 THR B 18 0.531 -11.980 -5.501 1.00 1.32 H new ATOM 0 HG22 THR B 18 0.319 -10.247 -5.152 1.00 1.32 H new ATOM 0 HG23 THR B 18 -0.987 -11.162 -5.943 1.00 1.32 H new ATOM 1912 N THR B 19 -1.960 -8.710 -6.772 1.00 0.86 N ATOM 1913 CA THR B 19 -3.404 -8.523 -6.663 1.00 0.96 C ATOM 1914 C THR B 19 -3.950 -7.692 -7.825 1.00 1.01 C ATOM 1915 O THR B 19 -4.999 -8.022 -8.373 1.00 1.10 O ATOM 1916 CB THR B 19 -3.746 -7.923 -5.292 1.00 1.05 C ATOM 1917 OG1 THR B 19 -3.440 -8.888 -4.306 1.00 1.13 O ATOM 1918 CG2 THR B 19 -5.226 -7.553 -5.181 1.00 1.18 C ATOM 0 H THR B 19 -1.443 -8.406 -5.947 1.00 0.86 H new ATOM 0 HA THR B 19 -3.896 -9.493 -6.734 1.00 0.96 H new ATOM 0 HB THR B 19 -3.166 -7.010 -5.157 1.00 1.05 H new ATOM 0 HG1 THR B 19 -2.478 -8.873 -4.121 1.00 1.13 H new ATOM 0 HG21 THR B 19 -5.423 -7.132 -4.195 1.00 1.18 H new ATOM 0 HG22 THR B 19 -5.475 -6.817 -5.946 1.00 1.18 H new ATOM 0 HG23 THR B 19 -5.836 -8.445 -5.323 1.00 1.18 H new ATOM 1926 N PHE B 20 -3.230 -6.643 -8.245 1.00 1.01 N ATOM 1927 CA PHE B 20 -3.538 -5.908 -9.470 1.00 1.10 C ATOM 1928 C PHE B 20 -3.931 -6.806 -10.646 1.00 1.26 C ATOM 1929 O PHE B 20 -4.791 -6.431 -11.443 1.00 1.51 O ATOM 1930 CB PHE B 20 -2.333 -5.055 -9.881 1.00 1.00 C ATOM 1931 CG PHE B 20 -2.436 -3.622 -9.430 1.00 0.78 C ATOM 1932 CD1 PHE B 20 -3.335 -2.761 -10.082 1.00 2.21 C ATOM 1933 CD2 PHE B 20 -1.685 -3.164 -8.334 1.00 2.06 C ATOM 1934 CE1 PHE B 20 -3.473 -1.442 -9.633 1.00 2.43 C ATOM 1935 CE2 PHE B 20 -1.741 -1.813 -7.964 1.00 1.90 C ATOM 1936 CZ PHE B 20 -2.620 -0.954 -8.635 1.00 0.96 C ATOM 0 H PHE B 20 -2.419 -6.283 -7.742 1.00 1.01 H new ATOM 0 HA PHE B 20 -4.403 -5.286 -9.239 1.00 1.10 H new ATOM 0 HB2 PHE B 20 -1.426 -5.495 -9.466 1.00 1.00 H new ATOM 0 HB3 PHE B 20 -2.232 -5.081 -10.966 1.00 1.00 H new ATOM 0 HD1 PHE B 20 -3.915 -3.114 -10.922 1.00 2.21 H new ATOM 0 HD2 PHE B 20 -1.066 -3.852 -7.778 1.00 2.06 H new ATOM 0 HE1 PHE B 20 -4.235 -0.803 -10.055 1.00 2.43 H new ATOM 0 HE2 PHE B 20 -1.113 -1.439 -7.169 1.00 1.90 H new ATOM 0 HZ PHE B 20 -2.640 0.095 -8.380 1.00 0.96 H new ATOM 1946 N PHE B 21 -3.273 -7.959 -10.795 1.00 1.22 N ATOM 1947 CA PHE B 21 -3.558 -8.869 -11.891 1.00 1.46 C ATOM 1948 C PHE B 21 -4.974 -9.434 -11.775 1.00 1.65 C ATOM 1949 O PHE B 21 -5.644 -9.629 -12.789 1.00 1.78 O ATOM 1950 CB PHE B 21 -2.488 -9.968 -11.985 1.00 1.53 C ATOM 1951 CG PHE B 21 -2.146 -10.380 -13.408 1.00 2.01 C ATOM 1952 CD1 PHE B 21 -3.098 -11.041 -14.208 1.00 3.09 C ATOM 1953 CD2 PHE B 21 -0.883 -10.068 -13.951 1.00 2.57 C ATOM 1954 CE1 PHE B 21 -2.797 -11.375 -15.540 1.00 3.89 C ATOM 1955 CE2 PHE B 21 -0.573 -10.424 -15.276 1.00 3.33 C ATOM 1956 CZ PHE B 21 -1.530 -11.078 -16.071 1.00 3.76 C ATOM 0 H PHE B 21 -2.538 -8.279 -10.164 1.00 1.22 H new ATOM 0 HA PHE B 21 -3.517 -8.311 -12.827 1.00 1.46 H new ATOM 0 HB2 PHE B 21 -1.581 -9.620 -11.491 1.00 1.53 H new ATOM 0 HB3 PHE B 21 -2.834 -10.845 -11.437 1.00 1.53 H new ATOM 0 HD1 PHE B 21 -4.064 -11.293 -13.796 1.00 3.09 H new ATOM 0 HD2 PHE B 21 -0.150 -9.553 -13.347 1.00 2.57 H new ATOM 0 HE1 PHE B 21 -3.540 -11.860 -16.156 1.00 3.89 H new ATOM 0 HE2 PHE B 21 0.401 -10.195 -15.683 1.00 3.33 H new ATOM 0 HZ PHE B 21 -1.292 -11.352 -17.088 1.00 3.76 H new ATOM 1966 N THR B 22 -5.469 -9.664 -10.557 1.00 1.85 N ATOM 1967 CA THR B 22 -6.714 -10.381 -10.345 1.00 2.09 C ATOM 1968 C THR B 22 -7.906 -9.432 -10.519 1.00 2.17 C ATOM 1969 O THR B 22 -8.769 -9.313 -9.652 1.00 2.64 O ATOM 1970 CB THR B 22 -6.722 -10.992 -8.931 1.00 2.68 C ATOM 1971 OG1 THR B 22 -5.437 -11.278 -8.421 1.00 3.08 O ATOM 1972 CG2 THR B 22 -7.553 -12.279 -8.916 1.00 2.96 C ATOM 0 H THR B 22 -5.015 -9.357 -9.697 1.00 1.85 H new ATOM 0 HA THR B 22 -6.798 -11.181 -11.081 1.00 2.09 H new ATOM 0 HB THR B 22 -7.162 -10.231 -8.286 1.00 2.68 H new ATOM 0 HG1 THR B 22 -5.479 -11.337 -7.444 1.00 3.08 H new ATOM 0 HG21 THR B 22 -7.551 -12.702 -7.911 1.00 2.96 H new ATOM 0 HG22 THR B 22 -8.577 -12.054 -9.213 1.00 2.96 H new ATOM 0 HG23 THR B 22 -7.123 -12.998 -9.613 1.00 2.96 H new ATOM 1980 N PHE B 23 -8.048 -8.807 -11.690 1.00 2.11 N ATOM 1981 CA PHE B 23 -9.111 -7.832 -11.921 1.00 2.54 C ATOM 1982 C PHE B 23 -10.411 -8.561 -12.307 1.00 2.65 C ATOM 1983 O PHE B 23 -11.120 -8.145 -13.222 1.00 3.75 O ATOM 1984 CB PHE B 23 -8.627 -6.821 -12.978 1.00 2.87 C ATOM 1985 CG PHE B 23 -9.569 -5.684 -13.349 1.00 3.83 C ATOM 1986 CD1 PHE B 23 -10.496 -5.170 -12.420 1.00 4.42 C ATOM 1987 CD2 PHE B 23 -9.489 -5.112 -14.635 1.00 5.01 C ATOM 1988 CE1 PHE B 23 -11.371 -4.136 -12.793 1.00 5.62 C ATOM 1989 CE2 PHE B 23 -10.362 -4.071 -15.004 1.00 6.20 C ATOM 1990 CZ PHE B 23 -11.305 -3.585 -14.082 1.00 6.33 C ATOM 0 H PHE B 23 -7.438 -8.961 -12.493 1.00 2.11 H new ATOM 0 HA PHE B 23 -9.340 -7.269 -11.016 1.00 2.54 H new ATOM 0 HB2 PHE B 23 -7.695 -6.382 -12.621 1.00 2.87 H new ATOM 0 HB3 PHE B 23 -8.392 -7.373 -13.888 1.00 2.87 H new ATOM 0 HD1 PHE B 23 -10.534 -5.572 -11.418 1.00 4.42 H new ATOM 0 HD2 PHE B 23 -8.755 -5.474 -15.340 1.00 5.01 H new ATOM 0 HE1 PHE B 23 -12.097 -3.764 -12.085 1.00 5.62 H new ATOM 0 HE2 PHE B 23 -10.307 -3.646 -15.995 1.00 6.20 H new ATOM 0 HZ PHE B 23 -11.978 -2.789 -14.365 1.00 6.33 H new ATOM 2000 N ALA B 24 -10.717 -9.663 -11.616 1.00 2.50 N ATOM 2001 CA ALA B 24 -11.791 -10.594 -11.928 1.00 2.88 C ATOM 2002 C ALA B 24 -11.826 -10.947 -13.421 1.00 3.17 C ATOM 2003 O ALA B 24 -12.840 -10.740 -14.085 1.00 3.79 O ATOM 2004 CB ALA B 24 -13.125 -10.029 -11.427 1.00 3.38 C ATOM 0 H ALA B 24 -10.194 -9.938 -10.785 1.00 2.50 H new ATOM 0 HA ALA B 24 -11.604 -11.533 -11.407 1.00 2.88 H new ATOM 0 HB1 ALA B 24 -13.927 -10.728 -11.662 1.00 3.38 H new ATOM 0 HB2 ALA B 24 -13.076 -9.882 -10.348 1.00 3.38 H new ATOM 0 HB3 ALA B 24 -13.322 -9.074 -11.914 1.00 3.38 H new ATOM 2010 N ARG B 25 -10.727 -11.500 -13.944 1.00 3.21 N ATOM 2011 CA ARG B 25 -10.618 -11.984 -15.317 1.00 3.70 C ATOM 2012 C ARG B 25 -9.304 -12.742 -15.478 1.00 3.65 C ATOM 2013 O ARG B 25 -8.391 -12.548 -14.678 1.00 4.12 O ATOM 2014 CB ARG B 25 -10.682 -10.820 -16.320 1.00 4.47 C ATOM 2015 CG ARG B 25 -9.495 -9.852 -16.184 1.00 5.59 C ATOM 2016 CD ARG B 25 -9.871 -8.491 -16.777 1.00 6.80 C ATOM 2017 NE ARG B 25 -10.762 -7.818 -15.827 1.00 7.63 N ATOM 2018 CZ ARG B 25 -11.778 -6.973 -16.035 1.00 8.60 C ATOM 2019 NH1 ARG B 25 -12.064 -6.530 -17.263 1.00 8.83 N ATOM 2020 NH2 ARG B 25 -12.486 -6.589 -14.971 1.00 9.86 N ATOM 0 H ARG B 25 -9.869 -11.625 -13.407 1.00 3.21 H new ATOM 0 HA ARG B 25 -11.456 -12.650 -15.523 1.00 3.70 H new ATOM 0 HB2 ARG B 25 -10.704 -11.220 -17.334 1.00 4.47 H new ATOM 0 HB3 ARG B 25 -11.612 -10.271 -16.174 1.00 4.47 H new ATOM 0 HG2 ARG B 25 -9.223 -9.740 -15.135 1.00 5.59 H new ATOM 0 HG3 ARG B 25 -8.623 -10.256 -16.698 1.00 5.59 H new ATOM 0 HD2 ARG B 25 -8.978 -7.891 -16.953 1.00 6.80 H new ATOM 0 HD3 ARG B 25 -10.365 -8.618 -17.740 1.00 6.80 H new ATOM 0 HE ARG B 25 -10.577 -8.029 -14.846 1.00 7.63 H new ATOM 0 HH11 ARG B 25 -11.504 -6.836 -18.059 1.00 8.83 H new ATOM 0 HH12 ARG B 25 -12.842 -5.886 -17.404 1.00 8.83 H new ATOM 0 HH21 ARG B 25 -12.244 -6.939 -14.044 1.00 9.86 H new ATOM 0 HH22 ARG B 25 -13.269 -5.945 -15.085 1.00 9.86 H new ATOM 2034 N GLN B 26 -9.201 -13.555 -16.534 1.00 4.13 N ATOM 2035 CA GLN B 26 -7.943 -14.102 -17.020 1.00 4.55 C ATOM 2036 C GLN B 26 -7.556 -13.265 -18.243 1.00 4.13 C ATOM 2037 O GLN B 26 -7.720 -13.697 -19.382 1.00 4.91 O ATOM 2038 CB GLN B 26 -8.112 -15.605 -17.316 1.00 6.18 C ATOM 2039 CG GLN B 26 -6.778 -16.368 -17.306 1.00 7.19 C ATOM 2040 CD GLN B 26 -5.782 -15.854 -18.340 1.00 7.69 C ATOM 2041 OE1 GLN B 26 -4.907 -15.058 -18.017 1.00 7.96 O ATOM 2042 NE2 GLN B 26 -5.903 -16.298 -19.587 1.00 8.49 N ATOM 0 H GLN B 26 -10.009 -13.853 -17.081 1.00 4.13 H new ATOM 0 HA GLN B 26 -7.138 -14.043 -16.287 1.00 4.55 H new ATOM 0 HB2 GLN B 26 -8.781 -16.043 -16.576 1.00 6.18 H new ATOM 0 HB3 GLN B 26 -8.588 -15.728 -18.289 1.00 6.18 H new ATOM 0 HG2 GLN B 26 -6.332 -16.294 -16.314 1.00 7.19 H new ATOM 0 HG3 GLN B 26 -6.970 -17.425 -17.491 1.00 7.19 H new ATOM 0 HE21 GLN B 26 -6.642 -16.960 -19.823 1.00 8.49 H new ATOM 0 HE22 GLN B 26 -5.257 -15.977 -20.308 1.00 8.49 H new ATOM 2051 N GLU B 27 -7.109 -12.035 -17.991 1.00 3.69 N ATOM 2052 CA GLU B 27 -6.656 -11.070 -18.979 1.00 3.70 C ATOM 2053 C GLU B 27 -5.710 -10.130 -18.227 1.00 3.35 C ATOM 2054 O GLU B 27 -5.722 -10.107 -16.995 1.00 4.56 O ATOM 2055 CB GLU B 27 -7.869 -10.374 -19.631 1.00 4.71 C ATOM 2056 CG GLU B 27 -7.545 -9.222 -20.594 1.00 5.56 C ATOM 2057 CD GLU B 27 -6.671 -9.665 -21.759 1.00 6.17 C ATOM 2058 OE1 GLU B 27 -5.435 -9.623 -21.569 1.00 6.67 O ATOM 2059 OE2 GLU B 27 -7.251 -10.034 -22.798 1.00 6.79 O ATOM 0 H GLU B 27 -7.052 -11.671 -17.040 1.00 3.69 H new ATOM 0 HA GLU B 27 -6.120 -11.518 -19.815 1.00 3.70 H new ATOM 0 HB2 GLU B 27 -8.445 -11.124 -20.173 1.00 4.71 H new ATOM 0 HB3 GLU B 27 -8.512 -9.990 -18.839 1.00 4.71 H new ATOM 0 HG2 GLU B 27 -8.474 -8.803 -20.980 1.00 5.56 H new ATOM 0 HG3 GLU B 27 -7.040 -8.426 -20.047 1.00 5.56 H new ATOM 2066 N GLY B 28 -4.849 -9.424 -18.955 1.00 2.64 N ATOM 2067 CA GLY B 28 -3.697 -8.741 -18.407 1.00 2.50 C ATOM 2068 C GLY B 28 -4.020 -7.486 -17.596 1.00 2.28 C ATOM 2069 O GLY B 28 -5.169 -7.055 -17.428 1.00 2.66 O ATOM 0 H GLY B 28 -4.941 -9.313 -19.965 1.00 2.64 H new ATOM 0 HA2 GLY B 28 -3.149 -9.436 -17.771 1.00 2.50 H new ATOM 0 HA3 GLY B 28 -3.032 -8.466 -19.226 1.00 2.50 H new ATOM 2073 N ARG B 29 -2.949 -6.861 -17.110 1.00 2.00 N ATOM 2074 CA ARG B 29 -2.998 -5.598 -16.410 1.00 1.87 C ATOM 2075 C ARG B 29 -1.903 -4.707 -16.975 1.00 1.57 C ATOM 2076 O ARG B 29 -0.770 -5.157 -17.142 1.00 1.60 O ATOM 2077 CB ARG B 29 -2.852 -5.836 -14.904 1.00 2.20 C ATOM 2078 CG ARG B 29 -3.497 -4.719 -14.079 1.00 3.71 C ATOM 2079 CD ARG B 29 -5.026 -4.685 -14.250 1.00 5.51 C ATOM 2080 NE ARG B 29 -5.466 -3.547 -15.075 1.00 7.36 N ATOM 2081 CZ ARG B 29 -6.236 -3.567 -16.175 1.00 8.87 C ATOM 2082 NH1 ARG B 29 -6.486 -4.695 -16.860 1.00 8.92 N ATOM 2083 NH2 ARG B 29 -6.735 -2.398 -16.588 1.00 10.76 N ATOM 0 H ARG B 29 -2.005 -7.236 -17.199 1.00 2.00 H new ATOM 0 HA ARG B 29 -3.956 -5.098 -16.553 1.00 1.87 H new ATOM 0 HB2 ARG B 29 -3.310 -6.790 -14.642 1.00 2.20 H new ATOM 0 HB3 ARG B 29 -1.795 -5.909 -14.650 1.00 2.20 H new ATOM 0 HG2 ARG B 29 -3.253 -4.859 -13.026 1.00 3.71 H new ATOM 0 HG3 ARG B 29 -3.077 -3.759 -14.378 1.00 3.71 H new ATOM 0 HD2 ARG B 29 -5.360 -5.616 -14.709 1.00 5.51 H new ATOM 0 HD3 ARG B 29 -5.499 -4.626 -13.270 1.00 5.51 H new ATOM 0 HE ARG B 29 -5.145 -2.627 -14.773 1.00 7.36 H new ATOM 0 HH11 ARG B 29 -6.085 -5.580 -16.549 1.00 8.92 H new ATOM 0 HH12 ARG B 29 -7.077 -4.667 -17.691 1.00 8.92 H new ATOM 0 HH21 ARG B 29 -6.525 -1.543 -16.073 1.00 10.76 H new ATOM 0 HH22 ARG B 29 -7.326 -2.361 -17.419 1.00 10.76 H new ATOM 2097 N LYS B 30 -2.272 -3.470 -17.312 1.00 1.68 N ATOM 2098 CA LYS B 30 -1.334 -2.423 -17.645 1.00 1.82 C ATOM 2099 C LYS B 30 -0.862 -1.869 -16.299 1.00 1.68 C ATOM 2100 O LYS B 30 -0.268 -2.590 -15.499 1.00 2.42 O ATOM 2101 CB LYS B 30 -2.040 -1.373 -18.522 1.00 2.27 C ATOM 2102 CG LYS B 30 -2.569 -1.920 -19.856 1.00 2.42 C ATOM 2103 CD LYS B 30 -3.378 -0.834 -20.590 1.00 2.91 C ATOM 2104 CE LYS B 30 -4.796 -0.696 -20.008 1.00 3.00 C ATOM 2105 NZ LYS B 30 -5.510 0.496 -20.503 1.00 3.80 N ATOM 0 H LYS B 30 -3.247 -3.174 -17.359 1.00 1.68 H new ATOM 0 HA LYS B 30 -0.477 -2.765 -18.225 1.00 1.82 H new ATOM 0 HB2 LYS B 30 -2.872 -0.948 -17.961 1.00 2.27 H new ATOM 0 HB3 LYS B 30 -1.344 -0.559 -18.726 1.00 2.27 H new ATOM 0 HG2 LYS B 30 -1.737 -2.248 -20.479 1.00 2.42 H new ATOM 0 HG3 LYS B 30 -3.196 -2.793 -19.677 1.00 2.42 H new ATOM 0 HD2 LYS B 30 -2.858 0.121 -20.515 1.00 2.91 H new ATOM 0 HD3 LYS B 30 -3.441 -1.080 -21.650 1.00 2.91 H new ATOM 0 HE2 LYS B 30 -5.373 -1.587 -20.256 1.00 3.00 H new ATOM 0 HE3 LYS B 30 -4.733 -0.650 -18.921 1.00 3.00 H new ATOM 0 HZ1 LYS B 30 -6.458 0.535 -20.077 1.00 3.80 H new ATOM 0 HZ2 LYS B 30 -4.978 1.352 -20.244 1.00 3.80 H new ATOM 0 HZ3 LYS B 30 -5.598 0.443 -21.538 1.00 3.80 H new ATOM 2119 N ASP B 31 -1.196 -0.612 -16.021 1.00 1.74 N ATOM 2120 CA ASP B 31 -0.824 0.083 -14.814 1.00 1.79 C ATOM 2121 C ASP B 31 -1.828 -0.213 -13.695 1.00 1.63 C ATOM 2122 O ASP B 31 -1.448 -0.636 -12.606 1.00 2.19 O ATOM 2123 CB ASP B 31 -0.738 1.603 -15.066 1.00 1.94 C ATOM 2124 CG ASP B 31 -0.514 2.083 -16.500 1.00 2.89 C ATOM 2125 OD1 ASP B 31 -1.238 1.595 -17.394 1.00 3.77 O ATOM 2126 OD2 ASP B 31 0.290 3.027 -16.671 1.00 3.83 O ATOM 0 H ASP B 31 -1.751 -0.039 -16.657 1.00 1.74 H new ATOM 0 HA ASP B 31 0.159 -0.272 -14.504 1.00 1.79 H new ATOM 0 HB2 ASP B 31 -1.662 2.054 -14.704 1.00 1.94 H new ATOM 0 HB3 ASP B 31 0.071 1.998 -14.452 1.00 1.94 H new ATOM 2131 N SER B 32 -3.109 0.080 -13.945 1.00 1.17 N ATOM 2132 CA SER B 32 -4.181 0.013 -12.961 1.00 1.12 C ATOM 2133 C SER B 32 -5.525 -0.165 -13.679 1.00 0.93 C ATOM 2134 O SER B 32 -5.591 -0.819 -14.727 1.00 0.99 O ATOM 2135 CB SER B 32 -4.136 1.282 -12.089 1.00 1.27 C ATOM 2136 OG SER B 32 -5.052 1.241 -11.008 1.00 1.88 O ATOM 0 H SER B 32 -3.432 0.378 -14.866 1.00 1.17 H new ATOM 0 HA SER B 32 -4.055 -0.846 -12.303 1.00 1.12 H new ATOM 0 HB2 SER B 32 -3.127 1.413 -11.699 1.00 1.27 H new ATOM 0 HB3 SER B 32 -4.353 2.151 -12.710 1.00 1.27 H new ATOM 0 HG SER B 32 -4.873 1.988 -10.399 1.00 1.88 H new ATOM 2142 N LEU B 33 -6.590 0.396 -13.098 1.00 0.88 N ATOM 2143 CA LEU B 33 -7.922 0.501 -13.672 1.00 0.86 C ATOM 2144 C LEU B 33 -8.233 1.978 -13.941 1.00 0.83 C ATOM 2145 O LEU B 33 -7.394 2.858 -13.722 1.00 0.98 O ATOM 2146 CB LEU B 33 -9.004 -0.082 -12.739 1.00 0.85 C ATOM 2147 CG LEU B 33 -8.732 -1.411 -12.013 1.00 1.00 C ATOM 2148 CD1 LEU B 33 -7.999 -2.459 -12.856 1.00 1.84 C ATOM 2149 CD2 LEU B 33 -8.012 -1.177 -10.683 1.00 1.39 C ATOM 0 H LEU B 33 -6.536 0.808 -12.167 1.00 0.88 H new ATOM 0 HA LEU B 33 -7.935 -0.075 -14.597 1.00 0.86 H new ATOM 0 HB2 LEU B 33 -9.221 0.669 -11.979 1.00 0.85 H new ATOM 0 HB3 LEU B 33 -9.912 -0.210 -13.329 1.00 0.85 H new ATOM 0 HG LEU B 33 -9.717 -1.835 -11.818 1.00 1.00 H new ATOM 0 HD11 LEU B 33 -7.850 -3.362 -12.265 1.00 1.84 H new ATOM 0 HD12 LEU B 33 -8.593 -2.697 -13.738 1.00 1.84 H new ATOM 0 HD13 LEU B 33 -7.031 -2.065 -13.166 1.00 1.84 H new ATOM 0 HD21 LEU B 33 -7.833 -2.134 -10.193 1.00 1.39 H new ATOM 0 HD22 LEU B 33 -7.059 -0.680 -10.867 1.00 1.39 H new ATOM 0 HD23 LEU B 33 -8.630 -0.550 -10.040 1.00 1.39 H new ATOM 2161 N SER B 34 -9.467 2.239 -14.377 1.00 0.78 N ATOM 2162 CA SER B 34 -10.018 3.573 -14.522 1.00 0.74 C ATOM 2163 C SER B 34 -10.302 4.171 -13.141 1.00 0.72 C ATOM 2164 O SER B 34 -10.405 3.439 -12.156 1.00 0.73 O ATOM 2165 CB SER B 34 -11.241 3.525 -15.446 1.00 0.83 C ATOM 2166 OG SER B 34 -11.813 2.227 -15.425 1.00 2.11 O ATOM 0 H SER B 34 -10.122 1.504 -14.644 1.00 0.78 H new ATOM 0 HA SER B 34 -9.300 4.241 -14.998 1.00 0.74 H new ATOM 0 HB2 SER B 34 -11.978 4.262 -15.126 1.00 0.83 H new ATOM 0 HB3 SER B 34 -10.949 3.787 -16.463 1.00 0.83 H new ATOM 0 HG SER B 34 -12.594 2.204 -16.016 1.00 2.11 H new ATOM 2172 N VAL B 35 -10.387 5.499 -13.040 1.00 0.79 N ATOM 2173 CA VAL B 35 -10.304 6.151 -11.737 1.00 0.81 C ATOM 2174 C VAL B 35 -11.529 5.853 -10.858 1.00 0.72 C ATOM 2175 O VAL B 35 -11.411 5.293 -9.766 1.00 0.69 O ATOM 2176 CB VAL B 35 -10.121 7.664 -11.911 1.00 1.00 C ATOM 2177 CG1 VAL B 35 -9.787 8.291 -10.564 1.00 1.02 C ATOM 2178 CG2 VAL B 35 -9.017 8.073 -12.897 1.00 1.24 C ATOM 0 H VAL B 35 -10.511 6.132 -13.830 1.00 0.79 H new ATOM 0 HA VAL B 35 -9.434 5.742 -11.223 1.00 0.81 H new ATOM 0 HB VAL B 35 -11.066 8.020 -12.322 1.00 1.00 H new ATOM 0 HG11 VAL B 35 -9.657 9.366 -10.686 1.00 1.02 H new ATOM 0 HG12 VAL B 35 -10.600 8.101 -9.863 1.00 1.02 H new ATOM 0 HG13 VAL B 35 -8.865 7.855 -10.178 1.00 1.02 H new ATOM 0 HG21 VAL B 35 -8.963 9.160 -12.953 1.00 1.24 H new ATOM 0 HG22 VAL B 35 -8.060 7.680 -12.555 1.00 1.24 H new ATOM 0 HG23 VAL B 35 -9.243 7.670 -13.884 1.00 1.24 H new ATOM 2188 N ASN B 36 -12.721 6.251 -11.310 1.00 0.81 N ATOM 2189 CA ASN B 36 -13.939 6.033 -10.534 1.00 0.92 C ATOM 2190 C ASN B 36 -14.161 4.531 -10.329 1.00 0.88 C ATOM 2191 O ASN B 36 -14.493 4.105 -9.228 1.00 0.92 O ATOM 2192 CB ASN B 36 -15.174 6.682 -11.182 1.00 1.23 C ATOM 2193 CG ASN B 36 -15.891 7.610 -10.202 1.00 2.51 C ATOM 2194 OD1 ASN B 36 -16.791 7.200 -9.473 1.00 3.46 O ATOM 2195 ND2 ASN B 36 -15.485 8.875 -10.147 1.00 3.01 N ATOM 0 H ASN B 36 -12.866 6.722 -12.203 1.00 0.81 H new ATOM 0 HA ASN B 36 -13.805 6.517 -9.566 1.00 0.92 H new ATOM 0 HB2 ASN B 36 -14.871 7.245 -12.064 1.00 1.23 H new ATOM 0 HB3 ASN B 36 -15.861 5.906 -11.520 1.00 1.23 H new ATOM 0 HD21 ASN B 36 -15.922 9.523 -9.492 1.00 3.01 H new ATOM 0 HD22 ASN B 36 -14.736 9.197 -10.760 1.00 3.01 H new ATOM 2202 N GLU B 37 -13.948 3.748 -11.397 1.00 0.88 N ATOM 2203 CA GLU B 37 -13.956 2.285 -11.390 1.00 0.90 C ATOM 2204 C GLU B 37 -13.161 1.774 -10.190 1.00 0.83 C ATOM 2205 O GLU B 37 -13.716 1.114 -9.316 1.00 0.90 O ATOM 2206 CB GLU B 37 -13.387 1.783 -12.731 1.00 1.00 C ATOM 2207 CG GLU B 37 -12.935 0.311 -12.780 1.00 1.37 C ATOM 2208 CD GLU B 37 -14.060 -0.702 -12.614 1.00 2.51 C ATOM 2209 OE1 GLU B 37 -15.232 -0.287 -12.715 1.00 3.39 O ATOM 2210 OE2 GLU B 37 -13.710 -1.887 -12.423 1.00 3.90 O ATOM 0 H GLU B 37 -13.759 4.135 -12.322 1.00 0.88 H new ATOM 0 HA GLU B 37 -14.971 1.900 -11.289 1.00 0.90 H new ATOM 0 HB2 GLU B 37 -14.145 1.933 -13.500 1.00 1.00 H new ATOM 0 HB3 GLU B 37 -12.536 2.410 -12.996 1.00 1.00 H new ATOM 0 HG2 GLU B 37 -12.437 0.129 -13.732 1.00 1.37 H new ATOM 0 HG3 GLU B 37 -12.195 0.145 -11.997 1.00 1.37 H new ATOM 2217 N PHE B 38 -11.871 2.123 -10.124 1.00 0.74 N ATOM 2218 CA PHE B 38 -11.011 1.829 -8.985 1.00 0.68 C ATOM 2219 C PHE B 38 -11.725 2.155 -7.670 1.00 0.66 C ATOM 2220 O PHE B 38 -11.830 1.290 -6.800 1.00 0.66 O ATOM 2221 CB PHE B 38 -9.675 2.580 -9.126 1.00 0.66 C ATOM 2222 CG PHE B 38 -9.011 2.946 -7.815 1.00 0.89 C ATOM 2223 CD1 PHE B 38 -8.349 1.960 -7.067 1.00 1.50 C ATOM 2224 CD2 PHE B 38 -9.201 4.229 -7.265 1.00 2.13 C ATOM 2225 CE1 PHE B 38 -7.807 2.277 -5.811 1.00 1.66 C ATOM 2226 CE2 PHE B 38 -8.719 4.524 -5.980 1.00 2.45 C ATOM 2227 CZ PHE B 38 -7.993 3.560 -5.265 1.00 1.66 C ATOM 0 H PHE B 38 -11.394 2.624 -10.873 1.00 0.74 H new ATOM 0 HA PHE B 38 -10.788 0.762 -8.968 1.00 0.68 H new ATOM 0 HB2 PHE B 38 -8.988 1.964 -9.706 1.00 0.66 H new ATOM 0 HB3 PHE B 38 -9.846 3.492 -9.698 1.00 0.66 H new ATOM 0 HD1 PHE B 38 -8.256 0.957 -7.458 1.00 1.50 H new ATOM 0 HD2 PHE B 38 -9.719 4.987 -7.833 1.00 2.13 H new ATOM 0 HE1 PHE B 38 -7.246 1.534 -5.263 1.00 1.66 H new ATOM 0 HE2 PHE B 38 -8.907 5.493 -5.542 1.00 2.45 H new ATOM 0 HZ PHE B 38 -7.578 3.802 -4.298 1.00 1.66 H new ATOM 2237 N LYS B 39 -12.223 3.389 -7.529 1.00 0.68 N ATOM 2238 CA LYS B 39 -12.907 3.812 -6.314 1.00 0.70 C ATOM 2239 C LYS B 39 -14.052 2.852 -5.958 1.00 0.77 C ATOM 2240 O LYS B 39 -14.117 2.372 -4.824 1.00 0.83 O ATOM 2241 CB LYS B 39 -13.267 5.314 -6.368 1.00 0.85 C ATOM 2242 CG LYS B 39 -14.563 5.750 -5.654 1.00 0.91 C ATOM 2243 CD LYS B 39 -15.648 5.985 -6.713 1.00 1.66 C ATOM 2244 CE LYS B 39 -17.008 6.400 -6.134 1.00 2.42 C ATOM 2245 NZ LYS B 39 -18.039 6.496 -7.194 1.00 3.57 N ATOM 0 H LYS B 39 -12.162 4.110 -8.248 1.00 0.68 H new ATOM 0 HA LYS B 39 -12.228 3.737 -5.464 1.00 0.70 H new ATOM 0 HB2 LYS B 39 -12.438 5.877 -5.939 1.00 0.85 H new ATOM 0 HB3 LYS B 39 -13.342 5.607 -7.415 1.00 0.85 H new ATOM 0 HG2 LYS B 39 -14.883 4.983 -4.948 1.00 0.91 H new ATOM 0 HG3 LYS B 39 -14.391 6.660 -5.080 1.00 0.91 H new ATOM 0 HD2 LYS B 39 -15.307 6.758 -7.402 1.00 1.66 H new ATOM 0 HD3 LYS B 39 -15.776 5.073 -7.296 1.00 1.66 H new ATOM 0 HE2 LYS B 39 -17.322 5.675 -5.383 1.00 2.42 H new ATOM 0 HE3 LYS B 39 -16.912 7.361 -5.629 1.00 2.42 H new ATOM 0 HZ1 LYS B 39 -18.611 7.352 -7.045 1.00 3.57 H new ATOM 0 HZ2 LYS B 39 -17.577 6.546 -8.124 1.00 3.57 H new ATOM 0 HZ3 LYS B 39 -18.654 5.658 -7.157 1.00 3.57 H new ATOM 2259 N GLU B 40 -14.960 2.557 -6.890 1.00 0.83 N ATOM 2260 CA GLU B 40 -16.079 1.671 -6.585 1.00 0.92 C ATOM 2261 C GLU B 40 -15.590 0.254 -6.280 1.00 0.87 C ATOM 2262 O GLU B 40 -16.065 -0.374 -5.336 1.00 0.97 O ATOM 2263 CB GLU B 40 -17.154 1.728 -7.679 1.00 1.06 C ATOM 2264 CG GLU B 40 -17.591 3.189 -7.855 1.00 1.12 C ATOM 2265 CD GLU B 40 -19.021 3.385 -8.328 1.00 1.65 C ATOM 2266 OE1 GLU B 40 -19.625 2.424 -8.843 1.00 2.16 O ATOM 2267 OE2 GLU B 40 -19.467 4.539 -8.137 1.00 2.57 O ATOM 0 H GLU B 40 -14.942 2.913 -7.846 1.00 0.83 H new ATOM 0 HA GLU B 40 -16.565 2.026 -5.676 1.00 0.92 H new ATOM 0 HB2 GLU B 40 -16.762 1.334 -8.617 1.00 1.06 H new ATOM 0 HB3 GLU B 40 -18.007 1.108 -7.405 1.00 1.06 H new ATOM 0 HG2 GLU B 40 -17.466 3.706 -6.903 1.00 1.12 H new ATOM 0 HG3 GLU B 40 -16.921 3.668 -8.568 1.00 1.12 H new ATOM 2274 N LEU B 41 -14.602 -0.230 -7.031 1.00 0.78 N ATOM 2275 CA LEU B 41 -14.000 -1.537 -6.822 1.00 0.75 C ATOM 2276 C LEU B 41 -13.497 -1.661 -5.376 1.00 0.66 C ATOM 2277 O LEU B 41 -13.907 -2.570 -4.653 1.00 0.70 O ATOM 2278 CB LEU B 41 -12.894 -1.756 -7.869 1.00 0.81 C ATOM 2279 CG LEU B 41 -12.455 -3.221 -8.005 1.00 1.58 C ATOM 2280 CD1 LEU B 41 -13.499 -4.060 -8.755 1.00 1.78 C ATOM 2281 CD2 LEU B 41 -11.125 -3.283 -8.763 1.00 3.08 C ATOM 0 H LEU B 41 -14.195 0.285 -7.811 1.00 0.78 H new ATOM 0 HA LEU B 41 -14.739 -2.327 -6.959 1.00 0.75 H new ATOM 0 HB2 LEU B 41 -13.247 -1.400 -8.837 1.00 0.81 H new ATOM 0 HB3 LEU B 41 -12.028 -1.150 -7.603 1.00 0.81 H new ATOM 0 HG LEU B 41 -12.345 -3.633 -7.002 1.00 1.58 H new ATOM 0 HD11 LEU B 41 -13.152 -5.090 -8.831 1.00 1.78 H new ATOM 0 HD12 LEU B 41 -14.444 -4.035 -8.213 1.00 1.78 H new ATOM 0 HD13 LEU B 41 -13.644 -3.652 -9.755 1.00 1.78 H new ATOM 0 HD21 LEU B 41 -10.810 -4.322 -8.861 1.00 3.08 H new ATOM 0 HD22 LEU B 41 -11.250 -2.846 -9.754 1.00 3.08 H new ATOM 0 HD23 LEU B 41 -10.367 -2.725 -8.214 1.00 3.08 H new ATOM 2293 N VAL B 42 -12.655 -0.725 -4.918 1.00 0.62 N ATOM 2294 CA VAL B 42 -12.181 -0.764 -3.535 1.00 0.64 C ATOM 2295 C VAL B 42 -13.352 -0.598 -2.558 1.00 0.79 C ATOM 2296 O VAL B 42 -13.423 -1.319 -1.564 1.00 0.91 O ATOM 2297 CB VAL B 42 -10.995 0.184 -3.267 1.00 0.61 C ATOM 2298 CG1 VAL B 42 -9.824 -0.155 -4.198 1.00 1.54 C ATOM 2299 CG2 VAL B 42 -11.346 1.670 -3.393 1.00 1.63 C ATOM 0 H VAL B 42 -12.296 0.051 -5.474 1.00 0.62 H new ATOM 0 HA VAL B 42 -11.761 -1.754 -3.357 1.00 0.64 H new ATOM 0 HB VAL B 42 -10.712 0.022 -2.227 1.00 0.61 H new ATOM 0 HG11 VAL B 42 -8.993 0.522 -3.999 1.00 1.54 H new ATOM 0 HG12 VAL B 42 -9.505 -1.183 -4.023 1.00 1.54 H new ATOM 0 HG13 VAL B 42 -10.140 -0.045 -5.235 1.00 1.54 H new ATOM 0 HG21 VAL B 42 -10.460 2.272 -3.190 1.00 1.63 H new ATOM 0 HG22 VAL B 42 -11.701 1.876 -4.403 1.00 1.63 H new ATOM 0 HG23 VAL B 42 -12.127 1.921 -2.676 1.00 1.63 H new ATOM 2309 N THR B 43 -14.305 0.299 -2.845 1.00 0.89 N ATOM 2310 CA THR B 43 -15.498 0.428 -2.010 1.00 1.10 C ATOM 2311 C THR B 43 -16.158 -0.942 -1.803 1.00 1.09 C ATOM 2312 O THR B 43 -16.478 -1.314 -0.676 1.00 1.22 O ATOM 2313 CB THR B 43 -16.484 1.458 -2.587 1.00 1.33 C ATOM 2314 OG1 THR B 43 -15.847 2.710 -2.738 1.00 2.64 O ATOM 2315 CG2 THR B 43 -17.691 1.666 -1.669 1.00 1.90 C ATOM 0 H THR B 43 -14.271 0.937 -3.640 1.00 0.89 H new ATOM 0 HA THR B 43 -15.191 0.803 -1.033 1.00 1.10 H new ATOM 0 HB THR B 43 -16.820 1.068 -3.548 1.00 1.33 H new ATOM 0 HG1 THR B 43 -15.239 2.677 -3.506 1.00 2.64 H new ATOM 0 HG21 THR B 43 -18.363 2.401 -2.112 1.00 1.90 H new ATOM 0 HG22 THR B 43 -18.219 0.721 -1.542 1.00 1.90 H new ATOM 0 HG23 THR B 43 -17.352 2.025 -0.697 1.00 1.90 H new ATOM 2323 N GLN B 44 -16.334 -1.711 -2.881 1.00 1.03 N ATOM 2324 CA GLN B 44 -16.864 -3.061 -2.781 1.00 1.07 C ATOM 2325 C GLN B 44 -15.933 -3.956 -1.958 1.00 1.06 C ATOM 2326 O GLN B 44 -16.411 -4.681 -1.086 1.00 1.15 O ATOM 2327 CB GLN B 44 -17.124 -3.651 -4.173 1.00 1.10 C ATOM 2328 CG GLN B 44 -18.270 -2.926 -4.890 1.00 1.67 C ATOM 2329 CD GLN B 44 -18.475 -3.478 -6.295 1.00 2.32 C ATOM 2330 OE1 GLN B 44 -18.198 -2.810 -7.284 1.00 3.45 O ATOM 2331 NE2 GLN B 44 -18.964 -4.711 -6.400 1.00 2.83 N ATOM 0 H GLN B 44 -16.115 -1.415 -3.832 1.00 1.03 H new ATOM 0 HA GLN B 44 -17.820 -3.013 -2.259 1.00 1.07 H new ATOM 0 HB2 GLN B 44 -16.217 -3.581 -4.773 1.00 1.10 H new ATOM 0 HB3 GLN B 44 -17.364 -4.710 -4.081 1.00 1.10 H new ATOM 0 HG2 GLN B 44 -19.190 -3.036 -4.315 1.00 1.67 H new ATOM 0 HG3 GLN B 44 -18.053 -1.859 -4.943 1.00 1.67 H new ATOM 0 HE21 GLN B 44 -19.186 -5.245 -5.560 1.00 2.83 H new ATOM 0 HE22 GLN B 44 -19.117 -5.122 -7.321 1.00 2.83 H new ATOM 2340 N GLN B 45 -14.619 -3.938 -2.227 1.00 1.00 N ATOM 2341 CA GLN B 45 -13.704 -4.835 -1.525 1.00 1.03 C ATOM 2342 C GLN B 45 -13.626 -4.605 -0.018 1.00 1.03 C ATOM 2343 O GLN B 45 -13.191 -5.526 0.661 1.00 1.05 O ATOM 2344 CB GLN B 45 -12.266 -4.823 -2.070 1.00 1.06 C ATOM 2345 CG GLN B 45 -11.984 -5.915 -3.120 1.00 0.91 C ATOM 2346 CD GLN B 45 -11.940 -5.371 -4.546 1.00 1.37 C ATOM 2347 OE1 GLN B 45 -11.395 -4.302 -4.795 1.00 2.50 O ATOM 2348 NE2 GLN B 45 -12.476 -6.119 -5.507 1.00 1.78 N ATOM 0 H GLN B 45 -14.178 -3.324 -2.912 1.00 1.00 H new ATOM 0 HA GLN B 45 -14.157 -5.808 -1.717 1.00 1.03 H new ATOM 0 HB2 GLN B 45 -12.064 -3.847 -2.512 1.00 1.06 H new ATOM 0 HB3 GLN B 45 -11.572 -4.945 -1.238 1.00 1.06 H new ATOM 0 HG2 GLN B 45 -11.033 -6.396 -2.890 1.00 0.91 H new ATOM 0 HG3 GLN B 45 -12.754 -6.684 -3.053 1.00 0.91 H new ATOM 0 HE21 GLN B 45 -12.924 -7.005 -5.274 1.00 1.78 H new ATOM 0 HE22 GLN B 45 -12.439 -5.806 -6.477 1.00 1.78 H new ATOM 2357 N LEU B 46 -13.950 -3.425 0.518 1.00 1.02 N ATOM 2358 CA LEU B 46 -13.769 -3.178 1.949 1.00 0.95 C ATOM 2359 C LEU B 46 -15.105 -3.180 2.719 1.00 0.98 C ATOM 2360 O LEU B 46 -15.515 -2.137 3.227 1.00 1.06 O ATOM 2361 CB LEU B 46 -12.939 -1.897 2.154 1.00 0.96 C ATOM 2362 CG LEU B 46 -11.456 -2.070 1.750 1.00 0.97 C ATOM 2363 CD1 LEU B 46 -11.163 -1.790 0.276 1.00 1.13 C ATOM 2364 CD2 LEU B 46 -10.581 -1.142 2.593 1.00 1.58 C ATOM 0 H LEU B 46 -14.332 -2.639 -0.007 1.00 1.02 H new ATOM 0 HA LEU B 46 -13.205 -4.005 2.381 1.00 0.95 H new ATOM 0 HB2 LEU B 46 -13.378 -1.088 1.569 1.00 0.96 H new ATOM 0 HB3 LEU B 46 -12.993 -1.599 3.201 1.00 0.96 H new ATOM 0 HG LEU B 46 -11.229 -3.121 1.927 1.00 0.97 H new ATOM 0 HD11 LEU B 46 -10.100 -1.936 0.082 1.00 1.13 H new ATOM 0 HD12 LEU B 46 -11.742 -2.472 -0.346 1.00 1.13 H new ATOM 0 HD13 LEU B 46 -11.437 -0.762 0.039 1.00 1.13 H new ATOM 0 HD21 LEU B 46 -9.537 -1.266 2.306 1.00 1.58 H new ATOM 0 HD22 LEU B 46 -10.882 -0.108 2.427 1.00 1.58 H new ATOM 0 HD23 LEU B 46 -10.699 -1.389 3.648 1.00 1.58 H new ATOM 2376 N PRO B 47 -15.813 -4.322 2.847 1.00 0.95 N ATOM 2377 CA PRO B 47 -17.176 -4.352 3.352 1.00 0.95 C ATOM 2378 C PRO B 47 -17.319 -4.091 4.850 1.00 1.01 C ATOM 2379 O PRO B 47 -18.413 -3.687 5.238 1.00 1.34 O ATOM 2380 CB PRO B 47 -17.714 -5.749 3.022 1.00 1.01 C ATOM 2381 CG PRO B 47 -16.454 -6.606 3.030 1.00 0.97 C ATOM 2382 CD PRO B 47 -15.451 -5.653 2.391 1.00 0.91 C ATOM 0 HA PRO B 47 -17.731 -3.541 2.881 1.00 0.95 H new ATOM 0 HB2 PRO B 47 -18.439 -6.089 3.762 1.00 1.01 H new ATOM 0 HB3 PRO B 47 -18.213 -5.772 2.053 1.00 1.01 H new ATOM 0 HG2 PRO B 47 -16.161 -6.899 4.038 1.00 0.97 H new ATOM 0 HG3 PRO B 47 -16.576 -7.524 2.454 1.00 0.97 H new ATOM 0 HD2 PRO B 47 -14.432 -5.903 2.688 1.00 0.91 H new ATOM 0 HD3 PRO B 47 -15.491 -5.717 1.304 1.00 0.91 H new ATOM 2390 N HIS B 48 -16.296 -4.383 5.672 1.00 1.22 N ATOM 2391 CA HIS B 48 -16.412 -4.486 7.135 1.00 1.50 C ATOM 2392 C HIS B 48 -17.169 -3.315 7.788 1.00 1.65 C ATOM 2393 O HIS B 48 -17.883 -3.531 8.767 1.00 2.60 O ATOM 2394 CB HIS B 48 -15.050 -4.730 7.790 1.00 2.05 C ATOM 2395 CG HIS B 48 -14.058 -3.619 7.611 1.00 1.40 C ATOM 2396 ND1 HIS B 48 -13.300 -3.411 6.487 1.00 2.76 N ATOM 2397 CD2 HIS B 48 -13.584 -2.793 8.592 1.00 1.96 C ATOM 2398 CE1 HIS B 48 -12.398 -2.466 6.777 1.00 3.53 C ATOM 2399 NE2 HIS B 48 -12.519 -2.071 8.055 1.00 2.85 N ATOM 0 H HIS B 48 -15.350 -4.557 5.332 1.00 1.22 H new ATOM 0 HA HIS B 48 -17.034 -5.362 7.321 1.00 1.50 H new ATOM 0 HB2 HIS B 48 -15.200 -4.896 8.857 1.00 2.05 H new ATOM 0 HB3 HIS B 48 -14.625 -5.647 7.382 1.00 2.05 H new ATOM 0 HD1 HIS B 48 -13.405 -3.890 5.592 1.00 2.76 H new ATOM 0 HD2 HIS B 48 -13.965 -2.714 9.599 1.00 1.96 H new ATOM 0 HE1 HIS B 48 -11.672 -2.075 6.079 1.00 3.53 H new ATOM 2407 N LEU B 49 -17.040 -2.088 7.256 1.00 1.29 N ATOM 2408 CA LEU B 49 -17.931 -0.985 7.629 1.00 1.33 C ATOM 2409 C LEU B 49 -18.132 -0.017 6.454 1.00 1.30 C ATOM 2410 O LEU B 49 -19.259 0.141 5.990 1.00 1.46 O ATOM 2411 CB LEU B 49 -17.425 -0.282 8.905 1.00 1.35 C ATOM 2412 CG LEU B 49 -18.497 0.421 9.761 1.00 1.54 C ATOM 2413 CD1 LEU B 49 -19.263 1.513 9.006 1.00 2.11 C ATOM 2414 CD2 LEU B 49 -19.477 -0.570 10.403 1.00 2.98 C ATOM 0 H LEU B 49 -16.329 -1.839 6.569 1.00 1.29 H new ATOM 0 HA LEU B 49 -18.914 -1.393 7.864 1.00 1.33 H new ATOM 0 HB2 LEU B 49 -16.920 -1.021 9.527 1.00 1.35 H new ATOM 0 HB3 LEU B 49 -16.677 0.457 8.616 1.00 1.35 H new ATOM 0 HG LEU B 49 -17.937 0.913 10.556 1.00 1.54 H new ATOM 0 HD11 LEU B 49 -20.001 1.965 9.669 1.00 2.11 H new ATOM 0 HD12 LEU B 49 -18.565 2.278 8.665 1.00 2.11 H new ATOM 0 HD13 LEU B 49 -19.769 1.074 8.146 1.00 2.11 H new ATOM 0 HD21 LEU B 49 -20.211 -0.024 10.995 1.00 2.98 H new ATOM 0 HD22 LEU B 49 -19.987 -1.134 9.623 1.00 2.98 H new ATOM 0 HD23 LEU B 49 -18.929 -1.257 11.048 1.00 2.98 H new ATOM 2426 N LEU B 50 -17.057 0.615 5.963 1.00 1.25 N ATOM 2427 CA LEU B 50 -17.078 1.581 4.874 1.00 1.30 C ATOM 2428 C LEU B 50 -17.588 2.937 5.373 1.00 1.23 C ATOM 2429 O LEU B 50 -18.705 3.358 5.086 1.00 1.53 O ATOM 2430 CB LEU B 50 -17.813 1.046 3.630 1.00 1.59 C ATOM 2431 CG LEU B 50 -17.200 1.568 2.322 1.00 1.86 C ATOM 2432 CD1 LEU B 50 -16.914 3.073 2.354 1.00 3.65 C ATOM 2433 CD2 LEU B 50 -15.917 0.797 1.997 1.00 2.37 C ATOM 0 H LEU B 50 -16.119 0.457 6.332 1.00 1.25 H new ATOM 0 HA LEU B 50 -16.056 1.743 4.532 1.00 1.30 H new ATOM 0 HB2 LEU B 50 -17.783 -0.044 3.633 1.00 1.59 H new ATOM 0 HB3 LEU B 50 -18.863 1.336 3.678 1.00 1.59 H new ATOM 0 HG LEU B 50 -17.941 1.403 1.540 1.00 1.86 H new ATOM 0 HD11 LEU B 50 -16.482 3.382 1.402 1.00 3.65 H new ATOM 0 HD12 LEU B 50 -17.843 3.616 2.524 1.00 3.65 H new ATOM 0 HD13 LEU B 50 -16.213 3.293 3.159 1.00 3.65 H new ATOM 0 HD21 LEU B 50 -15.491 1.175 1.068 1.00 2.37 H new ATOM 0 HD22 LEU B 50 -15.198 0.929 2.806 1.00 2.37 H new ATOM 0 HD23 LEU B 50 -16.148 -0.263 1.886 1.00 2.37 H new ATOM 2445 N LYS B 51 -16.746 3.612 6.157 1.00 1.00 N ATOM 2446 CA LYS B 51 -17.047 4.915 6.728 1.00 1.04 C ATOM 2447 C LYS B 51 -16.789 6.072 5.750 1.00 0.99 C ATOM 2448 O LYS B 51 -17.578 7.009 5.735 1.00 1.09 O ATOM 2449 CB LYS B 51 -16.312 5.065 8.071 1.00 1.20 C ATOM 2450 CG LYS B 51 -14.789 5.188 7.923 1.00 1.28 C ATOM 2451 CD LYS B 51 -14.337 6.662 7.835 1.00 1.60 C ATOM 2452 CE LYS B 51 -13.700 7.238 9.119 1.00 2.10 C ATOM 2453 NZ LYS B 51 -12.398 7.897 8.851 1.00 3.90 N ATOM 0 H LYS B 51 -15.824 3.259 6.414 1.00 1.00 H new ATOM 0 HA LYS B 51 -18.118 4.972 6.924 1.00 1.04 H new ATOM 0 HB2 LYS B 51 -16.692 5.946 8.588 1.00 1.20 H new ATOM 0 HB3 LYS B 51 -16.540 4.204 8.699 1.00 1.20 H new ATOM 0 HG2 LYS B 51 -14.302 4.709 8.772 1.00 1.28 H new ATOM 0 HG3 LYS B 51 -14.467 4.655 7.028 1.00 1.28 H new ATOM 0 HD2 LYS B 51 -13.619 6.756 7.020 1.00 1.60 H new ATOM 0 HD3 LYS B 51 -15.200 7.274 7.572 1.00 1.60 H new ATOM 0 HE2 LYS B 51 -14.383 7.957 9.571 1.00 2.10 H new ATOM 0 HE3 LYS B 51 -13.557 6.436 9.843 1.00 2.10 H new ATOM 0 HZ1 LYS B 51 -12.015 8.283 9.738 1.00 3.90 H new ATOM 0 HZ2 LYS B 51 -11.731 7.202 8.460 1.00 3.90 H new ATOM 0 HZ3 LYS B 51 -12.534 8.669 8.167 1.00 3.90 H new ATOM 2467 N ASP B 52 -15.641 6.047 5.045 1.00 0.96 N ATOM 2468 CA ASP B 52 -15.075 7.126 4.228 1.00 0.96 C ATOM 2469 C ASP B 52 -15.492 8.536 4.669 1.00 0.93 C ATOM 2470 O ASP B 52 -16.452 9.107 4.168 1.00 1.13 O ATOM 2471 CB ASP B 52 -15.148 6.855 2.712 1.00 1.29 C ATOM 2472 CG ASP B 52 -14.006 5.972 2.199 1.00 2.03 C ATOM 2473 OD1 ASP B 52 -13.844 4.885 2.797 1.00 2.24 O ATOM 2474 OD2 ASP B 52 -13.280 6.408 1.264 1.00 3.29 O ATOM 0 H ASP B 52 -15.050 5.216 5.034 1.00 0.96 H new ATOM 0 HA ASP B 52 -14.006 7.115 4.439 1.00 0.96 H new ATOM 0 HB2 ASP B 52 -16.100 6.377 2.481 1.00 1.29 H new ATOM 0 HB3 ASP B 52 -15.131 7.805 2.179 1.00 1.29 H new ATOM 2479 N VAL B 53 -14.719 9.123 5.586 1.00 0.92 N ATOM 2480 CA VAL B 53 -14.667 10.551 5.837 1.00 1.05 C ATOM 2481 C VAL B 53 -13.270 10.812 6.399 1.00 1.21 C ATOM 2482 O VAL B 53 -12.747 9.955 7.122 1.00 1.83 O ATOM 2483 CB VAL B 53 -15.810 11.024 6.758 1.00 1.68 C ATOM 2484 CG1 VAL B 53 -15.778 10.407 8.160 1.00 2.38 C ATOM 2485 CG2 VAL B 53 -15.785 12.552 6.879 1.00 2.81 C ATOM 0 H VAL B 53 -14.093 8.592 6.191 1.00 0.92 H new ATOM 0 HA VAL B 53 -14.824 11.132 4.929 1.00 1.05 H new ATOM 0 HB VAL B 53 -16.732 10.683 6.288 1.00 1.68 H new ATOM 0 HG11 VAL B 53 -16.614 10.790 8.745 1.00 2.38 H new ATOM 0 HG12 VAL B 53 -15.856 9.323 8.082 1.00 2.38 H new ATOM 0 HG13 VAL B 53 -14.841 10.669 8.651 1.00 2.38 H new ATOM 0 HG21 VAL B 53 -16.595 12.879 7.531 1.00 2.81 H new ATOM 0 HG22 VAL B 53 -14.831 12.868 7.300 1.00 2.81 H new ATOM 0 HG23 VAL B 53 -15.912 12.997 5.892 1.00 2.81 H new ATOM 2495 N GLY B 54 -12.661 11.942 6.033 1.00 1.34 N ATOM 2496 CA GLY B 54 -11.302 12.300 6.402 1.00 1.88 C ATOM 2497 C GLY B 54 -10.570 12.777 5.153 1.00 1.57 C ATOM 2498 O GLY B 54 -10.682 13.940 4.782 1.00 2.04 O ATOM 0 H GLY B 54 -13.118 12.648 5.456 1.00 1.34 H new ATOM 0 HA2 GLY B 54 -11.309 13.084 7.159 1.00 1.88 H new ATOM 0 HA3 GLY B 54 -10.789 11.442 6.837 1.00 1.88 H new ATOM 2502 N SER B 55 -9.855 11.869 4.489 1.00 1.19 N ATOM 2503 CA SER B 55 -9.293 12.100 3.168 1.00 1.14 C ATOM 2504 C SER B 55 -10.338 11.889 2.075 1.00 1.14 C ATOM 2505 O SER B 55 -10.064 12.281 0.942 1.00 1.36 O ATOM 2506 CB SER B 55 -8.051 11.244 2.921 1.00 1.43 C ATOM 2507 OG SER B 55 -6.970 11.689 3.719 1.00 1.86 O ATOM 0 H SER B 55 -9.650 10.942 4.862 1.00 1.19 H new ATOM 0 HA SER B 55 -8.979 13.143 3.130 1.00 1.14 H new ATOM 0 HB2 SER B 55 -8.271 10.201 3.147 1.00 1.43 H new ATOM 0 HB3 SER B 55 -7.775 11.290 1.868 1.00 1.43 H new ATOM 0 HG SER B 55 -6.244 11.031 3.683 1.00 1.86 H new ATOM 2513 N LEU B 56 -11.477 11.229 2.372 1.00 1.02 N ATOM 2514 CA LEU B 56 -12.511 10.907 1.386 1.00 0.97 C ATOM 2515 C LEU B 56 -12.659 12.060 0.415 1.00 0.93 C ATOM 2516 O LEU B 56 -12.433 11.891 -0.769 1.00 1.00 O ATOM 2517 CB LEU B 56 -13.889 10.644 2.030 1.00 1.04 C ATOM 2518 CG LEU B 56 -15.049 10.712 0.998 1.00 1.48 C ATOM 2519 CD1 LEU B 56 -14.844 9.746 -0.172 1.00 2.66 C ATOM 2520 CD2 LEU B 56 -16.433 10.468 1.598 1.00 2.84 C ATOM 0 H LEU B 56 -11.700 10.905 3.313 1.00 1.02 H new ATOM 0 HA LEU B 56 -12.191 9.996 0.881 1.00 0.97 H new ATOM 0 HB2 LEU B 56 -13.884 9.662 2.503 1.00 1.04 H new ATOM 0 HB3 LEU B 56 -14.064 11.376 2.818 1.00 1.04 H new ATOM 0 HG LEU B 56 -15.018 11.740 0.638 1.00 1.48 H new ATOM 0 HD11 LEU B 56 -15.681 9.831 -0.865 1.00 2.66 H new ATOM 0 HD12 LEU B 56 -13.917 9.993 -0.690 1.00 2.66 H new ATOM 0 HD13 LEU B 56 -14.788 8.725 0.205 1.00 2.66 H new ATOM 0 HD21 LEU B 56 -17.186 10.533 0.813 1.00 2.84 H new ATOM 0 HD22 LEU B 56 -16.464 9.477 2.050 1.00 2.84 H new ATOM 0 HD23 LEU B 56 -16.637 11.221 2.360 1.00 2.84 H new ATOM 2532 N ASP B 57 -13.028 13.218 0.939 1.00 0.98 N ATOM 2533 CA ASP B 57 -13.278 14.450 0.217 1.00 1.10 C ATOM 2534 C ASP B 57 -12.206 14.680 -0.853 1.00 1.08 C ATOM 2535 O ASP B 57 -12.513 14.766 -2.042 1.00 1.16 O ATOM 2536 CB ASP B 57 -13.347 15.607 1.232 1.00 1.31 C ATOM 2537 CG ASP B 57 -14.307 15.331 2.391 1.00 2.76 C ATOM 2538 OD1 ASP B 57 -14.102 14.298 3.074 1.00 4.17 O ATOM 2539 OD2 ASP B 57 -15.223 16.160 2.561 1.00 3.58 O ATOM 0 H ASP B 57 -13.169 13.327 1.943 1.00 0.98 H new ATOM 0 HA ASP B 57 -14.230 14.391 -0.310 1.00 1.10 H new ATOM 0 HB2 ASP B 57 -12.350 15.793 1.630 1.00 1.31 H new ATOM 0 HB3 ASP B 57 -13.659 16.516 0.718 1.00 1.31 H new ATOM 2544 N GLU B 58 -10.945 14.773 -0.421 1.00 1.12 N ATOM 2545 CA GLU B 58 -9.777 14.912 -1.285 1.00 1.23 C ATOM 2546 C GLU B 58 -9.758 13.811 -2.345 1.00 1.00 C ATOM 2547 O GLU B 58 -9.597 14.084 -3.535 1.00 1.08 O ATOM 2548 CB GLU B 58 -8.499 14.929 -0.436 1.00 1.49 C ATOM 2549 CG GLU B 58 -8.503 16.077 0.586 1.00 2.05 C ATOM 2550 CD GLU B 58 -8.608 17.438 -0.091 1.00 3.64 C ATOM 2551 OE1 GLU B 58 -7.613 17.839 -0.724 1.00 4.26 O ATOM 2552 OE2 GLU B 58 -9.707 18.033 -0.010 1.00 4.83 O ATOM 0 H GLU B 58 -10.705 14.753 0.570 1.00 1.12 H new ATOM 0 HA GLU B 58 -9.830 15.861 -1.818 1.00 1.23 H new ATOM 0 HB2 GLU B 58 -8.398 13.978 0.087 1.00 1.49 H new ATOM 0 HB3 GLU B 58 -7.631 15.027 -1.088 1.00 1.49 H new ATOM 0 HG2 GLU B 58 -9.339 15.948 1.274 1.00 2.05 H new ATOM 0 HG3 GLU B 58 -7.591 16.037 1.181 1.00 2.05 H new ATOM 2559 N LYS B 59 -9.954 12.566 -1.912 1.00 0.86 N ATOM 2560 CA LYS B 59 -10.059 11.410 -2.786 1.00 0.77 C ATOM 2561 C LYS B 59 -11.135 11.622 -3.862 1.00 0.72 C ATOM 2562 O LYS B 59 -10.853 11.495 -5.049 1.00 0.76 O ATOM 2563 CB LYS B 59 -10.277 10.139 -1.930 1.00 0.85 C ATOM 2564 CG LYS B 59 -9.232 9.075 -2.269 1.00 0.97 C ATOM 2565 CD LYS B 59 -9.014 8.010 -1.186 1.00 1.11 C ATOM 2566 CE LYS B 59 -10.174 7.033 -0.938 1.00 1.22 C ATOM 2567 NZ LYS B 59 -11.078 7.454 0.174 1.00 1.47 N ATOM 0 H LYS B 59 -10.045 12.334 -0.923 1.00 0.86 H new ATOM 0 HA LYS B 59 -9.128 11.274 -3.336 1.00 0.77 H new ATOM 0 HB2 LYS B 59 -10.216 10.392 -0.872 1.00 0.85 H new ATOM 0 HB3 LYS B 59 -11.277 9.743 -2.106 1.00 0.85 H new ATOM 0 HG2 LYS B 59 -9.529 8.577 -3.192 1.00 0.97 H new ATOM 0 HG3 LYS B 59 -8.282 9.571 -2.466 1.00 0.97 H new ATOM 0 HD2 LYS B 59 -8.131 7.429 -1.452 1.00 1.11 H new ATOM 0 HD3 LYS B 59 -8.791 8.519 -0.248 1.00 1.11 H new ATOM 0 HE2 LYS B 59 -10.758 6.934 -1.853 1.00 1.22 H new ATOM 0 HE3 LYS B 59 -9.767 6.047 -0.712 1.00 1.22 H new ATOM 0 HZ1 LYS B 59 -11.766 6.698 0.367 1.00 1.47 H new ATOM 0 HZ2 LYS B 59 -10.515 7.637 1.029 1.00 1.47 H new ATOM 0 HZ3 LYS B 59 -11.584 8.321 -0.099 1.00 1.47 H new ATOM 2581 N MET B 60 -12.360 11.965 -3.462 1.00 0.74 N ATOM 2582 CA MET B 60 -13.495 12.192 -4.335 1.00 0.76 C ATOM 2583 C MET B 60 -13.138 13.249 -5.368 1.00 0.78 C ATOM 2584 O MET B 60 -13.306 13.002 -6.559 1.00 0.80 O ATOM 2585 CB MET B 60 -14.736 12.559 -3.503 1.00 0.85 C ATOM 2586 CG MET B 60 -15.954 12.894 -4.378 1.00 1.02 C ATOM 2587 SD MET B 60 -16.022 14.596 -5.008 1.00 2.38 S ATOM 2588 CE MET B 60 -17.419 14.469 -6.146 1.00 2.55 C ATOM 0 H MET B 60 -12.590 12.096 -2.477 1.00 0.74 H new ATOM 0 HA MET B 60 -13.743 11.280 -4.879 1.00 0.76 H new ATOM 0 HB2 MET B 60 -14.985 11.729 -2.842 1.00 0.85 H new ATOM 0 HB3 MET B 60 -14.503 13.413 -2.867 1.00 0.85 H new ATOM 0 HG2 MET B 60 -15.968 12.210 -5.227 1.00 1.02 H new ATOM 0 HG3 MET B 60 -16.858 12.703 -3.800 1.00 1.02 H new ATOM 0 HE1 MET B 60 -17.593 15.436 -6.618 1.00 2.55 H new ATOM 0 HE2 MET B 60 -17.198 13.726 -6.912 1.00 2.55 H new ATOM 0 HE3 MET B 60 -18.311 14.169 -5.596 1.00 2.55 H new ATOM 2598 N LYS B 61 -12.628 14.403 -4.925 1.00 0.84 N ATOM 2599 CA LYS B 61 -12.243 15.466 -5.849 1.00 0.94 C ATOM 2600 C LYS B 61 -11.221 14.915 -6.845 1.00 0.92 C ATOM 2601 O LYS B 61 -11.419 14.979 -8.055 1.00 0.97 O ATOM 2602 CB LYS B 61 -11.642 16.650 -5.083 1.00 1.08 C ATOM 2603 CG LYS B 61 -12.644 17.334 -4.142 1.00 2.08 C ATOM 2604 CD LYS B 61 -11.867 17.785 -2.904 1.00 1.80 C ATOM 2605 CE LYS B 61 -12.723 18.534 -1.874 1.00 2.50 C ATOM 2606 NZ LYS B 61 -12.144 18.431 -0.517 1.00 2.57 N ATOM 0 H LYS B 61 -12.475 14.620 -3.940 1.00 0.84 H new ATOM 0 HA LYS B 61 -13.126 15.816 -6.383 1.00 0.94 H new ATOM 0 HB2 LYS B 61 -10.787 16.302 -4.502 1.00 1.08 H new ATOM 0 HB3 LYS B 61 -11.266 17.383 -5.797 1.00 1.08 H new ATOM 0 HG2 LYS B 61 -13.113 18.186 -4.633 1.00 2.08 H new ATOM 0 HG3 LYS B 61 -13.443 16.646 -3.865 1.00 2.08 H new ATOM 0 HD2 LYS B 61 -11.423 16.911 -2.427 1.00 1.80 H new ATOM 0 HD3 LYS B 61 -11.045 18.429 -3.217 1.00 1.80 H new ATOM 0 HE2 LYS B 61 -12.803 19.583 -2.159 1.00 2.50 H new ATOM 0 HE3 LYS B 61 -13.734 18.126 -1.872 1.00 2.50 H new ATOM 0 HZ1 LYS B 61 -12.665 19.055 0.131 1.00 2.57 H new ATOM 0 HZ2 LYS B 61 -12.215 17.449 -0.183 1.00 2.57 H new ATOM 0 HZ3 LYS B 61 -11.144 18.717 -0.544 1.00 2.57 H new ATOM 2620 N SER B 62 -10.135 14.354 -6.311 1.00 0.92 N ATOM 2621 CA SER B 62 -9.073 13.730 -7.094 1.00 0.95 C ATOM 2622 C SER B 62 -9.642 12.796 -8.173 1.00 0.92 C ATOM 2623 O SER B 62 -9.243 12.893 -9.333 1.00 1.06 O ATOM 2624 CB SER B 62 -8.084 13.016 -6.163 1.00 1.02 C ATOM 2625 OG SER B 62 -6.945 12.565 -6.871 1.00 1.42 O ATOM 0 H SER B 62 -9.968 14.321 -5.305 1.00 0.92 H new ATOM 0 HA SER B 62 -8.526 14.509 -7.626 1.00 0.95 H new ATOM 0 HB2 SER B 62 -7.775 13.695 -5.368 1.00 1.02 H new ATOM 0 HB3 SER B 62 -8.577 12.169 -5.686 1.00 1.02 H new ATOM 0 HG SER B 62 -6.332 12.116 -6.252 1.00 1.42 H new ATOM 2631 N LEU B 63 -10.584 11.915 -7.815 1.00 0.85 N ATOM 2632 CA LEU B 63 -11.261 11.075 -8.797 1.00 0.89 C ATOM 2633 C LEU B 63 -12.009 11.945 -9.809 1.00 0.93 C ATOM 2634 O LEU B 63 -11.793 11.813 -11.011 1.00 1.02 O ATOM 2635 CB LEU B 63 -12.185 10.029 -8.140 1.00 0.92 C ATOM 2636 CG LEU B 63 -11.510 8.828 -7.443 1.00 0.98 C ATOM 2637 CD1 LEU B 63 -10.006 8.950 -7.151 1.00 1.01 C ATOM 2638 CD2 LEU B 63 -12.226 8.578 -6.112 1.00 1.35 C ATOM 0 H LEU B 63 -10.891 11.769 -6.853 1.00 0.85 H new ATOM 0 HA LEU B 63 -10.500 10.506 -9.331 1.00 0.89 H new ATOM 0 HB2 LEU B 63 -12.805 10.541 -7.404 1.00 0.92 H new ATOM 0 HB3 LEU B 63 -12.855 9.641 -8.907 1.00 0.92 H new ATOM 0 HG LEU B 63 -11.597 8.010 -8.159 1.00 0.98 H new ATOM 0 HD11 LEU B 63 -9.656 8.042 -6.661 1.00 1.01 H new ATOM 0 HD12 LEU B 63 -9.464 9.090 -8.086 1.00 1.01 H new ATOM 0 HD13 LEU B 63 -9.830 9.805 -6.499 1.00 1.01 H new ATOM 0 HD21 LEU B 63 -11.764 7.732 -5.603 1.00 1.35 H new ATOM 0 HD22 LEU B 63 -12.148 9.466 -5.484 1.00 1.35 H new ATOM 0 HD23 LEU B 63 -13.277 8.358 -6.300 1.00 1.35 H new ATOM 2650 N ASP B 64 -12.893 12.816 -9.321 1.00 0.92 N ATOM 2651 CA ASP B 64 -13.812 13.614 -10.123 1.00 1.01 C ATOM 2652 C ASP B 64 -13.117 14.310 -11.298 1.00 1.03 C ATOM 2653 O ASP B 64 -13.604 14.224 -12.423 1.00 1.14 O ATOM 2654 CB ASP B 64 -14.528 14.616 -9.213 1.00 1.06 C ATOM 2655 CG ASP B 64 -15.634 15.342 -9.956 1.00 1.26 C ATOM 2656 OD1 ASP B 64 -16.738 14.760 -10.023 1.00 2.04 O ATOM 2657 OD2 ASP B 64 -15.359 16.466 -10.423 1.00 1.40 O ATOM 0 H ASP B 64 -12.990 12.989 -8.320 1.00 0.92 H new ATOM 0 HA ASP B 64 -14.546 12.946 -10.573 1.00 1.01 H new ATOM 0 HB2 ASP B 64 -14.947 14.094 -8.352 1.00 1.06 H new ATOM 0 HB3 ASP B 64 -13.809 15.340 -8.829 1.00 1.06 H new ATOM 2662 N VAL B 65 -11.958 14.935 -11.040 1.00 0.97 N ATOM 2663 CA VAL B 65 -11.230 15.795 -11.986 1.00 1.00 C ATOM 2664 C VAL B 65 -11.280 15.264 -13.418 1.00 1.03 C ATOM 2665 O VAL B 65 -11.781 15.930 -14.321 1.00 1.14 O ATOM 2666 CB VAL B 65 -9.760 15.937 -11.537 1.00 1.07 C ATOM 2667 CG1 VAL B 65 -8.851 16.567 -12.604 1.00 1.62 C ATOM 2668 CG2 VAL B 65 -9.672 16.823 -10.302 1.00 1.44 C ATOM 0 H VAL B 65 -11.487 14.853 -10.139 1.00 0.97 H new ATOM 0 HA VAL B 65 -11.722 16.768 -11.982 1.00 1.00 H new ATOM 0 HB VAL B 65 -9.418 14.921 -11.341 1.00 1.07 H new ATOM 0 HG11 VAL B 65 -7.833 16.636 -12.220 1.00 1.62 H new ATOM 0 HG12 VAL B 65 -8.859 15.948 -13.501 1.00 1.62 H new ATOM 0 HG13 VAL B 65 -9.215 17.565 -12.849 1.00 1.62 H new ATOM 0 HG21 VAL B 65 -8.630 16.916 -9.994 1.00 1.44 H new ATOM 0 HG22 VAL B 65 -10.072 17.810 -10.533 1.00 1.44 H new ATOM 0 HG23 VAL B 65 -10.251 16.378 -9.493 1.00 1.44 H new ATOM 2678 N ASN B 66 -10.717 14.073 -13.622 1.00 1.00 N ATOM 2679 CA ASN B 66 -10.740 13.388 -14.916 1.00 1.05 C ATOM 2680 C ASN B 66 -10.896 11.888 -14.691 1.00 1.11 C ATOM 2681 O ASN B 66 -10.069 11.084 -15.126 1.00 1.20 O ATOM 2682 CB ASN B 66 -9.482 13.712 -15.742 1.00 1.09 C ATOM 2683 CG ASN B 66 -9.494 15.118 -16.334 1.00 1.36 C ATOM 2684 OD1 ASN B 66 -8.662 15.952 -15.994 1.00 2.35 O ATOM 2685 ND2 ASN B 66 -10.414 15.392 -17.257 1.00 2.37 N ATOM 0 H ASN B 66 -10.230 13.553 -12.892 1.00 1.00 H new ATOM 0 HA ASN B 66 -11.593 13.745 -15.494 1.00 1.05 H new ATOM 0 HB2 ASN B 66 -8.602 13.599 -15.109 1.00 1.09 H new ATOM 0 HB3 ASN B 66 -9.389 12.986 -16.550 1.00 1.09 H new ATOM 0 HD21 ASN B 66 -10.437 16.312 -17.697 1.00 2.37 H new ATOM 0 HD22 ASN B 66 -11.096 14.682 -17.524 1.00 2.37 H new ATOM 2692 N GLN B 67 -11.989 11.518 -14.023 1.00 1.12 N ATOM 2693 CA GLN B 67 -12.233 10.145 -13.610 1.00 1.16 C ATOM 2694 C GLN B 67 -12.160 9.127 -14.753 1.00 1.29 C ATOM 2695 O GLN B 67 -11.827 7.962 -14.539 1.00 1.41 O ATOM 2696 CB GLN B 67 -13.562 9.994 -12.864 1.00 1.23 C ATOM 2697 CG GLN B 67 -14.717 10.885 -13.358 1.00 1.48 C ATOM 2698 CD GLN B 67 -14.987 10.788 -14.853 1.00 2.06 C ATOM 2699 OE1 GLN B 67 -14.489 11.595 -15.631 1.00 3.65 O ATOM 2700 NE2 GLN B 67 -15.730 9.774 -15.281 1.00 2.81 N ATOM 0 H GLN B 67 -12.729 12.167 -13.755 1.00 1.12 H new ATOM 0 HA GLN B 67 -11.414 9.918 -12.928 1.00 1.16 H new ATOM 0 HB2 GLN B 67 -13.878 8.953 -12.931 1.00 1.23 H new ATOM 0 HB3 GLN B 67 -13.390 10.207 -11.809 1.00 1.23 H new ATOM 0 HG2 GLN B 67 -15.625 10.615 -12.818 1.00 1.48 H new ATOM 0 HG3 GLN B 67 -14.493 11.922 -13.107 1.00 1.48 H new ATOM 0 HE21 GLN B 67 -16.132 9.118 -14.611 1.00 2.81 H new ATOM 0 HE22 GLN B 67 -15.899 9.651 -16.279 1.00 2.81 H new ATOM 2709 N ASP B 68 -12.542 9.570 -15.947 1.00 1.34 N ATOM 2710 CA ASP B 68 -12.535 8.788 -17.171 1.00 1.43 C ATOM 2711 C ASP B 68 -11.206 8.058 -17.396 1.00 1.54 C ATOM 2712 O ASP B 68 -11.196 6.923 -17.869 1.00 1.83 O ATOM 2713 CB ASP B 68 -12.840 9.739 -18.333 1.00 1.30 C ATOM 2714 CG ASP B 68 -12.705 9.038 -19.676 1.00 2.11 C ATOM 2715 OD1 ASP B 68 -13.694 8.388 -20.075 1.00 3.11 O ATOM 2716 OD2 ASP B 68 -11.616 9.179 -20.272 1.00 3.14 O ATOM 0 H ASP B 68 -12.878 10.522 -16.090 1.00 1.34 H new ATOM 0 HA ASP B 68 -13.293 8.008 -17.100 1.00 1.43 H new ATOM 0 HB2 ASP B 68 -13.851 10.133 -18.227 1.00 1.30 H new ATOM 0 HB3 ASP B 68 -12.161 10.591 -18.296 1.00 1.30 H new ATOM 2721 N SER B 69 -10.086 8.711 -17.062 1.00 1.44 N ATOM 2722 CA SER B 69 -8.765 8.190 -17.389 1.00 1.61 C ATOM 2723 C SER B 69 -8.414 6.932 -16.580 1.00 1.64 C ATOM 2724 O SER B 69 -9.226 6.408 -15.816 1.00 2.92 O ATOM 2725 CB SER B 69 -7.718 9.296 -17.203 1.00 1.65 C ATOM 2726 OG SER B 69 -6.515 8.943 -17.864 1.00 2.31 O ATOM 0 H SER B 69 -10.075 9.602 -16.565 1.00 1.44 H new ATOM 0 HA SER B 69 -8.770 7.879 -18.434 1.00 1.61 H new ATOM 0 HB2 SER B 69 -8.098 10.237 -17.600 1.00 1.65 H new ATOM 0 HB3 SER B 69 -7.527 9.452 -16.141 1.00 1.65 H new ATOM 0 HG SER B 69 -5.853 9.655 -17.741 1.00 2.31 H new ATOM 2732 N GLU B 70 -7.168 6.473 -16.737 1.00 0.85 N ATOM 2733 CA GLU B 70 -6.594 5.355 -16.002 1.00 0.76 C ATOM 2734 C GLU B 70 -5.591 5.853 -14.974 1.00 0.80 C ATOM 2735 O GLU B 70 -4.828 6.784 -15.229 1.00 1.22 O ATOM 2736 CB GLU B 70 -5.957 4.326 -16.948 1.00 0.97 C ATOM 2737 CG GLU B 70 -7.033 3.357 -17.453 1.00 1.79 C ATOM 2738 CD GLU B 70 -6.502 2.365 -18.477 1.00 2.46 C ATOM 2739 OE1 GLU B 70 -5.497 2.667 -19.158 1.00 2.76 O ATOM 2740 OE2 GLU B 70 -7.086 1.264 -18.613 1.00 3.62 O ATOM 0 H GLU B 70 -6.515 6.887 -17.402 1.00 0.85 H new ATOM 0 HA GLU B 70 -7.402 4.849 -15.474 1.00 0.76 H new ATOM 0 HB2 GLU B 70 -5.486 4.834 -17.790 1.00 0.97 H new ATOM 0 HB3 GLU B 70 -5.173 3.776 -16.428 1.00 0.97 H new ATOM 0 HG2 GLU B 70 -7.449 2.810 -16.607 1.00 1.79 H new ATOM 0 HG3 GLU B 70 -7.849 3.927 -17.896 1.00 1.79 H new ATOM 2747 N LEU B 71 -5.584 5.184 -13.822 1.00 0.89 N ATOM 2748 CA LEU B 71 -4.597 5.442 -12.781 1.00 1.12 C ATOM 2749 C LEU B 71 -3.331 4.662 -13.115 1.00 1.13 C ATOM 2750 O LEU B 71 -3.339 3.806 -14.000 1.00 1.16 O ATOM 2751 CB LEU B 71 -5.134 4.958 -11.424 1.00 1.38 C ATOM 2752 CG LEU B 71 -6.331 5.756 -10.897 1.00 2.02 C ATOM 2753 CD1 LEU B 71 -6.926 5.019 -9.694 1.00 1.93 C ATOM 2754 CD2 LEU B 71 -5.920 7.171 -10.471 1.00 3.67 C ATOM 0 H LEU B 71 -6.257 4.454 -13.587 1.00 0.89 H new ATOM 0 HA LEU B 71 -4.389 6.511 -12.727 1.00 1.12 H new ATOM 0 HB2 LEU B 71 -5.422 3.911 -11.513 1.00 1.38 H new ATOM 0 HB3 LEU B 71 -4.329 5.006 -10.690 1.00 1.38 H new ATOM 0 HG LEU B 71 -7.066 5.845 -11.697 1.00 2.02 H new ATOM 0 HD11 LEU B 71 -7.779 5.578 -9.310 1.00 1.93 H new ATOM 0 HD12 LEU B 71 -7.252 4.025 -10.001 1.00 1.93 H new ATOM 0 HD13 LEU B 71 -6.171 4.928 -8.913 1.00 1.93 H new ATOM 0 HD21 LEU B 71 -6.794 7.708 -10.103 1.00 3.67 H new ATOM 0 HD22 LEU B 71 -5.172 7.110 -9.681 1.00 3.67 H new ATOM 0 HD23 LEU B 71 -5.502 7.702 -11.327 1.00 3.67 H new ATOM 2766 N LYS B 72 -2.257 4.907 -12.369 1.00 1.12 N ATOM 2767 CA LYS B 72 -1.135 4.000 -12.252 1.00 0.98 C ATOM 2768 C LYS B 72 -1.018 3.523 -10.807 1.00 0.81 C ATOM 2769 O LYS B 72 -1.640 4.071 -9.893 1.00 0.72 O ATOM 2770 CB LYS B 72 0.146 4.646 -12.806 1.00 1.06 C ATOM 2771 CG LYS B 72 -0.001 4.896 -14.315 1.00 1.28 C ATOM 2772 CD LYS B 72 -0.569 6.263 -14.723 1.00 1.79 C ATOM 2773 CE LYS B 72 -1.388 6.138 -16.019 1.00 2.38 C ATOM 2774 NZ LYS B 72 -0.643 5.464 -17.106 1.00 3.09 N ATOM 0 H LYS B 72 -2.147 5.760 -11.821 1.00 1.12 H new ATOM 0 HA LYS B 72 -1.298 3.112 -12.863 1.00 0.98 H new ATOM 0 HB2 LYS B 72 0.341 5.586 -12.291 1.00 1.06 H new ATOM 0 HB3 LYS B 72 1.001 3.997 -12.618 1.00 1.06 H new ATOM 0 HG2 LYS B 72 0.979 4.780 -14.779 1.00 1.28 H new ATOM 0 HG3 LYS B 72 -0.644 4.120 -14.730 1.00 1.28 H new ATOM 0 HD2 LYS B 72 -1.198 6.656 -13.924 1.00 1.79 H new ATOM 0 HD3 LYS B 72 0.245 6.974 -14.867 1.00 1.79 H new ATOM 0 HE2 LYS B 72 -2.303 5.582 -15.813 1.00 2.38 H new ATOM 0 HE3 LYS B 72 -1.687 7.132 -16.352 1.00 2.38 H new ATOM 0 HZ1 LYS B 72 -1.223 5.453 -17.969 1.00 3.09 H new ATOM 0 HZ2 LYS B 72 0.242 5.978 -17.290 1.00 3.09 H new ATOM 0 HZ3 LYS B 72 -0.424 4.487 -16.823 1.00 3.09 H new ATOM 2788 N PHE B 73 -0.256 2.439 -10.625 1.00 0.81 N ATOM 2789 CA PHE B 73 -0.098 1.756 -9.348 1.00 0.77 C ATOM 2790 C PHE B 73 0.278 2.737 -8.240 1.00 0.62 C ATOM 2791 O PHE B 73 -0.210 2.609 -7.127 1.00 0.51 O ATOM 2792 CB PHE B 73 0.869 0.560 -9.459 1.00 0.99 C ATOM 2793 CG PHE B 73 2.003 0.739 -10.452 1.00 0.92 C ATOM 2794 CD1 PHE B 73 3.190 1.393 -10.076 1.00 2.19 C ATOM 2795 CD2 PHE B 73 1.841 0.294 -11.778 1.00 1.99 C ATOM 2796 CE1 PHE B 73 4.200 1.609 -11.029 1.00 2.85 C ATOM 2797 CE2 PHE B 73 2.828 0.558 -12.740 1.00 2.48 C ATOM 2798 CZ PHE B 73 4.011 1.216 -12.364 1.00 2.54 C ATOM 0 H PHE B 73 0.277 2.008 -11.380 1.00 0.81 H new ATOM 0 HA PHE B 73 -1.062 1.333 -9.067 1.00 0.77 H new ATOM 0 HB2 PHE B 73 1.296 0.365 -8.475 1.00 0.99 H new ATOM 0 HB3 PHE B 73 0.297 -0.325 -9.739 1.00 0.99 H new ATOM 0 HD1 PHE B 73 3.325 1.728 -9.058 1.00 2.19 H new ATOM 0 HD2 PHE B 73 0.953 -0.253 -12.056 1.00 1.99 H new ATOM 0 HE1 PHE B 73 5.126 2.080 -10.733 1.00 2.85 H new ATOM 0 HE2 PHE B 73 2.679 0.256 -13.766 1.00 2.48 H new ATOM 0 HZ PHE B 73 4.774 1.419 -13.101 1.00 2.54 H new ATOM 2808 N ASN B 74 1.110 3.730 -8.560 1.00 0.73 N ATOM 2809 CA ASN B 74 1.513 4.804 -7.657 1.00 0.77 C ATOM 2810 C ASN B 74 0.328 5.617 -7.114 1.00 0.67 C ATOM 2811 O ASN B 74 0.138 5.685 -5.898 1.00 0.65 O ATOM 2812 CB ASN B 74 2.519 5.679 -8.406 1.00 1.03 C ATOM 2813 CG ASN B 74 2.695 7.061 -7.781 1.00 1.52 C ATOM 2814 OD1 ASN B 74 3.400 7.225 -6.792 1.00 2.64 O ATOM 2815 ND2 ASN B 74 2.083 8.075 -8.380 1.00 2.18 N ATOM 0 H ASN B 74 1.534 3.809 -9.484 1.00 0.73 H new ATOM 0 HA ASN B 74 1.972 4.373 -6.767 1.00 0.77 H new ATOM 0 HB2 ASN B 74 3.484 5.173 -8.431 1.00 1.03 H new ATOM 0 HB3 ASN B 74 2.193 5.793 -9.440 1.00 1.03 H new ATOM 0 HD21 ASN B 74 2.193 9.022 -8.019 1.00 2.18 H new ATOM 0 HD22 ASN B 74 1.503 7.907 -9.202 1.00 2.18 H new ATOM 2822 N GLU B 75 -0.454 6.257 -7.988 1.00 0.80 N ATOM 2823 CA GLU B 75 -1.601 7.060 -7.569 1.00 0.82 C ATOM 2824 C GLU B 75 -2.604 6.182 -6.830 1.00 0.76 C ATOM 2825 O GLU B 75 -3.083 6.561 -5.762 1.00 0.78 O ATOM 2826 CB GLU B 75 -2.309 7.751 -8.742 1.00 1.03 C ATOM 2827 CG GLU B 75 -1.372 8.579 -9.623 1.00 1.26 C ATOM 2828 CD GLU B 75 -0.713 7.674 -10.639 1.00 2.08 C ATOM 2829 OE1 GLU B 75 -1.417 7.313 -11.604 1.00 3.07 O ATOM 2830 OE2 GLU B 75 0.434 7.262 -10.355 1.00 2.98 O ATOM 0 H GLU B 75 -0.310 6.232 -8.997 1.00 0.80 H new ATOM 0 HA GLU B 75 -1.214 7.841 -6.914 1.00 0.82 H new ATOM 0 HB2 GLU B 75 -2.798 6.995 -9.357 1.00 1.03 H new ATOM 0 HB3 GLU B 75 -3.093 8.399 -8.351 1.00 1.03 H new ATOM 0 HG2 GLU B 75 -1.931 9.367 -10.129 1.00 1.26 H new ATOM 0 HG3 GLU B 75 -0.615 9.068 -9.010 1.00 1.26 H new ATOM 2837 N TYR B 76 -2.901 5.003 -7.394 1.00 0.76 N ATOM 2838 CA TYR B 76 -3.683 3.987 -6.699 1.00 0.76 C ATOM 2839 C TYR B 76 -3.147 3.846 -5.278 1.00 0.65 C ATOM 2840 O TYR B 76 -3.915 3.939 -4.327 1.00 0.65 O ATOM 2841 CB TYR B 76 -3.626 2.660 -7.465 1.00 0.87 C ATOM 2842 CG TYR B 76 -4.037 1.418 -6.686 1.00 1.07 C ATOM 2843 CD1 TYR B 76 -3.124 0.821 -5.792 1.00 1.87 C ATOM 2844 CD2 TYR B 76 -5.177 0.693 -7.083 1.00 1.84 C ATOM 2845 CE1 TYR B 76 -3.386 -0.440 -5.243 1.00 2.14 C ATOM 2846 CE2 TYR B 76 -5.394 -0.608 -6.597 1.00 2.11 C ATOM 2847 CZ TYR B 76 -4.478 -1.185 -5.701 1.00 1.82 C ATOM 2848 OH TYR B 76 -4.559 -2.502 -5.370 1.00 2.32 O ATOM 0 H TYR B 76 -2.607 4.735 -8.333 1.00 0.76 H new ATOM 0 HA TYR B 76 -4.731 4.283 -6.649 1.00 0.76 H new ATOM 0 HB2 TYR B 76 -4.268 2.743 -8.342 1.00 0.87 H new ATOM 0 HB3 TYR B 76 -2.608 2.516 -7.827 1.00 0.87 H new ATOM 0 HD1 TYR B 76 -2.215 1.341 -5.529 1.00 1.87 H new ATOM 0 HD2 TYR B 76 -5.887 1.138 -7.764 1.00 1.84 H new ATOM 0 HE1 TYR B 76 -2.747 -0.837 -4.468 1.00 2.14 H new ATOM 0 HE2 TYR B 76 -6.265 -1.164 -6.912 1.00 2.11 H new ATOM 0 HH TYR B 76 -4.126 -2.649 -4.503 1.00 2.32 H new ATOM 2858 N TRP B 77 -1.833 3.650 -5.138 1.00 0.58 N ATOM 2859 CA TRP B 77 -1.196 3.451 -3.855 1.00 0.51 C ATOM 2860 C TRP B 77 -1.547 4.597 -2.921 1.00 0.59 C ATOM 2861 O TRP B 77 -2.257 4.395 -1.941 1.00 0.65 O ATOM 2862 CB TRP B 77 0.315 3.319 -4.012 1.00 0.47 C ATOM 2863 CG TRP B 77 0.835 2.234 -3.170 1.00 0.41 C ATOM 2864 CD1 TRP B 77 1.127 2.390 -1.875 1.00 0.41 C ATOM 2865 CD2 TRP B 77 1.238 0.891 -3.533 1.00 0.41 C ATOM 2866 NE1 TRP B 77 1.599 1.212 -1.371 1.00 0.41 N ATOM 2867 CE2 TRP B 77 1.787 0.285 -2.371 1.00 0.41 C ATOM 2868 CE3 TRP B 77 1.315 0.168 -4.741 1.00 0.46 C ATOM 2869 CZ2 TRP B 77 2.403 -0.964 -2.405 1.00 0.47 C ATOM 2870 CZ3 TRP B 77 2.004 -1.057 -4.783 1.00 0.51 C ATOM 2871 CH2 TRP B 77 2.469 -1.658 -3.615 1.00 0.53 C ATOM 0 H TRP B 77 -1.185 3.627 -5.925 1.00 0.58 H new ATOM 0 HA TRP B 77 -1.565 2.521 -3.422 1.00 0.51 H new ATOM 0 HB2 TRP B 77 0.561 3.125 -5.056 1.00 0.47 H new ATOM 0 HB3 TRP B 77 0.797 4.258 -3.741 1.00 0.47 H new ATOM 0 HD1 TRP B 77 1.008 3.305 -1.314 1.00 0.41 H new ATOM 0 HE1 TRP B 77 1.788 1.041 -0.383 1.00 0.41 H new ATOM 0 HE3 TRP B 77 0.845 0.555 -5.633 1.00 0.46 H new ATOM 0 HZ2 TRP B 77 2.824 -1.390 -1.507 1.00 0.47 H new ATOM 0 HZ3 TRP B 77 2.175 -1.539 -5.734 1.00 0.51 H new ATOM 0 HH2 TRP B 77 2.879 -2.657 -3.645 1.00 0.53 H new ATOM 2882 N ARG B 78 -1.062 5.797 -3.244 1.00 0.63 N ATOM 2883 CA ARG B 78 -1.357 7.015 -2.520 1.00 0.76 C ATOM 2884 C ARG B 78 -2.841 7.047 -2.079 1.00 0.79 C ATOM 2885 O ARG B 78 -3.117 7.181 -0.887 1.00 0.86 O ATOM 2886 CB ARG B 78 -0.925 8.221 -3.389 1.00 0.86 C ATOM 2887 CG ARG B 78 0.611 8.317 -3.557 1.00 1.86 C ATOM 2888 CD ARG B 78 1.110 9.405 -4.528 1.00 1.89 C ATOM 2889 NE ARG B 78 2.557 9.722 -4.362 1.00 3.57 N ATOM 2890 CZ ARG B 78 3.241 10.658 -5.054 1.00 4.23 C ATOM 2891 NH1 ARG B 78 2.663 11.305 -6.071 1.00 3.95 N ATOM 2892 NH2 ARG B 78 4.495 10.958 -4.709 1.00 5.91 N ATOM 0 H ARG B 78 -0.438 5.943 -4.038 1.00 0.63 H new ATOM 0 HA ARG B 78 -0.789 7.065 -1.591 1.00 0.76 H new ATOM 0 HB2 ARG B 78 -1.389 8.140 -4.372 1.00 0.86 H new ATOM 0 HB3 ARG B 78 -1.295 9.141 -2.936 1.00 0.86 H new ATOM 0 HG2 ARG B 78 1.055 8.498 -2.578 1.00 1.86 H new ATOM 0 HG3 ARG B 78 0.982 7.351 -3.901 1.00 1.86 H new ATOM 0 HD2 ARG B 78 0.932 9.078 -5.552 1.00 1.89 H new ATOM 0 HD3 ARG B 78 0.526 10.313 -4.377 1.00 1.89 H new ATOM 0 HE ARG B 78 3.075 9.186 -3.666 1.00 3.57 H new ATOM 0 HH11 ARG B 78 1.699 11.093 -6.329 1.00 3.95 H new ATOM 0 HH12 ARG B 78 3.186 12.011 -6.589 1.00 3.95 H new ATOM 0 HH21 ARG B 78 4.936 10.480 -3.923 1.00 5.91 H new ATOM 0 HH22 ARG B 78 5.012 11.665 -5.231 1.00 5.91 H new ATOM 2906 N LEU B 79 -3.799 6.840 -2.995 1.00 0.77 N ATOM 2907 CA LEU B 79 -5.221 6.833 -2.637 1.00 0.84 C ATOM 2908 C LEU B 79 -5.598 5.702 -1.677 1.00 0.79 C ATOM 2909 O LEU B 79 -6.321 5.966 -0.723 1.00 0.85 O ATOM 2910 CB LEU B 79 -6.148 6.786 -3.862 1.00 0.91 C ATOM 2911 CG LEU B 79 -6.315 8.125 -4.609 1.00 1.16 C ATOM 2912 CD1 LEU B 79 -5.120 9.090 -4.564 1.00 1.48 C ATOM 2913 CD2 LEU B 79 -6.651 7.852 -6.078 1.00 1.48 C ATOM 0 H LEU B 79 -3.614 6.676 -3.985 1.00 0.77 H new ATOM 0 HA LEU B 79 -5.370 7.783 -2.123 1.00 0.84 H new ATOM 0 HB2 LEU B 79 -5.763 6.044 -4.561 1.00 0.91 H new ATOM 0 HB3 LEU B 79 -7.131 6.442 -3.541 1.00 0.91 H new ATOM 0 HG LEU B 79 -7.118 8.629 -4.072 1.00 1.16 H new ATOM 0 HD11 LEU B 79 -5.360 9.993 -5.125 1.00 1.48 H new ATOM 0 HD12 LEU B 79 -4.903 9.353 -3.529 1.00 1.48 H new ATOM 0 HD13 LEU B 79 -4.248 8.610 -5.007 1.00 1.48 H new ATOM 0 HD21 LEU B 79 -6.769 8.798 -6.606 1.00 1.48 H new ATOM 0 HD22 LEU B 79 -5.844 7.279 -6.535 1.00 1.48 H new ATOM 0 HD23 LEU B 79 -7.579 7.284 -6.139 1.00 1.48 H new ATOM 2925 N ILE B 80 -5.192 4.446 -1.903 1.00 0.71 N ATOM 2926 CA ILE B 80 -5.589 3.368 -0.992 1.00 0.64 C ATOM 2927 C ILE B 80 -4.936 3.557 0.381 1.00 0.54 C ATOM 2928 O ILE B 80 -5.490 3.171 1.407 1.00 0.53 O ATOM 2929 CB ILE B 80 -5.388 1.954 -1.564 1.00 0.72 C ATOM 2930 CG1 ILE B 80 -3.935 1.556 -1.846 1.00 1.09 C ATOM 2931 CG2 ILE B 80 -6.146 1.803 -2.870 1.00 0.79 C ATOM 2932 CD1 ILE B 80 -3.705 0.090 -1.465 1.00 0.72 C ATOM 0 H ILE B 80 -4.605 4.157 -2.686 1.00 0.71 H new ATOM 0 HA ILE B 80 -6.669 3.447 -0.865 1.00 0.64 H new ATOM 0 HB ILE B 80 -5.760 1.299 -0.776 1.00 0.72 H new ATOM 0 HG12 ILE B 80 -3.708 1.705 -2.902 1.00 1.09 H new ATOM 0 HG13 ILE B 80 -3.258 2.197 -1.281 1.00 1.09 H new ATOM 0 HG21 ILE B 80 -5.995 0.798 -3.264 1.00 0.79 H new ATOM 0 HG22 ILE B 80 -7.209 1.968 -2.695 1.00 0.79 H new ATOM 0 HG23 ILE B 80 -5.779 2.534 -3.590 1.00 0.79 H new ATOM 0 HD11 ILE B 80 -2.669 -0.181 -1.670 1.00 0.72 H new ATOM 0 HD12 ILE B 80 -3.913 -0.047 -0.404 1.00 0.72 H new ATOM 0 HD13 ILE B 80 -4.369 -0.546 -2.050 1.00 0.72 H new ATOM 2944 N GLY B 81 -3.780 4.209 0.405 1.00 0.54 N ATOM 2945 CA GLY B 81 -3.200 4.756 1.617 1.00 0.54 C ATOM 2946 C GLY B 81 -4.175 5.659 2.349 1.00 0.55 C ATOM 2947 O GLY B 81 -4.468 5.445 3.525 1.00 0.56 O ATOM 0 H GLY B 81 -3.215 4.373 -0.428 1.00 0.54 H new ATOM 0 HA2 GLY B 81 -2.895 3.941 2.274 1.00 0.54 H new ATOM 0 HA3 GLY B 81 -2.300 5.318 1.368 1.00 0.54 H new ATOM 2951 N GLU B 82 -4.695 6.667 1.651 1.00 0.66 N ATOM 2952 CA GLU B 82 -5.723 7.510 2.229 1.00 0.74 C ATOM 2953 C GLU B 82 -6.943 6.668 2.649 1.00 0.68 C ATOM 2954 O GLU B 82 -7.446 6.820 3.761 1.00 0.66 O ATOM 2955 CB GLU B 82 -6.045 8.676 1.284 1.00 0.96 C ATOM 2956 CG GLU B 82 -4.824 9.571 0.982 1.00 1.04 C ATOM 2957 CD GLU B 82 -4.053 10.046 2.212 1.00 3.03 C ATOM 2958 OE1 GLU B 82 -4.721 10.360 3.222 1.00 4.30 O ATOM 2959 OE2 GLU B 82 -2.802 10.104 2.123 1.00 4.07 O ATOM 0 H GLU B 82 -4.422 6.912 0.699 1.00 0.66 H new ATOM 0 HA GLU B 82 -5.360 7.967 3.149 1.00 0.74 H new ATOM 0 HB2 GLU B 82 -6.436 8.278 0.347 1.00 0.96 H new ATOM 0 HB3 GLU B 82 -6.833 9.286 1.725 1.00 0.96 H new ATOM 0 HG2 GLU B 82 -4.141 9.022 0.333 1.00 1.04 H new ATOM 0 HG3 GLU B 82 -5.161 10.444 0.424 1.00 1.04 H new ATOM 2966 N LEU B 83 -7.369 5.710 1.816 1.00 0.69 N ATOM 2967 CA LEU B 83 -8.456 4.795 2.140 1.00 0.70 C ATOM 2968 C LEU B 83 -8.215 4.109 3.487 1.00 0.62 C ATOM 2969 O LEU B 83 -9.118 4.081 4.320 1.00 0.67 O ATOM 2970 CB LEU B 83 -8.666 3.774 1.017 1.00 0.84 C ATOM 2971 CG LEU B 83 -9.981 2.988 1.106 1.00 1.02 C ATOM 2972 CD1 LEU B 83 -11.218 3.854 0.841 1.00 2.31 C ATOM 2973 CD2 LEU B 83 -9.919 1.884 0.050 1.00 2.39 C ATOM 0 H LEU B 83 -6.963 5.552 0.894 1.00 0.69 H new ATOM 0 HA LEU B 83 -9.373 5.377 2.230 1.00 0.70 H new ATOM 0 HB2 LEU B 83 -8.633 4.294 0.060 1.00 0.84 H new ATOM 0 HB3 LEU B 83 -7.835 3.069 1.025 1.00 0.84 H new ATOM 0 HG LEU B 83 -10.081 2.598 2.119 1.00 1.02 H new ATOM 0 HD11 LEU B 83 -12.115 3.240 0.919 1.00 2.31 H new ATOM 0 HD12 LEU B 83 -11.264 4.658 1.576 1.00 2.31 H new ATOM 0 HD13 LEU B 83 -11.156 4.281 -0.160 1.00 2.31 H new ATOM 0 HD21 LEU B 83 -10.839 1.300 0.080 1.00 2.39 H new ATOM 0 HD22 LEU B 83 -9.805 2.331 -0.938 1.00 2.39 H new ATOM 0 HD23 LEU B 83 -9.069 1.233 0.254 1.00 2.39 H new ATOM 2985 N ALA B 84 -7.009 3.584 3.738 1.00 0.57 N ATOM 2986 CA ALA B 84 -6.666 3.064 5.054 1.00 0.60 C ATOM 2987 C ALA B 84 -6.979 4.048 6.196 1.00 0.65 C ATOM 2988 O ALA B 84 -7.368 3.600 7.271 1.00 0.80 O ATOM 2989 CB ALA B 84 -5.202 2.616 5.088 1.00 0.59 C ATOM 0 H ALA B 84 -6.263 3.511 3.047 1.00 0.57 H new ATOM 0 HA ALA B 84 -7.303 2.197 5.226 1.00 0.60 H new ATOM 0 HB1 ALA B 84 -4.963 2.230 6.079 1.00 0.59 H new ATOM 0 HB2 ALA B 84 -5.044 1.834 4.346 1.00 0.59 H new ATOM 0 HB3 ALA B 84 -4.556 3.465 4.864 1.00 0.59 H new ATOM 2995 N LYS B 85 -6.800 5.367 6.015 1.00 0.66 N ATOM 2996 CA LYS B 85 -7.156 6.332 7.063 1.00 0.81 C ATOM 2997 C LYS B 85 -8.650 6.641 7.083 1.00 0.81 C ATOM 2998 O LYS B 85 -9.201 6.965 8.138 1.00 1.01 O ATOM 2999 CB LYS B 85 -6.269 7.587 7.069 1.00 1.15 C ATOM 3000 CG LYS B 85 -6.610 8.675 6.039 1.00 1.21 C ATOM 3001 CD LYS B 85 -6.419 10.093 6.603 1.00 1.39 C ATOM 3002 CE LYS B 85 -4.945 10.506 6.714 1.00 2.00 C ATOM 3003 NZ LYS B 85 -4.265 9.859 7.854 1.00 3.86 N ATOM 0 H LYS B 85 -6.417 5.783 5.166 1.00 0.66 H new ATOM 0 HA LYS B 85 -6.939 5.840 8.011 1.00 0.81 H new ATOM 0 HB2 LYS B 85 -6.315 8.032 8.063 1.00 1.15 H new ATOM 0 HB3 LYS B 85 -5.237 7.276 6.907 1.00 1.15 H new ATOM 0 HG2 LYS B 85 -5.980 8.549 5.158 1.00 1.21 H new ATOM 0 HG3 LYS B 85 -7.643 8.552 5.713 1.00 1.21 H new ATOM 0 HD2 LYS B 85 -6.942 10.805 5.964 1.00 1.39 H new ATOM 0 HD3 LYS B 85 -6.881 10.150 7.589 1.00 1.39 H new ATOM 0 HE2 LYS B 85 -4.427 10.247 5.791 1.00 2.00 H new ATOM 0 HE3 LYS B 85 -4.881 11.589 6.823 1.00 2.00 H new ATOM 0 HZ1 LYS B 85 -3.710 10.568 8.375 1.00 3.86 H new ATOM 0 HZ2 LYS B 85 -4.974 9.440 8.489 1.00 3.86 H new ATOM 0 HZ3 LYS B 85 -3.632 9.113 7.502 1.00 3.86 H new ATOM 3017 N GLU B 86 -9.322 6.522 5.936 1.00 0.71 N ATOM 3018 CA GLU B 86 -10.769 6.477 5.948 1.00 0.75 C ATOM 3019 C GLU B 86 -11.195 5.306 6.835 1.00 0.86 C ATOM 3020 O GLU B 86 -11.682 5.528 7.944 1.00 1.03 O ATOM 3021 CB GLU B 86 -11.371 6.400 4.538 1.00 0.72 C ATOM 3022 CG GLU B 86 -11.629 7.796 3.947 1.00 0.94 C ATOM 3023 CD GLU B 86 -10.351 8.497 3.579 1.00 1.88 C ATOM 3024 OE1 GLU B 86 -9.866 9.219 4.474 1.00 3.39 O ATOM 3025 OE2 GLU B 86 -9.940 8.353 2.401 1.00 2.24 O ATOM 0 H GLU B 86 -8.893 6.457 5.013 1.00 0.71 H new ATOM 0 HA GLU B 86 -11.159 7.408 6.360 1.00 0.75 H new ATOM 0 HB2 GLU B 86 -10.695 5.848 3.884 1.00 0.72 H new ATOM 0 HB3 GLU B 86 -12.307 5.842 4.573 1.00 0.72 H new ATOM 0 HG2 GLU B 86 -12.260 7.704 3.063 1.00 0.94 H new ATOM 0 HG3 GLU B 86 -12.178 8.400 4.669 1.00 0.94 H new ATOM 3032 N ILE B 87 -11.035 4.067 6.380 1.00 0.86 N ATOM 3033 CA ILE B 87 -11.664 2.950 7.063 1.00 0.90 C ATOM 3034 C ILE B 87 -10.852 2.477 8.279 1.00 0.94 C ATOM 3035 O ILE B 87 -9.744 1.959 8.170 1.00 0.94 O ATOM 3036 CB ILE B 87 -12.071 1.853 6.073 1.00 0.93 C ATOM 3037 CG1 ILE B 87 -12.808 0.723 6.793 1.00 1.33 C ATOM 3038 CG2 ILE B 87 -10.894 1.237 5.312 1.00 1.35 C ATOM 3039 CD1 ILE B 87 -14.047 1.143 7.581 1.00 1.60 C ATOM 0 H ILE B 87 -10.486 3.817 5.558 1.00 0.86 H new ATOM 0 HA ILE B 87 -12.602 3.293 7.501 1.00 0.90 H new ATOM 0 HB ILE B 87 -12.716 2.350 5.349 1.00 0.93 H new ATOM 0 HG12 ILE B 87 -13.104 -0.022 6.055 1.00 1.33 H new ATOM 0 HG13 ILE B 87 -12.112 0.236 7.476 1.00 1.33 H new ATOM 0 HG21 ILE B 87 -11.262 0.469 4.631 1.00 1.35 H new ATOM 0 HG22 ILE B 87 -10.383 2.013 4.742 1.00 1.35 H new ATOM 0 HG23 ILE B 87 -10.197 0.790 6.020 1.00 1.35 H new ATOM 0 HD11 ILE B 87 -14.493 0.267 8.052 1.00 1.60 H new ATOM 0 HD12 ILE B 87 -13.763 1.863 8.349 1.00 1.60 H new ATOM 0 HD13 ILE B 87 -14.770 1.600 6.905 1.00 1.60 H new ATOM 3051 N ARG B 88 -11.453 2.622 9.463 1.00 1.13 N ATOM 3052 CA ARG B 88 -10.813 2.467 10.763 1.00 1.24 C ATOM 3053 C ARG B 88 -10.698 0.987 11.155 1.00 1.20 C ATOM 3054 O ARG B 88 -11.259 0.547 12.156 1.00 1.47 O ATOM 3055 CB ARG B 88 -11.600 3.299 11.797 1.00 1.61 C ATOM 3056 CG ARG B 88 -13.085 2.901 11.935 1.00 3.47 C ATOM 3057 CD ARG B 88 -13.905 3.984 12.644 1.00 4.16 C ATOM 3058 NE ARG B 88 -15.335 3.635 12.617 1.00 6.31 N ATOM 3059 CZ ARG B 88 -16.348 4.482 12.866 1.00 7.52 C ATOM 3060 NH1 ARG B 88 -16.089 5.716 13.311 1.00 7.00 N ATOM 3061 NH2 ARG B 88 -17.611 4.090 12.665 1.00 9.57 N ATOM 0 H ARG B 88 -12.442 2.861 9.540 1.00 1.13 H new ATOM 0 HA ARG B 88 -9.789 2.840 10.724 1.00 1.24 H new ATOM 0 HB2 ARG B 88 -11.117 3.199 12.769 1.00 1.61 H new ATOM 0 HB3 ARG B 88 -11.542 4.351 11.519 1.00 1.61 H new ATOM 0 HG2 ARG B 88 -13.505 2.717 10.946 1.00 3.47 H new ATOM 0 HG3 ARG B 88 -13.160 1.967 12.491 1.00 3.47 H new ATOM 0 HD2 ARG B 88 -13.568 4.090 13.675 1.00 4.16 H new ATOM 0 HD3 ARG B 88 -13.748 4.947 12.157 1.00 4.16 H new ATOM 0 HE ARG B 88 -15.577 2.670 12.391 1.00 6.31 H new ATOM 0 HH11 ARG B 88 -15.124 6.012 13.461 1.00 7.00 H new ATOM 0 HH12 ARG B 88 -16.856 6.361 13.501 1.00 7.00 H new ATOM 0 HH21 ARG B 88 -17.805 3.149 12.323 1.00 9.57 H new ATOM 0 HH22 ARG B 88 -18.381 4.732 12.854 1.00 9.57 H new ATOM 3075 N LYS B 89 -9.930 0.228 10.370 1.00 1.09 N ATOM 3076 CA LYS B 89 -9.705 -1.199 10.580 1.00 1.14 C ATOM 3077 C LYS B 89 -9.345 -1.537 12.031 1.00 1.25 C ATOM 3078 O LYS B 89 -9.881 -2.492 12.597 1.00 1.20 O ATOM 3079 CB LYS B 89 -8.609 -1.694 9.623 1.00 1.57 C ATOM 3080 CG LYS B 89 -9.222 -2.192 8.313 1.00 1.67 C ATOM 3081 CD LYS B 89 -8.147 -2.522 7.267 1.00 2.06 C ATOM 3082 CE LYS B 89 -8.725 -3.479 6.209 1.00 2.98 C ATOM 3083 NZ LYS B 89 -7.746 -3.794 5.159 1.00 3.90 N ATOM 0 H LYS B 89 -9.439 0.598 9.556 1.00 1.09 H new ATOM 0 HA LYS B 89 -10.643 -1.713 10.367 1.00 1.14 H new ATOM 0 HB2 LYS B 89 -7.906 -0.887 9.418 1.00 1.57 H new ATOM 0 HB3 LYS B 89 -8.043 -2.497 10.094 1.00 1.57 H new ATOM 0 HG2 LYS B 89 -9.823 -3.080 8.508 1.00 1.67 H new ATOM 0 HG3 LYS B 89 -9.895 -1.432 7.915 1.00 1.67 H new ATOM 0 HD2 LYS B 89 -7.797 -1.606 6.790 1.00 2.06 H new ATOM 0 HD3 LYS B 89 -7.284 -2.979 7.751 1.00 2.06 H new ATOM 0 HE2 LYS B 89 -9.048 -4.401 6.692 1.00 2.98 H new ATOM 0 HE3 LYS B 89 -9.609 -3.029 5.757 1.00 2.98 H new ATOM 0 HZ1 LYS B 89 -7.819 -4.800 4.907 1.00 3.90 H new ATOM 0 HZ2 LYS B 89 -7.938 -3.212 4.319 1.00 3.90 H new ATOM 0 HZ3 LYS B 89 -6.787 -3.593 5.507 1.00 3.90 H new ATOM 3097 N LYS B 90 -8.436 -0.761 12.634 1.00 1.65 N ATOM 3098 CA LYS B 90 -7.982 -0.970 14.007 1.00 2.09 C ATOM 3099 C LYS B 90 -9.046 -0.474 14.999 1.00 1.87 C ATOM 3100 O LYS B 90 -8.790 0.391 15.836 1.00 2.45 O ATOM 3101 CB LYS B 90 -6.596 -0.323 14.201 1.00 3.45 C ATOM 3102 CG LYS B 90 -5.718 -1.018 15.259 1.00 4.72 C ATOM 3103 CD LYS B 90 -6.286 -0.949 16.685 1.00 5.79 C ATOM 3104 CE LYS B 90 -5.294 -1.537 17.698 1.00 7.42 C ATOM 3105 NZ LYS B 90 -5.827 -1.506 19.078 1.00 8.53 N ATOM 0 H LYS B 90 -7.993 0.035 12.175 1.00 1.65 H new ATOM 0 HA LYS B 90 -7.857 -2.034 14.209 1.00 2.09 H new ATOM 0 HB2 LYS B 90 -6.068 -0.328 13.247 1.00 3.45 H new ATOM 0 HB3 LYS B 90 -6.731 0.721 14.486 1.00 3.45 H new ATOM 0 HG2 LYS B 90 -5.590 -2.064 14.980 1.00 4.72 H new ATOM 0 HG3 LYS B 90 -4.728 -0.562 15.251 1.00 4.72 H new ATOM 0 HD2 LYS B 90 -6.505 0.087 16.944 1.00 5.79 H new ATOM 0 HD3 LYS B 90 -7.228 -1.496 16.733 1.00 5.79 H new ATOM 0 HE2 LYS B 90 -5.061 -2.566 17.422 1.00 7.42 H new ATOM 0 HE3 LYS B 90 -4.360 -0.977 17.658 1.00 7.42 H new ATOM 0 HZ1 LYS B 90 -5.126 -1.912 19.730 1.00 8.53 H new ATOM 0 HZ2 LYS B 90 -6.025 -0.522 19.352 1.00 8.53 H new ATOM 0 HZ3 LYS B 90 -6.705 -2.062 19.124 1.00 8.53 H new ATOM 3119 N LYS B 91 -10.234 -1.067 14.926 1.00 2.26 N ATOM 3120 CA LYS B 91 -11.307 -0.942 15.894 1.00 3.63 C ATOM 3121 C LYS B 91 -12.058 -2.272 15.859 1.00 3.72 C ATOM 3122 O LYS B 91 -12.095 -2.974 16.867 1.00 4.58 O ATOM 3123 CB LYS B 91 -12.171 0.292 15.571 1.00 4.82 C ATOM 3124 CG LYS B 91 -13.249 0.619 16.624 1.00 5.80 C ATOM 3125 CD LYS B 91 -14.469 -0.298 16.479 1.00 6.35 C ATOM 3126 CE LYS B 91 -15.671 0.097 17.343 1.00 7.31 C ATOM 3127 NZ LYS B 91 -16.718 -0.945 17.268 1.00 7.85 N ATOM 0 H LYS B 91 -10.482 -1.678 14.148 1.00 2.26 H new ATOM 0 HA LYS B 91 -10.954 -0.766 16.910 1.00 3.63 H new ATOM 0 HB2 LYS B 91 -11.517 1.157 15.460 1.00 4.82 H new ATOM 0 HB3 LYS B 91 -12.658 0.135 14.609 1.00 4.82 H new ATOM 0 HG2 LYS B 91 -12.828 0.511 17.624 1.00 5.80 H new ATOM 0 HG3 LYS B 91 -13.559 1.659 16.519 1.00 5.80 H new ATOM 0 HD2 LYS B 91 -14.777 -0.308 15.434 1.00 6.35 H new ATOM 0 HD3 LYS B 91 -14.174 -1.316 16.734 1.00 6.35 H new ATOM 0 HE2 LYS B 91 -15.356 0.232 18.378 1.00 7.31 H new ATOM 0 HE3 LYS B 91 -16.073 1.052 17.005 1.00 7.31 H new ATOM 0 HZ1 LYS B 91 -17.621 -0.555 17.607 1.00 7.85 H new ATOM 0 HZ2 LYS B 91 -16.825 -1.260 16.283 1.00 7.85 H new ATOM 0 HZ3 LYS B 91 -16.446 -1.754 17.862 1.00 7.85 H new ATOM 3141 N ASP B 92 -12.622 -2.634 14.701 1.00 3.19 N ATOM 3142 CA ASP B 92 -13.356 -3.882 14.519 1.00 3.28 C ATOM 3143 C ASP B 92 -13.332 -4.347 13.057 1.00 2.57 C ATOM 3144 O ASP B 92 -14.371 -4.679 12.491 1.00 2.70 O ATOM 3145 CB ASP B 92 -14.801 -3.722 15.037 1.00 4.16 C ATOM 3146 CG ASP B 92 -15.572 -2.545 14.442 1.00 5.78 C ATOM 3147 OD1 ASP B 92 -15.051 -1.883 13.519 1.00 6.46 O ATOM 3148 OD2 ASP B 92 -16.632 -2.226 15.031 1.00 6.80 O ATOM 0 H ASP B 92 -12.579 -2.060 13.859 1.00 3.19 H new ATOM 0 HA ASP B 92 -12.861 -4.659 15.102 1.00 3.28 H new ATOM 0 HB2 ASP B 92 -15.350 -4.640 14.828 1.00 4.16 H new ATOM 0 HB3 ASP B 92 -14.772 -3.608 16.121 1.00 4.16 H new ATOM 3153 N LEU B 93 -12.133 -4.518 12.481 1.00 2.03 N ATOM 3154 CA LEU B 93 -12.034 -5.124 11.156 1.00 1.40 C ATOM 3155 C LEU B 93 -12.435 -6.599 11.239 1.00 0.99 C ATOM 3156 O LEU B 93 -13.498 -6.990 10.767 1.00 1.06 O ATOM 3157 CB LEU B 93 -10.585 -4.974 10.656 1.00 1.59 C ATOM 3158 CG LEU B 93 -10.231 -5.791 9.400 1.00 1.71 C ATOM 3159 CD1 LEU B 93 -11.126 -5.538 8.180 1.00 3.72 C ATOM 3160 CD2 LEU B 93 -8.730 -5.705 9.099 1.00 2.17 C ATOM 0 H LEU B 93 -11.243 -4.252 12.902 1.00 2.03 H new ATOM 0 HA LEU B 93 -12.706 -4.628 10.456 1.00 1.40 H new ATOM 0 HB2 LEU B 93 -10.398 -3.921 10.448 1.00 1.59 H new ATOM 0 HB3 LEU B 93 -9.909 -5.265 11.460 1.00 1.59 H new ATOM 0 HG LEU B 93 -10.460 -6.829 9.643 1.00 1.71 H new ATOM 0 HD11 LEU B 93 -10.794 -6.161 7.350 1.00 3.72 H new ATOM 0 HD12 LEU B 93 -12.158 -5.785 8.429 1.00 3.72 H new ATOM 0 HD13 LEU B 93 -11.063 -4.488 7.894 1.00 3.72 H new ATOM 0 HD21 LEU B 93 -8.504 -6.290 8.208 1.00 2.17 H new ATOM 0 HD22 LEU B 93 -8.452 -4.665 8.931 1.00 2.17 H new ATOM 0 HD23 LEU B 93 -8.166 -6.099 9.944 1.00 2.17 H new ATOM 3172 N LYS B 94 -11.659 -7.394 11.985 1.00 1.20 N ATOM 3173 CA LYS B 94 -11.808 -8.850 11.980 1.00 1.33 C ATOM 3174 C LYS B 94 -13.117 -9.247 12.660 1.00 1.39 C ATOM 3175 O LYS B 94 -13.736 -10.252 12.316 1.00 1.53 O ATOM 3176 CB LYS B 94 -10.613 -9.490 12.728 1.00 2.02 C ATOM 3177 CG LYS B 94 -9.922 -10.704 12.110 1.00 2.33 C ATOM 3178 CD LYS B 94 -9.399 -10.502 10.696 1.00 3.29 C ATOM 3179 CE LYS B 94 -8.554 -9.243 10.484 1.00 4.76 C ATOM 3180 NZ LYS B 94 -8.232 -9.062 9.055 1.00 6.12 N ATOM 0 H LYS B 94 -10.921 -7.051 12.600 1.00 1.20 H new ATOM 0 HA LYS B 94 -11.826 -9.206 10.950 1.00 1.33 H new ATOM 0 HB2 LYS B 94 -9.858 -8.716 12.867 1.00 2.02 H new ATOM 0 HB3 LYS B 94 -10.961 -9.778 13.720 1.00 2.02 H new ATOM 0 HG2 LYS B 94 -9.089 -10.993 12.751 1.00 2.33 H new ATOM 0 HG3 LYS B 94 -10.624 -11.538 12.105 1.00 2.33 H new ATOM 0 HD2 LYS B 94 -8.802 -11.371 10.420 1.00 3.29 H new ATOM 0 HD3 LYS B 94 -10.248 -10.469 10.014 1.00 3.29 H new ATOM 0 HE2 LYS B 94 -9.094 -8.371 10.853 1.00 4.76 H new ATOM 0 HE3 LYS B 94 -7.633 -9.316 11.062 1.00 4.76 H new ATOM 0 HZ1 LYS B 94 -7.968 -8.071 8.881 1.00 6.12 H new ATOM 0 HZ2 LYS B 94 -7.438 -9.682 8.797 1.00 6.12 H new ATOM 0 HZ3 LYS B 94 -9.063 -9.305 8.478 1.00 6.12 H new ATOM 3194 N ILE B 95 -13.501 -8.448 13.657 1.00 1.49 N ATOM 3195 CA ILE B 95 -14.733 -8.591 14.402 1.00 1.84 C ATOM 3196 C ILE B 95 -15.946 -8.349 13.498 1.00 1.93 C ATOM 3197 O ILE B 95 -17.033 -8.788 13.861 1.00 2.28 O ATOM 3198 CB ILE B 95 -14.681 -7.687 15.655 1.00 2.10 C ATOM 3199 CG1 ILE B 95 -13.643 -8.204 16.672 1.00 2.77 C ATOM 3200 CG2 ILE B 95 -16.033 -7.579 16.374 1.00 3.08 C ATOM 3201 CD1 ILE B 95 -12.271 -7.544 16.516 1.00 3.41 C ATOM 0 H ILE B 95 -12.936 -7.659 13.972 1.00 1.49 H new ATOM 0 HA ILE B 95 -14.847 -9.614 14.760 1.00 1.84 H new ATOM 0 HB ILE B 95 -14.401 -6.700 15.287 1.00 2.10 H new ATOM 0 HG12 ILE B 95 -14.013 -8.026 17.682 1.00 2.77 H new ATOM 0 HG13 ILE B 95 -13.536 -9.283 16.557 1.00 2.77 H new ATOM 0 HG21 ILE B 95 -15.931 -6.931 17.245 1.00 3.08 H new ATOM 0 HG22 ILE B 95 -16.774 -7.159 15.694 1.00 3.08 H new ATOM 0 HG23 ILE B 95 -16.355 -8.570 16.694 1.00 3.08 H new ATOM 0 HD11 ILE B 95 -11.585 -7.950 17.260 1.00 3.41 H new ATOM 0 HD12 ILE B 95 -11.883 -7.744 15.517 1.00 3.41 H new ATOM 0 HD13 ILE B 95 -12.367 -6.468 16.660 1.00 3.41 H new ATOM 3213 N ARG B 96 -15.757 -7.686 12.346 1.00 1.73 N ATOM 3214 CA ARG B 96 -16.723 -7.488 11.272 1.00 1.89 C ATOM 3215 C ARG B 96 -18.178 -7.304 11.726 1.00 2.63 C ATOM 3216 O ARG B 96 -18.904 -8.267 11.950 1.00 4.24 O ATOM 3217 CB ARG B 96 -16.573 -8.561 10.199 1.00 1.75 C ATOM 3218 CG ARG B 96 -16.911 -9.987 10.655 1.00 2.79 C ATOM 3219 CD ARG B 96 -18.184 -10.515 9.985 1.00 2.74 C ATOM 3220 NE ARG B 96 -18.128 -11.968 9.850 1.00 3.87 N ATOM 3221 CZ ARG B 96 -18.895 -12.701 9.037 1.00 4.28 C ATOM 3222 NH1 ARG B 96 -19.955 -12.170 8.418 1.00 3.76 N ATOM 3223 NH2 ARG B 96 -18.545 -13.975 8.846 1.00 5.91 N ATOM 0 H ARG B 96 -14.861 -7.247 12.133 1.00 1.73 H new ATOM 0 HA ARG B 96 -16.472 -6.523 10.831 1.00 1.89 H new ATOM 0 HB2 ARG B 96 -17.215 -8.303 9.357 1.00 1.75 H new ATOM 0 HB3 ARG B 96 -15.546 -8.547 9.833 1.00 1.75 H new ATOM 0 HG2 ARG B 96 -16.077 -10.650 10.423 1.00 2.79 H new ATOM 0 HG3 ARG B 96 -17.038 -10.001 11.738 1.00 2.79 H new ATOM 0 HD2 ARG B 96 -19.056 -10.232 10.575 1.00 2.74 H new ATOM 0 HD3 ARG B 96 -18.301 -10.057 9.003 1.00 2.74 H new ATOM 0 HE ARG B 96 -17.447 -12.465 10.424 1.00 3.87 H new ATOM 0 HH11 ARG B 96 -20.191 -11.188 8.562 1.00 3.76 H new ATOM 0 HH12 ARG B 96 -20.527 -12.747 7.802 1.00 3.76 H new ATOM 0 HH21 ARG B 96 -17.720 -14.353 9.313 1.00 5.91 H new ATOM 0 HH22 ARG B 96 -19.102 -14.571 8.233 1.00 5.91 H new ATOM 3237 N LYS B 97 -18.659 -6.060 11.785 1.00 2.27 N ATOM 3238 CA LYS B 97 -20.076 -5.826 12.051 1.00 2.69 C ATOM 3239 C LYS B 97 -20.976 -6.468 10.977 1.00 2.79 C ATOM 3240 O LYS B 97 -22.169 -6.655 11.210 1.00 3.57 O ATOM 3241 CB LYS B 97 -20.333 -4.318 12.208 1.00 3.50 C ATOM 3242 CG LYS B 97 -21.749 -4.055 12.741 1.00 4.25 C ATOM 3243 CD LYS B 97 -21.957 -2.583 13.110 1.00 5.51 C ATOM 3244 CE LYS B 97 -23.385 -2.399 13.647 1.00 6.50 C ATOM 3245 NZ LYS B 97 -23.673 -1.000 14.020 1.00 7.72 N ATOM 0 H LYS B 97 -18.100 -5.217 11.655 1.00 2.27 H new ATOM 0 HA LYS B 97 -20.341 -6.314 12.989 1.00 2.69 H new ATOM 0 HB2 LYS B 97 -19.598 -3.889 12.889 1.00 3.50 H new ATOM 0 HB3 LYS B 97 -20.204 -3.821 11.246 1.00 3.50 H new ATOM 0 HG2 LYS B 97 -22.480 -4.347 11.987 1.00 4.25 H new ATOM 0 HG3 LYS B 97 -21.928 -4.678 13.617 1.00 4.25 H new ATOM 0 HD2 LYS B 97 -21.230 -2.277 13.862 1.00 5.51 H new ATOM 0 HD3 LYS B 97 -21.799 -1.950 12.237 1.00 5.51 H new ATOM 0 HE2 LYS B 97 -24.099 -2.724 12.890 1.00 6.50 H new ATOM 0 HE3 LYS B 97 -23.528 -3.040 14.517 1.00 6.50 H new ATOM 0 HZ1 LYS B 97 -24.648 -0.929 14.376 1.00 7.72 H new ATOM 0 HZ2 LYS B 97 -23.011 -0.695 14.762 1.00 7.72 H new ATOM 0 HZ3 LYS B 97 -23.564 -0.389 13.186 1.00 7.72 H new ATOM 3259 N LYS B 98 -20.415 -6.765 9.802 1.00 3.23 N ATOM 3260 CA LYS B 98 -21.090 -7.295 8.635 1.00 4.75 C ATOM 3261 C LYS B 98 -20.257 -8.476 8.133 1.00 5.60 C ATOM 3262 O LYS B 98 -19.151 -8.210 7.616 1.00 6.45 O ATOM 3263 CB LYS B 98 -21.151 -6.140 7.630 1.00 5.87 C ATOM 3264 CG LYS B 98 -21.556 -6.518 6.202 1.00 7.43 C ATOM 3265 CD LYS B 98 -21.466 -5.226 5.380 1.00 8.57 C ATOM 3266 CE LYS B 98 -21.420 -5.469 3.869 1.00 10.30 C ATOM 3267 NZ LYS B 98 -20.869 -4.283 3.179 1.00 11.81 N ATOM 3268 OXT LYS B 98 -20.707 -9.633 8.296 1.00 5.98 O ATOM 0 H LYS B 98 -19.417 -6.630 9.640 1.00 3.23 H new ATOM 0 HA LYS B 98 -22.101 -7.657 8.821 1.00 4.75 H new ATOM 0 HB2 LYS B 98 -21.856 -5.397 8.002 1.00 5.87 H new ATOM 0 HB3 LYS B 98 -20.172 -5.662 7.595 1.00 5.87 H new ATOM 0 HG2 LYS B 98 -20.894 -7.284 5.799 1.00 7.43 H new ATOM 0 HG3 LYS B 98 -22.567 -6.926 6.178 1.00 7.43 H new ATOM 0 HD2 LYS B 98 -22.324 -4.595 5.613 1.00 8.57 H new ATOM 0 HD3 LYS B 98 -20.574 -4.675 5.679 1.00 8.57 H new ATOM 0 HE2 LYS B 98 -20.806 -6.343 3.652 1.00 10.30 H new ATOM 0 HE3 LYS B 98 -22.422 -5.683 3.497 1.00 10.30 H new ATOM 0 HZ1 LYS B 98 -20.605 -4.539 2.206 1.00 11.81 H new ATOM 0 HZ2 LYS B 98 -21.586 -3.530 3.156 1.00 11.81 H new ATOM 0 HZ3 LYS B 98 -20.028 -3.945 3.688 1.00 11.81 H new TER 3282 LYS B 98