USER MOD reduce.3.24.130724 H: found=0, std=0, add=1668, rem=0, adj=51 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: B 36 ASN : amide:sc= 1.96 K(o=4.3,f=-5.5!) USER MOD Set 1.2: B 39 LYS NZ :NH3+ 162:sc= 2.28 (180deg=0.75) USER MOD Set 1.3: B 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.4: B 67 GLN : amide:sc= 0.0914 K(o=4.3,f=-5.5) USER MOD Set 2.1: B 55 SER OG : rot -81:sc= 1.35 USER MOD Set 2.2: B 85 LYS NZ :NH3+ 180:sc= -0.162! (180deg=-0.898!) USER MOD Set 3.1: B 1 MET N :NH3+ 162:sc= 0.82 (180deg=-0.181) USER MOD Set 3.2: B 12 SER OG : rot 180:sc= 0.335 USER MOD Set 4.1: A 55 SER OG : rot -146:sc= 2.28 USER MOD Set 4.2: A 85 LYS NZ :NH3+ 178:sc= 1.27 (180deg=0) USER MOD Set 5.1: A 66 ASN : amide:sc= 0.948 K(o=2,f=1.2) USER MOD Set 5.2: A 69 SER OG : rot 41:sc= 1.03 USER MOD Set 6.1: A 44 GLN : amide:sc= -0.618 K(o=-0.18,f=-1.5) USER MOD Set 6.2: A 45 GLN : amide:sc= 0.442 K(o=-0.18,f=-1.5!) USER MOD Set 7.1: A 36 ASN : amide:sc= 0.708 K(o=2.8,f=-11!) USER MOD Set 7.2: A 39 LYS NZ :NH3+ 179:sc= 2.13 (180deg=0.862) USER MOD Set 8.1: A 18 THR OG1 : rot 180:sc= 0 USER MOD Set 8.2: A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -119:sc= 0.0406 (180deg=-0.0653) USER MOD Single : A 7 THR OG1 : rot 9:sc= 0.597 USER MOD Single : A 12 SER OG : rot 120:sc= -0.814 USER MOD Single : A 15 THR OG1 : rot -66:sc= 1.26 USER MOD Single : A 19 THR OG1 : rot -46:sc= 1.26 USER MOD Single : A 26 GLN : amide:sc= 0 K(o=0,f=-0.83) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 170:sc= 0.35 USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 43 THR OG1 : rot -25:sc= 0.315 USER MOD Single : A 48 HIS : no HE2:sc= -1.7 K(o=-1.7,f=-6.2!) USER MOD Single : A 51 LYS NZ :NH3+ -165:sc= -0.0513 (180deg=-0.401) USER MOD Single : A 59 LYS NZ :NH3+ -173:sc= 1.29 (180deg=0.885) USER MOD Single : A 60 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ -109:sc= 2.15 (180deg=-0.0497) USER MOD Single : A 62 SER OG : rot 93:sc= 1.2 USER MOD Single : A 67 GLN : amide:sc= -0.963 K(o=-0.96,f=-4.3!) USER MOD Single : A 72 LYS NZ :NH3+ 176:sc= -0.117! (180deg=-0.188!) USER MOD Single : A 74 ASN : amide:sc= -0.89 K(o=-0.89,f=-1.7) USER MOD Single : A 76 TYR OH : rot 30:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ -140:sc= 1.91 (180deg=0.252) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ -171:sc= 0.149 (180deg=0.134) USER MOD Single : A 94 LYS NZ :NH3+ -140:sc= 1.19 (180deg=1.08) USER MOD Single : A 97 LYS NZ :NH3+ 148:sc= 1.19 (180deg=0.539) USER MOD Single : A 98 LYS NZ :NH3+ 166:sc= -0.48 (180deg=-0.866) USER MOD Single : B 1 MET CE :methyl 175:sc= -2.8 (180deg=-3.12) USER MOD Single : B 7 THR OG1 : rot 180:sc= 0.0689 USER MOD Single : B 15 THR OG1 : rot 84:sc= 0.0194 USER MOD Single : B 18 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 69:sc= 1.25 USER MOD Single : B 22 THR OG1 : rot -52:sc= 0.463 USER MOD Single : B 26 GLN : amide:sc= 0.15 X(o=0.15,f=0) USER MOD Single : B 30 LYS NZ :NH3+ 141:sc= 0.937 (180deg=-3.48!) USER MOD Single : B 32 SER OG : rot -74:sc= 0.708 USER MOD Single : B 34 SER OG : rot 180:sc= 0 USER MOD Single : B 43 THR OG1 : rot 180:sc= 0 USER MOD Single : B 44 GLN : amide:sc= 0 X(o=0,f=-0.0068) USER MOD Single : B 45 GLN : amide:sc= -0.0172 K(o=-0.017,f=-1.6) USER MOD Single : B 48 HIS : no HD1:sc= 0.0561 K(o=0.056,f=-0.54) USER MOD Single : B 51 LYS NZ :NH3+ -172:sc= -0.0521 (180deg=-0.149) USER MOD Single : B 59 LYS NZ :NH3+ 179:sc= 0.986 (180deg=0.95) USER MOD Single : B 61 LYS NZ :NH3+ -157:sc= 1 (180deg=-1.59!) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= -0.267 X(o=-0.27,f=-0.02) USER MOD Single : B 69 SER OG : rot -83:sc= 1.04 USER MOD Single : B 72 LYS NZ :NH3+ -159:sc= 1.26 (180deg=1.1) USER MOD Single : B 74 ASN : amide:sc= 1.07 K(o=1.1,f=-2.9!) USER MOD Single : B 76 TYR OH : rot 180:sc= 0 USER MOD Single : B 89 LYS NZ :NH3+ 156:sc= 0.513 (180deg=-0.737) USER MOD Single : B 90 LYS NZ :NH3+ 156:sc= 0.693! (180deg=-0.938!) USER MOD Single : B 91 LYS NZ :NH3+ 177:sc= 1.17 (180deg=1.06) USER MOD Single : B 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 97 LYS NZ :NH3+ 172:sc= 1.29 (180deg=1.19) USER MOD Single : B 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -8.499 -17.767 12.989 1.00 4.74 N ATOM 2 CA MET A 1 -9.918 -17.750 13.382 1.00 3.86 C ATOM 3 C MET A 1 -10.520 -16.520 12.716 1.00 3.04 C ATOM 4 O MET A 1 -9.860 -15.486 12.741 1.00 2.83 O ATOM 5 CB MET A 1 -10.070 -17.653 14.907 1.00 4.01 C ATOM 6 CG MET A 1 -9.586 -18.904 15.653 1.00 4.63 C ATOM 7 SD MET A 1 -9.661 -18.747 17.456 1.00 5.40 S ATOM 8 CE MET A 1 -9.012 -20.361 17.944 1.00 6.02 C ATOM 0 H1 MET A 1 -8.296 -18.638 12.459 1.00 4.74 H new ATOM 0 H2 MET A 1 -8.295 -16.942 12.390 1.00 4.74 H new ATOM 0 H3 MET A 1 -7.903 -17.733 13.840 1.00 4.74 H new ATOM 0 HA MET A 1 -10.419 -18.668 13.074 1.00 3.86 H new ATOM 0 HB2 MET A 1 -9.512 -16.788 15.265 1.00 4.01 H new ATOM 0 HB3 MET A 1 -11.118 -17.479 15.149 1.00 4.01 H new ATOM 0 HG2 MET A 1 -10.191 -19.757 15.345 1.00 4.63 H new ATOM 0 HG3 MET A 1 -8.559 -19.118 15.358 1.00 4.63 H new ATOM 0 HE1 MET A 1 -8.991 -20.431 19.032 1.00 6.02 H new ATOM 0 HE2 MET A 1 -9.652 -21.147 17.542 1.00 6.02 H new ATOM 0 HE3 MET A 1 -8.002 -20.480 17.553 1.00 6.02 H new ATOM 20 N ALA A 2 -11.678 -16.646 12.064 1.00 3.13 N ATOM 21 CA ALA A 2 -12.286 -15.578 11.287 1.00 2.73 C ATOM 22 C ALA A 2 -13.784 -15.858 11.192 1.00 2.95 C ATOM 23 O ALA A 2 -14.173 -17.025 11.238 1.00 3.69 O ATOM 24 CB ALA A 2 -11.649 -15.561 9.891 1.00 3.24 C ATOM 0 H ALA A 2 -12.223 -17.508 12.065 1.00 3.13 H new ATOM 0 HA ALA A 2 -12.128 -14.607 11.756 1.00 2.73 H new ATOM 0 HB1 ALA A 2 -12.096 -14.764 9.297 1.00 3.24 H new ATOM 0 HB2 ALA A 2 -10.577 -15.388 9.982 1.00 3.24 H new ATOM 0 HB3 ALA A 2 -11.821 -16.519 9.401 1.00 3.24 H new ATOM 30 N ALA A 3 -14.604 -14.817 11.040 1.00 2.58 N ATOM 31 CA ALA A 3 -15.908 -14.929 10.397 1.00 2.82 C ATOM 32 C ALA A 3 -16.336 -13.567 9.835 1.00 2.39 C ATOM 33 O ALA A 3 -17.453 -13.109 10.074 1.00 2.64 O ATOM 34 CB ALA A 3 -16.941 -15.472 11.394 1.00 3.50 C ATOM 0 H ALA A 3 -14.380 -13.875 11.360 1.00 2.58 H new ATOM 0 HA ALA A 3 -15.842 -15.630 9.565 1.00 2.82 H new ATOM 0 HB1 ALA A 3 -17.912 -15.552 10.905 1.00 3.50 H new ATOM 0 HB2 ALA A 3 -16.628 -16.456 11.743 1.00 3.50 H new ATOM 0 HB3 ALA A 3 -17.018 -14.794 12.244 1.00 3.50 H new ATOM 40 N GLU A 4 -15.469 -12.967 9.017 1.00 1.91 N ATOM 41 CA GLU A 4 -15.664 -11.708 8.320 1.00 1.57 C ATOM 42 C GLU A 4 -15.663 -11.940 6.808 1.00 1.58 C ATOM 43 O GLU A 4 -14.926 -12.798 6.324 1.00 1.65 O ATOM 44 CB GLU A 4 -14.600 -10.686 8.772 1.00 1.30 C ATOM 45 CG GLU A 4 -13.118 -11.042 8.544 1.00 1.64 C ATOM 46 CD GLU A 4 -12.467 -11.935 9.599 1.00 3.26 C ATOM 47 OE1 GLU A 4 -13.188 -12.769 10.186 1.00 4.38 O ATOM 48 OE2 GLU A 4 -11.253 -11.774 9.822 1.00 3.97 O ATOM 0 H GLU A 4 -14.558 -13.378 8.816 1.00 1.91 H new ATOM 0 HA GLU A 4 -16.637 -11.288 8.574 1.00 1.57 H new ATOM 0 HB2 GLU A 4 -14.801 -9.745 8.260 1.00 1.30 H new ATOM 0 HB3 GLU A 4 -14.741 -10.505 9.838 1.00 1.30 H new ATOM 0 HG2 GLU A 4 -13.030 -11.535 7.576 1.00 1.64 H new ATOM 0 HG3 GLU A 4 -12.549 -10.114 8.482 1.00 1.64 H new ATOM 55 N PRO A 5 -16.469 -11.202 6.026 1.00 1.64 N ATOM 56 CA PRO A 5 -16.567 -11.420 4.595 1.00 1.75 C ATOM 57 C PRO A 5 -15.429 -10.679 3.886 1.00 1.57 C ATOM 58 O PRO A 5 -15.676 -9.894 2.972 1.00 1.59 O ATOM 59 CB PRO A 5 -17.954 -10.877 4.232 1.00 2.00 C ATOM 60 CG PRO A 5 -18.097 -9.676 5.168 1.00 1.99 C ATOM 61 CD PRO A 5 -17.350 -10.114 6.431 1.00 1.74 C ATOM 0 HA PRO A 5 -16.468 -12.462 4.292 1.00 1.75 H new ATOM 0 HB2 PRO A 5 -18.013 -10.583 3.184 1.00 2.00 H new ATOM 0 HB3 PRO A 5 -18.736 -11.617 4.400 1.00 2.00 H new ATOM 0 HG2 PRO A 5 -17.660 -8.776 4.735 1.00 1.99 H new ATOM 0 HG3 PRO A 5 -19.143 -9.453 5.378 1.00 1.99 H new ATOM 0 HD2 PRO A 5 -16.779 -9.287 6.852 1.00 1.74 H new ATOM 0 HD3 PRO A 5 -18.047 -10.444 7.201 1.00 1.74 H new ATOM 69 N LEU A 6 -14.179 -10.923 4.291 1.00 1.48 N ATOM 70 CA LEU A 6 -13.052 -10.172 3.742 1.00 1.38 C ATOM 71 C LEU A 6 -12.648 -10.734 2.372 1.00 1.36 C ATOM 72 O LEU A 6 -13.116 -11.796 1.961 1.00 1.72 O ATOM 73 CB LEU A 6 -11.908 -10.095 4.770 1.00 1.40 C ATOM 74 CG LEU A 6 -10.976 -11.309 4.978 1.00 1.31 C ATOM 75 CD1 LEU A 6 -11.660 -12.681 4.989 1.00 2.98 C ATOM 76 CD2 LEU A 6 -9.809 -11.316 3.985 1.00 2.01 C ATOM 0 H LEU A 6 -13.926 -11.625 4.987 1.00 1.48 H new ATOM 0 HA LEU A 6 -13.344 -9.139 3.554 1.00 1.38 H new ATOM 0 HB2 LEU A 6 -11.280 -9.248 4.494 1.00 1.40 H new ATOM 0 HB3 LEU A 6 -12.355 -9.860 5.736 1.00 1.40 H new ATOM 0 HG LEU A 6 -10.600 -11.161 5.990 1.00 1.31 H new ATOM 0 HD11 LEU A 6 -10.912 -13.459 5.142 1.00 2.98 H new ATOM 0 HD12 LEU A 6 -12.391 -12.717 5.797 1.00 2.98 H new ATOM 0 HD13 LEU A 6 -12.164 -12.844 4.036 1.00 2.98 H new ATOM 0 HD21 LEU A 6 -9.180 -12.187 4.169 1.00 2.01 H new ATOM 0 HD22 LEU A 6 -10.197 -11.357 2.967 1.00 2.01 H new ATOM 0 HD23 LEU A 6 -9.218 -10.409 4.112 1.00 2.01 H new ATOM 88 N THR A 7 -11.857 -9.988 1.597 1.00 1.10 N ATOM 89 CA THR A 7 -11.488 -10.333 0.226 1.00 1.14 C ATOM 90 C THR A 7 -10.162 -9.637 -0.086 1.00 1.11 C ATOM 91 O THR A 7 -9.855 -8.627 0.545 1.00 1.29 O ATOM 92 CB THR A 7 -12.624 -9.916 -0.732 1.00 1.45 C ATOM 93 OG1 THR A 7 -13.749 -10.748 -0.540 1.00 2.06 O ATOM 94 CG2 THR A 7 -12.254 -10.026 -2.216 1.00 1.39 C ATOM 0 H THR A 7 -11.448 -9.109 1.914 1.00 1.10 H new ATOM 0 HA THR A 7 -11.352 -11.407 0.099 1.00 1.14 H new ATOM 0 HB THR A 7 -12.827 -8.872 -0.495 1.00 1.45 H new ATOM 0 HG1 THR A 7 -13.609 -11.311 0.250 1.00 2.06 H new ATOM 0 HG21 THR A 7 -13.102 -9.716 -2.826 1.00 1.39 H new ATOM 0 HG22 THR A 7 -11.401 -9.382 -2.427 1.00 1.39 H new ATOM 0 HG23 THR A 7 -11.996 -11.059 -2.451 1.00 1.39 H new ATOM 102 N GLU A 8 -9.397 -10.175 -1.047 1.00 1.10 N ATOM 103 CA GLU A 8 -8.010 -9.836 -1.355 1.00 1.11 C ATOM 104 C GLU A 8 -7.710 -8.338 -1.236 1.00 1.14 C ATOM 105 O GLU A 8 -6.766 -7.938 -0.556 1.00 1.24 O ATOM 106 CB GLU A 8 -7.683 -10.298 -2.783 1.00 1.19 C ATOM 107 CG GLU A 8 -7.809 -11.812 -2.993 1.00 1.28 C ATOM 108 CD GLU A 8 -7.464 -12.168 -4.434 1.00 1.61 C ATOM 109 OE1 GLU A 8 -8.246 -11.747 -5.312 1.00 2.24 O ATOM 110 OE2 GLU A 8 -6.426 -12.836 -4.630 1.00 2.81 O ATOM 0 H GLU A 8 -9.757 -10.902 -1.665 1.00 1.10 H new ATOM 0 HA GLU A 8 -7.389 -10.347 -0.619 1.00 1.11 H new ATOM 0 HB2 GLU A 8 -8.348 -9.788 -3.480 1.00 1.19 H new ATOM 0 HB3 GLU A 8 -6.667 -9.991 -3.030 1.00 1.19 H new ATOM 0 HG2 GLU A 8 -7.143 -12.339 -2.310 1.00 1.28 H new ATOM 0 HG3 GLU A 8 -8.824 -12.136 -2.762 1.00 1.28 H new ATOM 117 N LEU A 9 -8.508 -7.506 -1.913 1.00 1.13 N ATOM 118 CA LEU A 9 -8.249 -6.075 -1.945 1.00 1.21 C ATOM 119 C LEU A 9 -8.271 -5.509 -0.524 1.00 1.29 C ATOM 120 O LEU A 9 -7.401 -4.710 -0.184 1.00 1.56 O ATOM 121 CB LEU A 9 -9.247 -5.352 -2.858 1.00 1.28 C ATOM 122 CG LEU A 9 -8.947 -5.506 -4.358 1.00 1.17 C ATOM 123 CD1 LEU A 9 -9.045 -6.954 -4.858 1.00 2.83 C ATOM 124 CD2 LEU A 9 -9.807 -4.551 -5.197 1.00 2.27 C ATOM 0 H LEU A 9 -9.330 -7.801 -2.440 1.00 1.13 H new ATOM 0 HA LEU A 9 -7.257 -5.907 -2.364 1.00 1.21 H new ATOM 0 HB2 LEU A 9 -10.249 -5.732 -2.657 1.00 1.28 H new ATOM 0 HB3 LEU A 9 -9.252 -4.292 -2.606 1.00 1.28 H new ATOM 0 HG LEU A 9 -7.902 -5.224 -4.490 1.00 1.17 H new ATOM 0 HD11 LEU A 9 -8.821 -6.987 -5.924 1.00 2.83 H new ATOM 0 HD12 LEU A 9 -8.330 -7.575 -4.318 1.00 2.83 H new ATOM 0 HD13 LEU A 9 -10.054 -7.330 -4.688 1.00 2.83 H new ATOM 0 HD21 LEU A 9 -9.572 -4.683 -6.253 1.00 2.27 H new ATOM 0 HD22 LEU A 9 -10.862 -4.769 -5.030 1.00 2.27 H new ATOM 0 HD23 LEU A 9 -9.598 -3.522 -4.905 1.00 2.27 H new ATOM 136 N GLU A 10 -9.227 -5.939 0.312 1.00 1.13 N ATOM 137 CA GLU A 10 -9.224 -5.530 1.710 1.00 1.12 C ATOM 138 C GLU A 10 -8.071 -6.200 2.450 1.00 1.09 C ATOM 139 O GLU A 10 -7.281 -5.510 3.098 1.00 1.10 O ATOM 140 CB GLU A 10 -10.568 -5.746 2.438 1.00 1.27 C ATOM 141 CG GLU A 10 -10.955 -4.411 3.098 1.00 2.09 C ATOM 142 CD GLU A 10 -11.910 -4.519 4.274 1.00 2.46 C ATOM 143 OE1 GLU A 10 -13.141 -4.419 4.071 1.00 3.68 O ATOM 144 OE2 GLU A 10 -11.351 -4.579 5.390 1.00 2.77 O ATOM 0 H GLU A 10 -9.994 -6.557 0.046 1.00 1.13 H new ATOM 0 HA GLU A 10 -9.077 -4.450 1.714 1.00 1.12 H new ATOM 0 HB2 GLU A 10 -11.338 -6.064 1.735 1.00 1.27 H new ATOM 0 HB3 GLU A 10 -10.476 -6.532 3.187 1.00 1.27 H new ATOM 0 HG2 GLU A 10 -10.045 -3.914 3.435 1.00 2.09 H new ATOM 0 HG3 GLU A 10 -11.407 -3.769 2.342 1.00 2.09 H new ATOM 151 N GLU A 11 -7.966 -7.529 2.322 1.00 1.17 N ATOM 152 CA GLU A 11 -6.961 -8.344 2.993 1.00 1.25 C ATOM 153 C GLU A 11 -5.600 -7.671 2.906 1.00 1.17 C ATOM 154 O GLU A 11 -4.911 -7.528 3.908 1.00 1.24 O ATOM 155 CB GLU A 11 -6.904 -9.759 2.393 1.00 1.25 C ATOM 156 CG GLU A 11 -6.137 -10.746 3.297 1.00 1.35 C ATOM 157 CD GLU A 11 -4.622 -10.555 3.253 1.00 2.39 C ATOM 158 OE1 GLU A 11 -4.102 -10.558 2.118 1.00 3.01 O ATOM 159 OE2 GLU A 11 -4.011 -10.395 4.336 1.00 3.67 O ATOM 0 H GLU A 11 -8.596 -8.075 1.733 1.00 1.17 H new ATOM 0 HA GLU A 11 -7.241 -8.438 4.042 1.00 1.25 H new ATOM 0 HB2 GLU A 11 -7.918 -10.126 2.236 1.00 1.25 H new ATOM 0 HB3 GLU A 11 -6.425 -9.718 1.415 1.00 1.25 H new ATOM 0 HG2 GLU A 11 -6.481 -10.629 4.325 1.00 1.35 H new ATOM 0 HG3 GLU A 11 -6.376 -11.766 2.995 1.00 1.35 H new ATOM 166 N SER A 12 -5.233 -7.184 1.722 1.00 1.08 N ATOM 167 CA SER A 12 -3.885 -6.689 1.520 1.00 1.01 C ATOM 168 C SER A 12 -3.595 -5.525 2.470 1.00 0.82 C ATOM 169 O SER A 12 -2.497 -5.371 3.013 1.00 0.82 O ATOM 170 CB SER A 12 -3.717 -6.289 0.055 1.00 1.06 C ATOM 171 OG SER A 12 -2.348 -6.338 -0.273 1.00 1.33 O ATOM 0 H SER A 12 -5.842 -7.124 0.906 1.00 1.08 H new ATOM 0 HA SER A 12 -3.161 -7.471 1.748 1.00 1.01 H new ATOM 0 HB2 SER A 12 -4.284 -6.963 -0.588 1.00 1.06 H new ATOM 0 HB3 SER A 12 -4.109 -5.286 -0.110 1.00 1.06 H new ATOM 0 HG SER A 12 -2.208 -6.983 -0.997 1.00 1.33 H new ATOM 177 N ILE A 13 -4.621 -4.704 2.694 1.00 0.72 N ATOM 178 CA ILE A 13 -4.538 -3.594 3.612 1.00 0.58 C ATOM 179 C ILE A 13 -4.434 -4.148 5.030 1.00 0.59 C ATOM 180 O ILE A 13 -3.596 -3.674 5.794 1.00 0.60 O ATOM 181 CB ILE A 13 -5.746 -2.665 3.407 1.00 0.61 C ATOM 182 CG1 ILE A 13 -5.718 -2.088 1.984 1.00 0.79 C ATOM 183 CG2 ILE A 13 -5.848 -1.504 4.402 1.00 0.59 C ATOM 184 CD1 ILE A 13 -7.137 -1.866 1.502 1.00 0.78 C ATOM 0 H ILE A 13 -5.529 -4.799 2.238 1.00 0.72 H new ATOM 0 HA ILE A 13 -3.650 -2.989 3.429 1.00 0.58 H new ATOM 0 HB ILE A 13 -6.621 -3.293 3.578 1.00 0.61 H new ATOM 0 HG12 ILE A 13 -5.167 -1.148 1.972 1.00 0.79 H new ATOM 0 HG13 ILE A 13 -5.197 -2.771 1.313 1.00 0.79 H new ATOM 0 HG21 ILE A 13 -6.731 -0.907 4.175 1.00 0.59 H new ATOM 0 HG22 ILE A 13 -5.927 -1.899 5.415 1.00 0.59 H new ATOM 0 HG23 ILE A 13 -4.958 -0.879 4.325 1.00 0.59 H new ATOM 0 HD11 ILE A 13 -7.118 -1.456 0.492 1.00 0.78 H new ATOM 0 HD12 ILE A 13 -7.673 -2.815 1.499 1.00 0.78 H new ATOM 0 HD13 ILE A 13 -7.642 -1.166 2.168 1.00 0.78 H new ATOM 196 N GLU A 14 -5.256 -5.152 5.366 1.00 0.63 N ATOM 197 CA GLU A 14 -5.190 -5.866 6.641 1.00 0.70 C ATOM 198 C GLU A 14 -3.752 -6.318 6.929 1.00 0.73 C ATOM 199 O GLU A 14 -3.232 -6.087 8.023 1.00 0.79 O ATOM 200 CB GLU A 14 -6.188 -7.033 6.694 1.00 0.84 C ATOM 201 CG GLU A 14 -7.596 -6.518 6.388 1.00 2.12 C ATOM 202 CD GLU A 14 -8.658 -7.599 6.495 1.00 3.46 C ATOM 203 OE1 GLU A 14 -8.769 -8.162 7.603 1.00 3.73 O ATOM 204 OE2 GLU A 14 -9.356 -7.798 5.480 1.00 5.11 O ATOM 0 H GLU A 14 -5.994 -5.493 4.749 1.00 0.63 H new ATOM 0 HA GLU A 14 -5.485 -5.177 7.432 1.00 0.70 H new ATOM 0 HB2 GLU A 14 -5.905 -7.800 5.972 1.00 0.84 H new ATOM 0 HB3 GLU A 14 -6.166 -7.499 7.679 1.00 0.84 H new ATOM 0 HG2 GLU A 14 -7.839 -5.708 7.076 1.00 2.12 H new ATOM 0 HG3 GLU A 14 -7.613 -6.098 5.382 1.00 2.12 H new ATOM 211 N THR A 15 -3.095 -6.915 5.931 1.00 0.74 N ATOM 212 CA THR A 15 -1.720 -7.365 6.039 1.00 0.80 C ATOM 213 C THR A 15 -0.814 -6.206 6.448 1.00 0.77 C ATOM 214 O THR A 15 -0.053 -6.310 7.409 1.00 0.85 O ATOM 215 CB THR A 15 -1.213 -7.971 4.724 1.00 0.81 C ATOM 216 OG1 THR A 15 -2.244 -8.474 3.903 1.00 1.48 O ATOM 217 CG2 THR A 15 -0.165 -9.038 5.045 1.00 1.29 C ATOM 0 H THR A 15 -3.514 -7.098 5.019 1.00 0.74 H new ATOM 0 HA THR A 15 -1.692 -8.142 6.803 1.00 0.80 H new ATOM 0 HB THR A 15 -0.758 -7.173 4.137 1.00 0.81 H new ATOM 0 HG1 THR A 15 -2.664 -9.244 4.340 1.00 1.48 H new ATOM 0 HG21 THR A 15 0.203 -9.477 4.118 1.00 1.29 H new ATOM 0 HG22 THR A 15 0.665 -8.582 5.586 1.00 1.29 H new ATOM 0 HG23 THR A 15 -0.615 -9.817 5.661 1.00 1.29 H new ATOM 225 N VAL A 16 -0.875 -5.094 5.712 1.00 0.71 N ATOM 226 CA VAL A 16 -0.032 -3.953 5.999 1.00 0.70 C ATOM 227 C VAL A 16 -0.326 -3.424 7.405 1.00 0.68 C ATOM 228 O VAL A 16 0.594 -3.263 8.207 1.00 0.71 O ATOM 229 CB VAL A 16 -0.211 -2.887 4.912 1.00 0.69 C ATOM 230 CG1 VAL A 16 0.462 -1.590 5.362 1.00 0.70 C ATOM 231 CG2 VAL A 16 0.403 -3.351 3.585 1.00 0.78 C ATOM 0 H VAL A 16 -1.501 -4.969 4.917 1.00 0.71 H new ATOM 0 HA VAL A 16 1.017 -4.250 5.986 1.00 0.70 H new ATOM 0 HB VAL A 16 -1.277 -2.720 4.758 1.00 0.69 H new ATOM 0 HG11 VAL A 16 0.337 -0.829 4.592 1.00 0.70 H new ATOM 0 HG12 VAL A 16 0.005 -1.246 6.290 1.00 0.70 H new ATOM 0 HG13 VAL A 16 1.525 -1.769 5.526 1.00 0.70 H new ATOM 0 HG21 VAL A 16 0.263 -2.578 2.829 1.00 0.78 H new ATOM 0 HG22 VAL A 16 1.468 -3.536 3.722 1.00 0.78 H new ATOM 0 HG23 VAL A 16 -0.086 -4.269 3.259 1.00 0.78 H new ATOM 241 N VAL A 17 -1.591 -3.140 7.722 1.00 0.66 N ATOM 242 CA VAL A 17 -1.913 -2.593 9.034 1.00 0.69 C ATOM 243 C VAL A 17 -1.442 -3.523 10.159 1.00 0.72 C ATOM 244 O VAL A 17 -0.922 -3.032 11.161 1.00 0.77 O ATOM 245 CB VAL A 17 -3.374 -2.136 9.180 1.00 0.70 C ATOM 246 CG1 VAL A 17 -3.716 -1.045 8.154 1.00 0.72 C ATOM 247 CG2 VAL A 17 -4.361 -3.292 9.071 1.00 0.70 C ATOM 0 H VAL A 17 -2.390 -3.277 7.102 1.00 0.66 H new ATOM 0 HA VAL A 17 -1.343 -1.669 9.131 1.00 0.69 H new ATOM 0 HB VAL A 17 -3.470 -1.721 10.183 1.00 0.70 H new ATOM 0 HG11 VAL A 17 -4.755 -0.740 8.280 1.00 0.72 H new ATOM 0 HG12 VAL A 17 -3.064 -0.185 8.307 1.00 0.72 H new ATOM 0 HG13 VAL A 17 -3.572 -1.435 7.146 1.00 0.72 H new ATOM 0 HG21 VAL A 17 -5.377 -2.914 9.181 1.00 0.70 H new ATOM 0 HG22 VAL A 17 -4.255 -3.770 8.097 1.00 0.70 H new ATOM 0 HG23 VAL A 17 -4.157 -4.020 9.857 1.00 0.70 H new ATOM 257 N THR A 18 -1.571 -4.851 10.007 1.00 0.74 N ATOM 258 CA THR A 18 -1.030 -5.751 11.019 1.00 0.80 C ATOM 259 C THR A 18 0.504 -5.743 11.021 1.00 0.82 C ATOM 260 O THR A 18 1.093 -5.807 12.099 1.00 0.87 O ATOM 261 CB THR A 18 -1.656 -7.157 11.001 1.00 0.93 C ATOM 262 OG1 THR A 18 -1.408 -7.791 12.242 1.00 1.49 O ATOM 263 CG2 THR A 18 -1.152 -8.076 9.891 1.00 1.18 C ATOM 0 H THR A 18 -2.030 -5.307 9.219 1.00 0.74 H new ATOM 0 HA THR A 18 -1.335 -5.351 11.986 1.00 0.80 H new ATOM 0 HB THR A 18 -2.718 -6.998 10.813 1.00 0.93 H new ATOM 0 HG1 THR A 18 -1.806 -8.687 12.237 1.00 1.49 H new ATOM 0 HG21 THR A 18 -1.652 -9.042 9.963 1.00 1.18 H new ATOM 0 HG22 THR A 18 -1.367 -7.627 8.921 1.00 1.18 H new ATOM 0 HG23 THR A 18 -0.076 -8.216 9.995 1.00 1.18 H new ATOM 271 N THR A 19 1.164 -5.656 9.855 1.00 0.82 N ATOM 272 CA THR A 19 2.627 -5.649 9.796 1.00 0.85 C ATOM 273 C THR A 19 3.245 -4.558 10.681 1.00 0.82 C ATOM 274 O THR A 19 4.331 -4.763 11.214 1.00 0.95 O ATOM 275 CB THR A 19 3.146 -5.606 8.347 1.00 0.87 C ATOM 276 OG1 THR A 19 3.090 -4.304 7.803 1.00 2.38 O ATOM 277 CG2 THR A 19 4.600 -6.076 8.267 1.00 1.35 C ATOM 0 H THR A 19 0.706 -5.590 8.946 1.00 0.82 H new ATOM 0 HA THR A 19 2.962 -6.598 10.215 1.00 0.85 H new ATOM 0 HB THR A 19 2.497 -6.270 7.777 1.00 0.87 H new ATOM 0 HG1 THR A 19 2.217 -3.904 8.001 1.00 2.38 H new ATOM 0 HG21 THR A 19 4.939 -6.035 7.232 1.00 1.35 H new ATOM 0 HG22 THR A 19 5.226 -5.428 8.880 1.00 1.35 H new ATOM 0 HG23 THR A 19 4.672 -7.101 8.632 1.00 1.35 H new ATOM 285 N PHE A 20 2.566 -3.422 10.896 1.00 0.80 N ATOM 286 CA PHE A 20 3.028 -2.454 11.892 1.00 0.87 C ATOM 287 C PHE A 20 3.279 -3.125 13.245 1.00 1.06 C ATOM 288 O PHE A 20 4.322 -2.912 13.856 1.00 1.30 O ATOM 289 CB PHE A 20 2.040 -1.291 12.052 1.00 0.99 C ATOM 290 CG PHE A 20 1.989 -0.362 10.858 1.00 0.94 C ATOM 291 CD1 PHE A 20 3.131 0.368 10.486 1.00 1.50 C ATOM 292 CD2 PHE A 20 0.797 -0.199 10.134 1.00 1.86 C ATOM 293 CE1 PHE A 20 3.101 1.191 9.351 1.00 1.40 C ATOM 294 CE2 PHE A 20 0.791 0.546 8.942 1.00 2.01 C ATOM 295 CZ PHE A 20 1.957 1.219 8.535 1.00 1.07 C ATOM 0 H PHE A 20 1.713 -3.157 10.403 1.00 0.80 H new ATOM 0 HA PHE A 20 3.972 -2.049 11.527 1.00 0.87 H new ATOM 0 HB2 PHE A 20 1.043 -1.695 12.228 1.00 0.99 H new ATOM 0 HB3 PHE A 20 2.312 -0.715 12.937 1.00 0.99 H new ATOM 0 HD1 PHE A 20 4.033 0.295 11.075 1.00 1.50 H new ATOM 0 HD2 PHE A 20 -0.117 -0.647 10.494 1.00 1.86 H new ATOM 0 HE1 PHE A 20 3.956 1.803 9.104 1.00 1.40 H new ATOM 0 HE2 PHE A 20 -0.105 0.601 8.341 1.00 2.01 H new ATOM 0 HZ PHE A 20 1.973 1.756 7.598 1.00 1.07 H new ATOM 305 N PHE A 21 2.337 -3.940 13.719 1.00 1.09 N ATOM 306 CA PHE A 21 2.525 -4.683 14.956 1.00 1.34 C ATOM 307 C PHE A 21 3.555 -5.785 14.726 1.00 1.47 C ATOM 308 O PHE A 21 4.524 -5.908 15.471 1.00 1.84 O ATOM 309 CB PHE A 21 1.188 -5.244 15.452 1.00 1.38 C ATOM 310 CG PHE A 21 0.151 -4.180 15.758 1.00 1.53 C ATOM 311 CD1 PHE A 21 0.133 -3.547 17.014 1.00 2.21 C ATOM 312 CD2 PHE A 21 -0.802 -3.823 14.786 1.00 3.31 C ATOM 313 CE1 PHE A 21 -0.859 -2.593 17.309 1.00 3.53 C ATOM 314 CE2 PHE A 21 -1.807 -2.891 15.089 1.00 4.81 C ATOM 315 CZ PHE A 21 -1.838 -2.276 16.352 1.00 4.71 C ATOM 0 H PHE A 21 1.439 -4.100 13.263 1.00 1.09 H new ATOM 0 HA PHE A 21 2.901 -4.019 15.734 1.00 1.34 H new ATOM 0 HB2 PHE A 21 0.787 -5.922 14.698 1.00 1.38 H new ATOM 0 HB3 PHE A 21 1.364 -5.835 16.351 1.00 1.38 H new ATOM 0 HD1 PHE A 21 0.881 -3.793 17.753 1.00 2.21 H new ATOM 0 HD2 PHE A 21 -0.760 -4.268 13.803 1.00 3.31 H new ATOM 0 HE1 PHE A 21 -0.868 -2.104 18.272 1.00 3.53 H new ATOM 0 HE2 PHE A 21 -2.557 -2.647 14.351 1.00 4.81 H new ATOM 0 HZ PHE A 21 -2.613 -1.561 16.587 1.00 4.71 H new ATOM 325 N THR A 22 3.352 -6.589 13.685 1.00 1.38 N ATOM 326 CA THR A 22 4.226 -7.704 13.361 1.00 1.77 C ATOM 327 C THR A 22 5.397 -7.212 12.497 1.00 1.97 C ATOM 328 O THR A 22 5.531 -7.623 11.347 1.00 2.35 O ATOM 329 CB THR A 22 3.387 -8.791 12.667 1.00 2.18 C ATOM 330 OG1 THR A 22 2.096 -8.866 13.250 1.00 2.79 O ATOM 331 CG2 THR A 22 4.064 -10.158 12.795 1.00 2.57 C ATOM 0 H THR A 22 2.569 -6.481 13.040 1.00 1.38 H new ATOM 0 HA THR A 22 4.663 -8.137 14.260 1.00 1.77 H new ATOM 0 HB THR A 22 3.301 -8.524 11.614 1.00 2.18 H new ATOM 0 HG1 THR A 22 1.573 -9.560 12.798 1.00 2.79 H new ATOM 0 HG21 THR A 22 3.455 -10.913 12.298 1.00 2.57 H new ATOM 0 HG22 THR A 22 5.049 -10.121 12.329 1.00 2.57 H new ATOM 0 HG23 THR A 22 4.171 -10.414 13.849 1.00 2.57 H new ATOM 339 N PHE A 23 6.230 -6.311 13.035 1.00 2.17 N ATOM 340 CA PHE A 23 7.279 -5.644 12.258 1.00 2.66 C ATOM 341 C PHE A 23 8.656 -6.285 12.476 1.00 3.00 C ATOM 342 O PHE A 23 9.662 -5.585 12.403 1.00 3.76 O ATOM 343 CB PHE A 23 7.281 -4.120 12.525 1.00 3.02 C ATOM 344 CG PHE A 23 7.877 -3.653 13.846 1.00 3.14 C ATOM 345 CD1 PHE A 23 7.194 -3.876 15.051 1.00 3.95 C ATOM 346 CD2 PHE A 23 9.183 -3.126 13.883 1.00 3.82 C ATOM 347 CE1 PHE A 23 7.882 -3.808 16.271 1.00 5.11 C ATOM 348 CE2 PHE A 23 9.862 -3.010 15.109 1.00 4.60 C ATOM 349 CZ PHE A 23 9.231 -3.414 16.297 1.00 5.21 C ATOM 0 H PHE A 23 6.195 -6.027 14.014 1.00 2.17 H new ATOM 0 HA PHE A 23 7.050 -5.784 11.202 1.00 2.66 H new ATOM 0 HB2 PHE A 23 7.827 -3.635 11.716 1.00 3.02 H new ATOM 0 HB3 PHE A 23 6.252 -3.765 12.473 1.00 3.02 H new ATOM 0 HD1 PHE A 23 6.138 -4.100 15.039 1.00 3.95 H new ATOM 0 HD2 PHE A 23 9.663 -2.811 12.969 1.00 3.82 H new ATOM 0 HE1 PHE A 23 7.375 -4.059 17.191 1.00 5.11 H new ATOM 0 HE2 PHE A 23 10.865 -2.612 15.137 1.00 4.60 H new ATOM 0 HZ PHE A 23 9.780 -3.422 17.227 1.00 5.21 H new ATOM 359 N ALA A 24 8.720 -7.600 12.722 1.00 3.49 N ATOM 360 CA ALA A 24 9.906 -8.286 13.225 1.00 3.85 C ATOM 361 C ALA A 24 10.193 -7.870 14.670 1.00 3.84 C ATOM 362 O ALA A 24 11.008 -6.984 14.916 1.00 4.30 O ATOM 363 CB ALA A 24 11.116 -8.130 12.292 1.00 4.43 C ATOM 0 H ALA A 24 7.929 -8.226 12.572 1.00 3.49 H new ATOM 0 HA ALA A 24 9.700 -9.356 13.235 1.00 3.85 H new ATOM 0 HB1 ALA A 24 11.971 -8.659 12.713 1.00 4.43 H new ATOM 0 HB2 ALA A 24 10.877 -8.547 11.314 1.00 4.43 H new ATOM 0 HB3 ALA A 24 11.360 -7.073 12.186 1.00 4.43 H new ATOM 369 N ARG A 25 9.523 -8.555 15.609 1.00 3.79 N ATOM 370 CA ARG A 25 9.546 -8.389 17.065 1.00 4.11 C ATOM 371 C ARG A 25 8.272 -7.674 17.530 1.00 4.01 C ATOM 372 O ARG A 25 7.724 -6.838 16.820 1.00 4.48 O ATOM 373 CB ARG A 25 10.821 -7.695 17.592 1.00 4.73 C ATOM 374 CG ARG A 25 10.938 -7.764 19.120 1.00 5.14 C ATOM 375 CD ARG A 25 12.183 -7.036 19.639 1.00 6.12 C ATOM 376 NE ARG A 25 12.044 -6.722 21.073 1.00 6.68 N ATOM 377 CZ ARG A 25 12.174 -7.594 22.087 1.00 7.33 C ATOM 378 NH1 ARG A 25 12.544 -8.854 21.839 1.00 7.70 N ATOM 379 NH2 ARG A 25 11.928 -7.200 23.341 1.00 8.20 N ATOM 0 H ARG A 25 8.892 -9.310 15.339 1.00 3.79 H new ATOM 0 HA ARG A 25 9.572 -9.388 17.499 1.00 4.11 H new ATOM 0 HB2 ARG A 25 11.697 -8.162 17.142 1.00 4.73 H new ATOM 0 HB3 ARG A 25 10.819 -6.651 17.278 1.00 4.73 H new ATOM 0 HG2 ARG A 25 10.048 -7.325 19.571 1.00 5.14 H new ATOM 0 HG3 ARG A 25 10.972 -8.807 19.433 1.00 5.14 H new ATOM 0 HD2 ARG A 25 13.065 -7.657 19.481 1.00 6.12 H new ATOM 0 HD3 ARG A 25 12.335 -6.117 19.073 1.00 6.12 H new ATOM 0 HE ARG A 25 11.830 -5.755 21.317 1.00 6.68 H new ATOM 0 HH11 ARG A 25 12.727 -9.153 20.881 1.00 7.70 H new ATOM 0 HH12 ARG A 25 12.643 -9.517 22.608 1.00 7.70 H new ATOM 0 HH21 ARG A 25 11.642 -6.239 23.527 1.00 8.20 H new ATOM 0 HH22 ARG A 25 12.026 -7.861 24.112 1.00 8.20 H new ATOM 393 N GLN A 26 7.811 -8.000 18.742 1.00 4.34 N ATOM 394 CA GLN A 26 6.725 -7.297 19.408 1.00 4.65 C ATOM 395 C GLN A 26 7.309 -6.068 20.113 1.00 4.43 C ATOM 396 O GLN A 26 8.254 -6.198 20.891 1.00 5.55 O ATOM 397 CB GLN A 26 6.057 -8.233 20.425 1.00 6.17 C ATOM 398 CG GLN A 26 5.437 -9.468 19.754 1.00 7.37 C ATOM 399 CD GLN A 26 4.801 -10.418 20.767 1.00 9.13 C ATOM 400 OE1 GLN A 26 4.789 -10.156 21.965 1.00 9.69 O ATOM 401 NE2 GLN A 26 4.274 -11.546 20.297 1.00 10.40 N ATOM 0 H GLN A 26 8.191 -8.771 19.290 1.00 4.34 H new ATOM 0 HA GLN A 26 5.973 -6.981 18.685 1.00 4.65 H new ATOM 0 HB2 GLN A 26 6.794 -8.553 21.161 1.00 6.17 H new ATOM 0 HB3 GLN A 26 5.283 -7.688 20.965 1.00 6.17 H new ATOM 0 HG2 GLN A 26 4.683 -9.148 19.035 1.00 7.37 H new ATOM 0 HG3 GLN A 26 6.206 -9.999 19.194 1.00 7.37 H new ATOM 0 HE21 GLN A 26 4.296 -11.741 19.296 1.00 10.40 H new ATOM 0 HE22 GLN A 26 3.848 -12.215 20.938 1.00 10.40 H new ATOM 410 N GLU A 27 6.766 -4.883 19.829 1.00 3.84 N ATOM 411 CA GLU A 27 7.153 -3.610 20.425 1.00 4.17 C ATOM 412 C GLU A 27 5.924 -2.705 20.300 1.00 3.59 C ATOM 413 O GLU A 27 4.991 -3.041 19.566 1.00 3.71 O ATOM 414 CB GLU A 27 8.394 -3.068 19.691 1.00 5.29 C ATOM 415 CG GLU A 27 9.232 -2.030 20.454 1.00 6.13 C ATOM 416 CD GLU A 27 8.706 -0.613 20.296 1.00 6.98 C ATOM 417 OE1 GLU A 27 8.855 -0.069 19.177 1.00 7.85 O ATOM 418 OE2 GLU A 27 8.097 -0.127 21.271 1.00 7.33 O ATOM 0 H GLU A 27 6.013 -4.784 19.148 1.00 3.84 H new ATOM 0 HA GLU A 27 7.438 -3.686 21.474 1.00 4.17 H new ATOM 0 HB2 GLU A 27 9.038 -3.910 19.439 1.00 5.29 H new ATOM 0 HB3 GLU A 27 8.069 -2.622 18.751 1.00 5.29 H new ATOM 0 HG2 GLU A 27 9.248 -2.290 21.512 1.00 6.13 H new ATOM 0 HG3 GLU A 27 10.262 -2.071 20.100 1.00 6.13 H new ATOM 425 N GLY A 28 5.898 -1.573 21.001 1.00 3.93 N ATOM 426 CA GLY A 28 4.787 -0.642 20.986 1.00 3.57 C ATOM 427 C GLY A 28 4.770 0.162 19.689 1.00 3.07 C ATOM 428 O GLY A 28 4.916 1.387 19.706 1.00 3.60 O ATOM 0 H GLY A 28 6.666 -1.278 21.604 1.00 3.93 H new ATOM 0 HA2 GLY A 28 3.849 -1.187 21.094 1.00 3.57 H new ATOM 0 HA3 GLY A 28 4.862 0.034 21.837 1.00 3.57 H new ATOM 432 N ARG A 29 4.508 -0.502 18.559 1.00 2.92 N ATOM 433 CA ARG A 29 4.420 0.170 17.272 1.00 2.51 C ATOM 434 C ARG A 29 3.023 0.784 17.160 1.00 2.13 C ATOM 435 O ARG A 29 2.165 0.326 16.411 1.00 3.00 O ATOM 436 CB ARG A 29 4.727 -0.793 16.117 1.00 3.34 C ATOM 437 CG ARG A 29 4.978 -0.005 14.818 1.00 4.23 C ATOM 438 CD ARG A 29 6.454 0.125 14.427 1.00 6.40 C ATOM 439 NE ARG A 29 7.175 1.068 15.303 1.00 7.58 N ATOM 440 CZ ARG A 29 7.816 0.726 16.435 1.00 8.79 C ATOM 441 NH1 ARG A 29 8.038 -0.549 16.751 1.00 9.28 N ATOM 442 NH2 ARG A 29 8.229 1.652 17.299 1.00 9.83 N ATOM 0 H ARG A 29 4.353 -1.509 18.517 1.00 2.92 H new ATOM 0 HA ARG A 29 5.169 0.959 17.204 1.00 2.51 H new ATOM 0 HB2 ARG A 29 5.602 -1.396 16.360 1.00 3.34 H new ATOM 0 HB3 ARG A 29 3.894 -1.482 15.977 1.00 3.34 H new ATOM 0 HG2 ARG A 29 4.441 -0.492 14.004 1.00 4.23 H new ATOM 0 HG3 ARG A 29 4.555 0.994 14.927 1.00 4.23 H new ATOM 0 HD2 ARG A 29 6.930 -0.854 14.478 1.00 6.40 H new ATOM 0 HD3 ARG A 29 6.527 0.462 13.393 1.00 6.40 H new ATOM 0 HE ARG A 29 7.188 2.051 15.030 1.00 7.58 H new ATOM 0 HH11 ARG A 29 7.720 -1.292 16.129 1.00 9.28 H new ATOM 0 HH12 ARG A 29 8.526 -0.783 17.615 1.00 9.28 H new ATOM 0 HH21 ARG A 29 8.061 2.640 17.107 1.00 9.83 H new ATOM 0 HH22 ARG A 29 8.713 1.373 18.152 1.00 9.83 H new ATOM 456 N LYS A 30 2.825 1.853 17.933 1.00 1.95 N ATOM 457 CA LYS A 30 1.620 2.666 17.969 1.00 2.49 C ATOM 458 C LYS A 30 1.255 3.064 16.539 1.00 2.09 C ATOM 459 O LYS A 30 0.111 2.883 16.107 1.00 2.77 O ATOM 460 CB LYS A 30 1.887 3.885 18.863 1.00 3.26 C ATOM 461 CG LYS A 30 2.019 3.474 20.341 1.00 4.36 C ATOM 462 CD LYS A 30 2.829 4.489 21.163 1.00 4.91 C ATOM 463 CE LYS A 30 4.340 4.253 20.993 1.00 5.06 C ATOM 464 NZ LYS A 30 5.157 5.233 21.739 1.00 5.75 N ATOM 0 H LYS A 30 3.539 2.187 18.581 1.00 1.95 H new ATOM 0 HA LYS A 30 0.775 2.118 18.387 1.00 2.49 H new ATOM 0 HB2 LYS A 30 2.800 4.384 18.539 1.00 3.26 H new ATOM 0 HB3 LYS A 30 1.075 4.604 18.754 1.00 3.26 H new ATOM 0 HG2 LYS A 30 1.025 3.369 20.776 1.00 4.36 H new ATOM 0 HG3 LYS A 30 2.498 2.497 20.402 1.00 4.36 H new ATOM 0 HD2 LYS A 30 2.577 5.502 20.848 1.00 4.91 H new ATOM 0 HD3 LYS A 30 2.560 4.407 22.216 1.00 4.91 H new ATOM 0 HE2 LYS A 30 4.587 3.247 21.332 1.00 5.06 H new ATOM 0 HE3 LYS A 30 4.595 4.304 19.934 1.00 5.06 H new ATOM 0 HZ1 LYS A 30 6.166 5.029 21.590 1.00 5.75 H new ATOM 0 HZ2 LYS A 30 4.944 6.193 21.399 1.00 5.75 H new ATOM 0 HZ3 LYS A 30 4.937 5.168 22.753 1.00 5.75 H new ATOM 478 N ASP A 31 2.258 3.544 15.790 1.00 1.53 N ATOM 479 CA ASP A 31 2.131 3.683 14.352 1.00 1.47 C ATOM 480 C ASP A 31 3.299 3.075 13.584 1.00 1.74 C ATOM 481 O ASP A 31 3.160 1.974 13.059 1.00 2.10 O ATOM 482 CB ASP A 31 1.757 5.120 13.941 1.00 1.56 C ATOM 483 CG ASP A 31 0.417 5.079 13.236 1.00 1.78 C ATOM 484 OD1 ASP A 31 0.328 4.366 12.213 1.00 2.91 O ATOM 485 OD2 ASP A 31 -0.597 5.472 13.856 1.00 2.29 O ATOM 0 H ASP A 31 3.160 3.839 16.165 1.00 1.53 H new ATOM 0 HA ASP A 31 1.281 3.074 14.045 1.00 1.47 H new ATOM 0 HB2 ASP A 31 1.705 5.765 14.818 1.00 1.56 H new ATOM 0 HB3 ASP A 31 2.519 5.538 13.283 1.00 1.56 H new ATOM 490 N SER A 32 4.433 3.770 13.478 1.00 1.81 N ATOM 491 CA SER A 32 5.435 3.413 12.481 1.00 1.60 C ATOM 492 C SER A 32 6.855 3.831 12.914 1.00 1.55 C ATOM 493 O SER A 32 7.227 3.669 14.081 1.00 1.98 O ATOM 494 CB SER A 32 4.980 4.041 11.148 1.00 1.50 C ATOM 495 OG SER A 32 5.746 3.560 10.061 1.00 1.91 O ATOM 0 H SER A 32 4.675 4.571 14.062 1.00 1.81 H new ATOM 0 HA SER A 32 5.507 2.332 12.364 1.00 1.60 H new ATOM 0 HB2 SER A 32 3.927 3.817 10.980 1.00 1.50 H new ATOM 0 HB3 SER A 32 5.070 5.126 11.206 1.00 1.50 H new ATOM 0 HG SER A 32 5.335 3.847 9.219 1.00 1.91 H new ATOM 501 N LEU A 33 7.607 4.346 11.934 1.00 1.15 N ATOM 502 CA LEU A 33 8.946 4.922 11.911 1.00 1.07 C ATOM 503 C LEU A 33 8.964 6.383 12.374 1.00 0.93 C ATOM 504 O LEU A 33 7.916 7.015 12.511 1.00 1.33 O ATOM 505 CB LEU A 33 10.151 4.064 12.350 1.00 1.49 C ATOM 506 CG LEU A 33 10.184 2.541 12.123 1.00 1.47 C ATOM 507 CD1 LEU A 33 9.433 1.719 13.168 1.00 1.48 C ATOM 508 CD2 LEU A 33 9.734 2.147 10.718 1.00 1.82 C ATOM 0 H LEU A 33 7.219 4.367 10.991 1.00 1.15 H new ATOM 0 HA LEU A 33 9.169 4.918 10.844 1.00 1.07 H new ATOM 0 HB2 LEU A 33 11.030 4.477 11.855 1.00 1.49 H new ATOM 0 HB3 LEU A 33 10.282 4.227 13.420 1.00 1.49 H new ATOM 0 HG LEU A 33 11.238 2.290 12.238 1.00 1.47 H new ATOM 0 HD11 LEU A 33 9.513 0.660 12.924 1.00 1.48 H new ATOM 0 HD12 LEU A 33 9.866 1.898 14.152 1.00 1.48 H new ATOM 0 HD13 LEU A 33 8.383 2.012 13.175 1.00 1.48 H new ATOM 0 HD21 LEU A 33 9.777 1.063 10.613 1.00 1.82 H new ATOM 0 HD22 LEU A 33 8.711 2.487 10.555 1.00 1.82 H new ATOM 0 HD23 LEU A 33 10.392 2.609 9.982 1.00 1.82 H new ATOM 520 N SER A 34 10.166 6.953 12.505 1.00 0.80 N ATOM 521 CA SER A 34 10.365 8.298 11.989 1.00 0.69 C ATOM 522 C SER A 34 10.550 8.159 10.477 1.00 0.66 C ATOM 523 O SER A 34 10.845 7.057 10.010 1.00 0.68 O ATOM 524 CB SER A 34 11.546 8.982 12.684 1.00 0.78 C ATOM 525 OG SER A 34 11.309 8.986 14.077 1.00 1.52 O ATOM 0 H SER A 34 10.979 6.522 12.945 1.00 0.80 H new ATOM 0 HA SER A 34 9.510 8.942 12.193 1.00 0.69 H new ATOM 0 HB2 SER A 34 12.474 8.455 12.460 1.00 0.78 H new ATOM 0 HB3 SER A 34 11.662 10.002 12.317 1.00 0.78 H new ATOM 0 HG SER A 34 12.059 9.420 14.535 1.00 1.52 H new ATOM 531 N VAL A 35 10.333 9.213 9.689 1.00 0.79 N ATOM 532 CA VAL A 35 10.215 9.010 8.250 1.00 0.92 C ATOM 533 C VAL A 35 11.563 8.582 7.640 1.00 0.82 C ATOM 534 O VAL A 35 11.615 7.663 6.821 1.00 0.78 O ATOM 535 CB VAL A 35 9.613 10.257 7.587 1.00 1.31 C ATOM 536 CG1 VAL A 35 9.257 9.975 6.128 1.00 1.58 C ATOM 537 CG2 VAL A 35 8.335 10.759 8.275 1.00 1.49 C ATOM 0 H VAL A 35 10.239 10.177 10.008 1.00 0.79 H new ATOM 0 HA VAL A 35 9.526 8.188 8.056 1.00 0.92 H new ATOM 0 HB VAL A 35 10.383 11.024 7.673 1.00 1.31 H new ATOM 0 HG11 VAL A 35 8.832 10.872 5.677 1.00 1.58 H new ATOM 0 HG12 VAL A 35 10.156 9.686 5.583 1.00 1.58 H new ATOM 0 HG13 VAL A 35 8.529 9.165 6.081 1.00 1.58 H new ATOM 0 HG21 VAL A 35 7.964 11.642 7.754 1.00 1.49 H new ATOM 0 HG22 VAL A 35 7.576 9.977 8.248 1.00 1.49 H new ATOM 0 HG23 VAL A 35 8.556 11.015 9.311 1.00 1.49 H new ATOM 547 N ASN A 36 12.670 9.223 8.038 1.00 0.87 N ATOM 548 CA ASN A 36 13.985 8.878 7.495 1.00 0.93 C ATOM 549 C ASN A 36 14.433 7.515 8.040 1.00 0.76 C ATOM 550 O ASN A 36 14.978 6.693 7.309 1.00 0.73 O ATOM 551 CB ASN A 36 15.031 9.953 7.819 1.00 1.30 C ATOM 552 CG ASN A 36 16.071 10.074 6.706 1.00 2.11 C ATOM 553 OD1 ASN A 36 16.539 9.080 6.158 1.00 2.81 O ATOM 554 ND2 ASN A 36 16.413 11.296 6.309 1.00 2.46 N ATOM 0 H ASN A 36 12.679 9.975 8.727 1.00 0.87 H new ATOM 0 HA ASN A 36 13.898 8.822 6.410 1.00 0.93 H new ATOM 0 HB2 ASN A 36 14.535 10.913 7.962 1.00 1.30 H new ATOM 0 HB3 ASN A 36 15.528 9.708 8.758 1.00 1.30 H new ATOM 0 HD21 ASN A 36 17.072 11.417 5.540 1.00 2.46 H new ATOM 0 HD22 ASN A 36 16.016 12.113 6.773 1.00 2.46 H new ATOM 561 N GLU A 37 14.173 7.274 9.331 1.00 0.82 N ATOM 562 CA GLU A 37 14.392 5.981 9.970 1.00 0.91 C ATOM 563 C GLU A 37 13.734 4.904 9.104 1.00 0.83 C ATOM 564 O GLU A 37 14.419 4.061 8.526 1.00 0.95 O ATOM 565 CB GLU A 37 13.819 6.037 11.399 1.00 1.05 C ATOM 566 CG GLU A 37 13.816 4.704 12.161 1.00 1.22 C ATOM 567 CD GLU A 37 15.205 4.211 12.551 1.00 2.41 C ATOM 568 OE1 GLU A 37 16.158 5.008 12.419 1.00 3.79 O ATOM 569 OE2 GLU A 37 15.272 3.048 12.995 1.00 3.30 O ATOM 0 H GLU A 37 13.801 7.982 9.964 1.00 0.82 H new ATOM 0 HA GLU A 37 15.451 5.737 10.055 1.00 0.91 H new ATOM 0 HB2 GLU A 37 14.393 6.763 11.974 1.00 1.05 H new ATOM 0 HB3 GLU A 37 12.796 6.409 11.347 1.00 1.05 H new ATOM 0 HG2 GLU A 37 13.214 4.814 13.063 1.00 1.22 H new ATOM 0 HG3 GLU A 37 13.332 3.946 11.545 1.00 1.22 H new ATOM 576 N PHE A 38 12.408 4.992 8.929 1.00 0.82 N ATOM 577 CA PHE A 38 11.709 4.185 7.940 1.00 0.86 C ATOM 578 C PHE A 38 12.451 4.071 6.607 1.00 0.77 C ATOM 579 O PHE A 38 12.722 2.943 6.212 1.00 0.94 O ATOM 580 CB PHE A 38 10.273 4.657 7.734 1.00 1.00 C ATOM 581 CG PHE A 38 9.474 3.775 6.788 1.00 1.60 C ATOM 582 CD1 PHE A 38 9.286 2.411 7.080 1.00 3.02 C ATOM 583 CD2 PHE A 38 8.922 4.316 5.614 1.00 1.72 C ATOM 584 CE1 PHE A 38 8.539 1.600 6.213 1.00 3.57 C ATOM 585 CE2 PHE A 38 8.112 3.520 4.785 1.00 2.24 C ATOM 586 CZ PHE A 38 7.931 2.159 5.078 1.00 2.87 C ATOM 0 H PHE A 38 11.805 5.617 9.464 1.00 0.82 H new ATOM 0 HA PHE A 38 11.678 3.178 8.357 1.00 0.86 H new ATOM 0 HB2 PHE A 38 9.768 4.691 8.699 1.00 1.00 H new ATOM 0 HB3 PHE A 38 10.286 5.675 7.345 1.00 1.00 H new ATOM 0 HD1 PHE A 38 9.718 1.987 7.975 1.00 3.02 H new ATOM 0 HD2 PHE A 38 9.120 5.344 5.348 1.00 1.72 H new ATOM 0 HE1 PHE A 38 8.432 0.545 6.419 1.00 3.57 H new ATOM 0 HE2 PHE A 38 7.629 3.956 3.923 1.00 2.24 H new ATOM 0 HZ PHE A 38 7.325 1.543 4.431 1.00 2.87 H new ATOM 596 N LYS A 39 12.791 5.180 5.924 1.00 0.66 N ATOM 597 CA LYS A 39 13.547 5.133 4.662 1.00 0.68 C ATOM 598 C LYS A 39 14.684 4.099 4.747 1.00 0.72 C ATOM 599 O LYS A 39 14.811 3.244 3.868 1.00 0.76 O ATOM 600 CB LYS A 39 14.088 6.527 4.261 1.00 0.84 C ATOM 601 CG LYS A 39 14.779 6.553 2.879 1.00 0.97 C ATOM 602 CD LYS A 39 15.998 7.498 2.896 1.00 1.91 C ATOM 603 CE LYS A 39 17.205 6.800 3.547 1.00 2.57 C ATOM 604 NZ LYS A 39 18.022 7.700 4.395 1.00 3.71 N ATOM 0 H LYS A 39 12.552 6.124 6.229 1.00 0.66 H new ATOM 0 HA LYS A 39 12.858 4.820 3.878 1.00 0.68 H new ATOM 0 HB2 LYS A 39 13.263 7.240 4.258 1.00 0.84 H new ATOM 0 HB3 LYS A 39 14.797 6.863 5.018 1.00 0.84 H new ATOM 0 HG2 LYS A 39 15.097 5.546 2.607 1.00 0.97 H new ATOM 0 HG3 LYS A 39 14.070 6.880 2.118 1.00 0.97 H new ATOM 0 HD2 LYS A 39 16.248 7.798 1.879 1.00 1.91 H new ATOM 0 HD3 LYS A 39 15.755 8.407 3.446 1.00 1.91 H new ATOM 0 HE2 LYS A 39 16.849 5.967 4.153 1.00 2.57 H new ATOM 0 HE3 LYS A 39 17.836 6.379 2.765 1.00 2.57 H new ATOM 0 HZ1 LYS A 39 18.807 7.163 4.815 1.00 3.71 H new ATOM 0 HZ2 LYS A 39 18.404 8.473 3.813 1.00 3.71 H new ATOM 0 HZ3 LYS A 39 17.429 8.096 5.152 1.00 3.71 H new ATOM 618 N GLU A 40 15.506 4.175 5.797 1.00 0.79 N ATOM 619 CA GLU A 40 16.637 3.270 5.969 1.00 0.92 C ATOM 620 C GLU A 40 16.185 1.843 6.307 1.00 0.99 C ATOM 621 O GLU A 40 16.758 0.878 5.805 1.00 1.15 O ATOM 622 CB GLU A 40 17.670 3.873 6.935 1.00 1.12 C ATOM 623 CG GLU A 40 18.125 5.191 6.293 1.00 1.10 C ATOM 624 CD GLU A 40 19.354 5.860 6.871 1.00 1.71 C ATOM 625 OE1 GLU A 40 19.910 5.360 7.868 1.00 2.25 O ATOM 626 OE2 GLU A 40 19.704 6.882 6.233 1.00 2.49 O ATOM 0 H GLU A 40 15.405 4.861 6.545 1.00 0.79 H new ATOM 0 HA GLU A 40 17.156 3.162 5.017 1.00 0.92 H new ATOM 0 HB2 GLU A 40 17.231 4.048 7.917 1.00 1.12 H new ATOM 0 HB3 GLU A 40 18.513 3.197 7.078 1.00 1.12 H new ATOM 0 HG2 GLU A 40 18.309 5.004 5.235 1.00 1.10 H new ATOM 0 HG3 GLU A 40 17.297 5.898 6.352 1.00 1.10 H new ATOM 633 N LEU A 41 15.127 1.686 7.101 1.00 0.97 N ATOM 634 CA LEU A 41 14.560 0.367 7.366 1.00 1.09 C ATOM 635 C LEU A 41 14.037 -0.297 6.079 1.00 1.05 C ATOM 636 O LEU A 41 14.323 -1.476 5.865 1.00 1.15 O ATOM 637 CB LEU A 41 13.504 0.434 8.481 1.00 1.22 C ATOM 638 CG LEU A 41 14.059 0.297 9.915 1.00 1.61 C ATOM 639 CD1 LEU A 41 14.455 -1.147 10.248 1.00 2.58 C ATOM 640 CD2 LEU A 41 15.246 1.220 10.217 1.00 3.00 C ATOM 0 H LEU A 41 14.647 2.454 7.570 1.00 0.97 H new ATOM 0 HA LEU A 41 15.359 -0.278 7.731 1.00 1.09 H new ATOM 0 HB2 LEU A 41 12.974 1.383 8.402 1.00 1.22 H new ATOM 0 HB3 LEU A 41 12.771 -0.355 8.314 1.00 1.22 H new ATOM 0 HG LEU A 41 13.229 0.606 10.550 1.00 1.61 H new ATOM 0 HD11 LEU A 41 14.840 -1.193 11.267 1.00 2.58 H new ATOM 0 HD12 LEU A 41 13.582 -1.793 10.160 1.00 2.58 H new ATOM 0 HD13 LEU A 41 15.226 -1.482 9.554 1.00 2.58 H new ATOM 0 HD21 LEU A 41 15.577 1.063 11.244 1.00 3.00 H new ATOM 0 HD22 LEU A 41 16.065 0.995 9.533 1.00 3.00 H new ATOM 0 HD23 LEU A 41 14.941 2.259 10.089 1.00 3.00 H new ATOM 652 N VAL A 42 13.316 0.413 5.195 1.00 0.95 N ATOM 653 CA VAL A 42 12.751 -0.214 3.991 1.00 0.95 C ATOM 654 C VAL A 42 13.868 -0.855 3.159 1.00 1.02 C ATOM 655 O VAL A 42 13.774 -2.020 2.783 1.00 1.13 O ATOM 656 CB VAL A 42 11.806 0.695 3.154 1.00 0.93 C ATOM 657 CG1 VAL A 42 11.163 1.829 3.945 1.00 1.68 C ATOM 658 CG2 VAL A 42 12.427 1.298 1.885 1.00 1.63 C ATOM 0 H VAL A 42 13.113 1.408 5.290 1.00 0.95 H new ATOM 0 HA VAL A 42 12.081 -1.000 4.338 1.00 0.95 H new ATOM 0 HB VAL A 42 11.041 -0.021 2.855 1.00 0.93 H new ATOM 0 HG11 VAL A 42 10.520 2.413 3.286 1.00 1.68 H new ATOM 0 HG12 VAL A 42 10.568 1.414 4.758 1.00 1.68 H new ATOM 0 HG13 VAL A 42 11.941 2.472 4.357 1.00 1.68 H new ATOM 0 HG21 VAL A 42 11.686 1.914 1.375 1.00 1.63 H new ATOM 0 HG22 VAL A 42 13.285 1.913 2.157 1.00 1.63 H new ATOM 0 HG23 VAL A 42 12.751 0.496 1.222 1.00 1.63 H new ATOM 668 N THR A 43 14.953 -0.115 2.903 1.00 0.99 N ATOM 669 CA THR A 43 16.089 -0.651 2.159 1.00 1.10 C ATOM 670 C THR A 43 16.797 -1.777 2.917 1.00 1.33 C ATOM 671 O THR A 43 17.589 -2.491 2.306 1.00 1.77 O ATOM 672 CB THR A 43 17.071 0.448 1.716 1.00 0.97 C ATOM 673 OG1 THR A 43 18.106 -0.104 0.926 1.00 1.85 O ATOM 674 CG2 THR A 43 17.708 1.180 2.894 1.00 1.11 C ATOM 0 H THR A 43 15.064 0.854 3.201 1.00 0.99 H new ATOM 0 HA THR A 43 15.680 -1.090 1.249 1.00 1.10 H new ATOM 0 HB THR A 43 16.485 1.165 1.141 1.00 0.97 H new ATOM 0 HG1 THR A 43 18.217 -1.052 1.149 1.00 1.85 H new ATOM 0 HG21 THR A 43 18.391 1.944 2.522 1.00 1.11 H new ATOM 0 HG22 THR A 43 16.929 1.651 3.494 1.00 1.11 H new ATOM 0 HG23 THR A 43 18.259 0.469 3.509 1.00 1.11 H new ATOM 682 N GLN A 44 16.604 -1.893 4.235 1.00 1.20 N ATOM 683 CA GLN A 44 17.164 -2.995 4.994 1.00 1.43 C ATOM 684 C GLN A 44 16.288 -4.232 4.782 1.00 1.54 C ATOM 685 O GLN A 44 16.793 -5.267 4.355 1.00 1.62 O ATOM 686 CB GLN A 44 17.312 -2.598 6.471 1.00 1.45 C ATOM 687 CG GLN A 44 18.360 -3.452 7.195 1.00 1.85 C ATOM 688 CD GLN A 44 18.002 -4.938 7.250 1.00 2.40 C ATOM 689 OE1 GLN A 44 16.890 -5.307 7.617 1.00 3.16 O ATOM 690 NE2 GLN A 44 18.932 -5.810 6.875 1.00 3.62 N ATOM 0 H GLN A 44 16.062 -1.232 4.791 1.00 1.20 H new ATOM 0 HA GLN A 44 18.167 -3.239 4.645 1.00 1.43 H new ATOM 0 HB2 GLN A 44 17.593 -1.547 6.537 1.00 1.45 H new ATOM 0 HB3 GLN A 44 16.350 -2.703 6.972 1.00 1.45 H new ATOM 0 HG2 GLN A 44 19.321 -3.336 6.694 1.00 1.85 H new ATOM 0 HG3 GLN A 44 18.483 -3.078 8.211 1.00 1.85 H new ATOM 0 HE21 GLN A 44 19.849 -5.480 6.574 1.00 3.62 H new ATOM 0 HE22 GLN A 44 18.729 -6.809 6.888 1.00 3.62 H new ATOM 699 N GLN A 45 14.985 -4.139 5.082 1.00 1.58 N ATOM 700 CA GLN A 45 14.096 -5.284 4.922 1.00 1.75 C ATOM 701 C GLN A 45 14.059 -5.725 3.442 1.00 1.80 C ATOM 702 O GLN A 45 14.116 -6.929 3.217 1.00 2.22 O ATOM 703 CB GLN A 45 12.693 -5.053 5.519 1.00 1.86 C ATOM 704 CG GLN A 45 12.464 -5.112 7.032 1.00 1.98 C ATOM 705 CD GLN A 45 13.174 -4.020 7.822 1.00 1.67 C ATOM 706 OE1 GLN A 45 12.549 -3.029 8.187 1.00 2.31 O ATOM 707 NE2 GLN A 45 14.458 -4.167 8.127 1.00 2.21 N ATOM 0 H GLN A 45 14.534 -3.293 5.431 1.00 1.58 H new ATOM 0 HA GLN A 45 14.507 -6.107 5.507 1.00 1.75 H new ATOM 0 HB2 GLN A 45 12.360 -4.071 5.183 1.00 1.86 H new ATOM 0 HB3 GLN A 45 12.027 -5.788 5.066 1.00 1.86 H new ATOM 0 HG2 GLN A 45 11.394 -5.047 7.227 1.00 1.98 H new ATOM 0 HG3 GLN A 45 12.796 -6.083 7.399 1.00 1.98 H new ATOM 0 HE21 GLN A 45 14.964 -4.996 7.817 1.00 2.21 H new ATOM 0 HE22 GLN A 45 14.938 -3.451 8.672 1.00 2.21 H new ATOM 716 N LEU A 46 14.013 -4.815 2.444 1.00 1.51 N ATOM 717 CA LEU A 46 14.119 -5.158 1.010 1.00 1.61 C ATOM 718 C LEU A 46 15.584 -5.273 0.562 1.00 1.72 C ATOM 719 O LEU A 46 16.205 -4.244 0.309 1.00 2.18 O ATOM 720 CB LEU A 46 13.464 -4.109 0.067 1.00 1.53 C ATOM 721 CG LEU A 46 11.932 -4.105 0.015 1.00 1.49 C ATOM 722 CD1 LEU A 46 11.378 -3.016 0.936 1.00 1.56 C ATOM 723 CD2 LEU A 46 11.287 -3.843 -1.355 1.00 1.72 C ATOM 0 H LEU A 46 13.901 -3.815 2.613 1.00 1.51 H new ATOM 0 HA LEU A 46 13.592 -6.109 0.928 1.00 1.61 H new ATOM 0 HB2 LEU A 46 13.798 -3.118 0.373 1.00 1.53 H new ATOM 0 HB3 LEU A 46 13.840 -4.275 -0.943 1.00 1.53 H new ATOM 0 HG LEU A 46 11.680 -5.123 0.311 1.00 1.49 H new ATOM 0 HD11 LEU A 46 10.289 -3.021 0.892 1.00 1.56 H new ATOM 0 HD12 LEU A 46 11.701 -3.206 1.960 1.00 1.56 H new ATOM 0 HD13 LEU A 46 11.749 -2.043 0.614 1.00 1.56 H new ATOM 0 HD21 LEU A 46 10.202 -3.866 -1.257 1.00 1.72 H new ATOM 0 HD22 LEU A 46 11.597 -2.865 -1.722 1.00 1.72 H new ATOM 0 HD23 LEU A 46 11.604 -4.612 -2.059 1.00 1.72 H new ATOM 735 N PRO A 47 16.132 -6.476 0.316 1.00 1.39 N ATOM 736 CA PRO A 47 17.405 -6.629 -0.369 1.00 1.33 C ATOM 737 C PRO A 47 17.255 -6.664 -1.900 1.00 1.19 C ATOM 738 O PRO A 47 18.221 -7.047 -2.555 1.00 1.31 O ATOM 739 CB PRO A 47 17.948 -7.964 0.149 1.00 1.41 C ATOM 740 CG PRO A 47 16.674 -8.801 0.247 1.00 1.39 C ATOM 741 CD PRO A 47 15.666 -7.775 0.767 1.00 1.36 C ATOM 0 HA PRO A 47 18.066 -5.785 -0.171 1.00 1.33 H new ATOM 0 HB2 PRO A 47 18.674 -8.403 -0.535 1.00 1.41 H new ATOM 0 HB3 PRO A 47 18.443 -7.857 1.114 1.00 1.41 H new ATOM 0 HG2 PRO A 47 16.379 -9.211 -0.719 1.00 1.39 H new ATOM 0 HG3 PRO A 47 16.789 -9.643 0.929 1.00 1.39 H new ATOM 0 HD2 PRO A 47 14.667 -7.984 0.384 1.00 1.36 H new ATOM 0 HD3 PRO A 47 15.604 -7.809 1.855 1.00 1.36 H new ATOM 749 N HIS A 48 16.094 -6.311 -2.484 1.00 1.26 N ATOM 750 CA HIS A 48 15.823 -6.423 -3.925 1.00 1.30 C ATOM 751 C HIS A 48 17.032 -5.996 -4.764 1.00 1.41 C ATOM 752 O HIS A 48 17.675 -6.809 -5.427 1.00 2.16 O ATOM 753 CB HIS A 48 14.630 -5.533 -4.333 1.00 1.80 C ATOM 754 CG HIS A 48 13.253 -6.062 -4.039 1.00 2.49 C ATOM 755 ND1 HIS A 48 12.901 -6.929 -3.037 1.00 3.60 N ATOM 756 CD2 HIS A 48 12.129 -5.824 -4.787 1.00 3.14 C ATOM 757 CE1 HIS A 48 11.604 -7.233 -3.204 1.00 4.70 C ATOM 758 NE2 HIS A 48 11.079 -6.563 -4.244 1.00 4.44 N ATOM 0 H HIS A 48 15.307 -5.934 -1.956 1.00 1.26 H new ATOM 0 HA HIS A 48 15.597 -7.472 -4.114 1.00 1.30 H new ATOM 0 HB2 HIS A 48 14.738 -4.571 -3.832 1.00 1.80 H new ATOM 0 HB3 HIS A 48 14.699 -5.344 -5.404 1.00 1.80 H new ATOM 0 HD1 HIS A 48 13.513 -7.279 -2.300 1.00 3.60 H new ATOM 0 HD2 HIS A 48 12.068 -5.176 -5.649 1.00 3.14 H new ATOM 0 HE1 HIS A 48 11.054 -7.925 -2.584 1.00 4.70 H new ATOM 766 N LEU A 49 17.302 -4.687 -4.725 1.00 1.77 N ATOM 767 CA LEU A 49 18.345 -3.986 -5.458 1.00 1.83 C ATOM 768 C LEU A 49 18.295 -2.511 -5.047 1.00 1.67 C ATOM 769 O LEU A 49 19.332 -1.918 -4.772 1.00 1.88 O ATOM 770 CB LEU A 49 18.158 -4.144 -6.977 1.00 1.88 C ATOM 771 CG LEU A 49 19.233 -3.427 -7.811 1.00 2.63 C ATOM 772 CD1 LEU A 49 20.636 -3.982 -7.534 1.00 3.74 C ATOM 773 CD2 LEU A 49 18.906 -3.614 -9.295 1.00 2.56 C ATOM 0 H LEU A 49 16.758 -4.053 -4.140 1.00 1.77 H new ATOM 0 HA LEU A 49 19.320 -4.409 -5.217 1.00 1.83 H new ATOM 0 HB2 LEU A 49 18.165 -5.205 -7.226 1.00 1.88 H new ATOM 0 HB3 LEU A 49 17.177 -3.758 -7.255 1.00 1.88 H new ATOM 0 HG LEU A 49 19.231 -2.372 -7.537 1.00 2.63 H new ATOM 0 HD11 LEU A 49 21.365 -3.448 -8.143 1.00 3.74 H new ATOM 0 HD12 LEU A 49 20.878 -3.850 -6.479 1.00 3.74 H new ATOM 0 HD13 LEU A 49 20.663 -5.043 -7.782 1.00 3.74 H new ATOM 0 HD21 LEU A 49 19.660 -3.111 -9.900 1.00 2.56 H new ATOM 0 HD22 LEU A 49 18.899 -4.677 -9.535 1.00 2.56 H new ATOM 0 HD23 LEU A 49 17.926 -3.187 -9.508 1.00 2.56 H new ATOM 785 N LEU A 50 17.080 -1.944 -4.997 1.00 1.42 N ATOM 786 CA LEU A 50 16.806 -0.575 -4.554 1.00 1.41 C ATOM 787 C LEU A 50 17.452 0.383 -5.544 1.00 1.45 C ATOM 788 O LEU A 50 18.336 1.173 -5.224 1.00 1.69 O ATOM 789 CB LEU A 50 17.228 -0.319 -3.093 1.00 1.66 C ATOM 790 CG LEU A 50 16.245 -0.861 -2.042 1.00 1.95 C ATOM 791 CD1 LEU A 50 14.975 -0.009 -1.943 1.00 3.01 C ATOM 792 CD2 LEU A 50 15.870 -2.324 -2.269 1.00 2.17 C ATOM 0 H LEU A 50 16.236 -2.445 -5.274 1.00 1.42 H new ATOM 0 HA LEU A 50 15.729 -0.406 -4.547 1.00 1.41 H new ATOM 0 HB2 LEU A 50 18.205 -0.772 -2.926 1.00 1.66 H new ATOM 0 HB3 LEU A 50 17.344 0.755 -2.944 1.00 1.66 H new ATOM 0 HG LEU A 50 16.782 -0.800 -1.095 1.00 1.95 H new ATOM 0 HD11 LEU A 50 14.312 -0.431 -1.188 1.00 3.01 H new ATOM 0 HD12 LEU A 50 15.241 1.010 -1.663 1.00 3.01 H new ATOM 0 HD13 LEU A 50 14.467 0.001 -2.908 1.00 3.01 H new ATOM 0 HD21 LEU A 50 15.174 -2.646 -1.494 1.00 2.17 H new ATOM 0 HD22 LEU A 50 15.400 -2.432 -3.246 1.00 2.17 H new ATOM 0 HD23 LEU A 50 16.768 -2.940 -2.229 1.00 2.17 H new ATOM 804 N LYS A 51 16.999 0.264 -6.791 1.00 1.31 N ATOM 805 CA LYS A 51 17.516 1.054 -7.892 1.00 1.39 C ATOM 806 C LYS A 51 16.981 2.487 -7.836 1.00 1.32 C ATOM 807 O LYS A 51 17.614 3.387 -8.380 1.00 1.39 O ATOM 808 CB LYS A 51 17.190 0.347 -9.210 1.00 1.41 C ATOM 809 CG LYS A 51 15.686 0.369 -9.511 1.00 1.22 C ATOM 810 CD LYS A 51 15.274 1.597 -10.341 1.00 1.35 C ATOM 811 CE LYS A 51 15.327 1.364 -11.857 1.00 1.58 C ATOM 812 NZ LYS A 51 16.705 1.455 -12.381 1.00 2.30 N ATOM 0 H LYS A 51 16.261 -0.387 -7.060 1.00 1.31 H new ATOM 0 HA LYS A 51 18.600 1.137 -7.815 1.00 1.39 H new ATOM 0 HB2 LYS A 51 17.731 0.829 -10.024 1.00 1.41 H new ATOM 0 HB3 LYS A 51 17.537 -0.685 -9.164 1.00 1.41 H new ATOM 0 HG2 LYS A 51 15.412 -0.539 -10.049 1.00 1.22 H new ATOM 0 HG3 LYS A 51 15.130 0.364 -8.573 1.00 1.22 H new ATOM 0 HD2 LYS A 51 14.262 1.889 -10.063 1.00 1.35 H new ATOM 0 HD3 LYS A 51 15.928 2.432 -10.088 1.00 1.35 H new ATOM 0 HE2 LYS A 51 14.915 0.382 -12.088 1.00 1.58 H new ATOM 0 HE3 LYS A 51 14.698 2.099 -12.359 1.00 1.58 H new ATOM 0 HZ1 LYS A 51 16.677 1.547 -13.417 1.00 2.30 H new ATOM 0 HZ2 LYS A 51 17.178 2.286 -11.972 1.00 2.30 H new ATOM 0 HZ3 LYS A 51 17.232 0.596 -12.124 1.00 2.30 H new ATOM 826 N ASP A 52 15.779 2.643 -7.265 1.00 1.23 N ATOM 827 CA ASP A 52 15.105 3.869 -6.869 1.00 1.20 C ATOM 828 C ASP A 52 15.414 5.071 -7.755 1.00 1.11 C ATOM 829 O ASP A 52 16.361 5.814 -7.510 1.00 1.39 O ATOM 830 CB ASP A 52 15.261 4.101 -5.357 1.00 1.65 C ATOM 831 CG ASP A 52 14.515 3.049 -4.531 1.00 1.94 C ATOM 832 OD1 ASP A 52 14.480 1.883 -4.992 1.00 2.22 O ATOM 833 OD2 ASP A 52 13.974 3.429 -3.463 1.00 2.93 O ATOM 0 H ASP A 52 15.205 1.828 -7.051 1.00 1.23 H new ATOM 0 HA ASP A 52 14.038 3.736 -7.050 1.00 1.20 H new ATOM 0 HB2 ASP A 52 16.319 4.083 -5.095 1.00 1.65 H new ATOM 0 HB3 ASP A 52 14.887 5.093 -5.103 1.00 1.65 H new ATOM 838 N VAL A 53 14.582 5.265 -8.789 1.00 0.90 N ATOM 839 CA VAL A 53 14.664 6.396 -9.692 1.00 0.93 C ATOM 840 C VAL A 53 13.271 6.878 -10.091 1.00 1.05 C ATOM 841 O VAL A 53 12.273 6.185 -9.892 1.00 1.63 O ATOM 842 CB VAL A 53 15.575 6.044 -10.874 1.00 1.48 C ATOM 843 CG1 VAL A 53 14.932 5.008 -11.803 1.00 1.93 C ATOM 844 CG2 VAL A 53 16.008 7.267 -11.686 1.00 2.19 C ATOM 0 H VAL A 53 13.823 4.622 -9.015 1.00 0.90 H new ATOM 0 HA VAL A 53 15.124 7.247 -9.190 1.00 0.93 H new ATOM 0 HB VAL A 53 16.470 5.612 -10.426 1.00 1.48 H new ATOM 0 HG11 VAL A 53 15.611 4.787 -12.627 1.00 1.93 H new ATOM 0 HG12 VAL A 53 14.730 4.094 -11.244 1.00 1.93 H new ATOM 0 HG13 VAL A 53 13.997 5.405 -12.199 1.00 1.93 H new ATOM 0 HG21 VAL A 53 16.651 6.950 -12.507 1.00 2.19 H new ATOM 0 HG22 VAL A 53 15.127 7.768 -12.087 1.00 2.19 H new ATOM 0 HG23 VAL A 53 16.555 7.956 -11.042 1.00 2.19 H new ATOM 854 N GLY A 54 13.198 8.100 -10.619 1.00 1.17 N ATOM 855 CA GLY A 54 11.944 8.763 -10.913 1.00 1.68 C ATOM 856 C GLY A 54 11.293 9.160 -9.596 1.00 1.47 C ATOM 857 O GLY A 54 11.556 10.241 -9.082 1.00 1.53 O ATOM 0 H GLY A 54 14.020 8.656 -10.854 1.00 1.17 H new ATOM 0 HA2 GLY A 54 12.116 9.643 -11.532 1.00 1.68 H new ATOM 0 HA3 GLY A 54 11.287 8.100 -11.477 1.00 1.68 H new ATOM 861 N SER A 55 10.497 8.266 -9.010 1.00 1.30 N ATOM 862 CA SER A 55 9.828 8.545 -7.744 1.00 1.19 C ATOM 863 C SER A 55 10.802 8.653 -6.573 1.00 1.03 C ATOM 864 O SER A 55 10.426 9.158 -5.519 1.00 1.08 O ATOM 865 CB SER A 55 8.658 7.617 -7.471 1.00 1.26 C ATOM 866 OG SER A 55 7.781 7.611 -8.577 1.00 1.65 O ATOM 0 H SER A 55 10.301 7.342 -9.394 1.00 1.30 H new ATOM 0 HA SER A 55 9.387 9.536 -7.851 1.00 1.19 H new ATOM 0 HB2 SER A 55 9.021 6.607 -7.278 1.00 1.26 H new ATOM 0 HB3 SER A 55 8.127 7.941 -6.576 1.00 1.26 H new ATOM 0 HG SER A 55 6.859 7.503 -8.263 1.00 1.65 H new ATOM 872 N LEU A 56 12.048 8.205 -6.759 1.00 0.96 N ATOM 873 CA LEU A 56 13.169 8.612 -5.915 1.00 1.12 C ATOM 874 C LEU A 56 13.034 10.079 -5.564 1.00 1.37 C ATOM 875 O LEU A 56 13.140 10.431 -4.396 1.00 1.27 O ATOM 876 CB LEU A 56 14.470 8.399 -6.689 1.00 1.51 C ATOM 877 CG LEU A 56 15.784 8.870 -6.034 1.00 1.90 C ATOM 878 CD1 LEU A 56 16.019 10.387 -6.021 1.00 2.86 C ATOM 879 CD2 LEU A 56 15.985 8.276 -4.635 1.00 2.51 C ATOM 0 H LEU A 56 12.304 7.551 -7.499 1.00 0.96 H new ATOM 0 HA LEU A 56 13.175 8.020 -5.000 1.00 1.12 H new ATOM 0 HB2 LEU A 56 14.564 7.333 -6.899 1.00 1.51 H new ATOM 0 HB3 LEU A 56 14.375 8.906 -7.649 1.00 1.51 H new ATOM 0 HG LEU A 56 16.548 8.473 -6.702 1.00 1.90 H new ATOM 0 HD11 LEU A 56 16.971 10.604 -5.537 1.00 2.86 H new ATOM 0 HD12 LEU A 56 16.039 10.761 -7.045 1.00 2.86 H new ATOM 0 HD13 LEU A 56 15.214 10.875 -5.472 1.00 2.86 H new ATOM 0 HD21 LEU A 56 16.924 8.639 -4.217 1.00 2.51 H new ATOM 0 HD22 LEU A 56 15.160 8.578 -3.990 1.00 2.51 H new ATOM 0 HD23 LEU A 56 16.014 7.188 -4.702 1.00 2.51 H new ATOM 891 N ASP A 57 12.774 10.915 -6.574 1.00 1.81 N ATOM 892 CA ASP A 57 12.576 12.344 -6.345 1.00 2.27 C ATOM 893 C ASP A 57 11.532 12.558 -5.241 1.00 2.02 C ATOM 894 O ASP A 57 11.820 13.152 -4.201 1.00 1.98 O ATOM 895 CB ASP A 57 12.134 13.052 -7.633 1.00 2.97 C ATOM 896 CG ASP A 57 11.563 14.430 -7.327 1.00 3.90 C ATOM 897 OD1 ASP A 57 12.364 15.360 -7.115 1.00 3.55 O ATOM 898 OD2 ASP A 57 10.316 14.521 -7.246 1.00 5.54 O ATOM 0 H ASP A 57 12.697 10.627 -7.549 1.00 1.81 H new ATOM 0 HA ASP A 57 13.526 12.775 -6.030 1.00 2.27 H new ATOM 0 HB2 ASP A 57 12.983 13.148 -8.310 1.00 2.97 H new ATOM 0 HB3 ASP A 57 11.384 12.449 -8.145 1.00 2.97 H new ATOM 903 N GLU A 58 10.323 12.042 -5.485 1.00 2.00 N ATOM 904 CA GLU A 58 9.182 12.123 -4.587 1.00 2.10 C ATOM 905 C GLU A 58 9.583 11.707 -3.172 1.00 1.69 C ATOM 906 O GLU A 58 9.368 12.446 -2.211 1.00 1.77 O ATOM 907 CB GLU A 58 8.022 11.272 -5.136 1.00 2.27 C ATOM 908 CG GLU A 58 6.684 11.532 -4.424 1.00 3.86 C ATOM 909 CD GLU A 58 5.834 12.593 -5.109 1.00 4.09 C ATOM 910 OE1 GLU A 58 6.399 13.647 -5.478 1.00 3.65 O ATOM 911 OE2 GLU A 58 4.620 12.319 -5.255 1.00 5.42 O ATOM 0 H GLU A 58 10.111 11.539 -6.347 1.00 2.00 H new ATOM 0 HA GLU A 58 8.838 13.156 -4.530 1.00 2.10 H new ATOM 0 HB2 GLU A 58 7.904 11.475 -6.200 1.00 2.27 H new ATOM 0 HB3 GLU A 58 8.278 10.217 -5.039 1.00 2.27 H new ATOM 0 HG2 GLU A 58 6.120 10.601 -4.374 1.00 3.86 H new ATOM 0 HG3 GLU A 58 6.881 11.841 -3.397 1.00 3.86 H new ATOM 918 N LYS A 59 10.172 10.520 -3.044 1.00 1.31 N ATOM 919 CA LYS A 59 10.540 9.957 -1.759 1.00 1.08 C ATOM 920 C LYS A 59 11.592 10.837 -1.082 1.00 0.96 C ATOM 921 O LYS A 59 11.360 11.370 0.003 1.00 1.00 O ATOM 922 CB LYS A 59 10.983 8.489 -1.945 1.00 0.95 C ATOM 923 CG LYS A 59 9.981 7.565 -1.243 1.00 1.26 C ATOM 924 CD LYS A 59 10.026 6.095 -1.676 1.00 1.47 C ATOM 925 CE LYS A 59 11.373 5.394 -1.430 1.00 1.41 C ATOM 926 NZ LYS A 59 11.972 4.891 -2.691 1.00 1.89 N ATOM 0 H LYS A 59 10.406 9.923 -3.837 1.00 1.31 H new ATOM 0 HA LYS A 59 9.681 9.941 -1.088 1.00 1.08 H new ATOM 0 HB2 LYS A 59 11.038 8.245 -3.006 1.00 0.95 H new ATOM 0 HB3 LYS A 59 11.981 8.343 -1.532 1.00 0.95 H new ATOM 0 HG2 LYS A 59 10.158 7.615 -0.169 1.00 1.26 H new ATOM 0 HG3 LYS A 59 8.975 7.947 -1.419 1.00 1.26 H new ATOM 0 HD2 LYS A 59 9.246 5.550 -1.145 1.00 1.47 H new ATOM 0 HD3 LYS A 59 9.790 6.036 -2.738 1.00 1.47 H new ATOM 0 HE2 LYS A 59 12.063 6.090 -0.952 1.00 1.41 H new ATOM 0 HE3 LYS A 59 11.229 4.563 -0.739 1.00 1.41 H new ATOM 0 HZ1 LYS A 59 12.816 4.324 -2.472 1.00 1.89 H new ATOM 0 HZ2 LYS A 59 11.279 4.301 -3.193 1.00 1.89 H new ATOM 0 HZ3 LYS A 59 12.242 5.696 -3.292 1.00 1.89 H new ATOM 940 N MET A 60 12.744 11.000 -1.727 1.00 0.96 N ATOM 941 CA MET A 60 13.869 11.740 -1.188 1.00 1.09 C ATOM 942 C MET A 60 13.432 13.131 -0.737 1.00 1.33 C ATOM 943 O MET A 60 13.692 13.499 0.407 1.00 1.38 O ATOM 944 CB MET A 60 15.003 11.786 -2.219 1.00 1.25 C ATOM 945 CG MET A 60 16.281 12.390 -1.627 1.00 1.52 C ATOM 946 SD MET A 60 17.724 12.286 -2.710 1.00 1.90 S ATOM 947 CE MET A 60 18.969 13.041 -1.644 1.00 2.47 C ATOM 0 H MET A 60 12.920 10.613 -2.654 1.00 0.96 H new ATOM 0 HA MET A 60 14.250 11.230 -0.303 1.00 1.09 H new ATOM 0 HB2 MET A 60 15.209 10.778 -2.579 1.00 1.25 H new ATOM 0 HB3 MET A 60 14.688 12.374 -3.081 1.00 1.25 H new ATOM 0 HG2 MET A 60 16.096 13.437 -1.387 1.00 1.52 H new ATOM 0 HG3 MET A 60 16.508 11.883 -0.689 1.00 1.52 H new ATOM 0 HE1 MET A 60 19.929 13.058 -2.161 1.00 2.47 H new ATOM 0 HE2 MET A 60 18.670 14.061 -1.401 1.00 2.47 H new ATOM 0 HE3 MET A 60 19.062 12.461 -0.726 1.00 2.47 H new ATOM 957 N LYS A 61 12.755 13.893 -1.605 1.00 1.53 N ATOM 958 CA LYS A 61 12.353 15.247 -1.246 1.00 1.75 C ATOM 959 C LYS A 61 11.404 15.210 -0.048 1.00 1.66 C ATOM 960 O LYS A 61 11.639 15.888 0.947 1.00 1.67 O ATOM 961 CB LYS A 61 11.786 16.011 -2.450 1.00 2.01 C ATOM 962 CG LYS A 61 10.348 15.618 -2.804 1.00 2.71 C ATOM 963 CD LYS A 61 9.986 16.111 -4.194 1.00 2.94 C ATOM 964 CE LYS A 61 8.504 15.846 -4.506 1.00 4.77 C ATOM 965 NZ LYS A 61 8.292 15.399 -5.898 1.00 5.16 N ATOM 0 H LYS A 61 12.481 13.597 -2.542 1.00 1.53 H new ATOM 0 HA LYS A 61 13.235 15.809 -0.941 1.00 1.75 H new ATOM 0 HB2 LYS A 61 11.820 17.080 -2.240 1.00 2.01 H new ATOM 0 HB3 LYS A 61 12.425 15.835 -3.315 1.00 2.01 H new ATOM 0 HG2 LYS A 61 10.239 14.534 -2.757 1.00 2.71 H new ATOM 0 HG3 LYS A 61 9.659 16.040 -2.072 1.00 2.71 H new ATOM 0 HD2 LYS A 61 10.192 17.179 -4.270 1.00 2.94 H new ATOM 0 HD3 LYS A 61 10.612 15.613 -4.935 1.00 2.94 H new ATOM 0 HE2 LYS A 61 8.121 15.088 -3.822 1.00 4.77 H new ATOM 0 HE3 LYS A 61 7.930 16.755 -4.328 1.00 4.77 H new ATOM 0 HZ1 LYS A 61 7.827 16.156 -6.439 1.00 5.16 H new ATOM 0 HZ2 LYS A 61 9.209 15.175 -6.334 1.00 5.16 H new ATOM 0 HZ3 LYS A 61 7.690 14.551 -5.902 1.00 5.16 H new ATOM 979 N SER A 62 10.341 14.400 -0.128 1.00 1.60 N ATOM 980 CA SER A 62 9.405 14.240 0.982 1.00 1.55 C ATOM 981 C SER A 62 10.122 13.978 2.313 1.00 1.41 C ATOM 982 O SER A 62 9.775 14.590 3.322 1.00 1.45 O ATOM 983 CB SER A 62 8.377 13.141 0.694 1.00 1.53 C ATOM 984 OG SER A 62 7.603 13.480 -0.438 1.00 2.04 O ATOM 0 H SER A 62 10.111 13.846 -0.953 1.00 1.60 H new ATOM 0 HA SER A 62 8.874 15.187 1.080 1.00 1.55 H new ATOM 0 HB2 SER A 62 8.886 12.192 0.524 1.00 1.53 H new ATOM 0 HB3 SER A 62 7.728 13.004 1.559 1.00 1.53 H new ATOM 0 HG SER A 62 8.010 13.092 -1.241 1.00 2.04 H new ATOM 990 N LEU A 63 11.117 13.085 2.340 1.00 1.29 N ATOM 991 CA LEU A 63 11.870 12.860 3.571 1.00 1.28 C ATOM 992 C LEU A 63 12.679 14.117 3.919 1.00 1.38 C ATOM 993 O LEU A 63 12.656 14.573 5.062 1.00 1.33 O ATOM 994 CB LEU A 63 12.723 11.576 3.504 1.00 1.22 C ATOM 995 CG LEU A 63 11.936 10.250 3.463 1.00 1.52 C ATOM 996 CD1 LEU A 63 10.457 10.330 3.056 1.00 1.83 C ATOM 997 CD2 LEU A 63 12.631 9.284 2.501 1.00 2.06 C ATOM 0 H LEU A 63 11.412 12.521 1.543 1.00 1.29 H new ATOM 0 HA LEU A 63 11.171 12.685 4.389 1.00 1.28 H new ATOM 0 HB2 LEU A 63 13.356 11.629 2.618 1.00 1.22 H new ATOM 0 HB3 LEU A 63 13.386 11.557 4.369 1.00 1.22 H new ATOM 0 HG LEU A 63 11.934 9.915 4.500 1.00 1.52 H new ATOM 0 HD11 LEU A 63 10.022 9.331 3.067 1.00 1.83 H new ATOM 0 HD12 LEU A 63 9.920 10.968 3.759 1.00 1.83 H new ATOM 0 HD13 LEU A 63 10.378 10.749 2.053 1.00 1.83 H new ATOM 0 HD21 LEU A 63 12.080 8.344 2.467 1.00 2.06 H new ATOM 0 HD22 LEU A 63 12.661 9.723 1.504 1.00 2.06 H new ATOM 0 HD23 LEU A 63 13.648 9.096 2.846 1.00 2.06 H new ATOM 1009 N ASP A 64 13.369 14.706 2.941 1.00 1.58 N ATOM 1010 CA ASP A 64 14.166 15.908 3.149 1.00 1.85 C ATOM 1011 C ASP A 64 13.375 17.026 3.844 1.00 2.03 C ATOM 1012 O ASP A 64 13.864 17.587 4.823 1.00 2.16 O ATOM 1013 CB ASP A 64 14.767 16.380 1.822 1.00 1.93 C ATOM 1014 CG ASP A 64 15.695 17.563 2.041 1.00 2.20 C ATOM 1015 OD1 ASP A 64 16.871 17.302 2.372 1.00 1.90 O ATOM 1016 OD2 ASP A 64 15.211 18.701 1.860 1.00 3.45 O ATOM 0 H ASP A 64 13.389 14.359 1.982 1.00 1.58 H new ATOM 0 HA ASP A 64 14.980 15.651 3.826 1.00 1.85 H new ATOM 0 HB2 ASP A 64 15.316 15.563 1.355 1.00 1.93 H new ATOM 0 HB3 ASP A 64 13.968 16.661 1.135 1.00 1.93 H new ATOM 1021 N VAL A 65 12.157 17.340 3.373 1.00 2.06 N ATOM 1022 CA VAL A 65 11.447 18.530 3.858 1.00 2.16 C ATOM 1023 C VAL A 65 11.270 18.510 5.378 1.00 2.15 C ATOM 1024 O VAL A 65 11.561 19.497 6.054 1.00 2.37 O ATOM 1025 CB VAL A 65 10.114 18.825 3.132 1.00 2.21 C ATOM 1026 CG1 VAL A 65 10.217 18.624 1.622 1.00 2.99 C ATOM 1027 CG2 VAL A 65 8.899 18.038 3.641 1.00 3.46 C ATOM 0 H VAL A 65 11.653 16.798 2.671 1.00 2.06 H new ATOM 0 HA VAL A 65 12.099 19.365 3.603 1.00 2.16 H new ATOM 0 HB VAL A 65 9.941 19.875 3.368 1.00 2.21 H new ATOM 0 HG11 VAL A 65 9.255 18.844 1.159 1.00 2.99 H new ATOM 0 HG12 VAL A 65 10.976 19.293 1.217 1.00 2.99 H new ATOM 0 HG13 VAL A 65 10.494 17.591 1.410 1.00 2.99 H new ATOM 0 HG21 VAL A 65 8.017 18.319 3.066 1.00 3.46 H new ATOM 0 HG22 VAL A 65 9.083 16.970 3.525 1.00 3.46 H new ATOM 0 HG23 VAL A 65 8.733 18.266 4.694 1.00 3.46 H new ATOM 1037 N ASN A 66 10.782 17.389 5.923 1.00 1.89 N ATOM 1038 CA ASN A 66 10.712 17.221 7.371 1.00 1.75 C ATOM 1039 C ASN A 66 10.492 15.774 7.796 1.00 1.75 C ATOM 1040 O ASN A 66 9.490 15.443 8.431 1.00 1.76 O ATOM 1041 CB ASN A 66 9.663 18.137 8.024 1.00 1.64 C ATOM 1042 CG ASN A 66 10.108 18.444 9.447 1.00 2.04 C ATOM 1043 OD1 ASN A 66 9.736 17.757 10.392 1.00 3.46 O ATOM 1044 ND2 ASN A 66 10.949 19.462 9.602 1.00 2.31 N ATOM 0 H ASN A 66 10.434 16.595 5.386 1.00 1.89 H new ATOM 0 HA ASN A 66 11.694 17.522 7.735 1.00 1.75 H new ATOM 0 HB2 ASN A 66 9.558 19.059 7.453 1.00 1.64 H new ATOM 0 HB3 ASN A 66 8.687 17.652 8.029 1.00 1.64 H new ATOM 0 HD21 ASN A 66 11.306 19.692 10.529 1.00 2.31 H new ATOM 0 HD22 ASN A 66 11.238 20.013 8.793 1.00 2.31 H new ATOM 1051 N GLN A 67 11.465 14.906 7.519 1.00 1.78 N ATOM 1052 CA GLN A 67 11.424 13.529 7.981 1.00 1.73 C ATOM 1053 C GLN A 67 11.079 13.390 9.468 1.00 1.82 C ATOM 1054 O GLN A 67 10.530 12.375 9.901 1.00 1.88 O ATOM 1055 CB GLN A 67 12.761 12.838 7.702 1.00 1.69 C ATOM 1056 CG GLN A 67 13.959 13.467 8.446 1.00 1.79 C ATOM 1057 CD GLN A 67 14.088 12.996 9.897 1.00 3.28 C ATOM 1058 OE1 GLN A 67 13.714 11.872 10.225 1.00 4.82 O ATOM 1059 NE2 GLN A 67 14.584 13.872 10.763 1.00 3.61 N ATOM 0 H GLN A 67 12.294 15.140 6.973 1.00 1.78 H new ATOM 0 HA GLN A 67 10.621 13.048 7.423 1.00 1.73 H new ATOM 0 HB2 GLN A 67 12.682 11.788 7.984 1.00 1.69 H new ATOM 0 HB3 GLN A 67 12.956 12.866 6.630 1.00 1.69 H new ATOM 0 HG2 GLN A 67 14.877 13.226 7.910 1.00 1.79 H new ATOM 0 HG3 GLN A 67 13.857 14.552 8.432 1.00 1.79 H new ATOM 0 HE21 GLN A 67 14.881 14.794 10.443 1.00 3.61 H new ATOM 0 HE22 GLN A 67 14.668 13.623 11.749 1.00 3.61 H new ATOM 1068 N ASP A 68 11.464 14.402 10.249 1.00 1.89 N ATOM 1069 CA ASP A 68 11.345 14.401 11.694 1.00 1.93 C ATOM 1070 C ASP A 68 9.881 14.471 12.143 1.00 2.02 C ATOM 1071 O ASP A 68 9.581 14.186 13.299 1.00 2.24 O ATOM 1072 CB ASP A 68 12.188 15.547 12.278 1.00 1.83 C ATOM 1073 CG ASP A 68 12.978 15.089 13.497 1.00 1.94 C ATOM 1074 OD1 ASP A 68 13.843 14.206 13.296 1.00 2.64 O ATOM 1075 OD2 ASP A 68 12.739 15.653 14.585 1.00 2.75 O ATOM 0 H ASP A 68 11.875 15.259 9.879 1.00 1.89 H new ATOM 0 HA ASP A 68 11.732 13.458 12.080 1.00 1.93 H new ATOM 0 HB2 ASP A 68 12.874 15.921 11.517 1.00 1.83 H new ATOM 0 HB3 ASP A 68 11.536 16.376 12.555 1.00 1.83 H new ATOM 1080 N SER A 69 8.935 14.751 11.234 1.00 1.96 N ATOM 1081 CA SER A 69 7.497 14.816 11.524 1.00 2.06 C ATOM 1082 C SER A 69 6.846 13.454 11.840 1.00 2.23 C ATOM 1083 O SER A 69 5.629 13.318 11.689 1.00 3.99 O ATOM 1084 CB SER A 69 6.804 15.424 10.301 1.00 2.03 C ATOM 1085 OG SER A 69 7.210 16.764 10.118 1.00 2.38 O ATOM 0 H SER A 69 9.154 14.942 10.256 1.00 1.96 H new ATOM 0 HA SER A 69 7.378 15.419 12.424 1.00 2.06 H new ATOM 0 HB2 SER A 69 7.044 14.840 9.412 1.00 2.03 H new ATOM 0 HB3 SER A 69 5.722 15.380 10.429 1.00 2.03 H new ATOM 0 HG SER A 69 8.173 16.839 10.283 1.00 2.38 H new ATOM 1091 N GLU A 70 7.650 12.465 12.241 1.00 0.86 N ATOM 1092 CA GLU A 70 7.378 11.036 12.351 1.00 0.78 C ATOM 1093 C GLU A 70 6.517 10.437 11.228 1.00 0.88 C ATOM 1094 O GLU A 70 6.057 11.137 10.327 1.00 1.14 O ATOM 1095 CB GLU A 70 7.035 10.597 13.791 1.00 1.11 C ATOM 1096 CG GLU A 70 5.896 11.369 14.471 1.00 1.85 C ATOM 1097 CD GLU A 70 4.537 11.170 13.826 1.00 2.56 C ATOM 1098 OE1 GLU A 70 4.350 10.135 13.151 1.00 3.11 O ATOM 1099 OE2 GLU A 70 3.710 12.106 13.847 1.00 3.89 O ATOM 0 H GLU A 70 8.607 12.672 12.526 1.00 0.86 H new ATOM 0 HA GLU A 70 8.331 10.548 12.149 1.00 0.78 H new ATOM 0 HB2 GLU A 70 6.773 9.539 13.776 1.00 1.11 H new ATOM 0 HB3 GLU A 70 7.931 10.695 14.404 1.00 1.11 H new ATOM 0 HG2 GLU A 70 5.838 11.063 15.516 1.00 1.85 H new ATOM 0 HG3 GLU A 70 6.137 12.432 14.463 1.00 1.85 H new ATOM 1106 N LEU A 71 6.344 9.115 11.235 1.00 1.13 N ATOM 1107 CA LEU A 71 5.668 8.389 10.165 1.00 1.32 C ATOM 1108 C LEU A 71 4.350 7.791 10.653 1.00 1.20 C ATOM 1109 O LEU A 71 4.258 7.315 11.781 1.00 1.29 O ATOM 1110 CB LEU A 71 6.605 7.312 9.610 1.00 1.83 C ATOM 1111 CG LEU A 71 6.074 6.625 8.346 1.00 1.75 C ATOM 1112 CD1 LEU A 71 5.859 7.608 7.192 1.00 1.63 C ATOM 1113 CD2 LEU A 71 7.113 5.608 7.889 1.00 2.78 C ATOM 0 H LEU A 71 6.673 8.515 11.991 1.00 1.13 H new ATOM 0 HA LEU A 71 5.421 9.083 9.362 1.00 1.32 H new ATOM 0 HB2 LEU A 71 7.572 7.763 9.389 1.00 1.83 H new ATOM 0 HB3 LEU A 71 6.774 6.558 10.379 1.00 1.83 H new ATOM 0 HG LEU A 71 5.116 6.169 8.594 1.00 1.75 H new ATOM 0 HD11 LEU A 71 5.483 7.071 6.322 1.00 1.63 H new ATOM 0 HD12 LEU A 71 5.136 8.367 7.491 1.00 1.63 H new ATOM 0 HD13 LEU A 71 6.805 8.087 6.941 1.00 1.63 H new ATOM 0 HD21 LEU A 71 6.758 5.105 6.990 1.00 2.78 H new ATOM 0 HD22 LEU A 71 8.051 6.119 7.673 1.00 2.78 H new ATOM 0 HD23 LEU A 71 7.273 4.872 8.677 1.00 2.78 H new ATOM 1125 N LYS A 72 3.338 7.778 9.778 1.00 1.08 N ATOM 1126 CA LYS A 72 2.047 7.154 10.015 1.00 1.02 C ATOM 1127 C LYS A 72 1.660 6.362 8.761 1.00 0.86 C ATOM 1128 O LYS A 72 2.246 6.572 7.693 1.00 0.81 O ATOM 1129 CB LYS A 72 0.959 8.189 10.372 1.00 1.11 C ATOM 1130 CG LYS A 72 1.442 9.496 11.039 1.00 0.99 C ATOM 1131 CD LYS A 72 1.574 10.677 10.048 1.00 1.68 C ATOM 1132 CE LYS A 72 2.969 11.307 9.916 1.00 2.95 C ATOM 1133 NZ LYS A 72 3.565 11.703 11.204 1.00 2.94 N ATOM 0 H LYS A 72 3.405 8.217 8.860 1.00 1.08 H new ATOM 0 HA LYS A 72 2.126 6.487 10.873 1.00 1.02 H new ATOM 0 HB2 LYS A 72 0.424 8.450 9.459 1.00 1.11 H new ATOM 0 HB3 LYS A 72 0.240 7.712 11.038 1.00 1.11 H new ATOM 0 HG2 LYS A 72 0.745 9.771 11.830 1.00 0.99 H new ATOM 0 HG3 LYS A 72 2.408 9.319 11.513 1.00 0.99 H new ATOM 0 HD2 LYS A 72 1.260 10.332 9.063 1.00 1.68 H new ATOM 0 HD3 LYS A 72 0.875 11.456 10.351 1.00 1.68 H new ATOM 0 HE2 LYS A 72 3.633 10.598 9.421 1.00 2.95 H new ATOM 0 HE3 LYS A 72 2.902 12.184 9.272 1.00 2.95 H new ATOM 0 HZ1 LYS A 72 4.530 12.057 11.046 1.00 2.94 H new ATOM 0 HZ2 LYS A 72 2.988 12.452 11.638 1.00 2.94 H new ATOM 0 HZ3 LYS A 72 3.598 10.880 11.839 1.00 2.94 H new ATOM 1147 N PHE A 73 0.667 5.475 8.903 1.00 0.83 N ATOM 1148 CA PHE A 73 0.176 4.573 7.862 1.00 0.75 C ATOM 1149 C PHE A 73 0.100 5.219 6.478 1.00 0.60 C ATOM 1150 O PHE A 73 0.616 4.657 5.519 1.00 0.56 O ATOM 1151 CB PHE A 73 -1.175 3.945 8.263 1.00 0.92 C ATOM 1152 CG PHE A 73 -2.127 4.875 8.996 1.00 0.90 C ATOM 1153 CD1 PHE A 73 -2.835 5.873 8.303 1.00 2.16 C ATOM 1154 CD2 PHE A 73 -2.116 4.891 10.401 1.00 1.97 C ATOM 1155 CE1 PHE A 73 -3.280 7.012 8.995 1.00 2.81 C ATOM 1156 CE2 PHE A 73 -2.596 6.009 11.101 1.00 2.72 C ATOM 1157 CZ PHE A 73 -3.148 7.089 10.392 1.00 2.76 C ATOM 0 H PHE A 73 0.165 5.364 9.784 1.00 0.83 H new ATOM 0 HA PHE A 73 0.917 3.778 7.778 1.00 0.75 H new ATOM 0 HB2 PHE A 73 -1.670 3.580 7.363 1.00 0.92 H new ATOM 0 HB3 PHE A 73 -0.982 3.078 8.894 1.00 0.92 H new ATOM 0 HD1 PHE A 73 -3.035 5.765 7.247 1.00 2.16 H new ATOM 0 HD2 PHE A 73 -1.736 4.039 10.945 1.00 1.97 H new ATOM 0 HE1 PHE A 73 -3.725 7.832 8.451 1.00 2.81 H new ATOM 0 HE2 PHE A 73 -2.541 6.039 12.179 1.00 2.72 H new ATOM 0 HZ PHE A 73 -3.470 7.975 10.919 1.00 2.76 H new ATOM 1167 N ASN A 74 -0.558 6.373 6.357 1.00 0.66 N ATOM 1168 CA ASN A 74 -0.871 6.960 5.057 1.00 0.70 C ATOM 1169 C ASN A 74 0.400 7.239 4.262 1.00 0.73 C ATOM 1170 O ASN A 74 0.496 6.869 3.093 1.00 0.83 O ATOM 1171 CB ASN A 74 -1.672 8.251 5.240 1.00 0.92 C ATOM 1172 CG ASN A 74 -2.066 8.955 3.934 1.00 2.12 C ATOM 1173 OD1 ASN A 74 -2.509 10.096 3.982 1.00 2.80 O ATOM 1174 ND2 ASN A 74 -1.916 8.334 2.766 1.00 3.61 N ATOM 0 H ASN A 74 -0.886 6.922 7.152 1.00 0.66 H new ATOM 0 HA ASN A 74 -1.472 6.244 4.497 1.00 0.70 H new ATOM 0 HB2 ASN A 74 -2.578 8.023 5.801 1.00 0.92 H new ATOM 0 HB3 ASN A 74 -1.087 8.942 5.847 1.00 0.92 H new ATOM 0 HD21 ASN A 74 -2.171 8.808 1.900 1.00 3.61 H new ATOM 0 HD22 ASN A 74 -1.546 7.384 2.737 1.00 3.61 H new ATOM 1181 N GLU A 75 1.350 7.928 4.895 1.00 0.72 N ATOM 1182 CA GLU A 75 2.575 8.340 4.243 1.00 0.80 C ATOM 1183 C GLU A 75 3.450 7.119 3.981 1.00 0.77 C ATOM 1184 O GLU A 75 3.930 6.949 2.859 1.00 0.88 O ATOM 1185 CB GLU A 75 3.257 9.432 5.070 1.00 0.85 C ATOM 1186 CG GLU A 75 4.580 9.884 4.439 1.00 2.62 C ATOM 1187 CD GLU A 75 4.739 11.389 4.540 1.00 3.14 C ATOM 1188 OE1 GLU A 75 5.189 11.852 5.604 1.00 3.77 O ATOM 1189 OE2 GLU A 75 4.324 12.042 3.554 1.00 3.83 O ATOM 0 H GLU A 75 1.284 8.212 5.873 1.00 0.72 H new ATOM 0 HA GLU A 75 2.369 8.782 3.268 1.00 0.80 H new ATOM 0 HB2 GLU A 75 2.588 10.288 5.164 1.00 0.85 H new ATOM 0 HB3 GLU A 75 3.443 9.061 6.078 1.00 0.85 H new ATOM 0 HG2 GLU A 75 5.414 9.391 4.939 1.00 2.62 H new ATOM 0 HG3 GLU A 75 4.612 9.580 3.393 1.00 2.62 H new ATOM 1196 N TYR A 76 3.601 6.246 4.991 1.00 0.70 N ATOM 1197 CA TYR A 76 4.243 4.940 4.830 1.00 0.75 C ATOM 1198 C TYR A 76 3.762 4.327 3.515 1.00 0.77 C ATOM 1199 O TYR A 76 4.562 3.983 2.646 1.00 0.81 O ATOM 1200 CB TYR A 76 3.911 4.049 6.042 1.00 0.74 C ATOM 1201 CG TYR A 76 4.270 2.572 5.939 1.00 0.93 C ATOM 1202 CD1 TYR A 76 3.451 1.697 5.196 1.00 2.01 C ATOM 1203 CD2 TYR A 76 5.277 2.032 6.761 1.00 2.26 C ATOM 1204 CE1 TYR A 76 3.701 0.316 5.197 1.00 2.16 C ATOM 1205 CE2 TYR A 76 5.458 0.639 6.841 1.00 2.46 C ATOM 1206 CZ TYR A 76 4.688 -0.218 6.037 1.00 1.59 C ATOM 1207 OH TYR A 76 4.883 -1.566 6.072 1.00 2.01 O ATOM 0 H TYR A 76 3.279 6.431 5.941 1.00 0.70 H new ATOM 0 HA TYR A 76 5.328 5.038 4.789 1.00 0.75 H new ATOM 0 HB2 TYR A 76 4.420 4.461 6.913 1.00 0.74 H new ATOM 0 HB3 TYR A 76 2.841 4.124 6.233 1.00 0.74 H new ATOM 0 HD1 TYR A 76 2.626 2.092 4.622 1.00 2.01 H new ATOM 0 HD2 TYR A 76 5.914 2.690 7.333 1.00 2.26 H new ATOM 0 HE1 TYR A 76 3.133 -0.336 4.550 1.00 2.16 H new ATOM 0 HE2 TYR A 76 6.190 0.228 7.521 1.00 2.46 H new ATOM 0 HH TYR A 76 4.656 -1.952 5.200 1.00 2.01 H new ATOM 1217 N TRP A 77 2.438 4.276 3.362 1.00 0.72 N ATOM 1218 CA TRP A 77 1.780 3.754 2.187 1.00 0.69 C ATOM 1219 C TRP A 77 2.346 4.353 0.903 1.00 0.71 C ATOM 1220 O TRP A 77 2.985 3.636 0.134 1.00 0.72 O ATOM 1221 CB TRP A 77 0.275 3.981 2.292 1.00 0.64 C ATOM 1222 CG TRP A 77 -0.482 2.781 1.911 1.00 0.60 C ATOM 1223 CD1 TRP A 77 -0.814 2.486 0.650 1.00 0.59 C ATOM 1224 CD2 TRP A 77 -1.073 1.756 2.749 1.00 0.55 C ATOM 1225 NE1 TRP A 77 -1.502 1.307 0.626 1.00 0.55 N ATOM 1226 CE2 TRP A 77 -1.734 0.831 1.894 1.00 0.53 C ATOM 1227 CE3 TRP A 77 -1.202 1.560 4.138 1.00 0.52 C ATOM 1228 CZ2 TRP A 77 -2.472 -0.243 2.386 1.00 0.52 C ATOM 1229 CZ3 TRP A 77 -1.963 0.487 4.627 1.00 0.50 C ATOM 1230 CH2 TRP A 77 -2.537 -0.442 3.765 1.00 0.52 C ATOM 0 H TRP A 77 1.788 4.607 4.075 1.00 0.72 H new ATOM 0 HA TRP A 77 1.970 2.682 2.139 1.00 0.69 H new ATOM 0 HB2 TRP A 77 0.020 4.264 3.313 1.00 0.64 H new ATOM 0 HB3 TRP A 77 -0.014 4.813 1.649 1.00 0.64 H new ATOM 0 HD1 TRP A 77 -0.575 3.087 -0.215 1.00 0.59 H new ATOM 0 HE1 TRP A 77 -1.806 0.838 -0.227 1.00 0.55 H new ATOM 0 HE3 TRP A 77 -0.715 2.235 4.826 1.00 0.52 H new ATOM 0 HZ2 TRP A 77 -2.986 -0.911 1.710 1.00 0.52 H new ATOM 0 HZ3 TRP A 77 -2.106 0.380 5.692 1.00 0.50 H new ATOM 0 HH2 TRP A 77 -3.032 -1.316 4.163 1.00 0.52 H new ATOM 1241 N ARG A 78 2.102 5.650 0.665 1.00 0.77 N ATOM 1242 CA ARG A 78 2.645 6.377 -0.473 1.00 0.83 C ATOM 1243 C ARG A 78 4.104 5.964 -0.741 1.00 0.91 C ATOM 1244 O ARG A 78 4.425 5.605 -1.873 1.00 0.93 O ATOM 1245 CB ARG A 78 2.588 7.898 -0.220 1.00 1.14 C ATOM 1246 CG ARG A 78 1.174 8.434 0.063 1.00 1.20 C ATOM 1247 CD ARG A 78 1.031 9.952 -0.149 1.00 1.53 C ATOM 1248 NE ARG A 78 0.959 10.700 1.117 1.00 2.26 N ATOM 1249 CZ ARG A 78 1.998 11.205 1.802 1.00 3.06 C ATOM 1250 NH1 ARG A 78 3.253 10.981 1.417 1.00 4.02 N ATOM 1251 NH2 ARG A 78 1.800 11.942 2.895 1.00 4.01 N ATOM 0 H ARG A 78 1.514 6.223 1.270 1.00 0.77 H new ATOM 0 HA ARG A 78 2.038 6.131 -1.344 1.00 0.83 H new ATOM 0 HB2 ARG A 78 3.233 8.140 0.625 1.00 1.14 H new ATOM 0 HB3 ARG A 78 2.994 8.416 -1.089 1.00 1.14 H new ATOM 0 HG2 ARG A 78 0.464 7.918 -0.583 1.00 1.20 H new ATOM 0 HG3 ARG A 78 0.903 8.193 1.091 1.00 1.20 H new ATOM 0 HD2 ARG A 78 1.878 10.314 -0.732 1.00 1.53 H new ATOM 0 HD3 ARG A 78 0.133 10.150 -0.734 1.00 1.53 H new ATOM 0 HE ARG A 78 0.030 10.849 1.512 1.00 2.26 H new ATOM 0 HH11 ARG A 78 3.439 10.417 0.588 1.00 4.02 H new ATOM 0 HH12 ARG A 78 4.028 11.374 1.951 1.00 4.02 H new ATOM 0 HH21 ARG A 78 0.851 12.128 3.220 1.00 4.01 H new ATOM 0 HH22 ARG A 78 2.597 12.320 3.407 1.00 4.01 H new ATOM 1265 N LEU A 79 4.985 5.983 0.278 1.00 0.98 N ATOM 1266 CA LEU A 79 6.384 5.605 0.061 1.00 1.08 C ATOM 1267 C LEU A 79 6.495 4.195 -0.516 1.00 1.00 C ATOM 1268 O LEU A 79 7.162 4.030 -1.534 1.00 1.03 O ATOM 1269 CB LEU A 79 7.283 5.667 1.307 1.00 1.36 C ATOM 1270 CG LEU A 79 7.786 7.054 1.729 1.00 1.53 C ATOM 1271 CD1 LEU A 79 6.711 7.925 2.376 1.00 2.04 C ATOM 1272 CD2 LEU A 79 8.948 6.856 2.717 1.00 2.36 C ATOM 0 H LEU A 79 4.755 6.250 1.235 1.00 0.98 H new ATOM 0 HA LEU A 79 6.743 6.359 -0.640 1.00 1.08 H new ATOM 0 HB2 LEU A 79 6.734 5.236 2.144 1.00 1.36 H new ATOM 0 HB3 LEU A 79 8.150 5.030 1.132 1.00 1.36 H new ATOM 0 HG LEU A 79 8.101 7.581 0.828 1.00 1.53 H new ATOM 0 HD11 LEU A 79 7.139 8.890 2.648 1.00 2.04 H new ATOM 0 HD12 LEU A 79 5.893 8.077 1.672 1.00 2.04 H new ATOM 0 HD13 LEU A 79 6.332 7.431 3.271 1.00 2.04 H new ATOM 0 HD21 LEU A 79 9.326 7.828 3.034 1.00 2.36 H new ATOM 0 HD22 LEU A 79 8.595 6.302 3.587 1.00 2.36 H new ATOM 0 HD23 LEU A 79 9.748 6.297 2.231 1.00 2.36 H new ATOM 1284 N ILE A 80 5.917 3.168 0.123 1.00 0.96 N ATOM 1285 CA ILE A 80 6.100 1.811 -0.406 1.00 0.97 C ATOM 1286 C ILE A 80 5.439 1.688 -1.785 1.00 0.96 C ATOM 1287 O ILE A 80 5.897 0.917 -2.623 1.00 1.03 O ATOM 1288 CB ILE A 80 5.712 0.665 0.560 1.00 0.95 C ATOM 1289 CG1 ILE A 80 4.245 0.250 0.402 1.00 1.01 C ATOM 1290 CG2 ILE A 80 5.983 1.031 2.011 1.00 0.85 C ATOM 1291 CD1 ILE A 80 3.780 -0.967 1.211 1.00 0.93 C ATOM 0 H ILE A 80 5.346 3.242 0.965 1.00 0.96 H new ATOM 0 HA ILE A 80 7.175 1.672 -0.520 1.00 0.97 H new ATOM 0 HB ILE A 80 6.342 -0.182 0.289 1.00 0.95 H new ATOM 0 HG12 ILE A 80 3.620 1.100 0.677 1.00 1.01 H new ATOM 0 HG13 ILE A 80 4.061 0.047 -0.653 1.00 1.01 H new ATOM 0 HG21 ILE A 80 5.697 0.200 2.655 1.00 0.85 H new ATOM 0 HG22 ILE A 80 7.044 1.242 2.141 1.00 0.85 H new ATOM 0 HG23 ILE A 80 5.402 1.914 2.278 1.00 0.85 H new ATOM 0 HD11 ILE A 80 2.725 -1.156 1.011 1.00 0.93 H new ATOM 0 HD12 ILE A 80 4.366 -1.840 0.924 1.00 0.93 H new ATOM 0 HD13 ILE A 80 3.918 -0.771 2.274 1.00 0.93 H new ATOM 1303 N GLY A 81 4.362 2.439 -2.021 1.00 0.92 N ATOM 1304 CA GLY A 81 3.745 2.566 -3.331 1.00 0.94 C ATOM 1305 C GLY A 81 4.760 2.999 -4.369 1.00 0.97 C ATOM 1306 O GLY A 81 4.954 2.325 -5.383 1.00 1.10 O ATOM 0 H GLY A 81 3.892 2.980 -1.295 1.00 0.92 H new ATOM 0 HA2 GLY A 81 3.304 1.613 -3.623 1.00 0.94 H new ATOM 0 HA3 GLY A 81 2.933 3.292 -3.286 1.00 0.94 H new ATOM 1310 N GLU A 82 5.427 4.119 -4.101 1.00 0.90 N ATOM 1311 CA GLU A 82 6.491 4.560 -4.970 1.00 0.96 C ATOM 1312 C GLU A 82 7.593 3.502 -5.041 1.00 0.93 C ATOM 1313 O GLU A 82 8.012 3.183 -6.145 1.00 1.02 O ATOM 1314 CB GLU A 82 6.981 5.956 -4.578 1.00 0.91 C ATOM 1315 CG GLU A 82 5.887 7.036 -4.727 1.00 1.10 C ATOM 1316 CD GLU A 82 5.235 7.122 -6.107 1.00 3.12 C ATOM 1317 OE1 GLU A 82 5.864 6.704 -7.101 1.00 4.60 O ATOM 1318 OE2 GLU A 82 4.093 7.632 -6.171 1.00 4.04 O ATOM 0 H GLU A 82 5.246 4.723 -3.299 1.00 0.90 H new ATOM 0 HA GLU A 82 6.111 4.667 -5.986 1.00 0.96 H new ATOM 0 HB2 GLU A 82 7.329 5.938 -3.545 1.00 0.91 H new ATOM 0 HB3 GLU A 82 7.837 6.224 -5.198 1.00 0.91 H new ATOM 0 HG2 GLU A 82 5.109 6.846 -3.987 1.00 1.10 H new ATOM 0 HG3 GLU A 82 6.323 8.006 -4.489 1.00 1.10 H new ATOM 1325 N LEU A 83 7.993 2.879 -3.925 1.00 0.86 N ATOM 1326 CA LEU A 83 8.976 1.803 -3.910 1.00 0.87 C ATOM 1327 C LEU A 83 8.603 0.746 -4.956 1.00 0.91 C ATOM 1328 O LEU A 83 9.393 0.468 -5.858 1.00 0.82 O ATOM 1329 CB LEU A 83 9.116 1.226 -2.488 1.00 0.89 C ATOM 1330 CG LEU A 83 10.464 0.563 -2.162 1.00 1.32 C ATOM 1331 CD1 LEU A 83 10.929 -0.382 -3.266 1.00 2.60 C ATOM 1332 CD2 LEU A 83 11.552 1.604 -1.896 1.00 1.89 C ATOM 0 H LEU A 83 7.635 3.115 -2.999 1.00 0.86 H new ATOM 0 HA LEU A 83 9.958 2.190 -4.183 1.00 0.87 H new ATOM 0 HB2 LEU A 83 8.946 2.030 -1.772 1.00 0.89 H new ATOM 0 HB3 LEU A 83 8.325 0.491 -2.335 1.00 0.89 H new ATOM 0 HG LEU A 83 10.298 -0.022 -1.257 1.00 1.32 H new ATOM 0 HD11 LEU A 83 11.885 -0.824 -2.987 1.00 2.60 H new ATOM 0 HD12 LEU A 83 10.190 -1.172 -3.404 1.00 2.60 H new ATOM 0 HD13 LEU A 83 11.044 0.174 -4.196 1.00 2.60 H new ATOM 0 HD21 LEU A 83 12.491 1.099 -1.669 1.00 1.89 H new ATOM 0 HD22 LEU A 83 11.681 2.230 -2.779 1.00 1.89 H new ATOM 0 HD23 LEU A 83 11.261 2.226 -1.050 1.00 1.89 H new ATOM 1344 N ALA A 84 7.386 0.184 -4.876 1.00 1.07 N ATOM 1345 CA ALA A 84 6.892 -0.770 -5.855 1.00 1.18 C ATOM 1346 C ALA A 84 7.105 -0.310 -7.306 1.00 1.22 C ATOM 1347 O ALA A 84 7.374 -1.154 -8.163 1.00 1.34 O ATOM 1348 CB ALA A 84 5.417 -1.080 -5.582 1.00 1.26 C ATOM 0 H ALA A 84 6.724 0.385 -4.126 1.00 1.07 H new ATOM 0 HA ALA A 84 7.479 -1.682 -5.743 1.00 1.18 H new ATOM 0 HB1 ALA A 84 5.053 -1.796 -6.319 1.00 1.26 H new ATOM 0 HB2 ALA A 84 5.313 -1.504 -4.583 1.00 1.26 H new ATOM 0 HB3 ALA A 84 4.834 -0.162 -5.649 1.00 1.26 H new ATOM 1354 N LYS A 85 6.974 0.989 -7.582 1.00 1.20 N ATOM 1355 CA LYS A 85 7.118 1.581 -8.905 1.00 1.27 C ATOM 1356 C LYS A 85 8.594 1.799 -9.282 1.00 1.10 C ATOM 1357 O LYS A 85 9.018 1.354 -10.345 1.00 1.35 O ATOM 1358 CB LYS A 85 6.236 2.838 -8.934 1.00 1.51 C ATOM 1359 CG LYS A 85 6.242 3.667 -10.224 1.00 1.59 C ATOM 1360 CD LYS A 85 7.313 4.766 -10.180 1.00 1.96 C ATOM 1361 CE LYS A 85 7.024 5.840 -11.238 1.00 2.30 C ATOM 1362 NZ LYS A 85 7.976 6.967 -11.152 1.00 2.84 N ATOM 0 H LYS A 85 6.757 1.678 -6.862 1.00 1.20 H new ATOM 0 HA LYS A 85 6.770 0.908 -9.689 1.00 1.27 H new ATOM 0 HB2 LYS A 85 5.209 2.535 -8.732 1.00 1.51 H new ATOM 0 HB3 LYS A 85 6.544 3.486 -8.114 1.00 1.51 H new ATOM 0 HG2 LYS A 85 6.424 3.014 -11.077 1.00 1.59 H new ATOM 0 HG3 LYS A 85 5.261 4.119 -10.372 1.00 1.59 H new ATOM 0 HD2 LYS A 85 7.336 5.220 -9.189 1.00 1.96 H new ATOM 0 HD3 LYS A 85 8.297 4.331 -10.354 1.00 1.96 H new ATOM 0 HE2 LYS A 85 7.077 5.395 -12.231 1.00 2.30 H new ATOM 0 HE3 LYS A 85 6.008 6.212 -11.109 1.00 2.30 H new ATOM 0 HZ1 LYS A 85 7.769 7.655 -11.904 1.00 2.84 H new ATOM 0 HZ2 LYS A 85 7.884 7.429 -10.225 1.00 2.84 H new ATOM 0 HZ3 LYS A 85 8.947 6.611 -11.266 1.00 2.84 H new ATOM 1376 N GLU A 86 9.365 2.478 -8.427 1.00 0.76 N ATOM 1377 CA GLU A 86 10.822 2.597 -8.442 1.00 0.69 C ATOM 1378 C GLU A 86 11.462 1.254 -8.810 1.00 0.70 C ATOM 1379 O GLU A 86 12.055 1.141 -9.884 1.00 0.79 O ATOM 1380 CB GLU A 86 11.270 3.073 -7.055 1.00 0.67 C ATOM 1381 CG GLU A 86 11.192 4.605 -6.941 1.00 0.89 C ATOM 1382 CD GLU A 86 11.252 5.044 -5.490 1.00 1.11 C ATOM 1383 OE1 GLU A 86 10.382 4.619 -4.702 1.00 1.98 O ATOM 1384 OE2 GLU A 86 12.196 5.763 -5.109 1.00 2.11 O ATOM 0 H GLU A 86 8.954 2.996 -7.650 1.00 0.76 H new ATOM 0 HA GLU A 86 11.142 3.318 -9.194 1.00 0.69 H new ATOM 0 HB2 GLU A 86 10.642 2.616 -6.290 1.00 0.67 H new ATOM 0 HB3 GLU A 86 12.292 2.743 -6.867 1.00 0.67 H new ATOM 0 HG2 GLU A 86 12.014 5.057 -7.496 1.00 0.89 H new ATOM 0 HG3 GLU A 86 10.267 4.961 -7.395 1.00 0.89 H new ATOM 1391 N ILE A 87 11.320 0.214 -7.976 1.00 0.70 N ATOM 1392 CA ILE A 87 11.907 -1.083 -8.299 1.00 0.77 C ATOM 1393 C ILE A 87 10.966 -1.779 -9.288 1.00 0.81 C ATOM 1394 O ILE A 87 10.153 -2.649 -8.950 1.00 1.01 O ATOM 1395 CB ILE A 87 12.283 -1.898 -7.041 1.00 0.85 C ATOM 1396 CG1 ILE A 87 13.165 -3.120 -7.362 1.00 1.22 C ATOM 1397 CG2 ILE A 87 11.092 -2.419 -6.223 1.00 1.15 C ATOM 1398 CD1 ILE A 87 14.451 -2.821 -8.135 1.00 1.53 C ATOM 0 H ILE A 87 10.813 0.248 -7.091 1.00 0.70 H new ATOM 0 HA ILE A 87 12.875 -0.966 -8.787 1.00 0.77 H new ATOM 0 HB ILE A 87 12.825 -1.163 -6.446 1.00 0.85 H new ATOM 0 HG12 ILE A 87 13.431 -3.610 -6.425 1.00 1.22 H new ATOM 0 HG13 ILE A 87 12.573 -3.832 -7.938 1.00 1.22 H new ATOM 0 HG21 ILE A 87 11.459 -2.978 -5.362 1.00 1.15 H new ATOM 0 HG22 ILE A 87 10.490 -1.577 -5.880 1.00 1.15 H new ATOM 0 HG23 ILE A 87 10.481 -3.072 -6.846 1.00 1.15 H new ATOM 0 HD11 ILE A 87 14.996 -3.749 -8.308 1.00 1.53 H new ATOM 0 HD12 ILE A 87 14.202 -2.363 -9.092 1.00 1.53 H new ATOM 0 HD13 ILE A 87 15.073 -2.138 -7.556 1.00 1.53 H new ATOM 1410 N ARG A 88 11.099 -1.354 -10.547 1.00 0.84 N ATOM 1411 CA ARG A 88 10.186 -1.683 -11.622 1.00 1.03 C ATOM 1412 C ARG A 88 10.551 -3.082 -12.100 1.00 1.23 C ATOM 1413 O ARG A 88 11.509 -3.275 -12.847 1.00 1.56 O ATOM 1414 CB ARG A 88 10.311 -0.651 -12.754 1.00 1.35 C ATOM 1415 CG ARG A 88 9.275 -0.919 -13.855 1.00 1.77 C ATOM 1416 CD ARG A 88 9.358 0.147 -14.953 1.00 1.80 C ATOM 1417 NE ARG A 88 8.408 -0.144 -16.039 1.00 2.70 N ATOM 1418 CZ ARG A 88 8.261 0.591 -17.153 1.00 3.14 C ATOM 1419 NH1 ARG A 88 8.996 1.696 -17.321 1.00 2.88 N ATOM 1420 NH2 ARG A 88 7.384 0.219 -18.092 1.00 4.46 N ATOM 0 H ARG A 88 11.869 -0.755 -10.845 1.00 0.84 H new ATOM 0 HA ARG A 88 9.149 -1.661 -11.286 1.00 1.03 H new ATOM 0 HB2 ARG A 88 10.171 0.353 -12.354 1.00 1.35 H new ATOM 0 HB3 ARG A 88 11.315 -0.688 -13.177 1.00 1.35 H new ATOM 0 HG2 ARG A 88 9.444 -1.906 -14.287 1.00 1.77 H new ATOM 0 HG3 ARG A 88 8.274 -0.926 -13.424 1.00 1.77 H new ATOM 0 HD2 ARG A 88 9.144 1.128 -14.530 1.00 1.80 H new ATOM 0 HD3 ARG A 88 10.372 0.186 -15.352 1.00 1.80 H new ATOM 0 HE ARG A 88 7.815 -0.968 -15.937 1.00 2.70 H new ATOM 0 HH11 ARG A 88 9.665 1.977 -16.604 1.00 2.88 H new ATOM 0 HH12 ARG A 88 8.887 2.257 -18.166 1.00 2.88 H new ATOM 0 HH21 ARG A 88 6.825 -0.624 -17.963 1.00 4.46 H new ATOM 0 HH22 ARG A 88 7.274 0.779 -18.937 1.00 4.46 H new ATOM 1434 N LYS A 89 9.781 -4.042 -11.598 1.00 1.38 N ATOM 1435 CA LYS A 89 9.950 -5.465 -11.820 1.00 1.65 C ATOM 1436 C LYS A 89 10.113 -5.781 -13.308 1.00 2.22 C ATOM 1437 O LYS A 89 9.453 -5.164 -14.147 1.00 3.09 O ATOM 1438 CB LYS A 89 8.743 -6.194 -11.221 1.00 2.23 C ATOM 1439 CG LYS A 89 8.540 -5.803 -9.748 1.00 1.77 C ATOM 1440 CD LYS A 89 7.224 -5.073 -9.449 1.00 2.28 C ATOM 1441 CE LYS A 89 7.141 -4.756 -7.947 1.00 2.17 C ATOM 1442 NZ LYS A 89 8.085 -3.675 -7.576 1.00 3.01 N ATOM 0 H LYS A 89 8.984 -3.833 -10.996 1.00 1.38 H new ATOM 0 HA LYS A 89 10.862 -5.807 -11.330 1.00 1.65 H new ATOM 0 HB2 LYS A 89 7.847 -5.952 -11.792 1.00 2.23 H new ATOM 0 HB3 LYS A 89 8.889 -7.271 -11.298 1.00 2.23 H new ATOM 0 HG2 LYS A 89 8.585 -6.705 -9.138 1.00 1.77 H new ATOM 0 HG3 LYS A 89 9.370 -5.168 -9.438 1.00 1.77 H new ATOM 0 HD2 LYS A 89 7.167 -4.152 -10.029 1.00 2.28 H new ATOM 0 HD3 LYS A 89 6.377 -5.691 -9.748 1.00 2.28 H new ATOM 0 HE2 LYS A 89 6.124 -4.459 -7.691 1.00 2.17 H new ATOM 0 HE3 LYS A 89 7.366 -5.653 -7.370 1.00 2.17 H new ATOM 0 HZ1 LYS A 89 8.524 -3.897 -6.660 1.00 3.01 H new ATOM 0 HZ2 LYS A 89 8.824 -3.594 -8.304 1.00 3.01 H new ATOM 0 HZ3 LYS A 89 7.570 -2.774 -7.504 1.00 3.01 H new ATOM 1456 N LYS A 90 10.994 -6.733 -13.625 1.00 2.21 N ATOM 1457 CA LYS A 90 11.313 -7.144 -14.983 1.00 2.94 C ATOM 1458 C LYS A 90 11.057 -8.641 -15.145 1.00 3.16 C ATOM 1459 O LYS A 90 10.302 -9.028 -16.034 1.00 3.69 O ATOM 1460 CB LYS A 90 12.757 -6.745 -15.329 1.00 3.78 C ATOM 1461 CG LYS A 90 13.101 -6.910 -16.819 1.00 4.54 C ATOM 1462 CD LYS A 90 12.483 -5.791 -17.679 1.00 5.33 C ATOM 1463 CE LYS A 90 12.667 -6.017 -19.189 1.00 6.29 C ATOM 1464 NZ LYS A 90 14.084 -6.012 -19.609 1.00 7.15 N ATOM 0 H LYS A 90 11.517 -7.251 -12.919 1.00 2.21 H new ATOM 0 HA LYS A 90 10.664 -6.629 -15.691 1.00 2.94 H new ATOM 0 HB2 LYS A 90 12.917 -5.706 -15.041 1.00 3.78 H new ATOM 0 HB3 LYS A 90 13.444 -7.350 -14.737 1.00 3.78 H new ATOM 0 HG2 LYS A 90 14.184 -6.908 -16.944 1.00 4.54 H new ATOM 0 HG3 LYS A 90 12.742 -7.878 -17.169 1.00 4.54 H new ATOM 0 HD2 LYS A 90 11.419 -5.716 -17.456 1.00 5.33 H new ATOM 0 HD3 LYS A 90 12.934 -4.838 -17.403 1.00 5.33 H new ATOM 0 HE2 LYS A 90 12.216 -6.970 -19.465 1.00 6.29 H new ATOM 0 HE3 LYS A 90 12.130 -5.241 -19.734 1.00 6.29 H new ATOM 0 HZ1 LYS A 90 14.142 -6.169 -20.635 1.00 7.15 H new ATOM 0 HZ2 LYS A 90 14.512 -5.094 -19.374 1.00 7.15 H new ATOM 0 HZ3 LYS A 90 14.596 -6.770 -19.113 1.00 7.15 H new ATOM 1478 N LYS A 91 11.681 -9.485 -14.318 1.00 3.38 N ATOM 1479 CA LYS A 91 11.431 -10.921 -14.332 1.00 4.02 C ATOM 1480 C LYS A 91 11.717 -11.529 -12.967 1.00 4.15 C ATOM 1481 O LYS A 91 10.849 -12.124 -12.330 1.00 4.38 O ATOM 1482 CB LYS A 91 12.364 -11.614 -15.340 1.00 4.88 C ATOM 1483 CG LYS A 91 11.835 -11.631 -16.777 1.00 5.16 C ATOM 1484 CD LYS A 91 12.653 -12.623 -17.619 1.00 6.00 C ATOM 1485 CE LYS A 91 12.418 -14.087 -17.188 1.00 6.20 C ATOM 1486 NZ LYS A 91 13.639 -14.732 -16.633 1.00 7.26 N ATOM 0 H LYS A 91 12.369 -9.190 -13.625 1.00 3.38 H new ATOM 0 HA LYS A 91 10.386 -11.067 -14.604 1.00 4.02 H new ATOM 0 HB2 LYS A 91 13.331 -11.112 -15.327 1.00 4.88 H new ATOM 0 HB3 LYS A 91 12.533 -12.641 -15.015 1.00 4.88 H new ATOM 0 HG2 LYS A 91 10.783 -11.915 -16.784 1.00 5.16 H new ATOM 0 HG3 LYS A 91 11.899 -10.633 -17.210 1.00 5.16 H new ATOM 0 HD2 LYS A 91 12.389 -12.509 -18.670 1.00 6.00 H new ATOM 0 HD3 LYS A 91 13.713 -12.385 -17.529 1.00 6.00 H new ATOM 0 HE2 LYS A 91 11.626 -14.117 -16.440 1.00 6.20 H new ATOM 0 HE3 LYS A 91 12.068 -14.661 -18.046 1.00 6.20 H new ATOM 0 HZ1 LYS A 91 13.466 -15.749 -16.504 1.00 7.26 H new ATOM 0 HZ2 LYS A 91 14.433 -14.597 -17.291 1.00 7.26 H new ATOM 0 HZ3 LYS A 91 13.873 -14.301 -15.716 1.00 7.26 H new ATOM 1500 N ASP A 92 12.971 -11.423 -12.544 1.00 4.28 N ATOM 1501 CA ASP A 92 13.515 -12.202 -11.459 1.00 4.70 C ATOM 1502 C ASP A 92 13.269 -11.389 -10.190 1.00 3.63 C ATOM 1503 O ASP A 92 14.218 -10.997 -9.509 1.00 3.84 O ATOM 1504 CB ASP A 92 15.013 -12.443 -11.712 1.00 5.93 C ATOM 1505 CG ASP A 92 15.383 -13.500 -12.758 1.00 6.87 C ATOM 1506 OD1 ASP A 92 14.672 -13.666 -13.784 1.00 6.93 O ATOM 1507 OD2 ASP A 92 16.444 -14.118 -12.500 1.00 8.01 O ATOM 0 H ASP A 92 13.644 -10.779 -12.959 1.00 4.28 H new ATOM 0 HA ASP A 92 13.049 -13.183 -11.367 1.00 4.70 H new ATOM 0 HB2 ASP A 92 15.462 -11.497 -12.014 1.00 5.93 H new ATOM 0 HB3 ASP A 92 15.474 -12.727 -10.766 1.00 5.93 H new ATOM 1512 N LEU A 93 11.999 -11.090 -9.892 1.00 2.94 N ATOM 1513 CA LEU A 93 11.729 -10.053 -8.908 1.00 2.23 C ATOM 1514 C LEU A 93 12.001 -10.597 -7.516 1.00 2.01 C ATOM 1515 O LEU A 93 13.006 -10.259 -6.902 1.00 2.05 O ATOM 1516 CB LEU A 93 10.236 -9.692 -9.031 1.00 2.51 C ATOM 1517 CG LEU A 93 9.627 -8.966 -7.814 1.00 2.17 C ATOM 1518 CD1 LEU A 93 10.331 -7.622 -7.581 1.00 3.43 C ATOM 1519 CD2 LEU A 93 8.105 -8.902 -8.005 1.00 2.65 C ATOM 0 H LEU A 93 11.177 -11.534 -10.302 1.00 2.94 H new ATOM 0 HA LEU A 93 12.360 -9.180 -9.075 1.00 2.23 H new ATOM 0 HB2 LEU A 93 10.103 -9.063 -9.911 1.00 2.51 H new ATOM 0 HB3 LEU A 93 9.672 -10.608 -9.206 1.00 2.51 H new ATOM 0 HG LEU A 93 9.795 -9.511 -6.885 1.00 2.17 H new ATOM 0 HD11 LEU A 93 9.888 -7.124 -6.718 1.00 3.43 H new ATOM 0 HD12 LEU A 93 11.391 -7.794 -7.396 1.00 3.43 H new ATOM 0 HD13 LEU A 93 10.214 -6.992 -8.463 1.00 3.43 H new ATOM 0 HD21 LEU A 93 7.653 -8.392 -7.155 1.00 2.65 H new ATOM 0 HD22 LEU A 93 7.876 -8.356 -8.920 1.00 2.65 H new ATOM 0 HD23 LEU A 93 7.704 -9.913 -8.076 1.00 2.65 H new ATOM 1531 N LYS A 94 11.177 -11.557 -7.089 1.00 2.03 N ATOM 1532 CA LYS A 94 11.253 -12.154 -5.765 1.00 1.96 C ATOM 1533 C LYS A 94 12.292 -13.279 -5.708 1.00 1.67 C ATOM 1534 O LYS A 94 12.809 -13.637 -4.654 1.00 1.84 O ATOM 1535 CB LYS A 94 9.839 -12.337 -5.183 1.00 2.48 C ATOM 1536 CG LYS A 94 9.330 -13.761 -4.980 1.00 2.04 C ATOM 1537 CD LYS A 94 7.813 -13.746 -4.750 1.00 2.49 C ATOM 1538 CE LYS A 94 7.028 -13.680 -6.070 1.00 4.11 C ATOM 1539 NZ LYS A 94 5.679 -13.110 -5.879 1.00 4.39 N ATOM 0 H LYS A 94 10.430 -11.943 -7.666 1.00 2.03 H new ATOM 0 HA LYS A 94 11.692 -11.489 -5.021 1.00 1.96 H new ATOM 0 HB2 LYS A 94 9.806 -11.829 -4.219 1.00 2.48 H new ATOM 0 HB3 LYS A 94 9.138 -11.821 -5.839 1.00 2.48 H new ATOM 0 HG2 LYS A 94 9.568 -14.369 -5.852 1.00 2.04 H new ATOM 0 HG3 LYS A 94 9.831 -14.217 -4.127 1.00 2.04 H new ATOM 0 HD2 LYS A 94 7.521 -14.641 -4.200 1.00 2.49 H new ATOM 0 HD3 LYS A 94 7.549 -12.890 -4.129 1.00 2.49 H new ATOM 0 HE2 LYS A 94 7.579 -13.076 -6.791 1.00 4.11 H new ATOM 0 HE3 LYS A 94 6.943 -14.681 -6.493 1.00 4.11 H new ATOM 0 HZ1 LYS A 94 4.995 -13.635 -6.461 1.00 4.39 H new ATOM 0 HZ2 LYS A 94 5.410 -13.183 -4.877 1.00 4.39 H new ATOM 0 HZ3 LYS A 94 5.681 -12.110 -6.165 1.00 4.39 H new ATOM 1553 N ILE A 95 12.636 -13.782 -6.901 1.00 1.56 N ATOM 1554 CA ILE A 95 13.877 -14.482 -7.207 1.00 1.81 C ATOM 1555 C ILE A 95 15.100 -13.646 -6.787 1.00 1.98 C ATOM 1556 O ILE A 95 16.191 -14.195 -6.637 1.00 2.32 O ATOM 1557 CB ILE A 95 13.873 -14.885 -8.699 1.00 1.82 C ATOM 1558 CG1 ILE A 95 12.749 -15.911 -8.949 1.00 1.79 C ATOM 1559 CG2 ILE A 95 15.226 -15.441 -9.163 1.00 2.58 C ATOM 1560 CD1 ILE A 95 12.593 -16.315 -10.418 1.00 1.87 C ATOM 0 H ILE A 95 12.023 -13.705 -7.713 1.00 1.56 H new ATOM 0 HA ILE A 95 13.949 -15.401 -6.625 1.00 1.81 H new ATOM 0 HB ILE A 95 13.691 -13.985 -9.287 1.00 1.82 H new ATOM 0 HG12 ILE A 95 12.947 -16.804 -8.356 1.00 1.79 H new ATOM 0 HG13 ILE A 95 11.806 -15.495 -8.594 1.00 1.79 H new ATOM 0 HG21 ILE A 95 15.167 -15.708 -10.218 1.00 2.58 H new ATOM 0 HG22 ILE A 95 15.998 -14.684 -9.023 1.00 2.58 H new ATOM 0 HG23 ILE A 95 15.476 -16.326 -8.578 1.00 2.58 H new ATOM 0 HD11 ILE A 95 11.783 -17.039 -10.512 1.00 1.87 H new ATOM 0 HD12 ILE A 95 12.363 -15.433 -11.015 1.00 1.87 H new ATOM 0 HD13 ILE A 95 13.522 -16.762 -10.773 1.00 1.87 H new ATOM 1572 N ARG A 96 14.927 -12.335 -6.580 1.00 1.87 N ATOM 1573 CA ARG A 96 15.851 -11.468 -5.866 1.00 2.16 C ATOM 1574 C ARG A 96 16.838 -10.802 -6.829 1.00 2.66 C ATOM 1575 O ARG A 96 18.045 -10.812 -6.584 1.00 2.66 O ATOM 1576 CB ARG A 96 16.485 -12.198 -4.653 1.00 2.37 C ATOM 1577 CG ARG A 96 16.718 -11.362 -3.382 1.00 2.90 C ATOM 1578 CD ARG A 96 17.644 -10.152 -3.561 1.00 3.88 C ATOM 1579 NE ARG A 96 18.979 -10.584 -3.996 1.00 3.86 N ATOM 1580 CZ ARG A 96 20.137 -9.940 -3.787 1.00 4.90 C ATOM 1581 NH1 ARG A 96 20.151 -8.694 -3.313 1.00 5.98 N ATOM 1582 NH2 ARG A 96 21.292 -10.561 -4.052 1.00 5.53 N ATOM 0 H ARG A 96 14.105 -11.837 -6.922 1.00 1.87 H new ATOM 0 HA ARG A 96 15.302 -10.638 -5.422 1.00 2.16 H new ATOM 0 HB2 ARG A 96 15.845 -13.041 -4.392 1.00 2.37 H new ATOM 0 HB3 ARG A 96 17.443 -12.611 -4.968 1.00 2.37 H new ATOM 0 HG2 ARG A 96 15.754 -11.011 -3.015 1.00 2.90 H new ATOM 0 HG3 ARG A 96 17.136 -12.009 -2.611 1.00 2.90 H new ATOM 0 HD2 ARG A 96 17.220 -9.468 -4.296 1.00 3.88 H new ATOM 0 HD3 ARG A 96 17.721 -9.604 -2.622 1.00 3.88 H new ATOM 0 HE ARG A 96 19.031 -11.464 -4.510 1.00 3.86 H new ATOM 0 HH11 ARG A 96 19.273 -8.218 -3.104 1.00 5.98 H new ATOM 0 HH12 ARG A 96 21.039 -8.217 -3.159 1.00 5.98 H new ATOM 0 HH21 ARG A 96 21.287 -11.516 -4.410 1.00 5.53 H new ATOM 0 HH22 ARG A 96 22.177 -10.079 -3.896 1.00 5.53 H new ATOM 1596 N LYS A 97 16.318 -10.182 -7.903 1.00 3.78 N ATOM 1597 CA LYS A 97 16.964 -9.033 -8.536 1.00 4.93 C ATOM 1598 C LYS A 97 15.933 -7.989 -9.004 1.00 7.17 C ATOM 1599 O LYS A 97 15.956 -6.855 -8.530 1.00 8.41 O ATOM 1600 CB LYS A 97 17.836 -9.415 -9.755 1.00 4.96 C ATOM 1601 CG LYS A 97 18.788 -10.617 -9.641 1.00 4.02 C ATOM 1602 CD LYS A 97 18.069 -11.923 -10.014 1.00 4.75 C ATOM 1603 CE LYS A 97 19.042 -13.091 -10.210 1.00 4.64 C ATOM 1604 NZ LYS A 97 18.340 -14.307 -10.677 1.00 5.85 N ATOM 0 H LYS A 97 15.445 -10.465 -8.349 1.00 3.78 H new ATOM 0 HA LYS A 97 17.607 -8.616 -7.761 1.00 4.93 H new ATOM 0 HB2 LYS A 97 17.165 -9.604 -10.593 1.00 4.96 H new ATOM 0 HB3 LYS A 97 18.436 -8.543 -10.017 1.00 4.96 H new ATOM 0 HG2 LYS A 97 19.646 -10.470 -10.296 1.00 4.02 H new ATOM 0 HG3 LYS A 97 19.172 -10.687 -8.623 1.00 4.02 H new ATOM 0 HD2 LYS A 97 17.354 -12.177 -9.232 1.00 4.75 H new ATOM 0 HD3 LYS A 97 17.498 -11.771 -10.930 1.00 4.75 H new ATOM 0 HE2 LYS A 97 19.808 -12.811 -10.933 1.00 4.64 H new ATOM 0 HE3 LYS A 97 19.553 -13.302 -9.271 1.00 4.64 H new ATOM 0 HZ1 LYS A 97 18.973 -14.859 -11.291 1.00 5.85 H new ATOM 0 HZ2 LYS A 97 18.062 -14.884 -9.857 1.00 5.85 H new ATOM 0 HZ3 LYS A 97 17.491 -14.034 -11.212 1.00 5.85 H new ATOM 1618 N LYS A 98 15.072 -8.347 -9.967 1.00 8.10 N ATOM 1619 CA LYS A 98 14.278 -7.421 -10.781 1.00 10.27 C ATOM 1620 C LYS A 98 13.298 -8.208 -11.660 1.00 10.89 C ATOM 1621 O LYS A 98 13.771 -8.916 -12.578 1.00 10.94 O ATOM 1622 CB LYS A 98 15.160 -6.604 -11.746 1.00 11.50 C ATOM 1623 CG LYS A 98 16.055 -5.519 -11.125 1.00 13.04 C ATOM 1624 CD LYS A 98 16.669 -4.595 -12.190 1.00 14.84 C ATOM 1625 CE LYS A 98 18.016 -5.096 -12.738 1.00 14.92 C ATOM 1626 NZ LYS A 98 17.957 -6.486 -13.234 1.00 14.23 N ATOM 1627 OXT LYS A 98 12.074 -8.027 -11.497 1.00 11.78 O ATOM 0 H LYS A 98 14.905 -9.324 -10.208 1.00 8.10 H new ATOM 0 HA LYS A 98 13.765 -6.757 -10.085 1.00 10.27 H new ATOM 0 HB2 LYS A 98 15.799 -7.299 -12.291 1.00 11.50 H new ATOM 0 HB3 LYS A 98 14.509 -6.127 -12.479 1.00 11.50 H new ATOM 0 HG2 LYS A 98 15.469 -4.924 -10.424 1.00 13.04 H new ATOM 0 HG3 LYS A 98 16.853 -5.992 -10.553 1.00 13.04 H new ATOM 0 HD2 LYS A 98 15.966 -4.490 -13.017 1.00 14.84 H new ATOM 0 HD3 LYS A 98 16.807 -3.602 -11.762 1.00 14.84 H new ATOM 0 HE2 LYS A 98 18.339 -4.441 -13.547 1.00 14.92 H new ATOM 0 HE3 LYS A 98 18.769 -5.028 -11.953 1.00 14.92 H new ATOM 0 HZ1 LYS A 98 18.806 -6.689 -13.799 1.00 14.23 H new ATOM 0 HZ2 LYS A 98 17.913 -7.141 -12.427 1.00 14.23 H new ATOM 0 HZ3 LYS A 98 17.110 -6.608 -13.826 1.00 14.23 H new TER 1641 LYS A 98 ATOM 1642 N MET B 1 5.935 -5.044 2.981 1.00 9.79 N ATOM 1643 CA MET B 1 7.231 -5.126 2.276 1.00 9.64 C ATOM 1644 C MET B 1 7.135 -6.295 1.191 1.00 9.34 C ATOM 1645 O MET B 1 6.043 -6.824 1.142 1.00 9.86 O ATOM 1646 CB MET B 1 7.570 -3.644 1.978 1.00 10.96 C ATOM 1647 CG MET B 1 8.125 -2.902 3.205 1.00 11.23 C ATOM 1648 SD MET B 1 8.098 -1.101 3.176 1.00 12.92 S ATOM 1649 CE MET B 1 8.821 -0.732 1.564 1.00 14.26 C ATOM 0 H1 MET B 1 6.057 -4.523 3.873 1.00 9.79 H new ATOM 0 H2 MET B 1 5.245 -4.548 2.382 1.00 9.79 H new ATOM 0 H3 MET B 1 5.590 -6.003 3.185 1.00 9.79 H new ATOM 0 HA MET B 1 8.135 -5.479 2.772 1.00 9.64 H new ATOM 0 HB2 MET B 1 8.300 -3.598 1.170 1.00 10.96 H new ATOM 0 HB3 MET B 1 6.673 -3.134 1.626 1.00 10.96 H new ATOM 0 HG2 MET B 1 7.563 -3.232 4.079 1.00 11.23 H new ATOM 0 HG3 MET B 1 9.157 -3.220 3.351 1.00 11.23 H new ATOM 0 HE1 MET B 1 8.780 0.342 1.384 1.00 14.26 H new ATOM 0 HE2 MET B 1 9.859 -1.064 1.546 1.00 14.26 H new ATOM 0 HE3 MET B 1 8.261 -1.251 0.786 1.00 14.26 H new ATOM 1661 N ALA B 2 8.108 -6.701 0.319 1.00 8.77 N ATOM 1662 CA ALA B 2 8.027 -7.607 -0.896 1.00 8.40 C ATOM 1663 C ALA B 2 8.766 -9.003 -0.937 1.00 7.54 C ATOM 1664 O ALA B 2 9.907 -9.160 -0.528 1.00 7.48 O ATOM 1665 CB ALA B 2 8.455 -6.805 -2.125 1.00 10.20 C ATOM 0 H ALA B 2 9.066 -6.377 0.452 1.00 8.77 H new ATOM 0 HA ALA B 2 6.983 -7.917 -0.858 1.00 8.40 H new ATOM 0 HB1 ALA B 2 8.403 -7.440 -3.010 1.00 10.20 H new ATOM 0 HB2 ALA B 2 7.790 -5.951 -2.252 1.00 10.20 H new ATOM 0 HB3 ALA B 2 9.477 -6.452 -1.991 1.00 10.20 H new ATOM 1671 N ALA B 3 8.130 -10.079 -1.439 1.00 7.05 N ATOM 1672 CA ALA B 3 8.162 -11.413 -0.823 1.00 6.71 C ATOM 1673 C ALA B 3 9.247 -12.328 -1.379 1.00 5.19 C ATOM 1674 O ALA B 3 8.964 -13.373 -1.961 1.00 5.31 O ATOM 1675 CB ALA B 3 6.788 -12.093 -0.908 1.00 7.89 C ATOM 0 H ALA B 3 7.574 -10.042 -2.293 1.00 7.05 H new ATOM 0 HA ALA B 3 8.417 -11.244 0.223 1.00 6.71 H new ATOM 0 HB1 ALA B 3 6.840 -13.078 -0.445 1.00 7.89 H new ATOM 0 HB2 ALA B 3 6.049 -11.486 -0.386 1.00 7.89 H new ATOM 0 HB3 ALA B 3 6.498 -12.199 -1.953 1.00 7.89 H new ATOM 1681 N GLU B 4 10.489 -11.954 -1.115 1.00 3.99 N ATOM 1682 CA GLU B 4 11.690 -12.763 -1.329 1.00 2.94 C ATOM 1683 C GLU B 4 11.845 -13.741 -0.146 1.00 2.62 C ATOM 1684 O GLU B 4 10.913 -13.841 0.648 1.00 3.17 O ATOM 1685 CB GLU B 4 12.902 -11.860 -1.606 1.00 2.37 C ATOM 1686 CG GLU B 4 12.473 -10.543 -2.261 1.00 2.71 C ATOM 1687 CD GLU B 4 13.630 -9.679 -2.699 1.00 3.13 C ATOM 1688 OE1 GLU B 4 14.171 -8.954 -1.834 1.00 4.01 O ATOM 1689 OE2 GLU B 4 13.897 -9.647 -3.911 1.00 3.56 O ATOM 0 H GLU B 4 10.703 -11.035 -0.727 1.00 3.99 H new ATOM 0 HA GLU B 4 11.606 -13.381 -2.223 1.00 2.94 H new ATOM 0 HB2 GLU B 4 13.425 -11.652 -0.672 1.00 2.37 H new ATOM 0 HB3 GLU B 4 13.606 -12.380 -2.256 1.00 2.37 H new ATOM 0 HG2 GLU B 4 11.848 -10.764 -3.126 1.00 2.71 H new ATOM 0 HG3 GLU B 4 11.857 -9.982 -1.558 1.00 2.71 H new ATOM 1696 N PRO B 5 12.912 -14.552 -0.014 1.00 2.94 N ATOM 1697 CA PRO B 5 13.070 -15.428 1.149 1.00 3.97 C ATOM 1698 C PRO B 5 13.437 -14.633 2.427 1.00 3.78 C ATOM 1699 O PRO B 5 14.544 -14.745 2.951 1.00 4.80 O ATOM 1700 CB PRO B 5 14.138 -16.437 0.717 1.00 5.34 C ATOM 1701 CG PRO B 5 15.035 -15.634 -0.226 1.00 4.27 C ATOM 1702 CD PRO B 5 14.106 -14.586 -0.848 1.00 3.05 C ATOM 0 HA PRO B 5 12.146 -15.934 1.430 1.00 3.97 H new ATOM 0 HB2 PRO B 5 14.696 -16.820 1.571 1.00 5.34 H new ATOM 0 HB3 PRO B 5 13.696 -17.297 0.214 1.00 5.34 H new ATOM 0 HG2 PRO B 5 15.857 -15.164 0.314 1.00 4.27 H new ATOM 0 HG3 PRO B 5 15.479 -16.273 -0.990 1.00 4.27 H new ATOM 0 HD2 PRO B 5 14.587 -13.609 -0.878 1.00 3.05 H new ATOM 0 HD3 PRO B 5 13.855 -14.849 -1.876 1.00 3.05 H new ATOM 1710 N LEU B 6 12.493 -13.811 2.900 1.00 3.10 N ATOM 1711 CA LEU B 6 12.618 -12.758 3.922 1.00 3.59 C ATOM 1712 C LEU B 6 11.378 -12.566 4.830 1.00 3.11 C ATOM 1713 O LEU B 6 10.431 -13.347 4.811 1.00 2.92 O ATOM 1714 CB LEU B 6 13.071 -11.428 3.297 1.00 3.75 C ATOM 1715 CG LEU B 6 12.451 -11.189 1.938 1.00 3.16 C ATOM 1716 CD1 LEU B 6 10.929 -11.202 2.127 1.00 3.02 C ATOM 1717 CD2 LEU B 6 13.054 -9.889 1.402 1.00 4.47 C ATOM 0 H LEU B 6 11.537 -13.868 2.548 1.00 3.10 H new ATOM 0 HA LEU B 6 13.394 -13.118 4.597 1.00 3.59 H new ATOM 0 HB2 LEU B 6 12.806 -10.607 3.964 1.00 3.75 H new ATOM 0 HB3 LEU B 6 14.157 -11.425 3.204 1.00 3.75 H new ATOM 0 HG LEU B 6 12.661 -11.952 1.188 1.00 3.16 H new ATOM 0 HD11 LEU B 6 10.442 -11.032 1.167 1.00 3.02 H new ATOM 0 HD12 LEU B 6 10.620 -12.169 2.525 1.00 3.02 H new ATOM 0 HD13 LEU B 6 10.642 -10.414 2.824 1.00 3.02 H new ATOM 0 HD21 LEU B 6 12.636 -9.672 0.419 1.00 4.47 H new ATOM 0 HD22 LEU B 6 12.820 -9.071 2.084 1.00 4.47 H new ATOM 0 HD23 LEU B 6 14.136 -9.996 1.321 1.00 4.47 H new ATOM 1729 N THR B 7 11.459 -11.515 5.652 1.00 3.39 N ATOM 1730 CA THR B 7 10.746 -11.109 6.853 1.00 3.17 C ATOM 1731 C THR B 7 9.342 -10.530 6.590 1.00 3.04 C ATOM 1732 O THR B 7 8.945 -10.314 5.443 1.00 3.17 O ATOM 1733 CB THR B 7 11.630 -9.935 7.336 1.00 2.67 C ATOM 1734 OG1 THR B 7 13.003 -10.267 7.209 1.00 2.73 O ATOM 1735 CG2 THR B 7 11.364 -9.430 8.747 1.00 2.65 C ATOM 0 H THR B 7 12.160 -10.806 5.439 1.00 3.39 H new ATOM 0 HA THR B 7 10.597 -11.952 7.527 1.00 3.17 H new ATOM 0 HB THR B 7 11.353 -9.110 6.680 1.00 2.67 H new ATOM 0 HG1 THR B 7 13.551 -9.515 7.516 1.00 2.73 H new ATOM 0 HG21 THR B 7 12.043 -8.608 8.973 1.00 2.65 H new ATOM 0 HG22 THR B 7 10.334 -9.081 8.820 1.00 2.65 H new ATOM 0 HG23 THR B 7 11.524 -10.239 9.459 1.00 2.65 H new ATOM 1743 N GLU B 8 8.596 -10.246 7.669 1.00 2.88 N ATOM 1744 CA GLU B 8 7.214 -9.787 7.624 1.00 2.79 C ATOM 1745 C GLU B 8 6.977 -8.490 6.846 1.00 2.76 C ATOM 1746 O GLU B 8 5.863 -8.322 6.349 1.00 2.86 O ATOM 1747 CB GLU B 8 6.618 -9.636 9.029 1.00 2.74 C ATOM 1748 CG GLU B 8 6.841 -10.860 9.925 1.00 3.18 C ATOM 1749 CD GLU B 8 8.019 -10.612 10.845 1.00 3.57 C ATOM 1750 OE1 GLU B 8 9.147 -10.759 10.325 1.00 4.05 O ATOM 1751 OE2 GLU B 8 7.771 -10.214 12.006 1.00 4.28 O ATOM 0 H GLU B 8 8.955 -10.334 8.620 1.00 2.88 H new ATOM 0 HA GLU B 8 6.706 -10.578 7.073 1.00 2.79 H new ATOM 0 HB2 GLU B 8 7.056 -8.761 9.508 1.00 2.74 H new ATOM 0 HB3 GLU B 8 5.548 -9.450 8.942 1.00 2.74 H new ATOM 0 HG2 GLU B 8 5.945 -11.061 10.512 1.00 3.18 H new ATOM 0 HG3 GLU B 8 7.025 -11.742 9.312 1.00 3.18 H new ATOM 1758 N LEU B 9 7.942 -7.559 6.716 1.00 2.66 N ATOM 1759 CA LEU B 9 7.734 -6.505 5.734 1.00 2.63 C ATOM 1760 C LEU B 9 7.712 -7.246 4.419 1.00 3.08 C ATOM 1761 O LEU B 9 6.636 -7.322 3.827 1.00 3.46 O ATOM 1762 CB LEU B 9 8.803 -5.428 5.927 1.00 2.55 C ATOM 1763 CG LEU B 9 8.633 -4.551 7.191 1.00 2.18 C ATOM 1764 CD1 LEU B 9 7.357 -3.702 7.179 1.00 1.92 C ATOM 1765 CD2 LEU B 9 8.733 -5.328 8.511 1.00 3.03 C ATOM 0 H LEU B 9 8.814 -7.520 7.244 1.00 2.66 H new ATOM 0 HA LEU B 9 6.809 -5.934 5.813 1.00 2.63 H new ATOM 0 HB2 LEU B 9 9.779 -5.911 5.968 1.00 2.55 H new ATOM 0 HB3 LEU B 9 8.805 -4.779 5.051 1.00 2.55 H new ATOM 0 HG LEU B 9 9.488 -3.876 7.145 1.00 2.18 H new ATOM 0 HD11 LEU B 9 7.303 -3.113 8.095 1.00 1.92 H new ATOM 0 HD12 LEU B 9 7.373 -3.034 6.318 1.00 1.92 H new ATOM 0 HD13 LEU B 9 6.486 -4.355 7.116 1.00 1.92 H new ATOM 0 HD21 LEU B 9 8.603 -4.642 9.348 1.00 3.03 H new ATOM 0 HD22 LEU B 9 7.956 -6.091 8.544 1.00 3.03 H new ATOM 0 HD23 LEU B 9 9.711 -5.803 8.580 1.00 3.03 H new ATOM 1777 N GLU B 10 8.804 -7.849 3.976 1.00 3.09 N ATOM 1778 CA GLU B 10 8.855 -8.313 2.604 1.00 3.16 C ATOM 1779 C GLU B 10 7.664 -9.216 2.203 1.00 3.07 C ATOM 1780 O GLU B 10 7.164 -9.245 1.094 1.00 3.23 O ATOM 1781 CB GLU B 10 10.209 -7.967 1.921 1.00 2.46 C ATOM 1782 CG GLU B 10 11.090 -6.992 2.684 1.00 3.77 C ATOM 1783 CD GLU B 10 10.494 -5.613 2.662 1.00 4.74 C ATOM 1784 OE1 GLU B 10 9.849 -5.305 1.645 1.00 4.47 O ATOM 1785 OE2 GLU B 10 10.629 -4.897 3.663 1.00 6.35 O ATOM 0 H GLU B 10 9.643 -8.024 4.530 1.00 3.09 H new ATOM 0 HA GLU B 10 8.580 -8.142 1.563 1.00 3.16 H new ATOM 0 HB2 GLU B 10 10.766 -8.891 1.767 1.00 2.46 H new ATOM 0 HB3 GLU B 10 10.004 -7.551 0.935 1.00 2.46 H new ATOM 0 HG2 GLU B 10 11.206 -7.328 3.715 1.00 3.77 H new ATOM 0 HG3 GLU B 10 12.086 -6.971 2.242 1.00 3.77 H new ATOM 1792 N GLU B 11 7.128 -9.928 3.194 1.00 2.90 N ATOM 1793 CA GLU B 11 5.856 -10.638 3.031 1.00 2.81 C ATOM 1794 C GLU B 11 4.773 -9.954 2.136 1.00 2.43 C ATOM 1795 O GLU B 11 4.085 -10.626 1.370 1.00 2.69 O ATOM 1796 CB GLU B 11 6.122 -12.122 2.732 1.00 2.51 C ATOM 1797 CG GLU B 11 4.993 -13.055 3.197 1.00 2.75 C ATOM 1798 CD GLU B 11 5.272 -14.505 2.817 1.00 3.11 C ATOM 1799 OE1 GLU B 11 5.541 -14.737 1.619 1.00 3.14 O ATOM 1800 OE2 GLU B 11 5.200 -15.356 3.729 1.00 4.13 O ATOM 0 H GLU B 11 7.552 -10.029 4.116 1.00 2.90 H new ATOM 0 HA GLU B 11 5.346 -10.574 3.992 1.00 2.81 H new ATOM 0 HB2 GLU B 11 6.267 -12.248 1.659 1.00 2.51 H new ATOM 0 HB3 GLU B 11 7.052 -12.421 3.216 1.00 2.51 H new ATOM 0 HG2 GLU B 11 4.878 -12.977 4.278 1.00 2.75 H new ATOM 0 HG3 GLU B 11 4.050 -12.736 2.752 1.00 2.75 H new ATOM 1807 N SER B 12 4.509 -8.646 2.304 1.00 2.02 N ATOM 1808 CA SER B 12 3.192 -8.057 2.022 1.00 2.09 C ATOM 1809 C SER B 12 2.883 -7.621 0.585 1.00 2.10 C ATOM 1810 O SER B 12 1.894 -8.039 -0.008 1.00 2.48 O ATOM 1811 CB SER B 12 2.884 -6.929 3.020 1.00 2.05 C ATOM 1812 OG SER B 12 4.020 -6.594 3.799 1.00 2.70 O ATOM 0 H SER B 12 5.199 -7.973 2.637 1.00 2.02 H new ATOM 0 HA SER B 12 2.516 -8.902 2.154 1.00 2.09 H new ATOM 0 HB2 SER B 12 2.541 -6.047 2.478 1.00 2.05 H new ATOM 0 HB3 SER B 12 2.070 -7.236 3.677 1.00 2.05 H new ATOM 0 HG SER B 12 3.789 -5.873 4.421 1.00 2.70 H new ATOM 1818 N ILE B 13 3.675 -6.683 0.068 1.00 1.70 N ATOM 1819 CA ILE B 13 3.580 -6.023 -1.224 1.00 1.70 C ATOM 1820 C ILE B 13 3.152 -7.035 -2.276 1.00 1.75 C ATOM 1821 O ILE B 13 2.252 -6.725 -3.054 1.00 1.79 O ATOM 1822 CB ILE B 13 4.942 -5.389 -1.591 1.00 1.65 C ATOM 1823 CG1 ILE B 13 5.333 -4.242 -0.647 1.00 1.57 C ATOM 1824 CG2 ILE B 13 5.000 -4.796 -3.014 1.00 1.73 C ATOM 1825 CD1 ILE B 13 6.822 -3.902 -0.777 1.00 1.58 C ATOM 0 H ILE B 13 4.475 -6.336 0.598 1.00 1.70 H new ATOM 0 HA ILE B 13 2.835 -5.228 -1.179 1.00 1.70 H new ATOM 0 HB ILE B 13 5.629 -6.231 -1.509 1.00 1.65 H new ATOM 0 HG12 ILE B 13 4.734 -3.360 -0.874 1.00 1.57 H new ATOM 0 HG13 ILE B 13 5.110 -4.522 0.382 1.00 1.57 H new ATOM 0 HG21 ILE B 13 5.988 -4.372 -3.191 1.00 1.73 H new ATOM 0 HG22 ILE B 13 4.806 -5.582 -3.744 1.00 1.73 H new ATOM 0 HG23 ILE B 13 4.247 -4.015 -3.114 1.00 1.73 H new ATOM 0 HD11 ILE B 13 7.070 -3.087 -0.097 1.00 1.58 H new ATOM 0 HD12 ILE B 13 7.419 -4.779 -0.525 1.00 1.58 H new ATOM 0 HD13 ILE B 13 7.038 -3.598 -1.801 1.00 1.58 H new ATOM 1837 N GLU B 14 3.736 -8.244 -2.284 1.00 1.82 N ATOM 1838 CA GLU B 14 3.414 -9.205 -3.353 1.00 1.82 C ATOM 1839 C GLU B 14 1.926 -9.569 -3.453 1.00 1.80 C ATOM 1840 O GLU B 14 1.462 -10.072 -4.476 1.00 2.06 O ATOM 1841 CB GLU B 14 4.277 -10.452 -3.242 1.00 2.06 C ATOM 1842 CG GLU B 14 5.717 -10.018 -3.493 1.00 1.45 C ATOM 1843 CD GLU B 14 5.982 -9.598 -4.931 1.00 2.68 C ATOM 1844 OE1 GLU B 14 5.865 -10.501 -5.789 1.00 3.19 O ATOM 1845 OE2 GLU B 14 6.288 -8.406 -5.141 1.00 4.12 O ATOM 0 H GLU B 14 4.409 -8.572 -1.591 1.00 1.82 H new ATOM 0 HA GLU B 14 3.647 -8.690 -4.285 1.00 1.82 H new ATOM 0 HB2 GLU B 14 4.176 -10.905 -2.255 1.00 2.06 H new ATOM 0 HB3 GLU B 14 3.967 -11.202 -3.970 1.00 2.06 H new ATOM 0 HG2 GLU B 14 5.959 -9.187 -2.830 1.00 1.45 H new ATOM 0 HG3 GLU B 14 6.386 -10.838 -3.233 1.00 1.45 H new ATOM 1852 N THR B 15 1.180 -9.309 -2.391 1.00 1.59 N ATOM 1853 CA THR B 15 -0.258 -9.521 -2.330 1.00 1.58 C ATOM 1854 C THR B 15 -0.993 -8.470 -3.164 1.00 1.47 C ATOM 1855 O THR B 15 -1.835 -8.825 -3.989 1.00 1.56 O ATOM 1856 CB THR B 15 -0.739 -9.534 -0.877 1.00 1.55 C ATOM 1857 OG1 THR B 15 -0.008 -10.499 -0.150 1.00 1.66 O ATOM 1858 CG2 THR B 15 -2.232 -9.870 -0.812 1.00 1.65 C ATOM 0 H THR B 15 1.568 -8.935 -1.525 1.00 1.59 H new ATOM 0 HA THR B 15 -0.487 -10.497 -2.759 1.00 1.58 H new ATOM 0 HB THR B 15 -0.581 -8.546 -0.444 1.00 1.55 H new ATOM 0 HG1 THR B 15 0.836 -10.107 0.157 1.00 1.66 H new ATOM 0 HG21 THR B 15 -2.559 -9.875 0.228 1.00 1.65 H new ATOM 0 HG22 THR B 15 -2.798 -9.121 -1.366 1.00 1.65 H new ATOM 0 HG23 THR B 15 -2.403 -10.853 -1.251 1.00 1.65 H new ATOM 1866 N VAL B 16 -0.654 -7.183 -3.014 1.00 1.30 N ATOM 1867 CA VAL B 16 -1.176 -6.163 -3.916 1.00 1.10 C ATOM 1868 C VAL B 16 -0.657 -6.547 -5.303 1.00 1.17 C ATOM 1869 O VAL B 16 -1.353 -6.523 -6.319 1.00 0.93 O ATOM 1870 CB VAL B 16 -0.640 -4.781 -3.506 1.00 0.95 C ATOM 1871 CG1 VAL B 16 -0.990 -3.785 -4.604 1.00 0.88 C ATOM 1872 CG2 VAL B 16 -1.178 -4.292 -2.160 1.00 1.00 C ATOM 0 H VAL B 16 -0.030 -6.833 -2.287 1.00 1.30 H new ATOM 0 HA VAL B 16 -2.264 -6.109 -3.894 1.00 1.10 H new ATOM 0 HB VAL B 16 0.439 -4.868 -3.381 1.00 0.95 H new ATOM 0 HG11 VAL B 16 -0.618 -2.797 -4.332 1.00 0.88 H new ATOM 0 HG12 VAL B 16 -0.531 -4.100 -5.541 1.00 0.88 H new ATOM 0 HG13 VAL B 16 -2.072 -3.744 -4.726 1.00 0.88 H new ATOM 0 HG21 VAL B 16 -0.758 -3.312 -1.935 1.00 1.00 H new ATOM 0 HG22 VAL B 16 -2.265 -4.219 -2.207 1.00 1.00 H new ATOM 0 HG23 VAL B 16 -0.895 -4.996 -1.378 1.00 1.00 H new ATOM 1882 N VAL B 17 0.606 -6.951 -5.249 1.00 1.71 N ATOM 1883 CA VAL B 17 1.487 -7.387 -6.286 1.00 2.18 C ATOM 1884 C VAL B 17 0.726 -8.204 -7.340 1.00 1.61 C ATOM 1885 O VAL B 17 0.596 -7.842 -8.508 1.00 1.40 O ATOM 1886 CB VAL B 17 2.479 -6.244 -6.558 1.00 1.69 C ATOM 1887 CG1 VAL B 17 3.910 -6.691 -6.265 1.00 1.20 C ATOM 1888 CG2 VAL B 17 2.301 -5.518 -7.867 1.00 1.88 C ATOM 0 H VAL B 17 1.084 -6.978 -4.348 1.00 1.71 H new ATOM 0 HA VAL B 17 2.204 -8.180 -6.075 1.00 2.18 H new ATOM 0 HB VAL B 17 2.232 -5.455 -5.847 1.00 1.69 H new ATOM 0 HG11 VAL B 17 4.596 -5.868 -6.464 1.00 1.20 H new ATOM 0 HG12 VAL B 17 3.992 -6.987 -5.219 1.00 1.20 H new ATOM 0 HG13 VAL B 17 4.165 -7.538 -6.903 1.00 1.20 H new ATOM 0 HG21 VAL B 17 3.053 -4.734 -7.953 1.00 1.88 H new ATOM 0 HG22 VAL B 17 2.414 -6.222 -8.692 1.00 1.88 H new ATOM 0 HG23 VAL B 17 1.307 -5.073 -7.904 1.00 1.88 H new ATOM 1898 N THR B 18 0.169 -9.317 -6.843 1.00 1.66 N ATOM 1899 CA THR B 18 -0.652 -10.269 -7.574 1.00 1.54 C ATOM 1900 C THR B 18 -2.103 -9.803 -7.714 1.00 1.37 C ATOM 1901 O THR B 18 -2.719 -10.095 -8.738 1.00 1.40 O ATOM 1902 CB THR B 18 -0.555 -11.664 -6.931 1.00 1.88 C ATOM 1903 OG1 THR B 18 -1.024 -12.647 -7.830 1.00 2.93 O ATOM 1904 CG2 THR B 18 -1.332 -11.775 -5.615 1.00 1.85 C ATOM 0 H THR B 18 0.291 -9.584 -5.866 1.00 1.66 H new ATOM 0 HA THR B 18 -0.260 -10.334 -8.589 1.00 1.54 H new ATOM 0 HB THR B 18 0.499 -11.825 -6.703 1.00 1.88 H new ATOM 0 HG1 THR B 18 -0.957 -13.531 -7.412 1.00 2.93 H new ATOM 0 HG21 THR B 18 -1.224 -12.782 -5.212 1.00 1.85 H new ATOM 0 HG22 THR B 18 -0.939 -11.054 -4.899 1.00 1.85 H new ATOM 0 HG23 THR B 18 -2.387 -11.568 -5.797 1.00 1.85 H new ATOM 1912 N THR B 19 -2.675 -9.110 -6.721 1.00 1.25 N ATOM 1913 CA THR B 19 -4.033 -8.578 -6.841 1.00 1.12 C ATOM 1914 C THR B 19 -4.208 -7.817 -8.163 1.00 0.89 C ATOM 1915 O THR B 19 -5.180 -8.043 -8.880 1.00 0.93 O ATOM 1916 CB THR B 19 -4.387 -7.722 -5.620 1.00 1.11 C ATOM 1917 OG1 THR B 19 -4.488 -8.537 -4.473 1.00 1.47 O ATOM 1918 CG2 THR B 19 -5.719 -6.991 -5.784 1.00 1.25 C ATOM 0 H THR B 19 -2.219 -8.907 -5.831 1.00 1.25 H new ATOM 0 HA THR B 19 -4.736 -9.411 -6.862 1.00 1.12 H new ATOM 0 HB THR B 19 -3.590 -6.986 -5.518 1.00 1.11 H new ATOM 0 HG1 THR B 19 -3.599 -8.870 -4.229 1.00 1.47 H new ATOM 0 HG21 THR B 19 -5.922 -6.400 -4.891 1.00 1.25 H new ATOM 0 HG22 THR B 19 -5.669 -6.333 -6.651 1.00 1.25 H new ATOM 0 HG23 THR B 19 -6.518 -7.718 -5.926 1.00 1.25 H new ATOM 1926 N PHE B 20 -3.249 -6.958 -8.528 1.00 0.82 N ATOM 1927 CA PHE B 20 -3.289 -6.283 -9.827 1.00 0.82 C ATOM 1928 C PHE B 20 -3.350 -7.261 -11.005 1.00 0.92 C ATOM 1929 O PHE B 20 -3.910 -6.923 -12.046 1.00 1.09 O ATOM 1930 CB PHE B 20 -2.088 -5.351 -10.004 1.00 0.97 C ATOM 1931 CG PHE B 20 -2.211 -4.035 -9.269 1.00 0.85 C ATOM 1932 CD1 PHE B 20 -3.091 -3.045 -9.747 1.00 1.21 C ATOM 1933 CD2 PHE B 20 -1.384 -3.760 -8.168 1.00 2.05 C ATOM 1934 CE1 PHE B 20 -3.143 -1.789 -9.121 1.00 1.27 C ATOM 1935 CE2 PHE B 20 -1.380 -2.480 -7.594 1.00 1.99 C ATOM 1936 CZ PHE B 20 -2.278 -1.509 -8.050 1.00 0.86 C ATOM 0 H PHE B 20 -2.445 -6.717 -7.948 1.00 0.82 H new ATOM 0 HA PHE B 20 -4.209 -5.699 -9.830 1.00 0.82 H new ATOM 0 HB2 PHE B 20 -1.190 -5.864 -9.659 1.00 0.97 H new ATOM 0 HB3 PHE B 20 -1.952 -5.150 -11.067 1.00 0.97 H new ATOM 0 HD1 PHE B 20 -3.726 -3.252 -10.596 1.00 1.21 H new ATOM 0 HD2 PHE B 20 -0.750 -4.535 -7.763 1.00 2.05 H new ATOM 0 HE1 PHE B 20 -3.845 -1.042 -9.461 1.00 1.27 H new ATOM 0 HE2 PHE B 20 -0.685 -2.245 -6.802 1.00 1.99 H new ATOM 0 HZ PHE B 20 -2.306 -0.539 -7.576 1.00 0.86 H new ATOM 1946 N PHE B 21 -2.746 -8.446 -10.876 1.00 0.98 N ATOM 1947 CA PHE B 21 -2.837 -9.474 -11.899 1.00 1.10 C ATOM 1948 C PHE B 21 -4.252 -10.048 -11.932 1.00 1.12 C ATOM 1949 O PHE B 21 -4.880 -10.088 -12.987 1.00 1.30 O ATOM 1950 CB PHE B 21 -1.777 -10.565 -11.705 1.00 1.28 C ATOM 1951 CG PHE B 21 -1.612 -11.450 -12.927 1.00 1.83 C ATOM 1952 CD1 PHE B 21 -2.507 -12.512 -13.154 1.00 3.57 C ATOM 1953 CD2 PHE B 21 -0.628 -11.149 -13.889 1.00 2.23 C ATOM 1954 CE1 PHE B 21 -2.424 -13.265 -14.338 1.00 4.30 C ATOM 1955 CE2 PHE B 21 -0.538 -11.912 -15.068 1.00 2.98 C ATOM 1956 CZ PHE B 21 -1.435 -12.970 -15.292 1.00 3.61 C ATOM 0 H PHE B 21 -2.187 -8.711 -10.065 1.00 0.98 H new ATOM 0 HA PHE B 21 -2.630 -9.019 -12.868 1.00 1.10 H new ATOM 0 HB2 PHE B 21 -0.821 -10.098 -11.469 1.00 1.28 H new ATOM 0 HB3 PHE B 21 -2.050 -11.182 -10.849 1.00 1.28 H new ATOM 0 HD1 PHE B 21 -3.260 -12.749 -12.417 1.00 3.57 H new ATOM 0 HD2 PHE B 21 0.058 -10.332 -13.722 1.00 2.23 H new ATOM 0 HE1 PHE B 21 -3.121 -14.071 -14.515 1.00 4.30 H new ATOM 0 HE2 PHE B 21 0.221 -11.684 -15.801 1.00 2.98 H new ATOM 0 HZ PHE B 21 -1.365 -13.556 -16.196 1.00 3.61 H new ATOM 1966 N THR B 22 -4.790 -10.459 -10.781 1.00 1.21 N ATOM 1967 CA THR B 22 -6.140 -11.015 -10.739 1.00 1.53 C ATOM 1968 C THR B 22 -7.174 -9.883 -10.670 1.00 1.59 C ATOM 1969 O THR B 22 -8.005 -9.843 -9.764 1.00 1.99 O ATOM 1970 CB THR B 22 -6.280 -12.068 -9.619 1.00 2.07 C ATOM 1971 OG1 THR B 22 -7.610 -12.539 -9.584 1.00 3.86 O ATOM 1972 CG2 THR B 22 -5.895 -11.580 -8.219 1.00 2.62 C ATOM 0 H THR B 22 -4.317 -10.417 -9.878 1.00 1.21 H new ATOM 0 HA THR B 22 -6.339 -11.558 -11.663 1.00 1.53 H new ATOM 0 HB THR B 22 -5.571 -12.856 -9.871 1.00 2.07 H new ATOM 0 HG1 THR B 22 -8.225 -11.778 -9.535 1.00 3.86 H new ATOM 0 HG21 THR B 22 -6.027 -12.390 -7.502 1.00 2.62 H new ATOM 0 HG22 THR B 22 -4.853 -11.261 -8.219 1.00 2.62 H new ATOM 0 HG23 THR B 22 -6.531 -10.740 -7.939 1.00 2.62 H new ATOM 1980 N PHE B 23 -7.172 -9.003 -11.678 1.00 1.73 N ATOM 1981 CA PHE B 23 -8.112 -7.890 -11.748 1.00 2.21 C ATOM 1982 C PHE B 23 -9.432 -8.378 -12.356 1.00 2.46 C ATOM 1983 O PHE B 23 -10.484 -8.226 -11.742 1.00 3.17 O ATOM 1984 CB PHE B 23 -7.504 -6.680 -12.485 1.00 2.63 C ATOM 1985 CG PHE B 23 -7.349 -6.826 -13.988 1.00 3.66 C ATOM 1986 CD1 PHE B 23 -6.325 -7.635 -14.508 1.00 4.72 C ATOM 1987 CD2 PHE B 23 -8.343 -6.326 -14.852 1.00 4.55 C ATOM 1988 CE1 PHE B 23 -6.409 -8.112 -15.826 1.00 6.37 C ATOM 1989 CE2 PHE B 23 -8.359 -6.711 -16.204 1.00 5.98 C ATOM 1990 CZ PHE B 23 -7.413 -7.632 -16.683 1.00 6.85 C ATOM 0 H PHE B 23 -6.521 -9.046 -12.462 1.00 1.73 H new ATOM 0 HA PHE B 23 -8.328 -7.529 -10.742 1.00 2.21 H new ATOM 0 HB2 PHE B 23 -8.128 -5.808 -12.287 1.00 2.63 H new ATOM 0 HB3 PHE B 23 -6.523 -6.474 -12.057 1.00 2.63 H new ATOM 0 HD1 PHE B 23 -5.474 -7.890 -13.894 1.00 4.72 H new ATOM 0 HD2 PHE B 23 -9.093 -5.646 -14.475 1.00 4.55 H new ATOM 0 HE1 PHE B 23 -5.702 -8.847 -16.181 1.00 6.37 H new ATOM 0 HE2 PHE B 23 -9.099 -6.299 -16.874 1.00 5.98 H new ATOM 0 HZ PHE B 23 -7.457 -7.970 -17.708 1.00 6.85 H new ATOM 2000 N ALA B 24 -9.378 -8.989 -13.545 1.00 2.82 N ATOM 2001 CA ALA B 24 -10.526 -9.579 -14.218 1.00 3.24 C ATOM 2002 C ALA B 24 -10.031 -10.432 -15.387 1.00 3.33 C ATOM 2003 O ALA B 24 -9.448 -9.896 -16.324 1.00 3.95 O ATOM 2004 CB ALA B 24 -11.479 -8.489 -14.723 1.00 4.11 C ATOM 0 H ALA B 24 -8.511 -9.086 -14.073 1.00 2.82 H new ATOM 0 HA ALA B 24 -11.074 -10.203 -13.512 1.00 3.24 H new ATOM 0 HB1 ALA B 24 -12.330 -8.952 -15.223 1.00 4.11 H new ATOM 0 HB2 ALA B 24 -11.833 -7.896 -13.880 1.00 4.11 H new ATOM 0 HB3 ALA B 24 -10.953 -7.843 -15.426 1.00 4.11 H new ATOM 2010 N ARG B 25 -10.295 -11.743 -15.335 1.00 3.38 N ATOM 2011 CA ARG B 25 -9.884 -12.742 -16.319 1.00 3.89 C ATOM 2012 C ARG B 25 -8.381 -13.032 -16.243 1.00 3.75 C ATOM 2013 O ARG B 25 -7.574 -12.157 -15.939 1.00 3.91 O ATOM 2014 CB ARG B 25 -10.213 -12.341 -17.764 1.00 4.91 C ATOM 2015 CG ARG B 25 -11.622 -11.792 -18.036 1.00 5.61 C ATOM 2016 CD ARG B 25 -11.584 -11.357 -19.503 1.00 6.82 C ATOM 2017 NE ARG B 25 -12.833 -10.777 -20.002 1.00 7.41 N ATOM 2018 CZ ARG B 25 -12.949 -10.296 -21.254 1.00 8.27 C ATOM 2019 NH1 ARG B 25 -11.896 -10.272 -22.080 1.00 8.72 N ATOM 2020 NH2 ARG B 25 -14.132 -9.834 -21.677 1.00 9.10 N ATOM 0 H ARG B 25 -10.827 -12.152 -14.567 1.00 3.38 H new ATOM 0 HA ARG B 25 -10.456 -13.633 -16.062 1.00 3.89 H new ATOM 0 HB2 ARG B 25 -9.490 -11.588 -18.079 1.00 4.91 H new ATOM 0 HB3 ARG B 25 -10.062 -13.213 -18.400 1.00 4.91 H new ATOM 0 HG2 ARG B 25 -12.384 -12.552 -17.867 1.00 5.61 H new ATOM 0 HG3 ARG B 25 -11.856 -10.954 -17.379 1.00 5.61 H new ATOM 0 HD2 ARG B 25 -10.784 -10.628 -19.631 1.00 6.82 H new ATOM 0 HD3 ARG B 25 -11.329 -12.221 -20.117 1.00 6.82 H new ATOM 0 HE ARG B 25 -13.641 -10.736 -19.381 1.00 7.41 H new ATOM 0 HH11 ARG B 25 -10.991 -10.621 -21.763 1.00 8.72 H new ATOM 0 HH12 ARG B 25 -11.998 -9.905 -23.026 1.00 8.72 H new ATOM 0 HH21 ARG B 25 -14.938 -9.848 -21.052 1.00 9.10 H new ATOM 0 HH22 ARG B 25 -14.227 -9.468 -22.624 1.00 9.10 H new ATOM 2034 N GLN B 26 -7.986 -14.253 -16.610 1.00 4.46 N ATOM 2035 CA GLN B 26 -6.581 -14.612 -16.742 1.00 5.00 C ATOM 2036 C GLN B 26 -6.064 -14.206 -18.131 1.00 4.65 C ATOM 2037 O GLN B 26 -5.567 -15.049 -18.882 1.00 5.42 O ATOM 2038 CB GLN B 26 -6.417 -16.116 -16.478 1.00 6.66 C ATOM 2039 CG GLN B 26 -7.348 -16.979 -17.348 1.00 7.59 C ATOM 2040 CD GLN B 26 -6.660 -18.266 -17.777 1.00 9.17 C ATOM 2041 OE1 GLN B 26 -7.022 -19.355 -17.346 1.00 10.35 O ATOM 2042 NE2 GLN B 26 -5.655 -18.136 -18.638 1.00 9.58 N ATOM 0 H GLN B 26 -8.631 -15.014 -16.822 1.00 4.46 H new ATOM 0 HA GLN B 26 -5.983 -14.075 -16.006 1.00 5.00 H new ATOM 0 HB2 GLN B 26 -5.382 -16.403 -16.666 1.00 6.66 H new ATOM 0 HB3 GLN B 26 -6.618 -16.320 -15.426 1.00 6.66 H new ATOM 0 HG2 GLN B 26 -8.255 -17.216 -16.791 1.00 7.59 H new ATOM 0 HG3 GLN B 26 -7.653 -16.415 -18.229 1.00 7.59 H new ATOM 0 HE21 GLN B 26 -5.386 -17.210 -18.972 1.00 9.58 H new ATOM 0 HE22 GLN B 26 -5.153 -18.962 -18.965 1.00 9.58 H new ATOM 2051 N GLU B 27 -6.165 -12.910 -18.445 1.00 3.98 N ATOM 2052 CA GLU B 27 -5.749 -12.319 -19.715 1.00 3.94 C ATOM 2053 C GLU B 27 -4.590 -11.355 -19.452 1.00 3.31 C ATOM 2054 O GLU B 27 -4.684 -10.158 -19.721 1.00 3.33 O ATOM 2055 CB GLU B 27 -6.944 -11.627 -20.391 1.00 4.56 C ATOM 2056 CG GLU B 27 -7.970 -12.654 -20.895 1.00 5.96 C ATOM 2057 CD GLU B 27 -9.167 -12.016 -21.591 1.00 6.95 C ATOM 2058 OE1 GLU B 27 -9.327 -10.778 -21.518 1.00 7.25 O ATOM 2059 OE2 GLU B 27 -9.994 -12.772 -22.136 1.00 7.88 O ATOM 0 H GLU B 27 -6.552 -12.223 -17.798 1.00 3.98 H new ATOM 0 HA GLU B 27 -5.401 -13.091 -20.402 1.00 3.94 H new ATOM 0 HB2 GLU B 27 -7.422 -10.949 -19.684 1.00 4.56 H new ATOM 0 HB3 GLU B 27 -6.592 -11.021 -21.226 1.00 4.56 H new ATOM 0 HG2 GLU B 27 -7.479 -13.339 -21.586 1.00 5.96 H new ATOM 0 HG3 GLU B 27 -8.323 -13.249 -20.053 1.00 5.96 H new ATOM 2066 N GLY B 28 -3.489 -11.887 -18.914 1.00 3.48 N ATOM 2067 CA GLY B 28 -2.363 -11.073 -18.484 1.00 3.40 C ATOM 2068 C GLY B 28 -2.832 -10.034 -17.466 1.00 3.14 C ATOM 2069 O GLY B 28 -3.710 -10.320 -16.655 1.00 3.82 O ATOM 0 H GLY B 28 -3.359 -12.888 -18.768 1.00 3.48 H new ATOM 0 HA2 GLY B 28 -1.593 -11.706 -18.043 1.00 3.40 H new ATOM 0 HA3 GLY B 28 -1.913 -10.576 -19.343 1.00 3.40 H new ATOM 2073 N ARG B 29 -2.273 -8.821 -17.518 1.00 2.37 N ATOM 2074 CA ARG B 29 -2.785 -7.674 -16.786 1.00 2.13 C ATOM 2075 C ARG B 29 -2.326 -6.416 -17.514 1.00 1.92 C ATOM 2076 O ARG B 29 -1.288 -6.452 -18.174 1.00 1.95 O ATOM 2077 CB ARG B 29 -2.334 -7.733 -15.317 1.00 2.06 C ATOM 2078 CG ARG B 29 -0.883 -7.276 -15.087 1.00 2.10 C ATOM 2079 CD ARG B 29 -0.819 -5.803 -14.649 1.00 2.81 C ATOM 2080 NE ARG B 29 0.342 -5.089 -15.208 1.00 3.68 N ATOM 2081 CZ ARG B 29 1.591 -5.117 -14.729 1.00 4.43 C ATOM 2082 NH1 ARG B 29 1.947 -6.075 -13.867 1.00 4.73 N ATOM 2083 NH2 ARG B 29 2.467 -4.183 -15.105 1.00 5.55 N ATOM 0 H ARG B 29 -1.445 -8.613 -18.076 1.00 2.37 H new ATOM 0 HA ARG B 29 -3.875 -7.672 -16.756 1.00 2.13 H new ATOM 0 HB2 ARG B 29 -2.999 -7.110 -14.719 1.00 2.06 H new ATOM 0 HB3 ARG B 29 -2.443 -8.755 -14.955 1.00 2.06 H new ATOM 0 HG2 ARG B 29 -0.419 -7.903 -14.326 1.00 2.10 H new ATOM 0 HG3 ARG B 29 -0.309 -7.409 -16.004 1.00 2.10 H new ATOM 0 HD2 ARG B 29 -1.734 -5.297 -14.958 1.00 2.81 H new ATOM 0 HD3 ARG B 29 -0.780 -5.754 -13.561 1.00 2.81 H new ATOM 0 HE ARG B 29 0.178 -4.520 -16.038 1.00 3.68 H new ATOM 0 HH11 ARG B 29 1.268 -6.779 -13.578 1.00 4.73 H new ATOM 0 HH12 ARG B 29 2.898 -6.102 -13.498 1.00 4.73 H new ATOM 0 HH21 ARG B 29 2.184 -3.450 -15.756 1.00 5.55 H new ATOM 0 HH22 ARG B 29 3.420 -4.202 -14.742 1.00 5.55 H new ATOM 2097 N LYS B 30 -3.084 -5.320 -17.410 1.00 1.94 N ATOM 2098 CA LYS B 30 -2.689 -4.055 -18.014 1.00 1.94 C ATOM 2099 C LYS B 30 -1.662 -3.390 -17.092 1.00 1.77 C ATOM 2100 O LYS B 30 -0.462 -3.515 -17.317 1.00 2.39 O ATOM 2101 CB LYS B 30 -3.940 -3.213 -18.321 1.00 2.29 C ATOM 2102 CG LYS B 30 -3.712 -2.110 -19.366 1.00 2.33 C ATOM 2103 CD LYS B 30 -2.926 -0.907 -18.820 1.00 3.06 C ATOM 2104 CE LYS B 30 -2.754 0.215 -19.854 1.00 3.41 C ATOM 2105 NZ LYS B 30 -4.046 0.673 -20.400 1.00 3.70 N ATOM 0 H LYS B 30 -3.974 -5.289 -16.912 1.00 1.94 H new ATOM 0 HA LYS B 30 -2.200 -4.188 -18.979 1.00 1.94 H new ATOM 0 HB2 LYS B 30 -4.732 -3.874 -18.673 1.00 2.29 H new ATOM 0 HB3 LYS B 30 -4.293 -2.756 -17.397 1.00 2.29 H new ATOM 0 HG2 LYS B 30 -3.175 -2.530 -20.216 1.00 2.33 H new ATOM 0 HG3 LYS B 30 -4.677 -1.766 -19.737 1.00 2.33 H new ATOM 0 HD2 LYS B 30 -3.440 -0.511 -17.944 1.00 3.06 H new ATOM 0 HD3 LYS B 30 -1.943 -1.242 -18.488 1.00 3.06 H new ATOM 0 HE2 LYS B 30 -2.238 1.057 -19.392 1.00 3.41 H new ATOM 0 HE3 LYS B 30 -2.122 -0.138 -20.669 1.00 3.41 H new ATOM 0 HZ1 LYS B 30 -4.026 1.706 -20.518 1.00 3.70 H new ATOM 0 HZ2 LYS B 30 -4.212 0.222 -21.322 1.00 3.70 H new ATOM 0 HZ3 LYS B 30 -4.811 0.414 -19.745 1.00 3.70 H new ATOM 2119 N ASP B 31 -2.124 -2.747 -16.016 1.00 1.48 N ATOM 2120 CA ASP B 31 -1.302 -2.084 -15.001 1.00 1.28 C ATOM 2121 C ASP B 31 -2.177 -1.801 -13.786 1.00 1.04 C ATOM 2122 O ASP B 31 -1.882 -2.241 -12.677 1.00 1.29 O ATOM 2123 CB ASP B 31 -0.675 -0.776 -15.522 1.00 1.52 C ATOM 2124 CG ASP B 31 0.685 -0.952 -16.193 1.00 2.34 C ATOM 2125 OD1 ASP B 31 1.445 -1.854 -15.776 1.00 3.14 O ATOM 2126 OD2 ASP B 31 0.995 -0.102 -17.056 1.00 3.11 O ATOM 0 H ASP B 31 -3.122 -2.671 -15.821 1.00 1.48 H new ATOM 0 HA ASP B 31 -0.476 -2.744 -14.736 1.00 1.28 H new ATOM 0 HB2 ASP B 31 -1.361 -0.317 -16.234 1.00 1.52 H new ATOM 0 HB3 ASP B 31 -0.568 -0.081 -14.689 1.00 1.52 H new ATOM 2131 N SER B 32 -3.252 -1.045 -14.003 1.00 1.00 N ATOM 2132 CA SER B 32 -4.227 -0.665 -12.993 1.00 0.88 C ATOM 2133 C SER B 32 -5.548 -0.370 -13.715 1.00 0.88 C ATOM 2134 O SER B 32 -5.729 -0.833 -14.840 1.00 0.98 O ATOM 2135 CB SER B 32 -3.681 0.521 -12.187 1.00 1.08 C ATOM 2136 OG SER B 32 -2.445 0.200 -11.576 1.00 2.73 O ATOM 0 H SER B 32 -3.472 -0.668 -14.925 1.00 1.00 H new ATOM 0 HA SER B 32 -4.413 -1.460 -12.271 1.00 0.88 H new ATOM 0 HB2 SER B 32 -3.552 1.382 -12.843 1.00 1.08 H new ATOM 0 HB3 SER B 32 -4.403 0.808 -11.423 1.00 1.08 H new ATOM 0 HG SER B 32 -2.601 -0.404 -10.820 1.00 2.73 H new ATOM 2142 N LEU B 33 -6.467 0.354 -13.070 1.00 0.90 N ATOM 2143 CA LEU B 33 -7.856 0.483 -13.490 1.00 0.89 C ATOM 2144 C LEU B 33 -8.127 1.886 -14.036 1.00 0.81 C ATOM 2145 O LEU B 33 -7.241 2.743 -14.033 1.00 0.87 O ATOM 2146 CB LEU B 33 -8.746 0.215 -12.262 1.00 1.08 C ATOM 2147 CG LEU B 33 -8.464 -1.122 -11.552 1.00 1.29 C ATOM 2148 CD1 LEU B 33 -9.184 -1.203 -10.204 1.00 3.35 C ATOM 2149 CD2 LEU B 33 -8.963 -2.273 -12.416 1.00 1.84 C ATOM 0 H LEU B 33 -6.255 0.878 -12.221 1.00 0.90 H new ATOM 0 HA LEU B 33 -8.072 -0.231 -14.285 1.00 0.89 H new ATOM 0 HB2 LEU B 33 -8.612 1.027 -11.547 1.00 1.08 H new ATOM 0 HB3 LEU B 33 -9.790 0.234 -12.574 1.00 1.08 H new ATOM 0 HG LEU B 33 -7.388 -1.187 -11.390 1.00 1.29 H new ATOM 0 HD11 LEU B 33 -8.963 -2.159 -9.730 1.00 3.35 H new ATOM 0 HD12 LEU B 33 -8.843 -0.392 -9.560 1.00 3.35 H new ATOM 0 HD13 LEU B 33 -10.259 -1.115 -10.360 1.00 3.35 H new ATOM 0 HD21 LEU B 33 -8.763 -3.219 -11.913 1.00 1.84 H new ATOM 0 HD22 LEU B 33 -10.036 -2.168 -12.578 1.00 1.84 H new ATOM 0 HD23 LEU B 33 -8.448 -2.257 -13.376 1.00 1.84 H new ATOM 2161 N SER B 34 -9.374 2.135 -14.447 1.00 0.79 N ATOM 2162 CA SER B 34 -9.883 3.490 -14.594 1.00 0.74 C ATOM 2163 C SER B 34 -10.158 4.079 -13.207 1.00 0.70 C ATOM 2164 O SER B 34 -10.253 3.349 -12.218 1.00 0.72 O ATOM 2165 CB SER B 34 -11.096 3.518 -15.529 1.00 0.84 C ATOM 2166 OG SER B 34 -10.809 2.760 -16.688 1.00 1.71 O ATOM 0 H SER B 34 -10.048 1.407 -14.684 1.00 0.79 H new ATOM 0 HA SER B 34 -9.136 4.125 -15.070 1.00 0.74 H new ATOM 0 HB2 SER B 34 -11.971 3.111 -15.021 1.00 0.84 H new ATOM 0 HB3 SER B 34 -11.336 4.546 -15.802 1.00 0.84 H new ATOM 0 HG SER B 34 -11.584 2.774 -17.288 1.00 1.71 H new ATOM 2172 N VAL B 35 -10.226 5.403 -13.106 1.00 0.74 N ATOM 2173 CA VAL B 35 -10.093 6.072 -11.819 1.00 0.77 C ATOM 2174 C VAL B 35 -11.316 5.840 -10.922 1.00 0.71 C ATOM 2175 O VAL B 35 -11.201 5.295 -9.823 1.00 0.74 O ATOM 2176 CB VAL B 35 -9.844 7.555 -12.085 1.00 0.93 C ATOM 2177 CG1 VAL B 35 -9.711 8.332 -10.791 1.00 1.10 C ATOM 2178 CG2 VAL B 35 -8.556 7.810 -12.882 1.00 0.97 C ATOM 0 H VAL B 35 -10.372 6.030 -13.897 1.00 0.74 H new ATOM 0 HA VAL B 35 -9.250 5.653 -11.269 1.00 0.77 H new ATOM 0 HB VAL B 35 -10.708 7.886 -12.661 1.00 0.93 H new ATOM 0 HG11 VAL B 35 -9.534 9.384 -11.015 1.00 1.10 H new ATOM 0 HG12 VAL B 35 -10.629 8.233 -10.211 1.00 1.10 H new ATOM 0 HG13 VAL B 35 -8.874 7.938 -10.215 1.00 1.10 H new ATOM 0 HG21 VAL B 35 -8.432 8.881 -13.040 1.00 0.97 H new ATOM 0 HG22 VAL B 35 -7.702 7.424 -12.326 1.00 0.97 H new ATOM 0 HG23 VAL B 35 -8.619 7.306 -13.846 1.00 0.97 H new ATOM 2188 N ASN B 36 -12.497 6.269 -11.379 1.00 0.76 N ATOM 2189 CA ASN B 36 -13.732 6.074 -10.619 1.00 0.88 C ATOM 2190 C ASN B 36 -13.984 4.574 -10.429 1.00 0.87 C ATOM 2191 O ASN B 36 -14.273 4.134 -9.318 1.00 0.92 O ATOM 2192 CB ASN B 36 -14.935 6.765 -11.296 1.00 1.14 C ATOM 2193 CG ASN B 36 -15.396 8.036 -10.569 1.00 2.42 C ATOM 2194 OD1 ASN B 36 -15.216 8.209 -9.362 1.00 3.72 O ATOM 2195 ND2 ASN B 36 -16.006 8.968 -11.288 1.00 2.61 N ATOM 0 H ASN B 36 -12.622 6.752 -12.269 1.00 0.76 H new ATOM 0 HA ASN B 36 -13.615 6.540 -9.641 1.00 0.88 H new ATOM 0 HB2 ASN B 36 -14.669 7.019 -12.322 1.00 1.14 H new ATOM 0 HB3 ASN B 36 -15.767 6.062 -11.347 1.00 1.14 H new ATOM 0 HD21 ASN B 36 -16.326 9.828 -10.842 1.00 2.61 H new ATOM 0 HD22 ASN B 36 -16.155 8.825 -12.287 1.00 2.61 H new ATOM 2202 N GLU B 37 -13.803 3.798 -11.507 1.00 0.88 N ATOM 2203 CA GLU B 37 -13.822 2.337 -11.498 1.00 0.94 C ATOM 2204 C GLU B 37 -13.059 1.813 -10.279 1.00 0.87 C ATOM 2205 O GLU B 37 -13.632 1.114 -9.452 1.00 0.94 O ATOM 2206 CB GLU B 37 -13.233 1.823 -12.824 1.00 1.04 C ATOM 2207 CG GLU B 37 -13.004 0.306 -12.929 1.00 1.32 C ATOM 2208 CD GLU B 37 -14.278 -0.513 -13.083 1.00 2.31 C ATOM 2209 OE1 GLU B 37 -15.361 0.104 -13.151 1.00 3.44 O ATOM 2210 OE2 GLU B 37 -14.132 -1.752 -13.149 1.00 3.18 O ATOM 0 H GLU B 37 -13.635 4.186 -12.435 1.00 0.88 H new ATOM 0 HA GLU B 37 -14.844 1.967 -11.417 1.00 0.94 H new ATOM 0 HB2 GLU B 37 -13.898 2.125 -13.633 1.00 1.04 H new ATOM 0 HB3 GLU B 37 -12.280 2.325 -12.991 1.00 1.04 H new ATOM 0 HG2 GLU B 37 -12.354 0.107 -13.781 1.00 1.32 H new ATOM 0 HG3 GLU B 37 -12.475 -0.032 -12.038 1.00 1.32 H new ATOM 2217 N PHE B 38 -11.780 2.179 -10.134 1.00 0.78 N ATOM 2218 CA PHE B 38 -10.976 1.800 -8.976 1.00 0.69 C ATOM 2219 C PHE B 38 -11.703 2.090 -7.663 1.00 0.66 C ATOM 2220 O PHE B 38 -11.886 1.177 -6.863 1.00 0.66 O ATOM 2221 CB PHE B 38 -9.607 2.491 -9.022 1.00 0.65 C ATOM 2222 CG PHE B 38 -8.951 2.797 -7.688 1.00 0.81 C ATOM 2223 CD1 PHE B 38 -8.383 1.763 -6.924 1.00 1.54 C ATOM 2224 CD2 PHE B 38 -8.902 4.122 -7.213 1.00 2.02 C ATOM 2225 CE1 PHE B 38 -7.698 2.060 -5.732 1.00 1.70 C ATOM 2226 CE2 PHE B 38 -8.253 4.411 -6.001 1.00 2.32 C ATOM 2227 CZ PHE B 38 -7.627 3.386 -5.272 1.00 1.58 C ATOM 0 H PHE B 38 -11.278 2.745 -10.818 1.00 0.78 H new ATOM 0 HA PHE B 38 -10.816 0.723 -9.019 1.00 0.69 H new ATOM 0 HB2 PHE B 38 -8.928 1.862 -9.598 1.00 0.65 H new ATOM 0 HB3 PHE B 38 -9.717 3.427 -9.569 1.00 0.65 H new ATOM 0 HD1 PHE B 38 -8.473 0.738 -7.253 1.00 1.54 H new ATOM 0 HD2 PHE B 38 -9.364 4.916 -7.781 1.00 2.02 H new ATOM 0 HE1 PHE B 38 -7.226 1.268 -5.170 1.00 1.70 H new ATOM 0 HE2 PHE B 38 -8.235 5.425 -5.628 1.00 2.32 H new ATOM 0 HZ PHE B 38 -7.093 3.616 -4.362 1.00 1.58 H new ATOM 2237 N LYS B 39 -12.102 3.347 -7.444 1.00 0.71 N ATOM 2238 CA LYS B 39 -12.827 3.772 -6.247 1.00 0.72 C ATOM 2239 C LYS B 39 -13.996 2.819 -5.959 1.00 0.78 C ATOM 2240 O LYS B 39 -14.177 2.347 -4.832 1.00 0.83 O ATOM 2241 CB LYS B 39 -13.258 5.243 -6.414 1.00 0.85 C ATOM 2242 CG LYS B 39 -14.596 5.638 -5.765 1.00 0.97 C ATOM 2243 CD LYS B 39 -14.939 7.084 -6.160 1.00 1.95 C ATOM 2244 CE LYS B 39 -16.438 7.310 -6.392 1.00 2.79 C ATOM 2245 NZ LYS B 39 -16.672 8.582 -7.106 1.00 4.28 N ATOM 0 H LYS B 39 -11.927 4.106 -8.103 1.00 0.71 H new ATOM 0 HA LYS B 39 -12.181 3.721 -5.371 1.00 0.72 H new ATOM 0 HB2 LYS B 39 -12.475 5.878 -5.999 1.00 0.85 H new ATOM 0 HB3 LYS B 39 -13.316 5.464 -7.480 1.00 0.85 H new ATOM 0 HG2 LYS B 39 -15.386 4.962 -6.091 1.00 0.97 H new ATOM 0 HG3 LYS B 39 -14.528 5.550 -4.681 1.00 0.97 H new ATOM 0 HD2 LYS B 39 -14.594 7.759 -5.377 1.00 1.95 H new ATOM 0 HD3 LYS B 39 -14.395 7.344 -7.068 1.00 1.95 H new ATOM 0 HE2 LYS B 39 -16.850 6.482 -6.969 1.00 2.79 H new ATOM 0 HE3 LYS B 39 -16.961 7.323 -5.436 1.00 2.79 H new ATOM 0 HZ1 LYS B 39 -17.627 8.578 -7.519 1.00 4.28 H new ATOM 0 HZ2 LYS B 39 -16.587 9.375 -6.439 1.00 4.28 H new ATOM 0 HZ3 LYS B 39 -15.968 8.689 -7.864 1.00 4.28 H new ATOM 2259 N GLU B 40 -14.803 2.558 -6.984 1.00 0.86 N ATOM 2260 CA GLU B 40 -16.011 1.762 -6.871 1.00 0.98 C ATOM 2261 C GLU B 40 -15.645 0.305 -6.541 1.00 0.91 C ATOM 2262 O GLU B 40 -16.117 -0.253 -5.550 1.00 1.01 O ATOM 2263 CB GLU B 40 -16.866 2.001 -8.125 1.00 1.19 C ATOM 2264 CG GLU B 40 -17.345 3.470 -8.083 1.00 1.25 C ATOM 2265 CD GLU B 40 -17.924 3.998 -9.385 1.00 1.98 C ATOM 2266 OE1 GLU B 40 -18.650 3.230 -10.047 1.00 2.09 O ATOM 2267 OE2 GLU B 40 -17.651 5.189 -9.665 1.00 3.24 O ATOM 0 H GLU B 40 -14.629 2.901 -7.929 1.00 0.86 H new ATOM 0 HA GLU B 40 -16.643 2.061 -6.035 1.00 0.98 H new ATOM 0 HB2 GLU B 40 -16.285 1.812 -9.028 1.00 1.19 H new ATOM 0 HB3 GLU B 40 -17.717 1.320 -8.145 1.00 1.19 H new ATOM 0 HG2 GLU B 40 -18.099 3.567 -7.302 1.00 1.25 H new ATOM 0 HG3 GLU B 40 -16.505 4.102 -7.795 1.00 1.25 H new ATOM 2274 N LEU B 41 -14.722 -0.284 -7.302 1.00 0.82 N ATOM 2275 CA LEU B 41 -14.173 -1.610 -7.045 1.00 0.79 C ATOM 2276 C LEU B 41 -13.660 -1.745 -5.609 1.00 0.71 C ATOM 2277 O LEU B 41 -14.035 -2.697 -4.927 1.00 0.75 O ATOM 2278 CB LEU B 41 -13.073 -1.947 -8.069 1.00 0.82 C ATOM 2279 CG LEU B 41 -13.573 -2.711 -9.310 1.00 1.19 C ATOM 2280 CD1 LEU B 41 -13.820 -4.188 -8.983 1.00 1.83 C ATOM 2281 CD2 LEU B 41 -14.827 -2.101 -9.949 1.00 2.74 C ATOM 0 H LEU B 41 -14.328 0.160 -8.132 1.00 0.82 H new ATOM 0 HA LEU B 41 -14.980 -2.333 -7.161 1.00 0.79 H new ATOM 0 HB2 LEU B 41 -12.599 -1.021 -8.394 1.00 0.82 H new ATOM 0 HB3 LEU B 41 -12.304 -2.542 -7.576 1.00 0.82 H new ATOM 0 HG LEU B 41 -12.774 -2.625 -10.046 1.00 1.19 H new ATOM 0 HD11 LEU B 41 -14.172 -4.704 -9.876 1.00 1.83 H new ATOM 0 HD12 LEU B 41 -12.891 -4.645 -8.642 1.00 1.83 H new ATOM 0 HD13 LEU B 41 -14.572 -4.266 -8.198 1.00 1.83 H new ATOM 0 HD21 LEU B 41 -15.118 -2.693 -10.816 1.00 2.74 H new ATOM 0 HD22 LEU B 41 -15.640 -2.097 -9.223 1.00 2.74 H new ATOM 0 HD23 LEU B 41 -14.615 -1.079 -10.262 1.00 2.74 H new ATOM 2293 N VAL B 42 -12.813 -0.825 -5.124 1.00 0.65 N ATOM 2294 CA VAL B 42 -12.332 -0.930 -3.750 1.00 0.66 C ATOM 2295 C VAL B 42 -13.514 -0.852 -2.781 1.00 0.79 C ATOM 2296 O VAL B 42 -13.684 -1.765 -1.981 1.00 0.95 O ATOM 2297 CB VAL B 42 -11.159 0.016 -3.403 1.00 0.63 C ATOM 2298 CG1 VAL B 42 -9.945 -0.289 -4.287 1.00 1.57 C ATOM 2299 CG2 VAL B 42 -11.485 1.509 -3.490 1.00 1.63 C ATOM 0 H VAL B 42 -12.459 -0.025 -5.649 1.00 0.65 H new ATOM 0 HA VAL B 42 -11.873 -1.912 -3.638 1.00 0.66 H new ATOM 0 HB VAL B 42 -10.940 -0.185 -2.354 1.00 0.63 H new ATOM 0 HG11 VAL B 42 -9.129 0.386 -4.030 1.00 1.57 H new ATOM 0 HG12 VAL B 42 -9.628 -1.320 -4.127 1.00 1.57 H new ATOM 0 HG13 VAL B 42 -10.214 -0.151 -5.334 1.00 1.57 H new ATOM 0 HG21 VAL B 42 -10.601 2.090 -3.229 1.00 1.63 H new ATOM 0 HG22 VAL B 42 -11.794 1.755 -4.506 1.00 1.63 H new ATOM 0 HG23 VAL B 42 -12.292 1.746 -2.797 1.00 1.63 H new ATOM 2309 N THR B 43 -14.371 0.174 -2.843 1.00 0.86 N ATOM 2310 CA THR B 43 -15.442 0.257 -1.848 1.00 0.99 C ATOM 2311 C THR B 43 -16.390 -0.950 -1.907 1.00 1.18 C ATOM 2312 O THR B 43 -16.967 -1.302 -0.882 1.00 1.43 O ATOM 2313 CB THR B 43 -16.179 1.605 -1.862 1.00 1.18 C ATOM 2314 OG1 THR B 43 -16.931 1.741 -0.672 1.00 1.50 O ATOM 2315 CG2 THR B 43 -17.125 1.767 -3.048 1.00 1.58 C ATOM 0 H THR B 43 -14.349 0.923 -3.535 1.00 0.86 H new ATOM 0 HA THR B 43 -14.953 0.210 -0.875 1.00 0.99 H new ATOM 0 HB THR B 43 -15.412 2.375 -1.946 1.00 1.18 H new ATOM 0 HG1 THR B 43 -17.401 2.601 -0.678 1.00 1.50 H new ATOM 0 HG21 THR B 43 -17.612 2.741 -2.995 1.00 1.58 H new ATOM 0 HG22 THR B 43 -16.560 1.694 -3.977 1.00 1.58 H new ATOM 0 HG23 THR B 43 -17.881 0.982 -3.021 1.00 1.58 H new ATOM 2323 N GLN B 44 -16.551 -1.584 -3.074 1.00 1.19 N ATOM 2324 CA GLN B 44 -17.258 -2.856 -3.181 1.00 1.34 C ATOM 2325 C GLN B 44 -16.488 -3.960 -2.444 1.00 1.32 C ATOM 2326 O GLN B 44 -17.048 -4.639 -1.587 1.00 1.44 O ATOM 2327 CB GLN B 44 -17.464 -3.220 -4.657 1.00 1.39 C ATOM 2328 CG GLN B 44 -18.498 -2.304 -5.327 1.00 2.07 C ATOM 2329 CD GLN B 44 -18.401 -2.363 -6.848 1.00 2.87 C ATOM 2330 OE1 GLN B 44 -18.319 -1.338 -7.515 1.00 4.31 O ATOM 2331 NE2 GLN B 44 -18.414 -3.565 -7.418 1.00 2.86 N ATOM 0 H GLN B 44 -16.196 -1.229 -3.962 1.00 1.19 H new ATOM 0 HA GLN B 44 -18.237 -2.758 -2.712 1.00 1.34 H new ATOM 0 HB2 GLN B 44 -16.514 -3.146 -5.186 1.00 1.39 H new ATOM 0 HB3 GLN B 44 -17.792 -4.257 -4.734 1.00 1.39 H new ATOM 0 HG2 GLN B 44 -19.500 -2.597 -5.014 1.00 2.07 H new ATOM 0 HG3 GLN B 44 -18.347 -1.278 -4.992 1.00 2.07 H new ATOM 0 HE21 GLN B 44 -18.483 -4.403 -6.840 1.00 2.86 H new ATOM 0 HE22 GLN B 44 -18.355 -3.649 -8.433 1.00 2.86 H new ATOM 2340 N GLN B 45 -15.208 -4.147 -2.779 1.00 1.21 N ATOM 2341 CA GLN B 45 -14.376 -5.188 -2.183 1.00 1.26 C ATOM 2342 C GLN B 45 -14.159 -4.993 -0.686 1.00 1.21 C ATOM 2343 O GLN B 45 -13.810 -5.963 -0.017 1.00 1.28 O ATOM 2344 CB GLN B 45 -12.994 -5.241 -2.851 1.00 1.24 C ATOM 2345 CG GLN B 45 -12.833 -6.412 -3.825 1.00 1.25 C ATOM 2346 CD GLN B 45 -13.740 -6.299 -5.051 1.00 1.47 C ATOM 2347 OE1 GLN B 45 -14.961 -6.343 -4.945 1.00 2.88 O ATOM 2348 NE2 GLN B 45 -13.153 -6.178 -6.238 1.00 1.81 N ATOM 0 H GLN B 45 -14.722 -3.578 -3.472 1.00 1.21 H new ATOM 0 HA GLN B 45 -14.921 -6.118 -2.343 1.00 1.26 H new ATOM 0 HB2 GLN B 45 -12.821 -4.307 -3.386 1.00 1.24 H new ATOM 0 HB3 GLN B 45 -12.228 -5.313 -2.079 1.00 1.24 H new ATOM 0 HG2 GLN B 45 -11.795 -6.465 -4.152 1.00 1.25 H new ATOM 0 HG3 GLN B 45 -13.051 -7.344 -3.303 1.00 1.25 H new ATOM 0 HE21 GLN B 45 -12.136 -6.143 -6.303 1.00 1.81 H new ATOM 0 HE22 GLN B 45 -13.720 -6.120 -7.084 1.00 1.81 H new ATOM 2357 N LEU B 46 -14.252 -3.757 -0.191 1.00 1.07 N ATOM 2358 CA LEU B 46 -13.889 -3.411 1.172 1.00 0.93 C ATOM 2359 C LEU B 46 -15.150 -3.259 2.049 1.00 0.83 C ATOM 2360 O LEU B 46 -15.579 -2.131 2.300 1.00 0.94 O ATOM 2361 CB LEU B 46 -13.066 -2.101 1.197 1.00 1.03 C ATOM 2362 CG LEU B 46 -11.767 -1.915 0.370 1.00 1.57 C ATOM 2363 CD1 LEU B 46 -10.651 -1.271 1.206 1.00 1.50 C ATOM 2364 CD2 LEU B 46 -11.236 -3.134 -0.394 1.00 3.27 C ATOM 0 H LEU B 46 -14.586 -2.963 -0.738 1.00 1.07 H new ATOM 0 HA LEU B 46 -13.278 -4.218 1.576 1.00 0.93 H new ATOM 0 HB2 LEU B 46 -13.744 -1.302 0.897 1.00 1.03 H new ATOM 0 HB3 LEU B 46 -12.801 -1.920 2.239 1.00 1.03 H new ATOM 0 HG LEU B 46 -12.089 -1.238 -0.421 1.00 1.57 H new ATOM 0 HD11 LEU B 46 -9.757 -1.157 0.593 1.00 1.50 H new ATOM 0 HD12 LEU B 46 -10.978 -0.292 1.557 1.00 1.50 H new ATOM 0 HD13 LEU B 46 -10.425 -1.906 2.062 1.00 1.50 H new ATOM 0 HD21 LEU B 46 -10.325 -2.861 -0.927 1.00 3.27 H new ATOM 0 HD22 LEU B 46 -11.018 -3.938 0.309 1.00 3.27 H new ATOM 0 HD23 LEU B 46 -11.987 -3.471 -1.108 1.00 3.27 H new ATOM 2376 N PRO B 47 -15.780 -4.339 2.540 1.00 0.81 N ATOM 2377 CA PRO B 47 -16.988 -4.227 3.342 1.00 0.95 C ATOM 2378 C PRO B 47 -16.744 -3.645 4.738 1.00 1.15 C ATOM 2379 O PRO B 47 -17.706 -3.179 5.346 1.00 1.69 O ATOM 2380 CB PRO B 47 -17.546 -5.649 3.443 1.00 1.26 C ATOM 2381 CG PRO B 47 -16.291 -6.511 3.348 1.00 1.15 C ATOM 2382 CD PRO B 47 -15.454 -5.740 2.332 1.00 0.85 C ATOM 0 HA PRO B 47 -17.682 -3.532 2.869 1.00 0.95 H new ATOM 0 HB2 PRO B 47 -18.077 -5.810 4.381 1.00 1.26 H new ATOM 0 HB3 PRO B 47 -18.248 -5.866 2.638 1.00 1.26 H new ATOM 0 HG2 PRO B 47 -15.785 -6.602 4.309 1.00 1.15 H new ATOM 0 HG3 PRO B 47 -16.515 -7.522 3.009 1.00 1.15 H new ATOM 0 HD2 PRO B 47 -14.390 -5.921 2.483 1.00 0.85 H new ATOM 0 HD3 PRO B 47 -15.689 -6.050 1.314 1.00 0.85 H new ATOM 2390 N HIS B 48 -15.516 -3.707 5.277 1.00 1.05 N ATOM 2391 CA HIS B 48 -15.255 -3.493 6.700 1.00 1.19 C ATOM 2392 C HIS B 48 -15.935 -2.251 7.281 1.00 1.50 C ATOM 2393 O HIS B 48 -16.516 -2.328 8.361 1.00 2.29 O ATOM 2394 CB HIS B 48 -13.748 -3.473 6.961 1.00 1.36 C ATOM 2395 CG HIS B 48 -13.386 -3.119 8.377 1.00 1.63 C ATOM 2396 ND1 HIS B 48 -12.994 -1.879 8.824 1.00 2.84 N ATOM 2397 CD2 HIS B 48 -13.510 -3.935 9.467 1.00 2.40 C ATOM 2398 CE1 HIS B 48 -12.884 -1.950 10.162 1.00 3.31 C ATOM 2399 NE2 HIS B 48 -13.187 -3.181 10.596 1.00 3.09 N ATOM 0 H HIS B 48 -14.677 -3.908 4.732 1.00 1.05 H new ATOM 0 HA HIS B 48 -15.705 -4.335 7.225 1.00 1.19 H new ATOM 0 HB2 HIS B 48 -13.334 -4.453 6.723 1.00 1.36 H new ATOM 0 HB3 HIS B 48 -13.280 -2.757 6.286 1.00 1.36 H new ATOM 0 HD2 HIS B 48 -13.804 -4.974 9.456 1.00 2.40 H new ATOM 0 HE1 HIS B 48 -12.592 -1.128 10.799 1.00 3.31 H new ATOM 0 HE2 HIS B 48 -13.182 -3.504 11.563 1.00 3.09 H new ATOM 2407 N LEU B 49 -15.865 -1.104 6.596 1.00 1.66 N ATOM 2408 CA LEU B 49 -16.665 0.047 6.999 1.00 1.77 C ATOM 2409 C LEU B 49 -16.834 1.025 5.838 1.00 1.75 C ATOM 2410 O LEU B 49 -17.964 1.258 5.407 1.00 1.78 O ATOM 2411 CB LEU B 49 -16.074 0.728 8.247 1.00 1.91 C ATOM 2412 CG LEU B 49 -17.147 1.209 9.237 1.00 1.99 C ATOM 2413 CD1 LEU B 49 -16.461 1.866 10.440 1.00 3.38 C ATOM 2414 CD2 LEU B 49 -18.131 2.200 8.603 1.00 2.86 C ATOM 0 H LEU B 49 -15.275 -0.953 5.778 1.00 1.66 H new ATOM 0 HA LEU B 49 -17.659 -0.308 7.272 1.00 1.77 H new ATOM 0 HB2 LEU B 49 -15.408 0.030 8.754 1.00 1.91 H new ATOM 0 HB3 LEU B 49 -15.467 1.579 7.936 1.00 1.91 H new ATOM 0 HG LEU B 49 -17.723 0.338 9.549 1.00 1.99 H new ATOM 0 HD11 LEU B 49 -17.216 2.210 11.147 1.00 3.38 H new ATOM 0 HD12 LEU B 49 -15.810 1.141 10.929 1.00 3.38 H new ATOM 0 HD13 LEU B 49 -15.868 2.715 10.101 1.00 3.38 H new ATOM 0 HD21 LEU B 49 -18.867 2.507 9.346 1.00 2.86 H new ATOM 0 HD22 LEU B 49 -17.587 3.075 8.247 1.00 2.86 H new ATOM 0 HD23 LEU B 49 -18.639 1.723 7.765 1.00 2.86 H new ATOM 2426 N LEU B 50 -15.722 1.575 5.335 1.00 1.79 N ATOM 2427 CA LEU B 50 -15.712 2.614 4.306 1.00 1.85 C ATOM 2428 C LEU B 50 -16.500 3.822 4.807 1.00 1.63 C ATOM 2429 O LEU B 50 -17.528 4.222 4.265 1.00 1.64 O ATOM 2430 CB LEU B 50 -16.145 2.054 2.939 1.00 2.16 C ATOM 2431 CG LEU B 50 -14.985 1.383 2.177 1.00 2.95 C ATOM 2432 CD1 LEU B 50 -14.191 2.412 1.366 1.00 4.62 C ATOM 2433 CD2 LEU B 50 -14.011 0.608 3.075 1.00 3.79 C ATOM 0 H LEU B 50 -14.787 1.303 5.640 1.00 1.79 H new ATOM 0 HA LEU B 50 -14.698 2.971 4.125 1.00 1.85 H new ATOM 0 HB2 LEU B 50 -16.946 1.329 3.085 1.00 2.16 H new ATOM 0 HB3 LEU B 50 -16.553 2.862 2.333 1.00 2.16 H new ATOM 0 HG LEU B 50 -15.465 0.661 1.517 1.00 2.95 H new ATOM 0 HD11 LEU B 50 -13.379 1.911 0.839 1.00 4.62 H new ATOM 0 HD12 LEU B 50 -14.850 2.893 0.644 1.00 4.62 H new ATOM 0 HD13 LEU B 50 -13.778 3.164 2.038 1.00 4.62 H new ATOM 0 HD21 LEU B 50 -13.225 0.166 2.463 1.00 3.79 H new ATOM 0 HD22 LEU B 50 -13.566 1.288 3.802 1.00 3.79 H new ATOM 0 HD23 LEU B 50 -14.549 -0.182 3.599 1.00 3.79 H new ATOM 2445 N LYS B 51 -15.979 4.375 5.903 1.00 1.55 N ATOM 2446 CA LYS B 51 -16.472 5.578 6.551 1.00 1.54 C ATOM 2447 C LYS B 51 -16.110 6.841 5.762 1.00 1.50 C ATOM 2448 O LYS B 51 -16.806 7.843 5.890 1.00 1.57 O ATOM 2449 CB LYS B 51 -15.911 5.635 7.978 1.00 1.65 C ATOM 2450 CG LYS B 51 -14.382 5.804 8.007 1.00 1.78 C ATOM 2451 CD LYS B 51 -13.955 7.275 8.129 1.00 2.02 C ATOM 2452 CE LYS B 51 -13.741 7.701 9.591 1.00 2.21 C ATOM 2453 NZ LYS B 51 -15.018 7.839 10.320 1.00 2.60 N ATOM 0 H LYS B 51 -15.169 3.976 6.378 1.00 1.55 H new ATOM 0 HA LYS B 51 -17.561 5.540 6.587 1.00 1.54 H new ATOM 0 HB2 LYS B 51 -16.374 6.463 8.514 1.00 1.65 H new ATOM 0 HB3 LYS B 51 -16.182 4.722 8.508 1.00 1.65 H new ATOM 0 HG2 LYS B 51 -13.973 5.240 8.845 1.00 1.78 H new ATOM 0 HG3 LYS B 51 -13.955 5.379 7.098 1.00 1.78 H new ATOM 0 HD2 LYS B 51 -13.033 7.431 7.569 1.00 2.02 H new ATOM 0 HD3 LYS B 51 -14.715 7.911 7.675 1.00 2.02 H new ATOM 0 HE2 LYS B 51 -13.114 6.966 10.095 1.00 2.21 H new ATOM 0 HE3 LYS B 51 -13.204 8.649 9.617 1.00 2.21 H new ATOM 0 HZ1 LYS B 51 -14.840 8.256 11.256 1.00 2.60 H new ATOM 0 HZ2 LYS B 51 -15.660 8.456 9.782 1.00 2.60 H new ATOM 0 HZ3 LYS B 51 -15.455 6.902 10.436 1.00 2.60 H new ATOM 2467 N ASP B 52 -14.976 6.796 5.050 1.00 1.45 N ATOM 2468 CA ASP B 52 -14.410 7.801 4.161 1.00 1.47 C ATOM 2469 C ASP B 52 -14.753 9.246 4.524 1.00 1.44 C ATOM 2470 O ASP B 52 -15.740 9.806 4.052 1.00 1.51 O ATOM 2471 CB ASP B 52 -14.589 7.396 2.687 1.00 1.70 C ATOM 2472 CG ASP B 52 -13.753 6.159 2.339 1.00 2.20 C ATOM 2473 OD1 ASP B 52 -13.602 5.311 3.252 1.00 2.48 O ATOM 2474 OD2 ASP B 52 -13.265 6.082 1.183 1.00 3.22 O ATOM 0 H ASP B 52 -14.379 5.970 5.091 1.00 1.45 H new ATOM 0 HA ASP B 52 -13.332 7.813 4.323 1.00 1.47 H new ATOM 0 HB2 ASP B 52 -15.641 7.192 2.490 1.00 1.70 H new ATOM 0 HB3 ASP B 52 -14.299 8.226 2.043 1.00 1.70 H new ATOM 2479 N VAL B 53 -13.887 9.862 5.344 1.00 1.51 N ATOM 2480 CA VAL B 53 -13.879 11.290 5.608 1.00 1.61 C ATOM 2481 C VAL B 53 -12.436 11.774 5.739 1.00 1.67 C ATOM 2482 O VAL B 53 -11.537 10.980 6.008 1.00 1.99 O ATOM 2483 CB VAL B 53 -14.765 11.620 6.816 1.00 1.92 C ATOM 2484 CG1 VAL B 53 -14.150 11.129 8.128 1.00 2.90 C ATOM 2485 CG2 VAL B 53 -15.057 13.118 6.918 1.00 3.08 C ATOM 0 H VAL B 53 -13.158 9.358 5.850 1.00 1.51 H new ATOM 0 HA VAL B 53 -14.316 11.836 4.772 1.00 1.61 H new ATOM 0 HB VAL B 53 -15.705 11.092 6.653 1.00 1.92 H new ATOM 0 HG11 VAL B 53 -14.810 11.384 8.957 1.00 2.90 H new ATOM 0 HG12 VAL B 53 -14.020 10.048 8.087 1.00 2.90 H new ATOM 0 HG13 VAL B 53 -13.181 11.606 8.276 1.00 2.90 H new ATOM 0 HG21 VAL B 53 -15.687 13.308 7.787 1.00 3.08 H new ATOM 0 HG22 VAL B 53 -14.120 13.665 7.023 1.00 3.08 H new ATOM 0 HG23 VAL B 53 -15.572 13.450 6.017 1.00 3.08 H new ATOM 2495 N GLY B 54 -12.208 13.067 5.501 1.00 1.73 N ATOM 2496 CA GLY B 54 -10.877 13.629 5.370 1.00 1.96 C ATOM 2497 C GLY B 54 -10.402 13.360 3.949 1.00 1.63 C ATOM 2498 O GLY B 54 -10.780 14.088 3.031 1.00 1.75 O ATOM 0 H GLY B 54 -12.954 13.754 5.394 1.00 1.73 H new ATOM 0 HA2 GLY B 54 -10.892 14.700 5.573 1.00 1.96 H new ATOM 0 HA3 GLY B 54 -10.198 13.177 6.093 1.00 1.96 H new ATOM 2502 N SER B 55 -9.649 12.276 3.745 1.00 1.46 N ATOM 2503 CA SER B 55 -9.212 11.905 2.406 1.00 1.34 C ATOM 2504 C SER B 55 -10.354 11.610 1.453 1.00 1.14 C ATOM 2505 O SER B 55 -10.107 11.566 0.258 1.00 1.20 O ATOM 2506 CB SER B 55 -8.174 10.799 2.364 1.00 1.57 C ATOM 2507 OG SER B 55 -7.038 11.233 3.058 1.00 2.02 O ATOM 0 H SER B 55 -9.334 11.648 4.485 1.00 1.46 H new ATOM 0 HA SER B 55 -8.714 12.807 2.051 1.00 1.34 H new ATOM 0 HB2 SER B 55 -8.570 9.890 2.816 1.00 1.57 H new ATOM 0 HB3 SER B 55 -7.919 10.557 1.332 1.00 1.57 H new ATOM 0 HG SER B 55 -6.497 11.804 2.474 1.00 2.02 H new ATOM 2513 N LEU B 56 -11.579 11.409 1.945 1.00 1.12 N ATOM 2514 CA LEU B 56 -12.763 11.435 1.095 1.00 1.22 C ATOM 2515 C LEU B 56 -12.607 12.547 0.075 1.00 1.23 C ATOM 2516 O LEU B 56 -12.765 12.315 -1.119 1.00 1.14 O ATOM 2517 CB LEU B 56 -13.992 11.704 1.962 1.00 1.72 C ATOM 2518 CG LEU B 56 -15.349 11.866 1.252 1.00 2.06 C ATOM 2519 CD1 LEU B 56 -15.552 13.202 0.522 1.00 2.66 C ATOM 2520 CD2 LEU B 56 -15.670 10.692 0.322 1.00 2.45 C ATOM 0 H LEU B 56 -11.773 11.227 2.930 1.00 1.12 H new ATOM 0 HA LEU B 56 -12.882 10.480 0.583 1.00 1.22 H new ATOM 0 HB2 LEU B 56 -14.083 10.886 2.677 1.00 1.72 H new ATOM 0 HB3 LEU B 56 -13.804 12.611 2.537 1.00 1.72 H new ATOM 0 HG LEU B 56 -16.064 11.868 2.075 1.00 2.06 H new ATOM 0 HD11 LEU B 56 -16.537 13.216 0.056 1.00 2.66 H new ATOM 0 HD12 LEU B 56 -15.477 14.022 1.236 1.00 2.66 H new ATOM 0 HD13 LEU B 56 -14.786 13.318 -0.245 1.00 2.66 H new ATOM 0 HD21 LEU B 56 -16.637 10.858 -0.152 1.00 2.45 H new ATOM 0 HD22 LEU B 56 -14.899 10.613 -0.444 1.00 2.45 H new ATOM 0 HD23 LEU B 56 -15.703 9.768 0.900 1.00 2.45 H new ATOM 2532 N ASP B 57 -12.260 13.741 0.560 1.00 1.52 N ATOM 2533 CA ASP B 57 -12.108 14.877 -0.332 1.00 1.74 C ATOM 2534 C ASP B 57 -10.953 14.638 -1.313 1.00 1.58 C ATOM 2535 O ASP B 57 -11.180 14.567 -2.516 1.00 1.60 O ATOM 2536 CB ASP B 57 -11.930 16.177 0.457 1.00 2.14 C ATOM 2537 CG ASP B 57 -11.736 17.340 -0.501 1.00 3.36 C ATOM 2538 OD1 ASP B 57 -12.443 17.399 -1.532 1.00 4.00 O ATOM 2539 OD2 ASP B 57 -10.825 18.165 -0.277 1.00 4.39 O ATOM 0 H ASP B 57 -12.084 13.938 1.545 1.00 1.52 H new ATOM 0 HA ASP B 57 -13.021 14.983 -0.917 1.00 1.74 H new ATOM 0 HB2 ASP B 57 -12.803 16.354 1.085 1.00 2.14 H new ATOM 0 HB3 ASP B 57 -11.070 16.095 1.122 1.00 2.14 H new ATOM 2544 N GLU B 58 -9.724 14.480 -0.802 1.00 1.54 N ATOM 2545 CA GLU B 58 -8.511 14.173 -1.566 1.00 1.54 C ATOM 2546 C GLU B 58 -8.775 13.159 -2.695 1.00 1.32 C ATOM 2547 O GLU B 58 -8.470 13.414 -3.861 1.00 1.44 O ATOM 2548 CB GLU B 58 -7.399 13.676 -0.620 1.00 1.54 C ATOM 2549 CG GLU B 58 -7.038 14.688 0.484 1.00 1.65 C ATOM 2550 CD GLU B 58 -5.804 14.266 1.283 1.00 3.28 C ATOM 2551 OE1 GLU B 58 -5.950 13.400 2.177 1.00 4.15 O ATOM 2552 OE2 GLU B 58 -4.727 14.844 1.034 1.00 4.58 O ATOM 0 H GLU B 58 -9.542 14.567 0.198 1.00 1.54 H new ATOM 0 HA GLU B 58 -8.179 15.094 -2.046 1.00 1.54 H new ATOM 0 HB2 GLU B 58 -7.717 12.742 -0.157 1.00 1.54 H new ATOM 0 HB3 GLU B 58 -6.507 13.454 -1.205 1.00 1.54 H new ATOM 0 HG2 GLU B 58 -6.859 15.664 0.033 1.00 1.65 H new ATOM 0 HG3 GLU B 58 -7.885 14.800 1.161 1.00 1.65 H new ATOM 2559 N LYS B 59 -9.376 12.020 -2.358 1.00 1.06 N ATOM 2560 CA LYS B 59 -9.727 10.977 -3.301 1.00 0.86 C ATOM 2561 C LYS B 59 -10.814 11.461 -4.250 1.00 0.84 C ATOM 2562 O LYS B 59 -10.578 11.553 -5.449 1.00 0.91 O ATOM 2563 CB LYS B 59 -10.193 9.728 -2.528 1.00 0.74 C ATOM 2564 CG LYS B 59 -8.965 8.864 -2.253 1.00 1.03 C ATOM 2565 CD LYS B 59 -9.083 7.759 -1.195 1.00 1.01 C ATOM 2566 CE LYS B 59 -10.347 6.884 -1.272 1.00 1.07 C ATOM 2567 NZ LYS B 59 -11.091 6.890 0.015 1.00 1.47 N ATOM 0 H LYS B 59 -9.636 11.798 -1.397 1.00 1.06 H new ATOM 0 HA LYS B 59 -8.852 10.720 -3.898 1.00 0.86 H new ATOM 0 HB2 LYS B 59 -10.675 10.015 -1.593 1.00 0.74 H new ATOM 0 HB3 LYS B 59 -10.929 9.172 -3.109 1.00 0.74 H new ATOM 0 HG2 LYS B 59 -8.669 8.397 -3.192 1.00 1.03 H new ATOM 0 HG3 LYS B 59 -8.151 9.525 -1.955 1.00 1.03 H new ATOM 0 HD2 LYS B 59 -8.211 7.111 -1.277 1.00 1.01 H new ATOM 0 HD3 LYS B 59 -9.045 8.222 -0.209 1.00 1.01 H new ATOM 0 HE2 LYS B 59 -10.995 7.247 -2.070 1.00 1.07 H new ATOM 0 HE3 LYS B 59 -10.069 5.862 -1.528 1.00 1.07 H new ATOM 0 HZ1 LYS B 59 -11.946 6.305 -0.076 1.00 1.47 H new ATOM 0 HZ2 LYS B 59 -10.486 6.505 0.768 1.00 1.47 H new ATOM 0 HZ3 LYS B 59 -11.363 7.865 0.254 1.00 1.47 H new ATOM 2581 N MET B 60 -11.998 11.772 -3.725 1.00 0.83 N ATOM 2582 CA MET B 60 -13.167 12.073 -4.541 1.00 0.85 C ATOM 2583 C MET B 60 -12.844 13.182 -5.542 1.00 0.85 C ATOM 2584 O MET B 60 -13.149 13.037 -6.721 1.00 0.85 O ATOM 2585 CB MET B 60 -14.366 12.436 -3.656 1.00 0.93 C ATOM 2586 CG MET B 60 -15.692 12.508 -4.429 1.00 1.02 C ATOM 2587 SD MET B 60 -16.493 10.916 -4.784 1.00 3.17 S ATOM 2588 CE MET B 60 -18.032 11.523 -5.509 1.00 3.30 C ATOM 0 H MET B 60 -12.171 11.822 -2.721 1.00 0.83 H new ATOM 0 HA MET B 60 -13.440 11.183 -5.109 1.00 0.85 H new ATOM 0 HB2 MET B 60 -14.457 11.698 -2.859 1.00 0.93 H new ATOM 0 HB3 MET B 60 -14.179 13.398 -3.179 1.00 0.93 H new ATOM 0 HG2 MET B 60 -16.389 13.124 -3.860 1.00 1.02 H new ATOM 0 HG3 MET B 60 -15.512 13.020 -5.374 1.00 1.02 H new ATOM 0 HE1 MET B 60 -18.659 10.678 -5.792 1.00 3.30 H new ATOM 0 HE2 MET B 60 -18.559 12.139 -4.780 1.00 3.30 H new ATOM 0 HE3 MET B 60 -17.807 12.120 -6.393 1.00 3.30 H new ATOM 2598 N LYS B 61 -12.204 14.263 -5.086 1.00 0.92 N ATOM 2599 CA LYS B 61 -11.818 15.372 -5.943 1.00 1.00 C ATOM 2600 C LYS B 61 -10.853 14.880 -7.032 1.00 0.99 C ATOM 2601 O LYS B 61 -11.083 15.107 -8.217 1.00 1.04 O ATOM 2602 CB LYS B 61 -11.296 16.561 -5.099 1.00 1.14 C ATOM 2603 CG LYS B 61 -9.836 16.415 -4.642 1.00 2.05 C ATOM 2604 CD LYS B 61 -9.404 17.248 -3.426 1.00 2.21 C ATOM 2605 CE LYS B 61 -9.742 18.738 -3.507 1.00 2.67 C ATOM 2606 NZ LYS B 61 -10.936 19.078 -2.709 1.00 2.46 N ATOM 0 H LYS B 61 -11.941 14.387 -4.108 1.00 0.92 H new ATOM 0 HA LYS B 61 -12.687 15.764 -6.471 1.00 1.00 H new ATOM 0 HB2 LYS B 61 -11.393 17.477 -5.683 1.00 1.14 H new ATOM 0 HB3 LYS B 61 -11.931 16.675 -4.220 1.00 1.14 H new ATOM 0 HG2 LYS B 61 -9.654 15.364 -4.416 1.00 2.05 H new ATOM 0 HG3 LYS B 61 -9.190 16.677 -5.480 1.00 2.05 H new ATOM 0 HD2 LYS B 61 -9.874 16.833 -2.535 1.00 2.21 H new ATOM 0 HD3 LYS B 61 -8.327 17.142 -3.297 1.00 2.21 H new ATOM 0 HE2 LYS B 61 -8.892 19.322 -3.155 1.00 2.67 H new ATOM 0 HE3 LYS B 61 -9.910 19.016 -4.548 1.00 2.67 H new ATOM 0 HZ1 LYS B 61 -11.360 19.955 -3.074 1.00 2.46 H new ATOM 0 HZ2 LYS B 61 -11.629 18.305 -2.774 1.00 2.46 H new ATOM 0 HZ3 LYS B 61 -10.662 19.214 -1.715 1.00 2.46 H new ATOM 2620 N SER B 62 -9.782 14.173 -6.645 1.00 1.01 N ATOM 2621 CA SER B 62 -8.778 13.704 -7.590 1.00 1.10 C ATOM 2622 C SER B 62 -9.412 12.770 -8.621 1.00 1.04 C ATOM 2623 O SER B 62 -9.026 12.782 -9.787 1.00 1.15 O ATOM 2624 CB SER B 62 -7.628 13.014 -6.845 1.00 1.25 C ATOM 2625 OG SER B 62 -6.555 12.740 -7.728 1.00 1.93 O ATOM 0 H SER B 62 -9.595 13.916 -5.676 1.00 1.01 H new ATOM 0 HA SER B 62 -8.367 14.561 -8.124 1.00 1.10 H new ATOM 0 HB2 SER B 62 -7.282 13.650 -6.030 1.00 1.25 H new ATOM 0 HB3 SER B 62 -7.983 12.086 -6.397 1.00 1.25 H new ATOM 0 HG SER B 62 -5.830 12.301 -7.236 1.00 1.93 H new ATOM 2631 N LEU B 63 -10.365 11.944 -8.185 1.00 0.95 N ATOM 2632 CA LEU B 63 -11.082 11.046 -9.065 1.00 0.94 C ATOM 2633 C LEU B 63 -11.957 11.856 -10.018 1.00 0.96 C ATOM 2634 O LEU B 63 -11.811 11.728 -11.231 1.00 1.03 O ATOM 2635 CB LEU B 63 -11.822 9.956 -8.262 1.00 1.04 C ATOM 2636 CG LEU B 63 -10.926 8.820 -7.709 1.00 1.21 C ATOM 2637 CD1 LEU B 63 -9.431 9.127 -7.535 1.00 1.34 C ATOM 2638 CD2 LEU B 63 -11.444 8.364 -6.345 1.00 1.63 C ATOM 0 H LEU B 63 -10.655 11.886 -7.209 1.00 0.95 H new ATOM 0 HA LEU B 63 -10.386 10.491 -9.694 1.00 0.94 H new ATOM 0 HB2 LEU B 63 -12.337 10.430 -7.426 1.00 1.04 H new ATOM 0 HB3 LEU B 63 -12.588 9.515 -8.900 1.00 1.04 H new ATOM 0 HG LEU B 63 -10.993 8.059 -8.486 1.00 1.21 H new ATOM 0 HD11 LEU B 63 -8.922 8.247 -7.141 1.00 1.34 H new ATOM 0 HD12 LEU B 63 -9.000 9.394 -8.500 1.00 1.34 H new ATOM 0 HD13 LEU B 63 -9.309 9.958 -6.840 1.00 1.34 H new ATOM 0 HD21 LEU B 63 -10.809 7.565 -5.963 1.00 1.63 H new ATOM 0 HD22 LEU B 63 -11.428 9.204 -5.650 1.00 1.63 H new ATOM 0 HD23 LEU B 63 -12.465 7.997 -6.448 1.00 1.63 H new ATOM 2650 N ASP B 64 -12.826 12.717 -9.485 1.00 0.96 N ATOM 2651 CA ASP B 64 -13.731 13.561 -10.254 1.00 1.06 C ATOM 2652 C ASP B 64 -13.026 14.248 -11.431 1.00 1.09 C ATOM 2653 O ASP B 64 -13.479 14.123 -12.568 1.00 1.23 O ATOM 2654 CB ASP B 64 -14.378 14.584 -9.317 1.00 1.10 C ATOM 2655 CG ASP B 64 -15.355 15.471 -10.069 1.00 1.26 C ATOM 2656 OD1 ASP B 64 -16.510 15.022 -10.228 1.00 2.18 O ATOM 2657 OD2 ASP B 64 -14.926 16.576 -10.462 1.00 2.58 O ATOM 0 H ASP B 64 -12.919 12.847 -8.478 1.00 0.96 H new ATOM 0 HA ASP B 64 -14.504 12.930 -10.692 1.00 1.06 H new ATOM 0 HB2 ASP B 64 -14.898 14.066 -8.511 1.00 1.10 H new ATOM 0 HB3 ASP B 64 -13.605 15.198 -8.855 1.00 1.10 H new ATOM 2662 N VAL B 65 -11.893 14.910 -11.152 1.00 1.01 N ATOM 2663 CA VAL B 65 -11.150 15.761 -12.090 1.00 1.04 C ATOM 2664 C VAL B 65 -11.125 15.193 -13.508 1.00 1.06 C ATOM 2665 O VAL B 65 -11.583 15.832 -14.451 1.00 1.15 O ATOM 2666 CB VAL B 65 -9.713 15.947 -11.565 1.00 1.08 C ATOM 2667 CG1 VAL B 65 -8.704 16.443 -12.610 1.00 1.65 C ATOM 2668 CG2 VAL B 65 -9.729 16.965 -10.436 1.00 1.45 C ATOM 0 H VAL B 65 -11.454 14.865 -10.232 1.00 1.01 H new ATOM 0 HA VAL B 65 -11.662 16.721 -12.149 1.00 1.04 H new ATOM 0 HB VAL B 65 -9.388 14.956 -11.248 1.00 1.08 H new ATOM 0 HG11 VAL B 65 -7.722 16.544 -12.148 1.00 1.65 H new ATOM 0 HG12 VAL B 65 -8.648 15.727 -13.430 1.00 1.65 H new ATOM 0 HG13 VAL B 65 -9.025 17.411 -12.995 1.00 1.65 H new ATOM 0 HG21 VAL B 65 -8.716 17.104 -10.057 1.00 1.45 H new ATOM 0 HG22 VAL B 65 -10.111 17.916 -10.809 1.00 1.45 H new ATOM 0 HG23 VAL B 65 -10.371 16.606 -9.632 1.00 1.45 H new ATOM 2678 N ASN B 66 -10.537 14.007 -13.650 1.00 1.00 N ATOM 2679 CA ASN B 66 -10.466 13.307 -14.936 1.00 1.02 C ATOM 2680 C ASN B 66 -10.629 11.804 -14.737 1.00 1.04 C ATOM 2681 O ASN B 66 -9.771 11.014 -15.140 1.00 1.10 O ATOM 2682 CB ASN B 66 -9.160 13.640 -15.684 1.00 1.05 C ATOM 2683 CG ASN B 66 -9.211 14.997 -16.382 1.00 1.33 C ATOM 2684 OD1 ASN B 66 -10.001 15.198 -17.299 1.00 2.22 O ATOM 2685 ND2 ASN B 66 -8.347 15.932 -15.996 1.00 2.24 N ATOM 0 H ASN B 66 -10.097 13.503 -12.880 1.00 1.00 H new ATOM 0 HA ASN B 66 -11.290 13.655 -15.558 1.00 1.02 H new ATOM 0 HB2 ASN B 66 -8.329 13.630 -14.978 1.00 1.05 H new ATOM 0 HB3 ASN B 66 -8.961 12.863 -16.422 1.00 1.05 H new ATOM 0 HD21 ASN B 66 -8.332 16.838 -16.465 1.00 2.24 H new ATOM 0 HD22 ASN B 66 -7.699 15.743 -15.231 1.00 2.24 H new ATOM 2692 N GLN B 67 -11.763 11.390 -14.162 1.00 1.07 N ATOM 2693 CA GLN B 67 -11.974 9.986 -13.837 1.00 1.08 C ATOM 2694 C GLN B 67 -11.849 9.042 -15.029 1.00 1.19 C ATOM 2695 O GLN B 67 -11.553 7.859 -14.866 1.00 1.31 O ATOM 2696 CB GLN B 67 -13.328 9.729 -13.184 1.00 1.12 C ATOM 2697 CG GLN B 67 -14.514 10.300 -13.990 1.00 1.27 C ATOM 2698 CD GLN B 67 -15.346 9.213 -14.673 1.00 2.34 C ATOM 2699 OE1 GLN B 67 -16.198 8.600 -14.041 1.00 3.22 O ATOM 2700 NE2 GLN B 67 -15.130 8.957 -15.958 1.00 3.30 N ATOM 0 H GLN B 67 -12.539 12.005 -13.916 1.00 1.07 H new ATOM 0 HA GLN B 67 -11.169 9.771 -13.135 1.00 1.08 H new ATOM 0 HB2 GLN B 67 -13.466 8.655 -13.060 1.00 1.12 H new ATOM 0 HB3 GLN B 67 -13.331 10.168 -12.186 1.00 1.12 H new ATOM 0 HG2 GLN B 67 -15.155 10.877 -13.324 1.00 1.27 H new ATOM 0 HG3 GLN B 67 -14.136 10.989 -14.745 1.00 1.27 H new ATOM 0 HE21 GLN B 67 -14.417 9.477 -16.469 1.00 3.30 H new ATOM 0 HE22 GLN B 67 -15.678 8.240 -16.434 1.00 3.30 H new ATOM 2709 N ASP B 68 -12.168 9.565 -16.212 1.00 1.23 N ATOM 2710 CA ASP B 68 -12.172 8.807 -17.449 1.00 1.30 C ATOM 2711 C ASP B 68 -10.792 8.199 -17.734 1.00 1.35 C ATOM 2712 O ASP B 68 -10.688 7.149 -18.362 1.00 1.53 O ATOM 2713 CB ASP B 68 -12.611 9.753 -18.570 1.00 1.28 C ATOM 2714 CG ASP B 68 -12.660 9.040 -19.911 1.00 2.23 C ATOM 2715 OD1 ASP B 68 -13.640 8.290 -20.108 1.00 3.33 O ATOM 2716 OD2 ASP B 68 -11.734 9.281 -20.713 1.00 3.08 O ATOM 0 H ASP B 68 -12.434 10.542 -16.333 1.00 1.23 H new ATOM 0 HA ASP B 68 -12.865 7.969 -17.376 1.00 1.30 H new ATOM 0 HB2 ASP B 68 -13.594 10.163 -18.338 1.00 1.28 H new ATOM 0 HB3 ASP B 68 -11.921 10.595 -18.629 1.00 1.28 H new ATOM 2721 N SER B 69 -9.732 8.853 -17.244 1.00 1.28 N ATOM 2722 CA SER B 69 -8.370 8.364 -17.392 1.00 1.36 C ATOM 2723 C SER B 69 -8.197 6.967 -16.782 1.00 1.51 C ATOM 2724 O SER B 69 -9.011 6.496 -15.984 1.00 2.73 O ATOM 2725 CB SER B 69 -7.403 9.367 -16.743 1.00 1.32 C ATOM 2726 OG SER B 69 -6.050 9.022 -16.991 1.00 1.99 O ATOM 0 H SER B 69 -9.802 9.734 -16.735 1.00 1.28 H new ATOM 0 HA SER B 69 -8.146 8.274 -18.455 1.00 1.36 H new ATOM 0 HB2 SER B 69 -7.601 10.367 -17.130 1.00 1.32 H new ATOM 0 HB3 SER B 69 -7.580 9.400 -15.668 1.00 1.32 H new ATOM 0 HG SER B 69 -5.758 8.353 -16.338 1.00 1.99 H new ATOM 2732 N GLU B 70 -7.065 6.344 -17.113 1.00 1.03 N ATOM 2733 CA GLU B 70 -6.512 5.265 -16.315 1.00 0.83 C ATOM 2734 C GLU B 70 -5.734 5.857 -15.150 1.00 0.84 C ATOM 2735 O GLU B 70 -5.321 7.017 -15.196 1.00 1.16 O ATOM 2736 CB GLU B 70 -5.633 4.338 -17.159 1.00 0.96 C ATOM 2737 CG GLU B 70 -6.540 3.377 -17.926 1.00 1.57 C ATOM 2738 CD GLU B 70 -5.747 2.455 -18.829 1.00 2.19 C ATOM 2739 OE1 GLU B 70 -4.927 2.944 -19.640 1.00 2.19 O ATOM 2740 OE2 GLU B 70 -5.910 1.220 -18.715 1.00 3.52 O ATOM 0 H GLU B 70 -6.513 6.577 -17.939 1.00 1.03 H new ATOM 0 HA GLU B 70 -7.328 4.655 -15.927 1.00 0.83 H new ATOM 0 HB2 GLU B 70 -5.025 4.920 -17.852 1.00 0.96 H new ATOM 0 HB3 GLU B 70 -4.946 3.783 -16.521 1.00 0.96 H new ATOM 0 HG2 GLU B 70 -7.120 2.783 -17.220 1.00 1.57 H new ATOM 0 HG3 GLU B 70 -7.251 3.947 -18.523 1.00 1.57 H new ATOM 2747 N LEU B 71 -5.538 5.029 -14.128 1.00 0.84 N ATOM 2748 CA LEU B 71 -4.591 5.271 -13.042 1.00 1.05 C ATOM 2749 C LEU B 71 -3.449 4.259 -13.155 1.00 0.86 C ATOM 2750 O LEU B 71 -3.511 3.375 -14.010 1.00 0.87 O ATOM 2751 CB LEU B 71 -5.314 5.192 -11.691 1.00 1.45 C ATOM 2752 CG LEU B 71 -5.715 3.760 -11.313 1.00 1.35 C ATOM 2753 CD1 LEU B 71 -4.960 3.270 -10.085 1.00 2.08 C ATOM 2754 CD2 LEU B 71 -7.201 3.699 -10.997 1.00 2.31 C ATOM 0 H LEU B 71 -6.045 4.150 -14.029 1.00 0.84 H new ATOM 0 HA LEU B 71 -4.166 6.272 -13.114 1.00 1.05 H new ATOM 0 HB2 LEU B 71 -4.668 5.600 -10.914 1.00 1.45 H new ATOM 0 HB3 LEU B 71 -6.206 5.817 -11.725 1.00 1.45 H new ATOM 0 HG LEU B 71 -5.471 3.126 -12.165 1.00 1.35 H new ATOM 0 HD11 LEU B 71 -5.271 2.252 -9.849 1.00 2.08 H new ATOM 0 HD12 LEU B 71 -3.889 3.284 -10.287 1.00 2.08 H new ATOM 0 HD13 LEU B 71 -5.179 3.922 -9.239 1.00 2.08 H new ATOM 0 HD21 LEU B 71 -7.475 2.678 -10.730 1.00 2.31 H new ATOM 0 HD22 LEU B 71 -7.423 4.364 -10.163 1.00 2.31 H new ATOM 0 HD23 LEU B 71 -7.772 4.011 -11.872 1.00 2.31 H new ATOM 2766 N LYS B 72 -2.432 4.360 -12.296 1.00 0.75 N ATOM 2767 CA LYS B 72 -1.314 3.430 -12.196 1.00 0.69 C ATOM 2768 C LYS B 72 -1.035 3.051 -10.738 1.00 0.62 C ATOM 2769 O LYS B 72 -1.489 3.691 -9.788 1.00 0.58 O ATOM 2770 CB LYS B 72 -0.072 3.986 -12.907 1.00 0.85 C ATOM 2771 CG LYS B 72 -0.411 4.353 -14.360 1.00 1.06 C ATOM 2772 CD LYS B 72 0.747 4.145 -15.341 1.00 2.36 C ATOM 2773 CE LYS B 72 0.877 2.646 -15.666 1.00 3.90 C ATOM 2774 NZ LYS B 72 1.729 2.384 -16.841 1.00 5.32 N ATOM 0 H LYS B 72 -2.366 5.125 -11.625 1.00 0.75 H new ATOM 0 HA LYS B 72 -1.588 2.509 -12.710 1.00 0.69 H new ATOM 0 HB2 LYS B 72 0.295 4.866 -12.378 1.00 0.85 H new ATOM 0 HB3 LYS B 72 0.728 3.246 -12.889 1.00 0.85 H new ATOM 0 HG2 LYS B 72 -1.262 3.755 -14.686 1.00 1.06 H new ATOM 0 HG3 LYS B 72 -0.722 5.397 -14.397 1.00 1.06 H new ATOM 0 HD2 LYS B 72 0.571 4.713 -16.255 1.00 2.36 H new ATOM 0 HD3 LYS B 72 1.676 4.517 -14.909 1.00 2.36 H new ATOM 0 HE2 LYS B 72 1.290 2.127 -14.801 1.00 3.90 H new ATOM 0 HE3 LYS B 72 -0.115 2.231 -15.843 1.00 3.90 H new ATOM 0 HZ1 LYS B 72 1.508 1.444 -17.228 1.00 5.32 H new ATOM 0 HZ2 LYS B 72 1.552 3.107 -17.567 1.00 5.32 H new ATOM 0 HZ3 LYS B 72 2.729 2.415 -16.558 1.00 5.32 H new ATOM 2788 N PHE B 73 -0.299 1.956 -10.562 1.00 0.72 N ATOM 2789 CA PHE B 73 -0.253 1.215 -9.310 1.00 0.80 C ATOM 2790 C PHE B 73 0.250 2.036 -8.121 1.00 0.76 C ATOM 2791 O PHE B 73 -0.231 1.833 -7.010 1.00 0.79 O ATOM 2792 CB PHE B 73 0.513 -0.107 -9.488 1.00 1.30 C ATOM 2793 CG PHE B 73 1.654 -0.060 -10.488 1.00 0.97 C ATOM 2794 CD1 PHE B 73 2.861 0.582 -10.158 1.00 1.76 C ATOM 2795 CD2 PHE B 73 1.464 -0.570 -11.788 1.00 2.27 C ATOM 2796 CE1 PHE B 73 3.866 0.723 -11.128 1.00 2.38 C ATOM 2797 CE2 PHE B 73 2.477 -0.437 -12.751 1.00 2.59 C ATOM 2798 CZ PHE B 73 3.677 0.215 -12.424 1.00 2.25 C ATOM 0 H PHE B 73 0.288 1.556 -11.295 1.00 0.72 H new ATOM 0 HA PHE B 73 -1.284 0.973 -9.052 1.00 0.80 H new ATOM 0 HB2 PHE B 73 0.911 -0.412 -8.520 1.00 1.30 H new ATOM 0 HB3 PHE B 73 -0.191 -0.878 -9.800 1.00 1.30 H new ATOM 0 HD1 PHE B 73 3.014 0.966 -9.160 1.00 1.76 H new ATOM 0 HD2 PHE B 73 0.538 -1.064 -12.044 1.00 2.27 H new ATOM 0 HE1 PHE B 73 4.789 1.224 -10.877 1.00 2.38 H new ATOM 0 HE2 PHE B 73 2.333 -0.836 -13.744 1.00 2.59 H new ATOM 0 HZ PHE B 73 4.453 0.326 -13.167 1.00 2.25 H new ATOM 2808 N ASN B 74 1.184 2.970 -8.318 1.00 0.89 N ATOM 2809 CA ASN B 74 1.629 3.836 -7.228 1.00 1.10 C ATOM 2810 C ASN B 74 0.493 4.756 -6.760 1.00 0.93 C ATOM 2811 O ASN B 74 0.350 5.000 -5.562 1.00 0.97 O ATOM 2812 CB ASN B 74 2.877 4.638 -7.614 1.00 1.50 C ATOM 2813 CG ASN B 74 2.596 5.639 -8.727 1.00 1.64 C ATOM 2814 OD1 ASN B 74 2.120 5.247 -9.790 1.00 3.20 O ATOM 2815 ND2 ASN B 74 2.876 6.918 -8.503 1.00 1.90 N ATOM 0 H ASN B 74 1.642 3.144 -9.213 1.00 0.89 H new ATOM 0 HA ASN B 74 1.907 3.196 -6.391 1.00 1.10 H new ATOM 0 HB2 ASN B 74 3.252 5.167 -6.738 1.00 1.50 H new ATOM 0 HB3 ASN B 74 3.663 3.953 -7.933 1.00 1.50 H new ATOM 0 HD21 ASN B 74 2.696 7.614 -9.227 1.00 1.90 H new ATOM 0 HD22 ASN B 74 3.271 7.204 -7.607 1.00 1.90 H new ATOM 2822 N GLU B 75 -0.327 5.247 -7.695 1.00 0.84 N ATOM 2823 CA GLU B 75 -1.457 6.114 -7.401 1.00 0.78 C ATOM 2824 C GLU B 75 -2.489 5.328 -6.599 1.00 0.73 C ATOM 2825 O GLU B 75 -2.909 5.759 -5.524 1.00 0.84 O ATOM 2826 CB GLU B 75 -2.064 6.655 -8.700 1.00 0.84 C ATOM 2827 CG GLU B 75 -1.015 7.306 -9.614 1.00 1.41 C ATOM 2828 CD GLU B 75 -1.625 7.708 -10.947 1.00 2.09 C ATOM 2829 OE1 GLU B 75 -2.399 6.879 -11.472 1.00 3.28 O ATOM 2830 OE2 GLU B 75 -1.297 8.815 -11.420 1.00 2.76 O ATOM 0 H GLU B 75 -0.217 5.047 -8.689 1.00 0.84 H new ATOM 0 HA GLU B 75 -1.124 6.968 -6.811 1.00 0.78 H new ATOM 0 HB2 GLU B 75 -2.552 5.841 -9.235 1.00 0.84 H new ATOM 0 HB3 GLU B 75 -2.836 7.386 -8.460 1.00 0.84 H new ATOM 0 HG2 GLU B 75 -0.595 8.184 -9.123 1.00 1.41 H new ATOM 0 HG3 GLU B 75 -0.193 6.611 -9.782 1.00 1.41 H new ATOM 2837 N TYR B 76 -2.857 4.148 -7.119 1.00 0.63 N ATOM 2838 CA TYR B 76 -3.683 3.181 -6.401 1.00 0.64 C ATOM 2839 C TYR B 76 -3.169 3.073 -4.968 1.00 0.65 C ATOM 2840 O TYR B 76 -3.919 3.303 -4.022 1.00 0.62 O ATOM 2841 CB TYR B 76 -3.609 1.823 -7.109 1.00 0.70 C ATOM 2842 CG TYR B 76 -4.464 0.696 -6.548 1.00 1.05 C ATOM 2843 CD1 TYR B 76 -4.036 -0.015 -5.408 1.00 1.80 C ATOM 2844 CD2 TYR B 76 -5.523 0.181 -7.320 1.00 2.04 C ATOM 2845 CE1 TYR B 76 -4.676 -1.209 -5.035 1.00 2.06 C ATOM 2846 CE2 TYR B 76 -6.161 -1.016 -6.948 1.00 2.53 C ATOM 2847 CZ TYR B 76 -5.735 -1.712 -5.805 1.00 2.09 C ATOM 2848 OH TYR B 76 -6.339 -2.879 -5.444 1.00 2.63 O ATOM 0 H TYR B 76 -2.586 3.841 -8.053 1.00 0.63 H new ATOM 0 HA TYR B 76 -4.724 3.503 -6.385 1.00 0.64 H new ATOM 0 HB2 TYR B 76 -3.888 1.971 -8.152 1.00 0.70 H new ATOM 0 HB3 TYR B 76 -2.570 1.494 -7.100 1.00 0.70 H new ATOM 0 HD1 TYR B 76 -3.212 0.360 -4.819 1.00 1.80 H new ATOM 0 HD2 TYR B 76 -5.848 0.709 -8.204 1.00 2.04 H new ATOM 0 HE1 TYR B 76 -4.352 -1.741 -4.153 1.00 2.06 H new ATOM 0 HE2 TYR B 76 -6.978 -1.400 -7.541 1.00 2.53 H new ATOM 0 HH TYR B 76 -7.054 -3.088 -6.081 1.00 2.63 H new ATOM 2858 N TRP B 77 -1.876 2.754 -4.828 1.00 0.73 N ATOM 2859 CA TRP B 77 -1.205 2.624 -3.551 1.00 0.75 C ATOM 2860 C TRP B 77 -1.518 3.813 -2.641 1.00 0.72 C ATOM 2861 O TRP B 77 -2.291 3.659 -1.697 1.00 0.63 O ATOM 2862 CB TRP B 77 0.295 2.432 -3.773 1.00 0.90 C ATOM 2863 CG TRP B 77 0.861 1.405 -2.877 1.00 0.87 C ATOM 2864 CD1 TRP B 77 1.230 1.630 -1.606 1.00 0.81 C ATOM 2865 CD2 TRP B 77 1.222 0.028 -3.173 1.00 0.94 C ATOM 2866 NE1 TRP B 77 1.675 0.463 -1.051 1.00 0.82 N ATOM 2867 CE2 TRP B 77 1.782 -0.531 -1.995 1.00 0.90 C ATOM 2868 CE3 TRP B 77 1.227 -0.776 -4.332 1.00 1.06 C ATOM 2869 CZ2 TRP B 77 2.329 -1.813 -1.967 1.00 0.99 C ATOM 2870 CZ3 TRP B 77 1.747 -2.083 -4.291 1.00 1.17 C ATOM 2871 CH2 TRP B 77 2.252 -2.619 -3.104 1.00 1.15 C ATOM 0 H TRP B 77 -1.263 2.577 -5.624 1.00 0.73 H new ATOM 0 HA TRP B 77 -1.579 1.739 -3.036 1.00 0.75 H new ATOM 0 HB2 TRP B 77 0.474 2.147 -4.810 1.00 0.90 H new ATOM 0 HB3 TRP B 77 0.810 3.379 -3.609 1.00 0.90 H new ATOM 0 HD1 TRP B 77 1.183 2.584 -1.101 1.00 0.81 H new ATOM 0 HE1 TRP B 77 1.899 0.345 -0.063 1.00 0.82 H new ATOM 0 HE3 TRP B 77 0.829 -0.386 -5.257 1.00 1.06 H new ATOM 0 HZ2 TRP B 77 2.809 -2.180 -1.072 1.00 0.99 H new ATOM 0 HZ3 TRP B 77 1.756 -2.681 -5.191 1.00 1.17 H new ATOM 0 HH2 TRP B 77 2.580 -3.647 -3.066 1.00 1.15 H new ATOM 2882 N ARG B 78 -0.953 4.993 -2.930 1.00 0.83 N ATOM 2883 CA ARG B 78 -1.205 6.235 -2.213 1.00 0.88 C ATOM 2884 C ARG B 78 -2.687 6.343 -1.803 1.00 0.86 C ATOM 2885 O ARG B 78 -2.968 6.544 -0.622 1.00 0.95 O ATOM 2886 CB ARG B 78 -0.799 7.424 -3.116 1.00 0.98 C ATOM 2887 CG ARG B 78 0.700 7.452 -3.487 1.00 2.09 C ATOM 2888 CD ARG B 78 1.019 8.262 -4.751 1.00 2.16 C ATOM 2889 NE ARG B 78 1.140 9.708 -4.487 1.00 2.48 N ATOM 2890 CZ ARG B 78 2.201 10.492 -4.772 1.00 3.51 C ATOM 2891 NH1 ARG B 78 3.324 10.026 -5.320 1.00 4.28 N ATOM 2892 NH2 ARG B 78 2.165 11.799 -4.502 1.00 4.43 N ATOM 0 H ARG B 78 -0.288 5.105 -3.695 1.00 0.83 H new ATOM 0 HA ARG B 78 -0.611 6.251 -1.299 1.00 0.88 H new ATOM 0 HB2 ARG B 78 -1.388 7.388 -4.032 1.00 0.98 H new ATOM 0 HB3 ARG B 78 -1.054 8.355 -2.609 1.00 0.98 H new ATOM 0 HG2 ARG B 78 1.262 7.868 -2.651 1.00 2.09 H new ATOM 0 HG3 ARG B 78 1.047 6.428 -3.627 1.00 2.09 H new ATOM 0 HD2 ARG B 78 1.950 7.897 -5.186 1.00 2.16 H new ATOM 0 HD3 ARG B 78 0.236 8.096 -5.491 1.00 2.16 H new ATOM 0 HE ARG B 78 0.341 10.161 -4.044 1.00 2.48 H new ATOM 0 HH11 ARG B 78 3.409 9.034 -5.543 1.00 4.28 H new ATOM 0 HH12 ARG B 78 4.098 10.661 -5.516 1.00 4.28 H new ATOM 0 HH21 ARG B 78 1.333 12.210 -4.078 1.00 4.43 H new ATOM 0 HH22 ARG B 78 2.970 12.387 -4.719 1.00 4.43 H new ATOM 2906 N LEU B 79 -3.638 6.150 -2.729 1.00 0.78 N ATOM 2907 CA LEU B 79 -5.057 6.305 -2.403 1.00 0.83 C ATOM 2908 C LEU B 79 -5.591 5.217 -1.461 1.00 0.69 C ATOM 2909 O LEU B 79 -6.397 5.536 -0.589 1.00 0.70 O ATOM 2910 CB LEU B 79 -5.949 6.459 -3.647 1.00 0.89 C ATOM 2911 CG LEU B 79 -5.985 7.914 -4.153 1.00 1.35 C ATOM 2912 CD1 LEU B 79 -4.616 8.502 -4.512 1.00 1.56 C ATOM 2913 CD2 LEU B 79 -6.880 8.004 -5.390 1.00 1.70 C ATOM 0 H LEU B 79 -3.450 5.890 -3.697 1.00 0.78 H new ATOM 0 HA LEU B 79 -5.112 7.245 -1.854 1.00 0.83 H new ATOM 0 HB2 LEU B 79 -5.581 5.808 -4.440 1.00 0.89 H new ATOM 0 HB3 LEU B 79 -6.961 6.132 -3.410 1.00 0.89 H new ATOM 0 HG LEU B 79 -6.372 8.500 -3.319 1.00 1.35 H new ATOM 0 HD11 LEU B 79 -4.740 9.528 -4.858 1.00 1.56 H new ATOM 0 HD12 LEU B 79 -3.973 8.491 -3.632 1.00 1.56 H new ATOM 0 HD13 LEU B 79 -4.160 7.906 -5.302 1.00 1.56 H new ATOM 0 HD21 LEU B 79 -6.905 9.034 -5.747 1.00 1.70 H new ATOM 0 HD22 LEU B 79 -6.484 7.358 -6.173 1.00 1.70 H new ATOM 0 HD23 LEU B 79 -7.890 7.685 -5.132 1.00 1.70 H new ATOM 2925 N ILE B 80 -5.203 3.941 -1.579 1.00 0.59 N ATOM 2926 CA ILE B 80 -5.628 3.007 -0.523 1.00 0.57 C ATOM 2927 C ILE B 80 -4.886 3.322 0.787 1.00 0.59 C ATOM 2928 O ILE B 80 -5.372 3.027 1.879 1.00 0.65 O ATOM 2929 CB ILE B 80 -5.573 1.514 -0.923 1.00 0.55 C ATOM 2930 CG1 ILE B 80 -4.183 0.923 -0.681 1.00 0.66 C ATOM 2931 CG2 ILE B 80 -6.022 1.280 -2.366 1.00 0.60 C ATOM 2932 CD1 ILE B 80 -4.042 -0.580 -0.908 1.00 0.58 C ATOM 0 H ILE B 80 -4.638 3.550 -2.333 1.00 0.59 H new ATOM 0 HA ILE B 80 -6.693 3.174 -0.359 1.00 0.57 H new ATOM 0 HB ILE B 80 -6.282 0.993 -0.279 1.00 0.55 H new ATOM 0 HG12 ILE B 80 -3.474 1.436 -1.331 1.00 0.66 H new ATOM 0 HG13 ILE B 80 -3.891 1.144 0.346 1.00 0.66 H new ATOM 0 HG21 ILE B 80 -5.965 0.216 -2.597 1.00 0.60 H new ATOM 0 HG22 ILE B 80 -7.049 1.623 -2.488 1.00 0.60 H new ATOM 0 HG23 ILE B 80 -5.372 1.834 -3.044 1.00 0.60 H new ATOM 0 HD11 ILE B 80 -3.015 -0.884 -0.706 1.00 0.58 H new ATOM 0 HD12 ILE B 80 -4.717 -1.114 -0.239 1.00 0.58 H new ATOM 0 HD13 ILE B 80 -4.294 -0.817 -1.942 1.00 0.58 H new ATOM 2944 N GLY B 81 -3.717 3.961 0.701 1.00 0.60 N ATOM 2945 CA GLY B 81 -3.072 4.539 1.857 1.00 0.66 C ATOM 2946 C GLY B 81 -3.972 5.578 2.517 1.00 0.70 C ATOM 2947 O GLY B 81 -4.183 5.570 3.724 1.00 0.73 O ATOM 0 H GLY B 81 -3.203 4.086 -0.171 1.00 0.60 H new ATOM 0 HA2 GLY B 81 -2.829 3.754 2.573 1.00 0.66 H new ATOM 0 HA3 GLY B 81 -2.131 5.002 1.560 1.00 0.66 H new ATOM 2951 N GLU B 82 -4.560 6.434 1.694 1.00 0.73 N ATOM 2952 CA GLU B 82 -5.602 7.335 2.132 1.00 0.78 C ATOM 2953 C GLU B 82 -6.784 6.547 2.714 1.00 0.75 C ATOM 2954 O GLU B 82 -7.237 6.907 3.794 1.00 0.82 O ATOM 2955 CB GLU B 82 -5.999 8.286 1.008 1.00 0.86 C ATOM 2956 CG GLU B 82 -4.851 9.243 0.653 1.00 0.95 C ATOM 2957 CD GLU B 82 -5.170 10.039 -0.605 1.00 1.70 C ATOM 2958 OE1 GLU B 82 -6.322 10.518 -0.687 1.00 2.37 O ATOM 2959 OE2 GLU B 82 -4.264 10.117 -1.463 1.00 2.90 O ATOM 0 H GLU B 82 -4.324 6.519 0.705 1.00 0.73 H new ATOM 0 HA GLU B 82 -5.224 7.962 2.940 1.00 0.78 H new ATOM 0 HB2 GLU B 82 -6.282 7.711 0.126 1.00 0.86 H new ATOM 0 HB3 GLU B 82 -6.875 8.861 1.308 1.00 0.86 H new ATOM 0 HG2 GLU B 82 -4.673 9.926 1.484 1.00 0.95 H new ATOM 0 HG3 GLU B 82 -3.933 8.675 0.505 1.00 0.95 H new ATOM 2966 N LEU B 83 -7.201 5.423 2.111 1.00 0.75 N ATOM 2967 CA LEU B 83 -8.178 4.542 2.762 1.00 0.86 C ATOM 2968 C LEU B 83 -7.737 4.184 4.182 1.00 0.98 C ATOM 2969 O LEU B 83 -8.522 4.365 5.108 1.00 1.12 O ATOM 2970 CB LEU B 83 -8.568 3.291 1.953 1.00 0.94 C ATOM 2971 CG LEU B 83 -9.508 3.589 0.776 1.00 1.34 C ATOM 2972 CD1 LEU B 83 -9.601 2.367 -0.145 1.00 2.14 C ATOM 2973 CD2 LEU B 83 -10.929 3.890 1.271 1.00 2.07 C ATOM 0 H LEU B 83 -6.884 5.109 1.194 1.00 0.75 H new ATOM 0 HA LEU B 83 -9.096 5.127 2.815 1.00 0.86 H new ATOM 0 HB2 LEU B 83 -7.663 2.817 1.573 1.00 0.94 H new ATOM 0 HB3 LEU B 83 -9.048 2.573 2.618 1.00 0.94 H new ATOM 0 HG LEU B 83 -9.102 4.451 0.247 1.00 1.34 H new ATOM 0 HD11 LEU B 83 -10.270 2.588 -0.977 1.00 2.14 H new ATOM 0 HD12 LEU B 83 -8.610 2.126 -0.530 1.00 2.14 H new ATOM 0 HD13 LEU B 83 -9.989 1.517 0.416 1.00 2.14 H new ATOM 0 HD21 LEU B 83 -11.575 4.098 0.418 1.00 2.07 H new ATOM 0 HD22 LEU B 83 -11.314 3.029 1.817 1.00 2.07 H new ATOM 0 HD23 LEU B 83 -10.908 4.758 1.930 1.00 2.07 H new ATOM 2985 N ALA B 84 -6.497 3.723 4.395 1.00 0.97 N ATOM 2986 CA ALA B 84 -6.004 3.536 5.760 1.00 1.13 C ATOM 2987 C ALA B 84 -6.160 4.793 6.646 1.00 1.26 C ATOM 2988 O ALA B 84 -6.391 4.660 7.847 1.00 1.49 O ATOM 2989 CB ALA B 84 -4.561 3.021 5.749 1.00 1.10 C ATOM 0 H ALA B 84 -5.834 3.479 3.659 1.00 0.97 H new ATOM 0 HA ALA B 84 -6.636 2.777 6.220 1.00 1.13 H new ATOM 0 HB1 ALA B 84 -4.214 2.889 6.774 1.00 1.10 H new ATOM 0 HB2 ALA B 84 -4.520 2.066 5.226 1.00 1.10 H new ATOM 0 HB3 ALA B 84 -3.921 3.742 5.239 1.00 1.10 H new ATOM 2995 N LYS B 85 -6.038 6.005 6.087 1.00 1.23 N ATOM 2996 CA LYS B 85 -6.259 7.255 6.821 1.00 1.50 C ATOM 2997 C LYS B 85 -7.740 7.455 7.177 1.00 1.53 C ATOM 2998 O LYS B 85 -8.060 7.779 8.318 1.00 1.80 O ATOM 2999 CB LYS B 85 -5.721 8.466 6.029 1.00 1.60 C ATOM 3000 CG LYS B 85 -5.415 9.663 6.949 1.00 1.80 C ATOM 3001 CD LYS B 85 -5.841 11.015 6.354 1.00 1.79 C ATOM 3002 CE LYS B 85 -4.954 11.477 5.188 1.00 2.21 C ATOM 3003 NZ LYS B 85 -5.505 12.688 4.547 1.00 2.96 N ATOM 0 H LYS B 85 -5.782 6.145 5.109 1.00 1.23 H new ATOM 0 HA LYS B 85 -5.703 7.181 7.756 1.00 1.50 H new ATOM 0 HB2 LYS B 85 -4.816 8.178 5.495 1.00 1.60 H new ATOM 0 HB3 LYS B 85 -6.453 8.763 5.278 1.00 1.60 H new ATOM 0 HG2 LYS B 85 -5.923 9.518 7.903 1.00 1.80 H new ATOM 0 HG3 LYS B 85 -4.345 9.687 7.158 1.00 1.80 H new ATOM 0 HD2 LYS B 85 -6.872 10.943 6.009 1.00 1.79 H new ATOM 0 HD3 LYS B 85 -5.820 11.771 7.139 1.00 1.79 H new ATOM 0 HE2 LYS B 85 -3.947 11.681 5.552 1.00 2.21 H new ATOM 0 HE3 LYS B 85 -4.871 10.678 4.451 1.00 2.21 H new ATOM 0 HZ1 LYS B 85 -4.886 12.978 3.763 1.00 2.96 H new ATOM 0 HZ2 LYS B 85 -6.456 12.484 4.180 1.00 2.96 H new ATOM 0 HZ3 LYS B 85 -5.561 13.456 5.246 1.00 2.96 H new ATOM 3017 N GLU B 86 -8.624 7.306 6.191 1.00 1.31 N ATOM 3018 CA GLU B 86 -10.076 7.354 6.320 1.00 1.33 C ATOM 3019 C GLU B 86 -10.543 6.229 7.253 1.00 1.40 C ATOM 3020 O GLU B 86 -10.890 6.456 8.414 1.00 1.59 O ATOM 3021 CB GLU B 86 -10.659 7.168 4.915 1.00 1.24 C ATOM 3022 CG GLU B 86 -10.574 8.454 4.078 1.00 1.45 C ATOM 3023 CD GLU B 86 -10.590 8.135 2.593 1.00 1.48 C ATOM 3024 OE1 GLU B 86 -9.711 7.379 2.131 1.00 2.43 O ATOM 3025 OE2 GLU B 86 -11.486 8.624 1.878 1.00 2.26 O ATOM 0 H GLU B 86 -8.328 7.140 5.229 1.00 1.31 H new ATOM 0 HA GLU B 86 -10.408 8.302 6.744 1.00 1.33 H new ATOM 0 HB2 GLU B 86 -10.124 6.368 4.404 1.00 1.24 H new ATOM 0 HB3 GLU B 86 -11.700 6.856 4.994 1.00 1.24 H new ATOM 0 HG2 GLU B 86 -11.411 9.108 4.323 1.00 1.45 H new ATOM 0 HG3 GLU B 86 -9.662 8.996 4.328 1.00 1.45 H new ATOM 3032 N ILE B 87 -10.607 5.005 6.725 1.00 1.28 N ATOM 3033 CA ILE B 87 -11.030 3.828 7.457 1.00 1.36 C ATOM 3034 C ILE B 87 -9.839 3.282 8.248 1.00 1.53 C ATOM 3035 O ILE B 87 -9.109 2.398 7.801 1.00 1.29 O ATOM 3036 CB ILE B 87 -11.738 2.809 6.539 1.00 1.26 C ATOM 3037 CG1 ILE B 87 -12.118 1.517 7.284 1.00 1.72 C ATOM 3038 CG2 ILE B 87 -10.960 2.462 5.259 1.00 1.83 C ATOM 3039 CD1 ILE B 87 -12.766 1.783 8.648 1.00 2.10 C ATOM 0 H ILE B 87 -10.359 4.809 5.755 1.00 1.28 H new ATOM 0 HA ILE B 87 -11.797 4.085 8.188 1.00 1.36 H new ATOM 0 HB ILE B 87 -12.648 3.322 6.227 1.00 1.26 H new ATOM 0 HG12 ILE B 87 -12.805 0.937 6.668 1.00 1.72 H new ATOM 0 HG13 ILE B 87 -11.225 0.908 7.424 1.00 1.72 H new ATOM 0 HG21 ILE B 87 -11.528 1.740 4.672 1.00 1.83 H new ATOM 0 HG22 ILE B 87 -10.805 3.367 4.671 1.00 1.83 H new ATOM 0 HG23 ILE B 87 -9.994 2.033 5.525 1.00 1.83 H new ATOM 0 HD11 ILE B 87 -13.012 0.834 9.125 1.00 2.10 H new ATOM 0 HD12 ILE B 87 -12.071 2.337 9.279 1.00 2.10 H new ATOM 0 HD13 ILE B 87 -13.676 2.367 8.511 1.00 2.10 H new ATOM 3051 N ARG B 88 -9.688 3.772 9.479 1.00 2.10 N ATOM 3052 CA ARG B 88 -8.573 3.425 10.348 1.00 2.42 C ATOM 3053 C ARG B 88 -8.854 2.072 11.006 1.00 2.20 C ATOM 3054 O ARG B 88 -9.005 1.975 12.221 1.00 2.75 O ATOM 3055 CB ARG B 88 -8.391 4.527 11.403 1.00 3.12 C ATOM 3056 CG ARG B 88 -8.049 5.874 10.754 1.00 3.90 C ATOM 3057 CD ARG B 88 -8.076 7.019 11.771 1.00 4.07 C ATOM 3058 NE ARG B 88 -7.093 6.814 12.848 1.00 4.84 N ATOM 3059 CZ ARG B 88 -7.036 7.535 13.979 1.00 5.37 C ATOM 3060 NH1 ARG B 88 -7.876 8.559 14.158 1.00 5.31 N ATOM 3061 NH2 ARG B 88 -6.140 7.228 14.925 1.00 6.55 N ATOM 0 H ARG B 88 -10.346 4.428 9.901 1.00 2.10 H new ATOM 0 HA ARG B 88 -7.651 3.346 9.772 1.00 2.42 H new ATOM 0 HB2 ARG B 88 -9.305 4.626 11.989 1.00 3.12 H new ATOM 0 HB3 ARG B 88 -7.598 4.243 12.094 1.00 3.12 H new ATOM 0 HG2 ARG B 88 -7.061 5.817 10.297 1.00 3.90 H new ATOM 0 HG3 ARG B 88 -8.759 6.082 9.953 1.00 3.90 H new ATOM 0 HD2 ARG B 88 -7.869 7.961 11.264 1.00 4.07 H new ATOM 0 HD3 ARG B 88 -9.075 7.101 12.200 1.00 4.07 H new ATOM 0 HE ARG B 88 -6.406 6.070 12.726 1.00 4.84 H new ATOM 0 HH11 ARG B 88 -8.558 8.791 13.436 1.00 5.31 H new ATOM 0 HH12 ARG B 88 -7.835 9.108 15.016 1.00 5.31 H new ATOM 0 HH21 ARG B 88 -5.500 6.446 14.787 1.00 6.55 H new ATOM 0 HH22 ARG B 88 -6.097 7.776 15.784 1.00 6.55 H new ATOM 3075 N LYS B 89 -8.908 1.019 10.187 1.00 1.56 N ATOM 3076 CA LYS B 89 -9.231 -0.336 10.618 1.00 1.31 C ATOM 3077 C LYS B 89 -8.192 -0.929 11.580 1.00 1.88 C ATOM 3078 O LYS B 89 -8.493 -1.938 12.208 1.00 1.85 O ATOM 3079 CB LYS B 89 -9.535 -1.239 9.409 1.00 1.46 C ATOM 3080 CG LYS B 89 -8.316 -1.555 8.528 1.00 1.38 C ATOM 3081 CD LYS B 89 -8.597 -1.338 7.029 1.00 1.79 C ATOM 3082 CE LYS B 89 -9.610 -2.324 6.415 1.00 2.67 C ATOM 3083 NZ LYS B 89 -9.006 -3.571 5.889 1.00 3.59 N ATOM 0 H LYS B 89 -8.724 1.090 9.186 1.00 1.56 H new ATOM 0 HA LYS B 89 -10.144 -0.279 11.210 1.00 1.31 H new ATOM 0 HB2 LYS B 89 -9.960 -2.176 9.769 1.00 1.46 H new ATOM 0 HB3 LYS B 89 -10.297 -0.759 8.795 1.00 1.46 H new ATOM 0 HG2 LYS B 89 -7.480 -0.926 8.832 1.00 1.38 H new ATOM 0 HG3 LYS B 89 -8.013 -2.589 8.691 1.00 1.38 H new ATOM 0 HD2 LYS B 89 -8.966 -0.323 6.886 1.00 1.79 H new ATOM 0 HD3 LYS B 89 -7.657 -1.416 6.482 1.00 1.79 H new ATOM 0 HE2 LYS B 89 -10.350 -2.584 7.171 1.00 2.67 H new ATOM 0 HE3 LYS B 89 -10.143 -1.823 5.607 1.00 2.67 H new ATOM 0 HZ1 LYS B 89 -9.723 -4.324 5.874 1.00 3.59 H new ATOM 0 HZ2 LYS B 89 -8.656 -3.407 4.924 1.00 3.59 H new ATOM 0 HZ3 LYS B 89 -8.215 -3.858 6.500 1.00 3.59 H new ATOM 3097 N LYS B 90 -6.981 -0.350 11.648 1.00 2.61 N ATOM 3098 CA LYS B 90 -5.843 -0.759 12.481 1.00 3.46 C ATOM 3099 C LYS B 90 -6.211 -0.904 13.974 1.00 2.62 C ATOM 3100 O LYS B 90 -5.750 -0.120 14.801 1.00 2.65 O ATOM 3101 CB LYS B 90 -4.694 0.261 12.270 1.00 5.04 C ATOM 3102 CG LYS B 90 -3.356 -0.169 12.908 1.00 6.37 C ATOM 3103 CD LYS B 90 -2.233 0.880 12.800 1.00 7.98 C ATOM 3104 CE LYS B 90 -2.547 2.186 13.554 1.00 8.39 C ATOM 3105 NZ LYS B 90 -1.330 2.983 13.824 1.00 10.11 N ATOM 0 H LYS B 90 -6.759 0.470 11.084 1.00 2.61 H new ATOM 0 HA LYS B 90 -5.522 -1.753 12.170 1.00 3.46 H new ATOM 0 HB2 LYS B 90 -4.545 0.410 11.201 1.00 5.04 H new ATOM 0 HB3 LYS B 90 -4.993 1.223 12.687 1.00 5.04 H new ATOM 0 HG2 LYS B 90 -3.526 -0.395 13.961 1.00 6.37 H new ATOM 0 HG3 LYS B 90 -3.021 -1.092 12.434 1.00 6.37 H new ATOM 0 HD2 LYS B 90 -1.309 0.455 13.192 1.00 7.98 H new ATOM 0 HD3 LYS B 90 -2.058 1.108 11.749 1.00 7.98 H new ATOM 0 HE2 LYS B 90 -3.247 2.782 12.968 1.00 8.39 H new ATOM 0 HE3 LYS B 90 -3.041 1.949 14.497 1.00 8.39 H new ATOM 0 HZ1 LYS B 90 -1.590 3.983 13.946 1.00 10.11 H new ATOM 0 HZ2 LYS B 90 -0.873 2.635 14.691 1.00 10.11 H new ATOM 0 HZ3 LYS B 90 -0.671 2.892 13.025 1.00 10.11 H new ATOM 3119 N LYS B 91 -6.988 -1.935 14.317 1.00 2.40 N ATOM 3120 CA LYS B 91 -7.349 -2.351 15.662 1.00 2.45 C ATOM 3121 C LYS B 91 -8.147 -3.661 15.590 1.00 2.37 C ATOM 3122 O LYS B 91 -7.697 -4.672 16.121 1.00 2.87 O ATOM 3123 CB LYS B 91 -8.166 -1.254 16.375 1.00 3.04 C ATOM 3124 CG LYS B 91 -8.394 -1.599 17.854 1.00 3.48 C ATOM 3125 CD LYS B 91 -9.290 -0.539 18.510 1.00 4.09 C ATOM 3126 CE LYS B 91 -9.669 -0.942 19.946 1.00 4.60 C ATOM 3127 NZ LYS B 91 -11.043 -1.483 20.018 1.00 4.97 N ATOM 0 H LYS B 91 -7.407 -2.538 13.609 1.00 2.40 H new ATOM 0 HA LYS B 91 -6.440 -2.515 16.241 1.00 2.45 H new ATOM 0 HB2 LYS B 91 -7.643 -0.301 16.298 1.00 3.04 H new ATOM 0 HB3 LYS B 91 -9.127 -1.131 15.876 1.00 3.04 H new ATOM 0 HG2 LYS B 91 -8.858 -2.582 17.939 1.00 3.48 H new ATOM 0 HG3 LYS B 91 -7.438 -1.651 18.375 1.00 3.48 H new ATOM 0 HD2 LYS B 91 -8.773 0.420 18.523 1.00 4.09 H new ATOM 0 HD3 LYS B 91 -10.194 -0.405 17.916 1.00 4.09 H new ATOM 0 HE2 LYS B 91 -8.964 -1.689 20.312 1.00 4.60 H new ATOM 0 HE3 LYS B 91 -9.584 -0.075 20.601 1.00 4.60 H new ATOM 0 HZ1 LYS B 91 -11.244 -1.791 20.991 1.00 4.97 H new ATOM 0 HZ2 LYS B 91 -11.722 -0.745 19.741 1.00 4.97 H new ATOM 0 HZ3 LYS B 91 -11.131 -2.294 19.373 1.00 4.97 H new ATOM 3141 N ASP B 92 -9.318 -3.638 14.937 1.00 2.16 N ATOM 3142 CA ASP B 92 -10.335 -4.684 15.024 1.00 2.31 C ATOM 3143 C ASP B 92 -10.926 -4.932 13.632 1.00 1.80 C ATOM 3144 O ASP B 92 -11.901 -4.288 13.263 1.00 2.32 O ATOM 3145 CB ASP B 92 -11.481 -4.250 15.963 1.00 3.06 C ATOM 3146 CG ASP B 92 -11.088 -3.975 17.404 1.00 4.11 C ATOM 3147 OD1 ASP B 92 -10.429 -4.832 18.021 1.00 4.75 O ATOM 3148 OD2 ASP B 92 -11.468 -2.888 17.894 1.00 4.92 O ATOM 0 H ASP B 92 -9.586 -2.871 14.320 1.00 2.16 H new ATOM 0 HA ASP B 92 -9.867 -5.588 15.413 1.00 2.31 H new ATOM 0 HB2 ASP B 92 -11.940 -3.350 15.553 1.00 3.06 H new ATOM 0 HB3 ASP B 92 -12.245 -5.028 15.957 1.00 3.06 H new ATOM 3153 N LEU B 93 -10.356 -5.853 12.852 1.00 1.39 N ATOM 3154 CA LEU B 93 -10.876 -6.178 11.522 1.00 1.15 C ATOM 3155 C LEU B 93 -12.067 -7.124 11.610 1.00 1.04 C ATOM 3156 O LEU B 93 -13.165 -6.801 11.160 1.00 1.11 O ATOM 3157 CB LEU B 93 -9.776 -6.806 10.654 1.00 1.86 C ATOM 3158 CG LEU B 93 -8.908 -5.771 9.935 1.00 1.29 C ATOM 3159 CD1 LEU B 93 -9.733 -5.023 8.883 1.00 2.54 C ATOM 3160 CD2 LEU B 93 -8.239 -4.798 10.906 1.00 2.93 C ATOM 0 H LEU B 93 -9.531 -6.389 13.120 1.00 1.39 H new ATOM 0 HA LEU B 93 -11.209 -5.248 11.061 1.00 1.15 H new ATOM 0 HB2 LEU B 93 -9.140 -7.431 11.281 1.00 1.86 H new ATOM 0 HB3 LEU B 93 -10.236 -7.461 9.914 1.00 1.86 H new ATOM 0 HG LEU B 93 -8.105 -6.310 9.432 1.00 1.29 H new ATOM 0 HD11 LEU B 93 -9.102 -4.290 8.380 1.00 2.54 H new ATOM 0 HD12 LEU B 93 -10.119 -5.733 8.151 1.00 2.54 H new ATOM 0 HD13 LEU B 93 -10.565 -4.513 9.368 1.00 2.54 H new ATOM 0 HD21 LEU B 93 -7.634 -4.084 10.347 1.00 2.93 H new ATOM 0 HD22 LEU B 93 -9.003 -4.263 11.470 1.00 2.93 H new ATOM 0 HD23 LEU B 93 -7.601 -5.352 11.595 1.00 2.93 H new ATOM 3172 N LYS B 94 -11.849 -8.312 12.184 1.00 1.25 N ATOM 3173 CA LYS B 94 -12.816 -9.402 12.136 1.00 1.48 C ATOM 3174 C LYS B 94 -14.176 -9.026 12.735 1.00 1.56 C ATOM 3175 O LYS B 94 -15.176 -9.714 12.526 1.00 1.85 O ATOM 3176 CB LYS B 94 -12.208 -10.701 12.681 1.00 1.97 C ATOM 3177 CG LYS B 94 -12.175 -10.853 14.205 1.00 3.76 C ATOM 3178 CD LYS B 94 -13.401 -11.644 14.685 1.00 5.41 C ATOM 3179 CE LYS B 94 -13.337 -11.856 16.202 1.00 7.01 C ATOM 3180 NZ LYS B 94 -14.505 -12.611 16.700 1.00 8.65 N ATOM 0 H LYS B 94 -10.996 -8.540 12.694 1.00 1.25 H new ATOM 0 HA LYS B 94 -13.048 -9.599 11.089 1.00 1.48 H new ATOM 0 HB2 LYS B 94 -12.767 -11.540 12.266 1.00 1.97 H new ATOM 0 HB3 LYS B 94 -11.187 -10.783 12.308 1.00 1.97 H new ATOM 0 HG2 LYS B 94 -11.261 -11.365 14.507 1.00 3.76 H new ATOM 0 HG3 LYS B 94 -12.160 -9.870 14.676 1.00 3.76 H new ATOM 0 HD2 LYS B 94 -14.313 -11.108 14.424 1.00 5.41 H new ATOM 0 HD3 LYS B 94 -13.442 -12.608 14.178 1.00 5.41 H new ATOM 0 HE2 LYS B 94 -12.423 -12.392 16.456 1.00 7.01 H new ATOM 0 HE3 LYS B 94 -13.289 -10.889 16.703 1.00 7.01 H new ATOM 0 HZ1 LYS B 94 -14.425 -12.734 17.730 1.00 8.65 H new ATOM 0 HZ2 LYS B 94 -15.376 -12.087 16.480 1.00 8.65 H new ATOM 0 HZ3 LYS B 94 -14.537 -13.544 16.241 1.00 8.65 H new ATOM 3194 N ILE B 95 -14.221 -7.961 13.538 1.00 1.54 N ATOM 3195 CA ILE B 95 -15.458 -7.431 14.066 1.00 1.88 C ATOM 3196 C ILE B 95 -16.419 -6.942 12.974 1.00 1.97 C ATOM 3197 O ILE B 95 -17.626 -6.999 13.195 1.00 2.35 O ATOM 3198 CB ILE B 95 -15.125 -6.344 15.102 1.00 2.00 C ATOM 3199 CG1 ILE B 95 -16.222 -6.251 16.169 1.00 2.85 C ATOM 3200 CG2 ILE B 95 -14.881 -4.984 14.430 1.00 3.06 C ATOM 3201 CD1 ILE B 95 -15.743 -5.403 17.349 1.00 3.54 C ATOM 0 H ILE B 95 -13.392 -7.447 13.835 1.00 1.54 H new ATOM 0 HA ILE B 95 -16.003 -8.236 14.559 1.00 1.88 H new ATOM 0 HB ILE B 95 -14.198 -6.631 15.599 1.00 2.00 H new ATOM 0 HG12 ILE B 95 -17.122 -5.812 15.738 1.00 2.85 H new ATOM 0 HG13 ILE B 95 -16.489 -7.250 16.514 1.00 2.85 H new ATOM 0 HG21 ILE B 95 -14.648 -4.239 15.191 1.00 3.06 H new ATOM 0 HG22 ILE B 95 -14.045 -5.066 13.735 1.00 3.06 H new ATOM 0 HG23 ILE B 95 -15.776 -4.681 13.887 1.00 3.06 H new ATOM 0 HD11 ILE B 95 -16.532 -5.345 18.099 1.00 3.54 H new ATOM 0 HD12 ILE B 95 -14.856 -5.860 17.789 1.00 3.54 H new ATOM 0 HD13 ILE B 95 -15.499 -4.399 17.001 1.00 3.54 H new ATOM 3213 N ARG B 96 -15.905 -6.529 11.808 1.00 1.67 N ATOM 3214 CA ARG B 96 -16.674 -6.139 10.626 1.00 1.82 C ATOM 3215 C ARG B 96 -17.504 -4.866 10.849 1.00 2.24 C ATOM 3216 O ARG B 96 -17.463 -4.248 11.910 1.00 3.24 O ATOM 3217 CB ARG B 96 -17.576 -7.282 10.132 1.00 2.07 C ATOM 3218 CG ARG B 96 -16.880 -8.646 10.024 1.00 2.14 C ATOM 3219 CD ARG B 96 -17.706 -9.823 10.571 1.00 2.91 C ATOM 3220 NE ARG B 96 -18.198 -9.560 11.929 1.00 4.32 N ATOM 3221 CZ ARG B 96 -19.473 -9.285 12.247 1.00 4.84 C ATOM 3222 NH1 ARG B 96 -20.489 -9.678 11.481 1.00 4.21 N ATOM 3223 NH2 ARG B 96 -19.744 -8.541 13.317 1.00 6.53 N ATOM 0 H ARG B 96 -14.899 -6.456 11.660 1.00 1.67 H new ATOM 0 HA ARG B 96 -15.938 -5.917 9.853 1.00 1.82 H new ATOM 0 HB2 ARG B 96 -18.425 -7.375 10.809 1.00 2.07 H new ATOM 0 HB3 ARG B 96 -17.976 -7.015 9.154 1.00 2.07 H new ATOM 0 HG2 ARG B 96 -16.644 -8.838 8.977 1.00 2.14 H new ATOM 0 HG3 ARG B 96 -15.933 -8.601 10.562 1.00 2.14 H new ATOM 0 HD2 ARG B 96 -18.551 -10.013 9.909 1.00 2.91 H new ATOM 0 HD3 ARG B 96 -17.095 -10.725 10.574 1.00 2.91 H new ATOM 0 HE ARG B 96 -17.519 -9.588 12.689 1.00 4.32 H new ATOM 0 HH11 ARG B 96 -20.309 -10.204 10.626 1.00 4.21 H new ATOM 0 HH12 ARG B 96 -21.447 -9.453 11.750 1.00 4.21 H new ATOM 0 HH21 ARG B 96 -18.984 -8.181 13.894 1.00 6.53 H new ATOM 0 HH22 ARG B 96 -20.712 -8.331 13.560 1.00 6.53 H new ATOM 3237 N LYS B 97 -18.279 -4.491 9.825 1.00 2.49 N ATOM 3238 CA LYS B 97 -19.177 -3.345 9.840 1.00 3.00 C ATOM 3239 C LYS B 97 -20.297 -3.572 10.861 1.00 2.96 C ATOM 3240 O LYS B 97 -20.556 -2.718 11.706 1.00 3.38 O ATOM 3241 CB LYS B 97 -19.705 -3.140 8.409 1.00 3.75 C ATOM 3242 CG LYS B 97 -20.323 -1.756 8.171 1.00 4.58 C ATOM 3243 CD LYS B 97 -20.355 -1.475 6.659 1.00 5.83 C ATOM 3244 CE LYS B 97 -20.954 -0.099 6.333 1.00 6.87 C ATOM 3245 NZ LYS B 97 -20.485 0.416 5.026 1.00 8.29 N ATOM 0 H LYS B 97 -18.294 -4.996 8.939 1.00 2.49 H new ATOM 0 HA LYS B 97 -18.659 -2.437 10.150 1.00 3.00 H new ATOM 0 HB2 LYS B 97 -18.886 -3.288 7.705 1.00 3.75 H new ATOM 0 HB3 LYS B 97 -20.453 -3.904 8.194 1.00 3.75 H new ATOM 0 HG2 LYS B 97 -21.332 -1.718 8.582 1.00 4.58 H new ATOM 0 HG3 LYS B 97 -19.741 -0.990 8.684 1.00 4.58 H new ATOM 0 HD2 LYS B 97 -19.342 -1.531 6.260 1.00 5.83 H new ATOM 0 HD3 LYS B 97 -20.938 -2.250 6.160 1.00 5.83 H new ATOM 0 HE2 LYS B 97 -22.042 -0.170 6.325 1.00 6.87 H new ATOM 0 HE3 LYS B 97 -20.686 0.608 7.118 1.00 6.87 H new ATOM 0 HZ1 LYS B 97 -21.014 1.278 4.783 1.00 8.29 H new ATOM 0 HZ2 LYS B 97 -19.470 0.637 5.084 1.00 8.29 H new ATOM 0 HZ3 LYS B 97 -20.641 -0.305 4.293 1.00 8.29 H new ATOM 3259 N LYS B 98 -20.951 -4.733 10.770 1.00 3.18 N ATOM 3260 CA LYS B 98 -21.781 -5.352 11.786 1.00 3.90 C ATOM 3261 C LYS B 98 -21.662 -6.848 11.504 1.00 4.44 C ATOM 3262 O LYS B 98 -22.006 -7.668 12.387 1.00 5.31 O ATOM 3263 CB LYS B 98 -23.246 -4.901 11.702 1.00 4.79 C ATOM 3264 CG LYS B 98 -23.431 -3.444 12.137 1.00 5.83 C ATOM 3265 CD LYS B 98 -24.908 -3.153 12.424 1.00 7.00 C ATOM 3266 CE LYS B 98 -25.078 -1.702 12.898 1.00 8.33 C ATOM 3267 NZ LYS B 98 -26.479 -1.395 13.255 1.00 9.47 N ATOM 3268 OXT LYS B 98 -21.148 -7.185 10.415 1.00 4.69 O ATOM 0 H LYS B 98 -20.906 -5.298 9.922 1.00 3.18 H new ATOM 0 HA LYS B 98 -21.456 -5.075 12.789 1.00 3.90 H new ATOM 0 HB2 LYS B 98 -23.603 -5.021 10.679 1.00 4.79 H new ATOM 0 HB3 LYS B 98 -23.859 -5.546 12.331 1.00 4.79 H new ATOM 0 HG2 LYS B 98 -22.835 -3.246 13.028 1.00 5.83 H new ATOM 0 HG3 LYS B 98 -23.068 -2.776 11.356 1.00 5.83 H new ATOM 0 HD2 LYS B 98 -25.501 -3.322 11.525 1.00 7.00 H new ATOM 0 HD3 LYS B 98 -25.280 -3.838 13.185 1.00 7.00 H new ATOM 0 HE2 LYS B 98 -24.437 -1.526 13.762 1.00 8.33 H new ATOM 0 HE3 LYS B 98 -24.747 -1.023 12.112 1.00 8.33 H new ATOM 0 HZ1 LYS B 98 -26.548 -0.406 13.569 1.00 9.47 H new ATOM 0 HZ2 LYS B 98 -27.088 -1.538 12.424 1.00 9.47 H new ATOM 0 HZ3 LYS B 98 -26.788 -2.025 14.023 1.00 9.47 H new TER 3282 LYS B 98