USER MOD reduce.3.24.130724 H: found=0, std=0, add=732, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 730 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 84 GLN : amide:sc= 0.805 K(o=0.81,f=-1) USER MOD Set 1.2: A 122 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0998) USER MOD Set 2.1: A 112 THR OG1 : rot 66:sc= 1.04 USER MOD Set 2.2: A 116 ASN : amide:sc= -0.408 K(o=0.64,f=-0.16) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 61 LYS NZ :NH3+ -155:sc= 1.15 (180deg=0.708) USER MOD Single : A 62 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= 0.693 K(o=0.69,f=-1.3) USER MOD Single : A 77 TYR OH : rot 170:sc= 1.27 USER MOD Single : A 78 TYR OH : rot 30:sc= -0.43 USER MOD Single : A 81 ASN : amide:sc= -0.396 X(o=-0.4,f=0) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 HIS : no HE2:sc= -0.186 K(o=-0.19,f=-3.5!) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 95 SER OG : rot 87:sc= 1.3 USER MOD Single : A 98 ASN : amide:sc= -0.0221 X(o=-0.022,f=-0.047) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0.356 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 150:sc= 0.319 USER MOD Single : A 110 ASN : amide:sc= 1.01 K(o=1,f=0) USER MOD Single : A 113 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 GLN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 121 GLN : amide:sc= 0.856 K(o=0.86,f=0) USER MOD Single : A 125 ASN : amide:sc=-0.000359 X(o=-0.00036,f=-0.00036) USER MOD Single : A 126 LYS NZ :NH3+ 164:sc= -0.216 (180deg=-0.824) USER MOD Single : A 128 HIS : no HD1:sc= -0.274 X(o=-0.27,f=-0.16) USER MOD Single : A 129 GLN : amide:sc= 0.88 K(o=0.88,f=-0.55) USER MOD Single : A 130 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 GLN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 141 SER OG : rot -130:sc= 0 USER MOD Single : A 143 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.133) USER MOD Single : A 144 HIS : no HD1:sc= -0.152 X(o=-0.15,f=-0.37) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 52 1.565 -15.836 -3.694 1.00 0.00 N ATOM 2 CA ALA A 52 1.155 -14.716 -4.517 1.00 0.00 C ATOM 3 C ALA A 52 0.887 -13.482 -3.657 1.00 0.00 C ATOM 4 O ALA A 52 0.870 -12.369 -4.169 1.00 0.00 O ATOM 5 CB ALA A 52 -0.128 -15.110 -5.246 1.00 0.00 C ATOM 0 HA ALA A 52 1.948 -14.474 -5.225 1.00 0.00 H new ATOM 0 HB1 ALA A 52 -0.459 -14.283 -5.874 1.00 0.00 H new ATOM 0 HB2 ALA A 52 0.061 -15.985 -5.868 1.00 0.00 H new ATOM 0 HB3 ALA A 52 -0.903 -15.344 -4.517 1.00 0.00 H new ATOM 11 N GLU A 53 0.678 -13.666 -2.357 1.00 0.00 N ATOM 12 CA GLU A 53 0.395 -12.606 -1.399 1.00 0.00 C ATOM 13 C GLU A 53 1.699 -11.926 -0.976 1.00 0.00 C ATOM 14 O GLU A 53 1.760 -10.737 -0.692 1.00 0.00 O ATOM 15 CB GLU A 53 -0.324 -13.218 -0.190 1.00 0.00 C ATOM 16 CG GLU A 53 -1.381 -14.249 -0.632 1.00 0.00 C ATOM 17 CD GLU A 53 -2.464 -14.476 0.414 1.00 0.00 C ATOM 18 OE1 GLU A 53 -2.160 -14.458 1.631 1.00 0.00 O ATOM 19 OE2 GLU A 53 -3.612 -14.683 -0.026 1.00 0.00 O ATOM 0 H GLU A 53 0.702 -14.591 -1.928 1.00 0.00 H new ATOM 0 HA GLU A 53 -0.246 -11.849 -1.850 1.00 0.00 H new ATOM 0 HB2 GLU A 53 0.404 -13.698 0.465 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -0.803 -12.429 0.390 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -1.844 -13.912 -1.559 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -0.888 -15.197 -0.848 1.00 0.00 H new ATOM 26 N ASN A 54 2.800 -12.671 -1.013 1.00 0.00 N ATOM 27 CA ASN A 54 4.120 -12.176 -0.632 1.00 0.00 C ATOM 28 C ASN A 54 4.770 -11.386 -1.774 1.00 0.00 C ATOM 29 O ASN A 54 5.893 -10.895 -1.649 1.00 0.00 O ATOM 30 CB ASN A 54 4.932 -13.399 -0.226 1.00 0.00 C ATOM 31 CG ASN A 54 6.235 -13.150 0.514 1.00 0.00 C ATOM 32 OD1 ASN A 54 6.565 -12.052 0.962 1.00 0.00 O ATOM 33 ND2 ASN A 54 6.978 -14.222 0.718 1.00 0.00 N ATOM 0 H ASN A 54 2.801 -13.646 -1.312 1.00 0.00 H new ATOM 0 HA ASN A 54 4.060 -11.472 0.198 1.00 0.00 H new ATOM 0 HB2 ASN A 54 4.302 -14.030 0.401 1.00 0.00 H new ATOM 0 HB3 ASN A 54 5.158 -13.969 -1.127 1.00 0.00 H new ATOM 0 HD21 ASN A 54 7.842 -14.149 1.255 1.00 0.00 H new ATOM 0 HD22 ASN A 54 6.688 -15.123 0.339 1.00 0.00 H new ATOM 40 N ARG A 55 4.089 -11.284 -2.921 1.00 0.00 N ATOM 41 CA ARG A 55 4.504 -10.507 -4.083 1.00 0.00 C ATOM 42 C ARG A 55 4.735 -9.051 -3.714 1.00 0.00 C ATOM 43 O ARG A 55 4.055 -8.520 -2.830 1.00 0.00 O ATOM 44 CB ARG A 55 3.399 -10.567 -5.142 1.00 0.00 C ATOM 45 CG ARG A 55 3.476 -11.777 -6.055 1.00 0.00 C ATOM 46 CD ARG A 55 2.510 -11.662 -7.246 1.00 0.00 C ATOM 47 NE ARG A 55 3.260 -11.424 -8.484 1.00 0.00 N ATOM 48 CZ ARG A 55 3.817 -10.284 -8.891 1.00 0.00 C ATOM 49 NH1 ARG A 55 3.401 -9.138 -8.377 1.00 0.00 N ATOM 50 NH2 ARG A 55 4.808 -10.291 -9.773 1.00 0.00 N ATOM 0 H ARG A 55 3.199 -11.761 -3.066 1.00 0.00 H new ATOM 0 HA ARG A 55 5.435 -10.928 -4.463 1.00 0.00 H new ATOM 0 HB2 ARG A 55 2.431 -10.565 -4.641 1.00 0.00 H new ATOM 0 HB3 ARG A 55 3.445 -9.664 -5.750 1.00 0.00 H new ATOM 0 HG2 ARG A 55 4.495 -11.888 -6.424 1.00 0.00 H new ATOM 0 HG3 ARG A 55 3.244 -12.677 -5.485 1.00 0.00 H new ATOM 0 HD2 ARG A 55 1.923 -12.576 -7.337 1.00 0.00 H new ATOM 0 HD3 ARG A 55 1.806 -10.847 -7.076 1.00 0.00 H new ATOM 0 HE ARG A 55 3.368 -12.225 -9.106 1.00 0.00 H new ATOM 0 HH11 ARG A 55 2.660 -9.133 -7.676 1.00 0.00 H new ATOM 0 HH12 ARG A 55 3.821 -8.260 -8.682 1.00 0.00 H new ATOM 0 HH21 ARG A 55 5.151 -11.176 -10.147 1.00 0.00 H new ATOM 0 HH22 ARG A 55 5.226 -9.412 -10.077 1.00 0.00 H new ATOM 64 N PRO A 56 5.609 -8.362 -4.460 1.00 0.00 N ATOM 65 CA PRO A 56 5.747 -6.933 -4.354 1.00 0.00 C ATOM 66 C PRO A 56 4.459 -6.306 -4.881 1.00 0.00 C ATOM 67 O PRO A 56 4.202 -6.322 -6.088 1.00 0.00 O ATOM 68 CB PRO A 56 6.990 -6.562 -5.152 1.00 0.00 C ATOM 69 CG PRO A 56 7.205 -7.709 -6.124 1.00 0.00 C ATOM 70 CD PRO A 56 6.358 -8.866 -5.598 1.00 0.00 C ATOM 0 HA PRO A 56 5.880 -6.568 -3.336 1.00 0.00 H new ATOM 0 HB2 PRO A 56 6.850 -5.620 -5.682 1.00 0.00 H new ATOM 0 HB3 PRO A 56 7.853 -6.435 -4.498 1.00 0.00 H new ATOM 0 HG2 PRO A 56 6.901 -7.429 -7.133 1.00 0.00 H new ATOM 0 HG3 PRO A 56 8.258 -7.987 -6.174 1.00 0.00 H new ATOM 0 HD2 PRO A 56 5.683 -9.233 -6.372 1.00 0.00 H new ATOM 0 HD3 PRO A 56 6.990 -9.704 -5.303 1.00 0.00 H new ATOM 78 N GLY A 57 3.635 -5.772 -3.981 1.00 0.00 N ATOM 79 CA GLY A 57 2.400 -5.108 -4.370 1.00 0.00 C ATOM 80 C GLY A 57 1.209 -6.047 -4.467 1.00 0.00 C ATOM 81 O GLY A 57 0.235 -5.663 -5.103 1.00 0.00 O ATOM 0 H GLY A 57 3.804 -5.788 -2.975 1.00 0.00 H new ATOM 0 HA2 GLY A 57 2.176 -4.324 -3.647 1.00 0.00 H new ATOM 0 HA3 GLY A 57 2.547 -4.621 -5.334 1.00 0.00 H new ATOM 85 N ALA A 58 1.226 -7.246 -3.884 1.00 0.00 N ATOM 86 CA ALA A 58 -0.006 -8.020 -3.791 1.00 0.00 C ATOM 87 C ALA A 58 -1.118 -7.244 -3.072 1.00 0.00 C ATOM 88 O ALA A 58 -0.838 -6.489 -2.130 1.00 0.00 O ATOM 89 CB ALA A 58 0.306 -9.292 -3.034 1.00 0.00 C ATOM 0 H ALA A 58 2.052 -7.689 -3.482 1.00 0.00 H new ATOM 0 HA ALA A 58 -0.369 -8.237 -4.796 1.00 0.00 H new ATOM 0 HB1 ALA A 58 -0.598 -9.895 -2.947 1.00 0.00 H new ATOM 0 HB2 ALA A 58 1.069 -9.857 -3.570 1.00 0.00 H new ATOM 0 HB3 ALA A 58 0.673 -9.042 -2.038 1.00 0.00 H new ATOM 95 N PHE A 59 -2.368 -7.452 -3.491 1.00 0.00 N ATOM 96 CA PHE A 59 -3.556 -6.932 -2.825 1.00 0.00 C ATOM 97 C PHE A 59 -3.893 -7.823 -1.621 1.00 0.00 C ATOM 98 O PHE A 59 -4.178 -9.002 -1.824 1.00 0.00 O ATOM 99 CB PHE A 59 -4.738 -6.896 -3.813 1.00 0.00 C ATOM 100 CG PHE A 59 -4.915 -5.646 -4.669 1.00 0.00 C ATOM 101 CD1 PHE A 59 -3.923 -4.652 -4.795 1.00 0.00 C ATOM 102 CD2 PHE A 59 -6.149 -5.450 -5.311 1.00 0.00 C ATOM 103 CE1 PHE A 59 -4.190 -3.468 -5.505 1.00 0.00 C ATOM 104 CE2 PHE A 59 -6.400 -4.286 -6.065 1.00 0.00 C ATOM 105 CZ PHE A 59 -5.434 -3.265 -6.122 1.00 0.00 C ATOM 0 H PHE A 59 -2.583 -8.001 -4.323 1.00 0.00 H new ATOM 0 HA PHE A 59 -3.365 -5.917 -2.476 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -4.639 -7.749 -4.484 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -5.655 -7.043 -3.243 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -2.953 -4.801 -4.344 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -6.918 -6.204 -5.225 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -3.428 -2.706 -5.576 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -7.333 -4.178 -6.598 1.00 0.00 H new ATOM 0 HZ PHE A 59 -5.647 -2.338 -6.633 1.00 0.00 H new ATOM 115 N ILE A 60 -3.908 -7.283 -0.391 1.00 0.00 N ATOM 116 CA ILE A 60 -4.320 -8.023 0.820 1.00 0.00 C ATOM 117 C ILE A 60 -5.769 -8.514 0.700 1.00 0.00 C ATOM 118 O ILE A 60 -6.086 -9.631 1.096 1.00 0.00 O ATOM 119 CB ILE A 60 -4.098 -7.146 2.084 1.00 0.00 C ATOM 120 CG1 ILE A 60 -2.589 -7.123 2.406 1.00 0.00 C ATOM 121 CG2 ILE A 60 -4.914 -7.622 3.293 1.00 0.00 C ATOM 122 CD1 ILE A 60 -2.146 -6.229 3.563 1.00 0.00 C ATOM 0 H ILE A 60 -3.634 -6.318 -0.205 1.00 0.00 H new ATOM 0 HA ILE A 60 -3.697 -8.912 0.921 1.00 0.00 H new ATOM 0 HB ILE A 60 -4.453 -6.138 1.869 1.00 0.00 H new ATOM 0 HG12 ILE A 60 -2.272 -8.143 2.624 1.00 0.00 H new ATOM 0 HG13 ILE A 60 -2.055 -6.808 1.509 1.00 0.00 H new ATOM 0 HG21 ILE A 60 -4.717 -6.970 4.144 1.00 0.00 H new ATOM 0 HG22 ILE A 60 -5.976 -7.591 3.050 1.00 0.00 H new ATOM 0 HG23 ILE A 60 -4.629 -8.644 3.545 1.00 0.00 H new ATOM 0 HD11 ILE A 60 -1.065 -6.302 3.686 1.00 0.00 H new ATOM 0 HD12 ILE A 60 -2.418 -5.195 3.349 1.00 0.00 H new ATOM 0 HD13 ILE A 60 -2.638 -6.551 4.481 1.00 0.00 H new ATOM 134 N LYS A 61 -6.650 -7.665 0.161 1.00 0.00 N ATOM 135 CA LYS A 61 -8.017 -8.002 -0.236 1.00 0.00 C ATOM 136 C LYS A 61 -8.825 -8.837 0.765 1.00 0.00 C ATOM 137 O LYS A 61 -9.600 -9.704 0.371 1.00 0.00 O ATOM 138 CB LYS A 61 -7.974 -8.583 -1.663 1.00 0.00 C ATOM 139 CG LYS A 61 -9.014 -7.869 -2.525 1.00 0.00 C ATOM 140 CD LYS A 61 -8.998 -8.281 -3.986 1.00 0.00 C ATOM 141 CE LYS A 61 -9.165 -9.775 -4.254 1.00 0.00 C ATOM 142 NZ LYS A 61 -8.160 -10.287 -5.208 1.00 0.00 N ATOM 0 H LYS A 61 -6.420 -6.687 -0.017 1.00 0.00 H new ATOM 0 HA LYS A 61 -8.598 -7.080 -0.234 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -6.980 -8.456 -2.091 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -8.176 -9.654 -1.639 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -10.005 -8.063 -2.115 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -8.847 -6.794 -2.460 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -9.794 -7.746 -4.504 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -8.056 -7.955 -4.426 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -9.084 -10.322 -3.315 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -10.164 -9.962 -4.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -8.531 -11.135 -5.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -7.953 -9.557 -5.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -7.288 -10.530 -4.696 1.00 0.00 H new ATOM 156 N GLN A 62 -8.790 -8.435 2.039 1.00 0.00 N ATOM 157 CA GLN A 62 -9.615 -8.963 3.131 1.00 0.00 C ATOM 158 C GLN A 62 -11.131 -8.770 2.946 1.00 0.00 C ATOM 159 O GLN A 62 -11.870 -8.932 3.916 1.00 0.00 O ATOM 160 CB GLN A 62 -9.143 -8.357 4.465 1.00 0.00 C ATOM 161 CG GLN A 62 -7.786 -8.976 4.848 1.00 0.00 C ATOM 162 CD GLN A 62 -7.902 -10.081 5.904 1.00 0.00 C ATOM 163 OE1 GLN A 62 -8.876 -10.834 5.954 1.00 0.00 O ATOM 164 NE2 GLN A 62 -6.920 -10.201 6.777 1.00 0.00 N ATOM 0 H GLN A 62 -8.157 -7.699 2.352 1.00 0.00 H new ATOM 0 HA GLN A 62 -9.473 -10.044 3.129 1.00 0.00 H new ATOM 0 HB2 GLN A 62 -9.050 -7.275 4.374 1.00 0.00 H new ATOM 0 HB3 GLN A 62 -9.878 -8.550 5.246 1.00 0.00 H new ATOM 0 HG2 GLN A 62 -7.315 -9.385 3.954 1.00 0.00 H new ATOM 0 HG3 GLN A 62 -7.129 -8.191 5.223 1.00 0.00 H new ATOM 0 HE21 GLN A 62 -6.116 -9.574 6.730 1.00 0.00 H new ATOM 0 HE22 GLN A 62 -6.964 -10.920 7.499 1.00 0.00 H new ATOM 173 N GLY A 63 -11.620 -8.362 1.768 1.00 0.00 N ATOM 174 CA GLY A 63 -13.038 -8.408 1.434 1.00 0.00 C ATOM 175 C GLY A 63 -13.936 -7.530 2.309 1.00 0.00 C ATOM 176 O GLY A 63 -15.153 -7.715 2.324 1.00 0.00 O ATOM 0 H GLY A 63 -11.035 -7.990 1.020 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -13.161 -8.105 0.394 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -13.380 -9.440 1.508 1.00 0.00 H new ATOM 180 N ARG A 64 -13.351 -6.579 3.032 1.00 0.00 N ATOM 181 CA ARG A 64 -13.988 -5.824 4.104 1.00 0.00 C ATOM 182 C ARG A 64 -14.492 -4.475 3.604 1.00 0.00 C ATOM 183 O ARG A 64 -14.167 -4.084 2.482 1.00 0.00 O ATOM 184 CB ARG A 64 -13.049 -5.742 5.319 1.00 0.00 C ATOM 185 CG ARG A 64 -11.579 -5.431 5.007 1.00 0.00 C ATOM 186 CD ARG A 64 -10.712 -5.642 6.249 1.00 0.00 C ATOM 187 NE ARG A 64 -10.934 -4.527 7.153 1.00 0.00 N ATOM 188 CZ ARG A 64 -10.143 -4.095 8.133 1.00 0.00 C ATOM 189 NH1 ARG A 64 -9.117 -4.818 8.553 1.00 0.00 N ATOM 190 NH2 ARG A 64 -10.407 -2.933 8.710 1.00 0.00 N ATOM 0 H ARG A 64 -12.381 -6.303 2.880 1.00 0.00 H new ATOM 0 HA ARG A 64 -14.881 -6.348 4.444 1.00 0.00 H new ATOM 0 HB2 ARG A 64 -13.427 -4.976 5.996 1.00 0.00 H new ATOM 0 HB3 ARG A 64 -13.094 -6.690 5.854 1.00 0.00 H new ATOM 0 HG2 ARG A 64 -11.229 -6.073 4.199 1.00 0.00 H new ATOM 0 HG3 ARG A 64 -11.484 -4.402 4.661 1.00 0.00 H new ATOM 0 HD2 ARG A 64 -10.968 -6.583 6.736 1.00 0.00 H new ATOM 0 HD3 ARG A 64 -9.660 -5.703 5.972 1.00 0.00 H new ATOM 0 HE ARG A 64 -11.804 -4.011 7.021 1.00 0.00 H new ATOM 0 HH11 ARG A 64 -8.921 -5.723 8.125 1.00 0.00 H new ATOM 0 HH12 ARG A 64 -8.522 -4.470 9.305 1.00 0.00 H new ATOM 0 HH21 ARG A 64 -11.208 -2.381 8.403 1.00 0.00 H new ATOM 0 HH22 ARG A 64 -9.810 -2.590 9.462 1.00 0.00 H new ATOM 204 N LYS A 65 -15.275 -3.755 4.416 1.00 0.00 N ATOM 205 CA LYS A 65 -15.569 -2.342 4.179 1.00 0.00 C ATOM 206 C LYS A 65 -14.713 -1.556 5.156 1.00 0.00 C ATOM 207 O LYS A 65 -14.769 -1.827 6.358 1.00 0.00 O ATOM 208 CB LYS A 65 -17.062 -2.004 4.379 1.00 0.00 C ATOM 209 CG LYS A 65 -17.402 -0.700 3.628 1.00 0.00 C ATOM 210 CD LYS A 65 -18.804 -0.101 3.786 1.00 0.00 C ATOM 211 CE LYS A 65 -19.930 -1.127 3.880 1.00 0.00 C ATOM 212 NZ LYS A 65 -20.362 -1.314 5.278 1.00 0.00 N ATOM 0 H LYS A 65 -15.719 -4.136 5.251 1.00 0.00 H new ATOM 0 HA LYS A 65 -15.345 -2.088 3.143 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -17.683 -2.821 4.010 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -17.281 -1.892 5.441 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -16.683 0.057 3.939 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -17.237 -0.879 2.565 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -18.820 0.519 4.682 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -19.000 0.557 2.940 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -20.776 -0.800 3.275 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -19.594 -2.079 3.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -21.128 -2.016 5.314 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -19.559 -1.649 5.848 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -20.704 -0.409 5.660 1.00 0.00 H new ATOM 226 N LEU A 66 -13.897 -0.631 4.664 1.00 0.00 N ATOM 227 CA LEU A 66 -13.269 0.384 5.488 1.00 0.00 C ATOM 228 C LEU A 66 -14.056 1.680 5.381 1.00 0.00 C ATOM 229 O LEU A 66 -15.138 1.719 4.807 1.00 0.00 O ATOM 230 CB LEU A 66 -11.786 0.550 5.136 1.00 0.00 C ATOM 231 CG LEU A 66 -11.031 -0.747 5.340 1.00 0.00 C ATOM 232 CD1 LEU A 66 -10.747 -1.357 3.991 1.00 0.00 C ATOM 233 CD2 LEU A 66 -9.748 -0.672 6.155 1.00 0.00 C ATOM 0 H LEU A 66 -13.654 -0.567 3.675 1.00 0.00 H new ATOM 0 HA LEU A 66 -13.289 0.070 6.532 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -11.689 0.872 4.099 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -11.347 1.332 5.756 1.00 0.00 H new ATOM 0 HG LEU A 66 -11.689 -1.366 5.950 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -10.203 -2.293 4.122 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -11.687 -1.553 3.475 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -10.145 -0.667 3.399 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -9.304 -1.665 6.227 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -9.046 0.004 5.667 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -9.973 -0.301 7.155 1.00 0.00 H new ATOM 245 N ASP A 67 -13.487 2.730 5.947 1.00 0.00 N ATOM 246 CA ASP A 67 -14.063 4.073 5.985 1.00 0.00 C ATOM 247 C ASP A 67 -12.950 5.025 5.567 1.00 0.00 C ATOM 248 O ASP A 67 -12.414 5.802 6.360 1.00 0.00 O ATOM 249 CB ASP A 67 -14.670 4.364 7.369 1.00 0.00 C ATOM 250 CG ASP A 67 -15.340 5.738 7.447 1.00 0.00 C ATOM 251 OD1 ASP A 67 -16.403 5.935 6.813 1.00 0.00 O ATOM 252 OD2 ASP A 67 -14.841 6.626 8.172 1.00 0.00 O ATOM 0 H ASP A 67 -12.580 2.674 6.410 1.00 0.00 H new ATOM 0 HA ASP A 67 -14.901 4.193 5.298 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -15.403 3.594 7.608 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -13.886 4.304 8.124 1.00 0.00 H new ATOM 257 N ILE A 68 -12.493 4.856 4.332 1.00 0.00 N ATOM 258 CA ILE A 68 -11.539 5.713 3.653 1.00 0.00 C ATOM 259 C ILE A 68 -12.375 6.906 3.168 1.00 0.00 C ATOM 260 O ILE A 68 -13.489 6.724 2.672 1.00 0.00 O ATOM 261 CB ILE A 68 -10.876 4.928 2.486 1.00 0.00 C ATOM 262 CG1 ILE A 68 -10.341 3.535 2.923 1.00 0.00 C ATOM 263 CG2 ILE A 68 -9.763 5.752 1.820 1.00 0.00 C ATOM 264 CD1 ILE A 68 -9.761 2.683 1.792 1.00 0.00 C ATOM 0 H ILE A 68 -12.796 4.075 3.750 1.00 0.00 H new ATOM 0 HA ILE A 68 -10.718 6.050 4.286 1.00 0.00 H new ATOM 0 HB ILE A 68 -11.663 4.750 1.753 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -9.571 3.679 3.681 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -11.153 2.982 3.395 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -9.319 5.175 1.008 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -10.183 6.676 1.422 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -8.996 5.990 2.557 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -9.414 1.731 2.195 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -10.531 2.501 1.042 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -8.924 3.209 1.333 1.00 0.00 H new ATOM 276 N ASP A 69 -11.871 8.130 3.316 1.00 0.00 N ATOM 277 CA ASP A 69 -12.583 9.327 2.863 1.00 0.00 C ATOM 278 C ASP A 69 -12.369 9.421 1.359 1.00 0.00 C ATOM 279 O ASP A 69 -11.238 9.667 0.929 1.00 0.00 O ATOM 280 CB ASP A 69 -12.042 10.574 3.574 1.00 0.00 C ATOM 281 CG ASP A 69 -12.759 11.875 3.179 1.00 0.00 C ATOM 282 OD1 ASP A 69 -13.488 11.971 2.173 1.00 0.00 O ATOM 283 OD2 ASP A 69 -12.580 12.860 3.941 1.00 0.00 O ATOM 0 H ASP A 69 -10.967 8.321 3.748 1.00 0.00 H new ATOM 0 HA ASP A 69 -13.646 9.265 3.097 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -12.131 10.434 4.651 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -10.979 10.674 3.353 1.00 0.00 H new ATOM 288 N PHE A 70 -13.400 9.131 0.562 1.00 0.00 N ATOM 289 CA PHE A 70 -13.306 9.139 -0.889 1.00 0.00 C ATOM 290 C PHE A 70 -14.081 10.293 -1.515 1.00 0.00 C ATOM 291 O PHE A 70 -13.917 10.544 -2.712 1.00 0.00 O ATOM 292 CB PHE A 70 -13.854 7.827 -1.445 1.00 0.00 C ATOM 293 CG PHE A 70 -12.943 6.628 -1.377 1.00 0.00 C ATOM 294 CD1 PHE A 70 -11.749 6.659 -2.116 1.00 0.00 C ATOM 295 CD2 PHE A 70 -13.322 5.458 -0.688 1.00 0.00 C ATOM 296 CE1 PHE A 70 -10.899 5.549 -2.114 1.00 0.00 C ATOM 297 CE2 PHE A 70 -12.478 4.334 -0.716 1.00 0.00 C ATOM 298 CZ PHE A 70 -11.257 4.406 -1.395 1.00 0.00 C ATOM 0 H PHE A 70 -14.325 8.884 0.912 1.00 0.00 H new ATOM 0 HA PHE A 70 -12.253 9.261 -1.141 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -14.772 7.587 -0.908 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -14.127 7.988 -2.488 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -11.488 7.539 -2.685 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -14.254 5.425 -0.143 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -9.971 5.575 -2.665 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -12.770 3.422 -0.217 1.00 0.00 H new ATOM 0 HZ PHE A 70 -10.581 3.565 -1.363 1.00 0.00 H new ATOM 308 N GLY A 71 -14.946 10.969 -0.763 1.00 0.00 N ATOM 309 CA GLY A 71 -15.707 12.097 -1.244 1.00 0.00 C ATOM 310 C GLY A 71 -17.175 11.725 -1.254 1.00 0.00 C ATOM 311 O GLY A 71 -17.734 11.474 -0.189 1.00 0.00 O ATOM 0 H GLY A 71 -15.134 10.737 0.212 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -15.542 12.964 -0.605 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -15.380 12.373 -2.247 1.00 0.00 H new ATOM 315 N ALA A 72 -17.807 11.724 -2.427 1.00 0.00 N ATOM 316 CA ALA A 72 -19.254 11.636 -2.570 1.00 0.00 C ATOM 317 C ALA A 72 -19.639 10.409 -3.395 1.00 0.00 C ATOM 318 O ALA A 72 -19.760 9.312 -2.858 1.00 0.00 O ATOM 319 CB ALA A 72 -19.744 12.952 -3.170 1.00 0.00 C ATOM 0 H ALA A 72 -17.316 11.786 -3.319 1.00 0.00 H new ATOM 0 HA ALA A 72 -19.740 11.498 -1.604 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -20.827 12.917 -3.289 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -19.479 13.775 -2.507 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -19.276 13.105 -4.143 1.00 0.00 H new ATOM 325 N GLU A 73 -19.734 10.548 -4.721 1.00 0.00 N ATOM 326 CA GLU A 73 -19.771 9.398 -5.625 1.00 0.00 C ATOM 327 C GLU A 73 -18.590 8.462 -5.347 1.00 0.00 C ATOM 328 O GLU A 73 -18.726 7.243 -5.437 1.00 0.00 O ATOM 329 CB GLU A 73 -19.806 9.853 -7.089 1.00 0.00 C ATOM 330 CG GLU A 73 -18.576 10.663 -7.539 1.00 0.00 C ATOM 331 CD GLU A 73 -18.687 11.258 -8.945 1.00 0.00 C ATOM 332 OE1 GLU A 73 -19.795 11.260 -9.536 1.00 0.00 O ATOM 333 OE2 GLU A 73 -17.657 11.761 -9.443 1.00 0.00 O ATOM 0 H GLU A 73 -19.787 11.451 -5.192 1.00 0.00 H new ATOM 0 HA GLU A 73 -20.688 8.838 -5.441 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -19.899 8.974 -7.727 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -20.700 10.457 -7.247 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -18.410 11.472 -6.828 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -17.698 10.018 -7.499 1.00 0.00 H new ATOM 340 N GLY A 74 -17.458 9.047 -4.950 1.00 0.00 N ATOM 341 CA GLY A 74 -16.258 8.362 -4.509 1.00 0.00 C ATOM 342 C GLY A 74 -16.466 7.458 -3.285 1.00 0.00 C ATOM 343 O GLY A 74 -15.807 6.425 -3.229 1.00 0.00 O ATOM 0 H GLY A 74 -17.356 10.062 -4.929 1.00 0.00 H new ATOM 0 HA2 GLY A 74 -15.874 7.759 -5.332 1.00 0.00 H new ATOM 0 HA3 GLY A 74 -15.495 9.104 -4.274 1.00 0.00 H new ATOM 347 N ASN A 75 -17.375 7.753 -2.345 1.00 0.00 N ATOM 348 CA ASN A 75 -17.766 6.796 -1.295 1.00 0.00 C ATOM 349 C ASN A 75 -18.857 5.825 -1.769 1.00 0.00 C ATOM 350 O ASN A 75 -18.804 4.633 -1.476 1.00 0.00 O ATOM 351 CB ASN A 75 -18.165 7.525 0.003 1.00 0.00 C ATOM 352 CG ASN A 75 -19.579 8.090 0.066 1.00 0.00 C ATOM 353 OD1 ASN A 75 -20.577 7.374 0.067 1.00 0.00 O ATOM 354 ND2 ASN A 75 -19.692 9.402 0.121 1.00 0.00 N ATOM 0 H ASN A 75 -17.856 8.651 -2.289 1.00 0.00 H new ATOM 0 HA ASN A 75 -16.890 6.186 -1.072 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -18.039 6.832 0.835 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -17.464 8.345 0.162 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -20.615 9.833 0.165 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -18.856 9.986 0.120 1.00 0.00 H new ATOM 361 N ARG A 76 -19.839 6.310 -2.532 1.00 0.00 N ATOM 362 CA ARG A 76 -21.065 5.572 -2.867 1.00 0.00 C ATOM 363 C ARG A 76 -20.852 4.213 -3.540 1.00 0.00 C ATOM 364 O ARG A 76 -21.583 3.263 -3.247 1.00 0.00 O ATOM 365 CB ARG A 76 -21.920 6.477 -3.759 1.00 0.00 C ATOM 366 CG ARG A 76 -22.725 7.490 -2.932 1.00 0.00 C ATOM 367 CD ARG A 76 -24.097 6.907 -2.560 1.00 0.00 C ATOM 368 NE ARG A 76 -25.003 6.931 -3.720 1.00 0.00 N ATOM 369 CZ ARG A 76 -25.622 8.013 -4.218 1.00 0.00 C ATOM 370 NH1 ARG A 76 -25.706 9.153 -3.527 1.00 0.00 N ATOM 371 NH2 ARG A 76 -26.114 7.939 -5.445 1.00 0.00 N ATOM 0 H ARG A 76 -19.807 7.243 -2.943 1.00 0.00 H new ATOM 0 HA ARG A 76 -21.557 5.328 -1.926 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -21.277 7.009 -4.461 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -22.602 5.866 -4.351 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -22.175 7.749 -2.027 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -22.856 8.411 -3.500 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -23.979 5.883 -2.205 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -24.531 7.480 -1.741 1.00 0.00 H new ATOM 0 HE ARG A 76 -25.177 6.042 -4.189 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -25.294 9.217 -2.596 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -26.182 9.960 -3.930 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -26.017 7.077 -5.982 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -26.590 8.744 -5.853 1.00 0.00 H new ATOM 385 N TYR A 77 -19.926 4.117 -4.485 1.00 0.00 N ATOM 386 CA TYR A 77 -19.571 2.886 -5.193 1.00 0.00 C ATOM 387 C TYR A 77 -18.771 1.944 -4.283 1.00 0.00 C ATOM 388 O TYR A 77 -18.896 0.727 -4.407 1.00 0.00 O ATOM 389 CB TYR A 77 -18.747 3.233 -6.435 1.00 0.00 C ATOM 390 CG TYR A 77 -19.109 2.430 -7.646 1.00 0.00 C ATOM 391 CD1 TYR A 77 -20.197 2.843 -8.429 1.00 0.00 C ATOM 392 CD2 TYR A 77 -18.329 1.325 -8.023 1.00 0.00 C ATOM 393 CE1 TYR A 77 -20.517 2.139 -9.592 1.00 0.00 C ATOM 394 CE2 TYR A 77 -18.676 0.594 -9.171 1.00 0.00 C ATOM 395 CZ TYR A 77 -19.785 0.991 -9.951 1.00 0.00 C ATOM 396 OH TYR A 77 -20.147 0.296 -11.057 1.00 0.00 O ATOM 0 H TYR A 77 -19.380 4.921 -4.793 1.00 0.00 H new ATOM 0 HA TYR A 77 -20.488 2.377 -5.490 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -18.876 4.291 -6.661 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -17.691 3.081 -6.213 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -20.784 3.700 -8.134 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -17.469 1.040 -7.435 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -21.329 2.477 -10.219 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -18.096 -0.271 -9.457 1.00 0.00 H new ATOM 0 HH TYR A 77 -19.458 -0.370 -11.265 1.00 0.00 H new ATOM 406 N TYR A 78 -17.969 2.473 -3.348 1.00 0.00 N ATOM 407 CA TYR A 78 -17.348 1.653 -2.312 1.00 0.00 C ATOM 408 C TYR A 78 -18.473 1.024 -1.502 1.00 0.00 C ATOM 409 O TYR A 78 -18.577 -0.189 -1.478 1.00 0.00 O ATOM 410 CB TYR A 78 -16.399 2.445 -1.403 1.00 0.00 C ATOM 411 CG TYR A 78 -15.449 1.577 -0.594 1.00 0.00 C ATOM 412 CD1 TYR A 78 -14.334 0.962 -1.203 1.00 0.00 C ATOM 413 CD2 TYR A 78 -15.672 1.401 0.785 1.00 0.00 C ATOM 414 CE1 TYR A 78 -13.479 0.137 -0.448 1.00 0.00 C ATOM 415 CE2 TYR A 78 -14.800 0.609 1.549 1.00 0.00 C ATOM 416 CZ TYR A 78 -13.727 -0.054 0.928 1.00 0.00 C ATOM 417 OH TYR A 78 -12.960 -0.872 1.689 1.00 0.00 O ATOM 0 H TYR A 78 -17.739 3.465 -3.293 1.00 0.00 H new ATOM 0 HA TYR A 78 -16.725 0.894 -2.786 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -15.815 3.132 -2.016 1.00 0.00 H new ATOM 0 HB3 TYR A 78 -16.991 3.053 -0.719 1.00 0.00 H new ATOM 0 HD1 TYR A 78 -14.136 1.125 -2.252 1.00 0.00 H new ATOM 0 HD2 TYR A 78 -16.518 1.878 1.258 1.00 0.00 H new ATOM 0 HE1 TYR A 78 -12.637 -0.348 -0.920 1.00 0.00 H new ATOM 0 HE2 TYR A 78 -14.953 0.509 2.613 1.00 0.00 H new ATOM 0 HH TYR A 78 -12.047 -0.890 1.332 1.00 0.00 H new ATOM 427 N GLU A 79 -19.381 1.816 -0.930 1.00 0.00 N ATOM 428 CA GLU A 79 -20.518 1.340 -0.138 1.00 0.00 C ATOM 429 C GLU A 79 -21.345 0.281 -0.870 1.00 0.00 C ATOM 430 O GLU A 79 -21.948 -0.581 -0.229 1.00 0.00 O ATOM 431 CB GLU A 79 -21.413 2.535 0.195 1.00 0.00 C ATOM 432 CG GLU A 79 -20.799 3.407 1.289 1.00 0.00 C ATOM 433 CD GLU A 79 -21.233 2.996 2.700 1.00 0.00 C ATOM 434 OE1 GLU A 79 -21.463 1.787 2.960 1.00 0.00 O ATOM 435 OE2 GLU A 79 -21.401 3.877 3.566 1.00 0.00 O ATOM 0 H GLU A 79 -19.346 2.833 -1.006 1.00 0.00 H new ATOM 0 HA GLU A 79 -20.124 0.873 0.765 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -21.572 3.133 -0.702 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -22.391 2.179 0.518 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -19.712 3.355 1.220 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -21.080 4.446 1.117 1.00 0.00 H new ATOM 442 N ALA A 80 -21.361 0.344 -2.205 1.00 0.00 N ATOM 443 CA ALA A 80 -21.957 -0.683 -3.047 1.00 0.00 C ATOM 444 C ALA A 80 -21.229 -2.028 -2.979 1.00 0.00 C ATOM 445 O ALA A 80 -21.870 -3.058 -2.766 1.00 0.00 O ATOM 446 CB ALA A 80 -22.076 -0.221 -4.514 1.00 0.00 C ATOM 0 H ALA A 80 -20.956 1.118 -2.731 1.00 0.00 H new ATOM 0 HA ALA A 80 -22.956 -0.839 -2.641 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -22.525 -1.015 -5.110 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -22.702 0.670 -4.565 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -21.085 0.009 -4.904 1.00 0.00 H new ATOM 452 N ASN A 81 -19.927 -2.054 -3.262 1.00 0.00 N ATOM 453 CA ASN A 81 -19.207 -3.288 -3.583 1.00 0.00 C ATOM 454 C ASN A 81 -17.759 -3.246 -3.083 1.00 0.00 C ATOM 455 O ASN A 81 -16.847 -3.779 -3.707 1.00 0.00 O ATOM 456 CB ASN A 81 -19.357 -3.620 -5.082 1.00 0.00 C ATOM 457 CG ASN A 81 -19.119 -2.448 -6.019 1.00 0.00 C ATOM 458 OD1 ASN A 81 -20.007 -2.054 -6.760 1.00 0.00 O ATOM 459 ND2 ASN A 81 -17.938 -1.869 -6.006 1.00 0.00 N ATOM 0 H ASN A 81 -19.340 -1.220 -3.275 1.00 0.00 H new ATOM 0 HA ASN A 81 -19.659 -4.119 -3.042 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -18.658 -4.418 -5.335 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -20.361 -4.008 -5.255 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -17.751 -1.077 -6.621 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -17.209 -2.212 -5.381 1.00 0.00 H new ATOM 466 N TYR A 82 -17.559 -2.649 -1.915 1.00 0.00 N ATOM 467 CA TYR A 82 -16.334 -2.459 -1.142 1.00 0.00 C ATOM 468 C TYR A 82 -15.476 -3.714 -1.023 1.00 0.00 C ATOM 469 O TYR A 82 -14.248 -3.654 -1.091 1.00 0.00 O ATOM 470 CB TYR A 82 -16.750 -2.018 0.270 1.00 0.00 C ATOM 471 CG TYR A 82 -17.883 -2.836 0.889 1.00 0.00 C ATOM 472 CD1 TYR A 82 -17.574 -3.996 1.622 1.00 0.00 C ATOM 473 CD2 TYR A 82 -19.236 -2.466 0.718 1.00 0.00 C ATOM 474 CE1 TYR A 82 -18.586 -4.780 2.198 1.00 0.00 C ATOM 475 CE2 TYR A 82 -20.255 -3.258 1.282 1.00 0.00 C ATOM 476 CZ TYR A 82 -19.936 -4.401 2.053 1.00 0.00 C ATOM 477 OH TYR A 82 -20.915 -5.101 2.690 1.00 0.00 O ATOM 0 H TYR A 82 -18.351 -2.234 -1.425 1.00 0.00 H new ATOM 0 HA TYR A 82 -15.726 -1.718 -1.662 1.00 0.00 H new ATOM 0 HB2 TYR A 82 -15.880 -2.075 0.924 1.00 0.00 H new ATOM 0 HB3 TYR A 82 -17.054 -0.972 0.234 1.00 0.00 H new ATOM 0 HD1 TYR A 82 -16.541 -4.288 1.744 1.00 0.00 H new ATOM 0 HD2 TYR A 82 -19.488 -1.579 0.156 1.00 0.00 H new ATOM 0 HE1 TYR A 82 -18.331 -5.672 2.751 1.00 0.00 H new ATOM 0 HE2 TYR A 82 -21.289 -2.991 1.125 1.00 0.00 H new ATOM 0 HH TYR A 82 -21.787 -4.705 2.483 1.00 0.00 H new ATOM 487 N TRP A 83 -16.117 -4.871 -0.871 1.00 0.00 N ATOM 488 CA TRP A 83 -15.452 -6.147 -0.665 1.00 0.00 C ATOM 489 C TRP A 83 -14.592 -6.561 -1.860 1.00 0.00 C ATOM 490 O TRP A 83 -13.814 -7.509 -1.788 1.00 0.00 O ATOM 491 CB TRP A 83 -16.520 -7.201 -0.388 1.00 0.00 C ATOM 492 CG TRP A 83 -17.438 -7.537 -1.523 1.00 0.00 C ATOM 493 CD1 TRP A 83 -18.550 -6.864 -1.894 1.00 0.00 C ATOM 494 CD2 TRP A 83 -17.347 -8.677 -2.422 1.00 0.00 C ATOM 495 NE1 TRP A 83 -19.242 -7.606 -2.826 1.00 0.00 N ATOM 496 CE2 TRP A 83 -18.532 -8.725 -3.210 1.00 0.00 C ATOM 497 CE3 TRP A 83 -16.381 -9.681 -2.634 1.00 0.00 C ATOM 498 CZ2 TRP A 83 -18.773 -9.769 -4.114 1.00 0.00 C ATOM 499 CZ3 TRP A 83 -16.616 -10.732 -3.539 1.00 0.00 C ATOM 500 CH2 TRP A 83 -17.819 -10.787 -4.264 1.00 0.00 C ATOM 0 H TRP A 83 -17.134 -4.945 -0.889 1.00 0.00 H new ATOM 0 HA TRP A 83 -14.772 -6.052 0.182 1.00 0.00 H new ATOM 0 HB2 TRP A 83 -16.021 -8.117 -0.070 1.00 0.00 H new ATOM 0 HB3 TRP A 83 -17.126 -6.860 0.451 1.00 0.00 H new ATOM 0 HD1 TRP A 83 -18.849 -5.896 -1.519 1.00 0.00 H new ATOM 0 HE1 TRP A 83 -20.164 -7.359 -3.187 1.00 0.00 H new ATOM 0 HE3 TRP A 83 -15.447 -9.643 -2.094 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 -19.686 -9.790 -4.691 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 -15.869 -11.500 -3.677 1.00 0.00 H new ATOM 0 HH2 TRP A 83 -18.009 -11.611 -4.935 1.00 0.00 H new ATOM 511 N GLN A 84 -14.736 -5.873 -2.986 1.00 0.00 N ATOM 512 CA GLN A 84 -13.987 -6.136 -4.191 1.00 0.00 C ATOM 513 C GLN A 84 -12.609 -5.467 -4.172 1.00 0.00 C ATOM 514 O GLN A 84 -11.887 -5.646 -5.146 1.00 0.00 O ATOM 515 CB GLN A 84 -14.853 -5.687 -5.374 1.00 0.00 C ATOM 516 CG GLN A 84 -16.088 -6.603 -5.526 1.00 0.00 C ATOM 517 CD GLN A 84 -15.877 -7.683 -6.593 1.00 0.00 C ATOM 518 OE1 GLN A 84 -15.263 -7.441 -7.629 1.00 0.00 O ATOM 519 NE2 GLN A 84 -16.342 -8.902 -6.362 1.00 0.00 N ATOM 0 H GLN A 84 -15.395 -5.100 -3.080 1.00 0.00 H new ATOM 0 HA GLN A 84 -13.772 -7.201 -4.280 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -15.175 -4.656 -5.225 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -14.264 -5.708 -6.291 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -16.307 -7.077 -4.569 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -16.957 -5.999 -5.789 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -16.851 -9.099 -5.500 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -16.191 -9.644 -7.046 1.00 0.00 H new ATOM 528 N PHE A 85 -12.230 -4.718 -3.127 1.00 0.00 N ATOM 529 CA PHE A 85 -11.040 -3.864 -3.097 1.00 0.00 C ATOM 530 C PHE A 85 -10.056 -4.337 -2.010 1.00 0.00 C ATOM 531 O PHE A 85 -10.485 -4.973 -1.038 1.00 0.00 O ATOM 532 CB PHE A 85 -11.482 -2.414 -2.827 1.00 0.00 C ATOM 533 CG PHE A 85 -12.320 -1.755 -3.907 1.00 0.00 C ATOM 534 CD1 PHE A 85 -13.653 -2.155 -4.123 1.00 0.00 C ATOM 535 CD2 PHE A 85 -11.783 -0.705 -4.675 1.00 0.00 C ATOM 536 CE1 PHE A 85 -14.433 -1.519 -5.098 1.00 0.00 C ATOM 537 CE2 PHE A 85 -12.566 -0.073 -5.656 1.00 0.00 C ATOM 538 CZ PHE A 85 -13.897 -0.471 -5.858 1.00 0.00 C ATOM 0 H PHE A 85 -12.760 -4.691 -2.256 1.00 0.00 H new ATOM 0 HA PHE A 85 -10.526 -3.922 -4.057 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -12.049 -2.397 -1.896 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -10.590 -1.808 -2.669 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -14.076 -2.956 -3.534 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -10.765 -0.384 -4.510 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -15.451 -1.838 -5.264 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -12.143 0.720 -6.255 1.00 0.00 H new ATOM 0 HZ PHE A 85 -14.506 0.029 -6.597 1.00 0.00 H new ATOM 548 N PRO A 86 -8.749 -4.028 -2.127 1.00 0.00 N ATOM 549 CA PRO A 86 -7.751 -4.384 -1.123 1.00 0.00 C ATOM 550 C PRO A 86 -8.023 -3.661 0.200 1.00 0.00 C ATOM 551 O PRO A 86 -8.502 -2.531 0.208 1.00 0.00 O ATOM 552 CB PRO A 86 -6.385 -4.052 -1.713 1.00 0.00 C ATOM 553 CG PRO A 86 -6.688 -3.053 -2.816 1.00 0.00 C ATOM 554 CD PRO A 86 -8.129 -3.327 -3.238 1.00 0.00 C ATOM 0 HA PRO A 86 -7.791 -5.446 -0.883 1.00 0.00 H new ATOM 0 HB2 PRO A 86 -5.720 -3.626 -0.962 1.00 0.00 H new ATOM 0 HB3 PRO A 86 -5.894 -4.942 -2.106 1.00 0.00 H new ATOM 0 HG2 PRO A 86 -6.572 -2.029 -2.460 1.00 0.00 H new ATOM 0 HG3 PRO A 86 -6.004 -3.177 -3.655 1.00 0.00 H new ATOM 0 HD2 PRO A 86 -8.655 -2.397 -3.454 1.00 0.00 H new ATOM 0 HD3 PRO A 86 -8.161 -3.930 -4.146 1.00 0.00 H new ATOM 562 N ASP A 87 -7.684 -4.316 1.312 1.00 0.00 N ATOM 563 CA ASP A 87 -7.658 -3.717 2.653 1.00 0.00 C ATOM 564 C ASP A 87 -6.316 -3.031 2.928 1.00 0.00 C ATOM 565 O ASP A 87 -6.230 -2.081 3.707 1.00 0.00 O ATOM 566 CB ASP A 87 -7.892 -4.831 3.682 1.00 0.00 C ATOM 567 CG ASP A 87 -7.380 -4.473 5.081 1.00 0.00 C ATOM 568 OD1 ASP A 87 -8.062 -3.728 5.806 1.00 0.00 O ATOM 569 OD2 ASP A 87 -6.301 -4.970 5.472 1.00 0.00 O ATOM 0 H ASP A 87 -7.413 -5.299 1.308 1.00 0.00 H new ATOM 0 HA ASP A 87 -8.438 -2.959 2.722 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -8.959 -5.049 3.737 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -7.398 -5.741 3.342 1.00 0.00 H new ATOM 574 N GLY A 88 -5.262 -3.502 2.269 1.00 0.00 N ATOM 575 CA GLY A 88 -3.907 -3.019 2.402 1.00 0.00 C ATOM 576 C GLY A 88 -3.066 -3.592 1.263 1.00 0.00 C ATOM 577 O GLY A 88 -3.554 -4.362 0.423 1.00 0.00 O ATOM 0 H GLY A 88 -5.342 -4.266 1.598 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -3.890 -1.930 2.372 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -3.492 -3.318 3.365 1.00 0.00 H new ATOM 581 N ILE A 89 -1.797 -3.214 1.246 1.00 0.00 N ATOM 582 CA ILE A 89 -0.748 -3.711 0.370 1.00 0.00 C ATOM 583 C ILE A 89 0.340 -4.265 1.298 1.00 0.00 C ATOM 584 O ILE A 89 0.289 -4.091 2.518 1.00 0.00 O ATOM 585 CB ILE A 89 -0.305 -2.570 -0.589 1.00 0.00 C ATOM 586 CG1 ILE A 89 -1.485 -2.056 -1.443 1.00 0.00 C ATOM 587 CG2 ILE A 89 0.844 -2.948 -1.546 1.00 0.00 C ATOM 588 CD1 ILE A 89 -2.066 -3.076 -2.430 1.00 0.00 C ATOM 0 H ILE A 89 -1.449 -2.502 1.889 1.00 0.00 H new ATOM 0 HA ILE A 89 -1.056 -4.517 -0.296 1.00 0.00 H new ATOM 0 HB ILE A 89 0.061 -1.792 0.081 1.00 0.00 H new ATOM 0 HG12 ILE A 89 -2.281 -1.726 -0.775 1.00 0.00 H new ATOM 0 HG13 ILE A 89 -1.155 -1.180 -2.002 1.00 0.00 H new ATOM 0 HG21 ILE A 89 1.088 -2.094 -2.177 1.00 0.00 H new ATOM 0 HG22 ILE A 89 1.722 -3.233 -0.966 1.00 0.00 H new ATOM 0 HG23 ILE A 89 0.536 -3.785 -2.172 1.00 0.00 H new ATOM 0 HD11 ILE A 89 -2.888 -2.621 -2.982 1.00 0.00 H new ATOM 0 HD12 ILE A 89 -1.290 -3.389 -3.128 1.00 0.00 H new ATOM 0 HD13 ILE A 89 -2.433 -3.944 -1.882 1.00 0.00 H new ATOM 600 N HIS A 90 1.301 -4.969 0.710 1.00 0.00 N ATOM 601 CA HIS A 90 2.391 -5.647 1.400 1.00 0.00 C ATOM 602 C HIS A 90 3.738 -4.938 1.162 1.00 0.00 C ATOM 603 O HIS A 90 4.769 -5.349 1.688 1.00 0.00 O ATOM 604 CB HIS A 90 2.454 -7.080 0.853 1.00 0.00 C ATOM 605 CG HIS A 90 1.204 -7.909 1.009 1.00 0.00 C ATOM 606 ND1 HIS A 90 0.082 -7.858 0.210 1.00 0.00 N ATOM 607 CD2 HIS A 90 1.071 -8.993 1.833 1.00 0.00 C ATOM 608 CE1 HIS A 90 -0.694 -8.904 0.536 1.00 0.00 C ATOM 609 NE2 HIS A 90 -0.153 -9.602 1.547 1.00 0.00 N ATOM 0 H HIS A 90 1.343 -5.087 -0.302 1.00 0.00 H new ATOM 0 HA HIS A 90 2.208 -5.638 2.475 1.00 0.00 H new ATOM 0 HB2 HIS A 90 2.702 -7.031 -0.207 1.00 0.00 H new ATOM 0 HB3 HIS A 90 3.274 -7.600 1.349 1.00 0.00 H new ATOM 0 HD1 HIS A 90 -0.122 -7.154 -0.499 1.00 0.00 H new ATOM 0 HD2 HIS A 90 1.786 -9.320 2.574 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -1.627 -9.150 0.051 1.00 0.00 H new ATOM 617 N TYR A 91 3.751 -3.921 0.298 1.00 0.00 N ATOM 618 CA TYR A 91 4.925 -3.409 -0.394 1.00 0.00 C ATOM 619 C TYR A 91 5.586 -2.333 0.457 1.00 0.00 C ATOM 620 O TYR A 91 5.334 -1.138 0.289 1.00 0.00 O ATOM 621 CB TYR A 91 4.505 -2.920 -1.788 1.00 0.00 C ATOM 622 CG TYR A 91 5.626 -2.426 -2.677 1.00 0.00 C ATOM 623 CD1 TYR A 91 6.365 -3.317 -3.479 1.00 0.00 C ATOM 624 CD2 TYR A 91 5.904 -1.050 -2.719 1.00 0.00 C ATOM 625 CE1 TYR A 91 7.373 -2.824 -4.324 1.00 0.00 C ATOM 626 CE2 TYR A 91 6.923 -0.548 -3.548 1.00 0.00 C ATOM 627 CZ TYR A 91 7.657 -1.440 -4.365 1.00 0.00 C ATOM 628 OH TYR A 91 8.646 -0.993 -5.187 1.00 0.00 O ATOM 0 H TYR A 91 2.902 -3.412 0.054 1.00 0.00 H new ATOM 0 HA TYR A 91 5.673 -4.188 -0.540 1.00 0.00 H new ATOM 0 HB2 TYR A 91 3.993 -3.735 -2.300 1.00 0.00 H new ATOM 0 HB3 TYR A 91 3.781 -2.115 -1.667 1.00 0.00 H new ATOM 0 HD1 TYR A 91 6.157 -4.376 -3.444 1.00 0.00 H new ATOM 0 HD2 TYR A 91 5.329 -0.370 -2.108 1.00 0.00 H new ATOM 0 HE1 TYR A 91 7.934 -3.506 -4.946 1.00 0.00 H new ATOM 0 HE2 TYR A 91 7.143 0.509 -3.561 1.00 0.00 H new ATOM 0 HH TYR A 91 8.723 -0.019 -5.107 1.00 0.00 H new ATOM 638 N ASN A 92 6.441 -2.762 1.378 1.00 0.00 N ATOM 639 CA ASN A 92 7.173 -1.877 2.274 1.00 0.00 C ATOM 640 C ASN A 92 8.404 -1.363 1.535 1.00 0.00 C ATOM 641 O ASN A 92 9.529 -1.748 1.850 1.00 0.00 O ATOM 642 CB ASN A 92 7.533 -2.613 3.571 1.00 0.00 C ATOM 643 CG ASN A 92 6.280 -3.135 4.252 1.00 0.00 C ATOM 644 OD1 ASN A 92 5.369 -2.376 4.589 1.00 0.00 O ATOM 645 ND2 ASN A 92 6.171 -4.442 4.402 1.00 0.00 N ATOM 0 H ASN A 92 6.648 -3.750 1.525 1.00 0.00 H new ATOM 0 HA ASN A 92 6.560 -1.024 2.563 1.00 0.00 H new ATOM 0 HB2 ASN A 92 8.206 -3.441 3.351 1.00 0.00 H new ATOM 0 HB3 ASN A 92 8.065 -1.939 4.243 1.00 0.00 H new ATOM 0 HD21 ASN A 92 5.322 -4.840 4.803 1.00 0.00 H new ATOM 0 HD22 ASN A 92 6.936 -5.054 4.117 1.00 0.00 H new ATOM 652 N GLY A 93 8.186 -0.523 0.522 1.00 0.00 N ATOM 653 CA GLY A 93 9.224 0.085 -0.301 1.00 0.00 C ATOM 654 C GLY A 93 9.970 1.158 0.485 1.00 0.00 C ATOM 655 O GLY A 93 9.785 2.347 0.236 1.00 0.00 O ATOM 0 H GLY A 93 7.246 -0.239 0.245 1.00 0.00 H new ATOM 0 HA2 GLY A 93 9.924 -0.680 -0.638 1.00 0.00 H new ATOM 0 HA3 GLY A 93 8.778 0.524 -1.193 1.00 0.00 H new ATOM 659 N CYS A 94 10.796 0.730 1.436 1.00 0.00 N ATOM 660 CA CYS A 94 11.618 1.564 2.288 1.00 0.00 C ATOM 661 C CYS A 94 13.055 1.257 1.884 1.00 0.00 C ATOM 662 O CYS A 94 13.694 0.339 2.409 1.00 0.00 O ATOM 663 CB CYS A 94 11.308 1.291 3.771 1.00 0.00 C ATOM 664 SG CYS A 94 10.398 2.588 4.679 1.00 0.00 S ATOM 0 H CYS A 94 10.911 -0.263 1.639 1.00 0.00 H new ATOM 0 HA CYS A 94 11.424 2.630 2.165 1.00 0.00 H new ATOM 0 HB2 CYS A 94 10.733 0.367 3.833 1.00 0.00 H new ATOM 0 HB3 CYS A 94 12.251 1.114 4.287 1.00 0.00 H new ATOM 669 N SER A 95 13.532 2.010 0.900 1.00 0.00 N ATOM 670 CA SER A 95 14.898 1.976 0.404 1.00 0.00 C ATOM 671 C SER A 95 15.398 3.412 0.349 1.00 0.00 C ATOM 672 O SER A 95 16.340 3.761 1.059 1.00 0.00 O ATOM 673 CB SER A 95 14.995 1.265 -0.959 1.00 0.00 C ATOM 674 OG SER A 95 13.746 0.871 -1.517 1.00 0.00 O ATOM 0 H SER A 95 12.951 2.688 0.407 1.00 0.00 H new ATOM 0 HA SER A 95 15.531 1.393 1.073 1.00 0.00 H new ATOM 0 HB2 SER A 95 15.499 1.927 -1.663 1.00 0.00 H new ATOM 0 HB3 SER A 95 15.622 0.381 -0.848 1.00 0.00 H new ATOM 0 HG SER A 95 13.373 1.612 -2.039 1.00 0.00 H new ATOM 680 N GLU A 96 14.709 4.237 -0.441 1.00 0.00 N ATOM 681 CA GLU A 96 14.963 5.628 -0.731 1.00 0.00 C ATOM 682 C GLU A 96 14.999 6.473 0.536 1.00 0.00 C ATOM 683 O GLU A 96 14.582 6.060 1.619 1.00 0.00 O ATOM 684 CB GLU A 96 13.863 6.165 -1.659 1.00 0.00 C ATOM 685 CG GLU A 96 13.742 5.466 -3.020 1.00 0.00 C ATOM 686 CD GLU A 96 12.742 4.303 -3.066 1.00 0.00 C ATOM 687 OE1 GLU A 96 12.982 3.274 -2.396 1.00 0.00 O ATOM 688 OE2 GLU A 96 11.776 4.417 -3.858 1.00 0.00 O ATOM 0 H GLU A 96 13.881 3.904 -0.936 1.00 0.00 H new ATOM 0 HA GLU A 96 15.939 5.695 -1.212 1.00 0.00 H new ATOM 0 HB2 GLU A 96 12.906 6.084 -1.143 1.00 0.00 H new ATOM 0 HB3 GLU A 96 14.044 7.226 -1.831 1.00 0.00 H new ATOM 0 HG2 GLU A 96 13.451 6.205 -3.766 1.00 0.00 H new ATOM 0 HG3 GLU A 96 14.725 5.092 -3.308 1.00 0.00 H new ATOM 695 N ALA A 97 15.463 7.706 0.371 1.00 0.00 N ATOM 696 CA ALA A 97 15.659 8.652 1.456 1.00 0.00 C ATOM 697 C ALA A 97 14.746 9.862 1.358 1.00 0.00 C ATOM 698 O ALA A 97 14.392 10.458 2.372 1.00 0.00 O ATOM 699 CB ALA A 97 17.122 9.060 1.444 1.00 0.00 C ATOM 0 H ALA A 97 15.718 8.082 -0.542 1.00 0.00 H new ATOM 0 HA ALA A 97 15.397 8.175 2.400 1.00 0.00 H new ATOM 0 HB1 ALA A 97 17.308 9.772 2.248 1.00 0.00 H new ATOM 0 HB2 ALA A 97 17.747 8.179 1.589 1.00 0.00 H new ATOM 0 HB3 ALA A 97 17.363 9.522 0.487 1.00 0.00 H new ATOM 705 N ASN A 98 14.305 10.187 0.149 1.00 0.00 N ATOM 706 CA ASN A 98 13.415 11.312 -0.120 1.00 0.00 C ATOM 707 C ASN A 98 12.403 10.875 -1.161 1.00 0.00 C ATOM 708 O ASN A 98 12.691 10.923 -2.357 1.00 0.00 O ATOM 709 CB ASN A 98 14.200 12.566 -0.529 1.00 0.00 C ATOM 710 CG ASN A 98 14.909 13.138 0.688 1.00 0.00 C ATOM 711 OD1 ASN A 98 14.281 13.675 1.595 1.00 0.00 O ATOM 712 ND2 ASN A 98 16.223 13.015 0.776 1.00 0.00 N ATOM 0 H ASN A 98 14.561 9.666 -0.690 1.00 0.00 H new ATOM 0 HA ASN A 98 12.880 11.597 0.786 1.00 0.00 H new ATOM 0 HB2 ASN A 98 14.926 12.317 -1.303 1.00 0.00 H new ATOM 0 HB3 ASN A 98 13.524 13.309 -0.953 1.00 0.00 H new ATOM 0 HD21 ASN A 98 16.714 13.367 1.598 1.00 0.00 H new ATOM 0 HD22 ASN A 98 16.745 12.569 0.022 1.00 0.00 H new ATOM 719 N VAL A 99 11.246 10.400 -0.704 1.00 0.00 N ATOM 720 CA VAL A 99 10.086 10.098 -1.539 1.00 0.00 C ATOM 721 C VAL A 99 8.877 10.931 -1.090 1.00 0.00 C ATOM 722 O VAL A 99 8.851 11.458 0.027 1.00 0.00 O ATOM 723 CB VAL A 99 9.798 8.580 -1.532 1.00 0.00 C ATOM 724 CG1 VAL A 99 10.806 7.840 -2.419 1.00 0.00 C ATOM 725 CG2 VAL A 99 9.791 7.963 -0.122 1.00 0.00 C ATOM 0 H VAL A 99 11.086 10.209 0.285 1.00 0.00 H new ATOM 0 HA VAL A 99 10.300 10.375 -2.571 1.00 0.00 H new ATOM 0 HB VAL A 99 8.791 8.461 -1.932 1.00 0.00 H new ATOM 0 HG11 VAL A 99 10.589 6.772 -2.403 1.00 0.00 H new ATOM 0 HG12 VAL A 99 10.731 8.210 -3.441 1.00 0.00 H new ATOM 0 HG13 VAL A 99 11.815 8.011 -2.044 1.00 0.00 H new ATOM 0 HG21 VAL A 99 9.583 6.895 -0.193 1.00 0.00 H new ATOM 0 HG22 VAL A 99 10.764 8.112 0.345 1.00 0.00 H new ATOM 0 HG23 VAL A 99 9.021 8.444 0.482 1.00 0.00 H new ATOM 735 N THR A 100 7.853 11.002 -1.942 1.00 0.00 N ATOM 736 CA THR A 100 6.506 11.415 -1.578 1.00 0.00 C ATOM 737 C THR A 100 5.531 10.351 -2.084 1.00 0.00 C ATOM 738 O THR A 100 5.917 9.385 -2.760 1.00 0.00 O ATOM 739 CB THR A 100 6.138 12.809 -2.141 1.00 0.00 C ATOM 740 OG1 THR A 100 5.764 12.733 -3.505 1.00 0.00 O ATOM 741 CG2 THR A 100 7.219 13.877 -2.032 1.00 0.00 C ATOM 0 H THR A 100 7.945 10.766 -2.930 1.00 0.00 H new ATOM 0 HA THR A 100 6.448 11.506 -0.493 1.00 0.00 H new ATOM 0 HB THR A 100 5.310 13.116 -1.502 1.00 0.00 H new ATOM 0 HG1 THR A 100 5.536 13.628 -3.832 1.00 0.00 H new ATOM 0 HG21 THR A 100 6.852 14.811 -2.457 1.00 0.00 H new ATOM 0 HG22 THR A 100 7.474 14.031 -0.983 1.00 0.00 H new ATOM 0 HG23 THR A 100 8.106 13.554 -2.577 1.00 0.00 H new ATOM 749 N LYS A 101 4.235 10.580 -1.841 1.00 0.00 N ATOM 750 CA LYS A 101 3.149 9.766 -2.373 1.00 0.00 C ATOM 751 C LYS A 101 3.159 9.691 -3.898 1.00 0.00 C ATOM 752 O LYS A 101 2.496 8.835 -4.468 1.00 0.00 O ATOM 753 CB LYS A 101 1.809 10.349 -1.899 1.00 0.00 C ATOM 754 CG LYS A 101 1.510 9.876 -0.480 1.00 0.00 C ATOM 755 CD LYS A 101 0.397 10.672 0.217 1.00 0.00 C ATOM 756 CE LYS A 101 -0.993 10.070 -0.015 1.00 0.00 C ATOM 757 NZ LYS A 101 -2.046 10.836 0.698 1.00 0.00 N ATOM 0 H LYS A 101 3.912 11.352 -1.258 1.00 0.00 H new ATOM 0 HA LYS A 101 3.287 8.751 -2.001 1.00 0.00 H new ATOM 0 HB2 LYS A 101 1.845 11.438 -1.929 1.00 0.00 H new ATOM 0 HB3 LYS A 101 1.009 10.038 -2.571 1.00 0.00 H new ATOM 0 HG2 LYS A 101 1.227 8.824 -0.510 1.00 0.00 H new ATOM 0 HG3 LYS A 101 2.420 9.945 0.115 1.00 0.00 H new ATOM 0 HD2 LYS A 101 0.598 10.710 1.288 1.00 0.00 H new ATOM 0 HD3 LYS A 101 0.409 11.700 -0.146 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -1.211 10.058 -1.083 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -1.003 9.034 0.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -2.973 10.401 0.519 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -1.851 10.827 1.719 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -2.053 11.818 0.356 1.00 0.00 H new ATOM 771 N GLU A 102 3.873 10.571 -4.587 1.00 0.00 N ATOM 772 CA GLU A 102 3.989 10.557 -6.036 1.00 0.00 C ATOM 773 C GLU A 102 5.243 9.817 -6.522 1.00 0.00 C ATOM 774 O GLU A 102 5.472 9.734 -7.731 1.00 0.00 O ATOM 775 CB GLU A 102 3.909 12.010 -6.534 1.00 0.00 C ATOM 776 CG GLU A 102 2.456 12.517 -6.643 1.00 0.00 C ATOM 777 CD GLU A 102 1.519 11.580 -7.425 1.00 0.00 C ATOM 778 OE1 GLU A 102 1.823 11.215 -8.578 1.00 0.00 O ATOM 779 OE2 GLU A 102 0.480 11.155 -6.857 1.00 0.00 O ATOM 0 H GLU A 102 4.396 11.327 -4.145 1.00 0.00 H new ATOM 0 HA GLU A 102 3.164 9.988 -6.465 1.00 0.00 H new ATOM 0 HB2 GLU A 102 4.466 12.655 -5.854 1.00 0.00 H new ATOM 0 HB3 GLU A 102 4.390 12.084 -7.509 1.00 0.00 H new ATOM 0 HG2 GLU A 102 2.056 12.658 -5.639 1.00 0.00 H new ATOM 0 HG3 GLU A 102 2.459 13.495 -7.125 1.00 0.00 H new ATOM 786 N ALA A 103 6.051 9.277 -5.607 1.00 0.00 N ATOM 787 CA ALA A 103 7.271 8.536 -5.883 1.00 0.00 C ATOM 788 C ALA A 103 7.142 7.112 -5.344 1.00 0.00 C ATOM 789 O ALA A 103 7.139 6.154 -6.118 1.00 0.00 O ATOM 790 CB ALA A 103 8.453 9.288 -5.261 1.00 0.00 C ATOM 0 H ALA A 103 5.858 9.351 -4.608 1.00 0.00 H new ATOM 0 HA ALA A 103 7.444 8.459 -6.956 1.00 0.00 H new ATOM 0 HB1 ALA A 103 9.376 8.743 -5.460 1.00 0.00 H new ATOM 0 HB2 ALA A 103 8.519 10.285 -5.696 1.00 0.00 H new ATOM 0 HB3 ALA A 103 8.306 9.371 -4.184 1.00 0.00 H new ATOM 796 N PHE A 104 7.015 6.973 -4.024 1.00 0.00 N ATOM 797 CA PHE A 104 6.963 5.679 -3.363 1.00 0.00 C ATOM 798 C PHE A 104 5.678 4.932 -3.751 1.00 0.00 C ATOM 799 O PHE A 104 5.748 3.789 -4.200 1.00 0.00 O ATOM 800 CB PHE A 104 7.122 5.864 -1.844 1.00 0.00 C ATOM 801 CG PHE A 104 6.391 4.816 -1.041 1.00 0.00 C ATOM 802 CD1 PHE A 104 6.880 3.500 -0.965 1.00 0.00 C ATOM 803 CD2 PHE A 104 5.135 5.136 -0.506 1.00 0.00 C ATOM 804 CE1 PHE A 104 6.096 2.500 -0.366 1.00 0.00 C ATOM 805 CE2 PHE A 104 4.340 4.129 0.056 1.00 0.00 C ATOM 806 CZ PHE A 104 4.823 2.809 0.139 1.00 0.00 C ATOM 0 H PHE A 104 6.945 7.764 -3.384 1.00 0.00 H new ATOM 0 HA PHE A 104 7.793 5.056 -3.696 1.00 0.00 H new ATOM 0 HB2 PHE A 104 8.181 5.835 -1.589 1.00 0.00 H new ATOM 0 HB3 PHE A 104 6.754 6.851 -1.563 1.00 0.00 H new ATOM 0 HD1 PHE A 104 7.854 3.259 -1.365 1.00 0.00 H new ATOM 0 HD2 PHE A 104 4.782 6.156 -0.527 1.00 0.00 H new ATOM 0 HE1 PHE A 104 6.474 1.491 -0.294 1.00 0.00 H new ATOM 0 HE2 PHE A 104 3.354 4.366 0.427 1.00 0.00 H new ATOM 0 HZ PHE A 104 4.217 2.037 0.589 1.00 0.00 H new ATOM 816 N VAL A 105 4.504 5.559 -3.605 1.00 0.00 N ATOM 817 CA VAL A 105 3.236 4.888 -3.902 1.00 0.00 C ATOM 818 C VAL A 105 3.156 4.591 -5.401 1.00 0.00 C ATOM 819 O VAL A 105 2.705 3.515 -5.770 1.00 0.00 O ATOM 820 CB VAL A 105 2.036 5.721 -3.430 1.00 0.00 C ATOM 821 CG1 VAL A 105 0.678 5.109 -3.714 1.00 0.00 C ATOM 822 CG2 VAL A 105 2.075 6.128 -1.967 1.00 0.00 C ATOM 0 H VAL A 105 4.408 6.523 -3.285 1.00 0.00 H new ATOM 0 HA VAL A 105 3.199 3.946 -3.354 1.00 0.00 H new ATOM 0 HB VAL A 105 2.152 6.613 -4.046 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -0.104 5.771 -3.343 1.00 0.00 H new ATOM 0 HG12 VAL A 105 0.558 4.972 -4.789 1.00 0.00 H new ATOM 0 HG13 VAL A 105 0.602 4.143 -3.214 1.00 0.00 H new ATOM 0 HG21 VAL A 105 1.186 6.712 -1.728 1.00 0.00 H new ATOM 0 HG22 VAL A 105 2.101 5.236 -1.342 1.00 0.00 H new ATOM 0 HG23 VAL A 105 2.965 6.729 -1.780 1.00 0.00 H new ATOM 832 N THR A 106 3.647 5.471 -6.275 1.00 0.00 N ATOM 833 CA THR A 106 3.842 5.157 -7.679 1.00 0.00 C ATOM 834 C THR A 106 4.641 3.855 -7.839 1.00 0.00 C ATOM 835 O THR A 106 4.245 3.000 -8.628 1.00 0.00 O ATOM 836 CB THR A 106 4.496 6.361 -8.369 1.00 0.00 C ATOM 837 OG1 THR A 106 3.587 7.444 -8.329 1.00 0.00 O ATOM 838 CG2 THR A 106 4.881 6.022 -9.806 1.00 0.00 C ATOM 0 H THR A 106 3.919 6.421 -6.022 1.00 0.00 H new ATOM 0 HA THR A 106 2.884 4.976 -8.166 1.00 0.00 H new ATOM 0 HB THR A 106 5.414 6.632 -7.848 1.00 0.00 H new ATOM 0 HG1 THR A 106 4.085 8.288 -8.297 1.00 0.00 H new ATOM 0 HG21 THR A 106 5.343 6.892 -10.274 1.00 0.00 H new ATOM 0 HG22 THR A 106 5.587 5.192 -9.807 1.00 0.00 H new ATOM 0 HG23 THR A 106 3.989 5.740 -10.365 1.00 0.00 H new ATOM 846 N GLY A 107 5.726 3.645 -7.090 1.00 0.00 N ATOM 847 CA GLY A 107 6.475 2.396 -7.141 1.00 0.00 C ATOM 848 C GLY A 107 5.648 1.208 -6.655 1.00 0.00 C ATOM 849 O GLY A 107 5.765 0.111 -7.209 1.00 0.00 O ATOM 0 H GLY A 107 6.104 4.332 -6.438 1.00 0.00 H new ATOM 0 HA2 GLY A 107 6.804 2.213 -8.164 1.00 0.00 H new ATOM 0 HA3 GLY A 107 7.372 2.487 -6.529 1.00 0.00 H new ATOM 853 N CYS A 108 4.783 1.423 -5.658 1.00 0.00 N ATOM 854 CA CYS A 108 3.883 0.380 -5.171 1.00 0.00 C ATOM 855 C CYS A 108 2.825 0.057 -6.228 1.00 0.00 C ATOM 856 O CYS A 108 2.423 -1.097 -6.354 1.00 0.00 O ATOM 857 CB CYS A 108 3.261 0.707 -3.794 1.00 0.00 C ATOM 858 SG CYS A 108 1.596 1.440 -3.745 1.00 0.00 S ATOM 0 H CYS A 108 4.690 2.315 -5.173 1.00 0.00 H new ATOM 0 HA CYS A 108 4.482 -0.515 -5.004 1.00 0.00 H new ATOM 0 HB2 CYS A 108 3.234 -0.216 -3.215 1.00 0.00 H new ATOM 0 HB3 CYS A 108 3.938 1.387 -3.278 1.00 0.00 H new ATOM 863 N ILE A 109 2.400 1.048 -7.011 1.00 0.00 N ATOM 864 CA ILE A 109 1.387 0.916 -8.043 1.00 0.00 C ATOM 865 C ILE A 109 1.968 0.246 -9.270 1.00 0.00 C ATOM 866 O ILE A 109 1.369 -0.689 -9.778 1.00 0.00 O ATOM 867 CB ILE A 109 0.736 2.280 -8.317 1.00 0.00 C ATOM 868 CG1 ILE A 109 -0.399 2.381 -7.287 1.00 0.00 C ATOM 869 CG2 ILE A 109 0.181 2.485 -9.736 1.00 0.00 C ATOM 870 CD1 ILE A 109 -0.848 3.817 -7.120 1.00 0.00 C ATOM 0 H ILE A 109 2.768 1.996 -6.937 1.00 0.00 H new ATOM 0 HA ILE A 109 0.584 0.261 -7.703 1.00 0.00 H new ATOM 0 HB ILE A 109 1.497 3.056 -8.234 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -1.241 1.767 -7.606 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -0.062 1.987 -6.328 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -0.255 3.481 -9.816 1.00 0.00 H new ATOM 0 HG22 ILE A 109 0.989 2.383 -10.461 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -0.585 1.737 -9.939 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -1.652 3.864 -6.386 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -0.009 4.423 -6.778 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -1.206 4.200 -8.076 1.00 0.00 H new ATOM 882 N ASN A 110 3.159 0.639 -9.711 1.00 0.00 N ATOM 883 CA ASN A 110 3.876 -0.092 -10.767 1.00 0.00 C ATOM 884 C ASN A 110 3.991 -1.571 -10.422 1.00 0.00 C ATOM 885 O ASN A 110 3.959 -2.423 -11.312 1.00 0.00 O ATOM 886 CB ASN A 110 5.304 0.424 -10.977 1.00 0.00 C ATOM 887 CG ASN A 110 5.375 1.662 -11.842 1.00 0.00 C ATOM 888 OD1 ASN A 110 5.523 1.587 -13.057 1.00 0.00 O ATOM 889 ND2 ASN A 110 5.302 2.815 -11.220 1.00 0.00 N ATOM 0 H ASN A 110 3.653 1.458 -9.358 1.00 0.00 H new ATOM 0 HA ASN A 110 3.292 0.062 -11.674 1.00 0.00 H new ATOM 0 HB2 ASN A 110 5.750 0.642 -10.007 1.00 0.00 H new ATOM 0 HB3 ASN A 110 5.903 -0.364 -11.433 1.00 0.00 H new ATOM 0 HD21 ASN A 110 5.369 3.685 -11.749 1.00 0.00 H new ATOM 0 HD22 ASN A 110 5.179 2.842 -10.208 1.00 0.00 H new ATOM 896 N ALA A 111 4.144 -1.882 -9.136 1.00 0.00 N ATOM 897 CA ALA A 111 4.223 -3.242 -8.667 1.00 0.00 C ATOM 898 C ALA A 111 2.827 -3.869 -8.712 1.00 0.00 C ATOM 899 O ALA A 111 2.627 -4.885 -9.378 1.00 0.00 O ATOM 900 CB ALA A 111 4.864 -3.233 -7.274 1.00 0.00 C ATOM 0 H ALA A 111 4.216 -1.185 -8.395 1.00 0.00 H new ATOM 0 HA ALA A 111 4.854 -3.863 -9.303 1.00 0.00 H new ATOM 0 HB1 ALA A 111 4.934 -4.254 -6.899 1.00 0.00 H new ATOM 0 HB2 ALA A 111 5.862 -2.800 -7.336 1.00 0.00 H new ATOM 0 HB3 ALA A 111 4.252 -2.638 -6.596 1.00 0.00 H new ATOM 906 N THR A 112 1.863 -3.272 -8.018 1.00 0.00 N ATOM 907 CA THR A 112 0.544 -3.851 -7.817 1.00 0.00 C ATOM 908 C THR A 112 -0.247 -3.934 -9.134 1.00 0.00 C ATOM 909 O THR A 112 -1.008 -4.883 -9.325 1.00 0.00 O ATOM 910 CB THR A 112 -0.192 -3.073 -6.712 1.00 0.00 C ATOM 911 OG1 THR A 112 -1.210 -3.853 -6.155 1.00 0.00 O ATOM 912 CG2 THR A 112 -0.855 -1.797 -7.192 1.00 0.00 C ATOM 0 H THR A 112 1.980 -2.361 -7.575 1.00 0.00 H new ATOM 0 HA THR A 112 0.648 -4.883 -7.482 1.00 0.00 H new ATOM 0 HB THR A 112 0.586 -2.822 -5.991 1.00 0.00 H new ATOM 0 HG1 THR A 112 -0.816 -4.615 -5.681 1.00 0.00 H new ATOM 0 HG21 THR A 112 -1.352 -1.308 -6.354 1.00 0.00 H new ATOM 0 HG22 THR A 112 -0.100 -1.129 -7.607 1.00 0.00 H new ATOM 0 HG23 THR A 112 -1.590 -2.036 -7.961 1.00 0.00 H new ATOM 920 N GLN A 113 -0.041 -3.011 -10.088 1.00 0.00 N ATOM 921 CA GLN A 113 -0.801 -2.999 -11.339 1.00 0.00 C ATOM 922 C GLN A 113 -0.570 -4.285 -12.123 1.00 0.00 C ATOM 923 O GLN A 113 -1.443 -4.710 -12.874 1.00 0.00 O ATOM 924 CB GLN A 113 -0.523 -1.756 -12.212 1.00 0.00 C ATOM 925 CG GLN A 113 0.858 -1.698 -12.887 1.00 0.00 C ATOM 926 CD GLN A 113 0.899 -0.738 -14.073 1.00 0.00 C ATOM 927 OE1 GLN A 113 1.131 -1.168 -15.202 1.00 0.00 O ATOM 928 NE2 GLN A 113 0.699 0.556 -13.880 1.00 0.00 N ATOM 0 H GLN A 113 0.649 -2.263 -10.012 1.00 0.00 H new ATOM 0 HA GLN A 113 -1.853 -2.941 -11.060 1.00 0.00 H new ATOM 0 HB2 GLN A 113 -1.287 -1.704 -12.988 1.00 0.00 H new ATOM 0 HB3 GLN A 113 -0.639 -0.868 -11.591 1.00 0.00 H new ATOM 0 HG2 GLN A 113 1.603 -1.392 -12.153 1.00 0.00 H new ATOM 0 HG3 GLN A 113 1.134 -2.697 -13.225 1.00 0.00 H new ATOM 0 HE21 GLN A 113 0.507 0.908 -12.942 1.00 0.00 H new ATOM 0 HE22 GLN A 113 0.737 1.201 -14.669 1.00 0.00 H new ATOM 937 N ALA A 114 0.601 -4.898 -11.924 1.00 0.00 N ATOM 938 CA ALA A 114 1.008 -6.159 -12.505 1.00 0.00 C ATOM 939 C ALA A 114 0.902 -7.318 -11.503 1.00 0.00 C ATOM 940 O ALA A 114 1.177 -8.449 -11.900 1.00 0.00 O ATOM 941 CB ALA A 114 2.435 -5.991 -13.031 1.00 0.00 C ATOM 0 H ALA A 114 1.320 -4.499 -11.321 1.00 0.00 H new ATOM 0 HA ALA A 114 0.337 -6.420 -13.323 1.00 0.00 H new ATOM 0 HB1 ALA A 114 2.771 -6.927 -13.476 1.00 0.00 H new ATOM 0 HB2 ALA A 114 2.455 -5.203 -13.784 1.00 0.00 H new ATOM 0 HB3 ALA A 114 3.097 -5.722 -12.208 1.00 0.00 H new ATOM 947 N ALA A 115 0.524 -7.073 -10.239 1.00 0.00 N ATOM 948 CA ALA A 115 0.156 -8.141 -9.308 1.00 0.00 C ATOM 949 C ALA A 115 -1.306 -8.557 -9.499 1.00 0.00 C ATOM 950 O ALA A 115 -1.672 -9.668 -9.124 1.00 0.00 O ATOM 951 CB ALA A 115 0.385 -7.704 -7.849 1.00 0.00 C ATOM 0 H ALA A 115 0.466 -6.136 -9.840 1.00 0.00 H new ATOM 0 HA ALA A 115 0.796 -8.997 -9.523 1.00 0.00 H new ATOM 0 HB1 ALA A 115 0.104 -8.515 -7.178 1.00 0.00 H new ATOM 0 HB2 ALA A 115 1.437 -7.460 -7.703 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -0.224 -6.826 -7.632 1.00 0.00 H new ATOM 957 N ASN A 116 -2.151 -7.670 -10.045 1.00 0.00 N ATOM 958 CA ASN A 116 -3.595 -7.889 -10.139 1.00 0.00 C ATOM 959 C ASN A 116 -4.136 -7.331 -11.464 1.00 0.00 C ATOM 960 O ASN A 116 -5.163 -6.651 -11.464 1.00 0.00 O ATOM 961 CB ASN A 116 -4.371 -7.319 -8.919 1.00 0.00 C ATOM 962 CG ASN A 116 -3.603 -7.171 -7.620 1.00 0.00 C ATOM 963 OD1 ASN A 116 -3.557 -8.064 -6.781 1.00 0.00 O ATOM 964 ND2 ASN A 116 -3.011 -6.008 -7.434 1.00 0.00 N ATOM 0 H ASN A 116 -1.847 -6.778 -10.434 1.00 0.00 H new ATOM 0 HA ASN A 116 -3.761 -8.966 -10.123 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -4.762 -6.339 -9.194 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -5.230 -7.964 -8.733 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -2.495 -5.830 -6.572 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -3.068 -5.286 -8.152 1.00 0.00 H new ATOM 971 N GLN A 117 -3.468 -7.558 -12.608 1.00 0.00 N ATOM 972 CA GLN A 117 -3.916 -7.011 -13.895 1.00 0.00 C ATOM 973 C GLN A 117 -5.398 -7.327 -14.127 1.00 0.00 C ATOM 974 O GLN A 117 -6.202 -6.424 -14.367 1.00 0.00 O ATOM 975 CB GLN A 117 -3.095 -7.558 -15.071 1.00 0.00 C ATOM 976 CG GLN A 117 -1.640 -7.092 -15.141 1.00 0.00 C ATOM 977 CD GLN A 117 -1.107 -7.174 -16.569 1.00 0.00 C ATOM 978 OE1 GLN A 117 -1.350 -8.140 -17.291 1.00 0.00 O ATOM 979 NE2 GLN A 117 -0.418 -6.143 -17.029 1.00 0.00 N ATOM 0 H GLN A 117 -2.616 -8.117 -12.665 1.00 0.00 H new ATOM 0 HA GLN A 117 -3.770 -5.932 -13.848 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -3.106 -8.647 -15.022 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -3.592 -7.276 -15.999 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -1.565 -6.066 -14.780 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -1.025 -7.707 -14.484 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -0.223 -5.348 -16.421 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -0.082 -6.143 -17.992 1.00 0.00 H new ATOM 988 N GLY A 118 -5.767 -8.595 -13.941 1.00 0.00 N ATOM 989 CA GLY A 118 -7.116 -9.115 -14.094 1.00 0.00 C ATOM 990 C GLY A 118 -8.109 -8.609 -13.051 1.00 0.00 C ATOM 991 O GLY A 118 -9.208 -9.154 -12.957 1.00 0.00 O ATOM 0 H GLY A 118 -5.099 -9.316 -13.667 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -7.484 -8.851 -15.086 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -7.080 -10.203 -14.046 1.00 0.00 H new ATOM 995 N GLU A 119 -7.761 -7.624 -12.226 1.00 0.00 N ATOM 996 CA GLU A 119 -8.605 -7.075 -11.192 1.00 0.00 C ATOM 997 C GLU A 119 -8.796 -5.569 -11.382 1.00 0.00 C ATOM 998 O GLU A 119 -9.901 -5.085 -11.133 1.00 0.00 O ATOM 999 CB GLU A 119 -8.042 -7.512 -9.837 1.00 0.00 C ATOM 1000 CG GLU A 119 -8.619 -6.661 -8.721 1.00 0.00 C ATOM 1001 CD GLU A 119 -8.393 -7.191 -7.310 1.00 0.00 C ATOM 1002 OE1 GLU A 119 -7.697 -8.211 -7.092 1.00 0.00 O ATOM 1003 OE2 GLU A 119 -8.965 -6.534 -6.415 1.00 0.00 O ATOM 0 H GLU A 119 -6.846 -7.176 -12.269 1.00 0.00 H new ATOM 0 HA GLU A 119 -9.621 -7.466 -11.247 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -8.277 -8.562 -9.660 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -6.955 -7.426 -9.843 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -8.188 -5.662 -8.789 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -9.692 -6.557 -8.884 1.00 0.00 H new ATOM 1010 N PHE A 120 -7.801 -4.842 -11.900 1.00 0.00 N ATOM 1011 CA PHE A 120 -8.048 -3.488 -12.404 1.00 0.00 C ATOM 1012 C PHE A 120 -8.898 -3.493 -13.679 1.00 0.00 C ATOM 1013 O PHE A 120 -9.579 -2.507 -13.944 1.00 0.00 O ATOM 1014 CB PHE A 120 -6.731 -2.754 -12.660 1.00 0.00 C ATOM 1015 CG PHE A 120 -5.888 -2.625 -11.412 1.00 0.00 C ATOM 1016 CD1 PHE A 120 -6.190 -1.647 -10.449 1.00 0.00 C ATOM 1017 CD2 PHE A 120 -4.859 -3.549 -11.173 1.00 0.00 C ATOM 1018 CE1 PHE A 120 -5.440 -1.578 -9.263 1.00 0.00 C ATOM 1019 CE2 PHE A 120 -4.119 -3.489 -9.982 1.00 0.00 C ATOM 1020 CZ PHE A 120 -4.399 -2.492 -9.035 1.00 0.00 C ATOM 0 H PHE A 120 -6.835 -5.160 -11.981 1.00 0.00 H new ATOM 0 HA PHE A 120 -8.608 -2.961 -11.631 1.00 0.00 H new ATOM 0 HB2 PHE A 120 -6.164 -3.287 -13.424 1.00 0.00 H new ATOM 0 HB3 PHE A 120 -6.943 -1.761 -13.055 1.00 0.00 H new ATOM 0 HD1 PHE A 120 -6.997 -0.950 -10.620 1.00 0.00 H new ATOM 0 HD2 PHE A 120 -4.636 -4.308 -11.908 1.00 0.00 H new ATOM 0 HE1 PHE A 120 -5.664 -0.821 -8.526 1.00 0.00 H new ATOM 0 HE2 PHE A 120 -3.336 -4.209 -9.795 1.00 0.00 H new ATOM 0 HZ PHE A 120 -3.813 -2.428 -8.130 1.00 0.00 H new ATOM 1030 N GLN A 121 -8.887 -4.578 -14.459 1.00 0.00 N ATOM 1031 CA GLN A 121 -9.665 -4.699 -15.679 1.00 0.00 C ATOM 1032 C GLN A 121 -11.022 -5.325 -15.357 1.00 0.00 C ATOM 1033 O GLN A 121 -11.237 -6.536 -15.486 1.00 0.00 O ATOM 1034 CB GLN A 121 -8.871 -5.308 -16.840 1.00 0.00 C ATOM 1035 CG GLN A 121 -8.499 -6.765 -16.637 1.00 0.00 C ATOM 1036 CD GLN A 121 -9.056 -7.669 -17.744 1.00 0.00 C ATOM 1037 OE1 GLN A 121 -8.308 -8.156 -18.586 1.00 0.00 O ATOM 1038 NE2 GLN A 121 -10.358 -7.893 -17.798 1.00 0.00 N ATOM 0 H GLN A 121 -8.327 -5.405 -14.251 1.00 0.00 H new ATOM 0 HA GLN A 121 -9.892 -3.711 -16.080 1.00 0.00 H new ATOM 0 HB2 GLN A 121 -9.457 -5.218 -17.754 1.00 0.00 H new ATOM 0 HB3 GLN A 121 -7.960 -4.728 -16.987 1.00 0.00 H new ATOM 0 HG2 GLN A 121 -7.414 -6.859 -16.606 1.00 0.00 H new ATOM 0 HG3 GLN A 121 -8.876 -7.103 -15.672 1.00 0.00 H new ATOM 0 HE21 GLN A 121 -10.975 -7.486 -17.095 1.00 0.00 H new ATOM 0 HE22 GLN A 121 -10.745 -8.473 -18.542 1.00 0.00 H new ATOM 1047 N LYS A 122 -11.931 -4.498 -14.856 1.00 0.00 N ATOM 1048 CA LYS A 122 -13.358 -4.817 -14.816 1.00 0.00 C ATOM 1049 C LYS A 122 -14.089 -3.957 -15.848 1.00 0.00 C ATOM 1050 O LYS A 122 -13.762 -2.773 -15.969 1.00 0.00 O ATOM 1051 CB LYS A 122 -13.943 -4.595 -13.412 1.00 0.00 C ATOM 1052 CG LYS A 122 -13.192 -5.262 -12.270 1.00 0.00 C ATOM 1053 CD LYS A 122 -13.254 -6.785 -12.434 1.00 0.00 C ATOM 1054 CE LYS A 122 -12.638 -7.483 -11.236 1.00 0.00 C ATOM 1055 NZ LYS A 122 -13.431 -7.324 -10.001 1.00 0.00 N ATOM 0 H LYS A 122 -11.702 -3.584 -14.464 1.00 0.00 H new ATOM 0 HA LYS A 122 -13.491 -5.872 -15.057 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -13.981 -3.523 -13.220 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -14.971 -4.956 -13.406 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -12.154 -4.929 -12.260 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -13.629 -4.971 -11.315 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -14.291 -7.101 -12.551 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -12.727 -7.079 -13.342 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -12.531 -8.545 -11.457 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -11.635 -7.089 -11.070 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -13.067 -7.968 -9.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -13.358 -6.342 -9.666 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -14.427 -7.550 -10.197 1.00 0.00 H new ATOM 1069 N PRO A 123 -15.136 -4.482 -16.515 1.00 0.00 N ATOM 1070 CA PRO A 123 -15.872 -3.752 -17.546 1.00 0.00 C ATOM 1071 C PRO A 123 -16.644 -2.538 -17.011 1.00 0.00 C ATOM 1072 O PRO A 123 -17.165 -1.749 -17.804 1.00 0.00 O ATOM 1073 CB PRO A 123 -16.798 -4.782 -18.200 1.00 0.00 C ATOM 1074 CG PRO A 123 -17.007 -5.828 -17.108 1.00 0.00 C ATOM 1075 CD PRO A 123 -15.666 -5.833 -16.378 1.00 0.00 C ATOM 0 HA PRO A 123 -15.179 -3.315 -18.265 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -17.742 -4.332 -18.509 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -16.346 -5.218 -19.091 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -17.828 -5.559 -16.443 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -17.243 -6.807 -17.526 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -15.793 -6.099 -15.329 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -14.986 -6.566 -16.813 1.00 0.00 H new ATOM 1083 N ASP A 124 -16.713 -2.359 -15.688 1.00 0.00 N ATOM 1084 CA ASP A 124 -17.197 -1.141 -15.053 1.00 0.00 C ATOM 1085 C ASP A 124 -16.368 0.045 -15.534 1.00 0.00 C ATOM 1086 O ASP A 124 -16.936 1.047 -15.950 1.00 0.00 O ATOM 1087 CB ASP A 124 -17.057 -1.199 -13.518 1.00 0.00 C ATOM 1088 CG ASP A 124 -17.957 -2.210 -12.825 1.00 0.00 C ATOM 1089 OD1 ASP A 124 -17.811 -3.415 -13.103 1.00 0.00 O ATOM 1090 OD2 ASP A 124 -18.700 -1.819 -11.891 1.00 0.00 O ATOM 0 H ASP A 124 -16.427 -3.075 -15.020 1.00 0.00 H new ATOM 0 HA ASP A 124 -18.249 -1.036 -15.318 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -16.021 -1.430 -13.272 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -17.268 -0.210 -13.112 1.00 0.00 H new ATOM 1095 N ASN A 125 -15.043 -0.036 -15.348 1.00 0.00 N ATOM 1096 CA ASN A 125 -14.001 1.007 -15.346 1.00 0.00 C ATOM 1097 C ASN A 125 -14.381 2.434 -14.934 1.00 0.00 C ATOM 1098 O ASN A 125 -13.606 3.369 -15.149 1.00 0.00 O ATOM 1099 CB ASN A 125 -13.146 0.972 -16.627 1.00 0.00 C ATOM 1100 CG ASN A 125 -13.703 1.820 -17.766 1.00 0.00 C ATOM 1101 OD1 ASN A 125 -14.772 1.552 -18.296 1.00 0.00 O ATOM 1102 ND2 ASN A 125 -13.012 2.864 -18.194 1.00 0.00 N ATOM 0 H ASN A 125 -14.622 -0.948 -15.173 1.00 0.00 H new ATOM 0 HA ASN A 125 -13.396 0.703 -14.492 1.00 0.00 H new ATOM 0 HB2 ASN A 125 -12.139 1.316 -16.390 1.00 0.00 H new ATOM 0 HB3 ASN A 125 -13.058 -0.060 -16.965 1.00 0.00 H new ATOM 0 HD21 ASN A 125 -13.372 3.435 -18.958 1.00 0.00 H new ATOM 0 HD22 ASN A 125 -12.119 3.097 -17.760 1.00 0.00 H new ATOM 1109 N LYS A 126 -15.524 2.618 -14.284 1.00 0.00 N ATOM 1110 CA LYS A 126 -16.065 3.920 -13.970 1.00 0.00 C ATOM 1111 C LYS A 126 -15.573 4.345 -12.595 1.00 0.00 C ATOM 1112 O LYS A 126 -14.443 4.792 -12.429 1.00 0.00 O ATOM 1113 CB LYS A 126 -17.596 3.851 -14.144 1.00 0.00 C ATOM 1114 CG LYS A 126 -18.242 5.178 -14.457 1.00 0.00 C ATOM 1115 CD LYS A 126 -18.209 6.149 -13.271 1.00 0.00 C ATOM 1116 CE LYS A 126 -19.069 7.367 -13.586 1.00 0.00 C ATOM 1117 NZ LYS A 126 -20.434 7.040 -14.067 1.00 0.00 N ATOM 0 H LYS A 126 -16.106 1.847 -13.957 1.00 0.00 H new ATOM 0 HA LYS A 126 -15.719 4.703 -14.644 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -17.828 3.148 -14.944 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -18.037 3.451 -13.231 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -17.734 5.633 -15.307 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -19.277 5.012 -14.756 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -18.576 5.654 -12.372 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -17.183 6.457 -13.069 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -19.149 7.982 -12.690 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -18.564 7.969 -14.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -21.037 7.885 -14.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -20.387 6.725 -15.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -20.836 6.281 -13.481 1.00 0.00 H new ATOM 1131 N LEU A 127 -16.429 4.185 -11.588 1.00 0.00 N ATOM 1132 CA LEU A 127 -16.168 4.638 -10.241 1.00 0.00 C ATOM 1133 C LEU A 127 -15.249 3.615 -9.604 1.00 0.00 C ATOM 1134 O LEU A 127 -14.316 4.020 -8.941 1.00 0.00 O ATOM 1135 CB LEU A 127 -17.464 4.805 -9.436 1.00 0.00 C ATOM 1136 CG LEU A 127 -17.748 6.205 -8.859 1.00 0.00 C ATOM 1137 CD1 LEU A 127 -16.696 6.723 -7.873 1.00 0.00 C ATOM 1138 CD2 LEU A 127 -17.971 7.295 -9.905 1.00 0.00 C ATOM 0 H LEU A 127 -17.335 3.729 -11.696 1.00 0.00 H new ATOM 0 HA LEU A 127 -15.700 5.622 -10.255 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -18.300 4.526 -10.077 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -17.445 4.095 -8.610 1.00 0.00 H new ATOM 0 HG LEU A 127 -18.680 6.021 -8.324 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -16.983 7.714 -7.522 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -16.627 6.043 -7.024 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -15.728 6.781 -8.371 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -18.164 8.245 -9.406 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -17.082 7.387 -10.530 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -18.826 7.032 -10.527 1.00 0.00 H new ATOM 1150 N HIS A 128 -15.439 2.315 -9.868 1.00 0.00 N ATOM 1151 CA HIS A 128 -14.529 1.269 -9.410 1.00 0.00 C ATOM 1152 C HIS A 128 -13.069 1.642 -9.709 1.00 0.00 C ATOM 1153 O HIS A 128 -12.245 1.600 -8.800 1.00 0.00 O ATOM 1154 CB HIS A 128 -14.955 -0.108 -9.965 1.00 0.00 C ATOM 1155 CG HIS A 128 -13.833 -0.936 -10.545 1.00 0.00 C ATOM 1156 ND1 HIS A 128 -12.947 -1.730 -9.849 1.00 0.00 N ATOM 1157 CD2 HIS A 128 -13.455 -0.947 -11.860 1.00 0.00 C ATOM 1158 CE1 HIS A 128 -12.044 -2.191 -10.734 1.00 0.00 C ATOM 1159 NE2 HIS A 128 -12.315 -1.737 -11.968 1.00 0.00 N ATOM 0 H HIS A 128 -16.231 1.964 -10.406 1.00 0.00 H new ATOM 0 HA HIS A 128 -14.593 1.184 -8.325 1.00 0.00 H new ATOM 0 HB2 HIS A 128 -15.429 -0.675 -9.164 1.00 0.00 H new ATOM 0 HB3 HIS A 128 -15.710 0.045 -10.736 1.00 0.00 H new ATOM 0 HD2 HIS A 128 -13.953 -0.434 -12.670 1.00 0.00 H new ATOM 0 HE1 HIS A 128 -11.215 -2.837 -10.486 1.00 0.00 H new ATOM 0 HE2 HIS A 128 -11.788 -1.933 -12.819 1.00 0.00 H new ATOM 1167 N GLN A 129 -12.767 2.075 -10.940 1.00 0.00 N ATOM 1168 CA GLN A 129 -11.426 2.471 -11.348 1.00 0.00 C ATOM 1169 C GLN A 129 -10.949 3.683 -10.546 1.00 0.00 C ATOM 1170 O GLN A 129 -9.842 3.684 -10.000 1.00 0.00 O ATOM 1171 CB GLN A 129 -11.426 2.766 -12.849 1.00 0.00 C ATOM 1172 CG GLN A 129 -10.033 2.600 -13.457 1.00 0.00 C ATOM 1173 CD GLN A 129 -9.810 1.178 -13.970 1.00 0.00 C ATOM 1174 OE1 GLN A 129 -9.996 0.920 -15.154 1.00 0.00 O ATOM 1175 NE2 GLN A 129 -9.473 0.231 -13.116 1.00 0.00 N ATOM 0 H GLN A 129 -13.460 2.159 -11.684 1.00 0.00 H new ATOM 0 HA GLN A 129 -10.731 1.656 -11.146 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -12.125 2.097 -13.352 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -11.779 3.783 -13.020 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -9.906 3.307 -14.277 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -9.278 2.840 -12.709 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -9.321 0.460 -12.134 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -9.364 -0.731 -13.438 1.00 0.00 H new ATOM 1184 N GLN A 130 -11.800 4.709 -10.494 1.00 0.00 N ATOM 1185 CA GLN A 130 -11.540 5.963 -9.814 1.00 0.00 C ATOM 1186 C GLN A 130 -11.285 5.760 -8.312 1.00 0.00 C ATOM 1187 O GLN A 130 -10.340 6.338 -7.771 1.00 0.00 O ATOM 1188 CB GLN A 130 -12.698 6.943 -10.114 1.00 0.00 C ATOM 1189 CG GLN A 130 -12.513 7.632 -11.476 1.00 0.00 C ATOM 1190 CD GLN A 130 -12.733 9.134 -11.364 1.00 0.00 C ATOM 1191 OE1 GLN A 130 -11.950 9.835 -10.733 1.00 0.00 O ATOM 1192 NE2 GLN A 130 -13.769 9.689 -11.976 1.00 0.00 N ATOM 0 H GLN A 130 -12.717 4.681 -10.941 1.00 0.00 H new ATOM 0 HA GLN A 130 -10.618 6.402 -10.194 1.00 0.00 H new ATOM 0 HB2 GLN A 130 -13.645 6.403 -10.103 1.00 0.00 H new ATOM 0 HB3 GLN A 130 -12.752 7.696 -9.328 1.00 0.00 H new ATOM 0 HG2 GLN A 130 -11.509 7.435 -11.853 1.00 0.00 H new ATOM 0 HG3 GLN A 130 -13.213 7.212 -12.198 1.00 0.00 H new ATOM 0 HE21 GLN A 130 -14.422 9.108 -12.502 1.00 0.00 H new ATOM 0 HE22 GLN A 130 -13.913 10.697 -11.921 1.00 0.00 H new ATOM 1201 N VAL A 131 -12.079 4.922 -7.651 1.00 0.00 N ATOM 1202 CA VAL A 131 -11.906 4.512 -6.268 1.00 0.00 C ATOM 1203 C VAL A 131 -10.581 3.772 -6.151 1.00 0.00 C ATOM 1204 O VAL A 131 -9.767 4.171 -5.329 1.00 0.00 O ATOM 1205 CB VAL A 131 -13.097 3.643 -5.810 1.00 0.00 C ATOM 1206 CG1 VAL A 131 -12.916 3.056 -4.404 1.00 0.00 C ATOM 1207 CG2 VAL A 131 -14.403 4.440 -5.784 1.00 0.00 C ATOM 0 H VAL A 131 -12.895 4.494 -8.088 1.00 0.00 H new ATOM 0 HA VAL A 131 -11.883 5.382 -5.612 1.00 0.00 H new ATOM 0 HB VAL A 131 -13.138 2.837 -6.542 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -13.789 2.457 -4.145 1.00 0.00 H new ATOM 0 HG12 VAL A 131 -12.025 2.428 -4.384 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -12.805 3.866 -3.683 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -15.217 3.794 -5.457 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -14.304 5.277 -5.093 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -14.619 4.817 -6.784 1.00 0.00 H new ATOM 1217 N LEU A 132 -10.345 2.715 -6.944 1.00 0.00 N ATOM 1218 CA LEU A 132 -9.245 1.778 -6.712 1.00 0.00 C ATOM 1219 C LEU A 132 -7.900 2.490 -6.671 1.00 0.00 C ATOM 1220 O LEU A 132 -7.044 2.067 -5.906 1.00 0.00 O ATOM 1221 CB LEU A 132 -9.153 0.694 -7.812 1.00 0.00 C ATOM 1222 CG LEU A 132 -9.301 -0.762 -7.350 1.00 0.00 C ATOM 1223 CD1 LEU A 132 -9.109 -1.706 -8.540 1.00 0.00 C ATOM 1224 CD2 LEU A 132 -8.329 -1.130 -6.221 1.00 0.00 C ATOM 0 H LEU A 132 -10.912 2.490 -7.761 1.00 0.00 H new ATOM 0 HA LEU A 132 -9.463 1.313 -5.751 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -9.923 0.896 -8.556 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -8.191 0.797 -8.313 1.00 0.00 H new ATOM 0 HG LEU A 132 -10.308 -0.871 -6.947 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -9.215 -2.738 -8.206 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -9.860 -1.491 -9.300 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -8.115 -1.562 -8.962 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -8.480 -2.171 -5.936 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -7.304 -0.993 -6.564 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -8.512 -0.488 -5.360 1.00 0.00 H new ATOM 1236 N TRP A 133 -7.700 3.535 -7.480 1.00 0.00 N ATOM 1237 CA TRP A 133 -6.501 4.363 -7.427 1.00 0.00 C ATOM 1238 C TRP A 133 -6.374 5.038 -6.068 1.00 0.00 C ATOM 1239 O TRP A 133 -5.425 4.743 -5.351 1.00 0.00 O ATOM 1240 CB TRP A 133 -6.511 5.394 -8.559 1.00 0.00 C ATOM 1241 CG TRP A 133 -5.682 5.085 -9.763 1.00 0.00 C ATOM 1242 CD1 TRP A 133 -5.341 6.026 -10.668 1.00 0.00 C ATOM 1243 CD2 TRP A 133 -5.066 3.835 -10.227 1.00 0.00 C ATOM 1244 NE1 TRP A 133 -4.538 5.470 -11.631 1.00 0.00 N ATOM 1245 CE2 TRP A 133 -4.341 4.130 -11.422 1.00 0.00 C ATOM 1246 CE3 TRP A 133 -5.038 2.484 -9.802 1.00 0.00 C ATOM 1247 CZ2 TRP A 133 -3.634 3.166 -12.149 1.00 0.00 C ATOM 1248 CZ3 TRP A 133 -4.344 1.510 -10.542 1.00 0.00 C ATOM 1249 CH2 TRP A 133 -3.627 1.840 -11.702 1.00 0.00 C ATOM 0 H TRP A 133 -8.370 3.828 -8.191 1.00 0.00 H new ATOM 0 HA TRP A 133 -5.630 3.722 -7.563 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -7.542 5.531 -8.884 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -6.175 6.348 -8.152 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -5.653 7.060 -10.639 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -4.136 5.992 -12.410 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -5.556 2.198 -8.898 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -3.099 3.442 -13.046 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -4.363 0.483 -10.209 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -3.078 1.082 -12.242 1.00 0.00 H new ATOM 1260 N ARG A 134 -7.303 5.925 -5.694 1.00 0.00 N ATOM 1261 CA ARG A 134 -7.255 6.610 -4.400 1.00 0.00 C ATOM 1262 C ARG A 134 -7.117 5.601 -3.264 1.00 0.00 C ATOM 1263 O ARG A 134 -6.360 5.851 -2.334 1.00 0.00 O ATOM 1264 CB ARG A 134 -8.502 7.496 -4.227 1.00 0.00 C ATOM 1265 CG ARG A 134 -8.642 8.123 -2.826 1.00 0.00 C ATOM 1266 CD ARG A 134 -7.440 8.988 -2.466 1.00 0.00 C ATOM 1267 NE ARG A 134 -7.680 9.746 -1.232 1.00 0.00 N ATOM 1268 CZ ARG A 134 -7.393 11.034 -1.031 1.00 0.00 C ATOM 1269 NH1 ARG A 134 -6.656 11.721 -1.904 1.00 0.00 N ATOM 1270 NH2 ARG A 134 -7.869 11.619 0.055 1.00 0.00 N ATOM 0 H ARG A 134 -8.101 6.185 -6.274 1.00 0.00 H new ATOM 0 HA ARG A 134 -6.377 7.256 -4.369 1.00 0.00 H new ATOM 0 HB2 ARG A 134 -8.473 8.294 -4.969 1.00 0.00 H new ATOM 0 HB3 ARG A 134 -9.390 6.899 -4.436 1.00 0.00 H new ATOM 0 HG2 ARG A 134 -9.548 8.727 -2.788 1.00 0.00 H new ATOM 0 HG3 ARG A 134 -8.755 7.332 -2.084 1.00 0.00 H new ATOM 0 HD2 ARG A 134 -6.559 8.358 -2.343 1.00 0.00 H new ATOM 0 HD3 ARG A 134 -7.227 9.677 -3.283 1.00 0.00 H new ATOM 0 HE ARG A 134 -8.106 9.241 -0.455 1.00 0.00 H new ATOM 0 HH11 ARG A 134 -6.301 11.263 -2.743 1.00 0.00 H new ATOM 0 HH12 ARG A 134 -6.447 12.705 -1.733 1.00 0.00 H new ATOM 0 HH21 ARG A 134 -8.439 11.087 0.713 1.00 0.00 H new ATOM 0 HH22 ARG A 134 -7.666 12.602 0.235 1.00 0.00 H new ATOM 1284 N LEU A 135 -7.829 4.480 -3.370 1.00 0.00 N ATOM 1285 CA LEU A 135 -7.821 3.359 -2.456 1.00 0.00 C ATOM 1286 C LEU A 135 -6.369 2.917 -2.304 1.00 0.00 C ATOM 1287 O LEU A 135 -5.784 3.190 -1.262 1.00 0.00 O ATOM 1288 CB LEU A 135 -8.798 2.283 -2.990 1.00 0.00 C ATOM 1289 CG LEU A 135 -9.055 1.024 -2.156 1.00 0.00 C ATOM 1290 CD1 LEU A 135 -7.836 0.184 -1.998 1.00 0.00 C ATOM 1291 CD2 LEU A 135 -9.609 1.202 -0.805 1.00 0.00 C ATOM 0 H LEU A 135 -8.466 4.330 -4.152 1.00 0.00 H new ATOM 0 HA LEU A 135 -8.181 3.598 -1.455 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -9.760 2.768 -3.157 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -8.430 1.961 -3.964 1.00 0.00 H new ATOM 0 HG LEU A 135 -9.825 0.546 -2.762 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -8.075 -0.695 -1.399 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -7.482 -0.131 -2.979 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -7.058 0.762 -1.500 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -9.738 0.228 -0.333 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -8.926 1.806 -0.208 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -10.574 1.704 -0.871 1.00 0.00 H new ATOM 1303 N VAL A 136 -5.766 2.283 -3.318 1.00 0.00 N ATOM 1304 CA VAL A 136 -4.417 1.720 -3.215 1.00 0.00 C ATOM 1305 C VAL A 136 -3.362 2.786 -2.910 1.00 0.00 C ATOM 1306 O VAL A 136 -2.364 2.493 -2.244 1.00 0.00 O ATOM 1307 CB VAL A 136 -4.107 0.804 -4.414 1.00 0.00 C ATOM 1308 CG1 VAL A 136 -4.008 1.433 -5.779 1.00 0.00 C ATOM 1309 CG2 VAL A 136 -2.806 0.028 -4.194 1.00 0.00 C ATOM 0 H VAL A 136 -6.200 2.147 -4.231 1.00 0.00 H new ATOM 0 HA VAL A 136 -4.377 1.067 -2.343 1.00 0.00 H new ATOM 0 HB VAL A 136 -4.997 0.175 -4.434 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -3.786 0.664 -6.519 1.00 0.00 H new ATOM 0 HG12 VAL A 136 -4.954 1.913 -6.028 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -3.212 2.178 -5.780 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -2.613 -0.610 -5.056 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -1.981 0.729 -4.069 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -2.897 -0.588 -3.300 1.00 0.00 H new ATOM 1319 N GLN A 137 -3.598 4.035 -3.317 1.00 0.00 N ATOM 1320 CA GLN A 137 -2.726 5.131 -2.948 1.00 0.00 C ATOM 1321 C GLN A 137 -2.730 5.365 -1.439 1.00 0.00 C ATOM 1322 O GLN A 137 -1.656 5.506 -0.844 1.00 0.00 O ATOM 1323 CB GLN A 137 -3.057 6.424 -3.707 1.00 0.00 C ATOM 1324 CG GLN A 137 -2.607 6.379 -5.176 1.00 0.00 C ATOM 1325 CD GLN A 137 -2.808 7.711 -5.892 1.00 0.00 C ATOM 1326 OE1 GLN A 137 -3.561 8.581 -5.452 1.00 0.00 O ATOM 1327 NE2 GLN A 137 -2.125 7.903 -7.008 1.00 0.00 N ATOM 0 H GLN A 137 -4.389 4.304 -3.903 1.00 0.00 H new ATOM 0 HA GLN A 137 -1.718 4.838 -3.242 1.00 0.00 H new ATOM 0 HB2 GLN A 137 -4.132 6.600 -3.665 1.00 0.00 H new ATOM 0 HB3 GLN A 137 -2.576 7.266 -3.209 1.00 0.00 H new ATOM 0 HG2 GLN A 137 -1.554 6.102 -5.221 1.00 0.00 H new ATOM 0 HG3 GLN A 137 -3.164 5.602 -5.699 1.00 0.00 H new ATOM 0 HE21 GLN A 137 -1.506 7.172 -7.359 1.00 0.00 H new ATOM 0 HE22 GLN A 137 -2.218 8.782 -7.518 1.00 0.00 H new ATOM 1336 N GLU A 138 -3.914 5.408 -0.823 1.00 0.00 N ATOM 1337 CA GLU A 138 -4.037 5.508 0.622 1.00 0.00 C ATOM 1338 C GLU A 138 -3.379 4.284 1.250 1.00 0.00 C ATOM 1339 O GLU A 138 -2.575 4.459 2.152 1.00 0.00 O ATOM 1340 CB GLU A 138 -5.507 5.693 1.061 1.00 0.00 C ATOM 1341 CG GLU A 138 -5.682 6.163 2.517 1.00 0.00 C ATOM 1342 CD GLU A 138 -4.798 7.357 2.941 1.00 0.00 C ATOM 1343 OE1 GLU A 138 -4.532 8.269 2.125 1.00 0.00 O ATOM 1344 OE2 GLU A 138 -4.381 7.418 4.119 1.00 0.00 O ATOM 0 H GLU A 138 -4.807 5.374 -1.315 1.00 0.00 H new ATOM 0 HA GLU A 138 -3.520 6.400 0.976 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -5.983 6.416 0.399 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -6.034 4.748 0.931 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -6.727 6.434 2.670 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -5.471 5.324 3.179 1.00 0.00 H new ATOM 1351 N LEU A 139 -3.631 3.070 0.739 1.00 0.00 N ATOM 1352 CA LEU A 139 -3.140 1.828 1.346 1.00 0.00 C ATOM 1353 C LEU A 139 -1.630 1.855 1.551 1.00 0.00 C ATOM 1354 O LEU A 139 -1.160 1.544 2.645 1.00 0.00 O ATOM 1355 CB LEU A 139 -3.497 0.572 0.534 1.00 0.00 C ATOM 1356 CG LEU A 139 -4.985 0.379 0.228 1.00 0.00 C ATOM 1357 CD1 LEU A 139 -5.278 -0.994 -0.363 1.00 0.00 C ATOM 1358 CD2 LEU A 139 -5.950 0.703 1.354 1.00 0.00 C ATOM 0 H LEU A 139 -4.181 2.923 -0.107 1.00 0.00 H new ATOM 0 HA LEU A 139 -3.646 1.771 2.310 1.00 0.00 H new ATOM 0 HB2 LEU A 139 -2.952 0.605 -0.410 1.00 0.00 H new ATOM 0 HB3 LEU A 139 -3.140 -0.303 1.077 1.00 0.00 H new ATOM 0 HG LEU A 139 -5.180 1.143 -0.525 1.00 0.00 H new ATOM 0 HD11 LEU A 139 -6.346 -1.084 -0.563 1.00 0.00 H new ATOM 0 HD12 LEU A 139 -4.723 -1.116 -1.293 1.00 0.00 H new ATOM 0 HD13 LEU A 139 -4.975 -1.767 0.344 1.00 0.00 H new ATOM 0 HD21 LEU A 139 -6.972 0.528 1.019 1.00 0.00 H new ATOM 0 HD22 LEU A 139 -5.735 0.066 2.212 1.00 0.00 H new ATOM 0 HD23 LEU A 139 -5.836 1.748 1.641 1.00 0.00 H new ATOM 1370 N CYS A 140 -0.873 2.169 0.496 1.00 0.00 N ATOM 1371 CA CYS A 140 0.581 2.202 0.582 1.00 0.00 C ATOM 1372 C CYS A 140 1.037 3.353 1.487 1.00 0.00 C ATOM 1373 O CYS A 140 2.007 3.201 2.227 1.00 0.00 O ATOM 1374 CB CYS A 140 1.184 2.327 -0.821 1.00 0.00 C ATOM 1375 SG CYS A 140 0.824 0.932 -1.924 1.00 0.00 S ATOM 0 H CYS A 140 -1.246 2.403 -0.424 1.00 0.00 H new ATOM 0 HA CYS A 140 0.934 1.271 1.024 1.00 0.00 H new ATOM 0 HB2 CYS A 140 0.813 3.243 -1.282 1.00 0.00 H new ATOM 0 HB3 CYS A 140 2.265 2.432 -0.730 1.00 0.00 H new ATOM 1380 N SER A 141 0.399 4.526 1.401 1.00 0.00 N ATOM 1381 CA SER A 141 0.700 5.654 2.275 1.00 0.00 C ATOM 1382 C SER A 141 0.336 5.377 3.748 1.00 0.00 C ATOM 1383 O SER A 141 1.220 5.114 4.562 1.00 0.00 O ATOM 1384 CB SER A 141 0.023 6.912 1.707 1.00 0.00 C ATOM 1385 OG SER A 141 0.805 8.058 1.974 1.00 0.00 O ATOM 0 H SER A 141 -0.339 4.715 0.723 1.00 0.00 H new ATOM 0 HA SER A 141 1.777 5.818 2.292 1.00 0.00 H new ATOM 0 HB2 SER A 141 -0.117 6.803 0.632 1.00 0.00 H new ATOM 0 HB3 SER A 141 -0.967 7.030 2.147 1.00 0.00 H new ATOM 0 HG SER A 141 0.240 8.754 2.370 1.00 0.00 H new ATOM 1391 N LEU A 142 -0.954 5.473 4.072 1.00 0.00 N ATOM 1392 CA LEU A 142 -1.649 5.502 5.355 1.00 0.00 C ATOM 1393 C LEU A 142 -0.910 6.246 6.460 1.00 0.00 C ATOM 1394 O LEU A 142 -1.271 7.391 6.739 1.00 0.00 O ATOM 1395 CB LEU A 142 -2.186 4.107 5.728 1.00 0.00 C ATOM 1396 CG LEU A 142 -3.669 3.998 5.315 1.00 0.00 C ATOM 1397 CD1 LEU A 142 -4.106 2.549 5.108 1.00 0.00 C ATOM 1398 CD2 LEU A 142 -4.597 4.684 6.329 1.00 0.00 C ATOM 0 H LEU A 142 -1.638 5.543 3.318 1.00 0.00 H new ATOM 0 HA LEU A 142 -2.530 6.131 5.228 1.00 0.00 H new ATOM 0 HB2 LEU A 142 -1.601 3.335 5.228 1.00 0.00 H new ATOM 0 HB3 LEU A 142 -2.083 3.941 6.800 1.00 0.00 H new ATOM 0 HG LEU A 142 -3.754 4.518 4.361 1.00 0.00 H new ATOM 0 HD11 LEU A 142 -5.157 2.524 4.819 1.00 0.00 H new ATOM 0 HD12 LEU A 142 -3.502 2.096 4.322 1.00 0.00 H new ATOM 0 HD13 LEU A 142 -3.972 1.992 6.036 1.00 0.00 H new ATOM 0 HD21 LEU A 142 -5.632 4.584 6.001 1.00 0.00 H new ATOM 0 HD22 LEU A 142 -4.479 4.215 7.306 1.00 0.00 H new ATOM 0 HD23 LEU A 142 -4.340 5.741 6.401 1.00 0.00 H new ATOM 1410 N LYS A 143 0.098 5.657 7.100 1.00 0.00 N ATOM 1411 CA LYS A 143 1.055 6.430 7.886 1.00 0.00 C ATOM 1412 C LYS A 143 2.073 6.979 6.893 1.00 0.00 C ATOM 1413 O LYS A 143 1.786 7.954 6.190 1.00 0.00 O ATOM 1414 CB LYS A 143 1.616 5.577 9.051 1.00 0.00 C ATOM 1415 CG LYS A 143 0.898 5.949 10.353 1.00 0.00 C ATOM 1416 CD LYS A 143 1.013 4.872 11.434 1.00 0.00 C ATOM 1417 CE LYS A 143 0.700 5.427 12.830 1.00 0.00 C ATOM 1418 NZ LYS A 143 -0.517 6.262 12.870 1.00 0.00 N ATOM 0 H LYS A 143 0.272 4.652 7.090 1.00 0.00 H new ATOM 0 HA LYS A 143 0.612 7.281 8.403 1.00 0.00 H new ATOM 0 HB2 LYS A 143 1.478 4.517 8.838 1.00 0.00 H new ATOM 0 HB3 LYS A 143 2.688 5.745 9.154 1.00 0.00 H new ATOM 0 HG2 LYS A 143 1.311 6.883 10.734 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -0.156 6.130 10.140 1.00 0.00 H new ATOM 0 HD2 LYS A 143 0.329 4.055 11.206 1.00 0.00 H new ATOM 0 HD3 LYS A 143 2.020 4.456 11.426 1.00 0.00 H new ATOM 0 HE2 LYS A 143 0.584 4.596 13.526 1.00 0.00 H new ATOM 0 HE3 LYS A 143 1.548 6.017 13.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -0.757 6.478 13.858 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -0.347 7.148 12.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -1.305 5.748 12.427 1.00 0.00 H new ATOM 1432 N HIS A 144 3.252 6.374 6.827 1.00 0.00 N ATOM 1433 CA HIS A 144 4.368 6.796 6.008 1.00 0.00 C ATOM 1434 C HIS A 144 5.455 5.723 6.107 1.00 0.00 C ATOM 1435 O HIS A 144 5.385 4.873 7.002 1.00 0.00 O ATOM 1436 CB HIS A 144 4.898 8.160 6.500 1.00 0.00 C ATOM 1437 CG HIS A 144 5.300 8.110 7.948 1.00 0.00 C ATOM 1438 ND1 HIS A 144 4.464 8.066 9.039 1.00 0.00 N ATOM 1439 CD2 HIS A 144 6.563 7.868 8.392 1.00 0.00 C ATOM 1440 CE1 HIS A 144 5.210 7.736 10.100 1.00 0.00 C ATOM 1441 NE2 HIS A 144 6.502 7.620 9.763 1.00 0.00 N ATOM 0 H HIS A 144 3.460 5.537 7.371 1.00 0.00 H new ATOM 0 HA HIS A 144 4.059 6.915 4.970 1.00 0.00 H new ATOM 0 HB2 HIS A 144 5.754 8.458 5.895 1.00 0.00 H new ATOM 0 HB3 HIS A 144 4.130 8.921 6.362 1.00 0.00 H new ATOM 0 HD2 HIS A 144 7.458 7.868 7.787 1.00 0.00 H new ATOM 0 HE1 HIS A 144 4.822 7.583 11.096 1.00 0.00 H new ATOM 0 HE2 HIS A 144 7.281 7.396 10.382 1.00 0.00 H new ATOM 1449 N CYS A 145 6.470 5.788 5.238 1.00 0.00 N ATOM 1450 CA CYS A 145 7.642 4.924 5.326 1.00 0.00 C ATOM 1451 C CYS A 145 8.475 5.386 6.524 1.00 0.00 C ATOM 1452 O CYS A 145 8.398 4.746 7.567 1.00 0.00 O ATOM 1453 CB CYS A 145 8.413 4.838 3.992 1.00 0.00 C ATOM 1454 SG CYS A 145 8.839 3.143 3.485 1.00 0.00 S ATOM 0 H CYS A 145 6.498 6.442 4.456 1.00 0.00 H new ATOM 0 HA CYS A 145 7.345 3.890 5.501 1.00 0.00 H new ATOM 0 HB2 CYS A 145 7.813 5.300 3.208 1.00 0.00 H new ATOM 0 HB3 CYS A 145 9.330 5.421 4.077 1.00 0.00 H new ATOM 1459 N GLU A 146 9.196 6.518 6.444 1.00 0.00 N ATOM 1460 CA GLU A 146 9.919 7.051 7.605 1.00 0.00 C ATOM 1461 C GLU A 146 10.089 8.569 7.566 1.00 0.00 C ATOM 1462 O GLU A 146 9.314 9.286 8.182 1.00 0.00 O ATOM 1463 CB GLU A 146 11.243 6.280 7.815 1.00 0.00 C ATOM 1464 CG GLU A 146 11.193 5.418 9.085 1.00 0.00 C ATOM 1465 CD GLU A 146 12.037 4.162 8.922 1.00 0.00 C ATOM 1466 OE1 GLU A 146 11.607 3.242 8.176 1.00 0.00 O ATOM 1467 OE2 GLU A 146 13.136 4.082 9.501 1.00 0.00 O ATOM 0 H GLU A 146 9.292 7.075 5.595 1.00 0.00 H new ATOM 0 HA GLU A 146 9.303 6.880 8.488 1.00 0.00 H new ATOM 0 HB2 GLU A 146 11.438 5.646 6.950 1.00 0.00 H new ATOM 0 HB3 GLU A 146 12.070 6.986 7.885 1.00 0.00 H new ATOM 0 HG2 GLU A 146 11.554 5.996 9.936 1.00 0.00 H new ATOM 0 HG3 GLU A 146 10.161 5.142 9.302 1.00 0.00 H new ATOM 1474 N PHE A 147 11.085 9.058 6.842 1.00 0.00 N ATOM 1475 CA PHE A 147 11.642 10.409 6.921 1.00 0.00 C ATOM 1476 C PHE A 147 10.565 11.495 6.832 1.00 0.00 C ATOM 1477 O PHE A 147 10.558 12.455 7.609 1.00 0.00 O ATOM 1478 CB PHE A 147 12.692 10.560 5.802 1.00 0.00 C ATOM 1479 CG PHE A 147 13.378 9.257 5.412 1.00 0.00 C ATOM 1480 CD1 PHE A 147 12.716 8.369 4.542 1.00 0.00 C ATOM 1481 CD2 PHE A 147 14.591 8.862 5.999 1.00 0.00 C ATOM 1482 CE1 PHE A 147 13.258 7.122 4.221 1.00 0.00 C ATOM 1483 CE2 PHE A 147 15.122 7.594 5.706 1.00 0.00 C ATOM 1484 CZ PHE A 147 14.460 6.725 4.823 1.00 0.00 C ATOM 0 H PHE A 147 11.558 8.490 6.139 1.00 0.00 H new ATOM 0 HA PHE A 147 12.110 10.544 7.896 1.00 0.00 H new ATOM 0 HB2 PHE A 147 12.209 10.982 4.920 1.00 0.00 H new ATOM 0 HB3 PHE A 147 13.450 11.275 6.124 1.00 0.00 H new ATOM 0 HD1 PHE A 147 11.768 8.659 4.113 1.00 0.00 H new ATOM 0 HD2 PHE A 147 15.112 9.528 6.671 1.00 0.00 H new ATOM 0 HE1 PHE A 147 12.757 6.472 3.518 1.00 0.00 H new ATOM 0 HE2 PHE A 147 16.049 7.284 6.165 1.00 0.00 H new ATOM 0 HZ PHE A 147 14.877 5.752 4.608 1.00 0.00 H new ATOM 1494 N TRP A 148 9.641 11.328 5.891 1.00 0.00 N ATOM 1495 CA TRP A 148 8.477 12.151 5.591 1.00 0.00 C ATOM 1496 C TRP A 148 7.305 11.878 6.552 1.00 0.00 C ATOM 1497 O TRP A 148 6.153 11.745 6.129 1.00 0.00 O ATOM 1498 CB TRP A 148 8.124 11.875 4.125 1.00 0.00 C ATOM 1499 CG TRP A 148 7.923 10.432 3.740 1.00 0.00 C ATOM 1500 CD1 TRP A 148 8.896 9.511 3.546 1.00 0.00 C ATOM 1501 CD2 TRP A 148 6.674 9.730 3.493 1.00 0.00 C ATOM 1502 NE1 TRP A 148 8.350 8.340 3.071 1.00 0.00 N ATOM 1503 CE2 TRP A 148 6.978 8.408 3.050 1.00 0.00 C ATOM 1504 CE3 TRP A 148 5.312 10.077 3.599 1.00 0.00 C ATOM 1505 CZ2 TRP A 148 5.982 7.490 2.699 1.00 0.00 C ATOM 1506 CZ3 TRP A 148 4.308 9.130 3.346 1.00 0.00 C ATOM 1507 CH2 TRP A 148 4.646 7.838 2.922 1.00 0.00 C ATOM 0 H TRP A 148 9.696 10.532 5.256 1.00 0.00 H new ATOM 0 HA TRP A 148 8.698 13.209 5.736 1.00 0.00 H new ATOM 0 HB2 TRP A 148 7.212 12.422 3.885 1.00 0.00 H new ATOM 0 HB3 TRP A 148 8.916 12.287 3.500 1.00 0.00 H new ATOM 0 HD1 TRP A 148 9.947 9.671 3.736 1.00 0.00 H new ATOM 0 HE1 TRP A 148 8.892 7.529 2.774 1.00 0.00 H new ATOM 0 HE3 TRP A 148 5.038 11.084 3.878 1.00 0.00 H new ATOM 0 HZ2 TRP A 148 6.239 6.535 2.266 1.00 0.00 H new ATOM 0 HZ3 TRP A 148 3.270 9.398 3.479 1.00 0.00 H new ATOM 0 HH2 TRP A 148 3.868 7.105 2.766 1.00 0.00 H new