USER MOD reduce.3.24.130724 H: found=0, std=0, add=1175, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1175 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 116 ASN : amide:sc= -2.27! C(o=-2.4!,f=-3.2!) USER MOD Set 1.2: A 125 LYS NZ :NH3+ -176:sc= -0.101 (180deg=-0.28) USER MOD Set 2.1: A 75 SER OG : rot 180:sc= 0.48 USER MOD Set 2.2: A 86 THR OG1 : rot -91:sc= 0.978 USER MOD Set 3.1: A 45 GLN : amide:sc= 1.32 K(o=2.6,f=-5.1) USER MOD Set 3.2: A 47 LYS NZ :NH3+ 176:sc= 1.3 (180deg=0) USER MOD Single : A 1 MET CE :methyl -162:sc= -0.0738 (180deg=-0.487) USER MOD Single : A 1 MET N :NH3+ -172:sc= 0 (180deg=-0.0862) USER MOD Single : A 3 GLN :FLIP amide:sc=-0.00883 F(o=-1.2!,f=-0.0088) USER MOD Single : A 4 ASN : amide:sc=-0.00835 X(o=-0.0084,f=-3.4e-05) USER MOD Single : A 5 ASN : amide:sc= 0.245 K(o=0.24,f=-4.2!) USER MOD Single : A 7 ASN : amide:sc= -5.62! C(o=-5.6!,f=-7.8!) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 23 GLN : amide:sc= -0.0808 K(o=-0.081,f=-1.6) USER MOD Single : A 24 LYS NZ :NH3+ 171:sc= 0.632 (180deg=0.47) USER MOD Single : A 28 THR OG1 : rot 71:sc= 0.583 USER MOD Single : A 30 SER OG : rot 58:sc= -2.87! USER MOD Single : A 31 THR OG1 : rot 180:sc= -0.426 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 MET CE :methyl 130:sc= -0.146 (180deg=-0.694) USER MOD Single : A 42 ASN : amide:sc= -0.237 K(o=-0.24,f=-9.8!) USER MOD Single : A 50 GLN :FLIP amide:sc= -15.7! C(o=-20!,f=-16!) USER MOD Single : A 53 HIS :FLIP no HE2:sc= -0.335 F(o=-1.9,f=-0.33) USER MOD Single : A 55 GLN : amide:sc= 0.0242 X(o=0.024,f=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 61 SER OG : rot -95:sc= 0.919 USER MOD Single : A 63 CYS SG : rot 180:sc= -0.48 USER MOD Single : A 64 LYS NZ :NH3+ -139:sc= -2.71! (180deg=-3.36!) USER MOD Single : A 69 GLN : amide:sc= -0.261 K(o=-0.26,f=-2.2) USER MOD Single : A 72 THR OG1 : rot -70:sc= -0.264 USER MOD Single : A 80 THR OG1 : rot 170:sc= 0 USER MOD Single : A 88 GLN : amide:sc= 0.369 K(o=0.37,f=-0.37) USER MOD Single : A 95 LYS NZ :NH3+ -179:sc= -1.29 (180deg=-1.32) USER MOD Single : A 96 THR OG1 : rot 36:sc= -2.51! USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 HIS : no HE2:sc= -4.22 K(o=-4.2,f=-6.4!) USER MOD Single : A 103 SER OG : rot -170:sc= -0.578 USER MOD Single : A 106 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.202) USER MOD Single : A 109 ASN : amide:sc= -0.0433 K(o=-0.043,f=-7.2!) USER MOD Single : A 110 GLN :FLIP amide:sc= 0 F(o=-0.72,f=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 LYS NZ :NH3+ -135:sc= 0.261 (180deg=0) USER MOD Single : A 119 SER OG : rot 170:sc= 0 USER MOD Single : A 120 SER OG : rot 180:sc= -0.887 USER MOD Single : A 126 MET CE :methyl 149:sc= -0.79 (180deg=-2.71!) USER MOD Single : A 131 THR OG1 : rot 180:sc= 0.0249 USER MOD Single : A 135 ASN : amide:sc= -2.51! C(o=-2.5!,f=-7.6!) USER MOD Single : A 140 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 HIS : no HD1:sc= -0.464 X(o=-0.46,f=-0.18) USER MOD Single : A 148 HIS : no HE2:sc= 1.08 K(o=1.1,f=-5.7!) USER MOD Single : A 149 HIS : no HE2:sc= 1.04 K(o=1,f=-4.8!) USER MOD Single : A 150 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 151 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 152 HIS : no HD1:sc= -0.144 K(o=-0.14,f=-0.75) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 20.478 -10.767 7.364 1.00 0.00 N ATOM 2 CA MET A 1 20.194 -11.411 6.060 1.00 0.00 C ATOM 3 C MET A 1 19.741 -10.372 5.046 1.00 0.00 C ATOM 4 O MET A 1 20.256 -10.310 3.930 1.00 0.00 O ATOM 5 CB MET A 1 19.122 -12.496 6.212 1.00 0.00 C ATOM 6 CG MET A 1 19.556 -13.660 7.086 1.00 0.00 C ATOM 7 SD MET A 1 18.300 -14.950 7.193 1.00 0.00 S ATOM 8 CE MET A 1 16.980 -14.072 8.033 1.00 0.00 C ATOM 0 H1 MET A 1 20.914 -11.460 8.006 1.00 0.00 H new ATOM 0 H2 MET A 1 21.129 -9.969 7.222 1.00 0.00 H new ATOM 0 H3 MET A 1 19.590 -10.420 7.780 1.00 0.00 H new ATOM 0 HA MET A 1 21.112 -11.878 5.704 1.00 0.00 H new ATOM 0 HB2 MET A 1 18.222 -12.050 6.636 1.00 0.00 H new ATOM 0 HB3 MET A 1 18.856 -12.873 5.225 1.00 0.00 H new ATOM 0 HG2 MET A 1 20.477 -14.086 6.687 1.00 0.00 H new ATOM 0 HG3 MET A 1 19.782 -13.294 8.087 1.00 0.00 H new ATOM 0 HE1 MET A 1 16.276 -14.790 8.454 1.00 0.00 H new ATOM 0 HE2 MET A 1 17.400 -13.463 8.833 1.00 0.00 H new ATOM 0 HE3 MET A 1 16.461 -13.429 7.322 1.00 0.00 H new ATOM 20 N ALA A 2 18.780 -9.555 5.446 1.00 0.00 N ATOM 21 CA ALA A 2 18.266 -8.485 4.606 1.00 0.00 C ATOM 22 C ALA A 2 18.011 -7.250 5.461 1.00 0.00 C ATOM 23 O ALA A 2 16.899 -7.022 5.923 1.00 0.00 O ATOM 24 CB ALA A 2 16.991 -8.937 3.906 1.00 0.00 C ATOM 0 H ALA A 2 18.334 -9.615 6.362 1.00 0.00 H new ATOM 0 HA ALA A 2 19.000 -8.235 3.840 1.00 0.00 H new ATOM 0 HB1 ALA A 2 16.614 -8.129 3.279 1.00 0.00 H new ATOM 0 HB2 ALA A 2 17.205 -9.807 3.286 1.00 0.00 H new ATOM 0 HB3 ALA A 2 16.240 -9.199 4.651 1.00 0.00 H new ATOM 30 N GLN A 3 19.062 -6.480 5.703 1.00 0.00 N ATOM 31 CA GLN A 3 18.971 -5.335 6.602 1.00 0.00 C ATOM 32 C GLN A 3 18.819 -4.019 5.846 1.00 0.00 C ATOM 33 O GLN A 3 18.172 -3.091 6.329 1.00 0.00 O ATOM 34 CB GLN A 3 20.204 -5.265 7.501 1.00 0.00 C ATOM 35 CG GLN A 3 20.379 -6.474 8.408 1.00 0.00 C ATOM 36 CD GLN A 3 21.594 -6.352 9.308 1.00 0.00 C ATOM 37 OE1 GLN A 3 21.930 -5.126 9.686 1.00 0.00 O flip ATOM 38 NE2 GLN A 3 22.223 -7.349 9.665 1.00 0.00 N flip ATOM 0 H GLN A 3 19.984 -6.625 5.292 1.00 0.00 H new ATOM 0 HA GLN A 3 18.077 -5.478 7.210 1.00 0.00 H new ATOM 0 HB2 GLN A 3 21.091 -5.161 6.876 1.00 0.00 H new ATOM 0 HB3 GLN A 3 20.141 -4.368 8.117 1.00 0.00 H new ATOM 0 HG2 GLN A 3 19.487 -6.596 9.022 1.00 0.00 H new ATOM 0 HG3 GLN A 3 20.471 -7.372 7.797 1.00 0.00 H new ATOM 0 HE21 GLN A 3 21.932 -8.275 9.352 1.00 0.00 H new ATOM 0 HE22 GLN A 3 23.035 -7.249 10.274 1.00 0.00 H new ATOM 47 N ASN A 4 19.417 -3.929 4.668 1.00 0.00 N ATOM 48 CA ASN A 4 19.442 -2.671 3.931 1.00 0.00 C ATOM 49 C ASN A 4 18.614 -2.763 2.660 1.00 0.00 C ATOM 50 O ASN A 4 18.352 -3.854 2.151 1.00 0.00 O ATOM 51 CB ASN A 4 20.883 -2.281 3.586 1.00 0.00 C ATOM 52 CG ASN A 4 21.539 -3.251 2.620 1.00 0.00 C ATOM 53 OD1 ASN A 4 22.099 -4.266 3.033 1.00 0.00 O ATOM 54 ND2 ASN A 4 21.499 -2.932 1.335 1.00 0.00 N ATOM 0 H ASN A 4 19.889 -4.705 4.203 1.00 0.00 H new ATOM 0 HA ASN A 4 19.007 -1.903 4.570 1.00 0.00 H new ATOM 0 HB2 ASN A 4 20.890 -1.282 3.151 1.00 0.00 H new ATOM 0 HB3 ASN A 4 21.471 -2.234 4.502 1.00 0.00 H new ATOM 0 HD21 ASN A 4 21.943 -3.538 0.645 1.00 0.00 H new ATOM 0 HD22 ASN A 4 21.024 -2.081 1.035 1.00 0.00 H new ATOM 61 N ASN A 5 18.204 -1.607 2.159 1.00 0.00 N ATOM 62 CA ASN A 5 17.419 -1.525 0.937 1.00 0.00 C ATOM 63 C ASN A 5 18.307 -1.182 -0.247 1.00 0.00 C ATOM 64 O ASN A 5 19.280 -0.441 -0.106 1.00 0.00 O ATOM 65 CB ASN A 5 16.307 -0.474 1.068 1.00 0.00 C ATOM 66 CG ASN A 5 16.821 0.945 1.246 1.00 0.00 C ATOM 67 OD1 ASN A 5 17.873 1.183 1.845 1.00 0.00 O ATOM 68 ND2 ASN A 5 16.072 1.904 0.726 1.00 0.00 N ATOM 0 H ASN A 5 18.405 -0.703 2.586 1.00 0.00 H new ATOM 0 HA ASN A 5 16.962 -2.500 0.770 1.00 0.00 H new ATOM 0 HB2 ASN A 5 15.677 -0.513 0.180 1.00 0.00 H new ATOM 0 HB3 ASN A 5 15.676 -0.731 1.919 1.00 0.00 H new ATOM 0 HD21 ASN A 5 16.358 2.879 0.814 1.00 0.00 H new ATOM 0 HD22 ASN A 5 15.208 1.668 0.237 1.00 0.00 H new ATOM 75 N GLU A 6 17.991 -1.732 -1.405 1.00 0.00 N ATOM 76 CA GLU A 6 18.728 -1.393 -2.612 1.00 0.00 C ATOM 77 C GLU A 6 17.817 -1.364 -3.827 1.00 0.00 C ATOM 78 O GLU A 6 17.857 -0.416 -4.610 1.00 0.00 O ATOM 79 CB GLU A 6 19.878 -2.366 -2.864 1.00 0.00 C ATOM 80 CG GLU A 6 19.422 -3.768 -3.219 1.00 0.00 C ATOM 81 CD GLU A 6 20.511 -4.586 -3.870 1.00 0.00 C ATOM 82 OE1 GLU A 6 21.435 -5.026 -3.160 1.00 0.00 O ATOM 83 OE2 GLU A 6 20.443 -4.784 -5.101 1.00 0.00 O ATOM 0 H GLU A 6 17.238 -2.408 -1.537 1.00 0.00 H new ATOM 0 HA GLU A 6 19.142 -0.397 -2.454 1.00 0.00 H new ATOM 0 HB2 GLU A 6 20.499 -1.980 -3.672 1.00 0.00 H new ATOM 0 HB3 GLU A 6 20.505 -2.412 -1.974 1.00 0.00 H new ATOM 0 HG2 GLU A 6 19.083 -4.275 -2.316 1.00 0.00 H new ATOM 0 HG3 GLU A 6 18.566 -3.708 -3.892 1.00 0.00 H new ATOM 90 N ASN A 7 16.997 -2.395 -4.001 1.00 0.00 N ATOM 91 CA ASN A 7 16.239 -2.521 -5.181 1.00 0.00 C ATOM 92 C ASN A 7 14.757 -2.455 -4.853 1.00 0.00 C ATOM 93 O ASN A 7 14.284 -1.505 -4.221 1.00 0.00 O ATOM 94 CB ASN A 7 16.626 -3.837 -5.883 1.00 0.00 C ATOM 95 CG ASN A 7 16.515 -5.088 -5.017 1.00 0.00 C ATOM 96 OD1 ASN A 7 15.431 -5.624 -4.831 1.00 0.00 O ATOM 97 ND2 ASN A 7 17.631 -5.608 -4.553 1.00 0.00 N ATOM 0 H ASN A 7 16.859 -3.143 -3.321 1.00 0.00 H new ATOM 0 HA ASN A 7 16.451 -1.698 -5.864 1.00 0.00 H new ATOM 0 HB2 ASN A 7 15.991 -3.963 -6.760 1.00 0.00 H new ATOM 0 HB3 ASN A 7 17.652 -3.752 -6.242 1.00 0.00 H new ATOM 0 HD21 ASN A 7 17.606 -6.479 -4.023 1.00 0.00 H new ATOM 0 HD22 ASN A 7 18.521 -5.140 -4.723 1.00 0.00 H new ATOM 104 N ALA A 8 14.076 -3.516 -5.206 1.00 0.00 N ATOM 105 CA ALA A 8 12.632 -3.604 -5.180 1.00 0.00 C ATOM 106 C ALA A 8 12.178 -4.799 -5.998 1.00 0.00 C ATOM 107 O ALA A 8 12.952 -5.405 -6.741 1.00 0.00 O ATOM 108 CB ALA A 8 11.983 -2.342 -5.725 1.00 0.00 C ATOM 0 H ALA A 8 14.524 -4.373 -5.531 1.00 0.00 H new ATOM 0 HA ALA A 8 12.323 -3.722 -4.141 1.00 0.00 H new ATOM 0 HB1 ALA A 8 10.899 -2.446 -5.689 1.00 0.00 H new ATOM 0 HB2 ALA A 8 12.286 -1.487 -5.120 1.00 0.00 H new ATOM 0 HB3 ALA A 8 12.299 -2.187 -6.757 1.00 0.00 H new ATOM 114 N LEU A 9 10.922 -5.131 -5.827 1.00 0.00 N ATOM 115 CA LEU A 9 10.289 -6.225 -6.523 1.00 0.00 C ATOM 116 C LEU A 9 9.865 -5.791 -7.918 1.00 0.00 C ATOM 117 O LEU A 9 9.693 -4.598 -8.173 1.00 0.00 O ATOM 118 CB LEU A 9 9.079 -6.714 -5.701 1.00 0.00 C ATOM 119 CG LEU A 9 7.779 -5.898 -5.760 1.00 0.00 C ATOM 120 CD1 LEU A 9 6.790 -6.385 -4.715 1.00 0.00 C ATOM 121 CD2 LEU A 9 8.019 -4.405 -5.590 1.00 0.00 C ATOM 0 H LEU A 9 10.298 -4.639 -5.187 1.00 0.00 H new ATOM 0 HA LEU A 9 10.996 -7.047 -6.634 1.00 0.00 H new ATOM 0 HB2 LEU A 9 8.848 -7.730 -6.022 1.00 0.00 H new ATOM 0 HB3 LEU A 9 9.388 -6.772 -4.657 1.00 0.00 H new ATOM 0 HG LEU A 9 7.360 -6.051 -6.755 1.00 0.00 H new ATOM 0 HD11 LEU A 9 5.877 -5.793 -4.775 1.00 0.00 H new ATOM 0 HD12 LEU A 9 6.555 -7.434 -4.897 1.00 0.00 H new ATOM 0 HD13 LEU A 9 7.227 -6.278 -3.722 1.00 0.00 H new ATOM 0 HD21 LEU A 9 7.068 -3.876 -5.640 1.00 0.00 H new ATOM 0 HD22 LEU A 9 8.487 -4.220 -4.623 1.00 0.00 H new ATOM 0 HD23 LEU A 9 8.674 -4.049 -6.385 1.00 0.00 H new ATOM 133 N PRO A 10 9.734 -6.748 -8.847 1.00 0.00 N ATOM 134 CA PRO A 10 9.129 -6.487 -10.149 1.00 0.00 C ATOM 135 C PRO A 10 7.795 -5.782 -9.965 1.00 0.00 C ATOM 136 O PRO A 10 7.054 -6.103 -9.031 1.00 0.00 O ATOM 137 CB PRO A 10 8.931 -7.887 -10.731 1.00 0.00 C ATOM 138 CG PRO A 10 9.979 -8.718 -10.078 1.00 0.00 C ATOM 139 CD PRO A 10 10.170 -8.146 -8.701 1.00 0.00 C ATOM 0 HA PRO A 10 9.731 -5.846 -10.792 1.00 0.00 H new ATOM 0 HB2 PRO A 10 7.933 -8.268 -10.516 1.00 0.00 H new ATOM 0 HB3 PRO A 10 9.045 -7.885 -11.815 1.00 0.00 H new ATOM 0 HG2 PRO A 10 9.672 -9.762 -10.026 1.00 0.00 H new ATOM 0 HG3 PRO A 10 10.910 -8.687 -10.645 1.00 0.00 H new ATOM 0 HD2 PRO A 10 9.574 -8.677 -7.959 1.00 0.00 H new ATOM 0 HD3 PRO A 10 11.210 -8.211 -8.380 1.00 0.00 H new ATOM 147 N ASP A 11 7.489 -4.838 -10.851 1.00 0.00 N ATOM 148 CA ASP A 11 6.345 -3.952 -10.657 1.00 0.00 C ATOM 149 C ASP A 11 5.078 -4.744 -10.450 1.00 0.00 C ATOM 150 O ASP A 11 4.645 -5.500 -11.321 1.00 0.00 O ATOM 151 CB ASP A 11 6.144 -3.003 -11.837 1.00 0.00 C ATOM 152 CG ASP A 11 7.255 -1.988 -11.973 1.00 0.00 C ATOM 153 OD1 ASP A 11 8.372 -2.366 -12.383 1.00 0.00 O ATOM 154 OD2 ASP A 11 7.007 -0.799 -11.676 1.00 0.00 O ATOM 0 H ASP A 11 8.015 -4.667 -11.708 1.00 0.00 H new ATOM 0 HA ASP A 11 6.563 -3.361 -9.768 1.00 0.00 H new ATOM 0 HB2 ASP A 11 6.076 -3.584 -12.756 1.00 0.00 H new ATOM 0 HB3 ASP A 11 5.195 -2.481 -11.719 1.00 0.00 H new ATOM 159 N ILE A 12 4.479 -4.542 -9.296 1.00 0.00 N ATOM 160 CA ILE A 12 3.291 -5.258 -8.916 1.00 0.00 C ATOM 161 C ILE A 12 2.089 -4.351 -9.030 1.00 0.00 C ATOM 162 O ILE A 12 2.087 -3.235 -8.526 1.00 0.00 O ATOM 163 CB ILE A 12 3.423 -5.810 -7.469 1.00 0.00 C ATOM 164 CG1 ILE A 12 3.876 -7.265 -7.505 1.00 0.00 C ATOM 165 CG2 ILE A 12 2.122 -5.682 -6.679 1.00 0.00 C ATOM 166 CD1 ILE A 12 2.872 -8.192 -8.162 1.00 0.00 C ATOM 0 H ILE A 12 4.806 -3.875 -8.597 1.00 0.00 H new ATOM 0 HA ILE A 12 3.160 -6.105 -9.590 1.00 0.00 H new ATOM 0 HB ILE A 12 4.172 -5.206 -6.957 1.00 0.00 H new ATOM 0 HG12 ILE A 12 4.823 -7.330 -8.040 1.00 0.00 H new ATOM 0 HG13 ILE A 12 4.061 -7.605 -6.486 1.00 0.00 H new ATOM 0 HG21 ILE A 12 2.265 -6.081 -5.675 1.00 0.00 H new ATOM 0 HG22 ILE A 12 1.837 -4.632 -6.615 1.00 0.00 H new ATOM 0 HG23 ILE A 12 1.334 -6.242 -7.183 1.00 0.00 H new ATOM 0 HD11 ILE A 12 3.258 -9.211 -8.154 1.00 0.00 H new ATOM 0 HD12 ILE A 12 1.931 -8.156 -7.614 1.00 0.00 H new ATOM 0 HD13 ILE A 12 2.705 -7.876 -9.192 1.00 0.00 H new ATOM 178 N THR A 13 1.091 -4.814 -9.737 1.00 0.00 N ATOM 179 CA THR A 13 -0.149 -4.113 -9.809 1.00 0.00 C ATOM 180 C THR A 13 -1.268 -5.014 -9.344 1.00 0.00 C ATOM 181 O THR A 13 -1.332 -6.187 -9.715 1.00 0.00 O ATOM 182 CB THR A 13 -0.413 -3.639 -11.242 1.00 0.00 C ATOM 183 OG1 THR A 13 0.238 -4.520 -12.172 1.00 0.00 O ATOM 184 CG2 THR A 13 0.072 -2.211 -11.445 1.00 0.00 C ATOM 0 H THR A 13 1.121 -5.682 -10.273 1.00 0.00 H new ATOM 0 HA THR A 13 -0.100 -3.238 -9.161 1.00 0.00 H new ATOM 0 HB THR A 13 -1.489 -3.657 -11.418 1.00 0.00 H new ATOM 0 HG1 THR A 13 0.066 -4.215 -13.087 1.00 0.00 H new ATOM 0 HG21 THR A 13 -0.128 -1.901 -12.471 1.00 0.00 H new ATOM 0 HG22 THR A 13 -0.452 -1.548 -10.757 1.00 0.00 H new ATOM 0 HG23 THR A 13 1.144 -2.160 -11.253 1.00 0.00 H new ATOM 192 N LYS A 14 -2.121 -4.484 -8.501 1.00 0.00 N ATOM 193 CA LYS A 14 -3.296 -5.200 -8.077 1.00 0.00 C ATOM 194 C LYS A 14 -4.490 -4.321 -8.344 1.00 0.00 C ATOM 195 O LYS A 14 -4.516 -3.171 -7.923 1.00 0.00 O ATOM 196 CB LYS A 14 -3.218 -5.531 -6.583 1.00 0.00 C ATOM 197 CG LYS A 14 -3.986 -6.786 -6.183 1.00 0.00 C ATOM 198 CD LYS A 14 -3.200 -8.069 -6.472 1.00 0.00 C ATOM 199 CE LYS A 14 -2.967 -8.289 -7.959 1.00 0.00 C ATOM 200 NZ LYS A 14 -2.254 -9.564 -8.241 1.00 0.00 N ATOM 0 H LYS A 14 -2.021 -3.554 -8.094 1.00 0.00 H new ATOM 0 HA LYS A 14 -3.377 -6.139 -8.624 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -2.172 -5.653 -6.303 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -3.603 -4.685 -6.014 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -4.223 -6.740 -5.120 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -4.934 -6.815 -6.720 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -2.239 -8.025 -5.960 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -3.741 -8.922 -6.062 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -3.926 -8.290 -8.478 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -2.389 -7.457 -8.360 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -2.120 -9.667 -9.267 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -1.327 -9.555 -7.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -2.816 -10.363 -7.884 1.00 0.00 H new ATOM 214 N SER A 15 -5.480 -4.839 -9.022 1.00 0.00 N ATOM 215 CA SER A 15 -6.618 -4.033 -9.342 1.00 0.00 C ATOM 216 C SER A 15 -7.913 -4.650 -8.888 1.00 0.00 C ATOM 217 O SER A 15 -8.157 -5.854 -9.011 1.00 0.00 O ATOM 218 CB SER A 15 -6.654 -3.731 -10.823 1.00 0.00 C ATOM 219 OG SER A 15 -6.123 -4.805 -11.588 1.00 0.00 O ATOM 0 H SER A 15 -5.518 -5.802 -9.357 1.00 0.00 H new ATOM 0 HA SER A 15 -6.510 -3.098 -8.793 1.00 0.00 H new ATOM 0 HB2 SER A 15 -7.682 -3.537 -11.131 1.00 0.00 H new ATOM 0 HB3 SER A 15 -6.085 -2.824 -11.024 1.00 0.00 H new ATOM 0 HG SER A 15 -6.162 -4.579 -12.541 1.00 0.00 H new ATOM 225 N ILE A 16 -8.723 -3.781 -8.351 1.00 0.00 N ATOM 226 CA ILE A 16 -10.016 -4.103 -7.848 1.00 0.00 C ATOM 227 C ILE A 16 -10.890 -2.882 -7.985 1.00 0.00 C ATOM 228 O ILE A 16 -10.403 -1.754 -7.934 1.00 0.00 O ATOM 229 CB ILE A 16 -9.967 -4.534 -6.371 1.00 0.00 C ATOM 230 CG1 ILE A 16 -11.371 -4.434 -5.764 1.00 0.00 C ATOM 231 CG2 ILE A 16 -8.938 -3.718 -5.595 1.00 0.00 C ATOM 232 CD1 ILE A 16 -11.506 -3.554 -4.550 1.00 0.00 C ATOM 0 H ILE A 16 -8.486 -2.794 -8.251 1.00 0.00 H new ATOM 0 HA ILE A 16 -10.415 -4.941 -8.419 1.00 0.00 H new ATOM 0 HB ILE A 16 -9.644 -5.573 -6.306 1.00 0.00 H new ATOM 0 HG12 ILE A 16 -12.051 -4.066 -6.532 1.00 0.00 H new ATOM 0 HG13 ILE A 16 -11.703 -5.438 -5.499 1.00 0.00 H new ATOM 0 HG21 ILE A 16 -8.925 -4.044 -4.555 1.00 0.00 H new ATOM 0 HG22 ILE A 16 -7.951 -3.865 -6.034 1.00 0.00 H new ATOM 0 HG23 ILE A 16 -9.202 -2.661 -5.641 1.00 0.00 H new ATOM 0 HD11 ILE A 16 -12.541 -3.561 -4.209 1.00 0.00 H new ATOM 0 HD12 ILE A 16 -10.860 -3.928 -3.756 1.00 0.00 H new ATOM 0 HD13 ILE A 16 -11.214 -2.535 -4.805 1.00 0.00 H new ATOM 244 N THR A 17 -12.160 -3.088 -8.173 1.00 0.00 N ATOM 245 CA THR A 17 -13.060 -1.981 -8.137 1.00 0.00 C ATOM 246 C THR A 17 -13.603 -1.859 -6.732 1.00 0.00 C ATOM 247 O THR A 17 -14.264 -2.767 -6.222 1.00 0.00 O ATOM 248 CB THR A 17 -14.232 -2.169 -9.102 1.00 0.00 C ATOM 249 OG1 THR A 17 -13.744 -2.396 -10.432 1.00 0.00 O ATOM 250 CG2 THR A 17 -15.137 -0.944 -9.075 1.00 0.00 C ATOM 0 H THR A 17 -12.588 -3.997 -8.350 1.00 0.00 H new ATOM 0 HA THR A 17 -12.518 -1.084 -8.437 1.00 0.00 H new ATOM 0 HB THR A 17 -14.811 -3.038 -8.787 1.00 0.00 H new ATOM 0 HG1 THR A 17 -14.501 -2.517 -11.042 1.00 0.00 H new ATOM 0 HG21 THR A 17 -15.967 -1.090 -9.766 1.00 0.00 H new ATOM 0 HG22 THR A 17 -15.525 -0.800 -8.067 1.00 0.00 H new ATOM 0 HG23 THR A 17 -14.567 -0.064 -9.373 1.00 0.00 H new ATOM 258 N LEU A 18 -13.339 -0.728 -6.116 1.00 0.00 N ATOM 259 CA LEU A 18 -13.843 -0.461 -4.812 1.00 0.00 C ATOM 260 C LEU A 18 -15.151 0.189 -5.035 1.00 0.00 C ATOM 261 O LEU A 18 -15.192 1.319 -5.515 1.00 0.00 O ATOM 262 CB LEU A 18 -12.945 0.520 -4.055 1.00 0.00 C ATOM 263 CG LEU A 18 -11.477 0.158 -3.984 1.00 0.00 C ATOM 264 CD1 LEU A 18 -10.659 1.376 -3.610 1.00 0.00 C ATOM 265 CD2 LEU A 18 -11.247 -0.953 -2.977 1.00 0.00 C ATOM 0 H LEU A 18 -12.771 0.021 -6.513 1.00 0.00 H new ATOM 0 HA LEU A 18 -13.900 -1.377 -4.225 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -13.035 1.500 -4.524 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -13.324 0.618 -3.038 1.00 0.00 H new ATOM 0 HG LEU A 18 -11.161 -0.196 -4.965 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -9.604 1.105 -3.562 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -10.800 2.153 -4.361 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -10.983 1.748 -2.638 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -10.185 -1.198 -2.942 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -11.577 -0.625 -1.991 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -11.813 -1.836 -3.274 1.00 0.00 H new ATOM 277 N GLU A 19 -16.226 -0.491 -4.772 1.00 0.00 N ATOM 278 CA GLU A 19 -17.465 0.178 -4.917 1.00 0.00 C ATOM 279 C GLU A 19 -17.573 1.118 -3.744 1.00 0.00 C ATOM 280 O GLU A 19 -18.128 0.785 -2.705 1.00 0.00 O ATOM 281 CB GLU A 19 -18.566 -0.873 -4.917 1.00 0.00 C ATOM 282 CG GLU A 19 -18.229 -2.070 -4.030 1.00 0.00 C ATOM 283 CD GLU A 19 -19.056 -3.296 -4.342 1.00 0.00 C ATOM 284 OE1 GLU A 19 -18.748 -3.980 -5.342 1.00 0.00 O ATOM 285 OE2 GLU A 19 -19.995 -3.599 -3.577 1.00 0.00 O ATOM 0 H GLU A 19 -16.266 -1.464 -4.470 1.00 0.00 H new ATOM 0 HA GLU A 19 -17.549 0.746 -5.844 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -19.496 -0.421 -4.574 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -18.736 -1.217 -5.937 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -17.173 -2.313 -4.146 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -18.380 -1.794 -2.986 1.00 0.00 H new ATOM 292 N ALA A 20 -17.036 2.308 -3.938 1.00 0.00 N ATOM 293 CA ALA A 20 -17.028 3.313 -2.906 1.00 0.00 C ATOM 294 C ALA A 20 -17.009 4.688 -3.517 1.00 0.00 C ATOM 295 O ALA A 20 -16.814 4.833 -4.711 1.00 0.00 O ATOM 296 CB ALA A 20 -15.826 3.124 -2.005 1.00 0.00 C ATOM 0 H ALA A 20 -16.597 2.598 -4.812 1.00 0.00 H new ATOM 0 HA ALA A 20 -17.934 3.210 -2.309 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -15.830 3.889 -1.228 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -15.869 2.138 -1.543 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -14.913 3.209 -2.594 1.00 0.00 H new ATOM 302 N PRO A 21 -17.225 5.717 -2.719 1.00 0.00 N ATOM 303 CA PRO A 21 -16.912 7.064 -3.135 1.00 0.00 C ATOM 304 C PRO A 21 -15.419 7.312 -2.969 1.00 0.00 C ATOM 305 O PRO A 21 -14.775 6.727 -2.090 1.00 0.00 O ATOM 306 CB PRO A 21 -17.707 7.917 -2.168 1.00 0.00 C ATOM 307 CG PRO A 21 -17.744 7.106 -0.919 1.00 0.00 C ATOM 308 CD PRO A 21 -17.765 5.663 -1.353 1.00 0.00 C ATOM 0 HA PRO A 21 -17.153 7.272 -4.178 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -17.230 8.883 -2.003 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -18.710 8.117 -2.544 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -16.874 7.312 -0.296 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -18.626 7.346 -0.325 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -17.154 5.038 -0.702 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -18.774 5.251 -1.335 1.00 0.00 H new ATOM 316 N ILE A 22 -14.885 8.183 -3.805 1.00 0.00 N ATOM 317 CA ILE A 22 -13.460 8.508 -3.804 1.00 0.00 C ATOM 318 C ILE A 22 -13.009 8.970 -2.428 1.00 0.00 C ATOM 319 O ILE A 22 -11.885 8.730 -2.004 1.00 0.00 O ATOM 320 CB ILE A 22 -13.177 9.594 -4.859 1.00 0.00 C ATOM 321 CG1 ILE A 22 -11.700 9.991 -4.855 1.00 0.00 C ATOM 322 CG2 ILE A 22 -14.069 10.806 -4.616 1.00 0.00 C ATOM 323 CD1 ILE A 22 -11.310 10.915 -5.982 1.00 0.00 C ATOM 0 H ILE A 22 -15.424 8.689 -4.508 1.00 0.00 H new ATOM 0 HA ILE A 22 -12.895 7.610 -4.055 1.00 0.00 H new ATOM 0 HB ILE A 22 -13.406 9.187 -5.844 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -11.467 10.474 -3.906 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -11.092 9.088 -4.912 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -13.861 11.568 -5.367 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -15.115 10.507 -4.683 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -13.870 11.211 -3.624 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -10.248 11.150 -5.909 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -11.510 10.429 -6.937 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -11.890 11.835 -5.915 1.00 0.00 H new ATOM 335 N GLN A 23 -13.927 9.613 -1.752 1.00 0.00 N ATOM 336 CA GLN A 23 -13.734 10.137 -0.416 1.00 0.00 C ATOM 337 C GLN A 23 -13.598 9.052 0.665 1.00 0.00 C ATOM 338 O GLN A 23 -12.946 9.272 1.684 1.00 0.00 O ATOM 339 CB GLN A 23 -14.873 11.087 -0.120 1.00 0.00 C ATOM 340 CG GLN A 23 -16.198 10.497 -0.507 1.00 0.00 C ATOM 341 CD GLN A 23 -17.050 10.106 0.684 1.00 0.00 C ATOM 342 OE1 GLN A 23 -16.536 9.760 1.748 1.00 0.00 O ATOM 343 NE2 GLN A 23 -18.360 10.161 0.512 1.00 0.00 N ATOM 0 H GLN A 23 -14.859 9.794 -2.124 1.00 0.00 H new ATOM 0 HA GLN A 23 -12.780 10.663 -0.387 1.00 0.00 H new ATOM 0 HB2 GLN A 23 -14.878 11.330 0.943 1.00 0.00 H new ATOM 0 HB3 GLN A 23 -14.718 12.021 -0.660 1.00 0.00 H new ATOM 0 HG2 GLN A 23 -16.745 11.217 -1.116 1.00 0.00 H new ATOM 0 HG3 GLN A 23 -16.029 9.618 -1.129 1.00 0.00 H new ATOM 0 HE21 GLN A 23 -18.745 10.453 -0.386 1.00 0.00 H new ATOM 0 HE22 GLN A 23 -18.986 9.911 1.278 1.00 0.00 H new ATOM 352 N LYS A 24 -14.217 7.892 0.482 1.00 0.00 N ATOM 353 CA LYS A 24 -14.100 6.843 1.495 1.00 0.00 C ATOM 354 C LYS A 24 -12.760 6.126 1.336 1.00 0.00 C ATOM 355 O LYS A 24 -12.075 5.805 2.309 1.00 0.00 O ATOM 356 CB LYS A 24 -15.238 5.832 1.358 1.00 0.00 C ATOM 357 CG LYS A 24 -15.325 4.870 2.530 1.00 0.00 C ATOM 358 CD LYS A 24 -16.130 5.450 3.681 1.00 0.00 C ATOM 359 CE LYS A 24 -17.628 5.362 3.416 1.00 0.00 C ATOM 360 NZ LYS A 24 -18.098 3.950 3.343 1.00 0.00 N ATOM 0 H LYS A 24 -14.788 7.655 -0.329 1.00 0.00 H new ATOM 0 HA LYS A 24 -14.158 7.303 2.481 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -16.183 6.368 1.265 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -15.102 5.263 0.438 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -15.783 3.937 2.201 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -14.320 4.627 2.876 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -15.890 4.915 4.600 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -15.847 6.491 3.835 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -18.168 5.884 4.206 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -17.862 5.871 2.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -19.137 3.931 3.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -17.720 3.502 2.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -17.765 3.430 4.180 1.00 0.00 H new ATOM 374 N VAL A 25 -12.370 5.940 0.090 1.00 0.00 N ATOM 375 CA VAL A 25 -11.033 5.490 -0.253 1.00 0.00 C ATOM 376 C VAL A 25 -10.015 6.549 0.161 1.00 0.00 C ATOM 377 O VAL A 25 -8.888 6.242 0.525 1.00 0.00 O ATOM 378 CB VAL A 25 -10.908 5.146 -1.746 1.00 0.00 C ATOM 379 CG1 VAL A 25 -9.613 4.393 -1.993 1.00 0.00 C ATOM 380 CG2 VAL A 25 -12.112 4.319 -2.194 1.00 0.00 C ATOM 0 H VAL A 25 -12.973 6.097 -0.717 1.00 0.00 H new ATOM 0 HA VAL A 25 -10.829 4.570 0.294 1.00 0.00 H new ATOM 0 HB VAL A 25 -10.889 6.067 -2.329 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -9.529 4.151 -3.053 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -8.768 5.014 -1.694 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -9.611 3.472 -1.410 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -12.015 4.080 -3.253 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -12.155 3.396 -1.616 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -13.026 4.891 -2.033 1.00 0.00 H new ATOM 390 N TRP A 26 -10.430 7.799 0.070 1.00 0.00 N ATOM 391 CA TRP A 26 -9.650 8.937 0.554 1.00 0.00 C ATOM 392 C TRP A 26 -9.294 8.722 2.013 1.00 0.00 C ATOM 393 O TRP A 26 -8.195 9.039 2.439 1.00 0.00 O ATOM 394 CB TRP A 26 -10.543 10.166 0.446 1.00 0.00 C ATOM 395 CG TRP A 26 -9.892 11.475 0.179 1.00 0.00 C ATOM 396 CD1 TRP A 26 -8.985 12.175 0.921 1.00 0.00 C ATOM 397 CD2 TRP A 26 -10.204 12.271 -0.940 1.00 0.00 C ATOM 398 NE1 TRP A 26 -8.708 13.373 0.292 1.00 0.00 N ATOM 399 CE2 TRP A 26 -9.455 13.448 -0.861 1.00 0.00 C ATOM 400 CE3 TRP A 26 -11.056 12.068 -2.009 1.00 0.00 C ATOM 401 CZ2 TRP A 26 -9.545 14.438 -1.835 1.00 0.00 C ATOM 402 CZ3 TRP A 26 -11.153 13.030 -2.974 1.00 0.00 C ATOM 403 CH2 TRP A 26 -10.399 14.212 -2.890 1.00 0.00 C ATOM 0 H TRP A 26 -11.324 8.061 -0.344 1.00 0.00 H new ATOM 0 HA TRP A 26 -8.734 9.054 -0.025 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -11.268 9.984 -0.348 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -11.104 10.255 1.376 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -8.552 11.844 1.853 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -8.058 14.084 0.627 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -11.637 11.161 -2.081 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -8.967 15.348 -1.766 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -11.818 12.880 -3.812 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -10.491 14.956 -3.667 1.00 0.00 H new ATOM 414 N GLU A 27 -10.260 8.224 2.767 1.00 0.00 N ATOM 415 CA GLU A 27 -10.040 7.768 4.137 1.00 0.00 C ATOM 416 C GLU A 27 -9.178 6.505 4.197 1.00 0.00 C ATOM 417 O GLU A 27 -8.553 6.226 5.220 1.00 0.00 O ATOM 418 CB GLU A 27 -11.366 7.503 4.832 1.00 0.00 C ATOM 419 CG GLU A 27 -12.203 8.749 5.026 1.00 0.00 C ATOM 420 CD GLU A 27 -11.468 9.803 5.824 1.00 0.00 C ATOM 421 OE1 GLU A 27 -11.387 9.671 7.060 1.00 0.00 O ATOM 422 OE2 GLU A 27 -10.957 10.764 5.219 1.00 0.00 O ATOM 0 H GLU A 27 -11.224 8.123 2.449 1.00 0.00 H new ATOM 0 HA GLU A 27 -9.506 8.567 4.651 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -11.935 6.779 4.249 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -11.174 7.048 5.804 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -12.479 9.156 4.053 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -13.130 8.488 5.536 1.00 0.00 H new ATOM 429 N THR A 28 -9.233 5.695 3.149 1.00 0.00 N ATOM 430 CA THR A 28 -8.597 4.383 3.169 1.00 0.00 C ATOM 431 C THR A 28 -7.211 4.242 2.472 1.00 0.00 C ATOM 432 O THR A 28 -6.589 3.203 2.608 1.00 0.00 O ATOM 433 CB THR A 28 -9.550 3.313 2.644 1.00 0.00 C ATOM 434 OG1 THR A 28 -10.869 3.548 3.157 1.00 0.00 O ATOM 435 CG2 THR A 28 -9.081 1.951 3.102 1.00 0.00 C ATOM 0 H THR A 28 -9.710 5.921 2.276 1.00 0.00 H new ATOM 0 HA THR A 28 -8.373 4.241 4.226 1.00 0.00 H new ATOM 0 HB THR A 28 -9.567 3.352 1.555 1.00 0.00 H new ATOM 0 HG1 THR A 28 -11.248 4.346 2.732 1.00 0.00 H new ATOM 0 HG21 THR A 28 -9.762 1.187 2.727 1.00 0.00 H new ATOM 0 HG22 THR A 28 -8.078 1.764 2.718 1.00 0.00 H new ATOM 0 HG23 THR A 28 -9.064 1.919 4.191 1.00 0.00 H new ATOM 443 N VAL A 29 -6.717 5.216 1.710 1.00 0.00 N ATOM 444 CA VAL A 29 -5.438 5.004 0.990 1.00 0.00 C ATOM 445 C VAL A 29 -4.440 6.152 1.158 1.00 0.00 C ATOM 446 O VAL A 29 -3.367 5.970 1.714 1.00 0.00 O ATOM 447 CB VAL A 29 -5.618 4.692 -0.520 1.00 0.00 C ATOM 448 CG1 VAL A 29 -6.356 3.393 -0.706 1.00 0.00 C ATOM 449 CG2 VAL A 29 -6.329 5.806 -1.259 1.00 0.00 C ATOM 0 H VAL A 29 -7.152 6.128 1.570 1.00 0.00 H new ATOM 0 HA VAL A 29 -5.021 4.120 1.472 1.00 0.00 H new ATOM 0 HB VAL A 29 -4.619 4.605 -0.947 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -6.473 3.190 -1.771 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.791 2.584 -0.243 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -7.339 3.463 -0.240 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -6.430 5.538 -2.311 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -7.318 5.956 -0.826 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -5.752 6.726 -1.172 1.00 0.00 H new ATOM 459 N SER A 30 -4.757 7.326 0.679 1.00 0.00 N ATOM 460 CA SER A 30 -3.815 8.425 0.788 1.00 0.00 C ATOM 461 C SER A 30 -4.178 9.280 1.973 1.00 0.00 C ATOM 462 O SER A 30 -4.627 10.417 1.835 1.00 0.00 O ATOM 463 CB SER A 30 -3.803 9.244 -0.487 1.00 0.00 C ATOM 464 OG SER A 30 -5.117 9.613 -0.861 1.00 0.00 O ATOM 0 H SER A 30 -5.639 7.551 0.218 1.00 0.00 H new ATOM 0 HA SER A 30 -2.812 8.026 0.935 1.00 0.00 H new ATOM 0 HB2 SER A 30 -3.196 10.138 -0.344 1.00 0.00 H new ATOM 0 HB3 SER A 30 -3.340 8.669 -1.289 1.00 0.00 H new ATOM 0 HG SER A 30 -5.536 10.115 -0.131 1.00 0.00 H new ATOM 470 N THR A 31 -4.030 8.696 3.133 1.00 0.00 N ATOM 471 CA THR A 31 -4.578 9.265 4.327 1.00 0.00 C ATOM 472 C THR A 31 -3.838 8.756 5.549 1.00 0.00 C ATOM 473 O THR A 31 -2.841 8.055 5.424 1.00 0.00 O ATOM 474 CB THR A 31 -6.084 8.959 4.375 1.00 0.00 C ATOM 475 OG1 THR A 31 -6.680 9.314 5.630 1.00 0.00 O ATOM 476 CG2 THR A 31 -6.311 7.499 4.061 1.00 0.00 C ATOM 0 H THR A 31 -3.529 7.819 3.272 1.00 0.00 H new ATOM 0 HA THR A 31 -4.452 10.348 4.324 1.00 0.00 H new ATOM 0 HB THR A 31 -6.574 9.575 3.621 1.00 0.00 H new ATOM 0 HG1 THR A 31 -7.637 9.102 5.609 1.00 0.00 H new ATOM 0 HG21 THR A 31 -7.378 7.281 4.095 1.00 0.00 H new ATOM 0 HG22 THR A 31 -5.927 7.277 3.065 1.00 0.00 H new ATOM 0 HG23 THR A 31 -5.792 6.884 4.796 1.00 0.00 H new ATOM 484 N SER A 32 -4.299 9.177 6.702 1.00 0.00 N ATOM 485 CA SER A 32 -3.820 8.695 7.980 1.00 0.00 C ATOM 486 C SER A 32 -4.097 7.200 8.100 1.00 0.00 C ATOM 487 O SER A 32 -4.712 6.600 7.216 1.00 0.00 O ATOM 488 CB SER A 32 -4.499 9.427 9.128 1.00 0.00 C ATOM 489 OG SER A 32 -4.326 10.831 9.021 1.00 0.00 O ATOM 0 H SER A 32 -5.034 9.880 6.782 1.00 0.00 H new ATOM 0 HA SER A 32 -2.747 8.881 8.036 1.00 0.00 H new ATOM 0 HB2 SER A 32 -5.563 9.189 9.135 1.00 0.00 H new ATOM 0 HB3 SER A 32 -4.089 9.080 10.076 1.00 0.00 H new ATOM 0 HG SER A 32 -4.775 11.274 9.771 1.00 0.00 H new ATOM 495 N GLU A 33 -3.560 6.612 9.163 1.00 0.00 N ATOM 496 CA GLU A 33 -3.384 5.164 9.353 1.00 0.00 C ATOM 497 C GLU A 33 -4.630 4.317 9.042 1.00 0.00 C ATOM 498 O GLU A 33 -4.579 3.095 9.139 1.00 0.00 O ATOM 499 CB GLU A 33 -2.963 4.910 10.792 1.00 0.00 C ATOM 500 CG GLU A 33 -1.997 5.952 11.323 1.00 0.00 C ATOM 501 CD GLU A 33 -1.925 5.948 12.833 1.00 0.00 C ATOM 502 OE1 GLU A 33 -2.790 6.583 13.472 1.00 0.00 O ATOM 503 OE2 GLU A 33 -1.015 5.306 13.391 1.00 0.00 O ATOM 0 H GLU A 33 -3.217 7.152 9.958 1.00 0.00 H new ATOM 0 HA GLU A 33 -2.624 4.853 8.637 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -3.850 4.889 11.425 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -2.500 3.926 10.860 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -1.004 5.767 10.913 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.305 6.939 10.978 1.00 0.00 H new ATOM 510 N GLY A 34 -5.754 4.942 8.734 1.00 0.00 N ATOM 511 CA GLY A 34 -6.877 4.183 8.226 1.00 0.00 C ATOM 512 C GLY A 34 -6.489 3.418 6.974 1.00 0.00 C ATOM 513 O GLY A 34 -6.978 2.315 6.747 1.00 0.00 O ATOM 0 H GLY A 34 -5.909 5.946 8.824 1.00 0.00 H new ATOM 0 HA2 GLY A 34 -7.226 3.487 8.989 1.00 0.00 H new ATOM 0 HA3 GLY A 34 -7.706 4.856 8.004 1.00 0.00 H new ATOM 517 N ILE A 35 -5.614 3.999 6.149 1.00 0.00 N ATOM 518 CA ILE A 35 -5.038 3.270 5.051 1.00 0.00 C ATOM 519 C ILE A 35 -4.063 2.207 5.548 1.00 0.00 C ATOM 520 O ILE A 35 -3.954 1.118 4.997 1.00 0.00 O ATOM 521 CB ILE A 35 -4.391 4.203 4.016 1.00 0.00 C ATOM 522 CG1 ILE A 35 -3.530 3.418 3.024 1.00 0.00 C ATOM 523 CG2 ILE A 35 -3.595 5.323 4.664 1.00 0.00 C ATOM 524 CD1 ILE A 35 -2.054 3.544 3.305 1.00 0.00 C ATOM 0 H ILE A 35 -5.300 4.966 6.232 1.00 0.00 H new ATOM 0 HA ILE A 35 -5.851 2.756 4.539 1.00 0.00 H new ATOM 0 HB ILE A 35 -5.205 4.672 3.463 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -3.813 2.366 3.057 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -3.734 3.771 2.013 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.158 5.954 3.890 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.255 5.922 5.291 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.800 4.897 5.276 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.493 2.967 2.570 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -1.760 4.592 3.244 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -1.840 3.165 4.304 1.00 0.00 H new ATOM 536 N ALA A 36 -3.356 2.549 6.602 1.00 0.00 N ATOM 537 CA ALA A 36 -2.452 1.609 7.277 1.00 0.00 C ATOM 538 C ALA A 36 -3.193 0.319 7.667 1.00 0.00 C ATOM 539 O ALA A 36 -2.590 -0.748 7.767 1.00 0.00 O ATOM 540 CB ALA A 36 -1.811 2.261 8.501 1.00 0.00 C ATOM 0 H ALA A 36 -3.382 3.478 7.023 1.00 0.00 H new ATOM 0 HA ALA A 36 -1.658 1.342 6.580 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -1.145 1.548 8.986 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -1.241 3.136 8.190 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -2.589 2.565 9.201 1.00 0.00 H new ATOM 546 N LYS A 37 -4.496 0.456 7.933 1.00 0.00 N ATOM 547 CA LYS A 37 -5.363 -0.650 8.362 1.00 0.00 C ATOM 548 C LYS A 37 -5.200 -1.934 7.526 1.00 0.00 C ATOM 549 O LYS A 37 -5.120 -3.024 8.097 1.00 0.00 O ATOM 550 CB LYS A 37 -6.829 -0.210 8.311 1.00 0.00 C ATOM 551 CG LYS A 37 -7.802 -1.216 8.910 1.00 0.00 C ATOM 552 CD LYS A 37 -7.741 -1.216 10.427 1.00 0.00 C ATOM 553 CE LYS A 37 -8.287 0.083 11.002 1.00 0.00 C ATOM 554 NZ LYS A 37 -8.158 0.136 12.479 1.00 0.00 N ATOM 0 H LYS A 37 -4.985 1.348 7.856 1.00 0.00 H new ATOM 0 HA LYS A 37 -5.056 -0.892 9.380 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -6.931 0.737 8.840 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -7.106 -0.027 7.273 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -8.816 -0.980 8.586 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -7.572 -2.213 8.536 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -8.314 -2.058 10.816 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -6.710 -1.355 10.752 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -7.755 0.926 10.561 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -9.336 0.189 10.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -8.542 1.037 12.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -8.687 -0.653 12.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -7.155 0.061 12.743 1.00 0.00 H new ATOM 568 N TRP A 38 -5.172 -1.834 6.190 1.00 0.00 N ATOM 569 CA TRP A 38 -5.119 -3.046 5.358 1.00 0.00 C ATOM 570 C TRP A 38 -3.703 -3.622 5.288 1.00 0.00 C ATOM 571 O TRP A 38 -3.029 -3.551 4.261 1.00 0.00 O ATOM 572 CB TRP A 38 -5.747 -2.876 3.937 1.00 0.00 C ATOM 573 CG TRP A 38 -5.686 -1.497 3.349 1.00 0.00 C ATOM 574 CD1 TRP A 38 -6.199 -0.377 3.905 1.00 0.00 C ATOM 575 CD2 TRP A 38 -5.153 -1.093 2.067 1.00 0.00 C ATOM 576 NE1 TRP A 38 -5.933 0.705 3.113 1.00 0.00 N ATOM 577 CE2 TRP A 38 -5.301 0.293 1.984 1.00 0.00 C ATOM 578 CE3 TRP A 38 -4.538 -1.741 0.996 1.00 0.00 C ATOM 579 CZ2 TRP A 38 -4.854 1.030 0.891 1.00 0.00 C ATOM 580 CZ3 TRP A 38 -4.113 -0.990 -0.091 1.00 0.00 C ATOM 581 CH2 TRP A 38 -4.268 0.375 -0.125 1.00 0.00 C ATOM 0 H TRP A 38 -5.185 -0.955 5.673 1.00 0.00 H new ATOM 0 HA TRP A 38 -5.755 -3.771 5.866 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -5.244 -3.562 3.255 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -6.792 -3.183 3.985 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -6.740 -0.342 4.839 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -6.172 1.671 3.335 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -4.395 -2.811 1.012 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -4.975 2.103 0.861 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -3.650 -1.490 -0.929 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -3.913 0.929 -0.981 1.00 0.00 H new ATOM 592 N PHE A 39 -3.280 -4.177 6.430 1.00 0.00 N ATOM 593 CA PHE A 39 -2.091 -5.027 6.546 1.00 0.00 C ATOM 594 C PHE A 39 -0.779 -4.273 6.347 1.00 0.00 C ATOM 595 O PHE A 39 -0.764 -3.120 5.922 1.00 0.00 O ATOM 596 CB PHE A 39 -2.178 -6.210 5.581 1.00 0.00 C ATOM 597 CG PHE A 39 -3.218 -7.224 5.972 1.00 0.00 C ATOM 598 CD1 PHE A 39 -4.563 -6.992 5.726 1.00 0.00 C ATOM 599 CD2 PHE A 39 -2.848 -8.410 6.581 1.00 0.00 C ATOM 600 CE1 PHE A 39 -5.517 -7.924 6.083 1.00 0.00 C ATOM 601 CE2 PHE A 39 -3.797 -9.346 6.941 1.00 0.00 C ATOM 602 CZ PHE A 39 -5.133 -9.103 6.691 1.00 0.00 C ATOM 0 H PHE A 39 -3.765 -4.044 7.317 1.00 0.00 H new ATOM 0 HA PHE A 39 -2.081 -5.394 7.572 1.00 0.00 H new ATOM 0 HB2 PHE A 39 -2.402 -5.838 4.581 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -1.205 -6.699 5.529 1.00 0.00 H new ATOM 0 HD1 PHE A 39 -4.868 -6.072 5.250 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -1.804 -8.606 6.777 1.00 0.00 H new ATOM 0 HE1 PHE A 39 -6.561 -7.731 5.887 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -3.495 -10.267 7.417 1.00 0.00 H new ATOM 0 HZ PHE A 39 -5.877 -9.834 6.971 1.00 0.00 H new ATOM 612 N MET A 40 0.318 -4.967 6.671 1.00 0.00 N ATOM 613 CA MET A 40 1.672 -4.413 6.622 1.00 0.00 C ATOM 614 C MET A 40 1.840 -3.271 7.625 1.00 0.00 C ATOM 615 O MET A 40 1.228 -2.216 7.489 1.00 0.00 O ATOM 616 CB MET A 40 2.037 -3.948 5.206 1.00 0.00 C ATOM 617 CG MET A 40 2.008 -5.060 4.164 1.00 0.00 C ATOM 618 SD MET A 40 2.730 -4.561 2.584 1.00 0.00 S ATOM 619 CE MET A 40 4.450 -4.358 3.049 1.00 0.00 C ATOM 0 H MET A 40 0.288 -5.939 6.978 1.00 0.00 H new ATOM 0 HA MET A 40 2.359 -5.212 6.900 1.00 0.00 H new ATOM 0 HB2 MET A 40 1.346 -3.161 4.903 1.00 0.00 H new ATOM 0 HB3 MET A 40 3.034 -3.507 5.225 1.00 0.00 H new ATOM 0 HG2 MET A 40 2.549 -5.925 4.548 1.00 0.00 H new ATOM 0 HG3 MET A 40 0.977 -5.374 4.004 1.00 0.00 H new ATOM 0 HE1 MET A 40 5.083 -4.900 2.347 1.00 0.00 H new ATOM 0 HE2 MET A 40 4.710 -3.300 3.029 1.00 0.00 H new ATOM 0 HE3 MET A 40 4.604 -4.751 4.054 1.00 0.00 H new ATOM 629 N PRO A 41 2.677 -3.483 8.661 1.00 0.00 N ATOM 630 CA PRO A 41 2.932 -2.483 9.710 1.00 0.00 C ATOM 631 C PRO A 41 3.245 -1.106 9.148 1.00 0.00 C ATOM 632 O PRO A 41 4.333 -0.867 8.614 1.00 0.00 O ATOM 633 CB PRO A 41 4.153 -3.027 10.420 1.00 0.00 C ATOM 634 CG PRO A 41 4.064 -4.502 10.246 1.00 0.00 C ATOM 635 CD PRO A 41 3.443 -4.722 8.892 1.00 0.00 C ATOM 0 HA PRO A 41 2.059 -2.345 10.348 1.00 0.00 H new ATOM 0 HB2 PRO A 41 5.072 -2.632 9.987 1.00 0.00 H new ATOM 0 HB3 PRO A 41 4.153 -2.752 11.475 1.00 0.00 H new ATOM 0 HG2 PRO A 41 5.051 -4.962 10.302 1.00 0.00 H new ATOM 0 HG3 PRO A 41 3.457 -4.952 11.032 1.00 0.00 H new ATOM 0 HD2 PRO A 41 4.200 -4.875 8.123 1.00 0.00 H new ATOM 0 HD3 PRO A 41 2.798 -5.601 8.884 1.00 0.00 H new ATOM 643 N ASN A 42 2.288 -0.214 9.279 1.00 0.00 N ATOM 644 CA ASN A 42 2.374 1.101 8.677 1.00 0.00 C ATOM 645 C ASN A 42 1.477 2.064 9.440 1.00 0.00 C ATOM 646 O ASN A 42 0.632 1.634 10.226 1.00 0.00 O ATOM 647 CB ASN A 42 1.936 0.997 7.214 1.00 0.00 C ATOM 648 CG ASN A 42 2.400 2.156 6.340 1.00 0.00 C ATOM 649 OD1 ASN A 42 2.725 3.237 6.820 1.00 0.00 O ATOM 650 ND2 ASN A 42 2.407 1.943 5.034 1.00 0.00 N ATOM 0 H ASN A 42 1.429 -0.378 9.804 1.00 0.00 H new ATOM 0 HA ASN A 42 3.397 1.476 8.719 1.00 0.00 H new ATOM 0 HB2 ASN A 42 2.319 0.066 6.797 1.00 0.00 H new ATOM 0 HB3 ASN A 42 0.848 0.940 7.175 1.00 0.00 H new ATOM 0 HD21 ASN A 42 2.688 2.689 4.397 1.00 0.00 H new ATOM 0 HD22 ASN A 42 2.131 1.033 4.664 1.00 0.00 H new ATOM 657 N ASP A 43 1.676 3.350 9.214 1.00 0.00 N ATOM 658 CA ASP A 43 0.820 4.383 9.758 1.00 0.00 C ATOM 659 C ASP A 43 0.898 5.607 8.860 1.00 0.00 C ATOM 660 O ASP A 43 0.917 6.751 9.316 1.00 0.00 O ATOM 661 CB ASP A 43 1.193 4.699 11.208 1.00 0.00 C ATOM 662 CG ASP A 43 2.619 5.200 11.395 1.00 0.00 C ATOM 663 OD1 ASP A 43 3.566 4.378 11.308 1.00 0.00 O ATOM 664 OD2 ASP A 43 2.793 6.409 11.668 1.00 0.00 O ATOM 0 H ASP A 43 2.442 3.707 8.643 1.00 0.00 H new ATOM 0 HA ASP A 43 -0.213 4.036 9.780 1.00 0.00 H new ATOM 0 HB2 ASP A 43 0.503 5.450 11.592 1.00 0.00 H new ATOM 0 HB3 ASP A 43 1.054 3.801 11.810 1.00 0.00 H new ATOM 669 N PHE A 44 0.956 5.313 7.557 1.00 0.00 N ATOM 670 CA PHE A 44 0.962 6.316 6.491 1.00 0.00 C ATOM 671 C PHE A 44 -0.039 7.440 6.748 1.00 0.00 C ATOM 672 O PHE A 44 -1.113 7.227 7.305 1.00 0.00 O ATOM 673 CB PHE A 44 0.633 5.657 5.148 1.00 0.00 C ATOM 674 CG PHE A 44 0.690 6.628 4.005 1.00 0.00 C ATOM 675 CD1 PHE A 44 1.811 7.407 3.826 1.00 0.00 C ATOM 676 CD2 PHE A 44 -0.378 6.791 3.140 1.00 0.00 C ATOM 677 CE1 PHE A 44 1.881 8.326 2.806 1.00 0.00 C ATOM 678 CE2 PHE A 44 -0.312 7.718 2.115 1.00 0.00 C ATOM 679 CZ PHE A 44 0.817 8.486 1.950 1.00 0.00 C ATOM 0 H PHE A 44 1.001 4.355 7.209 1.00 0.00 H new ATOM 0 HA PHE A 44 1.962 6.750 6.468 1.00 0.00 H new ATOM 0 HB2 PHE A 44 1.334 4.843 4.965 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -0.363 5.216 5.197 1.00 0.00 H new ATOM 0 HD1 PHE A 44 2.649 7.294 4.498 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -1.268 6.192 3.266 1.00 0.00 H new ATOM 0 HE1 PHE A 44 2.772 8.922 2.677 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -1.149 7.839 1.443 1.00 0.00 H new ATOM 0 HZ PHE A 44 0.868 9.212 1.152 1.00 0.00 H new ATOM 689 N GLN A 45 0.365 8.635 6.346 1.00 0.00 N ATOM 690 CA GLN A 45 -0.448 9.842 6.395 1.00 0.00 C ATOM 691 C GLN A 45 -0.145 10.581 5.108 1.00 0.00 C ATOM 692 O GLN A 45 1.012 10.562 4.689 1.00 0.00 O ATOM 693 CB GLN A 45 -0.038 10.679 7.611 1.00 0.00 C ATOM 694 CG GLN A 45 -0.079 9.899 8.915 1.00 0.00 C ATOM 695 CD GLN A 45 0.996 10.325 9.892 1.00 0.00 C ATOM 696 OE1 GLN A 45 1.390 11.491 9.930 1.00 0.00 O ATOM 697 NE2 GLN A 45 1.501 9.375 10.662 1.00 0.00 N ATOM 0 H GLN A 45 1.297 8.797 5.965 1.00 0.00 H new ATOM 0 HA GLN A 45 -1.513 9.629 6.488 1.00 0.00 H new ATOM 0 HB2 GLN A 45 0.970 11.063 7.456 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -0.699 11.542 7.690 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -1.057 10.029 9.379 1.00 0.00 H new ATOM 0 HG3 GLN A 45 0.033 8.836 8.700 1.00 0.00 H new ATOM 0 HE21 GLN A 45 1.144 8.422 10.597 1.00 0.00 H new ATOM 0 HE22 GLN A 45 2.248 9.596 11.321 1.00 0.00 H new ATOM 706 N LEU A 46 -1.112 11.216 4.444 1.00 0.00 N ATOM 707 CA LEU A 46 -0.784 11.739 3.126 1.00 0.00 C ATOM 708 C LEU A 46 0.104 12.970 3.266 1.00 0.00 C ATOM 709 O LEU A 46 -0.320 14.080 3.596 1.00 0.00 O ATOM 710 CB LEU A 46 -2.020 12.014 2.248 1.00 0.00 C ATOM 711 CG LEU A 46 -2.827 13.276 2.551 1.00 0.00 C ATOM 712 CD1 LEU A 46 -3.848 13.528 1.453 1.00 0.00 C ATOM 713 CD2 LEU A 46 -3.522 13.179 3.902 1.00 0.00 C ATOM 0 H LEU A 46 -2.065 11.372 4.771 1.00 0.00 H new ATOM 0 HA LEU A 46 -0.233 10.962 2.596 1.00 0.00 H new ATOM 0 HB2 LEU A 46 -1.692 12.064 1.210 1.00 0.00 H new ATOM 0 HB3 LEU A 46 -2.689 11.158 2.330 1.00 0.00 H new ATOM 0 HG LEU A 46 -2.132 14.115 2.589 1.00 0.00 H new ATOM 0 HD11 LEU A 46 -4.415 14.430 1.683 1.00 0.00 H new ATOM 0 HD12 LEU A 46 -3.334 13.656 0.500 1.00 0.00 H new ATOM 0 HD13 LEU A 46 -4.528 12.679 1.387 1.00 0.00 H new ATOM 0 HD21 LEU A 46 -4.087 14.093 4.087 1.00 0.00 H new ATOM 0 HD22 LEU A 46 -4.201 12.326 3.902 1.00 0.00 H new ATOM 0 HD23 LEU A 46 -2.776 13.049 4.686 1.00 0.00 H new ATOM 725 N LYS A 47 1.358 12.699 3.028 1.00 0.00 N ATOM 726 CA LYS A 47 2.444 13.633 3.160 1.00 0.00 C ATOM 727 C LYS A 47 3.294 13.521 1.931 1.00 0.00 C ATOM 728 O LYS A 47 3.207 12.527 1.261 1.00 0.00 O ATOM 729 CB LYS A 47 3.228 13.337 4.425 1.00 0.00 C ATOM 730 CG LYS A 47 2.665 14.074 5.620 1.00 0.00 C ATOM 731 CD LYS A 47 3.186 13.544 6.943 1.00 0.00 C ATOM 732 CE LYS A 47 2.502 14.244 8.108 1.00 0.00 C ATOM 733 NZ LYS A 47 2.895 13.676 9.423 1.00 0.00 N ATOM 0 H LYS A 47 1.666 11.776 2.722 1.00 0.00 H new ATOM 0 HA LYS A 47 2.078 14.656 3.247 1.00 0.00 H new ATOM 0 HB2 LYS A 47 3.213 12.265 4.619 1.00 0.00 H new ATOM 0 HB3 LYS A 47 4.271 13.620 4.281 1.00 0.00 H new ATOM 0 HG2 LYS A 47 2.912 15.132 5.536 1.00 0.00 H new ATOM 0 HG3 LYS A 47 1.578 13.998 5.607 1.00 0.00 H new ATOM 0 HD2 LYS A 47 3.012 12.470 7.004 1.00 0.00 H new ATOM 0 HD3 LYS A 47 4.264 13.696 7.003 1.00 0.00 H new ATOM 0 HE2 LYS A 47 2.749 15.305 8.086 1.00 0.00 H new ATOM 0 HE3 LYS A 47 1.421 14.166 7.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 2.455 14.230 10.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 2.575 12.688 9.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 3.930 13.712 9.521 1.00 0.00 H new ATOM 747 N GLU A 48 3.987 14.559 1.545 1.00 0.00 N ATOM 748 CA GLU A 48 4.896 14.457 0.412 1.00 0.00 C ATOM 749 C GLU A 48 6.320 14.854 0.780 1.00 0.00 C ATOM 750 O GLU A 48 6.541 15.914 1.365 1.00 0.00 O ATOM 751 CB GLU A 48 4.376 15.240 -0.772 1.00 0.00 C ATOM 752 CG GLU A 48 3.347 14.474 -1.577 1.00 0.00 C ATOM 753 CD GLU A 48 2.645 15.367 -2.574 1.00 0.00 C ATOM 754 OE1 GLU A 48 1.865 16.243 -2.151 1.00 0.00 O ATOM 755 OE2 GLU A 48 2.888 15.208 -3.789 1.00 0.00 O ATOM 0 H GLU A 48 3.948 15.478 1.985 1.00 0.00 H new ATOM 0 HA GLU A 48 4.937 13.408 0.120 1.00 0.00 H new ATOM 0 HB2 GLU A 48 3.934 16.172 -0.419 1.00 0.00 H new ATOM 0 HB3 GLU A 48 5.211 15.508 -1.419 1.00 0.00 H new ATOM 0 HG2 GLU A 48 3.833 13.652 -2.103 1.00 0.00 H new ATOM 0 HG3 GLU A 48 2.613 14.032 -0.904 1.00 0.00 H new ATOM 762 N GLY A 49 7.271 13.990 0.436 1.00 0.00 N ATOM 763 CA GLY A 49 8.684 14.226 0.724 1.00 0.00 C ATOM 764 C GLY A 49 8.919 14.514 2.188 1.00 0.00 C ATOM 765 O GLY A 49 9.702 15.384 2.565 1.00 0.00 O ATOM 0 H GLY A 49 7.086 13.111 -0.048 1.00 0.00 H new ATOM 0 HA2 GLY A 49 9.266 13.353 0.428 1.00 0.00 H new ATOM 0 HA3 GLY A 49 9.041 15.065 0.127 1.00 0.00 H new ATOM 769 N GLN A 50 8.202 13.767 2.985 1.00 0.00 N ATOM 770 CA GLN A 50 8.188 13.875 4.414 1.00 0.00 C ATOM 771 C GLN A 50 8.942 12.701 4.976 1.00 0.00 C ATOM 772 O GLN A 50 9.331 11.811 4.228 1.00 0.00 O ATOM 773 CB GLN A 50 6.737 13.820 4.872 1.00 0.00 C ATOM 774 CG GLN A 50 6.246 12.407 5.090 1.00 0.00 C ATOM 775 CD GLN A 50 6.257 11.625 3.807 1.00 0.00 C ATOM 776 OE1 GLN A 50 5.881 12.280 2.728 1.00 0.00 O flip ATOM 777 NE2 GLN A 50 6.588 10.455 3.783 1.00 0.00 N flip ATOM 0 H GLN A 50 7.584 13.034 2.636 1.00 0.00 H new ATOM 0 HA GLN A 50 8.648 14.804 4.750 1.00 0.00 H new ATOM 0 HB2 GLN A 50 6.631 14.384 5.799 1.00 0.00 H new ATOM 0 HB3 GLN A 50 6.107 14.308 4.128 1.00 0.00 H new ATOM 0 HG2 GLN A 50 6.876 11.910 5.828 1.00 0.00 H new ATOM 0 HG3 GLN A 50 5.235 12.429 5.497 1.00 0.00 H new ATOM 0 HE21 GLN A 50 6.872 9.988 4.644 1.00 0.00 H new ATOM 0 HE22 GLN A 50 6.581 9.941 2.902 1.00 0.00 H new ATOM 786 N GLU A 51 9.174 12.682 6.256 1.00 0.00 N ATOM 787 CA GLU A 51 9.469 11.420 6.874 1.00 0.00 C ATOM 788 C GLU A 51 8.488 11.190 8.021 1.00 0.00 C ATOM 789 O GLU A 51 8.320 12.051 8.883 1.00 0.00 O ATOM 790 CB GLU A 51 10.930 11.370 7.332 1.00 0.00 C ATOM 791 CG GLU A 51 11.900 11.777 6.227 1.00 0.00 C ATOM 792 CD GLU A 51 13.344 11.430 6.512 1.00 0.00 C ATOM 793 OE1 GLU A 51 13.842 11.763 7.607 1.00 0.00 O ATOM 794 OE2 GLU A 51 13.994 10.839 5.621 1.00 0.00 O ATOM 0 H GLU A 51 9.166 13.493 6.875 1.00 0.00 H new ATOM 0 HA GLU A 51 9.346 10.611 6.153 1.00 0.00 H new ATOM 0 HB2 GLU A 51 11.062 12.030 8.189 1.00 0.00 H new ATOM 0 HB3 GLU A 51 11.168 10.361 7.668 1.00 0.00 H new ATOM 0 HG2 GLU A 51 11.598 11.294 5.298 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.821 12.852 6.067 1.00 0.00 H new ATOM 801 N PHE A 52 7.842 10.024 8.030 1.00 0.00 N ATOM 802 CA PHE A 52 6.811 9.736 9.030 1.00 0.00 C ATOM 803 C PHE A 52 7.010 8.390 9.709 1.00 0.00 C ATOM 804 O PHE A 52 7.134 7.359 9.051 1.00 0.00 O ATOM 805 CB PHE A 52 5.391 9.837 8.447 1.00 0.00 C ATOM 806 CG PHE A 52 5.169 9.338 7.051 1.00 0.00 C ATOM 807 CD1 PHE A 52 5.828 8.242 6.523 1.00 0.00 C ATOM 808 CD2 PHE A 52 4.270 10.015 6.254 1.00 0.00 C ATOM 809 CE1 PHE A 52 5.585 7.842 5.232 1.00 0.00 C ATOM 810 CE2 PHE A 52 4.029 9.623 4.973 1.00 0.00 C ATOM 811 CZ PHE A 52 4.687 8.533 4.449 1.00 0.00 C ATOM 0 H PHE A 52 8.011 9.270 7.364 1.00 0.00 H new ATOM 0 HA PHE A 52 6.921 10.508 9.792 1.00 0.00 H new ATOM 0 HB2 PHE A 52 4.718 9.291 9.108 1.00 0.00 H new ATOM 0 HB3 PHE A 52 5.090 10.884 8.480 1.00 0.00 H new ATOM 0 HD1 PHE A 52 6.537 7.698 7.129 1.00 0.00 H new ATOM 0 HD2 PHE A 52 3.748 10.872 6.653 1.00 0.00 H new ATOM 0 HE1 PHE A 52 6.100 6.982 4.829 1.00 0.00 H new ATOM 0 HE2 PHE A 52 3.321 10.168 4.367 1.00 0.00 H new ATOM 0 HZ PHE A 52 4.500 8.222 3.432 1.00 0.00 H new ATOM 821 N HIS A 53 7.058 8.413 11.036 1.00 0.00 N ATOM 822 CA HIS A 53 7.222 7.192 11.812 1.00 0.00 C ATOM 823 C HIS A 53 6.485 7.276 13.141 1.00 0.00 C ATOM 824 O HIS A 53 6.504 8.311 13.812 1.00 0.00 O ATOM 825 CB HIS A 53 8.712 6.891 12.060 1.00 0.00 C ATOM 826 CG HIS A 53 9.468 7.951 12.818 1.00 0.00 C ATOM 827 ND1 HIS A 53 9.344 9.301 12.831 1.00 0.00 N flip ATOM 828 CD2 HIS A 53 10.518 7.662 13.663 1.00 0.00 C flip ATOM 829 CE1 HIS A 53 10.305 9.789 13.674 1.00 0.00 C flip ATOM 830 NE2 HIS A 53 11.001 8.784 14.164 1.00 0.00 N flip ATOM 0 H HIS A 53 6.986 9.263 11.595 1.00 0.00 H new ATOM 0 HA HIS A 53 6.791 6.379 11.228 1.00 0.00 H new ATOM 0 HB2 HIS A 53 8.789 5.952 12.608 1.00 0.00 H new ATOM 0 HB3 HIS A 53 9.200 6.739 11.097 1.00 0.00 H new ATOM 0 HD1 HIS A 53 8.661 9.851 12.309 1.00 0.00 H new ATOM 0 HD2 HIS A 53 10.888 6.671 13.881 1.00 0.00 H new ATOM 0 HE1 HIS A 53 10.467 10.832 13.901 1.00 0.00 H new ATOM 839 N LEU A 54 5.852 6.178 13.518 1.00 0.00 N ATOM 840 CA LEU A 54 5.269 6.040 14.842 1.00 0.00 C ATOM 841 C LEU A 54 6.333 5.441 15.758 1.00 0.00 C ATOM 842 O LEU A 54 6.208 5.434 16.981 1.00 0.00 O ATOM 843 CB LEU A 54 4.011 5.149 14.766 1.00 0.00 C ATOM 844 CG LEU A 54 3.026 5.235 15.945 1.00 0.00 C ATOM 845 CD1 LEU A 54 3.453 4.340 17.098 1.00 0.00 C ATOM 846 CD2 LEU A 54 2.879 6.675 16.417 1.00 0.00 C ATOM 0 H LEU A 54 5.728 5.362 12.919 1.00 0.00 H new ATOM 0 HA LEU A 54 4.956 7.006 15.240 1.00 0.00 H new ATOM 0 HB2 LEU A 54 3.471 5.401 13.853 1.00 0.00 H new ATOM 0 HB3 LEU A 54 4.334 4.113 14.669 1.00 0.00 H new ATOM 0 HG LEU A 54 2.058 4.881 15.590 1.00 0.00 H new ATOM 0 HD11 LEU A 54 2.733 4.427 17.912 1.00 0.00 H new ATOM 0 HD12 LEU A 54 3.494 3.305 16.759 1.00 0.00 H new ATOM 0 HD13 LEU A 54 4.438 4.646 17.450 1.00 0.00 H new ATOM 0 HD21 LEU A 54 2.178 6.715 17.251 1.00 0.00 H new ATOM 0 HD22 LEU A 54 3.849 7.053 16.740 1.00 0.00 H new ATOM 0 HD23 LEU A 54 2.504 7.290 15.599 1.00 0.00 H new ATOM 858 N GLN A 55 7.405 4.976 15.129 1.00 0.00 N ATOM 859 CA GLN A 55 8.523 4.360 15.830 1.00 0.00 C ATOM 860 C GLN A 55 9.324 5.397 16.623 1.00 0.00 C ATOM 861 O GLN A 55 9.000 6.590 16.602 1.00 0.00 O ATOM 862 CB GLN A 55 9.425 3.645 14.821 1.00 0.00 C ATOM 863 CG GLN A 55 8.708 2.554 14.038 1.00 0.00 C ATOM 864 CD GLN A 55 9.538 2.008 12.891 1.00 0.00 C ATOM 865 OE1 GLN A 55 10.295 1.049 13.052 1.00 0.00 O ATOM 866 NE2 GLN A 55 9.384 2.602 11.718 1.00 0.00 N ATOM 0 H GLN A 55 7.523 5.016 14.117 1.00 0.00 H new ATOM 0 HA GLN A 55 8.129 3.636 16.543 1.00 0.00 H new ATOM 0 HB2 GLN A 55 9.829 4.378 14.123 1.00 0.00 H new ATOM 0 HB3 GLN A 55 10.272 3.207 15.349 1.00 0.00 H new ATOM 0 HG2 GLN A 55 8.450 1.738 14.714 1.00 0.00 H new ATOM 0 HG3 GLN A 55 7.772 2.951 13.646 1.00 0.00 H new ATOM 0 HE21 GLN A 55 8.747 3.393 11.627 1.00 0.00 H new ATOM 0 HE22 GLN A 55 9.902 2.268 10.905 1.00 0.00 H new ATOM 875 N SER A 56 10.370 4.930 17.298 1.00 0.00 N ATOM 876 CA SER A 56 11.185 5.762 18.181 1.00 0.00 C ATOM 877 C SER A 56 11.694 7.018 17.466 1.00 0.00 C ATOM 878 O SER A 56 12.267 6.942 16.374 1.00 0.00 O ATOM 879 CB SER A 56 12.367 4.941 18.713 1.00 0.00 C ATOM 880 OG SER A 56 13.037 5.611 19.771 1.00 0.00 O ATOM 0 H SER A 56 10.679 3.959 17.248 1.00 0.00 H new ATOM 0 HA SER A 56 10.560 6.089 19.012 1.00 0.00 H new ATOM 0 HB2 SER A 56 12.009 3.973 19.064 1.00 0.00 H new ATOM 0 HB3 SER A 56 13.069 4.747 17.902 1.00 0.00 H new ATOM 0 HG SER A 56 13.783 5.059 20.087 1.00 0.00 H new ATOM 886 N PRO A 57 11.457 8.196 18.069 1.00 0.00 N ATOM 887 CA PRO A 57 11.947 9.476 17.558 1.00 0.00 C ATOM 888 C PRO A 57 13.457 9.608 17.725 1.00 0.00 C ATOM 889 O PRO A 57 14.074 8.845 18.473 1.00 0.00 O ATOM 890 CB PRO A 57 11.216 10.525 18.412 1.00 0.00 C ATOM 891 CG PRO A 57 10.163 9.770 19.156 1.00 0.00 C ATOM 892 CD PRO A 57 10.683 8.373 19.302 1.00 0.00 C ATOM 0 HA PRO A 57 11.758 9.588 16.490 1.00 0.00 H new ATOM 0 HB2 PRO A 57 11.903 11.020 19.098 1.00 0.00 H new ATOM 0 HB3 PRO A 57 10.775 11.302 17.787 1.00 0.00 H new ATOM 0 HG2 PRO A 57 9.975 10.220 20.131 1.00 0.00 H new ATOM 0 HG3 PRO A 57 9.218 9.780 18.613 1.00 0.00 H new ATOM 0 HD2 PRO A 57 11.304 8.261 20.191 1.00 0.00 H new ATOM 0 HD3 PRO A 57 9.876 7.645 19.383 1.00 0.00 H new ATOM 900 N PHE A 58 14.042 10.587 17.031 1.00 0.00 N ATOM 901 CA PHE A 58 15.496 10.775 17.007 1.00 0.00 C ATOM 902 C PHE A 58 16.191 9.528 16.470 1.00 0.00 C ATOM 903 O PHE A 58 17.349 9.260 16.787 1.00 0.00 O ATOM 904 CB PHE A 58 16.040 11.102 18.402 1.00 0.00 C ATOM 905 CG PHE A 58 15.465 12.347 19.010 1.00 0.00 C ATOM 906 CD1 PHE A 58 15.986 13.591 18.690 1.00 0.00 C ATOM 907 CD2 PHE A 58 14.409 12.274 19.905 1.00 0.00 C ATOM 908 CE1 PHE A 58 15.462 14.738 19.253 1.00 0.00 C ATOM 909 CE2 PHE A 58 13.885 13.417 20.471 1.00 0.00 C ATOM 910 CZ PHE A 58 14.410 14.650 20.143 1.00 0.00 C ATOM 0 H PHE A 58 13.526 11.268 16.473 1.00 0.00 H new ATOM 0 HA PHE A 58 15.704 11.617 16.347 1.00 0.00 H new ATOM 0 HB2 PHE A 58 15.838 10.261 19.065 1.00 0.00 H new ATOM 0 HB3 PHE A 58 17.123 11.207 18.342 1.00 0.00 H new ATOM 0 HD1 PHE A 58 16.809 13.664 17.994 1.00 0.00 H new ATOM 0 HD2 PHE A 58 13.992 11.311 20.162 1.00 0.00 H new ATOM 0 HE1 PHE A 58 15.875 15.703 18.997 1.00 0.00 H new ATOM 0 HE2 PHE A 58 13.065 13.347 21.170 1.00 0.00 H new ATOM 0 HZ PHE A 58 13.998 15.546 20.582 1.00 0.00 H new ATOM 920 N GLY A 59 15.476 8.773 15.653 1.00 0.00 N ATOM 921 CA GLY A 59 16.010 7.532 15.140 1.00 0.00 C ATOM 922 C GLY A 59 16.186 7.560 13.638 1.00 0.00 C ATOM 923 O GLY A 59 16.348 8.633 13.052 1.00 0.00 O ATOM 0 H GLY A 59 14.533 8.998 15.336 1.00 0.00 H new ATOM 0 HA2 GLY A 59 16.971 7.330 15.612 1.00 0.00 H new ATOM 0 HA3 GLY A 59 15.343 6.713 15.410 1.00 0.00 H new ATOM 927 N PRO A 60 16.154 6.389 12.989 1.00 0.00 N ATOM 928 CA PRO A 60 16.331 6.277 11.543 1.00 0.00 C ATOM 929 C PRO A 60 15.168 6.893 10.776 1.00 0.00 C ATOM 930 O PRO A 60 14.020 6.858 11.233 1.00 0.00 O ATOM 931 CB PRO A 60 16.381 4.762 11.289 1.00 0.00 C ATOM 932 CG PRO A 60 16.558 4.133 12.628 1.00 0.00 C ATOM 933 CD PRO A 60 15.939 5.077 13.615 1.00 0.00 C ATOM 0 HA PRO A 60 17.223 6.805 11.207 1.00 0.00 H new ATOM 0 HB2 PRO A 60 15.465 4.415 10.812 1.00 0.00 H new ATOM 0 HB3 PRO A 60 17.205 4.504 10.623 1.00 0.00 H new ATOM 0 HG2 PRO A 60 16.075 3.157 12.667 1.00 0.00 H new ATOM 0 HG3 PRO A 60 17.614 3.976 12.848 1.00 0.00 H new ATOM 0 HD2 PRO A 60 14.880 4.869 13.764 1.00 0.00 H new ATOM 0 HD3 PRO A 60 16.418 5.012 14.592 1.00 0.00 H new ATOM 941 N SER A 61 15.478 7.465 9.622 1.00 0.00 N ATOM 942 CA SER A 61 14.466 8.005 8.737 1.00 0.00 C ATOM 943 C SER A 61 13.567 6.882 8.239 1.00 0.00 C ATOM 944 O SER A 61 14.037 5.909 7.653 1.00 0.00 O ATOM 945 CB SER A 61 15.136 8.719 7.570 1.00 0.00 C ATOM 946 OG SER A 61 15.865 9.848 8.024 1.00 0.00 O ATOM 0 H SER A 61 16.433 7.566 9.278 1.00 0.00 H new ATOM 0 HA SER A 61 13.852 8.725 9.278 1.00 0.00 H new ATOM 0 HB2 SER A 61 15.806 8.032 7.053 1.00 0.00 H new ATOM 0 HB3 SER A 61 14.382 9.033 6.848 1.00 0.00 H new ATOM 0 HG SER A 61 15.311 10.652 7.938 1.00 0.00 H new ATOM 952 N PRO A 62 12.259 7.011 8.481 1.00 0.00 N ATOM 953 CA PRO A 62 11.304 5.939 8.223 1.00 0.00 C ATOM 954 C PRO A 62 10.923 5.803 6.755 1.00 0.00 C ATOM 955 O PRO A 62 11.510 5.027 6.010 1.00 0.00 O ATOM 956 CB PRO A 62 10.090 6.359 9.048 1.00 0.00 C ATOM 957 CG PRO A 62 10.152 7.855 9.089 1.00 0.00 C ATOM 958 CD PRO A 62 11.612 8.220 9.026 1.00 0.00 C ATOM 0 HA PRO A 62 11.717 4.965 8.484 1.00 0.00 H new ATOM 0 HB2 PRO A 62 9.163 6.014 8.590 1.00 0.00 H new ATOM 0 HB3 PRO A 62 10.128 5.934 10.051 1.00 0.00 H new ATOM 0 HG2 PRO A 62 9.606 8.290 8.252 1.00 0.00 H new ATOM 0 HG3 PRO A 62 9.695 8.238 10.001 1.00 0.00 H new ATOM 0 HD2 PRO A 62 11.780 9.086 8.385 1.00 0.00 H new ATOM 0 HD3 PRO A 62 12.003 8.472 10.012 1.00 0.00 H new ATOM 966 N CYS A 63 9.924 6.561 6.360 1.00 0.00 N ATOM 967 CA CYS A 63 9.387 6.506 5.020 1.00 0.00 C ATOM 968 C CYS A 63 9.292 7.915 4.459 1.00 0.00 C ATOM 969 O CYS A 63 9.281 8.880 5.221 1.00 0.00 O ATOM 970 CB CYS A 63 8.005 5.856 5.069 1.00 0.00 C ATOM 971 SG CYS A 63 7.975 4.221 5.841 1.00 0.00 S ATOM 0 H CYS A 63 9.459 7.238 6.965 1.00 0.00 H new ATOM 0 HA CYS A 63 10.038 5.916 4.375 1.00 0.00 H new ATOM 0 HB2 CYS A 63 7.327 6.514 5.613 1.00 0.00 H new ATOM 0 HB3 CYS A 63 7.620 5.772 4.053 1.00 0.00 H new ATOM 0 HG CYS A 63 6.760 3.760 5.834 1.00 0.00 H new ATOM 977 N LYS A 64 9.224 8.037 3.141 1.00 0.00 N ATOM 978 CA LYS A 64 9.101 9.342 2.511 1.00 0.00 C ATOM 979 C LYS A 64 8.205 9.225 1.306 1.00 0.00 C ATOM 980 O LYS A 64 8.376 8.321 0.485 1.00 0.00 O ATOM 981 CB LYS A 64 10.471 9.890 2.090 1.00 0.00 C ATOM 982 CG LYS A 64 10.409 11.267 1.447 1.00 0.00 C ATOM 983 CD LYS A 64 11.792 11.852 1.172 1.00 0.00 C ATOM 984 CE LYS A 64 12.563 12.153 2.455 1.00 0.00 C ATOM 985 NZ LYS A 64 13.160 10.931 3.061 1.00 0.00 N ATOM 0 H LYS A 64 9.252 7.252 2.491 1.00 0.00 H new ATOM 0 HA LYS A 64 8.671 10.037 3.232 1.00 0.00 H new ATOM 0 HB2 LYS A 64 11.118 9.937 2.966 1.00 0.00 H new ATOM 0 HB3 LYS A 64 10.932 9.193 1.390 1.00 0.00 H new ATOM 0 HG2 LYS A 64 9.854 11.202 0.511 1.00 0.00 H new ATOM 0 HG3 LYS A 64 9.856 11.943 2.099 1.00 0.00 H new ATOM 0 HD2 LYS A 64 12.365 11.153 0.563 1.00 0.00 H new ATOM 0 HD3 LYS A 64 11.687 12.768 0.591 1.00 0.00 H new ATOM 0 HE2 LYS A 64 13.354 12.872 2.240 1.00 0.00 H new ATOM 0 HE3 LYS A 64 11.894 12.622 3.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 13.045 10.964 4.094 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 12.681 10.088 2.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 14.172 10.887 2.827 1.00 0.00 H new ATOM 999 N VAL A 65 7.234 10.111 1.196 1.00 0.00 N ATOM 1000 CA VAL A 65 6.349 10.052 0.063 1.00 0.00 C ATOM 1001 C VAL A 65 6.991 10.703 -1.148 1.00 0.00 C ATOM 1002 O VAL A 65 7.468 11.830 -1.085 1.00 0.00 O ATOM 1003 CB VAL A 65 5.004 10.721 0.347 1.00 0.00 C ATOM 1004 CG1 VAL A 65 4.184 10.853 -0.919 1.00 0.00 C ATOM 1005 CG2 VAL A 65 4.216 9.943 1.388 1.00 0.00 C ATOM 0 H VAL A 65 7.045 10.860 1.862 1.00 0.00 H new ATOM 0 HA VAL A 65 6.165 8.997 -0.141 1.00 0.00 H new ATOM 0 HB VAL A 65 5.212 11.718 0.736 1.00 0.00 H new ATOM 0 HG11 VAL A 65 3.233 11.332 -0.688 1.00 0.00 H new ATOM 0 HG12 VAL A 65 4.728 11.458 -1.644 1.00 0.00 H new ATOM 0 HG13 VAL A 65 4.000 9.864 -1.338 1.00 0.00 H new ATOM 0 HG21 VAL A 65 3.264 10.441 1.571 1.00 0.00 H new ATOM 0 HG22 VAL A 65 4.033 8.932 1.025 1.00 0.00 H new ATOM 0 HG23 VAL A 65 4.786 9.897 2.316 1.00 0.00 H new ATOM 1015 N LEU A 66 7.009 9.964 -2.235 1.00 0.00 N ATOM 1016 CA LEU A 66 7.474 10.468 -3.505 1.00 0.00 C ATOM 1017 C LEU A 66 6.526 11.540 -4.009 1.00 0.00 C ATOM 1018 O LEU A 66 6.937 12.636 -4.384 1.00 0.00 O ATOM 1019 CB LEU A 66 7.533 9.322 -4.518 1.00 0.00 C ATOM 1020 CG LEU A 66 8.822 8.504 -4.509 1.00 0.00 C ATOM 1021 CD1 LEU A 66 10.028 9.395 -4.766 1.00 0.00 C ATOM 1022 CD2 LEU A 66 8.969 7.764 -3.193 1.00 0.00 C ATOM 0 H LEU A 66 6.700 8.992 -2.261 1.00 0.00 H new ATOM 0 HA LEU A 66 8.468 10.896 -3.380 1.00 0.00 H new ATOM 0 HB2 LEU A 66 6.695 8.650 -4.330 1.00 0.00 H new ATOM 0 HB3 LEU A 66 7.392 9.735 -5.517 1.00 0.00 H new ATOM 0 HG LEU A 66 8.769 7.769 -5.312 1.00 0.00 H new ATOM 0 HD11 LEU A 66 10.935 8.791 -4.755 1.00 0.00 H new ATOM 0 HD12 LEU A 66 9.924 9.876 -5.738 1.00 0.00 H new ATOM 0 HD13 LEU A 66 10.090 10.157 -3.989 1.00 0.00 H new ATOM 0 HD21 LEU A 66 9.893 7.185 -3.202 1.00 0.00 H new ATOM 0 HD22 LEU A 66 8.998 8.482 -2.373 1.00 0.00 H new ATOM 0 HD23 LEU A 66 8.121 7.092 -3.057 1.00 0.00 H new ATOM 1034 N ALA A 67 5.256 11.194 -4.013 1.00 0.00 N ATOM 1035 CA ALA A 67 4.215 12.059 -4.506 1.00 0.00 C ATOM 1036 C ALA A 67 2.904 11.627 -3.904 1.00 0.00 C ATOM 1037 O ALA A 67 2.675 10.436 -3.720 1.00 0.00 O ATOM 1038 CB ALA A 67 4.148 12.000 -6.016 1.00 0.00 C ATOM 0 H ALA A 67 4.918 10.295 -3.670 1.00 0.00 H new ATOM 0 HA ALA A 67 4.429 13.089 -4.221 1.00 0.00 H new ATOM 0 HB1 ALA A 67 3.356 12.659 -6.371 1.00 0.00 H new ATOM 0 HB2 ALA A 67 5.102 12.320 -6.435 1.00 0.00 H new ATOM 0 HB3 ALA A 67 3.938 10.978 -6.331 1.00 0.00 H new ATOM 1044 N VAL A 68 2.050 12.558 -3.580 1.00 0.00 N ATOM 1045 CA VAL A 68 0.745 12.189 -3.104 1.00 0.00 C ATOM 1046 C VAL A 68 -0.325 13.056 -3.752 1.00 0.00 C ATOM 1047 O VAL A 68 -0.196 14.279 -3.850 1.00 0.00 O ATOM 1048 CB VAL A 68 0.615 12.191 -1.560 1.00 0.00 C ATOM 1049 CG1 VAL A 68 0.263 13.561 -1.006 1.00 0.00 C ATOM 1050 CG2 VAL A 68 -0.413 11.157 -1.150 1.00 0.00 C ATOM 0 H VAL A 68 2.228 13.561 -3.635 1.00 0.00 H new ATOM 0 HA VAL A 68 0.593 11.152 -3.404 1.00 0.00 H new ATOM 0 HB VAL A 68 1.586 11.935 -1.136 1.00 0.00 H new ATOM 0 HG11 VAL A 68 0.184 13.505 0.080 1.00 0.00 H new ATOM 0 HG12 VAL A 68 1.041 14.274 -1.277 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.690 13.888 -1.422 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -0.511 11.152 -0.064 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -1.375 11.402 -1.600 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -0.094 10.172 -1.490 1.00 0.00 H new ATOM 1060 N GLN A 69 -1.360 12.400 -4.226 1.00 0.00 N ATOM 1061 CA GLN A 69 -2.401 13.034 -5.001 1.00 0.00 C ATOM 1062 C GLN A 69 -3.748 12.519 -4.562 1.00 0.00 C ATOM 1063 O GLN A 69 -3.934 11.306 -4.414 1.00 0.00 O ATOM 1064 CB GLN A 69 -2.193 12.717 -6.471 1.00 0.00 C ATOM 1065 CG GLN A 69 -0.949 13.351 -7.075 1.00 0.00 C ATOM 1066 CD GLN A 69 -0.872 13.180 -8.579 1.00 0.00 C ATOM 1067 OE1 GLN A 69 -1.409 12.228 -9.141 1.00 0.00 O ATOM 1068 NE2 GLN A 69 -0.183 14.094 -9.241 1.00 0.00 N ATOM 0 H GLN A 69 -1.504 11.400 -4.082 1.00 0.00 H new ATOM 0 HA GLN A 69 -2.362 14.112 -4.848 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -2.132 11.636 -6.593 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -3.066 13.052 -7.031 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -0.935 14.414 -6.834 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -0.064 12.909 -6.618 1.00 0.00 H new ATOM 0 HE21 GLN A 69 0.248 14.870 -8.739 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -0.083 14.023 -10.254 1.00 0.00 H new ATOM 1077 N ALA A 70 -4.706 13.428 -4.453 1.00 0.00 N ATOM 1078 CA ALA A 70 -5.961 13.119 -3.801 1.00 0.00 C ATOM 1079 C ALA A 70 -6.698 12.073 -4.597 1.00 0.00 C ATOM 1080 O ALA A 70 -7.028 12.297 -5.760 1.00 0.00 O ATOM 1081 CB ALA A 70 -6.824 14.358 -3.662 1.00 0.00 C ATOM 0 H ALA A 70 -4.635 14.382 -4.808 1.00 0.00 H new ATOM 0 HA ALA A 70 -5.746 12.740 -2.802 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -7.760 14.096 -3.169 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -6.297 15.104 -3.067 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -7.036 14.766 -4.650 1.00 0.00 H new ATOM 1087 N PRO A 71 -7.042 10.964 -3.920 1.00 0.00 N ATOM 1088 CA PRO A 71 -7.338 9.676 -4.495 1.00 0.00 C ATOM 1089 C PRO A 71 -7.279 9.614 -6.011 1.00 0.00 C ATOM 1090 O PRO A 71 -8.277 9.413 -6.700 1.00 0.00 O ATOM 1091 CB PRO A 71 -8.704 9.457 -3.895 1.00 0.00 C ATOM 1092 CG PRO A 71 -8.485 9.876 -2.470 1.00 0.00 C ATOM 1093 CD PRO A 71 -7.342 10.885 -2.492 1.00 0.00 C ATOM 0 HA PRO A 71 -6.609 8.897 -4.273 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -9.468 10.061 -4.386 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -9.022 8.417 -3.971 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -9.388 10.321 -2.052 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -8.234 9.018 -1.846 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -7.640 11.850 -2.083 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -6.484 10.544 -1.912 1.00 0.00 H new ATOM 1101 N THR A 72 -6.069 9.833 -6.501 1.00 0.00 N ATOM 1102 CA THR A 72 -5.706 9.549 -7.865 1.00 0.00 C ATOM 1103 C THR A 72 -4.380 8.803 -7.876 1.00 0.00 C ATOM 1104 O THR A 72 -4.236 7.781 -8.547 1.00 0.00 O ATOM 1105 CB THR A 72 -5.591 10.835 -8.707 1.00 0.00 C ATOM 1106 OG1 THR A 72 -4.850 11.831 -7.988 1.00 0.00 O ATOM 1107 CG2 THR A 72 -6.964 11.377 -9.060 1.00 0.00 C ATOM 0 H THR A 72 -5.305 10.219 -5.947 1.00 0.00 H new ATOM 0 HA THR A 72 -6.491 8.937 -8.310 1.00 0.00 H new ATOM 0 HB THR A 72 -5.067 10.589 -9.630 1.00 0.00 H new ATOM 0 HG1 THR A 72 -5.385 12.155 -7.233 1.00 0.00 H new ATOM 0 HG21 THR A 72 -6.855 12.284 -9.654 1.00 0.00 H new ATOM 0 HG22 THR A 72 -7.513 10.631 -9.634 1.00 0.00 H new ATOM 0 HG23 THR A 72 -7.511 11.606 -8.145 1.00 0.00 H new ATOM 1115 N GLU A 73 -3.415 9.308 -7.106 1.00 0.00 N ATOM 1116 CA GLU A 73 -2.094 8.693 -7.051 1.00 0.00 C ATOM 1117 C GLU A 73 -1.483 8.840 -5.669 1.00 0.00 C ATOM 1118 O GLU A 73 -1.637 9.859 -5.008 1.00 0.00 O ATOM 1119 CB GLU A 73 -1.176 9.305 -8.099 1.00 0.00 C ATOM 1120 CG GLU A 73 0.082 8.495 -8.337 1.00 0.00 C ATOM 1121 CD GLU A 73 0.852 8.978 -9.541 1.00 0.00 C ATOM 1122 OE1 GLU A 73 0.444 8.656 -10.676 1.00 0.00 O ATOM 1123 OE2 GLU A 73 1.868 9.679 -9.363 1.00 0.00 O ATOM 0 H GLU A 73 -3.524 10.134 -6.518 1.00 0.00 H new ATOM 0 HA GLU A 73 -2.209 7.630 -7.263 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -1.721 9.402 -9.038 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -0.898 10.312 -7.786 1.00 0.00 H new ATOM 0 HG2 GLU A 73 0.719 8.549 -7.454 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -0.183 7.447 -8.474 1.00 0.00 H new ATOM 1130 N LEU A 74 -0.800 7.813 -5.241 1.00 0.00 N ATOM 1131 CA LEU A 74 -0.066 7.839 -4.005 1.00 0.00 C ATOM 1132 C LEU A 74 1.244 7.143 -4.247 1.00 0.00 C ATOM 1133 O LEU A 74 1.247 6.020 -4.683 1.00 0.00 O ATOM 1134 CB LEU A 74 -0.902 7.092 -2.964 1.00 0.00 C ATOM 1135 CG LEU A 74 -0.373 7.004 -1.551 1.00 0.00 C ATOM 1136 CD1 LEU A 74 -1.524 6.729 -0.621 1.00 0.00 C ATOM 1137 CD2 LEU A 74 0.652 5.910 -1.411 1.00 0.00 C ATOM 0 H LEU A 74 -0.737 6.928 -5.744 1.00 0.00 H new ATOM 0 HA LEU A 74 0.128 8.851 -3.650 1.00 0.00 H new ATOM 0 HB2 LEU A 74 -1.883 7.565 -2.923 1.00 0.00 H new ATOM 0 HB3 LEU A 74 -1.054 6.075 -3.326 1.00 0.00 H new ATOM 0 HG LEU A 74 0.109 7.949 -1.302 1.00 0.00 H new ATOM 0 HD11 LEU A 74 -1.157 6.663 0.403 1.00 0.00 H new ATOM 0 HD12 LEU A 74 -2.252 7.537 -0.694 1.00 0.00 H new ATOM 0 HD13 LEU A 74 -1.998 5.787 -0.898 1.00 0.00 H new ATOM 0 HD21 LEU A 74 1.010 5.876 -0.382 1.00 0.00 H new ATOM 0 HD22 LEU A 74 0.200 4.952 -1.669 1.00 0.00 H new ATOM 0 HD23 LEU A 74 1.489 6.108 -2.080 1.00 0.00 H new ATOM 1149 N SER A 75 2.343 7.789 -3.969 1.00 0.00 N ATOM 1150 CA SER A 75 3.634 7.123 -4.111 1.00 0.00 C ATOM 1151 C SER A 75 4.526 7.452 -2.943 1.00 0.00 C ATOM 1152 O SER A 75 4.770 8.614 -2.661 1.00 0.00 O ATOM 1153 CB SER A 75 4.324 7.548 -5.402 1.00 0.00 C ATOM 1154 OG SER A 75 3.581 7.169 -6.545 1.00 0.00 O ATOM 0 H SER A 75 2.385 8.756 -3.648 1.00 0.00 H new ATOM 0 HA SER A 75 3.453 6.048 -4.140 1.00 0.00 H new ATOM 0 HB2 SER A 75 4.463 8.629 -5.401 1.00 0.00 H new ATOM 0 HB3 SER A 75 5.316 7.099 -5.448 1.00 0.00 H new ATOM 0 HG SER A 75 4.053 7.459 -7.353 1.00 0.00 H new ATOM 1160 N PHE A 76 5.023 6.437 -2.284 1.00 0.00 N ATOM 1161 CA PHE A 76 5.904 6.629 -1.160 1.00 0.00 C ATOM 1162 C PHE A 76 6.842 5.447 -1.026 1.00 0.00 C ATOM 1163 O PHE A 76 6.542 4.367 -1.524 1.00 0.00 O ATOM 1164 CB PHE A 76 5.088 6.978 0.088 1.00 0.00 C ATOM 1165 CG PHE A 76 4.434 5.848 0.839 1.00 0.00 C ATOM 1166 CD1 PHE A 76 3.273 5.244 0.370 1.00 0.00 C ATOM 1167 CD2 PHE A 76 4.965 5.418 2.044 1.00 0.00 C ATOM 1168 CE1 PHE A 76 2.669 4.229 1.090 1.00 0.00 C ATOM 1169 CE2 PHE A 76 4.362 4.406 2.766 1.00 0.00 C ATOM 1170 CZ PHE A 76 3.214 3.810 2.287 1.00 0.00 C ATOM 0 H PHE A 76 4.831 5.461 -2.509 1.00 0.00 H new ATOM 0 HA PHE A 76 6.560 7.486 -1.314 1.00 0.00 H new ATOM 0 HB2 PHE A 76 5.744 7.505 0.781 1.00 0.00 H new ATOM 0 HB3 PHE A 76 4.308 7.679 -0.208 1.00 0.00 H new ATOM 0 HD1 PHE A 76 2.839 5.570 -0.564 1.00 0.00 H new ATOM 0 HD2 PHE A 76 5.864 5.881 2.425 1.00 0.00 H new ATOM 0 HE1 PHE A 76 1.769 3.764 0.715 1.00 0.00 H new ATOM 0 HE2 PHE A 76 4.789 4.082 3.704 1.00 0.00 H new ATOM 0 HZ PHE A 76 2.742 3.017 2.848 1.00 0.00 H new ATOM 1180 N GLU A 77 7.975 5.638 -0.381 1.00 0.00 N ATOM 1181 CA GLU A 77 8.953 4.567 -0.276 1.00 0.00 C ATOM 1182 C GLU A 77 9.112 4.190 1.176 1.00 0.00 C ATOM 1183 O GLU A 77 9.255 5.041 2.061 1.00 0.00 O ATOM 1184 CB GLU A 77 10.315 4.970 -0.855 1.00 0.00 C ATOM 1185 CG GLU A 77 10.411 4.883 -2.371 1.00 0.00 C ATOM 1186 CD GLU A 77 11.745 5.375 -2.904 1.00 0.00 C ATOM 1187 OE1 GLU A 77 11.886 6.593 -3.132 1.00 0.00 O ATOM 1188 OE2 GLU A 77 12.651 4.543 -3.120 1.00 0.00 O ATOM 0 H GLU A 77 8.242 6.511 0.074 1.00 0.00 H new ATOM 0 HA GLU A 77 8.590 3.719 -0.856 1.00 0.00 H new ATOM 0 HB2 GLU A 77 10.537 5.992 -0.548 1.00 0.00 H new ATOM 0 HB3 GLU A 77 11.084 4.332 -0.418 1.00 0.00 H new ATOM 0 HG2 GLU A 77 10.260 3.849 -2.682 1.00 0.00 H new ATOM 0 HG3 GLU A 77 9.608 5.470 -2.816 1.00 0.00 H new ATOM 1195 N TRP A 78 9.055 2.884 1.384 1.00 0.00 N ATOM 1196 CA TRP A 78 8.669 2.317 2.670 1.00 0.00 C ATOM 1197 C TRP A 78 9.837 1.754 3.489 1.00 0.00 C ATOM 1198 O TRP A 78 10.353 0.676 3.201 1.00 0.00 O ATOM 1199 CB TRP A 78 7.640 1.221 2.392 1.00 0.00 C ATOM 1200 CG TRP A 78 6.864 0.721 3.577 1.00 0.00 C ATOM 1201 CD1 TRP A 78 7.249 0.695 4.887 1.00 0.00 C ATOM 1202 CD2 TRP A 78 5.560 0.141 3.533 1.00 0.00 C ATOM 1203 NE1 TRP A 78 6.255 0.137 5.658 1.00 0.00 N ATOM 1204 CE2 TRP A 78 5.211 -0.211 4.848 1.00 0.00 C ATOM 1205 CE3 TRP A 78 4.651 -0.112 2.501 1.00 0.00 C ATOM 1206 CZ2 TRP A 78 3.993 -0.806 5.158 1.00 0.00 C ATOM 1207 CZ3 TRP A 78 3.442 -0.699 2.810 1.00 0.00 C ATOM 1208 CH2 TRP A 78 3.122 -1.041 4.129 1.00 0.00 C ATOM 0 H TRP A 78 9.274 2.188 0.671 1.00 0.00 H new ATOM 0 HA TRP A 78 8.260 3.120 3.283 1.00 0.00 H new ATOM 0 HB2 TRP A 78 6.932 1.596 1.653 1.00 0.00 H new ATOM 0 HB3 TRP A 78 8.156 0.374 1.939 1.00 0.00 H new ATOM 0 HD1 TRP A 78 8.194 1.059 5.262 1.00 0.00 H new ATOM 0 HE1 TRP A 78 6.292 0.005 6.669 1.00 0.00 H new ATOM 0 HE3 TRP A 78 4.891 0.148 1.481 1.00 0.00 H new ATOM 0 HZ2 TRP A 78 3.743 -1.073 6.174 1.00 0.00 H new ATOM 0 HZ3 TRP A 78 2.731 -0.898 2.022 1.00 0.00 H new ATOM 0 HH2 TRP A 78 2.167 -1.500 4.339 1.00 0.00 H new ATOM 1219 N ASP A 79 10.220 2.521 4.508 1.00 0.00 N ATOM 1220 CA ASP A 79 11.021 2.044 5.652 1.00 0.00 C ATOM 1221 C ASP A 79 12.381 1.464 5.271 1.00 0.00 C ATOM 1222 O ASP A 79 13.221 2.137 4.672 1.00 0.00 O ATOM 1223 CB ASP A 79 10.230 1.004 6.460 1.00 0.00 C ATOM 1224 CG ASP A 79 10.600 1.006 7.931 1.00 0.00 C ATOM 1225 OD1 ASP A 79 10.260 1.982 8.636 1.00 0.00 O ATOM 1226 OD2 ASP A 79 11.217 0.027 8.392 1.00 0.00 O ATOM 0 H ASP A 79 9.982 3.511 4.570 1.00 0.00 H new ATOM 0 HA ASP A 79 11.223 2.930 6.254 1.00 0.00 H new ATOM 0 HB2 ASP A 79 9.163 1.203 6.357 1.00 0.00 H new ATOM 0 HB3 ASP A 79 10.410 0.012 6.045 1.00 0.00 H new ATOM 1231 N THR A 80 12.587 0.220 5.676 1.00 0.00 N ATOM 1232 CA THR A 80 13.859 -0.468 5.536 1.00 0.00 C ATOM 1233 C THR A 80 14.032 -1.025 4.136 1.00 0.00 C ATOM 1234 O THR A 80 15.143 -1.331 3.702 1.00 0.00 O ATOM 1235 CB THR A 80 13.947 -1.613 6.558 1.00 0.00 C ATOM 1236 OG1 THR A 80 15.141 -2.379 6.364 1.00 0.00 O ATOM 1237 CG2 THR A 80 12.724 -2.508 6.441 1.00 0.00 C ATOM 0 H THR A 80 11.864 -0.347 6.118 1.00 0.00 H new ATOM 0 HA THR A 80 14.655 0.254 5.719 1.00 0.00 H new ATOM 0 HB THR A 80 13.979 -1.181 7.558 1.00 0.00 H new ATOM 0 HG1 THR A 80 15.260 -2.996 7.116 1.00 0.00 H new ATOM 0 HG21 THR A 80 12.794 -3.317 7.168 1.00 0.00 H new ATOM 0 HG22 THR A 80 11.825 -1.923 6.634 1.00 0.00 H new ATOM 0 HG23 THR A 80 12.675 -2.927 5.436 1.00 0.00 H new ATOM 1245 N GLU A 81 12.922 -1.183 3.459 1.00 0.00 N ATOM 1246 CA GLU A 81 12.913 -1.602 2.083 1.00 0.00 C ATOM 1247 C GLU A 81 12.789 -0.357 1.224 1.00 0.00 C ATOM 1248 O GLU A 81 12.608 0.739 1.745 1.00 0.00 O ATOM 1249 CB GLU A 81 11.772 -2.577 1.835 1.00 0.00 C ATOM 1250 CG GLU A 81 11.728 -3.682 2.869 1.00 0.00 C ATOM 1251 CD GLU A 81 10.723 -3.442 3.982 1.00 0.00 C ATOM 1252 OE1 GLU A 81 10.522 -2.276 4.368 1.00 0.00 O ATOM 1253 OE2 GLU A 81 10.138 -4.427 4.480 1.00 0.00 O ATOM 0 H GLU A 81 11.994 -1.023 3.851 1.00 0.00 H new ATOM 0 HA GLU A 81 13.834 -2.127 1.829 1.00 0.00 H new ATOM 0 HB2 GLU A 81 10.826 -2.036 1.844 1.00 0.00 H new ATOM 0 HB3 GLU A 81 11.880 -3.015 0.843 1.00 0.00 H new ATOM 0 HG2 GLU A 81 11.488 -4.622 2.372 1.00 0.00 H new ATOM 0 HG3 GLU A 81 12.720 -3.797 3.306 1.00 0.00 H new ATOM 1260 N GLY A 82 12.921 -0.493 -0.071 1.00 0.00 N ATOM 1261 CA GLY A 82 12.852 0.675 -0.909 1.00 0.00 C ATOM 1262 C GLY A 82 11.848 0.558 -2.029 1.00 0.00 C ATOM 1263 O GLY A 82 12.184 0.839 -3.179 1.00 0.00 O ATOM 0 H GLY A 82 13.073 -1.376 -0.558 1.00 0.00 H new ATOM 0 HA2 GLY A 82 12.598 1.538 -0.294 1.00 0.00 H new ATOM 0 HA3 GLY A 82 13.837 0.865 -1.334 1.00 0.00 H new ATOM 1267 N TRP A 83 10.612 0.133 -1.740 1.00 0.00 N ATOM 1268 CA TRP A 83 9.624 0.185 -2.795 1.00 0.00 C ATOM 1269 C TRP A 83 9.111 1.582 -2.859 1.00 0.00 C ATOM 1270 O TRP A 83 8.835 2.200 -1.824 1.00 0.00 O ATOM 1271 CB TRP A 83 8.339 -0.639 -2.676 1.00 0.00 C ATOM 1272 CG TRP A 83 8.316 -1.945 -1.940 1.00 0.00 C ATOM 1273 CD1 TRP A 83 8.195 -3.174 -2.514 1.00 0.00 C ATOM 1274 CD2 TRP A 83 8.304 -2.166 -0.523 1.00 0.00 C ATOM 1275 NE1 TRP A 83 8.128 -4.145 -1.553 1.00 0.00 N ATOM 1276 CE2 TRP A 83 8.203 -3.557 -0.324 1.00 0.00 C ATOM 1277 CE3 TRP A 83 8.384 -1.338 0.593 1.00 0.00 C ATOM 1278 CZ2 TRP A 83 8.176 -4.134 0.939 1.00 0.00 C ATOM 1279 CZ3 TRP A 83 8.356 -1.915 1.849 1.00 0.00 C ATOM 1280 CH2 TRP A 83 8.251 -3.301 2.009 1.00 0.00 C ATOM 0 H TRP A 83 10.296 -0.227 -0.840 1.00 0.00 H new ATOM 0 HA TRP A 83 10.179 -0.218 -3.642 1.00 0.00 H new ATOM 0 HB2 TRP A 83 7.592 0.003 -2.208 1.00 0.00 H new ATOM 0 HB3 TRP A 83 7.995 -0.840 -3.691 1.00 0.00 H new ATOM 0 HD1 TRP A 83 8.157 -3.356 -3.578 1.00 0.00 H new ATOM 0 HE1 TRP A 83 8.037 -5.146 -1.727 1.00 0.00 H new ATOM 0 HE3 TRP A 83 8.466 -0.267 0.480 1.00 0.00 H new ATOM 0 HZ2 TRP A 83 8.098 -5.204 1.065 1.00 0.00 H new ATOM 0 HZ3 TRP A 83 8.416 -1.284 2.723 1.00 0.00 H new ATOM 0 HH2 TRP A 83 8.229 -3.718 3.005 1.00 0.00 H new ATOM 1291 N VAL A 84 8.963 2.040 -4.064 1.00 0.00 N ATOM 1292 CA VAL A 84 8.160 3.205 -4.347 1.00 0.00 C ATOM 1293 C VAL A 84 6.720 2.724 -4.514 1.00 0.00 C ATOM 1294 O VAL A 84 6.225 2.601 -5.636 1.00 0.00 O ATOM 1295 CB VAL A 84 8.607 3.901 -5.647 1.00 0.00 C ATOM 1296 CG1 VAL A 84 7.917 5.250 -5.817 1.00 0.00 C ATOM 1297 CG2 VAL A 84 10.120 4.061 -5.698 1.00 0.00 C ATOM 0 H VAL A 84 9.395 1.619 -4.887 1.00 0.00 H new ATOM 0 HA VAL A 84 8.263 3.925 -3.535 1.00 0.00 H new ATOM 0 HB VAL A 84 8.308 3.261 -6.477 1.00 0.00 H new ATOM 0 HG11 VAL A 84 8.253 5.716 -6.743 1.00 0.00 H new ATOM 0 HG12 VAL A 84 6.837 5.104 -5.855 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.167 5.895 -4.975 1.00 0.00 H new ATOM 0 HG21 VAL A 84 10.402 4.555 -6.627 1.00 0.00 H new ATOM 0 HG22 VAL A 84 10.451 4.663 -4.852 1.00 0.00 H new ATOM 0 HG23 VAL A 84 10.591 3.079 -5.651 1.00 0.00 H new ATOM 1307 N VAL A 85 6.098 2.330 -3.410 1.00 0.00 N ATOM 1308 CA VAL A 85 4.748 1.814 -3.446 1.00 0.00 C ATOM 1309 C VAL A 85 3.779 2.905 -3.866 1.00 0.00 C ATOM 1310 O VAL A 85 3.808 4.021 -3.343 1.00 0.00 O ATOM 1311 CB VAL A 85 4.323 1.197 -2.091 1.00 0.00 C ATOM 1312 CG1 VAL A 85 5.150 -0.031 -1.778 1.00 0.00 C ATOM 1313 CG2 VAL A 85 4.459 2.193 -0.960 1.00 0.00 C ATOM 0 H VAL A 85 6.514 2.361 -2.479 1.00 0.00 H new ATOM 0 HA VAL A 85 4.723 1.012 -4.184 1.00 0.00 H new ATOM 0 HB VAL A 85 3.274 0.915 -2.182 1.00 0.00 H new ATOM 0 HG11 VAL A 85 4.834 -0.448 -0.822 1.00 0.00 H new ATOM 0 HG12 VAL A 85 5.009 -0.774 -2.562 1.00 0.00 H new ATOM 0 HG13 VAL A 85 6.203 0.244 -1.724 1.00 0.00 H new ATOM 0 HG21 VAL A 85 4.152 1.725 -0.024 1.00 0.00 H new ATOM 0 HG22 VAL A 85 5.498 2.515 -0.881 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.826 3.058 -1.158 1.00 0.00 H new ATOM 1323 N THR A 86 2.942 2.585 -4.830 1.00 0.00 N ATOM 1324 CA THR A 86 2.042 3.555 -5.395 1.00 0.00 C ATOM 1325 C THR A 86 0.599 3.058 -5.348 1.00 0.00 C ATOM 1326 O THR A 86 0.307 1.925 -5.686 1.00 0.00 O ATOM 1327 CB THR A 86 2.451 3.901 -6.846 1.00 0.00 C ATOM 1328 OG1 THR A 86 3.810 4.366 -6.859 1.00 0.00 O ATOM 1329 CG2 THR A 86 1.544 4.977 -7.440 1.00 0.00 C ATOM 0 H THR A 86 2.870 1.653 -5.238 1.00 0.00 H new ATOM 0 HA THR A 86 2.106 4.462 -4.794 1.00 0.00 H new ATOM 0 HB THR A 86 2.353 3.000 -7.451 1.00 0.00 H new ATOM 0 HG1 THR A 86 3.823 5.340 -6.756 1.00 0.00 H new ATOM 0 HG21 THR A 86 1.859 5.196 -8.460 1.00 0.00 H new ATOM 0 HG22 THR A 86 0.514 4.621 -7.447 1.00 0.00 H new ATOM 0 HG23 THR A 86 1.611 5.883 -6.837 1.00 0.00 H new ATOM 1337 N PHE A 87 -0.299 3.900 -4.895 1.00 0.00 N ATOM 1338 CA PHE A 87 -1.708 3.569 -4.922 1.00 0.00 C ATOM 1339 C PHE A 87 -2.382 4.476 -5.924 1.00 0.00 C ATOM 1340 O PHE A 87 -2.166 5.679 -5.909 1.00 0.00 O ATOM 1341 CB PHE A 87 -2.348 3.738 -3.531 1.00 0.00 C ATOM 1342 CG PHE A 87 -1.705 2.898 -2.459 1.00 0.00 C ATOM 1343 CD1 PHE A 87 -1.166 1.660 -2.756 1.00 0.00 C ATOM 1344 CD2 PHE A 87 -1.633 3.354 -1.157 1.00 0.00 C ATOM 1345 CE1 PHE A 87 -0.558 0.895 -1.780 1.00 0.00 C ATOM 1346 CE2 PHE A 87 -1.030 2.594 -0.175 1.00 0.00 C ATOM 1347 CZ PHE A 87 -0.487 1.361 -0.493 1.00 0.00 C ATOM 0 H PHE A 87 -0.083 4.817 -4.504 1.00 0.00 H new ATOM 0 HA PHE A 87 -1.832 2.525 -5.209 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -2.291 4.787 -3.240 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -3.406 3.482 -3.595 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -1.221 1.285 -3.767 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -2.053 4.316 -0.904 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -0.139 -0.069 -2.030 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -0.982 2.961 0.840 1.00 0.00 H new ATOM 0 HZ PHE A 87 -0.008 0.767 0.272 1.00 0.00 H new ATOM 1357 N GLN A 88 -3.177 3.920 -6.807 1.00 0.00 N ATOM 1358 CA GLN A 88 -3.861 4.739 -7.778 1.00 0.00 C ATOM 1359 C GLN A 88 -5.357 4.561 -7.673 1.00 0.00 C ATOM 1360 O GLN A 88 -5.887 3.451 -7.684 1.00 0.00 O ATOM 1361 CB GLN A 88 -3.345 4.455 -9.186 1.00 0.00 C ATOM 1362 CG GLN A 88 -2.103 5.256 -9.499 1.00 0.00 C ATOM 1363 CD GLN A 88 -1.718 5.207 -10.962 1.00 0.00 C ATOM 1364 OE1 GLN A 88 -2.006 4.233 -11.659 1.00 0.00 O ATOM 1365 NE2 GLN A 88 -1.051 6.247 -11.437 1.00 0.00 N ATOM 0 H GLN A 88 -3.364 2.920 -6.873 1.00 0.00 H new ATOM 0 HA GLN A 88 -3.647 5.786 -7.562 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -3.127 3.392 -9.286 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -4.122 4.691 -9.913 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -2.264 6.294 -9.206 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -1.275 4.880 -8.899 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -0.832 7.034 -10.827 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -0.756 6.261 -12.413 1.00 0.00 H new ATOM 1374 N LEU A 89 -6.020 5.686 -7.561 1.00 0.00 N ATOM 1375 CA LEU A 89 -7.440 5.723 -7.274 1.00 0.00 C ATOM 1376 C LEU A 89 -8.196 6.421 -8.392 1.00 0.00 C ATOM 1377 O LEU A 89 -7.714 7.404 -8.956 1.00 0.00 O ATOM 1378 CB LEU A 89 -7.684 6.409 -5.929 1.00 0.00 C ATOM 1379 CG LEU A 89 -9.035 6.117 -5.267 1.00 0.00 C ATOM 1380 CD1 LEU A 89 -10.118 7.020 -5.829 1.00 0.00 C ATOM 1381 CD2 LEU A 89 -9.421 4.658 -5.459 1.00 0.00 C ATOM 0 H LEU A 89 -5.592 6.606 -7.666 1.00 0.00 H new ATOM 0 HA LEU A 89 -7.814 4.701 -7.211 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -6.892 6.111 -5.242 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -7.595 7.486 -6.070 1.00 0.00 H new ATOM 0 HG LEU A 89 -8.937 6.317 -4.200 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -11.068 6.794 -5.344 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -9.855 8.062 -5.645 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -10.210 6.853 -6.902 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -10.383 4.470 -4.982 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -9.495 4.438 -6.524 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -8.662 4.018 -5.009 1.00 0.00 H new ATOM 1393 N GLU A 90 -9.358 5.897 -8.731 1.00 0.00 N ATOM 1394 CA GLU A 90 -10.192 6.506 -9.735 1.00 0.00 C ATOM 1395 C GLU A 90 -11.537 6.910 -9.148 1.00 0.00 C ATOM 1396 O GLU A 90 -12.129 6.165 -8.365 1.00 0.00 O ATOM 1397 CB GLU A 90 -10.424 5.545 -10.889 1.00 0.00 C ATOM 1398 CG GLU A 90 -11.316 6.141 -11.948 1.00 0.00 C ATOM 1399 CD GLU A 90 -10.632 7.252 -12.718 1.00 0.00 C ATOM 1400 OE1 GLU A 90 -10.386 8.326 -12.136 1.00 0.00 O ATOM 1401 OE2 GLU A 90 -10.312 7.043 -13.904 1.00 0.00 O ATOM 0 H GLU A 90 -9.743 5.046 -8.320 1.00 0.00 H new ATOM 0 HA GLU A 90 -9.677 7.395 -10.099 1.00 0.00 H new ATOM 0 HB2 GLU A 90 -9.466 5.273 -11.333 1.00 0.00 H new ATOM 0 HB3 GLU A 90 -10.873 4.626 -10.511 1.00 0.00 H new ATOM 0 HG2 GLU A 90 -11.626 5.359 -12.641 1.00 0.00 H new ATOM 0 HG3 GLU A 90 -12.221 6.530 -11.481 1.00 0.00 H new ATOM 1408 N ASP A 91 -12.019 8.074 -9.548 1.00 0.00 N ATOM 1409 CA ASP A 91 -13.326 8.544 -9.166 1.00 0.00 C ATOM 1410 C ASP A 91 -14.230 8.538 -10.393 1.00 0.00 C ATOM 1411 O ASP A 91 -14.038 9.322 -11.321 1.00 0.00 O ATOM 1412 CB ASP A 91 -13.249 9.950 -8.571 1.00 0.00 C ATOM 1413 CG ASP A 91 -12.432 10.941 -9.385 1.00 0.00 C ATOM 1414 OD1 ASP A 91 -11.191 10.814 -9.425 1.00 0.00 O ATOM 1415 OD2 ASP A 91 -13.027 11.886 -9.950 1.00 0.00 O ATOM 0 H ASP A 91 -11.506 8.718 -10.150 1.00 0.00 H new ATOM 0 HA ASP A 91 -13.735 7.883 -8.402 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -14.261 10.339 -8.460 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.822 9.883 -7.570 1.00 0.00 H new ATOM 1420 N LEU A 92 -15.205 7.645 -10.420 1.00 0.00 N ATOM 1421 CA LEU A 92 -16.057 7.513 -11.586 1.00 0.00 C ATOM 1422 C LEU A 92 -17.508 7.654 -11.194 1.00 0.00 C ATOM 1423 O LEU A 92 -18.090 6.715 -10.662 1.00 0.00 O ATOM 1424 CB LEU A 92 -15.828 6.142 -12.215 1.00 0.00 C ATOM 1425 CG LEU A 92 -14.445 5.902 -12.805 1.00 0.00 C ATOM 1426 CD1 LEU A 92 -14.403 4.551 -13.500 1.00 0.00 C ATOM 1427 CD2 LEU A 92 -14.068 7.014 -13.774 1.00 0.00 C ATOM 0 H LEU A 92 -15.424 7.007 -9.655 1.00 0.00 H new ATOM 0 HA LEU A 92 -15.811 8.298 -12.302 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -16.016 5.381 -11.458 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -16.568 5.997 -13.003 1.00 0.00 H new ATOM 0 HG LEU A 92 -13.718 5.903 -11.993 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -13.410 4.388 -13.919 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -14.627 3.764 -12.780 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -15.142 4.531 -14.301 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -13.076 6.820 -14.182 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -14.794 7.050 -14.586 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -14.064 7.969 -13.248 1.00 0.00 H new ATOM 1439 N GLY A 93 -18.103 8.805 -11.507 1.00 0.00 N ATOM 1440 CA GLY A 93 -19.429 9.093 -11.009 1.00 0.00 C ATOM 1441 C GLY A 93 -19.403 8.913 -9.522 1.00 0.00 C ATOM 1442 O GLY A 93 -18.819 9.726 -8.802 1.00 0.00 O ATOM 0 H GLY A 93 -17.691 9.533 -12.091 1.00 0.00 H new ATOM 0 HA2 GLY A 93 -19.722 10.111 -11.266 1.00 0.00 H new ATOM 0 HA3 GLY A 93 -20.162 8.426 -11.463 1.00 0.00 H new ATOM 1446 N GLU A 94 -20.010 7.848 -9.045 1.00 0.00 N ATOM 1447 CA GLU A 94 -19.527 7.278 -7.819 1.00 0.00 C ATOM 1448 C GLU A 94 -19.210 5.809 -7.980 1.00 0.00 C ATOM 1449 O GLU A 94 -20.064 4.974 -8.290 1.00 0.00 O ATOM 1450 CB GLU A 94 -20.504 7.410 -6.718 1.00 0.00 C ATOM 1451 CG GLU A 94 -20.004 6.778 -5.436 1.00 0.00 C ATOM 1452 CD GLU A 94 -20.935 7.019 -4.272 1.00 0.00 C ATOM 1453 OE1 GLU A 94 -20.853 8.102 -3.655 1.00 0.00 O ATOM 1454 OE2 GLU A 94 -21.762 6.135 -3.975 1.00 0.00 O ATOM 0 H GLU A 94 -20.808 7.378 -9.472 1.00 0.00 H new ATOM 0 HA GLU A 94 -18.623 7.835 -7.572 1.00 0.00 H new ATOM 0 HB2 GLU A 94 -20.713 8.465 -6.544 1.00 0.00 H new ATOM 0 HB3 GLU A 94 -21.444 6.942 -7.010 1.00 0.00 H new ATOM 0 HG2 GLU A 94 -19.885 5.705 -5.586 1.00 0.00 H new ATOM 0 HG3 GLU A 94 -19.018 7.178 -5.198 1.00 0.00 H new ATOM 1461 N LYS A 95 -17.965 5.560 -7.781 1.00 0.00 N ATOM 1462 CA LYS A 95 -17.370 4.287 -7.512 1.00 0.00 C ATOM 1463 C LYS A 95 -15.912 4.621 -7.373 1.00 0.00 C ATOM 1464 O LYS A 95 -15.501 5.701 -7.812 1.00 0.00 O ATOM 1465 CB LYS A 95 -17.596 3.264 -8.618 1.00 0.00 C ATOM 1466 CG LYS A 95 -17.179 3.770 -9.969 1.00 0.00 C ATOM 1467 CD LYS A 95 -16.626 2.659 -10.843 1.00 0.00 C ATOM 1468 CE LYS A 95 -15.249 2.233 -10.370 1.00 0.00 C ATOM 1469 NZ LYS A 95 -14.633 1.240 -11.296 1.00 0.00 N ATOM 0 H LYS A 95 -17.269 6.305 -7.803 1.00 0.00 H new ATOM 0 HA LYS A 95 -17.806 3.815 -6.631 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -17.039 2.356 -8.387 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -18.651 2.992 -8.646 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -18.034 4.230 -10.464 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -16.424 4.547 -9.849 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -17.302 1.804 -10.823 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -16.571 2.998 -11.878 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -14.604 3.108 -10.292 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -15.324 1.802 -9.371 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -13.700 0.959 -10.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -15.245 0.402 -11.364 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -14.523 1.666 -12.239 1.00 0.00 H new ATOM 1483 N THR A 96 -15.122 3.773 -6.803 1.00 0.00 N ATOM 1484 CA THR A 96 -13.723 3.990 -6.877 1.00 0.00 C ATOM 1485 C THR A 96 -13.066 2.867 -7.646 1.00 0.00 C ATOM 1486 O THR A 96 -13.239 1.694 -7.331 1.00 0.00 O ATOM 1487 CB THR A 96 -13.158 4.099 -5.466 1.00 0.00 C ATOM 1488 OG1 THR A 96 -14.035 3.456 -4.539 1.00 0.00 O ATOM 1489 CG2 THR A 96 -12.981 5.554 -5.089 1.00 0.00 C ATOM 0 H THR A 96 -15.416 2.941 -6.292 1.00 0.00 H new ATOM 0 HA THR A 96 -13.518 4.920 -7.407 1.00 0.00 H new ATOM 0 HB THR A 96 -12.186 3.606 -5.434 1.00 0.00 H new ATOM 0 HG1 THR A 96 -14.437 2.668 -4.961 1.00 0.00 H new ATOM 0 HG21 THR A 96 -12.577 5.622 -4.079 1.00 0.00 H new ATOM 0 HG22 THR A 96 -12.293 6.030 -5.788 1.00 0.00 H new ATOM 0 HG23 THR A 96 -13.946 6.060 -5.128 1.00 0.00 H new ATOM 1497 N GLY A 97 -12.321 3.222 -8.669 1.00 0.00 N ATOM 1498 CA GLY A 97 -11.600 2.218 -9.402 1.00 0.00 C ATOM 1499 C GLY A 97 -10.197 2.144 -8.908 1.00 0.00 C ATOM 1500 O GLY A 97 -9.441 3.103 -9.023 1.00 0.00 O ATOM 0 H GLY A 97 -12.202 4.178 -9.003 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -12.088 1.250 -9.287 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -11.609 2.455 -10.466 1.00 0.00 H new ATOM 1504 N PHE A 98 -9.834 1.021 -8.341 1.00 0.00 N ATOM 1505 CA PHE A 98 -8.569 0.957 -7.667 1.00 0.00 C ATOM 1506 C PHE A 98 -7.536 0.248 -8.497 1.00 0.00 C ATOM 1507 O PHE A 98 -7.748 -0.864 -8.986 1.00 0.00 O ATOM 1508 CB PHE A 98 -8.644 0.268 -6.313 1.00 0.00 C ATOM 1509 CG PHE A 98 -7.483 0.682 -5.450 1.00 0.00 C ATOM 1510 CD1 PHE A 98 -7.443 1.955 -4.901 1.00 0.00 C ATOM 1511 CD2 PHE A 98 -6.418 -0.168 -5.223 1.00 0.00 C ATOM 1512 CE1 PHE A 98 -6.367 2.367 -4.141 1.00 0.00 C ATOM 1513 CE2 PHE A 98 -5.344 0.240 -4.457 1.00 0.00 C ATOM 1514 CZ PHE A 98 -5.315 1.506 -3.919 1.00 0.00 C ATOM 0 H PHE A 98 -10.382 0.161 -8.333 1.00 0.00 H new ATOM 0 HA PHE A 98 -8.281 1.997 -7.511 1.00 0.00 H new ATOM 0 HB2 PHE A 98 -9.582 0.523 -5.819 1.00 0.00 H new ATOM 0 HB3 PHE A 98 -8.638 -0.814 -6.447 1.00 0.00 H new ATOM 0 HD1 PHE A 98 -8.266 2.634 -5.071 1.00 0.00 H new ATOM 0 HD2 PHE A 98 -6.425 -1.161 -5.648 1.00 0.00 H new ATOM 0 HE1 PHE A 98 -6.350 3.362 -3.721 1.00 0.00 H new ATOM 0 HE2 PHE A 98 -4.522 -0.438 -4.279 1.00 0.00 H new ATOM 0 HZ PHE A 98 -4.471 1.823 -3.325 1.00 0.00 H new ATOM 1524 N THR A 99 -6.425 0.912 -8.658 1.00 0.00 N ATOM 1525 CA THR A 99 -5.266 0.314 -9.253 1.00 0.00 C ATOM 1526 C THR A 99 -4.135 0.445 -8.267 1.00 0.00 C ATOM 1527 O THR A 99 -3.717 1.549 -7.946 1.00 0.00 O ATOM 1528 CB THR A 99 -4.898 1.000 -10.580 1.00 0.00 C ATOM 1529 OG1 THR A 99 -6.054 1.066 -11.424 1.00 0.00 O ATOM 1530 CG2 THR A 99 -3.788 0.242 -11.290 1.00 0.00 C ATOM 0 H THR A 99 -6.299 1.885 -8.379 1.00 0.00 H new ATOM 0 HA THR A 99 -5.466 -0.733 -9.481 1.00 0.00 H new ATOM 0 HB THR A 99 -4.544 2.008 -10.363 1.00 0.00 H new ATOM 0 HG1 THR A 99 -5.818 1.505 -12.268 1.00 0.00 H new ATOM 0 HG21 THR A 99 -3.544 0.745 -12.226 1.00 0.00 H new ATOM 0 HG22 THR A 99 -2.904 0.211 -10.654 1.00 0.00 H new ATOM 0 HG23 THR A 99 -4.119 -0.775 -11.501 1.00 0.00 H new ATOM 1538 N LEU A 100 -3.643 -0.655 -7.759 1.00 0.00 N ATOM 1539 CA LEU A 100 -2.589 -0.560 -6.799 1.00 0.00 C ATOM 1540 C LEU A 100 -1.290 -0.986 -7.409 1.00 0.00 C ATOM 1541 O LEU A 100 -1.214 -1.977 -8.122 1.00 0.00 O ATOM 1542 CB LEU A 100 -2.875 -1.377 -5.546 1.00 0.00 C ATOM 1543 CG LEU A 100 -2.099 -0.909 -4.321 1.00 0.00 C ATOM 1544 CD1 LEU A 100 -2.761 -1.383 -3.060 1.00 0.00 C ATOM 1545 CD2 LEU A 100 -0.666 -1.381 -4.370 1.00 0.00 C ATOM 0 H LEU A 100 -3.949 -1.600 -7.989 1.00 0.00 H new ATOM 0 HA LEU A 100 -2.521 0.485 -6.497 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -3.942 -1.331 -5.329 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -2.634 -2.422 -5.741 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.098 0.181 -4.325 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -2.191 -1.038 -2.198 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.774 -0.984 -3.009 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -2.800 -2.472 -3.057 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -0.137 -1.032 -3.483 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.643 -2.470 -4.401 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.182 -0.982 -5.261 1.00 0.00 H new ATOM 1557 N ILE A 101 -0.276 -0.220 -7.122 1.00 0.00 N ATOM 1558 CA ILE A 101 1.039 -0.495 -7.600 1.00 0.00 C ATOM 1559 C ILE A 101 1.967 -0.711 -6.407 1.00 0.00 C ATOM 1560 O ILE A 101 2.078 0.137 -5.532 1.00 0.00 O ATOM 1561 CB ILE A 101 1.582 0.701 -8.424 1.00 0.00 C ATOM 1562 CG1 ILE A 101 0.488 1.333 -9.326 1.00 0.00 C ATOM 1563 CG2 ILE A 101 2.781 0.267 -9.263 1.00 0.00 C ATOM 1564 CD1 ILE A 101 -0.401 2.338 -8.628 1.00 0.00 C ATOM 0 H ILE A 101 -0.345 0.618 -6.545 1.00 0.00 H new ATOM 0 HA ILE A 101 1.000 -1.383 -8.231 1.00 0.00 H new ATOM 0 HB ILE A 101 1.900 1.467 -7.716 1.00 0.00 H new ATOM 0 HG12 ILE A 101 0.971 1.821 -10.172 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -0.135 0.536 -9.731 1.00 0.00 H new ATOM 0 HG21 ILE A 101 3.151 1.117 -9.836 1.00 0.00 H new ATOM 0 HG22 ILE A 101 3.570 -0.100 -8.607 1.00 0.00 H new ATOM 0 HG23 ILE A 101 2.479 -0.527 -9.946 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -1.135 2.727 -9.334 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -0.917 1.854 -7.799 1.00 0.00 H new ATOM 0 HD13 ILE A 101 0.207 3.159 -8.247 1.00 0.00 H new ATOM 1576 N HIS A 102 2.630 -1.828 -6.347 1.00 0.00 N ATOM 1577 CA HIS A 102 3.734 -1.950 -5.433 1.00 0.00 C ATOM 1578 C HIS A 102 4.943 -2.165 -6.286 1.00 0.00 C ATOM 1579 O HIS A 102 5.154 -3.231 -6.855 1.00 0.00 O ATOM 1580 CB HIS A 102 3.527 -3.099 -4.434 1.00 0.00 C ATOM 1581 CG HIS A 102 2.946 -2.663 -3.115 1.00 0.00 C ATOM 1582 ND1 HIS A 102 3.201 -3.335 -1.933 1.00 0.00 N ATOM 1583 CD2 HIS A 102 2.152 -1.602 -2.776 1.00 0.00 C ATOM 1584 CE1 HIS A 102 2.609 -2.709 -0.933 1.00 0.00 C ATOM 1585 NE2 HIS A 102 1.968 -1.658 -1.415 1.00 0.00 N ATOM 0 H HIS A 102 2.433 -2.657 -6.908 1.00 0.00 H new ATOM 0 HA HIS A 102 3.838 -1.056 -4.817 1.00 0.00 H new ATOM 0 HB2 HIS A 102 2.868 -3.843 -4.882 1.00 0.00 H new ATOM 0 HB3 HIS A 102 4.484 -3.588 -4.254 1.00 0.00 H new ATOM 0 HD1 HIS A 102 3.760 -4.184 -1.847 1.00 0.00 H new ATOM 0 HD2 HIS A 102 1.747 -0.861 -3.449 1.00 0.00 H new ATOM 0 HE1 HIS A 102 2.643 -3.006 0.105 1.00 0.00 H new ATOM 1594 N SER A 103 5.725 -1.131 -6.354 1.00 0.00 N ATOM 1595 CA SER A 103 6.840 -1.068 -7.243 1.00 0.00 C ATOM 1596 C SER A 103 7.914 -0.273 -6.575 1.00 0.00 C ATOM 1597 O SER A 103 7.644 0.410 -5.602 1.00 0.00 O ATOM 1598 CB SER A 103 6.432 -0.397 -8.553 1.00 0.00 C ATOM 1599 OG SER A 103 5.499 -1.185 -9.266 1.00 0.00 O ATOM 0 H SER A 103 5.603 -0.295 -5.783 1.00 0.00 H new ATOM 0 HA SER A 103 7.197 -2.072 -7.473 1.00 0.00 H new ATOM 0 HB2 SER A 103 6.000 0.581 -8.343 1.00 0.00 H new ATOM 0 HB3 SER A 103 7.316 -0.230 -9.169 1.00 0.00 H new ATOM 0 HG SER A 103 5.376 -0.814 -10.165 1.00 0.00 H new ATOM 1605 N GLY A 104 9.103 -0.355 -7.093 1.00 0.00 N ATOM 1606 CA GLY A 104 10.188 0.445 -6.594 1.00 0.00 C ATOM 1607 C GLY A 104 11.318 0.419 -7.593 1.00 0.00 C ATOM 1608 O GLY A 104 11.231 -0.307 -8.586 1.00 0.00 O ATOM 0 H GLY A 104 9.350 -0.972 -7.867 1.00 0.00 H new ATOM 0 HA2 GLY A 104 9.855 1.470 -6.429 1.00 0.00 H new ATOM 0 HA3 GLY A 104 10.527 0.061 -5.632 1.00 0.00 H new ATOM 1612 N TRP A 105 12.355 1.202 -7.375 1.00 0.00 N ATOM 1613 CA TRP A 105 13.422 1.298 -8.365 1.00 0.00 C ATOM 1614 C TRP A 105 14.356 0.089 -8.284 1.00 0.00 C ATOM 1615 O TRP A 105 14.764 -0.302 -7.192 1.00 0.00 O ATOM 1616 CB TRP A 105 14.208 2.594 -8.168 1.00 0.00 C ATOM 1617 CG TRP A 105 15.061 2.942 -9.345 1.00 0.00 C ATOM 1618 CD1 TRP A 105 16.395 2.709 -9.490 1.00 0.00 C ATOM 1619 CD2 TRP A 105 14.630 3.581 -10.553 1.00 0.00 C ATOM 1620 NE1 TRP A 105 16.823 3.163 -10.713 1.00 0.00 N ATOM 1621 CE2 TRP A 105 15.758 3.705 -11.383 1.00 0.00 C ATOM 1622 CE3 TRP A 105 13.400 4.058 -11.011 1.00 0.00 C ATOM 1623 CZ2 TRP A 105 15.692 4.290 -12.645 1.00 0.00 C ATOM 1624 CZ3 TRP A 105 13.336 4.637 -12.263 1.00 0.00 C ATOM 1625 CH2 TRP A 105 14.476 4.749 -13.067 1.00 0.00 C ATOM 0 H TRP A 105 12.486 1.773 -6.540 1.00 0.00 H new ATOM 0 HA TRP A 105 12.969 1.307 -9.356 1.00 0.00 H new ATOM 0 HB2 TRP A 105 13.511 3.410 -7.977 1.00 0.00 H new ATOM 0 HB3 TRP A 105 14.839 2.500 -7.284 1.00 0.00 H new ATOM 0 HD1 TRP A 105 17.024 2.236 -8.751 1.00 0.00 H new ATOM 0 HE1 TRP A 105 17.778 3.106 -11.065 1.00 0.00 H new ATOM 0 HE3 TRP A 105 12.515 3.976 -10.397 1.00 0.00 H new ATOM 0 HZ2 TRP A 105 16.570 4.378 -13.268 1.00 0.00 H new ATOM 0 HZ3 TRP A 105 12.390 5.010 -12.628 1.00 0.00 H new ATOM 0 HH2 TRP A 105 14.393 5.208 -14.041 1.00 0.00 H new ATOM 1636 N LYS A 106 14.671 -0.490 -9.458 1.00 0.00 N ATOM 1637 CA LYS A 106 15.557 -1.659 -9.578 1.00 0.00 C ATOM 1638 C LYS A 106 14.833 -2.941 -9.143 1.00 0.00 C ATOM 1639 O LYS A 106 14.372 -3.045 -8.015 1.00 0.00 O ATOM 1640 CB LYS A 106 16.843 -1.453 -8.760 1.00 0.00 C ATOM 1641 CG LYS A 106 17.953 -2.448 -9.065 1.00 0.00 C ATOM 1642 CD LYS A 106 18.487 -2.273 -10.478 1.00 0.00 C ATOM 1643 CE LYS A 106 19.725 -3.124 -10.721 1.00 0.00 C ATOM 1644 NZ LYS A 106 19.473 -4.564 -10.443 1.00 0.00 N ATOM 0 H LYS A 106 14.315 -0.157 -10.354 1.00 0.00 H new ATOM 0 HA LYS A 106 15.835 -1.768 -10.626 1.00 0.00 H new ATOM 0 HB2 LYS A 106 17.216 -0.445 -8.942 1.00 0.00 H new ATOM 0 HB3 LYS A 106 16.598 -1.516 -7.700 1.00 0.00 H new ATOM 0 HG2 LYS A 106 18.765 -2.319 -8.350 1.00 0.00 H new ATOM 0 HG3 LYS A 106 17.577 -3.463 -8.940 1.00 0.00 H new ATOM 0 HD2 LYS A 106 17.713 -2.544 -11.196 1.00 0.00 H new ATOM 0 HD3 LYS A 106 18.727 -1.224 -10.649 1.00 0.00 H new ATOM 0 HE2 LYS A 106 20.050 -3.005 -11.755 1.00 0.00 H new ATOM 0 HE3 LYS A 106 20.539 -2.769 -10.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 106 20.247 -5.135 -10.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 106 19.422 -4.715 -9.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 106 18.574 -4.850 -10.880 1.00 0.00 H new ATOM 1658 N GLU A 107 14.737 -3.917 -10.048 1.00 0.00 N ATOM 1659 CA GLU A 107 13.976 -5.144 -9.781 1.00 0.00 C ATOM 1660 C GLU A 107 14.734 -6.419 -10.196 1.00 0.00 C ATOM 1661 O GLU A 107 14.515 -6.959 -11.280 1.00 0.00 O ATOM 1662 CB GLU A 107 12.608 -5.081 -10.489 1.00 0.00 C ATOM 1663 CG GLU A 107 12.558 -4.158 -11.708 1.00 0.00 C ATOM 1664 CD GLU A 107 13.461 -4.598 -12.845 1.00 0.00 C ATOM 1665 OE1 GLU A 107 14.651 -4.209 -12.853 1.00 0.00 O ATOM 1666 OE2 GLU A 107 12.984 -5.322 -13.745 1.00 0.00 O ATOM 0 H GLU A 107 15.174 -3.884 -10.969 1.00 0.00 H new ATOM 0 HA GLU A 107 13.830 -5.202 -8.702 1.00 0.00 H new ATOM 0 HB2 GLU A 107 12.330 -6.088 -10.801 1.00 0.00 H new ATOM 0 HB3 GLU A 107 11.858 -4.751 -9.770 1.00 0.00 H new ATOM 0 HG2 GLU A 107 11.531 -4.106 -12.071 1.00 0.00 H new ATOM 0 HG3 GLU A 107 12.840 -3.151 -11.401 1.00 0.00 H new ATOM 1673 N PRO A 108 15.632 -6.924 -9.331 1.00 0.00 N ATOM 1674 CA PRO A 108 16.409 -8.130 -9.583 1.00 0.00 C ATOM 1675 C PRO A 108 15.809 -9.394 -8.940 1.00 0.00 C ATOM 1676 O PRO A 108 14.807 -9.926 -9.424 1.00 0.00 O ATOM 1677 CB PRO A 108 17.759 -7.788 -8.943 1.00 0.00 C ATOM 1678 CG PRO A 108 17.474 -6.700 -7.940 1.00 0.00 C ATOM 1679 CD PRO A 108 16.005 -6.348 -8.049 1.00 0.00 C ATOM 0 HA PRO A 108 16.454 -8.372 -10.645 1.00 0.00 H new ATOM 0 HB2 PRO A 108 18.195 -8.662 -8.459 1.00 0.00 H new ATOM 0 HB3 PRO A 108 18.473 -7.450 -9.694 1.00 0.00 H new ATOM 0 HG2 PRO A 108 17.713 -7.037 -6.931 1.00 0.00 H new ATOM 0 HG3 PRO A 108 18.093 -5.825 -8.138 1.00 0.00 H new ATOM 0 HD2 PRO A 108 15.425 -6.773 -7.230 1.00 0.00 H new ATOM 0 HD3 PRO A 108 15.844 -5.270 -8.027 1.00 0.00 H new ATOM 1687 N ASN A 109 16.422 -9.862 -7.847 1.00 0.00 N ATOM 1688 CA ASN A 109 16.005 -11.108 -7.196 1.00 0.00 C ATOM 1689 C ASN A 109 15.930 -10.954 -5.671 1.00 0.00 C ATOM 1690 O ASN A 109 15.010 -11.458 -5.038 1.00 0.00 O ATOM 1691 CB ASN A 109 16.959 -12.254 -7.572 1.00 0.00 C ATOM 1692 CG ASN A 109 18.396 -12.023 -7.126 1.00 0.00 C ATOM 1693 OD1 ASN A 109 18.865 -10.887 -7.041 1.00 0.00 O ATOM 1694 ND2 ASN A 109 19.107 -13.102 -6.842 1.00 0.00 N ATOM 0 H ASN A 109 17.209 -9.396 -7.395 1.00 0.00 H new ATOM 0 HA ASN A 109 15.003 -11.348 -7.553 1.00 0.00 H new ATOM 0 HB2 ASN A 109 16.594 -13.180 -7.127 1.00 0.00 H new ATOM 0 HB3 ASN A 109 16.941 -12.391 -8.653 1.00 0.00 H new ATOM 0 HD21 ASN A 109 20.077 -13.009 -6.541 1.00 0.00 H new ATOM 0 HD22 ASN A 109 18.685 -14.027 -6.924 1.00 0.00 H new ATOM 1701 N GLN A 110 16.919 -10.284 -5.090 1.00 0.00 N ATOM 1702 CA GLN A 110 16.907 -9.912 -3.670 1.00 0.00 C ATOM 1703 C GLN A 110 15.819 -8.870 -3.432 1.00 0.00 C ATOM 1704 O GLN A 110 15.448 -8.191 -4.372 1.00 0.00 O ATOM 1705 CB GLN A 110 18.265 -9.354 -3.250 1.00 0.00 C ATOM 1706 CG GLN A 110 18.345 -9.042 -1.768 1.00 0.00 C ATOM 1707 CD GLN A 110 19.617 -8.308 -1.388 1.00 0.00 C ATOM 1708 OE1 GLN A 110 20.686 -8.557 -2.127 1.00 0.00 O flip ATOM 1709 NE2 GLN A 110 19.637 -7.525 -0.437 1.00 0.00 N flip ATOM 0 H GLN A 110 17.756 -9.980 -5.587 1.00 0.00 H new ATOM 0 HA GLN A 110 16.702 -10.800 -3.072 1.00 0.00 H new ATOM 0 HB2 GLN A 110 19.042 -10.074 -3.507 1.00 0.00 H new ATOM 0 HB3 GLN A 110 18.470 -8.447 -3.818 1.00 0.00 H new ATOM 0 HG2 GLN A 110 17.484 -8.438 -1.482 1.00 0.00 H new ATOM 0 HG3 GLN A 110 18.285 -9.972 -1.202 1.00 0.00 H new ATOM 0 HE21 GLN A 110 18.790 -7.362 0.107 1.00 0.00 H new ATOM 0 HE22 GLN A 110 20.501 -7.040 -0.194 1.00 0.00 H new ATOM 1718 N VAL A 111 15.314 -8.714 -2.197 1.00 0.00 N ATOM 1719 CA VAL A 111 14.169 -7.839 -1.981 1.00 0.00 C ATOM 1720 C VAL A 111 14.553 -6.401 -1.918 1.00 0.00 C ATOM 1721 O VAL A 111 15.715 -6.002 -1.994 1.00 0.00 O ATOM 1722 CB VAL A 111 13.404 -7.982 -0.632 1.00 0.00 C ATOM 1723 CG1 VAL A 111 12.464 -9.152 -0.536 1.00 0.00 C ATOM 1724 CG2 VAL A 111 14.346 -7.913 0.557 1.00 0.00 C ATOM 0 H VAL A 111 15.674 -9.172 -1.360 1.00 0.00 H new ATOM 0 HA VAL A 111 13.554 -8.143 -2.828 1.00 0.00 H new ATOM 0 HB VAL A 111 12.745 -7.114 -0.606 1.00 0.00 H new ATOM 0 HG11 VAL A 111 11.986 -9.155 0.443 1.00 0.00 H new ATOM 0 HG12 VAL A 111 11.702 -9.071 -1.312 1.00 0.00 H new ATOM 0 HG13 VAL A 111 13.022 -10.079 -0.670 1.00 0.00 H new ATOM 0 HG21 VAL A 111 13.775 -8.017 1.480 1.00 0.00 H new ATOM 0 HG22 VAL A 111 15.076 -8.719 0.490 1.00 0.00 H new ATOM 0 HG23 VAL A 111 14.863 -6.954 0.556 1.00 0.00 H new ATOM 1734 N ILE A 112 13.503 -5.667 -1.709 1.00 0.00 N ATOM 1735 CA ILE A 112 13.517 -4.248 -1.567 1.00 0.00 C ATOM 1736 C ILE A 112 14.500 -3.818 -0.481 1.00 0.00 C ATOM 1737 O ILE A 112 15.291 -2.899 -0.671 1.00 0.00 O ATOM 1738 CB ILE A 112 12.118 -3.817 -1.141 1.00 0.00 C ATOM 1739 CG1 ILE A 112 11.096 -4.928 -1.367 1.00 0.00 C ATOM 1740 CG2 ILE A 112 11.701 -2.600 -1.900 1.00 0.00 C ATOM 1741 CD1 ILE A 112 10.774 -5.218 -2.820 1.00 0.00 C ATOM 0 H ILE A 112 12.567 -6.065 -1.629 1.00 0.00 H new ATOM 0 HA ILE A 112 13.817 -3.792 -2.510 1.00 0.00 H new ATOM 0 HB ILE A 112 12.153 -3.594 -0.075 1.00 0.00 H new ATOM 0 HG12 ILE A 112 11.467 -5.842 -0.904 1.00 0.00 H new ATOM 0 HG13 ILE A 112 10.173 -4.662 -0.852 1.00 0.00 H new ATOM 0 HG21 ILE A 112 10.700 -2.301 -1.587 1.00 0.00 H new ATOM 0 HG22 ILE A 112 12.401 -1.789 -1.700 1.00 0.00 H new ATOM 0 HG23 ILE A 112 11.697 -2.821 -2.967 1.00 0.00 H new ATOM 0 HD11 ILE A 112 10.039 -6.021 -2.877 1.00 0.00 H new ATOM 0 HD12 ILE A 112 10.368 -4.321 -3.289 1.00 0.00 H new ATOM 0 HD13 ILE A 112 11.683 -5.520 -3.341 1.00 0.00 H new ATOM 1753 N GLY A 113 14.448 -4.519 0.643 1.00 0.00 N ATOM 1754 CA GLY A 113 15.320 -4.231 1.763 1.00 0.00 C ATOM 1755 C GLY A 113 15.240 -5.325 2.806 1.00 0.00 C ATOM 1756 O GLY A 113 16.021 -6.267 2.784 1.00 0.00 O ATOM 0 H GLY A 113 13.805 -5.295 0.800 1.00 0.00 H new ATOM 0 HA2 GLY A 113 16.347 -4.132 1.413 1.00 0.00 H new ATOM 0 HA3 GLY A 113 15.042 -3.276 2.210 1.00 0.00 H new ATOM 1760 N LYS A 114 14.270 -5.207 3.699 1.00 0.00 N ATOM 1761 CA LYS A 114 13.991 -6.241 4.693 1.00 0.00 C ATOM 1762 C LYS A 114 12.597 -6.813 4.433 1.00 0.00 C ATOM 1763 O LYS A 114 11.954 -7.376 5.315 1.00 0.00 O ATOM 1764 CB LYS A 114 14.069 -5.641 6.101 1.00 0.00 C ATOM 1765 CG LYS A 114 14.003 -6.660 7.231 1.00 0.00 C ATOM 1766 CD LYS A 114 13.827 -5.973 8.576 1.00 0.00 C ATOM 1767 CE LYS A 114 12.518 -5.200 8.631 1.00 0.00 C ATOM 1768 NZ LYS A 114 12.435 -4.319 9.826 1.00 0.00 N ATOM 0 H LYS A 114 13.654 -4.396 3.758 1.00 0.00 H new ATOM 0 HA LYS A 114 14.729 -7.040 4.618 1.00 0.00 H new ATOM 0 HB2 LYS A 114 14.998 -5.079 6.191 1.00 0.00 H new ATOM 0 HB3 LYS A 114 13.253 -4.929 6.224 1.00 0.00 H new ATOM 0 HG2 LYS A 114 13.174 -7.346 7.058 1.00 0.00 H new ATOM 0 HG3 LYS A 114 14.915 -7.257 7.240 1.00 0.00 H new ATOM 0 HD2 LYS A 114 13.847 -6.717 9.373 1.00 0.00 H new ATOM 0 HD3 LYS A 114 14.661 -5.294 8.753 1.00 0.00 H new ATOM 0 HE2 LYS A 114 12.416 -4.596 7.729 1.00 0.00 H new ATOM 0 HE3 LYS A 114 11.684 -5.902 8.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 11.527 -3.812 9.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 12.505 -4.896 10.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 13.215 -3.631 9.805 1.00 0.00 H new ATOM 1782 N ALA A 115 12.147 -6.659 3.191 1.00 0.00 N ATOM 1783 CA ALA A 115 10.792 -7.029 2.790 1.00 0.00 C ATOM 1784 C ALA A 115 10.552 -8.530 2.936 1.00 0.00 C ATOM 1785 O ALA A 115 9.410 -8.976 3.040 1.00 0.00 O ATOM 1786 CB ALA A 115 10.539 -6.571 1.365 1.00 0.00 C ATOM 0 H ALA A 115 12.711 -6.274 2.433 1.00 0.00 H new ATOM 0 HA ALA A 115 10.087 -6.529 3.454 1.00 0.00 H new ATOM 0 HB1 ALA A 115 9.528 -6.848 1.068 1.00 0.00 H new ATOM 0 HB2 ALA A 115 10.651 -5.488 1.305 1.00 0.00 H new ATOM 0 HB3 ALA A 115 11.257 -7.047 0.697 1.00 0.00 H new ATOM 1792 N ASN A 116 11.646 -9.288 2.932 1.00 0.00 N ATOM 1793 CA ASN A 116 11.625 -10.735 3.147 1.00 0.00 C ATOM 1794 C ASN A 116 13.006 -11.285 2.841 1.00 0.00 C ATOM 1795 O ASN A 116 13.795 -11.561 3.740 1.00 0.00 O ATOM 1796 CB ASN A 116 10.597 -11.445 2.249 1.00 0.00 C ATOM 1797 CG ASN A 116 10.232 -12.841 2.739 1.00 0.00 C ATOM 1798 OD1 ASN A 116 9.150 -13.344 2.438 1.00 0.00 O ATOM 1799 ND2 ASN A 116 11.115 -13.471 3.501 1.00 0.00 N ATOM 0 H ASN A 116 12.582 -8.912 2.778 1.00 0.00 H new ATOM 0 HA ASN A 116 11.340 -10.919 4.183 1.00 0.00 H new ATOM 0 HB2 ASN A 116 9.693 -10.839 2.194 1.00 0.00 H new ATOM 0 HB3 ASN A 116 10.996 -11.515 1.237 1.00 0.00 H new ATOM 0 HD21 ASN A 116 10.907 -14.404 3.858 1.00 0.00 H new ATOM 0 HD22 ASN A 116 12.002 -13.023 3.730 1.00 0.00 H new ATOM 1806 N GLU A 117 13.282 -11.422 1.554 1.00 0.00 N ATOM 1807 CA GLU A 117 14.572 -11.880 1.072 1.00 0.00 C ATOM 1808 C GLU A 117 14.631 -11.705 -0.439 1.00 0.00 C ATOM 1809 O GLU A 117 15.543 -11.074 -0.966 1.00 0.00 O ATOM 1810 CB GLU A 117 14.797 -13.349 1.433 1.00 0.00 C ATOM 1811 CG GLU A 117 16.215 -13.822 1.167 1.00 0.00 C ATOM 1812 CD GLU A 117 16.391 -15.305 1.403 1.00 0.00 C ATOM 1813 OE1 GLU A 117 16.005 -15.791 2.487 1.00 0.00 O ATOM 1814 OE2 GLU A 117 16.935 -15.988 0.512 1.00 0.00 O ATOM 0 H GLU A 117 12.613 -11.217 0.812 1.00 0.00 H new ATOM 0 HA GLU A 117 15.356 -11.289 1.545 1.00 0.00 H new ATOM 0 HB2 GLU A 117 14.564 -13.497 2.487 1.00 0.00 H new ATOM 0 HB3 GLU A 117 14.102 -13.966 0.863 1.00 0.00 H new ATOM 0 HG2 GLU A 117 16.484 -13.588 0.137 1.00 0.00 H new ATOM 0 HG3 GLU A 117 16.903 -13.272 1.809 1.00 0.00 H new ATOM 1821 N LYS A 118 13.660 -12.298 -1.127 1.00 0.00 N ATOM 1822 CA LYS A 118 13.534 -12.172 -2.577 1.00 0.00 C ATOM 1823 C LYS A 118 12.570 -11.049 -2.980 1.00 0.00 C ATOM 1824 O LYS A 118 11.426 -11.025 -2.524 1.00 0.00 O ATOM 1825 CB LYS A 118 13.010 -13.459 -3.162 1.00 0.00 C ATOM 1826 CG LYS A 118 13.634 -14.716 -2.584 1.00 0.00 C ATOM 1827 CD LYS A 118 15.108 -14.863 -2.913 1.00 0.00 C ATOM 1828 CE LYS A 118 15.625 -16.204 -2.416 1.00 0.00 C ATOM 1829 NZ LYS A 118 17.107 -16.306 -2.478 1.00 0.00 N ATOM 0 H LYS A 118 12.940 -12.878 -0.697 1.00 0.00 H new ATOM 0 HA LYS A 118 14.528 -11.940 -2.959 1.00 0.00 H new ATOM 0 HB2 LYS A 118 11.932 -13.500 -3.008 1.00 0.00 H new ATOM 0 HB3 LYS A 118 13.178 -13.448 -4.239 1.00 0.00 H new ATOM 0 HG2 LYS A 118 13.510 -14.709 -1.501 1.00 0.00 H new ATOM 0 HG3 LYS A 118 13.097 -15.586 -2.961 1.00 0.00 H new ATOM 0 HD2 LYS A 118 15.258 -14.784 -3.990 1.00 0.00 H new ATOM 0 HD3 LYS A 118 15.674 -14.053 -2.452 1.00 0.00 H new ATOM 0 HE2 LYS A 118 15.297 -16.357 -1.388 1.00 0.00 H new ATOM 0 HE3 LYS A 118 15.185 -17.003 -3.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 17.375 -17.228 -2.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 17.482 -15.545 -3.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 17.502 -16.216 -1.520 1.00 0.00 H new ATOM 1843 N SER A 119 13.007 -10.137 -3.843 1.00 0.00 N ATOM 1844 CA SER A 119 12.089 -9.177 -4.458 1.00 0.00 C ATOM 1845 C SER A 119 11.020 -9.956 -5.238 1.00 0.00 C ATOM 1846 O SER A 119 9.884 -9.527 -5.384 1.00 0.00 O ATOM 1847 CB SER A 119 12.816 -8.165 -5.364 1.00 0.00 C ATOM 1848 OG SER A 119 13.406 -8.804 -6.481 1.00 0.00 O ATOM 0 H SER A 119 13.980 -10.040 -4.132 1.00 0.00 H new ATOM 0 HA SER A 119 11.620 -8.587 -3.671 1.00 0.00 H new ATOM 0 HB2 SER A 119 12.110 -7.408 -5.706 1.00 0.00 H new ATOM 0 HB3 SER A 119 13.585 -7.648 -4.791 1.00 0.00 H new ATOM 0 HG SER A 119 13.719 -8.128 -7.117 1.00 0.00 H new ATOM 1854 N SER A 120 11.403 -11.098 -5.778 1.00 0.00 N ATOM 1855 CA SER A 120 10.458 -11.958 -6.466 1.00 0.00 C ATOM 1856 C SER A 120 9.364 -12.486 -5.518 1.00 0.00 C ATOM 1857 O SER A 120 8.186 -12.512 -5.881 1.00 0.00 O ATOM 1858 CB SER A 120 11.208 -13.114 -7.124 1.00 0.00 C ATOM 1859 OG SER A 120 12.151 -13.676 -6.227 1.00 0.00 O ATOM 0 H SER A 120 12.360 -11.451 -5.754 1.00 0.00 H new ATOM 0 HA SER A 120 9.955 -11.368 -7.232 1.00 0.00 H new ATOM 0 HB2 SER A 120 10.500 -13.879 -7.441 1.00 0.00 H new ATOM 0 HB3 SER A 120 11.718 -12.760 -8.020 1.00 0.00 H new ATOM 0 HG SER A 120 12.620 -14.416 -6.666 1.00 0.00 H new ATOM 1865 N VAL A 121 9.739 -12.887 -4.301 1.00 0.00 N ATOM 1866 CA VAL A 121 8.761 -13.447 -3.361 1.00 0.00 C ATOM 1867 C VAL A 121 7.844 -12.365 -2.831 1.00 0.00 C ATOM 1868 O VAL A 121 6.666 -12.606 -2.584 1.00 0.00 O ATOM 1869 CB VAL A 121 9.376 -14.240 -2.181 1.00 0.00 C ATOM 1870 CG1 VAL A 121 10.258 -15.367 -2.687 1.00 0.00 C ATOM 1871 CG2 VAL A 121 10.132 -13.337 -1.221 1.00 0.00 C ATOM 0 H VAL A 121 10.694 -12.837 -3.946 1.00 0.00 H new ATOM 0 HA VAL A 121 8.193 -14.171 -3.945 1.00 0.00 H new ATOM 0 HB VAL A 121 8.551 -14.680 -1.620 1.00 0.00 H new ATOM 0 HG11 VAL A 121 10.678 -15.909 -1.840 1.00 0.00 H new ATOM 0 HG12 VAL A 121 9.664 -16.049 -3.295 1.00 0.00 H new ATOM 0 HG13 VAL A 121 11.066 -14.954 -3.290 1.00 0.00 H new ATOM 0 HG21 VAL A 121 10.546 -13.935 -0.409 1.00 0.00 H new ATOM 0 HG22 VAL A 121 10.941 -12.837 -1.753 1.00 0.00 H new ATOM 0 HG23 VAL A 121 9.451 -12.591 -0.811 1.00 0.00 H new ATOM 1881 N VAL A 122 8.385 -11.170 -2.642 1.00 0.00 N ATOM 1882 CA VAL A 122 7.587 -10.059 -2.175 1.00 0.00 C ATOM 1883 C VAL A 122 6.551 -9.701 -3.248 1.00 0.00 C ATOM 1884 O VAL A 122 5.415 -9.316 -2.951 1.00 0.00 O ATOM 1885 CB VAL A 122 8.483 -8.872 -1.808 1.00 0.00 C ATOM 1886 CG1 VAL A 122 9.111 -8.285 -3.038 1.00 0.00 C ATOM 1887 CG2 VAL A 122 7.735 -7.823 -1.017 1.00 0.00 C ATOM 0 H VAL A 122 9.368 -10.951 -2.805 1.00 0.00 H new ATOM 0 HA VAL A 122 7.052 -10.337 -1.267 1.00 0.00 H new ATOM 0 HB VAL A 122 9.279 -9.245 -1.163 1.00 0.00 H new ATOM 0 HG11 VAL A 122 9.744 -7.443 -2.757 1.00 0.00 H new ATOM 0 HG12 VAL A 122 9.716 -9.043 -3.535 1.00 0.00 H new ATOM 0 HG13 VAL A 122 8.330 -7.941 -3.717 1.00 0.00 H new ATOM 0 HG21 VAL A 122 8.408 -6.999 -0.778 1.00 0.00 H new ATOM 0 HG22 VAL A 122 6.899 -7.449 -1.608 1.00 0.00 H new ATOM 0 HG23 VAL A 122 7.358 -8.263 -0.094 1.00 0.00 H new ATOM 1897 N ARG A 123 6.958 -9.876 -4.501 1.00 0.00 N ATOM 1898 CA ARG A 123 6.066 -9.744 -5.643 1.00 0.00 C ATOM 1899 C ARG A 123 4.975 -10.808 -5.531 1.00 0.00 C ATOM 1900 O ARG A 123 3.814 -10.576 -5.868 1.00 0.00 O ATOM 1901 CB ARG A 123 6.898 -9.909 -6.932 1.00 0.00 C ATOM 1902 CG ARG A 123 6.177 -9.593 -8.236 1.00 0.00 C ATOM 1903 CD ARG A 123 5.401 -10.785 -8.775 1.00 0.00 C ATOM 1904 NE ARG A 123 4.711 -10.456 -10.019 1.00 0.00 N ATOM 1905 CZ ARG A 123 3.561 -11.001 -10.400 1.00 0.00 C ATOM 1906 NH1 ARG A 123 3.023 -11.979 -9.687 1.00 0.00 N ATOM 1907 NH2 ARG A 123 2.967 -10.578 -11.509 1.00 0.00 N ATOM 0 H ARG A 123 7.918 -10.114 -4.752 1.00 0.00 H new ATOM 0 HA ARG A 123 5.586 -8.766 -5.668 1.00 0.00 H new ATOM 0 HB2 ARG A 123 7.775 -9.266 -6.860 1.00 0.00 H new ATOM 0 HB3 ARG A 123 7.259 -10.936 -6.979 1.00 0.00 H new ATOM 0 HG2 ARG A 123 5.493 -8.760 -8.077 1.00 0.00 H new ATOM 0 HG3 ARG A 123 6.904 -9.270 -8.981 1.00 0.00 H new ATOM 0 HD2 ARG A 123 6.083 -11.618 -8.945 1.00 0.00 H new ATOM 0 HD3 ARG A 123 4.675 -11.115 -8.031 1.00 0.00 H new ATOM 0 HE ARG A 123 5.139 -9.764 -10.634 1.00 0.00 H new ATOM 0 HH11 ARG A 123 3.492 -12.314 -8.845 1.00 0.00 H new ATOM 0 HH12 ARG A 123 2.140 -12.397 -9.980 1.00 0.00 H new ATOM 0 HH21 ARG A 123 3.394 -9.837 -12.065 1.00 0.00 H new ATOM 0 HH22 ARG A 123 2.084 -10.994 -11.805 1.00 0.00 H new ATOM 1921 N GLY A 124 5.357 -11.956 -4.987 1.00 0.00 N ATOM 1922 CA GLY A 124 4.414 -13.040 -4.759 1.00 0.00 C ATOM 1923 C GLY A 124 3.462 -12.742 -3.609 1.00 0.00 C ATOM 1924 O GLY A 124 2.302 -13.180 -3.611 1.00 0.00 O ATOM 0 H GLY A 124 6.313 -12.159 -4.696 1.00 0.00 H new ATOM 0 HA2 GLY A 124 3.839 -13.216 -5.668 1.00 0.00 H new ATOM 0 HA3 GLY A 124 4.962 -13.958 -4.546 1.00 0.00 H new ATOM 1928 N LYS A 125 3.938 -11.961 -2.641 1.00 0.00 N ATOM 1929 CA LYS A 125 3.126 -11.555 -1.505 1.00 0.00 C ATOM 1930 C LYS A 125 1.945 -10.778 -2.000 1.00 0.00 C ATOM 1931 O LYS A 125 0.809 -10.967 -1.572 1.00 0.00 O ATOM 1932 CB LYS A 125 3.934 -10.643 -0.595 1.00 0.00 C ATOM 1933 CG LYS A 125 5.187 -11.301 -0.065 1.00 0.00 C ATOM 1934 CD LYS A 125 5.966 -10.353 0.834 1.00 0.00 C ATOM 1935 CE LYS A 125 7.044 -11.074 1.624 1.00 0.00 C ATOM 1936 NZ LYS A 125 6.471 -12.027 2.615 1.00 0.00 N ATOM 0 H LYS A 125 4.890 -11.596 -2.625 1.00 0.00 H new ATOM 0 HA LYS A 125 2.807 -12.444 -0.961 1.00 0.00 H new ATOM 0 HB2 LYS A 125 4.207 -9.741 -1.143 1.00 0.00 H new ATOM 0 HB3 LYS A 125 3.311 -10.330 0.243 1.00 0.00 H new ATOM 0 HG2 LYS A 125 4.922 -12.199 0.492 1.00 0.00 H new ATOM 0 HG3 LYS A 125 5.816 -11.616 -0.898 1.00 0.00 H new ATOM 0 HD2 LYS A 125 6.423 -9.571 0.227 1.00 0.00 H new ATOM 0 HD3 LYS A 125 5.280 -9.861 1.523 1.00 0.00 H new ATOM 0 HE2 LYS A 125 7.696 -11.614 0.937 1.00 0.00 H new ATOM 0 HE3 LYS A 125 7.664 -10.342 2.142 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 7.239 -12.446 3.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 5.817 -11.521 3.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 5.957 -12.780 2.115 1.00 0.00 H new ATOM 1950 N MET A 126 2.243 -9.919 -2.940 1.00 0.00 N ATOM 1951 CA MET A 126 1.246 -9.084 -3.545 1.00 0.00 C ATOM 1952 C MET A 126 0.476 -9.898 -4.571 1.00 0.00 C ATOM 1953 O MET A 126 -0.681 -9.618 -4.877 1.00 0.00 O ATOM 1954 CB MET A 126 1.927 -7.883 -4.194 1.00 0.00 C ATOM 1955 CG MET A 126 2.985 -7.226 -3.310 1.00 0.00 C ATOM 1956 SD MET A 126 2.303 -6.183 -1.999 1.00 0.00 S ATOM 1957 CE MET A 126 1.789 -7.395 -0.781 1.00 0.00 C ATOM 0 H MET A 126 3.185 -9.781 -3.306 1.00 0.00 H new ATOM 0 HA MET A 126 0.545 -8.719 -2.795 1.00 0.00 H new ATOM 0 HB2 MET A 126 2.392 -8.201 -5.127 1.00 0.00 H new ATOM 0 HB3 MET A 126 1.170 -7.142 -4.451 1.00 0.00 H new ATOM 0 HG2 MET A 126 3.600 -8.004 -2.858 1.00 0.00 H new ATOM 0 HG3 MET A 126 3.643 -6.622 -3.935 1.00 0.00 H new ATOM 0 HE1 MET A 126 1.877 -6.967 0.218 1.00 0.00 H new ATOM 0 HE2 MET A 126 0.753 -7.679 -0.965 1.00 0.00 H new ATOM 0 HE3 MET A 126 2.425 -8.277 -0.855 1.00 0.00 H new ATOM 1967 N ASP A 127 1.088 -10.980 -5.020 1.00 0.00 N ATOM 1968 CA ASP A 127 0.524 -11.757 -6.118 1.00 0.00 C ATOM 1969 C ASP A 127 -0.649 -12.615 -5.646 1.00 0.00 C ATOM 1970 O ASP A 127 -1.464 -13.066 -6.447 1.00 0.00 O ATOM 1971 CB ASP A 127 1.620 -12.633 -6.727 1.00 0.00 C ATOM 1972 CG ASP A 127 1.103 -13.634 -7.740 1.00 0.00 C ATOM 1973 OD1 ASP A 127 0.777 -13.225 -8.874 1.00 0.00 O ATOM 1974 OD2 ASP A 127 1.049 -14.840 -7.416 1.00 0.00 O ATOM 0 H ASP A 127 1.967 -11.341 -4.648 1.00 0.00 H new ATOM 0 HA ASP A 127 0.142 -11.071 -6.874 1.00 0.00 H new ATOM 0 HB2 ASP A 127 2.361 -11.993 -7.206 1.00 0.00 H new ATOM 0 HB3 ASP A 127 2.132 -13.169 -5.927 1.00 0.00 H new ATOM 1979 N GLY A 128 -0.774 -12.781 -4.341 1.00 0.00 N ATOM 1980 CA GLY A 128 -1.974 -13.409 -3.802 1.00 0.00 C ATOM 1981 C GLY A 128 -2.623 -12.581 -2.707 1.00 0.00 C ATOM 1982 O GLY A 128 -3.825 -12.245 -2.754 1.00 0.00 O ATOM 0 H GLY A 128 -0.081 -12.499 -3.648 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -2.691 -13.566 -4.608 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -1.719 -14.392 -3.407 1.00 0.00 H new ATOM 1986 N GLY A 129 -1.816 -12.216 -1.728 1.00 0.00 N ATOM 1987 CA GLY A 129 -2.329 -11.533 -0.572 1.00 0.00 C ATOM 1988 C GLY A 129 -2.832 -10.146 -0.888 1.00 0.00 C ATOM 1989 O GLY A 129 -3.662 -9.612 -0.159 1.00 0.00 O ATOM 0 H GLY A 129 -0.810 -12.383 -1.717 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -3.140 -12.119 -0.140 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -1.546 -11.467 0.183 1.00 0.00 H new ATOM 1993 N TRP A 130 -2.369 -9.562 -1.990 1.00 0.00 N ATOM 1994 CA TRP A 130 -2.674 -8.174 -2.257 1.00 0.00 C ATOM 1995 C TRP A 130 -4.125 -7.986 -2.689 1.00 0.00 C ATOM 1996 O TRP A 130 -4.709 -6.945 -2.426 1.00 0.00 O ATOM 1997 CB TRP A 130 -1.721 -7.630 -3.297 1.00 0.00 C ATOM 1998 CG TRP A 130 -1.329 -6.209 -3.093 1.00 0.00 C ATOM 1999 CD1 TRP A 130 -0.982 -5.337 -4.069 1.00 0.00 C ATOM 2000 CD2 TRP A 130 -1.228 -5.493 -1.851 1.00 0.00 C ATOM 2001 NE1 TRP A 130 -0.678 -4.126 -3.528 1.00 0.00 N ATOM 2002 CE2 TRP A 130 -0.827 -4.187 -2.168 1.00 0.00 C ATOM 2003 CE3 TRP A 130 -1.444 -5.820 -0.509 1.00 0.00 C ATOM 2004 CZ2 TRP A 130 -0.636 -3.203 -1.200 1.00 0.00 C ATOM 2005 CZ3 TRP A 130 -1.253 -4.845 0.455 1.00 0.00 C ATOM 2006 CH2 TRP A 130 -0.856 -3.549 0.104 1.00 0.00 C ATOM 0 H TRP A 130 -1.794 -10.023 -2.695 1.00 0.00 H new ATOM 0 HA TRP A 130 -2.545 -7.613 -1.332 1.00 0.00 H new ATOM 0 HB2 TRP A 130 -0.821 -8.245 -3.303 1.00 0.00 H new ATOM 0 HB3 TRP A 130 -2.181 -7.729 -4.280 1.00 0.00 H new ATOM 0 HD1 TRP A 130 -0.951 -5.569 -5.123 1.00 0.00 H new ATOM 0 HE1 TRP A 130 -0.385 -3.302 -4.053 1.00 0.00 H new ATOM 0 HE3 TRP A 130 -1.754 -6.816 -0.229 1.00 0.00 H new ATOM 0 HZ2 TRP A 130 -0.326 -2.204 -1.470 1.00 0.00 H new ATOM 0 HZ3 TRP A 130 -1.413 -5.088 1.495 1.00 0.00 H new ATOM 0 HH2 TRP A 130 -0.721 -2.808 0.878 1.00 0.00 H new ATOM 2017 N THR A 131 -4.724 -8.970 -3.353 1.00 0.00 N ATOM 2018 CA THR A 131 -6.149 -8.892 -3.601 1.00 0.00 C ATOM 2019 C THR A 131 -6.915 -9.172 -2.329 1.00 0.00 C ATOM 2020 O THR A 131 -7.917 -8.540 -2.059 1.00 0.00 O ATOM 2021 CB THR A 131 -6.648 -9.841 -4.692 1.00 0.00 C ATOM 2022 OG1 THR A 131 -5.909 -11.071 -4.652 1.00 0.00 O ATOM 2023 CG2 THR A 131 -6.541 -9.198 -6.068 1.00 0.00 C ATOM 0 H THR A 131 -4.259 -9.802 -3.716 1.00 0.00 H new ATOM 0 HA THR A 131 -6.327 -7.877 -3.955 1.00 0.00 H new ATOM 0 HB THR A 131 -7.700 -10.056 -4.504 1.00 0.00 H new ATOM 0 HG1 THR A 131 -6.237 -11.672 -5.353 1.00 0.00 H new ATOM 0 HG21 THR A 131 -6.902 -9.895 -6.824 1.00 0.00 H new ATOM 0 HG22 THR A 131 -7.144 -8.290 -6.093 1.00 0.00 H new ATOM 0 HG23 THR A 131 -5.500 -8.948 -6.273 1.00 0.00 H new ATOM 2031 N GLY A 132 -6.457 -10.115 -1.536 1.00 0.00 N ATOM 2032 CA GLY A 132 -7.096 -10.300 -0.257 1.00 0.00 C ATOM 2033 C GLY A 132 -7.164 -8.987 0.497 1.00 0.00 C ATOM 2034 O GLY A 132 -8.241 -8.510 0.862 1.00 0.00 O ATOM 0 H GLY A 132 -5.678 -10.740 -1.742 1.00 0.00 H new ATOM 0 HA2 GLY A 132 -8.101 -10.697 -0.400 1.00 0.00 H new ATOM 0 HA3 GLY A 132 -6.544 -11.035 0.329 1.00 0.00 H new ATOM 2038 N ILE A 133 -6.019 -8.351 0.630 1.00 0.00 N ATOM 2039 CA ILE A 133 -5.917 -7.125 1.391 1.00 0.00 C ATOM 2040 C ILE A 133 -6.544 -5.931 0.665 1.00 0.00 C ATOM 2041 O ILE A 133 -7.426 -5.273 1.193 1.00 0.00 O ATOM 2042 CB ILE A 133 -4.435 -6.817 1.631 1.00 0.00 C ATOM 2043 CG1 ILE A 133 -3.767 -7.962 2.397 1.00 0.00 C ATOM 2044 CG2 ILE A 133 -4.273 -5.503 2.369 1.00 0.00 C ATOM 2045 CD1 ILE A 133 -2.258 -7.856 2.466 1.00 0.00 C ATOM 0 H ILE A 133 -5.141 -8.666 0.218 1.00 0.00 H new ATOM 0 HA ILE A 133 -6.457 -7.272 2.326 1.00 0.00 H new ATOM 0 HB ILE A 133 -3.942 -6.722 0.664 1.00 0.00 H new ATOM 0 HG12 ILE A 133 -4.166 -7.989 3.411 1.00 0.00 H new ATOM 0 HG13 ILE A 133 -4.034 -8.907 1.924 1.00 0.00 H new ATOM 0 HG21 ILE A 133 -3.213 -5.304 2.529 1.00 0.00 H new ATOM 0 HG22 ILE A 133 -4.708 -4.698 1.778 1.00 0.00 H new ATOM 0 HG23 ILE A 133 -4.781 -5.561 3.332 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -1.859 -8.703 3.024 1.00 0.00 H new ATOM 0 HD12 ILE A 133 -1.846 -7.860 1.457 1.00 0.00 H new ATOM 0 HD13 ILE A 133 -1.981 -6.928 2.967 1.00 0.00 H new ATOM 2057 N VAL A 134 -6.115 -5.662 -0.553 1.00 0.00 N ATOM 2058 CA VAL A 134 -6.617 -4.509 -1.280 1.00 0.00 C ATOM 2059 C VAL A 134 -7.921 -4.807 -1.994 1.00 0.00 C ATOM 2060 O VAL A 134 -8.867 -4.038 -1.914 1.00 0.00 O ATOM 2061 CB VAL A 134 -5.581 -4.006 -2.294 1.00 0.00 C ATOM 2062 CG1 VAL A 134 -6.008 -2.683 -2.874 1.00 0.00 C ATOM 2063 CG2 VAL A 134 -4.230 -3.862 -1.642 1.00 0.00 C ATOM 0 H VAL A 134 -5.426 -6.220 -1.058 1.00 0.00 H new ATOM 0 HA VAL A 134 -6.806 -3.732 -0.539 1.00 0.00 H new ATOM 0 HB VAL A 134 -5.510 -4.739 -3.098 1.00 0.00 H new ATOM 0 HG11 VAL A 134 -5.261 -2.342 -3.591 1.00 0.00 H new ATOM 0 HG12 VAL A 134 -6.968 -2.799 -3.377 1.00 0.00 H new ATOM 0 HG13 VAL A 134 -6.105 -1.949 -2.074 1.00 0.00 H new ATOM 0 HG21 VAL A 134 -3.508 -3.504 -2.376 1.00 0.00 H new ATOM 0 HG22 VAL A 134 -4.297 -3.148 -0.821 1.00 0.00 H new ATOM 0 HG23 VAL A 134 -3.907 -4.829 -1.257 1.00 0.00 H new ATOM 2073 N ASN A 135 -8.011 -5.948 -2.644 1.00 0.00 N ATOM 2074 CA ASN A 135 -9.197 -6.225 -3.432 1.00 0.00 C ATOM 2075 C ASN A 135 -10.352 -6.456 -2.495 1.00 0.00 C ATOM 2076 O ASN A 135 -11.454 -5.952 -2.708 1.00 0.00 O ATOM 2077 CB ASN A 135 -8.991 -7.442 -4.347 1.00 0.00 C ATOM 2078 CG ASN A 135 -10.253 -7.889 -5.069 1.00 0.00 C ATOM 2079 OD1 ASN A 135 -10.563 -7.417 -6.159 1.00 0.00 O ATOM 2080 ND2 ASN A 135 -10.964 -8.841 -4.483 1.00 0.00 N ATOM 0 H ASN A 135 -7.301 -6.680 -2.646 1.00 0.00 H new ATOM 0 HA ASN A 135 -9.405 -5.371 -4.077 1.00 0.00 H new ATOM 0 HB2 ASN A 135 -8.226 -7.204 -5.086 1.00 0.00 H new ATOM 0 HB3 ASN A 135 -8.611 -8.272 -3.752 1.00 0.00 H new ATOM 0 HD21 ASN A 135 -11.800 -9.206 -4.938 1.00 0.00 H new ATOM 0 HD22 ASN A 135 -10.675 -9.209 -3.577 1.00 0.00 H new ATOM 2087 N GLU A 136 -10.100 -7.153 -1.401 1.00 0.00 N ATOM 2088 CA GLU A 136 -11.182 -7.464 -0.539 1.00 0.00 C ATOM 2089 C GLU A 136 -11.298 -6.468 0.612 1.00 0.00 C ATOM 2090 O GLU A 136 -12.376 -5.941 0.842 1.00 0.00 O ATOM 2091 CB GLU A 136 -11.033 -8.911 -0.080 1.00 0.00 C ATOM 2092 CG GLU A 136 -11.655 -9.194 1.272 1.00 0.00 C ATOM 2093 CD GLU A 136 -11.792 -10.672 1.548 1.00 0.00 C ATOM 2094 OE1 GLU A 136 -12.621 -11.324 0.879 1.00 0.00 O ATOM 2095 OE2 GLU A 136 -11.069 -11.191 2.423 1.00 0.00 O ATOM 0 H GLU A 136 -9.184 -7.496 -1.111 1.00 0.00 H new ATOM 0 HA GLU A 136 -12.126 -7.372 -1.077 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -11.489 -9.566 -0.823 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -9.973 -9.162 -0.041 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -11.045 -8.737 2.052 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -12.638 -8.726 1.321 1.00 0.00 H new ATOM 2102 N ARG A 137 -10.192 -6.120 1.264 1.00 0.00 N ATOM 2103 CA ARG A 137 -10.252 -5.210 2.411 1.00 0.00 C ATOM 2104 C ARG A 137 -10.308 -3.759 1.999 1.00 0.00 C ATOM 2105 O ARG A 137 -10.930 -2.974 2.677 1.00 0.00 O ATOM 2106 CB ARG A 137 -9.124 -5.448 3.413 1.00 0.00 C ATOM 2107 CG ARG A 137 -8.814 -4.261 4.345 1.00 0.00 C ATOM 2108 CD ARG A 137 -10.015 -3.804 5.183 1.00 0.00 C ATOM 2109 NE ARG A 137 -10.417 -4.763 6.209 1.00 0.00 N ATOM 2110 CZ ARG A 137 -11.440 -4.561 7.043 1.00 0.00 C ATOM 2111 NH1 ARG A 137 -12.187 -3.466 6.934 1.00 0.00 N ATOM 2112 NH2 ARG A 137 -11.723 -5.451 7.979 1.00 0.00 N ATOM 0 H ARG A 137 -9.256 -6.447 1.025 1.00 0.00 H new ATOM 0 HA ARG A 137 -11.190 -5.443 2.916 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -9.380 -6.313 4.025 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -8.218 -5.703 2.863 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -8.000 -4.539 5.014 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -8.461 -3.422 3.745 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -9.773 -2.855 5.661 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -10.860 -3.620 4.520 1.00 0.00 H new ATOM 0 HE ARG A 137 -9.889 -5.632 6.293 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -11.979 -2.777 6.211 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -12.968 -3.315 7.573 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -11.159 -6.296 8.066 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -12.505 -5.292 8.614 1.00 0.00 H new ATOM 2126 N LEU A 138 -9.678 -3.367 0.919 1.00 0.00 N ATOM 2127 CA LEU A 138 -9.751 -1.973 0.547 1.00 0.00 C ATOM 2128 C LEU A 138 -11.184 -1.656 0.216 1.00 0.00 C ATOM 2129 O LEU A 138 -11.695 -0.629 0.633 1.00 0.00 O ATOM 2130 CB LEU A 138 -8.804 -1.651 -0.593 1.00 0.00 C ATOM 2131 CG LEU A 138 -8.668 -0.182 -0.949 1.00 0.00 C ATOM 2132 CD1 LEU A 138 -8.400 0.671 0.274 1.00 0.00 C ATOM 2133 CD2 LEU A 138 -7.553 -0.016 -1.937 1.00 0.00 C ATOM 0 H LEU A 138 -9.129 -3.965 0.302 1.00 0.00 H new ATOM 0 HA LEU A 138 -9.429 -1.344 1.376 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -7.816 -2.036 -0.339 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -9.138 -2.190 -1.480 1.00 0.00 H new ATOM 0 HG LEU A 138 -9.611 0.152 -1.383 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -8.309 1.716 -0.024 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -9.224 0.565 0.979 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -7.473 0.347 0.748 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -7.451 1.038 -2.197 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -6.622 -0.374 -1.498 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -7.775 -0.591 -2.836 1.00 0.00 H new ATOM 2145 N ARG A 139 -11.855 -2.582 -0.467 1.00 0.00 N ATOM 2146 CA ARG A 139 -13.294 -2.463 -0.655 1.00 0.00 C ATOM 2147 C ARG A 139 -13.993 -2.579 0.696 1.00 0.00 C ATOM 2148 O ARG A 139 -15.057 -2.008 0.898 1.00 0.00 O ATOM 2149 CB ARG A 139 -13.824 -3.516 -1.648 1.00 0.00 C ATOM 2150 CG ARG A 139 -15.162 -3.153 -2.317 1.00 0.00 C ATOM 2151 CD ARG A 139 -16.367 -3.331 -1.390 1.00 0.00 C ATOM 2152 NE ARG A 139 -16.479 -4.696 -0.869 1.00 0.00 N ATOM 2153 CZ ARG A 139 -17.636 -5.332 -0.659 1.00 0.00 C ATOM 2154 NH1 ARG A 139 -18.789 -4.785 -1.032 1.00 0.00 N ATOM 2155 NH2 ARG A 139 -17.630 -6.535 -0.102 1.00 0.00 N ATOM 0 H ARG A 139 -11.432 -3.408 -0.891 1.00 0.00 H new ATOM 0 HA ARG A 139 -13.510 -1.485 -1.086 1.00 0.00 H new ATOM 0 HB2 ARG A 139 -13.076 -3.672 -2.425 1.00 0.00 H new ATOM 0 HB3 ARG A 139 -13.941 -4.464 -1.123 1.00 0.00 H new ATOM 0 HG2 ARG A 139 -15.122 -2.118 -2.656 1.00 0.00 H new ATOM 0 HG3 ARG A 139 -15.298 -3.774 -3.203 1.00 0.00 H new ATOM 0 HD2 ARG A 139 -16.286 -2.633 -0.557 1.00 0.00 H new ATOM 0 HD3 ARG A 139 -17.278 -3.077 -1.931 1.00 0.00 H new ATOM 0 HE ARG A 139 -15.616 -5.195 -0.652 1.00 0.00 H new ATOM 0 HH11 ARG A 139 -18.797 -3.871 -1.484 1.00 0.00 H new ATOM 0 HH12 ARG A 139 -19.665 -5.280 -0.866 1.00 0.00 H new ATOM 0 HH21 ARG A 139 -16.746 -6.970 0.163 1.00 0.00 H new ATOM 0 HH22 ARG A 139 -18.509 -7.026 0.061 1.00 0.00 H new ATOM 2169 N LYS A 140 -13.407 -3.321 1.631 1.00 0.00 N ATOM 2170 CA LYS A 140 -14.006 -3.445 2.943 1.00 0.00 C ATOM 2171 C LYS A 140 -13.882 -2.173 3.793 1.00 0.00 C ATOM 2172 O LYS A 140 -14.839 -1.734 4.398 1.00 0.00 O ATOM 2173 CB LYS A 140 -13.427 -4.629 3.709 1.00 0.00 C ATOM 2174 CG LYS A 140 -13.851 -5.972 3.157 1.00 0.00 C ATOM 2175 CD LYS A 140 -13.580 -7.090 4.131 1.00 0.00 C ATOM 2176 CE LYS A 140 -12.098 -7.424 4.211 1.00 0.00 C ATOM 2177 NZ LYS A 140 -11.843 -8.596 5.091 1.00 0.00 N ATOM 0 H LYS A 140 -12.535 -3.834 1.503 1.00 0.00 H new ATOM 0 HA LYS A 140 -15.068 -3.612 2.761 1.00 0.00 H new ATOM 0 HB2 LYS A 140 -12.339 -4.565 3.692 1.00 0.00 H new ATOM 0 HB3 LYS A 140 -13.734 -4.561 4.753 1.00 0.00 H new ATOM 0 HG2 LYS A 140 -14.914 -5.947 2.919 1.00 0.00 H new ATOM 0 HG3 LYS A 140 -13.320 -6.166 2.225 1.00 0.00 H new ATOM 0 HD2 LYS A 140 -13.942 -6.807 5.119 1.00 0.00 H new ATOM 0 HD3 LYS A 140 -14.137 -7.977 3.830 1.00 0.00 H new ATOM 0 HE2 LYS A 140 -11.717 -7.631 3.211 1.00 0.00 H new ATOM 0 HE3 LYS A 140 -11.550 -6.560 4.588 1.00 0.00 H new ATOM 0 HZ1 LYS A 140 -10.822 -8.793 5.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 140 -12.183 -8.389 6.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 140 -12.345 -9.427 4.717 1.00 0.00 H new ATOM 2191 N ALA A 141 -12.726 -1.570 3.822 1.00 0.00 N ATOM 2192 CA ALA A 141 -12.520 -0.392 4.637 1.00 0.00 C ATOM 2193 C ALA A 141 -13.303 0.771 4.064 1.00 0.00 C ATOM 2194 O ALA A 141 -13.768 1.650 4.793 1.00 0.00 O ATOM 2195 CB ALA A 141 -11.044 -0.068 4.738 1.00 0.00 C ATOM 0 H ALA A 141 -11.908 -1.871 3.292 1.00 0.00 H new ATOM 0 HA ALA A 141 -12.884 -0.586 5.646 1.00 0.00 H new ATOM 0 HB1 ALA A 141 -10.908 0.821 5.354 1.00 0.00 H new ATOM 0 HB2 ALA A 141 -10.517 -0.908 5.191 1.00 0.00 H new ATOM 0 HB3 ALA A 141 -10.643 0.117 3.741 1.00 0.00 H new ATOM 2201 N VAL A 142 -13.479 0.748 2.749 1.00 0.00 N ATOM 2202 CA VAL A 142 -14.234 1.768 2.081 1.00 0.00 C ATOM 2203 C VAL A 142 -15.711 1.403 2.088 1.00 0.00 C ATOM 2204 O VAL A 142 -16.561 2.264 1.888 1.00 0.00 O ATOM 2205 CB VAL A 142 -13.740 2.008 0.639 1.00 0.00 C ATOM 2206 CG1 VAL A 142 -12.266 2.383 0.643 1.00 0.00 C ATOM 2207 CG2 VAL A 142 -13.991 0.811 -0.266 1.00 0.00 C ATOM 0 H VAL A 142 -13.103 0.027 2.134 1.00 0.00 H new ATOM 0 HA VAL A 142 -14.088 2.701 2.625 1.00 0.00 H new ATOM 0 HB VAL A 142 -14.317 2.838 0.231 1.00 0.00 H new ATOM 0 HG11 VAL A 142 -11.930 2.550 -0.381 1.00 0.00 H new ATOM 0 HG12 VAL A 142 -12.124 3.294 1.224 1.00 0.00 H new ATOM 0 HG13 VAL A 142 -11.686 1.574 1.088 1.00 0.00 H new ATOM 0 HG21 VAL A 142 -13.626 1.030 -1.269 1.00 0.00 H new ATOM 0 HG22 VAL A 142 -13.467 -0.060 0.129 1.00 0.00 H new ATOM 0 HG23 VAL A 142 -15.060 0.604 -0.307 1.00 0.00 H new ATOM 2217 N GLU A 143 -16.012 0.120 2.327 1.00 0.00 N ATOM 2218 CA GLU A 143 -17.407 -0.336 2.384 1.00 0.00 C ATOM 2219 C GLU A 143 -17.635 -1.563 3.277 1.00 0.00 C ATOM 2220 O GLU A 143 -18.515 -1.536 4.140 1.00 0.00 O ATOM 2221 CB GLU A 143 -17.912 -0.653 0.983 1.00 0.00 C ATOM 2222 CG GLU A 143 -18.269 0.580 0.183 1.00 0.00 C ATOM 2223 CD GLU A 143 -19.491 1.300 0.720 1.00 0.00 C ATOM 2224 OE1 GLU A 143 -19.354 2.132 1.641 1.00 0.00 O ATOM 2225 OE2 GLU A 143 -20.604 1.047 0.209 1.00 0.00 O ATOM 0 H GLU A 143 -15.319 -0.612 2.482 1.00 0.00 H new ATOM 0 HA GLU A 143 -17.963 0.489 2.830 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -17.148 -1.216 0.448 1.00 0.00 H new ATOM 0 HB3 GLU A 143 -18.789 -1.296 1.057 1.00 0.00 H new ATOM 0 HG2 GLU A 143 -17.421 1.265 0.183 1.00 0.00 H new ATOM 0 HG3 GLU A 143 -18.448 0.295 -0.854 1.00 0.00 H new ATOM 2232 N GLU A 144 -16.848 -2.624 3.061 1.00 0.00 N ATOM 2233 CA GLU A 144 -17.078 -3.953 3.672 1.00 0.00 C ATOM 2234 C GLU A 144 -18.565 -4.303 3.670 1.00 0.00 C ATOM 2235 O GLU A 144 -19.131 -4.753 4.671 1.00 0.00 O ATOM 2236 CB GLU A 144 -16.458 -4.075 5.082 1.00 0.00 C ATOM 2237 CG GLU A 144 -16.981 -3.106 6.129 1.00 0.00 C ATOM 2238 CD GLU A 144 -16.337 -3.328 7.480 1.00 0.00 C ATOM 2239 OE1 GLU A 144 -15.171 -2.919 7.667 1.00 0.00 O ATOM 2240 OE2 GLU A 144 -16.998 -3.919 8.364 1.00 0.00 O ATOM 0 H GLU A 144 -16.028 -2.592 2.456 1.00 0.00 H new ATOM 0 HA GLU A 144 -16.560 -4.685 3.053 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -16.622 -5.091 5.442 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -15.380 -3.938 4.996 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -16.794 -2.083 5.802 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -18.061 -3.219 6.220 1.00 0.00 H new ATOM 2247 N LEU A 145 -19.189 -4.094 2.516 1.00 0.00 N ATOM 2248 CA LEU A 145 -20.607 -4.355 2.346 1.00 0.00 C ATOM 2249 C LEU A 145 -20.823 -5.825 2.007 1.00 0.00 C ATOM 2250 O LEU A 145 -21.232 -6.162 0.896 1.00 0.00 O ATOM 2251 CB LEU A 145 -21.178 -3.458 1.237 1.00 0.00 C ATOM 2252 CG LEU A 145 -22.613 -2.954 1.453 1.00 0.00 C ATOM 2253 CD1 LEU A 145 -23.600 -4.107 1.545 1.00 0.00 C ATOM 2254 CD2 LEU A 145 -22.680 -2.094 2.702 1.00 0.00 C ATOM 0 H LEU A 145 -18.726 -3.741 1.679 1.00 0.00 H new ATOM 0 HA LEU A 145 -21.128 -4.129 3.276 1.00 0.00 H new ATOM 0 HB2 LEU A 145 -20.524 -2.594 1.123 1.00 0.00 H new ATOM 0 HB3 LEU A 145 -21.145 -4.010 0.297 1.00 0.00 H new ATOM 0 HG LEU A 145 -22.893 -2.350 0.590 1.00 0.00 H new ATOM 0 HD11 LEU A 145 -24.605 -3.714 1.698 1.00 0.00 H new ATOM 0 HD12 LEU A 145 -23.573 -4.684 0.621 1.00 0.00 H new ATOM 0 HD13 LEU A 145 -23.331 -4.750 2.383 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -23.701 -1.741 2.847 1.00 0.00 H new ATOM 0 HD22 LEU A 145 -22.374 -2.683 3.566 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -22.013 -1.239 2.591 1.00 0.00 H new ATOM 2266 N GLU A 146 -20.492 -6.682 2.970 1.00 0.00 N ATOM 2267 CA GLU A 146 -20.714 -8.126 2.883 1.00 0.00 C ATOM 2268 C GLU A 146 -19.848 -8.813 1.827 1.00 0.00 C ATOM 2269 O GLU A 146 -19.586 -8.282 0.746 1.00 0.00 O ATOM 2270 CB GLU A 146 -22.187 -8.449 2.623 1.00 0.00 C ATOM 2271 CG GLU A 146 -23.104 -8.082 3.774 1.00 0.00 C ATOM 2272 CD GLU A 146 -24.503 -8.627 3.591 1.00 0.00 C ATOM 2273 OE1 GLU A 146 -24.739 -9.802 3.959 1.00 0.00 O ATOM 2274 OE2 GLU A 146 -25.374 -7.892 3.087 1.00 0.00 O ATOM 0 H GLU A 146 -20.056 -6.391 3.845 1.00 0.00 H new ATOM 0 HA GLU A 146 -20.418 -8.521 3.855 1.00 0.00 H new ATOM 0 HB2 GLU A 146 -22.513 -7.920 1.727 1.00 0.00 H new ATOM 0 HB3 GLU A 146 -22.285 -9.515 2.417 1.00 0.00 H new ATOM 0 HG2 GLU A 146 -22.686 -8.466 4.705 1.00 0.00 H new ATOM 0 HG3 GLU A 146 -23.149 -6.997 3.868 1.00 0.00 H new ATOM 2281 N HIS A 147 -19.387 -10.000 2.177 1.00 0.00 N ATOM 2282 CA HIS A 147 -18.745 -10.900 1.229 1.00 0.00 C ATOM 2283 C HIS A 147 -19.681 -12.088 0.998 1.00 0.00 C ATOM 2284 O HIS A 147 -19.357 -13.046 0.296 1.00 0.00 O ATOM 2285 CB HIS A 147 -17.382 -11.365 1.780 1.00 0.00 C ATOM 2286 CG HIS A 147 -16.581 -12.222 0.838 1.00 0.00 C ATOM 2287 ND1 HIS A 147 -15.705 -11.709 -0.097 1.00 0.00 N ATOM 2288 CD2 HIS A 147 -16.515 -13.567 0.704 1.00 0.00 C ATOM 2289 CE1 HIS A 147 -15.143 -12.701 -0.762 1.00 0.00 C ATOM 2290 NE2 HIS A 147 -15.618 -13.836 -0.295 1.00 0.00 N ATOM 0 H HIS A 147 -19.446 -10.370 3.126 1.00 0.00 H new ATOM 0 HA HIS A 147 -18.559 -10.392 0.283 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -16.792 -10.486 2.040 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -17.549 -11.921 2.702 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -17.068 -14.295 1.279 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -14.417 -12.599 -1.555 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -15.360 -14.766 -0.624 1.00 0.00 H new ATOM 2299 N HIS A 148 -20.867 -11.985 1.586 1.00 0.00 N ATOM 2300 CA HIS A 148 -21.838 -13.068 1.574 1.00 0.00 C ATOM 2301 C HIS A 148 -22.401 -13.292 0.178 1.00 0.00 C ATOM 2302 O HIS A 148 -22.743 -12.342 -0.523 1.00 0.00 O ATOM 2303 CB HIS A 148 -22.993 -12.773 2.538 1.00 0.00 C ATOM 2304 CG HIS A 148 -22.577 -12.633 3.970 1.00 0.00 C ATOM 2305 ND1 HIS A 148 -23.052 -11.636 4.796 1.00 0.00 N ATOM 2306 CD2 HIS A 148 -21.741 -13.379 4.727 1.00 0.00 C ATOM 2307 CE1 HIS A 148 -22.524 -11.775 5.997 1.00 0.00 C ATOM 2308 NE2 HIS A 148 -21.725 -12.825 5.981 1.00 0.00 N ATOM 0 H HIS A 148 -21.180 -11.151 2.082 1.00 0.00 H new ATOM 0 HA HIS A 148 -21.317 -13.970 1.894 1.00 0.00 H new ATOM 0 HB2 HIS A 148 -23.488 -11.854 2.224 1.00 0.00 H new ATOM 0 HB3 HIS A 148 -23.729 -13.574 2.462 1.00 0.00 H new ATOM 0 HD1 HIS A 148 -23.709 -10.905 4.521 1.00 0.00 H new ATOM 0 HD2 HIS A 148 -21.189 -14.249 4.404 1.00 0.00 H new ATOM 0 HE1 HIS A 148 -22.713 -11.138 6.848 1.00 0.00 H new ATOM 2317 N HIS A 149 -22.478 -14.553 -0.209 1.00 0.00 N ATOM 2318 CA HIS A 149 -23.149 -14.962 -1.435 1.00 0.00 C ATOM 2319 C HIS A 149 -23.767 -16.326 -1.212 1.00 0.00 C ATOM 2320 O HIS A 149 -23.313 -17.063 -0.340 1.00 0.00 O ATOM 2321 CB HIS A 149 -22.195 -14.988 -2.633 1.00 0.00 C ATOM 2322 CG HIS A 149 -22.038 -13.653 -3.297 1.00 0.00 C ATOM 2323 ND1 HIS A 149 -23.103 -12.817 -3.557 1.00 0.00 N ATOM 2324 CD2 HIS A 149 -20.937 -13.009 -3.755 1.00 0.00 C ATOM 2325 CE1 HIS A 149 -22.665 -11.722 -4.147 1.00 0.00 C ATOM 2326 NE2 HIS A 149 -21.355 -11.812 -4.278 1.00 0.00 N ATOM 0 H HIS A 149 -22.076 -15.327 0.319 1.00 0.00 H new ATOM 0 HA HIS A 149 -23.923 -14.232 -1.672 1.00 0.00 H new ATOM 0 HB2 HIS A 149 -21.217 -15.338 -2.302 1.00 0.00 H new ATOM 0 HB3 HIS A 149 -22.561 -15.709 -3.364 1.00 0.00 H new ATOM 0 HD1 HIS A 149 -24.077 -13.015 -3.329 1.00 0.00 H new ATOM 0 HD2 HIS A 149 -19.920 -13.371 -3.716 1.00 0.00 H new ATOM 0 HE1 HIS A 149 -23.276 -10.891 -4.469 1.00 0.00 H new ATOM 2335 N HIS A 150 -24.818 -16.641 -1.971 1.00 0.00 N ATOM 2336 CA HIS A 150 -25.635 -17.847 -1.747 1.00 0.00 C ATOM 2337 C HIS A 150 -26.540 -17.617 -0.535 1.00 0.00 C ATOM 2338 O HIS A 150 -27.707 -18.002 -0.534 1.00 0.00 O ATOM 2339 CB HIS A 150 -24.773 -19.106 -1.562 1.00 0.00 C ATOM 2340 CG HIS A 150 -25.539 -20.388 -1.658 1.00 0.00 C ATOM 2341 ND1 HIS A 150 -25.824 -21.186 -0.569 1.00 0.00 N ATOM 2342 CD2 HIS A 150 -26.063 -21.021 -2.732 1.00 0.00 C ATOM 2343 CE1 HIS A 150 -26.488 -22.252 -0.974 1.00 0.00 C ATOM 2344 NE2 HIS A 150 -26.646 -22.175 -2.280 1.00 0.00 N ATOM 0 H HIS A 150 -25.131 -16.072 -2.758 1.00 0.00 H new ATOM 0 HA HIS A 150 -26.245 -18.021 -2.633 1.00 0.00 H new ATOM 0 HB2 HIS A 150 -23.985 -19.108 -2.315 1.00 0.00 H new ATOM 0 HB3 HIS A 150 -24.284 -19.059 -0.589 1.00 0.00 H new ATOM 0 HD2 HIS A 150 -26.028 -20.680 -3.756 1.00 0.00 H new ATOM 0 HE1 HIS A 150 -26.842 -23.053 -0.342 1.00 0.00 H new ATOM 0 HE2 HIS A 150 -27.125 -22.863 -2.860 1.00 0.00 H new ATOM 2353 N HIS A 151 -25.982 -16.990 0.497 1.00 0.00 N ATOM 2354 CA HIS A 151 -26.779 -16.397 1.563 1.00 0.00 C ATOM 2355 C HIS A 151 -27.138 -14.976 1.150 1.00 0.00 C ATOM 2356 O HIS A 151 -27.775 -14.232 1.894 1.00 0.00 O ATOM 2357 CB HIS A 151 -26.013 -16.350 2.894 1.00 0.00 C ATOM 2358 CG HIS A 151 -25.763 -17.681 3.532 1.00 0.00 C ATOM 2359 ND1 HIS A 151 -26.715 -18.362 4.258 1.00 0.00 N ATOM 2360 CD2 HIS A 151 -24.647 -18.441 3.576 1.00 0.00 C ATOM 2361 CE1 HIS A 151 -26.192 -19.480 4.722 1.00 0.00 C ATOM 2362 NE2 HIS A 151 -24.939 -19.552 4.322 1.00 0.00 N ATOM 0 H HIS A 151 -24.975 -16.880 0.616 1.00 0.00 H new ATOM 0 HA HIS A 151 -27.669 -17.009 1.713 1.00 0.00 H new ATOM 0 HB2 HIS A 151 -25.054 -15.860 2.726 1.00 0.00 H new ATOM 0 HB3 HIS A 151 -26.571 -15.728 3.594 1.00 0.00 H new ATOM 0 HD2 HIS A 151 -23.700 -18.214 3.109 1.00 0.00 H new ATOM 0 HE1 HIS A 151 -26.704 -20.213 5.328 1.00 0.00 H new ATOM 0 HE2 HIS A 151 -24.292 -20.311 4.533 1.00 0.00 H new ATOM 2371 N HIS A 152 -26.696 -14.615 -0.049 1.00 0.00 N ATOM 2372 CA HIS A 152 -26.870 -13.275 -0.575 1.00 0.00 C ATOM 2373 C HIS A 152 -26.714 -13.307 -2.091 1.00 0.00 C ATOM 2374 O HIS A 152 -25.560 -13.392 -2.567 1.00 0.00 O ATOM 2375 CB HIS A 152 -25.828 -12.337 0.033 1.00 0.00 C ATOM 2376 CG HIS A 152 -26.322 -10.946 0.272 1.00 0.00 C ATOM 2377 ND1 HIS A 152 -26.460 -10.003 -0.721 1.00 0.00 N ATOM 2378 CD2 HIS A 152 -26.695 -10.337 1.418 1.00 0.00 C ATOM 2379 CE1 HIS A 152 -26.893 -8.873 -0.191 1.00 0.00 C ATOM 2380 NE2 HIS A 152 -27.044 -9.050 1.109 1.00 0.00 N ATOM 2381 OXT HIS A 152 -27.741 -13.279 -2.795 1.00 0.00 O ATOM 0 H HIS A 152 -26.206 -15.248 -0.682 1.00 0.00 H new ATOM 0 HA HIS A 152 -27.865 -12.911 -0.318 1.00 0.00 H new ATOM 0 HB2 HIS A 152 -25.485 -12.757 0.979 1.00 0.00 H new ATOM 0 HB3 HIS A 152 -24.963 -12.295 -0.629 1.00 0.00 H new ATOM 0 HD2 HIS A 152 -26.714 -10.784 2.401 1.00 0.00 H new ATOM 0 HE1 HIS A 152 -27.090 -7.958 -0.730 1.00 0.00 H new ATOM 0 HE2 HIS A 152 -27.367 -8.345 1.772 1.00 0.00 H new TER 2390 HIS A 152