USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1077 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 117 SER OG : rot 60:sc= 0.473 USER MOD Set 1.2: B 119 HIS : no HD1:sc= 0 X(o=0.47,f=0.47) USER MOD Set 2.1: B 84 THR OG1 : rot -28:sc= 1.22 USER MOD Set 2.2: B 111 LYS NZ :NH3+ 177:sc= 1.23 (180deg=0.33) USER MOD Set 3.1: A 54 THR OG1 : rot 180:sc= 0.471 USER MOD Set 3.2: A 57 THR OG1 : rot 90:sc= 0.0804 USER MOD Set 4.1: A 21 THR OG1 : rot 72:sc= 1.98 USER MOD Set 4.2: B 133 LYS NZ :NH3+ -150:sc= 2.46 (180deg=1.02) USER MOD Set 5.1: A 16 ASN : amide:sc= 1.03 K(o=2,f=1.5) USER MOD Set 5.2: A 17 SER OG : rot -94:sc= 0.985 USER MOD Set 6.1: A 15 CYS SG : rot 29:sc= -5.09! USER MOD Set 6.2: A 18 CYS SG : rot -117:sc= 2.09 USER MOD Set 6.3: B 85 CYS SG : rot 26:sc= -3.4! USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 5 SER OG : rot 180:sc= 0.0157 USER MOD Single : A 7 THR OG1 : rot 154:sc= 1.24 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 13 MET CE :methyl 154:sc= -0.408 (180deg=-1.32!) USER MOD Single : A 14 THR OG1 : rot -9:sc= 0.261 USER MOD Single : A 24 GLN : amide:sc= 0.891 K(o=0.89,f=-0.043) USER MOD Single : A 25 GLN : amide:sc= 0.226 K(o=0.23,f=-0.4) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 33 HIS : no HD1:sc= -0.0752 X(o=-0.075,f=0) USER MOD Single : A 34 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ -174:sc= 0.848 (180deg=0.825) USER MOD Single : A 43 ASN : amide:sc= -0.124 K(o=-0.12,f=-2.3!) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ -161:sc= 1.24 (180deg=0.975) USER MOD Single : A 53 GLN : amide:sc= -0.919 K(o=-0.92,f=-7.8!) USER MOD Single : A 56 LYS NZ :NH3+ -138:sc= 0.648 (180deg=0.0746) USER MOD Single : A 59 GLN : amide:sc= 0.335 X(o=0.34,f=0) USER MOD Single : A 65 MET CE :methyl -169:sc= -0.314 (180deg=-0.437) USER MOD Single : A 72 HIS : no HD1:sc= -0.77 X(o=-0.77,f=-1.2) USER MOD Single : A 73 ASN : amide:sc= -0.109 X(o=-0.11,f=0) USER MOD Single : B 74 MET CE :methyl 169:sc= -0.0246 (180deg=-0.198) USER MOD Single : B 76 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 77 HIS : no HE2:sc= 0.467 K(o=0.47,f=-3.8!) USER MOD Single : B 80 SER OG : rot 180:sc= 0 USER MOD Single : B 83 MET CE :methyl -168:sc= -0.0461 (180deg=-0.269) USER MOD Single : B 88 CYS SG : rot 180:sc= -0.332 USER MOD Single : B 93 SER OG : rot -35:sc= 1.27 USER MOD Single : B 97 ASN : amide:sc= 0 K(o=0,f=-0.77) USER MOD Single : B 98 LYS NZ :NH3+ -150:sc= 1.21 (180deg=0.569) USER MOD Single : B 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 104 TYR OH : rot 90:sc= -0.028 USER MOD Single : B 110 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 112 LYS NZ :NH3+ -163:sc= 1.14 (180deg=0.708) USER MOD Single : B 114 CYS SG : rot 180:sc= -0.534 USER MOD Single : B 120 SER OG : rot 180:sc= 0 USER MOD Single : B 121 MET CE :methyl -176:sc= -0.283 (180deg=-0.322) USER MOD Single : B 123 THR OG1 : rot 180:sc= 0 USER MOD Single : B 127 THR OG1 : rot 91:sc= 1.2 USER MOD Single : B 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 131 THR OG1 : rot -88:sc= 1.28 USER MOD Single : B 134 THR OG1 : rot 180:sc= 0 USER MOD Single : B 136 SER OG : rot 180:sc= 0 USER MOD Single : B 137 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 20 N GLY A 2 -7.936 -7.265 26.592 1.00 0.00 N ATOM 21 CA GLY A 2 -6.489 -7.425 26.718 1.00 0.00 C ATOM 22 C GLY A 2 -5.790 -7.635 25.375 1.00 0.00 C ATOM 23 O GLY A 2 -4.973 -6.803 24.979 1.00 0.00 O ATOM 0 HA2 GLY A 2 -6.073 -6.542 27.203 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -6.279 -8.275 27.367 1.00 0.00 H new ATOM 27 N VAL A 3 -6.135 -8.715 24.668 1.00 0.00 N ATOM 28 CA VAL A 3 -5.625 -9.034 23.319 1.00 0.00 C ATOM 29 C VAL A 3 -6.655 -9.810 22.490 1.00 0.00 C ATOM 30 O VAL A 3 -7.347 -10.688 23.005 1.00 0.00 O ATOM 31 CB VAL A 3 -4.299 -9.844 23.335 1.00 0.00 C ATOM 32 CG1 VAL A 3 -3.067 -8.953 23.559 1.00 0.00 C ATOM 33 CG2 VAL A 3 -4.277 -11.004 24.347 1.00 0.00 C ATOM 0 H VAL A 3 -6.791 -9.412 25.020 1.00 0.00 H new ATOM 0 HA VAL A 3 -5.429 -8.064 22.861 1.00 0.00 H new ATOM 0 HB VAL A 3 -4.252 -10.281 22.338 1.00 0.00 H new ATOM 0 HG11 VAL A 3 -2.168 -9.569 23.561 1.00 0.00 H new ATOM 0 HG12 VAL A 3 -3.000 -8.217 22.758 1.00 0.00 H new ATOM 0 HG13 VAL A 3 -3.158 -8.440 24.517 1.00 0.00 H new ATOM 0 HG21 VAL A 3 -3.316 -11.516 24.293 1.00 0.00 H new ATOM 0 HG22 VAL A 3 -4.423 -10.612 25.353 1.00 0.00 H new ATOM 0 HG23 VAL A 3 -5.077 -11.707 24.112 1.00 0.00 H new ATOM 43 N ASN A 4 -6.726 -9.499 21.192 1.00 0.00 N ATOM 44 CA ASN A 4 -7.562 -10.185 20.204 1.00 0.00 C ATOM 45 C ASN A 4 -6.720 -10.658 19.002 1.00 0.00 C ATOM 46 O ASN A 4 -6.280 -9.874 18.164 1.00 0.00 O ATOM 47 CB ASN A 4 -8.727 -9.271 19.784 1.00 0.00 C ATOM 48 CG ASN A 4 -9.845 -9.255 20.826 1.00 0.00 C ATOM 49 OD1 ASN A 4 -9.719 -8.707 21.916 1.00 0.00 O ATOM 50 ND2 ASN A 4 -10.973 -9.875 20.539 1.00 0.00 N ATOM 0 H ASN A 4 -6.184 -8.736 20.787 1.00 0.00 H new ATOM 0 HA ASN A 4 -7.989 -11.082 20.653 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -8.357 -8.257 19.634 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -9.127 -9.609 18.828 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -11.731 -9.896 21.221 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -11.087 -10.334 19.635 1.00 0.00 H new ATOM 57 N SER A 5 -6.485 -11.966 18.921 1.00 0.00 N ATOM 58 CA SER A 5 -5.865 -12.660 17.781 1.00 0.00 C ATOM 59 C SER A 5 -6.852 -12.830 16.611 1.00 0.00 C ATOM 60 O SER A 5 -8.015 -13.178 16.844 1.00 0.00 O ATOM 61 CB SER A 5 -5.354 -14.043 18.235 1.00 0.00 C ATOM 62 OG SER A 5 -6.333 -14.777 18.969 1.00 0.00 O ATOM 0 H SER A 5 -6.730 -12.604 19.678 1.00 0.00 H new ATOM 0 HA SER A 5 -5.033 -12.051 17.429 1.00 0.00 H new ATOM 0 HB2 SER A 5 -5.053 -14.620 17.360 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.465 -13.913 18.852 1.00 0.00 H new ATOM 0 HG SER A 5 -5.962 -15.645 19.232 1.00 0.00 H new ATOM 68 N VAL A 6 -6.409 -12.630 15.361 1.00 0.00 N ATOM 69 CA VAL A 6 -7.210 -12.873 14.140 1.00 0.00 C ATOM 70 C VAL A 6 -6.318 -13.105 12.898 1.00 0.00 C ATOM 71 O VAL A 6 -5.102 -12.907 12.965 1.00 0.00 O ATOM 72 CB VAL A 6 -8.270 -11.750 13.949 1.00 0.00 C ATOM 73 CG1 VAL A 6 -7.694 -10.469 13.328 1.00 0.00 C ATOM 74 CG2 VAL A 6 -9.496 -12.230 13.155 1.00 0.00 C ATOM 0 H VAL A 6 -5.469 -12.289 15.161 1.00 0.00 H new ATOM 0 HA VAL A 6 -7.762 -13.804 14.268 1.00 0.00 H new ATOM 0 HB VAL A 6 -8.597 -11.498 14.958 1.00 0.00 H new ATOM 0 HG11 VAL A 6 -8.486 -9.728 13.223 1.00 0.00 H new ATOM 0 HG12 VAL A 6 -6.910 -10.073 13.973 1.00 0.00 H new ATOM 0 HG13 VAL A 6 -7.277 -10.696 12.347 1.00 0.00 H new ATOM 0 HG21 VAL A 6 -10.205 -11.409 13.050 1.00 0.00 H new ATOM 0 HG22 VAL A 6 -9.181 -12.566 12.167 1.00 0.00 H new ATOM 0 HG23 VAL A 6 -9.972 -13.055 13.685 1.00 0.00 H new ATOM 84 N THR A 7 -6.911 -13.519 11.766 1.00 0.00 N ATOM 85 CA THR A 7 -6.228 -13.728 10.473 1.00 0.00 C ATOM 86 C THR A 7 -6.897 -12.890 9.378 1.00 0.00 C ATOM 87 O THR A 7 -8.097 -12.626 9.414 1.00 0.00 O ATOM 88 CB THR A 7 -6.229 -15.217 10.053 1.00 0.00 C ATOM 89 OG1 THR A 7 -6.189 -16.107 11.150 1.00 0.00 O ATOM 90 CG2 THR A 7 -5.005 -15.554 9.199 1.00 0.00 C ATOM 0 H THR A 7 -7.909 -13.724 11.721 1.00 0.00 H new ATOM 0 HA THR A 7 -5.192 -13.412 10.600 1.00 0.00 H new ATOM 0 HB THR A 7 -7.161 -15.343 9.502 1.00 0.00 H new ATOM 0 HG1 THR A 7 -6.591 -16.963 10.892 1.00 0.00 H new ATOM 0 HG21 THR A 7 -5.035 -16.607 8.920 1.00 0.00 H new ATOM 0 HG22 THR A 7 -5.009 -14.940 8.299 1.00 0.00 H new ATOM 0 HG23 THR A 7 -4.098 -15.355 9.769 1.00 0.00 H new ATOM 98 N ILE A 8 -6.136 -12.485 8.363 1.00 0.00 N ATOM 99 CA ILE A 8 -6.619 -11.814 7.145 1.00 0.00 C ATOM 100 C ILE A 8 -5.983 -12.474 5.913 1.00 0.00 C ATOM 101 O ILE A 8 -4.762 -12.514 5.764 1.00 0.00 O ATOM 102 CB ILE A 8 -6.307 -10.297 7.187 1.00 0.00 C ATOM 103 CG1 ILE A 8 -6.736 -9.646 8.522 1.00 0.00 C ATOM 104 CG2 ILE A 8 -6.959 -9.586 5.989 1.00 0.00 C ATOM 105 CD1 ILE A 8 -6.590 -8.120 8.568 1.00 0.00 C ATOM 0 H ILE A 8 -5.125 -12.618 8.361 1.00 0.00 H new ATOM 0 HA ILE A 8 -7.702 -11.921 7.085 1.00 0.00 H new ATOM 0 HB ILE A 8 -5.225 -10.182 7.118 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -7.777 -9.904 8.718 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -6.143 -10.078 9.328 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -6.732 -8.521 6.031 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -6.569 -10.004 5.061 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -8.039 -9.728 6.025 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -6.914 -7.753 9.542 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -5.546 -7.849 8.407 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -7.205 -7.672 7.788 1.00 0.00 H new ATOM 117 N SER A 9 -6.785 -12.967 4.978 1.00 0.00 N ATOM 118 CA SER A 9 -6.311 -13.713 3.797 1.00 0.00 C ATOM 119 C SER A 9 -5.730 -12.802 2.687 1.00 0.00 C ATOM 120 O SER A 9 -6.200 -12.833 1.552 1.00 0.00 O ATOM 121 CB SER A 9 -7.446 -14.625 3.305 1.00 0.00 C ATOM 122 OG SER A 9 -7.672 -15.675 4.231 1.00 0.00 O ATOM 0 H SER A 9 -7.799 -12.864 5.010 1.00 0.00 H new ATOM 0 HA SER A 9 -5.463 -14.333 4.089 1.00 0.00 H new ATOM 0 HB2 SER A 9 -8.359 -14.043 3.175 1.00 0.00 H new ATOM 0 HB3 SER A 9 -7.191 -15.040 2.330 1.00 0.00 H new ATOM 0 HG SER A 9 -8.398 -16.247 3.906 1.00 0.00 H new ATOM 128 N VAL A 10 -4.758 -11.942 3.023 1.00 0.00 N ATOM 129 CA VAL A 10 -4.205 -10.884 2.143 1.00 0.00 C ATOM 130 C VAL A 10 -3.636 -11.446 0.827 1.00 0.00 C ATOM 131 O VAL A 10 -2.554 -12.032 0.801 1.00 0.00 O ATOM 132 CB VAL A 10 -3.165 -9.989 2.858 1.00 0.00 C ATOM 133 CG1 VAL A 10 -2.548 -8.933 1.919 1.00 0.00 C ATOM 134 CG2 VAL A 10 -3.851 -9.238 4.012 1.00 0.00 C ATOM 0 H VAL A 10 -4.316 -11.958 3.942 1.00 0.00 H new ATOM 0 HA VAL A 10 -5.054 -10.250 1.888 1.00 0.00 H new ATOM 0 HB VAL A 10 -2.371 -10.646 3.213 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -1.825 -8.333 2.472 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -2.047 -9.432 1.090 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -3.335 -8.287 1.531 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -3.122 -8.606 4.519 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -4.655 -8.618 3.616 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -4.263 -9.957 4.720 1.00 0.00 H new ATOM 144 N GLU A 11 -4.394 -11.251 -0.254 1.00 0.00 N ATOM 145 CA GLU A 11 -4.215 -11.941 -1.545 1.00 0.00 C ATOM 146 C GLU A 11 -3.006 -11.471 -2.377 1.00 0.00 C ATOM 147 O GLU A 11 -2.284 -12.294 -2.935 1.00 0.00 O ATOM 148 CB GLU A 11 -5.484 -11.809 -2.412 1.00 0.00 C ATOM 149 CG GLU A 11 -6.798 -12.316 -1.794 1.00 0.00 C ATOM 150 CD GLU A 11 -6.930 -13.837 -1.662 1.00 0.00 C ATOM 151 OE1 GLU A 11 -5.953 -14.608 -1.827 1.00 0.00 O ATOM 152 OE2 GLU A 11 -8.062 -14.298 -1.380 1.00 0.00 O ATOM 0 H GLU A 11 -5.172 -10.592 -0.262 1.00 0.00 H new ATOM 0 HA GLU A 11 -4.022 -12.978 -1.271 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -5.612 -10.758 -2.670 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -5.316 -12.348 -3.345 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -6.906 -11.874 -0.804 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -7.627 -11.949 -2.399 1.00 0.00 H new ATOM 159 N GLY A 12 -2.792 -10.158 -2.524 1.00 0.00 N ATOM 160 CA GLY A 12 -1.846 -9.600 -3.512 1.00 0.00 C ATOM 161 C GLY A 12 -0.394 -9.458 -3.037 1.00 0.00 C ATOM 162 O GLY A 12 0.460 -9.002 -3.798 1.00 0.00 O ATOM 0 H GLY A 12 -3.266 -9.449 -1.965 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -1.859 -10.235 -4.398 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -2.206 -8.618 -3.818 1.00 0.00 H new ATOM 166 N MET A 13 -0.124 -9.832 -1.787 1.00 0.00 N ATOM 167 CA MET A 13 1.182 -9.824 -1.116 1.00 0.00 C ATOM 168 C MET A 13 1.923 -11.142 -1.398 1.00 0.00 C ATOM 169 O MET A 13 1.300 -12.202 -1.326 1.00 0.00 O ATOM 170 CB MET A 13 0.884 -9.622 0.367 1.00 0.00 C ATOM 171 CG MET A 13 2.123 -9.560 1.259 1.00 0.00 C ATOM 172 SD MET A 13 1.716 -9.744 3.008 1.00 0.00 S ATOM 173 CE MET A 13 1.155 -11.464 2.947 1.00 0.00 C ATOM 0 H MET A 13 -0.862 -10.173 -1.171 1.00 0.00 H new ATOM 0 HA MET A 13 1.837 -9.031 -1.476 1.00 0.00 H new ATOM 0 HB2 MET A 13 0.318 -8.699 0.488 1.00 0.00 H new ATOM 0 HB3 MET A 13 0.245 -10.435 0.710 1.00 0.00 H new ATOM 0 HG2 MET A 13 2.819 -10.346 0.965 1.00 0.00 H new ATOM 0 HG3 MET A 13 2.632 -8.609 1.105 1.00 0.00 H new ATOM 0 HE1 MET A 13 1.291 -11.926 3.925 1.00 0.00 H new ATOM 0 HE2 MET A 13 0.100 -11.493 2.675 1.00 0.00 H new ATOM 0 HE3 MET A 13 1.736 -12.010 2.204 1.00 0.00 H new ATOM 183 N THR A 14 3.222 -11.106 -1.749 1.00 0.00 N ATOM 184 CA THR A 14 3.861 -12.248 -2.446 1.00 0.00 C ATOM 185 C THR A 14 5.393 -12.284 -2.471 1.00 0.00 C ATOM 186 O THR A 14 5.926 -13.370 -2.696 1.00 0.00 O ATOM 187 CB THR A 14 3.236 -12.419 -3.843 1.00 0.00 C ATOM 188 OG1 THR A 14 3.780 -13.507 -4.559 1.00 0.00 O ATOM 189 CG2 THR A 14 3.415 -11.155 -4.667 1.00 0.00 C ATOM 0 H THR A 14 3.843 -10.317 -1.568 1.00 0.00 H new ATOM 0 HA THR A 14 3.639 -13.117 -1.826 1.00 0.00 H new ATOM 0 HB THR A 14 2.177 -12.619 -3.677 1.00 0.00 H new ATOM 0 HG1 THR A 14 4.555 -13.862 -4.076 1.00 0.00 H new ATOM 0 HG21 THR A 14 2.967 -11.295 -5.651 1.00 0.00 H new ATOM 0 HG22 THR A 14 2.929 -10.320 -4.163 1.00 0.00 H new ATOM 0 HG23 THR A 14 4.478 -10.942 -4.780 1.00 0.00 H new ATOM 197 N CYS A 15 6.114 -11.178 -2.245 1.00 0.00 N ATOM 198 CA CYS A 15 7.529 -11.078 -2.598 1.00 0.00 C ATOM 199 C CYS A 15 8.433 -10.295 -1.597 1.00 0.00 C ATOM 200 O CYS A 15 8.794 -10.806 -0.530 1.00 0.00 O ATOM 201 CB CYS A 15 7.565 -10.607 -4.070 1.00 0.00 C ATOM 202 SG CYS A 15 6.861 -8.939 -4.260 1.00 0.00 S ATOM 0 H CYS A 15 5.733 -10.335 -1.815 1.00 0.00 H new ATOM 0 HA CYS A 15 8.010 -12.052 -2.507 1.00 0.00 H new ATOM 0 HB2 CYS A 15 8.594 -10.611 -4.428 1.00 0.00 H new ATOM 0 HB3 CYS A 15 7.009 -11.310 -4.691 1.00 0.00 H new ATOM 0 HG CYS A 15 7.030 -8.269 -3.159 1.00 0.00 H new ATOM 207 N ASN A 16 8.935 -9.129 -2.011 1.00 0.00 N ATOM 208 CA ASN A 16 10.099 -8.454 -1.435 1.00 0.00 C ATOM 209 C ASN A 16 9.733 -7.531 -0.258 1.00 0.00 C ATOM 210 O ASN A 16 10.357 -7.611 0.806 1.00 0.00 O ATOM 211 CB ASN A 16 10.823 -7.688 -2.557 1.00 0.00 C ATOM 212 CG ASN A 16 11.984 -6.856 -2.024 1.00 0.00 C ATOM 213 OD1 ASN A 16 11.792 -5.743 -1.550 1.00 0.00 O ATOM 214 ND2 ASN A 16 13.200 -7.370 -2.052 1.00 0.00 N ATOM 0 H ASN A 16 8.525 -8.609 -2.787 1.00 0.00 H new ATOM 0 HA ASN A 16 10.765 -9.206 -1.011 1.00 0.00 H new ATOM 0 HB2 ASN A 16 11.195 -8.396 -3.298 1.00 0.00 H new ATOM 0 HB3 ASN A 16 10.114 -7.036 -3.067 1.00 0.00 H new ATOM 0 HD21 ASN A 16 13.987 -6.840 -1.677 1.00 0.00 H new ATOM 0 HD22 ASN A 16 13.353 -8.297 -2.448 1.00 0.00 H new ATOM 221 N SER A 17 8.730 -6.664 -0.417 1.00 0.00 N ATOM 222 CA SER A 17 8.440 -5.597 0.561 1.00 0.00 C ATOM 223 C SER A 17 6.974 -5.130 0.611 1.00 0.00 C ATOM 224 O SER A 17 6.632 -4.283 1.440 1.00 0.00 O ATOM 225 CB SER A 17 9.447 -4.430 0.458 1.00 0.00 C ATOM 226 OG SER A 17 9.780 -4.065 -0.870 1.00 0.00 O ATOM 0 H SER A 17 8.098 -6.676 -1.217 1.00 0.00 H new ATOM 0 HA SER A 17 8.585 -6.066 1.534 1.00 0.00 H new ATOM 0 HB2 SER A 17 9.032 -3.561 0.968 1.00 0.00 H new ATOM 0 HB3 SER A 17 10.360 -4.705 0.987 1.00 0.00 H new ATOM 0 HG SER A 17 10.599 -4.529 -1.141 1.00 0.00 H new ATOM 232 N CYS A 18 6.070 -5.761 -0.143 1.00 0.00 N ATOM 233 CA CYS A 18 4.650 -5.840 0.164 1.00 0.00 C ATOM 234 C CYS A 18 4.423 -6.274 1.636 1.00 0.00 C ATOM 235 O CYS A 18 3.823 -5.556 2.437 1.00 0.00 O ATOM 236 CB CYS A 18 4.102 -6.827 -0.884 1.00 0.00 C ATOM 237 SG CYS A 18 5.017 -8.400 -0.948 1.00 0.00 S ATOM 0 H CYS A 18 6.319 -6.243 -1.007 1.00 0.00 H new ATOM 0 HA CYS A 18 4.128 -4.885 0.101 1.00 0.00 H new ATOM 0 HB2 CYS A 18 3.055 -7.034 -0.664 1.00 0.00 H new ATOM 0 HB3 CYS A 18 4.135 -6.357 -1.867 1.00 0.00 H new ATOM 0 HG CYS A 18 5.577 -8.529 -2.114 1.00 0.00 H new ATOM 242 N VAL A 19 5.026 -7.409 1.984 1.00 0.00 N ATOM 243 CA VAL A 19 5.158 -7.969 3.346 1.00 0.00 C ATOM 244 C VAL A 19 5.588 -6.920 4.392 1.00 0.00 C ATOM 245 O VAL A 19 4.916 -6.738 5.409 1.00 0.00 O ATOM 246 CB VAL A 19 6.120 -9.190 3.371 1.00 0.00 C ATOM 247 CG1 VAL A 19 5.437 -10.426 2.760 1.00 0.00 C ATOM 248 CG2 VAL A 19 7.459 -8.961 2.637 1.00 0.00 C ATOM 0 H VAL A 19 5.466 -8.007 1.285 1.00 0.00 H new ATOM 0 HA VAL A 19 4.160 -8.307 3.626 1.00 0.00 H new ATOM 0 HB VAL A 19 6.352 -9.345 4.425 1.00 0.00 H new ATOM 0 HG11 VAL A 19 6.125 -11.271 2.785 1.00 0.00 H new ATOM 0 HG12 VAL A 19 4.542 -10.668 3.334 1.00 0.00 H new ATOM 0 HG13 VAL A 19 5.160 -10.215 1.727 1.00 0.00 H new ATOM 0 HG21 VAL A 19 8.069 -9.862 2.703 1.00 0.00 H new ATOM 0 HG22 VAL A 19 7.265 -8.731 1.589 1.00 0.00 H new ATOM 0 HG23 VAL A 19 7.990 -8.129 3.099 1.00 0.00 H new ATOM 258 N TRP A 20 6.659 -6.164 4.114 1.00 0.00 N ATOM 259 CA TRP A 20 7.176 -5.088 4.971 1.00 0.00 C ATOM 260 C TRP A 20 6.198 -3.907 5.083 1.00 0.00 C ATOM 261 O TRP A 20 6.050 -3.321 6.157 1.00 0.00 O ATOM 262 CB TRP A 20 8.531 -4.646 4.387 1.00 0.00 C ATOM 263 CG TRP A 20 9.151 -3.411 4.966 1.00 0.00 C ATOM 264 CD1 TRP A 20 10.044 -3.383 5.979 1.00 0.00 C ATOM 265 CD2 TRP A 20 8.990 -2.018 4.541 1.00 0.00 C ATOM 266 NE1 TRP A 20 10.426 -2.080 6.227 1.00 0.00 N ATOM 267 CE2 TRP A 20 9.813 -1.195 5.368 1.00 0.00 C ATOM 268 CE3 TRP A 20 8.247 -1.363 3.532 1.00 0.00 C ATOM 269 CZ2 TRP A 20 9.892 0.197 5.208 1.00 0.00 C ATOM 270 CZ3 TRP A 20 8.311 0.035 3.370 1.00 0.00 C ATOM 271 CH2 TRP A 20 9.129 0.816 4.204 1.00 0.00 C ATOM 0 H TRP A 20 7.206 -6.288 3.262 1.00 0.00 H new ATOM 0 HA TRP A 20 7.300 -5.458 5.989 1.00 0.00 H new ATOM 0 HB2 TRP A 20 9.236 -5.468 4.508 1.00 0.00 H new ATOM 0 HB3 TRP A 20 8.404 -4.491 3.316 1.00 0.00 H new ATOM 0 HD1 TRP A 20 10.405 -4.249 6.514 1.00 0.00 H new ATOM 0 HE1 TRP A 20 11.083 -1.806 6.958 1.00 0.00 H new ATOM 0 HE3 TRP A 20 7.619 -1.945 2.874 1.00 0.00 H new ATOM 0 HZ2 TRP A 20 10.532 0.785 5.849 1.00 0.00 H new ATOM 0 HZ3 TRP A 20 7.726 0.511 2.597 1.00 0.00 H new ATOM 0 HH2 TRP A 20 9.171 1.887 4.074 1.00 0.00 H new ATOM 282 N THR A 21 5.487 -3.586 3.994 1.00 0.00 N ATOM 283 CA THR A 21 4.509 -2.490 3.930 1.00 0.00 C ATOM 284 C THR A 21 3.345 -2.725 4.888 1.00 0.00 C ATOM 285 O THR A 21 2.889 -1.772 5.508 1.00 0.00 O ATOM 286 CB THR A 21 4.020 -2.270 2.492 1.00 0.00 C ATOM 287 OG1 THR A 21 5.133 -2.054 1.648 1.00 0.00 O ATOM 288 CG2 THR A 21 3.138 -1.029 2.391 1.00 0.00 C ATOM 0 H THR A 21 5.577 -4.092 3.113 1.00 0.00 H new ATOM 0 HA THR A 21 5.012 -1.577 4.251 1.00 0.00 H new ATOM 0 HB THR A 21 3.453 -3.153 2.198 1.00 0.00 H new ATOM 0 HG1 THR A 21 5.619 -2.896 1.525 1.00 0.00 H new ATOM 0 HG21 THR A 21 2.808 -0.900 1.360 1.00 0.00 H new ATOM 0 HG22 THR A 21 2.269 -1.146 3.039 1.00 0.00 H new ATOM 0 HG23 THR A 21 3.706 -0.152 2.702 1.00 0.00 H new ATOM 296 N ILE A 22 2.912 -3.975 5.099 1.00 0.00 N ATOM 297 CA ILE A 22 1.859 -4.290 6.089 1.00 0.00 C ATOM 298 C ILE A 22 2.251 -3.822 7.500 1.00 0.00 C ATOM 299 O ILE A 22 1.444 -3.193 8.181 1.00 0.00 O ATOM 300 CB ILE A 22 1.514 -5.803 6.103 1.00 0.00 C ATOM 301 CG1 ILE A 22 1.333 -6.461 4.715 1.00 0.00 C ATOM 302 CG2 ILE A 22 0.257 -6.029 6.965 1.00 0.00 C ATOM 303 CD1 ILE A 22 0.388 -5.755 3.739 1.00 0.00 C ATOM 0 H ILE A 22 3.271 -4.789 4.600 1.00 0.00 H new ATOM 0 HA ILE A 22 0.968 -3.743 5.781 1.00 0.00 H new ATOM 0 HB ILE A 22 2.387 -6.298 6.529 1.00 0.00 H new ATOM 0 HG12 ILE A 22 2.313 -6.538 4.244 1.00 0.00 H new ATOM 0 HG13 ILE A 22 0.970 -7.478 4.865 1.00 0.00 H new ATOM 0 HG21 ILE A 22 0.011 -7.091 6.978 1.00 0.00 H new ATOM 0 HG22 ILE A 22 0.448 -5.688 7.983 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -0.578 -5.468 6.545 1.00 0.00 H new ATOM 0 HD11 ILE A 22 0.347 -6.314 2.804 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -0.610 -5.701 4.174 1.00 0.00 H new ATOM 0 HD13 ILE A 22 0.754 -4.747 3.544 1.00 0.00 H new ATOM 315 N GLU A 23 3.493 -4.073 7.918 1.00 0.00 N ATOM 316 CA GLU A 23 4.027 -3.658 9.223 1.00 0.00 C ATOM 317 C GLU A 23 4.123 -2.132 9.350 1.00 0.00 C ATOM 318 O GLU A 23 3.923 -1.575 10.430 1.00 0.00 O ATOM 319 CB GLU A 23 5.403 -4.315 9.408 1.00 0.00 C ATOM 320 CG GLU A 23 5.998 -4.206 10.822 1.00 0.00 C ATOM 321 CD GLU A 23 6.616 -2.850 11.164 1.00 0.00 C ATOM 322 OE1 GLU A 23 7.169 -2.165 10.269 1.00 0.00 O ATOM 323 OE2 GLU A 23 6.627 -2.472 12.359 1.00 0.00 O ATOM 0 H GLU A 23 4.172 -4.580 7.350 1.00 0.00 H new ATOM 0 HA GLU A 23 3.345 -3.984 10.008 1.00 0.00 H new ATOM 0 HB2 GLU A 23 5.322 -5.370 9.146 1.00 0.00 H new ATOM 0 HB3 GLU A 23 6.101 -3.864 8.702 1.00 0.00 H new ATOM 0 HG2 GLU A 23 5.214 -4.423 11.547 1.00 0.00 H new ATOM 0 HG3 GLU A 23 6.761 -4.975 10.938 1.00 0.00 H new ATOM 330 N GLN A 24 4.396 -1.443 8.242 1.00 0.00 N ATOM 331 CA GLN A 24 4.374 0.016 8.203 1.00 0.00 C ATOM 332 C GLN A 24 2.943 0.553 8.373 1.00 0.00 C ATOM 333 O GLN A 24 2.713 1.367 9.269 1.00 0.00 O ATOM 334 CB GLN A 24 5.051 0.534 6.921 1.00 0.00 C ATOM 335 CG GLN A 24 6.543 0.160 6.811 1.00 0.00 C ATOM 336 CD GLN A 24 7.416 0.864 7.849 1.00 0.00 C ATOM 337 OE1 GLN A 24 7.891 1.974 7.652 1.00 0.00 O ATOM 338 NE2 GLN A 24 7.651 0.287 9.006 1.00 0.00 N ATOM 0 H GLN A 24 4.637 -1.879 7.352 1.00 0.00 H new ATOM 0 HA GLN A 24 4.951 0.397 9.046 1.00 0.00 H new ATOM 0 HB2 GLN A 24 4.521 0.136 6.055 1.00 0.00 H new ATOM 0 HB3 GLN A 24 4.954 1.619 6.883 1.00 0.00 H new ATOM 0 HG2 GLN A 24 6.650 -0.919 6.926 1.00 0.00 H new ATOM 0 HG3 GLN A 24 6.902 0.411 5.813 1.00 0.00 H new ATOM 0 HE21 GLN A 24 7.269 -0.638 9.201 1.00 0.00 H new ATOM 0 HE22 GLN A 24 8.215 0.765 9.709 1.00 0.00 H new ATOM 347 N GLN A 25 1.983 0.112 7.552 1.00 0.00 N ATOM 348 CA GLN A 25 0.621 0.658 7.565 1.00 0.00 C ATOM 349 C GLN A 25 -0.208 0.220 8.785 1.00 0.00 C ATOM 350 O GLN A 25 -0.933 1.038 9.349 1.00 0.00 O ATOM 351 CB GLN A 25 -0.112 0.339 6.247 1.00 0.00 C ATOM 352 CG GLN A 25 0.579 0.838 4.959 1.00 0.00 C ATOM 353 CD GLN A 25 1.157 2.251 5.044 1.00 0.00 C ATOM 354 OE1 GLN A 25 2.260 2.456 5.534 1.00 0.00 O ATOM 355 NE2 GLN A 25 0.471 3.276 4.590 1.00 0.00 N ATOM 0 H GLN A 25 2.126 -0.628 6.865 1.00 0.00 H new ATOM 0 HA GLN A 25 0.729 1.739 7.654 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -0.238 -0.741 6.175 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -1.110 0.774 6.294 1.00 0.00 H new ATOM 0 HG2 GLN A 25 1.383 0.147 4.704 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -0.141 0.804 4.141 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -0.450 3.130 4.177 1.00 0.00 H new ATOM 0 HE22 GLN A 25 0.860 4.217 4.650 1.00 0.00 H new ATOM 364 N ILE A 26 -0.143 -1.045 9.218 1.00 0.00 N ATOM 365 CA ILE A 26 -0.858 -1.497 10.432 1.00 0.00 C ATOM 366 C ILE A 26 -0.179 -0.974 11.706 1.00 0.00 C ATOM 367 O ILE A 26 -0.845 -0.443 12.602 1.00 0.00 O ATOM 368 CB ILE A 26 -1.106 -3.032 10.375 1.00 0.00 C ATOM 369 CG1 ILE A 26 -2.616 -3.366 10.463 1.00 0.00 C ATOM 370 CG2 ILE A 26 -0.293 -3.850 11.402 1.00 0.00 C ATOM 371 CD1 ILE A 26 -2.999 -4.555 9.574 1.00 0.00 C ATOM 0 H ILE A 26 0.394 -1.776 8.752 1.00 0.00 H new ATOM 0 HA ILE A 26 -1.854 -1.055 10.468 1.00 0.00 H new ATOM 0 HB ILE A 26 -0.734 -3.343 9.399 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -2.877 -3.589 11.497 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -3.197 -2.492 10.169 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -0.528 -4.909 11.292 1.00 0.00 H new ATOM 0 HG22 ILE A 26 0.772 -3.694 11.230 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -0.549 -3.525 12.410 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -4.067 -4.751 9.669 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -2.764 -4.323 8.535 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -2.439 -5.437 9.885 1.00 0.00 H new ATOM 383 N GLY A 27 1.155 -1.042 11.765 1.00 0.00 N ATOM 384 CA GLY A 27 1.966 -0.510 12.864 1.00 0.00 C ATOM 385 C GLY A 27 1.785 0.988 13.117 1.00 0.00 C ATOM 386 O GLY A 27 2.024 1.439 14.234 1.00 0.00 O ATOM 0 H GLY A 27 1.714 -1.479 11.032 1.00 0.00 H new ATOM 0 HA2 GLY A 27 1.719 -1.052 13.777 1.00 0.00 H new ATOM 0 HA3 GLY A 27 3.017 -0.706 12.651 1.00 0.00 H new ATOM 390 N LYS A 28 1.290 1.756 12.140 1.00 0.00 N ATOM 391 CA LYS A 28 0.928 3.172 12.309 1.00 0.00 C ATOM 392 C LYS A 28 -0.188 3.396 13.357 1.00 0.00 C ATOM 393 O LYS A 28 -0.250 4.459 13.975 1.00 0.00 O ATOM 394 CB LYS A 28 0.525 3.719 10.920 1.00 0.00 C ATOM 395 CG LYS A 28 0.199 5.222 10.856 1.00 0.00 C ATOM 396 CD LYS A 28 1.375 6.147 11.204 1.00 0.00 C ATOM 397 CE LYS A 28 2.494 6.150 10.149 1.00 0.00 C ATOM 398 NZ LYS A 28 2.118 6.906 8.928 1.00 0.00 N ATOM 0 H LYS A 28 1.126 1.408 11.195 1.00 0.00 H new ATOM 0 HA LYS A 28 1.788 3.714 12.702 1.00 0.00 H new ATOM 0 HB2 LYS A 28 1.336 3.513 10.221 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -0.345 3.163 10.571 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -0.150 5.462 9.852 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -0.625 5.431 11.538 1.00 0.00 H new ATOM 0 HD2 LYS A 28 1.002 7.164 11.327 1.00 0.00 H new ATOM 0 HD3 LYS A 28 1.793 5.843 12.163 1.00 0.00 H new ATOM 0 HE2 LYS A 28 3.395 6.586 10.580 1.00 0.00 H new ATOM 0 HE3 LYS A 28 2.736 5.123 9.877 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 2.904 6.879 8.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 1.274 6.476 8.499 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 1.913 7.894 9.181 1.00 0.00 H new ATOM 412 N VAL A 29 -1.067 2.410 13.571 1.00 0.00 N ATOM 413 CA VAL A 29 -2.313 2.569 14.355 1.00 0.00 C ATOM 414 C VAL A 29 -2.100 2.474 15.888 1.00 0.00 C ATOM 415 O VAL A 29 -3.004 2.792 16.660 1.00 0.00 O ATOM 416 CB VAL A 29 -3.404 1.585 13.845 1.00 0.00 C ATOM 417 CG1 VAL A 29 -4.776 1.800 14.504 1.00 0.00 C ATOM 418 CG2 VAL A 29 -3.599 1.712 12.319 1.00 0.00 C ATOM 0 H VAL A 29 -0.939 1.467 13.204 1.00 0.00 H new ATOM 0 HA VAL A 29 -2.665 3.587 14.188 1.00 0.00 H new ATOM 0 HB VAL A 29 -3.036 0.595 14.114 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -5.489 1.080 14.102 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -4.688 1.661 15.581 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -5.125 2.811 14.296 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -4.368 1.012 11.991 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -3.906 2.729 12.075 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -2.661 1.485 11.812 1.00 0.00 H new ATOM 428 N ASN A 30 -0.921 2.028 16.350 1.00 0.00 N ATOM 429 CA ASN A 30 -0.517 1.819 17.759 1.00 0.00 C ATOM 430 C ASN A 30 -1.221 0.635 18.466 1.00 0.00 C ATOM 431 O ASN A 30 -0.699 0.073 19.431 1.00 0.00 O ATOM 432 CB ASN A 30 -0.720 3.113 18.566 1.00 0.00 C ATOM 433 CG ASN A 30 0.349 3.284 19.634 1.00 0.00 C ATOM 434 OD1 ASN A 30 1.441 3.765 19.356 1.00 0.00 O ATOM 435 ND2 ASN A 30 0.094 2.898 20.868 1.00 0.00 N ATOM 0 H ASN A 30 -0.168 1.785 15.707 1.00 0.00 H new ATOM 0 HA ASN A 30 0.539 1.552 17.723 1.00 0.00 H new ATOM 0 HB2 ASN A 30 -0.701 3.969 17.892 1.00 0.00 H new ATOM 0 HB3 ASN A 30 -1.704 3.099 19.035 1.00 0.00 H new ATOM 0 HD21 ASN A 30 0.806 3.000 21.592 1.00 0.00 H new ATOM 0 HD22 ASN A 30 -0.815 2.498 21.100 1.00 0.00 H new ATOM 442 N GLY A 31 -2.420 0.257 18.003 1.00 0.00 N ATOM 443 CA GLY A 31 -3.265 -0.773 18.611 1.00 0.00 C ATOM 444 C GLY A 31 -2.909 -2.198 18.209 1.00 0.00 C ATOM 445 O GLY A 31 -3.351 -3.123 18.874 1.00 0.00 O ATOM 0 H GLY A 31 -2.839 0.673 17.171 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -3.198 -0.687 19.696 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -4.303 -0.581 18.340 1.00 0.00 H new ATOM 449 N VAL A 32 -2.132 -2.409 17.149 1.00 0.00 N ATOM 450 CA VAL A 32 -1.597 -3.738 16.812 1.00 0.00 C ATOM 451 C VAL A 32 -0.495 -4.121 17.803 1.00 0.00 C ATOM 452 O VAL A 32 0.515 -3.432 17.932 1.00 0.00 O ATOM 453 CB VAL A 32 -1.161 -3.850 15.345 1.00 0.00 C ATOM 454 CG1 VAL A 32 -0.555 -5.227 15.039 1.00 0.00 C ATOM 455 CG2 VAL A 32 -2.435 -3.624 14.510 1.00 0.00 C ATOM 0 H VAL A 32 -1.854 -1.673 16.500 1.00 0.00 H new ATOM 0 HA VAL A 32 -2.402 -4.466 16.912 1.00 0.00 H new ATOM 0 HB VAL A 32 -0.387 -3.119 15.113 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -0.258 -5.269 13.991 1.00 0.00 H new ATOM 0 HG12 VAL A 32 0.319 -5.389 15.671 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -1.295 -6.002 15.238 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -2.192 -3.691 13.450 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -3.175 -4.384 14.762 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -2.842 -2.636 14.727 1.00 0.00 H new ATOM 465 N HIS A 33 -0.716 -5.229 18.506 1.00 0.00 N ATOM 466 CA HIS A 33 0.168 -5.778 19.536 1.00 0.00 C ATOM 467 C HIS A 33 1.270 -6.660 18.909 1.00 0.00 C ATOM 468 O HIS A 33 2.397 -6.694 19.411 1.00 0.00 O ATOM 469 CB HIS A 33 -0.726 -6.570 20.508 1.00 0.00 C ATOM 470 CG HIS A 33 -0.072 -7.036 21.788 1.00 0.00 C ATOM 471 ND1 HIS A 33 -0.448 -6.665 23.059 1.00 0.00 N ATOM 472 CD2 HIS A 33 0.905 -7.989 21.928 1.00 0.00 C ATOM 473 CE1 HIS A 33 0.286 -7.367 23.935 1.00 0.00 C ATOM 474 NE2 HIS A 33 1.136 -8.191 23.296 1.00 0.00 N ATOM 0 H HIS A 33 -1.553 -5.795 18.369 1.00 0.00 H new ATOM 0 HA HIS A 33 0.693 -4.986 20.069 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -1.583 -5.949 20.768 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -1.113 -7.444 19.983 1.00 0.00 H new ATOM 0 HD2 HIS A 33 1.411 -8.498 21.121 1.00 0.00 H new ATOM 0 HE1 HIS A 33 0.206 -7.282 25.009 1.00 0.00 H new ATOM 0 HE2 HIS A 33 1.809 -8.830 23.719 1.00 0.00 H new ATOM 482 N HIS A 34 0.952 -7.353 17.806 1.00 0.00 N ATOM 483 CA HIS A 34 1.898 -8.121 16.989 1.00 0.00 C ATOM 484 C HIS A 34 1.381 -8.319 15.546 1.00 0.00 C ATOM 485 O HIS A 34 0.221 -8.704 15.374 1.00 0.00 O ATOM 486 CB HIS A 34 2.137 -9.480 17.665 1.00 0.00 C ATOM 487 CG HIS A 34 3.211 -10.290 16.993 1.00 0.00 C ATOM 488 ND1 HIS A 34 3.053 -11.489 16.336 1.00 0.00 N ATOM 489 CD2 HIS A 34 4.536 -9.961 16.921 1.00 0.00 C ATOM 490 CE1 HIS A 34 4.255 -11.879 15.887 1.00 0.00 C ATOM 491 NE2 HIS A 34 5.196 -10.976 16.220 1.00 0.00 N ATOM 0 H HIS A 34 -0.002 -7.395 17.448 1.00 0.00 H new ATOM 0 HA HIS A 34 2.833 -7.566 16.917 1.00 0.00 H new ATOM 0 HB2 HIS A 34 2.411 -9.318 18.708 1.00 0.00 H new ATOM 0 HB3 HIS A 34 1.207 -10.048 17.664 1.00 0.00 H new ATOM 0 HD2 HIS A 34 4.993 -9.073 17.333 1.00 0.00 H new ATOM 0 HE1 HIS A 34 4.442 -12.789 15.336 1.00 0.00 H new ATOM 0 HE2 HIS A 34 6.192 -11.022 16.004 1.00 0.00 H new ATOM 499 N ILE A 35 2.220 -8.106 14.519 1.00 0.00 N ATOM 500 CA ILE A 35 1.913 -8.387 13.094 1.00 0.00 C ATOM 501 C ILE A 35 2.911 -9.395 12.486 1.00 0.00 C ATOM 502 O ILE A 35 4.134 -9.229 12.563 1.00 0.00 O ATOM 503 CB ILE A 35 1.813 -7.068 12.268 1.00 0.00 C ATOM 504 CG1 ILE A 35 1.412 -7.295 10.788 1.00 0.00 C ATOM 505 CG2 ILE A 35 3.032 -6.142 12.414 1.00 0.00 C ATOM 506 CD1 ILE A 35 2.536 -7.534 9.769 1.00 0.00 C ATOM 0 H ILE A 35 3.156 -7.724 14.653 1.00 0.00 H new ATOM 0 HA ILE A 35 0.933 -8.861 13.049 1.00 0.00 H new ATOM 0 HB ILE A 35 0.984 -6.528 12.725 1.00 0.00 H new ATOM 0 HG12 ILE A 35 0.739 -8.152 10.751 1.00 0.00 H new ATOM 0 HG13 ILE A 35 0.841 -6.427 10.459 1.00 0.00 H new ATOM 0 HG21 ILE A 35 2.884 -5.248 11.809 1.00 0.00 H new ATOM 0 HG22 ILE A 35 3.149 -5.857 13.460 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.928 -6.664 12.077 1.00 0.00 H new ATOM 0 HD11 ILE A 35 2.105 -7.676 8.778 1.00 0.00 H new ATOM 0 HD12 ILE A 35 3.203 -6.672 9.754 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.099 -8.424 10.051 1.00 0.00 H new ATOM 518 N LYS A 36 2.366 -10.425 11.833 1.00 0.00 N ATOM 519 CA LYS A 36 3.064 -11.463 11.054 1.00 0.00 C ATOM 520 C LYS A 36 2.448 -11.588 9.644 1.00 0.00 C ATOM 521 O LYS A 36 1.237 -11.439 9.478 1.00 0.00 O ATOM 522 CB LYS A 36 2.965 -12.790 11.842 1.00 0.00 C ATOM 523 CG LYS A 36 3.230 -14.073 11.026 1.00 0.00 C ATOM 524 CD LYS A 36 3.101 -15.315 11.920 1.00 0.00 C ATOM 525 CE LYS A 36 2.976 -16.587 11.071 1.00 0.00 C ATOM 526 NZ LYS A 36 2.762 -17.788 11.913 1.00 0.00 N ATOM 0 H LYS A 36 1.356 -10.570 11.832 1.00 0.00 H new ATOM 0 HA LYS A 36 4.113 -11.200 10.914 1.00 0.00 H new ATOM 0 HB2 LYS A 36 3.674 -12.754 12.669 1.00 0.00 H new ATOM 0 HB3 LYS A 36 1.969 -12.858 12.279 1.00 0.00 H new ATOM 0 HG2 LYS A 36 2.523 -14.138 10.199 1.00 0.00 H new ATOM 0 HG3 LYS A 36 4.228 -14.034 10.590 1.00 0.00 H new ATOM 0 HD2 LYS A 36 3.971 -15.391 12.572 1.00 0.00 H new ATOM 0 HD3 LYS A 36 2.228 -15.215 12.565 1.00 0.00 H new ATOM 0 HE2 LYS A 36 2.146 -16.479 10.373 1.00 0.00 H new ATOM 0 HE3 LYS A 36 3.879 -16.717 10.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 2.682 -18.628 11.305 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 3.566 -17.905 12.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 1.887 -17.675 12.464 1.00 0.00 H new ATOM 540 N VAL A 37 3.247 -11.920 8.629 1.00 0.00 N ATOM 541 CA VAL A 37 2.787 -12.118 7.239 1.00 0.00 C ATOM 542 C VAL A 37 3.489 -13.298 6.566 1.00 0.00 C ATOM 543 O VAL A 37 4.658 -13.575 6.825 1.00 0.00 O ATOM 544 CB VAL A 37 2.935 -10.841 6.379 1.00 0.00 C ATOM 545 CG1 VAL A 37 1.825 -9.835 6.707 1.00 0.00 C ATOM 546 CG2 VAL A 37 4.299 -10.147 6.522 1.00 0.00 C ATOM 0 H VAL A 37 4.250 -12.063 8.744 1.00 0.00 H new ATOM 0 HA VAL A 37 1.724 -12.349 7.307 1.00 0.00 H new ATOM 0 HB VAL A 37 2.854 -11.178 5.346 1.00 0.00 H new ATOM 0 HG11 VAL A 37 1.948 -8.944 6.091 1.00 0.00 H new ATOM 0 HG12 VAL A 37 0.854 -10.286 6.504 1.00 0.00 H new ATOM 0 HG13 VAL A 37 1.884 -9.559 7.760 1.00 0.00 H new ATOM 0 HG21 VAL A 37 4.324 -9.261 5.888 1.00 0.00 H new ATOM 0 HG22 VAL A 37 4.451 -9.855 7.561 1.00 0.00 H new ATOM 0 HG23 VAL A 37 5.090 -10.833 6.218 1.00 0.00 H new ATOM 556 N SER A 38 2.742 -14.016 5.724 1.00 0.00 N ATOM 557 CA SER A 38 3.162 -15.262 5.069 1.00 0.00 C ATOM 558 C SER A 38 2.939 -15.194 3.540 1.00 0.00 C ATOM 559 O SER A 38 1.803 -15.081 3.072 1.00 0.00 O ATOM 560 CB SER A 38 2.383 -16.442 5.681 1.00 0.00 C ATOM 561 OG SER A 38 2.339 -16.396 7.106 1.00 0.00 O ATOM 0 H SER A 38 1.794 -13.738 5.469 1.00 0.00 H new ATOM 0 HA SER A 38 4.230 -15.406 5.235 1.00 0.00 H new ATOM 0 HB2 SER A 38 1.365 -16.441 5.290 1.00 0.00 H new ATOM 0 HB3 SER A 38 2.844 -17.378 5.366 1.00 0.00 H new ATOM 0 HG SER A 38 1.833 -17.165 7.443 1.00 0.00 H new ATOM 567 N LEU A 39 4.025 -15.234 2.752 1.00 0.00 N ATOM 568 CA LEU A 39 4.038 -14.828 1.334 1.00 0.00 C ATOM 569 C LEU A 39 3.613 -15.897 0.308 1.00 0.00 C ATOM 570 O LEU A 39 3.046 -15.557 -0.729 1.00 0.00 O ATOM 571 CB LEU A 39 5.432 -14.256 0.991 1.00 0.00 C ATOM 572 CG LEU A 39 6.555 -15.284 0.719 1.00 0.00 C ATOM 573 CD1 LEU A 39 7.796 -14.563 0.167 1.00 0.00 C ATOM 574 CD2 LEU A 39 6.973 -16.090 1.956 1.00 0.00 C ATOM 0 H LEU A 39 4.934 -15.554 3.086 1.00 0.00 H new ATOM 0 HA LEU A 39 3.258 -14.072 1.241 1.00 0.00 H new ATOM 0 HB2 LEU A 39 5.332 -13.620 0.111 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.749 -13.615 1.814 1.00 0.00 H new ATOM 0 HG LEU A 39 6.145 -15.990 -0.004 1.00 0.00 H new ATOM 0 HD11 LEU A 39 8.585 -15.291 -0.023 1.00 0.00 H new ATOM 0 HD12 LEU A 39 7.538 -14.055 -0.763 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.145 -13.831 0.895 1.00 0.00 H new ATOM 0 HD21 LEU A 39 7.764 -16.789 1.685 1.00 0.00 H new ATOM 0 HD22 LEU A 39 7.338 -15.411 2.727 1.00 0.00 H new ATOM 0 HD23 LEU A 39 6.115 -16.644 2.337 1.00 0.00 H new ATOM 586 N GLU A 40 3.886 -17.179 0.562 1.00 0.00 N ATOM 587 CA GLU A 40 3.476 -18.290 -0.313 1.00 0.00 C ATOM 588 C GLU A 40 2.068 -18.770 0.062 1.00 0.00 C ATOM 589 O GLU A 40 1.318 -19.262 -0.788 1.00 0.00 O ATOM 590 CB GLU A 40 4.466 -19.466 -0.202 1.00 0.00 C ATOM 591 CG GLU A 40 5.801 -19.192 -0.905 1.00 0.00 C ATOM 592 CD GLU A 40 6.822 -20.289 -0.612 1.00 0.00 C ATOM 593 OE1 GLU A 40 6.672 -21.433 -1.102 1.00 0.00 O ATOM 594 OE2 GLU A 40 7.798 -20.013 0.123 1.00 0.00 O ATOM 0 H GLU A 40 4.403 -17.482 1.388 1.00 0.00 H new ATOM 0 HA GLU A 40 3.473 -17.927 -1.341 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.653 -19.679 0.851 1.00 0.00 H new ATOM 0 HB3 GLU A 40 4.011 -20.359 -0.632 1.00 0.00 H new ATOM 0 HG2 GLU A 40 5.639 -19.121 -1.981 1.00 0.00 H new ATOM 0 HG3 GLU A 40 6.195 -18.230 -0.578 1.00 0.00 H new ATOM 601 N GLU A 41 1.700 -18.604 1.331 1.00 0.00 N ATOM 602 CA GLU A 41 0.343 -18.865 1.840 1.00 0.00 C ATOM 603 C GLU A 41 -0.630 -17.712 1.548 1.00 0.00 C ATOM 604 O GLU A 41 -1.843 -17.923 1.580 1.00 0.00 O ATOM 605 CB GLU A 41 0.379 -19.152 3.350 1.00 0.00 C ATOM 606 CG GLU A 41 1.112 -20.466 3.636 1.00 0.00 C ATOM 607 CD GLU A 41 1.039 -20.864 5.105 1.00 0.00 C ATOM 608 OE1 GLU A 41 1.659 -20.208 5.972 1.00 0.00 O ATOM 609 OE2 GLU A 41 0.374 -21.879 5.410 1.00 0.00 O ATOM 0 H GLU A 41 2.344 -18.279 2.052 1.00 0.00 H new ATOM 0 HA GLU A 41 -0.027 -19.743 1.311 1.00 0.00 H new ATOM 0 HB2 GLU A 41 0.876 -18.332 3.869 1.00 0.00 H new ATOM 0 HB3 GLU A 41 -0.638 -19.205 3.739 1.00 0.00 H new ATOM 0 HG2 GLU A 41 0.681 -21.260 3.026 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.157 -20.368 3.340 1.00 0.00 H new ATOM 616 N LYS A 42 -0.105 -16.515 1.256 1.00 0.00 N ATOM 617 CA LYS A 42 -0.855 -15.295 0.929 1.00 0.00 C ATOM 618 C LYS A 42 -1.872 -14.931 2.021 1.00 0.00 C ATOM 619 O LYS A 42 -3.079 -14.815 1.787 1.00 0.00 O ATOM 620 CB LYS A 42 -1.447 -15.377 -0.487 1.00 0.00 C ATOM 621 CG LYS A 42 -0.332 -15.408 -1.542 1.00 0.00 C ATOM 622 CD LYS A 42 -0.901 -15.216 -2.953 1.00 0.00 C ATOM 623 CE LYS A 42 0.001 -14.281 -3.768 1.00 0.00 C ATOM 624 NZ LYS A 42 -0.749 -13.651 -4.873 1.00 0.00 N ATOM 0 H LYS A 42 0.904 -16.364 1.241 1.00 0.00 H new ATOM 0 HA LYS A 42 -0.159 -14.456 0.913 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -2.064 -16.271 -0.577 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -2.098 -14.521 -0.664 1.00 0.00 H new ATOM 0 HG2 LYS A 42 0.395 -14.624 -1.330 1.00 0.00 H new ATOM 0 HG3 LYS A 42 0.199 -16.358 -1.487 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -0.983 -16.181 -3.454 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -1.907 -14.801 -2.893 1.00 0.00 H new ATOM 0 HE2 LYS A 42 0.413 -13.510 -3.117 1.00 0.00 H new ATOM 0 HE3 LYS A 42 0.844 -14.843 -4.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -0.095 -13.104 -5.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -1.206 -14.388 -5.447 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -1.475 -13.016 -4.483 1.00 0.00 H new ATOM 638 N ASN A 43 -1.371 -14.771 3.247 1.00 0.00 N ATOM 639 CA ASN A 43 -2.170 -14.373 4.402 1.00 0.00 C ATOM 640 C ASN A 43 -1.348 -13.651 5.482 1.00 0.00 C ATOM 641 O ASN A 43 -0.116 -13.650 5.477 1.00 0.00 O ATOM 642 CB ASN A 43 -2.995 -15.560 4.944 1.00 0.00 C ATOM 643 CG ASN A 43 -2.179 -16.727 5.489 1.00 0.00 C ATOM 644 OD1 ASN A 43 -1.143 -16.564 6.123 1.00 0.00 O ATOM 645 ND2 ASN A 43 -2.658 -17.938 5.284 1.00 0.00 N ATOM 0 H ASN A 43 -0.386 -14.917 3.466 1.00 0.00 H new ATOM 0 HA ASN A 43 -2.886 -13.626 4.059 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -3.649 -15.195 5.736 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -3.637 -15.929 4.145 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -2.165 -18.751 5.655 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -3.521 -18.062 4.755 1.00 0.00 H new ATOM 652 N ALA A 44 -2.070 -12.997 6.385 1.00 0.00 N ATOM 653 CA ALA A 44 -1.573 -12.083 7.399 1.00 0.00 C ATOM 654 C ALA A 44 -2.158 -12.498 8.764 1.00 0.00 C ATOM 655 O ALA A 44 -3.378 -12.632 8.893 1.00 0.00 O ATOM 656 CB ALA A 44 -2.007 -10.678 6.938 1.00 0.00 C ATOM 0 H ALA A 44 -3.084 -13.100 6.428 1.00 0.00 H new ATOM 0 HA ALA A 44 -0.490 -12.098 7.520 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -1.664 -9.936 7.659 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -1.571 -10.464 5.962 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.094 -10.638 6.866 1.00 0.00 H new ATOM 662 N THR A 45 -1.301 -12.731 9.762 1.00 0.00 N ATOM 663 CA THR A 45 -1.659 -13.166 11.125 1.00 0.00 C ATOM 664 C THR A 45 -1.378 -12.013 12.080 1.00 0.00 C ATOM 665 O THR A 45 -0.349 -11.353 11.961 1.00 0.00 O ATOM 666 CB THR A 45 -0.855 -14.416 11.507 1.00 0.00 C ATOM 667 OG1 THR A 45 -1.257 -15.499 10.695 1.00 0.00 O ATOM 668 CG2 THR A 45 -1.089 -14.834 12.955 1.00 0.00 C ATOM 0 H THR A 45 -0.294 -12.618 9.642 1.00 0.00 H new ATOM 0 HA THR A 45 -2.715 -13.430 11.179 1.00 0.00 H new ATOM 0 HB THR A 45 0.198 -14.168 11.370 1.00 0.00 H new ATOM 0 HG1 THR A 45 -0.743 -16.298 10.937 1.00 0.00 H new ATOM 0 HG21 THR A 45 -0.498 -15.723 13.177 1.00 0.00 H new ATOM 0 HG22 THR A 45 -0.790 -14.024 13.620 1.00 0.00 H new ATOM 0 HG23 THR A 45 -2.146 -15.054 13.104 1.00 0.00 H new ATOM 676 N ILE A 46 -2.287 -11.720 13.011 1.00 0.00 N ATOM 677 CA ILE A 46 -2.229 -10.460 13.765 1.00 0.00 C ATOM 678 C ILE A 46 -2.932 -10.533 15.126 1.00 0.00 C ATOM 679 O ILE A 46 -3.997 -11.144 15.272 1.00 0.00 O ATOM 680 CB ILE A 46 -2.728 -9.308 12.850 1.00 0.00 C ATOM 681 CG1 ILE A 46 -2.428 -7.910 13.422 1.00 0.00 C ATOM 682 CG2 ILE A 46 -4.220 -9.443 12.495 1.00 0.00 C ATOM 683 CD1 ILE A 46 -2.743 -6.792 12.425 1.00 0.00 C ATOM 0 H ILE A 46 -3.066 -12.329 13.262 1.00 0.00 H new ATOM 0 HA ILE A 46 -1.194 -10.253 14.036 1.00 0.00 H new ATOM 0 HB ILE A 46 -2.155 -9.407 11.928 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -3.012 -7.759 14.330 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.377 -7.854 13.706 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -4.518 -8.613 11.854 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -4.386 -10.384 11.971 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -4.814 -9.427 13.409 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -2.514 -5.827 12.877 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -2.140 -6.925 11.527 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -3.800 -6.827 12.160 1.00 0.00 H new ATOM 695 N ILE A 47 -2.337 -9.868 16.118 1.00 0.00 N ATOM 696 CA ILE A 47 -2.962 -9.571 17.416 1.00 0.00 C ATOM 697 C ILE A 47 -3.197 -8.065 17.511 1.00 0.00 C ATOM 698 O ILE A 47 -2.237 -7.292 17.471 1.00 0.00 O ATOM 699 CB ILE A 47 -2.096 -10.045 18.609 1.00 0.00 C ATOM 700 CG1 ILE A 47 -1.695 -11.532 18.499 1.00 0.00 C ATOM 701 CG2 ILE A 47 -2.857 -9.784 19.925 1.00 0.00 C ATOM 702 CD1 ILE A 47 -0.838 -12.030 19.671 1.00 0.00 C ATOM 0 H ILE A 47 -1.384 -9.511 16.043 1.00 0.00 H new ATOM 0 HA ILE A 47 -3.905 -10.114 17.473 1.00 0.00 H new ATOM 0 HB ILE A 47 -1.168 -9.474 18.595 1.00 0.00 H new ATOM 0 HG12 ILE A 47 -2.598 -12.139 18.438 1.00 0.00 H new ATOM 0 HG13 ILE A 47 -1.146 -11.683 17.570 1.00 0.00 H new ATOM 0 HG21 ILE A 47 -2.251 -10.116 20.768 1.00 0.00 H new ATOM 0 HG22 ILE A 47 -3.060 -8.718 20.022 1.00 0.00 H new ATOM 0 HG23 ILE A 47 -3.798 -10.333 19.916 1.00 0.00 H new ATOM 0 HD11 ILE A 47 -0.596 -13.082 19.523 1.00 0.00 H new ATOM 0 HD12 ILE A 47 0.083 -11.449 19.721 1.00 0.00 H new ATOM 0 HD13 ILE A 47 -1.392 -11.912 20.602 1.00 0.00 H new ATOM 714 N TYR A 48 -4.448 -7.652 17.706 1.00 0.00 N ATOM 715 CA TYR A 48 -4.825 -6.266 17.987 1.00 0.00 C ATOM 716 C TYR A 48 -5.395 -6.087 19.404 1.00 0.00 C ATOM 717 O TYR A 48 -6.046 -6.970 19.957 1.00 0.00 O ATOM 718 CB TYR A 48 -5.786 -5.748 16.904 1.00 0.00 C ATOM 719 CG TYR A 48 -7.208 -6.299 16.900 1.00 0.00 C ATOM 720 CD1 TYR A 48 -7.501 -7.508 16.236 1.00 0.00 C ATOM 721 CD2 TYR A 48 -8.255 -5.560 17.489 1.00 0.00 C ATOM 722 CE1 TYR A 48 -8.828 -7.976 16.154 1.00 0.00 C ATOM 723 CE2 TYR A 48 -9.587 -6.012 17.399 1.00 0.00 C ATOM 724 CZ TYR A 48 -9.879 -7.220 16.726 1.00 0.00 C ATOM 725 OH TYR A 48 -11.168 -7.653 16.621 1.00 0.00 O ATOM 0 H TYR A 48 -5.247 -8.285 17.672 1.00 0.00 H new ATOM 0 HA TYR A 48 -3.919 -5.660 17.956 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -5.846 -4.664 16.999 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -5.341 -5.959 15.931 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -6.702 -8.080 15.787 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -8.035 -4.641 18.013 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -9.042 -8.910 15.656 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -10.384 -5.435 17.844 1.00 0.00 H new ATOM 0 HH TYR A 48 -11.764 -7.017 17.069 1.00 0.00 H new ATOM 735 N ASP A 49 -5.155 -4.919 19.992 1.00 0.00 N ATOM 736 CA ASP A 49 -5.788 -4.457 21.222 1.00 0.00 C ATOM 737 C ASP A 49 -7.179 -3.887 20.879 1.00 0.00 C ATOM 738 O ASP A 49 -7.260 -2.944 20.079 1.00 0.00 O ATOM 739 CB ASP A 49 -4.892 -3.390 21.870 1.00 0.00 C ATOM 740 CG ASP A 49 -5.294 -3.082 23.311 1.00 0.00 C ATOM 741 OD1 ASP A 49 -6.469 -2.730 23.566 1.00 0.00 O ATOM 742 OD2 ASP A 49 -4.404 -3.189 24.188 1.00 0.00 O ATOM 0 H ASP A 49 -4.491 -4.245 19.611 1.00 0.00 H new ATOM 0 HA ASP A 49 -5.914 -5.277 21.929 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -3.856 -3.730 21.850 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -4.939 -2.475 21.280 1.00 0.00 H new ATOM 747 N PRO A 50 -8.272 -4.418 21.458 1.00 0.00 N ATOM 748 CA PRO A 50 -9.631 -4.035 21.082 1.00 0.00 C ATOM 749 C PRO A 50 -9.980 -2.585 21.439 1.00 0.00 C ATOM 750 O PRO A 50 -11.005 -2.091 20.983 1.00 0.00 O ATOM 751 CB PRO A 50 -10.547 -5.036 21.795 1.00 0.00 C ATOM 752 CG PRO A 50 -9.733 -5.427 23.025 1.00 0.00 C ATOM 753 CD PRO A 50 -8.306 -5.449 22.486 1.00 0.00 C ATOM 0 HA PRO A 50 -9.750 -4.069 19.999 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -11.501 -4.586 22.068 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -10.769 -5.899 21.167 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -9.850 -4.706 23.834 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -10.033 -6.398 23.418 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -7.583 -5.242 23.275 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -8.056 -6.426 22.073 1.00 0.00 H new ATOM 761 N LYS A 51 -9.152 -1.875 22.214 1.00 0.00 N ATOM 762 CA LYS A 51 -9.398 -0.472 22.568 1.00 0.00 C ATOM 763 C LYS A 51 -8.835 0.541 21.554 1.00 0.00 C ATOM 764 O LYS A 51 -9.295 1.682 21.526 1.00 0.00 O ATOM 765 CB LYS A 51 -8.795 -0.215 23.951 1.00 0.00 C ATOM 766 CG LYS A 51 -9.396 -1.099 25.051 1.00 0.00 C ATOM 767 CD LYS A 51 -8.862 -0.686 26.428 1.00 0.00 C ATOM 768 CE LYS A 51 -7.329 -0.645 26.527 1.00 0.00 C ATOM 769 NZ LYS A 51 -6.719 -1.962 26.249 1.00 0.00 N ATOM 0 H LYS A 51 -8.294 -2.256 22.613 1.00 0.00 H new ATOM 0 HA LYS A 51 -10.477 -0.320 22.563 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -7.719 -0.383 23.907 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -8.943 0.832 24.215 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -10.483 -1.017 25.037 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -9.152 -2.144 24.859 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -9.257 0.299 26.677 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -9.244 -1.381 27.176 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -6.940 0.090 25.822 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -7.039 -0.315 27.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -5.751 -1.983 26.629 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -7.285 -2.709 26.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -6.691 -2.122 25.222 1.00 0.00 H new ATOM 783 N LEU A 52 -7.821 0.162 20.760 1.00 0.00 N ATOM 784 CA LEU A 52 -7.093 1.042 19.832 1.00 0.00 C ATOM 785 C LEU A 52 -7.249 0.630 18.351 1.00 0.00 C ATOM 786 O LEU A 52 -6.637 1.247 17.478 1.00 0.00 O ATOM 787 CB LEU A 52 -5.598 1.046 20.237 1.00 0.00 C ATOM 788 CG LEU A 52 -5.154 1.800 21.511 1.00 0.00 C ATOM 789 CD1 LEU A 52 -5.647 3.250 21.526 1.00 0.00 C ATOM 790 CD2 LEU A 52 -5.559 1.107 22.816 1.00 0.00 C ATOM 0 H LEU A 52 -7.474 -0.797 20.746 1.00 0.00 H new ATOM 0 HA LEU A 52 -7.521 2.041 19.909 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -5.287 0.007 20.348 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -5.035 1.459 19.400 1.00 0.00 H new ATOM 0 HG LEU A 52 -4.065 1.792 21.465 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -5.311 3.739 22.440 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -5.246 3.780 20.662 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -6.736 3.264 21.487 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -5.212 1.697 23.664 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -6.644 1.015 22.858 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.109 0.115 22.856 1.00 0.00 H new ATOM 802 N GLN A 53 -8.025 -0.416 18.050 1.00 0.00 N ATOM 803 CA GLN A 53 -8.124 -1.042 16.725 1.00 0.00 C ATOM 804 C GLN A 53 -9.533 -1.616 16.472 1.00 0.00 C ATOM 805 O GLN A 53 -10.354 -1.694 17.394 1.00 0.00 O ATOM 806 CB GLN A 53 -7.045 -2.149 16.623 1.00 0.00 C ATOM 807 CG GLN A 53 -5.789 -1.741 15.834 1.00 0.00 C ATOM 808 CD GLN A 53 -6.044 -1.637 14.331 1.00 0.00 C ATOM 809 OE1 GLN A 53 -7.174 -1.638 13.872 1.00 0.00 O ATOM 810 NE2 GLN A 53 -5.022 -1.553 13.507 1.00 0.00 N ATOM 0 H GLN A 53 -8.622 -0.866 18.744 1.00 0.00 H new ATOM 0 HA GLN A 53 -7.953 -0.288 15.957 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -6.747 -2.443 17.629 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -7.486 -3.027 16.152 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -5.428 -0.781 16.204 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -4.999 -2.470 16.015 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -4.070 -1.551 13.874 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -5.181 -1.490 12.502 1.00 0.00 H new ATOM 819 N THR A 54 -9.797 -2.034 15.223 1.00 0.00 N ATOM 820 CA THR A 54 -11.015 -2.743 14.778 1.00 0.00 C ATOM 821 C THR A 54 -10.715 -3.637 13.567 1.00 0.00 C ATOM 822 O THR A 54 -9.781 -3.339 12.823 1.00 0.00 O ATOM 823 CB THR A 54 -12.154 -1.791 14.369 1.00 0.00 C ATOM 824 OG1 THR A 54 -11.687 -0.865 13.420 1.00 0.00 O ATOM 825 CG2 THR A 54 -12.782 -1.043 15.535 1.00 0.00 C ATOM 0 H THR A 54 -9.139 -1.881 14.459 1.00 0.00 H new ATOM 0 HA THR A 54 -11.334 -3.331 15.638 1.00 0.00 H new ATOM 0 HB THR A 54 -12.935 -2.422 13.946 1.00 0.00 H new ATOM 0 HG1 THR A 54 -12.417 -0.264 13.163 1.00 0.00 H new ATOM 0 HG21 THR A 54 -13.575 -0.393 15.166 1.00 0.00 H new ATOM 0 HG22 THR A 54 -13.199 -1.758 16.244 1.00 0.00 H new ATOM 0 HG23 THR A 54 -12.022 -0.441 16.032 1.00 0.00 H new ATOM 833 N PRO A 55 -11.533 -4.676 13.297 1.00 0.00 N ATOM 834 CA PRO A 55 -11.510 -5.429 12.043 1.00 0.00 C ATOM 835 C PRO A 55 -11.626 -4.530 10.807 1.00 0.00 C ATOM 836 O PRO A 55 -10.939 -4.772 9.815 1.00 0.00 O ATOM 837 CB PRO A 55 -12.686 -6.407 12.129 1.00 0.00 C ATOM 838 CG PRO A 55 -12.838 -6.622 13.630 1.00 0.00 C ATOM 839 CD PRO A 55 -12.521 -5.245 14.198 1.00 0.00 C ATOM 0 HA PRO A 55 -10.556 -5.943 11.924 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -13.591 -5.991 11.686 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -12.475 -7.340 11.606 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -13.845 -6.947 13.893 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -12.151 -7.382 14.002 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -13.415 -4.623 14.244 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -12.131 -5.319 15.213 1.00 0.00 H new ATOM 847 N LYS A 56 -12.441 -3.467 10.871 1.00 0.00 N ATOM 848 CA LYS A 56 -12.484 -2.417 9.843 1.00 0.00 C ATOM 849 C LYS A 56 -11.094 -1.795 9.620 1.00 0.00 C ATOM 850 O LYS A 56 -10.586 -1.846 8.500 1.00 0.00 O ATOM 851 CB LYS A 56 -13.534 -1.354 10.224 1.00 0.00 C ATOM 852 CG LYS A 56 -13.664 -0.251 9.154 1.00 0.00 C ATOM 853 CD LYS A 56 -14.655 0.832 9.600 1.00 0.00 C ATOM 854 CE LYS A 56 -14.853 1.953 8.567 1.00 0.00 C ATOM 855 NZ LYS A 56 -13.640 2.786 8.367 1.00 0.00 N ATOM 0 H LYS A 56 -13.092 -3.311 11.641 1.00 0.00 H new ATOM 0 HA LYS A 56 -12.781 -2.866 8.895 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -14.501 -1.836 10.365 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -13.261 -0.902 11.178 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -12.688 0.198 8.969 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -13.997 -0.689 8.213 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -15.619 0.367 9.807 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -14.305 1.269 10.535 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -15.144 1.512 7.614 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -15.676 2.592 8.887 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -13.913 3.788 8.306 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -12.991 2.652 9.168 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -13.166 2.503 7.486 1.00 0.00 H new ATOM 869 N THR A 57 -10.457 -1.243 10.660 1.00 0.00 N ATOM 870 CA THR A 57 -9.145 -0.570 10.563 1.00 0.00 C ATOM 871 C THR A 57 -8.021 -1.529 10.157 1.00 0.00 C ATOM 872 O THR A 57 -7.120 -1.124 9.427 1.00 0.00 O ATOM 873 CB THR A 57 -8.868 0.190 11.860 1.00 0.00 C ATOM 874 OG1 THR A 57 -9.855 1.193 11.930 1.00 0.00 O ATOM 875 CG2 THR A 57 -7.512 0.893 11.901 1.00 0.00 C ATOM 0 H THR A 57 -10.838 -1.248 11.606 1.00 0.00 H new ATOM 0 HA THR A 57 -9.179 0.159 9.753 1.00 0.00 H new ATOM 0 HB THR A 57 -8.874 -0.527 12.681 1.00 0.00 H new ATOM 0 HG1 THR A 57 -10.642 0.846 12.400 1.00 0.00 H new ATOM 0 HG21 THR A 57 -7.397 1.407 12.855 1.00 0.00 H new ATOM 0 HG22 THR A 57 -6.717 0.156 11.788 1.00 0.00 H new ATOM 0 HG23 THR A 57 -7.453 1.618 11.089 1.00 0.00 H new ATOM 883 N LEU A 58 -8.122 -2.818 10.495 1.00 0.00 N ATOM 884 CA LEU A 58 -7.253 -3.889 9.993 1.00 0.00 C ATOM 885 C LEU A 58 -7.319 -3.973 8.460 1.00 0.00 C ATOM 886 O LEU A 58 -6.303 -3.840 7.785 1.00 0.00 O ATOM 887 CB LEU A 58 -7.683 -5.205 10.690 1.00 0.00 C ATOM 888 CG LEU A 58 -6.690 -5.774 11.724 1.00 0.00 C ATOM 889 CD1 LEU A 58 -6.286 -4.765 12.808 1.00 0.00 C ATOM 890 CD2 LEU A 58 -7.315 -6.998 12.414 1.00 0.00 C ATOM 0 H LEU A 58 -8.832 -3.156 11.145 1.00 0.00 H new ATOM 0 HA LEU A 58 -6.208 -3.690 10.229 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -8.638 -5.035 11.187 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -7.853 -5.961 9.923 1.00 0.00 H new ATOM 0 HG LEU A 58 -5.789 -6.038 11.170 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -5.587 -5.235 13.500 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -5.811 -3.901 12.342 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -7.173 -4.442 13.353 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -6.614 -7.401 13.145 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -8.235 -6.701 12.918 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -7.540 -7.761 11.668 1.00 0.00 H new ATOM 902 N GLN A 59 -8.520 -4.143 7.908 1.00 0.00 N ATOM 903 CA GLN A 59 -8.790 -4.130 6.463 1.00 0.00 C ATOM 904 C GLN A 59 -8.430 -2.790 5.787 1.00 0.00 C ATOM 905 O GLN A 59 -7.963 -2.795 4.647 1.00 0.00 O ATOM 906 CB GLN A 59 -10.276 -4.469 6.229 1.00 0.00 C ATOM 907 CG GLN A 59 -10.653 -5.876 6.716 1.00 0.00 C ATOM 908 CD GLN A 59 -12.167 -6.096 6.741 1.00 0.00 C ATOM 909 OE1 GLN A 59 -12.818 -6.300 5.723 1.00 0.00 O ATOM 910 NE2 GLN A 59 -12.787 -6.044 7.899 1.00 0.00 N ATOM 0 H GLN A 59 -9.359 -4.298 8.467 1.00 0.00 H new ATOM 0 HA GLN A 59 -8.148 -4.881 6.002 1.00 0.00 H new ATOM 0 HB2 GLN A 59 -10.896 -3.734 6.743 1.00 0.00 H new ATOM 0 HB3 GLN A 59 -10.499 -4.387 5.165 1.00 0.00 H new ATOM 0 HG2 GLN A 59 -10.191 -6.619 6.066 1.00 0.00 H new ATOM 0 HG3 GLN A 59 -10.249 -6.032 7.716 1.00 0.00 H new ATOM 0 HE21 GLN A 59 -12.257 -5.875 8.754 1.00 0.00 H new ATOM 0 HE22 GLN A 59 -13.798 -6.173 7.942 1.00 0.00 H new ATOM 919 N GLU A 60 -8.622 -1.647 6.454 1.00 0.00 N ATOM 920 CA GLU A 60 -8.292 -0.312 5.926 1.00 0.00 C ATOM 921 C GLU A 60 -6.791 -0.073 5.809 1.00 0.00 C ATOM 922 O GLU A 60 -6.362 0.675 4.931 1.00 0.00 O ATOM 923 CB GLU A 60 -8.834 0.787 6.848 1.00 0.00 C ATOM 924 CG GLU A 60 -10.357 0.874 6.840 1.00 0.00 C ATOM 925 CD GLU A 60 -10.876 1.839 5.777 1.00 0.00 C ATOM 926 OE1 GLU A 60 -10.382 1.815 4.623 1.00 0.00 O ATOM 927 OE2 GLU A 60 -11.791 2.630 6.103 1.00 0.00 O ATOM 0 H GLU A 60 -9.018 -1.620 7.394 1.00 0.00 H new ATOM 0 HA GLU A 60 -8.748 -0.275 4.937 1.00 0.00 H new ATOM 0 HB2 GLU A 60 -8.492 0.601 7.866 1.00 0.00 H new ATOM 0 HB3 GLU A 60 -8.419 1.747 6.542 1.00 0.00 H new ATOM 0 HG2 GLU A 60 -10.774 -0.117 6.663 1.00 0.00 H new ATOM 0 HG3 GLU A 60 -10.706 1.196 7.821 1.00 0.00 H new ATOM 934 N ALA A 61 -5.999 -0.670 6.698 1.00 0.00 N ATOM 935 CA ALA A 61 -4.540 -0.620 6.622 1.00 0.00 C ATOM 936 C ALA A 61 -3.980 -1.434 5.440 1.00 0.00 C ATOM 937 O ALA A 61 -2.933 -1.081 4.901 1.00 0.00 O ATOM 938 CB ALA A 61 -3.977 -1.101 7.960 1.00 0.00 C ATOM 0 H ALA A 61 -6.352 -1.203 7.493 1.00 0.00 H new ATOM 0 HA ALA A 61 -4.228 0.407 6.435 1.00 0.00 H new ATOM 0 HB1 ALA A 61 -2.888 -1.073 7.928 1.00 0.00 H new ATOM 0 HB2 ALA A 61 -4.333 -0.451 8.759 1.00 0.00 H new ATOM 0 HB3 ALA A 61 -4.308 -2.122 8.148 1.00 0.00 H new ATOM 944 N ILE A 62 -4.660 -2.508 5.017 1.00 0.00 N ATOM 945 CA ILE A 62 -4.325 -3.215 3.767 1.00 0.00 C ATOM 946 C ILE A 62 -4.755 -2.413 2.535 1.00 0.00 C ATOM 947 O ILE A 62 -3.977 -2.249 1.599 1.00 0.00 O ATOM 948 CB ILE A 62 -4.892 -4.654 3.716 1.00 0.00 C ATOM 949 CG1 ILE A 62 -4.834 -5.448 5.040 1.00 0.00 C ATOM 950 CG2 ILE A 62 -4.139 -5.411 2.608 1.00 0.00 C ATOM 951 CD1 ILE A 62 -3.466 -5.496 5.729 1.00 0.00 C ATOM 0 H ILE A 62 -5.449 -2.910 5.523 1.00 0.00 H new ATOM 0 HA ILE A 62 -3.239 -3.306 3.754 1.00 0.00 H new ATOM 0 HB ILE A 62 -5.959 -4.563 3.513 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -5.554 -5.014 5.734 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -5.157 -6.470 4.843 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -4.515 -6.432 2.545 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -4.294 -4.908 1.654 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -3.074 -5.430 2.840 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -3.541 -6.078 6.647 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.739 -5.961 5.063 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -3.143 -4.483 5.967 1.00 0.00 H new ATOM 963 N ASP A 63 -5.986 -1.898 2.532 1.00 0.00 N ATOM 964 CA ASP A 63 -6.538 -1.136 1.402 1.00 0.00 C ATOM 965 C ASP A 63 -5.906 0.260 1.224 1.00 0.00 C ATOM 966 O ASP A 63 -6.197 0.957 0.253 1.00 0.00 O ATOM 967 CB ASP A 63 -8.066 -1.083 1.528 1.00 0.00 C ATOM 968 CG ASP A 63 -8.762 -0.771 0.200 1.00 0.00 C ATOM 969 OD1 ASP A 63 -8.829 -1.686 -0.657 1.00 0.00 O ATOM 970 OD2 ASP A 63 -9.259 0.368 0.025 1.00 0.00 O ATOM 0 H ASP A 63 -6.633 -1.996 3.314 1.00 0.00 H new ATOM 0 HA ASP A 63 -6.275 -1.662 0.484 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -8.428 -2.039 1.906 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -8.339 -0.325 2.263 1.00 0.00 H new ATOM 975 N ASP A 64 -5.007 0.658 2.129 1.00 0.00 N ATOM 976 CA ASP A 64 -4.136 1.827 1.991 1.00 0.00 C ATOM 977 C ASP A 64 -3.197 1.687 0.779 1.00 0.00 C ATOM 978 O ASP A 64 -3.011 2.652 0.039 1.00 0.00 O ATOM 979 CB ASP A 64 -3.335 2.028 3.297 1.00 0.00 C ATOM 980 CG ASP A 64 -3.391 3.471 3.803 1.00 0.00 C ATOM 981 OD1 ASP A 64 -4.513 4.026 3.879 1.00 0.00 O ATOM 982 OD2 ASP A 64 -2.348 4.015 4.233 1.00 0.00 O ATOM 0 H ASP A 64 -4.861 0.158 3.006 1.00 0.00 H new ATOM 0 HA ASP A 64 -4.754 2.707 1.815 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -3.726 1.362 4.066 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -2.296 1.745 3.129 1.00 0.00 H new ATOM 987 N MET A 65 -2.675 0.475 0.532 1.00 0.00 N ATOM 988 CA MET A 65 -1.857 0.167 -0.647 1.00 0.00 C ATOM 989 C MET A 65 -2.737 -0.318 -1.815 1.00 0.00 C ATOM 990 O MET A 65 -3.458 0.489 -2.399 1.00 0.00 O ATOM 991 CB MET A 65 -0.626 -0.686 -0.256 1.00 0.00 C ATOM 992 CG MET A 65 -0.874 -2.130 0.203 1.00 0.00 C ATOM 993 SD MET A 65 0.388 -2.785 1.318 1.00 0.00 S ATOM 994 CE MET A 65 -0.306 -2.245 2.900 1.00 0.00 C ATOM 0 H MET A 65 -2.811 -0.324 1.151 1.00 0.00 H new ATOM 0 HA MET A 65 -1.399 1.068 -1.056 1.00 0.00 H new ATOM 0 HB2 MET A 65 0.046 -0.718 -1.114 1.00 0.00 H new ATOM 0 HB3 MET A 65 -0.098 -0.166 0.543 1.00 0.00 H new ATOM 0 HG2 MET A 65 -1.842 -2.179 0.701 1.00 0.00 H new ATOM 0 HG3 MET A 65 -0.934 -2.772 -0.675 1.00 0.00 H new ATOM 0 HE1 MET A 65 0.432 -2.388 3.689 1.00 0.00 H new ATOM 0 HE2 MET A 65 -0.572 -1.190 2.839 1.00 0.00 H new ATOM 0 HE3 MET A 65 -1.197 -2.831 3.126 1.00 0.00 H new ATOM 1004 N GLY A 66 -2.676 -1.591 -2.215 1.00 0.00 N ATOM 1005 CA GLY A 66 -3.524 -2.149 -3.276 1.00 0.00 C ATOM 1006 C GLY A 66 -3.629 -3.668 -3.268 1.00 0.00 C ATOM 1007 O GLY A 66 -3.302 -4.290 -4.279 1.00 0.00 O ATOM 0 H GLY A 66 -2.032 -2.270 -1.809 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -4.525 -1.728 -3.183 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -3.133 -1.830 -4.242 1.00 0.00 H new ATOM 1011 N PHE A 67 -4.087 -4.255 -2.157 1.00 0.00 N ATOM 1012 CA PHE A 67 -4.356 -5.693 -2.030 1.00 0.00 C ATOM 1013 C PHE A 67 -5.777 -5.940 -1.498 1.00 0.00 C ATOM 1014 O PHE A 67 -6.330 -5.114 -0.769 1.00 0.00 O ATOM 1015 CB PHE A 67 -3.314 -6.365 -1.113 1.00 0.00 C ATOM 1016 CG PHE A 67 -1.847 -6.112 -1.427 1.00 0.00 C ATOM 1017 CD1 PHE A 67 -1.370 -6.196 -2.748 1.00 0.00 C ATOM 1018 CD2 PHE A 67 -0.942 -5.818 -0.387 1.00 0.00 C ATOM 1019 CE1 PHE A 67 -0.016 -5.960 -3.036 1.00 0.00 C ATOM 1020 CE2 PHE A 67 0.419 -5.596 -0.674 1.00 0.00 C ATOM 1021 CZ PHE A 67 0.880 -5.653 -2.000 1.00 0.00 C ATOM 0 H PHE A 67 -4.285 -3.734 -1.303 1.00 0.00 H new ATOM 0 HA PHE A 67 -4.280 -6.138 -3.022 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -3.502 -6.037 -0.091 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -3.485 -7.441 -1.139 1.00 0.00 H new ATOM 0 HD1 PHE A 67 -2.052 -6.444 -3.548 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -1.293 -5.763 0.633 1.00 0.00 H new ATOM 0 HE1 PHE A 67 0.336 -6.015 -4.055 1.00 0.00 H new ATOM 0 HE2 PHE A 67 1.110 -5.381 0.128 1.00 0.00 H new ATOM 0 HZ PHE A 67 1.920 -5.461 -2.221 1.00 0.00 H new ATOM 1031 N ASP A 68 -6.359 -7.089 -1.845 1.00 0.00 N ATOM 1032 CA ASP A 68 -7.647 -7.567 -1.335 1.00 0.00 C ATOM 1033 C ASP A 68 -7.455 -8.313 -0.005 1.00 0.00 C ATOM 1034 O ASP A 68 -6.468 -9.032 0.181 1.00 0.00 O ATOM 1035 CB ASP A 68 -8.342 -8.457 -2.378 1.00 0.00 C ATOM 1036 CG ASP A 68 -8.675 -7.698 -3.664 1.00 0.00 C ATOM 1037 OD1 ASP A 68 -9.497 -6.749 -3.630 1.00 0.00 O ATOM 1038 OD2 ASP A 68 -8.122 -8.039 -4.733 1.00 0.00 O ATOM 0 H ASP A 68 -5.934 -7.734 -2.511 1.00 0.00 H new ATOM 0 HA ASP A 68 -8.290 -6.707 -1.147 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -7.698 -9.304 -2.616 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -9.259 -8.863 -1.951 1.00 0.00 H new ATOM 1043 N ALA A 69 -8.392 -8.110 0.925 1.00 0.00 N ATOM 1044 CA ALA A 69 -8.235 -8.462 2.335 1.00 0.00 C ATOM 1045 C ALA A 69 -9.588 -8.666 3.033 1.00 0.00 C ATOM 1046 O ALA A 69 -10.376 -7.723 3.146 1.00 0.00 O ATOM 1047 CB ALA A 69 -7.425 -7.344 3.000 1.00 0.00 C ATOM 0 H ALA A 69 -9.296 -7.689 0.713 1.00 0.00 H new ATOM 0 HA ALA A 69 -7.712 -9.415 2.422 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -7.288 -7.573 4.057 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -6.451 -7.263 2.517 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -7.959 -6.399 2.900 1.00 0.00 H new ATOM 1053 N VAL A 70 -9.825 -9.875 3.539 1.00 0.00 N ATOM 1054 CA VAL A 70 -11.056 -10.367 4.165 1.00 0.00 C ATOM 1055 C VAL A 70 -10.651 -11.035 5.475 1.00 0.00 C ATOM 1056 O VAL A 70 -9.620 -11.716 5.529 1.00 0.00 O ATOM 1057 CB VAL A 70 -11.753 -11.422 3.266 1.00 0.00 C ATOM 1058 CG1 VAL A 70 -13.141 -11.790 3.815 1.00 0.00 C ATOM 1059 CG2 VAL A 70 -11.928 -10.913 1.820 1.00 0.00 C ATOM 0 H VAL A 70 -9.104 -10.596 3.521 1.00 0.00 H new ATOM 0 HA VAL A 70 -11.749 -9.540 4.321 1.00 0.00 H new ATOM 0 HB VAL A 70 -11.107 -12.300 3.267 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -13.605 -12.531 3.164 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -13.038 -12.202 4.819 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -13.766 -10.898 3.852 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -12.420 -11.680 1.221 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -12.537 -10.009 1.824 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -10.951 -10.690 1.392 1.00 0.00 H new ATOM 1069 N ILE A 71 -11.433 -10.834 6.536 1.00 0.00 N ATOM 1070 CA ILE A 71 -11.121 -11.417 7.845 1.00 0.00 C ATOM 1071 C ILE A 71 -11.408 -12.925 7.856 1.00 0.00 C ATOM 1072 O ILE A 71 -12.415 -13.383 7.309 1.00 0.00 O ATOM 1073 CB ILE A 71 -11.898 -10.687 8.970 1.00 0.00 C ATOM 1074 CG1 ILE A 71 -11.690 -9.154 9.005 1.00 0.00 C ATOM 1075 CG2 ILE A 71 -11.578 -11.277 10.356 1.00 0.00 C ATOM 1076 CD1 ILE A 71 -10.257 -8.659 9.221 1.00 0.00 C ATOM 0 H ILE A 71 -12.285 -10.274 6.517 1.00 0.00 H new ATOM 0 HA ILE A 71 -10.056 -11.282 8.034 1.00 0.00 H new ATOM 0 HB ILE A 71 -12.947 -10.857 8.725 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -12.055 -8.740 8.065 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -12.315 -8.744 9.798 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -12.141 -10.740 11.119 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -11.855 -12.331 10.376 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -10.511 -11.178 10.556 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -10.245 -7.569 9.225 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -9.884 -9.030 10.176 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -9.620 -9.025 8.416 1.00 0.00 H new ATOM 1088 N HIS A 72 -10.543 -13.708 8.502 1.00 0.00 N ATOM 1089 CA HIS A 72 -10.736 -15.146 8.669 1.00 0.00 C ATOM 1090 C HIS A 72 -10.010 -15.698 9.923 1.00 0.00 C ATOM 1091 O HIS A 72 -9.414 -14.942 10.693 1.00 0.00 O ATOM 1092 CB HIS A 72 -10.331 -15.849 7.355 1.00 0.00 C ATOM 1093 CG HIS A 72 -10.984 -17.199 7.238 1.00 0.00 C ATOM 1094 ND1 HIS A 72 -10.374 -18.424 7.364 1.00 0.00 N ATOM 1095 CD2 HIS A 72 -12.333 -17.416 7.209 1.00 0.00 C ATOM 1096 CE1 HIS A 72 -11.336 -19.357 7.434 1.00 0.00 C ATOM 1097 NE2 HIS A 72 -12.555 -18.791 7.366 1.00 0.00 N ATOM 0 H HIS A 72 -9.684 -13.358 8.926 1.00 0.00 H new ATOM 0 HA HIS A 72 -11.788 -15.357 8.860 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -10.616 -15.229 6.505 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -9.247 -15.962 7.318 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -13.095 -16.660 7.087 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -11.156 -20.417 7.532 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -13.456 -19.266 7.418 1.00 0.00 H new ATOM 1105 N ASN A 73 -10.070 -17.014 10.167 1.00 0.00 N ATOM 1106 CA ASN A 73 -9.329 -17.719 11.232 1.00 0.00 C ATOM 1107 C ASN A 73 -8.420 -18.804 10.632 1.00 0.00 C ATOM 1108 O ASN A 73 -8.818 -19.992 10.554 1.00 0.00 O ATOM 1109 CB ASN A 73 -10.329 -18.252 12.293 1.00 0.00 C ATOM 1110 CG ASN A 73 -10.995 -17.213 13.194 1.00 0.00 C ATOM 1111 OD1 ASN A 73 -11.753 -17.550 14.099 1.00 0.00 O ATOM 1112 ND2 ASN A 73 -10.755 -15.936 13.023 1.00 0.00 N ATOM 1113 OXT ASN A 73 -7.312 -18.428 10.179 1.00 0.00 O ATOM 0 H ASN A 73 -10.653 -17.641 9.613 1.00 0.00 H new ATOM 0 HA ASN A 73 -8.660 -17.030 11.748 1.00 0.00 H new ATOM 0 HB2 ASN A 73 -11.113 -18.804 11.774 1.00 0.00 H new ATOM 0 HB3 ASN A 73 -9.803 -18.965 12.928 1.00 0.00 H new ATOM 0 HD21 ASN A 73 -11.194 -15.248 13.635 1.00 0.00 H new ATOM 0 HD22 ASN A 73 -10.129 -15.630 12.278 1.00 0.00 H new ATOM 1121 N MET B 74 -2.389 16.878 -21.021 1.00 0.00 N ATOM 1122 CA MET B 74 -1.223 17.361 -21.794 1.00 0.00 C ATOM 1123 C MET B 74 0.068 17.409 -20.958 1.00 0.00 C ATOM 1124 O MET B 74 0.988 16.692 -21.364 1.00 0.00 O ATOM 1125 CB MET B 74 -1.488 18.665 -22.566 1.00 0.00 C ATOM 1126 CG MET B 74 -2.423 18.498 -23.768 1.00 0.00 C ATOM 1127 SD MET B 74 -2.870 20.064 -24.581 1.00 0.00 S ATOM 1128 CE MET B 74 -1.242 20.670 -25.117 1.00 0.00 C ATOM 0 HA MET B 74 -1.058 16.607 -22.563 1.00 0.00 H new ATOM 0 HB2 MET B 74 -1.918 19.398 -21.884 1.00 0.00 H new ATOM 0 HB3 MET B 74 -0.537 19.070 -22.912 1.00 0.00 H new ATOM 0 HG2 MET B 74 -1.946 17.845 -24.498 1.00 0.00 H new ATOM 0 HG3 MET B 74 -3.334 17.998 -23.440 1.00 0.00 H new ATOM 0 HE1 MET B 74 -1.373 21.514 -25.794 1.00 0.00 H new ATOM 0 HE2 MET B 74 -0.668 20.988 -24.247 1.00 0.00 H new ATOM 0 HE3 MET B 74 -0.708 19.871 -25.632 1.00 0.00 H new ATOM 1140 N PRO B 75 0.205 18.178 -19.844 1.00 0.00 N ATOM 1141 CA PRO B 75 1.406 18.138 -19.004 1.00 0.00 C ATOM 1142 C PRO B 75 1.712 16.727 -18.501 1.00 0.00 C ATOM 1143 O PRO B 75 0.800 16.005 -18.098 1.00 0.00 O ATOM 1144 CB PRO B 75 1.157 19.081 -17.821 1.00 0.00 C ATOM 1145 CG PRO B 75 0.109 20.048 -18.352 1.00 0.00 C ATOM 1146 CD PRO B 75 -0.710 19.183 -19.307 1.00 0.00 C ATOM 0 HA PRO B 75 2.272 18.449 -19.589 1.00 0.00 H new ATOM 0 HB2 PRO B 75 0.797 18.540 -16.946 1.00 0.00 H new ATOM 0 HB3 PRO B 75 2.068 19.600 -17.523 1.00 0.00 H new ATOM 0 HG2 PRO B 75 -0.506 20.456 -17.550 1.00 0.00 H new ATOM 0 HG3 PRO B 75 0.565 20.894 -18.866 1.00 0.00 H new ATOM 0 HD2 PRO B 75 -1.542 18.711 -18.786 1.00 0.00 H new ATOM 0 HD3 PRO B 75 -1.137 19.787 -20.108 1.00 0.00 H new ATOM 1154 N LYS B 76 2.993 16.347 -18.505 1.00 0.00 N ATOM 1155 CA LYS B 76 3.448 15.033 -18.045 1.00 0.00 C ATOM 1156 C LYS B 76 4.472 15.156 -16.906 1.00 0.00 C ATOM 1157 O LYS B 76 5.420 15.942 -16.987 1.00 0.00 O ATOM 1158 CB LYS B 76 4.008 14.248 -19.243 1.00 0.00 C ATOM 1159 CG LYS B 76 4.074 12.763 -18.882 1.00 0.00 C ATOM 1160 CD LYS B 76 4.757 11.911 -19.945 1.00 0.00 C ATOM 1161 CE LYS B 76 4.676 10.468 -19.440 1.00 0.00 C ATOM 1162 NZ LYS B 76 5.725 9.615 -20.036 1.00 0.00 N ATOM 0 H LYS B 76 3.750 16.949 -18.831 1.00 0.00 H new ATOM 0 HA LYS B 76 2.602 14.484 -17.631 1.00 0.00 H new ATOM 0 HB2 LYS B 76 3.374 14.394 -20.118 1.00 0.00 H new ATOM 0 HB3 LYS B 76 5.000 14.616 -19.503 1.00 0.00 H new ATOM 0 HG2 LYS B 76 4.607 12.650 -17.938 1.00 0.00 H new ATOM 0 HG3 LYS B 76 3.062 12.390 -18.723 1.00 0.00 H new ATOM 0 HD2 LYS B 76 4.260 12.016 -20.909 1.00 0.00 H new ATOM 0 HD3 LYS B 76 5.793 12.218 -20.086 1.00 0.00 H new ATOM 0 HE2 LYS B 76 4.773 10.458 -18.354 1.00 0.00 H new ATOM 0 HE3 LYS B 76 3.695 10.055 -19.676 1.00 0.00 H new ATOM 0 HZ1 LYS B 76 5.635 8.646 -19.668 1.00 0.00 H new ATOM 0 HZ2 LYS B 76 5.617 9.604 -21.070 1.00 0.00 H new ATOM 0 HZ3 LYS B 76 6.662 9.993 -19.790 1.00 0.00 H new ATOM 1176 N HIS B 77 4.297 14.365 -15.853 1.00 0.00 N ATOM 1177 CA HIS B 77 4.941 14.547 -14.554 1.00 0.00 C ATOM 1178 C HIS B 77 5.510 13.210 -14.013 1.00 0.00 C ATOM 1179 O HIS B 77 4.907 12.153 -14.217 1.00 0.00 O ATOM 1180 CB HIS B 77 3.942 15.228 -13.581 1.00 0.00 C ATOM 1181 CG HIS B 77 2.507 15.387 -14.057 1.00 0.00 C ATOM 1182 ND1 HIS B 77 1.895 16.547 -14.479 1.00 0.00 N ATOM 1183 CD2 HIS B 77 1.577 14.391 -14.186 1.00 0.00 C ATOM 1184 CE1 HIS B 77 0.637 16.252 -14.845 1.00 0.00 C ATOM 1185 NE2 HIS B 77 0.386 14.943 -14.675 1.00 0.00 N ATOM 0 H HIS B 77 3.682 13.551 -15.880 1.00 0.00 H new ATOM 0 HA HIS B 77 5.803 15.206 -14.658 1.00 0.00 H new ATOM 0 HB2 HIS B 77 3.929 14.654 -12.654 1.00 0.00 H new ATOM 0 HB3 HIS B 77 4.329 16.218 -13.338 1.00 0.00 H new ATOM 0 HD1 HIS B 77 2.324 17.472 -14.508 1.00 0.00 H new ATOM 0 HD2 HIS B 77 1.736 13.349 -13.949 1.00 0.00 H new ATOM 0 HE1 HIS B 77 -0.076 16.969 -15.224 1.00 0.00 H new ATOM 1193 N GLU B 78 6.669 13.243 -13.340 1.00 0.00 N ATOM 1194 CA GLU B 78 7.399 12.052 -12.871 1.00 0.00 C ATOM 1195 C GLU B 78 7.664 12.088 -11.358 1.00 0.00 C ATOM 1196 O GLU B 78 7.891 13.147 -10.775 1.00 0.00 O ATOM 1197 CB GLU B 78 8.747 11.884 -13.603 1.00 0.00 C ATOM 1198 CG GLU B 78 8.630 11.862 -15.135 1.00 0.00 C ATOM 1199 CD GLU B 78 9.882 11.340 -15.854 1.00 0.00 C ATOM 1200 OE1 GLU B 78 10.957 11.158 -15.231 1.00 0.00 O ATOM 1201 OE2 GLU B 78 9.804 11.065 -17.076 1.00 0.00 O ATOM 0 H GLU B 78 7.137 14.117 -13.100 1.00 0.00 H new ATOM 0 HA GLU B 78 6.753 11.204 -13.096 1.00 0.00 H new ATOM 0 HB2 GLU B 78 9.410 12.698 -13.312 1.00 0.00 H new ATOM 0 HB3 GLU B 78 9.215 10.957 -13.272 1.00 0.00 H new ATOM 0 HG2 GLU B 78 7.779 11.241 -15.414 1.00 0.00 H new ATOM 0 HG3 GLU B 78 8.417 12.872 -15.487 1.00 0.00 H new ATOM 1208 N PHE B 79 7.672 10.909 -10.730 1.00 0.00 N ATOM 1209 CA PHE B 79 7.840 10.708 -9.289 1.00 0.00 C ATOM 1210 C PHE B 79 8.798 9.531 -9.028 1.00 0.00 C ATOM 1211 O PHE B 79 8.607 8.447 -9.585 1.00 0.00 O ATOM 1212 CB PHE B 79 6.466 10.419 -8.646 1.00 0.00 C ATOM 1213 CG PHE B 79 5.390 11.481 -8.836 1.00 0.00 C ATOM 1214 CD1 PHE B 79 4.670 11.557 -10.047 1.00 0.00 C ATOM 1215 CD2 PHE B 79 5.076 12.372 -7.790 1.00 0.00 C ATOM 1216 CE1 PHE B 79 3.677 12.537 -10.228 1.00 0.00 C ATOM 1217 CE2 PHE B 79 4.066 13.337 -7.961 1.00 0.00 C ATOM 1218 CZ PHE B 79 3.372 13.425 -9.181 1.00 0.00 C ATOM 0 H PHE B 79 7.556 10.030 -11.235 1.00 0.00 H new ATOM 0 HA PHE B 79 8.264 11.610 -8.848 1.00 0.00 H new ATOM 0 HB2 PHE B 79 6.092 9.478 -9.049 1.00 0.00 H new ATOM 0 HB3 PHE B 79 6.614 10.271 -7.576 1.00 0.00 H new ATOM 0 HD1 PHE B 79 4.883 10.857 -10.842 1.00 0.00 H new ATOM 0 HD2 PHE B 79 5.612 12.314 -6.854 1.00 0.00 H new ATOM 0 HE1 PHE B 79 3.150 12.607 -11.168 1.00 0.00 H new ATOM 0 HE2 PHE B 79 3.823 14.012 -7.153 1.00 0.00 H new ATOM 0 HZ PHE B 79 2.605 14.174 -9.314 1.00 0.00 H new ATOM 1228 N SER B 80 9.799 9.706 -8.163 1.00 0.00 N ATOM 1229 CA SER B 80 10.579 8.590 -7.596 1.00 0.00 C ATOM 1230 C SER B 80 9.851 7.998 -6.381 1.00 0.00 C ATOM 1231 O SER B 80 9.099 8.701 -5.703 1.00 0.00 O ATOM 1232 CB SER B 80 11.992 9.035 -7.186 1.00 0.00 C ATOM 1233 OG SER B 80 12.793 7.946 -6.731 1.00 0.00 O ATOM 0 H SER B 80 10.096 10.624 -7.832 1.00 0.00 H new ATOM 0 HA SER B 80 10.675 7.830 -8.371 1.00 0.00 H new ATOM 0 HB2 SER B 80 12.481 9.512 -8.035 1.00 0.00 H new ATOM 0 HB3 SER B 80 11.920 9.784 -6.398 1.00 0.00 H new ATOM 0 HG SER B 80 13.682 8.275 -6.483 1.00 0.00 H new ATOM 1239 N VAL B 81 10.082 6.715 -6.095 1.00 0.00 N ATOM 1240 CA VAL B 81 9.455 5.984 -4.988 1.00 0.00 C ATOM 1241 C VAL B 81 10.454 5.016 -4.358 1.00 0.00 C ATOM 1242 O VAL B 81 11.266 4.411 -5.056 1.00 0.00 O ATOM 1243 CB VAL B 81 8.189 5.208 -5.442 1.00 0.00 C ATOM 1244 CG1 VAL B 81 6.968 6.130 -5.547 1.00 0.00 C ATOM 1245 CG2 VAL B 81 8.353 4.478 -6.790 1.00 0.00 C ATOM 0 H VAL B 81 10.726 6.140 -6.639 1.00 0.00 H new ATOM 0 HA VAL B 81 9.145 6.724 -4.250 1.00 0.00 H new ATOM 0 HB VAL B 81 8.039 4.458 -4.665 1.00 0.00 H new ATOM 0 HG11 VAL B 81 6.102 5.551 -5.867 1.00 0.00 H new ATOM 0 HG12 VAL B 81 6.766 6.578 -4.574 1.00 0.00 H new ATOM 0 HG13 VAL B 81 7.168 6.917 -6.274 1.00 0.00 H new ATOM 0 HG21 VAL B 81 7.427 3.960 -7.038 1.00 0.00 H new ATOM 0 HG22 VAL B 81 8.584 5.203 -7.571 1.00 0.00 H new ATOM 0 HG23 VAL B 81 9.165 3.754 -6.716 1.00 0.00 H new ATOM 1255 N ASP B 82 10.347 4.815 -3.040 1.00 0.00 N ATOM 1256 CA ASP B 82 11.097 3.789 -2.289 1.00 0.00 C ATOM 1257 C ASP B 82 10.689 2.342 -2.676 1.00 0.00 C ATOM 1258 O ASP B 82 11.285 1.374 -2.204 1.00 0.00 O ATOM 1259 CB ASP B 82 10.914 4.069 -0.782 1.00 0.00 C ATOM 1260 CG ASP B 82 11.934 3.357 0.120 1.00 0.00 C ATOM 1261 OD1 ASP B 82 13.157 3.516 -0.105 1.00 0.00 O ATOM 1262 OD2 ASP B 82 11.508 2.683 1.093 1.00 0.00 O ATOM 0 H ASP B 82 9.726 5.369 -2.450 1.00 0.00 H new ATOM 0 HA ASP B 82 12.154 3.855 -2.548 1.00 0.00 H new ATOM 0 HB2 ASP B 82 10.984 5.143 -0.613 1.00 0.00 H new ATOM 0 HB3 ASP B 82 9.910 3.764 -0.487 1.00 0.00 H new ATOM 1267 N MET B 83 9.677 2.196 -3.543 1.00 0.00 N ATOM 1268 CA MET B 83 9.136 0.947 -4.104 1.00 0.00 C ATOM 1269 C MET B 83 10.191 0.148 -4.884 1.00 0.00 C ATOM 1270 O MET B 83 10.901 0.707 -5.718 1.00 0.00 O ATOM 1271 CB MET B 83 7.947 1.318 -5.016 1.00 0.00 C ATOM 1272 CG MET B 83 7.166 0.162 -5.665 1.00 0.00 C ATOM 1273 SD MET B 83 7.948 -0.784 -7.004 1.00 0.00 S ATOM 1274 CE MET B 83 8.269 0.524 -8.215 1.00 0.00 C ATOM 0 H MET B 83 9.176 3.010 -3.898 1.00 0.00 H new ATOM 0 HA MET B 83 8.813 0.300 -3.288 1.00 0.00 H new ATOM 0 HB2 MET B 83 7.245 1.912 -4.430 1.00 0.00 H new ATOM 0 HB3 MET B 83 8.321 1.961 -5.813 1.00 0.00 H new ATOM 0 HG2 MET B 83 6.902 -0.541 -4.875 1.00 0.00 H new ATOM 0 HG3 MET B 83 6.233 0.571 -6.052 1.00 0.00 H new ATOM 0 HE1 MET B 83 8.548 0.076 -9.169 1.00 0.00 H new ATOM 0 HE2 MET B 83 7.371 1.127 -8.346 1.00 0.00 H new ATOM 0 HE3 MET B 83 9.082 1.157 -7.860 1.00 0.00 H new ATOM 1284 N THR B 84 10.233 -1.170 -4.652 1.00 0.00 N ATOM 1285 CA THR B 84 11.062 -2.149 -5.383 1.00 0.00 C ATOM 1286 C THR B 84 10.432 -3.547 -5.465 1.00 0.00 C ATOM 1287 O THR B 84 10.933 -4.397 -6.199 1.00 0.00 O ATOM 1288 CB THR B 84 12.466 -2.178 -4.768 1.00 0.00 C ATOM 1289 OG1 THR B 84 13.295 -2.938 -5.606 1.00 0.00 O ATOM 1290 CG2 THR B 84 12.519 -2.774 -3.361 1.00 0.00 C ATOM 0 H THR B 84 9.670 -1.605 -3.922 1.00 0.00 H new ATOM 0 HA THR B 84 11.131 -1.821 -6.420 1.00 0.00 H new ATOM 0 HB THR B 84 12.795 -1.143 -4.679 1.00 0.00 H new ATOM 0 HG1 THR B 84 12.757 -3.607 -6.079 1.00 0.00 H new ATOM 0 HG21 THR B 84 13.546 -2.758 -2.998 1.00 0.00 H new ATOM 0 HG22 THR B 84 11.889 -2.187 -2.693 1.00 0.00 H new ATOM 0 HG23 THR B 84 12.160 -3.803 -3.388 1.00 0.00 H new ATOM 1298 N CYS B 85 9.353 -3.795 -4.725 1.00 0.00 N ATOM 1299 CA CYS B 85 8.593 -5.038 -4.748 1.00 0.00 C ATOM 1300 C CYS B 85 7.638 -5.120 -5.965 1.00 0.00 C ATOM 1301 O CYS B 85 6.930 -4.164 -6.295 1.00 0.00 O ATOM 1302 CB CYS B 85 7.899 -5.132 -3.380 1.00 0.00 C ATOM 1303 SG CYS B 85 6.709 -6.502 -3.297 1.00 0.00 S ATOM 0 H CYS B 85 8.973 -3.111 -4.071 1.00 0.00 H new ATOM 0 HA CYS B 85 9.236 -5.907 -4.889 1.00 0.00 H new ATOM 0 HB2 CYS B 85 8.652 -5.261 -2.602 1.00 0.00 H new ATOM 0 HB3 CYS B 85 7.384 -4.194 -3.172 1.00 0.00 H new ATOM 0 HG CYS B 85 7.048 -7.424 -4.149 1.00 0.00 H new ATOM 1308 N GLY B 86 7.571 -6.301 -6.589 1.00 0.00 N ATOM 1309 CA GLY B 86 6.665 -6.601 -7.701 1.00 0.00 C ATOM 1310 C GLY B 86 5.193 -6.565 -7.285 1.00 0.00 C ATOM 1311 O GLY B 86 4.355 -6.122 -8.073 1.00 0.00 O ATOM 0 H GLY B 86 8.159 -7.092 -6.328 1.00 0.00 H new ATOM 0 HA2 GLY B 86 6.830 -5.882 -8.504 1.00 0.00 H new ATOM 0 HA3 GLY B 86 6.902 -7.586 -8.102 1.00 0.00 H new ATOM 1315 N GLY B 87 4.886 -6.935 -6.034 1.00 0.00 N ATOM 1316 CA GLY B 87 3.559 -6.770 -5.434 1.00 0.00 C ATOM 1317 C GLY B 87 3.245 -5.302 -5.156 1.00 0.00 C ATOM 1318 O GLY B 87 2.137 -4.849 -5.443 1.00 0.00 O ATOM 0 H GLY B 87 5.564 -7.363 -5.403 1.00 0.00 H new ATOM 0 HA2 GLY B 87 2.803 -7.184 -6.102 1.00 0.00 H new ATOM 0 HA3 GLY B 87 3.507 -7.336 -4.504 1.00 0.00 H new ATOM 1322 N CYS B 88 4.223 -4.512 -4.695 1.00 0.00 N ATOM 1323 CA CYS B 88 4.049 -3.057 -4.585 1.00 0.00 C ATOM 1324 C CYS B 88 3.815 -2.389 -5.958 1.00 0.00 C ATOM 1325 O CYS B 88 2.957 -1.513 -6.067 1.00 0.00 O ATOM 1326 CB CYS B 88 5.228 -2.439 -3.825 1.00 0.00 C ATOM 1327 SG CYS B 88 5.158 -2.917 -2.073 1.00 0.00 S ATOM 0 H CYS B 88 5.136 -4.852 -4.394 1.00 0.00 H new ATOM 0 HA CYS B 88 3.143 -2.867 -4.009 1.00 0.00 H new ATOM 0 HB2 CYS B 88 6.169 -2.772 -4.264 1.00 0.00 H new ATOM 0 HB3 CYS B 88 5.201 -1.353 -3.916 1.00 0.00 H new ATOM 0 HG CYS B 88 6.163 -2.390 -1.439 1.00 0.00 H new ATOM 1333 N ALA B 89 4.494 -2.835 -7.019 1.00 0.00 N ATOM 1334 CA ALA B 89 4.268 -2.357 -8.389 1.00 0.00 C ATOM 1335 C ALA B 89 2.848 -2.666 -8.914 1.00 0.00 C ATOM 1336 O ALA B 89 2.289 -1.851 -9.649 1.00 0.00 O ATOM 1337 CB ALA B 89 5.361 -2.933 -9.295 1.00 0.00 C ATOM 0 H ALA B 89 5.223 -3.545 -6.952 1.00 0.00 H new ATOM 0 HA ALA B 89 4.330 -1.269 -8.391 1.00 0.00 H new ATOM 0 HB1 ALA B 89 5.207 -2.587 -10.317 1.00 0.00 H new ATOM 0 HB2 ALA B 89 6.338 -2.601 -8.943 1.00 0.00 H new ATOM 0 HB3 ALA B 89 5.317 -4.022 -9.271 1.00 0.00 H new ATOM 1343 N GLU B 90 2.223 -3.774 -8.493 1.00 0.00 N ATOM 1344 CA GLU B 90 0.778 -3.974 -8.680 1.00 0.00 C ATOM 1345 C GLU B 90 -0.021 -2.960 -7.842 1.00 0.00 C ATOM 1346 O GLU B 90 -0.869 -2.250 -8.385 1.00 0.00 O ATOM 1347 CB GLU B 90 0.376 -5.430 -8.367 1.00 0.00 C ATOM 1348 CG GLU B 90 -1.150 -5.617 -8.340 1.00 0.00 C ATOM 1349 CD GLU B 90 -1.558 -7.083 -8.249 1.00 0.00 C ATOM 1350 OE1 GLU B 90 -1.604 -7.637 -7.127 1.00 0.00 O ATOM 1351 OE2 GLU B 90 -1.926 -7.678 -9.290 1.00 0.00 O ATOM 0 H GLU B 90 2.694 -4.546 -8.021 1.00 0.00 H new ATOM 0 HA GLU B 90 0.535 -3.795 -9.727 1.00 0.00 H new ATOM 0 HB2 GLU B 90 0.809 -6.094 -9.116 1.00 0.00 H new ATOM 0 HB3 GLU B 90 0.793 -5.721 -7.403 1.00 0.00 H new ATOM 0 HG2 GLU B 90 -1.564 -5.075 -7.490 1.00 0.00 H new ATOM 0 HG3 GLU B 90 -1.582 -5.178 -9.239 1.00 0.00 H new ATOM 1358 N ALA B 91 0.257 -2.849 -6.538 1.00 0.00 N ATOM 1359 CA ALA B 91 -0.475 -1.971 -5.619 1.00 0.00 C ATOM 1360 C ALA B 91 -0.496 -0.496 -6.065 1.00 0.00 C ATOM 1361 O ALA B 91 -1.547 0.146 -5.995 1.00 0.00 O ATOM 1362 CB ALA B 91 0.126 -2.128 -4.217 1.00 0.00 C ATOM 0 H ALA B 91 1.006 -3.373 -6.086 1.00 0.00 H new ATOM 0 HA ALA B 91 -1.521 -2.276 -5.617 1.00 0.00 H new ATOM 0 HB1 ALA B 91 -0.406 -1.482 -3.519 1.00 0.00 H new ATOM 0 HB2 ALA B 91 0.032 -3.165 -3.895 1.00 0.00 H new ATOM 0 HB3 ALA B 91 1.179 -1.849 -4.239 1.00 0.00 H new ATOM 1368 N VAL B 92 0.625 0.017 -6.579 1.00 0.00 N ATOM 1369 CA VAL B 92 0.747 1.383 -7.130 1.00 0.00 C ATOM 1370 C VAL B 92 -0.229 1.630 -8.297 1.00 0.00 C ATOM 1371 O VAL B 92 -0.723 2.744 -8.446 1.00 0.00 O ATOM 1372 CB VAL B 92 2.208 1.683 -7.547 1.00 0.00 C ATOM 1373 CG1 VAL B 92 2.393 2.976 -8.361 1.00 0.00 C ATOM 1374 CG2 VAL B 92 3.101 1.825 -6.303 1.00 0.00 C ATOM 0 H VAL B 92 1.496 -0.512 -6.628 1.00 0.00 H new ATOM 0 HA VAL B 92 0.470 2.076 -6.336 1.00 0.00 H new ATOM 0 HB VAL B 92 2.486 0.837 -8.176 1.00 0.00 H new ATOM 0 HG11 VAL B 92 3.447 3.103 -8.608 1.00 0.00 H new ATOM 0 HG12 VAL B 92 1.810 2.914 -9.280 1.00 0.00 H new ATOM 0 HG13 VAL B 92 2.053 3.828 -7.773 1.00 0.00 H new ATOM 0 HG21 VAL B 92 4.125 2.036 -6.612 1.00 0.00 H new ATOM 0 HG22 VAL B 92 2.734 2.643 -5.683 1.00 0.00 H new ATOM 0 HG23 VAL B 92 3.078 0.897 -5.731 1.00 0.00 H new ATOM 1384 N SER B 93 -0.587 0.610 -9.086 1.00 0.00 N ATOM 1385 CA SER B 93 -1.648 0.767 -10.095 1.00 0.00 C ATOM 1386 C SER B 93 -3.030 0.917 -9.434 1.00 0.00 C ATOM 1387 O SER B 93 -3.767 1.866 -9.712 1.00 0.00 O ATOM 1388 CB SER B 93 -1.603 -0.386 -11.117 1.00 0.00 C ATOM 1389 OG SER B 93 -2.076 -1.624 -10.609 1.00 0.00 O ATOM 0 H SER B 93 -0.168 -0.319 -9.049 1.00 0.00 H new ATOM 0 HA SER B 93 -1.467 1.690 -10.646 1.00 0.00 H new ATOM 0 HB2 SER B 93 -2.199 -0.110 -11.987 1.00 0.00 H new ATOM 0 HB3 SER B 93 -0.577 -0.514 -11.461 1.00 0.00 H new ATOM 0 HG SER B 93 -1.836 -1.702 -9.662 1.00 0.00 H new ATOM 1395 N ARG B 94 -3.350 0.042 -8.470 1.00 0.00 N ATOM 1396 CA ARG B 94 -4.633 0.053 -7.762 1.00 0.00 C ATOM 1397 C ARG B 94 -4.828 1.314 -6.905 1.00 0.00 C ATOM 1398 O ARG B 94 -5.962 1.795 -6.829 1.00 0.00 O ATOM 1399 CB ARG B 94 -4.801 -1.238 -6.943 1.00 0.00 C ATOM 1400 CG ARG B 94 -4.990 -2.456 -7.868 1.00 0.00 C ATOM 1401 CD ARG B 94 -5.212 -3.781 -7.129 1.00 0.00 C ATOM 1402 NE ARG B 94 -6.464 -3.790 -6.355 1.00 0.00 N ATOM 1403 CZ ARG B 94 -7.025 -4.844 -5.779 1.00 0.00 C ATOM 1404 NH1 ARG B 94 -6.476 -6.039 -5.785 1.00 0.00 N ATOM 1405 NH2 ARG B 94 -8.177 -4.692 -5.172 1.00 0.00 N ATOM 0 H ARG B 94 -2.720 -0.697 -8.159 1.00 0.00 H new ATOM 0 HA ARG B 94 -5.423 0.086 -8.512 1.00 0.00 H new ATOM 0 HB2 ARG B 94 -3.926 -1.389 -6.311 1.00 0.00 H new ATOM 0 HB3 ARG B 94 -5.661 -1.143 -6.280 1.00 0.00 H new ATOM 0 HG2 ARG B 94 -5.842 -2.272 -8.523 1.00 0.00 H new ATOM 0 HG3 ARG B 94 -4.112 -2.552 -8.507 1.00 0.00 H new ATOM 0 HD2 ARG B 94 -5.228 -4.598 -7.851 1.00 0.00 H new ATOM 0 HD3 ARG B 94 -4.372 -3.965 -6.459 1.00 0.00 H new ATOM 0 HE ARG B 94 -6.947 -2.898 -6.252 1.00 0.00 H new ATOM 0 HH11 ARG B 94 -5.579 -6.186 -6.247 1.00 0.00 H new ATOM 0 HH12 ARG B 94 -6.947 -6.819 -5.327 1.00 0.00 H new ATOM 0 HH21 ARG B 94 -8.625 -3.776 -5.149 1.00 0.00 H new ATOM 0 HH22 ARG B 94 -8.626 -5.490 -4.722 1.00 0.00 H new ATOM 1419 N VAL B 95 -3.763 1.875 -6.316 1.00 0.00 N ATOM 1420 CA VAL B 95 -3.836 3.134 -5.546 1.00 0.00 C ATOM 1421 C VAL B 95 -4.091 4.358 -6.442 1.00 0.00 C ATOM 1422 O VAL B 95 -4.860 5.234 -6.060 1.00 0.00 O ATOM 1423 CB VAL B 95 -2.606 3.349 -4.623 1.00 0.00 C ATOM 1424 CG1 VAL B 95 -1.467 4.165 -5.266 1.00 0.00 C ATOM 1425 CG2 VAL B 95 -3.031 4.033 -3.315 1.00 0.00 C ATOM 0 H VAL B 95 -2.826 1.473 -6.357 1.00 0.00 H new ATOM 0 HA VAL B 95 -4.702 3.029 -4.893 1.00 0.00 H new ATOM 0 HB VAL B 95 -2.212 2.351 -4.432 1.00 0.00 H new ATOM 0 HG11 VAL B 95 -0.647 4.269 -4.555 1.00 0.00 H new ATOM 0 HG12 VAL B 95 -1.110 3.651 -6.159 1.00 0.00 H new ATOM 0 HG13 VAL B 95 -1.837 5.153 -5.540 1.00 0.00 H new ATOM 0 HG21 VAL B 95 -2.158 4.177 -2.679 1.00 0.00 H new ATOM 0 HG22 VAL B 95 -3.479 5.001 -3.540 1.00 0.00 H new ATOM 0 HG23 VAL B 95 -3.758 3.408 -2.797 1.00 0.00 H new ATOM 1435 N LEU B 96 -3.504 4.424 -7.649 1.00 0.00 N ATOM 1436 CA LEU B 96 -3.766 5.516 -8.598 1.00 0.00 C ATOM 1437 C LEU B 96 -5.208 5.461 -9.114 1.00 0.00 C ATOM 1438 O LEU B 96 -5.873 6.493 -9.216 1.00 0.00 O ATOM 1439 CB LEU B 96 -2.743 5.459 -9.750 1.00 0.00 C ATOM 1440 CG LEU B 96 -1.339 5.978 -9.371 1.00 0.00 C ATOM 1441 CD1 LEU B 96 -0.356 5.674 -10.510 1.00 0.00 C ATOM 1442 CD2 LEU B 96 -1.338 7.492 -9.095 1.00 0.00 C ATOM 0 H LEU B 96 -2.841 3.728 -7.991 1.00 0.00 H new ATOM 0 HA LEU B 96 -3.650 6.471 -8.085 1.00 0.00 H new ATOM 0 HB2 LEU B 96 -2.657 4.429 -10.095 1.00 0.00 H new ATOM 0 HB3 LEU B 96 -3.122 6.045 -10.587 1.00 0.00 H new ATOM 0 HG LEU B 96 -1.035 5.469 -8.456 1.00 0.00 H new ATOM 0 HD11 LEU B 96 0.635 6.040 -10.243 1.00 0.00 H new ATOM 0 HD12 LEU B 96 -0.313 4.598 -10.676 1.00 0.00 H new ATOM 0 HD13 LEU B 96 -0.692 6.168 -11.422 1.00 0.00 H new ATOM 0 HD21 LEU B 96 -0.330 7.813 -8.832 1.00 0.00 H new ATOM 0 HD22 LEU B 96 -1.668 8.025 -9.987 1.00 0.00 H new ATOM 0 HD23 LEU B 96 -2.016 7.712 -8.270 1.00 0.00 H new ATOM 1454 N ASN B 97 -5.741 4.257 -9.323 1.00 0.00 N ATOM 1455 CA ASN B 97 -7.146 4.053 -9.678 1.00 0.00 C ATOM 1456 C ASN B 97 -8.145 4.414 -8.550 1.00 0.00 C ATOM 1457 O ASN B 97 -9.353 4.403 -8.791 1.00 0.00 O ATOM 1458 CB ASN B 97 -7.329 2.623 -10.209 1.00 0.00 C ATOM 1459 CG ASN B 97 -6.639 2.394 -11.555 1.00 0.00 C ATOM 1460 OD1 ASN B 97 -6.317 3.311 -12.305 1.00 0.00 O ATOM 1461 ND2 ASN B 97 -6.415 1.147 -11.913 1.00 0.00 N ATOM 0 H ASN B 97 -5.207 3.391 -9.250 1.00 0.00 H new ATOM 0 HA ASN B 97 -7.394 4.760 -10.469 1.00 0.00 H new ATOM 0 HB2 ASN B 97 -6.934 1.917 -9.479 1.00 0.00 H new ATOM 0 HB3 ASN B 97 -8.394 2.413 -10.312 1.00 0.00 H new ATOM 0 HD21 ASN B 97 -5.975 0.945 -12.811 1.00 0.00 H new ATOM 0 HD22 ASN B 97 -6.681 0.383 -11.292 1.00 0.00 H new ATOM 1468 N LYS B 98 -7.702 4.815 -7.345 1.00 0.00 N ATOM 1469 CA LYS B 98 -8.568 5.518 -6.376 1.00 0.00 C ATOM 1470 C LYS B 98 -8.988 6.915 -6.888 1.00 0.00 C ATOM 1471 O LYS B 98 -10.136 7.313 -6.677 1.00 0.00 O ATOM 1472 CB LYS B 98 -7.882 5.638 -5.000 1.00 0.00 C ATOM 1473 CG LYS B 98 -7.545 4.311 -4.294 1.00 0.00 C ATOM 1474 CD LYS B 98 -8.781 3.501 -3.872 1.00 0.00 C ATOM 1475 CE LYS B 98 -8.359 2.357 -2.939 1.00 0.00 C ATOM 1476 NZ LYS B 98 -9.506 1.502 -2.547 1.00 0.00 N ATOM 0 H LYS B 98 -6.748 4.665 -7.017 1.00 0.00 H new ATOM 0 HA LYS B 98 -9.470 4.917 -6.263 1.00 0.00 H new ATOM 0 HB2 LYS B 98 -6.959 6.205 -5.125 1.00 0.00 H new ATOM 0 HB3 LYS B 98 -8.528 6.221 -4.344 1.00 0.00 H new ATOM 0 HG2 LYS B 98 -6.933 3.702 -4.959 1.00 0.00 H new ATOM 0 HG3 LYS B 98 -6.942 4.523 -3.411 1.00 0.00 H new ATOM 0 HD2 LYS B 98 -9.497 4.149 -3.367 1.00 0.00 H new ATOM 0 HD3 LYS B 98 -9.282 3.099 -4.753 1.00 0.00 H new ATOM 0 HE2 LYS B 98 -7.605 1.746 -3.435 1.00 0.00 H new ATOM 0 HE3 LYS B 98 -7.895 2.772 -2.044 1.00 0.00 H new ATOM 0 HZ1 LYS B 98 -9.336 1.106 -1.601 1.00 0.00 H new ATOM 0 HZ2 LYS B 98 -10.375 2.073 -2.532 1.00 0.00 H new ATOM 0 HZ3 LYS B 98 -9.612 0.727 -3.233 1.00 0.00 H new ATOM 1490 N LEU B 99 -8.093 7.638 -7.582 1.00 0.00 N ATOM 1491 CA LEU B 99 -8.425 8.826 -8.388 1.00 0.00 C ATOM 1492 C LEU B 99 -9.108 8.439 -9.709 1.00 0.00 C ATOM 1493 O LEU B 99 -10.196 8.936 -10.000 1.00 0.00 O ATOM 1494 CB LEU B 99 -7.159 9.676 -8.634 1.00 0.00 C ATOM 1495 CG LEU B 99 -6.492 10.249 -7.366 1.00 0.00 C ATOM 1496 CD1 LEU B 99 -5.199 10.974 -7.763 1.00 0.00 C ATOM 1497 CD2 LEU B 99 -7.408 11.216 -6.600 1.00 0.00 C ATOM 0 H LEU B 99 -7.099 7.409 -7.599 1.00 0.00 H new ATOM 0 HA LEU B 99 -9.139 9.429 -7.827 1.00 0.00 H new ATOM 0 HB2 LEU B 99 -6.429 9.065 -9.164 1.00 0.00 H new ATOM 0 HB3 LEU B 99 -7.420 10.504 -9.293 1.00 0.00 H new ATOM 0 HG LEU B 99 -6.279 9.413 -6.700 1.00 0.00 H new ATOM 0 HD11 LEU B 99 -4.722 11.382 -6.872 1.00 0.00 H new ATOM 0 HD12 LEU B 99 -4.522 10.271 -8.248 1.00 0.00 H new ATOM 0 HD13 LEU B 99 -5.434 11.785 -8.452 1.00 0.00 H new ATOM 0 HD21 LEU B 99 -6.887 11.588 -5.718 1.00 0.00 H new ATOM 0 HD22 LEU B 99 -7.673 12.054 -7.245 1.00 0.00 H new ATOM 0 HD23 LEU B 99 -8.314 10.693 -6.293 1.00 0.00 H new ATOM 1509 N GLY B 100 -8.497 7.522 -10.473 1.00 0.00 N ATOM 1510 CA GLY B 100 -9.063 6.939 -11.701 1.00 0.00 C ATOM 1511 C GLY B 100 -8.868 7.788 -12.964 1.00 0.00 C ATOM 1512 O GLY B 100 -8.612 8.989 -12.903 1.00 0.00 O ATOM 0 H GLY B 100 -7.572 7.155 -10.249 1.00 0.00 H new ATOM 0 HA2 GLY B 100 -8.611 5.961 -11.864 1.00 0.00 H new ATOM 0 HA3 GLY B 100 -10.130 6.776 -11.551 1.00 0.00 H new ATOM 1516 N GLY B 101 -8.991 7.144 -14.130 1.00 0.00 N ATOM 1517 CA GLY B 101 -8.962 7.770 -15.465 1.00 0.00 C ATOM 1518 C GLY B 101 -7.633 8.394 -15.884 1.00 0.00 C ATOM 1519 O GLY B 101 -7.618 9.317 -16.700 1.00 0.00 O ATOM 0 H GLY B 101 -9.119 6.133 -14.176 1.00 0.00 H new ATOM 0 HA2 GLY B 101 -9.236 7.016 -16.204 1.00 0.00 H new ATOM 0 HA3 GLY B 101 -9.730 8.543 -15.499 1.00 0.00 H new ATOM 1523 N VAL B 102 -6.528 7.895 -15.339 1.00 0.00 N ATOM 1524 CA VAL B 102 -5.175 8.455 -15.528 1.00 0.00 C ATOM 1525 C VAL B 102 -4.341 7.639 -16.523 1.00 0.00 C ATOM 1526 O VAL B 102 -4.421 6.410 -16.569 1.00 0.00 O ATOM 1527 CB VAL B 102 -4.406 8.630 -14.192 1.00 0.00 C ATOM 1528 CG1 VAL B 102 -4.879 9.889 -13.452 1.00 0.00 C ATOM 1529 CG2 VAL B 102 -4.512 7.430 -13.237 1.00 0.00 C ATOM 0 H VAL B 102 -6.538 7.071 -14.738 1.00 0.00 H new ATOM 0 HA VAL B 102 -5.328 9.448 -15.951 1.00 0.00 H new ATOM 0 HB VAL B 102 -3.359 8.718 -14.482 1.00 0.00 H new ATOM 0 HG11 VAL B 102 -4.326 9.991 -12.518 1.00 0.00 H new ATOM 0 HG12 VAL B 102 -4.703 10.765 -14.076 1.00 0.00 H new ATOM 0 HG13 VAL B 102 -5.944 9.805 -13.236 1.00 0.00 H new ATOM 0 HG21 VAL B 102 -3.946 7.637 -12.329 1.00 0.00 H new ATOM 0 HG22 VAL B 102 -5.558 7.259 -12.982 1.00 0.00 H new ATOM 0 HG23 VAL B 102 -4.108 6.542 -13.722 1.00 0.00 H new ATOM 1539 N LYS B 103 -3.512 8.342 -17.303 1.00 0.00 N ATOM 1540 CA LYS B 103 -2.454 7.767 -18.145 1.00 0.00 C ATOM 1541 C LYS B 103 -1.136 7.702 -17.361 1.00 0.00 C ATOM 1542 O LYS B 103 -0.663 8.730 -16.875 1.00 0.00 O ATOM 1543 CB LYS B 103 -2.298 8.624 -19.417 1.00 0.00 C ATOM 1544 CG LYS B 103 -3.284 8.166 -20.503 1.00 0.00 C ATOM 1545 CD LYS B 103 -3.319 9.084 -21.734 1.00 0.00 C ATOM 1546 CE LYS B 103 -3.924 10.445 -21.374 1.00 0.00 C ATOM 1547 NZ LYS B 103 -4.274 11.244 -22.569 1.00 0.00 N ATOM 0 H LYS B 103 -3.560 9.359 -17.368 1.00 0.00 H new ATOM 0 HA LYS B 103 -2.723 6.751 -18.435 1.00 0.00 H new ATOM 0 HB2 LYS B 103 -2.473 9.673 -19.179 1.00 0.00 H new ATOM 0 HB3 LYS B 103 -1.277 8.548 -19.790 1.00 0.00 H new ATOM 0 HG2 LYS B 103 -3.018 7.158 -20.820 1.00 0.00 H new ATOM 0 HG3 LYS B 103 -4.284 8.111 -20.073 1.00 0.00 H new ATOM 0 HD2 LYS B 103 -2.310 9.220 -22.122 1.00 0.00 H new ATOM 0 HD3 LYS B 103 -3.905 8.617 -22.526 1.00 0.00 H new ATOM 0 HE2 LYS B 103 -4.817 10.293 -20.768 1.00 0.00 H new ATOM 0 HE3 LYS B 103 -3.215 11.004 -20.762 1.00 0.00 H new ATOM 0 HZ1 LYS B 103 -4.679 12.155 -22.271 1.00 0.00 H new ATOM 0 HZ2 LYS B 103 -3.419 11.414 -23.136 1.00 0.00 H new ATOM 0 HZ3 LYS B 103 -4.971 10.726 -23.141 1.00 0.00 H new ATOM 1561 N TYR B 104 -0.539 6.514 -17.227 1.00 0.00 N ATOM 1562 CA TYR B 104 0.711 6.324 -16.478 1.00 0.00 C ATOM 1563 C TYR B 104 1.504 5.068 -16.865 1.00 0.00 C ATOM 1564 O TYR B 104 0.944 4.096 -17.371 1.00 0.00 O ATOM 1565 CB TYR B 104 0.441 6.353 -14.962 1.00 0.00 C ATOM 1566 CG TYR B 104 -0.406 5.219 -14.412 1.00 0.00 C ATOM 1567 CD1 TYR B 104 -1.807 5.271 -14.534 1.00 0.00 C ATOM 1568 CD2 TYR B 104 0.194 4.136 -13.738 1.00 0.00 C ATOM 1569 CE1 TYR B 104 -2.610 4.256 -13.985 1.00 0.00 C ATOM 1570 CE2 TYR B 104 -0.603 3.121 -13.173 1.00 0.00 C ATOM 1571 CZ TYR B 104 -2.012 3.183 -13.295 1.00 0.00 C ATOM 1572 OH TYR B 104 -2.798 2.216 -12.755 1.00 0.00 O ATOM 0 H TYR B 104 -0.908 5.655 -17.635 1.00 0.00 H new ATOM 0 HA TYR B 104 1.349 7.163 -16.757 1.00 0.00 H new ATOM 0 HB2 TYR B 104 1.399 6.348 -14.443 1.00 0.00 H new ATOM 0 HB3 TYR B 104 -0.049 7.296 -14.719 1.00 0.00 H new ATOM 0 HD1 TYR B 104 -2.269 6.097 -15.054 1.00 0.00 H new ATOM 0 HD2 TYR B 104 1.270 4.084 -13.654 1.00 0.00 H new ATOM 0 HE1 TYR B 104 -3.684 4.299 -14.092 1.00 0.00 H new ATOM 0 HE2 TYR B 104 -0.140 2.298 -12.648 1.00 0.00 H new ATOM 0 HH TYR B 104 -2.939 1.504 -13.413 1.00 0.00 H new ATOM 1582 N ASP B 105 2.804 5.069 -16.557 1.00 0.00 N ATOM 1583 CA ASP B 105 3.705 3.919 -16.661 1.00 0.00 C ATOM 1584 C ASP B 105 4.676 3.868 -15.465 1.00 0.00 C ATOM 1585 O ASP B 105 5.383 4.838 -15.177 1.00 0.00 O ATOM 1586 CB ASP B 105 4.500 3.978 -17.975 1.00 0.00 C ATOM 1587 CG ASP B 105 3.672 3.710 -19.235 1.00 0.00 C ATOM 1588 OD1 ASP B 105 3.312 2.527 -19.458 1.00 0.00 O ATOM 1589 OD2 ASP B 105 3.433 4.671 -20.010 1.00 0.00 O ATOM 0 H ASP B 105 3.276 5.906 -16.214 1.00 0.00 H new ATOM 0 HA ASP B 105 3.096 3.015 -16.652 1.00 0.00 H new ATOM 0 HB2 ASP B 105 4.961 4.962 -18.062 1.00 0.00 H new ATOM 0 HB3 ASP B 105 5.310 3.250 -17.927 1.00 0.00 H new ATOM 1594 N ILE B 106 4.733 2.717 -14.790 1.00 0.00 N ATOM 1595 CA ILE B 106 5.657 2.414 -13.682 1.00 0.00 C ATOM 1596 C ILE B 106 6.930 1.783 -14.264 1.00 0.00 C ATOM 1597 O ILE B 106 6.844 0.857 -15.074 1.00 0.00 O ATOM 1598 CB ILE B 106 4.973 1.466 -12.658 1.00 0.00 C ATOM 1599 CG1 ILE B 106 3.647 2.058 -12.112 1.00 0.00 C ATOM 1600 CG2 ILE B 106 5.928 1.137 -11.486 1.00 0.00 C ATOM 1601 CD1 ILE B 106 2.746 1.023 -11.428 1.00 0.00 C ATOM 0 H ILE B 106 4.114 1.936 -15.005 1.00 0.00 H new ATOM 0 HA ILE B 106 5.924 3.329 -13.153 1.00 0.00 H new ATOM 0 HB ILE B 106 4.734 0.546 -13.190 1.00 0.00 H new ATOM 0 HG12 ILE B 106 3.879 2.851 -11.401 1.00 0.00 H new ATOM 0 HG13 ILE B 106 3.099 2.517 -12.934 1.00 0.00 H new ATOM 0 HG21 ILE B 106 5.426 0.472 -10.783 1.00 0.00 H new ATOM 0 HG22 ILE B 106 6.823 0.648 -11.872 1.00 0.00 H new ATOM 0 HG23 ILE B 106 6.209 2.058 -10.976 1.00 0.00 H new ATOM 0 HD11 ILE B 106 1.838 1.510 -11.072 1.00 0.00 H new ATOM 0 HD12 ILE B 106 2.483 0.242 -12.141 1.00 0.00 H new ATOM 0 HD13 ILE B 106 3.275 0.581 -10.584 1.00 0.00 H new ATOM 1613 N ASP B 107 8.105 2.253 -13.839 1.00 0.00 N ATOM 1614 CA ASP B 107 9.414 1.719 -14.233 1.00 0.00 C ATOM 1615 C ASP B 107 10.051 0.965 -13.047 1.00 0.00 C ATOM 1616 O ASP B 107 10.651 1.567 -12.152 1.00 0.00 O ATOM 1617 CB ASP B 107 10.298 2.870 -14.756 1.00 0.00 C ATOM 1618 CG ASP B 107 11.436 2.370 -15.654 1.00 0.00 C ATOM 1619 OD1 ASP B 107 12.532 2.058 -15.143 1.00 0.00 O ATOM 1620 OD2 ASP B 107 11.226 2.303 -16.890 1.00 0.00 O ATOM 0 H ASP B 107 8.176 3.039 -13.192 1.00 0.00 H new ATOM 0 HA ASP B 107 9.305 0.998 -15.043 1.00 0.00 H new ATOM 0 HB2 ASP B 107 9.681 3.574 -15.314 1.00 0.00 H new ATOM 0 HB3 ASP B 107 10.718 3.415 -13.911 1.00 0.00 H new ATOM 1625 N LEU B 108 9.891 -0.366 -13.030 1.00 0.00 N ATOM 1626 CA LEU B 108 10.390 -1.261 -11.978 1.00 0.00 C ATOM 1627 C LEU B 108 11.914 -1.169 -11.729 1.00 0.00 C ATOM 1628 O LEU B 108 12.281 -1.177 -10.551 1.00 0.00 O ATOM 1629 CB LEU B 108 9.888 -2.692 -12.288 1.00 0.00 C ATOM 1630 CG LEU B 108 10.101 -3.816 -11.244 1.00 0.00 C ATOM 1631 CD1 LEU B 108 11.522 -4.404 -11.251 1.00 0.00 C ATOM 1632 CD2 LEU B 108 9.690 -3.399 -9.823 1.00 0.00 C ATOM 0 H LEU B 108 9.396 -0.863 -13.770 1.00 0.00 H new ATOM 0 HA LEU B 108 9.983 -0.937 -11.020 1.00 0.00 H new ATOM 0 HB2 LEU B 108 8.818 -2.628 -12.485 1.00 0.00 H new ATOM 0 HB3 LEU B 108 10.364 -3.012 -13.215 1.00 0.00 H new ATOM 0 HG LEU B 108 9.429 -4.612 -11.563 1.00 0.00 H new ATOM 0 HD11 LEU B 108 11.596 -5.185 -10.494 1.00 0.00 H new ATOM 0 HD12 LEU B 108 11.736 -4.828 -12.232 1.00 0.00 H new ATOM 0 HD13 LEU B 108 12.243 -3.616 -11.031 1.00 0.00 H new ATOM 0 HD21 LEU B 108 9.862 -4.228 -9.136 1.00 0.00 H new ATOM 0 HD22 LEU B 108 10.283 -2.539 -9.510 1.00 0.00 H new ATOM 0 HD23 LEU B 108 8.633 -3.134 -9.813 1.00 0.00 H new ATOM 1644 N PRO B 109 12.813 -1.069 -12.735 1.00 0.00 N ATOM 1645 CA PRO B 109 14.253 -1.022 -12.479 1.00 0.00 C ATOM 1646 C PRO B 109 14.747 0.361 -12.021 1.00 0.00 C ATOM 1647 O PRO B 109 15.630 0.410 -11.168 1.00 0.00 O ATOM 1648 CB PRO B 109 14.919 -1.475 -13.780 1.00 0.00 C ATOM 1649 CG PRO B 109 13.921 -1.038 -14.846 1.00 0.00 C ATOM 1650 CD PRO B 109 12.569 -1.220 -14.165 1.00 0.00 C ATOM 0 HA PRO B 109 14.514 -1.675 -11.646 1.00 0.00 H new ATOM 0 HB2 PRO B 109 15.892 -1.004 -13.921 1.00 0.00 H new ATOM 0 HB3 PRO B 109 15.081 -2.553 -13.796 1.00 0.00 H new ATOM 0 HG2 PRO B 109 14.083 -0.003 -15.147 1.00 0.00 H new ATOM 0 HG3 PRO B 109 14.002 -1.648 -15.746 1.00 0.00 H new ATOM 0 HD2 PRO B 109 11.852 -0.479 -14.518 1.00 0.00 H new ATOM 0 HD3 PRO B 109 12.150 -2.201 -14.387 1.00 0.00 H new ATOM 1658 N ASN B 110 14.191 1.476 -12.525 1.00 0.00 N ATOM 1659 CA ASN B 110 14.583 2.834 -12.094 1.00 0.00 C ATOM 1660 C ASN B 110 13.834 3.315 -10.827 1.00 0.00 C ATOM 1661 O ASN B 110 14.171 4.351 -10.250 1.00 0.00 O ATOM 1662 CB ASN B 110 14.382 3.802 -13.271 1.00 0.00 C ATOM 1663 CG ASN B 110 15.223 5.069 -13.159 1.00 0.00 C ATOM 1664 OD1 ASN B 110 14.794 6.094 -12.642 1.00 0.00 O ATOM 1665 ND2 ASN B 110 16.434 5.048 -13.685 1.00 0.00 N ATOM 0 H ASN B 110 13.462 1.465 -13.238 1.00 0.00 H new ATOM 0 HA ASN B 110 15.635 2.808 -11.808 1.00 0.00 H new ATOM 0 HB2 ASN B 110 14.631 3.290 -14.200 1.00 0.00 H new ATOM 0 HB3 ASN B 110 13.329 4.077 -13.331 1.00 0.00 H new ATOM 0 HD21 ASN B 110 17.015 5.886 -13.662 1.00 0.00 H new ATOM 0 HD22 ASN B 110 16.789 4.194 -14.115 1.00 0.00 H new ATOM 1672 N LYS B 111 12.806 2.573 -10.391 1.00 0.00 N ATOM 1673 CA LYS B 111 12.030 2.805 -9.160 1.00 0.00 C ATOM 1674 C LYS B 111 11.262 4.152 -9.210 1.00 0.00 C ATOM 1675 O LYS B 111 11.218 4.923 -8.243 1.00 0.00 O ATOM 1676 CB LYS B 111 12.906 2.617 -7.892 1.00 0.00 C ATOM 1677 CG LYS B 111 13.966 1.508 -7.908 1.00 0.00 C ATOM 1678 CD LYS B 111 13.353 0.122 -7.835 1.00 0.00 C ATOM 1679 CE LYS B 111 14.406 -0.898 -8.302 1.00 0.00 C ATOM 1680 NZ LYS B 111 13.896 -2.287 -8.362 1.00 0.00 N ATOM 0 H LYS B 111 12.477 1.758 -10.908 1.00 0.00 H new ATOM 0 HA LYS B 111 11.257 2.040 -9.094 1.00 0.00 H new ATOM 0 HB2 LYS B 111 13.413 3.561 -7.693 1.00 0.00 H new ATOM 0 HB3 LYS B 111 12.239 2.430 -7.050 1.00 0.00 H new ATOM 0 HG2 LYS B 111 14.562 1.592 -8.817 1.00 0.00 H new ATOM 0 HG3 LYS B 111 14.646 1.647 -7.067 1.00 0.00 H new ATOM 0 HD2 LYS B 111 13.036 -0.100 -6.816 1.00 0.00 H new ATOM 0 HD3 LYS B 111 12.465 0.066 -8.465 1.00 0.00 H new ATOM 0 HE2 LYS B 111 14.768 -0.609 -9.289 1.00 0.00 H new ATOM 0 HE3 LYS B 111 15.260 -0.862 -7.626 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 14.639 -2.914 -8.731 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 13.623 -2.598 -7.408 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 13.067 -2.326 -8.989 1.00 0.00 H new ATOM 1694 N LYS B 112 10.675 4.464 -10.375 1.00 0.00 N ATOM 1695 CA LYS B 112 9.899 5.693 -10.619 1.00 0.00 C ATOM 1696 C LYS B 112 8.534 5.424 -11.287 1.00 0.00 C ATOM 1697 O LYS B 112 8.310 4.355 -11.854 1.00 0.00 O ATOM 1698 CB LYS B 112 10.758 6.720 -11.396 1.00 0.00 C ATOM 1699 CG LYS B 112 10.946 6.430 -12.897 1.00 0.00 C ATOM 1700 CD LYS B 112 11.603 7.625 -13.609 1.00 0.00 C ATOM 1701 CE LYS B 112 11.605 7.406 -15.128 1.00 0.00 C ATOM 1702 NZ LYS B 112 12.000 8.630 -15.864 1.00 0.00 N ATOM 0 H LYS B 112 10.727 3.857 -11.193 1.00 0.00 H new ATOM 0 HA LYS B 112 9.651 6.127 -9.650 1.00 0.00 H new ATOM 0 HB2 LYS B 112 10.301 7.704 -11.289 1.00 0.00 H new ATOM 0 HB3 LYS B 112 11.741 6.772 -10.928 1.00 0.00 H new ATOM 0 HG2 LYS B 112 11.563 5.541 -13.025 1.00 0.00 H new ATOM 0 HG3 LYS B 112 9.980 6.216 -13.354 1.00 0.00 H new ATOM 0 HD2 LYS B 112 11.064 8.541 -13.368 1.00 0.00 H new ATOM 0 HD3 LYS B 112 12.625 7.752 -13.252 1.00 0.00 H new ATOM 0 HE2 LYS B 112 12.291 6.596 -15.377 1.00 0.00 H new ATOM 0 HE3 LYS B 112 10.612 7.093 -15.451 1.00 0.00 H new ATOM 0 HZ1 LYS B 112 11.718 8.542 -16.861 1.00 0.00 H new ATOM 0 HZ2 LYS B 112 11.528 9.456 -15.443 1.00 0.00 H new ATOM 0 HZ3 LYS B 112 13.031 8.753 -15.805 1.00 0.00 H new ATOM 1716 N VAL B 113 7.638 6.408 -11.239 1.00 0.00 N ATOM 1717 CA VAL B 113 6.310 6.392 -11.878 1.00 0.00 C ATOM 1718 C VAL B 113 6.161 7.667 -12.711 1.00 0.00 C ATOM 1719 O VAL B 113 6.490 8.747 -12.224 1.00 0.00 O ATOM 1720 CB VAL B 113 5.167 6.324 -10.833 1.00 0.00 C ATOM 1721 CG1 VAL B 113 3.808 6.109 -11.523 1.00 0.00 C ATOM 1722 CG2 VAL B 113 5.385 5.201 -9.804 1.00 0.00 C ATOM 0 H VAL B 113 7.818 7.276 -10.735 1.00 0.00 H new ATOM 0 HA VAL B 113 6.236 5.503 -12.504 1.00 0.00 H new ATOM 0 HB VAL B 113 5.172 7.279 -10.308 1.00 0.00 H new ATOM 0 HG11 VAL B 113 3.021 6.064 -10.770 1.00 0.00 H new ATOM 0 HG12 VAL B 113 3.611 6.936 -12.205 1.00 0.00 H new ATOM 0 HG13 VAL B 113 3.828 5.174 -12.083 1.00 0.00 H new ATOM 0 HG21 VAL B 113 4.559 5.193 -9.093 1.00 0.00 H new ATOM 0 HG22 VAL B 113 5.431 4.241 -10.318 1.00 0.00 H new ATOM 0 HG23 VAL B 113 6.320 5.372 -9.271 1.00 0.00 H new ATOM 1732 N CYS B 114 5.678 7.546 -13.949 1.00 0.00 N ATOM 1733 CA CYS B 114 5.491 8.664 -14.882 1.00 0.00 C ATOM 1734 C CYS B 114 4.011 8.759 -15.284 1.00 0.00 C ATOM 1735 O CYS B 114 3.408 7.740 -15.615 1.00 0.00 O ATOM 1736 CB CYS B 114 6.407 8.437 -16.096 1.00 0.00 C ATOM 1737 SG CYS B 114 8.134 8.261 -15.547 1.00 0.00 S ATOM 0 H CYS B 114 5.399 6.647 -14.342 1.00 0.00 H new ATOM 0 HA CYS B 114 5.760 9.612 -14.417 1.00 0.00 H new ATOM 0 HB2 CYS B 114 6.095 7.543 -16.635 1.00 0.00 H new ATOM 0 HB3 CYS B 114 6.320 9.274 -16.789 1.00 0.00 H new ATOM 0 HG CYS B 114 8.900 8.068 -16.579 1.00 0.00 H new ATOM 1743 N ILE B 115 3.414 9.953 -15.231 1.00 0.00 N ATOM 1744 CA ILE B 115 1.954 10.174 -15.294 1.00 0.00 C ATOM 1745 C ILE B 115 1.633 11.351 -16.239 1.00 0.00 C ATOM 1746 O ILE B 115 2.381 12.327 -16.265 1.00 0.00 O ATOM 1747 CB ILE B 115 1.410 10.427 -13.854 1.00 0.00 C ATOM 1748 CG1 ILE B 115 1.791 9.298 -12.861 1.00 0.00 C ATOM 1749 CG2 ILE B 115 -0.117 10.659 -13.865 1.00 0.00 C ATOM 1750 CD1 ILE B 115 1.296 9.487 -11.420 1.00 0.00 C ATOM 0 H ILE B 115 3.942 10.821 -15.141 1.00 0.00 H new ATOM 0 HA ILE B 115 1.462 9.289 -15.697 1.00 0.00 H new ATOM 0 HB ILE B 115 1.894 11.336 -13.498 1.00 0.00 H new ATOM 0 HG12 ILE B 115 1.396 8.356 -13.241 1.00 0.00 H new ATOM 0 HG13 ILE B 115 2.877 9.205 -12.844 1.00 0.00 H new ATOM 0 HG21 ILE B 115 -0.466 10.832 -12.847 1.00 0.00 H new ATOM 0 HG22 ILE B 115 -0.349 11.528 -14.481 1.00 0.00 H new ATOM 0 HG23 ILE B 115 -0.616 9.781 -14.275 1.00 0.00 H new ATOM 0 HD11 ILE B 115 1.617 8.642 -10.811 1.00 0.00 H new ATOM 0 HD12 ILE B 115 1.711 10.408 -11.010 1.00 0.00 H new ATOM 0 HD13 ILE B 115 0.208 9.546 -11.414 1.00 0.00 H new ATOM 1762 N GLU B 116 0.521 11.288 -16.981 1.00 0.00 N ATOM 1763 CA GLU B 116 -0.075 12.418 -17.711 1.00 0.00 C ATOM 1764 C GLU B 116 -1.532 12.626 -17.247 1.00 0.00 C ATOM 1765 O GLU B 116 -2.445 11.923 -17.689 1.00 0.00 O ATOM 1766 CB GLU B 116 -0.003 12.185 -19.238 1.00 0.00 C ATOM 1767 CG GLU B 116 -0.233 13.500 -20.002 1.00 0.00 C ATOM 1768 CD GLU B 116 -0.647 13.319 -21.461 1.00 0.00 C ATOM 1769 OE1 GLU B 116 -0.101 12.438 -22.168 1.00 0.00 O ATOM 1770 OE2 GLU B 116 -1.537 14.084 -21.912 1.00 0.00 O ATOM 0 H GLU B 116 -0.007 10.423 -17.095 1.00 0.00 H new ATOM 0 HA GLU B 116 0.493 13.322 -17.491 1.00 0.00 H new ATOM 0 HB2 GLU B 116 0.970 11.771 -19.502 1.00 0.00 H new ATOM 0 HB3 GLU B 116 -0.752 11.451 -19.534 1.00 0.00 H new ATOM 0 HG2 GLU B 116 -1.003 14.075 -19.487 1.00 0.00 H new ATOM 0 HG3 GLU B 116 0.682 14.091 -19.968 1.00 0.00 H new ATOM 1777 N SER B 117 -1.775 13.582 -16.347 1.00 0.00 N ATOM 1778 CA SER B 117 -3.090 13.782 -15.711 1.00 0.00 C ATOM 1779 C SER B 117 -3.574 15.246 -15.705 1.00 0.00 C ATOM 1780 O SER B 117 -2.774 16.188 -15.734 1.00 0.00 O ATOM 1781 CB SER B 117 -3.016 13.248 -14.273 1.00 0.00 C ATOM 1782 OG SER B 117 -4.244 13.410 -13.584 1.00 0.00 O ATOM 0 H SER B 117 -1.065 14.245 -16.034 1.00 0.00 H new ATOM 0 HA SER B 117 -3.822 13.237 -16.306 1.00 0.00 H new ATOM 0 HB2 SER B 117 -2.747 12.192 -14.292 1.00 0.00 H new ATOM 0 HB3 SER B 117 -2.225 13.769 -13.733 1.00 0.00 H new ATOM 0 HG SER B 117 -4.951 12.923 -14.057 1.00 0.00 H new ATOM 1788 N GLU B 118 -4.898 15.450 -15.612 1.00 0.00 N ATOM 1789 CA GLU B 118 -5.504 16.759 -15.324 1.00 0.00 C ATOM 1790 C GLU B 118 -5.420 17.162 -13.838 1.00 0.00 C ATOM 1791 O GLU B 118 -5.749 18.292 -13.487 1.00 0.00 O ATOM 1792 CB GLU B 118 -6.955 16.836 -15.853 1.00 0.00 C ATOM 1793 CG GLU B 118 -7.984 15.929 -15.153 1.00 0.00 C ATOM 1794 CD GLU B 118 -9.419 16.270 -15.570 1.00 0.00 C ATOM 1795 OE1 GLU B 118 -9.938 17.330 -15.141 1.00 0.00 O ATOM 1796 OE2 GLU B 118 -10.067 15.493 -16.308 1.00 0.00 O ATOM 0 H GLU B 118 -5.583 14.705 -15.736 1.00 0.00 H new ATOM 0 HA GLU B 118 -4.906 17.493 -15.864 1.00 0.00 H new ATOM 0 HB2 GLU B 118 -7.296 17.868 -15.770 1.00 0.00 H new ATOM 0 HB3 GLU B 118 -6.946 16.588 -16.914 1.00 0.00 H new ATOM 0 HG2 GLU B 118 -7.773 14.887 -15.394 1.00 0.00 H new ATOM 0 HG3 GLU B 118 -7.885 16.033 -14.073 1.00 0.00 H new ATOM 1803 N HIS B 119 -4.976 16.263 -12.960 1.00 0.00 N ATOM 1804 CA HIS B 119 -4.955 16.475 -11.511 1.00 0.00 C ATOM 1805 C HIS B 119 -3.736 17.278 -11.004 1.00 0.00 C ATOM 1806 O HIS B 119 -2.667 17.300 -11.623 1.00 0.00 O ATOM 1807 CB HIS B 119 -5.025 15.115 -10.795 1.00 0.00 C ATOM 1808 CG HIS B 119 -6.258 14.293 -11.087 1.00 0.00 C ATOM 1809 ND1 HIS B 119 -7.547 14.756 -11.235 1.00 0.00 N ATOM 1810 CD2 HIS B 119 -6.315 12.928 -11.187 1.00 0.00 C ATOM 1811 CE1 HIS B 119 -8.355 13.700 -11.404 1.00 0.00 C ATOM 1812 NE2 HIS B 119 -7.648 12.558 -11.396 1.00 0.00 N ATOM 0 H HIS B 119 -4.614 15.351 -13.239 1.00 0.00 H new ATOM 0 HA HIS B 119 -5.828 17.084 -11.276 1.00 0.00 H new ATOM 0 HB2 HIS B 119 -4.146 14.532 -11.071 1.00 0.00 H new ATOM 0 HB3 HIS B 119 -4.969 15.286 -9.720 1.00 0.00 H new ATOM 0 HD2 HIS B 119 -5.475 12.253 -11.117 1.00 0.00 H new ATOM 0 HE1 HIS B 119 -9.426 13.759 -11.529 1.00 0.00 H new ATOM 0 HE2 HIS B 119 -8.010 11.612 -11.518 1.00 0.00 H new ATOM 1820 N SER B 120 -3.893 17.894 -9.831 1.00 0.00 N ATOM 1821 CA SER B 120 -2.841 18.553 -9.046 1.00 0.00 C ATOM 1822 C SER B 120 -1.752 17.594 -8.522 1.00 0.00 C ATOM 1823 O SER B 120 -2.050 16.473 -8.096 1.00 0.00 O ATOM 1824 CB SER B 120 -3.490 19.240 -7.836 1.00 0.00 C ATOM 1825 OG SER B 120 -4.251 20.374 -8.205 1.00 0.00 O ATOM 0 H SER B 120 -4.805 17.951 -9.377 1.00 0.00 H new ATOM 0 HA SER B 120 -2.351 19.258 -9.717 1.00 0.00 H new ATOM 0 HB2 SER B 120 -4.132 18.528 -7.318 1.00 0.00 H new ATOM 0 HB3 SER B 120 -2.714 19.540 -7.132 1.00 0.00 H new ATOM 0 HG SER B 120 -4.646 20.778 -7.404 1.00 0.00 H new ATOM 1831 N MET B 121 -0.488 18.045 -8.483 1.00 0.00 N ATOM 1832 CA MET B 121 0.640 17.188 -8.082 1.00 0.00 C ATOM 1833 C MET B 121 0.616 16.755 -6.612 1.00 0.00 C ATOM 1834 O MET B 121 0.942 15.603 -6.343 1.00 0.00 O ATOM 1835 CB MET B 121 2.007 17.760 -8.515 1.00 0.00 C ATOM 1836 CG MET B 121 2.336 19.223 -8.163 1.00 0.00 C ATOM 1837 SD MET B 121 2.439 19.723 -6.420 1.00 0.00 S ATOM 1838 CE MET B 121 3.657 18.550 -5.773 1.00 0.00 C ATOM 0 H MET B 121 -0.221 18.999 -8.725 1.00 0.00 H new ATOM 0 HA MET B 121 0.497 16.264 -8.642 1.00 0.00 H new ATOM 0 HB2 MET B 121 2.783 17.131 -8.078 1.00 0.00 H new ATOM 0 HB3 MET B 121 2.083 17.654 -9.597 1.00 0.00 H new ATOM 0 HG2 MET B 121 3.292 19.464 -8.629 1.00 0.00 H new ATOM 0 HG3 MET B 121 1.582 19.851 -8.639 1.00 0.00 H new ATOM 0 HE1 MET B 121 3.766 18.694 -4.698 1.00 0.00 H new ATOM 0 HE2 MET B 121 3.322 17.532 -5.971 1.00 0.00 H new ATOM 0 HE3 MET B 121 4.618 18.717 -6.260 1.00 0.00 H new ATOM 1848 N ASP B 122 0.184 17.593 -5.664 1.00 0.00 N ATOM 1849 CA ASP B 122 0.076 17.203 -4.247 1.00 0.00 C ATOM 1850 C ASP B 122 -1.087 16.220 -4.001 1.00 0.00 C ATOM 1851 O ASP B 122 -1.079 15.493 -3.006 1.00 0.00 O ATOM 1852 CB ASP B 122 -0.013 18.447 -3.345 1.00 0.00 C ATOM 1853 CG ASP B 122 0.210 18.141 -1.854 1.00 0.00 C ATOM 1854 OD1 ASP B 122 1.200 17.456 -1.503 1.00 0.00 O ATOM 1855 OD2 ASP B 122 -0.570 18.641 -1.004 1.00 0.00 O ATOM 0 H ASP B 122 -0.100 18.555 -5.851 1.00 0.00 H new ATOM 0 HA ASP B 122 0.986 16.666 -3.981 1.00 0.00 H new ATOM 0 HB2 ASP B 122 0.727 19.177 -3.673 1.00 0.00 H new ATOM 0 HB3 ASP B 122 -0.993 18.908 -3.471 1.00 0.00 H new ATOM 1860 N THR B 123 -2.085 16.177 -4.900 1.00 0.00 N ATOM 1861 CA THR B 123 -3.180 15.187 -4.901 1.00 0.00 C ATOM 1862 C THR B 123 -2.673 13.824 -5.368 1.00 0.00 C ATOM 1863 O THR B 123 -2.927 12.815 -4.707 1.00 0.00 O ATOM 1864 CB THR B 123 -4.361 15.685 -5.749 1.00 0.00 C ATOM 1865 OG1 THR B 123 -4.721 16.964 -5.274 1.00 0.00 O ATOM 1866 CG2 THR B 123 -5.588 14.782 -5.619 1.00 0.00 C ATOM 0 H THR B 123 -2.156 16.846 -5.667 1.00 0.00 H new ATOM 0 HA THR B 123 -3.544 15.065 -3.881 1.00 0.00 H new ATOM 0 HB THR B 123 -4.051 15.694 -6.794 1.00 0.00 H new ATOM 0 HG1 THR B 123 -5.473 17.308 -5.799 1.00 0.00 H new ATOM 0 HG21 THR B 123 -6.396 15.175 -6.236 1.00 0.00 H new ATOM 0 HG22 THR B 123 -5.335 13.775 -5.950 1.00 0.00 H new ATOM 0 HG23 THR B 123 -5.909 14.752 -4.578 1.00 0.00 H new ATOM 1874 N LEU B 124 -1.913 13.794 -6.471 1.00 0.00 N ATOM 1875 CA LEU B 124 -1.200 12.594 -6.940 1.00 0.00 C ATOM 1876 C LEU B 124 -0.231 12.074 -5.864 1.00 0.00 C ATOM 1877 O LEU B 124 -0.286 10.898 -5.503 1.00 0.00 O ATOM 1878 CB LEU B 124 -0.443 12.910 -8.251 1.00 0.00 C ATOM 1879 CG LEU B 124 -1.318 13.250 -9.478 1.00 0.00 C ATOM 1880 CD1 LEU B 124 -0.419 13.697 -10.641 1.00 0.00 C ATOM 1881 CD2 LEU B 124 -2.167 12.054 -9.934 1.00 0.00 C ATOM 0 H LEU B 124 -1.773 14.608 -7.069 1.00 0.00 H new ATOM 0 HA LEU B 124 -1.931 11.810 -7.136 1.00 0.00 H new ATOM 0 HB2 LEU B 124 0.228 13.749 -8.066 1.00 0.00 H new ATOM 0 HB3 LEU B 124 0.181 12.052 -8.502 1.00 0.00 H new ATOM 0 HG LEU B 124 -1.996 14.051 -9.184 1.00 0.00 H new ATOM 0 HD11 LEU B 124 -1.036 13.937 -11.507 1.00 0.00 H new ATOM 0 HD12 LEU B 124 0.148 14.579 -10.344 1.00 0.00 H new ATOM 0 HD13 LEU B 124 0.270 12.892 -10.898 1.00 0.00 H new ATOM 0 HD21 LEU B 124 -2.765 12.341 -10.799 1.00 0.00 H new ATOM 0 HD22 LEU B 124 -1.513 11.225 -10.204 1.00 0.00 H new ATOM 0 HD23 LEU B 124 -2.827 11.746 -9.123 1.00 0.00 H new ATOM 1893 N LEU B 125 0.606 12.958 -5.312 1.00 0.00 N ATOM 1894 CA LEU B 125 1.592 12.671 -4.266 1.00 0.00 C ATOM 1895 C LEU B 125 0.933 12.085 -3.010 1.00 0.00 C ATOM 1896 O LEU B 125 1.316 11.001 -2.577 1.00 0.00 O ATOM 1897 CB LEU B 125 2.356 13.984 -3.993 1.00 0.00 C ATOM 1898 CG LEU B 125 3.483 13.934 -2.947 1.00 0.00 C ATOM 1899 CD1 LEU B 125 4.551 12.892 -3.299 1.00 0.00 C ATOM 1900 CD2 LEU B 125 4.136 15.320 -2.825 1.00 0.00 C ATOM 0 H LEU B 125 0.615 13.938 -5.595 1.00 0.00 H new ATOM 0 HA LEU B 125 2.294 11.903 -4.592 1.00 0.00 H new ATOM 0 HB2 LEU B 125 2.783 14.329 -4.935 1.00 0.00 H new ATOM 0 HB3 LEU B 125 1.634 14.736 -3.676 1.00 0.00 H new ATOM 0 HG LEU B 125 3.037 13.642 -1.996 1.00 0.00 H new ATOM 0 HD11 LEU B 125 5.326 12.892 -2.533 1.00 0.00 H new ATOM 0 HD12 LEU B 125 4.093 11.904 -3.351 1.00 0.00 H new ATOM 0 HD13 LEU B 125 4.995 13.137 -4.264 1.00 0.00 H new ATOM 0 HD21 LEU B 125 4.934 15.282 -2.083 1.00 0.00 H new ATOM 0 HD22 LEU B 125 4.550 15.613 -3.790 1.00 0.00 H new ATOM 0 HD23 LEU B 125 3.387 16.049 -2.515 1.00 0.00 H new ATOM 1912 N ALA B 126 -0.096 12.741 -2.463 1.00 0.00 N ATOM 1913 CA ALA B 126 -0.837 12.257 -1.293 1.00 0.00 C ATOM 1914 C ALA B 126 -1.519 10.896 -1.511 1.00 0.00 C ATOM 1915 O ALA B 126 -1.681 10.143 -0.549 1.00 0.00 O ATOM 1916 CB ALA B 126 -1.878 13.313 -0.914 1.00 0.00 C ATOM 0 H ALA B 126 -0.441 13.631 -2.823 1.00 0.00 H new ATOM 0 HA ALA B 126 -0.118 12.100 -0.489 1.00 0.00 H new ATOM 0 HB1 ALA B 126 -2.441 12.973 -0.045 1.00 0.00 H new ATOM 0 HB2 ALA B 126 -1.375 14.251 -0.677 1.00 0.00 H new ATOM 0 HB3 ALA B 126 -2.560 13.468 -1.750 1.00 0.00 H new ATOM 1922 N THR B 127 -1.919 10.584 -2.752 1.00 0.00 N ATOM 1923 CA THR B 127 -2.498 9.285 -3.138 1.00 0.00 C ATOM 1924 C THR B 127 -1.430 8.193 -3.145 1.00 0.00 C ATOM 1925 O THR B 127 -1.633 7.143 -2.541 1.00 0.00 O ATOM 1926 CB THR B 127 -3.219 9.394 -4.486 1.00 0.00 C ATOM 1927 OG1 THR B 127 -4.205 10.399 -4.381 1.00 0.00 O ATOM 1928 CG2 THR B 127 -3.928 8.092 -4.860 1.00 0.00 C ATOM 0 H THR B 127 -1.849 11.238 -3.531 1.00 0.00 H new ATOM 0 HA THR B 127 -3.242 9.001 -2.394 1.00 0.00 H new ATOM 0 HB THR B 127 -2.475 9.621 -5.249 1.00 0.00 H new ATOM 0 HG1 THR B 127 -3.823 11.261 -4.646 1.00 0.00 H new ATOM 0 HG21 THR B 127 -4.426 8.212 -5.822 1.00 0.00 H new ATOM 0 HG22 THR B 127 -3.197 7.286 -4.928 1.00 0.00 H new ATOM 0 HG23 THR B 127 -4.667 7.848 -4.097 1.00 0.00 H new ATOM 1936 N LEU B 128 -0.274 8.442 -3.770 1.00 0.00 N ATOM 1937 CA LEU B 128 0.855 7.501 -3.792 1.00 0.00 C ATOM 1938 C LEU B 128 1.388 7.208 -2.380 1.00 0.00 C ATOM 1939 O LEU B 128 1.684 6.057 -2.055 1.00 0.00 O ATOM 1940 CB LEU B 128 1.968 8.072 -4.695 1.00 0.00 C ATOM 1941 CG LEU B 128 1.652 8.069 -6.205 1.00 0.00 C ATOM 1942 CD1 LEU B 128 2.708 8.895 -6.955 1.00 0.00 C ATOM 1943 CD2 LEU B 128 1.625 6.639 -6.771 1.00 0.00 C ATOM 0 H LEU B 128 -0.093 9.307 -4.279 1.00 0.00 H new ATOM 0 HA LEU B 128 0.507 6.550 -4.196 1.00 0.00 H new ATOM 0 HB2 LEU B 128 2.176 9.096 -4.385 1.00 0.00 H new ATOM 0 HB3 LEU B 128 2.879 7.498 -4.529 1.00 0.00 H new ATOM 0 HG LEU B 128 0.665 8.509 -6.343 1.00 0.00 H new ATOM 0 HD11 LEU B 128 2.483 8.891 -8.021 1.00 0.00 H new ATOM 0 HD12 LEU B 128 2.698 9.920 -6.585 1.00 0.00 H new ATOM 0 HD13 LEU B 128 3.694 8.460 -6.791 1.00 0.00 H new ATOM 0 HD21 LEU B 128 1.400 6.674 -7.837 1.00 0.00 H new ATOM 0 HD22 LEU B 128 2.597 6.170 -6.621 1.00 0.00 H new ATOM 0 HD23 LEU B 128 0.859 6.059 -6.257 1.00 0.00 H new ATOM 1955 N LYS B 129 1.464 8.219 -1.512 1.00 0.00 N ATOM 1956 CA LYS B 129 1.964 8.106 -0.131 1.00 0.00 C ATOM 1957 C LYS B 129 1.145 7.149 0.769 1.00 0.00 C ATOM 1958 O LYS B 129 1.671 6.641 1.764 1.00 0.00 O ATOM 1959 CB LYS B 129 2.063 9.528 0.453 1.00 0.00 C ATOM 1960 CG LYS B 129 3.276 10.289 -0.122 1.00 0.00 C ATOM 1961 CD LYS B 129 3.211 11.803 0.115 1.00 0.00 C ATOM 1962 CE LYS B 129 3.342 12.175 1.590 1.00 0.00 C ATOM 1963 NZ LYS B 129 2.785 13.518 1.874 1.00 0.00 N ATOM 0 H LYS B 129 1.173 9.167 -1.752 1.00 0.00 H new ATOM 0 HA LYS B 129 2.948 7.639 -0.159 1.00 0.00 H new ATOM 0 HB2 LYS B 129 1.148 10.078 0.232 1.00 0.00 H new ATOM 0 HB3 LYS B 129 2.147 9.472 1.538 1.00 0.00 H new ATOM 0 HG2 LYS B 129 4.188 9.897 0.327 1.00 0.00 H new ATOM 0 HG3 LYS B 129 3.341 10.098 -1.193 1.00 0.00 H new ATOM 0 HD2 LYS B 129 4.006 12.289 -0.450 1.00 0.00 H new ATOM 0 HD3 LYS B 129 2.266 12.187 -0.270 1.00 0.00 H new ATOM 0 HE2 LYS B 129 2.826 11.432 2.199 1.00 0.00 H new ATOM 0 HE3 LYS B 129 4.393 12.150 1.879 1.00 0.00 H new ATOM 0 HZ1 LYS B 129 2.894 13.732 2.886 1.00 0.00 H new ATOM 0 HZ2 LYS B 129 3.294 14.231 1.313 1.00 0.00 H new ATOM 0 HZ3 LYS B 129 1.776 13.536 1.623 1.00 0.00 H new ATOM 1977 N LYS B 130 -0.090 6.789 0.390 1.00 0.00 N ATOM 1978 CA LYS B 130 -0.885 5.744 1.068 1.00 0.00 C ATOM 1979 C LYS B 130 -0.265 4.335 0.961 1.00 0.00 C ATOM 1980 O LYS B 130 -0.525 3.474 1.798 1.00 0.00 O ATOM 1981 CB LYS B 130 -2.311 5.715 0.494 1.00 0.00 C ATOM 1982 CG LYS B 130 -3.029 7.069 0.538 1.00 0.00 C ATOM 1983 CD LYS B 130 -4.478 6.962 0.050 1.00 0.00 C ATOM 1984 CE LYS B 130 -5.366 6.338 1.131 1.00 0.00 C ATOM 1985 NZ LYS B 130 -6.665 5.896 0.583 1.00 0.00 N ATOM 0 H LYS B 130 -0.572 7.216 -0.401 1.00 0.00 H new ATOM 0 HA LYS B 130 -0.899 6.008 2.126 1.00 0.00 H new ATOM 0 HB2 LYS B 130 -2.269 5.371 -0.540 1.00 0.00 H new ATOM 0 HB3 LYS B 130 -2.900 4.985 1.049 1.00 0.00 H new ATOM 0 HG2 LYS B 130 -3.017 7.454 1.558 1.00 0.00 H new ATOM 0 HG3 LYS B 130 -2.489 7.787 -0.080 1.00 0.00 H new ATOM 0 HD2 LYS B 130 -4.854 7.951 -0.210 1.00 0.00 H new ATOM 0 HD3 LYS B 130 -4.519 6.357 -0.856 1.00 0.00 H new ATOM 0 HE2 LYS B 130 -4.851 5.488 1.578 1.00 0.00 H new ATOM 0 HE3 LYS B 130 -5.535 7.063 1.927 1.00 0.00 H new ATOM 0 HZ1 LYS B 130 -7.239 5.479 1.344 1.00 0.00 H new ATOM 0 HZ2 LYS B 130 -7.167 6.712 0.178 1.00 0.00 H new ATOM 0 HZ3 LYS B 130 -6.505 5.185 -0.159 1.00 0.00 H new ATOM 1999 N THR B 131 0.605 4.098 -0.036 1.00 0.00 N ATOM 2000 CA THR B 131 1.341 2.832 -0.227 1.00 0.00 C ATOM 2001 C THR B 131 2.445 2.575 0.801 1.00 0.00 C ATOM 2002 O THR B 131 3.133 1.564 0.674 1.00 0.00 O ATOM 2003 CB THR B 131 1.902 2.696 -1.650 1.00 0.00 C ATOM 2004 OG1 THR B 131 2.878 3.680 -1.889 1.00 0.00 O ATOM 2005 CG2 THR B 131 0.819 2.791 -2.718 1.00 0.00 C ATOM 0 H THR B 131 0.822 4.795 -0.748 1.00 0.00 H new ATOM 0 HA THR B 131 0.587 2.062 -0.066 1.00 0.00 H new ATOM 0 HB THR B 131 2.348 1.703 -1.715 1.00 0.00 H new ATOM 0 HG1 THR B 131 2.448 4.490 -2.234 1.00 0.00 H new ATOM 0 HG21 THR B 131 1.271 2.688 -3.705 1.00 0.00 H new ATOM 0 HG22 THR B 131 0.090 1.995 -2.568 1.00 0.00 H new ATOM 0 HG23 THR B 131 0.321 3.758 -2.646 1.00 0.00 H new ATOM 2013 N GLY B 132 2.664 3.457 1.784 1.00 0.00 N ATOM 2014 CA GLY B 132 3.681 3.272 2.828 1.00 0.00 C ATOM 2015 C GLY B 132 5.091 3.444 2.277 1.00 0.00 C ATOM 2016 O GLY B 132 5.903 2.521 2.348 1.00 0.00 O ATOM 0 H GLY B 132 2.137 4.325 1.878 1.00 0.00 H new ATOM 0 HA2 GLY B 132 3.514 3.990 3.631 1.00 0.00 H new ATOM 0 HA3 GLY B 132 3.579 2.278 3.263 1.00 0.00 H new ATOM 2020 N LYS B 133 5.351 4.597 1.653 1.00 0.00 N ATOM 2021 CA LYS B 133 6.601 4.921 0.952 1.00 0.00 C ATOM 2022 C LYS B 133 7.016 6.379 1.171 1.00 0.00 C ATOM 2023 O LYS B 133 6.160 7.266 1.264 1.00 0.00 O ATOM 2024 CB LYS B 133 6.447 4.658 -0.566 1.00 0.00 C ATOM 2025 CG LYS B 133 6.044 3.229 -0.969 1.00 0.00 C ATOM 2026 CD LYS B 133 7.116 2.170 -0.673 1.00 0.00 C ATOM 2027 CE LYS B 133 6.543 0.749 -0.786 1.00 0.00 C ATOM 2028 NZ LYS B 133 5.646 0.433 0.353 1.00 0.00 N ATOM 0 H LYS B 133 4.674 5.359 1.620 1.00 0.00 H new ATOM 0 HA LYS B 133 7.379 4.278 1.365 1.00 0.00 H new ATOM 0 HB2 LYS B 133 5.701 5.348 -0.960 1.00 0.00 H new ATOM 0 HB3 LYS B 133 7.392 4.898 -1.053 1.00 0.00 H new ATOM 0 HG2 LYS B 133 5.127 2.960 -0.444 1.00 0.00 H new ATOM 0 HG3 LYS B 133 5.817 3.214 -2.035 1.00 0.00 H new ATOM 0 HD2 LYS B 133 7.947 2.286 -1.369 1.00 0.00 H new ATOM 0 HD3 LYS B 133 7.516 2.325 0.329 1.00 0.00 H new ATOM 0 HE2 LYS B 133 5.993 0.651 -1.722 1.00 0.00 H new ATOM 0 HE3 LYS B 133 7.360 0.028 -0.819 1.00 0.00 H new ATOM 0 HZ1 LYS B 133 5.680 -0.588 0.549 1.00 0.00 H new ATOM 0 HZ2 LYS B 133 5.957 0.958 1.195 1.00 0.00 H new ATOM 0 HZ3 LYS B 133 4.672 0.707 0.114 1.00 0.00 H new ATOM 2042 N THR B 134 8.331 6.628 1.131 1.00 0.00 N ATOM 2043 CA THR B 134 8.868 7.925 0.706 1.00 0.00 C ATOM 2044 C THR B 134 8.609 8.054 -0.786 1.00 0.00 C ATOM 2045 O THR B 134 9.149 7.279 -1.577 1.00 0.00 O ATOM 2046 CB THR B 134 10.362 8.066 0.991 1.00 0.00 C ATOM 2047 OG1 THR B 134 10.598 7.753 2.337 1.00 0.00 O ATOM 2048 CG2 THR B 134 10.855 9.497 0.770 1.00 0.00 C ATOM 0 H THR B 134 9.044 5.945 1.389 1.00 0.00 H new ATOM 0 HA THR B 134 8.374 8.716 1.271 1.00 0.00 H new ATOM 0 HB THR B 134 10.889 7.396 0.311 1.00 0.00 H new ATOM 0 HG1 THR B 134 11.555 7.839 2.530 1.00 0.00 H new ATOM 0 HG21 THR B 134 11.922 9.551 0.984 1.00 0.00 H new ATOM 0 HG22 THR B 134 10.678 9.787 -0.266 1.00 0.00 H new ATOM 0 HG23 THR B 134 10.317 10.174 1.434 1.00 0.00 H new ATOM 2056 N VAL B 135 7.770 9.012 -1.147 1.00 0.00 N ATOM 2057 CA VAL B 135 7.483 9.420 -2.535 1.00 0.00 C ATOM 2058 C VAL B 135 8.105 10.802 -2.789 1.00 0.00 C ATOM 2059 O VAL B 135 8.045 11.671 -1.918 1.00 0.00 O ATOM 2060 CB VAL B 135 5.961 9.464 -2.806 1.00 0.00 C ATOM 2061 CG1 VAL B 135 5.656 9.697 -4.299 1.00 0.00 C ATOM 2062 CG2 VAL B 135 5.247 8.178 -2.346 1.00 0.00 C ATOM 0 H VAL B 135 7.244 9.555 -0.462 1.00 0.00 H new ATOM 0 HA VAL B 135 7.917 8.685 -3.213 1.00 0.00 H new ATOM 0 HB VAL B 135 5.580 10.303 -2.223 1.00 0.00 H new ATOM 0 HG11 VAL B 135 4.577 9.722 -4.450 1.00 0.00 H new ATOM 0 HG12 VAL B 135 6.089 10.646 -4.615 1.00 0.00 H new ATOM 0 HG13 VAL B 135 6.087 8.888 -4.889 1.00 0.00 H new ATOM 0 HG21 VAL B 135 4.181 8.258 -2.558 1.00 0.00 H new ATOM 0 HG22 VAL B 135 5.660 7.322 -2.880 1.00 0.00 H new ATOM 0 HG23 VAL B 135 5.395 8.043 -1.275 1.00 0.00 H new ATOM 2072 N SER B 136 8.704 11.016 -3.964 1.00 0.00 N ATOM 2073 CA SER B 136 9.377 12.282 -4.312 1.00 0.00 C ATOM 2074 C SER B 136 9.018 12.763 -5.729 1.00 0.00 C ATOM 2075 O SER B 136 9.346 12.099 -6.713 1.00 0.00 O ATOM 2076 CB SER B 136 10.904 12.112 -4.209 1.00 0.00 C ATOM 2077 OG SER B 136 11.322 11.609 -2.948 1.00 0.00 O ATOM 0 H SER B 136 8.739 10.317 -4.706 1.00 0.00 H new ATOM 0 HA SER B 136 9.030 13.034 -3.603 1.00 0.00 H new ATOM 0 HB2 SER B 136 11.243 11.436 -4.994 1.00 0.00 H new ATOM 0 HB3 SER B 136 11.384 13.074 -4.388 1.00 0.00 H new ATOM 0 HG SER B 136 12.298 11.519 -2.939 1.00 0.00 H new ATOM 2083 N TYR B 137 8.384 13.937 -5.854 1.00 0.00 N ATOM 2084 CA TYR B 137 8.039 14.552 -7.145 1.00 0.00 C ATOM 2085 C TYR B 137 9.278 15.129 -7.856 1.00 0.00 C ATOM 2086 O TYR B 137 9.926 16.047 -7.340 1.00 0.00 O ATOM 2087 CB TYR B 137 6.966 15.633 -6.927 1.00 0.00 C ATOM 2088 CG TYR B 137 6.520 16.362 -8.187 1.00 0.00 C ATOM 2089 CD1 TYR B 137 6.214 15.638 -9.355 1.00 0.00 C ATOM 2090 CD2 TYR B 137 6.398 17.767 -8.194 1.00 0.00 C ATOM 2091 CE1 TYR B 137 5.793 16.306 -10.516 1.00 0.00 C ATOM 2092 CE2 TYR B 137 5.929 18.439 -9.342 1.00 0.00 C ATOM 2093 CZ TYR B 137 5.616 17.704 -10.510 1.00 0.00 C ATOM 2094 OH TYR B 137 5.134 18.326 -11.619 1.00 0.00 O ATOM 0 H TYR B 137 8.092 14.494 -5.051 1.00 0.00 H new ATOM 0 HA TYR B 137 7.638 13.778 -7.800 1.00 0.00 H new ATOM 0 HB2 TYR B 137 6.094 15.170 -6.466 1.00 0.00 H new ATOM 0 HB3 TYR B 137 7.350 16.366 -6.218 1.00 0.00 H new ATOM 0 HD1 TYR B 137 6.304 14.562 -9.358 1.00 0.00 H new ATOM 0 HD2 TYR B 137 6.666 18.333 -7.314 1.00 0.00 H new ATOM 0 HE1 TYR B 137 5.604 15.745 -11.419 1.00 0.00 H new ATOM 0 HE2 TYR B 137 5.809 19.512 -9.330 1.00 0.00 H new ATOM 0 HH TYR B 137 5.070 19.290 -11.452 1.00 0.00 H new ATOM 2104 N LEU B 138 9.616 14.574 -9.027 1.00 0.00 N ATOM 2105 CA LEU B 138 10.923 14.702 -9.680 1.00 0.00 C ATOM 2106 C LEU B 138 10.808 14.609 -11.216 1.00 0.00 C ATOM 2107 O LEU B 138 11.417 13.738 -11.852 1.00 0.00 O ATOM 2108 CB LEU B 138 11.885 13.636 -9.095 1.00 0.00 C ATOM 2109 CG LEU B 138 12.350 13.846 -7.638 1.00 0.00 C ATOM 2110 CD1 LEU B 138 13.117 12.607 -7.166 1.00 0.00 C ATOM 2111 CD2 LEU B 138 13.246 15.085 -7.495 1.00 0.00 C ATOM 0 H LEU B 138 8.963 14.003 -9.564 1.00 0.00 H new ATOM 0 HA LEU B 138 11.332 15.691 -9.475 1.00 0.00 H new ATOM 0 HB2 LEU B 138 11.395 12.664 -9.159 1.00 0.00 H new ATOM 0 HB3 LEU B 138 12.769 13.590 -9.731 1.00 0.00 H new ATOM 0 HG LEU B 138 11.463 14.002 -7.024 1.00 0.00 H new ATOM 0 HD11 LEU B 138 13.446 12.753 -6.137 1.00 0.00 H new ATOM 0 HD12 LEU B 138 12.466 11.734 -7.218 1.00 0.00 H new ATOM 0 HD13 LEU B 138 13.985 12.451 -7.806 1.00 0.00 H new ATOM 0 HD21 LEU B 138 13.551 15.196 -6.454 1.00 0.00 H new ATOM 0 HD22 LEU B 138 14.130 14.969 -8.122 1.00 0.00 H new ATOM 0 HD23 LEU B 138 12.694 15.971 -7.808 1.00 0.00 H new ATOM 2123 N GLY B 139 10.079 15.547 -11.827 1.00 0.00 N ATOM 2124 CA GLY B 139 10.127 15.825 -13.268 1.00 0.00 C ATOM 2125 C GLY B 139 8.834 16.379 -13.863 1.00 0.00 C ATOM 2126 O GLY B 139 7.744 15.905 -13.543 1.00 0.00 O ATOM 0 H GLY B 139 9.425 16.147 -11.325 1.00 0.00 H new ATOM 0 HA2 GLY B 139 10.931 16.536 -13.459 1.00 0.00 H new ATOM 0 HA3 GLY B 139 10.385 14.905 -13.792 1.00 0.00 H new ATOM 2130 N LEU B 140 8.973 17.334 -14.789 1.00 0.00 N ATOM 2131 CA LEU B 140 7.887 18.017 -15.504 1.00 0.00 C ATOM 2132 C LEU B 140 8.341 18.469 -16.904 1.00 0.00 C ATOM 2133 O LEU B 140 9.476 18.922 -17.074 1.00 0.00 O ATOM 2134 CB LEU B 140 7.444 19.216 -14.640 1.00 0.00 C ATOM 2135 CG LEU B 140 6.300 20.076 -15.220 1.00 0.00 C ATOM 2136 CD1 LEU B 140 5.029 19.254 -15.480 1.00 0.00 C ATOM 2137 CD2 LEU B 140 5.983 21.223 -14.250 1.00 0.00 C ATOM 0 H LEU B 140 9.893 17.669 -15.075 1.00 0.00 H new ATOM 0 HA LEU B 140 7.049 17.338 -15.658 1.00 0.00 H new ATOM 0 HB2 LEU B 140 7.133 18.842 -13.665 1.00 0.00 H new ATOM 0 HB3 LEU B 140 8.308 19.859 -14.474 1.00 0.00 H new ATOM 0 HG LEU B 140 6.636 20.471 -16.179 1.00 0.00 H new ATOM 0 HD11 LEU B 140 4.253 19.902 -15.887 1.00 0.00 H new ATOM 0 HD12 LEU B 140 5.249 18.459 -16.193 1.00 0.00 H new ATOM 0 HD13 LEU B 140 4.681 18.816 -14.544 1.00 0.00 H new ATOM 0 HD21 LEU B 140 5.176 21.831 -14.657 1.00 0.00 H new ATOM 0 HD22 LEU B 140 5.677 20.812 -13.288 1.00 0.00 H new ATOM 0 HD23 LEU B 140 6.871 21.841 -14.115 1.00 0.00 H new ATOM 2149 N GLU B 141 7.449 18.381 -17.897 1.00 0.00 N ATOM 2150 CA GLU B 141 7.664 18.845 -19.287 1.00 0.00 C ATOM 2151 C GLU B 141 7.192 20.290 -19.510 1.00 0.00 C ATOM 2152 O GLU B 141 5.980 20.554 -19.674 1.00 0.00 O ATOM 2153 CB GLU B 141 7.000 17.876 -20.285 1.00 0.00 C ATOM 2154 CG GLU B 141 7.458 16.410 -20.182 1.00 0.00 C ATOM 2155 CD GLU B 141 8.937 16.174 -20.544 1.00 0.00 C ATOM 2156 OE1 GLU B 141 9.836 16.445 -19.714 1.00 0.00 O ATOM 2157 OE2 GLU B 141 9.215 15.636 -21.647 1.00 0.00 O ATOM 2158 OXT GLU B 141 8.053 21.198 -19.504 1.00 0.00 O ATOM 0 H GLU B 141 6.525 17.973 -17.759 1.00 0.00 H new ATOM 0 HA GLU B 141 8.739 18.847 -19.465 1.00 0.00 H new ATOM 0 HB2 GLU B 141 5.920 17.913 -20.139 1.00 0.00 H new ATOM 0 HB3 GLU B 141 7.197 18.231 -21.297 1.00 0.00 H new ATOM 0 HG2 GLU B 141 7.286 16.060 -19.164 1.00 0.00 H new ATOM 0 HG3 GLU B 141 6.835 15.801 -20.838 1.00 0.00 H new