USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1330 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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 7 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 8 THR OG1 : rot 13:sc= -0.972 USER MOD Single : A 9 THR OG1 : rot -60:sc= 1.18 USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0.0026) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 THR OG1 : rot -91:sc= 0.896 USER MOD Single : A 19 GLN : amide:sc= -1.78 K(o=-1.8,f=-2.6) USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 24 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 129:sc= -0.101 USER MOD Single : A 32 THR OG1 : rot 36:sc= 0.411 USER MOD Single : A 34 HIS : no HD1:sc=-0.00833 X(o=-0.0083,f=0) USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 68 HIS : no HE2:sc= -0.326 X(o=-0.33,f=-0.2) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 73 MET CE :methyl -173:sc= 0 (180deg=-0.0593) USER MOD Single : A 76 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0144) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= 0 X(o=0,f=-0.039) USER MOD Single : A 81 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.00153) USER MOD Single : A 88 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 THR OG1 : rot 180:sc= 0.0713 USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=-0.074) USER MOD Single : A 103 HIS : no HD1:sc= -0.162 K(o=-0.16,f=-0.89) USER MOD Single : A 109 THR OG1 : rot 180:sc= -1.17 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 ASN : amide:sc=-0.00752 X(o=-0.0075,f=0.3) USER MOD Single : A 119 ASN : amide:sc= 0.05 K(o=0.05,f=-4.9!) USER MOD Single : A 120 TYR OH : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 138 THR OG1 : rot 24:sc= -0.0923 USER MOD Single : A 140 GLN : amide:sc= -0.526 K(o=-0.53,f=-5.8!) USER MOD Single : A 141 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 142 THR OG1 : rot 169:sc= 0.00447 USER MOD Single : A 143 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot -63:sc= 0.46 USER MOD Single : A 148 TYR OH : rot 180:sc= 0 USER MOD Single : A 149 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 150 ASN : amide:sc= -0.962 K(o=-0.96,f=-2.7!) USER MOD Single : A 152 ASN : amide:sc= -0.0407 X(o=-0.041,f=0) USER MOD Single : A 154 TYR OH : rot 180:sc= 0 USER MOD Single : A 158 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 161 GLN : amide:sc= -0.188 X(o=-0.19,f=-0.037) USER MOD Single : A 165 HIS : no HD1:sc=-0.00905 X(o=-0.0091,f=0) USER MOD Single : A 166 HIS : no HD1:sc=-0.00484 X(o=-0.0048,f=-0.31) USER MOD Single : A 167 HIS : no HD1:sc= 0 X(o=0,f=-0.0093) USER MOD Single : A 168 HIS : no HD1:sc= -0.0208 X(o=-0.021,f=0) USER MOD Single : A 169 HIS : no HD1:sc= -0.344 X(o=-0.34,f=0.022) USER MOD Single : A 170 HIS : no HD1:sc= -0.181 X(o=-0.18,f=-0.48) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -29.827 -7.318 20.029 1.00 0.00 N ATOM 2 CA MET A 1 -31.038 -8.073 20.445 1.00 0.00 C ATOM 3 C MET A 1 -31.648 -8.828 19.269 1.00 0.00 C ATOM 4 O MET A 1 -32.627 -8.380 18.672 1.00 0.00 O ATOM 5 CB MET A 1 -32.052 -7.085 21.023 1.00 0.00 C ATOM 6 CG MET A 1 -33.246 -7.757 21.684 1.00 0.00 C ATOM 7 SD MET A 1 -32.827 -8.521 23.262 1.00 0.00 S ATOM 8 CE MET A 1 -34.258 -8.079 24.244 1.00 0.00 C ATOM 0 H1 MET A 1 -29.433 -6.814 20.849 1.00 0.00 H new ATOM 0 H2 MET A 1 -29.117 -7.980 19.655 1.00 0.00 H new ATOM 0 H3 MET A 1 -30.083 -6.631 19.291 1.00 0.00 H new ATOM 0 HA MET A 1 -30.760 -8.810 21.198 1.00 0.00 H new ATOM 0 HB2 MET A 1 -31.552 -6.450 21.754 1.00 0.00 H new ATOM 0 HB3 MET A 1 -32.408 -6.433 20.225 1.00 0.00 H new ATOM 0 HG2 MET A 1 -34.033 -7.019 21.840 1.00 0.00 H new ATOM 0 HG3 MET A 1 -33.648 -8.516 21.013 1.00 0.00 H new ATOM 0 HE1 MET A 1 -34.147 -8.482 25.251 1.00 0.00 H new ATOM 0 HE2 MET A 1 -34.343 -6.994 24.295 1.00 0.00 H new ATOM 0 HE3 MET A 1 -35.156 -8.492 23.785 1.00 0.00 H new ATOM 20 N ASN A 2 -31.064 -9.976 18.941 1.00 0.00 N ATOM 21 CA ASN A 2 -31.551 -10.792 17.835 1.00 0.00 C ATOM 22 C ASN A 2 -30.773 -12.101 17.741 1.00 0.00 C ATOM 23 O ASN A 2 -29.603 -12.169 18.119 1.00 0.00 O ATOM 24 CB ASN A 2 -31.441 -10.021 16.518 1.00 0.00 C ATOM 25 CG ASN A 2 -32.670 -10.189 15.647 1.00 0.00 C ATOM 26 OD1 ASN A 2 -32.782 -11.154 14.890 1.00 0.00 O ATOM 27 ND2 ASN A 2 -33.601 -9.249 15.749 1.00 0.00 N ATOM 0 H ASN A 2 -30.253 -10.362 19.425 1.00 0.00 H new ATOM 0 HA ASN A 2 -32.599 -11.027 18.022 1.00 0.00 H new ATOM 0 HB2 ASN A 2 -31.292 -8.962 16.731 1.00 0.00 H new ATOM 0 HB3 ASN A 2 -30.562 -10.363 15.972 1.00 0.00 H new ATOM 0 HD21 ASN A 2 -34.450 -9.309 15.187 1.00 0.00 H new ATOM 0 HD22 ASN A 2 -33.467 -8.466 16.389 1.00 0.00 H new ATOM 34 N ALA A 3 -31.431 -13.139 17.235 1.00 0.00 N ATOM 35 CA ALA A 3 -30.803 -14.447 17.090 1.00 0.00 C ATOM 36 C ALA A 3 -29.597 -14.387 16.154 1.00 0.00 C ATOM 37 O ALA A 3 -28.748 -15.279 16.166 1.00 0.00 O ATOM 38 CB ALA A 3 -31.816 -15.462 16.580 1.00 0.00 C ATOM 0 H ALA A 3 -32.400 -13.099 16.918 1.00 0.00 H new ATOM 0 HA ALA A 3 -30.448 -14.759 18.072 1.00 0.00 H new ATOM 0 HB1 ALA A 3 -31.335 -16.435 16.476 1.00 0.00 H new ATOM 0 HB2 ALA A 3 -32.642 -15.539 17.287 1.00 0.00 H new ATOM 0 HB3 ALA A 3 -32.197 -15.140 15.611 1.00 0.00 H new ATOM 44 N ASP A 4 -29.524 -13.333 15.347 1.00 0.00 N ATOM 45 CA ASP A 4 -28.419 -13.163 14.411 1.00 0.00 C ATOM 46 C ASP A 4 -27.170 -12.681 15.138 1.00 0.00 C ATOM 47 O ASP A 4 -26.121 -13.322 15.084 1.00 0.00 O ATOM 48 CB ASP A 4 -28.800 -12.169 13.312 1.00 0.00 C ATOM 49 CG ASP A 4 -29.906 -12.693 12.417 1.00 0.00 C ATOM 50 OD1 ASP A 4 -29.803 -13.851 11.961 1.00 0.00 O ATOM 51 OD2 ASP A 4 -30.877 -11.946 12.173 1.00 0.00 O ATOM 0 H ASP A 4 -30.217 -12.585 15.323 1.00 0.00 H new ATOM 0 HA ASP A 4 -28.206 -14.130 13.955 1.00 0.00 H new ATOM 0 HB2 ASP A 4 -29.119 -11.232 13.768 1.00 0.00 H new ATOM 0 HB3 ASP A 4 -27.921 -11.946 12.707 1.00 0.00 H new ATOM 57 N GLU A 5 -27.295 -11.550 15.823 1.00 0.00 N ATOM 58 CA GLU A 5 -26.180 -10.983 16.570 1.00 0.00 C ATOM 59 C GLU A 5 -25.806 -11.882 17.744 1.00 0.00 C ATOM 60 O GLU A 5 -24.664 -11.876 18.203 1.00 0.00 O ATOM 61 CB GLU A 5 -26.535 -9.583 17.075 1.00 0.00 C ATOM 62 CG GLU A 5 -26.161 -8.474 16.105 1.00 0.00 C ATOM 63 CD GLU A 5 -26.121 -7.111 16.768 1.00 0.00 C ATOM 64 OE1 GLU A 5 -27.083 -6.772 17.489 1.00 0.00 O ATOM 65 OE2 GLU A 5 -25.127 -6.381 16.566 1.00 0.00 O ATOM 0 H GLU A 5 -28.158 -11.008 15.876 1.00 0.00 H new ATOM 0 HA GLU A 5 -25.323 -10.911 15.901 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -27.606 -9.537 17.271 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -26.030 -9.409 18.025 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -25.186 -8.691 15.669 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -26.880 -8.455 15.286 1.00 0.00 H new ATOM 73 N TRP A 6 -26.776 -12.655 18.225 1.00 0.00 N ATOM 74 CA TRP A 6 -26.545 -13.560 19.346 1.00 0.00 C ATOM 75 C TRP A 6 -25.746 -14.781 18.902 1.00 0.00 C ATOM 76 O TRP A 6 -24.858 -15.247 19.616 1.00 0.00 O ATOM 77 CB TRP A 6 -27.876 -14.000 19.957 1.00 0.00 C ATOM 78 CG TRP A 6 -27.788 -14.293 21.424 1.00 0.00 C ATOM 79 CD1 TRP A 6 -26.695 -14.741 22.106 1.00 0.00 C ATOM 80 CD2 TRP A 6 -28.838 -14.160 22.389 1.00 0.00 C ATOM 81 NE1 TRP A 6 -26.999 -14.894 23.437 1.00 0.00 N ATOM 82 CE2 TRP A 6 -28.309 -14.544 23.636 1.00 0.00 C ATOM 83 CE3 TRP A 6 -30.174 -13.753 22.320 1.00 0.00 C ATOM 84 CZ2 TRP A 6 -29.069 -14.533 24.803 1.00 0.00 C ATOM 85 CZ3 TRP A 6 -30.927 -13.742 23.479 1.00 0.00 C ATOM 86 CH2 TRP A 6 -30.373 -14.129 24.706 1.00 0.00 C ATOM 0 H TRP A 6 -27.727 -12.673 17.857 1.00 0.00 H new ATOM 0 HA TRP A 6 -25.968 -13.025 20.100 1.00 0.00 H new ATOM 0 HB2 TRP A 6 -28.618 -13.219 19.794 1.00 0.00 H new ATOM 0 HB3 TRP A 6 -28.230 -14.890 19.437 1.00 0.00 H new ATOM 0 HD1 TRP A 6 -25.731 -14.946 21.664 1.00 0.00 H new ATOM 0 HE1 TRP A 6 -26.355 -15.216 24.159 1.00 0.00 H new ATOM 0 HE3 TRP A 6 -30.609 -13.453 21.378 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 -28.645 -14.832 25.750 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 -31.960 -13.430 23.438 1.00 0.00 H new ATOM 0 HH2 TRP A 6 -30.988 -14.108 25.594 1.00 0.00 H new ATOM 97 N MET A 7 -26.070 -15.297 17.721 1.00 0.00 N ATOM 98 CA MET A 7 -25.383 -16.465 17.183 1.00 0.00 C ATOM 99 C MET A 7 -24.008 -16.088 16.641 1.00 0.00 C ATOM 100 O MET A 7 -23.077 -16.893 16.666 1.00 0.00 O ATOM 101 CB MET A 7 -26.220 -17.110 16.076 1.00 0.00 C ATOM 102 CG MET A 7 -27.422 -17.882 16.594 1.00 0.00 C ATOM 103 SD MET A 7 -26.997 -19.548 17.136 1.00 0.00 S ATOM 104 CE MET A 7 -28.400 -19.933 18.181 1.00 0.00 C ATOM 0 H MET A 7 -26.804 -14.925 17.118 1.00 0.00 H new ATOM 0 HA MET A 7 -25.250 -17.181 17.994 1.00 0.00 H new ATOM 0 HB2 MET A 7 -26.564 -16.333 15.393 1.00 0.00 H new ATOM 0 HB3 MET A 7 -25.587 -17.784 15.499 1.00 0.00 H new ATOM 0 HG2 MET A 7 -27.868 -17.337 17.425 1.00 0.00 H new ATOM 0 HG3 MET A 7 -28.177 -17.941 15.810 1.00 0.00 H new ATOM 0 HE1 MET A 7 -28.283 -20.936 18.592 1.00 0.00 H new ATOM 0 HE2 MET A 7 -28.456 -19.211 18.996 1.00 0.00 H new ATOM 0 HE3 MET A 7 -29.316 -19.887 17.592 1.00 0.00 H new ATOM 114 N THR A 8 -23.887 -14.858 16.150 1.00 0.00 N ATOM 115 CA THR A 8 -22.625 -14.373 15.602 1.00 0.00 C ATOM 116 C THR A 8 -21.517 -14.425 16.651 1.00 0.00 C ATOM 117 O THR A 8 -20.342 -14.582 16.317 1.00 0.00 O ATOM 118 CB THR A 8 -22.786 -12.943 15.086 1.00 0.00 C ATOM 119 OG1 THR A 8 -23.459 -12.138 16.038 1.00 0.00 O ATOM 120 CG2 THR A 8 -23.557 -12.859 13.786 1.00 0.00 C ATOM 0 H THR A 8 -24.648 -14.179 16.121 1.00 0.00 H new ATOM 0 HA THR A 8 -22.345 -15.023 14.773 1.00 0.00 H new ATOM 0 HB THR A 8 -21.772 -12.583 14.912 1.00 0.00 H new ATOM 0 HG1 THR A 8 -23.491 -12.607 16.898 1.00 0.00 H new ATOM 0 HG21 THR A 8 -23.635 -11.817 13.476 1.00 0.00 H new ATOM 0 HG22 THR A 8 -23.036 -13.429 13.017 1.00 0.00 H new ATOM 0 HG23 THR A 8 -24.556 -13.271 13.928 1.00 0.00 H new ATOM 128 N THR A 9 -21.899 -14.294 17.918 1.00 0.00 N ATOM 129 CA THR A 9 -20.935 -14.327 19.013 1.00 0.00 C ATOM 130 C THR A 9 -20.147 -15.633 19.009 1.00 0.00 C ATOM 131 O THR A 9 -18.964 -15.656 19.348 1.00 0.00 O ATOM 132 CB THR A 9 -21.652 -14.155 20.354 1.00 0.00 C ATOM 133 OG1 THR A 9 -22.509 -15.254 20.608 1.00 0.00 O ATOM 134 CG2 THR A 9 -22.486 -12.894 20.429 1.00 0.00 C ATOM 0 H THR A 9 -22.867 -14.164 18.211 1.00 0.00 H new ATOM 0 HA THR A 9 -20.235 -13.503 18.872 1.00 0.00 H new ATOM 0 HB THR A 9 -20.860 -14.091 21.100 1.00 0.00 H new ATOM 0 HG1 THR A 9 -23.184 -15.313 19.900 1.00 0.00 H new ATOM 0 HG21 THR A 9 -22.967 -12.833 21.405 1.00 0.00 H new ATOM 0 HG22 THR A 9 -21.844 -12.024 20.286 1.00 0.00 H new ATOM 0 HG23 THR A 9 -23.248 -12.915 19.650 1.00 0.00 H new ATOM 142 N PHE A 10 -20.811 -16.718 18.623 1.00 0.00 N ATOM 143 CA PHE A 10 -20.171 -18.027 18.575 1.00 0.00 C ATOM 144 C PHE A 10 -19.239 -18.134 17.371 1.00 0.00 C ATOM 145 O PHE A 10 -18.108 -18.608 17.488 1.00 0.00 O ATOM 146 CB PHE A 10 -21.229 -19.133 18.518 1.00 0.00 C ATOM 147 CG PHE A 10 -21.311 -19.948 19.778 1.00 0.00 C ATOM 148 CD1 PHE A 10 -21.723 -19.369 20.967 1.00 0.00 C ATOM 149 CD2 PHE A 10 -20.976 -21.292 19.771 1.00 0.00 C ATOM 150 CE1 PHE A 10 -21.801 -20.115 22.127 1.00 0.00 C ATOM 151 CE2 PHE A 10 -21.051 -22.044 20.929 1.00 0.00 C ATOM 152 CZ PHE A 10 -21.464 -21.455 22.108 1.00 0.00 C ATOM 0 H PHE A 10 -21.791 -16.716 18.339 1.00 0.00 H new ATOM 0 HA PHE A 10 -19.578 -18.148 19.481 1.00 0.00 H new ATOM 0 HB2 PHE A 10 -22.203 -18.684 18.321 1.00 0.00 H new ATOM 0 HB3 PHE A 10 -21.007 -19.794 17.680 1.00 0.00 H new ATOM 0 HD1 PHE A 10 -21.986 -18.322 20.987 1.00 0.00 H new ATOM 0 HD2 PHE A 10 -20.653 -21.757 18.852 1.00 0.00 H new ATOM 0 HE1 PHE A 10 -22.125 -19.652 23.047 1.00 0.00 H new ATOM 0 HE2 PHE A 10 -20.787 -23.091 20.912 1.00 0.00 H new ATOM 0 HZ PHE A 10 -21.523 -22.041 23.013 1.00 0.00 H new ATOM 162 N ARG A 11 -19.721 -17.689 16.215 1.00 0.00 N ATOM 163 CA ARG A 11 -18.931 -17.735 14.989 1.00 0.00 C ATOM 164 C ARG A 11 -17.677 -16.877 15.118 1.00 0.00 C ATOM 165 O ARG A 11 -16.623 -17.216 14.581 1.00 0.00 O ATOM 166 CB ARG A 11 -19.768 -17.260 13.801 1.00 0.00 C ATOM 167 CG ARG A 11 -19.454 -17.992 12.505 1.00 0.00 C ATOM 168 CD ARG A 11 -20.689 -18.669 11.930 1.00 0.00 C ATOM 169 NE ARG A 11 -21.410 -17.799 11.004 1.00 0.00 N ATOM 170 CZ ARG A 11 -22.611 -18.081 10.505 1.00 0.00 C ATOM 171 NH1 ARG A 11 -23.229 -19.207 10.840 1.00 0.00 N ATOM 172 NH2 ARG A 11 -23.196 -17.235 9.668 1.00 0.00 N ATOM 0 H ARG A 11 -20.654 -17.293 16.101 1.00 0.00 H new ATOM 0 HA ARG A 11 -18.627 -18.768 14.820 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -20.824 -17.391 14.036 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -19.604 -16.192 13.655 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -19.053 -17.287 11.777 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -18.681 -18.738 12.686 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -20.394 -19.583 11.414 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -21.353 -18.962 12.743 1.00 0.00 H new ATOM 0 HE ARG A 11 -20.967 -16.924 10.723 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -22.783 -19.861 11.483 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -24.149 -19.418 10.454 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -22.725 -16.369 9.407 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -24.117 -17.451 9.285 1.00 0.00 H new ATOM 186 N GLU A 12 -17.799 -15.762 15.833 1.00 0.00 N ATOM 187 CA GLU A 12 -16.674 -14.855 16.031 1.00 0.00 C ATOM 188 C GLU A 12 -15.599 -15.502 16.898 1.00 0.00 C ATOM 189 O GLU A 12 -14.405 -15.336 16.652 1.00 0.00 O ATOM 190 CB GLU A 12 -17.152 -13.551 16.675 1.00 0.00 C ATOM 191 CG GLU A 12 -17.359 -12.423 15.678 1.00 0.00 C ATOM 192 CD GLU A 12 -18.820 -12.213 15.331 1.00 0.00 C ATOM 193 OE1 GLU A 12 -19.653 -12.186 16.261 1.00 0.00 O ATOM 194 OE2 GLU A 12 -19.131 -12.073 14.129 1.00 0.00 O ATOM 0 H GLU A 12 -18.665 -15.466 16.284 1.00 0.00 H new ATOM 0 HA GLU A 12 -16.241 -14.633 15.056 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -18.088 -13.737 17.201 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -16.424 -13.236 17.422 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -16.951 -11.500 16.089 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -16.801 -12.641 14.768 1.00 0.00 H new ATOM 202 N ASN A 13 -16.031 -16.240 17.916 1.00 0.00 N ATOM 203 CA ASN A 13 -15.105 -16.912 18.820 1.00 0.00 C ATOM 204 C ASN A 13 -14.279 -17.956 18.076 1.00 0.00 C ATOM 205 O ASN A 13 -13.058 -18.017 18.225 1.00 0.00 O ATOM 206 CB ASN A 13 -15.870 -17.574 19.968 1.00 0.00 C ATOM 207 CG ASN A 13 -16.000 -16.667 21.176 1.00 0.00 C ATOM 208 OD1 ASN A 13 -16.471 -15.535 21.069 1.00 0.00 O ATOM 209 ND2 ASN A 13 -15.579 -17.161 22.334 1.00 0.00 N ATOM 0 H ASN A 13 -17.016 -16.388 18.135 1.00 0.00 H new ATOM 0 HA ASN A 13 -14.427 -16.162 19.228 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -16.864 -17.858 19.622 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -15.359 -18.492 20.260 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -15.639 -16.596 23.181 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -15.195 -18.105 22.376 1.00 0.00 H new ATOM 216 N ILE A 14 -14.951 -18.775 17.275 1.00 0.00 N ATOM 217 CA ILE A 14 -14.280 -19.816 16.507 1.00 0.00 C ATOM 218 C ILE A 14 -13.465 -19.218 15.365 1.00 0.00 C ATOM 219 O ILE A 14 -12.435 -19.764 14.970 1.00 0.00 O ATOM 220 CB ILE A 14 -15.287 -20.827 15.929 1.00 0.00 C ATOM 221 CG1 ILE A 14 -16.251 -21.299 17.018 1.00 0.00 C ATOM 222 CG2 ILE A 14 -14.556 -22.010 15.312 1.00 0.00 C ATOM 223 CD1 ILE A 14 -15.560 -21.931 18.206 1.00 0.00 C ATOM 0 H ILE A 14 -15.961 -18.738 17.141 1.00 0.00 H new ATOM 0 HA ILE A 14 -13.612 -20.334 17.195 1.00 0.00 H new ATOM 0 HB ILE A 14 -15.865 -20.334 15.147 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -16.842 -20.450 17.361 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -16.947 -22.019 16.588 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -15.282 -22.716 14.908 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -13.906 -21.658 14.510 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -13.955 -22.505 16.075 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -16.306 -22.242 18.938 1.00 0.00 H new ATOM 0 HD12 ILE A 14 -14.991 -22.800 17.876 1.00 0.00 H new ATOM 0 HD13 ILE A 14 -14.884 -21.207 18.661 1.00 0.00 H new ATOM 235 N ALA A 15 -13.934 -18.092 14.836 1.00 0.00 N ATOM 236 CA ALA A 15 -13.250 -17.420 13.739 1.00 0.00 C ATOM 237 C ALA A 15 -11.975 -16.738 14.221 1.00 0.00 C ATOM 238 O ALA A 15 -10.963 -16.727 13.522 1.00 0.00 O ATOM 239 CB ALA A 15 -14.176 -16.407 13.082 1.00 0.00 C ATOM 0 H ALA A 15 -14.785 -17.626 15.150 1.00 0.00 H new ATOM 0 HA ALA A 15 -12.971 -18.173 13.002 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -13.652 -15.912 12.264 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -15.057 -16.918 12.693 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -14.483 -15.664 13.818 1.00 0.00 H new ATOM 245 N GLN A 16 -12.031 -16.169 15.421 1.00 0.00 N ATOM 246 CA GLN A 16 -10.879 -15.486 15.997 1.00 0.00 C ATOM 247 C GLN A 16 -9.797 -16.483 16.398 1.00 0.00 C ATOM 248 O GLN A 16 -8.606 -16.210 16.260 1.00 0.00 O ATOM 249 CB GLN A 16 -11.305 -14.661 17.215 1.00 0.00 C ATOM 250 CG GLN A 16 -11.702 -13.234 16.874 1.00 0.00 C ATOM 251 CD GLN A 16 -11.521 -12.284 18.041 1.00 0.00 C ATOM 252 OE1 GLN A 16 -10.522 -11.571 18.126 1.00 0.00 O ATOM 253 NE2 GLN A 16 -12.490 -12.271 18.949 1.00 0.00 N ATOM 0 H GLN A 16 -12.862 -16.168 16.013 1.00 0.00 H new ATOM 0 HA GLN A 16 -10.469 -14.819 15.239 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -12.144 -15.156 17.703 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -10.486 -14.640 17.934 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -11.105 -12.886 16.031 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -12.744 -13.217 16.555 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -13.301 -12.880 18.838 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -12.423 -11.652 19.757 1.00 0.00 H new ATOM 262 N THR A 17 -10.221 -17.641 16.894 1.00 0.00 N ATOM 263 CA THR A 17 -9.289 -18.680 17.315 1.00 0.00 C ATOM 264 C THR A 17 -8.553 -19.269 16.115 1.00 0.00 C ATOM 265 O THR A 17 -7.399 -19.682 16.224 1.00 0.00 O ATOM 266 CB THR A 17 -10.030 -19.787 18.066 1.00 0.00 C ATOM 267 OG1 THR A 17 -11.357 -19.916 17.588 1.00 0.00 O ATOM 268 CG2 THR A 17 -10.101 -19.552 19.560 1.00 0.00 C ATOM 0 H THR A 17 -11.205 -17.883 17.014 1.00 0.00 H new ATOM 0 HA THR A 17 -8.556 -18.226 17.982 1.00 0.00 H new ATOM 0 HB THR A 17 -9.455 -20.695 17.884 1.00 0.00 H new ATOM 0 HG1 THR A 17 -11.952 -19.346 18.118 1.00 0.00 H new ATOM 0 HG21 THR A 17 -10.639 -20.374 20.032 1.00 0.00 H new ATOM 0 HG22 THR A 17 -9.092 -19.497 19.968 1.00 0.00 H new ATOM 0 HG23 THR A 17 -10.623 -18.616 19.757 1.00 0.00 H new ATOM 276 N TRP A 18 -9.230 -19.304 14.972 1.00 0.00 N ATOM 277 CA TRP A 18 -8.641 -19.842 13.751 1.00 0.00 C ATOM 278 C TRP A 18 -7.761 -18.800 13.066 1.00 0.00 C ATOM 279 O TRP A 18 -6.694 -19.121 12.543 1.00 0.00 O ATOM 280 CB TRP A 18 -9.740 -20.312 12.794 1.00 0.00 C ATOM 281 CG TRP A 18 -9.878 -21.803 12.736 1.00 0.00 C ATOM 282 CD1 TRP A 18 -10.980 -22.538 13.066 1.00 0.00 C ATOM 283 CD2 TRP A 18 -8.878 -22.741 12.324 1.00 0.00 C ATOM 284 NE1 TRP A 18 -10.728 -23.876 12.885 1.00 0.00 N ATOM 285 CE2 TRP A 18 -9.443 -24.027 12.429 1.00 0.00 C ATOM 286 CE3 TRP A 18 -7.560 -22.621 11.875 1.00 0.00 C ATOM 287 CZ2 TRP A 18 -8.736 -25.181 12.101 1.00 0.00 C ATOM 288 CZ3 TRP A 18 -6.859 -23.767 11.550 1.00 0.00 C ATOM 289 CH2 TRP A 18 -7.448 -25.032 11.665 1.00 0.00 C ATOM 0 H TRP A 18 -10.187 -18.966 14.866 1.00 0.00 H new ATOM 0 HA TRP A 18 -8.017 -20.694 14.022 1.00 0.00 H new ATOM 0 HB2 TRP A 18 -10.691 -19.878 13.103 1.00 0.00 H new ATOM 0 HB3 TRP A 18 -9.527 -19.935 11.794 1.00 0.00 H new ATOM 0 HD1 TRP A 18 -11.915 -22.127 13.418 1.00 0.00 H new ATOM 0 HE1 TRP A 18 -11.388 -24.633 13.061 1.00 0.00 H new ATOM 0 HE3 TRP A 18 -7.097 -21.649 11.784 1.00 0.00 H new ATOM 0 HZ2 TRP A 18 -9.188 -26.158 12.188 1.00 0.00 H new ATOM 0 HZ3 TRP A 18 -5.840 -23.685 11.202 1.00 0.00 H new ATOM 0 HH2 TRP A 18 -6.873 -25.908 11.404 1.00 0.00 H new ATOM 300 N GLN A 19 -8.216 -17.552 13.074 1.00 0.00 N ATOM 301 CA GLN A 19 -7.471 -16.463 12.453 1.00 0.00 C ATOM 302 C GLN A 19 -6.222 -16.129 13.263 1.00 0.00 C ATOM 303 O GLN A 19 -5.113 -16.102 12.730 1.00 0.00 O ATOM 304 CB GLN A 19 -8.355 -15.222 12.321 1.00 0.00 C ATOM 305 CG GLN A 19 -9.093 -15.139 10.994 1.00 0.00 C ATOM 306 CD GLN A 19 -10.299 -16.055 10.940 1.00 0.00 C ATOM 307 OE1 GLN A 19 -10.166 -17.279 10.972 1.00 0.00 O ATOM 308 NE2 GLN A 19 -11.486 -15.466 10.857 1.00 0.00 N ATOM 0 H GLN A 19 -9.097 -17.269 13.504 1.00 0.00 H new ATOM 0 HA GLN A 19 -7.162 -16.787 11.459 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -9.082 -15.216 13.133 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -7.737 -14.332 12.440 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -9.414 -14.111 10.825 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -8.409 -15.397 10.185 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -11.550 -14.448 10.833 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -12.334 -16.031 10.817 1.00 0.00 H new ATOM 317 N GLN A 20 -6.411 -15.874 14.554 1.00 0.00 N ATOM 318 CA GLN A 20 -5.299 -15.541 15.437 1.00 0.00 C ATOM 319 C GLN A 20 -4.589 -14.272 14.966 1.00 0.00 C ATOM 320 O GLN A 20 -3.376 -14.269 14.758 1.00 0.00 O ATOM 321 CB GLN A 20 -4.306 -16.704 15.500 1.00 0.00 C ATOM 322 CG GLN A 20 -4.708 -17.796 16.479 1.00 0.00 C ATOM 323 CD GLN A 20 -3.912 -17.746 17.768 1.00 0.00 C ATOM 324 OE1 GLN A 20 -3.014 -18.559 17.988 1.00 0.00 O ATOM 325 NE2 GLN A 20 -4.237 -16.788 18.628 1.00 0.00 N ATOM 0 H GLN A 20 -7.323 -15.892 15.011 1.00 0.00 H new ATOM 0 HA GLN A 20 -5.700 -15.360 16.434 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -4.205 -17.139 14.506 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -3.326 -16.319 15.781 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -5.769 -17.701 16.708 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -4.570 -18.769 16.009 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -4.988 -16.135 18.405 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -3.735 -16.705 19.512 1.00 0.00 H new ATOM 334 N PRO A 21 -5.343 -13.173 14.792 1.00 0.00 N ATOM 335 CA PRO A 21 -4.781 -11.894 14.344 1.00 0.00 C ATOM 336 C PRO A 21 -3.902 -11.244 15.408 1.00 0.00 C ATOM 337 O PRO A 21 -4.388 -10.835 16.463 1.00 0.00 O ATOM 338 CB PRO A 21 -6.018 -11.036 14.075 1.00 0.00 C ATOM 339 CG PRO A 21 -7.077 -11.613 14.949 1.00 0.00 C ATOM 340 CD PRO A 21 -6.798 -13.089 15.018 1.00 0.00 C ATOM 0 HA PRO A 21 -4.134 -12.015 13.475 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -5.833 -9.989 14.315 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -6.307 -11.076 13.025 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -7.051 -11.164 15.942 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -8.069 -11.422 14.539 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -7.079 -13.506 15.985 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -7.355 -13.639 14.259 1.00 0.00 H new ATOM 348 N GLU A 22 -2.608 -11.152 15.122 1.00 0.00 N ATOM 349 CA GLU A 22 -1.661 -10.551 16.054 1.00 0.00 C ATOM 350 C GLU A 22 -0.322 -10.285 15.374 1.00 0.00 C ATOM 351 O GLU A 22 0.734 -10.375 16.001 1.00 0.00 O ATOM 352 CB GLU A 22 -1.458 -11.462 17.267 1.00 0.00 C ATOM 353 CG GLU A 22 -0.898 -10.741 18.482 1.00 0.00 C ATOM 354 CD GLU A 22 -1.845 -9.687 19.022 1.00 0.00 C ATOM 355 OE1 GLU A 22 -1.955 -8.611 18.397 1.00 0.00 O ATOM 356 OE2 GLU A 22 -2.477 -9.937 20.070 1.00 0.00 O ATOM 0 H GLU A 22 -2.191 -11.486 14.253 1.00 0.00 H new ATOM 0 HA GLU A 22 -2.074 -9.599 16.388 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -2.412 -11.917 17.533 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -0.783 -12.273 16.993 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -0.685 -11.468 19.265 1.00 0.00 H new ATOM 0 HG3 GLU A 22 0.049 -10.272 18.217 1.00 0.00 H new ATOM 364 N HIS A 23 -0.373 -9.959 14.086 1.00 0.00 N ATOM 365 CA HIS A 23 0.836 -9.681 13.320 1.00 0.00 C ATOM 366 C HIS A 23 1.137 -8.185 13.304 1.00 0.00 C ATOM 367 O HIS A 23 0.244 -7.364 13.100 1.00 0.00 O ATOM 368 CB HIS A 23 0.687 -10.198 11.888 1.00 0.00 C ATOM 369 CG HIS A 23 1.207 -11.589 11.698 1.00 0.00 C ATOM 370 ND1 HIS A 23 2.505 -11.862 11.320 1.00 0.00 N ATOM 371 CD2 HIS A 23 0.598 -12.791 11.836 1.00 0.00 C ATOM 372 CE1 HIS A 23 2.670 -13.170 11.233 1.00 0.00 C ATOM 373 NE2 HIS A 23 1.529 -13.756 11.541 1.00 0.00 N ATOM 0 H HIS A 23 -1.238 -9.881 13.552 1.00 0.00 H new ATOM 0 HA HIS A 23 1.668 -10.196 13.800 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -0.366 -10.171 11.608 1.00 0.00 H new ATOM 0 HB3 HIS A 23 1.214 -9.526 11.211 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -0.429 -12.959 12.124 1.00 0.00 H new ATOM 0 HE1 HIS A 23 3.584 -13.674 10.957 1.00 0.00 H new ATOM 0 HE2 HIS A 23 1.365 -14.763 11.557 1.00 0.00 H new ATOM 382 N TYR A 24 2.403 -7.841 13.518 1.00 0.00 N ATOM 383 CA TYR A 24 2.825 -6.444 13.527 1.00 0.00 C ATOM 384 C TYR A 24 3.704 -6.135 12.320 1.00 0.00 C ATOM 385 O TYR A 24 4.814 -6.655 12.199 1.00 0.00 O ATOM 386 CB TYR A 24 3.577 -6.125 14.821 1.00 0.00 C ATOM 387 CG TYR A 24 2.770 -5.310 15.807 1.00 0.00 C ATOM 388 CD1 TYR A 24 2.471 -3.977 15.553 1.00 0.00 C ATOM 389 CD2 TYR A 24 2.308 -5.873 16.989 1.00 0.00 C ATOM 390 CE1 TYR A 24 1.734 -3.228 16.451 1.00 0.00 C ATOM 391 CE2 TYR A 24 1.570 -5.130 17.892 1.00 0.00 C ATOM 392 CZ TYR A 24 1.286 -3.809 17.618 1.00 0.00 C ATOM 393 OH TYR A 24 0.552 -3.067 18.514 1.00 0.00 O ATOM 0 H TYR A 24 3.154 -8.510 13.687 1.00 0.00 H new ATOM 0 HA TYR A 24 1.934 -5.819 13.472 1.00 0.00 H new ATOM 0 HB2 TYR A 24 3.878 -7.059 15.296 1.00 0.00 H new ATOM 0 HB3 TYR A 24 4.490 -5.583 14.576 1.00 0.00 H new ATOM 0 HD1 TYR A 24 2.820 -3.519 14.639 1.00 0.00 H new ATOM 0 HD2 TYR A 24 2.528 -6.908 17.207 1.00 0.00 H new ATOM 0 HE1 TYR A 24 1.510 -2.193 16.239 1.00 0.00 H new ATOM 0 HE2 TYR A 24 1.218 -5.582 18.807 1.00 0.00 H new ATOM 0 HH TYR A 24 0.313 -3.626 19.283 1.00 0.00 H new ATOM 403 N ASP A 25 3.202 -5.287 11.429 1.00 0.00 N ATOM 404 CA ASP A 25 3.943 -4.908 10.231 1.00 0.00 C ATOM 405 C ASP A 25 4.501 -3.495 10.359 1.00 0.00 C ATOM 406 O ASP A 25 3.803 -2.577 10.788 1.00 0.00 O ATOM 407 CB ASP A 25 3.042 -5.003 8.999 1.00 0.00 C ATOM 408 CG ASP A 25 3.834 -5.099 7.710 1.00 0.00 C ATOM 409 OD1 ASP A 25 3.370 -5.789 6.778 1.00 0.00 O ATOM 410 OD2 ASP A 25 4.918 -4.483 7.632 1.00 0.00 O ATOM 0 H ASP A 25 2.285 -4.849 11.514 1.00 0.00 H new ATOM 0 HA ASP A 25 4.778 -5.599 10.117 1.00 0.00 H new ATOM 0 HB2 ASP A 25 2.396 -5.876 9.091 1.00 0.00 H new ATOM 0 HB3 ASP A 25 2.392 -4.129 8.959 1.00 0.00 H new ATOM 416 N LEU A 26 5.766 -3.328 9.985 1.00 0.00 N ATOM 417 CA LEU A 26 6.418 -2.026 10.058 1.00 0.00 C ATOM 418 C LEU A 26 6.542 -1.401 8.672 1.00 0.00 C ATOM 419 O LEU A 26 6.875 -2.079 7.702 1.00 0.00 O ATOM 420 CB LEU A 26 7.802 -2.161 10.694 1.00 0.00 C ATOM 421 CG LEU A 26 7.813 -2.753 12.103 1.00 0.00 C ATOM 422 CD1 LEU A 26 7.900 -4.270 12.045 1.00 0.00 C ATOM 423 CD2 LEU A 26 8.968 -2.181 12.912 1.00 0.00 C ATOM 0 H LEU A 26 6.359 -4.078 9.629 1.00 0.00 H new ATOM 0 HA LEU A 26 5.803 -1.374 10.677 1.00 0.00 H new ATOM 0 HB2 LEU A 26 8.422 -2.785 10.050 1.00 0.00 H new ATOM 0 HB3 LEU A 26 8.267 -1.176 10.727 1.00 0.00 H new ATOM 0 HG LEU A 26 6.880 -2.483 12.597 1.00 0.00 H new ATOM 0 HD11 LEU A 26 7.907 -4.673 13.058 1.00 0.00 H new ATOM 0 HD12 LEU A 26 7.040 -4.663 11.504 1.00 0.00 H new ATOM 0 HD13 LEU A 26 8.816 -4.563 11.532 1.00 0.00 H new ATOM 0 HD21 LEU A 26 8.961 -2.613 13.913 1.00 0.00 H new ATOM 0 HD22 LEU A 26 9.911 -2.421 12.420 1.00 0.00 H new ATOM 0 HD23 LEU A 26 8.861 -1.099 12.984 1.00 0.00 H new ATOM 435 N TYR A 27 6.269 -0.102 8.588 1.00 0.00 N ATOM 436 CA TYR A 27 6.351 0.616 7.322 1.00 0.00 C ATOM 437 C TYR A 27 7.378 1.742 7.399 1.00 0.00 C ATOM 438 O TYR A 27 7.265 2.641 8.231 1.00 0.00 O ATOM 439 CB TYR A 27 4.982 1.186 6.945 1.00 0.00 C ATOM 440 CG TYR A 27 4.038 0.159 6.359 1.00 0.00 C ATOM 441 CD1 TYR A 27 3.661 -0.962 7.087 1.00 0.00 C ATOM 442 CD2 TYR A 27 3.524 0.312 5.078 1.00 0.00 C ATOM 443 CE1 TYR A 27 2.798 -1.902 6.555 1.00 0.00 C ATOM 444 CE2 TYR A 27 2.662 -0.623 4.538 1.00 0.00 C ATOM 445 CZ TYR A 27 2.301 -1.728 5.281 1.00 0.00 C ATOM 446 OH TYR A 27 1.443 -2.661 4.747 1.00 0.00 O ATOM 0 H TYR A 27 5.989 0.474 9.382 1.00 0.00 H new ATOM 0 HA TYR A 27 6.668 -0.089 6.554 1.00 0.00 H new ATOM 0 HB2 TYR A 27 4.524 1.624 7.832 1.00 0.00 H new ATOM 0 HB3 TYR A 27 5.120 1.993 6.225 1.00 0.00 H new ATOM 0 HD1 TYR A 27 4.048 -1.102 8.085 1.00 0.00 H new ATOM 0 HD2 TYR A 27 3.803 1.177 4.494 1.00 0.00 H new ATOM 0 HE1 TYR A 27 2.515 -2.768 7.135 1.00 0.00 H new ATOM 0 HE2 TYR A 27 2.273 -0.490 3.539 1.00 0.00 H new ATOM 0 HH TYR A 27 0.647 -2.210 4.397 1.00 0.00 H new ATOM 456 N ILE A 28 8.379 1.683 6.527 1.00 0.00 N ATOM 457 CA ILE A 28 9.425 2.697 6.497 1.00 0.00 C ATOM 458 C ILE A 28 9.822 3.032 5.059 1.00 0.00 C ATOM 459 O ILE A 28 10.153 2.140 4.277 1.00 0.00 O ATOM 460 CB ILE A 28 10.674 2.236 7.275 1.00 0.00 C ATOM 461 CG1 ILE A 28 11.722 3.351 7.316 1.00 0.00 C ATOM 462 CG2 ILE A 28 11.256 0.976 6.649 1.00 0.00 C ATOM 463 CD1 ILE A 28 12.775 3.150 8.385 1.00 0.00 C ATOM 0 H ILE A 28 8.487 0.944 5.832 1.00 0.00 H new ATOM 0 HA ILE A 28 9.020 3.589 6.975 1.00 0.00 H new ATOM 0 HB ILE A 28 10.378 2.006 8.299 1.00 0.00 H new ATOM 0 HG12 ILE A 28 12.210 3.416 6.344 1.00 0.00 H new ATOM 0 HG13 ILE A 28 11.221 4.304 7.485 1.00 0.00 H new ATOM 0 HG21 ILE A 28 12.137 0.664 7.210 1.00 0.00 H new ATOM 0 HG22 ILE A 28 10.511 0.181 6.672 1.00 0.00 H new ATOM 0 HG23 ILE A 28 11.538 1.180 5.616 1.00 0.00 H new ATOM 0 HD11 ILE A 28 13.485 3.977 8.357 1.00 0.00 H new ATOM 0 HD12 ILE A 28 12.297 3.115 9.364 1.00 0.00 H new ATOM 0 HD13 ILE A 28 13.302 2.213 8.205 1.00 0.00 H new ATOM 475 N PRO A 29 9.795 4.325 4.685 1.00 0.00 N ATOM 476 CA PRO A 29 10.155 4.761 3.332 1.00 0.00 C ATOM 477 C PRO A 29 11.649 4.631 3.060 1.00 0.00 C ATOM 478 O PRO A 29 12.472 5.216 3.764 1.00 0.00 O ATOM 479 CB PRO A 29 9.735 6.232 3.310 1.00 0.00 C ATOM 480 CG PRO A 29 9.803 6.663 4.734 1.00 0.00 C ATOM 481 CD PRO A 29 9.413 5.461 5.548 1.00 0.00 C ATOM 0 HA PRO A 29 9.672 4.154 2.566 1.00 0.00 H new ATOM 0 HB2 PRO A 29 10.401 6.825 2.684 1.00 0.00 H new ATOM 0 HB3 PRO A 29 8.729 6.351 2.907 1.00 0.00 H new ATOM 0 HG2 PRO A 29 10.807 7.001 4.992 1.00 0.00 H new ATOM 0 HG3 PRO A 29 9.128 7.498 4.922 1.00 0.00 H new ATOM 0 HD2 PRO A 29 9.938 5.435 6.503 1.00 0.00 H new ATOM 0 HD3 PRO A 29 8.346 5.455 5.771 1.00 0.00 H new ATOM 489 N ALA A 30 11.994 3.860 2.034 1.00 0.00 N ATOM 490 CA ALA A 30 13.391 3.652 1.669 1.00 0.00 C ATOM 491 C ALA A 30 13.916 4.811 0.827 1.00 0.00 C ATOM 492 O ALA A 30 13.188 5.379 0.013 1.00 0.00 O ATOM 493 CB ALA A 30 13.550 2.339 0.920 1.00 0.00 C ATOM 0 H ALA A 30 11.326 3.369 1.440 1.00 0.00 H new ATOM 0 HA ALA A 30 13.978 3.608 2.586 1.00 0.00 H new ATOM 0 HB1 ALA A 30 14.597 2.197 0.654 1.00 0.00 H new ATOM 0 HB2 ALA A 30 13.222 1.516 1.555 1.00 0.00 H new ATOM 0 HB3 ALA A 30 12.945 2.362 0.014 1.00 0.00 H new ATOM 499 N ILE A 31 15.183 5.156 1.030 1.00 0.00 N ATOM 500 CA ILE A 31 15.806 6.247 0.291 1.00 0.00 C ATOM 501 C ILE A 31 16.655 5.716 -0.860 1.00 0.00 C ATOM 502 O ILE A 31 17.308 4.679 -0.736 1.00 0.00 O ATOM 503 CB ILE A 31 16.689 7.113 1.208 1.00 0.00 C ATOM 504 CG1 ILE A 31 17.676 6.235 1.980 1.00 0.00 C ATOM 505 CG2 ILE A 31 15.826 7.920 2.166 1.00 0.00 C ATOM 506 CD1 ILE A 31 19.024 6.887 2.195 1.00 0.00 C ATOM 0 H ILE A 31 15.798 4.695 1.700 1.00 0.00 H new ATOM 0 HA ILE A 31 14.999 6.861 -0.109 1.00 0.00 H new ATOM 0 HB ILE A 31 17.258 7.808 0.590 1.00 0.00 H new ATOM 0 HG12 ILE A 31 17.245 5.983 2.949 1.00 0.00 H new ATOM 0 HG13 ILE A 31 17.816 5.299 1.440 1.00 0.00 H new ATOM 0 HG21 ILE A 31 16.465 8.527 2.808 1.00 0.00 H new ATOM 0 HG22 ILE A 31 15.161 8.570 1.597 1.00 0.00 H new ATOM 0 HG23 ILE A 31 15.233 7.242 2.781 1.00 0.00 H new ATOM 0 HD11 ILE A 31 19.672 6.208 2.749 1.00 0.00 H new ATOM 0 HD12 ILE A 31 19.476 7.114 1.230 1.00 0.00 H new ATOM 0 HD13 ILE A 31 18.896 7.809 2.762 1.00 0.00 H new ATOM 518 N THR A 32 16.643 6.433 -1.979 1.00 0.00 N ATOM 519 CA THR A 32 17.412 6.033 -3.151 1.00 0.00 C ATOM 520 C THR A 32 18.180 7.217 -3.731 1.00 0.00 C ATOM 521 O THR A 32 17.585 8.210 -4.150 1.00 0.00 O ATOM 522 CB THR A 32 16.488 5.439 -4.216 1.00 0.00 C ATOM 523 OG1 THR A 32 15.486 6.370 -4.585 1.00 0.00 O ATOM 524 CG2 THR A 32 15.793 4.172 -3.767 1.00 0.00 C ATOM 0 H THR A 32 16.109 7.294 -2.099 1.00 0.00 H new ATOM 0 HA THR A 32 18.131 5.275 -2.839 1.00 0.00 H new ATOM 0 HB THR A 32 17.136 5.199 -5.059 1.00 0.00 H new ATOM 0 HG1 THR A 32 15.861 7.275 -4.574 1.00 0.00 H new ATOM 0 HG21 THR A 32 15.154 3.804 -4.569 1.00 0.00 H new ATOM 0 HG22 THR A 32 16.538 3.416 -3.521 1.00 0.00 H new ATOM 0 HG23 THR A 32 15.186 4.383 -2.887 1.00 0.00 H new ATOM 532 N TRP A 33 19.504 7.105 -3.751 1.00 0.00 N ATOM 533 CA TRP A 33 20.354 8.166 -4.281 1.00 0.00 C ATOM 534 C TRP A 33 20.170 9.457 -3.488 1.00 0.00 C ATOM 535 O TRP A 33 19.111 10.081 -3.536 1.00 0.00 O ATOM 536 CB TRP A 33 20.040 8.410 -5.758 1.00 0.00 C ATOM 537 CG TRP A 33 21.263 8.629 -6.596 1.00 0.00 C ATOM 538 CD1 TRP A 33 22.298 9.479 -6.330 1.00 0.00 C ATOM 539 CD2 TRP A 33 21.579 7.989 -7.838 1.00 0.00 C ATOM 540 NE1 TRP A 33 23.237 9.406 -7.330 1.00 0.00 N ATOM 541 CE2 TRP A 33 22.819 8.498 -8.267 1.00 0.00 C ATOM 542 CE3 TRP A 33 20.933 7.033 -8.628 1.00 0.00 C ATOM 543 CZ2 TRP A 33 23.424 8.084 -9.450 1.00 0.00 C ATOM 544 CZ3 TRP A 33 21.536 6.623 -9.803 1.00 0.00 C ATOM 545 CH2 TRP A 33 22.771 7.147 -10.203 1.00 0.00 C ATOM 0 H TRP A 33 20.012 6.290 -3.406 1.00 0.00 H new ATOM 0 HA TRP A 33 21.392 7.848 -4.186 1.00 0.00 H new ATOM 0 HB2 TRP A 33 19.487 7.557 -6.151 1.00 0.00 H new ATOM 0 HB3 TRP A 33 19.388 9.279 -5.845 1.00 0.00 H new ATOM 0 HD1 TRP A 33 22.368 10.116 -5.460 1.00 0.00 H new ATOM 0 HE1 TRP A 33 24.105 9.941 -7.369 1.00 0.00 H new ATOM 0 HE3 TRP A 33 19.981 6.622 -8.326 1.00 0.00 H new ATOM 0 HZ2 TRP A 33 24.375 8.488 -9.763 1.00 0.00 H new ATOM 0 HZ3 TRP A 33 21.046 5.886 -10.422 1.00 0.00 H new ATOM 0 HH2 TRP A 33 23.217 6.805 -11.125 1.00 0.00 H new ATOM 556 N HIS A 34 21.209 9.850 -2.758 1.00 0.00 N ATOM 557 CA HIS A 34 21.162 11.066 -1.953 1.00 0.00 C ATOM 558 C HIS A 34 22.292 12.017 -2.333 1.00 0.00 C ATOM 559 O HIS A 34 23.392 11.584 -2.677 1.00 0.00 O ATOM 560 CB HIS A 34 21.250 10.721 -0.466 1.00 0.00 C ATOM 561 CG HIS A 34 22.490 9.966 -0.098 1.00 0.00 C ATOM 562 ND1 HIS A 34 22.553 8.588 -0.068 1.00 0.00 N ATOM 563 CD2 HIS A 34 23.722 10.404 0.255 1.00 0.00 C ATOM 564 CE1 HIS A 34 23.768 8.213 0.290 1.00 0.00 C ATOM 565 NE2 HIS A 34 24.496 9.295 0.491 1.00 0.00 N ATOM 0 H HIS A 34 22.093 9.344 -2.707 1.00 0.00 H new ATOM 0 HA HIS A 34 20.212 11.564 -2.149 1.00 0.00 H new ATOM 0 HB2 HIS A 34 21.210 11.642 0.115 1.00 0.00 H new ATOM 0 HB3 HIS A 34 20.378 10.129 -0.187 1.00 0.00 H new ATOM 0 HD2 HIS A 34 24.037 11.434 0.336 1.00 0.00 H new ATOM 0 HE1 HIS A 34 24.108 7.194 0.400 1.00 0.00 H new ATOM 0 HE2 HIS A 34 25.475 9.306 0.776 1.00 0.00 H new ATOM 574 N ALA A 35 22.012 13.315 -2.266 1.00 0.00 N ATOM 575 CA ALA A 35 23.004 14.330 -2.601 1.00 0.00 C ATOM 576 C ALA A 35 23.461 14.198 -4.050 1.00 0.00 C ATOM 577 O ALA A 35 23.054 13.278 -4.759 1.00 0.00 O ATOM 578 CB ALA A 35 24.197 14.232 -1.660 1.00 0.00 C ATOM 0 H ALA A 35 21.106 13.688 -1.983 1.00 0.00 H new ATOM 0 HA ALA A 35 22.539 15.308 -2.483 1.00 0.00 H new ATOM 0 HB1 ALA A 35 24.930 14.995 -1.921 1.00 0.00 H new ATOM 0 HB2 ALA A 35 23.864 14.385 -0.633 1.00 0.00 H new ATOM 0 HB3 ALA A 35 24.652 13.246 -1.751 1.00 0.00 H new ATOM 584 N ARG A 36 24.310 15.125 -4.483 1.00 0.00 N ATOM 585 CA ARG A 36 24.824 15.115 -5.847 1.00 0.00 C ATOM 586 C ARG A 36 26.067 14.237 -5.952 1.00 0.00 C ATOM 587 O ARG A 36 26.025 13.150 -6.529 1.00 0.00 O ATOM 588 CB ARG A 36 25.154 16.539 -6.301 1.00 0.00 C ATOM 589 CG ARG A 36 23.951 17.302 -6.833 1.00 0.00 C ATOM 590 CD ARG A 36 24.356 18.299 -7.906 1.00 0.00 C ATOM 591 NE ARG A 36 25.099 19.430 -7.353 1.00 0.00 N ATOM 592 CZ ARG A 36 25.331 20.561 -8.016 1.00 0.00 C ATOM 593 NH1 ARG A 36 24.879 20.717 -9.254 1.00 0.00 N ATOM 594 NH2 ARG A 36 26.017 21.538 -7.440 1.00 0.00 N ATOM 0 H ARG A 36 24.656 15.893 -3.908 1.00 0.00 H new ATOM 0 HA ARG A 36 24.052 14.703 -6.497 1.00 0.00 H new ATOM 0 HB2 ARG A 36 25.581 17.089 -5.462 1.00 0.00 H new ATOM 0 HB3 ARG A 36 25.919 16.496 -7.077 1.00 0.00 H new ATOM 0 HG2 ARG A 36 23.225 16.600 -7.242 1.00 0.00 H new ATOM 0 HG3 ARG A 36 23.460 17.827 -6.014 1.00 0.00 H new ATOM 0 HD2 ARG A 36 24.967 17.796 -8.656 1.00 0.00 H new ATOM 0 HD3 ARG A 36 23.464 18.665 -8.415 1.00 0.00 H new ATOM 0 HE ARG A 36 25.461 19.348 -6.403 1.00 0.00 H new ATOM 0 HH11 ARG A 36 24.351 19.968 -9.702 1.00 0.00 H new ATOM 0 HH12 ARG A 36 25.060 21.586 -9.757 1.00 0.00 H new ATOM 0 HH21 ARG A 36 26.367 21.423 -6.489 1.00 0.00 H new ATOM 0 HH22 ARG A 36 26.195 22.405 -7.948 1.00 0.00 H new ATOM 608 N PHE A 37 27.171 14.716 -5.389 1.00 0.00 N ATOM 609 CA PHE A 37 28.428 13.977 -5.418 1.00 0.00 C ATOM 610 C PHE A 37 29.471 14.647 -4.528 1.00 0.00 C ATOM 611 O PHE A 37 30.122 13.991 -3.715 1.00 0.00 O ATOM 612 CB PHE A 37 28.952 13.875 -6.850 1.00 0.00 C ATOM 613 CG PHE A 37 29.094 15.206 -7.533 1.00 0.00 C ATOM 614 CD1 PHE A 37 28.027 15.763 -8.219 1.00 0.00 C ATOM 615 CD2 PHE A 37 30.293 15.898 -7.488 1.00 0.00 C ATOM 616 CE1 PHE A 37 28.154 16.988 -8.849 1.00 0.00 C ATOM 617 CE2 PHE A 37 30.425 17.122 -8.116 1.00 0.00 C ATOM 618 CZ PHE A 37 29.355 17.668 -8.797 1.00 0.00 C ATOM 0 H PHE A 37 27.221 15.613 -4.907 1.00 0.00 H new ATOM 0 HA PHE A 37 28.240 12.973 -5.037 1.00 0.00 H new ATOM 0 HB2 PHE A 37 29.921 13.376 -6.839 1.00 0.00 H new ATOM 0 HB3 PHE A 37 28.277 13.247 -7.432 1.00 0.00 H new ATOM 0 HD1 PHE A 37 27.086 15.235 -8.262 1.00 0.00 H new ATOM 0 HD2 PHE A 37 31.134 15.477 -6.957 1.00 0.00 H new ATOM 0 HE1 PHE A 37 27.315 17.412 -9.381 1.00 0.00 H new ATOM 0 HE2 PHE A 37 31.365 17.652 -8.074 1.00 0.00 H new ATOM 0 HZ PHE A 37 29.457 18.625 -9.288 1.00 0.00 H new ATOM 628 N ALA A 38 29.622 15.957 -4.688 1.00 0.00 N ATOM 629 CA ALA A 38 30.583 16.717 -3.898 1.00 0.00 C ATOM 630 C ALA A 38 29.903 17.397 -2.716 1.00 0.00 C ATOM 631 O ALA A 38 28.764 17.854 -2.821 1.00 0.00 O ATOM 632 CB ALA A 38 31.284 17.747 -4.771 1.00 0.00 C ATOM 0 H ALA A 38 29.091 16.514 -5.357 1.00 0.00 H new ATOM 0 HA ALA A 38 31.326 16.023 -3.506 1.00 0.00 H new ATOM 0 HB1 ALA A 38 31.999 18.308 -4.169 1.00 0.00 H new ATOM 0 HB2 ALA A 38 31.810 17.241 -5.581 1.00 0.00 H new ATOM 0 HB3 ALA A 38 30.546 18.432 -5.190 1.00 0.00 H new ATOM 638 N TYR A 39 30.606 17.461 -1.590 1.00 0.00 N ATOM 639 CA TYR A 39 30.067 18.086 -0.387 1.00 0.00 C ATOM 640 C TYR A 39 30.840 19.353 -0.038 1.00 0.00 C ATOM 641 O TYR A 39 32.039 19.305 0.238 1.00 0.00 O ATOM 642 CB TYR A 39 30.115 17.105 0.786 1.00 0.00 C ATOM 643 CG TYR A 39 29.076 16.010 0.702 1.00 0.00 C ATOM 644 CD1 TYR A 39 27.719 16.313 0.703 1.00 0.00 C ATOM 645 CD2 TYR A 39 29.449 14.675 0.624 1.00 0.00 C ATOM 646 CE1 TYR A 39 26.766 15.315 0.626 1.00 0.00 C ATOM 647 CE2 TYR A 39 28.502 13.671 0.547 1.00 0.00 C ATOM 648 CZ TYR A 39 27.162 13.997 0.548 1.00 0.00 C ATOM 649 OH TYR A 39 26.217 13.001 0.472 1.00 0.00 O ATOM 0 H TYR A 39 31.550 17.088 -1.485 1.00 0.00 H new ATOM 0 HA TYR A 39 29.030 18.359 -0.582 1.00 0.00 H new ATOM 0 HB2 TYR A 39 31.105 16.652 0.830 1.00 0.00 H new ATOM 0 HB3 TYR A 39 29.975 17.656 1.716 1.00 0.00 H new ATOM 0 HD1 TYR A 39 27.405 17.344 0.765 1.00 0.00 H new ATOM 0 HD2 TYR A 39 30.498 14.416 0.623 1.00 0.00 H new ATOM 0 HE1 TYR A 39 25.716 15.567 0.627 1.00 0.00 H new ATOM 0 HE2 TYR A 39 28.810 12.638 0.486 1.00 0.00 H new ATOM 0 HH TYR A 39 26.663 12.130 0.422 1.00 0.00 H new ATOM 659 N ASP A 40 30.146 20.486 -0.052 1.00 0.00 N ATOM 660 CA ASP A 40 30.765 21.767 0.264 1.00 0.00 C ATOM 661 C ASP A 40 31.313 21.770 1.687 1.00 0.00 C ATOM 662 O ASP A 40 30.983 20.898 2.492 1.00 0.00 O ATOM 663 CB ASP A 40 29.755 22.903 0.091 1.00 0.00 C ATOM 664 CG ASP A 40 30.388 24.158 -0.475 1.00 0.00 C ATOM 665 OD1 ASP A 40 30.290 25.219 0.178 1.00 0.00 O ATOM 666 OD2 ASP A 40 30.981 24.082 -1.571 1.00 0.00 O ATOM 0 H ASP A 40 29.153 20.543 -0.279 1.00 0.00 H new ATOM 0 HA ASP A 40 31.595 21.921 -0.426 1.00 0.00 H new ATOM 0 HB2 ASP A 40 28.953 22.575 -0.570 1.00 0.00 H new ATOM 0 HB3 ASP A 40 29.301 23.132 1.055 1.00 0.00 H new ATOM 672 N LYS A 41 32.152 22.755 1.992 1.00 0.00 N ATOM 673 CA LYS A 41 32.745 22.870 3.319 1.00 0.00 C ATOM 674 C LYS A 41 31.679 23.171 4.367 1.00 0.00 C ATOM 675 O LYS A 41 31.794 22.756 5.521 1.00 0.00 O ATOM 676 CB LYS A 41 33.811 23.968 3.330 1.00 0.00 C ATOM 677 CG LYS A 41 35.168 23.501 2.829 1.00 0.00 C ATOM 678 CD LYS A 41 36.284 24.412 3.316 1.00 0.00 C ATOM 679 CE LYS A 41 36.985 23.831 4.534 1.00 0.00 C ATOM 680 NZ LYS A 41 38.168 23.011 4.157 1.00 0.00 N ATOM 0 H LYS A 41 32.436 23.485 1.338 1.00 0.00 H new ATOM 0 HA LYS A 41 33.212 21.916 3.565 1.00 0.00 H new ATOM 0 HB2 LYS A 41 33.471 24.799 2.713 1.00 0.00 H new ATOM 0 HB3 LYS A 41 33.919 24.348 4.346 1.00 0.00 H new ATOM 0 HG2 LYS A 41 35.353 22.483 3.171 1.00 0.00 H new ATOM 0 HG3 LYS A 41 35.166 23.476 1.739 1.00 0.00 H new ATOM 0 HD2 LYS A 41 37.008 24.562 2.515 1.00 0.00 H new ATOM 0 HD3 LYS A 41 35.874 25.391 3.563 1.00 0.00 H new ATOM 0 HE2 LYS A 41 37.300 24.641 5.192 1.00 0.00 H new ATOM 0 HE3 LYS A 41 36.283 23.217 5.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 38.617 22.634 5.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 37.865 22.223 3.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 38.850 23.603 3.641 1.00 0.00 H new ATOM 694 N GLU A 42 30.641 23.894 3.960 1.00 0.00 N ATOM 695 CA GLU A 42 29.555 24.249 4.864 1.00 0.00 C ATOM 696 C GLU A 42 28.282 24.569 4.087 1.00 0.00 C ATOM 697 O GLU A 42 27.272 23.877 4.217 1.00 0.00 O ATOM 698 CB GLU A 42 29.953 25.448 5.728 1.00 0.00 C ATOM 699 CG GLU A 42 30.643 25.060 7.025 1.00 0.00 C ATOM 700 CD GLU A 42 30.184 25.899 8.202 1.00 0.00 C ATOM 701 OE1 GLU A 42 29.076 25.643 8.718 1.00 0.00 O ATOM 702 OE2 GLU A 42 30.934 26.812 8.607 1.00 0.00 O ATOM 0 H GLU A 42 30.530 24.245 3.009 1.00 0.00 H new ATOM 0 HA GLU A 42 29.360 23.393 5.510 1.00 0.00 H new ATOM 0 HB2 GLU A 42 30.615 26.096 5.153 1.00 0.00 H new ATOM 0 HB3 GLU A 42 29.061 26.030 5.960 1.00 0.00 H new ATOM 0 HG2 GLU A 42 30.449 24.008 7.235 1.00 0.00 H new ATOM 0 HG3 GLU A 42 31.721 25.167 6.905 1.00 0.00 H new ATOM 710 N LYS A 43 28.338 25.621 3.278 1.00 0.00 N ATOM 711 CA LYS A 43 27.190 26.034 2.479 1.00 0.00 C ATOM 712 C LYS A 43 26.771 24.928 1.515 1.00 0.00 C ATOM 713 O LYS A 43 27.560 24.490 0.677 1.00 0.00 O ATOM 714 CB LYS A 43 27.516 27.309 1.700 1.00 0.00 C ATOM 715 CG LYS A 43 26.348 28.276 1.597 1.00 0.00 C ATOM 716 CD LYS A 43 26.157 29.059 2.885 1.00 0.00 C ATOM 717 CE LYS A 43 24.905 29.918 2.836 1.00 0.00 C ATOM 718 NZ LYS A 43 23.754 29.264 3.515 1.00 0.00 N ATOM 0 H LYS A 43 29.167 26.204 3.158 1.00 0.00 H new ATOM 0 HA LYS A 43 26.360 26.233 3.157 1.00 0.00 H new ATOM 0 HB2 LYS A 43 28.354 27.814 2.181 1.00 0.00 H new ATOM 0 HB3 LYS A 43 27.842 27.038 0.696 1.00 0.00 H new ATOM 0 HG2 LYS A 43 26.519 28.967 0.772 1.00 0.00 H new ATOM 0 HG3 LYS A 43 25.437 27.724 1.367 1.00 0.00 H new ATOM 0 HD2 LYS A 43 26.092 28.368 3.725 1.00 0.00 H new ATOM 0 HD3 LYS A 43 27.027 29.692 3.059 1.00 0.00 H new ATOM 0 HE2 LYS A 43 25.106 30.879 3.309 1.00 0.00 H new ATOM 0 HE3 LYS A 43 24.645 30.122 1.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 22.920 29.883 3.459 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 23.545 28.358 3.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 23.991 29.093 4.513 1.00 0.00 H new ATOM 732 N THR A 44 25.526 24.479 1.641 1.00 0.00 N ATOM 733 CA THR A 44 25.003 23.424 0.782 1.00 0.00 C ATOM 734 C THR A 44 23.743 23.886 0.058 1.00 0.00 C ATOM 735 O THR A 44 23.321 25.034 0.197 1.00 0.00 O ATOM 736 CB THR A 44 24.702 22.170 1.604 1.00 0.00 C ATOM 737 OG1 THR A 44 23.777 22.459 2.638 1.00 0.00 O ATOM 738 CG2 THR A 44 25.932 21.564 2.245 1.00 0.00 C ATOM 0 H THR A 44 24.861 24.830 2.330 1.00 0.00 H new ATOM 0 HA THR A 44 25.762 23.188 0.037 1.00 0.00 H new ATOM 0 HB THR A 44 24.291 21.452 0.895 1.00 0.00 H new ATOM 0 HG1 THR A 44 23.596 21.644 3.152 1.00 0.00 H new ATOM 0 HG21 THR A 44 25.647 20.678 2.813 1.00 0.00 H new ATOM 0 HG22 THR A 44 26.646 21.284 1.470 1.00 0.00 H new ATOM 0 HG23 THR A 44 26.390 22.292 2.914 1.00 0.00 H new ATOM 746 N ASP A 45 23.146 22.985 -0.715 1.00 0.00 N ATOM 747 CA ASP A 45 21.933 23.300 -1.460 1.00 0.00 C ATOM 748 C ASP A 45 20.925 22.159 -1.369 1.00 0.00 C ATOM 749 O ASP A 45 20.191 21.889 -2.319 1.00 0.00 O ATOM 750 CB ASP A 45 22.269 23.584 -2.926 1.00 0.00 C ATOM 751 CG ASP A 45 22.870 24.961 -3.125 1.00 0.00 C ATOM 752 OD1 ASP A 45 22.101 25.913 -3.373 1.00 0.00 O ATOM 753 OD2 ASP A 45 24.109 25.087 -3.032 1.00 0.00 O ATOM 0 H ASP A 45 23.483 22.031 -0.842 1.00 0.00 H new ATOM 0 HA ASP A 45 21.486 24.190 -1.017 1.00 0.00 H new ATOM 0 HB2 ASP A 45 22.968 22.830 -3.288 1.00 0.00 H new ATOM 0 HB3 ASP A 45 21.364 23.495 -3.527 1.00 0.00 H new ATOM 759 N ARG A 46 20.896 21.494 -0.219 1.00 0.00 N ATOM 760 CA ARG A 46 19.977 20.382 -0.003 1.00 0.00 C ATOM 761 C ARG A 46 19.476 20.361 1.437 1.00 0.00 C ATOM 762 O ARG A 46 20.122 20.897 2.338 1.00 0.00 O ATOM 763 CB ARG A 46 20.662 19.054 -0.335 1.00 0.00 C ATOM 764 CG ARG A 46 19.703 17.981 -0.826 1.00 0.00 C ATOM 765 CD ARG A 46 19.891 17.697 -2.308 1.00 0.00 C ATOM 766 NE ARG A 46 18.912 18.405 -3.129 1.00 0.00 N ATOM 767 CZ ARG A 46 18.623 18.077 -4.386 1.00 0.00 C ATOM 768 NH1 ARG A 46 19.234 17.053 -4.969 1.00 0.00 N ATOM 769 NH2 ARG A 46 17.719 18.774 -5.062 1.00 0.00 N ATOM 0 H ARG A 46 21.498 21.705 0.577 1.00 0.00 H new ATOM 0 HA ARG A 46 19.122 20.518 -0.665 1.00 0.00 H new ATOM 0 HB2 ARG A 46 21.422 19.227 -1.097 1.00 0.00 H new ATOM 0 HB3 ARG A 46 21.179 18.689 0.553 1.00 0.00 H new ATOM 0 HG2 ARG A 46 19.859 17.065 -0.257 1.00 0.00 H new ATOM 0 HG3 ARG A 46 18.676 18.299 -0.643 1.00 0.00 H new ATOM 0 HD2 ARG A 46 20.897 17.991 -2.609 1.00 0.00 H new ATOM 0 HD3 ARG A 46 19.806 16.625 -2.485 1.00 0.00 H new ATOM 0 HE ARG A 46 18.421 19.197 -2.715 1.00 0.00 H new ATOM 0 HH11 ARG A 46 19.929 16.513 -4.453 1.00 0.00 H new ATOM 0 HH12 ARG A 46 19.009 16.806 -5.933 1.00 0.00 H new ATOM 0 HH21 ARG A 46 17.246 19.561 -4.618 1.00 0.00 H new ATOM 0 HH22 ARG A 46 17.497 18.523 -6.025 1.00 0.00 H new ATOM 783 N TYR A 47 18.320 19.739 1.648 1.00 0.00 N ATOM 784 CA TYR A 47 17.732 19.649 2.980 1.00 0.00 C ATOM 785 C TYR A 47 17.763 18.211 3.491 1.00 0.00 C ATOM 786 O TYR A 47 17.676 17.262 2.712 1.00 0.00 O ATOM 787 CB TYR A 47 16.292 20.169 2.960 1.00 0.00 C ATOM 788 CG TYR A 47 16.073 21.377 3.842 1.00 0.00 C ATOM 789 CD1 TYR A 47 16.795 22.547 3.642 1.00 0.00 C ATOM 790 CD2 TYR A 47 15.144 21.348 4.874 1.00 0.00 C ATOM 791 CE1 TYR A 47 16.598 23.653 4.446 1.00 0.00 C ATOM 792 CE2 TYR A 47 14.940 22.451 5.682 1.00 0.00 C ATOM 793 CZ TYR A 47 15.670 23.600 5.464 1.00 0.00 C ATOM 794 OH TYR A 47 15.470 24.699 6.267 1.00 0.00 O ATOM 0 H TYR A 47 17.772 19.290 0.914 1.00 0.00 H new ATOM 0 HA TYR A 47 18.323 20.267 3.656 1.00 0.00 H new ATOM 0 HB2 TYR A 47 16.021 20.423 1.935 1.00 0.00 H new ATOM 0 HB3 TYR A 47 15.622 19.371 3.278 1.00 0.00 H new ATOM 0 HD1 TYR A 47 17.522 22.593 2.845 1.00 0.00 H new ATOM 0 HD2 TYR A 47 14.572 20.449 5.048 1.00 0.00 H new ATOM 0 HE1 TYR A 47 17.168 24.555 4.278 1.00 0.00 H new ATOM 0 HE2 TYR A 47 14.213 22.413 6.480 1.00 0.00 H new ATOM 0 HH TYR A 47 14.782 24.496 6.934 1.00 0.00 H new ATOM 804 N ASN A 48 17.888 18.058 4.805 1.00 0.00 N ATOM 805 CA ASN A 48 17.930 16.738 5.421 1.00 0.00 C ATOM 806 C ASN A 48 16.523 16.180 5.609 1.00 0.00 C ATOM 807 O ASN A 48 15.536 16.910 5.504 1.00 0.00 O ATOM 808 CB ASN A 48 18.653 16.802 6.768 1.00 0.00 C ATOM 809 CG ASN A 48 20.080 16.297 6.683 1.00 0.00 C ATOM 810 OD1 ASN A 48 20.860 16.741 5.839 1.00 0.00 O ATOM 811 ND2 ASN A 48 20.431 15.362 7.559 1.00 0.00 N ATOM 0 H ASN A 48 17.962 18.833 5.464 1.00 0.00 H new ATOM 0 HA ASN A 48 18.479 16.071 4.755 1.00 0.00 H new ATOM 0 HB2 ASN A 48 18.656 17.831 7.127 1.00 0.00 H new ATOM 0 HB3 ASN A 48 18.104 16.210 7.500 1.00 0.00 H new ATOM 0 HD21 ASN A 48 21.378 14.984 7.549 1.00 0.00 H new ATOM 0 HD22 ASN A 48 19.753 15.022 8.241 1.00 0.00 H new ATOM 818 N GLU A 49 16.437 14.884 5.889 1.00 0.00 N ATOM 819 CA GLU A 49 15.150 14.229 6.093 1.00 0.00 C ATOM 820 C GLU A 49 14.734 14.292 7.559 1.00 0.00 C ATOM 821 O GLU A 49 15.284 13.583 8.402 1.00 0.00 O ATOM 822 CB GLU A 49 15.217 12.772 5.632 1.00 0.00 C ATOM 823 CG GLU A 49 13.910 12.257 5.053 1.00 0.00 C ATOM 824 CD GLU A 49 14.015 10.827 4.560 1.00 0.00 C ATOM 825 OE1 GLU A 49 13.339 10.491 3.565 1.00 0.00 O ATOM 826 OE2 GLU A 49 14.773 10.042 5.170 1.00 0.00 O ATOM 0 H GLU A 49 17.243 14.266 5.980 1.00 0.00 H new ATOM 0 HA GLU A 49 14.404 14.757 5.499 1.00 0.00 H new ATOM 0 HB2 GLU A 49 16.001 12.673 4.882 1.00 0.00 H new ATOM 0 HB3 GLU A 49 15.503 12.145 6.477 1.00 0.00 H new ATOM 0 HG2 GLU A 49 13.131 12.319 5.813 1.00 0.00 H new ATOM 0 HG3 GLU A 49 13.604 12.900 4.228 1.00 0.00 H new ATOM 834 N ARG A 50 13.761 15.146 7.857 1.00 0.00 N ATOM 835 CA ARG A 50 13.271 15.302 9.222 1.00 0.00 C ATOM 836 C ARG A 50 12.501 14.061 9.670 1.00 0.00 C ATOM 837 O ARG A 50 12.062 13.262 8.843 1.00 0.00 O ATOM 838 CB ARG A 50 12.375 16.538 9.327 1.00 0.00 C ATOM 839 CG ARG A 50 13.136 17.850 9.237 1.00 0.00 C ATOM 840 CD ARG A 50 13.775 18.216 10.566 1.00 0.00 C ATOM 841 NE ARG A 50 14.991 17.447 10.820 1.00 0.00 N ATOM 842 CZ ARG A 50 16.129 17.619 10.151 1.00 0.00 C ATOM 843 NH1 ARG A 50 16.212 18.530 9.190 1.00 0.00 N ATOM 844 NH2 ARG A 50 17.189 16.876 10.447 1.00 0.00 N ATOM 0 H ARG A 50 13.296 15.741 7.172 1.00 0.00 H new ATOM 0 HA ARG A 50 14.132 15.430 9.878 1.00 0.00 H new ATOM 0 HB2 ARG A 50 11.630 16.505 8.532 1.00 0.00 H new ATOM 0 HB3 ARG A 50 11.834 16.505 10.273 1.00 0.00 H new ATOM 0 HG2 ARG A 50 13.907 17.773 8.471 1.00 0.00 H new ATOM 0 HG3 ARG A 50 12.457 18.645 8.927 1.00 0.00 H new ATOM 0 HD2 ARG A 50 14.011 19.280 10.574 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.061 18.042 11.371 1.00 0.00 H new ATOM 0 HE ARG A 50 14.967 16.737 11.552 1.00 0.00 H new ATOM 0 HH11 ARG A 50 15.401 19.104 8.960 1.00 0.00 H new ATOM 0 HH12 ARG A 50 17.087 18.657 8.681 1.00 0.00 H new ATOM 0 HH21 ARG A 50 17.130 16.175 11.186 1.00 0.00 H new ATOM 0 HH22 ARG A 50 18.062 17.006 9.936 1.00 0.00 H new ATOM 858 N PRO A 51 12.326 13.886 10.991 1.00 0.00 N ATOM 859 CA PRO A 51 11.604 12.737 11.546 1.00 0.00 C ATOM 860 C PRO A 51 10.228 12.557 10.913 1.00 0.00 C ATOM 861 O PRO A 51 9.431 13.494 10.859 1.00 0.00 O ATOM 862 CB PRO A 51 11.467 13.084 13.030 1.00 0.00 C ATOM 863 CG PRO A 51 12.603 14.007 13.309 1.00 0.00 C ATOM 864 CD PRO A 51 12.816 14.793 12.045 1.00 0.00 C ATOM 0 HA PRO A 51 12.128 11.800 11.361 1.00 0.00 H new ATOM 0 HB2 PRO A 51 10.509 13.561 13.238 1.00 0.00 H new ATOM 0 HB3 PRO A 51 11.521 12.191 13.652 1.00 0.00 H new ATOM 0 HG2 PRO A 51 12.373 14.667 14.145 1.00 0.00 H new ATOM 0 HG3 PRO A 51 13.501 13.451 13.579 1.00 0.00 H new ATOM 0 HD2 PRO A 51 12.261 15.731 12.057 1.00 0.00 H new ATOM 0 HD3 PRO A 51 13.867 15.045 11.901 1.00 0.00 H new ATOM 872 N TRP A 52 9.956 11.347 10.434 1.00 0.00 N ATOM 873 CA TRP A 52 8.676 11.045 9.804 1.00 0.00 C ATOM 874 C TRP A 52 7.876 10.051 10.642 1.00 0.00 C ATOM 875 O TRP A 52 7.082 9.275 10.111 1.00 0.00 O ATOM 876 CB TRP A 52 8.897 10.486 8.396 1.00 0.00 C ATOM 877 CG TRP A 52 8.165 11.246 7.333 1.00 0.00 C ATOM 878 CD1 TRP A 52 8.575 12.394 6.717 1.00 0.00 C ATOM 879 CD2 TRP A 52 6.895 10.913 6.761 1.00 0.00 C ATOM 880 NE1 TRP A 52 7.636 12.794 5.796 1.00 0.00 N ATOM 881 CE2 TRP A 52 6.596 11.902 5.806 1.00 0.00 C ATOM 882 CE3 TRP A 52 5.982 9.875 6.965 1.00 0.00 C ATOM 883 CZ2 TRP A 52 5.423 11.883 5.055 1.00 0.00 C ATOM 884 CZ3 TRP A 52 4.817 9.856 6.219 1.00 0.00 C ATOM 885 CH2 TRP A 52 4.547 10.854 5.275 1.00 0.00 C ATOM 0 H TRP A 52 10.604 10.561 10.470 1.00 0.00 H new ATOM 0 HA TRP A 52 8.106 11.971 9.734 1.00 0.00 H new ATOM 0 HB2 TRP A 52 9.964 10.498 8.172 1.00 0.00 H new ATOM 0 HB3 TRP A 52 8.578 9.444 8.372 1.00 0.00 H new ATOM 0 HD1 TRP A 52 9.500 12.911 6.923 1.00 0.00 H new ATOM 0 HE1 TRP A 52 7.703 13.620 5.202 1.00 0.00 H new ATOM 0 HE3 TRP A 52 6.182 9.102 7.692 1.00 0.00 H new ATOM 0 HZ2 TRP A 52 5.212 12.652 4.326 1.00 0.00 H new ATOM 0 HZ3 TRP A 52 4.104 9.058 6.367 1.00 0.00 H new ATOM 0 HH2 TRP A 52 3.629 10.811 4.708 1.00 0.00 H new ATOM 896 N GLY A 53 8.090 10.082 11.954 1.00 0.00 N ATOM 897 CA GLY A 53 7.381 9.179 12.843 1.00 0.00 C ATOM 898 C GLY A 53 7.613 7.722 12.499 1.00 0.00 C ATOM 899 O GLY A 53 8.724 7.212 12.643 1.00 0.00 O ATOM 0 H GLY A 53 8.741 10.716 12.417 1.00 0.00 H new ATOM 0 HA2 GLY A 53 7.699 9.361 13.869 1.00 0.00 H new ATOM 0 HA3 GLY A 53 6.313 9.394 12.797 1.00 0.00 H new ATOM 903 N GLY A 54 6.562 7.049 12.041 1.00 0.00 N ATOM 904 CA GLY A 54 6.677 5.647 11.682 1.00 0.00 C ATOM 905 C GLY A 54 5.368 5.066 11.184 1.00 0.00 C ATOM 906 O GLY A 54 4.292 5.505 11.589 1.00 0.00 O ATOM 0 H GLY A 54 5.633 7.449 11.912 1.00 0.00 H new ATOM 0 HA2 GLY A 54 7.438 5.534 10.910 1.00 0.00 H new ATOM 0 HA3 GLY A 54 7.016 5.080 12.549 1.00 0.00 H new ATOM 910 N GLY A 55 5.460 4.076 10.302 1.00 0.00 N ATOM 911 CA GLY A 55 4.268 3.449 9.762 1.00 0.00 C ATOM 912 C GLY A 55 4.050 2.051 10.308 1.00 0.00 C ATOM 913 O GLY A 55 5.006 1.350 10.637 1.00 0.00 O ATOM 0 H GLY A 55 6.340 3.697 9.951 1.00 0.00 H new ATOM 0 HA2 GLY A 55 3.400 4.066 9.994 1.00 0.00 H new ATOM 0 HA3 GLY A 55 4.345 3.404 8.676 1.00 0.00 H new ATOM 917 N PHE A 56 2.788 1.646 10.402 1.00 0.00 N ATOM 918 CA PHE A 56 2.446 0.323 10.911 1.00 0.00 C ATOM 919 C PHE A 56 1.421 -0.358 10.010 1.00 0.00 C ATOM 920 O PHE A 56 0.853 0.268 9.116 1.00 0.00 O ATOM 921 CB PHE A 56 1.900 0.428 12.336 1.00 0.00 C ATOM 922 CG PHE A 56 2.969 0.402 13.391 1.00 0.00 C ATOM 923 CD1 PHE A 56 3.565 -0.793 13.763 1.00 0.00 C ATOM 924 CD2 PHE A 56 3.375 1.571 14.013 1.00 0.00 C ATOM 925 CE1 PHE A 56 4.548 -0.821 14.734 1.00 0.00 C ATOM 926 CE2 PHE A 56 4.358 1.550 14.984 1.00 0.00 C ATOM 927 CZ PHE A 56 4.945 0.353 15.345 1.00 0.00 C ATOM 0 H PHE A 56 1.985 2.215 10.132 1.00 0.00 H new ATOM 0 HA PHE A 56 3.353 -0.281 10.920 1.00 0.00 H new ATOM 0 HB2 PHE A 56 1.330 1.352 12.431 1.00 0.00 H new ATOM 0 HB3 PHE A 56 1.207 -0.394 12.512 1.00 0.00 H new ATOM 0 HD1 PHE A 56 3.257 -1.713 13.288 1.00 0.00 H new ATOM 0 HD2 PHE A 56 2.918 2.510 13.736 1.00 0.00 H new ATOM 0 HE1 PHE A 56 5.005 -1.758 15.015 1.00 0.00 H new ATOM 0 HE2 PHE A 56 4.667 2.469 15.460 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.713 0.335 16.104 1.00 0.00 H new ATOM 937 N GLY A 57 1.190 -1.645 10.252 1.00 0.00 N ATOM 938 CA GLY A 57 0.234 -2.389 9.454 1.00 0.00 C ATOM 939 C GLY A 57 -0.242 -3.652 10.145 1.00 0.00 C ATOM 940 O GLY A 57 0.525 -4.310 10.847 1.00 0.00 O ATOM 0 H GLY A 57 1.648 -2.185 10.986 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -0.624 -1.753 9.235 1.00 0.00 H new ATOM 0 HA3 GLY A 57 0.689 -2.651 8.499 1.00 0.00 H new ATOM 944 N LEU A 58 -1.512 -3.990 9.947 1.00 0.00 N ATOM 945 CA LEU A 58 -2.091 -5.182 10.555 1.00 0.00 C ATOM 946 C LEU A 58 -2.419 -6.229 9.497 1.00 0.00 C ATOM 947 O LEU A 58 -2.624 -5.902 8.327 1.00 0.00 O ATOM 948 CB LEU A 58 -3.354 -4.818 11.339 1.00 0.00 C ATOM 949 CG LEU A 58 -3.717 -5.784 12.468 1.00 0.00 C ATOM 950 CD1 LEU A 58 -2.609 -5.827 13.510 1.00 0.00 C ATOM 951 CD2 LEU A 58 -5.037 -5.382 13.108 1.00 0.00 C ATOM 0 H LEU A 58 -2.160 -3.454 9.370 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.355 -5.603 11.240 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -3.226 -3.821 11.761 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -4.192 -4.765 10.644 1.00 0.00 H new ATOM 0 HG LEU A 58 -3.829 -6.782 12.045 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -2.884 -6.519 14.306 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -1.683 -6.161 13.043 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -2.465 -4.831 13.929 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -5.280 -6.080 13.909 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -4.951 -4.375 13.517 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -5.827 -5.402 12.357 1.00 0.00 H new ATOM 963 N SER A 59 -2.469 -7.491 9.914 1.00 0.00 N ATOM 964 CA SER A 59 -2.772 -8.587 9.001 1.00 0.00 C ATOM 965 C SER A 59 -4.161 -9.155 9.277 1.00 0.00 C ATOM 966 O SER A 59 -4.579 -9.270 10.429 1.00 0.00 O ATOM 967 CB SER A 59 -1.723 -9.692 9.132 1.00 0.00 C ATOM 968 OG SER A 59 -1.465 -10.301 7.879 1.00 0.00 O ATOM 0 H SER A 59 -2.304 -7.779 10.878 1.00 0.00 H new ATOM 0 HA SER A 59 -2.753 -8.196 7.984 1.00 0.00 H new ATOM 0 HB2 SER A 59 -0.800 -9.275 9.534 1.00 0.00 H new ATOM 0 HB3 SER A 59 -2.069 -10.444 9.841 1.00 0.00 H new ATOM 0 HG SER A 59 -0.790 -11.003 7.989 1.00 0.00 H new ATOM 974 N ARG A 60 -4.872 -9.508 8.210 1.00 0.00 N ATOM 975 CA ARG A 60 -6.214 -10.064 8.337 1.00 0.00 C ATOM 976 C ARG A 60 -6.490 -11.075 7.228 1.00 0.00 C ATOM 977 O ARG A 60 -6.481 -10.733 6.045 1.00 0.00 O ATOM 978 CB ARG A 60 -7.258 -8.946 8.298 1.00 0.00 C ATOM 979 CG ARG A 60 -7.735 -8.512 9.674 1.00 0.00 C ATOM 980 CD ARG A 60 -8.821 -7.450 9.581 1.00 0.00 C ATOM 981 NE ARG A 60 -10.003 -7.808 10.361 1.00 0.00 N ATOM 982 CZ ARG A 60 -11.198 -7.245 10.196 1.00 0.00 C ATOM 983 NH1 ARG A 60 -11.373 -6.298 9.282 1.00 0.00 N ATOM 984 NH2 ARG A 60 -12.221 -7.630 10.947 1.00 0.00 N ATOM 0 H ARG A 60 -4.541 -9.419 7.249 1.00 0.00 H new ATOM 0 HA ARG A 60 -6.279 -10.578 9.296 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -6.837 -8.084 7.780 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -8.115 -9.281 7.714 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -8.116 -9.377 10.217 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -6.893 -8.123 10.246 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -8.428 -6.497 9.935 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -9.104 -7.310 8.538 1.00 0.00 H new ATOM 0 HE ARG A 60 -9.907 -8.531 11.074 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -10.590 -5.998 8.702 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -12.291 -5.870 9.160 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -12.092 -8.357 11.651 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -13.137 -7.199 10.821 1.00 0.00 H new ATOM 998 N TRP A 61 -6.736 -12.321 7.619 1.00 0.00 N ATOM 999 CA TRP A 61 -7.015 -13.382 6.658 1.00 0.00 C ATOM 1000 C TRP A 61 -8.514 -13.511 6.410 1.00 0.00 C ATOM 1001 O TRP A 61 -9.313 -13.485 7.346 1.00 0.00 O ATOM 1002 CB TRP A 61 -6.447 -14.713 7.158 1.00 0.00 C ATOM 1003 CG TRP A 61 -5.405 -15.292 6.251 1.00 0.00 C ATOM 1004 CD1 TRP A 61 -4.053 -15.271 6.437 1.00 0.00 C ATOM 1005 CD2 TRP A 61 -5.630 -15.976 5.013 1.00 0.00 C ATOM 1006 NE1 TRP A 61 -3.422 -15.900 5.392 1.00 0.00 N ATOM 1007 CE2 TRP A 61 -4.369 -16.342 4.505 1.00 0.00 C ATOM 1008 CE3 TRP A 61 -6.774 -16.316 4.287 1.00 0.00 C ATOM 1009 CZ2 TRP A 61 -4.223 -17.031 3.303 1.00 0.00 C ATOM 1010 CZ3 TRP A 61 -6.627 -17.000 3.094 1.00 0.00 C ATOM 1011 CH2 TRP A 61 -5.360 -17.351 2.613 1.00 0.00 C ATOM 0 H TRP A 61 -6.748 -12.621 8.594 1.00 0.00 H new ATOM 0 HA TRP A 61 -6.533 -13.123 5.715 1.00 0.00 H new ATOM 0 HB2 TRP A 61 -6.016 -14.567 8.148 1.00 0.00 H new ATOM 0 HB3 TRP A 61 -7.261 -15.429 7.268 1.00 0.00 H new ATOM 0 HD1 TRP A 61 -3.552 -14.824 7.283 1.00 0.00 H new ATOM 0 HE1 TRP A 61 -2.414 -16.019 5.292 1.00 0.00 H new ATOM 0 HE3 TRP A 61 -7.755 -16.050 4.651 1.00 0.00 H new ATOM 0 HZ2 TRP A 61 -3.247 -17.303 2.929 1.00 0.00 H new ATOM 0 HZ3 TRP A 61 -7.504 -17.268 2.524 1.00 0.00 H new ATOM 0 HH2 TRP A 61 -5.279 -17.885 1.678 1.00 0.00 H new ATOM 1022 N ASP A 62 -8.889 -13.652 5.142 1.00 0.00 N ATOM 1023 CA ASP A 62 -10.293 -13.785 4.771 1.00 0.00 C ATOM 1024 C ASP A 62 -10.607 -15.214 4.337 1.00 0.00 C ATOM 1025 O ASP A 62 -9.996 -15.740 3.406 1.00 0.00 O ATOM 1026 CB ASP A 62 -10.641 -12.806 3.648 1.00 0.00 C ATOM 1027 CG ASP A 62 -11.855 -11.960 3.974 1.00 0.00 C ATOM 1028 OD1 ASP A 62 -11.789 -11.177 4.946 1.00 0.00 O ATOM 1029 OD2 ASP A 62 -12.872 -12.079 3.260 1.00 0.00 O ATOM 0 H ASP A 62 -8.240 -13.677 4.355 1.00 0.00 H new ATOM 0 HA ASP A 62 -10.899 -13.550 5.646 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -9.787 -12.155 3.460 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -10.826 -13.362 2.729 1.00 0.00 H new ATOM 1035 N GLU A 63 -11.565 -15.835 5.020 1.00 0.00 N ATOM 1036 CA GLU A 63 -11.966 -17.205 4.712 1.00 0.00 C ATOM 1037 C GLU A 63 -12.375 -17.350 3.247 1.00 0.00 C ATOM 1038 O GLU A 63 -12.359 -18.451 2.697 1.00 0.00 O ATOM 1039 CB GLU A 63 -13.122 -17.634 5.619 1.00 0.00 C ATOM 1040 CG GLU A 63 -12.669 -18.277 6.919 1.00 0.00 C ATOM 1041 CD GLU A 63 -13.731 -18.218 7.999 1.00 0.00 C ATOM 1042 OE1 GLU A 63 -14.727 -18.963 7.894 1.00 0.00 O ATOM 1043 OE2 GLU A 63 -13.566 -17.426 8.951 1.00 0.00 O ATOM 0 H GLU A 63 -12.079 -15.410 5.792 1.00 0.00 H new ATOM 0 HA GLU A 63 -11.107 -17.851 4.890 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -13.735 -16.763 5.849 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -13.756 -18.336 5.078 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -12.403 -19.317 6.732 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -11.768 -17.776 7.273 1.00 0.00 H new ATOM 1051 N LYS A 64 -12.742 -16.236 2.620 1.00 0.00 N ATOM 1052 CA LYS A 64 -13.154 -16.248 1.222 1.00 0.00 C ATOM 1053 C LYS A 64 -11.971 -15.975 0.294 1.00 0.00 C ATOM 1054 O LYS A 64 -12.146 -15.483 -0.820 1.00 0.00 O ATOM 1055 CB LYS A 64 -14.254 -15.209 0.985 1.00 0.00 C ATOM 1056 CG LYS A 64 -15.415 -15.732 0.155 1.00 0.00 C ATOM 1057 CD LYS A 64 -16.742 -15.168 0.637 1.00 0.00 C ATOM 1058 CE LYS A 64 -16.960 -13.749 0.139 1.00 0.00 C ATOM 1059 NZ LYS A 64 -17.719 -13.720 -1.141 1.00 0.00 N ATOM 0 H LYS A 64 -12.762 -15.315 3.058 1.00 0.00 H new ATOM 0 HA LYS A 64 -13.543 -17.241 0.996 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -14.632 -14.866 1.948 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -13.822 -14.342 0.485 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -15.264 -15.467 -0.891 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -15.440 -16.820 0.208 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -17.556 -15.805 0.291 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -16.769 -15.180 1.727 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -17.500 -13.178 0.894 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -15.995 -13.261 0.000 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -17.847 -12.734 -1.447 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -17.192 -14.243 -1.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -18.650 -14.163 -1.003 1.00 0.00 H new ATOM 1073 N GLY A 65 -10.767 -16.300 0.758 1.00 0.00 N ATOM 1074 CA GLY A 65 -9.580 -16.082 -0.047 1.00 0.00 C ATOM 1075 C GLY A 65 -9.301 -14.612 -0.285 1.00 0.00 C ATOM 1076 O GLY A 65 -9.125 -14.184 -1.426 1.00 0.00 O ATOM 0 H GLY A 65 -10.594 -16.710 1.676 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -8.721 -16.536 0.448 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -9.698 -16.586 -1.006 1.00 0.00 H new ATOM 1080 N ASN A 66 -9.260 -13.836 0.794 1.00 0.00 N ATOM 1081 CA ASN A 66 -9.000 -12.404 0.694 1.00 0.00 C ATOM 1082 C ASN A 66 -7.934 -11.974 1.697 1.00 0.00 C ATOM 1083 O ASN A 66 -7.744 -12.617 2.730 1.00 0.00 O ATOM 1084 CB ASN A 66 -10.290 -11.612 0.923 1.00 0.00 C ATOM 1085 CG ASN A 66 -10.558 -10.612 -0.184 1.00 0.00 C ATOM 1086 OD1 ASN A 66 -9.649 -9.927 -0.652 1.00 0.00 O ATOM 1087 ND2 ASN A 66 -11.813 -10.523 -0.611 1.00 0.00 N ATOM 0 H ASN A 66 -9.403 -14.174 1.746 1.00 0.00 H new ATOM 0 HA ASN A 66 -8.631 -12.195 -0.310 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -11.130 -12.303 0.996 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -10.226 -11.087 1.876 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -12.053 -9.868 -1.355 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -12.536 -11.110 -0.195 1.00 0.00 H new ATOM 1094 N TRP A 67 -7.243 -10.882 1.386 1.00 0.00 N ATOM 1095 CA TRP A 67 -6.197 -10.365 2.260 1.00 0.00 C ATOM 1096 C TRP A 67 -6.502 -8.932 2.685 1.00 0.00 C ATOM 1097 O TRP A 67 -6.538 -8.023 1.857 1.00 0.00 O ATOM 1098 CB TRP A 67 -4.839 -10.425 1.555 1.00 0.00 C ATOM 1099 CG TRP A 67 -3.994 -11.583 1.991 1.00 0.00 C ATOM 1100 CD1 TRP A 67 -4.432 -12.793 2.445 1.00 0.00 C ATOM 1101 CD2 TRP A 67 -2.563 -11.640 2.013 1.00 0.00 C ATOM 1102 NE1 TRP A 67 -3.362 -13.599 2.749 1.00 0.00 N ATOM 1103 CE2 TRP A 67 -2.203 -12.913 2.492 1.00 0.00 C ATOM 1104 CE3 TRP A 67 -1.550 -10.737 1.674 1.00 0.00 C ATOM 1105 CZ2 TRP A 67 -0.875 -13.306 2.640 1.00 0.00 C ATOM 1106 CZ3 TRP A 67 -0.232 -11.128 1.821 1.00 0.00 C ATOM 1107 CH2 TRP A 67 0.094 -12.403 2.300 1.00 0.00 C ATOM 0 H TRP A 67 -7.389 -10.338 0.535 1.00 0.00 H new ATOM 0 HA TRP A 67 -6.162 -10.989 3.153 1.00 0.00 H new ATOM 0 HB2 TRP A 67 -4.999 -10.486 0.479 1.00 0.00 H new ATOM 0 HB3 TRP A 67 -4.298 -9.498 1.745 1.00 0.00 H new ATOM 0 HD1 TRP A 67 -5.469 -13.076 2.550 1.00 0.00 H new ATOM 0 HE1 TRP A 67 -3.420 -14.552 3.107 1.00 0.00 H new ATOM 0 HE3 TRP A 67 -1.793 -9.752 1.304 1.00 0.00 H new ATOM 0 HZ2 TRP A 67 -0.620 -14.288 3.010 1.00 0.00 H new ATOM 0 HZ3 TRP A 67 0.559 -10.439 1.562 1.00 0.00 H new ATOM 0 HH2 TRP A 67 1.133 -12.679 2.403 1.00 0.00 H new ATOM 1118 N HIS A 68 -6.722 -8.739 3.981 1.00 0.00 N ATOM 1119 CA HIS A 68 -7.025 -7.418 4.518 1.00 0.00 C ATOM 1120 C HIS A 68 -5.865 -6.893 5.357 1.00 0.00 C ATOM 1121 O HIS A 68 -5.328 -7.606 6.205 1.00 0.00 O ATOM 1122 CB HIS A 68 -8.300 -7.467 5.361 1.00 0.00 C ATOM 1123 CG HIS A 68 -9.557 -7.454 4.548 1.00 0.00 C ATOM 1124 ND1 HIS A 68 -10.477 -8.482 4.568 1.00 0.00 N ATOM 1125 CD2 HIS A 68 -10.047 -6.531 3.686 1.00 0.00 C ATOM 1126 CE1 HIS A 68 -11.476 -8.192 3.755 1.00 0.00 C ATOM 1127 NE2 HIS A 68 -11.240 -7.013 3.208 1.00 0.00 N ATOM 0 H HIS A 68 -6.696 -9.482 4.680 1.00 0.00 H new ATOM 0 HA HIS A 68 -7.179 -6.739 3.680 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -8.284 -8.367 5.976 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -8.309 -6.616 6.042 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -10.398 -9.333 5.124 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -9.585 -5.591 3.424 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -12.340 -8.813 3.569 1.00 0.00 H new ATOM 1136 N GLY A 69 -5.483 -5.644 5.115 1.00 0.00 N ATOM 1137 CA GLY A 69 -4.389 -5.046 5.857 1.00 0.00 C ATOM 1138 C GLY A 69 -4.675 -3.612 6.258 1.00 0.00 C ATOM 1139 O GLY A 69 -5.027 -2.784 5.418 1.00 0.00 O ATOM 0 H GLY A 69 -5.912 -5.035 4.418 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -4.194 -5.638 6.751 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -3.484 -5.077 5.251 1.00 0.00 H new ATOM 1143 N LEU A 70 -4.524 -3.319 7.545 1.00 0.00 N ATOM 1144 CA LEU A 70 -4.769 -1.975 8.056 1.00 0.00 C ATOM 1145 C LEU A 70 -3.522 -1.107 7.922 1.00 0.00 C ATOM 1146 O LEU A 70 -2.400 -1.613 7.905 1.00 0.00 O ATOM 1147 CB LEU A 70 -5.208 -2.036 9.521 1.00 0.00 C ATOM 1148 CG LEU A 70 -6.535 -2.754 9.770 1.00 0.00 C ATOM 1149 CD1 LEU A 70 -6.747 -2.983 11.258 1.00 0.00 C ATOM 1150 CD2 LEU A 70 -7.689 -1.958 9.182 1.00 0.00 C ATOM 0 H LEU A 70 -4.233 -3.993 8.253 1.00 0.00 H new ATOM 0 HA LEU A 70 -5.567 -1.527 7.463 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -4.429 -2.535 10.097 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -5.286 -1.018 9.904 1.00 0.00 H new ATOM 0 HG LEU A 70 -6.500 -3.725 9.276 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -7.696 -3.495 11.416 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -5.935 -3.595 11.651 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -6.762 -2.024 11.775 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -8.626 -2.483 9.368 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -7.726 -0.973 9.648 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.543 -1.846 8.108 1.00 0.00 H new ATOM 1162 N TYR A 71 -3.728 0.202 7.827 1.00 0.00 N ATOM 1163 CA TYR A 71 -2.620 1.141 7.695 1.00 0.00 C ATOM 1164 C TYR A 71 -2.704 2.234 8.756 1.00 0.00 C ATOM 1165 O TYR A 71 -3.665 3.002 8.796 1.00 0.00 O ATOM 1166 CB TYR A 71 -2.619 1.769 6.299 1.00 0.00 C ATOM 1167 CG TYR A 71 -2.585 0.753 5.179 1.00 0.00 C ATOM 1168 CD1 TYR A 71 -3.755 0.176 4.703 1.00 0.00 C ATOM 1169 CD2 TYR A 71 -1.382 0.373 4.598 1.00 0.00 C ATOM 1170 CE1 TYR A 71 -3.728 -0.753 3.680 1.00 0.00 C ATOM 1171 CE2 TYR A 71 -1.346 -0.555 3.574 1.00 0.00 C ATOM 1172 CZ TYR A 71 -2.521 -1.114 3.120 1.00 0.00 C ATOM 1173 OH TYR A 71 -2.489 -2.038 2.100 1.00 0.00 O ATOM 0 H TYR A 71 -4.651 0.637 7.839 1.00 0.00 H new ATOM 0 HA TYR A 71 -1.691 0.590 7.839 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -3.508 2.390 6.188 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -1.756 2.428 6.207 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -4.702 0.458 5.139 1.00 0.00 H new ATOM 0 HD2 TYR A 71 -0.460 0.810 4.952 1.00 0.00 H new ATOM 0 HE1 TYR A 71 -4.647 -1.193 3.322 1.00 0.00 H new ATOM 0 HE2 TYR A 71 -0.403 -0.840 3.132 1.00 0.00 H new ATOM 0 HH TYR A 71 -1.562 -2.180 1.816 1.00 0.00 H new ATOM 1183 N ALA A 72 -1.691 2.297 9.613 1.00 0.00 N ATOM 1184 CA ALA A 72 -1.649 3.295 10.675 1.00 0.00 C ATOM 1185 C ALA A 72 -0.300 4.005 10.707 1.00 0.00 C ATOM 1186 O ALA A 72 0.715 3.413 11.069 1.00 0.00 O ATOM 1187 CB ALA A 72 -1.937 2.645 12.021 1.00 0.00 C ATOM 0 H ALA A 72 -0.888 1.669 9.593 1.00 0.00 H new ATOM 0 HA ALA A 72 -2.418 4.040 10.471 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -1.902 3.401 12.805 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -2.927 2.189 12.000 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -1.188 1.879 12.223 1.00 0.00 H new ATOM 1193 N MET A 73 -0.299 5.278 10.324 1.00 0.00 N ATOM 1194 CA MET A 73 0.925 6.069 10.308 1.00 0.00 C ATOM 1195 C MET A 73 0.863 7.193 11.337 1.00 0.00 C ATOM 1196 O MET A 73 -0.210 7.536 11.833 1.00 0.00 O ATOM 1197 CB MET A 73 1.162 6.653 8.914 1.00 0.00 C ATOM 1198 CG MET A 73 2.629 6.703 8.516 1.00 0.00 C ATOM 1199 SD MET A 73 3.092 5.372 7.391 1.00 0.00 S ATOM 1200 CE MET A 73 3.117 6.245 5.827 1.00 0.00 C ATOM 0 H MET A 73 -1.132 5.783 10.021 1.00 0.00 H new ATOM 0 HA MET A 73 1.754 5.411 10.566 1.00 0.00 H new ATOM 0 HB2 MET A 73 0.616 6.058 8.182 1.00 0.00 H new ATOM 0 HB3 MET A 73 0.749 7.661 8.877 1.00 0.00 H new ATOM 0 HG2 MET A 73 2.840 7.662 8.043 1.00 0.00 H new ATOM 0 HG3 MET A 73 3.246 6.646 9.413 1.00 0.00 H new ATOM 0 HE1 MET A 73 3.265 5.533 5.015 1.00 0.00 H new ATOM 0 HE2 MET A 73 2.170 6.765 5.685 1.00 0.00 H new ATOM 0 HE3 MET A 73 3.932 6.969 5.827 1.00 0.00 H new ATOM 1210 N ALA A 74 2.021 7.762 11.653 1.00 0.00 N ATOM 1211 CA ALA A 74 2.102 8.848 12.622 1.00 0.00 C ATOM 1212 C ALA A 74 3.202 9.834 12.246 1.00 0.00 C ATOM 1213 O ALA A 74 4.292 9.437 11.834 1.00 0.00 O ATOM 1214 CB ALA A 74 2.340 8.292 14.018 1.00 0.00 C ATOM 0 H ALA A 74 2.918 7.488 11.251 1.00 0.00 H new ATOM 0 HA ALA A 74 1.152 9.383 12.615 1.00 0.00 H new ATOM 0 HB1 ALA A 74 2.398 9.114 14.732 1.00 0.00 H new ATOM 0 HB2 ALA A 74 1.517 7.631 14.292 1.00 0.00 H new ATOM 0 HB3 ALA A 74 3.275 7.732 14.032 1.00 0.00 H new ATOM 1220 N PHE A 75 2.910 11.123 12.391 1.00 0.00 N ATOM 1221 CA PHE A 75 3.877 12.165 12.066 1.00 0.00 C ATOM 1222 C PHE A 75 4.004 13.167 13.209 1.00 0.00 C ATOM 1223 O PHE A 75 3.068 13.362 13.984 1.00 0.00 O ATOM 1224 CB PHE A 75 3.465 12.889 10.782 1.00 0.00 C ATOM 1225 CG PHE A 75 4.545 13.765 10.213 1.00 0.00 C ATOM 1226 CD1 PHE A 75 5.678 13.207 9.643 1.00 0.00 C ATOM 1227 CD2 PHE A 75 4.426 15.144 10.249 1.00 0.00 C ATOM 1228 CE1 PHE A 75 6.673 14.010 9.119 1.00 0.00 C ATOM 1229 CE2 PHE A 75 5.418 15.952 9.727 1.00 0.00 C ATOM 1230 CZ PHE A 75 6.543 15.384 9.161 1.00 0.00 C ATOM 0 H PHE A 75 2.013 11.470 12.731 1.00 0.00 H new ATOM 0 HA PHE A 75 4.847 11.691 11.914 1.00 0.00 H new ATOM 0 HB2 PHE A 75 3.177 12.150 10.035 1.00 0.00 H new ATOM 0 HB3 PHE A 75 2.584 13.498 10.985 1.00 0.00 H new ATOM 0 HD1 PHE A 75 5.785 12.133 9.608 1.00 0.00 H new ATOM 0 HD2 PHE A 75 3.548 15.593 10.690 1.00 0.00 H new ATOM 0 HE1 PHE A 75 7.551 13.563 8.677 1.00 0.00 H new ATOM 0 HE2 PHE A 75 5.314 17.026 9.761 1.00 0.00 H new ATOM 0 HZ PHE A 75 7.319 16.014 8.752 1.00 0.00 H new ATOM 1240 N LYS A 76 5.169 13.800 13.308 1.00 0.00 N ATOM 1241 CA LYS A 76 5.420 14.782 14.356 1.00 0.00 C ATOM 1242 C LYS A 76 5.223 16.199 13.830 1.00 0.00 C ATOM 1243 O LYS A 76 6.079 16.737 13.129 1.00 0.00 O ATOM 1244 CB LYS A 76 6.840 14.621 14.903 1.00 0.00 C ATOM 1245 CG LYS A 76 7.038 15.245 16.275 1.00 0.00 C ATOM 1246 CD LYS A 76 8.499 15.566 16.536 1.00 0.00 C ATOM 1247 CE LYS A 76 8.658 16.880 17.283 1.00 0.00 C ATOM 1248 NZ LYS A 76 8.025 16.833 18.630 1.00 0.00 N ATOM 0 H LYS A 76 5.954 13.650 12.674 1.00 0.00 H new ATOM 0 HA LYS A 76 4.706 14.610 15.161 1.00 0.00 H new ATOM 0 HB2 LYS A 76 7.081 13.559 14.958 1.00 0.00 H new ATOM 0 HB3 LYS A 76 7.543 15.072 14.203 1.00 0.00 H new ATOM 0 HG2 LYS A 76 6.445 16.157 16.350 1.00 0.00 H new ATOM 0 HG3 LYS A 76 6.672 14.563 17.042 1.00 0.00 H new ATOM 0 HD2 LYS A 76 8.951 14.761 17.115 1.00 0.00 H new ATOM 0 HD3 LYS A 76 9.036 15.618 15.589 1.00 0.00 H new ATOM 0 HE2 LYS A 76 9.718 17.112 17.388 1.00 0.00 H new ATOM 0 HE3 LYS A 76 8.211 17.685 16.700 1.00 0.00 H new ATOM 0 HZ1 LYS A 76 8.185 17.736 19.120 1.00 0.00 H new ATOM 0 HZ2 LYS A 76 7.003 16.670 18.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 76 8.445 16.059 19.184 1.00 0.00 H new ATOM 1262 N ASP A 77 4.088 16.799 14.175 1.00 0.00 N ATOM 1263 CA ASP A 77 3.778 18.155 13.737 1.00 0.00 C ATOM 1264 C ASP A 77 4.800 19.150 14.280 1.00 0.00 C ATOM 1265 O ASP A 77 5.458 18.891 15.287 1.00 0.00 O ATOM 1266 CB ASP A 77 2.373 18.552 14.193 1.00 0.00 C ATOM 1267 CG ASP A 77 1.319 18.256 13.144 1.00 0.00 C ATOM 1268 OD1 ASP A 77 0.218 18.840 13.226 1.00 0.00 O ATOM 1269 OD2 ASP A 77 1.594 17.440 12.239 1.00 0.00 O ATOM 0 H ASP A 77 3.369 16.368 14.756 1.00 0.00 H new ATOM 0 HA ASP A 77 3.819 18.176 12.648 1.00 0.00 H new ATOM 0 HB2 ASP A 77 2.128 18.018 15.111 1.00 0.00 H new ATOM 0 HB3 ASP A 77 2.358 19.616 14.429 1.00 0.00 H new ATOM 1275 N SER A 78 4.927 20.288 13.605 1.00 0.00 N ATOM 1276 CA SER A 78 5.870 21.321 14.018 1.00 0.00 C ATOM 1277 C SER A 78 5.408 21.995 15.307 1.00 0.00 C ATOM 1278 O SER A 78 6.225 22.455 16.104 1.00 0.00 O ATOM 1279 CB SER A 78 6.031 22.366 12.912 1.00 0.00 C ATOM 1280 OG SER A 78 7.087 23.263 13.207 1.00 0.00 O ATOM 0 H SER A 78 4.389 20.518 12.770 1.00 0.00 H new ATOM 0 HA SER A 78 6.834 20.846 14.202 1.00 0.00 H new ATOM 0 HB2 SER A 78 6.228 21.868 11.963 1.00 0.00 H new ATOM 0 HB3 SER A 78 5.100 22.921 12.794 1.00 0.00 H new ATOM 0 HG SER A 78 7.170 23.920 12.484 1.00 0.00 H new ATOM 1286 N TRP A 79 4.094 22.050 15.504 1.00 0.00 N ATOM 1287 CA TRP A 79 3.525 22.668 16.696 1.00 0.00 C ATOM 1288 C TRP A 79 4.024 21.973 17.960 1.00 0.00 C ATOM 1289 O TRP A 79 4.762 22.559 18.752 1.00 0.00 O ATOM 1290 CB TRP A 79 1.997 22.621 16.639 1.00 0.00 C ATOM 1291 CG TRP A 79 1.357 23.969 16.761 1.00 0.00 C ATOM 1292 CD1 TRP A 79 1.422 24.994 15.860 1.00 0.00 C ATOM 1293 CD2 TRP A 79 0.554 24.442 17.849 1.00 0.00 C ATOM 1294 NE1 TRP A 79 0.710 26.074 16.321 1.00 0.00 N ATOM 1295 CE2 TRP A 79 0.168 25.761 17.540 1.00 0.00 C ATOM 1296 CE3 TRP A 79 0.125 23.881 19.055 1.00 0.00 C ATOM 1297 CZ2 TRP A 79 -0.627 26.523 18.392 1.00 0.00 C ATOM 1298 CZ3 TRP A 79 -0.664 24.638 19.900 1.00 0.00 C ATOM 1299 CH2 TRP A 79 -1.034 25.947 19.565 1.00 0.00 C ATOM 0 H TRP A 79 3.404 21.674 14.854 1.00 0.00 H new ATOM 0 HA TRP A 79 3.847 23.709 16.726 1.00 0.00 H new ATOM 0 HB2 TRP A 79 1.690 22.165 15.698 1.00 0.00 H new ATOM 0 HB3 TRP A 79 1.630 21.979 17.440 1.00 0.00 H new ATOM 0 HD1 TRP A 79 1.956 24.960 14.922 1.00 0.00 H new ATOM 0 HE1 TRP A 79 0.602 26.964 15.835 1.00 0.00 H new ATOM 0 HE3 TRP A 79 0.405 22.873 19.322 1.00 0.00 H new ATOM 0 HZ2 TRP A 79 -0.912 27.533 18.136 1.00 0.00 H new ATOM 0 HZ3 TRP A 79 -1.001 24.213 20.834 1.00 0.00 H new ATOM 0 HH2 TRP A 79 -1.653 26.513 20.246 1.00 0.00 H new ATOM 1310 N ASN A 80 3.617 20.721 18.141 1.00 0.00 N ATOM 1311 CA ASN A 80 4.023 19.948 19.309 1.00 0.00 C ATOM 1312 C ASN A 80 3.484 18.523 19.233 1.00 0.00 C ATOM 1313 O ASN A 80 4.246 17.566 19.100 1.00 0.00 O ATOM 1314 CB ASN A 80 3.531 20.623 20.591 1.00 0.00 C ATOM 1315 CG ASN A 80 4.454 20.372 21.768 1.00 0.00 C ATOM 1316 OD1 ASN A 80 5.616 20.776 21.757 1.00 0.00 O ATOM 1317 ND2 ASN A 80 3.937 19.701 22.791 1.00 0.00 N ATOM 0 H ASN A 80 3.007 20.220 17.495 1.00 0.00 H new ATOM 0 HA ASN A 80 5.112 19.906 19.324 1.00 0.00 H new ATOM 0 HB2 ASN A 80 3.445 21.697 20.423 1.00 0.00 H new ATOM 0 HB3 ASN A 80 2.533 20.257 20.831 1.00 0.00 H new ATOM 0 HD21 ASN A 80 4.509 19.501 23.611 1.00 0.00 H new ATOM 0 HD22 ASN A 80 2.968 19.385 22.756 1.00 0.00 H new ATOM 1324 N LYS A 81 2.163 18.390 19.319 1.00 0.00 N ATOM 1325 CA LYS A 81 1.522 17.082 19.261 1.00 0.00 C ATOM 1326 C LYS A 81 1.820 16.387 17.936 1.00 0.00 C ATOM 1327 O LYS A 81 2.476 16.952 17.060 1.00 0.00 O ATOM 1328 CB LYS A 81 0.010 17.225 19.445 1.00 0.00 C ATOM 1329 CG LYS A 81 -0.398 17.595 20.862 1.00 0.00 C ATOM 1330 CD LYS A 81 -1.909 17.645 21.012 1.00 0.00 C ATOM 1331 CE LYS A 81 -2.513 16.249 21.023 1.00 0.00 C ATOM 1332 NZ LYS A 81 -2.332 15.575 22.339 1.00 0.00 N ATOM 0 H LYS A 81 1.517 19.172 19.429 1.00 0.00 H new ATOM 0 HA LYS A 81 1.925 16.472 20.069 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -0.361 17.986 18.759 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -0.471 16.286 19.170 1.00 0.00 H new ATOM 0 HG2 LYS A 81 0.014 16.868 21.562 1.00 0.00 H new ATOM 0 HG3 LYS A 81 0.027 18.564 21.122 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -2.167 18.162 21.936 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -2.338 18.222 20.193 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -3.576 16.312 20.791 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -2.051 15.647 20.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -2.772 14.633 22.310 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -1.317 15.477 22.542 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -2.781 16.144 23.085 1.00 0.00 H new ATOM 1346 N TRP A 82 1.333 15.158 17.796 1.00 0.00 N ATOM 1347 CA TRP A 82 1.547 14.384 16.578 1.00 0.00 C ATOM 1348 C TRP A 82 0.232 14.172 15.834 1.00 0.00 C ATOM 1349 O TRP A 82 -0.829 14.064 16.447 1.00 0.00 O ATOM 1350 CB TRP A 82 2.182 13.033 16.912 1.00 0.00 C ATOM 1351 CG TRP A 82 3.395 13.144 17.783 1.00 0.00 C ATOM 1352 CD1 TRP A 82 3.471 13.739 19.011 1.00 0.00 C ATOM 1353 CD2 TRP A 82 4.707 12.648 17.496 1.00 0.00 C ATOM 1354 NE1 TRP A 82 4.750 13.643 19.503 1.00 0.00 N ATOM 1355 CE2 TRP A 82 5.527 12.977 18.591 1.00 0.00 C ATOM 1356 CE3 TRP A 82 5.267 11.956 16.418 1.00 0.00 C ATOM 1357 CZ2 TRP A 82 6.878 12.638 18.639 1.00 0.00 C ATOM 1358 CZ3 TRP A 82 6.608 11.621 16.467 1.00 0.00 C ATOM 1359 CH2 TRP A 82 7.399 11.961 17.571 1.00 0.00 C ATOM 0 H TRP A 82 0.787 14.677 18.511 1.00 0.00 H new ATOM 0 HA TRP A 82 2.224 14.945 15.933 1.00 0.00 H new ATOM 0 HB2 TRP A 82 1.443 12.406 17.410 1.00 0.00 H new ATOM 0 HB3 TRP A 82 2.455 12.529 15.985 1.00 0.00 H new ATOM 0 HD1 TRP A 82 2.646 14.215 19.520 1.00 0.00 H new ATOM 0 HE1 TRP A 82 5.069 14.008 20.400 1.00 0.00 H new ATOM 0 HE3 TRP A 82 4.664 11.688 15.563 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 7.491 12.900 19.489 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 7.053 11.088 15.640 1.00 0.00 H new ATOM 0 HH2 TRP A 82 8.443 11.683 17.579 1.00 0.00 H new ATOM 1370 N GLU A 83 0.310 14.113 14.508 1.00 0.00 N ATOM 1371 CA GLU A 83 -0.875 13.913 13.682 1.00 0.00 C ATOM 1372 C GLU A 83 -1.152 12.423 13.477 1.00 0.00 C ATOM 1373 O GLU A 83 -0.283 11.683 13.017 1.00 0.00 O ATOM 1374 CB GLU A 83 -0.700 14.601 12.327 1.00 0.00 C ATOM 1375 CG GLU A 83 -1.303 15.996 12.271 1.00 0.00 C ATOM 1376 CD GLU A 83 -1.936 16.302 10.928 1.00 0.00 C ATOM 1377 OE1 GLU A 83 -2.419 15.357 10.269 1.00 0.00 O ATOM 1378 OE2 GLU A 83 -1.951 17.487 10.534 1.00 0.00 O ATOM 0 H GLU A 83 1.180 14.201 13.983 1.00 0.00 H new ATOM 0 HA GLU A 83 -1.726 14.355 14.200 1.00 0.00 H new ATOM 0 HB2 GLU A 83 0.363 14.664 12.095 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.159 13.985 11.554 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -2.055 16.095 13.054 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -0.527 16.732 12.479 1.00 0.00 H new ATOM 1386 N PRO A 84 -2.369 11.959 13.818 1.00 0.00 N ATOM 1387 CA PRO A 84 -2.746 10.553 13.667 1.00 0.00 C ATOM 1388 C PRO A 84 -3.130 10.205 12.233 1.00 0.00 C ATOM 1389 O PRO A 84 -3.632 11.050 11.491 1.00 0.00 O ATOM 1390 CB PRO A 84 -3.956 10.425 14.589 1.00 0.00 C ATOM 1391 CG PRO A 84 -4.592 11.771 14.558 1.00 0.00 C ATOM 1392 CD PRO A 84 -3.472 12.766 14.378 1.00 0.00 C ATOM 0 HA PRO A 84 -1.926 9.877 13.910 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -4.642 9.654 14.239 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -3.657 10.150 15.601 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -5.310 11.843 13.741 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -5.139 11.964 15.481 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -3.759 13.573 13.704 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -3.190 13.226 15.325 1.00 0.00 H new ATOM 1400 N ILE A 85 -2.894 8.954 11.849 1.00 0.00 N ATOM 1401 CA ILE A 85 -3.217 8.493 10.505 1.00 0.00 C ATOM 1402 C ILE A 85 -3.752 7.065 10.532 1.00 0.00 C ATOM 1403 O ILE A 85 -3.046 6.135 10.923 1.00 0.00 O ATOM 1404 CB ILE A 85 -1.989 8.552 9.578 1.00 0.00 C ATOM 1405 CG1 ILE A 85 -1.303 9.915 9.690 1.00 0.00 C ATOM 1406 CG2 ILE A 85 -2.396 8.273 8.140 1.00 0.00 C ATOM 1407 CD1 ILE A 85 -0.085 10.055 8.801 1.00 0.00 C ATOM 0 H ILE A 85 -2.480 8.242 12.451 1.00 0.00 H new ATOM 0 HA ILE A 85 -3.985 9.161 10.116 1.00 0.00 H new ATOM 0 HB ILE A 85 -1.281 7.784 9.889 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -2.020 10.695 9.435 1.00 0.00 H new ATOM 0 HG13 ILE A 85 -1.007 10.080 10.726 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -1.517 8.318 7.498 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -2.843 7.281 8.074 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -3.121 9.019 7.816 1.00 0.00 H new ATOM 0 HD11 ILE A 85 0.350 11.046 8.933 1.00 0.00 H new ATOM 0 HD12 ILE A 85 0.651 9.297 9.070 1.00 0.00 H new ATOM 0 HD13 ILE A 85 -0.378 9.923 7.759 1.00 0.00 H new ATOM 1419 N ALA A 86 -5.003 6.898 10.114 1.00 0.00 N ATOM 1420 CA ALA A 86 -5.632 5.583 10.093 1.00 0.00 C ATOM 1421 C ALA A 86 -6.169 5.253 8.705 1.00 0.00 C ATOM 1422 O ALA A 86 -6.419 6.146 7.895 1.00 0.00 O ATOM 1423 CB ALA A 86 -6.750 5.516 11.122 1.00 0.00 C ATOM 0 H ALA A 86 -5.600 7.657 9.786 1.00 0.00 H new ATOM 0 HA ALA A 86 -4.874 4.842 10.347 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -7.211 4.528 11.095 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -6.341 5.699 12.116 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -7.501 6.273 10.894 1.00 0.00 H new ATOM 1429 N GLY A 87 -6.343 3.963 8.436 1.00 0.00 N ATOM 1430 CA GLY A 87 -6.850 3.535 7.145 1.00 0.00 C ATOM 1431 C GLY A 87 -6.928 2.026 7.023 1.00 0.00 C ATOM 1432 O GLY A 87 -6.301 1.301 7.795 1.00 0.00 O ATOM 0 H GLY A 87 -6.142 3.206 9.089 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -7.841 3.961 6.988 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -6.207 3.927 6.357 1.00 0.00 H new ATOM 1436 N TYR A 88 -7.702 1.552 6.053 1.00 0.00 N ATOM 1437 CA TYR A 88 -7.860 0.119 5.832 1.00 0.00 C ATOM 1438 C TYR A 88 -7.957 -0.195 4.343 1.00 0.00 C ATOM 1439 O TYR A 88 -8.689 0.466 3.606 1.00 0.00 O ATOM 1440 CB TYR A 88 -9.106 -0.395 6.556 1.00 0.00 C ATOM 1441 CG TYR A 88 -10.378 0.318 6.155 1.00 0.00 C ATOM 1442 CD1 TYR A 88 -11.118 -0.106 5.058 1.00 0.00 C ATOM 1443 CD2 TYR A 88 -10.837 1.416 6.871 1.00 0.00 C ATOM 1444 CE1 TYR A 88 -12.280 0.544 4.687 1.00 0.00 C ATOM 1445 CE2 TYR A 88 -11.999 2.071 6.508 1.00 0.00 C ATOM 1446 CZ TYR A 88 -12.716 1.630 5.415 1.00 0.00 C ATOM 1447 OH TYR A 88 -13.873 2.280 5.050 1.00 0.00 O ATOM 0 H TYR A 88 -8.230 2.139 5.407 1.00 0.00 H new ATOM 0 HA TYR A 88 -6.981 -0.384 6.234 1.00 0.00 H new ATOM 0 HB2 TYR A 88 -9.218 -1.461 6.356 1.00 0.00 H new ATOM 0 HB3 TYR A 88 -8.962 -0.286 7.631 1.00 0.00 H new ATOM 0 HD1 TYR A 88 -10.780 -0.957 4.486 1.00 0.00 H new ATOM 0 HD2 TYR A 88 -10.276 1.764 7.726 1.00 0.00 H new ATOM 0 HE1 TYR A 88 -12.843 0.203 3.831 1.00 0.00 H new ATOM 0 HE2 TYR A 88 -12.343 2.922 7.076 1.00 0.00 H new ATOM 0 HH TYR A 88 -14.040 3.023 5.667 1.00 0.00 H new ATOM 1457 N GLY A 89 -7.216 -1.207 3.907 1.00 0.00 N ATOM 1458 CA GLY A 89 -7.233 -1.589 2.508 1.00 0.00 C ATOM 1459 C GLY A 89 -7.281 -3.091 2.314 1.00 0.00 C ATOM 1460 O GLY A 89 -7.108 -3.854 3.266 1.00 0.00 O ATOM 0 H GLY A 89 -6.604 -1.770 4.498 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -8.097 -1.136 2.022 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -6.346 -1.191 2.016 1.00 0.00 H new ATOM 1464 N TRP A 90 -7.518 -3.518 1.078 1.00 0.00 N ATOM 1465 CA TRP A 90 -7.589 -4.940 0.760 1.00 0.00 C ATOM 1466 C TRP A 90 -6.743 -5.265 -0.466 1.00 0.00 C ATOM 1467 O TRP A 90 -6.581 -4.434 -1.360 1.00 0.00 O ATOM 1468 CB TRP A 90 -9.042 -5.357 0.516 1.00 0.00 C ATOM 1469 CG TRP A 90 -9.673 -4.657 -0.649 1.00 0.00 C ATOM 1470 CD1 TRP A 90 -9.676 -5.070 -1.950 1.00 0.00 C ATOM 1471 CD2 TRP A 90 -10.391 -3.418 -0.618 1.00 0.00 C ATOM 1472 NE1 TRP A 90 -10.354 -4.164 -2.730 1.00 0.00 N ATOM 1473 CE2 TRP A 90 -10.802 -3.141 -1.936 1.00 0.00 C ATOM 1474 CE3 TRP A 90 -10.727 -2.516 0.396 1.00 0.00 C ATOM 1475 CZ2 TRP A 90 -11.532 -2.001 -2.264 1.00 0.00 C ATOM 1476 CZ3 TRP A 90 -11.451 -1.385 0.068 1.00 0.00 C ATOM 1477 CH2 TRP A 90 -11.846 -1.137 -1.252 1.00 0.00 C ATOM 0 H TRP A 90 -7.664 -2.900 0.280 1.00 0.00 H new ATOM 0 HA TRP A 90 -7.195 -5.498 1.610 1.00 0.00 H new ATOM 0 HB2 TRP A 90 -9.080 -6.433 0.348 1.00 0.00 H new ATOM 0 HB3 TRP A 90 -9.627 -5.153 1.413 1.00 0.00 H new ATOM 0 HD1 TRP A 90 -9.213 -5.976 -2.313 1.00 0.00 H new ATOM 0 HE1 TRP A 90 -10.500 -4.241 -3.737 1.00 0.00 H new ATOM 0 HE3 TRP A 90 -10.426 -2.700 1.417 1.00 0.00 H new ATOM 0 HZ2 TRP A 90 -11.839 -1.807 -3.281 1.00 0.00 H new ATOM 0 HZ3 TRP A 90 -11.716 -0.681 0.843 1.00 0.00 H new ATOM 0 HH2 TRP A 90 -12.411 -0.244 -1.476 1.00 0.00 H new ATOM 1488 N GLU A 91 -6.203 -6.479 -0.502 1.00 0.00 N ATOM 1489 CA GLU A 91 -5.372 -6.913 -1.619 1.00 0.00 C ATOM 1490 C GLU A 91 -5.591 -8.393 -1.918 1.00 0.00 C ATOM 1491 O GLU A 91 -5.956 -9.168 -1.034 1.00 0.00 O ATOM 1492 CB GLU A 91 -3.896 -6.655 -1.313 1.00 0.00 C ATOM 1493 CG GLU A 91 -3.410 -5.290 -1.772 1.00 0.00 C ATOM 1494 CD GLU A 91 -2.050 -4.934 -1.204 1.00 0.00 C ATOM 1495 OE1 GLU A 91 -1.116 -4.703 -1.999 1.00 0.00 O ATOM 1496 OE2 GLU A 91 -1.919 -4.886 0.037 1.00 0.00 O ATOM 0 H GLU A 91 -6.326 -7.179 0.229 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.660 -6.337 -2.499 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -3.735 -6.747 -0.239 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -3.294 -7.426 -1.793 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -3.361 -5.273 -2.861 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.134 -4.532 -1.474 1.00 0.00 H new ATOM 1504 N SER A 92 -5.364 -8.777 -3.170 1.00 0.00 N ATOM 1505 CA SER A 92 -5.536 -10.164 -3.587 1.00 0.00 C ATOM 1506 C SER A 92 -4.187 -10.857 -3.737 1.00 0.00 C ATOM 1507 O SER A 92 -3.268 -10.322 -4.359 1.00 0.00 O ATOM 1508 CB SER A 92 -6.307 -10.230 -4.907 1.00 0.00 C ATOM 1509 OG SER A 92 -7.659 -9.847 -4.728 1.00 0.00 O ATOM 0 H SER A 92 -5.061 -8.148 -3.913 1.00 0.00 H new ATOM 0 HA SER A 92 -6.106 -10.682 -2.816 1.00 0.00 H new ATOM 0 HB2 SER A 92 -5.835 -9.576 -5.641 1.00 0.00 H new ATOM 0 HB3 SER A 92 -6.263 -11.243 -5.307 1.00 0.00 H new ATOM 0 HG SER A 92 -8.129 -9.896 -5.586 1.00 0.00 H new ATOM 1515 N THR A 93 -4.074 -12.051 -3.164 1.00 0.00 N ATOM 1516 CA THR A 93 -2.836 -12.819 -3.234 1.00 0.00 C ATOM 1517 C THR A 93 -2.697 -13.504 -4.590 1.00 0.00 C ATOM 1518 O THR A 93 -3.647 -14.100 -5.096 1.00 0.00 O ATOM 1519 CB THR A 93 -2.794 -13.861 -2.116 1.00 0.00 C ATOM 1520 OG1 THR A 93 -4.102 -14.295 -1.787 1.00 0.00 O ATOM 1521 CG2 THR A 93 -2.145 -13.352 -0.847 1.00 0.00 C ATOM 0 H THR A 93 -4.825 -12.508 -2.646 1.00 0.00 H new ATOM 0 HA THR A 93 -2.002 -12.129 -3.109 1.00 0.00 H new ATOM 0 HB THR A 93 -2.192 -14.681 -2.507 1.00 0.00 H new ATOM 0 HG1 THR A 93 -4.055 -14.963 -1.071 1.00 0.00 H new ATOM 0 HG21 THR A 93 -2.148 -14.141 -0.095 1.00 0.00 H new ATOM 0 HG22 THR A 93 -1.117 -13.055 -1.058 1.00 0.00 H new ATOM 0 HG23 THR A 93 -2.701 -12.492 -0.473 1.00 0.00 H new ATOM 1529 N TRP A 94 -1.505 -13.413 -5.172 1.00 0.00 N ATOM 1530 CA TRP A 94 -1.240 -14.024 -6.469 1.00 0.00 C ATOM 1531 C TRP A 94 0.233 -14.392 -6.606 1.00 0.00 C ATOM 1532 O TRP A 94 1.113 -13.634 -6.198 1.00 0.00 O ATOM 1533 CB TRP A 94 -1.648 -13.073 -7.597 1.00 0.00 C ATOM 1534 CG TRP A 94 -2.283 -13.771 -8.761 1.00 0.00 C ATOM 1535 CD1 TRP A 94 -1.715 -14.726 -9.554 1.00 0.00 C ATOM 1536 CD2 TRP A 94 -3.607 -13.564 -9.266 1.00 0.00 C ATOM 1537 NE1 TRP A 94 -2.605 -15.128 -10.520 1.00 0.00 N ATOM 1538 CE2 TRP A 94 -3.774 -14.429 -10.365 1.00 0.00 C ATOM 1539 CE3 TRP A 94 -4.668 -12.733 -8.896 1.00 0.00 C ATOM 1540 CZ2 TRP A 94 -4.959 -14.485 -11.095 1.00 0.00 C ATOM 1541 CZ3 TRP A 94 -5.843 -12.791 -9.621 1.00 0.00 C ATOM 1542 CH2 TRP A 94 -5.980 -13.662 -10.710 1.00 0.00 C ATOM 0 H TRP A 94 -0.708 -12.922 -4.766 1.00 0.00 H new ATOM 0 HA TRP A 94 -1.832 -14.937 -6.541 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -2.343 -12.331 -7.204 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -0.767 -12.532 -7.943 1.00 0.00 H new ATOM 0 HD1 TRP A 94 -0.712 -15.110 -9.439 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -2.425 -15.832 -11.236 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -4.571 -12.058 -8.059 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -5.067 -15.155 -11.935 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -6.670 -12.154 -9.343 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -6.911 -13.683 -11.256 1.00 0.00 H new ATOM 1553 N ARG A 95 0.496 -15.560 -7.184 1.00 0.00 N ATOM 1554 CA ARG A 95 1.865 -16.027 -7.374 1.00 0.00 C ATOM 1555 C ARG A 95 2.161 -16.254 -8.856 1.00 0.00 C ATOM 1556 O ARG A 95 1.757 -17.266 -9.428 1.00 0.00 O ATOM 1557 CB ARG A 95 2.094 -17.324 -6.595 1.00 0.00 C ATOM 1558 CG ARG A 95 1.583 -17.274 -5.165 1.00 0.00 C ATOM 1559 CD ARG A 95 1.261 -18.664 -4.640 1.00 0.00 C ATOM 1560 NE ARG A 95 -0.143 -19.013 -4.839 1.00 0.00 N ATOM 1561 CZ ARG A 95 -1.153 -18.409 -4.214 1.00 0.00 C ATOM 1562 NH1 ARG A 95 -0.917 -17.428 -3.352 1.00 0.00 N ATOM 1563 NH2 ARG A 95 -2.401 -18.788 -4.452 1.00 0.00 N ATOM 0 H ARG A 95 -0.220 -16.200 -7.529 1.00 0.00 H new ATOM 0 HA ARG A 95 2.541 -15.259 -6.999 1.00 0.00 H new ATOM 0 HB2 ARG A 95 1.603 -18.144 -7.119 1.00 0.00 H new ATOM 0 HB3 ARG A 95 3.161 -17.547 -6.583 1.00 0.00 H new ATOM 0 HG2 ARG A 95 2.332 -16.807 -4.526 1.00 0.00 H new ATOM 0 HG3 ARG A 95 0.690 -16.650 -5.118 1.00 0.00 H new ATOM 0 HD2 ARG A 95 1.891 -19.397 -5.144 1.00 0.00 H new ATOM 0 HD3 ARG A 95 1.500 -18.715 -3.578 1.00 0.00 H new ATOM 0 HE ARG A 95 -0.363 -19.763 -5.495 1.00 0.00 H new ATOM 0 HH11 ARG A 95 0.041 -17.133 -3.165 1.00 0.00 H new ATOM 0 HH12 ARG A 95 -1.694 -16.969 -2.876 1.00 0.00 H new ATOM 0 HH21 ARG A 95 -2.588 -19.542 -5.113 1.00 0.00 H new ATOM 0 HH22 ARG A 95 -3.174 -18.326 -3.974 1.00 0.00 H new ATOM 1577 N PRO A 96 2.874 -15.312 -9.501 1.00 0.00 N ATOM 1578 CA PRO A 96 3.219 -15.421 -10.922 1.00 0.00 C ATOM 1579 C PRO A 96 3.976 -16.707 -11.237 1.00 0.00 C ATOM 1580 O PRO A 96 3.676 -17.393 -12.214 1.00 0.00 O ATOM 1581 CB PRO A 96 4.112 -14.202 -11.174 1.00 0.00 C ATOM 1582 CG PRO A 96 3.756 -13.237 -10.096 1.00 0.00 C ATOM 1583 CD PRO A 96 3.398 -14.071 -8.900 1.00 0.00 C ATOM 0 HA PRO A 96 2.330 -15.449 -11.552 1.00 0.00 H new ATOM 0 HB2 PRO A 96 5.168 -14.470 -11.132 1.00 0.00 H new ATOM 0 HB3 PRO A 96 3.931 -13.777 -12.161 1.00 0.00 H new ATOM 0 HG2 PRO A 96 4.592 -12.574 -9.874 1.00 0.00 H new ATOM 0 HG3 PRO A 96 2.920 -12.606 -10.397 1.00 0.00 H new ATOM 0 HD2 PRO A 96 4.266 -14.264 -8.269 1.00 0.00 H new ATOM 0 HD3 PRO A 96 2.652 -13.580 -8.275 1.00 0.00 H new ATOM 1591 N LEU A 97 4.959 -17.028 -10.401 1.00 0.00 N ATOM 1592 CA LEU A 97 5.760 -18.232 -10.590 1.00 0.00 C ATOM 1593 C LEU A 97 5.961 -18.963 -9.267 1.00 0.00 C ATOM 1594 O LEU A 97 5.467 -18.533 -8.225 1.00 0.00 O ATOM 1595 CB LEU A 97 7.116 -17.876 -11.203 1.00 0.00 C ATOM 1596 CG LEU A 97 7.187 -17.995 -12.727 1.00 0.00 C ATOM 1597 CD1 LEU A 97 8.032 -16.873 -13.311 1.00 0.00 C ATOM 1598 CD2 LEU A 97 7.747 -19.351 -13.129 1.00 0.00 C ATOM 0 H LEU A 97 5.220 -16.471 -9.587 1.00 0.00 H new ATOM 0 HA LEU A 97 5.225 -18.893 -11.271 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.368 -16.854 -10.921 1.00 0.00 H new ATOM 0 HB3 LEU A 97 7.876 -18.524 -10.767 1.00 0.00 H new ATOM 0 HG LEU A 97 6.177 -17.907 -13.127 1.00 0.00 H new ATOM 0 HD11 LEU A 97 8.071 -16.974 -14.396 1.00 0.00 H new ATOM 0 HD12 LEU A 97 7.589 -15.911 -13.052 1.00 0.00 H new ATOM 0 HD13 LEU A 97 9.042 -16.929 -12.905 1.00 0.00 H new ATOM 0 HD21 LEU A 97 7.791 -19.419 -14.216 1.00 0.00 H new ATOM 0 HD22 LEU A 97 8.750 -19.467 -12.718 1.00 0.00 H new ATOM 0 HD23 LEU A 97 7.102 -20.140 -12.742 1.00 0.00 H new ATOM 1610 N ALA A 98 6.693 -20.072 -9.315 1.00 0.00 N ATOM 1611 CA ALA A 98 6.962 -20.864 -8.121 1.00 0.00 C ATOM 1612 C ALA A 98 8.406 -21.351 -8.100 1.00 0.00 C ATOM 1613 O ALA A 98 8.682 -22.496 -7.742 1.00 0.00 O ATOM 1614 CB ALA A 98 6.003 -22.044 -8.045 1.00 0.00 C ATOM 0 H ALA A 98 7.110 -20.442 -10.169 1.00 0.00 H new ATOM 0 HA ALA A 98 6.808 -20.228 -7.249 1.00 0.00 H new ATOM 0 HB1 ALA A 98 6.214 -22.627 -7.149 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.977 -21.677 -8.006 1.00 0.00 H new ATOM 0 HB3 ALA A 98 6.130 -22.673 -8.926 1.00 0.00 H new ATOM 1620 N ASP A 99 9.326 -20.472 -8.486 1.00 0.00 N ATOM 1621 CA ASP A 99 10.744 -20.812 -8.512 1.00 0.00 C ATOM 1622 C ASP A 99 11.494 -20.111 -7.383 1.00 0.00 C ATOM 1623 O ASP A 99 12.227 -20.744 -6.624 1.00 0.00 O ATOM 1624 CB ASP A 99 11.357 -20.431 -9.861 1.00 0.00 C ATOM 1625 CG ASP A 99 12.394 -21.434 -10.329 1.00 0.00 C ATOM 1626 OD1 ASP A 99 13.005 -22.102 -9.468 1.00 0.00 O ATOM 1627 OD2 ASP A 99 12.593 -21.552 -11.556 1.00 0.00 O ATOM 0 H ASP A 99 9.115 -19.520 -8.785 1.00 0.00 H new ATOM 0 HA ASP A 99 10.836 -21.889 -8.370 1.00 0.00 H new ATOM 0 HB2 ASP A 99 10.567 -20.355 -10.608 1.00 0.00 H new ATOM 0 HB3 ASP A 99 11.818 -19.446 -9.783 1.00 0.00 H new ATOM 1633 N GLU A 100 11.305 -18.800 -7.280 1.00 0.00 N ATOM 1634 CA GLU A 100 11.965 -18.012 -6.244 1.00 0.00 C ATOM 1635 C GLU A 100 10.954 -17.490 -5.227 1.00 0.00 C ATOM 1636 O GLU A 100 11.168 -16.449 -4.604 1.00 0.00 O ATOM 1637 CB GLU A 100 12.725 -16.842 -6.871 1.00 0.00 C ATOM 1638 CG GLU A 100 14.036 -16.524 -6.173 1.00 0.00 C ATOM 1639 CD GLU A 100 15.121 -16.089 -7.138 1.00 0.00 C ATOM 1640 OE1 GLU A 100 14.911 -15.086 -7.853 1.00 0.00 O ATOM 1641 OE2 GLU A 100 16.179 -16.751 -7.181 1.00 0.00 O ATOM 0 H GLU A 100 10.701 -18.261 -7.900 1.00 0.00 H new ATOM 0 HA GLU A 100 12.671 -18.660 -5.726 1.00 0.00 H new ATOM 0 HB2 GLU A 100 12.926 -17.070 -7.918 1.00 0.00 H new ATOM 0 HB3 GLU A 100 12.090 -15.956 -6.854 1.00 0.00 H new ATOM 0 HG2 GLU A 100 13.870 -15.735 -5.439 1.00 0.00 H new ATOM 0 HG3 GLU A 100 14.374 -17.403 -5.625 1.00 0.00 H new ATOM 1649 N ASN A 101 9.855 -18.219 -5.061 1.00 0.00 N ATOM 1650 CA ASN A 101 8.812 -17.829 -4.117 1.00 0.00 C ATOM 1651 C ASN A 101 8.297 -16.424 -4.421 1.00 0.00 C ATOM 1652 O ASN A 101 7.890 -15.694 -3.517 1.00 0.00 O ATOM 1653 CB ASN A 101 9.343 -17.891 -2.684 1.00 0.00 C ATOM 1654 CG ASN A 101 9.126 -19.248 -2.045 1.00 0.00 C ATOM 1655 OD1 ASN A 101 7.991 -19.703 -1.896 1.00 0.00 O ATOM 1656 ND2 ASN A 101 10.215 -19.904 -1.661 1.00 0.00 N ATOM 0 H ASN A 101 9.663 -19.083 -5.568 1.00 0.00 H new ATOM 0 HA ASN A 101 7.983 -18.530 -4.221 1.00 0.00 H new ATOM 0 HB2 ASN A 101 10.408 -17.659 -2.684 1.00 0.00 H new ATOM 0 HB3 ASN A 101 8.850 -17.127 -2.083 1.00 0.00 H new ATOM 0 HD21 ASN A 101 10.130 -20.822 -1.224 1.00 0.00 H new ATOM 0 HD22 ASN A 101 11.136 -19.490 -1.803 1.00 0.00 H new ATOM 1663 N PHE A 102 8.318 -16.054 -5.696 1.00 0.00 N ATOM 1664 CA PHE A 102 7.853 -14.737 -6.118 1.00 0.00 C ATOM 1665 C PHE A 102 6.394 -14.524 -5.730 1.00 0.00 C ATOM 1666 O PHE A 102 5.526 -15.331 -6.069 1.00 0.00 O ATOM 1667 CB PHE A 102 8.022 -14.575 -7.631 1.00 0.00 C ATOM 1668 CG PHE A 102 9.265 -13.825 -8.019 1.00 0.00 C ATOM 1669 CD1 PHE A 102 9.311 -12.443 -7.935 1.00 0.00 C ATOM 1670 CD2 PHE A 102 10.388 -14.503 -8.465 1.00 0.00 C ATOM 1671 CE1 PHE A 102 10.452 -11.751 -8.290 1.00 0.00 C ATOM 1672 CE2 PHE A 102 11.533 -13.816 -8.823 1.00 0.00 C ATOM 1673 CZ PHE A 102 11.565 -12.438 -8.735 1.00 0.00 C ATOM 0 H PHE A 102 8.652 -16.647 -6.456 1.00 0.00 H new ATOM 0 HA PHE A 102 8.457 -13.985 -5.610 1.00 0.00 H new ATOM 0 HB2 PHE A 102 8.043 -15.562 -8.094 1.00 0.00 H new ATOM 0 HB3 PHE A 102 7.153 -14.054 -8.032 1.00 0.00 H new ATOM 0 HD1 PHE A 102 8.444 -11.900 -7.588 1.00 0.00 H new ATOM 0 HD2 PHE A 102 10.369 -15.581 -8.534 1.00 0.00 H new ATOM 0 HE1 PHE A 102 10.474 -10.674 -8.220 1.00 0.00 H new ATOM 0 HE2 PHE A 102 12.401 -14.356 -9.171 1.00 0.00 H new ATOM 0 HZ PHE A 102 12.458 -11.899 -9.013 1.00 0.00 H new ATOM 1683 N HIS A 103 6.129 -13.435 -5.017 1.00 0.00 N ATOM 1684 CA HIS A 103 4.774 -13.115 -4.582 1.00 0.00 C ATOM 1685 C HIS A 103 4.284 -11.824 -5.229 1.00 0.00 C ATOM 1686 O HIS A 103 5.081 -10.954 -5.583 1.00 0.00 O ATOM 1687 CB HIS A 103 4.723 -12.986 -3.058 1.00 0.00 C ATOM 1688 CG HIS A 103 4.592 -14.300 -2.351 1.00 0.00 C ATOM 1689 ND1 HIS A 103 3.783 -15.321 -2.804 1.00 0.00 N ATOM 1690 CD2 HIS A 103 5.173 -14.758 -1.217 1.00 0.00 C ATOM 1691 CE1 HIS A 103 3.872 -16.349 -1.978 1.00 0.00 C ATOM 1692 NE2 HIS A 103 4.709 -16.033 -1.008 1.00 0.00 N ATOM 0 H HIS A 103 6.835 -12.758 -4.728 1.00 0.00 H new ATOM 0 HA HIS A 103 4.118 -13.928 -4.894 1.00 0.00 H new ATOM 0 HB2 HIS A 103 5.628 -12.486 -2.713 1.00 0.00 H new ATOM 0 HB3 HIS A 103 3.882 -12.349 -2.783 1.00 0.00 H new ATOM 0 HD2 HIS A 103 5.872 -14.220 -0.593 1.00 0.00 H new ATOM 0 HE1 HIS A 103 3.349 -17.288 -2.080 1.00 0.00 H new ATOM 0 HE2 HIS A 103 4.969 -16.638 -0.229 1.00 0.00 H new ATOM 1701 N LEU A 104 2.970 -11.704 -5.379 1.00 0.00 N ATOM 1702 CA LEU A 104 2.374 -10.518 -5.984 1.00 0.00 C ATOM 1703 C LEU A 104 1.005 -10.227 -5.376 1.00 0.00 C ATOM 1704 O LEU A 104 0.246 -11.143 -5.063 1.00 0.00 O ATOM 1705 CB LEU A 104 2.244 -10.702 -7.497 1.00 0.00 C ATOM 1706 CG LEU A 104 1.675 -9.498 -8.249 1.00 0.00 C ATOM 1707 CD1 LEU A 104 2.252 -9.424 -9.654 1.00 0.00 C ATOM 1708 CD2 LEU A 104 0.156 -9.571 -8.298 1.00 0.00 C ATOM 0 H LEU A 104 2.297 -12.413 -5.090 1.00 0.00 H new ATOM 0 HA LEU A 104 3.029 -9.670 -5.783 1.00 0.00 H new ATOM 0 HB2 LEU A 104 3.228 -10.934 -7.905 1.00 0.00 H new ATOM 0 HB3 LEU A 104 1.607 -11.565 -7.689 1.00 0.00 H new ATOM 0 HG LEU A 104 1.959 -8.592 -7.714 1.00 0.00 H new ATOM 0 HD11 LEU A 104 1.835 -8.561 -10.173 1.00 0.00 H new ATOM 0 HD12 LEU A 104 3.336 -9.325 -9.597 1.00 0.00 H new ATOM 0 HD13 LEU A 104 1.999 -10.333 -10.200 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -0.233 -8.707 -8.837 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -0.148 -10.484 -8.810 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -0.241 -9.574 -7.283 1.00 0.00 H new ATOM 1720 N GLY A 105 0.698 -8.944 -5.213 1.00 0.00 N ATOM 1721 CA GLY A 105 -0.579 -8.554 -4.645 1.00 0.00 C ATOM 1722 C GLY A 105 -1.162 -7.327 -5.318 1.00 0.00 C ATOM 1723 O GLY A 105 -0.449 -6.362 -5.591 1.00 0.00 O ATOM 0 H GLY A 105 1.311 -8.168 -5.464 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -1.282 -9.382 -4.735 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -0.454 -8.356 -3.580 1.00 0.00 H new ATOM 1727 N LEU A 106 -2.464 -7.363 -5.586 1.00 0.00 N ATOM 1728 CA LEU A 106 -3.142 -6.245 -6.232 1.00 0.00 C ATOM 1729 C LEU A 106 -4.448 -5.913 -5.516 1.00 0.00 C ATOM 1730 O LEU A 106 -5.214 -6.807 -5.154 1.00 0.00 O ATOM 1731 CB LEU A 106 -3.420 -6.571 -7.701 1.00 0.00 C ATOM 1732 CG LEU A 106 -3.258 -5.395 -8.666 1.00 0.00 C ATOM 1733 CD1 LEU A 106 -4.142 -4.233 -8.243 1.00 0.00 C ATOM 1734 CD2 LEU A 106 -1.801 -4.963 -8.737 1.00 0.00 C ATOM 0 H LEU A 106 -3.070 -8.154 -5.366 1.00 0.00 H new ATOM 0 HA LEU A 106 -2.488 -5.375 -6.177 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -2.750 -7.372 -8.013 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -4.437 -6.954 -7.786 1.00 0.00 H new ATOM 0 HG LEU A 106 -3.569 -5.717 -9.660 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -4.014 -3.405 -8.941 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -5.185 -4.550 -8.244 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -3.862 -3.909 -7.241 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -1.703 -4.126 -9.428 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -1.463 -4.658 -7.747 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -1.191 -5.796 -9.088 1.00 0.00 H new ATOM 1746 N GLY A 107 -4.696 -4.624 -5.316 1.00 0.00 N ATOM 1747 CA GLY A 107 -5.910 -4.197 -4.645 1.00 0.00 C ATOM 1748 C GLY A 107 -5.935 -2.703 -4.385 1.00 0.00 C ATOM 1749 O GLY A 107 -5.130 -1.956 -4.939 1.00 0.00 O ATOM 0 H GLY A 107 -4.078 -3.866 -5.607 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -6.773 -4.471 -5.252 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -6.004 -4.729 -3.698 1.00 0.00 H new ATOM 1753 N PHE A 108 -6.865 -2.268 -3.540 1.00 0.00 N ATOM 1754 CA PHE A 108 -6.995 -0.854 -3.207 1.00 0.00 C ATOM 1755 C PHE A 108 -6.953 -0.645 -1.697 1.00 0.00 C ATOM 1756 O PHE A 108 -7.200 -1.573 -0.925 1.00 0.00 O ATOM 1757 CB PHE A 108 -8.298 -0.291 -3.776 1.00 0.00 C ATOM 1758 CG PHE A 108 -8.498 -0.598 -5.233 1.00 0.00 C ATOM 1759 CD1 PHE A 108 -8.988 -1.830 -5.634 1.00 0.00 C ATOM 1760 CD2 PHE A 108 -8.196 0.347 -6.200 1.00 0.00 C ATOM 1761 CE1 PHE A 108 -9.174 -2.114 -6.974 1.00 0.00 C ATOM 1762 CE2 PHE A 108 -8.379 0.068 -7.541 1.00 0.00 C ATOM 1763 CZ PHE A 108 -8.869 -1.163 -7.929 1.00 0.00 C ATOM 0 H PHE A 108 -7.539 -2.875 -3.074 1.00 0.00 H new ATOM 0 HA PHE A 108 -6.154 -0.323 -3.653 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -9.137 -0.695 -3.209 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -8.309 0.790 -3.636 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -9.227 -2.577 -4.892 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -7.813 1.312 -5.903 1.00 0.00 H new ATOM 0 HE1 PHE A 108 -9.557 -3.078 -7.274 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -8.139 0.813 -8.285 1.00 0.00 H new ATOM 0 HZ PHE A 108 -9.014 -1.382 -8.977 1.00 0.00 H new ATOM 1773 N THR A 109 -6.642 0.578 -1.282 1.00 0.00 N ATOM 1774 CA THR A 109 -6.569 0.908 0.137 1.00 0.00 C ATOM 1775 C THR A 109 -7.317 2.204 0.434 1.00 0.00 C ATOM 1776 O THR A 109 -7.358 3.113 -0.395 1.00 0.00 O ATOM 1777 CB THR A 109 -5.110 1.034 0.578 1.00 0.00 C ATOM 1778 OG1 THR A 109 -4.546 2.245 0.107 1.00 0.00 O ATOM 1779 CG2 THR A 109 -4.237 -0.100 0.089 1.00 0.00 C ATOM 0 H THR A 109 -6.436 1.357 -1.907 1.00 0.00 H new ATOM 0 HA THR A 109 -7.042 0.101 0.697 1.00 0.00 H new ATOM 0 HB THR A 109 -5.135 1.008 1.667 1.00 0.00 H new ATOM 0 HG1 THR A 109 -3.613 2.308 0.401 1.00 0.00 H new ATOM 0 HG21 THR A 109 -3.215 0.051 0.437 1.00 0.00 H new ATOM 0 HG22 THR A 109 -4.617 -1.045 0.478 1.00 0.00 H new ATOM 0 HG23 THR A 109 -4.249 -0.125 -1.001 1.00 0.00 H new ATOM 1787 N ALA A 110 -7.908 2.281 1.622 1.00 0.00 N ATOM 1788 CA ALA A 110 -8.655 3.465 2.028 1.00 0.00 C ATOM 1789 C ALA A 110 -7.936 4.211 3.148 1.00 0.00 C ATOM 1790 O ALA A 110 -7.802 3.700 4.260 1.00 0.00 O ATOM 1791 CB ALA A 110 -10.060 3.078 2.466 1.00 0.00 C ATOM 0 H ALA A 110 -7.884 1.538 2.320 1.00 0.00 H new ATOM 0 HA ALA A 110 -8.725 4.132 1.169 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -10.607 3.972 2.767 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -10.580 2.596 1.638 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -10.002 2.388 3.308 1.00 0.00 H new ATOM 1797 N GLY A 111 -7.476 5.420 2.847 1.00 0.00 N ATOM 1798 CA GLY A 111 -6.776 6.216 3.838 1.00 0.00 C ATOM 1799 C GLY A 111 -7.648 7.309 4.425 1.00 0.00 C ATOM 1800 O GLY A 111 -8.195 8.134 3.693 1.00 0.00 O ATOM 0 H GLY A 111 -7.575 5.863 1.934 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -6.425 5.566 4.639 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -5.894 6.665 3.382 1.00 0.00 H new ATOM 1804 N VAL A 112 -7.776 7.315 5.746 1.00 0.00 N ATOM 1805 CA VAL A 112 -8.589 8.315 6.431 1.00 0.00 C ATOM 1806 C VAL A 112 -7.731 9.197 7.333 1.00 0.00 C ATOM 1807 O VAL A 112 -6.921 8.700 8.115 1.00 0.00 O ATOM 1808 CB VAL A 112 -9.693 7.657 7.278 1.00 0.00 C ATOM 1809 CG1 VAL A 112 -10.732 6.997 6.384 1.00 0.00 C ATOM 1810 CG2 VAL A 112 -9.095 6.649 8.248 1.00 0.00 C ATOM 0 H VAL A 112 -7.328 6.639 6.365 1.00 0.00 H new ATOM 0 HA VAL A 112 -9.051 8.929 5.658 1.00 0.00 H new ATOM 0 HB VAL A 112 -10.189 8.434 7.859 1.00 0.00 H new ATOM 0 HG11 VAL A 112 -11.504 6.537 7.001 1.00 0.00 H new ATOM 0 HG12 VAL A 112 -11.184 7.748 5.736 1.00 0.00 H new ATOM 0 HG13 VAL A 112 -10.253 6.232 5.773 1.00 0.00 H new ATOM 0 HG21 VAL A 112 -9.891 6.195 8.838 1.00 0.00 H new ATOM 0 HG22 VAL A 112 -8.570 5.874 7.690 1.00 0.00 H new ATOM 0 HG23 VAL A 112 -8.395 7.155 8.913 1.00 0.00 H new ATOM 1820 N THR A 113 -7.917 10.508 7.216 1.00 0.00 N ATOM 1821 CA THR A 113 -7.160 11.461 8.020 1.00 0.00 C ATOM 1822 C THR A 113 -8.075 12.548 8.578 1.00 0.00 C ATOM 1823 O THR A 113 -9.121 12.848 8.004 1.00 0.00 O ATOM 1824 CB THR A 113 -6.047 12.094 7.185 1.00 0.00 C ATOM 1825 OG1 THR A 113 -6.542 12.517 5.927 1.00 0.00 O ATOM 1826 CG2 THR A 113 -4.884 11.159 6.931 1.00 0.00 C ATOM 0 H THR A 113 -8.584 10.934 6.573 1.00 0.00 H new ATOM 0 HA THR A 113 -6.714 10.921 8.856 1.00 0.00 H new ATOM 0 HB THR A 113 -5.690 12.940 7.773 1.00 0.00 H new ATOM 0 HG1 THR A 113 -5.815 12.921 5.408 1.00 0.00 H new ATOM 0 HG21 THR A 113 -4.130 11.671 6.333 1.00 0.00 H new ATOM 0 HG22 THR A 113 -4.448 10.854 7.882 1.00 0.00 H new ATOM 0 HG23 THR A 113 -5.236 10.278 6.394 1.00 0.00 H new ATOM 1834 N ALA A 114 -7.672 13.133 9.701 1.00 0.00 N ATOM 1835 CA ALA A 114 -8.455 14.186 10.337 1.00 0.00 C ATOM 1836 C ALA A 114 -7.774 15.542 10.188 1.00 0.00 C ATOM 1837 O ALA A 114 -6.568 15.620 9.954 1.00 0.00 O ATOM 1838 CB ALA A 114 -8.676 13.862 11.807 1.00 0.00 C ATOM 0 H ALA A 114 -6.808 12.896 10.189 1.00 0.00 H new ATOM 0 HA ALA A 114 -9.423 14.239 9.838 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -9.262 14.656 12.270 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -9.212 12.917 11.895 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -7.713 13.781 12.310 1.00 0.00 H new ATOM 1844 N ARG A 115 -8.556 16.609 10.327 1.00 0.00 N ATOM 1845 CA ARG A 115 -8.028 17.963 10.208 1.00 0.00 C ATOM 1846 C ARG A 115 -7.207 18.337 11.438 1.00 0.00 C ATOM 1847 O ARG A 115 -6.944 17.499 12.300 1.00 0.00 O ATOM 1848 CB ARG A 115 -9.170 18.962 10.017 1.00 0.00 C ATOM 1849 CG ARG A 115 -8.839 20.089 9.051 1.00 0.00 C ATOM 1850 CD ARG A 115 -10.039 20.456 8.192 1.00 0.00 C ATOM 1851 NE ARG A 115 -9.717 21.498 7.221 1.00 0.00 N ATOM 1852 CZ ARG A 115 -9.627 22.791 7.522 1.00 0.00 C ATOM 1853 NH1 ARG A 115 -9.833 23.205 8.766 1.00 0.00 N ATOM 1854 NH2 ARG A 115 -9.331 23.673 6.577 1.00 0.00 N ATOM 0 H ARG A 115 -9.556 16.562 10.522 1.00 0.00 H new ATOM 0 HA ARG A 115 -7.376 17.997 9.336 1.00 0.00 H new ATOM 0 HB2 ARG A 115 -10.050 18.430 9.654 1.00 0.00 H new ATOM 0 HB3 ARG A 115 -9.433 19.390 10.985 1.00 0.00 H new ATOM 0 HG2 ARG A 115 -8.509 20.964 9.611 1.00 0.00 H new ATOM 0 HG3 ARG A 115 -8.010 19.789 8.411 1.00 0.00 H new ATOM 0 HD2 ARG A 115 -10.395 19.569 7.668 1.00 0.00 H new ATOM 0 HD3 ARG A 115 -10.853 20.796 8.832 1.00 0.00 H new ATOM 0 HE ARG A 115 -9.551 21.218 6.254 1.00 0.00 H new ATOM 0 HH11 ARG A 115 -10.061 22.531 9.497 1.00 0.00 H new ATOM 0 HH12 ARG A 115 -9.763 24.197 8.991 1.00 0.00 H new ATOM 0 HH21 ARG A 115 -9.172 23.360 5.619 1.00 0.00 H new ATOM 0 HH22 ARG A 115 -9.262 24.664 6.808 1.00 0.00 H new ATOM 1868 N ASP A 116 -6.805 19.602 11.512 1.00 0.00 N ATOM 1869 CA ASP A 116 -6.014 20.089 12.637 1.00 0.00 C ATOM 1870 C ASP A 116 -6.856 20.970 13.555 1.00 0.00 C ATOM 1871 O ASP A 116 -6.363 21.948 14.115 1.00 0.00 O ATOM 1872 CB ASP A 116 -4.800 20.870 12.133 1.00 0.00 C ATOM 1873 CG ASP A 116 -3.692 20.947 13.165 1.00 0.00 C ATOM 1874 OD1 ASP A 116 -3.471 19.943 13.875 1.00 0.00 O ATOM 1875 OD2 ASP A 116 -3.044 22.010 13.263 1.00 0.00 O ATOM 0 H ASP A 116 -7.014 20.308 10.806 1.00 0.00 H new ATOM 0 HA ASP A 116 -5.671 19.226 13.208 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -4.418 20.397 11.228 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -5.109 21.879 11.860 1.00 0.00 H new ATOM 1881 N ASN A 117 -8.128 20.615 13.704 1.00 0.00 N ATOM 1882 CA ASN A 117 -9.039 21.373 14.554 1.00 0.00 C ATOM 1883 C ASN A 117 -10.070 20.454 15.200 1.00 0.00 C ATOM 1884 O ASN A 117 -11.241 20.453 14.820 1.00 0.00 O ATOM 1885 CB ASN A 117 -9.744 22.459 13.739 1.00 0.00 C ATOM 1886 CG ASN A 117 -10.413 23.499 14.617 1.00 0.00 C ATOM 1887 OD1 ASN A 117 -11.404 23.214 15.290 1.00 0.00 O ATOM 1888 ND2 ASN A 117 -9.874 24.712 14.614 1.00 0.00 N ATOM 0 H ASN A 117 -8.551 19.807 13.247 1.00 0.00 H new ATOM 0 HA ASN A 117 -8.454 21.844 15.344 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -9.020 22.949 13.088 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -10.491 21.997 13.094 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -10.281 25.453 15.185 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -9.052 24.904 14.041 1.00 0.00 H new ATOM 1895 N TRP A 118 -9.626 19.672 16.180 1.00 0.00 N ATOM 1896 CA TRP A 118 -10.508 18.744 16.882 1.00 0.00 C ATOM 1897 C TRP A 118 -11.001 17.648 15.941 1.00 0.00 C ATOM 1898 O TRP A 118 -10.526 16.513 15.992 1.00 0.00 O ATOM 1899 CB TRP A 118 -11.697 19.494 17.489 1.00 0.00 C ATOM 1900 CG TRP A 118 -11.819 19.309 18.971 1.00 0.00 C ATOM 1901 CD1 TRP A 118 -11.895 18.125 19.646 1.00 0.00 C ATOM 1902 CD2 TRP A 118 -11.879 20.342 19.962 1.00 0.00 C ATOM 1903 NE1 TRP A 118 -11.999 18.358 20.997 1.00 0.00 N ATOM 1904 CE2 TRP A 118 -11.992 19.711 21.215 1.00 0.00 C ATOM 1905 CE3 TRP A 118 -11.848 21.739 19.911 1.00 0.00 C ATOM 1906 CZ2 TRP A 118 -12.073 20.429 22.406 1.00 0.00 C ATOM 1907 CZ3 TRP A 118 -11.929 22.450 21.093 1.00 0.00 C ATOM 1908 CH2 TRP A 118 -12.040 21.795 22.325 1.00 0.00 C ATOM 0 H TRP A 118 -8.660 19.662 16.506 1.00 0.00 H new ATOM 0 HA TRP A 118 -9.940 18.277 17.686 1.00 0.00 H new ATOM 0 HB2 TRP A 118 -11.598 20.557 17.269 1.00 0.00 H new ATOM 0 HB3 TRP A 118 -12.615 19.154 17.010 1.00 0.00 H new ATOM 0 HD1 TRP A 118 -11.876 17.148 19.186 1.00 0.00 H new ATOM 0 HE1 TRP A 118 -12.070 17.641 21.719 1.00 0.00 H new ATOM 0 HE3 TRP A 118 -11.762 22.253 18.965 1.00 0.00 H new ATOM 0 HZ2 TRP A 118 -12.159 19.926 23.358 1.00 0.00 H new ATOM 0 HZ3 TRP A 118 -11.906 23.529 21.066 1.00 0.00 H new ATOM 0 HH2 TRP A 118 -12.101 22.380 23.231 1.00 0.00 H new ATOM 1919 N ASN A 119 -11.956 17.995 15.083 1.00 0.00 N ATOM 1920 CA ASN A 119 -12.512 17.041 14.131 1.00 0.00 C ATOM 1921 C ASN A 119 -13.079 15.819 14.848 1.00 0.00 C ATOM 1922 O ASN A 119 -13.126 15.774 16.077 1.00 0.00 O ATOM 1923 CB ASN A 119 -11.440 16.609 13.127 1.00 0.00 C ATOM 1924 CG ASN A 119 -11.523 17.381 11.825 1.00 0.00 C ATOM 1925 OD1 ASN A 119 -11.375 16.815 10.743 1.00 0.00 O ATOM 1926 ND2 ASN A 119 -11.762 18.684 11.925 1.00 0.00 N ATOM 0 H ASN A 119 -12.360 18.930 15.028 1.00 0.00 H new ATOM 0 HA ASN A 119 -13.325 17.532 13.596 1.00 0.00 H new ATOM 0 HB2 ASN A 119 -10.454 16.752 13.569 1.00 0.00 H new ATOM 0 HB3 ASN A 119 -11.546 15.544 12.922 1.00 0.00 H new ATOM 0 HD21 ASN A 119 -11.829 19.256 11.083 1.00 0.00 H new ATOM 0 HD22 ASN A 119 -11.878 19.112 12.843 1.00 0.00 H new ATOM 1933 N TYR A 120 -13.507 14.829 14.071 1.00 0.00 N ATOM 1934 CA TYR A 120 -14.070 13.607 14.631 1.00 0.00 C ATOM 1935 C TYR A 120 -14.098 12.495 13.586 1.00 0.00 C ATOM 1936 O TYR A 120 -13.725 11.355 13.866 1.00 0.00 O ATOM 1937 CB TYR A 120 -15.484 13.867 15.159 1.00 0.00 C ATOM 1938 CG TYR A 120 -15.680 13.443 16.597 1.00 0.00 C ATOM 1939 CD1 TYR A 120 -15.365 14.300 17.643 1.00 0.00 C ATOM 1940 CD2 TYR A 120 -16.181 12.185 16.908 1.00 0.00 C ATOM 1941 CE1 TYR A 120 -15.543 13.916 18.959 1.00 0.00 C ATOM 1942 CE2 TYR A 120 -16.362 11.793 18.220 1.00 0.00 C ATOM 1943 CZ TYR A 120 -16.042 12.663 19.242 1.00 0.00 C ATOM 1944 OH TYR A 120 -16.221 12.276 20.551 1.00 0.00 O ATOM 0 H TYR A 120 -13.474 14.850 13.052 1.00 0.00 H new ATOM 0 HA TYR A 120 -13.436 13.288 15.458 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -15.707 14.930 15.069 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -16.200 13.337 14.532 1.00 0.00 H new ATOM 0 HD1 TYR A 120 -14.974 15.283 17.425 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -16.433 11.502 16.110 1.00 0.00 H new ATOM 0 HE1 TYR A 120 -15.292 14.594 19.761 1.00 0.00 H new ATOM 0 HE2 TYR A 120 -16.752 10.811 18.445 1.00 0.00 H new ATOM 0 HH TYR A 120 -16.581 11.365 20.576 1.00 0.00 H new ATOM 1954 N ILE A 121 -14.543 12.835 12.381 1.00 0.00 N ATOM 1955 CA ILE A 121 -14.619 11.869 11.292 1.00 0.00 C ATOM 1956 C ILE A 121 -13.622 12.208 10.186 1.00 0.00 C ATOM 1957 O ILE A 121 -13.837 13.143 9.414 1.00 0.00 O ATOM 1958 CB ILE A 121 -16.036 11.816 10.688 1.00 0.00 C ATOM 1959 CG1 ILE A 121 -17.082 11.681 11.797 1.00 0.00 C ATOM 1960 CG2 ILE A 121 -16.149 10.663 9.703 1.00 0.00 C ATOM 1961 CD1 ILE A 121 -17.659 13.005 12.247 1.00 0.00 C ATOM 0 H ILE A 121 -14.857 13.774 12.134 1.00 0.00 H new ATOM 0 HA ILE A 121 -14.373 10.895 11.715 1.00 0.00 H new ATOM 0 HB ILE A 121 -16.221 12.746 10.151 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -17.892 11.041 11.446 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.629 11.181 12.653 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -17.155 10.639 9.285 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -15.425 10.799 8.899 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -15.947 9.724 10.218 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -18.393 12.833 13.034 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -16.859 13.639 12.629 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -18.141 13.498 11.403 1.00 0.00 H new ATOM 1973 N PRO A 122 -12.510 11.456 10.093 1.00 0.00 N ATOM 1974 CA PRO A 122 -11.483 11.692 9.072 1.00 0.00 C ATOM 1975 C PRO A 122 -11.987 11.396 7.664 1.00 0.00 C ATOM 1976 O PRO A 122 -12.800 10.494 7.461 1.00 0.00 O ATOM 1977 CB PRO A 122 -10.362 10.722 9.454 1.00 0.00 C ATOM 1978 CG PRO A 122 -11.036 9.650 10.238 1.00 0.00 C ATOM 1979 CD PRO A 122 -12.164 10.321 10.969 1.00 0.00 C ATOM 0 HA PRO A 122 -11.168 12.735 9.049 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -9.872 10.316 8.569 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -9.593 11.220 10.045 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -11.409 8.863 9.583 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -10.342 9.182 10.936 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -13.010 9.648 11.108 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -11.858 10.657 11.960 1.00 0.00 H new ATOM 1987 N LEU A 123 -11.501 12.163 6.694 1.00 0.00 N ATOM 1988 CA LEU A 123 -11.902 11.983 5.304 1.00 0.00 C ATOM 1989 C LEU A 123 -11.150 10.816 4.665 1.00 0.00 C ATOM 1990 O LEU A 123 -9.920 10.823 4.605 1.00 0.00 O ATOM 1991 CB LEU A 123 -11.644 13.265 4.509 1.00 0.00 C ATOM 1992 CG LEU A 123 -12.776 14.293 4.553 1.00 0.00 C ATOM 1993 CD1 LEU A 123 -12.647 15.177 5.783 1.00 0.00 C ATOM 1994 CD2 LEU A 123 -12.777 15.135 3.286 1.00 0.00 C ATOM 0 H LEU A 123 -10.829 12.915 6.845 1.00 0.00 H new ATOM 0 HA LEU A 123 -12.968 11.758 5.286 1.00 0.00 H new ATOM 0 HB2 LEU A 123 -10.735 13.732 4.887 1.00 0.00 H new ATOM 0 HB3 LEU A 123 -11.456 12.998 3.469 1.00 0.00 H new ATOM 0 HG LEU A 123 -13.725 13.760 4.613 1.00 0.00 H new ATOM 0 HD11 LEU A 123 -13.461 15.902 5.797 1.00 0.00 H new ATOM 0 HD12 LEU A 123 -12.695 14.561 6.681 1.00 0.00 H new ATOM 0 HD13 LEU A 123 -11.693 15.703 5.754 1.00 0.00 H new ATOM 0 HD21 LEU A 123 -13.588 15.862 3.333 1.00 0.00 H new ATOM 0 HD22 LEU A 123 -11.825 15.659 3.197 1.00 0.00 H new ATOM 0 HD23 LEU A 123 -12.918 14.489 2.420 1.00 0.00 H new ATOM 2006 N PRO A 124 -11.877 9.793 4.178 1.00 0.00 N ATOM 2007 CA PRO A 124 -11.264 8.623 3.546 1.00 0.00 C ATOM 2008 C PRO A 124 -10.819 8.904 2.114 1.00 0.00 C ATOM 2009 O PRO A 124 -11.207 9.910 1.520 1.00 0.00 O ATOM 2010 CB PRO A 124 -12.391 7.594 3.562 1.00 0.00 C ATOM 2011 CG PRO A 124 -13.639 8.405 3.481 1.00 0.00 C ATOM 2012 CD PRO A 124 -13.351 9.695 4.206 1.00 0.00 C ATOM 0 HA PRO A 124 -10.361 8.301 4.064 1.00 0.00 H new ATOM 0 HB2 PRO A 124 -12.311 6.904 2.722 1.00 0.00 H new ATOM 0 HB3 PRO A 124 -12.367 6.993 4.471 1.00 0.00 H new ATOM 0 HG2 PRO A 124 -13.913 8.595 2.443 1.00 0.00 H new ATOM 0 HG3 PRO A 124 -14.476 7.879 3.941 1.00 0.00 H new ATOM 0 HD2 PRO A 124 -13.818 10.546 3.710 1.00 0.00 H new ATOM 0 HD3 PRO A 124 -13.731 9.674 5.227 1.00 0.00 H new ATOM 2020 N VAL A 125 -10.005 8.009 1.567 1.00 0.00 N ATOM 2021 CA VAL A 125 -9.508 8.160 0.205 1.00 0.00 C ATOM 2022 C VAL A 125 -9.206 6.802 -0.422 1.00 0.00 C ATOM 2023 O VAL A 125 -8.389 6.039 0.092 1.00 0.00 O ATOM 2024 CB VAL A 125 -8.235 9.025 0.163 1.00 0.00 C ATOM 2025 CG1 VAL A 125 -7.843 9.332 -1.275 1.00 0.00 C ATOM 2026 CG2 VAL A 125 -8.437 10.310 0.952 1.00 0.00 C ATOM 0 H VAL A 125 -9.675 7.171 2.046 1.00 0.00 H new ATOM 0 HA VAL A 125 -10.294 8.656 -0.365 1.00 0.00 H new ATOM 0 HB VAL A 125 -7.422 8.464 0.625 1.00 0.00 H new ATOM 0 HG11 VAL A 125 -6.941 9.944 -1.284 1.00 0.00 H new ATOM 0 HG12 VAL A 125 -7.654 8.400 -1.807 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -8.653 9.872 -1.765 1.00 0.00 H new ATOM 0 HG21 VAL A 125 -7.527 10.909 0.911 1.00 0.00 H new ATOM 0 HG22 VAL A 125 -9.263 10.876 0.521 1.00 0.00 H new ATOM 0 HG23 VAL A 125 -8.666 10.068 1.990 1.00 0.00 H new ATOM 2036 N LEU A 126 -9.871 6.508 -1.534 1.00 0.00 N ATOM 2037 CA LEU A 126 -9.675 5.242 -2.230 1.00 0.00 C ATOM 2038 C LEU A 126 -8.672 5.397 -3.369 1.00 0.00 C ATOM 2039 O LEU A 126 -8.843 6.239 -4.251 1.00 0.00 O ATOM 2040 CB LEU A 126 -11.007 4.723 -2.775 1.00 0.00 C ATOM 2041 CG LEU A 126 -11.193 3.207 -2.696 1.00 0.00 C ATOM 2042 CD1 LEU A 126 -11.365 2.764 -1.251 1.00 0.00 C ATOM 2043 CD2 LEU A 126 -12.386 2.773 -3.533 1.00 0.00 C ATOM 0 H LEU A 126 -10.551 7.129 -1.973 1.00 0.00 H new ATOM 0 HA LEU A 126 -9.278 4.521 -1.515 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -11.818 5.202 -2.226 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -11.101 5.031 -3.816 1.00 0.00 H new ATOM 0 HG LEU A 126 -10.299 2.729 -3.097 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -11.496 1.682 -1.215 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -10.481 3.042 -0.678 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -12.242 3.250 -0.823 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -12.504 1.691 -3.465 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -13.288 3.260 -3.162 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -12.223 3.056 -4.573 1.00 0.00 H new ATOM 2055 N LEU A 127 -7.625 4.578 -3.344 1.00 0.00 N ATOM 2056 CA LEU A 127 -6.594 4.624 -4.374 1.00 0.00 C ATOM 2057 C LEU A 127 -6.003 3.237 -4.615 1.00 0.00 C ATOM 2058 O LEU A 127 -5.886 2.435 -3.688 1.00 0.00 O ATOM 2059 CB LEU A 127 -5.487 5.601 -3.976 1.00 0.00 C ATOM 2060 CG LEU A 127 -4.767 5.266 -2.669 1.00 0.00 C ATOM 2061 CD1 LEU A 127 -3.336 5.780 -2.702 1.00 0.00 C ATOM 2062 CD2 LEU A 127 -5.519 5.852 -1.483 1.00 0.00 C ATOM 0 H LEU A 127 -7.469 3.875 -2.622 1.00 0.00 H new ATOM 0 HA LEU A 127 -7.056 4.968 -5.299 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -4.751 5.639 -4.779 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -5.917 6.599 -3.891 1.00 0.00 H new ATOM 0 HG LEU A 127 -4.739 4.182 -2.557 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -2.839 5.533 -1.764 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -2.801 5.314 -3.530 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -3.341 6.862 -2.836 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -4.993 5.605 -0.561 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -5.577 6.935 -1.588 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -6.526 5.436 -1.449 1.00 0.00 H new ATOM 2074 N PRO A 128 -5.621 2.934 -5.868 1.00 0.00 N ATOM 2075 CA PRO A 128 -5.040 1.636 -6.224 1.00 0.00 C ATOM 2076 C PRO A 128 -3.620 1.471 -5.695 1.00 0.00 C ATOM 2077 O PRO A 128 -2.844 2.427 -5.663 1.00 0.00 O ATOM 2078 CB PRO A 128 -5.042 1.654 -7.753 1.00 0.00 C ATOM 2079 CG PRO A 128 -4.970 3.099 -8.110 1.00 0.00 C ATOM 2080 CD PRO A 128 -5.725 3.831 -7.034 1.00 0.00 C ATOM 0 HA PRO A 128 -5.601 0.807 -5.793 1.00 0.00 H new ATOM 0 HB2 PRO A 128 -4.193 1.103 -8.157 1.00 0.00 H new ATOM 0 HB3 PRO A 128 -5.943 1.191 -8.154 1.00 0.00 H new ATOM 0 HG2 PRO A 128 -3.935 3.437 -8.159 1.00 0.00 H new ATOM 0 HG3 PRO A 128 -5.412 3.281 -9.090 1.00 0.00 H new ATOM 0 HD2 PRO A 128 -5.286 4.807 -6.829 1.00 0.00 H new ATOM 0 HD3 PRO A 128 -6.764 4.001 -7.318 1.00 0.00 H new ATOM 2088 N LEU A 129 -3.285 0.254 -5.280 1.00 0.00 N ATOM 2089 CA LEU A 129 -1.956 -0.034 -4.753 1.00 0.00 C ATOM 2090 C LEU A 129 -1.536 -1.463 -5.086 1.00 0.00 C ATOM 2091 O LEU A 129 -2.373 -2.310 -5.397 1.00 0.00 O ATOM 2092 CB LEU A 129 -1.928 0.176 -3.237 1.00 0.00 C ATOM 2093 CG LEU A 129 -1.706 1.622 -2.789 1.00 0.00 C ATOM 2094 CD1 LEU A 129 -3.039 2.333 -2.604 1.00 0.00 C ATOM 2095 CD2 LEU A 129 -0.897 1.662 -1.502 1.00 0.00 C ATOM 0 H LEU A 129 -3.915 -0.548 -5.298 1.00 0.00 H new ATOM 0 HA LEU A 129 -1.251 0.653 -5.222 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -2.870 -0.178 -2.819 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -1.139 -0.445 -2.814 1.00 0.00 H new ATOM 0 HG LEU A 129 -1.144 2.141 -3.565 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -2.862 3.360 -2.285 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -3.585 2.335 -3.548 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -3.626 1.814 -1.846 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -0.748 2.698 -1.198 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -1.433 1.127 -0.718 1.00 0.00 H new ATOM 0 HD23 LEU A 129 0.072 1.190 -1.666 1.00 0.00 H new ATOM 2107 N ALA A 130 -0.235 -1.722 -5.017 1.00 0.00 N ATOM 2108 CA ALA A 130 0.297 -3.047 -5.310 1.00 0.00 C ATOM 2109 C ALA A 130 1.307 -3.478 -4.251 1.00 0.00 C ATOM 2110 O ALA A 130 1.533 -2.768 -3.271 1.00 0.00 O ATOM 2111 CB ALA A 130 0.937 -3.064 -6.691 1.00 0.00 C ATOM 0 H ALA A 130 0.471 -1.031 -4.761 1.00 0.00 H new ATOM 0 HA ALA A 130 -0.530 -3.757 -5.296 1.00 0.00 H new ATOM 0 HB1 ALA A 130 1.330 -4.059 -6.897 1.00 0.00 H new ATOM 0 HB2 ALA A 130 0.190 -2.806 -7.442 1.00 0.00 H new ATOM 0 HB3 ALA A 130 1.750 -2.339 -6.724 1.00 0.00 H new ATOM 2117 N SER A 131 1.911 -4.643 -4.454 1.00 0.00 N ATOM 2118 CA SER A 131 2.897 -5.167 -3.516 1.00 0.00 C ATOM 2119 C SER A 131 3.605 -6.387 -4.094 1.00 0.00 C ATOM 2120 O SER A 131 3.084 -7.056 -4.985 1.00 0.00 O ATOM 2121 CB SER A 131 2.225 -5.531 -2.190 1.00 0.00 C ATOM 2122 OG SER A 131 1.613 -6.807 -2.262 1.00 0.00 O ATOM 0 H SER A 131 1.735 -5.243 -5.260 1.00 0.00 H new ATOM 0 HA SER A 131 3.641 -4.391 -3.338 1.00 0.00 H new ATOM 0 HB2 SER A 131 2.965 -5.524 -1.390 1.00 0.00 H new ATOM 0 HB3 SER A 131 1.477 -4.779 -1.939 1.00 0.00 H new ATOM 0 HG SER A 131 1.192 -7.017 -1.402 1.00 0.00 H new ATOM 2128 N VAL A 132 4.797 -6.670 -3.578 1.00 0.00 N ATOM 2129 CA VAL A 132 5.580 -7.810 -4.041 1.00 0.00 C ATOM 2130 C VAL A 132 6.340 -8.457 -2.889 1.00 0.00 C ATOM 2131 O VAL A 132 7.117 -7.800 -2.197 1.00 0.00 O ATOM 2132 CB VAL A 132 6.583 -7.397 -5.134 1.00 0.00 C ATOM 2133 CG1 VAL A 132 5.865 -7.145 -6.451 1.00 0.00 C ATOM 2134 CG2 VAL A 132 7.367 -6.166 -4.704 1.00 0.00 C ATOM 0 H VAL A 132 5.242 -6.125 -2.839 1.00 0.00 H new ATOM 0 HA VAL A 132 4.875 -8.529 -4.459 1.00 0.00 H new ATOM 0 HB VAL A 132 7.288 -8.216 -5.281 1.00 0.00 H new ATOM 0 HG11 VAL A 132 6.590 -6.854 -7.211 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.354 -8.054 -6.766 1.00 0.00 H new ATOM 0 HG13 VAL A 132 5.136 -6.345 -6.321 1.00 0.00 H new ATOM 0 HG21 VAL A 132 8.070 -5.890 -5.490 1.00 0.00 H new ATOM 0 HG22 VAL A 132 6.679 -5.340 -4.527 1.00 0.00 H new ATOM 0 HG23 VAL A 132 7.915 -6.385 -3.787 1.00 0.00 H new ATOM 2144 N GLY A 133 6.110 -9.750 -2.687 1.00 0.00 N ATOM 2145 CA GLY A 133 6.780 -10.464 -1.616 1.00 0.00 C ATOM 2146 C GLY A 133 8.046 -11.153 -2.082 1.00 0.00 C ATOM 2147 O GLY A 133 7.995 -12.096 -2.871 1.00 0.00 O ATOM 0 H GLY A 133 5.472 -10.316 -3.246 1.00 0.00 H new ATOM 0 HA2 GLY A 133 7.024 -9.766 -0.815 1.00 0.00 H new ATOM 0 HA3 GLY A 133 6.100 -11.205 -1.197 1.00 0.00 H new ATOM 2151 N TYR A 134 9.188 -10.682 -1.591 1.00 0.00 N ATOM 2152 CA TYR A 134 10.476 -11.259 -1.960 1.00 0.00 C ATOM 2153 C TYR A 134 11.306 -11.575 -0.721 1.00 0.00 C ATOM 2154 O TYR A 134 11.705 -10.674 0.018 1.00 0.00 O ATOM 2155 CB TYR A 134 11.244 -10.303 -2.873 1.00 0.00 C ATOM 2156 CG TYR A 134 12.424 -10.944 -3.568 1.00 0.00 C ATOM 2157 CD1 TYR A 134 12.248 -12.039 -4.406 1.00 0.00 C ATOM 2158 CD2 TYR A 134 13.712 -10.455 -3.388 1.00 0.00 C ATOM 2159 CE1 TYR A 134 13.323 -12.628 -5.044 1.00 0.00 C ATOM 2160 CE2 TYR A 134 14.792 -11.039 -4.023 1.00 0.00 C ATOM 2161 CZ TYR A 134 14.592 -12.124 -4.849 1.00 0.00 C ATOM 2162 OH TYR A 134 15.665 -12.709 -5.483 1.00 0.00 O ATOM 0 H TYR A 134 9.248 -9.902 -0.936 1.00 0.00 H new ATOM 0 HA TYR A 134 10.289 -12.189 -2.496 1.00 0.00 H new ATOM 0 HB2 TYR A 134 10.562 -9.906 -3.625 1.00 0.00 H new ATOM 0 HB3 TYR A 134 11.596 -9.456 -2.284 1.00 0.00 H new ATOM 0 HD1 TYR A 134 11.255 -12.436 -4.561 1.00 0.00 H new ATOM 0 HD2 TYR A 134 13.872 -9.605 -2.741 1.00 0.00 H new ATOM 0 HE1 TYR A 134 13.170 -13.478 -5.692 1.00 0.00 H new ATOM 0 HE2 TYR A 134 15.787 -10.647 -3.873 1.00 0.00 H new ATOM 0 HH TYR A 134 16.487 -12.234 -5.241 1.00 0.00 H new ATOM 2172 N GLY A 135 11.563 -12.861 -0.499 1.00 0.00 N ATOM 2173 CA GLY A 135 12.344 -13.272 0.653 1.00 0.00 C ATOM 2174 C GLY A 135 11.744 -12.797 1.964 1.00 0.00 C ATOM 2175 O GLY A 135 10.525 -12.658 2.074 1.00 0.00 O ATOM 0 H GLY A 135 11.245 -13.624 -1.096 1.00 0.00 H new ATOM 0 HA2 GLY A 135 12.421 -14.359 0.666 1.00 0.00 H new ATOM 0 HA3 GLY A 135 13.357 -12.881 0.559 1.00 0.00 H new ATOM 2179 N PRO A 136 12.579 -12.538 2.984 1.00 0.00 N ATOM 2180 CA PRO A 136 12.108 -12.074 4.292 1.00 0.00 C ATOM 2181 C PRO A 136 11.609 -10.631 4.258 1.00 0.00 C ATOM 2182 O PRO A 136 11.004 -10.154 5.217 1.00 0.00 O ATOM 2183 CB PRO A 136 13.350 -12.189 5.176 1.00 0.00 C ATOM 2184 CG PRO A 136 14.497 -12.053 4.234 1.00 0.00 C ATOM 2185 CD PRO A 136 14.048 -12.677 2.941 1.00 0.00 C ATOM 0 HA PRO A 136 11.258 -12.657 4.647 1.00 0.00 H new ATOM 0 HB2 PRO A 136 13.368 -11.409 5.937 1.00 0.00 H new ATOM 0 HB3 PRO A 136 13.377 -13.145 5.698 1.00 0.00 H new ATOM 0 HG2 PRO A 136 14.762 -11.005 4.090 1.00 0.00 H new ATOM 0 HG3 PRO A 136 15.383 -12.555 4.623 1.00 0.00 H new ATOM 0 HD2 PRO A 136 14.475 -12.165 2.079 1.00 0.00 H new ATOM 0 HD3 PRO A 136 14.351 -13.722 2.873 1.00 0.00 H new ATOM 2193 N VAL A 137 11.869 -9.938 3.152 1.00 0.00 N ATOM 2194 CA VAL A 137 11.445 -8.551 3.004 1.00 0.00 C ATOM 2195 C VAL A 137 10.240 -8.440 2.075 1.00 0.00 C ATOM 2196 O VAL A 137 10.022 -9.297 1.218 1.00 0.00 O ATOM 2197 CB VAL A 137 12.583 -7.670 2.457 1.00 0.00 C ATOM 2198 CG1 VAL A 137 13.675 -7.498 3.502 1.00 0.00 C ATOM 2199 CG2 VAL A 137 13.148 -8.264 1.175 1.00 0.00 C ATOM 0 H VAL A 137 12.370 -10.315 2.347 1.00 0.00 H new ATOM 0 HA VAL A 137 11.168 -8.198 3.998 1.00 0.00 H new ATOM 0 HB VAL A 137 12.177 -6.685 2.225 1.00 0.00 H new ATOM 0 HG11 VAL A 137 14.471 -6.873 3.097 1.00 0.00 H new ATOM 0 HG12 VAL A 137 13.257 -7.024 4.390 1.00 0.00 H new ATOM 0 HG13 VAL A 137 14.081 -8.474 3.768 1.00 0.00 H new ATOM 0 HG21 VAL A 137 13.951 -7.628 0.803 1.00 0.00 H new ATOM 0 HG22 VAL A 137 13.539 -9.261 1.377 1.00 0.00 H new ATOM 0 HG23 VAL A 137 12.359 -8.329 0.425 1.00 0.00 H new ATOM 2209 N THR A 138 9.461 -7.377 2.249 1.00 0.00 N ATOM 2210 CA THR A 138 8.279 -7.154 1.426 1.00 0.00 C ATOM 2211 C THR A 138 8.191 -5.696 0.985 1.00 0.00 C ATOM 2212 O THR A 138 8.222 -4.784 1.811 1.00 0.00 O ATOM 2213 CB THR A 138 7.015 -7.543 2.194 1.00 0.00 C ATOM 2214 OG1 THR A 138 7.191 -7.340 3.585 1.00 0.00 O ATOM 2215 CG2 THR A 138 6.610 -8.987 1.988 1.00 0.00 C ATOM 0 H THR A 138 9.627 -6.657 2.952 1.00 0.00 H new ATOM 0 HA THR A 138 8.363 -7.780 0.538 1.00 0.00 H new ATOM 0 HB THR A 138 6.227 -6.902 1.798 1.00 0.00 H new ATOM 0 HG1 THR A 138 7.887 -6.666 3.732 1.00 0.00 H new ATOM 0 HG21 THR A 138 5.706 -9.197 2.560 1.00 0.00 H new ATOM 0 HG22 THR A 138 6.418 -9.164 0.930 1.00 0.00 H new ATOM 0 HG23 THR A 138 7.413 -9.642 2.325 1.00 0.00 H new ATOM 2223 N PHE A 139 8.081 -5.484 -0.323 1.00 0.00 N ATOM 2224 CA PHE A 139 7.989 -4.137 -0.873 1.00 0.00 C ATOM 2225 C PHE A 139 6.570 -3.839 -1.346 1.00 0.00 C ATOM 2226 O PHE A 139 5.915 -4.689 -1.950 1.00 0.00 O ATOM 2227 CB PHE A 139 8.974 -3.969 -2.031 1.00 0.00 C ATOM 2228 CG PHE A 139 9.768 -2.695 -1.964 1.00 0.00 C ATOM 2229 CD1 PHE A 139 9.155 -1.470 -2.169 1.00 0.00 C ATOM 2230 CD2 PHE A 139 11.127 -2.724 -1.696 1.00 0.00 C ATOM 2231 CE1 PHE A 139 9.882 -0.296 -2.107 1.00 0.00 C ATOM 2232 CE2 PHE A 139 11.859 -1.553 -1.632 1.00 0.00 C ATOM 2233 CZ PHE A 139 11.237 -0.338 -1.838 1.00 0.00 C ATOM 0 H PHE A 139 8.053 -6.228 -1.021 1.00 0.00 H new ATOM 0 HA PHE A 139 8.244 -3.430 -0.084 1.00 0.00 H new ATOM 0 HB2 PHE A 139 9.661 -4.815 -2.039 1.00 0.00 H new ATOM 0 HB3 PHE A 139 8.424 -3.996 -2.972 1.00 0.00 H new ATOM 0 HD1 PHE A 139 8.096 -1.432 -2.380 1.00 0.00 H new ATOM 0 HD2 PHE A 139 11.620 -3.672 -1.535 1.00 0.00 H new ATOM 0 HE1 PHE A 139 9.392 0.653 -2.269 1.00 0.00 H new ATOM 0 HE2 PHE A 139 12.918 -1.589 -1.421 1.00 0.00 H new ATOM 0 HZ PHE A 139 11.808 0.578 -1.789 1.00 0.00 H new ATOM 2243 N GLN A 140 6.101 -2.627 -1.069 1.00 0.00 N ATOM 2244 CA GLN A 140 4.759 -2.217 -1.467 1.00 0.00 C ATOM 2245 C GLN A 140 4.805 -0.939 -2.299 1.00 0.00 C ATOM 2246 O GLN A 140 5.448 0.039 -1.918 1.00 0.00 O ATOM 2247 CB GLN A 140 3.881 -2.005 -0.231 1.00 0.00 C ATOM 2248 CG GLN A 140 2.461 -2.524 -0.398 1.00 0.00 C ATOM 2249 CD GLN A 140 1.454 -1.410 -0.602 1.00 0.00 C ATOM 2250 OE1 GLN A 140 1.818 -0.277 -0.919 1.00 0.00 O ATOM 2251 NE2 GLN A 140 0.177 -1.727 -0.420 1.00 0.00 N ATOM 0 H GLN A 140 6.630 -1.911 -0.571 1.00 0.00 H new ATOM 0 HA GLN A 140 4.329 -3.011 -2.078 1.00 0.00 H new ATOM 0 HB2 GLN A 140 4.343 -2.502 0.622 1.00 0.00 H new ATOM 0 HB3 GLN A 140 3.845 -0.941 0.001 1.00 0.00 H new ATOM 0 HG2 GLN A 140 2.424 -3.203 -1.250 1.00 0.00 H new ATOM 0 HG3 GLN A 140 2.184 -3.103 0.483 1.00 0.00 H new ATOM 0 HE21 GLN A 140 -0.080 -2.679 -0.158 1.00 0.00 H new ATOM 0 HE22 GLN A 140 -0.547 -1.019 -0.543 1.00 0.00 H new ATOM 2260 N MET A 141 4.119 -0.955 -3.437 1.00 0.00 N ATOM 2261 CA MET A 141 4.082 0.202 -4.324 1.00 0.00 C ATOM 2262 C MET A 141 2.722 0.890 -4.262 1.00 0.00 C ATOM 2263 O MET A 141 1.717 0.271 -3.914 1.00 0.00 O ATOM 2264 CB MET A 141 4.389 -0.220 -5.761 1.00 0.00 C ATOM 2265 CG MET A 141 5.771 -0.832 -5.933 1.00 0.00 C ATOM 2266 SD MET A 141 6.535 -0.389 -7.505 1.00 0.00 S ATOM 2267 CE MET A 141 8.121 -1.207 -7.352 1.00 0.00 C ATOM 0 H MET A 141 3.581 -1.756 -3.767 1.00 0.00 H new ATOM 0 HA MET A 141 4.842 0.909 -3.991 1.00 0.00 H new ATOM 0 HB2 MET A 141 3.639 -0.940 -6.088 1.00 0.00 H new ATOM 0 HB3 MET A 141 4.302 0.649 -6.413 1.00 0.00 H new ATOM 0 HG2 MET A 141 6.414 -0.504 -5.116 1.00 0.00 H new ATOM 0 HG3 MET A 141 5.695 -1.917 -5.863 1.00 0.00 H new ATOM 0 HE1 MET A 141 8.712 -1.026 -8.250 1.00 0.00 H new ATOM 0 HE2 MET A 141 8.651 -0.814 -6.484 1.00 0.00 H new ATOM 0 HE3 MET A 141 7.967 -2.279 -7.229 1.00 0.00 H new ATOM 2277 N THR A 142 2.699 2.175 -4.603 1.00 0.00 N ATOM 2278 CA THR A 142 1.462 2.948 -4.586 1.00 0.00 C ATOM 2279 C THR A 142 1.269 3.695 -5.901 1.00 0.00 C ATOM 2280 O THR A 142 2.209 4.283 -6.437 1.00 0.00 O ATOM 2281 CB THR A 142 1.473 3.938 -3.421 1.00 0.00 C ATOM 2282 OG1 THR A 142 1.890 3.301 -2.226 1.00 0.00 O ATOM 2283 CG2 THR A 142 0.121 4.568 -3.158 1.00 0.00 C ATOM 0 H THR A 142 3.522 2.702 -4.894 1.00 0.00 H new ATOM 0 HA THR A 142 0.631 2.255 -4.458 1.00 0.00 H new ATOM 0 HB THR A 142 2.170 4.722 -3.715 1.00 0.00 H new ATOM 0 HG1 THR A 142 2.067 3.977 -1.539 1.00 0.00 H new ATOM 0 HG21 THR A 142 0.199 5.260 -2.319 1.00 0.00 H new ATOM 0 HG22 THR A 142 -0.207 5.109 -4.045 1.00 0.00 H new ATOM 0 HG23 THR A 142 -0.603 3.789 -2.920 1.00 0.00 H new ATOM 2291 N TYR A 143 0.044 3.669 -6.416 1.00 0.00 N ATOM 2292 CA TYR A 143 -0.274 4.345 -7.669 1.00 0.00 C ATOM 2293 C TYR A 143 -1.215 5.520 -7.429 1.00 0.00 C ATOM 2294 O TYR A 143 -2.308 5.353 -6.888 1.00 0.00 O ATOM 2295 CB TYR A 143 -0.906 3.363 -8.657 1.00 0.00 C ATOM 2296 CG TYR A 143 -0.685 3.734 -10.106 1.00 0.00 C ATOM 2297 CD1 TYR A 143 -1.063 4.981 -10.590 1.00 0.00 C ATOM 2298 CD2 TYR A 143 -0.099 2.837 -10.991 1.00 0.00 C ATOM 2299 CE1 TYR A 143 -0.863 5.323 -11.914 1.00 0.00 C ATOM 2300 CE2 TYR A 143 0.106 3.172 -12.315 1.00 0.00 C ATOM 2301 CZ TYR A 143 -0.277 4.416 -12.772 1.00 0.00 C ATOM 2302 OH TYR A 143 -0.076 4.753 -14.091 1.00 0.00 O ATOM 0 H TYR A 143 -0.745 3.187 -5.985 1.00 0.00 H new ATOM 0 HA TYR A 143 0.655 4.727 -8.092 1.00 0.00 H new ATOM 0 HB2 TYR A 143 -0.497 2.368 -8.479 1.00 0.00 H new ATOM 0 HB3 TYR A 143 -1.977 3.306 -8.465 1.00 0.00 H new ATOM 0 HD1 TYR A 143 -1.520 5.694 -9.920 1.00 0.00 H new ATOM 0 HD2 TYR A 143 0.201 1.862 -10.637 1.00 0.00 H new ATOM 0 HE1 TYR A 143 -1.164 6.295 -12.275 1.00 0.00 H new ATOM 0 HE2 TYR A 143 0.564 2.464 -12.989 1.00 0.00 H new ATOM 0 HH TYR A 143 0.348 4.004 -14.559 1.00 0.00 H new ATOM 2312 N ILE A 144 -0.783 6.710 -7.835 1.00 0.00 N ATOM 2313 CA ILE A 144 -1.587 7.914 -7.663 1.00 0.00 C ATOM 2314 C ILE A 144 -2.274 8.307 -8.970 1.00 0.00 C ATOM 2315 O ILE A 144 -1.657 8.913 -9.845 1.00 0.00 O ATOM 2316 CB ILE A 144 -0.729 9.095 -7.175 1.00 0.00 C ATOM 2317 CG1 ILE A 144 0.131 8.671 -5.982 1.00 0.00 C ATOM 2318 CG2 ILE A 144 -1.614 10.276 -6.804 1.00 0.00 C ATOM 2319 CD1 ILE A 144 1.528 8.236 -6.369 1.00 0.00 C ATOM 0 H ILE A 144 0.119 6.866 -8.285 1.00 0.00 H new ATOM 0 HA ILE A 144 -2.342 7.686 -6.911 1.00 0.00 H new ATOM 0 HB ILE A 144 -0.067 9.403 -7.985 1.00 0.00 H new ATOM 0 HG12 ILE A 144 0.199 9.502 -5.280 1.00 0.00 H new ATOM 0 HG13 ILE A 144 -0.364 7.852 -5.460 1.00 0.00 H new ATOM 0 HG21 ILE A 144 -0.992 11.103 -6.461 1.00 0.00 H new ATOM 0 HG22 ILE A 144 -2.186 10.590 -7.677 1.00 0.00 H new ATOM 0 HG23 ILE A 144 -2.298 9.982 -6.008 1.00 0.00 H new ATOM 0 HD11 ILE A 144 2.081 7.950 -5.474 1.00 0.00 H new ATOM 0 HD12 ILE A 144 1.469 7.385 -7.047 1.00 0.00 H new ATOM 0 HD13 ILE A 144 2.041 9.060 -6.864 1.00 0.00 H new ATOM 2331 N PRO A 145 -3.568 7.967 -9.121 1.00 0.00 N ATOM 2332 CA PRO A 145 -4.330 8.291 -10.330 1.00 0.00 C ATOM 2333 C PRO A 145 -4.686 9.772 -10.411 1.00 0.00 C ATOM 2334 O PRO A 145 -5.273 10.331 -9.484 1.00 0.00 O ATOM 2335 CB PRO A 145 -5.595 7.445 -10.184 1.00 0.00 C ATOM 2336 CG PRO A 145 -5.773 7.285 -8.715 1.00 0.00 C ATOM 2337 CD PRO A 145 -4.387 7.241 -8.130 1.00 0.00 C ATOM 0 HA PRO A 145 -3.764 8.085 -11.238 1.00 0.00 H new ATOM 0 HB2 PRO A 145 -6.456 7.938 -10.636 1.00 0.00 H new ATOM 0 HB3 PRO A 145 -5.485 6.479 -10.677 1.00 0.00 H new ATOM 0 HG2 PRO A 145 -6.346 8.114 -8.299 1.00 0.00 H new ATOM 0 HG3 PRO A 145 -6.322 6.372 -8.486 1.00 0.00 H new ATOM 0 HD2 PRO A 145 -4.350 7.720 -7.151 1.00 0.00 H new ATOM 0 HD3 PRO A 145 -4.040 6.216 -7.997 1.00 0.00 H new ATOM 2345 N GLY A 146 -4.326 10.402 -11.523 1.00 0.00 N ATOM 2346 CA GLY A 146 -4.615 11.813 -11.703 1.00 0.00 C ATOM 2347 C GLY A 146 -4.436 12.264 -13.140 1.00 0.00 C ATOM 2348 O GLY A 146 -3.945 11.508 -13.979 1.00 0.00 O ATOM 0 H GLY A 146 -3.839 9.961 -12.303 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -5.639 12.014 -11.387 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -3.961 12.400 -11.057 1.00 0.00 H new ATOM 2352 N THR A 147 -4.835 13.500 -13.424 1.00 0.00 N ATOM 2353 CA THR A 147 -4.717 14.051 -14.768 1.00 0.00 C ATOM 2354 C THR A 147 -3.572 15.057 -14.845 1.00 0.00 C ATOM 2355 O THR A 147 -3.794 16.267 -14.834 1.00 0.00 O ATOM 2356 CB THR A 147 -6.027 14.719 -15.186 1.00 0.00 C ATOM 2357 OG1 THR A 147 -5.843 15.500 -16.354 1.00 0.00 O ATOM 2358 CG2 THR A 147 -6.605 15.622 -14.117 1.00 0.00 C ATOM 0 H THR A 147 -5.243 14.138 -12.741 1.00 0.00 H new ATOM 0 HA THR A 147 -4.502 13.230 -15.452 1.00 0.00 H new ATOM 0 HB THR A 147 -6.724 13.900 -15.365 1.00 0.00 H new ATOM 0 HG1 THR A 147 -5.209 16.224 -16.167 1.00 0.00 H new ATOM 0 HG21 THR A 147 -7.534 16.064 -14.478 1.00 0.00 H new ATOM 0 HG22 THR A 147 -6.806 15.039 -13.218 1.00 0.00 H new ATOM 0 HG23 THR A 147 -5.892 16.413 -13.885 1.00 0.00 H new ATOM 2366 N TYR A 148 -2.347 14.547 -14.921 1.00 0.00 N ATOM 2367 CA TYR A 148 -1.167 15.400 -14.999 1.00 0.00 C ATOM 2368 C TYR A 148 -0.639 15.471 -16.428 1.00 0.00 C ATOM 2369 O TYR A 148 -1.207 14.870 -17.340 1.00 0.00 O ATOM 2370 CB TYR A 148 -0.075 14.880 -14.064 1.00 0.00 C ATOM 2371 CG TYR A 148 -0.101 15.513 -12.690 1.00 0.00 C ATOM 2372 CD1 TYR A 148 -1.278 15.572 -11.955 1.00 0.00 C ATOM 2373 CD2 TYR A 148 1.051 16.050 -12.130 1.00 0.00 C ATOM 2374 CE1 TYR A 148 -1.306 16.149 -10.699 1.00 0.00 C ATOM 2375 CE2 TYR A 148 1.031 16.628 -10.874 1.00 0.00 C ATOM 2376 CZ TYR A 148 -0.150 16.676 -10.164 1.00 0.00 C ATOM 2377 OH TYR A 148 -0.174 17.251 -8.914 1.00 0.00 O ATOM 0 H TYR A 148 -2.146 13.547 -14.930 1.00 0.00 H new ATOM 0 HA TYR A 148 -1.454 16.404 -14.688 1.00 0.00 H new ATOM 0 HB2 TYR A 148 -0.182 13.800 -13.959 1.00 0.00 H new ATOM 0 HB3 TYR A 148 0.898 15.061 -14.520 1.00 0.00 H new ATOM 0 HD1 TYR A 148 -2.186 15.161 -12.371 1.00 0.00 H new ATOM 0 HD2 TYR A 148 1.977 16.016 -12.684 1.00 0.00 H new ATOM 0 HE1 TYR A 148 -2.229 16.187 -10.140 1.00 0.00 H new ATOM 0 HE2 TYR A 148 1.936 17.040 -10.451 1.00 0.00 H new ATOM 0 HH TYR A 148 0.723 17.572 -8.684 1.00 0.00 H new ATOM 2387 N ASN A 149 0.450 16.208 -16.616 1.00 0.00 N ATOM 2388 CA ASN A 149 1.055 16.358 -17.934 1.00 0.00 C ATOM 2389 C ASN A 149 1.754 15.071 -18.361 1.00 0.00 C ATOM 2390 O ASN A 149 1.766 14.722 -19.541 1.00 0.00 O ATOM 2391 CB ASN A 149 2.052 17.517 -17.932 1.00 0.00 C ATOM 2392 CG ASN A 149 1.408 18.834 -18.316 1.00 0.00 C ATOM 2393 OD1 ASN A 149 1.769 19.447 -19.321 1.00 0.00 O ATOM 2394 ND2 ASN A 149 0.447 19.279 -17.515 1.00 0.00 N ATOM 0 H ASN A 149 0.932 16.711 -15.871 1.00 0.00 H new ATOM 0 HA ASN A 149 0.261 16.573 -18.649 1.00 0.00 H new ATOM 0 HB2 ASN A 149 2.497 17.608 -16.941 1.00 0.00 H new ATOM 0 HB3 ASN A 149 2.863 17.296 -18.626 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -0.023 20.160 -17.723 1.00 0.00 H new ATOM 0 HD22 ASN A 149 0.178 18.740 -16.692 1.00 0.00 H new ATOM 2401 N ASN A 150 2.336 14.371 -17.393 1.00 0.00 N ATOM 2402 CA ASN A 150 3.038 13.122 -17.669 1.00 0.00 C ATOM 2403 C ASN A 150 2.230 11.925 -17.181 1.00 0.00 C ATOM 2404 O ASN A 150 2.040 10.952 -17.911 1.00 0.00 O ATOM 2405 CB ASN A 150 4.414 13.128 -17.002 1.00 0.00 C ATOM 2406 CG ASN A 150 5.434 12.313 -17.774 1.00 0.00 C ATOM 2407 OD1 ASN A 150 5.351 11.086 -17.828 1.00 0.00 O ATOM 2408 ND2 ASN A 150 6.403 12.992 -18.375 1.00 0.00 N ATOM 0 H ASN A 150 2.336 14.647 -16.411 1.00 0.00 H new ATOM 0 HA ASN A 150 3.165 13.037 -18.748 1.00 0.00 H new ATOM 0 HB2 ASN A 150 4.767 14.155 -16.912 1.00 0.00 H new ATOM 0 HB3 ASN A 150 4.326 12.731 -15.991 1.00 0.00 H new ATOM 0 HD21 ASN A 150 7.118 12.497 -18.908 1.00 0.00 H new ATOM 0 HD22 ASN A 150 6.433 14.009 -18.304 1.00 0.00 H new ATOM 2415 N GLY A 151 1.754 12.002 -15.942 1.00 0.00 N ATOM 2416 CA GLY A 151 0.972 10.919 -15.378 1.00 0.00 C ATOM 2417 C GLY A 151 1.798 9.669 -15.141 1.00 0.00 C ATOM 2418 O GLY A 151 1.296 8.551 -15.266 1.00 0.00 O ATOM 0 H GLY A 151 1.897 12.797 -15.319 1.00 0.00 H new ATOM 0 HA2 GLY A 151 0.533 11.245 -14.435 1.00 0.00 H new ATOM 0 HA3 GLY A 151 0.146 10.683 -16.049 1.00 0.00 H new ATOM 2422 N ASN A 152 3.068 9.858 -14.796 1.00 0.00 N ATOM 2423 CA ASN A 152 3.965 8.737 -14.540 1.00 0.00 C ATOM 2424 C ASN A 152 4.673 8.904 -13.200 1.00 0.00 C ATOM 2425 O ASN A 152 5.735 9.521 -13.119 1.00 0.00 O ATOM 2426 CB ASN A 152 4.995 8.614 -15.666 1.00 0.00 C ATOM 2427 CG ASN A 152 4.734 7.419 -16.561 1.00 0.00 C ATOM 2428 OD1 ASN A 152 5.602 6.566 -16.748 1.00 0.00 O ATOM 2429 ND2 ASN A 152 3.531 7.349 -17.121 1.00 0.00 N ATOM 0 H ASN A 152 3.499 10.776 -14.687 1.00 0.00 H new ATOM 0 HA ASN A 152 3.369 7.825 -14.503 1.00 0.00 H new ATOM 0 HB2 ASN A 152 4.983 9.524 -16.267 1.00 0.00 H new ATOM 0 HB3 ASN A 152 5.992 8.530 -15.235 1.00 0.00 H new ATOM 0 HD21 ASN A 152 3.298 6.567 -17.732 1.00 0.00 H new ATOM 0 HD22 ASN A 152 2.841 8.078 -16.939 1.00 0.00 H new ATOM 2436 N VAL A 153 4.078 8.349 -12.149 1.00 0.00 N ATOM 2437 CA VAL A 153 4.651 8.436 -10.811 1.00 0.00 C ATOM 2438 C VAL A 153 4.528 7.108 -10.072 1.00 0.00 C ATOM 2439 O VAL A 153 3.461 6.495 -10.051 1.00 0.00 O ATOM 2440 CB VAL A 153 3.972 9.538 -9.979 1.00 0.00 C ATOM 2441 CG1 VAL A 153 4.349 10.915 -10.504 1.00 0.00 C ATOM 2442 CG2 VAL A 153 2.461 9.354 -9.983 1.00 0.00 C ATOM 0 H VAL A 153 3.199 7.834 -12.198 1.00 0.00 H new ATOM 0 HA VAL A 153 5.705 8.683 -10.935 1.00 0.00 H new ATOM 0 HB VAL A 153 4.323 9.459 -8.950 1.00 0.00 H new ATOM 0 HG11 VAL A 153 3.859 11.680 -9.902 1.00 0.00 H new ATOM 0 HG12 VAL A 153 5.430 11.044 -10.445 1.00 0.00 H new ATOM 0 HG13 VAL A 153 4.029 11.009 -11.542 1.00 0.00 H new ATOM 0 HG21 VAL A 153 1.997 10.142 -9.390 1.00 0.00 H new ATOM 0 HG22 VAL A 153 2.091 9.405 -11.007 1.00 0.00 H new ATOM 0 HG23 VAL A 153 2.212 8.383 -9.555 1.00 0.00 H new ATOM 2452 N TYR A 154 5.626 6.670 -9.465 1.00 0.00 N ATOM 2453 CA TYR A 154 5.641 5.415 -8.723 1.00 0.00 C ATOM 2454 C TYR A 154 6.113 5.637 -7.289 1.00 0.00 C ATOM 2455 O TYR A 154 7.110 6.317 -7.052 1.00 0.00 O ATOM 2456 CB TYR A 154 6.549 4.398 -9.418 1.00 0.00 C ATOM 2457 CG TYR A 154 6.200 4.169 -10.872 1.00 0.00 C ATOM 2458 CD1 TYR A 154 6.583 5.077 -11.850 1.00 0.00 C ATOM 2459 CD2 TYR A 154 5.489 3.042 -11.266 1.00 0.00 C ATOM 2460 CE1 TYR A 154 6.267 4.871 -13.179 1.00 0.00 C ATOM 2461 CE2 TYR A 154 5.168 2.828 -12.593 1.00 0.00 C ATOM 2462 CZ TYR A 154 5.560 3.746 -13.546 1.00 0.00 C ATOM 2463 OH TYR A 154 5.243 3.537 -14.868 1.00 0.00 O ATOM 0 H TYR A 154 6.517 7.166 -9.472 1.00 0.00 H new ATOM 0 HA TYR A 154 4.623 5.025 -8.696 1.00 0.00 H new ATOM 0 HB2 TYR A 154 7.582 4.740 -9.350 1.00 0.00 H new ATOM 0 HB3 TYR A 154 6.492 3.449 -8.885 1.00 0.00 H new ATOM 0 HD1 TYR A 154 7.137 5.960 -11.567 1.00 0.00 H new ATOM 0 HD2 TYR A 154 5.182 2.321 -10.523 1.00 0.00 H new ATOM 0 HE1 TYR A 154 6.572 5.588 -13.927 1.00 0.00 H new ATOM 0 HE2 TYR A 154 4.614 1.948 -12.883 1.00 0.00 H new ATOM 0 HH TYR A 154 4.744 2.698 -14.956 1.00 0.00 H new ATOM 2473 N PHE A 155 5.388 5.059 -6.338 1.00 0.00 N ATOM 2474 CA PHE A 155 5.732 5.195 -4.927 1.00 0.00 C ATOM 2475 C PHE A 155 6.362 3.911 -4.393 1.00 0.00 C ATOM 2476 O PHE A 155 5.931 2.809 -4.732 1.00 0.00 O ATOM 2477 CB PHE A 155 4.487 5.549 -4.108 1.00 0.00 C ATOM 2478 CG PHE A 155 4.641 6.801 -3.292 1.00 0.00 C ATOM 2479 CD1 PHE A 155 5.176 7.948 -3.855 1.00 0.00 C ATOM 2480 CD2 PHE A 155 4.251 6.829 -1.964 1.00 0.00 C ATOM 2481 CE1 PHE A 155 5.319 9.101 -3.107 1.00 0.00 C ATOM 2482 CE2 PHE A 155 4.391 7.980 -1.210 1.00 0.00 C ATOM 2483 CZ PHE A 155 4.926 9.117 -1.784 1.00 0.00 C ATOM 0 H PHE A 155 4.559 4.492 -6.518 1.00 0.00 H new ATOM 0 HA PHE A 155 6.460 6.000 -4.832 1.00 0.00 H new ATOM 0 HB2 PHE A 155 3.639 5.667 -4.783 1.00 0.00 H new ATOM 0 HB3 PHE A 155 4.251 4.718 -3.443 1.00 0.00 H new ATOM 0 HD1 PHE A 155 5.485 7.941 -4.890 1.00 0.00 H new ATOM 0 HD2 PHE A 155 3.833 5.942 -1.512 1.00 0.00 H new ATOM 0 HE1 PHE A 155 5.738 9.989 -3.557 1.00 0.00 H new ATOM 0 HE2 PHE A 155 4.083 7.990 -0.175 1.00 0.00 H new ATOM 0 HZ PHE A 155 5.037 10.017 -1.198 1.00 0.00 H new ATOM 2493 N ALA A 156 7.385 4.063 -3.558 1.00 0.00 N ATOM 2494 CA ALA A 156 8.074 2.918 -2.977 1.00 0.00 C ATOM 2495 C ALA A 156 7.967 2.924 -1.456 1.00 0.00 C ATOM 2496 O ALA A 156 8.117 3.965 -0.817 1.00 0.00 O ATOM 2497 CB ALA A 156 9.534 2.911 -3.404 1.00 0.00 C ATOM 0 H ALA A 156 7.755 4.969 -3.269 1.00 0.00 H new ATOM 0 HA ALA A 156 7.593 2.012 -3.344 1.00 0.00 H new ATOM 0 HB1 ALA A 156 10.038 2.051 -2.963 1.00 0.00 H new ATOM 0 HB2 ALA A 156 9.595 2.850 -4.491 1.00 0.00 H new ATOM 0 HB3 ALA A 156 10.017 3.827 -3.064 1.00 0.00 H new ATOM 2503 N TRP A 157 7.704 1.755 -0.882 1.00 0.00 N ATOM 2504 CA TRP A 157 7.576 1.624 0.564 1.00 0.00 C ATOM 2505 C TRP A 157 8.005 0.235 1.025 1.00 0.00 C ATOM 2506 O TRP A 157 7.420 -0.771 0.624 1.00 0.00 O ATOM 2507 CB TRP A 157 6.133 1.898 0.996 1.00 0.00 C ATOM 2508 CG TRP A 157 5.950 3.241 1.635 1.00 0.00 C ATOM 2509 CD1 TRP A 157 6.816 3.872 2.481 1.00 0.00 C ATOM 2510 CD2 TRP A 157 4.828 4.119 1.480 1.00 0.00 C ATOM 2511 NE1 TRP A 157 6.302 5.088 2.861 1.00 0.00 N ATOM 2512 CE2 TRP A 157 5.083 5.262 2.259 1.00 0.00 C ATOM 2513 CE3 TRP A 157 3.634 4.049 0.756 1.00 0.00 C ATOM 2514 CZ2 TRP A 157 4.187 6.326 2.336 1.00 0.00 C ATOM 2515 CZ3 TRP A 157 2.746 5.105 0.834 1.00 0.00 C ATOM 2516 CH2 TRP A 157 3.026 6.231 1.618 1.00 0.00 C ATOM 0 H TRP A 157 7.575 0.884 -1.397 1.00 0.00 H new ATOM 0 HA TRP A 157 8.232 2.359 1.031 1.00 0.00 H new ATOM 0 HB2 TRP A 157 5.481 1.826 0.126 1.00 0.00 H new ATOM 0 HB3 TRP A 157 5.818 1.124 1.696 1.00 0.00 H new ATOM 0 HD1 TRP A 157 7.766 3.473 2.804 1.00 0.00 H new ATOM 0 HE1 TRP A 157 6.754 5.753 3.489 1.00 0.00 H new ATOM 0 HE3 TRP A 157 3.410 3.186 0.147 1.00 0.00 H new ATOM 0 HZ2 TRP A 157 4.401 7.195 2.941 1.00 0.00 H new ATOM 0 HZ3 TRP A 157 1.820 5.061 0.280 1.00 0.00 H new ATOM 0 HH2 TRP A 157 2.312 7.040 1.657 1.00 0.00 H new ATOM 2527 N MET A 158 9.031 0.187 1.869 1.00 0.00 N ATOM 2528 CA MET A 158 9.539 -1.080 2.383 1.00 0.00 C ATOM 2529 C MET A 158 8.899 -1.419 3.724 1.00 0.00 C ATOM 2530 O MET A 158 8.676 -0.542 4.558 1.00 0.00 O ATOM 2531 CB MET A 158 11.061 -1.018 2.532 1.00 0.00 C ATOM 2532 CG MET A 158 11.753 -2.344 2.250 1.00 0.00 C ATOM 2533 SD MET A 158 12.988 -2.764 3.495 1.00 0.00 S ATOM 2534 CE MET A 158 14.496 -2.618 2.540 1.00 0.00 C ATOM 0 H MET A 158 9.527 1.010 2.211 1.00 0.00 H new ATOM 0 HA MET A 158 9.281 -1.863 1.670 1.00 0.00 H new ATOM 0 HB2 MET A 158 11.454 -0.261 1.854 1.00 0.00 H new ATOM 0 HB3 MET A 158 11.306 -0.697 3.544 1.00 0.00 H new ATOM 0 HG2 MET A 158 11.006 -3.136 2.204 1.00 0.00 H new ATOM 0 HG3 MET A 158 12.231 -2.299 1.271 1.00 0.00 H new ATOM 0 HE1 MET A 158 15.352 -2.848 3.174 1.00 0.00 H new ATOM 0 HE2 MET A 158 14.466 -3.316 1.703 1.00 0.00 H new ATOM 0 HE3 MET A 158 14.589 -1.601 2.160 1.00 0.00 H new ATOM 2544 N ARG A 159 8.606 -2.700 3.926 1.00 0.00 N ATOM 2545 CA ARG A 159 7.991 -3.158 5.167 1.00 0.00 C ATOM 2546 C ARG A 159 8.527 -4.530 5.564 1.00 0.00 C ATOM 2547 O ARG A 159 8.963 -5.306 4.714 1.00 0.00 O ATOM 2548 CB ARG A 159 6.470 -3.213 5.019 1.00 0.00 C ATOM 2549 CG ARG A 159 5.993 -4.244 4.008 1.00 0.00 C ATOM 2550 CD ARG A 159 5.569 -3.592 2.702 1.00 0.00 C ATOM 2551 NE ARG A 159 4.833 -4.517 1.842 1.00 0.00 N ATOM 2552 CZ ARG A 159 3.589 -4.924 2.085 1.00 0.00 C ATOM 2553 NH1 ARG A 159 2.939 -4.490 3.158 1.00 0.00 N ATOM 2554 NH2 ARG A 159 2.993 -5.767 1.253 1.00 0.00 N ATOM 0 H ARG A 159 8.785 -3.439 3.246 1.00 0.00 H new ATOM 0 HA ARG A 159 8.245 -2.447 5.953 1.00 0.00 H new ATOM 0 HB2 ARG A 159 6.027 -3.436 5.990 1.00 0.00 H new ATOM 0 HB3 ARG A 159 6.107 -2.229 4.721 1.00 0.00 H new ATOM 0 HG2 ARG A 159 6.791 -4.961 3.815 1.00 0.00 H new ATOM 0 HG3 ARG A 159 5.155 -4.803 4.425 1.00 0.00 H new ATOM 0 HD2 ARG A 159 4.947 -2.723 2.916 1.00 0.00 H new ATOM 0 HD3 ARG A 159 6.451 -3.230 2.174 1.00 0.00 H new ATOM 0 HE ARG A 159 5.300 -4.871 1.007 1.00 0.00 H new ATOM 0 HH11 ARG A 159 3.393 -3.841 3.801 1.00 0.00 H new ATOM 0 HH12 ARG A 159 1.986 -4.805 3.339 1.00 0.00 H new ATOM 0 HH21 ARG A 159 3.488 -6.104 0.427 1.00 0.00 H new ATOM 0 HH22 ARG A 159 2.040 -6.079 1.439 1.00 0.00 H new ATOM 2568 N PHE A 160 8.489 -4.822 6.860 1.00 0.00 N ATOM 2569 CA PHE A 160 8.971 -6.101 7.368 1.00 0.00 C ATOM 2570 C PHE A 160 8.015 -6.665 8.415 1.00 0.00 C ATOM 2571 O PHE A 160 7.638 -5.974 9.361 1.00 0.00 O ATOM 2572 CB PHE A 160 10.369 -5.943 7.968 1.00 0.00 C ATOM 2573 CG PHE A 160 11.179 -7.207 7.945 1.00 0.00 C ATOM 2574 CD1 PHE A 160 10.829 -8.285 8.744 1.00 0.00 C ATOM 2575 CD2 PHE A 160 12.291 -7.319 7.126 1.00 0.00 C ATOM 2576 CE1 PHE A 160 11.572 -9.450 8.725 1.00 0.00 C ATOM 2577 CE2 PHE A 160 13.038 -8.481 7.103 1.00 0.00 C ATOM 2578 CZ PHE A 160 12.678 -9.548 7.904 1.00 0.00 C ATOM 0 H PHE A 160 8.130 -4.191 7.577 1.00 0.00 H new ATOM 0 HA PHE A 160 9.020 -6.800 6.533 1.00 0.00 H new ATOM 0 HB2 PHE A 160 10.905 -5.168 7.420 1.00 0.00 H new ATOM 0 HB3 PHE A 160 10.276 -5.599 8.998 1.00 0.00 H new ATOM 0 HD1 PHE A 160 9.966 -8.213 9.389 1.00 0.00 H new ATOM 0 HD2 PHE A 160 12.577 -6.488 6.498 1.00 0.00 H new ATOM 0 HE1 PHE A 160 11.288 -10.283 9.351 1.00 0.00 H new ATOM 0 HE2 PHE A 160 13.902 -8.555 6.460 1.00 0.00 H new ATOM 0 HZ PHE A 160 13.261 -10.457 7.888 1.00 0.00 H new ATOM 2588 N GLN A 161 7.629 -7.925 8.238 1.00 0.00 N ATOM 2589 CA GLN A 161 6.718 -8.582 9.167 1.00 0.00 C ATOM 2590 C GLN A 161 7.440 -8.971 10.453 1.00 0.00 C ATOM 2591 O GLN A 161 8.487 -9.618 10.417 1.00 0.00 O ATOM 2592 CB GLN A 161 6.104 -9.824 8.518 1.00 0.00 C ATOM 2593 CG GLN A 161 7.126 -10.891 8.158 1.00 0.00 C ATOM 2594 CD GLN A 161 6.727 -11.688 6.932 1.00 0.00 C ATOM 2595 OE1 GLN A 161 6.659 -12.917 6.971 1.00 0.00 O ATOM 2596 NE2 GLN A 161 6.464 -10.991 5.833 1.00 0.00 N ATOM 0 H GLN A 161 7.933 -8.510 7.460 1.00 0.00 H new ATOM 0 HA GLN A 161 5.923 -7.879 9.416 1.00 0.00 H new ATOM 0 HB2 GLN A 161 5.368 -10.253 9.198 1.00 0.00 H new ATOM 0 HB3 GLN A 161 5.569 -9.526 7.616 1.00 0.00 H new ATOM 0 HG2 GLN A 161 8.092 -10.419 7.982 1.00 0.00 H new ATOM 0 HG3 GLN A 161 7.252 -11.569 9.003 1.00 0.00 H new ATOM 0 HE21 GLN A 161 6.533 -9.973 5.846 1.00 0.00 H new ATOM 0 HE22 GLN A 161 6.193 -11.473 4.976 1.00 0.00 H new ATOM 2605 N PHE A 162 6.874 -8.573 11.588 1.00 0.00 N ATOM 2606 CA PHE A 162 7.466 -8.880 12.885 1.00 0.00 C ATOM 2607 C PHE A 162 6.467 -9.607 13.779 1.00 0.00 C ATOM 2608 O PHE A 162 5.263 -9.353 13.719 1.00 0.00 O ATOM 2609 CB PHE A 162 7.939 -7.596 13.570 1.00 0.00 C ATOM 2610 CG PHE A 162 9.160 -7.788 14.422 1.00 0.00 C ATOM 2611 CD1 PHE A 162 10.393 -8.042 13.843 1.00 0.00 C ATOM 2612 CD2 PHE A 162 9.076 -7.713 15.803 1.00 0.00 C ATOM 2613 CE1 PHE A 162 11.519 -8.220 14.626 1.00 0.00 C ATOM 2614 CE2 PHE A 162 10.197 -7.889 16.591 1.00 0.00 C ATOM 2615 CZ PHE A 162 11.421 -8.142 16.001 1.00 0.00 C ATOM 0 H PHE A 162 6.007 -8.038 11.636 1.00 0.00 H new ATOM 0 HA PHE A 162 8.323 -9.533 12.720 1.00 0.00 H new ATOM 0 HB2 PHE A 162 8.151 -6.844 12.809 1.00 0.00 H new ATOM 0 HB3 PHE A 162 7.131 -7.205 14.189 1.00 0.00 H new ATOM 0 HD1 PHE A 162 10.476 -8.102 12.768 1.00 0.00 H new ATOM 0 HD2 PHE A 162 8.122 -7.514 16.269 1.00 0.00 H new ATOM 0 HE1 PHE A 162 12.474 -8.420 14.162 1.00 0.00 H new ATOM 0 HE2 PHE A 162 10.117 -7.829 17.666 1.00 0.00 H new ATOM 0 HZ PHE A 162 12.299 -8.278 16.614 1.00 0.00 H new ATOM 2625 N LEU A 163 6.974 -10.513 14.608 1.00 0.00 N ATOM 2626 CA LEU A 163 6.127 -11.279 15.516 1.00 0.00 C ATOM 2627 C LEU A 163 6.339 -10.838 16.960 1.00 0.00 C ATOM 2628 O LEU A 163 7.380 -10.277 17.302 1.00 0.00 O ATOM 2629 CB LEU A 163 6.419 -12.775 15.380 1.00 0.00 C ATOM 2630 CG LEU A 163 5.198 -13.689 15.522 1.00 0.00 C ATOM 2631 CD1 LEU A 163 4.787 -14.249 14.168 1.00 0.00 C ATOM 2632 CD2 LEU A 163 5.485 -14.818 16.501 1.00 0.00 C ATOM 0 H LEU A 163 7.968 -10.735 14.670 1.00 0.00 H new ATOM 0 HA LEU A 163 5.087 -11.092 15.247 1.00 0.00 H new ATOM 0 HB2 LEU A 163 6.876 -12.953 14.407 1.00 0.00 H new ATOM 0 HB3 LEU A 163 7.154 -13.056 16.134 1.00 0.00 H new ATOM 0 HG LEU A 163 4.371 -13.096 15.914 1.00 0.00 H new ATOM 0 HD11 LEU A 163 3.918 -14.896 14.290 1.00 0.00 H new ATOM 0 HD12 LEU A 163 4.537 -13.428 13.496 1.00 0.00 H new ATOM 0 HD13 LEU A 163 5.611 -14.825 13.747 1.00 0.00 H new ATOM 0 HD21 LEU A 163 4.606 -15.456 16.588 1.00 0.00 H new ATOM 0 HD22 LEU A 163 6.327 -15.408 16.139 1.00 0.00 H new ATOM 0 HD23 LEU A 163 5.728 -14.400 17.478 1.00 0.00 H new ATOM 2644 N GLU A 164 5.345 -11.097 17.805 1.00 0.00 N ATOM 2645 CA GLU A 164 5.423 -10.728 19.214 1.00 0.00 C ATOM 2646 C GLU A 164 5.657 -11.957 20.084 1.00 0.00 C ATOM 2647 O GLU A 164 5.116 -13.031 19.819 1.00 0.00 O ATOM 2648 CB GLU A 164 4.140 -10.017 19.647 1.00 0.00 C ATOM 2649 CG GLU A 164 4.378 -8.869 20.615 1.00 0.00 C ATOM 2650 CD GLU A 164 4.931 -7.634 19.930 1.00 0.00 C ATOM 2651 OE1 GLU A 164 4.188 -7.007 19.146 1.00 0.00 O ATOM 2652 OE2 GLU A 164 6.108 -7.295 20.178 1.00 0.00 O ATOM 0 H GLU A 164 4.477 -11.561 17.538 1.00 0.00 H new ATOM 0 HA GLU A 164 6.266 -10.049 19.342 1.00 0.00 H new ATOM 0 HB2 GLU A 164 3.630 -9.636 18.763 1.00 0.00 H new ATOM 0 HB3 GLU A 164 3.472 -10.742 20.113 1.00 0.00 H new ATOM 0 HG2 GLU A 164 3.441 -8.616 21.111 1.00 0.00 H new ATOM 0 HG3 GLU A 164 5.072 -9.191 21.391 1.00 0.00 H new ATOM 2660 N HIS A 165 6.467 -11.794 21.125 1.00 0.00 N ATOM 2661 CA HIS A 165 6.774 -12.891 22.035 1.00 0.00 C ATOM 2662 C HIS A 165 6.375 -12.541 23.466 1.00 0.00 C ATOM 2663 O HIS A 165 6.333 -11.368 23.839 1.00 0.00 O ATOM 2664 CB HIS A 165 8.266 -13.228 21.976 1.00 0.00 C ATOM 2665 CG HIS A 165 8.575 -14.431 21.141 1.00 0.00 C ATOM 2666 ND1 HIS A 165 9.465 -15.410 21.530 1.00 0.00 N ATOM 2667 CD2 HIS A 165 8.106 -14.813 19.929 1.00 0.00 C ATOM 2668 CE1 HIS A 165 9.531 -16.340 20.594 1.00 0.00 C ATOM 2669 NE2 HIS A 165 8.716 -16.002 19.613 1.00 0.00 N ATOM 0 H HIS A 165 6.923 -10.912 21.359 1.00 0.00 H new ATOM 0 HA HIS A 165 6.199 -13.762 21.721 1.00 0.00 H new ATOM 0 HB2 HIS A 165 8.808 -12.370 21.578 1.00 0.00 H new ATOM 0 HB3 HIS A 165 8.633 -13.395 22.989 1.00 0.00 H new ATOM 0 HD2 HIS A 165 7.386 -14.281 19.324 1.00 0.00 H new ATOM 0 HE1 HIS A 165 10.147 -17.226 20.626 1.00 0.00 H new ATOM 0 HE2 HIS A 165 8.564 -16.537 18.758 1.00 0.00 H new ATOM 2678 N HIS A 166 6.085 -13.564 24.262 1.00 0.00 N ATOM 2679 CA HIS A 166 5.691 -13.365 25.651 1.00 0.00 C ATOM 2680 C HIS A 166 6.908 -13.391 26.569 1.00 0.00 C ATOM 2681 O HIS A 166 7.901 -14.060 26.281 1.00 0.00 O ATOM 2682 CB HIS A 166 4.692 -14.441 26.079 1.00 0.00 C ATOM 2683 CG HIS A 166 3.559 -14.623 25.117 1.00 0.00 C ATOM 2684 ND1 HIS A 166 3.654 -15.399 23.980 1.00 0.00 N ATOM 2685 CD2 HIS A 166 2.300 -14.125 25.126 1.00 0.00 C ATOM 2686 CE1 HIS A 166 2.502 -15.369 23.332 1.00 0.00 C ATOM 2687 NE2 HIS A 166 1.665 -14.604 24.006 1.00 0.00 N ATOM 0 H HIS A 166 6.116 -14.540 23.968 1.00 0.00 H new ATOM 0 HA HIS A 166 5.217 -12.387 25.732 1.00 0.00 H new ATOM 0 HB2 HIS A 166 5.218 -15.389 26.192 1.00 0.00 H new ATOM 0 HB3 HIS A 166 4.289 -14.182 27.058 1.00 0.00 H new ATOM 0 HD2 HIS A 166 1.874 -13.473 25.874 1.00 0.00 H new ATOM 0 HE1 HIS A 166 2.283 -15.883 22.408 1.00 0.00 H new ATOM 0 HE2 HIS A 166 0.702 -14.401 23.739 1.00 0.00 H new ATOM 2696 N HIS A 167 6.826 -12.658 27.674 1.00 0.00 N ATOM 2697 CA HIS A 167 7.924 -12.597 28.633 1.00 0.00 C ATOM 2698 C HIS A 167 7.597 -13.401 29.888 1.00 0.00 C ATOM 2699 O HIS A 167 6.551 -13.209 30.506 1.00 0.00 O ATOM 2700 CB HIS A 167 8.221 -11.144 29.008 1.00 0.00 C ATOM 2701 CG HIS A 167 8.999 -10.405 27.965 1.00 0.00 C ATOM 2702 ND1 HIS A 167 8.507 -9.304 27.296 1.00 0.00 N ATOM 2703 CD2 HIS A 167 10.245 -10.613 27.475 1.00 0.00 C ATOM 2704 CE1 HIS A 167 9.414 -8.869 26.440 1.00 0.00 C ATOM 2705 NE2 HIS A 167 10.478 -9.645 26.529 1.00 0.00 N ATOM 0 H HIS A 167 6.012 -12.098 27.928 1.00 0.00 H new ATOM 0 HA HIS A 167 8.807 -13.032 28.164 1.00 0.00 H new ATOM 0 HB2 HIS A 167 7.280 -10.623 29.185 1.00 0.00 H new ATOM 0 HB3 HIS A 167 8.777 -11.125 29.946 1.00 0.00 H new ATOM 0 HD2 HIS A 167 10.928 -11.395 27.773 1.00 0.00 H new ATOM 0 HE1 HIS A 167 9.304 -8.022 25.779 1.00 0.00 H new ATOM 0 HE2 HIS A 167 11.334 -9.542 25.984 1.00 0.00 H new ATOM 2714 N HIS A 168 8.502 -14.302 30.258 1.00 0.00 N ATOM 2715 CA HIS A 168 8.312 -15.136 31.439 1.00 0.00 C ATOM 2716 C HIS A 168 9.312 -14.767 32.531 1.00 0.00 C ATOM 2717 O HIS A 168 8.926 -14.357 33.625 1.00 0.00 O ATOM 2718 CB HIS A 168 8.461 -16.615 31.074 1.00 0.00 C ATOM 2719 CG HIS A 168 7.172 -17.268 30.684 1.00 0.00 C ATOM 2720 ND1 HIS A 168 6.941 -18.620 30.822 1.00 0.00 N ATOM 2721 CD2 HIS A 168 6.037 -16.746 30.157 1.00 0.00 C ATOM 2722 CE1 HIS A 168 5.722 -18.902 30.396 1.00 0.00 C ATOM 2723 NE2 HIS A 168 5.154 -17.783 29.989 1.00 0.00 N ATOM 0 H HIS A 168 9.374 -14.473 29.757 1.00 0.00 H new ATOM 0 HA HIS A 168 7.305 -14.962 31.818 1.00 0.00 H new ATOM 0 HB2 HIS A 168 9.169 -16.708 30.251 1.00 0.00 H new ATOM 0 HB3 HIS A 168 8.887 -17.149 31.923 1.00 0.00 H new ATOM 0 HD2 HIS A 168 5.861 -15.708 29.915 1.00 0.00 H new ATOM 0 HE1 HIS A 168 5.268 -19.882 30.383 1.00 0.00 H new ATOM 0 HE2 HIS A 168 4.210 -17.702 29.610 1.00 0.00 H new ATOM 2732 N HIS A 169 10.596 -14.913 32.223 1.00 0.00 N ATOM 2733 CA HIS A 169 11.653 -14.595 33.178 1.00 0.00 C ATOM 2734 C HIS A 169 12.635 -13.590 32.584 1.00 0.00 C ATOM 2735 O HIS A 169 13.713 -13.961 32.122 1.00 0.00 O ATOM 2736 CB HIS A 169 12.393 -15.867 33.593 1.00 0.00 C ATOM 2737 CG HIS A 169 11.865 -16.483 34.852 1.00 0.00 C ATOM 2738 ND1 HIS A 169 12.593 -17.367 35.621 1.00 0.00 N ATOM 2739 CD2 HIS A 169 10.672 -16.339 35.477 1.00 0.00 C ATOM 2740 CE1 HIS A 169 11.871 -17.739 36.663 1.00 0.00 C ATOM 2741 NE2 HIS A 169 10.702 -17.129 36.598 1.00 0.00 N ATOM 0 H HIS A 169 10.931 -15.249 31.320 1.00 0.00 H new ATOM 0 HA HIS A 169 11.192 -14.149 34.059 1.00 0.00 H new ATOM 0 HB2 HIS A 169 12.326 -16.596 32.786 1.00 0.00 H new ATOM 0 HB3 HIS A 169 13.450 -15.636 33.727 1.00 0.00 H new ATOM 0 HD2 HIS A 169 9.850 -15.718 35.153 1.00 0.00 H new ATOM 0 HE1 HIS A 169 12.184 -18.425 37.436 1.00 0.00 H new ATOM 0 HE2 HIS A 169 9.943 -17.229 37.273 1.00 0.00 H new ATOM 2750 N HIS A 170 12.254 -12.317 32.601 1.00 0.00 N ATOM 2751 CA HIS A 170 13.102 -11.258 32.064 1.00 0.00 C ATOM 2752 C HIS A 170 13.400 -10.208 33.131 1.00 0.00 C ATOM 2753 O HIS A 170 12.460 -9.492 33.534 1.00 0.00 O ATOM 2754 CB HIS A 170 12.430 -10.600 30.859 1.00 0.00 C ATOM 2755 CG HIS A 170 13.392 -10.199 29.784 1.00 0.00 C ATOM 2756 ND1 HIS A 170 14.493 -10.953 29.439 1.00 0.00 N ATOM 2757 CD2 HIS A 170 13.414 -9.114 28.973 1.00 0.00 C ATOM 2758 CE1 HIS A 170 15.152 -10.350 28.464 1.00 0.00 C ATOM 2759 NE2 HIS A 170 14.516 -9.232 28.164 1.00 0.00 N ATOM 2760 OXT HIS A 170 14.572 -10.112 33.552 1.00 0.00 O ATOM 0 H HIS A 170 11.364 -11.993 32.980 1.00 0.00 H new ATOM 0 HA HIS A 170 14.044 -11.706 31.746 1.00 0.00 H new ATOM 0 HB2 HIS A 170 11.697 -11.289 30.441 1.00 0.00 H new ATOM 0 HB3 HIS A 170 11.884 -9.718 31.194 1.00 0.00 H new ATOM 0 HD2 HIS A 170 12.697 -8.306 28.965 1.00 0.00 H new ATOM 0 HE1 HIS A 170 16.055 -10.710 27.994 1.00 0.00 H new ATOM 0 HE2 HIS A 170 14.798 -8.564 27.447 1.00 0.00 H new TER 2769 HIS A 170