USER MOD reduce.3.24.130724 H: found=0, std=0, add=1038, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1036 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 65 THR OG1 : rot 120:sc= -0.593 USER MOD Set 1.2: A 68 ASN : amide:sc= 0.386 K(o=-2.5,f=-6.5) USER MOD Set 1.3: A 72 LYS NZ :NH3+ 161:sc= -0.0266 (180deg=-0.795) USER MOD Set 1.4: A 118 SER OG : rot 180:sc= -2.24! USER MOD Set 1.5: A 122 LYS NZ :NH3+ -175:sc= -0.0627 (180deg=-0.0151) USER MOD Set 2.1: A 45 HIS : no HD1:sc= -0.403 X(o=-5.4,f=-4.9) USER MOD Set 2.2: A 48 LYS NZ :NH3+ 143:sc=-0.00209 (180deg=0) USER MOD Set 2.3: A 64 HIS : no HD1:sc= -4.99! C(o=-5.4!,f=-5.1!) 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 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.00272) USER MOD Single : A 16 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 GLN : amide:sc= -0.838 K(o=-0.84,f=0) USER MOD Single : A 19 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 21 ASN : amide:sc= -0.733 K(o=-0.73,f=-5.7!) USER MOD Single : A 23 THR OG1 : rot 118:sc= 1.24 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc=-0.00774 X(o=-0.0077,f=-0.29) USER MOD Single : A 34 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 ASN : amide:sc=-0.00142 X(o=-0.0014,f=0) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 MET CE :methyl 176:sc= -5.34! (180deg=-5.65!) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 MET CE :methyl -146:sc= -0.576 (180deg=-2.91!) USER MOD Single : A 57 SER OG : rot 180:sc= -1.29 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 59 MET CE :methyl -111:sc= -9.82! (180deg=-16.1!) USER MOD Single : A 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 CYS SG : rot 83:sc= -2.87! USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 79 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.39 USER MOD Single : A 82 SER OG : rot -87:sc= -0.283! USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 MET CE :methyl -155:sc= -4.31! (180deg=-5.91!) USER MOD Single : A 96 THR OG1 : rot 98:sc= 1.34 USER MOD Single : A 98 MET CE :methyl -111:sc= -14.1! (180deg=-21.3!) USER MOD Single : A 101 LYS NZ :NH3+ -164:sc= 0 (180deg=-0.163) USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= -0.803 USER MOD Single : A 113 ASN : amide:sc= -2.02! C(o=-2!,f=-3.6!) USER MOD Single : A 120 THR OG1 : rot 95:sc= 0.00101 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= -0.0634 USER MOD Single : A 127 SER OG : rot -100:sc= -0.34! USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 7.728 -29.516 -2.159 1.00 0.00 N ATOM 2 CA MET A 1 6.349 -29.289 -2.682 1.00 0.00 C ATOM 3 C MET A 1 6.232 -27.878 -3.263 1.00 0.00 C ATOM 4 O MET A 1 7.217 -27.203 -3.484 1.00 0.00 O ATOM 5 CB MET A 1 5.433 -29.449 -1.469 1.00 0.00 C ATOM 6 CG MET A 1 4.455 -30.599 -1.717 1.00 0.00 C ATOM 7 SD MET A 1 3.789 -31.177 -0.136 1.00 0.00 S ATOM 8 CE MET A 1 4.006 -32.948 -0.433 1.00 0.00 C ATOM 0 H1 MET A 1 7.797 -30.477 -1.767 1.00 0.00 H new ATOM 0 H2 MET A 1 8.415 -29.408 -2.932 1.00 0.00 H new ATOM 0 H3 MET A 1 7.935 -28.822 -1.413 1.00 0.00 H new ATOM 0 HA MET A 1 6.090 -29.984 -3.481 1.00 0.00 H new ATOM 0 HB2 MET A 1 6.026 -29.648 -0.576 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.885 -28.524 -1.289 1.00 0.00 H new ATOM 0 HG2 MET A 1 3.644 -30.267 -2.366 1.00 0.00 H new ATOM 0 HG3 MET A 1 4.961 -31.416 -2.231 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.653 -33.508 0.433 1.00 0.00 H new ATOM 0 HE2 MET A 1 3.434 -33.242 -1.313 1.00 0.00 H new ATOM 0 HE3 MET A 1 5.062 -33.163 -0.598 1.00 0.00 H new ATOM 20 N MET A 2 5.033 -27.429 -3.513 1.00 0.00 N ATOM 21 CA MET A 2 4.852 -26.062 -4.081 1.00 0.00 C ATOM 22 C MET A 2 4.148 -25.156 -3.067 1.00 0.00 C ATOM 23 O MET A 2 3.135 -24.552 -3.360 1.00 0.00 O ATOM 24 CB MET A 2 3.979 -26.263 -5.320 1.00 0.00 C ATOM 25 CG MET A 2 4.429 -25.306 -6.425 1.00 0.00 C ATOM 26 SD MET A 2 2.981 -24.503 -7.156 1.00 0.00 S ATOM 27 CE MET A 2 2.499 -25.860 -8.252 1.00 0.00 C ATOM 0 H MET A 2 4.171 -27.949 -3.349 1.00 0.00 H new ATOM 0 HA MET A 2 5.802 -25.585 -4.324 1.00 0.00 H new ATOM 0 HB2 MET A 2 4.052 -27.294 -5.666 1.00 0.00 H new ATOM 0 HB3 MET A 2 2.933 -26.083 -5.073 1.00 0.00 H new ATOM 0 HG2 MET A 2 5.107 -24.556 -6.017 1.00 0.00 H new ATOM 0 HG3 MET A 2 4.981 -25.851 -7.191 1.00 0.00 H new ATOM 0 HE1 MET A 2 1.608 -25.576 -8.812 1.00 0.00 H new ATOM 0 HE2 MET A 2 3.312 -26.073 -8.946 1.00 0.00 H new ATOM 0 HE3 MET A 2 2.286 -26.749 -7.658 1.00 0.00 H new ATOM 37 N GLU A 3 4.675 -25.057 -1.877 1.00 0.00 N ATOM 38 CA GLU A 3 4.031 -24.190 -0.848 1.00 0.00 C ATOM 39 C GLU A 3 5.028 -23.186 -0.294 1.00 0.00 C ATOM 40 O GLU A 3 4.681 -22.291 0.452 1.00 0.00 O ATOM 41 CB GLU A 3 3.607 -25.137 0.267 1.00 0.00 C ATOM 42 CG GLU A 3 4.823 -25.936 0.734 1.00 0.00 C ATOM 43 CD GLU A 3 4.496 -26.642 2.051 1.00 0.00 C ATOM 44 OE1 GLU A 3 4.377 -25.957 3.053 1.00 0.00 O ATOM 45 OE2 GLU A 3 4.371 -27.855 2.035 1.00 0.00 O ATOM 0 H GLU A 3 5.522 -25.538 -1.573 1.00 0.00 H new ATOM 0 HA GLU A 3 3.195 -23.630 -1.268 1.00 0.00 H new ATOM 0 HB2 GLU A 3 3.185 -24.573 1.099 1.00 0.00 H new ATOM 0 HB3 GLU A 3 2.828 -25.811 -0.088 1.00 0.00 H new ATOM 0 HG2 GLU A 3 5.103 -26.668 -0.023 1.00 0.00 H new ATOM 0 HG3 GLU A 3 5.678 -25.273 0.867 1.00 0.00 H new ATOM 52 N GLU A 4 6.264 -23.336 -0.632 1.00 0.00 N ATOM 53 CA GLU A 4 7.277 -22.397 -0.097 1.00 0.00 C ATOM 54 C GLU A 4 7.189 -21.054 -0.824 1.00 0.00 C ATOM 55 O GLU A 4 7.824 -20.086 -0.452 1.00 0.00 O ATOM 56 CB GLU A 4 8.627 -23.068 -0.347 1.00 0.00 C ATOM 57 CG GLU A 4 8.548 -24.543 0.056 1.00 0.00 C ATOM 58 CD GLU A 4 9.582 -24.833 1.145 1.00 0.00 C ATOM 59 OE1 GLU A 4 10.541 -24.084 1.239 1.00 0.00 O ATOM 60 OE2 GLU A 4 9.400 -25.801 1.865 1.00 0.00 O ATOM 0 H GLU A 4 6.621 -24.063 -1.252 1.00 0.00 H new ATOM 0 HA GLU A 4 7.127 -22.190 0.963 1.00 0.00 H new ATOM 0 HB2 GLU A 4 8.898 -22.982 -1.399 1.00 0.00 H new ATOM 0 HB3 GLU A 4 9.406 -22.565 0.225 1.00 0.00 H new ATOM 0 HG2 GLU A 4 7.547 -24.778 0.418 1.00 0.00 H new ATOM 0 HG3 GLU A 4 8.730 -25.178 -0.811 1.00 0.00 H new ATOM 67 N TYR A 5 6.395 -20.994 -1.852 1.00 0.00 N ATOM 68 CA TYR A 5 6.249 -19.718 -2.609 1.00 0.00 C ATOM 69 C TYR A 5 5.346 -18.764 -1.838 1.00 0.00 C ATOM 70 O TYR A 5 5.470 -17.558 -1.921 1.00 0.00 O ATOM 71 CB TYR A 5 5.618 -20.116 -3.945 1.00 0.00 C ATOM 72 CG TYR A 5 6.705 -20.337 -4.969 1.00 0.00 C ATOM 73 CD1 TYR A 5 7.157 -19.269 -5.754 1.00 0.00 C ATOM 74 CD2 TYR A 5 7.262 -21.611 -5.136 1.00 0.00 C ATOM 75 CE1 TYR A 5 8.165 -19.473 -6.703 1.00 0.00 C ATOM 76 CE2 TYR A 5 8.271 -21.816 -6.086 1.00 0.00 C ATOM 77 CZ TYR A 5 8.722 -20.748 -6.869 1.00 0.00 C ATOM 78 OH TYR A 5 9.717 -20.949 -7.804 1.00 0.00 O ATOM 0 H TYR A 5 5.839 -21.773 -2.204 1.00 0.00 H new ATOM 0 HA TYR A 5 7.199 -19.205 -2.757 1.00 0.00 H new ATOM 0 HB2 TYR A 5 5.027 -21.024 -3.824 1.00 0.00 H new ATOM 0 HB3 TYR A 5 4.937 -19.336 -4.285 1.00 0.00 H new ATOM 0 HD1 TYR A 5 6.727 -18.286 -5.627 1.00 0.00 H new ATOM 0 HD2 TYR A 5 6.914 -22.436 -4.532 1.00 0.00 H new ATOM 0 HE1 TYR A 5 8.513 -18.648 -7.307 1.00 0.00 H new ATOM 0 HE2 TYR A 5 8.701 -22.799 -6.214 1.00 0.00 H new ATOM 0 HH TYR A 5 9.994 -21.889 -7.790 1.00 0.00 H new ATOM 88 N LEU A 6 4.455 -19.307 -1.075 1.00 0.00 N ATOM 89 CA LEU A 6 3.537 -18.456 -0.266 1.00 0.00 C ATOM 90 C LEU A 6 4.162 -18.193 1.104 1.00 0.00 C ATOM 91 O LEU A 6 3.885 -17.199 1.746 1.00 0.00 O ATOM 92 CB LEU A 6 2.245 -19.265 -0.132 1.00 0.00 C ATOM 93 CG LEU A 6 2.473 -20.447 0.812 1.00 0.00 C ATOM 94 CD1 LEU A 6 1.860 -20.139 2.179 1.00 0.00 C ATOM 95 CD2 LEU A 6 1.815 -21.700 0.229 1.00 0.00 C ATOM 0 H LEU A 6 4.316 -20.312 -0.971 1.00 0.00 H new ATOM 0 HA LEU A 6 3.348 -17.486 -0.727 1.00 0.00 H new ATOM 0 HB2 LEU A 6 1.445 -18.631 0.250 1.00 0.00 H new ATOM 0 HB3 LEU A 6 1.926 -19.625 -1.110 1.00 0.00 H new ATOM 0 HG LEU A 6 3.544 -20.617 0.926 1.00 0.00 H new ATOM 0 HD11 LEU A 6 2.024 -20.983 2.850 1.00 0.00 H new ATOM 0 HD12 LEU A 6 2.329 -19.248 2.596 1.00 0.00 H new ATOM 0 HD13 LEU A 6 0.789 -19.967 2.067 1.00 0.00 H new ATOM 0 HD21 LEU A 6 1.977 -22.542 0.901 1.00 0.00 H new ATOM 0 HD22 LEU A 6 0.745 -21.529 0.114 1.00 0.00 H new ATOM 0 HD23 LEU A 6 2.254 -21.922 -0.744 1.00 0.00 H new ATOM 107 N GLY A 7 5.011 -19.075 1.555 1.00 0.00 N ATOM 108 CA GLY A 7 5.661 -18.873 2.878 1.00 0.00 C ATOM 109 C GLY A 7 6.508 -17.600 2.835 1.00 0.00 C ATOM 110 O GLY A 7 6.464 -16.782 3.733 1.00 0.00 O ATOM 0 H GLY A 7 5.282 -19.927 1.063 1.00 0.00 H new ATOM 0 HA2 GLY A 7 4.905 -18.795 3.659 1.00 0.00 H new ATOM 0 HA3 GLY A 7 6.286 -19.731 3.124 1.00 0.00 H new ATOM 114 N VAL A 8 7.280 -17.425 1.796 1.00 0.00 N ATOM 115 CA VAL A 8 8.129 -16.200 1.702 1.00 0.00 C ATOM 116 C VAL A 8 7.317 -15.037 1.151 1.00 0.00 C ATOM 117 O VAL A 8 7.553 -13.888 1.464 1.00 0.00 O ATOM 118 CB VAL A 8 9.260 -16.562 0.740 1.00 0.00 C ATOM 119 CG1 VAL A 8 10.402 -15.558 0.897 1.00 0.00 C ATOM 120 CG2 VAL A 8 9.767 -17.969 1.055 1.00 0.00 C ATOM 0 H VAL A 8 7.360 -18.073 1.012 1.00 0.00 H new ATOM 0 HA VAL A 8 8.509 -15.893 2.676 1.00 0.00 H new ATOM 0 HB VAL A 8 8.890 -16.533 -0.285 1.00 0.00 H new ATOM 0 HG11 VAL A 8 11.209 -15.815 0.211 1.00 0.00 H new ATOM 0 HG12 VAL A 8 10.039 -14.556 0.670 1.00 0.00 H new ATOM 0 HG13 VAL A 8 10.773 -15.586 1.921 1.00 0.00 H new ATOM 0 HG21 VAL A 8 10.574 -18.227 0.369 1.00 0.00 H new ATOM 0 HG22 VAL A 8 10.138 -18.001 2.079 1.00 0.00 H new ATOM 0 HG23 VAL A 8 8.952 -18.683 0.942 1.00 0.00 H new ATOM 130 N PHE A 9 6.362 -15.338 0.337 1.00 0.00 N ATOM 131 CA PHE A 9 5.510 -14.267 -0.250 1.00 0.00 C ATOM 132 C PHE A 9 4.786 -13.518 0.874 1.00 0.00 C ATOM 133 O PHE A 9 4.743 -12.304 0.898 1.00 0.00 O ATOM 134 CB PHE A 9 4.529 -15.016 -1.163 1.00 0.00 C ATOM 135 CG PHE A 9 3.199 -14.296 -1.221 1.00 0.00 C ATOM 136 CD1 PHE A 9 3.123 -13.006 -1.757 1.00 0.00 C ATOM 137 CD2 PHE A 9 2.044 -14.922 -0.736 1.00 0.00 C ATOM 138 CE1 PHE A 9 1.893 -12.341 -1.809 1.00 0.00 C ATOM 139 CE2 PHE A 9 0.814 -14.258 -0.787 1.00 0.00 C ATOM 140 CZ PHE A 9 0.738 -12.967 -1.324 1.00 0.00 C ATOM 0 H PHE A 9 6.126 -16.286 0.045 1.00 0.00 H new ATOM 0 HA PHE A 9 6.073 -13.517 -0.806 1.00 0.00 H new ATOM 0 HB2 PHE A 9 4.948 -15.098 -2.166 1.00 0.00 H new ATOM 0 HB3 PHE A 9 4.383 -16.031 -0.794 1.00 0.00 H new ATOM 0 HD1 PHE A 9 4.014 -12.523 -2.131 1.00 0.00 H new ATOM 0 HD2 PHE A 9 2.103 -15.918 -0.322 1.00 0.00 H new ATOM 0 HE1 PHE A 9 1.834 -11.345 -2.223 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -0.077 -14.741 -0.412 1.00 0.00 H new ATOM 0 HZ PHE A 9 -0.212 -12.454 -1.364 1.00 0.00 H new ATOM 150 N VAL A 10 4.221 -14.234 1.807 1.00 0.00 N ATOM 151 CA VAL A 10 3.507 -13.563 2.929 1.00 0.00 C ATOM 152 C VAL A 10 4.517 -12.925 3.885 1.00 0.00 C ATOM 153 O VAL A 10 4.260 -11.895 4.475 1.00 0.00 O ATOM 154 CB VAL A 10 2.727 -14.677 3.626 1.00 0.00 C ATOM 155 CG1 VAL A 10 1.870 -14.078 4.743 1.00 0.00 C ATOM 156 CG2 VAL A 10 1.818 -15.373 2.610 1.00 0.00 C ATOM 0 H VAL A 10 4.223 -15.253 1.841 1.00 0.00 H new ATOM 0 HA VAL A 10 2.849 -12.765 2.586 1.00 0.00 H new ATOM 0 HB VAL A 10 3.425 -15.399 4.049 1.00 0.00 H new ATOM 0 HG11 VAL A 10 1.313 -14.872 5.240 1.00 0.00 H new ATOM 0 HG12 VAL A 10 2.513 -13.578 5.467 1.00 0.00 H new ATOM 0 HG13 VAL A 10 1.172 -13.357 4.319 1.00 0.00 H new ATOM 0 HG21 VAL A 10 1.261 -16.168 3.105 1.00 0.00 H new ATOM 0 HG22 VAL A 10 1.121 -14.649 2.190 1.00 0.00 H new ATOM 0 HG23 VAL A 10 2.425 -15.799 1.811 1.00 0.00 H new ATOM 166 N ASP A 11 5.669 -13.521 4.040 1.00 0.00 N ATOM 167 CA ASP A 11 6.688 -12.929 4.953 1.00 0.00 C ATOM 168 C ASP A 11 7.206 -11.624 4.361 1.00 0.00 C ATOM 169 O ASP A 11 7.706 -10.759 5.054 1.00 0.00 O ATOM 170 CB ASP A 11 7.803 -13.970 5.041 1.00 0.00 C ATOM 171 CG ASP A 11 8.643 -13.718 6.294 1.00 0.00 C ATOM 172 OD1 ASP A 11 9.346 -12.722 6.321 1.00 0.00 O ATOM 173 OD2 ASP A 11 8.570 -14.527 7.205 1.00 0.00 O ATOM 0 H ASP A 11 5.947 -14.386 3.577 1.00 0.00 H new ATOM 0 HA ASP A 11 6.285 -12.697 5.939 1.00 0.00 H new ATOM 0 HB2 ASP A 11 7.376 -14.973 5.073 1.00 0.00 H new ATOM 0 HB3 ASP A 11 8.433 -13.919 4.153 1.00 0.00 H new ATOM 178 N GLU A 12 7.068 -11.480 3.083 1.00 0.00 N ATOM 179 CA GLU A 12 7.527 -10.233 2.414 1.00 0.00 C ATOM 180 C GLU A 12 6.382 -9.221 2.385 1.00 0.00 C ATOM 181 O GLU A 12 6.557 -8.061 2.696 1.00 0.00 O ATOM 182 CB GLU A 12 7.915 -10.655 0.997 1.00 0.00 C ATOM 183 CG GLU A 12 9.337 -11.217 1.010 1.00 0.00 C ATOM 184 CD GLU A 12 9.508 -12.215 -0.137 1.00 0.00 C ATOM 185 OE1 GLU A 12 8.517 -12.804 -0.535 1.00 0.00 O ATOM 186 OE2 GLU A 12 10.626 -12.372 -0.597 1.00 0.00 O ATOM 0 H GLU A 12 6.654 -12.176 2.463 1.00 0.00 H new ATOM 0 HA GLU A 12 8.364 -9.762 2.931 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.218 -11.406 0.625 1.00 0.00 H new ATOM 0 HB3 GLU A 12 7.855 -9.802 0.321 1.00 0.00 H new ATOM 0 HG2 GLU A 12 10.059 -10.407 0.911 1.00 0.00 H new ATOM 0 HG3 GLU A 12 9.536 -11.706 1.963 1.00 0.00 H new ATOM 193 N THR A 13 5.207 -9.659 2.025 1.00 0.00 N ATOM 194 CA THR A 13 4.048 -8.723 1.989 1.00 0.00 C ATOM 195 C THR A 13 3.855 -8.092 3.373 1.00 0.00 C ATOM 196 O THR A 13 3.429 -6.960 3.497 1.00 0.00 O ATOM 197 CB THR A 13 2.842 -9.587 1.588 1.00 0.00 C ATOM 198 OG1 THR A 13 1.876 -8.773 0.938 1.00 0.00 O ATOM 199 CG2 THR A 13 2.213 -10.239 2.824 1.00 0.00 C ATOM 0 H THR A 13 5.000 -10.621 1.755 1.00 0.00 H new ATOM 0 HA THR A 13 4.188 -7.901 1.287 1.00 0.00 H new ATOM 0 HB THR A 13 3.180 -10.373 0.913 1.00 0.00 H new ATOM 0 HG1 THR A 13 1.106 -9.322 0.680 1.00 0.00 H new ATOM 0 HG21 THR A 13 1.361 -10.847 2.521 1.00 0.00 H new ATOM 0 HG22 THR A 13 2.952 -10.870 3.318 1.00 0.00 H new ATOM 0 HG23 THR A 13 1.879 -9.464 3.514 1.00 0.00 H new ATOM 207 N LYS A 14 4.181 -8.813 4.413 1.00 0.00 N ATOM 208 CA LYS A 14 4.034 -8.251 5.784 1.00 0.00 C ATOM 209 C LYS A 14 5.164 -7.263 6.046 1.00 0.00 C ATOM 210 O LYS A 14 4.948 -6.160 6.506 1.00 0.00 O ATOM 211 CB LYS A 14 4.146 -9.448 6.727 1.00 0.00 C ATOM 212 CG LYS A 14 2.833 -10.231 6.721 1.00 0.00 C ATOM 213 CD LYS A 14 3.127 -11.712 6.958 1.00 0.00 C ATOM 214 CE LYS A 14 2.239 -12.235 8.088 1.00 0.00 C ATOM 215 NZ LYS A 14 2.902 -11.781 9.343 1.00 0.00 N ATOM 0 H LYS A 14 4.542 -9.766 4.371 1.00 0.00 H new ATOM 0 HA LYS A 14 3.091 -7.722 5.920 1.00 0.00 H new ATOM 0 HB2 LYS A 14 4.967 -10.093 6.416 1.00 0.00 H new ATOM 0 HB3 LYS A 14 4.373 -9.108 7.737 1.00 0.00 H new ATOM 0 HG2 LYS A 14 2.167 -9.852 7.496 1.00 0.00 H new ATOM 0 HG3 LYS A 14 2.321 -10.098 5.768 1.00 0.00 H new ATOM 0 HD2 LYS A 14 2.945 -12.280 6.046 1.00 0.00 H new ATOM 0 HD3 LYS A 14 4.178 -11.848 7.214 1.00 0.00 H new ATOM 0 HE2 LYS A 14 1.227 -11.838 8.011 1.00 0.00 H new ATOM 0 HE3 LYS A 14 2.158 -13.322 8.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 3.108 -12.604 9.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 3.789 -11.292 9.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 2.271 -11.130 9.853 1.00 0.00 H new ATOM 229 N GLU A 15 6.374 -7.645 5.743 1.00 0.00 N ATOM 230 CA GLU A 15 7.513 -6.716 5.964 1.00 0.00 C ATOM 231 C GLU A 15 7.339 -5.478 5.088 1.00 0.00 C ATOM 232 O GLU A 15 7.996 -4.471 5.269 1.00 0.00 O ATOM 233 CB GLU A 15 8.760 -7.502 5.557 1.00 0.00 C ATOM 234 CG GLU A 15 9.011 -8.621 6.569 1.00 0.00 C ATOM 235 CD GLU A 15 10.278 -9.384 6.181 1.00 0.00 C ATOM 236 OE1 GLU A 15 10.197 -10.214 5.290 1.00 0.00 O ATOM 237 OE2 GLU A 15 11.310 -9.127 6.781 1.00 0.00 O ATOM 0 H GLU A 15 6.621 -8.555 5.354 1.00 0.00 H new ATOM 0 HA GLU A 15 7.581 -6.373 6.997 1.00 0.00 H new ATOM 0 HB2 GLU A 15 8.629 -7.922 4.560 1.00 0.00 H new ATOM 0 HB3 GLU A 15 9.623 -6.838 5.512 1.00 0.00 H new ATOM 0 HG2 GLU A 15 9.117 -8.203 7.570 1.00 0.00 H new ATOM 0 HG3 GLU A 15 8.159 -9.300 6.596 1.00 0.00 H new ATOM 244 N TYR A 16 6.452 -5.552 4.143 1.00 0.00 N ATOM 245 CA TYR A 16 6.211 -4.391 3.244 1.00 0.00 C ATOM 246 C TYR A 16 5.099 -3.504 3.806 1.00 0.00 C ATOM 247 O TYR A 16 5.196 -2.297 3.786 1.00 0.00 O ATOM 248 CB TYR A 16 5.795 -4.997 1.901 1.00 0.00 C ATOM 249 CG TYR A 16 7.016 -5.504 1.168 1.00 0.00 C ATOM 250 CD1 TYR A 16 8.184 -4.731 1.131 1.00 0.00 C ATOM 251 CD2 TYR A 16 6.979 -6.747 0.525 1.00 0.00 C ATOM 252 CE1 TYR A 16 9.314 -5.205 0.452 1.00 0.00 C ATOM 253 CE2 TYR A 16 8.108 -7.219 -0.154 1.00 0.00 C ATOM 254 CZ TYR A 16 9.275 -6.447 -0.190 1.00 0.00 C ATOM 255 OH TYR A 16 10.389 -6.912 -0.859 1.00 0.00 O ATOM 0 H TYR A 16 5.877 -6.373 3.951 1.00 0.00 H new ATOM 0 HA TYR A 16 7.095 -3.761 3.144 1.00 0.00 H new ATOM 0 HB2 TYR A 16 5.091 -5.814 2.062 1.00 0.00 H new ATOM 0 HB3 TYR A 16 5.282 -4.249 1.297 1.00 0.00 H new ATOM 0 HD1 TYR A 16 8.213 -3.771 1.625 1.00 0.00 H new ATOM 0 HD2 TYR A 16 6.078 -7.342 0.553 1.00 0.00 H new ATOM 0 HE1 TYR A 16 10.216 -4.611 0.424 1.00 0.00 H new ATOM 0 HE2 TYR A 16 8.079 -8.178 -0.650 1.00 0.00 H new ATOM 0 HH TYR A 16 10.194 -7.790 -1.248 1.00 0.00 H new ATOM 265 N LEU A 17 4.042 -4.085 4.309 1.00 0.00 N ATOM 266 CA LEU A 17 2.945 -3.245 4.867 1.00 0.00 C ATOM 267 C LEU A 17 3.482 -2.449 6.056 1.00 0.00 C ATOM 268 O LEU A 17 3.106 -1.316 6.281 1.00 0.00 O ATOM 269 CB LEU A 17 1.845 -4.227 5.292 1.00 0.00 C ATOM 270 CG LEU A 17 2.159 -4.819 6.669 1.00 0.00 C ATOM 271 CD1 LEU A 17 1.737 -3.833 7.760 1.00 0.00 C ATOM 272 CD2 LEU A 17 1.389 -6.130 6.848 1.00 0.00 C ATOM 0 H LEU A 17 3.892 -5.093 4.357 1.00 0.00 H new ATOM 0 HA LEU A 17 2.554 -2.524 4.149 1.00 0.00 H new ATOM 0 HB2 LEU A 17 0.883 -3.715 5.320 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.759 -5.027 4.557 1.00 0.00 H new ATOM 0 HG LEU A 17 3.230 -5.009 6.744 1.00 0.00 H new ATOM 0 HD11 LEU A 17 1.961 -4.256 8.739 1.00 0.00 H new ATOM 0 HD12 LEU A 17 2.282 -2.897 7.635 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.667 -3.642 7.684 1.00 0.00 H new ATOM 0 HD21 LEU A 17 1.612 -6.552 7.828 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.319 -5.937 6.771 1.00 0.00 H new ATOM 0 HD23 LEU A 17 1.687 -6.836 6.073 1.00 0.00 H new ATOM 284 N GLN A 18 4.386 -3.024 6.796 1.00 0.00 N ATOM 285 CA GLN A 18 4.981 -2.296 7.941 1.00 0.00 C ATOM 286 C GLN A 18 5.964 -1.291 7.381 1.00 0.00 C ATOM 287 O GLN A 18 5.962 -0.125 7.724 1.00 0.00 O ATOM 288 CB GLN A 18 5.655 -3.382 8.777 1.00 0.00 C ATOM 289 CG GLN A 18 7.147 -3.092 8.978 1.00 0.00 C ATOM 290 CD GLN A 18 7.751 -4.136 9.918 1.00 0.00 C ATOM 291 OE1 GLN A 18 8.724 -3.868 10.595 1.00 0.00 O ATOM 292 NE2 GLN A 18 7.213 -5.322 9.990 1.00 0.00 N ATOM 0 H GLN A 18 4.738 -3.971 6.654 1.00 0.00 H new ATOM 0 HA GLN A 18 4.271 -1.741 8.554 1.00 0.00 H new ATOM 0 HB2 GLN A 18 5.163 -3.453 9.747 1.00 0.00 H new ATOM 0 HB3 GLN A 18 5.534 -4.348 8.286 1.00 0.00 H new ATOM 0 HG2 GLN A 18 7.664 -3.110 8.018 1.00 0.00 H new ATOM 0 HG3 GLN A 18 7.281 -2.093 9.393 1.00 0.00 H new ATOM 0 HE21 GLN A 18 6.396 -5.547 9.422 1.00 0.00 H new ATOM 0 HE22 GLN A 18 7.609 -6.025 10.615 1.00 0.00 H new ATOM 301 N ASN A 19 6.761 -1.736 6.469 1.00 0.00 N ATOM 302 CA ASN A 19 7.706 -0.809 5.812 1.00 0.00 C ATOM 303 C ASN A 19 6.865 0.222 5.082 1.00 0.00 C ATOM 304 O ASN A 19 7.276 1.337 4.831 1.00 0.00 O ATOM 305 CB ASN A 19 8.510 -1.673 4.837 1.00 0.00 C ATOM 306 CG ASN A 19 9.279 -0.773 3.867 1.00 0.00 C ATOM 307 OD1 ASN A 19 10.061 0.059 4.283 1.00 0.00 O ATOM 308 ND2 ASN A 19 9.088 -0.902 2.583 1.00 0.00 N ATOM 0 H ASN A 19 6.801 -2.703 6.147 1.00 0.00 H new ATOM 0 HA ASN A 19 8.382 -0.291 6.493 1.00 0.00 H new ATOM 0 HB2 ASN A 19 9.204 -2.309 5.386 1.00 0.00 H new ATOM 0 HB3 ASN A 19 7.842 -2.333 4.284 1.00 0.00 H new ATOM 0 HD21 ASN A 19 9.595 -0.305 1.929 1.00 0.00 H new ATOM 0 HD22 ASN A 19 8.432 -1.600 2.233 1.00 0.00 H new ATOM 315 N LEU A 20 5.660 -0.161 4.775 1.00 0.00 N ATOM 316 CA LEU A 20 4.721 0.760 4.089 1.00 0.00 C ATOM 317 C LEU A 20 3.902 1.509 5.132 1.00 0.00 C ATOM 318 O LEU A 20 3.252 2.494 4.842 1.00 0.00 O ATOM 319 CB LEU A 20 3.833 -0.145 3.233 1.00 0.00 C ATOM 320 CG LEU A 20 2.653 0.656 2.681 1.00 0.00 C ATOM 321 CD1 LEU A 20 3.108 1.459 1.462 1.00 0.00 C ATOM 322 CD2 LEU A 20 1.535 -0.307 2.274 1.00 0.00 C ATOM 0 H LEU A 20 5.282 -1.087 4.974 1.00 0.00 H new ATOM 0 HA LEU A 20 5.225 1.509 3.478 1.00 0.00 H new ATOM 0 HB2 LEU A 20 4.413 -0.567 2.412 1.00 0.00 H new ATOM 0 HB3 LEU A 20 3.469 -0.981 3.830 1.00 0.00 H new ATOM 0 HG LEU A 20 2.284 1.340 3.446 1.00 0.00 H new ATOM 0 HD11 LEU A 20 2.267 2.030 1.068 1.00 0.00 H new ATOM 0 HD12 LEU A 20 3.906 2.142 1.753 1.00 0.00 H new ATOM 0 HD13 LEU A 20 3.476 0.778 0.694 1.00 0.00 H new ATOM 0 HD21 LEU A 20 0.692 0.260 1.880 1.00 0.00 H new ATOM 0 HD22 LEU A 20 1.903 -0.989 1.508 1.00 0.00 H new ATOM 0 HD23 LEU A 20 1.213 -0.879 3.144 1.00 0.00 H new ATOM 334 N ASN A 21 3.970 1.079 6.359 1.00 0.00 N ATOM 335 CA ASN A 21 3.242 1.789 7.421 1.00 0.00 C ATOM 336 C ASN A 21 4.206 2.784 7.988 1.00 0.00 C ATOM 337 O ASN A 21 3.861 3.876 8.379 1.00 0.00 O ATOM 338 CB ASN A 21 2.871 0.736 8.454 1.00 0.00 C ATOM 339 CG ASN A 21 1.454 0.228 8.182 1.00 0.00 C ATOM 340 OD1 ASN A 21 0.852 0.577 7.185 1.00 0.00 O ATOM 341 ND2 ASN A 21 0.890 -0.589 9.029 1.00 0.00 N ATOM 0 H ASN A 21 4.502 0.264 6.664 1.00 0.00 H new ATOM 0 HA ASN A 21 2.342 2.302 7.083 1.00 0.00 H new ATOM 0 HB2 ASN A 21 3.579 -0.092 8.415 1.00 0.00 H new ATOM 0 HB3 ASN A 21 2.930 1.159 9.457 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -0.054 -0.933 8.854 1.00 0.00 H new ATOM 0 HD22 ASN A 21 1.393 -0.883 9.866 1.00 0.00 H new ATOM 348 N ASP A 22 5.439 2.407 7.991 1.00 0.00 N ATOM 349 CA ASP A 22 6.467 3.326 8.488 1.00 0.00 C ATOM 350 C ASP A 22 6.558 4.466 7.498 1.00 0.00 C ATOM 351 O ASP A 22 6.802 5.608 7.834 1.00 0.00 O ATOM 352 CB ASP A 22 7.767 2.522 8.555 1.00 0.00 C ATOM 353 CG ASP A 22 8.677 3.114 9.634 1.00 0.00 C ATOM 354 OD1 ASP A 22 8.175 3.417 10.704 1.00 0.00 O ATOM 355 OD2 ASP A 22 9.860 3.253 9.371 1.00 0.00 O ATOM 0 H ASP A 22 5.777 1.500 7.670 1.00 0.00 H new ATOM 0 HA ASP A 22 6.251 3.740 9.473 1.00 0.00 H new ATOM 0 HB2 ASP A 22 7.550 1.478 8.780 1.00 0.00 H new ATOM 0 HB3 ASP A 22 8.270 2.542 7.588 1.00 0.00 H new ATOM 360 N THR A 23 6.306 4.137 6.276 1.00 0.00 N ATOM 361 CA THR A 23 6.300 5.146 5.195 1.00 0.00 C ATOM 362 C THR A 23 4.981 5.901 5.261 1.00 0.00 C ATOM 363 O THR A 23 4.921 7.105 5.105 1.00 0.00 O ATOM 364 CB THR A 23 6.342 4.314 3.929 1.00 0.00 C ATOM 365 OG1 THR A 23 7.570 3.599 3.870 1.00 0.00 O ATOM 366 CG2 THR A 23 6.207 5.218 2.706 1.00 0.00 C ATOM 0 H THR A 23 6.098 3.186 5.970 1.00 0.00 H new ATOM 0 HA THR A 23 7.117 5.865 5.255 1.00 0.00 H new ATOM 0 HB THR A 23 5.513 3.606 3.937 1.00 0.00 H new ATOM 0 HG1 THR A 23 7.389 2.636 3.880 1.00 0.00 H new ATOM 0 HG21 THR A 23 6.238 4.612 1.800 1.00 0.00 H new ATOM 0 HG22 THR A 23 5.259 5.753 2.752 1.00 0.00 H new ATOM 0 HG23 THR A 23 7.028 5.935 2.691 1.00 0.00 H new ATOM 374 N LEU A 24 3.915 5.184 5.513 1.00 0.00 N ATOM 375 CA LEU A 24 2.589 5.836 5.616 1.00 0.00 C ATOM 376 C LEU A 24 2.541 6.602 6.927 1.00 0.00 C ATOM 377 O LEU A 24 1.814 7.565 7.075 1.00 0.00 O ATOM 378 CB LEU A 24 1.571 4.694 5.621 1.00 0.00 C ATOM 379 CG LEU A 24 1.330 4.217 4.187 1.00 0.00 C ATOM 380 CD1 LEU A 24 0.503 2.929 4.211 1.00 0.00 C ATOM 381 CD2 LEU A 24 0.567 5.295 3.411 1.00 0.00 C ATOM 0 H LEU A 24 3.913 4.173 5.651 1.00 0.00 H new ATOM 0 HA LEU A 24 2.387 6.533 4.803 1.00 0.00 H new ATOM 0 HB2 LEU A 24 1.937 3.869 6.233 1.00 0.00 H new ATOM 0 HB3 LEU A 24 0.634 5.030 6.066 1.00 0.00 H new ATOM 0 HG LEU A 24 2.288 4.028 3.702 1.00 0.00 H new ATOM 0 HD11 LEU A 24 0.331 2.588 3.190 1.00 0.00 H new ATOM 0 HD12 LEU A 24 1.043 2.160 4.764 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -0.454 3.120 4.696 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.395 4.955 2.390 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -0.391 5.484 3.896 1.00 0.00 H new ATOM 0 HD23 LEU A 24 1.153 6.214 3.394 1.00 0.00 H new ATOM 393 N LEU A 25 3.322 6.180 7.885 1.00 0.00 N ATOM 394 CA LEU A 25 3.324 6.899 9.193 1.00 0.00 C ATOM 395 C LEU A 25 4.224 8.112 9.119 1.00 0.00 C ATOM 396 O LEU A 25 4.064 9.076 9.841 1.00 0.00 O ATOM 397 CB LEU A 25 3.836 5.891 10.205 1.00 0.00 C ATOM 398 CG LEU A 25 2.731 4.881 10.437 1.00 0.00 C ATOM 399 CD1 LEU A 25 3.309 3.614 11.065 1.00 0.00 C ATOM 400 CD2 LEU A 25 1.679 5.501 11.358 1.00 0.00 C ATOM 0 H LEU A 25 3.951 5.380 7.821 1.00 0.00 H new ATOM 0 HA LEU A 25 2.334 7.264 9.467 1.00 0.00 H new ATOM 0 HB2 LEU A 25 4.735 5.398 9.835 1.00 0.00 H new ATOM 0 HB3 LEU A 25 4.105 6.386 11.138 1.00 0.00 H new ATOM 0 HG LEU A 25 2.267 4.613 9.488 1.00 0.00 H new ATOM 0 HD11 LEU A 25 2.509 2.892 11.229 1.00 0.00 H new ATOM 0 HD12 LEU A 25 4.055 3.184 10.396 1.00 0.00 H new ATOM 0 HD13 LEU A 25 3.776 3.861 12.018 1.00 0.00 H new ATOM 0 HD21 LEU A 25 0.878 4.782 11.532 1.00 0.00 H new ATOM 0 HD22 LEU A 25 2.140 5.768 12.309 1.00 0.00 H new ATOM 0 HD23 LEU A 25 1.268 6.396 10.890 1.00 0.00 H new ATOM 412 N GLU A 26 5.121 8.096 8.201 1.00 0.00 N ATOM 413 CA GLU A 26 5.994 9.268 8.000 1.00 0.00 C ATOM 414 C GLU A 26 5.331 10.091 6.930 1.00 0.00 C ATOM 415 O GLU A 26 5.483 11.293 6.841 1.00 0.00 O ATOM 416 CB GLU A 26 7.350 8.718 7.551 1.00 0.00 C ATOM 417 CG GLU A 26 8.031 8.016 8.729 1.00 0.00 C ATOM 418 CD GLU A 26 9.236 8.839 9.188 1.00 0.00 C ATOM 419 OE1 GLU A 26 10.077 9.135 8.356 1.00 0.00 O ATOM 420 OE2 GLU A 26 9.297 9.157 10.364 1.00 0.00 O ATOM 0 H GLU A 26 5.293 7.313 7.570 1.00 0.00 H new ATOM 0 HA GLU A 26 6.144 9.886 8.885 1.00 0.00 H new ATOM 0 HB2 GLU A 26 7.216 8.019 6.725 1.00 0.00 H new ATOM 0 HB3 GLU A 26 7.980 9.528 7.183 1.00 0.00 H new ATOM 0 HG2 GLU A 26 7.325 7.895 9.551 1.00 0.00 H new ATOM 0 HG3 GLU A 26 8.351 7.017 8.434 1.00 0.00 H new ATOM 427 N LEU A 27 4.568 9.421 6.128 1.00 0.00 N ATOM 428 CA LEU A 27 3.845 10.101 5.060 1.00 0.00 C ATOM 429 C LEU A 27 2.706 10.905 5.672 1.00 0.00 C ATOM 430 O LEU A 27 2.294 11.917 5.145 1.00 0.00 O ATOM 431 CB LEU A 27 3.324 8.981 4.161 1.00 0.00 C ATOM 432 CG LEU A 27 2.396 9.560 3.098 1.00 0.00 C ATOM 433 CD1 LEU A 27 3.161 10.579 2.254 1.00 0.00 C ATOM 434 CD2 LEU A 27 1.890 8.430 2.199 1.00 0.00 C ATOM 0 H LEU A 27 4.419 8.413 6.177 1.00 0.00 H new ATOM 0 HA LEU A 27 4.461 10.799 4.493 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.159 8.466 3.686 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.791 8.241 4.758 1.00 0.00 H new ATOM 0 HG LEU A 27 1.550 10.051 3.579 1.00 0.00 H new ATOM 0 HD11 LEU A 27 2.498 10.993 1.494 1.00 0.00 H new ATOM 0 HD12 LEU A 27 3.525 11.382 2.895 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.006 10.090 1.770 1.00 0.00 H new ATOM 0 HD21 LEU A 27 1.226 8.840 1.438 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.737 7.942 1.717 1.00 0.00 H new ATOM 0 HD23 LEU A 27 1.346 7.702 2.801 1.00 0.00 H new ATOM 446 N GLU A 28 2.204 10.478 6.799 1.00 0.00 N ATOM 447 CA GLU A 28 1.110 11.256 7.442 1.00 0.00 C ATOM 448 C GLU A 28 1.690 12.531 8.032 1.00 0.00 C ATOM 449 O GLU A 28 1.103 13.591 7.949 1.00 0.00 O ATOM 450 CB GLU A 28 0.523 10.387 8.545 1.00 0.00 C ATOM 451 CG GLU A 28 1.624 9.682 9.333 1.00 0.00 C ATOM 452 CD GLU A 28 1.044 9.152 10.646 1.00 0.00 C ATOM 453 OE1 GLU A 28 0.273 8.208 10.593 1.00 0.00 O ATOM 454 OE2 GLU A 28 1.384 9.699 11.683 1.00 0.00 O ATOM 0 H GLU A 28 2.499 9.637 7.295 1.00 0.00 H new ATOM 0 HA GLU A 28 0.337 11.525 6.722 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -0.074 11.002 9.218 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -0.149 9.647 8.110 1.00 0.00 H new ATOM 0 HG2 GLU A 28 2.038 8.861 8.747 1.00 0.00 H new ATOM 0 HG3 GLU A 28 2.442 10.373 9.536 1.00 0.00 H new ATOM 461 N LYS A 29 2.864 12.446 8.590 1.00 0.00 N ATOM 462 CA LYS A 29 3.497 13.668 9.137 1.00 0.00 C ATOM 463 C LYS A 29 3.983 14.491 7.953 1.00 0.00 C ATOM 464 O LYS A 29 4.271 15.667 8.051 1.00 0.00 O ATOM 465 CB LYS A 29 4.634 13.148 10.024 1.00 0.00 C ATOM 466 CG LYS A 29 6.014 13.534 9.480 1.00 0.00 C ATOM 467 CD LYS A 29 6.982 12.416 9.811 1.00 0.00 C ATOM 468 CE LYS A 29 7.188 12.353 11.323 1.00 0.00 C ATOM 469 NZ LYS A 29 8.658 12.504 11.516 1.00 0.00 N ATOM 0 H LYS A 29 3.407 11.588 8.689 1.00 0.00 H new ATOM 0 HA LYS A 29 2.843 14.312 9.724 1.00 0.00 H new ATOM 0 HB2 LYS A 29 4.518 13.547 11.032 1.00 0.00 H new ATOM 0 HB3 LYS A 29 4.566 12.063 10.101 1.00 0.00 H new ATOM 0 HG2 LYS A 29 5.968 13.690 8.402 1.00 0.00 H new ATOM 0 HG3 LYS A 29 6.349 14.471 9.924 1.00 0.00 H new ATOM 0 HD2 LYS A 29 6.594 11.465 9.446 1.00 0.00 H new ATOM 0 HD3 LYS A 29 7.935 12.585 9.310 1.00 0.00 H new ATOM 0 HE2 LYS A 29 6.639 13.147 11.830 1.00 0.00 H new ATOM 0 HE3 LYS A 29 6.831 11.408 11.731 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 8.880 12.471 12.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 9.153 11.731 11.028 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 8.968 13.416 11.123 1.00 0.00 H new ATOM 483 N ASN A 30 4.046 13.847 6.827 1.00 0.00 N ATOM 484 CA ASN A 30 4.485 14.529 5.578 1.00 0.00 C ATOM 485 C ASN A 30 3.865 13.812 4.399 1.00 0.00 C ATOM 486 O ASN A 30 4.491 13.014 3.729 1.00 0.00 O ATOM 487 CB ASN A 30 6.012 14.443 5.555 1.00 0.00 C ATOM 488 CG ASN A 30 6.596 15.833 5.300 1.00 0.00 C ATOM 489 OD1 ASN A 30 6.489 16.359 4.209 1.00 0.00 O ATOM 490 ND2 ASN A 30 7.214 16.455 6.267 1.00 0.00 N ATOM 0 H ASN A 30 3.809 12.861 6.714 1.00 0.00 H new ATOM 0 HA ASN A 30 4.175 15.573 5.531 1.00 0.00 H new ATOM 0 HB2 ASN A 30 6.379 14.051 6.503 1.00 0.00 H new ATOM 0 HB3 ASN A 30 6.337 13.752 4.777 1.00 0.00 H new ATOM 0 HD21 ASN A 30 7.607 17.383 6.107 1.00 0.00 H new ATOM 0 HD22 ASN A 30 7.304 16.014 7.182 1.00 0.00 H new ATOM 497 N PRO A 31 2.621 14.117 4.227 1.00 0.00 N ATOM 498 CA PRO A 31 1.816 13.504 3.167 1.00 0.00 C ATOM 499 C PRO A 31 1.995 14.233 1.832 1.00 0.00 C ATOM 500 O PRO A 31 1.178 14.120 0.939 1.00 0.00 O ATOM 501 CB PRO A 31 0.405 13.668 3.699 1.00 0.00 C ATOM 502 CG PRO A 31 0.432 14.850 4.614 1.00 0.00 C ATOM 503 CD PRO A 31 1.853 15.070 5.032 1.00 0.00 C ATOM 0 HA PRO A 31 2.088 12.469 2.958 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -0.301 13.824 2.884 1.00 0.00 H new ATOM 0 HB3 PRO A 31 0.084 12.772 4.231 1.00 0.00 H new ATOM 0 HG2 PRO A 31 0.041 15.733 4.109 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -0.200 14.674 5.485 1.00 0.00 H new ATOM 0 HD2 PRO A 31 2.169 16.096 4.842 1.00 0.00 H new ATOM 0 HD3 PRO A 31 1.986 14.888 6.098 1.00 0.00 H new ATOM 511 N GLU A 32 3.055 14.973 1.684 1.00 0.00 N ATOM 512 CA GLU A 32 3.280 15.697 0.401 1.00 0.00 C ATOM 513 C GLU A 32 4.777 15.759 0.099 1.00 0.00 C ATOM 514 O GLU A 32 5.220 16.497 -0.758 1.00 0.00 O ATOM 515 CB GLU A 32 2.702 17.106 0.599 1.00 0.00 C ATOM 516 CG GLU A 32 2.721 17.495 2.081 1.00 0.00 C ATOM 517 CD GLU A 32 2.858 19.015 2.209 1.00 0.00 C ATOM 518 OE1 GLU A 32 1.837 19.681 2.231 1.00 0.00 O ATOM 519 OE2 GLU A 32 3.981 19.485 2.282 1.00 0.00 O ATOM 0 H GLU A 32 3.775 15.109 2.393 1.00 0.00 H new ATOM 0 HA GLU A 32 2.800 15.196 -0.440 1.00 0.00 H new ATOM 0 HB2 GLU A 32 3.281 17.827 0.021 1.00 0.00 H new ATOM 0 HB3 GLU A 32 1.680 17.142 0.221 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.805 17.160 2.568 1.00 0.00 H new ATOM 0 HG3 GLU A 32 3.550 17.001 2.587 1.00 0.00 H new ATOM 526 N ASP A 33 5.559 14.979 0.794 1.00 0.00 N ATOM 527 CA ASP A 33 7.027 14.982 0.543 1.00 0.00 C ATOM 528 C ASP A 33 7.321 14.348 -0.812 1.00 0.00 C ATOM 529 O ASP A 33 8.385 14.504 -1.377 1.00 0.00 O ATOM 530 CB ASP A 33 7.632 14.151 1.675 1.00 0.00 C ATOM 531 CG ASP A 33 6.880 12.824 1.794 1.00 0.00 C ATOM 532 OD1 ASP A 33 6.533 12.267 0.767 1.00 0.00 O ATOM 533 OD2 ASP A 33 6.662 12.388 2.913 1.00 0.00 O ATOM 0 H ASP A 33 5.244 14.340 1.524 1.00 0.00 H new ATOM 0 HA ASP A 33 7.443 15.989 0.522 1.00 0.00 H new ATOM 0 HB2 ASP A 33 8.688 13.966 1.480 1.00 0.00 H new ATOM 0 HB3 ASP A 33 7.573 14.700 2.615 1.00 0.00 H new ATOM 538 N MET A 34 6.374 13.621 -1.321 1.00 0.00 N ATOM 539 CA MET A 34 6.547 12.940 -2.633 1.00 0.00 C ATOM 540 C MET A 34 7.655 11.897 -2.539 1.00 0.00 C ATOM 541 O MET A 34 8.017 11.270 -3.514 1.00 0.00 O ATOM 542 CB MET A 34 6.904 14.045 -3.627 1.00 0.00 C ATOM 543 CG MET A 34 5.660 14.419 -4.434 1.00 0.00 C ATOM 544 SD MET A 34 6.147 15.375 -5.891 1.00 0.00 S ATOM 545 CE MET A 34 4.501 15.499 -6.633 1.00 0.00 C ATOM 0 H MET A 34 5.469 13.465 -0.877 1.00 0.00 H new ATOM 0 HA MET A 34 5.647 12.411 -2.945 1.00 0.00 H new ATOM 0 HB2 MET A 34 7.284 14.918 -3.097 1.00 0.00 H new ATOM 0 HB3 MET A 34 7.697 13.708 -4.294 1.00 0.00 H new ATOM 0 HG2 MET A 34 5.127 13.518 -4.739 1.00 0.00 H new ATOM 0 HG3 MET A 34 4.975 15.001 -3.817 1.00 0.00 H new ATOM 0 HE1 MET A 34 4.563 16.062 -7.564 1.00 0.00 H new ATOM 0 HE2 MET A 34 4.118 14.499 -6.838 1.00 0.00 H new ATOM 0 HE3 MET A 34 3.829 16.010 -5.944 1.00 0.00 H new ATOM 555 N GLU A 35 8.167 11.676 -1.363 1.00 0.00 N ATOM 556 CA GLU A 35 9.211 10.643 -1.199 1.00 0.00 C ATOM 557 C GLU A 35 8.554 9.452 -0.528 1.00 0.00 C ATOM 558 O GLU A 35 8.736 8.316 -0.914 1.00 0.00 O ATOM 559 CB GLU A 35 10.293 11.275 -0.313 1.00 0.00 C ATOM 560 CG GLU A 35 9.892 11.183 1.163 1.00 0.00 C ATOM 561 CD GLU A 35 11.028 11.724 2.034 1.00 0.00 C ATOM 562 OE1 GLU A 35 11.969 12.265 1.477 1.00 0.00 O ATOM 563 OE2 GLU A 35 10.938 11.587 3.244 1.00 0.00 O ATOM 0 H GLU A 35 7.904 12.169 -0.510 1.00 0.00 H new ATOM 0 HA GLU A 35 9.658 10.308 -2.135 1.00 0.00 H new ATOM 0 HB2 GLU A 35 11.244 10.767 -0.471 1.00 0.00 H new ATOM 0 HB3 GLU A 35 10.438 12.318 -0.593 1.00 0.00 H new ATOM 0 HG2 GLU A 35 8.980 11.754 1.340 1.00 0.00 H new ATOM 0 HG3 GLU A 35 9.677 10.148 1.429 1.00 0.00 H new ATOM 570 N LEU A 36 7.739 9.724 0.450 1.00 0.00 N ATOM 571 CA LEU A 36 7.007 8.623 1.119 1.00 0.00 C ATOM 572 C LEU A 36 5.909 8.160 0.167 1.00 0.00 C ATOM 573 O LEU A 36 5.440 7.042 0.231 1.00 0.00 O ATOM 574 CB LEU A 36 6.409 9.230 2.387 1.00 0.00 C ATOM 575 CG LEU A 36 7.531 9.770 3.276 1.00 0.00 C ATOM 576 CD1 LEU A 36 6.993 10.030 4.678 1.00 0.00 C ATOM 577 CD2 LEU A 36 8.669 8.747 3.354 1.00 0.00 C ATOM 0 H LEU A 36 7.550 10.659 0.812 1.00 0.00 H new ATOM 0 HA LEU A 36 7.637 7.769 1.370 1.00 0.00 H new ATOM 0 HB2 LEU A 36 5.719 10.033 2.127 1.00 0.00 H new ATOM 0 HB3 LEU A 36 5.834 8.477 2.927 1.00 0.00 H new ATOM 0 HG LEU A 36 7.907 10.700 2.850 1.00 0.00 H new ATOM 0 HD11 LEU A 36 7.794 10.415 5.310 1.00 0.00 H new ATOM 0 HD12 LEU A 36 6.187 10.762 4.628 1.00 0.00 H new ATOM 0 HD13 LEU A 36 6.613 9.100 5.100 1.00 0.00 H new ATOM 0 HD21 LEU A 36 9.465 9.136 3.988 1.00 0.00 H new ATOM 0 HD22 LEU A 36 8.292 7.815 3.776 1.00 0.00 H new ATOM 0 HD23 LEU A 36 9.060 8.561 2.354 1.00 0.00 H new ATOM 589 N ILE A 37 5.514 9.021 -0.740 1.00 0.00 N ATOM 590 CA ILE A 37 4.469 8.636 -1.721 1.00 0.00 C ATOM 591 C ILE A 37 5.086 7.700 -2.758 1.00 0.00 C ATOM 592 O ILE A 37 4.440 6.803 -3.262 1.00 0.00 O ATOM 593 CB ILE A 37 4.018 9.946 -2.366 1.00 0.00 C ATOM 594 CG1 ILE A 37 3.177 10.740 -1.364 1.00 0.00 C ATOM 595 CG2 ILE A 37 3.176 9.643 -3.606 1.00 0.00 C ATOM 596 CD1 ILE A 37 2.991 12.171 -1.871 1.00 0.00 C ATOM 0 H ILE A 37 5.874 9.971 -0.838 1.00 0.00 H new ATOM 0 HA ILE A 37 3.627 8.115 -1.265 1.00 0.00 H new ATOM 0 HB ILE A 37 4.893 10.529 -2.655 1.00 0.00 H new ATOM 0 HG12 ILE A 37 2.207 10.262 -1.229 1.00 0.00 H new ATOM 0 HG13 ILE A 37 3.666 10.749 -0.390 1.00 0.00 H new ATOM 0 HG21 ILE A 37 2.855 10.578 -4.065 1.00 0.00 H new ATOM 0 HG22 ILE A 37 3.771 9.074 -4.320 1.00 0.00 H new ATOM 0 HG23 ILE A 37 2.301 9.061 -3.318 1.00 0.00 H new ATOM 0 HD11 ILE A 37 2.392 12.735 -1.156 1.00 0.00 H new ATOM 0 HD12 ILE A 37 3.965 12.647 -1.983 1.00 0.00 H new ATOM 0 HD13 ILE A 37 2.483 12.152 -2.835 1.00 0.00 H new ATOM 608 N ASN A 38 6.343 7.892 -3.068 1.00 0.00 N ATOM 609 CA ASN A 38 6.999 6.993 -4.056 1.00 0.00 C ATOM 610 C ASN A 38 7.557 5.777 -3.333 1.00 0.00 C ATOM 611 O ASN A 38 7.702 4.709 -3.893 1.00 0.00 O ATOM 612 CB ASN A 38 8.119 7.821 -4.688 1.00 0.00 C ATOM 613 CG ASN A 38 8.471 7.240 -6.059 1.00 0.00 C ATOM 614 OD1 ASN A 38 9.521 6.651 -6.231 1.00 0.00 O ATOM 615 ND2 ASN A 38 7.634 7.382 -7.049 1.00 0.00 N ATOM 0 H ASN A 38 6.936 8.626 -2.682 1.00 0.00 H new ATOM 0 HA ASN A 38 6.309 6.630 -4.817 1.00 0.00 H new ATOM 0 HB2 ASN A 38 7.804 8.859 -4.791 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.998 7.817 -4.043 1.00 0.00 H new ATOM 0 HD21 ASN A 38 7.860 6.999 -7.967 1.00 0.00 H new ATOM 0 HD22 ASN A 38 6.753 7.876 -6.905 1.00 0.00 H new ATOM 622 N GLU A 39 7.837 5.931 -2.078 1.00 0.00 N ATOM 623 CA GLU A 39 8.351 4.785 -1.284 1.00 0.00 C ATOM 624 C GLU A 39 7.188 3.849 -0.997 1.00 0.00 C ATOM 625 O GLU A 39 7.344 2.655 -0.832 1.00 0.00 O ATOM 626 CB GLU A 39 8.901 5.392 0.008 1.00 0.00 C ATOM 627 CG GLU A 39 10.239 6.075 -0.277 1.00 0.00 C ATOM 628 CD GLU A 39 11.366 5.045 -0.194 1.00 0.00 C ATOM 629 OE1 GLU A 39 11.178 4.045 0.480 1.00 0.00 O ATOM 630 OE2 GLU A 39 12.397 5.272 -0.804 1.00 0.00 O ATOM 0 H GLU A 39 7.733 6.804 -1.562 1.00 0.00 H new ATOM 0 HA GLU A 39 9.125 4.216 -1.798 1.00 0.00 H new ATOM 0 HB2 GLU A 39 8.192 6.113 0.414 1.00 0.00 H new ATOM 0 HB3 GLU A 39 9.031 4.615 0.761 1.00 0.00 H new ATOM 0 HG2 GLU A 39 10.222 6.532 -1.266 1.00 0.00 H new ATOM 0 HG3 GLU A 39 10.411 6.876 0.442 1.00 0.00 H new ATOM 637 N ALA A 40 6.020 4.405 -0.969 1.00 0.00 N ATOM 638 CA ALA A 40 4.795 3.597 -0.729 1.00 0.00 C ATOM 639 C ALA A 40 4.243 3.129 -2.076 1.00 0.00 C ATOM 640 O ALA A 40 3.985 1.960 -2.282 1.00 0.00 O ATOM 641 CB ALA A 40 3.819 4.549 -0.039 1.00 0.00 C ATOM 0 H ALA A 40 5.854 5.402 -1.104 1.00 0.00 H new ATOM 0 HA ALA A 40 4.976 2.711 -0.121 1.00 0.00 H new ATOM 0 HB1 ALA A 40 2.887 4.025 0.172 1.00 0.00 H new ATOM 0 HB2 ALA A 40 4.255 4.903 0.895 1.00 0.00 H new ATOM 0 HB3 ALA A 40 3.618 5.399 -0.691 1.00 0.00 H new ATOM 647 N PHE A 41 4.082 4.036 -3.006 1.00 0.00 N ATOM 648 CA PHE A 41 3.572 3.641 -4.348 1.00 0.00 C ATOM 649 C PHE A 41 4.338 2.407 -4.833 1.00 0.00 C ATOM 650 O PHE A 41 3.776 1.498 -5.410 1.00 0.00 O ATOM 651 CB PHE A 41 3.858 4.853 -5.241 1.00 0.00 C ATOM 652 CG PHE A 41 3.286 4.626 -6.620 1.00 0.00 C ATOM 653 CD1 PHE A 41 1.901 4.520 -6.797 1.00 0.00 C ATOM 654 CD2 PHE A 41 4.142 4.527 -7.723 1.00 0.00 C ATOM 655 CE1 PHE A 41 1.374 4.315 -8.079 1.00 0.00 C ATOM 656 CE2 PHE A 41 3.615 4.323 -9.002 1.00 0.00 C ATOM 657 CZ PHE A 41 2.231 4.217 -9.181 1.00 0.00 C ATOM 0 H PHE A 41 4.282 5.030 -2.892 1.00 0.00 H new ATOM 0 HA PHE A 41 2.513 3.383 -4.350 1.00 0.00 H new ATOM 0 HB2 PHE A 41 3.422 5.750 -4.801 1.00 0.00 H new ATOM 0 HB3 PHE A 41 4.933 5.020 -5.307 1.00 0.00 H new ATOM 0 HD1 PHE A 41 1.240 4.596 -5.946 1.00 0.00 H new ATOM 0 HD2 PHE A 41 5.210 4.608 -7.586 1.00 0.00 H new ATOM 0 HE1 PHE A 41 0.306 4.233 -8.217 1.00 0.00 H new ATOM 0 HE2 PHE A 41 4.276 4.247 -9.852 1.00 0.00 H new ATOM 0 HZ PHE A 41 1.825 4.060 -10.169 1.00 0.00 H new ATOM 667 N ARG A 42 5.623 2.374 -4.591 1.00 0.00 N ATOM 668 CA ARG A 42 6.446 1.212 -5.018 1.00 0.00 C ATOM 669 C ARG A 42 6.158 0.001 -4.123 1.00 0.00 C ATOM 670 O ARG A 42 5.649 -1.010 -4.567 1.00 0.00 O ATOM 671 CB ARG A 42 7.886 1.680 -4.812 1.00 0.00 C ATOM 672 CG ARG A 42 8.386 2.416 -6.056 1.00 0.00 C ATOM 673 CD ARG A 42 7.400 3.513 -6.465 1.00 0.00 C ATOM 674 NE ARG A 42 6.507 2.866 -7.464 1.00 0.00 N ATOM 675 CZ ARG A 42 6.898 2.748 -8.703 1.00 0.00 C ATOM 676 NH1 ARG A 42 7.214 3.812 -9.390 1.00 0.00 N ATOM 677 NH2 ARG A 42 6.977 1.568 -9.255 1.00 0.00 N ATOM 0 H ARG A 42 6.139 3.112 -4.111 1.00 0.00 H new ATOM 0 HA ARG A 42 6.241 0.908 -6.044 1.00 0.00 H new ATOM 0 HB2 ARG A 42 7.942 2.338 -3.945 1.00 0.00 H new ATOM 0 HB3 ARG A 42 8.528 0.824 -4.605 1.00 0.00 H new ATOM 0 HG2 ARG A 42 9.364 2.854 -5.857 1.00 0.00 H new ATOM 0 HG3 ARG A 42 8.514 1.710 -6.876 1.00 0.00 H new ATOM 0 HD2 ARG A 42 6.835 3.878 -5.607 1.00 0.00 H new ATOM 0 HD3 ARG A 42 7.918 4.371 -6.894 1.00 0.00 H new ATOM 0 HE ARG A 42 5.592 2.516 -7.181 1.00 0.00 H new ATOM 0 HH11 ARG A 42 7.155 4.734 -8.958 1.00 0.00 H new ATOM 0 HH12 ARG A 42 7.520 3.721 -10.359 1.00 0.00 H new ATOM 0 HH21 ARG A 42 6.733 0.736 -8.718 1.00 0.00 H new ATOM 0 HH22 ARG A 42 7.283 1.478 -10.224 1.00 0.00 H new ATOM 691 N ALA A 43 6.494 0.100 -2.865 1.00 0.00 N ATOM 692 CA ALA A 43 6.263 -1.034 -1.922 1.00 0.00 C ATOM 693 C ALA A 43 4.931 -1.731 -2.210 1.00 0.00 C ATOM 694 O ALA A 43 4.850 -2.943 -2.223 1.00 0.00 O ATOM 695 CB ALA A 43 6.241 -0.392 -0.536 1.00 0.00 C ATOM 0 H ALA A 43 6.923 0.925 -2.446 1.00 0.00 H new ATOM 0 HA ALA A 43 7.034 -1.799 -2.014 1.00 0.00 H new ATOM 0 HB1 ALA A 43 6.075 -1.161 0.219 1.00 0.00 H new ATOM 0 HB2 ALA A 43 7.195 0.101 -0.348 1.00 0.00 H new ATOM 0 HB3 ALA A 43 5.437 0.343 -0.488 1.00 0.00 H new ATOM 701 N LEU A 44 3.886 -0.986 -2.440 1.00 0.00 N ATOM 702 CA LEU A 44 2.574 -1.633 -2.723 1.00 0.00 C ATOM 703 C LEU A 44 2.585 -2.230 -4.125 1.00 0.00 C ATOM 704 O LEU A 44 2.231 -3.373 -4.323 1.00 0.00 O ATOM 705 CB LEU A 44 1.539 -0.515 -2.616 1.00 0.00 C ATOM 706 CG LEU A 44 1.283 -0.203 -1.143 1.00 0.00 C ATOM 707 CD1 LEU A 44 0.866 1.261 -0.995 1.00 0.00 C ATOM 708 CD2 LEU A 44 0.167 -1.106 -0.616 1.00 0.00 C ATOM 0 H LEU A 44 3.882 0.034 -2.445 1.00 0.00 H new ATOM 0 HA LEU A 44 2.354 -2.445 -2.031 1.00 0.00 H new ATOM 0 HB2 LEU A 44 1.895 0.377 -3.132 1.00 0.00 H new ATOM 0 HB3 LEU A 44 0.611 -0.815 -3.103 1.00 0.00 H new ATOM 0 HG LEU A 44 2.194 -0.380 -0.572 1.00 0.00 H new ATOM 0 HD11 LEU A 44 0.683 1.483 0.056 1.00 0.00 H new ATOM 0 HD12 LEU A 44 1.661 1.905 -1.369 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.045 1.440 -1.567 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -0.015 -0.883 0.435 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -0.744 -0.930 -1.188 1.00 0.00 H new ATOM 0 HD23 LEU A 44 0.464 -2.150 -0.719 1.00 0.00 H new ATOM 720 N HIS A 45 3.011 -1.480 -5.098 1.00 0.00 N ATOM 721 CA HIS A 45 3.064 -2.035 -6.475 1.00 0.00 C ATOM 722 C HIS A 45 4.007 -3.234 -6.468 1.00 0.00 C ATOM 723 O HIS A 45 3.859 -4.172 -7.227 1.00 0.00 O ATOM 724 CB HIS A 45 3.625 -0.905 -7.336 1.00 0.00 C ATOM 725 CG HIS A 45 3.226 -1.118 -8.771 1.00 0.00 C ATOM 726 ND1 HIS A 45 3.861 -0.467 -9.817 1.00 0.00 N ATOM 727 CD2 HIS A 45 2.259 -1.903 -9.349 1.00 0.00 C ATOM 728 CE1 HIS A 45 3.273 -0.867 -10.959 1.00 0.00 C ATOM 729 NE2 HIS A 45 2.291 -1.743 -10.732 1.00 0.00 N ATOM 0 H HIS A 45 3.323 -0.514 -5.001 1.00 0.00 H new ATOM 0 HA HIS A 45 2.096 -2.369 -6.850 1.00 0.00 H new ATOM 0 HB2 HIS A 45 3.250 0.056 -6.983 1.00 0.00 H new ATOM 0 HB3 HIS A 45 4.711 -0.874 -7.251 1.00 0.00 H new ATOM 0 HD2 HIS A 45 1.577 -2.547 -8.813 1.00 0.00 H new ATOM 0 HE1 HIS A 45 3.561 -0.521 -11.941 1.00 0.00 H new ATOM 0 HE2 HIS A 45 1.693 -2.197 -11.423 1.00 0.00 H new ATOM 737 N THR A 46 4.974 -3.203 -5.592 1.00 0.00 N ATOM 738 CA THR A 46 5.943 -4.326 -5.494 1.00 0.00 C ATOM 739 C THR A 46 5.295 -5.508 -4.757 1.00 0.00 C ATOM 740 O THR A 46 5.347 -6.634 -5.211 1.00 0.00 O ATOM 741 CB THR A 46 7.136 -3.731 -4.718 1.00 0.00 C ATOM 742 OG1 THR A 46 8.225 -3.545 -5.610 1.00 0.00 O ATOM 743 CG2 THR A 46 7.575 -4.657 -3.576 1.00 0.00 C ATOM 0 H THR A 46 5.134 -2.439 -4.935 1.00 0.00 H new ATOM 0 HA THR A 46 6.260 -4.718 -6.461 1.00 0.00 H new ATOM 0 HB THR A 46 6.826 -2.778 -4.288 1.00 0.00 H new ATOM 0 HG1 THR A 46 8.986 -3.165 -5.123 1.00 0.00 H new ATOM 0 HG21 THR A 46 8.417 -4.210 -3.048 1.00 0.00 H new ATOM 0 HG22 THR A 46 6.746 -4.798 -2.883 1.00 0.00 H new ATOM 0 HG23 THR A 46 7.874 -5.622 -3.985 1.00 0.00 H new ATOM 751 N LEU A 47 4.682 -5.263 -3.626 1.00 0.00 N ATOM 752 CA LEU A 47 4.037 -6.384 -2.884 1.00 0.00 C ATOM 753 C LEU A 47 2.695 -6.732 -3.538 1.00 0.00 C ATOM 754 O LEU A 47 2.308 -7.882 -3.605 1.00 0.00 O ATOM 755 CB LEU A 47 3.865 -5.879 -1.445 1.00 0.00 C ATOM 756 CG LEU A 47 2.598 -5.035 -1.315 1.00 0.00 C ATOM 757 CD1 LEU A 47 1.377 -5.951 -1.196 1.00 0.00 C ATOM 758 CD2 LEU A 47 2.702 -4.169 -0.056 1.00 0.00 C ATOM 0 H LEU A 47 4.602 -4.345 -3.190 1.00 0.00 H new ATOM 0 HA LEU A 47 4.631 -7.298 -2.898 1.00 0.00 H new ATOM 0 HB2 LEU A 47 3.815 -6.726 -0.761 1.00 0.00 H new ATOM 0 HB3 LEU A 47 4.733 -5.287 -1.156 1.00 0.00 H new ATOM 0 HG LEU A 47 2.490 -4.402 -2.196 1.00 0.00 H new ATOM 0 HD11 LEU A 47 0.475 -5.345 -1.103 1.00 0.00 H new ATOM 0 HD12 LEU A 47 1.304 -6.577 -2.085 1.00 0.00 H new ATOM 0 HD13 LEU A 47 1.481 -6.584 -0.314 1.00 0.00 H new ATOM 0 HD21 LEU A 47 1.801 -3.563 0.044 1.00 0.00 H new ATOM 0 HD22 LEU A 47 2.807 -4.810 0.819 1.00 0.00 H new ATOM 0 HD23 LEU A 47 3.571 -3.516 -0.134 1.00 0.00 H new ATOM 770 N LYS A 48 1.994 -5.752 -4.046 1.00 0.00 N ATOM 771 CA LYS A 48 0.699 -6.035 -4.721 1.00 0.00 C ATOM 772 C LYS A 48 0.914 -7.128 -5.769 1.00 0.00 C ATOM 773 O LYS A 48 0.183 -8.095 -5.835 1.00 0.00 O ATOM 774 CB LYS A 48 0.313 -4.716 -5.388 1.00 0.00 C ATOM 775 CG LYS A 48 -0.829 -4.953 -6.373 1.00 0.00 C ATOM 776 CD LYS A 48 -0.458 -4.356 -7.729 1.00 0.00 C ATOM 777 CE LYS A 48 0.266 -5.405 -8.574 1.00 0.00 C ATOM 778 NZ LYS A 48 0.403 -4.783 -9.921 1.00 0.00 N ATOM 0 H LYS A 48 2.265 -4.769 -4.021 1.00 0.00 H new ATOM 0 HA LYS A 48 -0.076 -6.382 -4.038 1.00 0.00 H new ATOM 0 HB2 LYS A 48 0.010 -3.990 -4.633 1.00 0.00 H new ATOM 0 HB3 LYS A 48 1.173 -4.295 -5.908 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -1.022 -6.021 -6.474 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -1.746 -4.497 -6.001 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -1.356 -4.016 -8.245 1.00 0.00 H new ATOM 0 HD3 LYS A 48 0.180 -3.483 -7.590 1.00 0.00 H new ATOM 0 HE2 LYS A 48 1.240 -5.650 -8.151 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -0.302 -6.334 -8.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 1.319 -5.050 -10.335 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -0.366 -5.116 -10.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 0.352 -3.748 -9.832 1.00 0.00 H new ATOM 792 N GLY A 49 1.928 -6.986 -6.583 1.00 0.00 N ATOM 793 CA GLY A 49 2.202 -8.021 -7.620 1.00 0.00 C ATOM 794 C GLY A 49 2.460 -9.361 -6.933 1.00 0.00 C ATOM 795 O GLY A 49 1.867 -10.366 -7.269 1.00 0.00 O ATOM 0 H GLY A 49 2.576 -6.199 -6.573 1.00 0.00 H new ATOM 0 HA2 GLY A 49 1.355 -8.104 -8.301 1.00 0.00 H new ATOM 0 HA3 GLY A 49 3.066 -7.733 -8.219 1.00 0.00 H new ATOM 799 N MET A 50 3.335 -9.384 -5.962 1.00 0.00 N ATOM 800 CA MET A 50 3.617 -10.664 -5.249 1.00 0.00 C ATOM 801 C MET A 50 2.298 -11.330 -4.848 1.00 0.00 C ATOM 802 O MET A 50 2.229 -12.527 -4.649 1.00 0.00 O ATOM 803 CB MET A 50 4.419 -10.263 -4.011 1.00 0.00 C ATOM 804 CG MET A 50 5.905 -10.539 -4.254 1.00 0.00 C ATOM 805 SD MET A 50 6.769 -10.642 -2.667 1.00 0.00 S ATOM 806 CE MET A 50 6.056 -9.156 -1.922 1.00 0.00 C ATOM 0 H MET A 50 3.864 -8.576 -5.633 1.00 0.00 H new ATOM 0 HA MET A 50 4.164 -11.377 -5.867 1.00 0.00 H new ATOM 0 HB2 MET A 50 4.266 -9.206 -3.792 1.00 0.00 H new ATOM 0 HB3 MET A 50 4.072 -10.823 -3.143 1.00 0.00 H new ATOM 0 HG2 MET A 50 6.027 -11.470 -4.807 1.00 0.00 H new ATOM 0 HG3 MET A 50 6.338 -9.746 -4.865 1.00 0.00 H new ATOM 0 HE1 MET A 50 6.403 -9.062 -0.893 1.00 0.00 H new ATOM 0 HE2 MET A 50 6.366 -8.279 -2.491 1.00 0.00 H new ATOM 0 HE3 MET A 50 4.969 -9.230 -1.932 1.00 0.00 H new ATOM 816 N ALA A 51 1.250 -10.559 -4.739 1.00 0.00 N ATOM 817 CA ALA A 51 -0.072 -11.136 -4.361 1.00 0.00 C ATOM 818 C ALA A 51 -0.827 -11.547 -5.624 1.00 0.00 C ATOM 819 O ALA A 51 -1.665 -12.426 -5.603 1.00 0.00 O ATOM 820 CB ALA A 51 -0.800 -10.003 -3.639 1.00 0.00 C ATOM 0 H ALA A 51 1.253 -9.551 -4.896 1.00 0.00 H new ATOM 0 HA ALA A 51 0.015 -12.023 -3.734 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -1.786 -10.346 -3.326 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -0.226 -9.701 -2.763 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -0.908 -9.153 -4.312 1.00 0.00 H new ATOM 826 N GLY A 52 -0.521 -10.928 -6.728 1.00 0.00 N ATOM 827 CA GLY A 52 -1.200 -11.290 -8.000 1.00 0.00 C ATOM 828 C GLY A 52 -0.396 -12.399 -8.667 1.00 0.00 C ATOM 829 O GLY A 52 -0.914 -13.206 -9.412 1.00 0.00 O ATOM 0 H GLY A 52 0.173 -10.184 -6.804 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -2.220 -11.623 -7.806 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -1.268 -10.422 -8.656 1.00 0.00 H new ATOM 833 N THR A 53 0.875 -12.447 -8.379 1.00 0.00 N ATOM 834 CA THR A 53 1.742 -13.503 -8.962 1.00 0.00 C ATOM 835 C THR A 53 1.568 -14.800 -8.172 1.00 0.00 C ATOM 836 O THR A 53 2.030 -15.854 -8.564 1.00 0.00 O ATOM 837 CB THR A 53 3.163 -12.953 -8.812 1.00 0.00 C ATOM 838 OG1 THR A 53 3.446 -12.075 -9.892 1.00 0.00 O ATOM 839 CG2 THR A 53 4.175 -14.100 -8.810 1.00 0.00 C ATOM 0 H THR A 53 1.352 -11.793 -7.759 1.00 0.00 H new ATOM 0 HA THR A 53 1.504 -13.732 -10.001 1.00 0.00 H new ATOM 0 HB THR A 53 3.237 -12.412 -7.868 1.00 0.00 H new ATOM 0 HG1 THR A 53 4.355 -11.721 -9.796 1.00 0.00 H new ATOM 0 HG21 THR A 53 5.182 -13.697 -8.703 1.00 0.00 H new ATOM 0 HG22 THR A 53 3.963 -14.771 -7.978 1.00 0.00 H new ATOM 0 HG23 THR A 53 4.103 -14.651 -9.748 1.00 0.00 H new ATOM 847 N MET A 54 0.904 -14.718 -7.059 1.00 0.00 N ATOM 848 CA MET A 54 0.687 -15.930 -6.218 1.00 0.00 C ATOM 849 C MET A 54 -0.772 -16.381 -6.303 1.00 0.00 C ATOM 850 O MET A 54 -1.202 -17.268 -5.592 1.00 0.00 O ATOM 851 CB MET A 54 1.035 -15.491 -4.795 1.00 0.00 C ATOM 852 CG MET A 54 1.229 -16.725 -3.911 1.00 0.00 C ATOM 853 SD MET A 54 2.820 -16.610 -3.057 1.00 0.00 S ATOM 854 CE MET A 54 3.845 -16.328 -4.521 1.00 0.00 C ATOM 0 H MET A 54 0.498 -13.859 -6.689 1.00 0.00 H new ATOM 0 HA MET A 54 1.296 -16.774 -6.544 1.00 0.00 H new ATOM 0 HB2 MET A 54 1.944 -14.889 -4.801 1.00 0.00 H new ATOM 0 HB3 MET A 54 0.240 -14.864 -4.392 1.00 0.00 H new ATOM 0 HG2 MET A 54 0.419 -16.797 -3.185 1.00 0.00 H new ATOM 0 HG3 MET A 54 1.194 -17.630 -4.518 1.00 0.00 H new ATOM 0 HE1 MET A 54 4.817 -16.801 -4.381 1.00 0.00 H new ATOM 0 HE2 MET A 54 3.356 -16.756 -5.396 1.00 0.00 H new ATOM 0 HE3 MET A 54 3.980 -15.257 -4.669 1.00 0.00 H new ATOM 864 N GLY A 55 -1.532 -15.782 -7.172 1.00 0.00 N ATOM 865 CA GLY A 55 -2.961 -16.178 -7.309 1.00 0.00 C ATOM 866 C GLY A 55 -3.819 -15.330 -6.370 1.00 0.00 C ATOM 867 O GLY A 55 -5.028 -15.300 -6.480 1.00 0.00 O ATOM 0 H GLY A 55 -1.227 -15.034 -7.795 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -3.289 -16.043 -8.340 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -3.080 -17.235 -7.072 1.00 0.00 H new ATOM 871 N PHE A 56 -3.208 -14.638 -5.448 1.00 0.00 N ATOM 872 CA PHE A 56 -4.000 -13.794 -4.511 1.00 0.00 C ATOM 873 C PHE A 56 -4.170 -12.392 -5.093 1.00 0.00 C ATOM 874 O PHE A 56 -3.977 -11.402 -4.417 1.00 0.00 O ATOM 875 CB PHE A 56 -3.175 -13.748 -3.226 1.00 0.00 C ATOM 876 CG PHE A 56 -3.159 -15.119 -2.599 1.00 0.00 C ATOM 877 CD1 PHE A 56 -4.347 -15.854 -2.499 1.00 0.00 C ATOM 878 CD2 PHE A 56 -1.960 -15.658 -2.122 1.00 0.00 C ATOM 879 CE1 PHE A 56 -4.335 -17.128 -1.922 1.00 0.00 C ATOM 880 CE2 PHE A 56 -1.948 -16.933 -1.544 1.00 0.00 C ATOM 881 CZ PHE A 56 -3.135 -17.668 -1.444 1.00 0.00 C ATOM 0 H PHE A 56 -2.198 -14.621 -5.304 1.00 0.00 H new ATOM 0 HA PHE A 56 -5.000 -14.191 -4.335 1.00 0.00 H new ATOM 0 HB2 PHE A 56 -2.158 -13.423 -3.444 1.00 0.00 H new ATOM 0 HB3 PHE A 56 -3.600 -13.023 -2.532 1.00 0.00 H new ATOM 0 HD1 PHE A 56 -5.273 -15.437 -2.868 1.00 0.00 H new ATOM 0 HD2 PHE A 56 -1.044 -15.091 -2.199 1.00 0.00 H new ATOM 0 HE1 PHE A 56 -5.251 -17.695 -1.845 1.00 0.00 H new ATOM 0 HE2 PHE A 56 -1.022 -17.350 -1.175 1.00 0.00 H new ATOM 0 HZ PHE A 56 -3.125 -18.652 -0.998 1.00 0.00 H new ATOM 891 N SER A 57 -4.526 -12.298 -6.345 1.00 0.00 N ATOM 892 CA SER A 57 -4.701 -10.956 -6.961 1.00 0.00 C ATOM 893 C SER A 57 -5.820 -10.208 -6.257 1.00 0.00 C ATOM 894 O SER A 57 -5.878 -8.994 -6.265 1.00 0.00 O ATOM 895 CB SER A 57 -5.064 -11.217 -8.417 1.00 0.00 C ATOM 896 OG SER A 57 -3.988 -11.890 -9.058 1.00 0.00 O ATOM 0 H SER A 57 -4.702 -13.089 -6.964 1.00 0.00 H new ATOM 0 HA SER A 57 -3.801 -10.346 -6.879 1.00 0.00 H new ATOM 0 HB2 SER A 57 -5.971 -11.819 -8.475 1.00 0.00 H new ATOM 0 HB3 SER A 57 -5.274 -10.276 -8.925 1.00 0.00 H new ATOM 0 HG SER A 57 -4.220 -12.060 -9.995 1.00 0.00 H new ATOM 902 N SER A 58 -6.690 -10.929 -5.625 1.00 0.00 N ATOM 903 CA SER A 58 -7.802 -10.280 -4.888 1.00 0.00 C ATOM 904 C SER A 58 -7.191 -9.436 -3.786 1.00 0.00 C ATOM 905 O SER A 58 -7.601 -8.321 -3.528 1.00 0.00 O ATOM 906 CB SER A 58 -8.627 -11.423 -4.301 1.00 0.00 C ATOM 907 OG SER A 58 -9.534 -11.903 -5.283 1.00 0.00 O ATOM 0 H SER A 58 -6.681 -11.948 -5.585 1.00 0.00 H new ATOM 0 HA SER A 58 -8.425 -9.640 -5.513 1.00 0.00 H new ATOM 0 HB2 SER A 58 -7.970 -12.228 -3.972 1.00 0.00 H new ATOM 0 HB3 SER A 58 -9.173 -11.078 -3.423 1.00 0.00 H new ATOM 0 HG SER A 58 -10.063 -12.638 -4.908 1.00 0.00 H new ATOM 913 N MET A 59 -6.185 -9.963 -3.149 1.00 0.00 N ATOM 914 CA MET A 59 -5.506 -9.206 -2.078 1.00 0.00 C ATOM 915 C MET A 59 -4.489 -8.253 -2.707 1.00 0.00 C ATOM 916 O MET A 59 -4.083 -7.274 -2.111 1.00 0.00 O ATOM 917 CB MET A 59 -4.818 -10.273 -1.225 1.00 0.00 C ATOM 918 CG MET A 59 -4.067 -9.606 -0.073 1.00 0.00 C ATOM 919 SD MET A 59 -2.727 -10.688 0.479 1.00 0.00 S ATOM 920 CE MET A 59 -1.918 -10.870 -1.128 1.00 0.00 C ATOM 0 H MET A 59 -5.806 -10.892 -3.330 1.00 0.00 H new ATOM 0 HA MET A 59 -6.184 -8.598 -1.479 1.00 0.00 H new ATOM 0 HB2 MET A 59 -5.557 -10.972 -0.834 1.00 0.00 H new ATOM 0 HB3 MET A 59 -4.126 -10.851 -1.837 1.00 0.00 H new ATOM 0 HG2 MET A 59 -3.664 -8.646 -0.395 1.00 0.00 H new ATOM 0 HG3 MET A 59 -4.750 -9.405 0.752 1.00 0.00 H new ATOM 0 HE1 MET A 59 -2.044 -11.892 -1.485 1.00 0.00 H new ATOM 0 HE2 MET A 59 -2.366 -10.179 -1.841 1.00 0.00 H new ATOM 0 HE3 MET A 59 -0.855 -10.649 -1.027 1.00 0.00 H new ATOM 930 N ALA A 60 -4.089 -8.522 -3.924 1.00 0.00 N ATOM 931 CA ALA A 60 -3.119 -7.618 -4.598 1.00 0.00 C ATOM 932 C ALA A 60 -3.855 -6.374 -5.079 1.00 0.00 C ATOM 933 O ALA A 60 -3.346 -5.275 -5.013 1.00 0.00 O ATOM 934 CB ALA A 60 -2.577 -8.414 -5.786 1.00 0.00 C ATOM 0 H ALA A 60 -4.392 -9.325 -4.475 1.00 0.00 H new ATOM 0 HA ALA A 60 -2.313 -7.296 -3.938 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -1.854 -7.807 -6.331 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -2.092 -9.321 -5.425 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -3.399 -8.682 -6.450 1.00 0.00 H new ATOM 940 N LYS A 61 -5.065 -6.532 -5.538 1.00 0.00 N ATOM 941 CA LYS A 61 -5.833 -5.346 -5.993 1.00 0.00 C ATOM 942 C LYS A 61 -6.032 -4.426 -4.801 1.00 0.00 C ATOM 943 O LYS A 61 -6.156 -3.225 -4.929 1.00 0.00 O ATOM 944 CB LYS A 61 -7.167 -5.899 -6.488 1.00 0.00 C ATOM 945 CG LYS A 61 -6.939 -6.712 -7.760 1.00 0.00 C ATOM 946 CD LYS A 61 -7.814 -7.963 -7.712 1.00 0.00 C ATOM 947 CE LYS A 61 -9.250 -7.589 -8.071 1.00 0.00 C ATOM 948 NZ LYS A 61 -9.343 -7.782 -9.546 1.00 0.00 N ATOM 0 H LYS A 61 -5.550 -7.426 -5.617 1.00 0.00 H new ATOM 0 HA LYS A 61 -5.334 -4.778 -6.778 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.621 -6.525 -5.720 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -7.861 -5.082 -6.685 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -7.184 -6.114 -8.638 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -5.889 -6.990 -7.846 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -7.436 -8.712 -8.408 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -7.780 -8.407 -6.717 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -9.965 -8.221 -7.545 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -9.470 -6.558 -7.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -10.303 -7.544 -9.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -8.656 -7.163 -10.021 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -9.135 -8.774 -9.780 1.00 0.00 H new ATOM 962 N LEU A 62 -6.034 -4.996 -3.632 1.00 0.00 N ATOM 963 CA LEU A 62 -6.189 -4.184 -2.407 1.00 0.00 C ATOM 964 C LEU A 62 -4.910 -3.378 -2.187 1.00 0.00 C ATOM 965 O LEU A 62 -4.942 -2.247 -1.747 1.00 0.00 O ATOM 966 CB LEU A 62 -6.384 -5.205 -1.289 1.00 0.00 C ATOM 967 CG LEU A 62 -6.298 -4.507 0.068 1.00 0.00 C ATOM 968 CD1 LEU A 62 -7.087 -3.197 0.029 1.00 0.00 C ATOM 969 CD2 LEU A 62 -6.887 -5.420 1.144 1.00 0.00 C ATOM 0 H LEU A 62 -5.934 -5.999 -3.476 1.00 0.00 H new ATOM 0 HA LEU A 62 -7.019 -3.480 -2.455 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -7.352 -5.695 -1.396 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -5.624 -5.983 -1.357 1.00 0.00 H new ATOM 0 HG LEU A 62 -5.254 -4.292 0.297 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.022 -2.704 0.999 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -6.671 -2.544 -0.738 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -8.131 -3.408 -0.202 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -6.827 -4.925 2.113 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -7.930 -5.633 0.909 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.324 -6.353 1.177 1.00 0.00 H new ATOM 981 N CYS A 63 -3.783 -3.957 -2.505 1.00 0.00 N ATOM 982 CA CYS A 63 -2.493 -3.232 -2.331 1.00 0.00 C ATOM 983 C CYS A 63 -2.317 -2.214 -3.457 1.00 0.00 C ATOM 984 O CYS A 63 -1.830 -1.121 -3.244 1.00 0.00 O ATOM 985 CB CYS A 63 -1.416 -4.316 -2.406 1.00 0.00 C ATOM 986 SG CYS A 63 -1.763 -5.596 -1.175 1.00 0.00 S ATOM 0 H CYS A 63 -3.701 -4.903 -2.878 1.00 0.00 H new ATOM 0 HA CYS A 63 -2.444 -2.681 -1.392 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -1.393 -4.753 -3.404 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -0.433 -3.880 -2.226 1.00 0.00 H new ATOM 0 HG CYS A 63 -2.633 -6.435 -1.655 1.00 0.00 H new ATOM 992 N HIS A 64 -2.723 -2.550 -4.653 1.00 0.00 N ATOM 993 CA HIS A 64 -2.587 -1.573 -5.770 1.00 0.00 C ATOM 994 C HIS A 64 -3.502 -0.383 -5.495 1.00 0.00 C ATOM 995 O HIS A 64 -3.245 0.730 -5.910 1.00 0.00 O ATOM 996 CB HIS A 64 -3.034 -2.316 -7.030 1.00 0.00 C ATOM 997 CG HIS A 64 -2.197 -1.864 -8.196 1.00 0.00 C ATOM 998 ND1 HIS A 64 -2.330 -2.414 -9.462 1.00 0.00 N ATOM 999 CD2 HIS A 64 -1.209 -0.916 -8.302 1.00 0.00 C ATOM 1000 CE1 HIS A 64 -1.445 -1.796 -10.267 1.00 0.00 C ATOM 1001 NE2 HIS A 64 -0.737 -0.874 -9.610 1.00 0.00 N ATOM 0 H HIS A 64 -3.138 -3.448 -4.902 1.00 0.00 H new ATOM 0 HA HIS A 64 -1.569 -1.199 -5.880 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -2.930 -3.392 -6.888 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -4.088 -2.121 -7.227 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -0.852 -0.297 -7.492 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -1.323 -2.019 -11.317 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -0.007 -0.269 -9.986 1.00 0.00 H new ATOM 1009 N THR A 65 -4.565 -0.622 -4.781 1.00 0.00 N ATOM 1010 CA THR A 65 -5.512 0.476 -4.446 1.00 0.00 C ATOM 1011 C THR A 65 -4.819 1.475 -3.507 1.00 0.00 C ATOM 1012 O THR A 65 -4.702 2.644 -3.814 1.00 0.00 O ATOM 1013 CB THR A 65 -6.694 -0.245 -3.775 1.00 0.00 C ATOM 1014 OG1 THR A 65 -7.757 -0.364 -4.709 1.00 0.00 O ATOM 1015 CG2 THR A 65 -7.184 0.527 -2.550 1.00 0.00 C ATOM 0 H THR A 65 -4.820 -1.538 -4.412 1.00 0.00 H new ATOM 0 HA THR A 65 -5.846 1.057 -5.306 1.00 0.00 H new ATOM 0 HB THR A 65 -6.361 -1.231 -3.451 1.00 0.00 H new ATOM 0 HG1 THR A 65 -7.965 -1.311 -4.849 1.00 0.00 H new ATOM 0 HG21 THR A 65 -8.020 -0.005 -2.095 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.373 0.615 -1.827 1.00 0.00 H new ATOM 0 HG23 THR A 65 -7.509 1.522 -2.853 1.00 0.00 H new ATOM 1023 N LEU A 66 -4.328 1.020 -2.383 1.00 0.00 N ATOM 1024 CA LEU A 66 -3.616 1.959 -1.466 1.00 0.00 C ATOM 1025 C LEU A 66 -2.547 2.667 -2.288 1.00 0.00 C ATOM 1026 O LEU A 66 -2.245 3.826 -2.092 1.00 0.00 O ATOM 1027 CB LEU A 66 -2.954 1.095 -0.381 1.00 0.00 C ATOM 1028 CG LEU A 66 -3.891 -0.025 0.092 1.00 0.00 C ATOM 1029 CD1 LEU A 66 -3.336 -0.626 1.382 1.00 0.00 C ATOM 1030 CD2 LEU A 66 -5.295 0.528 0.364 1.00 0.00 C ATOM 0 H LEU A 66 -4.388 0.053 -2.064 1.00 0.00 H new ATOM 0 HA LEU A 66 -4.280 2.695 -1.012 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -2.033 0.661 -0.771 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -2.677 1.722 0.467 1.00 0.00 H new ATOM 0 HG LEU A 66 -3.954 -0.785 -0.687 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -3.996 -1.423 1.725 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -2.342 -1.033 1.196 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -3.274 0.148 2.147 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -5.946 -0.280 0.698 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -5.241 1.294 1.138 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -5.698 0.964 -0.550 1.00 0.00 H new ATOM 1042 N GLU A 67 -1.987 1.953 -3.226 1.00 0.00 N ATOM 1043 CA GLU A 67 -0.943 2.539 -4.107 1.00 0.00 C ATOM 1044 C GLU A 67 -1.590 3.488 -5.107 1.00 0.00 C ATOM 1045 O GLU A 67 -1.103 4.571 -5.359 1.00 0.00 O ATOM 1046 CB GLU A 67 -0.328 1.339 -4.821 1.00 0.00 C ATOM 1047 CG GLU A 67 0.806 1.808 -5.734 1.00 0.00 C ATOM 1048 CD GLU A 67 0.306 1.859 -7.179 1.00 0.00 C ATOM 1049 OE1 GLU A 67 -0.892 1.998 -7.366 1.00 0.00 O ATOM 1050 OE2 GLU A 67 1.128 1.756 -8.074 1.00 0.00 O ATOM 0 H GLU A 67 -2.213 0.977 -3.420 1.00 0.00 H new ATOM 0 HA GLU A 67 -0.197 3.114 -3.559 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.052 0.625 -4.091 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -1.089 0.823 -5.406 1.00 0.00 H new ATOM 0 HG2 GLU A 67 1.154 2.793 -5.423 1.00 0.00 H new ATOM 0 HG3 GLU A 67 1.656 1.130 -5.655 1.00 0.00 H new ATOM 1057 N ASN A 68 -2.694 3.099 -5.671 1.00 0.00 N ATOM 1058 CA ASN A 68 -3.374 3.993 -6.636 1.00 0.00 C ATOM 1059 C ASN A 68 -3.431 5.397 -6.053 1.00 0.00 C ATOM 1060 O ASN A 68 -3.074 6.367 -6.690 1.00 0.00 O ATOM 1061 CB ASN A 68 -4.779 3.434 -6.757 1.00 0.00 C ATOM 1062 CG ASN A 68 -4.942 2.726 -8.102 1.00 0.00 C ATOM 1063 OD1 ASN A 68 -5.121 3.364 -9.121 1.00 0.00 O ATOM 1064 ND2 ASN A 68 -4.887 1.424 -8.151 1.00 0.00 N ATOM 0 H ASN A 68 -3.153 2.203 -5.505 1.00 0.00 H new ATOM 0 HA ASN A 68 -2.865 4.043 -7.599 1.00 0.00 H new ATOM 0 HB2 ASN A 68 -4.974 2.736 -5.943 1.00 0.00 H new ATOM 0 HB3 ASN A 68 -5.509 4.239 -6.669 1.00 0.00 H new ATOM 0 HD21 ASN A 68 -4.994 0.942 -9.044 1.00 0.00 H new ATOM 0 HD22 ASN A 68 -4.737 0.887 -7.297 1.00 0.00 H new ATOM 1071 N ILE A 69 -3.855 5.502 -4.827 1.00 0.00 N ATOM 1072 CA ILE A 69 -3.918 6.848 -4.181 1.00 0.00 C ATOM 1073 C ILE A 69 -2.527 7.424 -4.212 1.00 0.00 C ATOM 1074 O ILE A 69 -2.300 8.567 -4.551 1.00 0.00 O ATOM 1075 CB ILE A 69 -4.362 6.675 -2.715 1.00 0.00 C ATOM 1076 CG1 ILE A 69 -5.143 5.381 -2.507 1.00 0.00 C ATOM 1077 CG2 ILE A 69 -5.254 7.851 -2.319 1.00 0.00 C ATOM 1078 CD1 ILE A 69 -6.337 5.343 -3.450 1.00 0.00 C ATOM 0 H ILE A 69 -4.160 4.722 -4.244 1.00 0.00 H new ATOM 0 HA ILE A 69 -4.621 7.502 -4.697 1.00 0.00 H new ATOM 0 HB ILE A 69 -3.465 6.638 -2.098 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -4.497 4.522 -2.689 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -5.482 5.312 -1.473 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -5.571 7.734 -1.283 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -4.697 8.782 -2.425 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -6.131 7.877 -2.966 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -6.892 4.417 -3.298 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -6.988 6.193 -3.247 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -5.988 5.391 -4.481 1.00 0.00 H new ATOM 1090 N LEU A 70 -1.590 6.600 -3.892 1.00 0.00 N ATOM 1091 CA LEU A 70 -0.178 7.047 -3.924 1.00 0.00 C ATOM 1092 C LEU A 70 0.145 7.425 -5.353 1.00 0.00 C ATOM 1093 O LEU A 70 1.028 8.213 -5.629 1.00 0.00 O ATOM 1094 CB LEU A 70 0.660 5.858 -3.448 1.00 0.00 C ATOM 1095 CG LEU A 70 0.275 5.511 -2.008 1.00 0.00 C ATOM 1096 CD1 LEU A 70 0.947 4.200 -1.598 1.00 0.00 C ATOM 1097 CD2 LEU A 70 0.735 6.634 -1.075 1.00 0.00 C ATOM 0 H LEU A 70 -1.735 5.631 -3.608 1.00 0.00 H new ATOM 0 HA LEU A 70 0.022 7.909 -3.288 1.00 0.00 H new ATOM 0 HB2 LEU A 70 0.495 4.999 -4.098 1.00 0.00 H new ATOM 0 HB3 LEU A 70 1.721 6.101 -3.504 1.00 0.00 H new ATOM 0 HG LEU A 70 -0.807 5.399 -1.939 1.00 0.00 H new ATOM 0 HD11 LEU A 70 0.671 3.955 -0.572 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.620 3.400 -2.262 1.00 0.00 H new ATOM 0 HD13 LEU A 70 2.029 4.309 -1.667 1.00 0.00 H new ATOM 0 HD21 LEU A 70 0.462 6.389 -0.049 1.00 0.00 H new ATOM 0 HD22 LEU A 70 1.817 6.746 -1.146 1.00 0.00 H new ATOM 0 HD23 LEU A 70 0.254 7.568 -1.365 1.00 0.00 H new ATOM 1109 N ASP A 71 -0.614 6.895 -6.260 1.00 0.00 N ATOM 1110 CA ASP A 71 -0.422 7.241 -7.681 1.00 0.00 C ATOM 1111 C ASP A 71 -1.043 8.607 -7.913 1.00 0.00 C ATOM 1112 O ASP A 71 -0.417 9.491 -8.458 1.00 0.00 O ATOM 1113 CB ASP A 71 -1.156 6.157 -8.471 1.00 0.00 C ATOM 1114 CG ASP A 71 -0.397 5.870 -9.768 1.00 0.00 C ATOM 1115 OD1 ASP A 71 0.376 6.720 -10.180 1.00 0.00 O ATOM 1116 OD2 ASP A 71 -0.603 4.806 -10.329 1.00 0.00 O ATOM 0 H ASP A 71 -1.365 6.231 -6.074 1.00 0.00 H new ATOM 0 HA ASP A 71 0.624 7.286 -7.983 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -1.235 5.248 -7.875 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -2.172 6.481 -8.696 1.00 0.00 H new ATOM 1121 N LYS A 72 -2.256 8.818 -7.464 1.00 0.00 N ATOM 1122 CA LYS A 72 -2.847 10.165 -7.645 1.00 0.00 C ATOM 1123 C LYS A 72 -2.038 11.146 -6.820 1.00 0.00 C ATOM 1124 O LYS A 72 -1.891 12.305 -7.154 1.00 0.00 O ATOM 1125 CB LYS A 72 -4.257 10.044 -7.111 1.00 0.00 C ATOM 1126 CG LYS A 72 -5.161 9.499 -8.196 1.00 0.00 C ATOM 1127 CD LYS A 72 -6.066 8.470 -7.553 1.00 0.00 C ATOM 1128 CE LYS A 72 -5.357 7.123 -7.523 1.00 0.00 C ATOM 1129 NZ LYS A 72 -6.287 6.176 -8.199 1.00 0.00 N ATOM 0 H LYS A 72 -2.844 8.131 -6.993 1.00 0.00 H new ATOM 0 HA LYS A 72 -2.847 10.511 -8.679 1.00 0.00 H new ATOM 0 HB2 LYS A 72 -4.274 9.384 -6.243 1.00 0.00 H new ATOM 0 HB3 LYS A 72 -4.616 11.018 -6.778 1.00 0.00 H new ATOM 0 HG2 LYS A 72 -5.748 10.300 -8.645 1.00 0.00 H new ATOM 0 HG3 LYS A 72 -4.573 9.048 -8.995 1.00 0.00 H new ATOM 0 HD2 LYS A 72 -6.326 8.780 -6.541 1.00 0.00 H new ATOM 0 HD3 LYS A 72 -6.999 8.390 -8.111 1.00 0.00 H new ATOM 0 HE2 LYS A 72 -4.399 7.171 -8.041 1.00 0.00 H new ATOM 0 HE3 LYS A 72 -5.151 6.809 -6.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 -5.762 5.332 -8.504 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 -7.039 5.896 -7.537 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 -6.711 6.638 -9.029 1.00 0.00 H new ATOM 1143 N ALA A 73 -1.487 10.658 -5.756 1.00 0.00 N ATOM 1144 CA ALA A 73 -0.642 11.514 -4.891 1.00 0.00 C ATOM 1145 C ALA A 73 0.515 12.029 -5.730 1.00 0.00 C ATOM 1146 O ALA A 73 0.897 13.179 -5.650 1.00 0.00 O ATOM 1147 CB ALA A 73 -0.142 10.590 -3.782 1.00 0.00 C ATOM 0 H ALA A 73 -1.586 9.692 -5.443 1.00 0.00 H new ATOM 0 HA ALA A 73 -1.169 12.372 -4.474 1.00 0.00 H new ATOM 0 HB1 ALA A 73 0.493 11.153 -3.098 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -0.993 10.184 -3.235 1.00 0.00 H new ATOM 0 HB3 ALA A 73 0.431 9.773 -4.220 1.00 0.00 H new ATOM 1153 N ARG A 74 1.055 11.183 -6.565 1.00 0.00 N ATOM 1154 CA ARG A 74 2.163 11.628 -7.442 1.00 0.00 C ATOM 1155 C ARG A 74 1.572 12.153 -8.752 1.00 0.00 C ATOM 1156 O ARG A 74 2.240 12.805 -9.531 1.00 0.00 O ATOM 1157 CB ARG A 74 3.047 10.393 -7.667 1.00 0.00 C ATOM 1158 CG ARG A 74 2.455 9.496 -8.759 1.00 0.00 C ATOM 1159 CD ARG A 74 3.510 8.481 -9.206 1.00 0.00 C ATOM 1160 NE ARG A 74 2.780 7.524 -10.083 1.00 0.00 N ATOM 1161 CZ ARG A 74 3.201 7.306 -11.299 1.00 0.00 C ATOM 1162 NH1 ARG A 74 4.478 7.183 -11.537 1.00 0.00 N ATOM 1163 NH2 ARG A 74 2.343 7.211 -12.278 1.00 0.00 N ATOM 0 H ARG A 74 0.775 10.208 -6.674 1.00 0.00 H new ATOM 0 HA ARG A 74 2.754 12.434 -7.007 1.00 0.00 H new ATOM 0 HB2 ARG A 74 4.052 10.706 -7.951 1.00 0.00 H new ATOM 0 HB3 ARG A 74 3.139 9.831 -6.738 1.00 0.00 H new ATOM 0 HG2 ARG A 74 1.573 8.979 -8.382 1.00 0.00 H new ATOM 0 HG3 ARG A 74 2.133 10.100 -9.607 1.00 0.00 H new ATOM 0 HD2 ARG A 74 4.323 8.968 -9.745 1.00 0.00 H new ATOM 0 HD3 ARG A 74 3.955 7.972 -8.351 1.00 0.00 H new ATOM 0 HE ARG A 74 1.953 7.040 -9.734 1.00 0.00 H new ATOM 0 HH11 ARG A 74 5.149 7.257 -10.772 1.00 0.00 H new ATOM 0 HH12 ARG A 74 4.805 7.013 -12.488 1.00 0.00 H new ATOM 0 HH21 ARG A 74 1.345 7.307 -12.092 1.00 0.00 H new ATOM 0 HH22 ARG A 74 2.671 7.041 -13.229 1.00 0.00 H new ATOM 1177 N ASN A 75 0.310 11.889 -8.987 1.00 0.00 N ATOM 1178 CA ASN A 75 -0.334 12.393 -10.235 1.00 0.00 C ATOM 1179 C ASN A 75 -1.041 13.719 -9.942 1.00 0.00 C ATOM 1180 O ASN A 75 -1.619 14.333 -10.816 1.00 0.00 O ATOM 1181 CB ASN A 75 -1.348 11.321 -10.642 1.00 0.00 C ATOM 1182 CG ASN A 75 -1.343 11.166 -12.165 1.00 0.00 C ATOM 1183 OD1 ASN A 75 -0.675 10.302 -12.697 1.00 0.00 O ATOM 1184 ND2 ASN A 75 -2.065 11.973 -12.895 1.00 0.00 N ATOM 0 H ASN A 75 -0.298 11.349 -8.371 1.00 0.00 H new ATOM 0 HA ASN A 75 0.389 12.573 -11.031 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -1.099 10.371 -10.168 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -2.344 11.598 -10.297 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -2.068 11.877 -13.911 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -2.626 12.699 -12.450 1.00 0.00 H new ATOM 1191 N SER A 76 -0.991 14.161 -8.710 1.00 0.00 N ATOM 1192 CA SER A 76 -1.645 15.447 -8.328 1.00 0.00 C ATOM 1193 C SER A 76 -3.164 15.280 -8.256 1.00 0.00 C ATOM 1194 O SER A 76 -3.907 16.197 -8.540 1.00 0.00 O ATOM 1195 CB SER A 76 -1.261 16.445 -9.422 1.00 0.00 C ATOM 1196 OG SER A 76 -0.973 17.705 -8.827 1.00 0.00 O ATOM 0 H SER A 76 -0.519 13.679 -7.945 1.00 0.00 H new ATOM 0 HA SER A 76 -1.322 15.786 -7.344 1.00 0.00 H new ATOM 0 HB2 SER A 76 -0.393 16.083 -9.973 1.00 0.00 H new ATOM 0 HB3 SER A 76 -2.075 16.546 -10.140 1.00 0.00 H new ATOM 0 HG SER A 76 -0.725 18.347 -9.525 1.00 0.00 H new ATOM 1202 N GLU A 77 -3.638 14.123 -7.870 1.00 0.00 N ATOM 1203 CA GLU A 77 -5.108 13.932 -7.780 1.00 0.00 C ATOM 1204 C GLU A 77 -5.518 13.744 -6.321 1.00 0.00 C ATOM 1205 O GLU A 77 -6.539 14.236 -5.881 1.00 0.00 O ATOM 1206 CB GLU A 77 -5.401 12.692 -8.623 1.00 0.00 C ATOM 1207 CG GLU A 77 -5.247 13.041 -10.104 1.00 0.00 C ATOM 1208 CD GLU A 77 -6.384 13.971 -10.532 1.00 0.00 C ATOM 1209 OE1 GLU A 77 -7.184 14.325 -9.682 1.00 0.00 O ATOM 1210 OE2 GLU A 77 -6.434 14.314 -11.702 1.00 0.00 O ATOM 0 H GLU A 77 -3.073 13.312 -7.616 1.00 0.00 H new ATOM 0 HA GLU A 77 -5.672 14.790 -8.145 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -4.718 11.886 -8.354 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -6.411 12.334 -8.425 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -4.285 13.523 -10.276 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -5.261 12.132 -10.706 1.00 0.00 H new ATOM 1217 N ILE A 78 -4.718 13.059 -5.565 1.00 0.00 N ATOM 1218 CA ILE A 78 -5.047 12.861 -4.120 1.00 0.00 C ATOM 1219 C ILE A 78 -3.802 13.052 -3.254 1.00 0.00 C ATOM 1220 O ILE A 78 -2.762 13.473 -3.717 1.00 0.00 O ATOM 1221 CB ILE A 78 -5.547 11.421 -3.996 1.00 0.00 C ATOM 1222 CG1 ILE A 78 -4.387 10.449 -4.229 1.00 0.00 C ATOM 1223 CG2 ILE A 78 -6.641 11.169 -5.035 1.00 0.00 C ATOM 1224 CD1 ILE A 78 -3.569 10.284 -2.951 1.00 0.00 C ATOM 0 H ILE A 78 -3.849 12.625 -5.877 1.00 0.00 H new ATOM 0 HA ILE A 78 -5.792 13.582 -3.784 1.00 0.00 H new ATOM 0 HB ILE A 78 -5.952 11.265 -2.996 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -4.773 9.481 -4.549 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -3.749 10.819 -5.032 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -6.997 10.143 -4.947 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -7.469 11.857 -4.865 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -6.237 11.328 -6.035 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -2.748 9.590 -3.132 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -3.167 11.251 -2.649 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -4.207 9.893 -2.159 1.00 0.00 H new ATOM 1236 N LYS A 79 -3.906 12.720 -1.999 1.00 0.00 N ATOM 1237 CA LYS A 79 -2.741 12.841 -1.081 1.00 0.00 C ATOM 1238 C LYS A 79 -3.009 12.031 0.189 1.00 0.00 C ATOM 1239 O LYS A 79 -3.788 11.098 0.186 1.00 0.00 O ATOM 1240 CB LYS A 79 -2.614 14.332 -0.768 1.00 0.00 C ATOM 1241 CG LYS A 79 -3.739 14.763 0.175 1.00 0.00 C ATOM 1242 CD LYS A 79 -4.645 15.758 -0.543 1.00 0.00 C ATOM 1243 CE LYS A 79 -3.799 16.875 -1.157 1.00 0.00 C ATOM 1244 NZ LYS A 79 -4.498 18.136 -0.782 1.00 0.00 N ATOM 0 H LYS A 79 -4.758 12.366 -1.565 1.00 0.00 H new ATOM 0 HA LYS A 79 -1.820 12.457 -1.521 1.00 0.00 H new ATOM 0 HB2 LYS A 79 -1.646 14.535 -0.310 1.00 0.00 H new ATOM 0 HB3 LYS A 79 -2.659 14.911 -1.690 1.00 0.00 H new ATOM 0 HG2 LYS A 79 -4.315 13.894 0.494 1.00 0.00 H new ATOM 0 HG3 LYS A 79 -3.322 15.217 1.074 1.00 0.00 H new ATOM 0 HD2 LYS A 79 -5.214 15.250 -1.321 1.00 0.00 H new ATOM 0 HD3 LYS A 79 -5.367 16.178 0.157 1.00 0.00 H new ATOM 0 HE2 LYS A 79 -2.780 16.858 -0.769 1.00 0.00 H new ATOM 0 HE3 LYS A 79 -3.730 16.769 -2.240 1.00 0.00 H new ATOM 0 HZ1 LYS A 79 -3.977 18.949 -1.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 79 -5.463 18.127 -1.170 1.00 0.00 H new ATOM 0 HZ3 LYS A 79 -4.543 18.213 0.254 1.00 0.00 H new ATOM 1258 N ILE A 80 -2.369 12.368 1.269 1.00 0.00 N ATOM 1259 CA ILE A 80 -2.584 11.605 2.527 1.00 0.00 C ATOM 1260 C ILE A 80 -3.061 12.519 3.642 1.00 0.00 C ATOM 1261 O ILE A 80 -2.362 12.800 4.596 1.00 0.00 O ATOM 1262 CB ILE A 80 -1.224 11.027 2.827 1.00 0.00 C ATOM 1263 CG1 ILE A 80 -1.013 9.865 1.876 1.00 0.00 C ATOM 1264 CG2 ILE A 80 -1.157 10.547 4.278 1.00 0.00 C ATOM 1265 CD1 ILE A 80 -0.288 10.352 0.626 1.00 0.00 C ATOM 0 H ILE A 80 -1.705 13.140 1.336 1.00 0.00 H new ATOM 0 HA ILE A 80 -3.352 10.837 2.436 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.447 11.780 2.695 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -0.431 9.083 2.365 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.973 9.426 1.604 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -0.169 10.132 4.479 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -1.341 11.387 4.948 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -1.913 9.779 4.442 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -0.137 9.515 -0.056 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -0.886 11.119 0.134 1.00 0.00 H new ATOM 0 HD13 ILE A 80 0.679 10.771 0.906 1.00 0.00 H new ATOM 1277 N THR A 81 -4.263 12.963 3.517 1.00 0.00 N ATOM 1278 CA THR A 81 -4.864 13.854 4.546 1.00 0.00 C ATOM 1279 C THR A 81 -5.386 13.020 5.715 1.00 0.00 C ATOM 1280 O THR A 81 -6.474 13.248 6.207 1.00 0.00 O ATOM 1281 CB THR A 81 -6.030 14.528 3.827 1.00 0.00 C ATOM 1282 OG1 THR A 81 -6.879 13.531 3.277 1.00 0.00 O ATOM 1283 CG2 THR A 81 -5.497 15.418 2.705 1.00 0.00 C ATOM 0 H THR A 81 -4.876 12.747 2.731 1.00 0.00 H new ATOM 0 HA THR A 81 -4.149 14.570 4.951 1.00 0.00 H new ATOM 0 HB THR A 81 -6.590 15.139 4.535 1.00 0.00 H new ATOM 0 HG1 THR A 81 -7.630 13.959 2.816 1.00 0.00 H new ATOM 0 HG21 THR A 81 -6.332 15.898 2.194 1.00 0.00 H new ATOM 0 HG22 THR A 81 -4.842 16.181 3.126 1.00 0.00 H new ATOM 0 HG23 THR A 81 -4.937 14.811 1.994 1.00 0.00 H new ATOM 1291 N SER A 82 -4.641 12.041 6.154 1.00 0.00 N ATOM 1292 CA SER A 82 -5.127 11.184 7.274 1.00 0.00 C ATOM 1293 C SER A 82 -6.310 10.345 6.782 1.00 0.00 C ATOM 1294 O SER A 82 -6.285 9.131 6.818 1.00 0.00 O ATOM 1295 CB SER A 82 -5.567 12.155 8.370 1.00 0.00 C ATOM 1296 OG SER A 82 -6.987 12.220 8.400 1.00 0.00 O ATOM 0 H SER A 82 -3.721 11.798 5.787 1.00 0.00 H new ATOM 0 HA SER A 82 -4.365 10.497 7.643 1.00 0.00 H new ATOM 0 HB2 SER A 82 -5.186 11.826 9.337 1.00 0.00 H new ATOM 0 HB3 SER A 82 -5.150 13.145 8.183 1.00 0.00 H new ATOM 0 HG SER A 82 -7.297 12.897 7.762 1.00 0.00 H new ATOM 1302 N ASP A 83 -7.342 10.991 6.313 1.00 0.00 N ATOM 1303 CA ASP A 83 -8.529 10.254 5.803 1.00 0.00 C ATOM 1304 C ASP A 83 -8.164 9.435 4.564 1.00 0.00 C ATOM 1305 O ASP A 83 -8.411 8.247 4.505 1.00 0.00 O ATOM 1306 CB ASP A 83 -9.517 11.346 5.423 1.00 0.00 C ATOM 1307 CG ASP A 83 -10.922 10.955 5.887 1.00 0.00 C ATOM 1308 OD1 ASP A 83 -11.113 10.820 7.085 1.00 0.00 O ATOM 1309 OD2 ASP A 83 -11.783 10.798 5.038 1.00 0.00 O ATOM 0 H ASP A 83 -7.413 12.007 6.262 1.00 0.00 H new ATOM 0 HA ASP A 83 -8.927 9.557 6.540 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -9.223 12.291 5.880 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -9.509 11.497 4.344 1.00 0.00 H new ATOM 1314 N LEU A 84 -7.570 10.052 3.573 1.00 0.00 N ATOM 1315 CA LEU A 84 -7.193 9.281 2.359 1.00 0.00 C ATOM 1316 C LEU A 84 -6.241 8.186 2.782 1.00 0.00 C ATOM 1317 O LEU A 84 -6.344 7.050 2.366 1.00 0.00 O ATOM 1318 CB LEU A 84 -6.497 10.282 1.436 1.00 0.00 C ATOM 1319 CG LEU A 84 -7.513 11.306 0.935 1.00 0.00 C ATOM 1320 CD1 LEU A 84 -6.776 12.509 0.345 1.00 0.00 C ATOM 1321 CD2 LEU A 84 -8.392 10.666 -0.143 1.00 0.00 C ATOM 0 H LEU A 84 -7.334 11.044 3.555 1.00 0.00 H new ATOM 0 HA LEU A 84 -8.043 8.822 1.855 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.691 10.785 1.970 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -6.044 9.761 0.593 1.00 0.00 H new ATOM 0 HG LEU A 84 -8.138 11.635 1.765 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -7.501 13.240 -0.013 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -6.150 12.964 1.112 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -6.151 12.181 -0.486 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -9.118 11.396 -0.501 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -7.768 10.337 -0.974 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -8.917 9.809 0.278 1.00 0.00 H new ATOM 1333 N LEU A 85 -5.328 8.522 3.638 1.00 0.00 N ATOM 1334 CA LEU A 85 -4.375 7.503 4.128 1.00 0.00 C ATOM 1335 C LEU A 85 -5.130 6.511 5.024 1.00 0.00 C ATOM 1336 O LEU A 85 -4.814 5.339 5.079 1.00 0.00 O ATOM 1337 CB LEU A 85 -3.311 8.306 4.894 1.00 0.00 C ATOM 1338 CG LEU A 85 -3.363 8.000 6.392 1.00 0.00 C ATOM 1339 CD1 LEU A 85 -2.802 6.600 6.646 1.00 0.00 C ATOM 1340 CD2 LEU A 85 -2.528 9.031 7.153 1.00 0.00 C ATOM 0 H LEU A 85 -5.201 9.459 4.020 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.909 6.910 3.341 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.321 8.068 4.505 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -3.469 9.372 4.732 1.00 0.00 H new ATOM 0 HG LEU A 85 -4.396 8.045 6.736 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -2.839 6.381 7.713 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.398 5.865 6.104 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -1.769 6.554 6.302 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -2.565 8.813 8.220 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -1.494 8.987 6.809 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -2.929 10.029 6.972 1.00 0.00 H new ATOM 1352 N ASP A 86 -6.138 6.977 5.716 1.00 0.00 N ATOM 1353 CA ASP A 86 -6.927 6.066 6.594 1.00 0.00 C ATOM 1354 C ASP A 86 -7.555 4.962 5.745 1.00 0.00 C ATOM 1355 O ASP A 86 -7.569 3.806 6.121 1.00 0.00 O ATOM 1356 CB ASP A 86 -8.008 6.948 7.224 1.00 0.00 C ATOM 1357 CG ASP A 86 -7.731 7.110 8.720 1.00 0.00 C ATOM 1358 OD1 ASP A 86 -6.793 7.813 9.058 1.00 0.00 O ATOM 1359 OD2 ASP A 86 -8.463 6.528 9.504 1.00 0.00 O ATOM 0 H ASP A 86 -6.448 7.949 5.710 1.00 0.00 H new ATOM 0 HA ASP A 86 -6.316 5.583 7.356 1.00 0.00 H new ATOM 0 HB2 ASP A 86 -8.023 7.924 6.739 1.00 0.00 H new ATOM 0 HB3 ASP A 86 -8.990 6.501 7.072 1.00 0.00 H new ATOM 1364 N LYS A 87 -8.049 5.303 4.584 1.00 0.00 N ATOM 1365 CA LYS A 87 -8.643 4.264 3.701 1.00 0.00 C ATOM 1366 C LYS A 87 -7.506 3.405 3.172 1.00 0.00 C ATOM 1367 O LYS A 87 -7.564 2.192 3.178 1.00 0.00 O ATOM 1368 CB LYS A 87 -9.324 5.031 2.565 1.00 0.00 C ATOM 1369 CG LYS A 87 -10.280 6.070 3.149 1.00 0.00 C ATOM 1370 CD LYS A 87 -11.143 5.419 4.231 1.00 0.00 C ATOM 1371 CE LYS A 87 -12.435 6.220 4.401 1.00 0.00 C ATOM 1372 NZ LYS A 87 -12.290 6.905 5.714 1.00 0.00 N ATOM 0 H LYS A 87 -8.066 6.253 4.213 1.00 0.00 H new ATOM 0 HA LYS A 87 -9.359 3.617 4.207 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -8.575 5.521 1.943 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -9.870 4.340 1.922 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -9.716 6.902 3.571 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -10.913 6.480 2.362 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -11.374 4.390 3.957 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -10.598 5.383 5.174 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.563 6.939 3.592 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -13.309 5.568 4.390 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.138 7.476 5.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -12.176 6.195 6.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -11.454 7.523 5.692 1.00 0.00 H new ATOM 1386 N ILE A 88 -6.447 4.038 2.755 1.00 0.00 N ATOM 1387 CA ILE A 88 -5.272 3.275 2.268 1.00 0.00 C ATOM 1388 C ILE A 88 -4.770 2.402 3.421 1.00 0.00 C ATOM 1389 O ILE A 88 -4.412 1.255 3.249 1.00 0.00 O ATOM 1390 CB ILE A 88 -4.254 4.356 1.899 1.00 0.00 C ATOM 1391 CG1 ILE A 88 -4.392 4.716 0.432 1.00 0.00 C ATOM 1392 CG2 ILE A 88 -2.827 3.881 2.175 1.00 0.00 C ATOM 1393 CD1 ILE A 88 -4.296 6.238 0.299 1.00 0.00 C ATOM 0 H ILE A 88 -6.347 5.053 2.731 1.00 0.00 H new ATOM 0 HA ILE A 88 -5.475 2.619 1.421 1.00 0.00 H new ATOM 0 HB ILE A 88 -4.453 5.234 2.513 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -3.609 4.234 -0.153 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -5.346 4.360 0.042 1.00 0.00 H new ATOM 0 HG21 ILE A 88 -2.123 4.668 1.904 1.00 0.00 H new ATOM 0 HG22 ILE A 88 -2.720 3.647 3.234 1.00 0.00 H new ATOM 0 HG23 ILE A 88 -2.620 2.989 1.584 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -4.393 6.518 -0.750 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -5.095 6.705 0.875 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -3.331 6.576 0.677 1.00 0.00 H new ATOM 1405 N PHE A 89 -4.763 2.959 4.601 1.00 0.00 N ATOM 1406 CA PHE A 89 -4.307 2.198 5.799 1.00 0.00 C ATOM 1407 C PHE A 89 -5.359 1.159 6.176 1.00 0.00 C ATOM 1408 O PHE A 89 -5.088 0.193 6.859 1.00 0.00 O ATOM 1409 CB PHE A 89 -4.155 3.249 6.899 1.00 0.00 C ATOM 1410 CG PHE A 89 -3.896 2.569 8.222 1.00 0.00 C ATOM 1411 CD1 PHE A 89 -2.596 2.179 8.564 1.00 0.00 C ATOM 1412 CD2 PHE A 89 -4.954 2.334 9.107 1.00 0.00 C ATOM 1413 CE1 PHE A 89 -2.355 1.551 9.791 1.00 0.00 C ATOM 1414 CE2 PHE A 89 -4.713 1.706 10.335 1.00 0.00 C ATOM 1415 CZ PHE A 89 -3.414 1.314 10.676 1.00 0.00 C ATOM 0 H PHE A 89 -5.056 3.918 4.788 1.00 0.00 H new ATOM 0 HA PHE A 89 -3.374 1.660 5.629 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -3.333 3.924 6.659 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -5.058 3.856 6.962 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -1.780 2.363 7.881 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -5.956 2.637 8.843 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -1.352 1.249 10.055 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -5.529 1.524 11.018 1.00 0.00 H new ATOM 0 HZ PHE A 89 -3.228 0.828 11.622 1.00 0.00 H new ATOM 1425 N ALA A 90 -6.548 1.343 5.695 1.00 0.00 N ATOM 1426 CA ALA A 90 -7.630 0.366 5.971 1.00 0.00 C ATOM 1427 C ALA A 90 -7.426 -0.814 5.034 1.00 0.00 C ATOM 1428 O ALA A 90 -7.654 -1.956 5.382 1.00 0.00 O ATOM 1429 CB ALA A 90 -8.933 1.102 5.653 1.00 0.00 C ATOM 0 H ALA A 90 -6.822 2.137 5.116 1.00 0.00 H new ATOM 0 HA ALA A 90 -7.642 -0.003 6.997 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -9.779 0.439 5.834 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -9.019 1.982 6.290 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -8.931 1.410 4.607 1.00 0.00 H new ATOM 1435 N GLY A 91 -6.953 -0.535 3.851 1.00 0.00 N ATOM 1436 CA GLY A 91 -6.676 -1.624 2.883 1.00 0.00 C ATOM 1437 C GLY A 91 -5.492 -2.416 3.422 1.00 0.00 C ATOM 1438 O GLY A 91 -5.481 -3.631 3.413 1.00 0.00 O ATOM 0 H GLY A 91 -6.747 0.406 3.515 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -7.548 -2.267 2.768 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -6.449 -1.215 1.898 1.00 0.00 H new ATOM 1442 N VAL A 92 -4.506 -1.725 3.930 1.00 0.00 N ATOM 1443 CA VAL A 92 -3.330 -2.418 4.514 1.00 0.00 C ATOM 1444 C VAL A 92 -3.802 -3.191 5.743 1.00 0.00 C ATOM 1445 O VAL A 92 -3.197 -4.156 6.165 1.00 0.00 O ATOM 1446 CB VAL A 92 -2.363 -1.293 4.908 1.00 0.00 C ATOM 1447 CG1 VAL A 92 -1.452 -1.758 6.049 1.00 0.00 C ATOM 1448 CG2 VAL A 92 -1.506 -0.913 3.699 1.00 0.00 C ATOM 0 H VAL A 92 -4.468 -0.706 3.964 1.00 0.00 H new ATOM 0 HA VAL A 92 -2.851 -3.123 3.835 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.938 -0.429 5.240 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -0.770 -0.953 6.321 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -2.060 -2.026 6.913 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -0.878 -2.626 5.725 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.819 -0.114 3.977 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.937 -1.782 3.368 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.151 -0.572 2.889 1.00 0.00 H new ATOM 1458 N ASP A 93 -4.899 -2.767 6.308 1.00 0.00 N ATOM 1459 CA ASP A 93 -5.451 -3.460 7.501 1.00 0.00 C ATOM 1460 C ASP A 93 -6.200 -4.711 7.056 1.00 0.00 C ATOM 1461 O ASP A 93 -6.265 -5.695 7.766 1.00 0.00 O ATOM 1462 CB ASP A 93 -6.405 -2.444 8.135 1.00 0.00 C ATOM 1463 CG ASP A 93 -6.449 -2.664 9.649 1.00 0.00 C ATOM 1464 OD1 ASP A 93 -6.075 -3.741 10.081 1.00 0.00 O ATOM 1465 OD2 ASP A 93 -6.855 -1.751 10.350 1.00 0.00 O ATOM 0 H ASP A 93 -5.440 -1.963 5.990 1.00 0.00 H new ATOM 0 HA ASP A 93 -4.683 -3.780 8.205 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -6.073 -1.430 7.913 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -7.403 -2.553 7.711 1.00 0.00 H new ATOM 1470 N MET A 94 -6.753 -4.689 5.876 1.00 0.00 N ATOM 1471 CA MET A 94 -7.479 -5.886 5.380 1.00 0.00 C ATOM 1472 C MET A 94 -6.467 -6.929 4.902 1.00 0.00 C ATOM 1473 O MET A 94 -6.585 -8.100 5.206 1.00 0.00 O ATOM 1474 CB MET A 94 -8.350 -5.382 4.233 1.00 0.00 C ATOM 1475 CG MET A 94 -9.757 -5.110 4.765 1.00 0.00 C ATOM 1476 SD MET A 94 -10.360 -3.534 4.113 1.00 0.00 S ATOM 1477 CE MET A 94 -10.145 -3.927 2.363 1.00 0.00 C ATOM 0 H MET A 94 -6.733 -3.895 5.236 1.00 0.00 H new ATOM 0 HA MET A 94 -8.088 -6.364 6.147 1.00 0.00 H new ATOM 0 HB2 MET A 94 -7.925 -4.473 3.808 1.00 0.00 H new ATOM 0 HB3 MET A 94 -8.385 -6.122 3.433 1.00 0.00 H new ATOM 0 HG2 MET A 94 -10.429 -5.917 4.473 1.00 0.00 H new ATOM 0 HG3 MET A 94 -9.746 -5.084 5.855 1.00 0.00 H new ATOM 0 HE1 MET A 94 -10.024 -3.005 1.795 1.00 0.00 H new ATOM 0 HE2 MET A 94 -9.260 -4.550 2.236 1.00 0.00 H new ATOM 0 HE3 MET A 94 -11.021 -4.464 2.000 1.00 0.00 H new ATOM 1487 N ILE A 95 -5.455 -6.519 4.181 1.00 0.00 N ATOM 1488 CA ILE A 95 -4.441 -7.493 3.729 1.00 0.00 C ATOM 1489 C ILE A 95 -3.809 -8.145 4.953 1.00 0.00 C ATOM 1490 O ILE A 95 -3.510 -9.322 4.958 1.00 0.00 O ATOM 1491 CB ILE A 95 -3.425 -6.662 2.956 1.00 0.00 C ATOM 1492 CG1 ILE A 95 -2.789 -5.618 3.879 1.00 0.00 C ATOM 1493 CG2 ILE A 95 -4.128 -5.962 1.799 1.00 0.00 C ATOM 1494 CD1 ILE A 95 -1.629 -4.934 3.152 1.00 0.00 C ATOM 0 H ILE A 95 -5.295 -5.554 3.891 1.00 0.00 H new ATOM 0 HA ILE A 95 -4.848 -8.293 3.110 1.00 0.00 H new ATOM 0 HB ILE A 95 -2.642 -7.315 2.571 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -3.533 -4.879 4.176 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -2.430 -6.094 4.792 1.00 0.00 H new ATOM 0 HG21 ILE A 95 -3.406 -5.365 1.242 1.00 0.00 H new ATOM 0 HG22 ILE A 95 -4.570 -6.707 1.138 1.00 0.00 H new ATOM 0 HG23 ILE A 95 -4.911 -5.312 2.189 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -1.176 -4.191 3.808 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -0.882 -5.679 2.877 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -2.002 -4.444 2.252 1.00 0.00 H new ATOM 1506 N THR A 96 -3.641 -7.396 6.012 1.00 0.00 N ATOM 1507 CA THR A 96 -3.072 -7.989 7.246 1.00 0.00 C ATOM 1508 C THR A 96 -4.040 -9.064 7.710 1.00 0.00 C ATOM 1509 O THR A 96 -3.657 -10.164 8.056 1.00 0.00 O ATOM 1510 CB THR A 96 -2.999 -6.842 8.256 1.00 0.00 C ATOM 1511 OG1 THR A 96 -2.024 -5.902 7.831 1.00 0.00 O ATOM 1512 CG2 THR A 96 -2.614 -7.392 9.631 1.00 0.00 C ATOM 0 H THR A 96 -3.874 -6.405 6.070 1.00 0.00 H new ATOM 0 HA THR A 96 -2.087 -8.436 7.111 1.00 0.00 H new ATOM 0 HB THR A 96 -3.971 -6.354 8.323 1.00 0.00 H new ATOM 0 HG1 THR A 96 -2.465 -5.161 7.365 1.00 0.00 H new ATOM 0 HG21 THR A 96 -2.563 -6.573 10.349 1.00 0.00 H new ATOM 0 HG22 THR A 96 -3.363 -8.114 9.957 1.00 0.00 H new ATOM 0 HG23 THR A 96 -1.642 -7.881 9.568 1.00 0.00 H new ATOM 1520 N ARG A 97 -5.307 -8.752 7.685 1.00 0.00 N ATOM 1521 CA ARG A 97 -6.323 -9.755 8.088 1.00 0.00 C ATOM 1522 C ARG A 97 -6.421 -10.837 7.010 1.00 0.00 C ATOM 1523 O ARG A 97 -6.573 -12.005 7.301 1.00 0.00 O ATOM 1524 CB ARG A 97 -7.632 -8.970 8.189 1.00 0.00 C ATOM 1525 CG ARG A 97 -7.724 -8.257 9.544 1.00 0.00 C ATOM 1526 CD ARG A 97 -6.344 -7.760 9.984 1.00 0.00 C ATOM 1527 NE ARG A 97 -6.609 -6.900 11.170 1.00 0.00 N ATOM 1528 CZ ARG A 97 -5.880 -7.025 12.246 1.00 0.00 C ATOM 1529 NH1 ARG A 97 -5.901 -8.141 12.923 1.00 0.00 N ATOM 1530 NH2 ARG A 97 -5.131 -6.033 12.644 1.00 0.00 N ATOM 0 H ARG A 97 -5.679 -7.845 7.402 1.00 0.00 H new ATOM 0 HA ARG A 97 -6.081 -10.253 9.027 1.00 0.00 H new ATOM 0 HB2 ARG A 97 -7.689 -8.240 7.382 1.00 0.00 H new ATOM 0 HB3 ARG A 97 -8.479 -9.645 8.068 1.00 0.00 H new ATOM 0 HG2 ARG A 97 -8.414 -7.416 9.473 1.00 0.00 H new ATOM 0 HG3 ARG A 97 -8.128 -8.938 10.293 1.00 0.00 H new ATOM 0 HD2 ARG A 97 -5.687 -8.592 10.238 1.00 0.00 H new ATOM 0 HD3 ARG A 97 -5.854 -7.197 9.189 1.00 0.00 H new ATOM 0 HE ARG A 97 -7.361 -6.212 11.142 1.00 0.00 H new ATOM 0 HH11 ARG A 97 -6.487 -8.916 12.611 1.00 0.00 H new ATOM 0 HH12 ARG A 97 -5.331 -8.238 13.764 1.00 0.00 H new ATOM 0 HH21 ARG A 97 -5.116 -5.161 12.115 1.00 0.00 H new ATOM 0 HH22 ARG A 97 -4.561 -6.129 13.484 1.00 0.00 H new ATOM 1544 N MET A 98 -6.306 -10.456 5.764 1.00 0.00 N ATOM 1545 CA MET A 98 -6.362 -11.462 4.672 1.00 0.00 C ATOM 1546 C MET A 98 -5.127 -12.341 4.784 1.00 0.00 C ATOM 1547 O MET A 98 -5.150 -13.524 4.508 1.00 0.00 O ATOM 1548 CB MET A 98 -6.323 -10.647 3.376 1.00 0.00 C ATOM 1549 CG MET A 98 -7.693 -10.686 2.700 1.00 0.00 C ATOM 1550 SD MET A 98 -7.515 -10.240 0.953 1.00 0.00 S ATOM 1551 CE MET A 98 -9.255 -9.855 0.636 1.00 0.00 C ATOM 0 H MET A 98 -6.176 -9.491 5.460 1.00 0.00 H new ATOM 0 HA MET A 98 -7.246 -12.099 4.710 1.00 0.00 H new ATOM 0 HB2 MET A 98 -6.043 -9.616 3.592 1.00 0.00 H new ATOM 0 HB3 MET A 98 -5.564 -11.050 2.705 1.00 0.00 H new ATOM 0 HG2 MET A 98 -8.127 -11.682 2.790 1.00 0.00 H new ATOM 0 HG3 MET A 98 -8.375 -9.995 3.195 1.00 0.00 H new ATOM 0 HE1 MET A 98 -9.680 -10.609 -0.026 1.00 0.00 H new ATOM 0 HE2 MET A 98 -9.804 -9.849 1.578 1.00 0.00 H new ATOM 0 HE3 MET A 98 -9.331 -8.875 0.165 1.00 0.00 H new ATOM 1561 N VAL A 99 -4.044 -11.751 5.200 1.00 0.00 N ATOM 1562 CA VAL A 99 -2.785 -12.515 5.353 1.00 0.00 C ATOM 1563 C VAL A 99 -2.753 -13.202 6.721 1.00 0.00 C ATOM 1564 O VAL A 99 -2.373 -14.350 6.837 1.00 0.00 O ATOM 1565 CB VAL A 99 -1.688 -11.459 5.241 1.00 0.00 C ATOM 1566 CG1 VAL A 99 -0.399 -11.972 5.891 1.00 0.00 C ATOM 1567 CG2 VAL A 99 -1.425 -11.156 3.764 1.00 0.00 C ATOM 0 H VAL A 99 -3.980 -10.762 5.442 1.00 0.00 H new ATOM 0 HA VAL A 99 -2.670 -13.303 4.609 1.00 0.00 H new ATOM 0 HB VAL A 99 -2.011 -10.552 5.753 1.00 0.00 H new ATOM 0 HG11 VAL A 99 0.378 -11.213 5.807 1.00 0.00 H new ATOM 0 HG12 VAL A 99 -0.583 -12.187 6.944 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.074 -12.882 5.386 1.00 0.00 H new ATOM 0 HG21 VAL A 99 -0.642 -10.402 3.681 1.00 0.00 H new ATOM 0 HG22 VAL A 99 -1.107 -12.067 3.257 1.00 0.00 H new ATOM 0 HG23 VAL A 99 -2.338 -10.783 3.301 1.00 0.00 H new ATOM 1577 N ASP A 100 -3.166 -12.522 7.757 1.00 0.00 N ATOM 1578 CA ASP A 100 -3.166 -13.165 9.097 1.00 0.00 C ATOM 1579 C ASP A 100 -4.071 -14.384 9.034 1.00 0.00 C ATOM 1580 O ASP A 100 -3.869 -15.366 9.720 1.00 0.00 O ATOM 1581 CB ASP A 100 -3.721 -12.110 10.057 1.00 0.00 C ATOM 1582 CG ASP A 100 -4.218 -12.787 11.336 1.00 0.00 C ATOM 1583 OD1 ASP A 100 -3.799 -13.904 11.592 1.00 0.00 O ATOM 1584 OD2 ASP A 100 -5.010 -12.177 12.035 1.00 0.00 O ATOM 0 H ASP A 100 -3.500 -11.559 7.732 1.00 0.00 H new ATOM 0 HA ASP A 100 -2.179 -13.494 9.422 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -2.948 -11.380 10.297 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -4.537 -11.565 9.582 1.00 0.00 H new ATOM 1589 N LYS A 101 -5.057 -14.333 8.185 1.00 0.00 N ATOM 1590 CA LYS A 101 -5.966 -15.492 8.038 1.00 0.00 C ATOM 1591 C LYS A 101 -5.414 -16.418 6.947 1.00 0.00 C ATOM 1592 O LYS A 101 -5.692 -17.596 6.925 1.00 0.00 O ATOM 1593 CB LYS A 101 -7.332 -14.889 7.667 1.00 0.00 C ATOM 1594 CG LYS A 101 -7.578 -15.019 6.167 1.00 0.00 C ATOM 1595 CD LYS A 101 -7.935 -16.460 5.843 1.00 0.00 C ATOM 1596 CE LYS A 101 -9.385 -16.543 5.357 1.00 0.00 C ATOM 1597 NZ LYS A 101 -10.214 -16.232 6.554 1.00 0.00 N ATOM 0 H LYS A 101 -5.270 -13.535 7.587 1.00 0.00 H new ATOM 0 HA LYS A 101 -6.057 -16.096 8.941 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -8.123 -15.398 8.218 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -7.365 -13.839 7.958 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -8.385 -14.354 5.860 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -6.689 -14.719 5.613 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -7.263 -16.846 5.077 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -7.803 -17.084 6.727 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -9.572 -15.832 4.552 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -9.614 -17.534 4.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -11.196 -16.528 6.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -9.838 -16.742 7.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -10.188 -15.209 6.738 1.00 0.00 H new ATOM 1611 N ILE A 102 -4.623 -15.895 6.047 1.00 0.00 N ATOM 1612 CA ILE A 102 -4.043 -16.761 4.982 1.00 0.00 C ATOM 1613 C ILE A 102 -2.974 -17.632 5.637 1.00 0.00 C ATOM 1614 O ILE A 102 -2.969 -18.839 5.515 1.00 0.00 O ATOM 1615 CB ILE A 102 -3.451 -15.785 3.953 1.00 0.00 C ATOM 1616 CG1 ILE A 102 -4.384 -15.692 2.745 1.00 0.00 C ATOM 1617 CG2 ILE A 102 -2.066 -16.247 3.485 1.00 0.00 C ATOM 1618 CD1 ILE A 102 -4.184 -14.347 2.037 1.00 0.00 C ATOM 0 H ILE A 102 -4.356 -14.912 6.004 1.00 0.00 H new ATOM 0 HA ILE A 102 -4.758 -17.424 4.495 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.348 -14.809 4.427 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -4.182 -16.511 2.054 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.421 -15.794 3.066 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -1.672 -15.537 2.758 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -1.392 -16.302 4.340 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -2.147 -17.231 3.024 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -4.851 -14.286 1.177 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -4.408 -13.535 2.729 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -3.150 -14.263 1.701 1.00 0.00 H new ATOM 1630 N VAL A 103 -2.094 -17.018 6.375 1.00 0.00 N ATOM 1631 CA VAL A 103 -1.056 -17.799 7.084 1.00 0.00 C ATOM 1632 C VAL A 103 -1.772 -18.744 8.045 1.00 0.00 C ATOM 1633 O VAL A 103 -1.312 -19.830 8.343 1.00 0.00 O ATOM 1634 CB VAL A 103 -0.238 -16.755 7.847 1.00 0.00 C ATOM 1635 CG1 VAL A 103 0.482 -17.417 9.024 1.00 0.00 C ATOM 1636 CG2 VAL A 103 0.793 -16.128 6.905 1.00 0.00 C ATOM 0 H VAL A 103 -2.052 -16.009 6.515 1.00 0.00 H new ATOM 0 HA VAL A 103 -0.417 -18.393 6.431 1.00 0.00 H new ATOM 0 HB VAL A 103 -0.906 -15.981 8.225 1.00 0.00 H new ATOM 0 HG11 VAL A 103 1.063 -16.668 9.563 1.00 0.00 H new ATOM 0 HG12 VAL A 103 -0.252 -17.860 9.697 1.00 0.00 H new ATOM 0 HG13 VAL A 103 1.149 -18.194 8.652 1.00 0.00 H new ATOM 0 HG21 VAL A 103 1.376 -15.384 7.447 1.00 0.00 H new ATOM 0 HG22 VAL A 103 1.458 -16.904 6.525 1.00 0.00 H new ATOM 0 HG23 VAL A 103 0.280 -15.649 6.071 1.00 0.00 H new ATOM 1646 N SER A 104 -2.913 -18.323 8.521 1.00 0.00 N ATOM 1647 CA SER A 104 -3.702 -19.166 9.458 1.00 0.00 C ATOM 1648 C SER A 104 -4.510 -20.201 8.689 1.00 0.00 C ATOM 1649 O SER A 104 -4.386 -21.392 8.894 1.00 0.00 O ATOM 1650 CB SER A 104 -4.636 -18.189 10.168 1.00 0.00 C ATOM 1651 OG SER A 104 -5.194 -18.820 11.313 1.00 0.00 O ATOM 0 H SER A 104 -3.334 -17.421 8.297 1.00 0.00 H new ATOM 0 HA SER A 104 -3.066 -19.713 10.154 1.00 0.00 H new ATOM 0 HB2 SER A 104 -4.089 -17.294 10.463 1.00 0.00 H new ATOM 0 HB3 SER A 104 -5.429 -17.870 9.492 1.00 0.00 H new ATOM 0 HG SER A 104 -5.793 -18.195 11.772 1.00 0.00 H new ATOM 1657 N GLU A 105 -5.342 -19.744 7.811 1.00 0.00 N ATOM 1658 CA GLU A 105 -6.188 -20.678 7.010 1.00 0.00 C ATOM 1659 C GLU A 105 -5.644 -20.796 5.583 1.00 0.00 C ATOM 1660 O GLU A 105 -5.654 -21.855 4.989 1.00 0.00 O ATOM 1661 CB GLU A 105 -7.580 -20.040 6.994 1.00 0.00 C ATOM 1662 CG GLU A 105 -7.905 -19.457 8.371 1.00 0.00 C ATOM 1663 CD GLU A 105 -9.415 -19.516 8.608 1.00 0.00 C ATOM 1664 OE1 GLU A 105 -10.119 -19.933 7.704 1.00 0.00 O ATOM 1665 OE2 GLU A 105 -9.841 -19.143 9.689 1.00 0.00 O ATOM 0 H GLU A 105 -5.480 -18.755 7.605 1.00 0.00 H new ATOM 0 HA GLU A 105 -6.201 -21.683 7.432 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -7.620 -19.255 6.239 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.327 -20.785 6.720 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -7.383 -20.017 9.147 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -7.557 -18.426 8.432 1.00 0.00 H new ATOM 1672 N GLY A 106 -5.175 -19.712 5.032 1.00 0.00 N ATOM 1673 CA GLY A 106 -4.634 -19.749 3.642 1.00 0.00 C ATOM 1674 C GLY A 106 -5.657 -19.137 2.684 1.00 0.00 C ATOM 1675 O GLY A 106 -5.668 -19.425 1.503 1.00 0.00 O ATOM 0 H GLY A 106 -5.142 -18.798 5.485 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -3.695 -19.198 3.590 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -4.416 -20.777 3.352 1.00 0.00 H new ATOM 1679 N SER A 107 -6.524 -18.301 3.186 1.00 0.00 N ATOM 1680 CA SER A 107 -7.558 -17.677 2.300 1.00 0.00 C ATOM 1681 C SER A 107 -7.570 -16.156 2.434 1.00 0.00 C ATOM 1682 O SER A 107 -7.753 -15.605 3.494 1.00 0.00 O ATOM 1683 CB SER A 107 -8.893 -18.247 2.766 1.00 0.00 C ATOM 1684 OG SER A 107 -8.677 -19.181 3.817 1.00 0.00 O ATOM 0 H SER A 107 -6.565 -18.021 4.166 1.00 0.00 H new ATOM 0 HA SER A 107 -7.352 -17.896 1.252 1.00 0.00 H new ATOM 0 HB2 SER A 107 -9.542 -17.442 3.110 1.00 0.00 H new ATOM 0 HB3 SER A 107 -9.402 -18.733 1.934 1.00 0.00 H new ATOM 0 HG SER A 107 -9.538 -19.543 4.115 1.00 0.00 H new ATOM 1690 N ASP A 108 -7.418 -15.470 1.348 1.00 0.00 N ATOM 1691 CA ASP A 108 -7.462 -13.985 1.404 1.00 0.00 C ATOM 1692 C ASP A 108 -8.921 -13.538 1.326 1.00 0.00 C ATOM 1693 O ASP A 108 -9.221 -12.377 1.137 1.00 0.00 O ATOM 1694 CB ASP A 108 -6.686 -13.514 0.173 1.00 0.00 C ATOM 1695 CG ASP A 108 -7.469 -13.876 -1.092 1.00 0.00 C ATOM 1696 OD1 ASP A 108 -8.454 -14.585 -0.973 1.00 0.00 O ATOM 1697 OD2 ASP A 108 -7.070 -13.436 -2.156 1.00 0.00 O ATOM 0 H ASP A 108 -7.265 -15.868 0.421 1.00 0.00 H new ATOM 0 HA ASP A 108 -7.034 -13.577 2.320 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -6.528 -12.437 0.220 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.701 -13.980 0.150 1.00 0.00 H new ATOM 1702 N ASP A 109 -9.835 -14.465 1.457 1.00 0.00 N ATOM 1703 CA ASP A 109 -11.280 -14.104 1.376 1.00 0.00 C ATOM 1704 C ASP A 109 -11.837 -13.763 2.761 1.00 0.00 C ATOM 1705 O ASP A 109 -12.549 -14.543 3.362 1.00 0.00 O ATOM 1706 CB ASP A 109 -11.965 -15.352 0.816 1.00 0.00 C ATOM 1707 CG ASP A 109 -13.027 -14.938 -0.205 1.00 0.00 C ATOM 1708 OD1 ASP A 109 -13.955 -14.247 0.182 1.00 0.00 O ATOM 1709 OD2 ASP A 109 -12.894 -15.321 -1.355 1.00 0.00 O ATOM 0 H ASP A 109 -9.643 -15.454 1.616 1.00 0.00 H new ATOM 0 HA ASP A 109 -11.445 -13.225 0.752 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -11.229 -16.004 0.346 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -12.425 -15.921 1.624 1.00 0.00 H new ATOM 1714 N ILE A 110 -11.534 -12.599 3.268 1.00 0.00 N ATOM 1715 CA ILE A 110 -12.065 -12.210 4.606 1.00 0.00 C ATOM 1716 C ILE A 110 -13.294 -11.314 4.432 1.00 0.00 C ATOM 1717 O ILE A 110 -13.519 -10.398 5.196 1.00 0.00 O ATOM 1718 CB ILE A 110 -10.939 -11.433 5.284 1.00 0.00 C ATOM 1719 CG1 ILE A 110 -10.649 -10.166 4.483 1.00 0.00 C ATOM 1720 CG2 ILE A 110 -9.676 -12.296 5.351 1.00 0.00 C ATOM 1721 CD1 ILE A 110 -9.824 -9.201 5.335 1.00 0.00 C ATOM 0 H ILE A 110 -10.943 -11.902 2.815 1.00 0.00 H new ATOM 0 HA ILE A 110 -12.367 -13.076 5.195 1.00 0.00 H new ATOM 0 HB ILE A 110 -11.243 -11.167 6.297 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -10.108 -10.416 3.571 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -11.583 -9.693 4.180 1.00 0.00 H new ATOM 0 HG21 ILE A 110 -8.877 -11.735 5.836 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -9.883 -13.200 5.923 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -9.367 -12.568 4.342 1.00 0.00 H new ATOM 0 HD11 ILE A 110 -9.617 -8.297 4.763 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -10.382 -8.942 6.235 1.00 0.00 H new ATOM 0 HD13 ILE A 110 -8.884 -9.676 5.616 1.00 0.00 H new ATOM 1733 N GLY A 111 -14.083 -11.565 3.423 1.00 0.00 N ATOM 1734 CA GLY A 111 -15.285 -10.717 3.196 1.00 0.00 C ATOM 1735 C GLY A 111 -14.845 -9.366 2.627 1.00 0.00 C ATOM 1736 O GLY A 111 -15.648 -8.484 2.402 1.00 0.00 O ATOM 0 H GLY A 111 -13.947 -12.318 2.749 1.00 0.00 H new ATOM 0 HA2 GLY A 111 -15.969 -11.211 2.506 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -15.826 -10.573 4.131 1.00 0.00 H new ATOM 1740 N GLU A 112 -13.569 -9.200 2.395 1.00 0.00 N ATOM 1741 CA GLU A 112 -13.067 -7.910 1.844 1.00 0.00 C ATOM 1742 C GLU A 112 -13.964 -7.412 0.707 1.00 0.00 C ATOM 1743 O GLU A 112 -14.850 -8.104 0.244 1.00 0.00 O ATOM 1744 CB GLU A 112 -11.671 -8.232 1.317 1.00 0.00 C ATOM 1745 CG GLU A 112 -10.622 -7.701 2.293 1.00 0.00 C ATOM 1746 CD GLU A 112 -9.457 -7.095 1.512 1.00 0.00 C ATOM 1747 OE1 GLU A 112 -9.716 -6.302 0.621 1.00 0.00 O ATOM 1748 OE2 GLU A 112 -8.326 -7.437 1.815 1.00 0.00 O ATOM 0 H GLU A 112 -12.852 -9.906 2.565 1.00 0.00 H new ATOM 0 HA GLU A 112 -13.058 -7.122 2.597 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -11.557 -9.309 1.194 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -11.529 -7.782 0.334 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -11.065 -6.949 2.946 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -10.264 -8.508 2.933 1.00 0.00 H new ATOM 1755 N ASN A 113 -13.726 -6.211 0.257 1.00 0.00 N ATOM 1756 CA ASN A 113 -14.540 -5.636 -0.853 1.00 0.00 C ATOM 1757 C ASN A 113 -13.663 -4.725 -1.705 1.00 0.00 C ATOM 1758 O ASN A 113 -13.733 -3.525 -1.612 1.00 0.00 O ATOM 1759 CB ASN A 113 -15.643 -4.839 -0.157 1.00 0.00 C ATOM 1760 CG ASN A 113 -16.246 -5.679 0.971 1.00 0.00 C ATOM 1761 OD1 ASN A 113 -15.694 -5.756 2.050 1.00 0.00 O ATOM 1762 ND2 ASN A 113 -17.366 -6.316 0.764 1.00 0.00 N ATOM 0 H ASN A 113 -12.995 -5.596 0.614 1.00 0.00 H new ATOM 0 HA ASN A 113 -14.953 -6.396 -1.517 1.00 0.00 H new ATOM 0 HB2 ASN A 113 -15.237 -3.910 0.244 1.00 0.00 H new ATOM 0 HB3 ASN A 113 -16.417 -4.565 -0.874 1.00 0.00 H new ATOM 0 HD21 ASN A 113 -17.778 -6.879 1.508 1.00 0.00 H new ATOM 0 HD22 ASN A 113 -17.830 -6.251 -0.142 1.00 0.00 H new ATOM 1769 N ILE A 114 -12.826 -5.294 -2.528 1.00 0.00 N ATOM 1770 CA ILE A 114 -11.926 -4.455 -3.375 1.00 0.00 C ATOM 1771 C ILE A 114 -12.732 -3.496 -4.252 1.00 0.00 C ATOM 1772 O ILE A 114 -12.672 -2.296 -4.080 1.00 0.00 O ATOM 1773 CB ILE A 114 -11.142 -5.444 -4.242 1.00 0.00 C ATOM 1774 CG1 ILE A 114 -10.645 -6.623 -3.390 1.00 0.00 C ATOM 1775 CG2 ILE A 114 -9.944 -4.726 -4.864 1.00 0.00 C ATOM 1776 CD1 ILE A 114 -10.234 -6.134 -1.996 1.00 0.00 C ATOM 0 H ILE A 114 -12.725 -6.301 -2.652 1.00 0.00 H new ATOM 0 HA ILE A 114 -11.268 -3.836 -2.765 1.00 0.00 H new ATOM 0 HB ILE A 114 -11.795 -5.827 -5.026 1.00 0.00 H new ATOM 0 HG12 ILE A 114 -11.430 -7.374 -3.303 1.00 0.00 H new ATOM 0 HG13 ILE A 114 -9.797 -7.103 -3.879 1.00 0.00 H new ATOM 0 HG21 ILE A 114 -9.382 -5.425 -5.483 1.00 0.00 H new ATOM 0 HG22 ILE A 114 -10.296 -3.898 -5.480 1.00 0.00 H new ATOM 0 HG23 ILE A 114 -9.299 -4.342 -4.073 1.00 0.00 H new ATOM 0 HD11 ILE A 114 -9.884 -6.979 -1.403 1.00 0.00 H new ATOM 0 HD12 ILE A 114 -9.434 -5.400 -2.089 1.00 0.00 H new ATOM 0 HD13 ILE A 114 -11.092 -5.675 -1.504 1.00 0.00 H new ATOM 1788 N ASP A 115 -13.482 -4.007 -5.191 1.00 0.00 N ATOM 1789 CA ASP A 115 -14.281 -3.099 -6.065 1.00 0.00 C ATOM 1790 C ASP A 115 -14.956 -2.033 -5.213 1.00 0.00 C ATOM 1791 O ASP A 115 -15.260 -0.947 -5.665 1.00 0.00 O ATOM 1792 CB ASP A 115 -15.321 -3.993 -6.741 1.00 0.00 C ATOM 1793 CG ASP A 115 -15.783 -3.341 -8.045 1.00 0.00 C ATOM 1794 OD1 ASP A 115 -16.125 -2.171 -8.010 1.00 0.00 O ATOM 1795 OD2 ASP A 115 -15.788 -4.024 -9.057 1.00 0.00 O ATOM 0 H ASP A 115 -13.576 -5.003 -5.390 1.00 0.00 H new ATOM 0 HA ASP A 115 -13.665 -2.583 -6.801 1.00 0.00 H new ATOM 0 HB2 ASP A 115 -14.895 -4.975 -6.944 1.00 0.00 H new ATOM 0 HB3 ASP A 115 -16.172 -4.146 -6.077 1.00 0.00 H new ATOM 1800 N VAL A 116 -15.185 -2.350 -3.980 1.00 0.00 N ATOM 1801 CA VAL A 116 -15.837 -1.384 -3.056 1.00 0.00 C ATOM 1802 C VAL A 116 -14.792 -0.538 -2.346 1.00 0.00 C ATOM 1803 O VAL A 116 -14.837 0.676 -2.359 1.00 0.00 O ATOM 1804 CB VAL A 116 -16.590 -2.255 -2.054 1.00 0.00 C ATOM 1805 CG1 VAL A 116 -17.285 -1.368 -1.018 1.00 0.00 C ATOM 1806 CG2 VAL A 116 -17.634 -3.091 -2.795 1.00 0.00 C ATOM 0 H VAL A 116 -14.947 -3.249 -3.562 1.00 0.00 H new ATOM 0 HA VAL A 116 -16.496 -0.692 -3.580 1.00 0.00 H new ATOM 0 HB VAL A 116 -15.886 -2.915 -1.546 1.00 0.00 H new ATOM 0 HG11 VAL A 116 -17.821 -1.994 -0.305 1.00 0.00 H new ATOM 0 HG12 VAL A 116 -16.540 -0.773 -0.490 1.00 0.00 H new ATOM 0 HG13 VAL A 116 -17.989 -0.705 -1.521 1.00 0.00 H new ATOM 0 HG21 VAL A 116 -18.174 -3.714 -2.082 1.00 0.00 H new ATOM 0 HG22 VAL A 116 -18.336 -2.430 -3.303 1.00 0.00 H new ATOM 0 HG23 VAL A 116 -17.138 -3.726 -3.529 1.00 0.00 H new ATOM 1816 N PHE A 117 -13.855 -1.178 -1.731 1.00 0.00 N ATOM 1817 CA PHE A 117 -12.789 -0.424 -1.010 1.00 0.00 C ATOM 1818 C PHE A 117 -11.995 0.414 -2.007 1.00 0.00 C ATOM 1819 O PHE A 117 -11.368 1.395 -1.655 1.00 0.00 O ATOM 1820 CB PHE A 117 -11.895 -1.485 -0.366 1.00 0.00 C ATOM 1821 CG PHE A 117 -12.036 -1.416 1.135 1.00 0.00 C ATOM 1822 CD1 PHE A 117 -11.301 -0.473 1.866 1.00 0.00 C ATOM 1823 CD2 PHE A 117 -12.903 -2.294 1.798 1.00 0.00 C ATOM 1824 CE1 PHE A 117 -11.432 -0.411 3.258 1.00 0.00 C ATOM 1825 CE2 PHE A 117 -13.033 -2.231 3.190 1.00 0.00 C ATOM 1826 CZ PHE A 117 -12.298 -1.288 3.921 1.00 0.00 C ATOM 0 H PHE A 117 -13.772 -2.194 -1.691 1.00 0.00 H new ATOM 0 HA PHE A 117 -13.197 0.255 -0.262 1.00 0.00 H new ATOM 0 HB2 PHE A 117 -12.173 -2.476 -0.723 1.00 0.00 H new ATOM 0 HB3 PHE A 117 -10.856 -1.323 -0.652 1.00 0.00 H new ATOM 0 HD1 PHE A 117 -10.634 0.206 1.355 1.00 0.00 H new ATOM 0 HD2 PHE A 117 -13.471 -3.020 1.235 1.00 0.00 H new ATOM 0 HE1 PHE A 117 -10.864 0.315 3.821 1.00 0.00 H new ATOM 0 HE2 PHE A 117 -13.700 -2.909 3.701 1.00 0.00 H new ATOM 0 HZ PHE A 117 -12.400 -1.238 4.995 1.00 0.00 H new ATOM 1836 N SER A 118 -12.040 0.051 -3.258 1.00 0.00 N ATOM 1837 CA SER A 118 -11.319 0.829 -4.279 1.00 0.00 C ATOM 1838 C SER A 118 -12.259 1.886 -4.804 1.00 0.00 C ATOM 1839 O SER A 118 -11.892 3.018 -4.996 1.00 0.00 O ATOM 1840 CB SER A 118 -10.955 -0.174 -5.371 1.00 0.00 C ATOM 1841 OG SER A 118 -10.849 0.502 -6.617 1.00 0.00 O ATOM 0 H SER A 118 -12.551 -0.758 -3.611 1.00 0.00 H new ATOM 0 HA SER A 118 -10.425 1.325 -3.901 1.00 0.00 H new ATOM 0 HB2 SER A 118 -10.012 -0.665 -5.130 1.00 0.00 H new ATOM 0 HB3 SER A 118 -11.714 -0.954 -5.431 1.00 0.00 H new ATOM 0 HG SER A 118 -10.614 -0.140 -7.319 1.00 0.00 H new ATOM 1847 N ASP A 119 -13.485 1.512 -4.989 1.00 0.00 N ATOM 1848 CA ASP A 119 -14.499 2.484 -5.474 1.00 0.00 C ATOM 1849 C ASP A 119 -14.754 3.497 -4.377 1.00 0.00 C ATOM 1850 O ASP A 119 -15.003 4.659 -4.616 1.00 0.00 O ATOM 1851 CB ASP A 119 -15.753 1.655 -5.763 1.00 0.00 C ATOM 1852 CG ASP A 119 -16.922 2.587 -6.089 1.00 0.00 C ATOM 1853 OD1 ASP A 119 -17.213 3.446 -5.274 1.00 0.00 O ATOM 1854 OD2 ASP A 119 -17.506 2.424 -7.147 1.00 0.00 O ATOM 0 H ASP A 119 -13.835 0.568 -4.825 1.00 0.00 H new ATOM 0 HA ASP A 119 -14.184 3.028 -6.364 1.00 0.00 H new ATOM 0 HB2 ASP A 119 -15.570 0.979 -6.599 1.00 0.00 H new ATOM 0 HB3 ASP A 119 -15.998 1.036 -4.900 1.00 0.00 H new ATOM 1859 N THR A 120 -14.648 3.055 -3.171 1.00 0.00 N ATOM 1860 CA THR A 120 -14.836 3.969 -2.018 1.00 0.00 C ATOM 1861 C THR A 120 -13.712 4.992 -2.049 1.00 0.00 C ATOM 1862 O THR A 120 -13.903 6.177 -1.863 1.00 0.00 O ATOM 1863 CB THR A 120 -14.744 3.050 -0.791 1.00 0.00 C ATOM 1864 OG1 THR A 120 -16.052 2.653 -0.404 1.00 0.00 O ATOM 1865 CG2 THR A 120 -14.067 3.774 0.374 1.00 0.00 C ATOM 0 H THR A 120 -14.437 2.088 -2.925 1.00 0.00 H new ATOM 0 HA THR A 120 -15.777 4.519 -2.019 1.00 0.00 H new ATOM 0 HB THR A 120 -14.149 2.174 -1.051 1.00 0.00 H new ATOM 0 HG1 THR A 120 -16.263 1.785 -0.807 1.00 0.00 H new ATOM 0 HG21 THR A 120 -14.011 3.107 1.234 1.00 0.00 H new ATOM 0 HG22 THR A 120 -13.061 4.073 0.081 1.00 0.00 H new ATOM 0 HG23 THR A 120 -14.646 4.659 0.638 1.00 0.00 H new ATOM 1873 N ILE A 121 -12.544 4.511 -2.302 1.00 0.00 N ATOM 1874 CA ILE A 121 -11.351 5.387 -2.381 1.00 0.00 C ATOM 1875 C ILE A 121 -11.336 6.115 -3.734 1.00 0.00 C ATOM 1876 O ILE A 121 -11.077 7.298 -3.811 1.00 0.00 O ATOM 1877 CB ILE A 121 -10.182 4.403 -2.227 1.00 0.00 C ATOM 1878 CG1 ILE A 121 -9.480 4.666 -0.895 1.00 0.00 C ATOM 1879 CG2 ILE A 121 -9.177 4.538 -3.376 1.00 0.00 C ATOM 1880 CD1 ILE A 121 -8.955 6.101 -0.866 1.00 0.00 C ATOM 0 H ILE A 121 -12.355 3.522 -2.463 1.00 0.00 H new ATOM 0 HA ILE A 121 -11.316 6.173 -1.627 1.00 0.00 H new ATOM 0 HB ILE A 121 -10.580 3.389 -2.251 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -10.173 4.505 -0.069 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -8.657 3.964 -0.762 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -8.364 3.826 -3.234 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -9.677 4.333 -4.323 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -8.775 5.551 -3.390 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -8.455 6.286 0.085 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -8.248 6.246 -1.683 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -9.788 6.795 -0.979 1.00 0.00 H new ATOM 1892 N LYS A 122 -11.625 5.411 -4.794 1.00 0.00 N ATOM 1893 CA LYS A 122 -11.642 6.053 -6.131 1.00 0.00 C ATOM 1894 C LYS A 122 -12.789 7.054 -6.187 1.00 0.00 C ATOM 1895 O LYS A 122 -12.707 8.083 -6.827 1.00 0.00 O ATOM 1896 CB LYS A 122 -11.867 4.903 -7.111 1.00 0.00 C ATOM 1897 CG LYS A 122 -10.525 4.524 -7.737 1.00 0.00 C ATOM 1898 CD LYS A 122 -10.171 3.077 -7.389 1.00 0.00 C ATOM 1899 CE LYS A 122 -8.891 3.055 -6.546 1.00 0.00 C ATOM 1900 NZ LYS A 122 -7.978 2.113 -7.254 1.00 0.00 N ATOM 0 H LYS A 122 -11.850 4.416 -4.788 1.00 0.00 H new ATOM 0 HA LYS A 122 -10.726 6.598 -6.361 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -12.299 4.046 -6.595 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -12.575 5.199 -7.885 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -10.573 4.644 -8.819 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -9.745 5.194 -7.376 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -10.990 2.613 -6.839 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -10.029 2.496 -8.300 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -8.451 4.049 -6.471 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -9.094 2.719 -5.529 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -7.113 1.980 -6.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -8.454 1.197 -7.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -7.729 2.504 -8.185 1.00 0.00 H new ATOM 1914 N SER A 123 -13.852 6.765 -5.492 1.00 0.00 N ATOM 1915 CA SER A 123 -15.001 7.706 -5.468 1.00 0.00 C ATOM 1916 C SER A 123 -14.767 8.743 -4.381 1.00 0.00 C ATOM 1917 O SER A 123 -15.431 9.758 -4.310 1.00 0.00 O ATOM 1918 CB SER A 123 -16.213 6.852 -5.135 1.00 0.00 C ATOM 1919 OG SER A 123 -17.400 7.573 -5.440 1.00 0.00 O ATOM 0 H SER A 123 -13.974 5.916 -4.939 1.00 0.00 H new ATOM 0 HA SER A 123 -15.135 8.234 -6.412 1.00 0.00 H new ATOM 0 HB2 SER A 123 -16.183 5.922 -5.703 1.00 0.00 H new ATOM 0 HB3 SER A 123 -16.201 6.581 -4.079 1.00 0.00 H new ATOM 0 HG SER A 123 -18.182 7.022 -5.227 1.00 0.00 H new ATOM 1925 N PHE A 124 -13.803 8.493 -3.546 1.00 0.00 N ATOM 1926 CA PHE A 124 -13.483 9.461 -2.463 1.00 0.00 C ATOM 1927 C PHE A 124 -12.804 10.686 -3.068 1.00 0.00 C ATOM 1928 O PHE A 124 -12.498 11.647 -2.389 1.00 0.00 O ATOM 1929 CB PHE A 124 -12.520 8.717 -1.541 1.00 0.00 C ATOM 1930 CG PHE A 124 -13.183 8.471 -0.206 1.00 0.00 C ATOM 1931 CD1 PHE A 124 -13.836 9.518 0.456 1.00 0.00 C ATOM 1932 CD2 PHE A 124 -13.142 7.196 0.371 1.00 0.00 C ATOM 1933 CE1 PHE A 124 -14.448 9.288 1.695 1.00 0.00 C ATOM 1934 CE2 PHE A 124 -13.754 6.967 1.609 1.00 0.00 C ATOM 1935 CZ PHE A 124 -14.407 8.014 2.271 1.00 0.00 C ATOM 0 H PHE A 124 -13.219 7.657 -3.566 1.00 0.00 H new ATOM 0 HA PHE A 124 -14.368 9.806 -1.928 1.00 0.00 H new ATOM 0 HB2 PHE A 124 -12.227 7.769 -1.993 1.00 0.00 H new ATOM 0 HB3 PHE A 124 -11.609 9.300 -1.404 1.00 0.00 H new ATOM 0 HD1 PHE A 124 -13.868 10.502 0.012 1.00 0.00 H new ATOM 0 HD2 PHE A 124 -12.638 6.389 -0.139 1.00 0.00 H new ATOM 0 HE1 PHE A 124 -14.952 10.095 2.206 1.00 0.00 H new ATOM 0 HE2 PHE A 124 -13.723 5.983 2.053 1.00 0.00 H new ATOM 0 HZ PHE A 124 -14.879 7.838 3.226 1.00 0.00 H new ATOM 1945 N ALA A 125 -12.566 10.651 -4.346 1.00 0.00 N ATOM 1946 CA ALA A 125 -11.904 11.804 -5.020 1.00 0.00 C ATOM 1947 C ALA A 125 -12.840 12.410 -6.067 1.00 0.00 C ATOM 1948 O ALA A 125 -14.042 12.242 -6.011 1.00 0.00 O ATOM 1949 CB ALA A 125 -10.663 11.211 -5.689 1.00 0.00 C ATOM 0 H ALA A 125 -12.802 9.870 -4.958 1.00 0.00 H new ATOM 0 HA ALA A 125 -11.649 12.601 -4.322 1.00 0.00 H new ATOM 0 HB1 ALA A 125 -10.118 11.999 -6.209 1.00 0.00 H new ATOM 0 HB2 ALA A 125 -10.019 10.764 -4.931 1.00 0.00 H new ATOM 0 HB3 ALA A 125 -10.966 10.446 -6.404 1.00 0.00 H new ATOM 1955 N SER A 126 -12.300 13.117 -7.021 1.00 0.00 N ATOM 1956 CA SER A 126 -13.162 13.733 -8.069 1.00 0.00 C ATOM 1957 C SER A 126 -13.460 12.715 -9.174 1.00 0.00 C ATOM 1958 O SER A 126 -14.440 12.000 -9.123 1.00 0.00 O ATOM 1959 CB SER A 126 -12.346 14.899 -8.620 1.00 0.00 C ATOM 1960 OG SER A 126 -12.971 15.396 -9.796 1.00 0.00 O ATOM 0 H SER A 126 -11.301 13.295 -7.120 1.00 0.00 H new ATOM 0 HA SER A 126 -14.123 14.061 -7.672 1.00 0.00 H new ATOM 0 HB2 SER A 126 -12.270 15.689 -7.873 1.00 0.00 H new ATOM 0 HB3 SER A 126 -11.330 14.573 -8.844 1.00 0.00 H new ATOM 0 HG SER A 126 -12.450 16.146 -10.151 1.00 0.00 H new ATOM 1966 N SER A 127 -12.624 12.645 -10.173 1.00 0.00 N ATOM 1967 CA SER A 127 -12.866 11.673 -11.277 1.00 0.00 C ATOM 1968 C SER A 127 -11.540 11.245 -11.912 1.00 0.00 C ATOM 1969 O SER A 127 -10.475 11.538 -11.408 1.00 0.00 O ATOM 1970 CB SER A 127 -13.724 12.431 -12.288 1.00 0.00 C ATOM 1971 OG SER A 127 -13.681 11.758 -13.538 1.00 0.00 O ATOM 0 H SER A 127 -11.786 13.217 -10.273 1.00 0.00 H new ATOM 0 HA SER A 127 -13.354 10.764 -10.925 1.00 0.00 H new ATOM 0 HB2 SER A 127 -14.752 12.497 -11.933 1.00 0.00 H new ATOM 0 HB3 SER A 127 -13.359 13.452 -12.399 1.00 0.00 H new ATOM 0 HG SER A 127 -13.046 12.211 -14.132 1.00 0.00 H new ATOM 1977 N GLY A 128 -11.600 10.552 -13.016 1.00 0.00 N ATOM 1978 CA GLY A 128 -10.349 10.102 -13.689 1.00 0.00 C ATOM 1979 C GLY A 128 -10.698 9.113 -14.800 1.00 0.00 C ATOM 1980 O GLY A 128 -11.176 8.025 -14.547 1.00 0.00 O ATOM 0 H GLY A 128 -12.465 10.277 -13.482 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -9.818 10.959 -14.103 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -9.682 9.633 -12.966 1.00 0.00 H new ATOM 1984 N LYS A 129 -10.468 9.481 -16.031 1.00 0.00 N ATOM 1985 CA LYS A 129 -10.796 8.557 -17.154 1.00 0.00 C ATOM 1986 C LYS A 129 -12.199 7.975 -16.958 1.00 0.00 C ATOM 1987 O LYS A 129 -13.112 8.663 -16.545 1.00 0.00 O ATOM 1988 CB LYS A 129 -9.738 7.456 -17.080 1.00 0.00 C ATOM 1989 CG LYS A 129 -8.346 8.088 -17.005 1.00 0.00 C ATOM 1990 CD LYS A 129 -8.015 8.752 -18.343 1.00 0.00 C ATOM 1991 CE LYS A 129 -6.553 9.206 -18.339 1.00 0.00 C ATOM 1992 NZ LYS A 129 -6.199 9.373 -19.776 1.00 0.00 N ATOM 0 H LYS A 129 -10.069 10.378 -16.307 1.00 0.00 H new ATOM 0 HA LYS A 129 -10.792 9.057 -18.122 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -9.912 6.829 -16.206 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -9.809 6.810 -17.955 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -8.312 8.825 -16.203 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -7.602 7.327 -16.770 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -8.188 8.052 -19.161 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -8.672 9.606 -18.510 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -6.431 10.140 -17.791 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -5.912 8.468 -17.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -5.210 9.684 -19.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -6.318 8.466 -20.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -6.822 10.086 -20.206 1.00 0.00 H new ATOM 2006 N GLU A 130 -12.378 6.714 -17.243 1.00 0.00 N ATOM 2007 CA GLU A 130 -13.724 6.097 -17.065 1.00 0.00 C ATOM 2008 C GLU A 130 -14.238 6.357 -15.646 1.00 0.00 C ATOM 2009 O GLU A 130 -13.473 6.608 -14.735 1.00 0.00 O ATOM 2010 CB GLU A 130 -13.505 4.600 -17.289 1.00 0.00 C ATOM 2011 CG GLU A 130 -13.957 4.221 -18.701 1.00 0.00 C ATOM 2012 CD GLU A 130 -14.132 2.704 -18.790 1.00 0.00 C ATOM 2013 OE1 GLU A 130 -13.163 2.002 -18.553 1.00 0.00 O ATOM 2014 OE2 GLU A 130 -15.231 2.271 -19.093 1.00 0.00 O ATOM 0 H GLU A 130 -11.653 6.086 -17.590 1.00 0.00 H new ATOM 0 HA GLU A 130 -14.463 6.508 -17.753 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -12.452 4.352 -17.154 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -14.065 4.026 -16.551 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -14.896 4.721 -18.940 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -13.222 4.557 -19.432 1.00 0.00 H new ATOM 2021 N LYS A 131 -15.527 6.301 -15.448 1.00 0.00 N ATOM 2022 CA LYS A 131 -16.083 6.548 -14.086 1.00 0.00 C ATOM 2023 C LYS A 131 -17.318 5.671 -13.849 1.00 0.00 C ATOM 2024 O LYS A 131 -17.412 4.567 -14.348 1.00 0.00 O ATOM 2025 CB LYS A 131 -16.466 8.028 -14.074 1.00 0.00 C ATOM 2026 CG LYS A 131 -17.679 8.249 -14.980 1.00 0.00 C ATOM 2027 CD LYS A 131 -17.506 9.558 -15.754 1.00 0.00 C ATOM 2028 CE LYS A 131 -17.482 9.262 -17.255 1.00 0.00 C ATOM 2029 NZ LYS A 131 -16.190 9.826 -17.738 1.00 0.00 N ATOM 0 H LYS A 131 -16.219 6.095 -16.169 1.00 0.00 H new ATOM 0 HA LYS A 131 -15.367 6.307 -13.300 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -16.695 8.347 -13.057 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -15.628 8.634 -14.417 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -17.785 7.415 -15.674 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -18.590 8.285 -14.383 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -18.322 10.242 -15.520 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -16.581 10.051 -15.455 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -17.542 8.191 -17.447 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -18.329 9.724 -17.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -16.100 9.662 -18.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -16.165 10.848 -17.548 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -15.402 9.362 -17.243 1.00 0.00 H new ATOM 2043 N LEU A 132 -18.263 6.156 -13.089 1.00 0.00 N ATOM 2044 CA LEU A 132 -19.491 5.350 -12.818 1.00 0.00 C ATOM 2045 C LEU A 132 -20.304 5.176 -14.104 1.00 0.00 C ATOM 2046 O LEU A 132 -20.974 6.084 -14.553 1.00 0.00 O ATOM 2047 CB LEU A 132 -20.281 6.164 -11.790 1.00 0.00 C ATOM 2048 CG LEU A 132 -20.801 5.235 -10.693 1.00 0.00 C ATOM 2049 CD1 LEU A 132 -20.306 5.723 -9.330 1.00 0.00 C ATOM 2050 CD2 LEU A 132 -22.330 5.238 -10.707 1.00 0.00 C ATOM 0 H LEU A 132 -18.239 7.074 -12.644 1.00 0.00 H new ATOM 0 HA LEU A 132 -19.256 4.350 -12.453 1.00 0.00 H new ATOM 0 HB2 LEU A 132 -19.646 6.936 -11.356 1.00 0.00 H new ATOM 0 HB3 LEU A 132 -21.114 6.672 -12.276 1.00 0.00 H new ATOM 0 HG LEU A 132 -20.435 4.224 -10.872 1.00 0.00 H new ATOM 0 HD11 LEU A 132 -20.678 5.060 -8.549 1.00 0.00 H new ATOM 0 HD12 LEU A 132 -19.216 5.723 -9.318 1.00 0.00 H new ATOM 0 HD13 LEU A 132 -20.671 6.734 -9.151 1.00 0.00 H new ATOM 0 HD21 LEU A 132 -22.702 4.576 -9.925 1.00 0.00 H new ATOM 0 HD22 LEU A 132 -22.694 6.250 -10.529 1.00 0.00 H new ATOM 0 HD23 LEU A 132 -22.686 4.890 -11.677 1.00 0.00 H new ATOM 2062 N GLU A 133 -20.252 4.015 -14.697 1.00 0.00 N ATOM 2063 CA GLU A 133 -21.023 3.785 -15.954 1.00 0.00 C ATOM 2064 C GLU A 133 -22.525 3.918 -15.685 1.00 0.00 C ATOM 2065 O GLU A 133 -22.888 4.061 -14.530 1.00 0.00 O ATOM 2066 CB GLU A 133 -20.679 2.356 -16.376 1.00 0.00 C ATOM 2067 CG GLU A 133 -20.905 1.408 -15.196 1.00 0.00 C ATOM 2068 CD GLU A 133 -21.067 -0.022 -15.716 1.00 0.00 C ATOM 2069 OE1 GLU A 133 -21.204 -0.182 -16.917 1.00 0.00 O ATOM 2070 OE2 GLU A 133 -21.051 -0.932 -14.903 1.00 0.00 O ATOM 0 H GLU A 133 -19.710 3.216 -14.367 1.00 0.00 H new ATOM 0 HA GLU A 133 -20.773 4.510 -16.729 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -21.298 2.056 -17.221 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -19.642 2.302 -16.706 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -20.063 1.462 -14.505 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -21.793 1.707 -14.640 1.00 0.00 H new TER 2077 GLU A 133