USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1027 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 39 SER OG : rot 48:sc= 1.2 USER MOD Set 1.2: A 124 SER OG : rot 180:sc= -1.55! USER MOD Set 2.1: A 85 MET CE :methyl 138:sc= 0 (180deg=-0.0453) USER MOD Set 2.2: A 91 MET CE :methyl 177:sc= -3.15! (180deg=-3.42!) USER MOD Set 3.1: A 73 THR OG1 : rot -82:sc= 2.04 USER MOD Set 3.2: A 75 THR OG1 : rot -63:sc= 1.2 USER MOD Set 4.1: A 51 THR OG1 : rot 180:sc= -1.71! USER MOD Set 4.2: A 60 HIS : no HD1:sc= -1.96! K(o=-3.7!,f=1.5) USER MOD Set 5.1: A 30 GLN : amide:sc= -0.0192 K(o=0.23,f=-6.3!) USER MOD Set 5.2: A 33 LYS NZ :NH3+ -161:sc= 0.254 (180deg=0) USER MOD Set 6.1: A 2 ASN : amide:sc= 0 K(o=0.43,f=-0.14) USER MOD Set 6.2: A 4 SER OG : rot 170:sc= 0.434 USER MOD Single : A 1 MET CE :methyl 175:sc= -0.878 (180deg=-0.981) USER MOD Single : A 1 MET N :NH3+ -170:sc= 0 (180deg=-0.0884) USER MOD Single : A 6 LYS NZ :NH3+ 161:sc= 1.31 (180deg=1.11) USER MOD Single : A 7 TYR OH : rot 140:sc= 1.08 USER MOD Single : A 8 GLN : amide:sc= -3! C(o=-3!,f=-2.3!) USER MOD Single : A 10 GLN : amide:sc= -1.52 K(o=-1.5,f=-1) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 GLN : amide:sc= -2.01! C(o=-2!,f=-5.2!) USER MOD Single : A 14 ASN : amide:sc= -0.731 K(o=-0.73,f=-1.4!) USER MOD Single : A 19 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 LYS NZ :NH3+ 157:sc= 0.898 (180deg=0.626) USER MOD Single : A 22 MET CE :methyl -138:sc= -0.143 (180deg=-0.705) USER MOD Single : A 31 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0504) USER MOD Single : A 36 LYS NZ :NH3+ 139:sc= 1.01 (180deg=-0.381) USER MOD Single : A 43 HIS : no HD1:sc= -1.19 K(o=0.29,f=-8.1!) USER MOD Single : A 46 LYS NZ :NH3+ -158:sc= -0.15 (180deg=-0.777) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ -175:sc= 1.16 (180deg=1.07) USER MOD Single : A 53 THR OG1 : rot 78:sc= 0.922 USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 SER OG : rot 180:sc=0.000606 USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 ASN : amide:sc= -0.414 X(o=-0.41,f=-0.037) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 CYS SG : rot -51:sc= -2.51! USER MOD Single : A 74 MET CE :methyl -117:sc= -0.974 (180deg=-3.72!) USER MOD Single : A 78 LYS NZ :NH3+ 162:sc= 0 (180deg=-0.151) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.076) USER MOD Single : A 89 ASN : amide:sc= -0.0219 X(o=-0.022,f=0) USER MOD Single : A 90 LYS NZ :NH3+ -176:sc= -0.741 (180deg=-0.812) USER MOD Single : A 93 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0.0333 USER MOD Single : A 96 LYS NZ :NH3+ 171:sc= 1.21 (180deg=0.905) USER MOD Single : A 99 LYS NZ :NH3+ -162:sc= 1.26 (180deg=1.15) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 71:sc= 1.26 USER MOD Single : A 105 ASN : amide:sc=-0.00544 K(o=-0.0054,f=-0.86) USER MOD Single : A 108 THR OG1 : rot 180:sc=-0.00113 USER MOD Single : A 110 THR OG1 : rot 126:sc= 0.446 USER MOD Single : A 111 ASN : amide:sc= -0.45 K(o=-0.45,f=-3.5!) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 MET CE :methyl -169:sc= -0.32 (180deg=-0.728) USER MOD Single : A 114 THR OG1 : rot 79:sc= 0.0839 USER MOD Single : A 120 TYR OH : rot 165:sc= -0.0297 USER MOD Single : A 121 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.558) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 8.374 -16.785 2.972 1.00 0.00 N ATOM 2 CA MET A 1 9.043 -15.518 3.335 1.00 0.00 C ATOM 3 C MET A 1 8.388 -14.907 4.566 1.00 0.00 C ATOM 4 O MET A 1 7.435 -14.129 4.465 1.00 0.00 O ATOM 5 CB MET A 1 8.985 -14.529 2.165 1.00 0.00 C ATOM 6 CG MET A 1 9.793 -14.964 0.951 1.00 0.00 C ATOM 7 SD MET A 1 9.695 -13.786 -0.413 1.00 0.00 S ATOM 8 CE MET A 1 10.404 -12.324 0.342 1.00 0.00 C ATOM 0 H1 MET A 1 8.930 -17.274 2.242 1.00 0.00 H new ATOM 0 H2 MET A 1 8.298 -17.391 3.814 1.00 0.00 H new ATOM 0 H3 MET A 1 7.423 -16.582 2.604 1.00 0.00 H new ATOM 0 HA MET A 1 10.087 -15.733 3.562 1.00 0.00 H new ATOM 0 HB2 MET A 1 7.945 -14.393 1.868 1.00 0.00 H new ATOM 0 HB3 MET A 1 9.349 -13.559 2.503 1.00 0.00 H new ATOM 0 HG2 MET A 1 10.836 -15.091 1.241 1.00 0.00 H new ATOM 0 HG3 MET A 1 9.436 -15.936 0.612 1.00 0.00 H new ATOM 0 HE1 MET A 1 10.493 -11.535 -0.405 1.00 0.00 H new ATOM 0 HE2 MET A 1 9.760 -11.984 1.153 1.00 0.00 H new ATOM 0 HE3 MET A 1 11.391 -12.562 0.738 1.00 0.00 H new ATOM 20 N ASN A 2 8.884 -15.287 5.731 1.00 0.00 N ATOM 21 CA ASN A 2 8.393 -14.739 6.987 1.00 0.00 C ATOM 22 C ASN A 2 9.400 -13.737 7.541 1.00 0.00 C ATOM 23 O ASN A 2 10.380 -14.118 8.184 1.00 0.00 O ATOM 24 CB ASN A 2 8.143 -15.859 8.006 1.00 0.00 C ATOM 25 CG ASN A 2 7.648 -15.333 9.341 1.00 0.00 C ATOM 26 OD1 ASN A 2 6.993 -14.296 9.412 1.00 0.00 O ATOM 27 ND2 ASN A 2 7.955 -16.051 10.411 1.00 0.00 N ATOM 0 H ASN A 2 9.629 -15.976 5.835 1.00 0.00 H new ATOM 0 HA ASN A 2 7.447 -14.230 6.801 1.00 0.00 H new ATOM 0 HB2 ASN A 2 7.411 -16.557 7.601 1.00 0.00 H new ATOM 0 HB3 ASN A 2 9.066 -16.418 8.160 1.00 0.00 H new ATOM 0 HD21 ASN A 2 7.645 -15.748 11.334 1.00 0.00 H new ATOM 0 HD22 ASN A 2 8.501 -16.907 10.311 1.00 0.00 H new ATOM 34 N PHE A 3 9.168 -12.463 7.269 1.00 0.00 N ATOM 35 CA PHE A 3 10.070 -11.412 7.717 1.00 0.00 C ATOM 36 C PHE A 3 9.263 -10.227 8.241 1.00 0.00 C ATOM 37 O PHE A 3 9.588 -9.070 7.984 1.00 0.00 O ATOM 38 CB PHE A 3 10.989 -10.987 6.563 1.00 0.00 C ATOM 39 CG PHE A 3 12.225 -10.246 7.001 1.00 0.00 C ATOM 40 CD1 PHE A 3 13.188 -10.879 7.770 1.00 0.00 C ATOM 41 CD2 PHE A 3 12.423 -8.923 6.642 1.00 0.00 C ATOM 42 CE1 PHE A 3 14.326 -10.204 8.172 1.00 0.00 C ATOM 43 CE2 PHE A 3 13.557 -8.245 7.040 1.00 0.00 C ATOM 44 CZ PHE A 3 14.510 -8.886 7.807 1.00 0.00 C ATOM 0 H PHE A 3 8.362 -12.130 6.740 1.00 0.00 H new ATOM 0 HA PHE A 3 10.693 -11.787 8.529 1.00 0.00 H new ATOM 0 HB2 PHE A 3 11.289 -11.875 6.006 1.00 0.00 H new ATOM 0 HB3 PHE A 3 10.424 -10.356 5.877 1.00 0.00 H new ATOM 0 HD1 PHE A 3 13.048 -11.910 8.059 1.00 0.00 H new ATOM 0 HD2 PHE A 3 11.681 -8.416 6.043 1.00 0.00 H new ATOM 0 HE1 PHE A 3 15.070 -10.708 8.771 1.00 0.00 H new ATOM 0 HE2 PHE A 3 13.699 -7.214 6.752 1.00 0.00 H new ATOM 0 HZ PHE A 3 15.398 -8.357 8.121 1.00 0.00 H new ATOM 54 N SER A 4 8.188 -10.539 8.956 1.00 0.00 N ATOM 55 CA SER A 4 7.334 -9.547 9.571 1.00 0.00 C ATOM 56 C SER A 4 8.131 -8.508 10.358 1.00 0.00 C ATOM 57 O SER A 4 9.071 -8.838 11.084 1.00 0.00 O ATOM 58 CB SER A 4 6.360 -10.270 10.485 1.00 0.00 C ATOM 59 OG SER A 4 5.797 -11.389 9.814 1.00 0.00 O ATOM 0 H SER A 4 7.888 -11.499 9.123 1.00 0.00 H new ATOM 0 HA SER A 4 6.802 -9.003 8.790 1.00 0.00 H new ATOM 0 HB2 SER A 4 6.873 -10.599 11.389 1.00 0.00 H new ATOM 0 HB3 SER A 4 5.569 -9.588 10.798 1.00 0.00 H new ATOM 0 HG SER A 4 5.299 -11.938 10.455 1.00 0.00 H new ATOM 65 N GLY A 5 7.738 -7.257 10.199 1.00 0.00 N ATOM 66 CA GLY A 5 8.420 -6.156 10.834 1.00 0.00 C ATOM 67 C GLY A 5 7.944 -4.847 10.259 1.00 0.00 C ATOM 68 O GLY A 5 6.959 -4.821 9.520 1.00 0.00 O ATOM 0 H GLY A 5 6.939 -6.982 9.627 1.00 0.00 H new ATOM 0 HA2 GLY A 5 8.238 -6.177 11.908 1.00 0.00 H new ATOM 0 HA3 GLY A 5 9.496 -6.254 10.691 1.00 0.00 H new ATOM 72 N LYS A 6 8.628 -3.764 10.567 1.00 0.00 N ATOM 73 CA LYS A 6 8.212 -2.463 10.075 1.00 0.00 C ATOM 74 C LYS A 6 9.011 -2.087 8.828 1.00 0.00 C ATOM 75 O LYS A 6 10.188 -2.426 8.703 1.00 0.00 O ATOM 76 CB LYS A 6 8.428 -1.396 11.137 1.00 0.00 C ATOM 77 CG LYS A 6 7.522 -0.196 10.998 1.00 0.00 C ATOM 78 CD LYS A 6 6.169 -0.448 11.608 1.00 0.00 C ATOM 79 CE LYS A 6 5.877 0.559 12.686 1.00 0.00 C ATOM 80 NZ LYS A 6 4.481 0.458 13.183 1.00 0.00 N ATOM 0 H LYS A 6 9.466 -3.756 11.149 1.00 0.00 H new ATOM 0 HA LYS A 6 7.152 -2.520 9.829 1.00 0.00 H new ATOM 0 HB2 LYS A 6 8.276 -1.841 12.120 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.465 -1.062 11.096 1.00 0.00 H new ATOM 0 HG2 LYS A 6 7.983 0.666 11.479 1.00 0.00 H new ATOM 0 HG3 LYS A 6 7.405 0.052 9.943 1.00 0.00 H new ATOM 0 HD2 LYS A 6 5.401 -0.395 10.836 1.00 0.00 H new ATOM 0 HD3 LYS A 6 6.134 -1.455 12.024 1.00 0.00 H new ATOM 0 HE2 LYS A 6 6.568 0.411 13.516 1.00 0.00 H new ATOM 0 HE3 LYS A 6 6.052 1.563 12.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 4.409 0.920 14.112 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 3.839 0.926 12.512 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 4.216 -0.544 13.274 1.00 0.00 H new ATOM 94 N TYR A 7 8.365 -1.377 7.924 1.00 0.00 N ATOM 95 CA TYR A 7 8.982 -0.910 6.691 1.00 0.00 C ATOM 96 C TYR A 7 8.613 0.543 6.470 1.00 0.00 C ATOM 97 O TYR A 7 7.444 0.873 6.337 1.00 0.00 O ATOM 98 CB TYR A 7 8.494 -1.734 5.498 1.00 0.00 C ATOM 99 CG TYR A 7 8.835 -3.200 5.585 1.00 0.00 C ATOM 100 CD1 TYR A 7 8.145 -4.039 6.445 1.00 0.00 C ATOM 101 CD2 TYR A 7 9.849 -3.738 4.816 1.00 0.00 C ATOM 102 CE1 TYR A 7 8.459 -5.379 6.539 1.00 0.00 C ATOM 103 CE2 TYR A 7 10.165 -5.077 4.899 1.00 0.00 C ATOM 104 CZ TYR A 7 9.472 -5.892 5.765 1.00 0.00 C ATOM 105 OH TYR A 7 9.797 -7.222 5.862 1.00 0.00 O ATOM 0 H TYR A 7 7.387 -1.104 8.023 1.00 0.00 H new ATOM 0 HA TYR A 7 10.063 -1.019 6.777 1.00 0.00 H new ATOM 0 HB2 TYR A 7 7.412 -1.627 5.414 1.00 0.00 H new ATOM 0 HB3 TYR A 7 8.927 -1.324 4.585 1.00 0.00 H new ATOM 0 HD1 TYR A 7 7.348 -3.637 7.052 1.00 0.00 H new ATOM 0 HD2 TYR A 7 10.401 -3.101 4.141 1.00 0.00 H new ATOM 0 HE1 TYR A 7 7.913 -6.020 7.216 1.00 0.00 H new ATOM 0 HE2 TYR A 7 10.955 -5.486 4.286 1.00 0.00 H new ATOM 0 HH TYR A 7 9.993 -7.577 4.970 1.00 0.00 H new ATOM 115 N GLN A 8 9.585 1.420 6.444 1.00 0.00 N ATOM 116 CA GLN A 8 9.291 2.823 6.244 1.00 0.00 C ATOM 117 C GLN A 8 9.495 3.181 4.776 1.00 0.00 C ATOM 118 O GLN A 8 10.535 2.869 4.187 1.00 0.00 O ATOM 119 CB GLN A 8 10.136 3.660 7.202 1.00 0.00 C ATOM 120 CG GLN A 8 11.531 4.003 6.721 1.00 0.00 C ATOM 121 CD GLN A 8 11.607 5.352 6.030 1.00 0.00 C ATOM 122 OE1 GLN A 8 12.433 5.562 5.142 1.00 0.00 O ATOM 123 NE2 GLN A 8 10.760 6.282 6.449 1.00 0.00 N ATOM 0 H GLN A 8 10.574 1.196 6.557 1.00 0.00 H new ATOM 0 HA GLN A 8 8.248 3.041 6.475 1.00 0.00 H new ATOM 0 HB2 GLN A 8 9.605 4.589 7.409 1.00 0.00 H new ATOM 0 HB3 GLN A 8 10.219 3.123 8.147 1.00 0.00 H new ATOM 0 HG2 GLN A 8 12.214 3.998 7.571 1.00 0.00 H new ATOM 0 HG3 GLN A 8 11.872 3.229 6.033 1.00 0.00 H new ATOM 0 HE21 GLN A 8 10.091 6.067 7.188 1.00 0.00 H new ATOM 0 HE22 GLN A 8 10.778 7.213 6.032 1.00 0.00 H new ATOM 132 N VAL A 9 8.464 3.762 4.171 1.00 0.00 N ATOM 133 CA VAL A 9 8.498 4.093 2.753 1.00 0.00 C ATOM 134 C VAL A 9 9.573 5.128 2.473 1.00 0.00 C ATOM 135 O VAL A 9 9.681 6.139 3.169 1.00 0.00 O ATOM 136 CB VAL A 9 7.152 4.641 2.237 1.00 0.00 C ATOM 137 CG1 VAL A 9 7.155 4.703 0.717 1.00 0.00 C ATOM 138 CG2 VAL A 9 5.992 3.804 2.733 1.00 0.00 C ATOM 0 H VAL A 9 7.595 4.013 4.642 1.00 0.00 H new ATOM 0 HA VAL A 9 8.714 3.161 2.230 1.00 0.00 H new ATOM 0 HB VAL A 9 7.026 5.650 2.629 1.00 0.00 H new ATOM 0 HG11 VAL A 9 6.199 5.092 0.367 1.00 0.00 H new ATOM 0 HG12 VAL A 9 7.958 5.359 0.381 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.310 3.703 0.312 1.00 0.00 H new ATOM 0 HG21 VAL A 9 5.057 4.216 2.352 1.00 0.00 H new ATOM 0 HG22 VAL A 9 6.107 2.779 2.382 1.00 0.00 H new ATOM 0 HG23 VAL A 9 5.976 3.814 3.823 1.00 0.00 H new ATOM 148 N GLN A 10 10.358 4.869 1.450 1.00 0.00 N ATOM 149 CA GLN A 10 11.414 5.769 1.059 1.00 0.00 C ATOM 150 C GLN A 10 11.065 6.459 -0.242 1.00 0.00 C ATOM 151 O GLN A 10 10.800 7.657 -0.279 1.00 0.00 O ATOM 152 CB GLN A 10 12.733 5.017 0.900 1.00 0.00 C ATOM 153 CG GLN A 10 13.297 4.426 2.167 1.00 0.00 C ATOM 154 CD GLN A 10 14.800 4.268 2.081 1.00 0.00 C ATOM 155 OE1 GLN A 10 15.350 4.040 1.000 1.00 0.00 O ATOM 156 NE2 GLN A 10 15.474 4.406 3.206 1.00 0.00 N ATOM 0 H GLN A 10 10.281 4.033 0.871 1.00 0.00 H new ATOM 0 HA GLN A 10 11.526 6.518 1.843 1.00 0.00 H new ATOM 0 HB2 GLN A 10 12.589 4.214 0.177 1.00 0.00 H new ATOM 0 HB3 GLN A 10 13.471 5.698 0.477 1.00 0.00 H new ATOM 0 HG2 GLN A 10 13.045 5.066 3.013 1.00 0.00 H new ATOM 0 HG3 GLN A 10 12.838 3.455 2.354 1.00 0.00 H new ATOM 0 HE21 GLN A 10 14.979 4.594 4.078 1.00 0.00 H new ATOM 0 HE22 GLN A 10 16.491 4.325 3.205 1.00 0.00 H new ATOM 165 N SER A 11 11.036 5.691 -1.303 1.00 0.00 N ATOM 166 CA SER A 11 10.786 6.232 -2.610 1.00 0.00 C ATOM 167 C SER A 11 9.334 6.049 -2.942 1.00 0.00 C ATOM 168 O SER A 11 8.694 5.161 -2.418 1.00 0.00 O ATOM 169 CB SER A 11 11.626 5.531 -3.645 1.00 0.00 C ATOM 170 OG SER A 11 12.991 5.472 -3.256 1.00 0.00 O ATOM 0 H SER A 11 11.184 4.682 -1.283 1.00 0.00 H new ATOM 0 HA SER A 11 11.045 7.291 -2.612 1.00 0.00 H new ATOM 0 HB2 SER A 11 11.247 4.521 -3.799 1.00 0.00 H new ATOM 0 HB3 SER A 11 11.541 6.053 -4.598 1.00 0.00 H new ATOM 0 HG SER A 11 13.509 5.010 -3.948 1.00 0.00 H new ATOM 176 N GLN A 12 8.814 6.918 -3.759 1.00 0.00 N ATOM 177 CA GLN A 12 7.471 6.761 -4.296 1.00 0.00 C ATOM 178 C GLN A 12 7.389 7.462 -5.636 1.00 0.00 C ATOM 179 O GLN A 12 8.149 8.394 -5.901 1.00 0.00 O ATOM 180 CB GLN A 12 6.389 7.342 -3.382 1.00 0.00 C ATOM 181 CG GLN A 12 6.328 6.763 -1.972 1.00 0.00 C ATOM 182 CD GLN A 12 5.481 7.593 -1.026 1.00 0.00 C ATOM 183 OE1 GLN A 12 4.867 7.062 -0.104 1.00 0.00 O ATOM 184 NE2 GLN A 12 5.448 8.901 -1.238 1.00 0.00 N ATOM 0 H GLN A 12 9.298 7.757 -4.078 1.00 0.00 H new ATOM 0 HA GLN A 12 7.288 5.690 -4.388 1.00 0.00 H new ATOM 0 HB2 GLN A 12 6.544 8.418 -3.306 1.00 0.00 H new ATOM 0 HB3 GLN A 12 5.420 7.193 -3.858 1.00 0.00 H new ATOM 0 HG2 GLN A 12 5.926 5.751 -2.018 1.00 0.00 H new ATOM 0 HG3 GLN A 12 7.339 6.686 -1.573 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.971 9.305 -2.015 1.00 0.00 H new ATOM 0 HE22 GLN A 12 4.899 9.503 -0.625 1.00 0.00 H new ATOM 193 N GLU A 13 6.466 7.041 -6.466 1.00 0.00 N ATOM 194 CA GLU A 13 6.221 7.755 -7.716 1.00 0.00 C ATOM 195 C GLU A 13 4.758 8.078 -7.910 1.00 0.00 C ATOM 196 O GLU A 13 3.874 7.412 -7.365 1.00 0.00 O ATOM 197 CB GLU A 13 6.713 7.008 -8.949 1.00 0.00 C ATOM 198 CG GLU A 13 5.836 5.867 -9.370 1.00 0.00 C ATOM 199 CD GLU A 13 6.421 5.069 -10.518 1.00 0.00 C ATOM 200 OE1 GLU A 13 7.373 4.294 -10.284 1.00 0.00 O ATOM 201 OE2 GLU A 13 5.947 5.225 -11.662 1.00 0.00 O ATOM 0 H GLU A 13 5.876 6.223 -6.312 1.00 0.00 H new ATOM 0 HA GLU A 13 6.796 8.676 -7.618 1.00 0.00 H new ATOM 0 HB2 GLU A 13 6.796 7.712 -9.777 1.00 0.00 H new ATOM 0 HB3 GLU A 13 7.715 6.627 -8.753 1.00 0.00 H new ATOM 0 HG2 GLU A 13 5.675 5.206 -8.519 1.00 0.00 H new ATOM 0 HG3 GLU A 13 4.860 6.254 -9.663 1.00 0.00 H new ATOM 208 N ASN A 14 4.539 9.117 -8.701 1.00 0.00 N ATOM 209 CA ASN A 14 3.220 9.515 -9.157 1.00 0.00 C ATOM 210 C ASN A 14 2.286 9.846 -8.005 1.00 0.00 C ATOM 211 O ASN A 14 1.095 9.531 -8.049 1.00 0.00 O ATOM 212 CB ASN A 14 2.586 8.441 -10.035 1.00 0.00 C ATOM 213 CG ASN A 14 3.177 8.392 -11.424 1.00 0.00 C ATOM 214 OD1 ASN A 14 3.644 9.401 -11.950 1.00 0.00 O ATOM 215 ND2 ASN A 14 3.140 7.224 -12.036 1.00 0.00 N ATOM 0 H ASN A 14 5.287 9.716 -9.049 1.00 0.00 H new ATOM 0 HA ASN A 14 3.364 10.420 -9.748 1.00 0.00 H new ATOM 0 HB2 ASN A 14 2.711 7.469 -9.558 1.00 0.00 H new ATOM 0 HB3 ASN A 14 1.514 8.625 -10.108 1.00 0.00 H new ATOM 0 HD21 ASN A 14 3.508 7.133 -12.983 1.00 0.00 H new ATOM 0 HD22 ASN A 14 2.743 6.412 -11.562 1.00 0.00 H new ATOM 222 N PHE A 15 2.816 10.497 -6.989 1.00 0.00 N ATOM 223 CA PHE A 15 2.002 10.894 -5.856 1.00 0.00 C ATOM 224 C PHE A 15 1.086 12.038 -6.255 1.00 0.00 C ATOM 225 O PHE A 15 -0.104 12.037 -5.928 1.00 0.00 O ATOM 226 CB PHE A 15 2.877 11.302 -4.664 1.00 0.00 C ATOM 227 CG PHE A 15 2.085 11.870 -3.513 1.00 0.00 C ATOM 228 CD1 PHE A 15 1.742 13.214 -3.483 1.00 0.00 C ATOM 229 CD2 PHE A 15 1.670 11.056 -2.471 1.00 0.00 C ATOM 230 CE1 PHE A 15 1.003 13.734 -2.441 1.00 0.00 C ATOM 231 CE2 PHE A 15 0.928 11.571 -1.424 1.00 0.00 C ATOM 232 CZ PHE A 15 0.594 12.912 -1.409 1.00 0.00 C ATOM 0 H PHE A 15 3.799 10.761 -6.924 1.00 0.00 H new ATOM 0 HA PHE A 15 1.397 10.040 -5.551 1.00 0.00 H new ATOM 0 HB2 PHE A 15 3.436 10.433 -4.318 1.00 0.00 H new ATOM 0 HB3 PHE A 15 3.607 12.041 -4.994 1.00 0.00 H new ATOM 0 HD1 PHE A 15 2.058 13.862 -4.287 1.00 0.00 H new ATOM 0 HD2 PHE A 15 1.929 10.008 -2.477 1.00 0.00 H new ATOM 0 HE1 PHE A 15 0.744 14.783 -2.432 1.00 0.00 H new ATOM 0 HE2 PHE A 15 0.610 10.926 -0.619 1.00 0.00 H new ATOM 0 HZ PHE A 15 0.015 13.316 -0.592 1.00 0.00 H new ATOM 242 N GLU A 16 1.646 13.005 -6.979 1.00 0.00 N ATOM 243 CA GLU A 16 0.891 14.175 -7.397 1.00 0.00 C ATOM 244 C GLU A 16 -0.296 13.768 -8.226 1.00 0.00 C ATOM 245 O GLU A 16 -1.411 14.025 -7.845 1.00 0.00 O ATOM 246 CB GLU A 16 1.721 15.137 -8.230 1.00 0.00 C ATOM 247 CG GLU A 16 3.204 14.986 -8.065 1.00 0.00 C ATOM 248 CD GLU A 16 3.953 16.164 -8.650 1.00 0.00 C ATOM 249 OE1 GLU A 16 3.309 16.987 -9.341 1.00 0.00 O ATOM 250 OE2 GLU A 16 5.176 16.272 -8.428 1.00 0.00 O ATOM 0 H GLU A 16 2.619 12.998 -7.286 1.00 0.00 H new ATOM 0 HA GLU A 16 0.579 14.674 -6.480 1.00 0.00 H new ATOM 0 HB2 GLU A 16 1.469 14.997 -9.281 1.00 0.00 H new ATOM 0 HB3 GLU A 16 1.442 16.158 -7.969 1.00 0.00 H new ATOM 0 HG2 GLU A 16 3.445 14.891 -7.006 1.00 0.00 H new ATOM 0 HG3 GLU A 16 3.533 14.067 -8.551 1.00 0.00 H new ATOM 257 N PRO A 17 -0.079 13.100 -9.361 1.00 0.00 N ATOM 258 CA PRO A 17 -1.158 12.802 -10.293 1.00 0.00 C ATOM 259 C PRO A 17 -2.269 11.998 -9.639 1.00 0.00 C ATOM 260 O PRO A 17 -3.434 12.095 -10.030 1.00 0.00 O ATOM 261 CB PRO A 17 -0.500 11.998 -11.391 1.00 0.00 C ATOM 262 CG PRO A 17 0.776 11.503 -10.805 1.00 0.00 C ATOM 263 CD PRO A 17 1.201 12.531 -9.800 1.00 0.00 C ATOM 0 HA PRO A 17 -1.631 13.713 -10.659 1.00 0.00 H new ATOM 0 HB2 PRO A 17 -1.135 11.170 -11.707 1.00 0.00 H new ATOM 0 HB3 PRO A 17 -0.316 12.613 -12.272 1.00 0.00 H new ATOM 0 HG2 PRO A 17 0.636 10.531 -10.332 1.00 0.00 H new ATOM 0 HG3 PRO A 17 1.535 11.376 -11.577 1.00 0.00 H new ATOM 0 HD2 PRO A 17 1.751 12.085 -8.972 1.00 0.00 H new ATOM 0 HD3 PRO A 17 1.850 13.287 -10.243 1.00 0.00 H new ATOM 271 N PHE A 18 -1.904 11.218 -8.628 1.00 0.00 N ATOM 272 CA PHE A 18 -2.879 10.448 -7.886 1.00 0.00 C ATOM 273 C PHE A 18 -3.717 11.371 -7.008 1.00 0.00 C ATOM 274 O PHE A 18 -4.940 11.349 -7.074 1.00 0.00 O ATOM 275 CB PHE A 18 -2.184 9.396 -7.020 1.00 0.00 C ATOM 276 CG PHE A 18 -3.150 8.526 -6.274 1.00 0.00 C ATOM 277 CD1 PHE A 18 -4.030 7.723 -6.969 1.00 0.00 C ATOM 278 CD2 PHE A 18 -3.194 8.525 -4.889 1.00 0.00 C ATOM 279 CE1 PHE A 18 -4.941 6.931 -6.307 1.00 0.00 C ATOM 280 CE2 PHE A 18 -4.107 7.735 -4.215 1.00 0.00 C ATOM 281 CZ PHE A 18 -4.982 6.935 -4.926 1.00 0.00 C ATOM 0 H PHE A 18 -0.942 11.106 -8.309 1.00 0.00 H new ATOM 0 HA PHE A 18 -3.532 9.941 -8.596 1.00 0.00 H new ATOM 0 HB2 PHE A 18 -1.553 8.771 -7.652 1.00 0.00 H new ATOM 0 HB3 PHE A 18 -1.527 9.895 -6.308 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -4.004 7.715 -8.049 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -2.509 9.147 -4.331 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -5.623 6.307 -6.866 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -4.136 7.743 -3.135 1.00 0.00 H new ATOM 0 HZ PHE A 18 -5.695 6.315 -4.404 1.00 0.00 H new ATOM 291 N MET A 19 -3.048 12.204 -6.217 1.00 0.00 N ATOM 292 CA MET A 19 -3.732 13.177 -5.365 1.00 0.00 C ATOM 293 C MET A 19 -4.380 14.261 -6.193 1.00 0.00 C ATOM 294 O MET A 19 -5.417 14.787 -5.824 1.00 0.00 O ATOM 295 CB MET A 19 -2.768 13.792 -4.358 1.00 0.00 C ATOM 296 CG MET A 19 -2.746 13.038 -3.046 1.00 0.00 C ATOM 297 SD MET A 19 -4.236 13.309 -2.069 1.00 0.00 S ATOM 298 CE MET A 19 -3.902 12.276 -0.645 1.00 0.00 C ATOM 0 H MET A 19 -2.031 12.226 -6.147 1.00 0.00 H new ATOM 0 HA MET A 19 -4.512 12.646 -4.819 1.00 0.00 H new ATOM 0 HB2 MET A 19 -1.764 13.807 -4.782 1.00 0.00 H new ATOM 0 HB3 MET A 19 -3.051 14.828 -4.174 1.00 0.00 H new ATOM 0 HG2 MET A 19 -2.635 11.972 -3.245 1.00 0.00 H new ATOM 0 HG3 MET A 19 -1.875 13.347 -2.468 1.00 0.00 H new ATOM 0 HE1 MET A 19 -4.737 12.338 0.053 1.00 0.00 H new ATOM 0 HE2 MET A 19 -3.775 11.242 -0.967 1.00 0.00 H new ATOM 0 HE3 MET A 19 -2.991 12.618 -0.153 1.00 0.00 H new ATOM 308 N LYS A 20 -3.774 14.581 -7.313 1.00 0.00 N ATOM 309 CA LYS A 20 -4.317 15.567 -8.212 1.00 0.00 C ATOM 310 C LYS A 20 -5.687 15.118 -8.652 1.00 0.00 C ATOM 311 O LYS A 20 -6.667 15.850 -8.503 1.00 0.00 O ATOM 312 CB LYS A 20 -3.397 15.730 -9.405 1.00 0.00 C ATOM 313 CG LYS A 20 -2.501 16.934 -9.284 1.00 0.00 C ATOM 314 CD LYS A 20 -1.208 16.730 -10.020 1.00 0.00 C ATOM 315 CE LYS A 20 -0.429 18.012 -10.073 1.00 0.00 C ATOM 316 NZ LYS A 20 0.949 17.829 -10.605 1.00 0.00 N ATOM 0 H LYS A 20 -2.895 14.166 -7.623 1.00 0.00 H new ATOM 0 HA LYS A 20 -4.400 16.531 -7.710 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -2.784 14.835 -9.512 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -3.996 15.817 -10.312 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -3.012 17.811 -9.680 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -2.295 17.132 -8.232 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -0.618 15.959 -9.525 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -1.410 16.377 -11.031 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -0.962 18.730 -10.697 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -0.373 18.439 -9.072 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 1.298 18.733 -10.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 1.577 17.508 -9.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 0.937 17.118 -11.364 1.00 0.00 H new ATOM 330 N ALA A 21 -5.754 13.851 -9.061 1.00 0.00 N ATOM 331 CA ALA A 21 -7.004 13.230 -9.448 1.00 0.00 C ATOM 332 C ALA A 21 -7.873 12.967 -8.227 1.00 0.00 C ATOM 333 O ALA A 21 -9.089 12.788 -8.321 1.00 0.00 O ATOM 334 CB ALA A 21 -6.745 11.954 -10.209 1.00 0.00 C ATOM 0 H ALA A 21 -4.943 13.236 -9.130 1.00 0.00 H new ATOM 0 HA ALA A 21 -7.542 13.915 -10.104 1.00 0.00 H new ATOM 0 HB1 ALA A 21 -7.695 11.500 -10.492 1.00 0.00 H new ATOM 0 HB2 ALA A 21 -6.167 12.176 -11.106 1.00 0.00 H new ATOM 0 HB3 ALA A 21 -6.186 11.262 -9.579 1.00 0.00 H new ATOM 340 N MET A 22 -7.217 12.962 -7.080 1.00 0.00 N ATOM 341 CA MET A 22 -7.869 12.811 -5.786 1.00 0.00 C ATOM 342 C MET A 22 -8.491 14.135 -5.360 1.00 0.00 C ATOM 343 O MET A 22 -9.200 14.219 -4.360 1.00 0.00 O ATOM 344 CB MET A 22 -6.855 12.315 -4.743 1.00 0.00 C ATOM 345 CG MET A 22 -6.743 10.804 -4.686 1.00 0.00 C ATOM 346 SD MET A 22 -8.257 10.005 -4.113 1.00 0.00 S ATOM 347 CE MET A 22 -8.391 10.678 -2.458 1.00 0.00 C ATOM 0 H MET A 22 -6.204 13.064 -7.018 1.00 0.00 H new ATOM 0 HA MET A 22 -8.665 12.071 -5.866 1.00 0.00 H new ATOM 0 HB2 MET A 22 -5.876 12.737 -4.970 1.00 0.00 H new ATOM 0 HB3 MET A 22 -7.143 12.688 -3.760 1.00 0.00 H new ATOM 0 HG2 MET A 22 -6.492 10.426 -5.677 1.00 0.00 H new ATOM 0 HG3 MET A 22 -5.922 10.531 -4.024 1.00 0.00 H new ATOM 0 HE1 MET A 22 -8.690 9.889 -1.768 1.00 0.00 H new ATOM 0 HE2 MET A 22 -7.427 11.083 -2.151 1.00 0.00 H new ATOM 0 HE3 MET A 22 -9.138 11.471 -2.447 1.00 0.00 H new ATOM 357 N GLY A 23 -8.211 15.167 -6.140 1.00 0.00 N ATOM 358 CA GLY A 23 -8.810 16.467 -5.919 1.00 0.00 C ATOM 359 C GLY A 23 -7.840 17.440 -5.292 1.00 0.00 C ATOM 360 O GLY A 23 -8.228 18.507 -4.821 1.00 0.00 O ATOM 0 H GLY A 23 -7.571 15.126 -6.933 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -9.163 16.869 -6.869 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -9.682 16.359 -5.274 1.00 0.00 H new ATOM 364 N LEU A 24 -6.574 17.071 -5.280 1.00 0.00 N ATOM 365 CA LEU A 24 -5.557 17.885 -4.634 1.00 0.00 C ATOM 366 C LEU A 24 -4.943 18.855 -5.627 1.00 0.00 C ATOM 367 O LEU A 24 -4.526 18.479 -6.724 1.00 0.00 O ATOM 368 CB LEU A 24 -4.482 17.009 -3.983 1.00 0.00 C ATOM 369 CG LEU A 24 -3.747 17.658 -2.818 1.00 0.00 C ATOM 370 CD1 LEU A 24 -4.722 17.933 -1.685 1.00 0.00 C ATOM 371 CD2 LEU A 24 -2.594 16.788 -2.320 1.00 0.00 C ATOM 0 H LEU A 24 -6.223 16.215 -5.709 1.00 0.00 H new ATOM 0 HA LEU A 24 -6.035 18.463 -3.843 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -4.947 16.088 -3.632 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.753 16.728 -4.743 1.00 0.00 H new ATOM 0 HG LEU A 24 -3.321 18.597 -3.171 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -4.192 18.397 -0.853 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -5.507 18.604 -2.035 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -5.168 16.995 -1.353 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -2.095 17.286 -1.489 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.982 15.826 -1.986 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.881 16.631 -3.129 1.00 0.00 H new ATOM 383 N PRO A 25 -4.916 20.125 -5.239 1.00 0.00 N ATOM 384 CA PRO A 25 -4.305 21.187 -6.022 1.00 0.00 C ATOM 385 C PRO A 25 -2.793 21.056 -6.037 1.00 0.00 C ATOM 386 O PRO A 25 -2.213 20.532 -5.091 1.00 0.00 O ATOM 387 CB PRO A 25 -4.700 22.473 -5.300 1.00 0.00 C ATOM 388 CG PRO A 25 -5.309 22.076 -4.003 1.00 0.00 C ATOM 389 CD PRO A 25 -5.480 20.597 -3.978 1.00 0.00 C ATOM 0 HA PRO A 25 -4.634 21.160 -7.061 1.00 0.00 H new ATOM 0 HB2 PRO A 25 -3.828 23.107 -5.138 1.00 0.00 H new ATOM 0 HB3 PRO A 25 -5.407 23.049 -5.897 1.00 0.00 H new ATOM 0 HG2 PRO A 25 -4.675 22.395 -3.176 1.00 0.00 H new ATOM 0 HG3 PRO A 25 -6.273 22.568 -3.874 1.00 0.00 H new ATOM 0 HD2 PRO A 25 -4.963 20.155 -3.126 1.00 0.00 H new ATOM 0 HD3 PRO A 25 -6.531 20.324 -3.890 1.00 0.00 H new ATOM 397 N GLU A 26 -2.168 21.545 -7.101 1.00 0.00 N ATOM 398 CA GLU A 26 -0.716 21.486 -7.257 1.00 0.00 C ATOM 399 C GLU A 26 0.000 22.043 -6.035 1.00 0.00 C ATOM 400 O GLU A 26 1.055 21.550 -5.650 1.00 0.00 O ATOM 401 CB GLU A 26 -0.256 22.259 -8.492 1.00 0.00 C ATOM 402 CG GLU A 26 -0.397 23.756 -8.355 1.00 0.00 C ATOM 403 CD GLU A 26 -1.829 24.249 -8.339 1.00 0.00 C ATOM 404 OE1 GLU A 26 -2.435 24.296 -7.251 1.00 0.00 O ATOM 405 OE2 GLU A 26 -2.347 24.610 -9.417 1.00 0.00 O ATOM 0 H GLU A 26 -2.650 21.993 -7.880 1.00 0.00 H new ATOM 0 HA GLU A 26 -0.460 20.433 -7.374 1.00 0.00 H new ATOM 0 HB2 GLU A 26 0.788 22.018 -8.694 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -0.833 21.926 -9.355 1.00 0.00 H new ATOM 0 HG2 GLU A 26 0.094 24.073 -7.435 1.00 0.00 H new ATOM 0 HG3 GLU A 26 0.131 24.236 -9.179 1.00 0.00 H new ATOM 412 N ASP A 27 -0.579 23.071 -5.433 1.00 0.00 N ATOM 413 CA ASP A 27 0.036 23.710 -4.289 1.00 0.00 C ATOM 414 C ASP A 27 0.101 22.747 -3.111 1.00 0.00 C ATOM 415 O ASP A 27 1.143 22.597 -2.478 1.00 0.00 O ATOM 416 CB ASP A 27 -0.730 24.974 -3.905 1.00 0.00 C ATOM 417 CG ASP A 27 -0.115 25.684 -2.720 1.00 0.00 C ATOM 418 OD1 ASP A 27 0.912 26.376 -2.907 1.00 0.00 O ATOM 419 OD2 ASP A 27 -0.653 25.559 -1.603 1.00 0.00 O ATOM 0 H ASP A 27 -1.470 23.476 -5.719 1.00 0.00 H new ATOM 0 HA ASP A 27 1.053 23.993 -4.559 1.00 0.00 H new ATOM 0 HB2 ASP A 27 -0.757 25.652 -4.758 1.00 0.00 H new ATOM 0 HB3 ASP A 27 -1.763 24.713 -3.673 1.00 0.00 H new ATOM 424 N LEU A 28 -1.009 22.063 -2.856 1.00 0.00 N ATOM 425 CA LEU A 28 -1.060 21.064 -1.797 1.00 0.00 C ATOM 426 C LEU A 28 -0.315 19.810 -2.227 1.00 0.00 C ATOM 427 O LEU A 28 0.292 19.115 -1.413 1.00 0.00 O ATOM 428 CB LEU A 28 -2.499 20.725 -1.452 1.00 0.00 C ATOM 429 CG LEU A 28 -3.226 21.775 -0.629 1.00 0.00 C ATOM 430 CD1 LEU A 28 -4.668 21.366 -0.426 1.00 0.00 C ATOM 431 CD2 LEU A 28 -2.531 21.972 0.706 1.00 0.00 C ATOM 0 H LEU A 28 -1.883 22.182 -3.367 1.00 0.00 H new ATOM 0 HA LEU A 28 -0.580 21.475 -0.909 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.051 20.565 -2.378 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -2.513 19.782 -0.905 1.00 0.00 H new ATOM 0 HG LEU A 28 -3.207 22.723 -1.167 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.182 22.124 0.165 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -5.158 21.267 -1.395 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -4.705 20.411 0.098 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -3.063 22.727 1.285 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -2.525 21.031 1.256 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -1.505 22.300 0.537 1.00 0.00 H new ATOM 443 N ILE A 29 -0.368 19.547 -3.522 1.00 0.00 N ATOM 444 CA ILE A 29 0.343 18.452 -4.136 1.00 0.00 C ATOM 445 C ILE A 29 1.835 18.569 -3.892 1.00 0.00 C ATOM 446 O ILE A 29 2.466 17.608 -3.489 1.00 0.00 O ATOM 447 CB ILE A 29 0.053 18.453 -5.645 1.00 0.00 C ATOM 448 CG1 ILE A 29 -1.244 17.708 -5.914 1.00 0.00 C ATOM 449 CG2 ILE A 29 1.177 17.848 -6.429 1.00 0.00 C ATOM 450 CD1 ILE A 29 -1.124 16.210 -5.846 1.00 0.00 C ATOM 0 H ILE A 29 -0.916 20.100 -4.181 1.00 0.00 H new ATOM 0 HA ILE A 29 0.004 17.515 -3.693 1.00 0.00 H new ATOM 0 HB ILE A 29 -0.046 19.488 -5.971 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -1.993 18.034 -5.192 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -1.611 17.987 -6.902 1.00 0.00 H new ATOM 0 HG21 ILE A 29 0.932 17.868 -7.491 1.00 0.00 H new ATOM 0 HG22 ILE A 29 2.090 18.419 -6.256 1.00 0.00 H new ATOM 0 HG23 ILE A 29 1.328 16.816 -6.111 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -2.094 15.758 -6.050 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -0.401 15.869 -6.587 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -0.789 15.917 -4.851 1.00 0.00 H new ATOM 462 N GLN A 30 2.382 19.758 -4.104 1.00 0.00 N ATOM 463 CA GLN A 30 3.806 19.996 -3.908 1.00 0.00 C ATOM 464 C GLN A 30 4.209 19.797 -2.448 1.00 0.00 C ATOM 465 O GLN A 30 5.339 19.405 -2.153 1.00 0.00 O ATOM 466 CB GLN A 30 4.175 21.413 -4.362 1.00 0.00 C ATOM 467 CG GLN A 30 4.391 21.550 -5.850 1.00 0.00 C ATOM 468 CD GLN A 30 5.550 20.710 -6.349 1.00 0.00 C ATOM 469 OE1 GLN A 30 5.377 19.553 -6.729 1.00 0.00 O ATOM 470 NE2 GLN A 30 6.742 21.289 -6.357 1.00 0.00 N ATOM 0 H GLN A 30 1.858 20.577 -4.413 1.00 0.00 H new ATOM 0 HA GLN A 30 4.350 19.270 -4.512 1.00 0.00 H new ATOM 0 HB2 GLN A 30 3.384 22.098 -4.057 1.00 0.00 H new ATOM 0 HB3 GLN A 30 5.083 21.723 -3.844 1.00 0.00 H new ATOM 0 HG2 GLN A 30 3.482 21.256 -6.374 1.00 0.00 H new ATOM 0 HG3 GLN A 30 4.575 22.597 -6.092 1.00 0.00 H new ATOM 0 HE21 GLN A 30 6.844 22.251 -6.034 1.00 0.00 H new ATOM 0 HE22 GLN A 30 7.558 20.773 -6.687 1.00 0.00 H new ATOM 479 N LYS A 31 3.273 20.050 -1.544 1.00 0.00 N ATOM 480 CA LYS A 31 3.534 19.947 -0.118 1.00 0.00 C ATOM 481 C LYS A 31 3.490 18.500 0.308 1.00 0.00 C ATOM 482 O LYS A 31 4.337 18.028 1.060 1.00 0.00 O ATOM 483 CB LYS A 31 2.517 20.747 0.671 1.00 0.00 C ATOM 484 CG LYS A 31 2.672 22.237 0.484 1.00 0.00 C ATOM 485 CD LYS A 31 1.345 22.920 0.628 1.00 0.00 C ATOM 486 CE LYS A 31 0.782 22.762 2.027 1.00 0.00 C ATOM 487 NZ LYS A 31 1.558 23.528 3.036 1.00 0.00 N ATOM 0 H LYS A 31 2.320 20.330 -1.777 1.00 0.00 H new ATOM 0 HA LYS A 31 4.525 20.353 0.083 1.00 0.00 H new ATOM 0 HB2 LYS A 31 1.513 20.450 0.367 1.00 0.00 H new ATOM 0 HB3 LYS A 31 2.614 20.506 1.730 1.00 0.00 H new ATOM 0 HG2 LYS A 31 3.374 22.632 1.219 1.00 0.00 H new ATOM 0 HG3 LYS A 31 3.091 22.445 -0.500 1.00 0.00 H new ATOM 0 HD2 LYS A 31 1.454 23.980 0.397 1.00 0.00 H new ATOM 0 HD3 LYS A 31 0.643 22.507 -0.096 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -0.255 23.097 2.039 1.00 0.00 H new ATOM 0 HE3 LYS A 31 0.780 21.706 2.298 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 1.053 23.515 3.945 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 2.496 23.095 3.155 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 1.669 24.511 2.715 1.00 0.00 H new ATOM 501 N GLY A 32 2.487 17.804 -0.200 1.00 0.00 N ATOM 502 CA GLY A 32 2.314 16.402 0.102 1.00 0.00 C ATOM 503 C GLY A 32 3.212 15.519 -0.739 1.00 0.00 C ATOM 504 O GLY A 32 3.347 14.329 -0.467 1.00 0.00 O ATOM 0 H GLY A 32 1.781 18.193 -0.825 1.00 0.00 H new ATOM 0 HA2 GLY A 32 2.525 16.231 1.158 1.00 0.00 H new ATOM 0 HA3 GLY A 32 1.274 16.122 -0.064 1.00 0.00 H new ATOM 508 N LYS A 33 3.851 16.121 -1.737 1.00 0.00 N ATOM 509 CA LYS A 33 4.554 15.392 -2.782 1.00 0.00 C ATOM 510 C LYS A 33 5.695 14.507 -2.260 1.00 0.00 C ATOM 511 O LYS A 33 6.157 13.607 -2.969 1.00 0.00 O ATOM 512 CB LYS A 33 5.038 16.410 -3.815 1.00 0.00 C ATOM 513 CG LYS A 33 6.480 16.300 -4.204 1.00 0.00 C ATOM 514 CD LYS A 33 6.628 16.506 -5.695 1.00 0.00 C ATOM 515 CE LYS A 33 7.698 17.516 -6.023 1.00 0.00 C ATOM 516 NZ LYS A 33 7.723 17.837 -7.473 1.00 0.00 N ATOM 0 H LYS A 33 3.895 17.135 -1.842 1.00 0.00 H new ATOM 0 HA LYS A 33 3.863 14.684 -3.240 1.00 0.00 H new ATOM 0 HB2 LYS A 33 4.429 16.307 -4.713 1.00 0.00 H new ATOM 0 HB3 LYS A 33 4.861 17.411 -3.423 1.00 0.00 H new ATOM 0 HG2 LYS A 33 7.069 17.043 -3.665 1.00 0.00 H new ATOM 0 HG3 LYS A 33 6.868 15.321 -3.923 1.00 0.00 H new ATOM 0 HD2 LYS A 33 6.869 15.555 -6.170 1.00 0.00 H new ATOM 0 HD3 LYS A 33 5.677 16.838 -6.111 1.00 0.00 H new ATOM 0 HE2 LYS A 33 7.526 18.428 -5.451 1.00 0.00 H new ATOM 0 HE3 LYS A 33 8.670 17.128 -5.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 8.639 18.264 -7.718 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 7.589 16.965 -8.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 6.959 18.507 -7.693 1.00 0.00 H new ATOM 530 N ASP A 34 6.139 14.727 -1.029 1.00 0.00 N ATOM 531 CA ASP A 34 7.243 13.939 -0.494 1.00 0.00 C ATOM 532 C ASP A 34 6.848 13.267 0.815 1.00 0.00 C ATOM 533 O ASP A 34 7.697 12.817 1.583 1.00 0.00 O ATOM 534 CB ASP A 34 8.492 14.804 -0.300 1.00 0.00 C ATOM 535 CG ASP A 34 9.756 13.969 -0.211 1.00 0.00 C ATOM 536 OD1 ASP A 34 10.188 13.431 -1.255 1.00 0.00 O ATOM 537 OD2 ASP A 34 10.313 13.824 0.897 1.00 0.00 O ATOM 0 H ASP A 34 5.761 15.429 -0.393 1.00 0.00 H new ATOM 0 HA ASP A 34 7.479 13.160 -1.220 1.00 0.00 H new ATOM 0 HB2 ASP A 34 8.579 15.506 -1.130 1.00 0.00 H new ATOM 0 HB3 ASP A 34 8.385 15.397 0.609 1.00 0.00 H new ATOM 542 N ILE A 35 5.556 13.213 1.081 1.00 0.00 N ATOM 543 CA ILE A 35 5.057 12.492 2.218 1.00 0.00 C ATOM 544 C ILE A 35 4.897 11.014 1.913 1.00 0.00 C ATOM 545 O ILE A 35 4.461 10.622 0.830 1.00 0.00 O ATOM 546 CB ILE A 35 3.727 13.091 2.721 1.00 0.00 C ATOM 547 CG1 ILE A 35 4.014 14.329 3.557 1.00 0.00 C ATOM 548 CG2 ILE A 35 2.911 12.086 3.499 1.00 0.00 C ATOM 549 CD1 ILE A 35 4.394 15.539 2.757 1.00 0.00 C ATOM 0 H ILE A 35 4.837 13.665 0.517 1.00 0.00 H new ATOM 0 HA ILE A 35 5.796 12.592 3.013 1.00 0.00 H new ATOM 0 HB ILE A 35 3.128 13.372 1.855 1.00 0.00 H new ATOM 0 HG12 ILE A 35 3.132 14.564 4.152 1.00 0.00 H new ATOM 0 HG13 ILE A 35 4.819 14.102 4.256 1.00 0.00 H new ATOM 0 HG21 ILE A 35 1.984 12.551 3.834 1.00 0.00 H new ATOM 0 HG22 ILE A 35 2.680 11.233 2.861 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.480 11.747 4.365 1.00 0.00 H new ATOM 0 HD11 ILE A 35 4.581 16.376 3.430 1.00 0.00 H new ATOM 0 HD12 ILE A 35 5.295 15.327 2.182 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.582 15.795 2.077 1.00 0.00 H new ATOM 561 N LYS A 36 5.297 10.211 2.880 1.00 0.00 N ATOM 562 CA LYS A 36 5.136 8.774 2.819 1.00 0.00 C ATOM 563 C LYS A 36 4.446 8.316 4.093 1.00 0.00 C ATOM 564 O LYS A 36 3.272 8.608 4.324 1.00 0.00 O ATOM 565 CB LYS A 36 6.491 8.058 2.679 1.00 0.00 C ATOM 566 CG LYS A 36 7.381 8.592 1.569 1.00 0.00 C ATOM 567 CD LYS A 36 8.365 9.627 2.082 1.00 0.00 C ATOM 568 CE LYS A 36 9.125 10.271 0.941 1.00 0.00 C ATOM 569 NZ LYS A 36 10.227 11.137 1.431 1.00 0.00 N ATOM 0 H LYS A 36 5.745 10.541 3.735 1.00 0.00 H new ATOM 0 HA LYS A 36 4.539 8.523 1.942 1.00 0.00 H new ATOM 0 HB2 LYS A 36 7.027 8.136 3.625 1.00 0.00 H new ATOM 0 HB3 LYS A 36 6.310 6.998 2.502 1.00 0.00 H new ATOM 0 HG2 LYS A 36 7.927 7.766 1.113 1.00 0.00 H new ATOM 0 HG3 LYS A 36 6.762 9.035 0.789 1.00 0.00 H new ATOM 0 HD2 LYS A 36 7.831 10.393 2.645 1.00 0.00 H new ATOM 0 HD3 LYS A 36 9.067 9.156 2.770 1.00 0.00 H new ATOM 0 HE2 LYS A 36 9.533 9.496 0.293 1.00 0.00 H new ATOM 0 HE3 LYS A 36 8.439 10.864 0.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 11.066 11.003 0.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 9.929 12.133 1.393 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 10.459 10.882 2.412 1.00 0.00 H new ATOM 583 N GLY A 37 5.207 7.651 4.932 1.00 0.00 N ATOM 584 CA GLY A 37 4.702 7.182 6.196 1.00 0.00 C ATOM 585 C GLY A 37 5.396 5.914 6.612 1.00 0.00 C ATOM 586 O GLY A 37 6.266 5.413 5.894 1.00 0.00 O ATOM 0 H GLY A 37 6.186 7.423 4.757 1.00 0.00 H new ATOM 0 HA2 GLY A 37 4.848 7.948 6.958 1.00 0.00 H new ATOM 0 HA3 GLY A 37 3.629 7.007 6.121 1.00 0.00 H new ATOM 590 N VAL A 38 5.028 5.389 7.761 1.00 0.00 N ATOM 591 CA VAL A 38 5.610 4.157 8.233 1.00 0.00 C ATOM 592 C VAL A 38 4.636 3.006 8.043 1.00 0.00 C ATOM 593 O VAL A 38 3.487 3.069 8.489 1.00 0.00 O ATOM 594 CB VAL A 38 6.013 4.262 9.709 1.00 0.00 C ATOM 595 CG1 VAL A 38 6.734 3.008 10.168 1.00 0.00 C ATOM 596 CG2 VAL A 38 6.887 5.480 9.892 1.00 0.00 C ATOM 0 H VAL A 38 4.330 5.797 8.382 1.00 0.00 H new ATOM 0 HA VAL A 38 6.509 3.967 7.647 1.00 0.00 H new ATOM 0 HB VAL A 38 5.116 4.362 10.320 1.00 0.00 H new ATOM 0 HG11 VAL A 38 7.008 3.110 11.218 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.078 2.146 10.046 1.00 0.00 H new ATOM 0 HG13 VAL A 38 7.634 2.866 9.570 1.00 0.00 H new ATOM 0 HG21 VAL A 38 7.179 5.564 10.939 1.00 0.00 H new ATOM 0 HG22 VAL A 38 7.779 5.384 9.273 1.00 0.00 H new ATOM 0 HG23 VAL A 38 6.334 6.372 9.597 1.00 0.00 H new ATOM 606 N SER A 39 5.090 1.972 7.355 1.00 0.00 N ATOM 607 CA SER A 39 4.264 0.802 7.108 1.00 0.00 C ATOM 608 C SER A 39 4.807 -0.403 7.864 1.00 0.00 C ATOM 609 O SER A 39 5.992 -0.485 8.133 1.00 0.00 O ATOM 610 CB SER A 39 4.148 0.511 5.603 1.00 0.00 C ATOM 611 OG SER A 39 5.341 0.831 4.908 1.00 0.00 O ATOM 0 H SER A 39 6.028 1.919 6.957 1.00 0.00 H new ATOM 0 HA SER A 39 3.260 1.010 7.477 1.00 0.00 H new ATOM 0 HB2 SER A 39 3.913 -0.543 5.454 1.00 0.00 H new ATOM 0 HB3 SER A 39 3.320 1.084 5.185 1.00 0.00 H new ATOM 0 HG SER A 39 6.109 0.454 5.386 1.00 0.00 H new ATOM 617 N GLU A 40 3.933 -1.300 8.262 1.00 0.00 N ATOM 618 CA GLU A 40 4.344 -2.491 8.987 1.00 0.00 C ATOM 619 C GLU A 40 3.772 -3.728 8.310 1.00 0.00 C ATOM 620 O GLU A 40 2.574 -3.774 8.018 1.00 0.00 O ATOM 621 CB GLU A 40 3.849 -2.411 10.427 1.00 0.00 C ATOM 622 CG GLU A 40 4.532 -3.391 11.358 1.00 0.00 C ATOM 623 CD GLU A 40 4.010 -3.288 12.774 1.00 0.00 C ATOM 624 OE1 GLU A 40 4.099 -2.192 13.362 1.00 0.00 O ATOM 625 OE2 GLU A 40 3.522 -4.302 13.313 1.00 0.00 O ATOM 0 H GLU A 40 2.929 -1.231 8.097 1.00 0.00 H new ATOM 0 HA GLU A 40 5.432 -2.556 8.986 1.00 0.00 H new ATOM 0 HB2 GLU A 40 4.005 -1.399 10.800 1.00 0.00 H new ATOM 0 HB3 GLU A 40 2.775 -2.595 10.444 1.00 0.00 H new ATOM 0 HG2 GLU A 40 4.382 -4.406 10.989 1.00 0.00 H new ATOM 0 HG3 GLU A 40 5.606 -3.206 11.354 1.00 0.00 H new ATOM 632 N ILE A 41 4.620 -4.717 8.058 1.00 0.00 N ATOM 633 CA ILE A 41 4.205 -5.919 7.346 1.00 0.00 C ATOM 634 C ILE A 41 4.470 -7.159 8.194 1.00 0.00 C ATOM 635 O ILE A 41 5.618 -7.464 8.500 1.00 0.00 O ATOM 636 CB ILE A 41 4.962 -6.087 6.004 1.00 0.00 C ATOM 637 CG1 ILE A 41 5.026 -4.772 5.218 1.00 0.00 C ATOM 638 CG2 ILE A 41 4.318 -7.169 5.161 1.00 0.00 C ATOM 639 CD1 ILE A 41 3.680 -4.150 4.956 1.00 0.00 C ATOM 0 H ILE A 41 5.601 -4.710 8.337 1.00 0.00 H new ATOM 0 HA ILE A 41 3.139 -5.810 7.145 1.00 0.00 H new ATOM 0 HB ILE A 41 5.984 -6.382 6.242 1.00 0.00 H new ATOM 0 HG12 ILE A 41 5.643 -4.061 5.768 1.00 0.00 H new ATOM 0 HG13 ILE A 41 5.523 -4.954 4.265 1.00 0.00 H new ATOM 0 HG21 ILE A 41 4.863 -7.272 4.223 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.344 -8.115 5.702 1.00 0.00 H new ATOM 0 HG23 ILE A 41 3.283 -6.899 4.951 1.00 0.00 H new ATOM 0 HD11 ILE A 41 3.810 -3.224 4.396 1.00 0.00 H new ATOM 0 HD12 ILE A 41 3.066 -4.841 4.378 1.00 0.00 H new ATOM 0 HD13 ILE A 41 3.188 -3.934 5.904 1.00 0.00 H new ATOM 651 N VAL A 42 3.415 -7.867 8.571 1.00 0.00 N ATOM 652 CA VAL A 42 3.548 -9.110 9.330 1.00 0.00 C ATOM 653 C VAL A 42 2.834 -10.234 8.593 1.00 0.00 C ATOM 654 O VAL A 42 1.615 -10.246 8.500 1.00 0.00 O ATOM 655 CB VAL A 42 2.943 -8.982 10.745 1.00 0.00 C ATOM 656 CG1 VAL A 42 3.246 -10.216 11.574 1.00 0.00 C ATOM 657 CG2 VAL A 42 3.436 -7.727 11.448 1.00 0.00 C ATOM 0 H VAL A 42 2.452 -7.603 8.364 1.00 0.00 H new ATOM 0 HA VAL A 42 4.612 -9.327 9.427 1.00 0.00 H new ATOM 0 HB VAL A 42 1.862 -8.898 10.636 1.00 0.00 H new ATOM 0 HG11 VAL A 42 2.810 -10.103 12.567 1.00 0.00 H new ATOM 0 HG12 VAL A 42 2.820 -11.094 11.088 1.00 0.00 H new ATOM 0 HG13 VAL A 42 4.325 -10.338 11.663 1.00 0.00 H new ATOM 0 HG21 VAL A 42 2.991 -7.668 12.441 1.00 0.00 H new ATOM 0 HG22 VAL A 42 4.522 -7.763 11.538 1.00 0.00 H new ATOM 0 HG23 VAL A 42 3.149 -6.849 10.869 1.00 0.00 H new ATOM 667 N HIS A 43 3.587 -11.185 8.088 1.00 0.00 N ATOM 668 CA HIS A 43 3.007 -12.250 7.281 1.00 0.00 C ATOM 669 C HIS A 43 2.871 -13.534 8.090 1.00 0.00 C ATOM 670 O HIS A 43 3.859 -14.117 8.537 1.00 0.00 O ATOM 671 CB HIS A 43 3.825 -12.453 5.992 1.00 0.00 C ATOM 672 CG HIS A 43 3.708 -13.816 5.367 1.00 0.00 C ATOM 673 ND1 HIS A 43 4.803 -14.591 5.064 1.00 0.00 N ATOM 674 CD2 HIS A 43 2.627 -14.533 4.978 1.00 0.00 C ATOM 675 CE1 HIS A 43 4.402 -15.722 4.522 1.00 0.00 C ATOM 676 NE2 HIS A 43 3.086 -15.715 4.458 1.00 0.00 N ATOM 0 H HIS A 43 4.597 -11.249 8.217 1.00 0.00 H new ATOM 0 HA HIS A 43 2.000 -11.958 6.984 1.00 0.00 H new ATOM 0 HB2 HIS A 43 3.512 -11.708 5.261 1.00 0.00 H new ATOM 0 HB3 HIS A 43 4.875 -12.261 6.213 1.00 0.00 H new ATOM 0 HD2 HIS A 43 1.594 -14.229 5.062 1.00 0.00 H new ATOM 0 HE1 HIS A 43 5.045 -16.522 4.186 1.00 0.00 H new ATOM 0 HE2 HIS A 43 2.505 -16.465 4.083 1.00 0.00 H new ATOM 685 N GLU A 44 1.628 -13.951 8.274 1.00 0.00 N ATOM 686 CA GLU A 44 1.305 -15.137 9.038 1.00 0.00 C ATOM 687 C GLU A 44 0.565 -16.161 8.165 1.00 0.00 C ATOM 688 O GLU A 44 -0.628 -16.006 7.873 1.00 0.00 O ATOM 689 CB GLU A 44 0.455 -14.719 10.232 1.00 0.00 C ATOM 690 CG GLU A 44 -0.074 -15.866 11.062 1.00 0.00 C ATOM 691 CD GLU A 44 -0.958 -15.387 12.193 1.00 0.00 C ATOM 692 OE1 GLU A 44 -0.432 -14.794 13.157 1.00 0.00 O ATOM 693 OE2 GLU A 44 -2.188 -15.581 12.110 1.00 0.00 O ATOM 0 H GLU A 44 0.813 -13.470 7.893 1.00 0.00 H new ATOM 0 HA GLU A 44 2.220 -15.615 9.389 1.00 0.00 H new ATOM 0 HB2 GLU A 44 1.049 -14.068 10.873 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -0.388 -14.129 9.872 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -0.639 -16.545 10.423 1.00 0.00 H new ATOM 0 HG3 GLU A 44 0.762 -16.434 11.471 1.00 0.00 H new ATOM 700 N GLY A 45 1.281 -17.203 7.750 1.00 0.00 N ATOM 701 CA GLY A 45 0.696 -18.242 6.918 1.00 0.00 C ATOM 702 C GLY A 45 0.404 -17.749 5.513 1.00 0.00 C ATOM 703 O GLY A 45 1.306 -17.619 4.689 1.00 0.00 O ATOM 0 H GLY A 45 2.265 -17.347 7.978 1.00 0.00 H new ATOM 0 HA2 GLY A 45 1.375 -19.093 6.870 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -0.227 -18.597 7.377 1.00 0.00 H new ATOM 707 N LYS A 46 -0.863 -17.498 5.241 1.00 0.00 N ATOM 708 CA LYS A 46 -1.283 -16.861 4.000 1.00 0.00 C ATOM 709 C LYS A 46 -1.475 -15.386 4.218 1.00 0.00 C ATOM 710 O LYS A 46 -1.065 -14.551 3.417 1.00 0.00 O ATOM 711 CB LYS A 46 -2.595 -17.428 3.524 1.00 0.00 C ATOM 712 CG LYS A 46 -2.454 -18.539 2.509 1.00 0.00 C ATOM 713 CD LYS A 46 -2.064 -19.853 3.168 1.00 0.00 C ATOM 714 CE LYS A 46 -2.229 -21.029 2.221 1.00 0.00 C ATOM 715 NZ LYS A 46 -3.620 -21.131 1.702 1.00 0.00 N ATOM 0 H LYS A 46 -1.631 -17.728 5.871 1.00 0.00 H new ATOM 0 HA LYS A 46 -0.507 -17.044 3.256 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -3.150 -17.804 4.384 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -3.189 -16.625 3.088 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -3.395 -18.665 1.974 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -1.701 -18.264 1.770 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -1.028 -19.798 3.503 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -2.678 -20.011 4.055 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -1.537 -20.923 1.386 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -1.966 -21.952 2.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -3.800 -22.104 1.381 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -4.291 -20.886 2.458 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -3.742 -20.475 0.904 1.00 0.00 H new ATOM 729 N LYS A 47 -2.098 -15.081 5.328 1.00 0.00 N ATOM 730 CA LYS A 47 -2.501 -13.729 5.622 1.00 0.00 C ATOM 731 C LYS A 47 -1.310 -12.875 5.986 1.00 0.00 C ATOM 732 O LYS A 47 -0.438 -13.277 6.751 1.00 0.00 O ATOM 733 CB LYS A 47 -3.493 -13.706 6.772 1.00 0.00 C ATOM 734 CG LYS A 47 -4.333 -14.954 6.864 1.00 0.00 C ATOM 735 CD LYS A 47 -5.478 -14.750 7.821 1.00 0.00 C ATOM 736 CE LYS A 47 -6.092 -16.065 8.248 1.00 0.00 C ATOM 737 NZ LYS A 47 -7.209 -15.856 9.202 1.00 0.00 N ATOM 0 H LYS A 47 -2.339 -15.759 6.051 1.00 0.00 H new ATOM 0 HA LYS A 47 -2.970 -13.325 4.725 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -2.950 -13.573 7.708 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -4.149 -12.843 6.659 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -4.718 -15.214 5.878 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -3.718 -15.790 7.197 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -5.126 -14.211 8.700 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -6.240 -14.129 7.350 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -6.456 -16.600 7.371 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -5.329 -16.692 8.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -7.609 -16.776 9.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -6.855 -15.367 10.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -7.947 -15.278 8.751 1.00 0.00 H new ATOM 751 N VAL A 48 -1.281 -11.698 5.415 1.00 0.00 N ATOM 752 CA VAL A 48 -0.224 -10.759 5.665 1.00 0.00 C ATOM 753 C VAL A 48 -0.824 -9.468 6.206 1.00 0.00 C ATOM 754 O VAL A 48 -1.808 -8.960 5.671 1.00 0.00 O ATOM 755 CB VAL A 48 0.591 -10.476 4.388 1.00 0.00 C ATOM 756 CG1 VAL A 48 1.732 -9.514 4.674 1.00 0.00 C ATOM 757 CG2 VAL A 48 1.121 -11.766 3.784 1.00 0.00 C ATOM 0 H VAL A 48 -1.992 -11.366 4.763 1.00 0.00 H new ATOM 0 HA VAL A 48 0.458 -11.187 6.400 1.00 0.00 H new ATOM 0 HB VAL A 48 -0.076 -10.009 3.664 1.00 0.00 H new ATOM 0 HG11 VAL A 48 2.292 -9.331 3.757 1.00 0.00 H new ATOM 0 HG12 VAL A 48 1.329 -8.573 5.048 1.00 0.00 H new ATOM 0 HG13 VAL A 48 2.395 -9.948 5.423 1.00 0.00 H new ATOM 0 HG21 VAL A 48 1.692 -11.539 2.884 1.00 0.00 H new ATOM 0 HG22 VAL A 48 1.765 -12.268 4.506 1.00 0.00 H new ATOM 0 HG23 VAL A 48 0.286 -12.418 3.528 1.00 0.00 H new ATOM 767 N LYS A 49 -0.246 -8.966 7.278 1.00 0.00 N ATOM 768 CA LYS A 49 -0.728 -7.753 7.920 1.00 0.00 C ATOM 769 C LYS A 49 -0.067 -6.532 7.304 1.00 0.00 C ATOM 770 O LYS A 49 1.158 -6.482 7.180 1.00 0.00 O ATOM 771 CB LYS A 49 -0.409 -7.780 9.403 1.00 0.00 C ATOM 772 CG LYS A 49 -0.878 -9.030 10.128 1.00 0.00 C ATOM 773 CD LYS A 49 -0.260 -9.112 11.514 1.00 0.00 C ATOM 774 CE LYS A 49 -0.672 -10.374 12.250 1.00 0.00 C ATOM 775 NZ LYS A 49 -2.106 -10.363 12.647 1.00 0.00 N ATOM 0 H LYS A 49 0.568 -9.383 7.730 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.807 -7.700 7.776 1.00 0.00 H new ATOM 0 HB2 LYS A 49 0.669 -7.685 9.531 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -0.864 -6.910 9.875 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -1.965 -9.023 10.209 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -0.607 -9.914 9.551 1.00 0.00 H new ATOM 0 HD2 LYS A 49 0.826 -9.081 11.428 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -0.559 -8.240 12.096 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -0.481 -11.239 11.615 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -0.053 -10.489 13.140 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -2.314 -11.207 13.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -2.305 -9.509 13.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -2.702 -10.366 11.795 1.00 0.00 H new ATOM 789 N LEU A 50 -0.874 -5.562 6.911 1.00 0.00 N ATOM 790 CA LEU A 50 -0.366 -4.320 6.352 1.00 0.00 C ATOM 791 C LEU A 50 -0.870 -3.131 7.149 1.00 0.00 C ATOM 792 O LEU A 50 -2.069 -2.860 7.206 1.00 0.00 O ATOM 793 CB LEU A 50 -0.776 -4.159 4.885 1.00 0.00 C ATOM 794 CG LEU A 50 0.326 -4.409 3.852 1.00 0.00 C ATOM 795 CD1 LEU A 50 0.893 -5.808 3.992 1.00 0.00 C ATOM 796 CD2 LEU A 50 -0.198 -4.177 2.444 1.00 0.00 C ATOM 0 H LEU A 50 -1.891 -5.611 6.969 1.00 0.00 H new ATOM 0 HA LEU A 50 0.722 -4.359 6.407 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -1.600 -4.842 4.681 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -1.158 -3.148 4.743 1.00 0.00 H new ATOM 0 HG LEU A 50 1.133 -3.700 4.038 1.00 0.00 H new ATOM 0 HD11 LEU A 50 1.674 -5.960 3.247 1.00 0.00 H new ATOM 0 HD12 LEU A 50 1.314 -5.932 4.990 1.00 0.00 H new ATOM 0 HD13 LEU A 50 0.099 -6.539 3.840 1.00 0.00 H new ATOM 0 HD21 LEU A 50 0.600 -4.360 1.724 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -1.027 -4.857 2.248 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -0.543 -3.148 2.349 1.00 0.00 H new ATOM 808 N THR A 51 0.047 -2.444 7.788 1.00 0.00 N ATOM 809 CA THR A 51 -0.262 -1.197 8.445 1.00 0.00 C ATOM 810 C THR A 51 0.453 -0.075 7.715 1.00 0.00 C ATOM 811 O THR A 51 1.671 -0.054 7.680 1.00 0.00 O ATOM 812 CB THR A 51 0.186 -1.218 9.912 1.00 0.00 C ATOM 813 OG1 THR A 51 -0.229 -2.441 10.535 1.00 0.00 O ATOM 814 CG2 THR A 51 -0.407 -0.039 10.652 1.00 0.00 C ATOM 0 H THR A 51 1.022 -2.732 7.867 1.00 0.00 H new ATOM 0 HA THR A 51 -1.341 -1.044 8.423 1.00 0.00 H new ATOM 0 HB THR A 51 1.273 -1.151 9.949 1.00 0.00 H new ATOM 0 HG1 THR A 51 0.062 -2.447 11.471 1.00 0.00 H new ATOM 0 HG21 THR A 51 -0.083 -0.062 11.693 1.00 0.00 H new ATOM 0 HG22 THR A 51 -0.071 0.888 10.188 1.00 0.00 H new ATOM 0 HG23 THR A 51 -1.495 -0.092 10.609 1.00 0.00 H new ATOM 822 N ILE A 52 -0.288 0.843 7.120 1.00 0.00 N ATOM 823 CA ILE A 52 0.327 1.860 6.278 1.00 0.00 C ATOM 824 C ILE A 52 -0.123 3.255 6.689 1.00 0.00 C ATOM 825 O ILE A 52 -1.320 3.527 6.792 1.00 0.00 O ATOM 826 CB ILE A 52 0.011 1.661 4.772 1.00 0.00 C ATOM 827 CG1 ILE A 52 0.137 0.190 4.354 1.00 0.00 C ATOM 828 CG2 ILE A 52 0.937 2.519 3.925 1.00 0.00 C ATOM 829 CD1 ILE A 52 -1.142 -0.596 4.528 1.00 0.00 C ATOM 0 H ILE A 52 -1.303 0.908 7.201 1.00 0.00 H new ATOM 0 HA ILE A 52 1.402 1.755 6.421 1.00 0.00 H new ATOM 0 HB ILE A 52 -1.022 1.968 4.609 1.00 0.00 H new ATOM 0 HG12 ILE A 52 0.445 0.142 3.309 1.00 0.00 H new ATOM 0 HG13 ILE A 52 0.926 -0.280 4.941 1.00 0.00 H new ATOM 0 HG21 ILE A 52 0.706 2.371 2.870 1.00 0.00 H new ATOM 0 HG22 ILE A 52 0.798 3.569 4.183 1.00 0.00 H new ATOM 0 HG23 ILE A 52 1.972 2.233 4.114 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -0.981 -1.627 4.214 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -1.440 -0.579 5.576 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -1.929 -0.150 3.920 1.00 0.00 H new ATOM 841 N THR A 53 0.841 4.131 6.927 1.00 0.00 N ATOM 842 CA THR A 53 0.550 5.514 7.258 1.00 0.00 C ATOM 843 C THR A 53 0.631 6.384 6.012 1.00 0.00 C ATOM 844 O THR A 53 1.641 6.375 5.311 1.00 0.00 O ATOM 845 CB THR A 53 1.542 6.068 8.298 1.00 0.00 C ATOM 846 OG1 THR A 53 1.722 5.127 9.366 1.00 0.00 O ATOM 847 CG2 THR A 53 1.047 7.392 8.866 1.00 0.00 C ATOM 0 H THR A 53 1.835 3.906 6.896 1.00 0.00 H new ATOM 0 HA THR A 53 -0.457 5.538 7.675 1.00 0.00 H new ATOM 0 HB THR A 53 2.496 6.234 7.798 1.00 0.00 H new ATOM 0 HG1 THR A 53 2.327 4.413 9.074 1.00 0.00 H new ATOM 0 HG21 THR A 53 1.763 7.764 9.598 1.00 0.00 H new ATOM 0 HG22 THR A 53 0.942 8.118 8.059 1.00 0.00 H new ATOM 0 HG23 THR A 53 0.081 7.243 9.347 1.00 0.00 H new ATOM 855 N TYR A 54 -0.433 7.110 5.729 1.00 0.00 N ATOM 856 CA TYR A 54 -0.414 8.099 4.672 1.00 0.00 C ATOM 857 C TYR A 54 -0.482 9.479 5.292 1.00 0.00 C ATOM 858 O TYR A 54 -1.565 9.965 5.619 1.00 0.00 O ATOM 859 CB TYR A 54 -1.608 7.901 3.736 1.00 0.00 C ATOM 860 CG TYR A 54 -1.685 6.526 3.121 1.00 0.00 C ATOM 861 CD1 TYR A 54 -1.003 6.238 1.952 1.00 0.00 C ATOM 862 CD2 TYR A 54 -2.449 5.518 3.701 1.00 0.00 C ATOM 863 CE1 TYR A 54 -1.076 4.990 1.374 1.00 0.00 C ATOM 864 CE2 TYR A 54 -2.524 4.262 3.129 1.00 0.00 C ATOM 865 CZ TYR A 54 -1.836 4.003 1.964 1.00 0.00 C ATOM 866 OH TYR A 54 -1.910 2.753 1.384 1.00 0.00 O ATOM 0 H TYR A 54 -1.324 7.032 6.219 1.00 0.00 H new ATOM 0 HA TYR A 54 0.504 7.991 4.094 1.00 0.00 H new ATOM 0 HB2 TYR A 54 -2.527 8.091 4.291 1.00 0.00 H new ATOM 0 HB3 TYR A 54 -1.558 8.642 2.938 1.00 0.00 H new ATOM 0 HD1 TYR A 54 -0.403 7.005 1.485 1.00 0.00 H new ATOM 0 HD2 TYR A 54 -2.992 5.720 4.612 1.00 0.00 H new ATOM 0 HE1 TYR A 54 -0.539 4.785 0.460 1.00 0.00 H new ATOM 0 HE2 TYR A 54 -3.118 3.488 3.593 1.00 0.00 H new ATOM 0 HH TYR A 54 -2.486 2.174 1.926 1.00 0.00 H new ATOM 876 N GLY A 55 0.675 10.107 5.440 1.00 0.00 N ATOM 877 CA GLY A 55 0.732 11.430 6.029 1.00 0.00 C ATOM 878 C GLY A 55 0.230 11.445 7.467 1.00 0.00 C ATOM 879 O GLY A 55 0.986 11.165 8.400 1.00 0.00 O ATOM 0 H GLY A 55 1.578 9.723 5.162 1.00 0.00 H new ATOM 0 HA2 GLY A 55 1.759 11.794 6.001 1.00 0.00 H new ATOM 0 HA3 GLY A 55 0.134 12.118 5.431 1.00 0.00 H new ATOM 883 N SER A 56 -1.048 11.757 7.642 1.00 0.00 N ATOM 884 CA SER A 56 -1.649 11.824 8.965 1.00 0.00 C ATOM 885 C SER A 56 -2.408 10.540 9.313 1.00 0.00 C ATOM 886 O SER A 56 -2.376 10.084 10.458 1.00 0.00 O ATOM 887 CB SER A 56 -2.596 13.027 9.043 1.00 0.00 C ATOM 888 OG SER A 56 -3.537 13.006 7.979 1.00 0.00 O ATOM 0 H SER A 56 -1.690 11.969 6.878 1.00 0.00 H new ATOM 0 HA SER A 56 -0.844 11.939 9.691 1.00 0.00 H new ATOM 0 HB2 SER A 56 -3.122 13.019 9.998 1.00 0.00 H new ATOM 0 HB3 SER A 56 -2.019 13.951 9.005 1.00 0.00 H new ATOM 0 HG SER A 56 -4.131 13.782 8.052 1.00 0.00 H new ATOM 894 N LYS A 57 -3.066 9.946 8.326 1.00 0.00 N ATOM 895 CA LYS A 57 -3.953 8.832 8.568 1.00 0.00 C ATOM 896 C LYS A 57 -3.209 7.509 8.436 1.00 0.00 C ATOM 897 O LYS A 57 -2.300 7.375 7.620 1.00 0.00 O ATOM 898 CB LYS A 57 -5.087 8.885 7.559 1.00 0.00 C ATOM 899 CG LYS A 57 -6.471 8.735 8.145 1.00 0.00 C ATOM 900 CD LYS A 57 -6.647 7.418 8.873 1.00 0.00 C ATOM 901 CE LYS A 57 -8.111 7.129 9.090 1.00 0.00 C ATOM 902 NZ LYS A 57 -8.332 5.870 9.851 1.00 0.00 N ATOM 0 H LYS A 57 -2.997 10.224 7.347 1.00 0.00 H new ATOM 0 HA LYS A 57 -4.346 8.901 9.582 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -5.035 9.835 7.027 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -4.934 8.097 6.821 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -6.662 9.557 8.835 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -7.211 8.809 7.348 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -6.192 6.613 8.296 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -6.131 7.454 9.832 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -8.567 7.960 9.627 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -8.612 7.060 8.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -9.353 5.714 9.975 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -7.921 5.071 9.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -7.877 5.944 10.783 1.00 0.00 H new ATOM 916 N VAL A 58 -3.604 6.536 9.238 1.00 0.00 N ATOM 917 CA VAL A 58 -3.003 5.212 9.202 1.00 0.00 C ATOM 918 C VAL A 58 -4.065 4.153 8.925 1.00 0.00 C ATOM 919 O VAL A 58 -5.087 4.097 9.610 1.00 0.00 O ATOM 920 CB VAL A 58 -2.300 4.869 10.531 1.00 0.00 C ATOM 921 CG1 VAL A 58 -1.386 3.668 10.362 1.00 0.00 C ATOM 922 CG2 VAL A 58 -1.545 6.073 11.071 1.00 0.00 C ATOM 0 H VAL A 58 -4.347 6.639 9.930 1.00 0.00 H new ATOM 0 HA VAL A 58 -2.262 5.219 8.403 1.00 0.00 H new ATOM 0 HB VAL A 58 -3.062 4.604 11.264 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -0.900 3.444 11.312 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -1.972 2.807 10.042 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -0.628 3.890 9.611 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -1.058 5.806 12.009 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -0.792 6.385 10.347 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -2.243 6.892 11.245 1.00 0.00 H new ATOM 932 N ILE A 59 -3.833 3.331 7.914 1.00 0.00 N ATOM 933 CA ILE A 59 -4.738 2.236 7.598 1.00 0.00 C ATOM 934 C ILE A 59 -4.118 0.906 8.001 1.00 0.00 C ATOM 935 O ILE A 59 -2.994 0.589 7.609 1.00 0.00 O ATOM 936 CB ILE A 59 -5.095 2.193 6.094 1.00 0.00 C ATOM 937 CG1 ILE A 59 -5.724 3.513 5.665 1.00 0.00 C ATOM 938 CG2 ILE A 59 -6.054 1.061 5.808 1.00 0.00 C ATOM 939 CD1 ILE A 59 -6.080 3.577 4.193 1.00 0.00 C ATOM 0 H ILE A 59 -3.024 3.401 7.297 1.00 0.00 H new ATOM 0 HA ILE A 59 -5.655 2.408 8.162 1.00 0.00 H new ATOM 0 HB ILE A 59 -4.177 2.030 5.530 1.00 0.00 H new ATOM 0 HG12 ILE A 59 -6.625 3.682 6.254 1.00 0.00 H new ATOM 0 HG13 ILE A 59 -5.034 4.325 5.897 1.00 0.00 H new ATOM 0 HG21 ILE A 59 -6.293 1.047 4.745 1.00 0.00 H new ATOM 0 HG22 ILE A 59 -5.593 0.114 6.089 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -6.968 1.204 6.384 1.00 0.00 H new ATOM 0 HD11 ILE A 59 -6.522 4.547 3.967 1.00 0.00 H new ATOM 0 HD12 ILE A 59 -5.179 3.441 3.595 1.00 0.00 H new ATOM 0 HD13 ILE A 59 -6.795 2.789 3.957 1.00 0.00 H new ATOM 951 N HIS A 60 -4.852 0.141 8.790 1.00 0.00 N ATOM 952 CA HIS A 60 -4.405 -1.172 9.222 1.00 0.00 C ATOM 953 C HIS A 60 -5.315 -2.236 8.626 1.00 0.00 C ATOM 954 O HIS A 60 -6.512 -2.267 8.909 1.00 0.00 O ATOM 955 CB HIS A 60 -4.423 -1.246 10.759 1.00 0.00 C ATOM 956 CG HIS A 60 -4.092 -2.595 11.329 1.00 0.00 C ATOM 957 ND1 HIS A 60 -4.990 -3.344 12.057 1.00 0.00 N ATOM 958 CD2 HIS A 60 -2.951 -3.320 11.291 1.00 0.00 C ATOM 959 CE1 HIS A 60 -4.413 -4.468 12.442 1.00 0.00 C ATOM 960 NE2 HIS A 60 -3.175 -4.479 11.990 1.00 0.00 N ATOM 0 H HIS A 60 -5.769 0.410 9.147 1.00 0.00 H new ATOM 0 HA HIS A 60 -3.385 -1.346 8.878 1.00 0.00 H new ATOM 0 HB2 HIS A 60 -3.714 -0.517 11.152 1.00 0.00 H new ATOM 0 HB3 HIS A 60 -5.411 -0.951 11.111 1.00 0.00 H new ATOM 0 HD2 HIS A 60 -2.031 -3.038 10.800 1.00 0.00 H new ATOM 0 HE1 HIS A 60 -4.877 -5.247 13.028 1.00 0.00 H new ATOM 0 HE2 HIS A 60 -2.496 -5.226 12.136 1.00 0.00 H new ATOM 969 N ASN A 61 -4.749 -3.115 7.815 1.00 0.00 N ATOM 970 CA ASN A 61 -5.531 -4.137 7.143 1.00 0.00 C ATOM 971 C ASN A 61 -4.734 -5.423 7.041 1.00 0.00 C ATOM 972 O ASN A 61 -3.519 -5.401 6.868 1.00 0.00 O ATOM 973 CB ASN A 61 -5.966 -3.668 5.745 1.00 0.00 C ATOM 974 CG ASN A 61 -4.798 -3.408 4.806 1.00 0.00 C ATOM 975 OD1 ASN A 61 -4.353 -4.297 4.085 1.00 0.00 O ATOM 976 ND2 ASN A 61 -4.302 -2.178 4.802 1.00 0.00 N ATOM 0 H ASN A 61 -3.751 -3.140 7.607 1.00 0.00 H new ATOM 0 HA ASN A 61 -6.429 -4.322 7.733 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -6.617 -4.422 5.303 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -6.555 -2.756 5.842 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -3.524 -1.944 4.185 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -4.699 -1.466 5.416 1.00 0.00 H new ATOM 983 N GLU A 62 -5.415 -6.535 7.203 1.00 0.00 N ATOM 984 CA GLU A 62 -4.806 -7.834 7.041 1.00 0.00 C ATOM 985 C GLU A 62 -5.569 -8.614 5.986 1.00 0.00 C ATOM 986 O GLU A 62 -6.795 -8.522 5.902 1.00 0.00 O ATOM 987 CB GLU A 62 -4.802 -8.579 8.367 1.00 0.00 C ATOM 988 CG GLU A 62 -4.035 -7.861 9.463 1.00 0.00 C ATOM 989 CD GLU A 62 -4.310 -8.433 10.836 1.00 0.00 C ATOM 990 OE1 GLU A 62 -4.048 -9.635 11.045 1.00 0.00 O ATOM 991 OE2 GLU A 62 -4.770 -7.679 11.719 1.00 0.00 O ATOM 0 H GLU A 62 -6.404 -6.564 7.450 1.00 0.00 H new ATOM 0 HA GLU A 62 -3.772 -7.717 6.717 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -5.831 -8.729 8.693 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -4.367 -9.567 8.218 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -2.967 -7.924 9.255 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -4.300 -6.804 9.454 1.00 0.00 H new ATOM 998 N PHE A 63 -4.851 -9.377 5.185 1.00 0.00 N ATOM 999 CA PHE A 63 -5.450 -10.064 4.059 1.00 0.00 C ATOM 1000 C PHE A 63 -4.863 -11.453 3.917 1.00 0.00 C ATOM 1001 O PHE A 63 -3.723 -11.676 4.288 1.00 0.00 O ATOM 1002 CB PHE A 63 -5.222 -9.258 2.784 1.00 0.00 C ATOM 1003 CG PHE A 63 -3.787 -8.850 2.576 1.00 0.00 C ATOM 1004 CD1 PHE A 63 -2.856 -9.729 2.041 1.00 0.00 C ATOM 1005 CD2 PHE A 63 -3.374 -7.586 2.931 1.00 0.00 C ATOM 1006 CE1 PHE A 63 -1.544 -9.348 1.862 1.00 0.00 C ATOM 1007 CE2 PHE A 63 -2.059 -7.194 2.758 1.00 0.00 C ATOM 1008 CZ PHE A 63 -1.144 -8.078 2.221 1.00 0.00 C ATOM 0 H PHE A 63 -3.849 -9.537 5.294 1.00 0.00 H new ATOM 0 HA PHE A 63 -6.522 -10.160 4.231 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -5.551 -9.847 1.928 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -5.844 -8.364 2.813 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -3.164 -10.726 1.761 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -4.086 -6.891 3.350 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -0.831 -10.042 1.442 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -1.749 -6.199 3.042 1.00 0.00 H new ATOM 0 HZ PHE A 63 -0.117 -7.775 2.082 1.00 0.00 H new ATOM 1018 N THR A 64 -5.630 -12.365 3.353 1.00 0.00 N ATOM 1019 CA THR A 64 -5.227 -13.757 3.259 1.00 0.00 C ATOM 1020 C THR A 64 -4.822 -14.100 1.823 1.00 0.00 C ATOM 1021 O THR A 64 -5.536 -13.779 0.875 1.00 0.00 O ATOM 1022 CB THR A 64 -6.381 -14.663 3.681 1.00 0.00 C ATOM 1023 OG1 THR A 64 -6.986 -14.157 4.878 1.00 0.00 O ATOM 1024 CG2 THR A 64 -5.908 -16.083 3.907 1.00 0.00 C ATOM 0 H THR A 64 -6.545 -12.165 2.949 1.00 0.00 H new ATOM 0 HA THR A 64 -4.375 -13.913 3.920 1.00 0.00 H new ATOM 0 HB THR A 64 -7.116 -14.672 2.876 1.00 0.00 H new ATOM 0 HG1 THR A 64 -7.727 -14.742 5.143 1.00 0.00 H new ATOM 0 HG21 THR A 64 -6.752 -16.704 4.206 1.00 0.00 H new ATOM 0 HG22 THR A 64 -5.478 -16.474 2.985 1.00 0.00 H new ATOM 0 HG23 THR A 64 -5.153 -16.094 4.693 1.00 0.00 H new ATOM 1032 N LEU A 65 -3.678 -14.748 1.682 1.00 0.00 N ATOM 1033 CA LEU A 65 -3.126 -15.112 0.384 1.00 0.00 C ATOM 1034 C LEU A 65 -3.981 -16.133 -0.353 1.00 0.00 C ATOM 1035 O LEU A 65 -4.308 -17.188 0.186 1.00 0.00 O ATOM 1036 CB LEU A 65 -1.738 -15.677 0.596 1.00 0.00 C ATOM 1037 CG LEU A 65 -0.591 -14.696 0.392 1.00 0.00 C ATOM 1038 CD1 LEU A 65 0.146 -15.077 -0.864 1.00 0.00 C ATOM 1039 CD2 LEU A 65 -1.106 -13.271 0.279 1.00 0.00 C ATOM 0 H LEU A 65 -3.100 -15.039 2.470 1.00 0.00 H new ATOM 0 HA LEU A 65 -3.099 -14.215 -0.234 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -1.677 -16.074 1.609 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -1.599 -16.517 -0.084 1.00 0.00 H new ATOM 0 HG LEU A 65 0.077 -14.741 1.252 1.00 0.00 H new ATOM 0 HD11 LEU A 65 0.972 -14.384 -1.026 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.536 -16.090 -0.764 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -0.536 -15.033 -1.713 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -0.266 -12.591 0.134 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -1.785 -13.196 -0.570 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -1.637 -13.002 1.192 1.00 0.00 H new ATOM 1051 N GLY A 66 -4.341 -15.799 -1.590 1.00 0.00 N ATOM 1052 CA GLY A 66 -5.110 -16.701 -2.427 1.00 0.00 C ATOM 1053 C GLY A 66 -6.512 -16.847 -1.920 1.00 0.00 C ATOM 1054 O GLY A 66 -7.255 -17.738 -2.333 1.00 0.00 O ATOM 0 H GLY A 66 -4.110 -14.908 -2.030 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -5.128 -16.326 -3.450 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -4.627 -17.678 -2.454 1.00 0.00 H new ATOM 1058 N GLU A 67 -6.866 -15.961 -1.023 1.00 0.00 N ATOM 1059 CA GLU A 67 -8.104 -16.063 -0.317 1.00 0.00 C ATOM 1060 C GLU A 67 -8.812 -14.718 -0.348 1.00 0.00 C ATOM 1061 O GLU A 67 -8.163 -13.670 -0.289 1.00 0.00 O ATOM 1062 CB GLU A 67 -7.810 -16.520 1.115 1.00 0.00 C ATOM 1063 CG GLU A 67 -9.037 -16.782 1.964 1.00 0.00 C ATOM 1064 CD GLU A 67 -9.974 -17.786 1.332 1.00 0.00 C ATOM 1065 OE1 GLU A 67 -9.680 -19.000 1.401 1.00 0.00 O ATOM 1066 OE2 GLU A 67 -11.002 -17.371 0.762 1.00 0.00 O ATOM 0 H GLU A 67 -6.300 -15.152 -0.767 1.00 0.00 H new ATOM 0 HA GLU A 67 -8.763 -16.794 -0.785 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -7.212 -17.431 1.075 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -7.201 -15.760 1.606 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -8.726 -17.146 2.943 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -9.569 -15.845 2.126 1.00 0.00 H new ATOM 1073 N GLU A 68 -10.128 -14.732 -0.469 1.00 0.00 N ATOM 1074 CA GLU A 68 -10.882 -13.494 -0.509 1.00 0.00 C ATOM 1075 C GLU A 68 -10.891 -12.851 0.875 1.00 0.00 C ATOM 1076 O GLU A 68 -11.329 -13.459 1.853 1.00 0.00 O ATOM 1077 CB GLU A 68 -12.303 -13.727 -1.000 1.00 0.00 C ATOM 1078 CG GLU A 68 -13.023 -12.435 -1.310 1.00 0.00 C ATOM 1079 CD GLU A 68 -14.400 -12.640 -1.905 1.00 0.00 C ATOM 1080 OE1 GLU A 68 -15.315 -13.072 -1.178 1.00 0.00 O ATOM 1081 OE2 GLU A 68 -14.575 -12.362 -3.112 1.00 0.00 O ATOM 0 H GLU A 68 -10.691 -15.579 -0.541 1.00 0.00 H new ATOM 0 HA GLU A 68 -10.398 -12.819 -1.214 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -12.278 -14.350 -1.894 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -12.861 -14.278 -0.243 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -13.115 -11.850 -0.395 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -12.420 -11.849 -2.003 1.00 0.00 H new ATOM 1088 N CYS A 69 -10.377 -11.638 0.948 1.00 0.00 N ATOM 1089 CA CYS A 69 -10.282 -10.896 2.189 1.00 0.00 C ATOM 1090 C CYS A 69 -10.739 -9.486 1.988 1.00 0.00 C ATOM 1091 O CYS A 69 -10.534 -8.883 0.946 1.00 0.00 O ATOM 1092 CB CYS A 69 -8.850 -10.895 2.698 1.00 0.00 C ATOM 1093 SG CYS A 69 -7.629 -11.186 1.399 1.00 0.00 S ATOM 0 H CYS A 69 -10.010 -11.136 0.139 1.00 0.00 H new ATOM 0 HA CYS A 69 -10.923 -11.380 2.925 1.00 0.00 H new ATOM 0 HB2 CYS A 69 -8.642 -9.937 3.174 1.00 0.00 H new ATOM 0 HB3 CYS A 69 -8.744 -11.662 3.465 1.00 0.00 H new ATOM 0 HG CYS A 69 -7.955 -12.251 0.728 1.00 0.00 H new ATOM 1099 N GLU A 70 -11.338 -8.961 3.007 1.00 0.00 N ATOM 1100 CA GLU A 70 -11.995 -7.707 2.915 1.00 0.00 C ATOM 1101 C GLU A 70 -11.054 -6.585 3.313 1.00 0.00 C ATOM 1102 O GLU A 70 -10.465 -6.601 4.395 1.00 0.00 O ATOM 1103 CB GLU A 70 -13.217 -7.739 3.798 1.00 0.00 C ATOM 1104 CG GLU A 70 -14.176 -8.866 3.466 1.00 0.00 C ATOM 1105 CD GLU A 70 -13.668 -10.254 3.821 1.00 0.00 C ATOM 1106 OE1 GLU A 70 -12.922 -10.385 4.818 1.00 0.00 O ATOM 1107 OE2 GLU A 70 -14.038 -11.223 3.131 1.00 0.00 O ATOM 0 H GLU A 70 -11.383 -9.395 3.929 1.00 0.00 H new ATOM 0 HA GLU A 70 -12.303 -7.520 1.886 1.00 0.00 H new ATOM 0 HB2 GLU A 70 -12.902 -7.835 4.837 1.00 0.00 H new ATOM 0 HB3 GLU A 70 -13.743 -6.788 3.711 1.00 0.00 H new ATOM 0 HG2 GLU A 70 -15.116 -8.692 3.990 1.00 0.00 H new ATOM 0 HG3 GLU A 70 -14.396 -8.836 2.399 1.00 0.00 H new ATOM 1114 N LEU A 71 -10.927 -5.615 2.435 1.00 0.00 N ATOM 1115 CA LEU A 71 -9.995 -4.528 2.618 1.00 0.00 C ATOM 1116 C LEU A 71 -10.709 -3.346 3.240 1.00 0.00 C ATOM 1117 O LEU A 71 -11.729 -2.893 2.731 1.00 0.00 O ATOM 1118 CB LEU A 71 -9.423 -4.126 1.267 1.00 0.00 C ATOM 1119 CG LEU A 71 -7.909 -3.895 1.216 1.00 0.00 C ATOM 1120 CD1 LEU A 71 -7.515 -2.733 2.105 1.00 0.00 C ATOM 1121 CD2 LEU A 71 -7.160 -5.155 1.621 1.00 0.00 C ATOM 0 H LEU A 71 -11.469 -5.559 1.573 1.00 0.00 H new ATOM 0 HA LEU A 71 -9.187 -4.846 3.277 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -9.676 -4.901 0.543 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -9.920 -3.212 0.942 1.00 0.00 H new ATOM 0 HG LEU A 71 -7.636 -3.649 0.190 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.436 -2.586 2.055 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -8.021 -1.829 1.767 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -7.804 -2.948 3.134 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -6.087 -4.970 1.578 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -7.440 -5.434 2.637 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -7.416 -5.966 0.939 1.00 0.00 H new ATOM 1133 N GLU A 72 -10.160 -2.852 4.327 1.00 0.00 N ATOM 1134 CA GLU A 72 -10.778 -1.774 5.078 1.00 0.00 C ATOM 1135 C GLU A 72 -10.066 -0.467 4.769 1.00 0.00 C ATOM 1136 O GLU A 72 -8.862 -0.343 4.986 1.00 0.00 O ATOM 1137 CB GLU A 72 -10.707 -2.069 6.576 1.00 0.00 C ATOM 1138 CG GLU A 72 -11.548 -1.132 7.430 1.00 0.00 C ATOM 1139 CD GLU A 72 -11.560 -1.546 8.884 1.00 0.00 C ATOM 1140 OE1 GLU A 72 -12.044 -2.660 9.185 1.00 0.00 O ATOM 1141 OE2 GLU A 72 -11.087 -0.764 9.733 1.00 0.00 O ATOM 0 H GLU A 72 -9.277 -3.182 4.717 1.00 0.00 H new ATOM 0 HA GLU A 72 -11.826 -1.690 4.789 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -11.033 -3.094 6.750 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -9.668 -2.006 6.900 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -11.159 -0.117 7.345 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -12.569 -1.114 7.050 1.00 0.00 H new ATOM 1148 N THR A 73 -10.800 0.484 4.236 1.00 0.00 N ATOM 1149 CA THR A 73 -10.233 1.762 3.867 1.00 0.00 C ATOM 1150 C THR A 73 -10.297 2.757 5.021 1.00 0.00 C ATOM 1151 O THR A 73 -10.917 2.496 6.054 1.00 0.00 O ATOM 1152 CB THR A 73 -10.982 2.337 2.652 1.00 0.00 C ATOM 1153 OG1 THR A 73 -12.379 2.433 2.951 1.00 0.00 O ATOM 1154 CG2 THR A 73 -10.791 1.444 1.442 1.00 0.00 C ATOM 0 H THR A 73 -11.798 0.395 4.047 1.00 0.00 H new ATOM 0 HA THR A 73 -9.185 1.600 3.614 1.00 0.00 H new ATOM 0 HB THR A 73 -10.581 3.326 2.431 1.00 0.00 H new ATOM 0 HG1 THR A 73 -12.803 1.560 2.817 1.00 0.00 H new ATOM 0 HG21 THR A 73 -11.327 1.865 0.591 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.729 1.376 1.204 1.00 0.00 H new ATOM 0 HG23 THR A 73 -11.179 0.449 1.659 1.00 0.00 H new ATOM 1162 N MET A 74 -9.661 3.910 4.821 1.00 0.00 N ATOM 1163 CA MET A 74 -9.641 4.982 5.814 1.00 0.00 C ATOM 1164 C MET A 74 -11.022 5.613 5.964 1.00 0.00 C ATOM 1165 O MET A 74 -11.223 6.510 6.785 1.00 0.00 O ATOM 1166 CB MET A 74 -8.612 6.053 5.426 1.00 0.00 C ATOM 1167 CG MET A 74 -8.856 6.673 4.058 1.00 0.00 C ATOM 1168 SD MET A 74 -7.589 7.866 3.590 1.00 0.00 S ATOM 1169 CE MET A 74 -7.893 9.171 4.779 1.00 0.00 C ATOM 0 H MET A 74 -9.146 4.127 3.968 1.00 0.00 H new ATOM 0 HA MET A 74 -9.355 4.548 6.772 1.00 0.00 H new ATOM 0 HB2 MET A 74 -8.621 6.841 6.179 1.00 0.00 H new ATOM 0 HB3 MET A 74 -7.617 5.609 5.441 1.00 0.00 H new ATOM 0 HG2 MET A 74 -8.897 5.882 3.309 1.00 0.00 H new ATOM 0 HG3 MET A 74 -9.829 7.165 4.056 1.00 0.00 H new ATOM 0 HE1 MET A 74 -8.192 10.079 4.255 1.00 0.00 H new ATOM 0 HE2 MET A 74 -8.689 8.866 5.458 1.00 0.00 H new ATOM 0 HE3 MET A 74 -6.984 9.363 5.348 1.00 0.00 H new ATOM 1179 N THR A 75 -11.968 5.147 5.162 1.00 0.00 N ATOM 1180 CA THR A 75 -13.325 5.654 5.204 1.00 0.00 C ATOM 1181 C THR A 75 -14.179 4.726 6.057 1.00 0.00 C ATOM 1182 O THR A 75 -15.252 5.093 6.531 1.00 0.00 O ATOM 1183 CB THR A 75 -13.931 5.745 3.787 1.00 0.00 C ATOM 1184 OG1 THR A 75 -14.331 4.446 3.335 1.00 0.00 O ATOM 1185 CG2 THR A 75 -12.924 6.320 2.808 1.00 0.00 C ATOM 0 H THR A 75 -11.815 4.413 4.470 1.00 0.00 H new ATOM 0 HA THR A 75 -13.306 6.655 5.634 1.00 0.00 H new ATOM 0 HB THR A 75 -14.800 6.401 3.835 1.00 0.00 H new ATOM 0 HG1 THR A 75 -13.544 3.866 3.268 1.00 0.00 H new ATOM 0 HG21 THR A 75 -13.372 6.375 1.816 1.00 0.00 H new ATOM 0 HG22 THR A 75 -12.633 7.320 3.131 1.00 0.00 H new ATOM 0 HG23 THR A 75 -12.043 5.679 2.773 1.00 0.00 H new ATOM 1193 N GLY A 76 -13.662 3.519 6.256 1.00 0.00 N ATOM 1194 CA GLY A 76 -14.368 2.503 7.000 1.00 0.00 C ATOM 1195 C GLY A 76 -15.013 1.486 6.088 1.00 0.00 C ATOM 1196 O GLY A 76 -15.473 0.438 6.539 1.00 0.00 O ATOM 0 H GLY A 76 -12.749 3.227 5.907 1.00 0.00 H new ATOM 0 HA2 GLY A 76 -13.675 1.999 7.674 1.00 0.00 H new ATOM 0 HA3 GLY A 76 -15.132 2.972 7.620 1.00 0.00 H new ATOM 1200 N GLU A 77 -15.050 1.803 4.799 1.00 0.00 N ATOM 1201 CA GLU A 77 -15.612 0.916 3.811 1.00 0.00 C ATOM 1202 C GLU A 77 -14.667 -0.224 3.513 1.00 0.00 C ATOM 1203 O GLU A 77 -13.562 -0.042 2.992 1.00 0.00 O ATOM 1204 CB GLU A 77 -15.930 1.692 2.549 1.00 0.00 C ATOM 1205 CG GLU A 77 -17.047 1.084 1.744 1.00 0.00 C ATOM 1206 CD GLU A 77 -17.440 1.941 0.563 1.00 0.00 C ATOM 1207 OE1 GLU A 77 -16.543 2.540 -0.068 1.00 0.00 O ATOM 1208 OE2 GLU A 77 -18.647 2.019 0.255 1.00 0.00 O ATOM 0 H GLU A 77 -14.691 2.679 4.420 1.00 0.00 H new ATOM 0 HA GLU A 77 -16.534 0.489 4.206 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -16.198 2.714 2.817 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -15.034 1.749 1.930 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -16.741 0.100 1.389 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -17.915 0.936 2.386 1.00 0.00 H new ATOM 1215 N LYS A 78 -15.127 -1.391 3.884 1.00 0.00 N ATOM 1216 CA LYS A 78 -14.385 -2.610 3.762 1.00 0.00 C ATOM 1217 C LYS A 78 -15.012 -3.489 2.682 1.00 0.00 C ATOM 1218 O LYS A 78 -16.212 -3.762 2.717 1.00 0.00 O ATOM 1219 CB LYS A 78 -14.431 -3.292 5.109 1.00 0.00 C ATOM 1220 CG LYS A 78 -13.593 -4.537 5.228 1.00 0.00 C ATOM 1221 CD LYS A 78 -14.111 -5.424 6.350 1.00 0.00 C ATOM 1222 CE LYS A 78 -13.051 -6.383 6.863 1.00 0.00 C ATOM 1223 NZ LYS A 78 -12.124 -5.729 7.825 1.00 0.00 N ATOM 0 H LYS A 78 -16.054 -1.518 4.290 1.00 0.00 H new ATOM 0 HA LYS A 78 -13.352 -2.420 3.471 1.00 0.00 H new ATOM 0 HB2 LYS A 78 -14.107 -2.581 5.869 1.00 0.00 H new ATOM 0 HB3 LYS A 78 -15.467 -3.548 5.333 1.00 0.00 H new ATOM 0 HG2 LYS A 78 -13.610 -5.085 4.286 1.00 0.00 H new ATOM 0 HG3 LYS A 78 -12.555 -4.266 5.420 1.00 0.00 H new ATOM 0 HD2 LYS A 78 -14.461 -4.799 7.172 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -14.970 -5.992 5.994 1.00 0.00 H new ATOM 0 HE2 LYS A 78 -13.534 -7.232 7.346 1.00 0.00 H new ATOM 0 HE3 LYS A 78 -12.481 -6.777 6.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 -11.623 -6.457 8.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 -11.433 -5.152 7.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 -12.666 -5.121 8.471 1.00 0.00 H new ATOM 1237 N VAL A 79 -14.205 -3.927 1.733 1.00 0.00 N ATOM 1238 CA VAL A 79 -14.699 -4.683 0.589 1.00 0.00 C ATOM 1239 C VAL A 79 -13.889 -5.964 0.371 1.00 0.00 C ATOM 1240 O VAL A 79 -12.666 -5.955 0.484 1.00 0.00 O ATOM 1241 CB VAL A 79 -14.658 -3.816 -0.686 1.00 0.00 C ATOM 1242 CG1 VAL A 79 -13.254 -3.334 -0.978 1.00 0.00 C ATOM 1243 CG2 VAL A 79 -15.209 -4.585 -1.853 1.00 0.00 C ATOM 0 H VAL A 79 -13.197 -3.772 1.730 1.00 0.00 H new ATOM 0 HA VAL A 79 -15.730 -4.965 0.801 1.00 0.00 H new ATOM 0 HB VAL A 79 -15.280 -2.937 -0.519 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -13.259 -2.726 -1.883 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -12.893 -2.736 -0.141 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -12.597 -4.192 -1.121 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -15.175 -3.963 -2.747 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -14.611 -5.482 -2.012 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -16.241 -4.868 -1.647 1.00 0.00 H new ATOM 1253 N LYS A 80 -14.580 -7.066 0.072 1.00 0.00 N ATOM 1254 CA LYS A 80 -13.919 -8.333 -0.235 1.00 0.00 C ATOM 1255 C LYS A 80 -13.084 -8.240 -1.485 1.00 0.00 C ATOM 1256 O LYS A 80 -13.570 -7.944 -2.578 1.00 0.00 O ATOM 1257 CB LYS A 80 -14.936 -9.452 -0.413 1.00 0.00 C ATOM 1258 CG LYS A 80 -15.654 -9.821 0.851 1.00 0.00 C ATOM 1259 CD LYS A 80 -16.839 -10.722 0.569 1.00 0.00 C ATOM 1260 CE LYS A 80 -17.807 -10.058 -0.390 1.00 0.00 C ATOM 1261 NZ LYS A 80 -18.690 -9.080 0.293 1.00 0.00 N ATOM 0 H LYS A 80 -15.599 -7.105 0.036 1.00 0.00 H new ATOM 0 HA LYS A 80 -13.269 -8.555 0.611 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -15.668 -9.150 -1.161 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -14.428 -10.334 -0.803 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -14.965 -10.325 1.529 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -15.994 -8.917 1.356 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -16.492 -11.665 0.147 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -17.350 -10.960 1.502 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -17.247 -9.552 -1.177 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -18.418 -10.821 -0.873 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -19.335 -8.651 -0.401 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -19.244 -9.566 1.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -18.110 -8.337 0.733 1.00 0.00 H new ATOM 1275 N ALA A 81 -11.824 -8.516 -1.290 1.00 0.00 N ATOM 1276 CA ALA A 81 -10.842 -8.491 -2.338 1.00 0.00 C ATOM 1277 C ALA A 81 -9.970 -9.743 -2.264 1.00 0.00 C ATOM 1278 O ALA A 81 -9.671 -10.233 -1.183 1.00 0.00 O ATOM 1279 CB ALA A 81 -10.007 -7.253 -2.152 1.00 0.00 C ATOM 0 H ALA A 81 -11.443 -8.770 -0.378 1.00 0.00 H new ATOM 0 HA ALA A 81 -11.322 -8.475 -3.317 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -9.249 -7.204 -2.934 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -10.645 -6.371 -2.210 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -9.520 -7.285 -1.177 1.00 0.00 H new ATOM 1285 N VAL A 82 -9.568 -10.272 -3.406 1.00 0.00 N ATOM 1286 CA VAL A 82 -8.760 -11.485 -3.423 1.00 0.00 C ATOM 1287 C VAL A 82 -7.301 -11.151 -3.714 1.00 0.00 C ATOM 1288 O VAL A 82 -6.970 -10.655 -4.791 1.00 0.00 O ATOM 1289 CB VAL A 82 -9.278 -12.501 -4.453 1.00 0.00 C ATOM 1290 CG1 VAL A 82 -8.471 -13.777 -4.388 1.00 0.00 C ATOM 1291 CG2 VAL A 82 -10.715 -12.828 -4.163 1.00 0.00 C ATOM 0 H VAL A 82 -9.783 -9.888 -4.326 1.00 0.00 H new ATOM 0 HA VAL A 82 -8.836 -11.939 -2.435 1.00 0.00 H new ATOM 0 HB VAL A 82 -9.184 -12.062 -5.446 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -8.851 -14.486 -5.124 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -7.425 -13.557 -4.602 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -8.554 -14.210 -3.391 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.079 -13.549 -4.895 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -10.797 -13.254 -3.163 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -11.314 -11.919 -4.220 1.00 0.00 H new ATOM 1301 N VAL A 83 -6.441 -11.401 -2.737 1.00 0.00 N ATOM 1302 CA VAL A 83 -5.035 -11.048 -2.848 1.00 0.00 C ATOM 1303 C VAL A 83 -4.129 -12.279 -2.913 1.00 0.00 C ATOM 1304 O VAL A 83 -4.167 -13.156 -2.051 1.00 0.00 O ATOM 1305 CB VAL A 83 -4.602 -10.145 -1.683 1.00 0.00 C ATOM 1306 CG1 VAL A 83 -4.807 -10.847 -0.373 1.00 0.00 C ATOM 1307 CG2 VAL A 83 -3.161 -9.705 -1.846 1.00 0.00 C ATOM 0 H VAL A 83 -6.695 -11.848 -1.856 1.00 0.00 H new ATOM 0 HA VAL A 83 -4.925 -10.504 -3.786 1.00 0.00 H new ATOM 0 HB VAL A 83 -5.224 -9.250 -1.691 1.00 0.00 H new ATOM 0 HG11 VAL A 83 -4.495 -10.194 0.442 1.00 0.00 H new ATOM 0 HG12 VAL A 83 -5.861 -11.097 -0.255 1.00 0.00 H new ATOM 0 HG13 VAL A 83 -4.213 -11.761 -0.353 1.00 0.00 H new ATOM 0 HG21 VAL A 83 -2.879 -9.067 -1.009 1.00 0.00 H new ATOM 0 HG22 VAL A 83 -2.513 -10.581 -1.869 1.00 0.00 H new ATOM 0 HG23 VAL A 83 -3.053 -9.150 -2.778 1.00 0.00 H new ATOM 1317 N LYS A 84 -3.341 -12.351 -3.967 1.00 0.00 N ATOM 1318 CA LYS A 84 -2.257 -13.316 -4.061 1.00 0.00 C ATOM 1319 C LYS A 84 -1.096 -12.649 -4.770 1.00 0.00 C ATOM 1320 O LYS A 84 -1.266 -11.582 -5.359 1.00 0.00 O ATOM 1321 CB LYS A 84 -2.652 -14.624 -4.740 1.00 0.00 C ATOM 1322 CG LYS A 84 -1.728 -15.754 -4.329 1.00 0.00 C ATOM 1323 CD LYS A 84 -0.746 -16.139 -5.430 1.00 0.00 C ATOM 1324 CE LYS A 84 -1.428 -16.809 -6.610 1.00 0.00 C ATOM 1325 NZ LYS A 84 -1.937 -18.161 -6.268 1.00 0.00 N ATOM 0 H LYS A 84 -3.431 -11.745 -4.782 1.00 0.00 H new ATOM 0 HA LYS A 84 -1.974 -13.610 -3.050 1.00 0.00 H new ATOM 0 HB2 LYS A 84 -3.679 -14.877 -4.479 1.00 0.00 H new ATOM 0 HB3 LYS A 84 -2.620 -14.499 -5.822 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -1.172 -15.459 -3.439 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -2.324 -16.625 -4.058 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -0.224 -15.247 -5.775 1.00 0.00 H new ATOM 0 HD3 LYS A 84 0.008 -16.811 -5.021 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -2.255 -16.186 -6.951 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -0.724 -16.886 -7.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -2.256 -18.641 -7.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -1.177 -18.716 -5.825 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -2.734 -18.075 -5.606 1.00 0.00 H new ATOM 1339 N MET A 85 0.078 -13.256 -4.718 1.00 0.00 N ATOM 1340 CA MET A 85 1.299 -12.519 -4.965 1.00 0.00 C ATOM 1341 C MET A 85 1.536 -12.351 -6.456 1.00 0.00 C ATOM 1342 O MET A 85 1.843 -13.302 -7.173 1.00 0.00 O ATOM 1343 CB MET A 85 2.505 -13.221 -4.313 1.00 0.00 C ATOM 1344 CG MET A 85 2.176 -14.055 -3.095 1.00 0.00 C ATOM 1345 SD MET A 85 3.336 -15.410 -2.835 1.00 0.00 S ATOM 1346 CE MET A 85 4.878 -14.518 -2.644 1.00 0.00 C ATOM 0 H MET A 85 0.208 -14.246 -4.509 1.00 0.00 H new ATOM 0 HA MET A 85 1.189 -11.531 -4.517 1.00 0.00 H new ATOM 0 HB2 MET A 85 2.979 -13.862 -5.056 1.00 0.00 H new ATOM 0 HB3 MET A 85 3.237 -12.465 -4.030 1.00 0.00 H new ATOM 0 HG2 MET A 85 2.171 -13.414 -2.213 1.00 0.00 H new ATOM 0 HG3 MET A 85 1.170 -14.461 -3.200 1.00 0.00 H new ATOM 0 HE1 MET A 85 5.455 -14.959 -1.831 1.00 0.00 H new ATOM 0 HE2 MET A 85 5.450 -14.579 -3.570 1.00 0.00 H new ATOM 0 HE3 MET A 85 4.668 -13.473 -2.415 1.00 0.00 H new ATOM 1356 N GLU A 86 1.375 -11.111 -6.901 1.00 0.00 N ATOM 1357 CA GLU A 86 1.646 -10.722 -8.268 1.00 0.00 C ATOM 1358 C GLU A 86 2.638 -9.582 -8.256 1.00 0.00 C ATOM 1359 O GLU A 86 2.561 -8.698 -7.410 1.00 0.00 O ATOM 1360 CB GLU A 86 0.385 -10.282 -8.980 1.00 0.00 C ATOM 1361 CG GLU A 86 0.546 -10.243 -10.489 1.00 0.00 C ATOM 1362 CD GLU A 86 -0.716 -9.784 -11.190 1.00 0.00 C ATOM 1363 OE1 GLU A 86 -1.606 -10.626 -11.435 1.00 0.00 O ATOM 1364 OE2 GLU A 86 -0.829 -8.578 -11.500 1.00 0.00 O ATOM 0 H GLU A 86 1.049 -10.344 -6.313 1.00 0.00 H new ATOM 0 HA GLU A 86 2.049 -11.582 -8.802 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -0.428 -10.961 -8.723 1.00 0.00 H new ATOM 0 HB3 GLU A 86 0.098 -9.293 -8.624 1.00 0.00 H new ATOM 0 HG2 GLU A 86 1.367 -9.574 -10.747 1.00 0.00 H new ATOM 0 HG3 GLU A 86 0.819 -11.235 -10.849 1.00 0.00 H new ATOM 1371 N GLY A 87 3.537 -9.579 -9.203 1.00 0.00 N ATOM 1372 CA GLY A 87 4.683 -8.722 -9.092 1.00 0.00 C ATOM 1373 C GLY A 87 5.849 -9.545 -8.634 1.00 0.00 C ATOM 1374 O GLY A 87 6.952 -9.043 -8.440 1.00 0.00 O ATOM 0 H GLY A 87 3.499 -10.151 -10.047 1.00 0.00 H new ATOM 0 HA2 GLY A 87 4.902 -8.256 -10.053 1.00 0.00 H new ATOM 0 HA3 GLY A 87 4.487 -7.916 -8.384 1.00 0.00 H new ATOM 1378 N ASP A 88 5.544 -10.823 -8.407 1.00 0.00 N ATOM 1379 CA ASP A 88 6.539 -11.871 -8.208 1.00 0.00 C ATOM 1380 C ASP A 88 7.151 -11.845 -6.813 1.00 0.00 C ATOM 1381 O ASP A 88 7.523 -12.886 -6.270 1.00 0.00 O ATOM 1382 CB ASP A 88 7.602 -11.712 -9.275 1.00 0.00 C ATOM 1383 CG ASP A 88 8.147 -13.036 -9.765 1.00 0.00 C ATOM 1384 OD1 ASP A 88 7.516 -13.647 -10.652 1.00 0.00 O ATOM 1385 OD2 ASP A 88 9.207 -13.472 -9.272 1.00 0.00 O ATOM 0 H ASP A 88 4.583 -11.162 -8.356 1.00 0.00 H new ATOM 0 HA ASP A 88 6.052 -12.842 -8.294 1.00 0.00 H new ATOM 0 HB2 ASP A 88 7.184 -11.162 -10.118 1.00 0.00 H new ATOM 0 HB3 ASP A 88 8.421 -11.112 -8.878 1.00 0.00 H new ATOM 1390 N ASN A 89 7.236 -10.665 -6.233 1.00 0.00 N ATOM 1391 CA ASN A 89 7.816 -10.512 -4.907 1.00 0.00 C ATOM 1392 C ASN A 89 6.751 -10.405 -3.819 1.00 0.00 C ATOM 1393 O ASN A 89 6.949 -10.857 -2.696 1.00 0.00 O ATOM 1394 CB ASN A 89 8.732 -9.297 -4.873 1.00 0.00 C ATOM 1395 CG ASN A 89 10.058 -9.543 -5.562 1.00 0.00 C ATOM 1396 OD1 ASN A 89 10.211 -9.288 -6.755 1.00 0.00 O ATOM 1397 ND2 ASN A 89 11.029 -10.045 -4.814 1.00 0.00 N ATOM 0 H ASN A 89 6.912 -9.795 -6.656 1.00 0.00 H new ATOM 0 HA ASN A 89 8.398 -11.410 -4.700 1.00 0.00 H new ATOM 0 HB2 ASN A 89 8.230 -8.456 -5.351 1.00 0.00 H new ATOM 0 HB3 ASN A 89 8.913 -9.013 -3.836 1.00 0.00 H new ATOM 0 HD21 ASN A 89 11.943 -10.234 -5.225 1.00 0.00 H new ATOM 0 HD22 ASN A 89 10.862 -10.243 -3.827 1.00 0.00 H new ATOM 1404 N LYS A 90 5.639 -9.773 -4.143 1.00 0.00 N ATOM 1405 CA LYS A 90 4.542 -9.590 -3.200 1.00 0.00 C ATOM 1406 C LYS A 90 3.203 -9.627 -3.931 1.00 0.00 C ATOM 1407 O LYS A 90 3.172 -9.862 -5.130 1.00 0.00 O ATOM 1408 CB LYS A 90 4.689 -8.374 -2.290 1.00 0.00 C ATOM 1409 CG LYS A 90 3.816 -8.467 -1.063 1.00 0.00 C ATOM 1410 CD LYS A 90 4.293 -7.546 0.043 1.00 0.00 C ATOM 1411 CE LYS A 90 3.549 -7.815 1.333 1.00 0.00 C ATOM 1412 NZ LYS A 90 2.074 -7.642 1.180 1.00 0.00 N ATOM 0 H LYS A 90 5.467 -9.371 -5.065 1.00 0.00 H new ATOM 0 HA LYS A 90 4.580 -10.433 -2.510 1.00 0.00 H new ATOM 0 HB2 LYS A 90 5.731 -8.275 -1.985 1.00 0.00 H new ATOM 0 HB3 LYS A 90 4.433 -7.473 -2.847 1.00 0.00 H new ATOM 0 HG2 LYS A 90 2.789 -8.214 -1.328 1.00 0.00 H new ATOM 0 HG3 LYS A 90 3.808 -9.495 -0.701 1.00 0.00 H new ATOM 0 HD2 LYS A 90 5.363 -7.685 0.200 1.00 0.00 H new ATOM 0 HD3 LYS A 90 4.147 -6.508 -0.255 1.00 0.00 H new ATOM 0 HE2 LYS A 90 3.761 -8.830 1.668 1.00 0.00 H new ATOM 0 HE3 LYS A 90 3.914 -7.141 2.108 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 1.612 -7.770 2.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 1.872 -6.687 0.821 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 1.709 -8.348 0.510 1.00 0.00 H new ATOM 1426 N MET A 91 2.103 -9.462 -3.204 1.00 0.00 N ATOM 1427 CA MET A 91 0.779 -9.828 -3.684 1.00 0.00 C ATOM 1428 C MET A 91 -0.020 -8.614 -4.131 1.00 0.00 C ATOM 1429 O MET A 91 0.182 -7.502 -3.646 1.00 0.00 O ATOM 1430 CB MET A 91 -0.021 -10.494 -2.565 1.00 0.00 C ATOM 1431 CG MET A 91 0.716 -11.593 -1.838 1.00 0.00 C ATOM 1432 SD MET A 91 1.723 -10.968 -0.471 1.00 0.00 S ATOM 1433 CE MET A 91 2.566 -12.459 0.058 1.00 0.00 C ATOM 0 H MET A 91 2.107 -9.069 -2.263 1.00 0.00 H new ATOM 0 HA MET A 91 0.932 -10.502 -4.527 1.00 0.00 H new ATOM 0 HB2 MET A 91 -0.316 -9.732 -1.843 1.00 0.00 H new ATOM 0 HB3 MET A 91 -0.938 -10.906 -2.986 1.00 0.00 H new ATOM 0 HG2 MET A 91 -0.004 -12.316 -1.454 1.00 0.00 H new ATOM 0 HG3 MET A 91 1.356 -12.124 -2.543 1.00 0.00 H new ATOM 0 HE1 MET A 91 3.263 -12.218 0.861 1.00 0.00 H new ATOM 0 HE2 MET A 91 1.834 -13.183 0.418 1.00 0.00 H new ATOM 0 HE3 MET A 91 3.114 -12.885 -0.782 1.00 0.00 H new ATOM 1443 N VAL A 92 -0.923 -8.858 -5.073 1.00 0.00 N ATOM 1444 CA VAL A 92 -1.803 -7.832 -5.602 1.00 0.00 C ATOM 1445 C VAL A 92 -3.218 -8.068 -5.109 1.00 0.00 C ATOM 1446 O VAL A 92 -3.696 -9.205 -5.098 1.00 0.00 O ATOM 1447 CB VAL A 92 -1.807 -7.826 -7.146 1.00 0.00 C ATOM 1448 CG1 VAL A 92 -2.878 -6.896 -7.703 1.00 0.00 C ATOM 1449 CG2 VAL A 92 -0.450 -7.417 -7.654 1.00 0.00 C ATOM 0 H VAL A 92 -1.063 -9.778 -5.491 1.00 0.00 H new ATOM 0 HA VAL A 92 -1.433 -6.868 -5.253 1.00 0.00 H new ATOM 0 HB VAL A 92 -2.038 -8.835 -7.487 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.849 -6.919 -8.792 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.859 -7.223 -7.359 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.693 -5.879 -7.357 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -0.455 -7.414 -8.744 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -0.211 -6.418 -7.289 1.00 0.00 H new ATOM 0 HG23 VAL A 92 0.300 -8.123 -7.297 1.00 0.00 H new ATOM 1459 N THR A 93 -3.875 -7.004 -4.693 1.00 0.00 N ATOM 1460 CA THR A 93 -5.244 -7.095 -4.232 1.00 0.00 C ATOM 1461 C THR A 93 -6.104 -6.042 -4.926 1.00 0.00 C ATOM 1462 O THR A 93 -5.786 -4.850 -4.915 1.00 0.00 O ATOM 1463 CB THR A 93 -5.341 -6.962 -2.690 1.00 0.00 C ATOM 1464 OG1 THR A 93 -6.711 -6.940 -2.277 1.00 0.00 O ATOM 1465 CG2 THR A 93 -4.635 -5.709 -2.188 1.00 0.00 C ATOM 0 H THR A 93 -3.481 -6.064 -4.665 1.00 0.00 H new ATOM 0 HA THR A 93 -5.621 -8.084 -4.493 1.00 0.00 H new ATOM 0 HB THR A 93 -4.844 -7.829 -2.256 1.00 0.00 H new ATOM 0 HG1 THR A 93 -6.757 -6.857 -1.302 1.00 0.00 H new ATOM 0 HG21 THR A 93 -4.725 -5.651 -1.103 1.00 0.00 H new ATOM 0 HG22 THR A 93 -3.581 -5.750 -2.463 1.00 0.00 H new ATOM 0 HG23 THR A 93 -5.093 -4.828 -2.638 1.00 0.00 H new ATOM 1473 N THR A 94 -7.154 -6.501 -5.586 1.00 0.00 N ATOM 1474 CA THR A 94 -8.082 -5.614 -6.255 1.00 0.00 C ATOM 1475 C THR A 94 -9.308 -5.369 -5.393 1.00 0.00 C ATOM 1476 O THR A 94 -10.017 -6.308 -5.030 1.00 0.00 O ATOM 1477 CB THR A 94 -8.516 -6.195 -7.609 1.00 0.00 C ATOM 1478 OG1 THR A 94 -8.305 -7.617 -7.623 1.00 0.00 O ATOM 1479 CG2 THR A 94 -7.750 -5.543 -8.745 1.00 0.00 C ATOM 0 H THR A 94 -7.383 -7.491 -5.671 1.00 0.00 H new ATOM 0 HA THR A 94 -7.570 -4.667 -6.424 1.00 0.00 H new ATOM 0 HB THR A 94 -9.577 -5.989 -7.749 1.00 0.00 H new ATOM 0 HG1 THR A 94 -8.586 -7.981 -8.489 1.00 0.00 H new ATOM 0 HG21 THR A 94 -8.074 -5.970 -9.694 1.00 0.00 H new ATOM 0 HG22 THR A 94 -7.943 -4.470 -8.745 1.00 0.00 H new ATOM 0 HG23 THR A 94 -6.683 -5.720 -8.613 1.00 0.00 H new ATOM 1487 N PHE A 95 -9.587 -4.107 -5.107 1.00 0.00 N ATOM 1488 CA PHE A 95 -10.668 -3.764 -4.196 1.00 0.00 C ATOM 1489 C PHE A 95 -11.198 -2.372 -4.502 1.00 0.00 C ATOM 1490 O PHE A 95 -10.441 -1.486 -4.891 1.00 0.00 O ATOM 1491 CB PHE A 95 -10.192 -3.866 -2.738 1.00 0.00 C ATOM 1492 CG PHE A 95 -9.122 -2.882 -2.350 1.00 0.00 C ATOM 1493 CD1 PHE A 95 -7.784 -3.179 -2.547 1.00 0.00 C ATOM 1494 CD2 PHE A 95 -9.457 -1.666 -1.774 1.00 0.00 C ATOM 1495 CE1 PHE A 95 -6.800 -2.283 -2.182 1.00 0.00 C ATOM 1496 CE2 PHE A 95 -8.476 -0.766 -1.403 1.00 0.00 C ATOM 1497 CZ PHE A 95 -7.145 -1.074 -1.609 1.00 0.00 C ATOM 0 H PHE A 95 -9.083 -3.307 -5.490 1.00 0.00 H new ATOM 0 HA PHE A 95 -11.483 -4.474 -4.336 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -11.050 -3.726 -2.080 1.00 0.00 H new ATOM 0 HB3 PHE A 95 -9.818 -4.875 -2.563 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -7.507 -4.123 -2.992 1.00 0.00 H new ATOM 0 HD2 PHE A 95 -10.496 -1.419 -1.613 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -5.760 -2.527 -2.344 1.00 0.00 H new ATOM 0 HE2 PHE A 95 -8.749 0.177 -0.953 1.00 0.00 H new ATOM 0 HZ PHE A 95 -6.376 -0.372 -1.323 1.00 0.00 H new ATOM 1507 N LYS A 96 -12.509 -2.196 -4.341 1.00 0.00 N ATOM 1508 CA LYS A 96 -13.189 -0.963 -4.727 1.00 0.00 C ATOM 1509 C LYS A 96 -12.946 -0.621 -6.197 1.00 0.00 C ATOM 1510 O LYS A 96 -13.060 0.537 -6.606 1.00 0.00 O ATOM 1511 CB LYS A 96 -12.767 0.184 -3.829 1.00 0.00 C ATOM 1512 CG LYS A 96 -13.432 0.112 -2.475 1.00 0.00 C ATOM 1513 CD LYS A 96 -13.144 1.338 -1.660 1.00 0.00 C ATOM 1514 CE LYS A 96 -13.753 2.578 -2.291 1.00 0.00 C ATOM 1515 NZ LYS A 96 -15.240 2.513 -2.347 1.00 0.00 N ATOM 0 H LYS A 96 -13.127 -2.902 -3.941 1.00 0.00 H new ATOM 0 HA LYS A 96 -14.260 -1.124 -4.602 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -11.684 0.167 -3.703 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -13.018 1.131 -4.307 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -14.509 0.002 -2.602 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -13.082 -0.772 -1.942 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -13.540 1.209 -0.653 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -12.066 1.468 -1.564 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -13.451 3.458 -1.722 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -13.359 2.700 -3.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -15.617 3.436 -2.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -15.530 1.786 -3.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -15.613 2.271 -1.407 1.00 0.00 H new ATOM 1529 N GLY A 97 -12.606 -1.638 -6.985 1.00 0.00 N ATOM 1530 CA GLY A 97 -12.325 -1.436 -8.391 1.00 0.00 C ATOM 1531 C GLY A 97 -10.878 -1.062 -8.647 1.00 0.00 C ATOM 1532 O GLY A 97 -10.433 -1.016 -9.795 1.00 0.00 O ATOM 0 H GLY A 97 -12.520 -2.604 -6.669 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -12.564 -2.347 -8.940 1.00 0.00 H new ATOM 0 HA3 GLY A 97 -12.974 -0.650 -8.779 1.00 0.00 H new ATOM 1536 N ILE A 98 -10.132 -0.803 -7.578 1.00 0.00 N ATOM 1537 CA ILE A 98 -8.752 -0.368 -7.707 1.00 0.00 C ATOM 1538 C ILE A 98 -7.825 -1.567 -7.595 1.00 0.00 C ATOM 1539 O ILE A 98 -8.131 -2.541 -6.909 1.00 0.00 O ATOM 1540 CB ILE A 98 -8.367 0.733 -6.677 1.00 0.00 C ATOM 1541 CG1 ILE A 98 -7.996 0.155 -5.304 1.00 0.00 C ATOM 1542 CG2 ILE A 98 -9.507 1.729 -6.525 1.00 0.00 C ATOM 1543 CD1 ILE A 98 -6.508 -0.064 -5.112 1.00 0.00 C ATOM 0 H ILE A 98 -10.462 -0.887 -6.616 1.00 0.00 H new ATOM 0 HA ILE A 98 -8.641 0.087 -8.691 1.00 0.00 H new ATOM 0 HB ILE A 98 -7.482 1.236 -7.066 1.00 0.00 H new ATOM 0 HG12 ILE A 98 -8.357 0.829 -4.527 1.00 0.00 H new ATOM 0 HG13 ILE A 98 -8.514 -0.795 -5.168 1.00 0.00 H new ATOM 0 HG21 ILE A 98 -9.227 2.495 -5.802 1.00 0.00 H new ATOM 0 HG22 ILE A 98 -9.712 2.197 -7.488 1.00 0.00 H new ATOM 0 HG23 ILE A 98 -10.400 1.210 -6.176 1.00 0.00 H new ATOM 0 HD11 ILE A 98 -6.326 -0.474 -4.119 1.00 0.00 H new ATOM 0 HD12 ILE A 98 -6.143 -0.762 -5.865 1.00 0.00 H new ATOM 0 HD13 ILE A 98 -5.984 0.886 -5.214 1.00 0.00 H new ATOM 1555 N LYS A 99 -6.709 -1.504 -8.289 1.00 0.00 N ATOM 1556 CA LYS A 99 -5.784 -2.617 -8.337 1.00 0.00 C ATOM 1557 C LYS A 99 -4.486 -2.264 -7.615 1.00 0.00 C ATOM 1558 O LYS A 99 -3.759 -1.371 -8.033 1.00 0.00 O ATOM 1559 CB LYS A 99 -5.518 -3.033 -9.790 1.00 0.00 C ATOM 1560 CG LYS A 99 -5.609 -1.903 -10.796 1.00 0.00 C ATOM 1561 CD LYS A 99 -7.042 -1.541 -11.189 1.00 0.00 C ATOM 1562 CE LYS A 99 -7.876 -2.776 -11.498 1.00 0.00 C ATOM 1563 NZ LYS A 99 -9.273 -2.425 -11.858 1.00 0.00 N ATOM 0 H LYS A 99 -6.419 -0.690 -8.830 1.00 0.00 H new ATOM 0 HA LYS A 99 -6.233 -3.467 -7.823 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -4.524 -3.477 -9.851 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -6.232 -3.808 -10.069 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -5.122 -1.020 -10.382 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -5.056 -2.182 -11.693 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -7.510 -0.981 -10.379 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -7.025 -0.887 -12.061 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -7.417 -3.328 -12.319 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -7.880 -3.438 -10.632 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -9.878 -3.266 -11.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -9.618 -1.678 -11.222 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -9.303 -2.085 -12.840 1.00 0.00 H new ATOM 1577 N SER A 100 -4.205 -2.950 -6.517 1.00 0.00 N ATOM 1578 CA SER A 100 -3.046 -2.625 -5.698 1.00 0.00 C ATOM 1579 C SER A 100 -2.017 -3.755 -5.723 1.00 0.00 C ATOM 1580 O SER A 100 -2.287 -4.862 -5.265 1.00 0.00 O ATOM 1581 CB SER A 100 -3.506 -2.355 -4.265 1.00 0.00 C ATOM 1582 OG SER A 100 -2.444 -1.887 -3.450 1.00 0.00 O ATOM 0 H SER A 100 -4.761 -3.733 -6.173 1.00 0.00 H new ATOM 0 HA SER A 100 -2.566 -1.735 -6.104 1.00 0.00 H new ATOM 0 HB2 SER A 100 -4.309 -1.618 -4.274 1.00 0.00 H new ATOM 0 HB3 SER A 100 -3.917 -3.269 -3.837 1.00 0.00 H new ATOM 0 HG SER A 100 -2.776 -1.724 -2.542 1.00 0.00 H new ATOM 1588 N VAL A 101 -0.839 -3.459 -6.251 1.00 0.00 N ATOM 1589 CA VAL A 101 0.249 -4.426 -6.327 1.00 0.00 C ATOM 1590 C VAL A 101 1.293 -4.135 -5.252 1.00 0.00 C ATOM 1591 O VAL A 101 1.596 -2.981 -4.955 1.00 0.00 O ATOM 1592 CB VAL A 101 0.906 -4.470 -7.735 1.00 0.00 C ATOM 1593 CG1 VAL A 101 0.264 -3.467 -8.667 1.00 0.00 C ATOM 1594 CG2 VAL A 101 2.411 -4.285 -7.662 1.00 0.00 C ATOM 0 H VAL A 101 -0.609 -2.544 -6.639 1.00 0.00 H new ATOM 0 HA VAL A 101 -0.181 -5.412 -6.149 1.00 0.00 H new ATOM 0 HB VAL A 101 0.730 -5.464 -8.147 1.00 0.00 H new ATOM 0 HG11 VAL A 101 0.743 -3.520 -9.644 1.00 0.00 H new ATOM 0 HG12 VAL A 101 -0.797 -3.694 -8.771 1.00 0.00 H new ATOM 0 HG13 VAL A 101 0.382 -2.463 -8.259 1.00 0.00 H new ATOM 0 HG21 VAL A 101 2.831 -4.322 -8.667 1.00 0.00 H new ATOM 0 HG22 VAL A 101 2.637 -3.320 -7.209 1.00 0.00 H new ATOM 0 HG23 VAL A 101 2.846 -5.080 -7.057 1.00 0.00 H new ATOM 1604 N THR A 102 1.802 -5.185 -4.645 1.00 0.00 N ATOM 1605 CA THR A 102 2.861 -5.072 -3.665 1.00 0.00 C ATOM 1606 C THR A 102 3.988 -5.978 -4.099 1.00 0.00 C ATOM 1607 O THR A 102 3.729 -7.059 -4.599 1.00 0.00 O ATOM 1608 CB THR A 102 2.416 -5.481 -2.250 1.00 0.00 C ATOM 1609 OG1 THR A 102 0.991 -5.403 -2.124 1.00 0.00 O ATOM 1610 CG2 THR A 102 3.056 -4.573 -1.209 1.00 0.00 C ATOM 0 H THR A 102 1.493 -6.142 -4.817 1.00 0.00 H new ATOM 0 HA THR A 102 3.165 -4.026 -3.615 1.00 0.00 H new ATOM 0 HB THR A 102 2.736 -6.510 -2.084 1.00 0.00 H new ATOM 0 HG1 THR A 102 0.577 -6.124 -2.643 1.00 0.00 H new ATOM 0 HG21 THR A 102 2.731 -4.875 -0.213 1.00 0.00 H new ATOM 0 HG22 THR A 102 4.141 -4.651 -1.276 1.00 0.00 H new ATOM 0 HG23 THR A 102 2.755 -3.541 -1.391 1.00 0.00 H new ATOM 1618 N GLU A 103 5.213 -5.521 -3.993 1.00 0.00 N ATOM 1619 CA GLU A 103 6.359 -6.327 -4.340 1.00 0.00 C ATOM 1620 C GLU A 103 7.356 -6.355 -3.182 1.00 0.00 C ATOM 1621 O GLU A 103 7.917 -5.332 -2.835 1.00 0.00 O ATOM 1622 CB GLU A 103 6.997 -5.674 -5.550 1.00 0.00 C ATOM 1623 CG GLU A 103 7.698 -6.610 -6.489 1.00 0.00 C ATOM 1624 CD GLU A 103 8.859 -5.930 -7.188 1.00 0.00 C ATOM 1625 OE1 GLU A 103 9.782 -5.453 -6.492 1.00 0.00 O ATOM 1626 OE2 GLU A 103 8.841 -5.833 -8.434 1.00 0.00 O ATOM 0 H GLU A 103 5.443 -4.583 -3.665 1.00 0.00 H new ATOM 0 HA GLU A 103 6.063 -7.355 -4.552 1.00 0.00 H new ATOM 0 HB2 GLU A 103 6.224 -5.141 -6.104 1.00 0.00 H new ATOM 0 HB3 GLU A 103 7.713 -4.928 -5.205 1.00 0.00 H new ATOM 0 HG2 GLU A 103 8.062 -7.476 -5.937 1.00 0.00 H new ATOM 0 HG3 GLU A 103 6.991 -6.979 -7.232 1.00 0.00 H new ATOM 1633 N PHE A 104 7.588 -7.510 -2.583 1.00 0.00 N ATOM 1634 CA PHE A 104 8.487 -7.585 -1.438 1.00 0.00 C ATOM 1635 C PHE A 104 9.782 -8.289 -1.806 1.00 0.00 C ATOM 1636 O PHE A 104 9.827 -9.503 -2.002 1.00 0.00 O ATOM 1637 CB PHE A 104 7.796 -8.274 -0.265 1.00 0.00 C ATOM 1638 CG PHE A 104 8.655 -8.427 0.958 1.00 0.00 C ATOM 1639 CD1 PHE A 104 9.507 -7.413 1.366 1.00 0.00 C ATOM 1640 CD2 PHE A 104 8.600 -9.588 1.702 1.00 0.00 C ATOM 1641 CE1 PHE A 104 10.289 -7.563 2.494 1.00 0.00 C ATOM 1642 CE2 PHE A 104 9.379 -9.746 2.830 1.00 0.00 C ATOM 1643 CZ PHE A 104 10.225 -8.732 3.226 1.00 0.00 C ATOM 0 H PHE A 104 7.174 -8.399 -2.863 1.00 0.00 H new ATOM 0 HA PHE A 104 8.742 -6.570 -1.134 1.00 0.00 H new ATOM 0 HB2 PHE A 104 6.905 -7.706 0.001 1.00 0.00 H new ATOM 0 HB3 PHE A 104 7.461 -9.261 -0.585 1.00 0.00 H new ATOM 0 HD1 PHE A 104 9.560 -6.497 0.796 1.00 0.00 H new ATOM 0 HD2 PHE A 104 7.938 -10.385 1.397 1.00 0.00 H new ATOM 0 HE1 PHE A 104 10.950 -6.767 2.803 1.00 0.00 H new ATOM 0 HE2 PHE A 104 9.326 -10.661 3.401 1.00 0.00 H new ATOM 0 HZ PHE A 104 10.837 -8.852 4.108 1.00 0.00 H new ATOM 1653 N ASN A 105 10.834 -7.503 -1.888 1.00 0.00 N ATOM 1654 CA ASN A 105 12.140 -7.994 -2.290 1.00 0.00 C ATOM 1655 C ASN A 105 13.132 -7.896 -1.143 1.00 0.00 C ATOM 1656 O ASN A 105 13.654 -6.815 -0.866 1.00 0.00 O ATOM 1657 CB ASN A 105 12.680 -7.189 -3.471 1.00 0.00 C ATOM 1658 CG ASN A 105 13.919 -7.831 -4.069 1.00 0.00 C ATOM 1659 OD1 ASN A 105 14.051 -9.057 -4.085 1.00 0.00 O ATOM 1660 ND2 ASN A 105 14.840 -7.011 -4.543 1.00 0.00 N ATOM 0 H ASN A 105 10.811 -6.505 -1.678 1.00 0.00 H new ATOM 0 HA ASN A 105 12.020 -9.038 -2.580 1.00 0.00 H new ATOM 0 HB2 ASN A 105 11.909 -7.104 -4.237 1.00 0.00 H new ATOM 0 HB3 ASN A 105 12.917 -6.177 -3.143 1.00 0.00 H new ATOM 0 HD21 ASN A 105 15.701 -7.386 -4.942 1.00 0.00 H new ATOM 0 HD22 ASN A 105 14.691 -6.003 -4.510 1.00 0.00 H new ATOM 1667 N GLY A 106 13.388 -9.015 -0.482 1.00 0.00 N ATOM 1668 CA GLY A 106 14.378 -9.045 0.581 1.00 0.00 C ATOM 1669 C GLY A 106 13.978 -8.220 1.782 1.00 0.00 C ATOM 1670 O GLY A 106 13.327 -8.715 2.698 1.00 0.00 O ATOM 0 H GLY A 106 12.927 -9.907 -0.662 1.00 0.00 H new ATOM 0 HA2 GLY A 106 14.538 -10.077 0.893 1.00 0.00 H new ATOM 0 HA3 GLY A 106 15.329 -8.678 0.195 1.00 0.00 H new ATOM 1674 N ASP A 107 14.396 -6.968 1.785 1.00 0.00 N ATOM 1675 CA ASP A 107 14.066 -6.045 2.866 1.00 0.00 C ATOM 1676 C ASP A 107 13.331 -4.818 2.325 1.00 0.00 C ATOM 1677 O ASP A 107 12.918 -3.939 3.084 1.00 0.00 O ATOM 1678 CB ASP A 107 15.341 -5.603 3.589 1.00 0.00 C ATOM 1679 CG ASP A 107 16.108 -4.539 2.825 1.00 0.00 C ATOM 1680 OD1 ASP A 107 16.655 -4.849 1.745 1.00 0.00 O ATOM 1681 OD2 ASP A 107 16.183 -3.393 3.311 1.00 0.00 O ATOM 0 H ASP A 107 14.970 -6.560 1.047 1.00 0.00 H new ATOM 0 HA ASP A 107 13.413 -6.563 3.569 1.00 0.00 H new ATOM 0 HB2 ASP A 107 15.080 -5.219 4.575 1.00 0.00 H new ATOM 0 HB3 ASP A 107 15.985 -6.469 3.744 1.00 0.00 H new ATOM 1686 N THR A 108 13.173 -4.767 1.012 1.00 0.00 N ATOM 1687 CA THR A 108 12.543 -3.642 0.347 1.00 0.00 C ATOM 1688 C THR A 108 11.199 -4.042 -0.262 1.00 0.00 C ATOM 1689 O THR A 108 11.023 -5.177 -0.693 1.00 0.00 O ATOM 1690 CB THR A 108 13.463 -3.104 -0.760 1.00 0.00 C ATOM 1691 OG1 THR A 108 14.292 -4.158 -1.276 1.00 0.00 O ATOM 1692 CG2 THR A 108 14.327 -1.979 -0.229 1.00 0.00 C ATOM 0 H THR A 108 13.479 -5.506 0.379 1.00 0.00 H new ATOM 0 HA THR A 108 12.369 -2.866 1.093 1.00 0.00 H new ATOM 0 HB THR A 108 12.841 -2.717 -1.567 1.00 0.00 H new ATOM 0 HG1 THR A 108 14.872 -3.802 -1.981 1.00 0.00 H new ATOM 0 HG21 THR A 108 14.973 -1.609 -1.025 1.00 0.00 H new ATOM 0 HG22 THR A 108 13.691 -1.169 0.128 1.00 0.00 H new ATOM 0 HG23 THR A 108 14.940 -2.348 0.593 1.00 0.00 H new ATOM 1700 N ILE A 109 10.255 -3.114 -0.293 1.00 0.00 N ATOM 1701 CA ILE A 109 8.938 -3.382 -0.853 1.00 0.00 C ATOM 1702 C ILE A 109 8.586 -2.340 -1.907 1.00 0.00 C ATOM 1703 O ILE A 109 8.731 -1.147 -1.675 1.00 0.00 O ATOM 1704 CB ILE A 109 7.829 -3.359 0.223 1.00 0.00 C ATOM 1705 CG1 ILE A 109 8.350 -3.869 1.565 1.00 0.00 C ATOM 1706 CG2 ILE A 109 6.643 -4.202 -0.225 1.00 0.00 C ATOM 1707 CD1 ILE A 109 7.297 -3.888 2.646 1.00 0.00 C ATOM 0 H ILE A 109 10.376 -2.166 0.064 1.00 0.00 H new ATOM 0 HA ILE A 109 8.988 -4.378 -1.292 1.00 0.00 H new ATOM 0 HB ILE A 109 7.509 -2.325 0.351 1.00 0.00 H new ATOM 0 HG12 ILE A 109 8.745 -4.877 1.434 1.00 0.00 H new ATOM 0 HG13 ILE A 109 9.180 -3.240 1.887 1.00 0.00 H new ATOM 0 HG21 ILE A 109 5.869 -4.177 0.542 1.00 0.00 H new ATOM 0 HG22 ILE A 109 6.244 -3.802 -1.157 1.00 0.00 H new ATOM 0 HG23 ILE A 109 6.966 -5.231 -0.381 1.00 0.00 H new ATOM 0 HD11 ILE A 109 7.734 -4.261 3.573 1.00 0.00 H new ATOM 0 HD12 ILE A 109 6.919 -2.878 2.803 1.00 0.00 H new ATOM 0 HD13 ILE A 109 6.477 -4.539 2.344 1.00 0.00 H new ATOM 1719 N THR A 110 8.124 -2.794 -3.052 1.00 0.00 N ATOM 1720 CA THR A 110 7.647 -1.909 -4.089 1.00 0.00 C ATOM 1721 C THR A 110 6.121 -1.979 -4.146 1.00 0.00 C ATOM 1722 O THR A 110 5.551 -2.991 -4.534 1.00 0.00 O ATOM 1723 CB THR A 110 8.224 -2.302 -5.462 1.00 0.00 C ATOM 1724 OG1 THR A 110 9.608 -2.677 -5.340 1.00 0.00 O ATOM 1725 CG2 THR A 110 8.092 -1.144 -6.421 1.00 0.00 C ATOM 0 H THR A 110 8.069 -3.785 -3.289 1.00 0.00 H new ATOM 0 HA THR A 110 7.973 -0.895 -3.855 1.00 0.00 H new ATOM 0 HB THR A 110 7.664 -3.156 -5.844 1.00 0.00 H new ATOM 0 HG1 THR A 110 9.741 -3.567 -5.727 1.00 0.00 H new ATOM 0 HG21 THR A 110 8.501 -1.426 -7.391 1.00 0.00 H new ATOM 0 HG22 THR A 110 7.040 -0.883 -6.533 1.00 0.00 H new ATOM 0 HG23 THR A 110 8.639 -0.285 -6.032 1.00 0.00 H new ATOM 1733 N ASN A 111 5.467 -0.911 -3.744 1.00 0.00 N ATOM 1734 CA ASN A 111 4.017 -0.871 -3.695 1.00 0.00 C ATOM 1735 C ASN A 111 3.493 -0.111 -4.896 1.00 0.00 C ATOM 1736 O ASN A 111 3.724 1.083 -5.015 1.00 0.00 O ATOM 1737 CB ASN A 111 3.553 -0.153 -2.421 1.00 0.00 C ATOM 1738 CG ASN A 111 2.436 -0.887 -1.699 1.00 0.00 C ATOM 1739 OD1 ASN A 111 2.303 -0.784 -0.479 1.00 0.00 O ATOM 1740 ND2 ASN A 111 1.625 -1.630 -2.439 1.00 0.00 N ATOM 0 H ASN A 111 5.920 -0.048 -3.443 1.00 0.00 H new ATOM 0 HA ASN A 111 3.637 -1.893 -3.699 1.00 0.00 H new ATOM 0 HB2 ASN A 111 4.401 -0.039 -1.746 1.00 0.00 H new ATOM 0 HB3 ASN A 111 3.214 0.850 -2.679 1.00 0.00 H new ATOM 0 HD21 ASN A 111 0.859 -2.141 -2.000 1.00 0.00 H new ATOM 0 HD22 ASN A 111 1.767 -1.691 -3.447 1.00 0.00 H new ATOM 1747 N THR A 112 2.773 -0.781 -5.769 1.00 0.00 N ATOM 1748 CA THR A 112 2.243 -0.127 -6.943 1.00 0.00 C ATOM 1749 C THR A 112 0.724 -0.068 -6.854 1.00 0.00 C ATOM 1750 O THR A 112 0.056 -1.089 -6.802 1.00 0.00 O ATOM 1751 CB THR A 112 2.655 -0.865 -8.233 1.00 0.00 C ATOM 1752 OG1 THR A 112 4.053 -1.184 -8.198 1.00 0.00 O ATOM 1753 CG2 THR A 112 2.356 -0.019 -9.455 1.00 0.00 C ATOM 0 H THR A 112 2.543 -1.771 -5.689 1.00 0.00 H new ATOM 0 HA THR A 112 2.654 0.882 -6.982 1.00 0.00 H new ATOM 0 HB THR A 112 2.077 -1.787 -8.295 1.00 0.00 H new ATOM 0 HG1 THR A 112 4.302 -1.654 -9.021 1.00 0.00 H new ATOM 0 HG21 THR A 112 2.655 -0.559 -10.353 1.00 0.00 H new ATOM 0 HG22 THR A 112 1.288 0.194 -9.498 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.910 0.918 -9.394 1.00 0.00 H new ATOM 1761 N MET A 113 0.180 1.124 -6.824 1.00 0.00 N ATOM 1762 CA MET A 113 -1.251 1.291 -6.765 1.00 0.00 C ATOM 1763 C MET A 113 -1.769 1.663 -8.126 1.00 0.00 C ATOM 1764 O MET A 113 -1.150 2.437 -8.843 1.00 0.00 O ATOM 1765 CB MET A 113 -1.655 2.389 -5.798 1.00 0.00 C ATOM 1766 CG MET A 113 -3.147 2.383 -5.538 1.00 0.00 C ATOM 1767 SD MET A 113 -3.694 3.770 -4.523 1.00 0.00 S ATOM 1768 CE MET A 113 -5.453 3.440 -4.418 1.00 0.00 C ATOM 0 H MET A 113 0.709 1.996 -6.840 1.00 0.00 H new ATOM 0 HA MET A 113 -1.673 0.346 -6.423 1.00 0.00 H new ATOM 0 HB2 MET A 113 -1.121 2.260 -4.857 1.00 0.00 H new ATOM 0 HB3 MET A 113 -1.360 3.357 -6.202 1.00 0.00 H new ATOM 0 HG2 MET A 113 -3.676 2.407 -6.491 1.00 0.00 H new ATOM 0 HG3 MET A 113 -3.420 1.450 -5.045 1.00 0.00 H new ATOM 0 HE1 MET A 113 -5.961 4.305 -3.992 1.00 0.00 H new ATOM 0 HE2 MET A 113 -5.846 3.243 -5.415 1.00 0.00 H new ATOM 0 HE3 MET A 113 -5.623 2.571 -3.783 1.00 0.00 H new ATOM 1778 N THR A 114 -2.878 1.088 -8.499 1.00 0.00 N ATOM 1779 CA THR A 114 -3.476 1.402 -9.765 1.00 0.00 C ATOM 1780 C THR A 114 -4.944 1.793 -9.598 1.00 0.00 C ATOM 1781 O THR A 114 -5.771 0.973 -9.195 1.00 0.00 O ATOM 1782 CB THR A 114 -3.366 0.201 -10.695 1.00 0.00 C ATOM 1783 OG1 THR A 114 -2.139 -0.502 -10.451 1.00 0.00 O ATOM 1784 CG2 THR A 114 -3.411 0.643 -12.134 1.00 0.00 C ATOM 0 H THR A 114 -3.386 0.399 -7.944 1.00 0.00 H new ATOM 0 HA THR A 114 -2.944 2.250 -10.195 1.00 0.00 H new ATOM 0 HB THR A 114 -4.209 -0.462 -10.499 1.00 0.00 H new ATOM 0 HG1 THR A 114 -2.236 -1.062 -9.653 1.00 0.00 H new ATOM 0 HG21 THR A 114 -3.331 -0.228 -12.785 1.00 0.00 H new ATOM 0 HG22 THR A 114 -4.353 1.156 -12.328 1.00 0.00 H new ATOM 0 HG23 THR A 114 -2.581 1.321 -12.332 1.00 0.00 H new ATOM 1792 N LEU A 115 -5.265 3.042 -9.883 1.00 0.00 N ATOM 1793 CA LEU A 115 -6.652 3.474 -9.909 1.00 0.00 C ATOM 1794 C LEU A 115 -7.020 3.851 -11.331 1.00 0.00 C ATOM 1795 O LEU A 115 -6.629 4.903 -11.807 1.00 0.00 O ATOM 1796 CB LEU A 115 -6.864 4.676 -8.992 1.00 0.00 C ATOM 1797 CG LEU A 115 -8.187 4.671 -8.217 1.00 0.00 C ATOM 1798 CD1 LEU A 115 -8.501 6.056 -7.701 1.00 0.00 C ATOM 1799 CD2 LEU A 115 -9.322 4.169 -9.084 1.00 0.00 C ATOM 0 H LEU A 115 -4.588 3.773 -10.099 1.00 0.00 H new ATOM 0 HA LEU A 115 -7.284 2.659 -9.557 1.00 0.00 H new ATOM 0 HB2 LEU A 115 -6.042 4.719 -8.278 1.00 0.00 H new ATOM 0 HB3 LEU A 115 -6.814 5.585 -9.591 1.00 0.00 H new ATOM 0 HG LEU A 115 -8.078 3.994 -7.370 1.00 0.00 H new ATOM 0 HD11 LEU A 115 -9.443 6.035 -7.153 1.00 0.00 H new ATOM 0 HD12 LEU A 115 -7.702 6.387 -7.037 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -8.584 6.747 -8.540 1.00 0.00 H new ATOM 0 HD21 LEU A 115 -10.249 4.176 -8.510 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -9.429 4.817 -9.954 1.00 0.00 H new ATOM 0 HD23 LEU A 115 -9.106 3.153 -9.413 1.00 0.00 H new ATOM 1811 N GLY A 116 -7.812 3.009 -11.975 1.00 0.00 N ATOM 1812 CA GLY A 116 -8.186 3.240 -13.359 1.00 0.00 C ATOM 1813 C GLY A 116 -6.999 3.586 -14.250 1.00 0.00 C ATOM 1814 O GLY A 116 -6.290 2.697 -14.723 1.00 0.00 O ATOM 0 H GLY A 116 -8.206 2.163 -11.563 1.00 0.00 H new ATOM 0 HA2 GLY A 116 -8.678 2.349 -13.750 1.00 0.00 H new ATOM 0 HA3 GLY A 116 -8.913 4.051 -13.402 1.00 0.00 H new ATOM 1818 N ASP A 117 -6.773 4.880 -14.463 1.00 0.00 N ATOM 1819 CA ASP A 117 -5.665 5.333 -15.297 1.00 0.00 C ATOM 1820 C ASP A 117 -4.459 5.729 -14.447 1.00 0.00 C ATOM 1821 O ASP A 117 -3.317 5.580 -14.882 1.00 0.00 O ATOM 1822 CB ASP A 117 -6.081 6.519 -16.185 1.00 0.00 C ATOM 1823 CG ASP A 117 -6.150 7.843 -15.440 1.00 0.00 C ATOM 1824 OD1 ASP A 117 -5.117 8.543 -15.362 1.00 0.00 O ATOM 1825 OD2 ASP A 117 -7.241 8.199 -14.943 1.00 0.00 O ATOM 0 H ASP A 117 -7.341 5.631 -14.071 1.00 0.00 H new ATOM 0 HA ASP A 117 -5.386 4.497 -15.938 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -5.373 6.612 -17.008 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -7.056 6.308 -16.625 1.00 0.00 H new ATOM 1830 N ILE A 118 -4.702 6.211 -13.229 1.00 0.00 N ATOM 1831 CA ILE A 118 -3.615 6.703 -12.390 1.00 0.00 C ATOM 1832 C ILE A 118 -2.863 5.563 -11.729 1.00 0.00 C ATOM 1833 O ILE A 118 -3.450 4.729 -11.038 1.00 0.00 O ATOM 1834 CB ILE A 118 -4.088 7.684 -11.307 1.00 0.00 C ATOM 1835 CG1 ILE A 118 -5.322 7.153 -10.625 1.00 0.00 C ATOM 1836 CG2 ILE A 118 -4.379 9.017 -11.915 1.00 0.00 C ATOM 1837 CD1 ILE A 118 -5.882 8.063 -9.594 1.00 0.00 C ATOM 0 H ILE A 118 -5.629 6.270 -12.807 1.00 0.00 H new ATOM 0 HA ILE A 118 -2.949 7.240 -13.065 1.00 0.00 H new ATOM 0 HB ILE A 118 -3.296 7.795 -10.567 1.00 0.00 H new ATOM 0 HG12 ILE A 118 -6.086 6.960 -11.378 1.00 0.00 H new ATOM 0 HG13 ILE A 118 -5.084 6.196 -10.160 1.00 0.00 H new ATOM 0 HG21 ILE A 118 -4.714 9.706 -11.139 1.00 0.00 H new ATOM 0 HG22 ILE A 118 -3.476 9.409 -12.383 1.00 0.00 H new ATOM 0 HG23 ILE A 118 -5.160 8.911 -12.668 1.00 0.00 H new ATOM 0 HD11 ILE A 118 -6.768 7.609 -9.150 1.00 0.00 H new ATOM 0 HD12 ILE A 118 -5.136 8.237 -8.818 1.00 0.00 H new ATOM 0 HD13 ILE A 118 -6.154 9.012 -10.056 1.00 0.00 H new ATOM 1849 N VAL A 119 -1.565 5.516 -11.952 1.00 0.00 N ATOM 1850 CA VAL A 119 -0.735 4.529 -11.297 1.00 0.00 C ATOM 1851 C VAL A 119 0.120 5.224 -10.236 1.00 0.00 C ATOM 1852 O VAL A 119 0.562 6.353 -10.425 1.00 0.00 O ATOM 1853 CB VAL A 119 0.147 3.752 -12.304 1.00 0.00 C ATOM 1854 CG1 VAL A 119 1.401 4.521 -12.666 1.00 0.00 C ATOM 1855 CG2 VAL A 119 0.485 2.371 -11.770 1.00 0.00 C ATOM 0 H VAL A 119 -1.065 6.147 -12.579 1.00 0.00 H new ATOM 0 HA VAL A 119 -1.380 3.791 -10.821 1.00 0.00 H new ATOM 0 HB VAL A 119 -0.430 3.632 -13.221 1.00 0.00 H new ATOM 0 HG11 VAL A 119 1.992 3.941 -13.375 1.00 0.00 H new ATOM 0 HG12 VAL A 119 1.126 5.474 -13.118 1.00 0.00 H new ATOM 0 HG13 VAL A 119 1.989 4.702 -11.766 1.00 0.00 H new ATOM 0 HG21 VAL A 119 1.105 1.843 -12.494 1.00 0.00 H new ATOM 0 HG22 VAL A 119 1.027 2.467 -10.829 1.00 0.00 H new ATOM 0 HG23 VAL A 119 -0.435 1.810 -11.603 1.00 0.00 H new ATOM 1865 N TYR A 120 0.313 4.553 -9.121 1.00 0.00 N ATOM 1866 CA TYR A 120 0.984 5.116 -7.958 1.00 0.00 C ATOM 1867 C TYR A 120 2.011 4.117 -7.453 1.00 0.00 C ATOM 1868 O TYR A 120 1.755 2.931 -7.475 1.00 0.00 O ATOM 1869 CB TYR A 120 -0.053 5.407 -6.860 1.00 0.00 C ATOM 1870 CG TYR A 120 0.529 6.013 -5.603 1.00 0.00 C ATOM 1871 CD1 TYR A 120 1.275 7.178 -5.658 1.00 0.00 C ATOM 1872 CD2 TYR A 120 0.324 5.425 -4.365 1.00 0.00 C ATOM 1873 CE1 TYR A 120 1.808 7.741 -4.520 1.00 0.00 C ATOM 1874 CE2 TYR A 120 0.852 5.982 -3.217 1.00 0.00 C ATOM 1875 CZ TYR A 120 1.594 7.141 -3.300 1.00 0.00 C ATOM 1876 OH TYR A 120 2.121 7.695 -2.157 1.00 0.00 O ATOM 0 H TYR A 120 0.006 3.589 -8.990 1.00 0.00 H new ATOM 0 HA TYR A 120 1.484 6.047 -8.227 1.00 0.00 H new ATOM 0 HB2 TYR A 120 -0.809 6.083 -7.260 1.00 0.00 H new ATOM 0 HB3 TYR A 120 -0.561 4.478 -6.601 1.00 0.00 H new ATOM 0 HD1 TYR A 120 1.442 7.655 -6.613 1.00 0.00 H new ATOM 0 HD2 TYR A 120 -0.257 4.517 -4.297 1.00 0.00 H new ATOM 0 HE1 TYR A 120 2.391 8.648 -4.584 1.00 0.00 H new ATOM 0 HE2 TYR A 120 0.685 5.512 -2.259 1.00 0.00 H new ATOM 0 HH TYR A 120 1.689 7.298 -1.372 1.00 0.00 H new ATOM 1886 N LYS A 121 3.188 4.553 -7.052 1.00 0.00 N ATOM 1887 CA LYS A 121 4.146 3.604 -6.499 1.00 0.00 C ATOM 1888 C LYS A 121 4.782 4.133 -5.230 1.00 0.00 C ATOM 1889 O LYS A 121 4.947 5.333 -5.066 1.00 0.00 O ATOM 1890 CB LYS A 121 5.243 3.262 -7.500 1.00 0.00 C ATOM 1891 CG LYS A 121 5.912 1.935 -7.214 1.00 0.00 C ATOM 1892 CD LYS A 121 7.345 2.147 -6.775 1.00 0.00 C ATOM 1893 CE LYS A 121 8.302 1.988 -7.940 1.00 0.00 C ATOM 1894 NZ LYS A 121 9.701 2.323 -7.569 1.00 0.00 N ATOM 0 H LYS A 121 3.502 5.523 -7.093 1.00 0.00 H new ATOM 0 HA LYS A 121 3.584 2.699 -6.268 1.00 0.00 H new ATOM 0 HB2 LYS A 121 4.817 3.239 -8.503 1.00 0.00 H new ATOM 0 HB3 LYS A 121 5.995 4.051 -7.490 1.00 0.00 H new ATOM 0 HG2 LYS A 121 5.362 1.404 -6.437 1.00 0.00 H new ATOM 0 HG3 LYS A 121 5.888 1.309 -8.106 1.00 0.00 H new ATOM 0 HD2 LYS A 121 7.453 3.143 -6.345 1.00 0.00 H new ATOM 0 HD3 LYS A 121 7.598 1.432 -5.992 1.00 0.00 H new ATOM 0 HE2 LYS A 121 8.261 0.961 -8.304 1.00 0.00 H new ATOM 0 HE3 LYS A 121 7.982 2.630 -8.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 10.260 2.482 -8.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 9.709 3.185 -6.988 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 10.114 1.537 -7.028 1.00 0.00 H new ATOM 1908 N ARG A 122 5.108 3.219 -4.332 1.00 0.00 N ATOM 1909 CA ARG A 122 5.891 3.519 -3.152 1.00 0.00 C ATOM 1910 C ARG A 122 6.914 2.416 -2.941 1.00 0.00 C ATOM 1911 O ARG A 122 6.643 1.266 -3.236 1.00 0.00 O ATOM 1912 CB ARG A 122 5.015 3.621 -1.904 1.00 0.00 C ATOM 1913 CG ARG A 122 3.762 4.443 -2.085 1.00 0.00 C ATOM 1914 CD ARG A 122 2.903 4.426 -0.834 1.00 0.00 C ATOM 1915 NE ARG A 122 2.429 3.079 -0.506 1.00 0.00 N ATOM 1916 CZ ARG A 122 1.145 2.726 -0.512 1.00 0.00 C ATOM 1917 NH1 ARG A 122 0.222 3.584 -0.922 1.00 0.00 N ATOM 1918 NH2 ARG A 122 0.784 1.503 -0.141 1.00 0.00 N ATOM 0 H ARG A 122 4.833 2.240 -4.405 1.00 0.00 H new ATOM 0 HA ARG A 122 6.380 4.481 -3.308 1.00 0.00 H new ATOM 0 HB2 ARG A 122 4.733 2.616 -1.590 1.00 0.00 H new ATOM 0 HB3 ARG A 122 5.605 4.054 -1.096 1.00 0.00 H new ATOM 0 HG2 ARG A 122 4.031 5.471 -2.329 1.00 0.00 H new ATOM 0 HG3 ARG A 122 3.189 4.055 -2.927 1.00 0.00 H new ATOM 0 HD2 ARG A 122 3.477 4.821 0.004 1.00 0.00 H new ATOM 0 HD3 ARG A 122 2.047 5.086 -0.974 1.00 0.00 H new ATOM 0 HE ARG A 122 3.121 2.372 -0.259 1.00 0.00 H new ATOM 0 HH11 ARG A 122 0.495 4.516 -1.234 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -0.761 3.312 -0.926 1.00 0.00 H new ATOM 0 HH21 ARG A 122 1.492 0.829 0.150 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -0.201 1.238 -0.147 1.00 0.00 H new ATOM 1932 N VAL A 123 8.082 2.756 -2.457 1.00 0.00 N ATOM 1933 CA VAL A 123 9.059 1.756 -2.092 1.00 0.00 C ATOM 1934 C VAL A 123 9.335 1.847 -0.596 1.00 0.00 C ATOM 1935 O VAL A 123 9.870 2.847 -0.127 1.00 0.00 O ATOM 1936 CB VAL A 123 10.370 1.949 -2.873 1.00 0.00 C ATOM 1937 CG1 VAL A 123 11.437 0.963 -2.415 1.00 0.00 C ATOM 1938 CG2 VAL A 123 10.099 1.787 -4.352 1.00 0.00 C ATOM 0 H VAL A 123 8.382 3.719 -2.306 1.00 0.00 H new ATOM 0 HA VAL A 123 8.659 0.773 -2.340 1.00 0.00 H new ATOM 0 HB VAL A 123 10.748 2.953 -2.680 1.00 0.00 H new ATOM 0 HG11 VAL A 123 12.351 1.125 -2.986 1.00 0.00 H new ATOM 0 HG12 VAL A 123 11.640 1.113 -1.355 1.00 0.00 H new ATOM 0 HG13 VAL A 123 11.084 -0.056 -2.576 1.00 0.00 H new ATOM 0 HG21 VAL A 123 11.026 1.923 -4.909 1.00 0.00 H new ATOM 0 HG22 VAL A 123 9.705 0.789 -4.542 1.00 0.00 H new ATOM 0 HG23 VAL A 123 9.371 2.532 -4.672 1.00 0.00 H new ATOM 1948 N SER A 124 8.988 0.812 0.141 1.00 0.00 N ATOM 1949 CA SER A 124 9.215 0.801 1.575 1.00 0.00 C ATOM 1950 C SER A 124 10.432 -0.047 1.881 1.00 0.00 C ATOM 1951 O SER A 124 10.582 -1.139 1.351 1.00 0.00 O ATOM 1952 CB SER A 124 7.997 0.248 2.317 1.00 0.00 C ATOM 1953 OG SER A 124 6.795 0.825 1.833 1.00 0.00 O ATOM 0 H SER A 124 8.548 -0.032 -0.226 1.00 0.00 H new ATOM 0 HA SER A 124 9.382 1.824 1.912 1.00 0.00 H new ATOM 0 HB2 SER A 124 7.957 -0.835 2.199 1.00 0.00 H new ATOM 0 HB3 SER A 124 8.096 0.449 3.384 1.00 0.00 H new ATOM 0 HG SER A 124 6.033 0.452 2.323 1.00 0.00 H new ATOM 1959 N LYS A 125 11.303 0.455 2.722 1.00 0.00 N ATOM 1960 CA LYS A 125 12.517 -0.251 3.035 1.00 0.00 C ATOM 1961 C LYS A 125 12.579 -0.528 4.537 1.00 0.00 C ATOM 1962 O LYS A 125 12.116 0.277 5.351 1.00 0.00 O ATOM 1963 CB LYS A 125 13.708 0.569 2.519 1.00 0.00 C ATOM 1964 CG LYS A 125 15.047 -0.117 2.659 1.00 0.00 C ATOM 1965 CD LYS A 125 15.667 0.180 4.001 1.00 0.00 C ATOM 1966 CE LYS A 125 16.633 1.350 3.930 1.00 0.00 C ATOM 1967 NZ LYS A 125 17.177 1.697 5.269 1.00 0.00 N ATOM 0 H LYS A 125 11.192 1.349 3.201 1.00 0.00 H new ATOM 0 HA LYS A 125 12.549 -1.222 2.541 1.00 0.00 H new ATOM 0 HB2 LYS A 125 13.543 0.805 1.468 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.741 1.517 3.057 1.00 0.00 H new ATOM 0 HG2 LYS A 125 14.922 -1.194 2.542 1.00 0.00 H new ATOM 0 HG3 LYS A 125 15.715 0.215 1.864 1.00 0.00 H new ATOM 0 HD2 LYS A 125 14.881 0.401 4.723 1.00 0.00 H new ATOM 0 HD3 LYS A 125 16.193 -0.704 4.362 1.00 0.00 H new ATOM 0 HE2 LYS A 125 17.454 1.104 3.257 1.00 0.00 H new ATOM 0 HE3 LYS A 125 16.124 2.217 3.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 17.832 2.500 5.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 16.396 1.956 5.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 17.684 0.878 5.661 1.00 0.00 H new ATOM 1981 N ARG A 126 13.129 -1.691 4.879 1.00 0.00 N ATOM 1982 CA ARG A 126 13.159 -2.190 6.247 1.00 0.00 C ATOM 1983 C ARG A 126 13.788 -1.197 7.198 1.00 0.00 C ATOM 1984 O ARG A 126 14.847 -0.637 6.918 1.00 0.00 O ATOM 1985 CB ARG A 126 13.962 -3.488 6.321 1.00 0.00 C ATOM 1986 CG ARG A 126 13.144 -4.735 6.481 1.00 0.00 C ATOM 1987 CD ARG A 126 12.104 -4.590 7.557 1.00 0.00 C ATOM 1988 NE ARG A 126 12.665 -4.226 8.858 1.00 0.00 N ATOM 1989 CZ ARG A 126 12.402 -4.880 9.989 1.00 0.00 C ATOM 1990 NH1 ARG A 126 11.728 -6.026 9.957 1.00 0.00 N ATOM 1991 NH2 ARG A 126 12.836 -4.398 11.144 1.00 0.00 N ATOM 0 H ARG A 126 13.570 -2.318 4.206 1.00 0.00 H new ATOM 0 HA ARG A 126 12.123 -2.359 6.542 1.00 0.00 H new ATOM 0 HB2 ARG A 126 14.561 -3.579 5.415 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.658 -3.419 7.157 1.00 0.00 H new ATOM 0 HG2 ARG A 126 12.657 -4.973 5.535 1.00 0.00 H new ATOM 0 HG3 ARG A 126 13.800 -5.571 6.721 1.00 0.00 H new ATOM 0 HD2 ARG A 126 11.382 -3.831 7.255 1.00 0.00 H new ATOM 0 HD3 ARG A 126 11.558 -5.528 7.654 1.00 0.00 H new ATOM 0 HE ARG A 126 13.294 -3.425 8.902 1.00 0.00 H new ATOM 0 HH11 ARG A 126 11.411 -6.406 9.065 1.00 0.00 H new ATOM 0 HH12 ARG A 126 11.528 -6.524 10.824 1.00 0.00 H new ATOM 0 HH21 ARG A 126 13.370 -3.529 11.166 1.00 0.00 H new ATOM 0 HH22 ARG A 126 12.637 -4.896 12.012 1.00 0.00 H new ATOM 2005 N ILE A 127 13.148 -0.998 8.330 1.00 0.00 N ATOM 2006 CA ILE A 127 13.735 -0.186 9.362 1.00 0.00 C ATOM 2007 C ILE A 127 14.317 -1.064 10.461 1.00 0.00 C ATOM 2008 O ILE A 127 13.546 -1.806 11.101 1.00 0.00 O ATOM 2009 CB ILE A 127 12.759 0.842 9.955 1.00 0.00 C ATOM 2010 CG1 ILE A 127 11.331 0.338 9.890 1.00 0.00 C ATOM 2011 CG2 ILE A 127 12.890 2.161 9.233 1.00 0.00 C ATOM 2012 CD1 ILE A 127 10.352 1.345 10.399 1.00 0.00 C ATOM 2013 OXT ILE A 127 15.547 -1.031 10.662 1.00 0.00 O ATOM 0 H ILE A 127 12.231 -1.385 8.554 1.00 0.00 H new ATOM 0 HA ILE A 127 14.534 0.385 8.890 1.00 0.00 H new ATOM 0 HB ILE A 127 13.014 0.990 11.004 1.00 0.00 H new ATOM 0 HG12 ILE A 127 11.084 0.083 8.859 1.00 0.00 H new ATOM 0 HG13 ILE A 127 11.244 -0.578 10.474 1.00 0.00 H new ATOM 0 HG21 ILE A 127 12.193 2.881 9.662 1.00 0.00 H new ATOM 0 HG22 ILE A 127 13.909 2.534 9.339 1.00 0.00 H new ATOM 0 HG23 ILE A 127 12.663 2.021 8.176 1.00 0.00 H new ATOM 0 HD11 ILE A 127 9.343 0.938 10.332 1.00 0.00 H new ATOM 0 HD12 ILE A 127 10.580 1.581 11.438 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.418 2.252 9.798 1.00 0.00 H new TER 2025 ILE A 127