USER MOD reduce.3.24.130724 H: found=0, std=0, add=386, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 389 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 126 GLN : amide:sc= 0.86 K(o=1.9,f=-3) USER MOD Set 1.2: A 128 LYS NZ :NH3+ 167:sc= 0.995 (180deg=0) USER MOD Single : A 96 LYS NZ :NH3+ -141:sc= 2.52 (180deg=1.3) USER MOD Single : A 97 TYR OH : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= -0.164 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= 0.649 K(o=0.65,f=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0.0035 USER MOD Single : A 112 GLN : amide:sc= -0.189 X(o=-0.19,f=-0.19) USER MOD Single : A 115 THR OG1 : rot -47:sc= 0.00199 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 LYS NZ :NH3+ -164:sc= 1.23 (180deg=0.918) USER MOD Single : A 123 MET CE :methyl -165:sc= 0 (180deg=-0.137) USER MOD Single : A 129 GLN : amide:sc= 0.418 X(o=0.42,f=-0.001) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 91 4.378 -15.166 -5.637 1.00 1.00 N ATOM 2 CA ALA A 91 5.172 -14.270 -4.748 1.00 1.00 C ATOM 3 C ALA A 91 6.447 -13.763 -5.447 1.00 1.00 C ATOM 4 O ALA A 91 6.951 -14.412 -6.367 1.00 1.00 O ATOM 5 CB ALA A 91 5.512 -14.962 -3.412 1.00 1.00 C ATOM 0 HA ALA A 91 4.551 -13.402 -4.526 1.00 1.00 H new ATOM 0 HB1 ALA A 91 6.091 -14.282 -2.787 1.00 1.00 H new ATOM 0 HB2 ALA A 91 4.590 -15.232 -2.897 1.00 1.00 H new ATOM 0 HB3 ALA A 91 6.096 -15.862 -3.607 1.00 1.00 H new ATOM 13 N ALA A 92 6.971 -12.608 -5.017 1.00 1.00 N ATOM 14 CA ALA A 92 8.183 -11.971 -5.559 1.00 1.00 C ATOM 15 C ALA A 92 8.962 -11.183 -4.483 1.00 1.00 C ATOM 16 O ALA A 92 8.444 -10.912 -3.394 1.00 1.00 O ATOM 17 CB ALA A 92 7.763 -11.054 -6.721 1.00 1.00 C ATOM 0 H ALA A 92 6.551 -12.072 -4.258 1.00 1.00 H new ATOM 0 HA ALA A 92 8.863 -12.745 -5.915 1.00 1.00 H new ATOM 0 HB1 ALA A 92 8.645 -10.570 -7.140 1.00 1.00 H new ATOM 0 HB2 ALA A 92 7.273 -11.647 -7.494 1.00 1.00 H new ATOM 0 HB3 ALA A 92 7.072 -10.295 -6.354 1.00 1.00 H new ATOM 23 N ARG A 93 10.206 -10.791 -4.806 1.00 1.00 N ATOM 24 CA ARG A 93 11.122 -10.030 -3.928 1.00 1.00 C ATOM 25 C ARG A 93 11.949 -9.000 -4.736 1.00 1.00 C ATOM 26 O ARG A 93 13.161 -9.180 -4.906 1.00 1.00 O ATOM 27 CB ARG A 93 11.971 -11.031 -3.112 1.00 1.00 C ATOM 28 CG ARG A 93 12.703 -10.363 -1.934 1.00 1.00 C ATOM 29 CD ARG A 93 13.545 -11.361 -1.128 1.00 1.00 C ATOM 30 NE ARG A 93 12.707 -12.338 -0.400 1.00 1.00 N ATOM 31 CZ ARG A 93 13.127 -13.398 0.272 1.00 1.00 C ATOM 32 NH1 ARG A 93 14.390 -13.699 0.370 1.00 1.00 N ATOM 33 NH2 ARG A 93 12.272 -14.183 0.867 1.00 1.00 N ATOM 0 H ARG A 93 10.619 -11.000 -5.715 1.00 1.00 H new ATOM 0 HA ARG A 93 10.559 -9.427 -3.216 1.00 1.00 H new ATOM 0 HB2 ARG A 93 11.326 -11.824 -2.732 1.00 1.00 H new ATOM 0 HB3 ARG A 93 12.702 -11.502 -3.769 1.00 1.00 H new ATOM 0 HG2 ARG A 93 13.348 -9.570 -2.313 1.00 1.00 H new ATOM 0 HG3 ARG A 93 11.973 -9.893 -1.276 1.00 1.00 H new ATOM 0 HD2 ARG A 93 14.218 -11.892 -1.801 1.00 1.00 H new ATOM 0 HD3 ARG A 93 14.168 -10.818 -0.417 1.00 1.00 H new ATOM 0 HE ARG A 93 11.700 -12.178 -0.418 1.00 1.00 H new ATOM 0 HH11 ARG A 93 15.091 -13.110 -0.079 1.00 1.00 H new ATOM 0 HH12 ARG A 93 14.678 -14.524 0.896 1.00 1.00 H new ATOM 0 HH21 ARG A 93 11.273 -13.981 0.816 1.00 1.00 H new ATOM 0 HH22 ARG A 93 12.602 -14.998 1.383 1.00 1.00 H new ATOM 47 N PRO A 94 11.304 -7.960 -5.308 1.00 1.00 N ATOM 48 CA PRO A 94 11.975 -6.948 -6.132 1.00 1.00 C ATOM 49 C PRO A 94 12.929 -6.050 -5.320 1.00 1.00 C ATOM 50 O PRO A 94 12.832 -5.945 -4.095 1.00 1.00 O ATOM 51 CB PRO A 94 10.838 -6.143 -6.775 1.00 1.00 C ATOM 52 CG PRO A 94 9.707 -6.246 -5.753 1.00 1.00 C ATOM 53 CD PRO A 94 9.880 -7.656 -5.191 1.00 1.00 C ATOM 0 HA PRO A 94 12.620 -7.413 -6.877 1.00 1.00 H new ATOM 0 HB2 PRO A 94 11.128 -5.107 -6.949 1.00 1.00 H new ATOM 0 HB3 PRO A 94 10.547 -6.559 -7.739 1.00 1.00 H new ATOM 0 HG2 PRO A 94 9.796 -5.488 -4.975 1.00 1.00 H new ATOM 0 HG3 PRO A 94 8.730 -6.114 -6.217 1.00 1.00 H new ATOM 0 HD2 PRO A 94 9.554 -7.705 -4.152 1.00 1.00 H new ATOM 0 HD3 PRO A 94 9.280 -8.375 -5.748 1.00 1.00 H new ATOM 61 N ALA A 95 13.843 -5.372 -6.021 1.00 1.00 N ATOM 62 CA ALA A 95 14.847 -4.463 -5.451 1.00 1.00 C ATOM 63 C ALA A 95 15.227 -3.326 -6.425 1.00 1.00 C ATOM 64 O ALA A 95 14.864 -3.355 -7.603 1.00 1.00 O ATOM 65 CB ALA A 95 16.075 -5.303 -5.062 1.00 1.00 C ATOM 0 H ALA A 95 13.908 -5.442 -7.037 1.00 1.00 H new ATOM 0 HA ALA A 95 14.432 -3.971 -4.572 1.00 1.00 H new ATOM 0 HB1 ALA A 95 16.839 -4.654 -4.635 1.00 1.00 H new ATOM 0 HB2 ALA A 95 15.784 -6.054 -4.327 1.00 1.00 H new ATOM 0 HB3 ALA A 95 16.473 -5.798 -5.948 1.00 1.00 H new ATOM 71 N LYS A 96 16.002 -2.349 -5.931 1.00 1.00 N ATOM 72 CA LYS A 96 16.482 -1.161 -6.658 1.00 1.00 C ATOM 73 C LYS A 96 18.012 -1.056 -6.694 1.00 1.00 C ATOM 74 O LYS A 96 18.554 -0.511 -7.653 1.00 1.00 O ATOM 75 CB LYS A 96 15.816 0.087 -6.043 1.00 1.00 C ATOM 76 CG LYS A 96 16.123 1.382 -6.815 1.00 1.00 C ATOM 77 CD LYS A 96 15.427 2.621 -6.225 1.00 1.00 C ATOM 78 CE LYS A 96 13.891 2.634 -6.294 1.00 1.00 C ATOM 79 NZ LYS A 96 13.382 2.599 -7.694 1.00 1.00 N ATOM 0 H LYS A 96 16.328 -2.366 -4.965 1.00 1.00 H new ATOM 0 HA LYS A 96 16.193 -1.247 -7.705 1.00 1.00 H new ATOM 0 HB2 LYS A 96 14.737 -0.063 -6.013 1.00 1.00 H new ATOM 0 HB3 LYS A 96 16.151 0.199 -5.012 1.00 1.00 H new ATOM 0 HG2 LYS A 96 17.200 1.547 -6.820 1.00 1.00 H new ATOM 0 HG3 LYS A 96 15.814 1.260 -7.853 1.00 1.00 H new ATOM 0 HD2 LYS A 96 15.724 2.716 -5.180 1.00 1.00 H new ATOM 0 HD3 LYS A 96 15.801 3.504 -6.744 1.00 1.00 H new ATOM 0 HE2 LYS A 96 13.499 1.777 -5.747 1.00 1.00 H new ATOM 0 HE3 LYS A 96 13.516 3.528 -5.797 1.00 1.00 H new ATOM 0 HZ1 LYS A 96 12.553 3.222 -7.778 1.00 1.00 H new ATOM 0 HZ2 LYS A 96 14.127 2.925 -8.342 1.00 1.00 H new ATOM 0 HZ3 LYS A 96 13.110 1.626 -7.940 1.00 1.00 H new ATOM 93 N TYR A 97 18.705 -1.651 -5.726 1.00 1.00 N ATOM 94 CA TYR A 97 20.166 -1.671 -5.635 1.00 1.00 C ATOM 95 C TYR A 97 20.673 -3.068 -5.246 1.00 1.00 C ATOM 96 O TYR A 97 19.971 -3.821 -4.570 1.00 1.00 O ATOM 97 CB TYR A 97 20.641 -0.645 -4.589 1.00 1.00 C ATOM 98 CG TYR A 97 20.018 0.734 -4.690 1.00 1.00 C ATOM 99 CD1 TYR A 97 20.588 1.708 -5.530 1.00 1.00 C ATOM 100 CD2 TYR A 97 18.867 1.045 -3.938 1.00 1.00 C ATOM 101 CE1 TYR A 97 19.997 2.978 -5.645 1.00 1.00 C ATOM 102 CE2 TYR A 97 18.300 2.332 -4.017 1.00 1.00 C ATOM 103 CZ TYR A 97 18.863 3.304 -4.875 1.00 1.00 C ATOM 104 OH TYR A 97 18.322 4.551 -4.964 1.00 1.00 O ATOM 0 H TYR A 97 18.253 -2.148 -4.959 1.00 1.00 H new ATOM 0 HA TYR A 97 20.570 -1.413 -6.614 1.00 1.00 H new ATOM 0 HB2 TYR A 97 20.435 -1.044 -3.596 1.00 1.00 H new ATOM 0 HB3 TYR A 97 21.723 -0.542 -4.673 1.00 1.00 H new ATOM 0 HD1 TYR A 97 21.483 1.479 -6.089 1.00 1.00 H new ATOM 0 HD2 TYR A 97 18.420 0.296 -3.301 1.00 1.00 H new ATOM 0 HE1 TYR A 97 20.413 3.706 -6.325 1.00 1.00 H new ATOM 0 HE2 TYR A 97 17.433 2.577 -3.421 1.00 1.00 H new ATOM 0 HH TYR A 97 17.545 4.614 -4.370 1.00 1.00 H new ATOM 114 N SER A 98 21.913 -3.376 -5.621 1.00 1.00 N ATOM 115 CA SER A 98 22.609 -4.649 -5.382 1.00 1.00 C ATOM 116 C SER A 98 24.072 -4.381 -5.002 1.00 1.00 C ATOM 117 O SER A 98 24.706 -3.491 -5.575 1.00 1.00 O ATOM 118 CB SER A 98 22.565 -5.509 -6.649 1.00 1.00 C ATOM 119 OG SER A 98 21.304 -6.141 -6.772 1.00 1.00 O ATOM 0 H SER A 98 22.496 -2.710 -6.128 1.00 1.00 H new ATOM 0 HA SER A 98 22.113 -5.175 -4.566 1.00 1.00 H new ATOM 0 HB2 SER A 98 22.755 -4.888 -7.525 1.00 1.00 H new ATOM 0 HB3 SER A 98 23.354 -6.260 -6.614 1.00 1.00 H new ATOM 0 HG SER A 98 21.289 -6.686 -7.587 1.00 1.00 H new ATOM 125 N TYR A 99 24.606 -5.121 -4.022 1.00 1.00 N ATOM 126 CA TYR A 99 25.917 -4.836 -3.423 1.00 1.00 C ATOM 127 C TYR A 99 26.716 -6.082 -2.997 1.00 1.00 C ATOM 128 O TYR A 99 26.215 -7.210 -2.988 1.00 1.00 O ATOM 129 CB TYR A 99 25.737 -3.821 -2.280 1.00 1.00 C ATOM 130 CG TYR A 99 24.916 -4.274 -1.083 1.00 1.00 C ATOM 131 CD1 TYR A 99 23.517 -4.111 -1.078 1.00 1.00 C ATOM 132 CD2 TYR A 99 25.566 -4.781 0.058 1.00 1.00 C ATOM 133 CE1 TYR A 99 22.779 -4.395 0.086 1.00 1.00 C ATOM 134 CE2 TYR A 99 24.832 -5.061 1.227 1.00 1.00 C ATOM 135 CZ TYR A 99 23.436 -4.851 1.247 1.00 1.00 C ATOM 136 OH TYR A 99 22.714 -5.102 2.375 1.00 1.00 O ATOM 0 H TYR A 99 24.141 -5.935 -3.621 1.00 1.00 H new ATOM 0 HA TYR A 99 26.542 -4.399 -4.202 1.00 1.00 H new ATOM 0 HB2 TYR A 99 26.726 -3.532 -1.924 1.00 1.00 H new ATOM 0 HB3 TYR A 99 25.272 -2.925 -2.691 1.00 1.00 H new ATOM 0 HD1 TYR A 99 23.010 -3.768 -1.968 1.00 1.00 H new ATOM 0 HD2 TYR A 99 26.632 -4.956 0.037 1.00 1.00 H new ATOM 0 HE1 TYR A 99 21.707 -4.263 0.090 1.00 1.00 H new ATOM 0 HE2 TYR A 99 25.336 -5.435 2.106 1.00 1.00 H new ATOM 0 HH TYR A 99 23.314 -5.410 3.086 1.00 1.00 H new ATOM 146 N VAL A 100 27.988 -5.853 -2.649 1.00 1.00 N ATOM 147 CA VAL A 100 29.054 -6.851 -2.411 1.00 1.00 C ATOM 148 C VAL A 100 29.579 -6.766 -0.968 1.00 1.00 C ATOM 149 O VAL A 100 29.476 -5.717 -0.334 1.00 1.00 O ATOM 150 CB VAL A 100 30.200 -6.575 -3.423 1.00 1.00 C ATOM 151 CG1 VAL A 100 31.449 -7.453 -3.251 1.00 1.00 C ATOM 152 CG2 VAL A 100 29.718 -6.771 -4.867 1.00 1.00 C ATOM 0 H VAL A 100 28.330 -4.901 -2.515 1.00 1.00 H new ATOM 0 HA VAL A 100 28.657 -7.856 -2.551 1.00 1.00 H new ATOM 0 HB VAL A 100 30.481 -5.543 -3.214 1.00 1.00 H new ATOM 0 HG11 VAL A 100 32.190 -7.183 -4.004 1.00 1.00 H new ATOM 0 HG12 VAL A 100 31.869 -7.298 -2.257 1.00 1.00 H new ATOM 0 HG13 VAL A 100 31.176 -8.502 -3.370 1.00 1.00 H new ATOM 0 HG21 VAL A 100 30.540 -6.572 -5.555 1.00 1.00 H new ATOM 0 HG22 VAL A 100 29.374 -7.797 -5.000 1.00 1.00 H new ATOM 0 HG23 VAL A 100 28.897 -6.084 -5.073 1.00 1.00 H new ATOM 162 N ASP A 101 30.190 -7.851 -0.471 1.00 1.00 N ATOM 163 CA ASP A 101 30.931 -7.853 0.805 1.00 1.00 C ATOM 164 C ASP A 101 32.346 -8.455 0.691 1.00 1.00 C ATOM 165 O ASP A 101 33.294 -7.832 1.172 1.00 1.00 O ATOM 166 CB ASP A 101 30.101 -8.563 1.884 1.00 1.00 C ATOM 167 CG ASP A 101 30.799 -8.535 3.257 1.00 1.00 C ATOM 168 OD1 ASP A 101 30.859 -7.454 3.889 1.00 1.00 O ATOM 169 OD2 ASP A 101 31.278 -9.601 3.714 1.00 1.00 O ATOM 0 H ASP A 101 30.186 -8.756 -0.942 1.00 1.00 H new ATOM 0 HA ASP A 101 31.084 -6.813 1.093 1.00 1.00 H new ATOM 0 HB2 ASP A 101 29.124 -8.085 1.963 1.00 1.00 H new ATOM 0 HB3 ASP A 101 29.927 -9.597 1.586 1.00 1.00 H new ATOM 174 N GLU A 102 32.531 -9.610 0.025 1.00 1.00 N ATOM 175 CA GLU A 102 33.854 -10.236 -0.124 1.00 1.00 C ATOM 176 C GLU A 102 34.059 -11.034 -1.429 1.00 1.00 C ATOM 177 O GLU A 102 35.011 -10.754 -2.161 1.00 1.00 O ATOM 178 CB GLU A 102 34.093 -11.122 1.113 1.00 1.00 C ATOM 179 CG GLU A 102 35.493 -11.734 1.123 1.00 1.00 C ATOM 180 CD GLU A 102 35.715 -12.643 2.349 1.00 1.00 C ATOM 181 OE1 GLU A 102 35.422 -13.861 2.270 1.00 1.00 O ATOM 182 OE2 GLU A 102 36.207 -12.152 3.396 1.00 1.00 O ATOM 0 H GLU A 102 31.775 -10.130 -0.420 1.00 1.00 H new ATOM 0 HA GLU A 102 34.589 -9.434 -0.195 1.00 1.00 H new ATOM 0 HB2 GLU A 102 33.952 -10.528 2.016 1.00 1.00 H new ATOM 0 HB3 GLU A 102 33.350 -11.919 1.136 1.00 1.00 H new ATOM 0 HG2 GLU A 102 35.643 -12.312 0.211 1.00 1.00 H new ATOM 0 HG3 GLU A 102 36.237 -10.938 1.122 1.00 1.00 H new ATOM 189 N ASN A 103 33.180 -11.996 -1.749 1.00 1.00 N ATOM 190 CA ASN A 103 33.393 -12.966 -2.836 1.00 1.00 C ATOM 191 C ASN A 103 32.511 -12.744 -4.084 1.00 1.00 C ATOM 192 O ASN A 103 32.579 -13.522 -5.040 1.00 1.00 O ATOM 193 CB ASN A 103 33.255 -14.388 -2.251 1.00 1.00 C ATOM 194 CG ASN A 103 34.245 -14.628 -1.122 1.00 1.00 C ATOM 195 OD1 ASN A 103 35.447 -14.718 -1.330 1.00 1.00 O ATOM 196 ND2 ASN A 103 33.787 -14.696 0.108 1.00 1.00 N ATOM 0 H ASN A 103 32.295 -12.124 -1.258 1.00 1.00 H new ATOM 0 HA ASN A 103 34.401 -12.818 -3.223 1.00 1.00 H new ATOM 0 HB2 ASN A 103 32.240 -14.533 -1.882 1.00 1.00 H new ATOM 0 HB3 ASN A 103 33.416 -15.123 -3.039 1.00 1.00 H new ATOM 0 HD21 ASN A 103 34.433 -14.824 0.887 1.00 1.00 H new ATOM 0 HD22 ASN A 103 32.785 -14.621 0.284 1.00 1.00 H new ATOM 203 N GLY A 104 31.684 -11.693 -4.085 1.00 1.00 N ATOM 204 CA GLY A 104 30.757 -11.352 -5.176 1.00 1.00 C ATOM 205 C GLY A 104 29.525 -10.583 -4.690 1.00 1.00 C ATOM 206 O GLY A 104 29.411 -10.267 -3.505 1.00 1.00 O ATOM 0 H GLY A 104 31.638 -11.036 -3.306 1.00 1.00 H new ATOM 0 HA2 GLY A 104 31.283 -10.753 -5.920 1.00 1.00 H new ATOM 0 HA3 GLY A 104 30.436 -12.267 -5.673 1.00 1.00 H new ATOM 210 N GLU A 105 28.593 -10.267 -5.597 1.00 1.00 N ATOM 211 CA GLU A 105 27.295 -9.681 -5.222 1.00 1.00 C ATOM 212 C GLU A 105 26.576 -10.597 -4.224 1.00 1.00 C ATOM 213 O GLU A 105 26.349 -11.781 -4.490 1.00 1.00 O ATOM 214 CB GLU A 105 26.409 -9.391 -6.438 1.00 1.00 C ATOM 215 CG GLU A 105 27.000 -8.297 -7.335 1.00 1.00 C ATOM 216 CD GLU A 105 26.079 -8.011 -8.536 1.00 1.00 C ATOM 217 OE1 GLU A 105 26.159 -8.744 -9.554 1.00 1.00 O ATOM 218 OE2 GLU A 105 25.270 -7.053 -8.472 1.00 1.00 O ATOM 0 H GLU A 105 28.712 -10.407 -6.600 1.00 1.00 H new ATOM 0 HA GLU A 105 27.493 -8.720 -4.748 1.00 1.00 H new ATOM 0 HB2 GLU A 105 26.280 -10.305 -7.018 1.00 1.00 H new ATOM 0 HB3 GLU A 105 25.419 -9.086 -6.100 1.00 1.00 H new ATOM 0 HG2 GLU A 105 27.143 -7.385 -6.756 1.00 1.00 H new ATOM 0 HG3 GLU A 105 27.983 -8.605 -7.691 1.00 1.00 H new ATOM 225 N THR A 106 26.234 -10.030 -3.066 1.00 1.00 N ATOM 226 CA THR A 106 25.757 -10.764 -1.895 1.00 1.00 C ATOM 227 C THR A 106 24.336 -10.409 -1.449 1.00 1.00 C ATOM 228 O THR A 106 23.576 -11.304 -1.063 1.00 1.00 O ATOM 229 CB THR A 106 26.777 -10.633 -0.754 1.00 1.00 C ATOM 230 OG1 THR A 106 26.506 -11.589 0.250 1.00 1.00 O ATOM 231 CG2 THR A 106 26.830 -9.254 -0.090 1.00 1.00 C ATOM 0 H THR A 106 26.283 -9.023 -2.914 1.00 1.00 H new ATOM 0 HA THR A 106 25.678 -11.810 -2.193 1.00 1.00 H new ATOM 0 HB THR A 106 27.745 -10.796 -1.227 1.00 1.00 H new ATOM 0 HG1 THR A 106 27.162 -11.499 0.973 1.00 1.00 H new ATOM 0 HG21 THR A 106 27.579 -9.260 0.702 1.00 1.00 H new ATOM 0 HG22 THR A 106 27.095 -8.502 -0.833 1.00 1.00 H new ATOM 0 HG23 THR A 106 25.854 -9.017 0.334 1.00 1.00 H new ATOM 239 N LYS A 107 23.946 -9.128 -1.531 1.00 1.00 N ATOM 240 CA LYS A 107 22.676 -8.604 -0.980 1.00 1.00 C ATOM 241 C LYS A 107 22.098 -7.466 -1.831 1.00 1.00 C ATOM 242 O LYS A 107 22.758 -6.952 -2.735 1.00 1.00 O ATOM 243 CB LYS A 107 22.896 -8.143 0.478 1.00 1.00 C ATOM 244 CG LYS A 107 22.998 -9.306 1.477 1.00 1.00 C ATOM 245 CD LYS A 107 23.134 -8.799 2.919 1.00 1.00 C ATOM 246 CE LYS A 107 23.238 -9.987 3.888 1.00 1.00 C ATOM 247 NZ LYS A 107 23.351 -9.540 5.303 1.00 1.00 N ATOM 0 H LYS A 107 24.510 -8.411 -1.988 1.00 1.00 H new ATOM 0 HA LYS A 107 21.943 -9.411 -1.000 1.00 1.00 H new ATOM 0 HB2 LYS A 107 23.808 -7.549 0.530 1.00 1.00 H new ATOM 0 HB3 LYS A 107 22.074 -7.491 0.773 1.00 1.00 H new ATOM 0 HG2 LYS A 107 22.113 -9.937 1.394 1.00 1.00 H new ATOM 0 HG3 LYS A 107 23.857 -9.928 1.226 1.00 1.00 H new ATOM 0 HD2 LYS A 107 24.018 -8.168 3.009 1.00 1.00 H new ATOM 0 HD3 LYS A 107 22.274 -8.182 3.179 1.00 1.00 H new ATOM 0 HE2 LYS A 107 22.360 -10.624 3.777 1.00 1.00 H new ATOM 0 HE3 LYS A 107 24.106 -10.593 3.628 1.00 1.00 H new ATOM 0 HZ1 LYS A 107 23.419 -10.371 5.925 1.00 1.00 H new ATOM 0 HZ2 LYS A 107 24.202 -8.953 5.415 1.00 1.00 H new ATOM 0 HZ3 LYS A 107 22.511 -8.983 5.559 1.00 1.00 H new ATOM 261 N THR A 108 20.857 -7.082 -1.534 1.00 1.00 N ATOM 262 CA THR A 108 20.060 -6.105 -2.298 1.00 1.00 C ATOM 263 C THR A 108 19.285 -5.146 -1.383 1.00 1.00 C ATOM 264 O THR A 108 19.118 -5.404 -0.186 1.00 1.00 O ATOM 265 CB THR A 108 19.074 -6.810 -3.253 1.00 1.00 C ATOM 266 OG1 THR A 108 18.092 -7.512 -2.512 1.00 1.00 O ATOM 267 CG2 THR A 108 19.753 -7.818 -4.178 1.00 1.00 C ATOM 0 H THR A 108 20.355 -7.452 -0.727 1.00 1.00 H new ATOM 0 HA THR A 108 20.771 -5.521 -2.882 1.00 1.00 H new ATOM 0 HB THR A 108 18.633 -6.019 -3.860 1.00 1.00 H new ATOM 0 HG1 THR A 108 17.471 -7.954 -3.128 1.00 1.00 H new ATOM 0 HG21 THR A 108 19.006 -8.279 -4.824 1.00 1.00 H new ATOM 0 HG22 THR A 108 20.496 -7.307 -4.790 1.00 1.00 H new ATOM 0 HG23 THR A 108 20.242 -8.588 -3.581 1.00 1.00 H new ATOM 275 N TRP A 109 18.819 -4.021 -1.940 1.00 1.00 N ATOM 276 CA TRP A 109 18.107 -2.959 -1.212 1.00 1.00 C ATOM 277 C TRP A 109 17.082 -2.245 -2.109 1.00 1.00 C ATOM 278 O TRP A 109 17.186 -2.273 -3.335 1.00 1.00 O ATOM 279 CB TRP A 109 19.158 -1.990 -0.636 1.00 1.00 C ATOM 280 CG TRP A 109 18.648 -0.800 0.124 1.00 1.00 C ATOM 281 CD1 TRP A 109 17.755 -0.830 1.143 1.00 1.00 C ATOM 282 CD2 TRP A 109 19.038 0.603 -0.016 1.00 1.00 C ATOM 283 NE1 TRP A 109 17.518 0.453 1.589 1.00 1.00 N ATOM 284 CE2 TRP A 109 18.306 1.374 0.938 1.00 1.00 C ATOM 285 CE3 TRP A 109 19.956 1.300 -0.832 1.00 1.00 C ATOM 286 CZ2 TRP A 109 18.465 2.762 1.068 1.00 1.00 C ATOM 287 CZ3 TRP A 109 20.119 2.695 -0.712 1.00 1.00 C ATOM 288 CH2 TRP A 109 19.379 3.426 0.233 1.00 1.00 C ATOM 0 H TRP A 109 18.928 -3.818 -2.933 1.00 1.00 H new ATOM 0 HA TRP A 109 17.528 -3.390 -0.395 1.00 1.00 H new ATOM 0 HB2 TRP A 109 19.815 -2.557 0.024 1.00 1.00 H new ATOM 0 HB3 TRP A 109 19.771 -1.627 -1.461 1.00 1.00 H new ATOM 0 HD1 TRP A 109 17.299 -1.723 1.544 1.00 1.00 H new ATOM 0 HE1 TRP A 109 16.841 0.691 2.314 1.00 1.00 H new ATOM 0 HE3 TRP A 109 20.542 0.756 -1.559 1.00 1.00 H new ATOM 0 HZ2 TRP A 109 17.893 3.312 1.800 1.00 1.00 H new ATOM 0 HZ3 TRP A 109 20.820 3.208 -1.353 1.00 1.00 H new ATOM 0 HH2 TRP A 109 19.513 4.494 0.317 1.00 1.00 H new ATOM 299 N THR A 110 16.083 -1.599 -1.504 1.00 1.00 N ATOM 300 CA THR A 110 14.911 -0.999 -2.175 1.00 1.00 C ATOM 301 C THR A 110 14.930 0.535 -2.221 1.00 1.00 C ATOM 302 O THR A 110 14.239 1.127 -3.050 1.00 1.00 O ATOM 303 CB THR A 110 13.634 -1.409 -1.425 1.00 1.00 C ATOM 304 OG1 THR A 110 13.777 -1.041 -0.063 1.00 1.00 O ATOM 305 CG2 THR A 110 13.382 -2.914 -1.486 1.00 1.00 C ATOM 0 H THR A 110 16.061 -1.470 -0.492 1.00 1.00 H new ATOM 0 HA THR A 110 14.940 -1.366 -3.201 1.00 1.00 H new ATOM 0 HB THR A 110 12.792 -0.905 -1.900 1.00 1.00 H new ATOM 0 HG1 THR A 110 12.969 -1.294 0.431 1.00 1.00 H new ATOM 0 HG21 THR A 110 12.468 -3.152 -0.941 1.00 1.00 H new ATOM 0 HG22 THR A 110 13.276 -3.223 -2.526 1.00 1.00 H new ATOM 0 HG23 THR A 110 14.222 -3.442 -1.034 1.00 1.00 H new ATOM 313 N GLY A 111 15.702 1.180 -1.339 1.00 1.00 N ATOM 314 CA GLY A 111 15.717 2.636 -1.137 1.00 1.00 C ATOM 315 C GLY A 111 14.978 3.102 0.129 1.00 1.00 C ATOM 316 O GLY A 111 15.118 4.263 0.521 1.00 1.00 O ATOM 0 H GLY A 111 16.354 0.690 -0.727 1.00 1.00 H new ATOM 0 HA2 GLY A 111 16.752 2.974 -1.086 1.00 1.00 H new ATOM 0 HA3 GLY A 111 15.267 3.117 -2.005 1.00 1.00 H new ATOM 320 N GLN A 112 14.199 2.224 0.779 1.00 1.00 N ATOM 321 CA GLN A 112 13.535 2.517 2.059 1.00 1.00 C ATOM 322 C GLN A 112 14.491 2.293 3.249 1.00 1.00 C ATOM 323 O GLN A 112 15.370 1.428 3.207 1.00 1.00 O ATOM 324 CB GLN A 112 12.265 1.657 2.214 1.00 1.00 C ATOM 325 CG GLN A 112 11.073 2.146 1.367 1.00 1.00 C ATOM 326 CD GLN A 112 11.233 1.923 -0.137 1.00 1.00 C ATOM 327 OE1 GLN A 112 11.133 0.814 -0.644 1.00 1.00 O ATOM 328 NE2 GLN A 112 11.462 2.961 -0.918 1.00 1.00 N ATOM 0 H GLN A 112 14.011 1.285 0.429 1.00 1.00 H new ATOM 0 HA GLN A 112 13.247 3.568 2.057 1.00 1.00 H new ATOM 0 HB2 GLN A 112 12.498 0.629 1.937 1.00 1.00 H new ATOM 0 HB3 GLN A 112 11.972 1.645 3.264 1.00 1.00 H new ATOM 0 HG2 GLN A 112 10.170 1.636 1.704 1.00 1.00 H new ATOM 0 HG3 GLN A 112 10.925 3.210 1.550 1.00 1.00 H new ATOM 0 HE21 GLN A 112 11.549 3.894 -0.514 1.00 1.00 H new ATOM 0 HE22 GLN A 112 11.553 2.831 -1.926 1.00 1.00 H new ATOM 337 N GLY A 113 14.302 3.063 4.328 1.00 1.00 N ATOM 338 CA GLY A 113 15.225 3.095 5.473 1.00 1.00 C ATOM 339 C GLY A 113 16.585 3.739 5.148 1.00 1.00 C ATOM 340 O GLY A 113 16.786 4.307 4.067 1.00 1.00 O ATOM 0 H GLY A 113 13.501 3.685 4.433 1.00 1.00 H new ATOM 0 HA2 GLY A 113 14.758 3.644 6.291 1.00 1.00 H new ATOM 0 HA3 GLY A 113 15.389 2.077 5.826 1.00 1.00 H new ATOM 344 N ARG A 114 17.530 3.675 6.097 1.00 1.00 N ATOM 345 CA ARG A 114 18.917 4.139 5.896 1.00 1.00 C ATOM 346 C ARG A 114 19.669 3.298 4.848 1.00 1.00 C ATOM 347 O ARG A 114 19.411 2.101 4.693 1.00 1.00 O ATOM 348 CB ARG A 114 19.672 4.195 7.238 1.00 1.00 C ATOM 349 CG ARG A 114 19.901 2.825 7.904 1.00 1.00 C ATOM 350 CD ARG A 114 20.648 2.991 9.235 1.00 1.00 C ATOM 351 NE ARG A 114 20.893 1.682 9.877 1.00 1.00 N ATOM 352 CZ ARG A 114 20.123 1.048 10.747 1.00 1.00 C ATOM 353 NH1 ARG A 114 18.983 1.536 11.160 1.00 1.00 N ATOM 354 NH2 ARG A 114 20.486 -0.108 11.223 1.00 1.00 N ATOM 0 H ARG A 114 17.357 3.299 7.029 1.00 1.00 H new ATOM 0 HA ARG A 114 18.869 5.151 5.495 1.00 1.00 H new ATOM 0 HB2 ARG A 114 20.639 4.671 7.076 1.00 1.00 H new ATOM 0 HB3 ARG A 114 19.115 4.830 7.927 1.00 1.00 H new ATOM 0 HG2 ARG A 114 18.943 2.334 8.077 1.00 1.00 H new ATOM 0 HG3 ARG A 114 20.474 2.181 7.237 1.00 1.00 H new ATOM 0 HD2 ARG A 114 21.598 3.497 9.062 1.00 1.00 H new ATOM 0 HD3 ARG A 114 20.067 3.625 9.905 1.00 1.00 H new ATOM 0 HE ARG A 114 21.760 1.211 9.618 1.00 1.00 H new ATOM 0 HH11 ARG A 114 18.657 2.437 10.811 1.00 1.00 H new ATOM 0 HH12 ARG A 114 18.419 1.016 11.832 1.00 1.00 H new ATOM 0 HH21 ARG A 114 21.367 -0.528 10.926 1.00 1.00 H new ATOM 0 HH22 ARG A 114 19.890 -0.593 11.893 1.00 1.00 H new ATOM 368 N THR A 115 20.644 3.916 4.178 1.00 1.00 N ATOM 369 CA THR A 115 21.550 3.249 3.224 1.00 1.00 C ATOM 370 C THR A 115 22.331 2.104 3.903 1.00 1.00 C ATOM 371 O THR A 115 22.859 2.321 5.000 1.00 1.00 O ATOM 372 CB THR A 115 22.550 4.263 2.639 1.00 1.00 C ATOM 373 OG1 THR A 115 21.845 5.379 2.132 1.00 1.00 O ATOM 374 CG2 THR A 115 23.385 3.690 1.495 1.00 1.00 C ATOM 0 H THR A 115 20.834 4.913 4.281 1.00 1.00 H new ATOM 0 HA THR A 115 20.938 2.832 2.425 1.00 1.00 H new ATOM 0 HB THR A 115 23.223 4.536 3.452 1.00 1.00 H new ATOM 0 HG1 THR A 115 21.097 5.070 1.580 1.00 1.00 H new ATOM 0 HG21 THR A 115 24.070 4.454 1.126 1.00 1.00 H new ATOM 0 HG22 THR A 115 23.956 2.834 1.855 1.00 1.00 H new ATOM 0 HG23 THR A 115 22.726 3.373 0.687 1.00 1.00 H new ATOM 382 N PRO A 116 22.444 0.904 3.289 1.00 1.00 N ATOM 383 CA PRO A 116 23.288 -0.193 3.777 1.00 1.00 C ATOM 384 C PRO A 116 24.723 0.242 4.113 1.00 1.00 C ATOM 385 O PRO A 116 25.357 0.961 3.339 1.00 1.00 O ATOM 386 CB PRO A 116 23.260 -1.257 2.674 1.00 1.00 C ATOM 387 CG PRO A 116 21.899 -1.040 2.017 1.00 1.00 C ATOM 388 CD PRO A 116 21.709 0.475 2.109 1.00 1.00 C ATOM 0 HA PRO A 116 22.902 -0.575 4.722 1.00 1.00 H new ATOM 0 HB2 PRO A 116 24.076 -1.123 1.964 1.00 1.00 H new ATOM 0 HB3 PRO A 116 23.355 -2.263 3.082 1.00 1.00 H new ATOM 0 HG2 PRO A 116 21.890 -1.386 0.983 1.00 1.00 H new ATOM 0 HG3 PRO A 116 21.108 -1.578 2.540 1.00 1.00 H new ATOM 0 HD2 PRO A 116 22.086 0.970 1.214 1.00 1.00 H new ATOM 0 HD3 PRO A 116 20.653 0.731 2.194 1.00 1.00 H new ATOM 396 N ALA A 117 25.252 -0.215 5.253 1.00 1.00 N ATOM 397 CA ALA A 117 26.523 0.263 5.808 1.00 1.00 C ATOM 398 C ALA A 117 27.705 0.121 4.833 1.00 1.00 C ATOM 399 O ALA A 117 28.473 1.065 4.652 1.00 1.00 O ATOM 400 CB ALA A 117 26.778 -0.471 7.130 1.00 1.00 C ATOM 0 H ALA A 117 24.805 -0.934 5.822 1.00 1.00 H new ATOM 0 HA ALA A 117 26.442 1.335 5.987 1.00 1.00 H new ATOM 0 HB1 ALA A 117 27.720 -0.130 7.560 1.00 1.00 H new ATOM 0 HB2 ALA A 117 25.965 -0.262 7.825 1.00 1.00 H new ATOM 0 HB3 ALA A 117 26.831 -1.544 6.946 1.00 1.00 H new ATOM 406 N VAL A 118 27.830 -1.019 4.141 1.00 1.00 N ATOM 407 CA VAL A 118 28.904 -1.231 3.152 1.00 1.00 C ATOM 408 C VAL A 118 28.760 -0.338 1.910 1.00 1.00 C ATOM 409 O VAL A 118 29.767 0.156 1.410 1.00 1.00 O ATOM 410 CB VAL A 118 29.053 -2.725 2.808 1.00 1.00 C ATOM 411 CG1 VAL A 118 27.860 -3.293 2.032 1.00 1.00 C ATOM 412 CG2 VAL A 118 30.338 -3.016 2.026 1.00 1.00 C ATOM 0 H VAL A 118 27.199 -1.814 4.246 1.00 1.00 H new ATOM 0 HA VAL A 118 29.838 -0.915 3.617 1.00 1.00 H new ATOM 0 HB VAL A 118 29.098 -3.224 3.776 1.00 1.00 H new ATOM 0 HG11 VAL A 118 28.031 -4.349 1.823 1.00 1.00 H new ATOM 0 HG12 VAL A 118 26.953 -3.183 2.627 1.00 1.00 H new ATOM 0 HG13 VAL A 118 27.745 -2.751 1.093 1.00 1.00 H new ATOM 0 HG21 VAL A 118 30.397 -4.082 1.807 1.00 1.00 H new ATOM 0 HG22 VAL A 118 30.331 -2.454 1.092 1.00 1.00 H new ATOM 0 HG23 VAL A 118 31.201 -2.719 2.621 1.00 1.00 H new ATOM 422 N ILE A 119 27.530 -0.037 1.457 1.00 1.00 N ATOM 423 CA ILE A 119 27.293 0.957 0.389 1.00 1.00 C ATOM 424 C ILE A 119 27.750 2.339 0.864 1.00 1.00 C ATOM 425 O ILE A 119 28.556 2.979 0.190 1.00 1.00 O ATOM 426 CB ILE A 119 25.816 0.969 -0.090 1.00 1.00 C ATOM 427 CG1 ILE A 119 25.439 -0.388 -0.731 1.00 1.00 C ATOM 428 CG2 ILE A 119 25.571 2.117 -1.088 1.00 1.00 C ATOM 429 CD1 ILE A 119 24.006 -0.446 -1.285 1.00 1.00 C ATOM 0 H ILE A 119 26.679 -0.470 1.815 1.00 1.00 H new ATOM 0 HA ILE A 119 27.884 0.671 -0.481 1.00 1.00 H new ATOM 0 HB ILE A 119 25.182 1.130 0.781 1.00 1.00 H new ATOM 0 HG12 ILE A 119 26.138 -0.602 -1.539 1.00 1.00 H new ATOM 0 HG13 ILE A 119 25.561 -1.175 0.013 1.00 1.00 H new ATOM 0 HG21 ILE A 119 24.529 2.104 -1.409 1.00 1.00 H new ATOM 0 HG22 ILE A 119 25.791 3.070 -0.607 1.00 1.00 H new ATOM 0 HG23 ILE A 119 26.219 1.990 -1.955 1.00 1.00 H new ATOM 0 HD11 ILE A 119 23.822 -1.430 -1.716 1.00 1.00 H new ATOM 0 HD12 ILE A 119 23.296 -0.266 -0.478 1.00 1.00 H new ATOM 0 HD13 ILE A 119 23.882 0.316 -2.054 1.00 1.00 H new ATOM 441 N LYS A 120 27.324 2.776 2.058 1.00 1.00 N ATOM 442 CA LYS A 120 27.752 4.050 2.669 1.00 1.00 C ATOM 443 C LYS A 120 29.278 4.147 2.737 1.00 1.00 C ATOM 444 O LYS A 120 29.856 5.143 2.303 1.00 1.00 O ATOM 445 CB LYS A 120 27.081 4.203 4.051 1.00 1.00 C ATOM 446 CG LYS A 120 27.674 5.346 4.893 1.00 1.00 C ATOM 447 CD LYS A 120 26.856 5.586 6.170 1.00 1.00 C ATOM 448 CE LYS A 120 27.479 6.725 6.992 1.00 1.00 C ATOM 449 NZ LYS A 120 26.710 6.991 8.243 1.00 1.00 N ATOM 0 H LYS A 120 26.666 2.252 2.635 1.00 1.00 H new ATOM 0 HA LYS A 120 27.428 4.882 2.044 1.00 1.00 H new ATOM 0 HB2 LYS A 120 26.014 4.379 3.912 1.00 1.00 H new ATOM 0 HB3 LYS A 120 27.180 3.267 4.601 1.00 1.00 H new ATOM 0 HG2 LYS A 120 28.704 5.107 5.159 1.00 1.00 H new ATOM 0 HG3 LYS A 120 27.701 6.260 4.300 1.00 1.00 H new ATOM 0 HD2 LYS A 120 25.827 5.836 5.910 1.00 1.00 H new ATOM 0 HD3 LYS A 120 26.822 4.674 6.766 1.00 1.00 H new ATOM 0 HE2 LYS A 120 28.508 6.470 7.245 1.00 1.00 H new ATOM 0 HE3 LYS A 120 27.515 7.632 6.388 1.00 1.00 H new ATOM 0 HZ1 LYS A 120 27.161 7.766 8.770 1.00 1.00 H new ATOM 0 HZ2 LYS A 120 25.735 7.259 8.001 1.00 1.00 H new ATOM 0 HZ3 LYS A 120 26.697 6.134 8.831 1.00 1.00 H new ATOM 463 N LYS A 121 29.933 3.091 3.228 1.00 1.00 N ATOM 464 CA LYS A 121 31.392 3.060 3.394 1.00 1.00 C ATOM 465 C LYS A 121 32.130 3.104 2.055 1.00 1.00 C ATOM 466 O LYS A 121 33.080 3.864 1.918 1.00 1.00 O ATOM 467 CB LYS A 121 31.811 1.844 4.245 1.00 1.00 C ATOM 468 CG LYS A 121 33.104 2.148 5.017 1.00 1.00 C ATOM 469 CD LYS A 121 32.821 2.966 6.295 1.00 1.00 C ATOM 470 CE LYS A 121 34.059 3.693 6.854 1.00 1.00 C ATOM 471 NZ LYS A 121 35.228 2.793 7.067 1.00 1.00 N ATOM 0 H LYS A 121 29.468 2.232 3.522 1.00 1.00 H new ATOM 0 HA LYS A 121 31.685 3.964 3.928 1.00 1.00 H new ATOM 0 HB2 LYS A 121 31.014 1.590 4.944 1.00 1.00 H new ATOM 0 HB3 LYS A 121 31.960 0.976 3.602 1.00 1.00 H new ATOM 0 HG2 LYS A 121 33.598 1.214 5.284 1.00 1.00 H new ATOM 0 HG3 LYS A 121 33.791 2.700 4.375 1.00 1.00 H new ATOM 0 HD2 LYS A 121 32.045 3.701 6.080 1.00 1.00 H new ATOM 0 HD3 LYS A 121 32.425 2.300 7.062 1.00 1.00 H new ATOM 0 HE2 LYS A 121 34.344 4.490 6.167 1.00 1.00 H new ATOM 0 HE3 LYS A 121 33.797 4.166 7.800 1.00 1.00 H new ATOM 0 HZ1 LYS A 121 35.921 3.264 7.683 1.00 1.00 H new ATOM 0 HZ2 LYS A 121 34.910 1.911 7.516 1.00 1.00 H new ATOM 0 HZ3 LYS A 121 35.670 2.576 6.151 1.00 1.00 H new ATOM 485 N ALA A 122 31.661 2.366 1.050 1.00 1.00 N ATOM 486 CA ALA A 122 32.221 2.397 -0.300 1.00 1.00 C ATOM 487 C ALA A 122 32.069 3.779 -0.967 1.00 1.00 C ATOM 488 O ALA A 122 33.018 4.283 -1.568 1.00 1.00 O ATOM 489 CB ALA A 122 31.559 1.288 -1.126 1.00 1.00 C ATOM 0 H ALA A 122 30.875 1.724 1.151 1.00 1.00 H new ATOM 0 HA ALA A 122 33.295 2.219 -0.244 1.00 1.00 H new ATOM 0 HB1 ALA A 122 31.965 1.296 -2.138 1.00 1.00 H new ATOM 0 HB2 ALA A 122 31.758 0.321 -0.663 1.00 1.00 H new ATOM 0 HB3 ALA A 122 30.483 1.457 -1.166 1.00 1.00 H new ATOM 495 N MET A 123 30.907 4.426 -0.822 1.00 1.00 N ATOM 496 CA MET A 123 30.689 5.796 -1.306 1.00 1.00 C ATOM 497 C MET A 123 31.625 6.819 -0.635 1.00 1.00 C ATOM 498 O MET A 123 32.196 7.668 -1.320 1.00 1.00 O ATOM 499 CB MET A 123 29.216 6.210 -1.146 1.00 1.00 C ATOM 500 CG MET A 123 28.288 5.401 -2.064 1.00 1.00 C ATOM 501 SD MET A 123 26.619 6.072 -2.287 1.00 1.00 S ATOM 502 CE MET A 123 26.044 6.201 -0.571 1.00 1.00 C ATOM 0 H MET A 123 30.092 4.016 -0.367 1.00 1.00 H new ATOM 0 HA MET A 123 30.935 5.795 -2.368 1.00 1.00 H new ATOM 0 HB2 MET A 123 28.911 6.071 -0.109 1.00 1.00 H new ATOM 0 HB3 MET A 123 29.111 7.272 -1.370 1.00 1.00 H new ATOM 0 HG2 MET A 123 28.759 5.317 -3.043 1.00 1.00 H new ATOM 0 HG3 MET A 123 28.203 4.391 -1.664 1.00 1.00 H new ATOM 0 HE1 MET A 123 24.963 6.340 -0.559 1.00 1.00 H new ATOM 0 HE2 MET A 123 26.298 5.288 -0.032 1.00 1.00 H new ATOM 0 HE3 MET A 123 26.525 7.052 -0.089 1.00 1.00 H new ATOM 512 N GLU A 124 31.851 6.711 0.679 1.00 1.00 N ATOM 513 CA GLU A 124 32.789 7.574 1.412 1.00 1.00 C ATOM 514 C GLU A 124 34.270 7.303 1.072 1.00 1.00 C ATOM 515 O GLU A 124 35.042 8.246 0.888 1.00 1.00 O ATOM 516 CB GLU A 124 32.571 7.413 2.928 1.00 1.00 C ATOM 517 CG GLU A 124 31.272 8.055 3.438 1.00 1.00 C ATOM 518 CD GLU A 124 31.347 9.592 3.399 1.00 1.00 C ATOM 519 OE1 GLU A 124 31.928 10.200 4.333 1.00 1.00 O ATOM 520 OE2 GLU A 124 30.821 10.213 2.444 1.00 1.00 O ATOM 0 H GLU A 124 31.387 6.020 1.268 1.00 1.00 H new ATOM 0 HA GLU A 124 32.577 8.596 1.099 1.00 1.00 H new ATOM 0 HB2 GLU A 124 32.562 6.351 3.174 1.00 1.00 H new ATOM 0 HB3 GLU A 124 33.416 7.855 3.456 1.00 1.00 H new ATOM 0 HG2 GLU A 124 30.434 7.715 2.829 1.00 1.00 H new ATOM 0 HG3 GLU A 124 31.079 7.725 4.459 1.00 1.00 H new ATOM 527 N GLU A 125 34.686 6.033 0.983 1.00 1.00 N ATOM 528 CA GLU A 125 36.093 5.642 0.776 1.00 1.00 C ATOM 529 C GLU A 125 36.569 5.727 -0.687 1.00 1.00 C ATOM 530 O GLU A 125 37.769 5.892 -0.922 1.00 1.00 O ATOM 531 CB GLU A 125 36.326 4.211 1.295 1.00 1.00 C ATOM 532 CG GLU A 125 36.293 4.123 2.830 1.00 1.00 C ATOM 533 CD GLU A 125 36.564 2.705 3.382 1.00 1.00 C ATOM 534 OE1 GLU A 125 36.801 1.743 2.608 1.00 1.00 O ATOM 535 OE2 GLU A 125 36.550 2.542 4.629 1.00 1.00 O ATOM 0 H GLU A 125 34.051 5.238 1.053 1.00 1.00 H new ATOM 0 HA GLU A 125 36.681 6.367 1.338 1.00 1.00 H new ATOM 0 HB2 GLU A 125 35.564 3.550 0.881 1.00 1.00 H new ATOM 0 HB3 GLU A 125 37.290 3.851 0.935 1.00 1.00 H new ATOM 0 HG2 GLU A 125 37.034 4.809 3.239 1.00 1.00 H new ATOM 0 HG3 GLU A 125 35.318 4.459 3.183 1.00 1.00 H new ATOM 542 N GLN A 126 35.660 5.624 -1.669 1.00 1.00 N ATOM 543 CA GLN A 126 36.002 5.483 -3.098 1.00 1.00 C ATOM 544 C GLN A 126 35.319 6.529 -4.008 1.00 1.00 C ATOM 545 O GLN A 126 35.479 6.481 -5.228 1.00 1.00 O ATOM 546 CB GLN A 126 35.691 4.044 -3.569 1.00 1.00 C ATOM 547 CG GLN A 126 36.341 2.949 -2.699 1.00 1.00 C ATOM 548 CD GLN A 126 36.158 1.537 -3.255 1.00 1.00 C ATOM 549 OE1 GLN A 126 35.163 1.195 -3.881 1.00 1.00 O ATOM 550 NE2 GLN A 126 37.108 0.648 -3.049 1.00 1.00 N ATOM 0 H GLN A 126 34.655 5.636 -1.494 1.00 1.00 H new ATOM 0 HA GLN A 126 37.071 5.677 -3.189 1.00 1.00 H new ATOM 0 HB2 GLN A 126 34.611 3.898 -3.572 1.00 1.00 H new ATOM 0 HB3 GLN A 126 36.032 3.927 -4.598 1.00 1.00 H new ATOM 0 HG2 GLN A 126 37.407 3.158 -2.603 1.00 1.00 H new ATOM 0 HG3 GLN A 126 35.916 2.994 -1.696 1.00 1.00 H new ATOM 0 HE21 GLN A 126 37.947 0.909 -2.530 1.00 1.00 H new ATOM 0 HE22 GLN A 126 37.005 -0.301 -3.408 1.00 1.00 H new ATOM 559 N GLY A 127 34.546 7.466 -3.444 1.00 1.00 N ATOM 560 CA GLY A 127 33.846 8.534 -4.181 1.00 1.00 C ATOM 561 C GLY A 127 32.605 8.082 -4.973 1.00 1.00 C ATOM 562 O GLY A 127 31.982 8.903 -5.657 1.00 1.00 O ATOM 0 H GLY A 127 34.384 7.506 -2.438 1.00 1.00 H new ATOM 0 HA2 GLY A 127 33.543 9.304 -3.472 1.00 1.00 H new ATOM 0 HA3 GLY A 127 34.550 8.997 -4.873 1.00 1.00 H new ATOM 566 N LYS A 128 32.243 6.791 -4.887 1.00 1.00 N ATOM 567 CA LYS A 128 31.074 6.181 -5.552 1.00 1.00 C ATOM 568 C LYS A 128 29.751 6.843 -5.146 1.00 1.00 C ATOM 569 O LYS A 128 29.663 7.509 -4.115 1.00 1.00 O ATOM 570 CB LYS A 128 31.058 4.663 -5.282 1.00 1.00 C ATOM 571 CG LYS A 128 32.166 3.945 -6.073 1.00 1.00 C ATOM 572 CD LYS A 128 32.259 2.458 -5.704 1.00 1.00 C ATOM 573 CE LYS A 128 33.292 1.775 -6.613 1.00 1.00 C ATOM 574 NZ LYS A 128 33.622 0.402 -6.137 1.00 1.00 N ATOM 0 H LYS A 128 32.773 6.118 -4.334 1.00 1.00 H new ATOM 0 HA LYS A 128 31.172 6.350 -6.624 1.00 1.00 H new ATOM 0 HB2 LYS A 128 31.191 4.479 -4.216 1.00 1.00 H new ATOM 0 HB3 LYS A 128 30.087 4.252 -5.557 1.00 1.00 H new ATOM 0 HG2 LYS A 128 31.972 4.043 -7.141 1.00 1.00 H new ATOM 0 HG3 LYS A 128 33.123 4.428 -5.878 1.00 1.00 H new ATOM 0 HD2 LYS A 128 32.548 2.348 -4.659 1.00 1.00 H new ATOM 0 HD3 LYS A 128 31.285 1.981 -5.818 1.00 1.00 H new ATOM 0 HE2 LYS A 128 32.904 1.724 -7.630 1.00 1.00 H new ATOM 0 HE3 LYS A 128 34.200 2.376 -6.648 1.00 1.00 H new ATOM 0 HZ1 LYS A 128 34.143 -0.107 -6.879 1.00 1.00 H new ATOM 0 HZ2 LYS A 128 34.210 0.463 -5.281 1.00 1.00 H new ATOM 0 HZ3 LYS A 128 32.744 -0.110 -5.918 1.00 1.00 H new ATOM 588 N GLN A 129 28.712 6.618 -5.944 1.00 1.00 N ATOM 589 CA GLN A 129 27.363 7.182 -5.798 1.00 1.00 C ATOM 590 C GLN A 129 26.311 6.061 -5.920 1.00 1.00 C ATOM 591 O GLN A 129 26.647 4.932 -6.267 1.00 1.00 O ATOM 592 CB GLN A 129 27.155 8.271 -6.871 1.00 1.00 C ATOM 593 CG GLN A 129 28.219 9.388 -6.895 1.00 1.00 C ATOM 594 CD GLN A 129 28.300 10.199 -5.602 1.00 1.00 C ATOM 595 OE1 GLN A 129 27.301 10.631 -5.040 1.00 1.00 O ATOM 596 NE2 GLN A 129 29.486 10.457 -5.086 1.00 1.00 N ATOM 0 H GLN A 129 28.787 6.005 -6.756 1.00 1.00 H new ATOM 0 HA GLN A 129 27.249 7.638 -4.814 1.00 1.00 H new ATOM 0 HB2 GLN A 129 27.133 7.793 -7.850 1.00 1.00 H new ATOM 0 HB3 GLN A 129 26.177 8.727 -6.717 1.00 1.00 H new ATOM 0 HG2 GLN A 129 29.194 8.943 -7.094 1.00 1.00 H new ATOM 0 HG3 GLN A 129 28.003 10.064 -7.722 1.00 1.00 H new ATOM 0 HE21 GLN A 129 30.328 10.105 -5.541 1.00 1.00 H new ATOM 0 HE22 GLN A 129 29.561 11.009 -4.231 1.00 1.00 H new ATOM 605 N LEU A 130 25.023 6.340 -5.668 1.00 1.00 N ATOM 606 CA LEU A 130 23.972 5.305 -5.667 1.00 1.00 C ATOM 607 C LEU A 130 23.860 4.566 -7.015 1.00 1.00 C ATOM 608 O LEU A 130 23.587 3.366 -7.054 1.00 1.00 O ATOM 609 CB LEU A 130 22.608 5.911 -5.264 1.00 1.00 C ATOM 610 CG LEU A 130 22.348 6.219 -3.773 1.00 1.00 C ATOM 611 CD1 LEU A 130 22.647 5.033 -2.854 1.00 1.00 C ATOM 612 CD2 LEU A 130 23.117 7.439 -3.267 1.00 1.00 C ATOM 0 H LEU A 130 24.681 7.278 -5.461 1.00 1.00 H new ATOM 0 HA LEU A 130 24.265 4.563 -4.924 1.00 1.00 H new ATOM 0 HB2 LEU A 130 22.481 6.839 -5.821 1.00 1.00 H new ATOM 0 HB3 LEU A 130 21.829 5.227 -5.602 1.00 1.00 H new ATOM 0 HG LEU A 130 21.281 6.436 -3.732 1.00 1.00 H new ATOM 0 HD11 LEU A 130 22.444 5.314 -1.820 1.00 1.00 H new ATOM 0 HD12 LEU A 130 22.015 4.189 -3.132 1.00 1.00 H new ATOM 0 HD13 LEU A 130 23.695 4.750 -2.954 1.00 1.00 H new ATOM 0 HD21 LEU A 130 22.890 7.601 -2.213 1.00 1.00 H new ATOM 0 HD22 LEU A 130 24.187 7.270 -3.386 1.00 1.00 H new ATOM 0 HD23 LEU A 130 22.823 8.318 -3.840 1.00 1.00 H new ATOM 624 N GLU A 131 24.133 5.254 -8.125 1.00 1.00 N ATOM 625 CA GLU A 131 24.157 4.655 -9.470 1.00 1.00 C ATOM 626 C GLU A 131 25.224 3.554 -9.660 1.00 1.00 C ATOM 627 O GLU A 131 25.056 2.691 -10.523 1.00 1.00 O ATOM 628 CB GLU A 131 24.280 5.744 -10.550 1.00 1.00 C ATOM 629 CG GLU A 131 25.611 6.507 -10.528 1.00 1.00 C ATOM 630 CD GLU A 131 25.638 7.581 -11.631 1.00 1.00 C ATOM 631 OE1 GLU A 131 26.025 7.266 -12.784 1.00 1.00 O ATOM 632 OE2 GLU A 131 25.279 8.752 -11.354 1.00 1.00 O ATOM 0 H GLU A 131 24.346 6.251 -8.121 1.00 1.00 H new ATOM 0 HA GLU A 131 23.200 4.145 -9.582 1.00 1.00 H new ATOM 0 HB2 GLU A 131 24.155 5.283 -11.530 1.00 1.00 H new ATOM 0 HB3 GLU A 131 23.464 6.456 -10.426 1.00 1.00 H new ATOM 0 HG2 GLU A 131 25.752 6.975 -9.554 1.00 1.00 H new ATOM 0 HG3 GLU A 131 26.438 5.811 -10.670 1.00 1.00 H new ATOM 639 N ASP A 132 26.284 3.523 -8.841 1.00 1.00 N ATOM 640 CA ASP A 132 27.278 2.440 -8.825 1.00 1.00 C ATOM 641 C ASP A 132 26.739 1.118 -8.232 1.00 1.00 C ATOM 642 O ASP A 132 27.362 0.066 -8.397 1.00 1.00 O ATOM 643 CB ASP A 132 28.551 2.885 -8.087 1.00 1.00 C ATOM 644 CG ASP A 132 29.284 4.017 -8.830 1.00 1.00 C ATOM 645 OD1 ASP A 132 29.883 3.738 -9.896 1.00 1.00 O ATOM 646 OD2 ASP A 132 29.282 5.172 -8.344 1.00 1.00 O ATOM 0 H ASP A 132 26.478 4.259 -8.162 1.00 1.00 H new ATOM 0 HA ASP A 132 27.518 2.231 -9.867 1.00 1.00 H new ATOM 0 HB2 ASP A 132 28.289 3.220 -7.083 1.00 1.00 H new ATOM 0 HB3 ASP A 132 29.221 2.033 -7.974 1.00 1.00 H new ATOM 651 N PHE A 133 25.563 1.158 -7.592 1.00 1.00 N ATOM 652 CA PHE A 133 24.890 0.020 -6.949 1.00 1.00 C ATOM 653 C PHE A 133 23.478 -0.225 -7.519 1.00 1.00 C ATOM 654 O PHE A 133 22.910 -1.301 -7.340 1.00 1.00 O ATOM 655 CB PHE A 133 24.828 0.262 -5.428 1.00 1.00 C ATOM 656 CG PHE A 133 26.163 0.624 -4.800 1.00 1.00 C ATOM 657 CD1 PHE A 133 26.555 1.974 -4.724 1.00 1.00 C ATOM 658 CD2 PHE A 133 27.033 -0.381 -4.340 1.00 1.00 C ATOM 659 CE1 PHE A 133 27.817 2.319 -4.213 1.00 1.00 C ATOM 660 CE2 PHE A 133 28.293 -0.035 -3.812 1.00 1.00 C ATOM 661 CZ PHE A 133 28.688 1.314 -3.760 1.00 1.00 C ATOM 0 H PHE A 133 25.030 2.023 -7.504 1.00 1.00 H new ATOM 0 HA PHE A 133 25.470 -0.879 -7.158 1.00 1.00 H new ATOM 0 HB2 PHE A 133 24.116 1.063 -5.228 1.00 1.00 H new ATOM 0 HB3 PHE A 133 24.443 -0.636 -4.944 1.00 1.00 H new ATOM 0 HD1 PHE A 133 25.882 2.749 -5.060 1.00 1.00 H new ATOM 0 HD2 PHE A 133 26.735 -1.418 -4.391 1.00 1.00 H new ATOM 0 HE1 PHE A 133 28.117 3.355 -4.168 1.00 1.00 H new ATOM 0 HE2 PHE A 133 28.956 -0.806 -3.447 1.00 1.00 H new ATOM 0 HZ PHE A 133 29.661 1.577 -3.372 1.00 1.00 H new ATOM 671 N LEU A 134 22.904 0.766 -8.203 1.00 1.00 N ATOM 672 CA LEU A 134 21.595 0.741 -8.855 1.00 1.00 C ATOM 673 C LEU A 134 21.463 -0.362 -9.918 1.00 1.00 C ATOM 674 O LEU A 134 22.377 -0.597 -10.714 1.00 1.00 O ATOM 675 CB LEU A 134 21.425 2.130 -9.500 1.00 1.00 C ATOM 676 CG LEU A 134 20.092 2.394 -10.209 1.00 1.00 C ATOM 677 CD1 LEU A 134 18.980 2.604 -9.190 1.00 1.00 C ATOM 678 CD2 LEU A 134 20.218 3.648 -11.071 1.00 1.00 C ATOM 0 H LEU A 134 23.371 1.665 -8.324 1.00 1.00 H new ATOM 0 HA LEU A 134 20.822 0.518 -8.120 1.00 1.00 H new ATOM 0 HB2 LEU A 134 21.555 2.885 -8.725 1.00 1.00 H new ATOM 0 HB3 LEU A 134 22.230 2.272 -10.221 1.00 1.00 H new ATOM 0 HG LEU A 134 19.849 1.532 -10.830 1.00 1.00 H new ATOM 0 HD11 LEU A 134 18.040 2.790 -9.710 1.00 1.00 H new ATOM 0 HD12 LEU A 134 18.881 1.713 -8.570 1.00 1.00 H new ATOM 0 HD13 LEU A 134 19.221 3.460 -8.559 1.00 1.00 H new ATOM 0 HD21 LEU A 134 19.271 3.839 -11.577 1.00 1.00 H new ATOM 0 HD22 LEU A 134 20.470 4.500 -10.439 1.00 1.00 H new ATOM 0 HD23 LEU A 134 21.003 3.502 -11.813 1.00 1.00 H new ATOM 690 N ILE A 135 20.269 -0.966 -9.971 1.00 1.00 N ATOM 691 CA ILE A 135 19.897 -2.008 -10.957 1.00 1.00 C ATOM 692 C ILE A 135 18.610 -1.728 -11.768 1.00 1.00 C ATOM 693 O ILE A 135 18.332 -2.478 -12.704 1.00 1.00 O ATOM 694 CB ILE A 135 19.880 -3.412 -10.303 1.00 1.00 C ATOM 695 CG1 ILE A 135 18.671 -3.566 -9.349 1.00 1.00 C ATOM 696 CG2 ILE A 135 21.241 -3.717 -9.654 1.00 1.00 C ATOM 697 CD1 ILE A 135 18.820 -4.542 -8.184 1.00 1.00 C ATOM 0 H ILE A 135 19.515 -0.745 -9.321 1.00 1.00 H new ATOM 0 HA ILE A 135 20.686 -1.978 -11.708 1.00 1.00 H new ATOM 0 HB ILE A 135 19.737 -4.171 -11.072 1.00 1.00 H new ATOM 0 HG12 ILE A 135 18.437 -2.584 -8.939 1.00 1.00 H new ATOM 0 HG13 ILE A 135 17.811 -3.877 -9.942 1.00 1.00 H new ATOM 0 HG21 ILE A 135 21.213 -4.707 -9.199 1.00 1.00 H new ATOM 0 HG22 ILE A 135 22.021 -3.689 -10.415 1.00 1.00 H new ATOM 0 HG23 ILE A 135 21.454 -2.971 -8.888 1.00 1.00 H new ATOM 0 HD11 ILE A 135 17.901 -4.552 -7.598 1.00 1.00 H new ATOM 0 HD12 ILE A 135 19.014 -5.543 -8.570 1.00 1.00 H new ATOM 0 HD13 ILE A 135 19.651 -4.229 -7.552 1.00 1.00 H new ATOM 709 N LYS A 136 17.840 -0.662 -11.457 1.00 1.00 N ATOM 710 CA LYS A 136 16.645 -0.252 -12.228 1.00 1.00 C ATOM 711 C LYS A 136 16.631 1.256 -12.522 1.00 1.00 C ATOM 712 O LYS A 136 17.088 1.674 -13.583 1.00 1.00 O ATOM 713 CB LYS A 136 15.350 -0.732 -11.531 1.00 1.00 C ATOM 714 CG LYS A 136 15.197 -2.261 -11.526 1.00 1.00 C ATOM 715 CD LYS A 136 13.848 -2.675 -10.913 1.00 1.00 C ATOM 716 CE LYS A 136 13.689 -4.200 -10.790 1.00 1.00 C ATOM 717 NZ LYS A 136 13.543 -4.881 -12.112 1.00 1.00 N ATOM 0 H LYS A 136 18.032 -0.057 -10.658 1.00 1.00 H new ATOM 0 HA LYS A 136 16.693 -0.743 -13.200 1.00 1.00 H new ATOM 0 HB2 LYS A 136 15.342 -0.369 -10.503 1.00 1.00 H new ATOM 0 HB3 LYS A 136 14.489 -0.289 -12.032 1.00 1.00 H new ATOM 0 HG2 LYS A 136 15.270 -2.641 -12.545 1.00 1.00 H new ATOM 0 HG3 LYS A 136 16.012 -2.710 -10.959 1.00 1.00 H new ATOM 0 HD2 LYS A 136 13.750 -2.224 -9.926 1.00 1.00 H new ATOM 0 HD3 LYS A 136 13.039 -2.279 -11.527 1.00 1.00 H new ATOM 0 HE2 LYS A 136 14.556 -4.609 -10.271 1.00 1.00 H new ATOM 0 HE3 LYS A 136 12.816 -4.420 -10.176 1.00 1.00 H new ATOM 0 HZ1 LYS A 136 13.440 -5.905 -11.965 1.00 1.00 H new ATOM 0 HZ2 LYS A 136 12.701 -4.514 -12.600 1.00 1.00 H new ATOM 0 HZ3 LYS A 136 14.387 -4.698 -12.692 1.00 1.00 H new ATOM 731 N GLU A 137 16.151 2.076 -11.582 1.00 1.00 N ATOM 732 CA GLU A 137 16.043 3.542 -11.716 1.00 1.00 C ATOM 733 C GLU A 137 15.937 4.228 -10.339 1.00 1.00 C ATOM 734 O GLU A 137 15.341 3.670 -9.413 1.00 1.00 O ATOM 735 CB GLU A 137 14.810 3.875 -12.583 1.00 1.00 C ATOM 736 CG GLU A 137 14.625 5.366 -12.906 1.00 1.00 C ATOM 737 CD GLU A 137 15.855 5.963 -13.623 1.00 1.00 C ATOM 738 OE1 GLU A 137 16.827 6.362 -12.932 1.00 1.00 O ATOM 739 OE2 GLU A 137 15.860 6.027 -14.877 1.00 1.00 O ATOM 0 H GLU A 137 15.816 1.735 -10.681 1.00 1.00 H new ATOM 0 HA GLU A 137 16.946 3.920 -12.196 1.00 1.00 H new ATOM 0 HB2 GLU A 137 14.884 3.322 -13.520 1.00 1.00 H new ATOM 0 HB3 GLU A 137 13.917 3.516 -12.071 1.00 1.00 H new ATOM 0 HG2 GLU A 137 13.743 5.494 -13.534 1.00 1.00 H new ATOM 0 HG3 GLU A 137 14.442 5.916 -11.983 1.00 1.00 H new ATOM 746 N LEU A 138 16.525 5.418 -10.194 1.00 1.00 N ATOM 747 CA LEU A 138 16.521 6.212 -8.958 1.00 1.00 C ATOM 748 C LEU A 138 15.143 6.861 -8.698 1.00 1.00 C ATOM 749 O LEU A 138 14.485 7.344 -9.624 1.00 1.00 O ATOM 750 CB LEU A 138 17.595 7.318 -9.057 1.00 1.00 C ATOM 751 CG LEU A 138 19.050 6.821 -9.152 1.00 1.00 C ATOM 752 CD1 LEU A 138 19.983 7.971 -9.529 1.00 1.00 C ATOM 753 CD2 LEU A 138 19.563 6.227 -7.838 1.00 1.00 C ATOM 0 H LEU A 138 17.032 5.871 -10.954 1.00 1.00 H new ATOM 0 HA LEU A 138 16.739 5.541 -8.127 1.00 1.00 H new ATOM 0 HB2 LEU A 138 17.381 7.931 -9.932 1.00 1.00 H new ATOM 0 HB3 LEU A 138 17.507 7.966 -8.185 1.00 1.00 H new ATOM 0 HG LEU A 138 19.049 6.043 -9.915 1.00 1.00 H new ATOM 0 HD11 LEU A 138 21.007 7.603 -9.592 1.00 1.00 H new ATOM 0 HD12 LEU A 138 19.685 8.380 -10.494 1.00 1.00 H new ATOM 0 HD13 LEU A 138 19.924 8.751 -8.770 1.00 1.00 H new ATOM 0 HD21 LEU A 138 20.593 5.894 -7.967 1.00 1.00 H new ATOM 0 HD22 LEU A 138 19.522 6.985 -7.055 1.00 1.00 H new ATOM 0 HD23 LEU A 138 18.940 5.378 -7.555 1.00 1.00 H new ATOM 765 N GLU A 139 14.745 6.926 -7.420 1.00 1.00 N ATOM 766 CA GLU A 139 13.500 7.555 -6.925 1.00 1.00 C ATOM 767 C GLU A 139 13.699 8.257 -5.565 1.00 1.00 C ATOM 768 O GLU A 139 14.314 7.660 -4.650 1.00 1.00 O ATOM 769 CB GLU A 139 12.364 6.518 -6.811 1.00 1.00 C ATOM 770 CG GLU A 139 11.829 6.017 -8.162 1.00 1.00 C ATOM 771 CD GLU A 139 10.654 5.034 -7.970 1.00 1.00 C ATOM 772 OE1 GLU A 139 10.907 3.805 -7.859 1.00 1.00 O ATOM 773 OE2 GLU A 139 9.476 5.472 -7.940 1.00 1.00 O ATOM 0 H GLU A 139 15.302 6.526 -6.665 1.00 1.00 H new ATOM 0 HA GLU A 139 13.224 8.313 -7.658 1.00 1.00 H new ATOM 0 HB2 GLU A 139 12.723 5.664 -6.236 1.00 1.00 H new ATOM 0 HB3 GLU A 139 11.541 6.958 -6.248 1.00 1.00 H new ATOM 0 HG2 GLU A 139 11.502 6.865 -8.763 1.00 1.00 H new ATOM 0 HG3 GLU A 139 12.631 5.526 -8.714 1.00 1.00 H new TER 780 GLU A 139