USER MOD reduce.3.24.130724 H: found=0, std=0, add=552, rem=0, adj=9 USER MOD reduce.3.24.130724 removed 553 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 74 ASN : amide:sc= -0.0697 K(o=-0.07,f=-0.63) USER MOD Single : A 76 ASN : amide:sc= -0.391 K(o=-0.39,f=-2.4!) USER MOD Single : A 77 LYS NZ :NH3+ -161:sc= -0.22 (180deg=-0.986) USER MOD Single : A 82 GLN : amide:sc= -0.0652 X(o=-0.065,f=-0.49) USER MOD Single : A 87 THR OG1 : rot -7:sc= -0.361 USER MOD Single : A 88 GLN : amide:sc= -0.0115 X(o=-0.012,f=0) USER MOD Single : A 93 GLN : amide:sc= -0.185 X(o=-0.18,f=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 ASN : amide:sc= -3.47! C(o=-3.5!,f=-3.7!) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot 55:sc= 1.04 USER MOD Single : A 117 GLN : amide:sc= -2.54 X(o=-2.5,f=-2.2) USER MOD Single : A 118 CYS SG : rot -120:sc= 0.415 USER MOD Single : A 122 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= -0.172 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 LYS NZ :NH3+ 160:sc= -0.038 (180deg=-0.26) USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.0379 USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 915 N PHE A 65 10.391 -5.118 3.158 1.00 0.00 N ATOM 916 CA PHE A 65 9.950 -3.962 3.931 1.00 0.00 C ATOM 917 C PHE A 65 9.391 -4.393 5.283 1.00 0.00 C ATOM 918 O PHE A 65 9.382 -5.580 5.612 1.00 0.00 O ATOM 919 CB PHE A 65 8.890 -3.179 3.154 1.00 0.00 C ATOM 920 CG PHE A 65 9.449 -2.389 2.006 1.00 0.00 C ATOM 921 CD1 PHE A 65 9.599 -2.970 0.757 1.00 0.00 C ATOM 922 CD2 PHE A 65 9.825 -1.066 2.176 1.00 0.00 C ATOM 923 CE1 PHE A 65 10.113 -2.247 -0.302 1.00 0.00 C ATOM 924 CE2 PHE A 65 10.341 -0.338 1.121 1.00 0.00 C ATOM 925 CZ PHE A 65 10.484 -0.929 -0.120 1.00 0.00 C ATOM 0 HA PHE A 65 10.814 -3.320 4.104 1.00 0.00 H new ATOM 0 HB2 PHE A 65 8.141 -3.875 2.775 1.00 0.00 H new ATOM 0 HB3 PHE A 65 8.378 -2.500 3.836 1.00 0.00 H new ATOM 0 HD1 PHE A 65 9.311 -4.000 0.610 1.00 0.00 H new ATOM 0 HD2 PHE A 65 9.714 -0.599 3.143 1.00 0.00 H new ATOM 0 HE1 PHE A 65 10.225 -2.712 -1.271 1.00 0.00 H new ATOM 0 HE2 PHE A 65 10.632 0.692 1.266 1.00 0.00 H new ATOM 0 HZ PHE A 65 10.885 -0.361 -0.946 1.00 0.00 H new ATOM 935 N ARG A 66 8.927 -3.422 6.062 1.00 0.00 N ATOM 936 CA ARG A 66 8.367 -3.701 7.379 1.00 0.00 C ATOM 937 C ARG A 66 7.128 -2.849 7.634 1.00 0.00 C ATOM 938 O ARG A 66 6.893 -1.855 6.948 1.00 0.00 O ATOM 939 CB ARG A 66 9.414 -3.446 8.466 1.00 0.00 C ATOM 940 CG ARG A 66 9.725 -4.672 9.311 1.00 0.00 C ATOM 941 CD ARG A 66 9.621 -4.370 10.798 1.00 0.00 C ATOM 942 NE ARG A 66 8.348 -4.815 11.360 1.00 0.00 N ATOM 943 CZ ARG A 66 7.859 -4.383 12.520 1.00 0.00 C ATOM 944 NH1 ARG A 66 8.533 -3.497 13.243 1.00 0.00 N ATOM 945 NH2 ARG A 66 6.693 -4.837 12.958 1.00 0.00 N ATOM 0 H ARG A 66 8.928 -2.435 5.804 1.00 0.00 H new ATOM 0 HA ARG A 66 8.074 -4.751 7.409 1.00 0.00 H new ATOM 0 HB2 ARG A 66 10.334 -3.095 7.998 1.00 0.00 H new ATOM 0 HB3 ARG A 66 9.062 -2.646 9.117 1.00 0.00 H new ATOM 0 HG2 ARG A 66 9.036 -5.476 9.054 1.00 0.00 H new ATOM 0 HG3 ARG A 66 10.729 -5.028 9.081 1.00 0.00 H new ATOM 0 HD2 ARG A 66 10.440 -4.859 11.325 1.00 0.00 H new ATOM 0 HD3 ARG A 66 9.733 -3.298 10.959 1.00 0.00 H new ATOM 0 HE ARG A 66 7.802 -5.496 10.833 1.00 0.00 H new ATOM 0 HH11 ARG A 66 9.430 -3.144 12.910 1.00 0.00 H new ATOM 0 HH12 ARG A 66 8.154 -3.169 14.131 1.00 0.00 H new ATOM 0 HH21 ARG A 66 6.171 -5.517 12.406 1.00 0.00 H new ATOM 0 HH22 ARG A 66 6.318 -4.506 13.847 1.00 0.00 H new ATOM 959 N VAL A 67 6.337 -3.246 8.627 1.00 0.00 N ATOM 960 CA VAL A 67 5.122 -2.519 8.974 1.00 0.00 C ATOM 961 C VAL A 67 5.433 -1.329 9.875 1.00 0.00 C ATOM 962 O VAL A 67 5.823 -1.497 11.030 1.00 0.00 O ATOM 963 CB VAL A 67 4.103 -3.432 9.682 1.00 0.00 C ATOM 964 CG1 VAL A 67 2.774 -2.715 9.856 1.00 0.00 C ATOM 965 CG2 VAL A 67 3.922 -4.730 8.909 1.00 0.00 C ATOM 0 H VAL A 67 6.517 -4.067 9.205 1.00 0.00 H new ATOM 0 HA VAL A 67 4.690 -2.161 8.040 1.00 0.00 H new ATOM 0 HB VAL A 67 4.488 -3.677 10.672 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.067 -3.376 10.358 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.921 -1.817 10.457 1.00 0.00 H new ATOM 0 HG13 VAL A 67 2.380 -2.437 8.879 1.00 0.00 H new ATOM 0 HG21 VAL A 67 3.199 -5.362 9.424 1.00 0.00 H new ATOM 0 HG22 VAL A 67 3.560 -4.508 7.905 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.877 -5.251 8.843 1.00 0.00 H new ATOM 975 N GLY A 68 5.254 -0.125 9.340 1.00 0.00 N ATOM 976 CA GLY A 68 5.518 1.076 10.110 1.00 0.00 C ATOM 977 C GLY A 68 6.713 1.849 9.587 1.00 0.00 C ATOM 978 O GLY A 68 7.581 2.261 10.358 1.00 0.00 O ATOM 0 H GLY A 68 4.931 0.040 8.387 1.00 0.00 H new ATOM 0 HA2 GLY A 68 4.637 1.718 10.090 1.00 0.00 H new ATOM 0 HA3 GLY A 68 5.692 0.805 11.151 1.00 0.00 H new ATOM 982 N GLU A 69 6.759 2.047 8.274 1.00 0.00 N ATOM 983 CA GLU A 69 7.856 2.776 7.649 1.00 0.00 C ATOM 984 C GLU A 69 7.342 3.674 6.528 1.00 0.00 C ATOM 985 O GLU A 69 6.207 3.531 6.075 1.00 0.00 O ATOM 986 CB GLU A 69 8.899 1.801 7.099 1.00 0.00 C ATOM 987 CG GLU A 69 9.491 0.883 8.157 1.00 0.00 C ATOM 988 CD GLU A 69 11.005 0.958 8.213 1.00 0.00 C ATOM 989 OE1 GLU A 69 11.536 2.061 8.461 1.00 0.00 O ATOM 990 OE2 GLU A 69 11.659 -0.087 8.009 1.00 0.00 O ATOM 0 H GLU A 69 6.049 1.713 7.622 1.00 0.00 H new ATOM 0 HA GLU A 69 8.322 3.403 8.409 1.00 0.00 H new ATOM 0 HB2 GLU A 69 8.441 1.194 6.318 1.00 0.00 H new ATOM 0 HB3 GLU A 69 9.703 2.368 6.631 1.00 0.00 H new ATOM 0 HG2 GLU A 69 9.081 1.147 9.132 1.00 0.00 H new ATOM 0 HG3 GLU A 69 9.189 -0.144 7.952 1.00 0.00 H new ATOM 997 N ARG A 70 8.186 4.599 6.083 1.00 0.00 N ATOM 998 CA ARG A 70 7.817 5.520 5.014 1.00 0.00 C ATOM 999 C ARG A 70 8.286 4.996 3.660 1.00 0.00 C ATOM 1000 O ARG A 70 9.424 4.551 3.517 1.00 0.00 O ATOM 1001 CB ARG A 70 8.414 6.903 5.274 1.00 0.00 C ATOM 1002 CG ARG A 70 7.687 8.026 4.549 1.00 0.00 C ATOM 1003 CD ARG A 70 6.958 8.941 5.521 1.00 0.00 C ATOM 1004 NE ARG A 70 7.886 9.682 6.373 1.00 0.00 N ATOM 1005 CZ ARG A 70 8.581 10.742 5.967 1.00 0.00 C ATOM 1006 NH1 ARG A 70 8.459 11.186 4.722 1.00 0.00 N ATOM 1007 NH2 ARG A 70 9.401 11.357 6.806 1.00 0.00 N ATOM 0 H ARG A 70 9.130 4.731 6.446 1.00 0.00 H new ATOM 0 HA ARG A 70 6.730 5.600 4.996 1.00 0.00 H new ATOM 0 HB2 ARG A 70 8.396 7.102 6.346 1.00 0.00 H new ATOM 0 HB3 ARG A 70 9.460 6.901 4.968 1.00 0.00 H new ATOM 0 HG2 ARG A 70 8.403 8.608 3.968 1.00 0.00 H new ATOM 0 HG3 ARG A 70 6.973 7.602 3.843 1.00 0.00 H new ATOM 0 HD2 ARG A 70 6.338 9.643 4.963 1.00 0.00 H new ATOM 0 HD3 ARG A 70 6.288 8.349 6.144 1.00 0.00 H new ATOM 0 HE ARG A 70 8.008 9.368 7.336 1.00 0.00 H new ATOM 0 HH11 ARG A 70 7.830 10.714 4.072 1.00 0.00 H new ATOM 0 HH12 ARG A 70 8.994 11.999 4.416 1.00 0.00 H new ATOM 0 HH21 ARG A 70 9.500 11.018 7.763 1.00 0.00 H new ATOM 0 HH22 ARG A 70 9.934 12.169 6.495 1.00 0.00 H new ATOM 1021 N VAL A 71 7.401 5.054 2.671 1.00 0.00 N ATOM 1022 CA VAL A 71 7.725 4.587 1.329 1.00 0.00 C ATOM 1023 C VAL A 71 7.071 5.464 0.268 1.00 0.00 C ATOM 1024 O VAL A 71 6.086 6.152 0.538 1.00 0.00 O ATOM 1025 CB VAL A 71 7.280 3.128 1.118 1.00 0.00 C ATOM 1026 CG1 VAL A 71 8.217 2.173 1.842 1.00 0.00 C ATOM 1027 CG2 VAL A 71 5.846 2.934 1.585 1.00 0.00 C ATOM 0 H VAL A 71 6.454 5.420 2.774 1.00 0.00 H new ATOM 0 HA VAL A 71 8.809 4.646 1.228 1.00 0.00 H new ATOM 0 HB VAL A 71 7.324 2.905 0.052 1.00 0.00 H new ATOM 0 HG11 VAL A 71 7.886 1.147 1.681 1.00 0.00 H new ATOM 0 HG12 VAL A 71 9.229 2.293 1.455 1.00 0.00 H new ATOM 0 HG13 VAL A 71 8.208 2.394 2.909 1.00 0.00 H new ATOM 0 HG21 VAL A 71 5.549 1.897 1.428 1.00 0.00 H new ATOM 0 HG22 VAL A 71 5.773 3.176 2.645 1.00 0.00 H new ATOM 0 HG23 VAL A 71 5.186 3.590 1.017 1.00 0.00 H new ATOM 1037 N TRP A 72 7.624 5.436 -0.941 1.00 0.00 N ATOM 1038 CA TRP A 72 7.095 6.229 -2.043 1.00 0.00 C ATOM 1039 C TRP A 72 6.448 5.333 -3.097 1.00 0.00 C ATOM 1040 O TRP A 72 7.129 4.570 -3.780 1.00 0.00 O ATOM 1041 CB TRP A 72 8.207 7.062 -2.680 1.00 0.00 C ATOM 1042 CG TRP A 72 8.387 8.403 -2.038 1.00 0.00 C ATOM 1043 CD1 TRP A 72 8.165 9.623 -2.610 1.00 0.00 C ATOM 1044 CD2 TRP A 72 8.827 8.662 -0.700 1.00 0.00 C ATOM 1045 NE1 TRP A 72 8.440 10.623 -1.710 1.00 0.00 N ATOM 1046 CE2 TRP A 72 8.849 10.059 -0.530 1.00 0.00 C ATOM 1047 CE3 TRP A 72 9.206 7.848 0.372 1.00 0.00 C ATOM 1048 CZ2 TRP A 72 9.232 10.659 0.666 1.00 0.00 C ATOM 1049 CZ3 TRP A 72 9.586 8.445 1.559 1.00 0.00 C ATOM 1050 CH2 TRP A 72 9.598 9.838 1.698 1.00 0.00 C ATOM 0 H TRP A 72 8.439 4.872 -1.181 1.00 0.00 H new ATOM 0 HA TRP A 72 6.333 6.898 -1.643 1.00 0.00 H new ATOM 0 HB2 TRP A 72 9.145 6.510 -2.620 1.00 0.00 H new ATOM 0 HB3 TRP A 72 7.986 7.201 -3.738 1.00 0.00 H new ATOM 0 HD1 TRP A 72 7.823 9.779 -3.623 1.00 0.00 H new ATOM 0 HE1 TRP A 72 8.354 11.623 -1.891 1.00 0.00 H new ATOM 0 HE3 TRP A 72 9.202 6.772 0.274 1.00 0.00 H new ATOM 0 HZ2 TRP A 72 9.240 11.733 0.776 1.00 0.00 H new ATOM 0 HZ3 TRP A 72 9.879 7.826 2.394 1.00 0.00 H new ATOM 0 HH2 TRP A 72 9.902 10.273 2.638 1.00 0.00 H new ATOM 1061 N VAL A 73 5.128 5.434 -3.222 1.00 0.00 N ATOM 1062 CA VAL A 73 4.390 4.635 -4.192 1.00 0.00 C ATOM 1063 C VAL A 73 4.747 5.036 -5.619 1.00 0.00 C ATOM 1064 O VAL A 73 4.614 6.199 -6.000 1.00 0.00 O ATOM 1065 CB VAL A 73 2.868 4.777 -3.997 1.00 0.00 C ATOM 1066 CG1 VAL A 73 2.122 3.783 -4.872 1.00 0.00 C ATOM 1067 CG2 VAL A 73 2.499 4.591 -2.532 1.00 0.00 C ATOM 0 H VAL A 73 4.549 6.061 -2.664 1.00 0.00 H new ATOM 0 HA VAL A 73 4.674 3.596 -4.027 1.00 0.00 H new ATOM 0 HB VAL A 73 2.573 5.782 -4.298 1.00 0.00 H new ATOM 0 HG11 VAL A 73 1.049 3.899 -4.720 1.00 0.00 H new ATOM 0 HG12 VAL A 73 2.363 3.968 -5.919 1.00 0.00 H new ATOM 0 HG13 VAL A 73 2.419 2.769 -4.605 1.00 0.00 H new ATOM 0 HG21 VAL A 73 1.421 4.695 -2.412 1.00 0.00 H new ATOM 0 HG22 VAL A 73 2.807 3.599 -2.202 1.00 0.00 H new ATOM 0 HG23 VAL A 73 3.005 5.346 -1.931 1.00 0.00 H new ATOM 1077 N ASN A 74 5.202 4.065 -6.405 1.00 0.00 N ATOM 1078 CA ASN A 74 5.580 4.316 -7.791 1.00 0.00 C ATOM 1079 C ASN A 74 6.741 5.304 -7.877 1.00 0.00 C ATOM 1080 O ASN A 74 6.968 5.918 -8.919 1.00 0.00 O ATOM 1081 CB ASN A 74 4.380 4.848 -8.580 1.00 0.00 C ATOM 1082 CG ASN A 74 3.823 3.823 -9.548 1.00 0.00 C ATOM 1083 OD1 ASN A 74 3.854 2.622 -9.283 1.00 0.00 O ATOM 1084 ND2 ASN A 74 3.311 4.294 -10.679 1.00 0.00 N ATOM 0 H ASN A 74 5.318 3.097 -6.105 1.00 0.00 H new ATOM 0 HA ASN A 74 5.905 3.371 -8.226 1.00 0.00 H new ATOM 0 HB2 ASN A 74 3.597 5.150 -7.885 1.00 0.00 H new ATOM 0 HB3 ASN A 74 4.678 5.740 -9.131 1.00 0.00 H new ATOM 0 HD21 ASN A 74 2.923 3.652 -11.369 1.00 0.00 H new ATOM 0 HD22 ASN A 74 3.306 5.298 -10.857 1.00 0.00 H new ATOM 1091 N GLY A 75 7.475 5.452 -6.777 1.00 0.00 N ATOM 1092 CA GLY A 75 8.603 6.366 -6.756 1.00 0.00 C ATOM 1093 C GLY A 75 8.183 7.814 -6.923 1.00 0.00 C ATOM 1094 O GLY A 75 8.886 8.600 -7.558 1.00 0.00 O ATOM 0 H GLY A 75 7.309 4.956 -5.901 1.00 0.00 H new ATOM 0 HA2 GLY A 75 9.140 6.253 -5.814 1.00 0.00 H new ATOM 0 HA3 GLY A 75 9.297 6.099 -7.552 1.00 0.00 H new ATOM 1098 N ASN A 76 7.036 8.167 -6.352 1.00 0.00 N ATOM 1099 CA ASN A 76 6.526 9.531 -6.441 1.00 0.00 C ATOM 1100 C ASN A 76 5.227 9.678 -5.653 1.00 0.00 C ATOM 1101 O ASN A 76 4.262 10.273 -6.132 1.00 0.00 O ATOM 1102 CB ASN A 76 6.296 9.919 -7.903 1.00 0.00 C ATOM 1103 CG ASN A 76 5.488 8.881 -8.658 1.00 0.00 C ATOM 1104 OD1 ASN A 76 6.023 8.142 -9.484 1.00 0.00 O ATOM 1105 ND2 ASN A 76 4.192 8.823 -8.378 1.00 0.00 N ATOM 0 H ASN A 76 6.442 7.528 -5.823 1.00 0.00 H new ATOM 0 HA ASN A 76 7.271 10.199 -6.009 1.00 0.00 H new ATOM 0 HB2 ASN A 76 5.779 10.878 -7.944 1.00 0.00 H new ATOM 0 HB3 ASN A 76 7.259 10.054 -8.396 1.00 0.00 H new ATOM 0 HD21 ASN A 76 3.597 8.146 -8.855 1.00 0.00 H new ATOM 0 HD22 ASN A 76 3.791 9.456 -7.686 1.00 0.00 H new ATOM 1112 N LYS A 77 5.212 9.131 -4.441 1.00 0.00 N ATOM 1113 CA LYS A 77 4.034 9.199 -3.584 1.00 0.00 C ATOM 1114 C LYS A 77 4.357 8.694 -2.180 1.00 0.00 C ATOM 1115 O LYS A 77 4.217 7.505 -1.893 1.00 0.00 O ATOM 1116 CB LYS A 77 2.893 8.375 -4.185 1.00 0.00 C ATOM 1117 CG LYS A 77 1.976 9.178 -5.093 1.00 0.00 C ATOM 1118 CD LYS A 77 0.533 8.714 -4.979 1.00 0.00 C ATOM 1119 CE LYS A 77 0.314 7.391 -5.697 1.00 0.00 C ATOM 1120 NZ LYS A 77 0.859 7.414 -7.082 1.00 0.00 N ATOM 0 H LYS A 77 6.003 8.635 -4.030 1.00 0.00 H new ATOM 0 HA LYS A 77 3.722 10.241 -3.515 1.00 0.00 H new ATOM 0 HB2 LYS A 77 3.315 7.544 -4.751 1.00 0.00 H new ATOM 0 HB3 LYS A 77 2.303 7.943 -3.377 1.00 0.00 H new ATOM 0 HG2 LYS A 77 2.041 10.235 -4.834 1.00 0.00 H new ATOM 0 HG3 LYS A 77 2.310 9.081 -6.126 1.00 0.00 H new ATOM 0 HD2 LYS A 77 0.266 8.607 -3.928 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -0.128 9.471 -5.400 1.00 0.00 H new ATOM 0 HE2 LYS A 77 0.790 6.589 -5.133 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -0.752 7.168 -5.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 0.425 6.650 -7.639 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 0.644 8.330 -7.525 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.890 7.278 -7.052 1.00 0.00 H new ATOM 1134 N PRO A 78 4.798 9.593 -1.280 1.00 0.00 N ATOM 1135 CA PRO A 78 5.142 9.225 0.099 1.00 0.00 C ATOM 1136 C PRO A 78 3.940 8.706 0.879 1.00 0.00 C ATOM 1137 O PRO A 78 2.801 9.091 0.616 1.00 0.00 O ATOM 1138 CB PRO A 78 5.652 10.536 0.710 1.00 0.00 C ATOM 1139 CG PRO A 78 5.082 11.611 -0.150 1.00 0.00 C ATOM 1140 CD PRO A 78 4.995 11.031 -1.533 1.00 0.00 C ATOM 0 HA PRO A 78 5.872 8.416 0.130 1.00 0.00 H new ATOM 0 HB2 PRO A 78 5.324 10.643 1.744 1.00 0.00 H new ATOM 0 HB3 PRO A 78 6.741 10.571 0.715 1.00 0.00 H new ATOM 0 HG2 PRO A 78 4.099 11.917 0.208 1.00 0.00 H new ATOM 0 HG3 PRO A 78 5.716 12.498 -0.138 1.00 0.00 H new ATOM 0 HD2 PRO A 78 4.166 11.458 -2.098 1.00 0.00 H new ATOM 0 HD3 PRO A 78 5.902 11.219 -2.107 1.00 0.00 H new ATOM 1148 N GLY A 79 4.203 7.828 1.843 1.00 0.00 N ATOM 1149 CA GLY A 79 3.136 7.268 2.650 1.00 0.00 C ATOM 1150 C GLY A 79 3.658 6.446 3.812 1.00 0.00 C ATOM 1151 O GLY A 79 4.807 6.606 4.226 1.00 0.00 O ATOM 0 H GLY A 79 5.138 7.495 2.079 1.00 0.00 H new ATOM 0 HA2 GLY A 79 2.511 8.076 3.032 1.00 0.00 H new ATOM 0 HA3 GLY A 79 2.500 6.643 2.023 1.00 0.00 H new ATOM 1155 N PHE A 80 2.814 5.566 4.339 1.00 0.00 N ATOM 1156 CA PHE A 80 3.198 4.715 5.460 1.00 0.00 C ATOM 1157 C PHE A 80 2.683 3.293 5.266 1.00 0.00 C ATOM 1158 O PHE A 80 1.491 3.077 5.046 1.00 0.00 O ATOM 1159 CB PHE A 80 2.657 5.290 6.771 1.00 0.00 C ATOM 1160 CG PHE A 80 3.259 6.617 7.139 1.00 0.00 C ATOM 1161 CD1 PHE A 80 2.897 7.769 6.461 1.00 0.00 C ATOM 1162 CD2 PHE A 80 4.187 6.710 8.164 1.00 0.00 C ATOM 1163 CE1 PHE A 80 3.449 8.990 6.796 1.00 0.00 C ATOM 1164 CE2 PHE A 80 4.743 7.928 8.505 1.00 0.00 C ATOM 1165 CZ PHE A 80 4.373 9.070 7.820 1.00 0.00 C ATOM 0 H PHE A 80 1.860 5.423 4.008 1.00 0.00 H new ATOM 0 HA PHE A 80 4.287 4.685 5.504 1.00 0.00 H new ATOM 0 HB2 PHE A 80 1.576 5.401 6.691 1.00 0.00 H new ATOM 0 HB3 PHE A 80 2.846 4.579 7.575 1.00 0.00 H new ATOM 0 HD1 PHE A 80 2.174 7.712 5.661 1.00 0.00 H new ATOM 0 HD2 PHE A 80 4.479 5.820 8.702 1.00 0.00 H new ATOM 0 HE1 PHE A 80 3.159 9.881 6.258 1.00 0.00 H new ATOM 0 HE2 PHE A 80 5.466 7.988 9.305 1.00 0.00 H new ATOM 0 HZ PHE A 80 4.806 10.024 8.085 1.00 0.00 H new ATOM 1175 N ILE A 81 3.590 2.324 5.349 1.00 0.00 N ATOM 1176 CA ILE A 81 3.227 0.922 5.183 1.00 0.00 C ATOM 1177 C ILE A 81 2.409 0.422 6.369 1.00 0.00 C ATOM 1178 O ILE A 81 2.644 0.820 7.509 1.00 0.00 O ATOM 1179 CB ILE A 81 4.474 0.033 5.022 1.00 0.00 C ATOM 1180 CG1 ILE A 81 5.403 0.605 3.950 1.00 0.00 C ATOM 1181 CG2 ILE A 81 4.070 -1.392 4.674 1.00 0.00 C ATOM 1182 CD1 ILE A 81 6.678 -0.189 3.767 1.00 0.00 C ATOM 0 H ILE A 81 4.581 2.485 5.530 1.00 0.00 H new ATOM 0 HA ILE A 81 2.625 0.857 4.277 1.00 0.00 H new ATOM 0 HB ILE A 81 5.012 0.016 5.970 1.00 0.00 H new ATOM 0 HG12 ILE A 81 4.869 0.643 3.001 1.00 0.00 H new ATOM 0 HG13 ILE A 81 5.659 1.632 4.213 1.00 0.00 H new ATOM 0 HG21 ILE A 81 4.963 -2.007 4.564 1.00 0.00 H new ATOM 0 HG22 ILE A 81 3.446 -1.798 5.470 1.00 0.00 H new ATOM 0 HG23 ILE A 81 3.511 -1.393 3.738 1.00 0.00 H new ATOM 0 HD11 ILE A 81 7.287 0.275 2.991 1.00 0.00 H new ATOM 0 HD12 ILE A 81 7.234 -0.205 4.704 1.00 0.00 H new ATOM 0 HD13 ILE A 81 6.432 -1.209 3.473 1.00 0.00 H new ATOM 1194 N GLN A 82 1.446 -0.451 6.090 1.00 0.00 N ATOM 1195 CA GLN A 82 0.592 -1.005 7.135 1.00 0.00 C ATOM 1196 C GLN A 82 0.493 -2.522 7.007 1.00 0.00 C ATOM 1197 O GLN A 82 0.626 -3.249 7.992 1.00 0.00 O ATOM 1198 CB GLN A 82 -0.803 -0.383 7.065 1.00 0.00 C ATOM 1199 CG GLN A 82 -0.792 1.135 7.040 1.00 0.00 C ATOM 1200 CD GLN A 82 -1.002 1.744 8.412 1.00 0.00 C ATOM 1201 OE1 GLN A 82 -1.887 1.329 9.159 1.00 0.00 O ATOM 1202 NE2 GLN A 82 -0.184 2.733 8.752 1.00 0.00 N ATOM 0 H GLN A 82 1.238 -0.790 5.151 1.00 0.00 H new ATOM 0 HA GLN A 82 1.039 -0.768 8.100 1.00 0.00 H new ATOM 0 HB2 GLN A 82 -1.310 -0.749 6.172 1.00 0.00 H new ATOM 0 HB3 GLN A 82 -1.385 -0.720 7.923 1.00 0.00 H new ATOM 0 HG2 GLN A 82 0.159 1.481 6.635 1.00 0.00 H new ATOM 0 HG3 GLN A 82 -1.573 1.489 6.367 1.00 0.00 H new ATOM 0 HE21 GLN A 82 0.536 3.046 8.101 1.00 0.00 H new ATOM 0 HE22 GLN A 82 -0.276 3.180 9.664 1.00 0.00 H new ATOM 1211 N PHE A 83 0.257 -2.994 5.787 1.00 0.00 N ATOM 1212 CA PHE A 83 0.139 -4.424 5.529 1.00 0.00 C ATOM 1213 C PHE A 83 1.275 -4.912 4.637 1.00 0.00 C ATOM 1214 O PHE A 83 1.781 -4.168 3.796 1.00 0.00 O ATOM 1215 CB PHE A 83 -1.208 -4.737 4.876 1.00 0.00 C ATOM 1216 CG PHE A 83 -1.593 -6.186 4.959 1.00 0.00 C ATOM 1217 CD1 PHE A 83 -1.963 -6.750 6.170 1.00 0.00 C ATOM 1218 CD2 PHE A 83 -1.584 -6.986 3.827 1.00 0.00 C ATOM 1219 CE1 PHE A 83 -2.317 -8.083 6.250 1.00 0.00 C ATOM 1220 CE2 PHE A 83 -1.936 -8.320 3.901 1.00 0.00 C ATOM 1221 CZ PHE A 83 -2.303 -8.870 5.113 1.00 0.00 C ATOM 0 H PHE A 83 0.144 -2.406 4.961 1.00 0.00 H new ATOM 0 HA PHE A 83 0.202 -4.946 6.484 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -1.982 -4.136 5.353 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -1.173 -4.438 3.828 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -1.975 -6.140 7.061 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -1.298 -6.561 2.876 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -2.604 -8.510 7.199 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -1.924 -8.932 3.011 1.00 0.00 H new ATOM 0 HZ PHE A 83 -2.579 -9.913 5.173 1.00 0.00 H new ATOM 1231 N LEU A 84 1.672 -6.166 4.825 1.00 0.00 N ATOM 1232 CA LEU A 84 2.749 -6.754 4.036 1.00 0.00 C ATOM 1233 C LEU A 84 2.562 -8.261 3.900 1.00 0.00 C ATOM 1234 O LEU A 84 2.863 -9.020 4.822 1.00 0.00 O ATOM 1235 CB LEU A 84 4.103 -6.453 4.680 1.00 0.00 C ATOM 1236 CG LEU A 84 4.624 -5.032 4.459 1.00 0.00 C ATOM 1237 CD1 LEU A 84 5.788 -4.739 5.394 1.00 0.00 C ATOM 1238 CD2 LEU A 84 5.041 -4.837 3.010 1.00 0.00 C ATOM 0 H LEU A 84 1.264 -6.795 5.517 1.00 0.00 H new ATOM 0 HA LEU A 84 2.721 -6.311 3.041 1.00 0.00 H new ATOM 0 HB2 LEU A 84 4.026 -6.633 5.752 1.00 0.00 H new ATOM 0 HB3 LEU A 84 4.838 -7.158 4.291 1.00 0.00 H new ATOM 0 HG LEU A 84 3.819 -4.332 4.682 1.00 0.00 H new ATOM 0 HD11 LEU A 84 6.146 -3.724 5.223 1.00 0.00 H new ATOM 0 HD12 LEU A 84 5.458 -4.838 6.428 1.00 0.00 H new ATOM 0 HD13 LEU A 84 6.596 -5.445 5.202 1.00 0.00 H new ATOM 0 HD21 LEU A 84 5.409 -3.820 2.871 1.00 0.00 H new ATOM 0 HD22 LEU A 84 5.830 -5.546 2.760 1.00 0.00 H new ATOM 0 HD23 LEU A 84 4.183 -5.004 2.359 1.00 0.00 H new ATOM 1250 N GLY A 85 2.065 -8.689 2.744 1.00 0.00 N ATOM 1251 CA GLY A 85 1.847 -10.104 2.510 1.00 0.00 C ATOM 1252 C GLY A 85 0.931 -10.363 1.331 1.00 0.00 C ATOM 1253 O GLY A 85 0.832 -9.541 0.420 1.00 0.00 O ATOM 0 H GLY A 85 1.810 -8.081 1.966 1.00 0.00 H new ATOM 0 HA2 GLY A 85 2.806 -10.592 2.335 1.00 0.00 H new ATOM 0 HA3 GLY A 85 1.418 -10.555 3.405 1.00 0.00 H new ATOM 1257 N GLU A 86 0.259 -11.509 1.347 1.00 0.00 N ATOM 1258 CA GLU A 86 -0.655 -11.875 0.271 1.00 0.00 C ATOM 1259 C GLU A 86 -2.027 -11.244 0.483 1.00 0.00 C ATOM 1260 O GLU A 86 -2.240 -10.506 1.445 1.00 0.00 O ATOM 1261 CB GLU A 86 -0.788 -13.396 0.182 1.00 0.00 C ATOM 1262 CG GLU A 86 0.234 -14.043 -0.737 1.00 0.00 C ATOM 1263 CD GLU A 86 -0.265 -15.339 -1.345 1.00 0.00 C ATOM 1264 OE1 GLU A 86 -1.486 -15.452 -1.581 1.00 0.00 O ATOM 1265 OE2 GLU A 86 0.566 -16.241 -1.585 1.00 0.00 O ATOM 0 H GLU A 86 0.330 -12.201 2.093 1.00 0.00 H new ATOM 0 HA GLU A 86 -0.243 -11.498 -0.665 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -0.686 -13.820 1.181 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -1.789 -13.645 -0.169 1.00 0.00 H new ATOM 0 HG2 GLU A 86 0.491 -13.347 -1.535 1.00 0.00 H new ATOM 0 HG3 GLU A 86 1.149 -14.237 -0.177 1.00 0.00 H new ATOM 1272 N THR A 87 -2.955 -11.538 -0.421 1.00 0.00 N ATOM 1273 CA THR A 87 -4.307 -10.999 -0.334 1.00 0.00 C ATOM 1274 C THR A 87 -5.344 -12.087 -0.587 1.00 0.00 C ATOM 1275 O THR A 87 -4.998 -13.240 -0.844 1.00 0.00 O ATOM 1276 CB THR A 87 -4.490 -9.860 -1.339 1.00 0.00 C ATOM 1277 OG1 THR A 87 -4.325 -10.331 -2.664 1.00 0.00 O ATOM 1278 CG2 THR A 87 -3.519 -8.718 -1.132 1.00 0.00 C ATOM 0 H THR A 87 -2.795 -12.147 -1.223 1.00 0.00 H new ATOM 0 HA THR A 87 -4.452 -10.612 0.674 1.00 0.00 H new ATOM 0 HB THR A 87 -5.502 -9.488 -1.175 1.00 0.00 H new ATOM 0 HG1 THR A 87 -4.013 -11.260 -2.645 1.00 0.00 H new ATOM 0 HG21 THR A 87 -3.703 -7.944 -1.877 1.00 0.00 H new ATOM 0 HG22 THR A 87 -3.656 -8.301 -0.134 1.00 0.00 H new ATOM 0 HG23 THR A 87 -2.498 -9.085 -1.235 1.00 0.00 H new ATOM 1286 N GLN A 88 -6.618 -11.713 -0.514 1.00 0.00 N ATOM 1287 CA GLN A 88 -7.706 -12.659 -0.737 1.00 0.00 C ATOM 1288 C GLN A 88 -8.508 -12.303 -1.989 1.00 0.00 C ATOM 1289 O GLN A 88 -9.539 -12.914 -2.268 1.00 0.00 O ATOM 1290 CB GLN A 88 -8.633 -12.694 0.481 1.00 0.00 C ATOM 1291 CG GLN A 88 -8.274 -13.777 1.486 1.00 0.00 C ATOM 1292 CD GLN A 88 -8.074 -13.233 2.887 1.00 0.00 C ATOM 1293 OE1 GLN A 88 -6.947 -12.977 3.311 1.00 0.00 O ATOM 1294 NE2 GLN A 88 -9.171 -13.053 3.614 1.00 0.00 N ATOM 0 H GLN A 88 -6.922 -10.763 -0.302 1.00 0.00 H new ATOM 0 HA GLN A 88 -7.265 -13.645 -0.886 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -8.604 -11.724 0.978 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -9.658 -12.848 0.143 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -9.064 -14.528 1.502 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -7.362 -14.279 1.162 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -10.085 -13.279 3.222 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -9.099 -12.689 4.564 1.00 0.00 H new ATOM 1303 N PHE A 89 -8.031 -11.314 -2.744 1.00 0.00 N ATOM 1304 CA PHE A 89 -8.710 -10.889 -3.962 1.00 0.00 C ATOM 1305 C PHE A 89 -7.881 -11.233 -5.195 1.00 0.00 C ATOM 1306 O PHE A 89 -8.426 -11.533 -6.257 1.00 0.00 O ATOM 1307 CB PHE A 89 -8.987 -9.385 -3.921 1.00 0.00 C ATOM 1308 CG PHE A 89 -7.777 -8.560 -3.585 1.00 0.00 C ATOM 1309 CD1 PHE A 89 -6.760 -8.389 -4.511 1.00 0.00 C ATOM 1310 CD2 PHE A 89 -7.658 -7.955 -2.345 1.00 0.00 C ATOM 1311 CE1 PHE A 89 -5.647 -7.630 -4.205 1.00 0.00 C ATOM 1312 CE2 PHE A 89 -6.547 -7.194 -2.033 1.00 0.00 C ATOM 1313 CZ PHE A 89 -5.541 -7.031 -2.965 1.00 0.00 C ATOM 0 H PHE A 89 -7.179 -10.795 -2.532 1.00 0.00 H new ATOM 0 HA PHE A 89 -9.658 -11.423 -4.024 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -9.375 -9.069 -4.889 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -9.767 -9.187 -3.186 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -6.839 -8.854 -5.482 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -8.442 -8.079 -1.613 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -4.861 -7.505 -4.935 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -6.466 -6.728 -1.062 1.00 0.00 H new ATOM 0 HZ PHE A 89 -4.672 -6.436 -2.725 1.00 0.00 H new ATOM 1323 N ALA A 90 -6.561 -11.190 -5.046 1.00 0.00 N ATOM 1324 CA ALA A 90 -5.657 -11.499 -6.146 1.00 0.00 C ATOM 1325 C ALA A 90 -4.394 -12.191 -5.640 1.00 0.00 C ATOM 1326 O ALA A 90 -3.825 -11.793 -4.623 1.00 0.00 O ATOM 1327 CB ALA A 90 -5.297 -10.231 -6.905 1.00 0.00 C ATOM 0 H ALA A 90 -6.094 -10.944 -4.173 1.00 0.00 H new ATOM 0 HA ALA A 90 -6.169 -12.182 -6.824 1.00 0.00 H new ATOM 0 HB1 ALA A 90 -4.621 -10.477 -7.724 1.00 0.00 H new ATOM 0 HB2 ALA A 90 -6.203 -9.777 -7.306 1.00 0.00 H new ATOM 0 HB3 ALA A 90 -4.808 -9.529 -6.229 1.00 0.00 H new ATOM 1333 N PRO A 91 -3.933 -13.243 -6.343 1.00 0.00 N ATOM 1334 CA PRO A 91 -2.730 -13.985 -5.953 1.00 0.00 C ATOM 1335 C PRO A 91 -1.451 -13.201 -6.224 1.00 0.00 C ATOM 1336 O PRO A 91 -1.186 -12.800 -7.357 1.00 0.00 O ATOM 1337 CB PRO A 91 -2.787 -15.234 -6.833 1.00 0.00 C ATOM 1338 CG PRO A 91 -3.543 -14.806 -8.042 1.00 0.00 C ATOM 1339 CD PRO A 91 -4.547 -13.790 -7.570 1.00 0.00 C ATOM 0 HA PRO A 91 -2.710 -14.198 -4.884 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -1.787 -15.582 -7.093 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -3.288 -16.056 -6.322 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -2.874 -14.376 -8.787 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -4.039 -15.655 -8.512 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -4.713 -13.013 -8.316 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -5.515 -14.247 -7.365 1.00 0.00 H new ATOM 1347 N GLY A 92 -0.661 -12.986 -5.177 1.00 0.00 N ATOM 1348 CA GLY A 92 0.581 -12.251 -5.325 1.00 0.00 C ATOM 1349 C GLY A 92 0.968 -11.507 -4.062 1.00 0.00 C ATOM 1350 O GLY A 92 0.310 -11.634 -3.030 1.00 0.00 O ATOM 0 H GLY A 92 -0.859 -13.308 -4.229 1.00 0.00 H new ATOM 0 HA2 GLY A 92 1.379 -12.943 -5.595 1.00 0.00 H new ATOM 0 HA3 GLY A 92 0.484 -11.541 -6.146 1.00 0.00 H new ATOM 1354 N GLN A 93 2.043 -10.727 -4.144 1.00 0.00 N ATOM 1355 CA GLN A 93 2.518 -9.959 -3.000 1.00 0.00 C ATOM 1356 C GLN A 93 2.102 -8.496 -3.116 1.00 0.00 C ATOM 1357 O GLN A 93 2.280 -7.871 -4.162 1.00 0.00 O ATOM 1358 CB GLN A 93 4.042 -10.060 -2.890 1.00 0.00 C ATOM 1359 CG GLN A 93 4.513 -11.224 -2.033 1.00 0.00 C ATOM 1360 CD GLN A 93 4.967 -10.786 -0.655 1.00 0.00 C ATOM 1361 OE1 GLN A 93 6.123 -10.982 -0.278 1.00 0.00 O ATOM 1362 NE2 GLN A 93 4.057 -10.190 0.107 1.00 0.00 N ATOM 0 H GLN A 93 2.600 -10.611 -4.991 1.00 0.00 H new ATOM 0 HA GLN A 93 2.066 -10.376 -2.100 1.00 0.00 H new ATOM 0 HB2 GLN A 93 4.464 -10.161 -3.890 1.00 0.00 H new ATOM 0 HB3 GLN A 93 4.430 -9.131 -2.472 1.00 0.00 H new ATOM 0 HG2 GLN A 93 3.704 -11.947 -1.932 1.00 0.00 H new ATOM 0 HG3 GLN A 93 5.334 -11.733 -2.537 1.00 0.00 H new ATOM 0 HE21 GLN A 93 3.111 -10.048 -0.246 1.00 0.00 H new ATOM 0 HE22 GLN A 93 4.305 -9.874 1.045 1.00 0.00 H new ATOM 1371 N TRP A 94 1.547 -7.956 -2.036 1.00 0.00 N ATOM 1372 CA TRP A 94 1.105 -6.566 -2.016 1.00 0.00 C ATOM 1373 C TRP A 94 1.681 -5.829 -0.811 1.00 0.00 C ATOM 1374 O TRP A 94 2.230 -6.447 0.102 1.00 0.00 O ATOM 1375 CB TRP A 94 -0.423 -6.496 -1.989 1.00 0.00 C ATOM 1376 CG TRP A 94 -1.071 -7.228 -3.123 1.00 0.00 C ATOM 1377 CD1 TRP A 94 -1.340 -8.565 -3.190 1.00 0.00 C ATOM 1378 CD2 TRP A 94 -1.531 -6.664 -4.357 1.00 0.00 C ATOM 1379 NE1 TRP A 94 -1.940 -8.866 -4.388 1.00 0.00 N ATOM 1380 CE2 TRP A 94 -2.068 -7.716 -5.123 1.00 0.00 C ATOM 1381 CE3 TRP A 94 -1.542 -5.371 -4.889 1.00 0.00 C ATOM 1382 CZ2 TRP A 94 -2.609 -7.515 -6.390 1.00 0.00 C ATOM 1383 CZ3 TRP A 94 -2.080 -5.173 -6.147 1.00 0.00 C ATOM 1384 CH2 TRP A 94 -2.607 -6.239 -6.885 1.00 0.00 C ATOM 0 H TRP A 94 1.392 -8.460 -1.163 1.00 0.00 H new ATOM 0 HA TRP A 94 1.468 -6.082 -2.922 1.00 0.00 H new ATOM 0 HB2 TRP A 94 -0.782 -6.910 -1.047 1.00 0.00 H new ATOM 0 HB3 TRP A 94 -0.732 -5.451 -2.017 1.00 0.00 H new ATOM 0 HD1 TRP A 94 -1.114 -9.281 -2.414 1.00 0.00 H new ATOM 0 HE1 TRP A 94 -2.242 -9.795 -4.683 1.00 0.00 H new ATOM 0 HE3 TRP A 94 -1.138 -4.542 -4.327 1.00 0.00 H new ATOM 0 HZ2 TRP A 94 -3.016 -8.336 -6.962 1.00 0.00 H new ATOM 0 HZ3 TRP A 94 -2.094 -4.178 -6.568 1.00 0.00 H new ATOM 0 HH2 TRP A 94 -3.020 -6.051 -7.865 1.00 0.00 H new ATOM 1395 N ALA A 95 1.554 -4.506 -0.816 1.00 0.00 N ATOM 1396 CA ALA A 95 2.062 -3.686 0.276 1.00 0.00 C ATOM 1397 C ALA A 95 1.142 -2.502 0.548 1.00 0.00 C ATOM 1398 O ALA A 95 1.137 -1.522 -0.197 1.00 0.00 O ATOM 1399 CB ALA A 95 3.470 -3.203 -0.040 1.00 0.00 C ATOM 0 H ALA A 95 1.103 -3.980 -1.565 1.00 0.00 H new ATOM 0 HA ALA A 95 2.093 -4.300 1.176 1.00 0.00 H new ATOM 0 HB1 ALA A 95 3.838 -2.591 0.784 1.00 0.00 H new ATOM 0 HB2 ALA A 95 4.127 -4.062 -0.176 1.00 0.00 H new ATOM 0 HB3 ALA A 95 3.454 -2.609 -0.954 1.00 0.00 H new ATOM 1405 N GLY A 96 0.365 -2.597 1.621 1.00 0.00 N ATOM 1406 CA GLY A 96 -0.549 -1.526 1.974 1.00 0.00 C ATOM 1407 C GLY A 96 0.175 -0.289 2.468 1.00 0.00 C ATOM 1408 O GLY A 96 0.924 -0.348 3.443 1.00 0.00 O ATOM 0 H GLY A 96 0.352 -3.397 2.253 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -1.154 -1.267 1.105 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -1.234 -1.876 2.747 1.00 0.00 H new ATOM 1412 N ILE A 97 -0.049 0.835 1.795 1.00 0.00 N ATOM 1413 CA ILE A 97 0.587 2.092 2.171 1.00 0.00 C ATOM 1414 C ILE A 97 -0.445 3.200 2.346 1.00 0.00 C ATOM 1415 O ILE A 97 -1.402 3.297 1.579 1.00 0.00 O ATOM 1416 CB ILE A 97 1.625 2.534 1.121 1.00 0.00 C ATOM 1417 CG1 ILE A 97 2.530 1.360 0.735 1.00 0.00 C ATOM 1418 CG2 ILE A 97 2.451 3.697 1.650 1.00 0.00 C ATOM 1419 CD1 ILE A 97 2.397 0.947 -0.714 1.00 0.00 C ATOM 0 H ILE A 97 -0.667 0.901 0.986 1.00 0.00 H new ATOM 0 HA ILE A 97 1.093 1.917 3.120 1.00 0.00 H new ATOM 0 HB ILE A 97 1.096 2.866 0.228 1.00 0.00 H new ATOM 0 HG12 ILE A 97 3.567 1.630 0.934 1.00 0.00 H new ATOM 0 HG13 ILE A 97 2.296 0.506 1.371 1.00 0.00 H new ATOM 0 HG21 ILE A 97 3.180 3.998 0.897 1.00 0.00 H new ATOM 0 HG22 ILE A 97 1.794 4.537 1.875 1.00 0.00 H new ATOM 0 HG23 ILE A 97 2.972 3.390 2.557 1.00 0.00 H new ATOM 0 HD11 ILE A 97 3.066 0.111 -0.917 1.00 0.00 H new ATOM 0 HD12 ILE A 97 1.369 0.645 -0.913 1.00 0.00 H new ATOM 0 HD13 ILE A 97 2.660 1.787 -1.357 1.00 0.00 H new ATOM 1431 N VAL A 98 -0.243 4.036 3.360 1.00 0.00 N ATOM 1432 CA VAL A 98 -1.155 5.138 3.635 1.00 0.00 C ATOM 1433 C VAL A 98 -0.575 6.464 3.157 1.00 0.00 C ATOM 1434 O VAL A 98 0.418 6.951 3.697 1.00 0.00 O ATOM 1435 CB VAL A 98 -1.473 5.244 5.139 1.00 0.00 C ATOM 1436 CG1 VAL A 98 -2.580 6.257 5.383 1.00 0.00 C ATOM 1437 CG2 VAL A 98 -1.853 3.882 5.701 1.00 0.00 C ATOM 0 H VAL A 98 0.545 3.970 4.004 1.00 0.00 H new ATOM 0 HA VAL A 98 -2.076 4.928 3.090 1.00 0.00 H new ATOM 0 HB VAL A 98 -0.578 5.589 5.657 1.00 0.00 H new ATOM 0 HG11 VAL A 98 -2.790 6.317 6.451 1.00 0.00 H new ATOM 0 HG12 VAL A 98 -2.265 7.235 5.020 1.00 0.00 H new ATOM 0 HG13 VAL A 98 -3.481 5.946 4.853 1.00 0.00 H new ATOM 0 HG21 VAL A 98 -2.074 3.976 6.764 1.00 0.00 H new ATOM 0 HG22 VAL A 98 -2.733 3.506 5.179 1.00 0.00 H new ATOM 0 HG23 VAL A 98 -1.024 3.187 5.563 1.00 0.00 H new ATOM 1447 N LEU A 99 -1.202 7.045 2.138 1.00 0.00 N ATOM 1448 CA LEU A 99 -0.747 8.316 1.585 1.00 0.00 C ATOM 1449 C LEU A 99 -1.071 9.468 2.532 1.00 0.00 C ATOM 1450 O LEU A 99 -1.848 9.311 3.473 1.00 0.00 O ATOM 1451 CB LEU A 99 -1.396 8.564 0.222 1.00 0.00 C ATOM 1452 CG LEU A 99 -1.228 7.431 -0.791 1.00 0.00 C ATOM 1453 CD1 LEU A 99 -2.318 7.496 -1.850 1.00 0.00 C ATOM 1454 CD2 LEU A 99 0.149 7.494 -1.435 1.00 0.00 C ATOM 0 H LEU A 99 -2.026 6.656 1.679 1.00 0.00 H new ATOM 0 HA LEU A 99 0.335 8.264 1.461 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -2.461 8.743 0.371 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -0.976 9.476 -0.203 1.00 0.00 H new ATOM 0 HG LEU A 99 -1.319 6.481 -0.265 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.182 6.682 -2.562 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -3.294 7.403 -1.374 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -2.260 8.450 -2.374 1.00 0.00 H new ATOM 0 HD21 LEU A 99 0.252 6.681 -2.153 1.00 0.00 H new ATOM 0 HD22 LEU A 99 0.267 8.448 -1.948 1.00 0.00 H new ATOM 0 HD23 LEU A 99 0.915 7.398 -0.666 1.00 0.00 H new ATOM 1466 N ASP A 100 -0.468 10.624 2.276 1.00 0.00 N ATOM 1467 CA ASP A 100 -0.693 11.803 3.105 1.00 0.00 C ATOM 1468 C ASP A 100 -1.634 12.784 2.413 1.00 0.00 C ATOM 1469 O ASP A 100 -1.549 13.994 2.623 1.00 0.00 O ATOM 1470 CB ASP A 100 0.637 12.491 3.420 1.00 0.00 C ATOM 1471 CG ASP A 100 1.670 11.527 3.968 1.00 0.00 C ATOM 1472 OD1 ASP A 100 1.349 10.793 4.925 1.00 0.00 O ATOM 1473 OD2 ASP A 100 2.801 11.506 3.438 1.00 0.00 O ATOM 0 H ASP A 100 0.180 10.770 1.502 1.00 0.00 H new ATOM 0 HA ASP A 100 -1.157 11.478 4.036 1.00 0.00 H new ATOM 0 HB2 ASP A 100 1.024 12.959 2.515 1.00 0.00 H new ATOM 0 HB3 ASP A 100 0.468 13.288 4.144 1.00 0.00 H new ATOM 1478 N GLU A 101 -2.532 12.253 1.589 1.00 0.00 N ATOM 1479 CA GLU A 101 -3.491 13.081 0.866 1.00 0.00 C ATOM 1480 C GLU A 101 -4.561 12.217 0.202 1.00 0.00 C ATOM 1481 O GLU A 101 -4.319 11.054 -0.123 1.00 0.00 O ATOM 1482 CB GLU A 101 -2.773 13.928 -0.187 1.00 0.00 C ATOM 1483 CG GLU A 101 -2.695 15.405 0.169 1.00 0.00 C ATOM 1484 CD GLU A 101 -1.720 16.165 -0.707 1.00 0.00 C ATOM 1485 OE1 GLU A 101 -0.642 15.615 -1.013 1.00 0.00 O ATOM 1486 OE2 GLU A 101 -2.036 17.312 -1.089 1.00 0.00 O ATOM 0 H GLU A 101 -2.616 11.253 1.405 1.00 0.00 H new ATOM 0 HA GLU A 101 -3.977 13.743 1.582 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -1.763 13.542 -0.324 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -3.288 13.820 -1.141 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -3.685 15.850 0.075 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -2.397 15.508 1.212 1.00 0.00 H new ATOM 1493 N PRO A 102 -5.765 12.777 -0.011 1.00 0.00 N ATOM 1494 CA PRO A 102 -6.873 12.051 -0.641 1.00 0.00 C ATOM 1495 C PRO A 102 -6.612 11.766 -2.116 1.00 0.00 C ATOM 1496 O PRO A 102 -7.321 12.264 -2.992 1.00 0.00 O ATOM 1497 CB PRO A 102 -8.061 13.003 -0.480 1.00 0.00 C ATOM 1498 CG PRO A 102 -7.450 14.357 -0.363 1.00 0.00 C ATOM 1499 CD PRO A 102 -6.138 14.159 0.344 1.00 0.00 C ATOM 0 HA PRO A 102 -7.031 11.073 -0.186 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -8.733 12.945 -1.336 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -8.649 12.756 0.404 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -7.300 14.804 -1.346 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -8.098 15.030 0.198 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -5.389 14.876 0.009 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -6.239 14.284 1.422 1.00 0.00 H new ATOM 1507 N ILE A 103 -5.589 10.962 -2.385 1.00 0.00 N ATOM 1508 CA ILE A 103 -5.233 10.610 -3.755 1.00 0.00 C ATOM 1509 C ILE A 103 -4.890 9.128 -3.871 1.00 0.00 C ATOM 1510 O ILE A 103 -4.064 8.735 -4.694 1.00 0.00 O ATOM 1511 CB ILE A 103 -4.038 11.443 -4.256 1.00 0.00 C ATOM 1512 CG1 ILE A 103 -2.891 11.389 -3.244 1.00 0.00 C ATOM 1513 CG2 ILE A 103 -4.462 12.882 -4.507 1.00 0.00 C ATOM 1514 CD1 ILE A 103 -1.520 11.458 -3.882 1.00 0.00 C ATOM 0 H ILE A 103 -4.992 10.542 -1.673 1.00 0.00 H new ATOM 0 HA ILE A 103 -6.103 10.828 -4.374 1.00 0.00 H new ATOM 0 HB ILE A 103 -3.688 11.019 -5.197 1.00 0.00 H new ATOM 0 HG12 ILE A 103 -2.998 12.215 -2.541 1.00 0.00 H new ATOM 0 HG13 ILE A 103 -2.969 10.467 -2.667 1.00 0.00 H new ATOM 0 HG21 ILE A 103 -3.606 13.457 -4.860 1.00 0.00 H new ATOM 0 HG22 ILE A 103 -5.250 12.903 -5.260 1.00 0.00 H new ATOM 0 HG23 ILE A 103 -4.835 13.318 -3.580 1.00 0.00 H new ATOM 0 HD11 ILE A 103 -0.755 11.415 -3.107 1.00 0.00 H new ATOM 0 HD12 ILE A 103 -1.393 10.617 -4.564 1.00 0.00 H new ATOM 0 HD13 ILE A 103 -1.423 12.392 -4.436 1.00 0.00 H new ATOM 1526 N GLY A 104 -5.533 8.311 -3.043 1.00 0.00 N ATOM 1527 CA GLY A 104 -5.282 6.882 -3.070 1.00 0.00 C ATOM 1528 C GLY A 104 -6.210 6.148 -4.017 1.00 0.00 C ATOM 1529 O GLY A 104 -6.905 6.768 -4.821 1.00 0.00 O ATOM 0 H GLY A 104 -6.223 8.613 -2.355 1.00 0.00 H new ATOM 0 HA2 GLY A 104 -4.249 6.703 -3.368 1.00 0.00 H new ATOM 0 HA3 GLY A 104 -5.399 6.477 -2.065 1.00 0.00 H new ATOM 1533 N LYS A 105 -6.221 4.821 -3.924 1.00 0.00 N ATOM 1534 CA LYS A 105 -7.071 4.001 -4.779 1.00 0.00 C ATOM 1535 C LYS A 105 -7.753 2.899 -3.975 1.00 0.00 C ATOM 1536 O LYS A 105 -8.043 1.823 -4.500 1.00 0.00 O ATOM 1537 CB LYS A 105 -6.247 3.388 -5.912 1.00 0.00 C ATOM 1538 CG LYS A 105 -5.807 4.397 -6.960 1.00 0.00 C ATOM 1539 CD LYS A 105 -6.687 4.338 -8.198 1.00 0.00 C ATOM 1540 CE LYS A 105 -6.021 3.558 -9.319 1.00 0.00 C ATOM 1541 NZ LYS A 105 -6.971 3.251 -10.424 1.00 0.00 N ATOM 0 H LYS A 105 -5.650 4.292 -3.265 1.00 0.00 H new ATOM 0 HA LYS A 105 -7.842 4.642 -5.205 1.00 0.00 H new ATOM 0 HB2 LYS A 105 -5.365 2.908 -5.489 1.00 0.00 H new ATOM 0 HB3 LYS A 105 -6.834 2.607 -6.396 1.00 0.00 H new ATOM 0 HG2 LYS A 105 -5.841 5.401 -6.536 1.00 0.00 H new ATOM 0 HG3 LYS A 105 -4.771 4.204 -7.240 1.00 0.00 H new ATOM 0 HD2 LYS A 105 -7.640 3.873 -7.946 1.00 0.00 H new ATOM 0 HD3 LYS A 105 -6.906 5.350 -8.538 1.00 0.00 H new ATOM 0 HE2 LYS A 105 -5.181 4.132 -9.711 1.00 0.00 H new ATOM 0 HE3 LYS A 105 -5.614 2.628 -8.922 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 -6.477 2.718 -11.168 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 -7.760 2.682 -10.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 -7.341 4.138 -10.821 1.00 0.00 H new ATOM 1555 N ASN A 106 -8.007 3.173 -2.699 1.00 0.00 N ATOM 1556 CA ASN A 106 -8.655 2.205 -1.822 1.00 0.00 C ATOM 1557 C ASN A 106 -8.873 2.793 -0.432 1.00 0.00 C ATOM 1558 O ASN A 106 -8.624 3.977 -0.202 1.00 0.00 O ATOM 1559 CB ASN A 106 -7.816 0.928 -1.728 1.00 0.00 C ATOM 1560 CG ASN A 106 -8.424 -0.222 -2.508 1.00 0.00 C ATOM 1561 OD1 ASN A 106 -9.296 -0.020 -3.354 1.00 0.00 O ATOM 1562 ND2 ASN A 106 -7.966 -1.436 -2.226 1.00 0.00 N ATOM 0 H ASN A 106 -7.774 4.058 -2.249 1.00 0.00 H new ATOM 0 HA ASN A 106 -9.628 1.958 -2.247 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -6.812 1.128 -2.103 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -7.714 0.640 -0.682 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -8.338 -2.248 -2.718 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -7.242 -1.556 -1.517 1.00 0.00 H new ATOM 1569 N ASP A 107 -9.337 1.960 0.494 1.00 0.00 N ATOM 1570 CA ASP A 107 -9.586 2.398 1.861 1.00 0.00 C ATOM 1571 C ASP A 107 -9.157 1.332 2.862 1.00 0.00 C ATOM 1572 O ASP A 107 -9.749 1.196 3.933 1.00 0.00 O ATOM 1573 CB ASP A 107 -11.069 2.725 2.051 1.00 0.00 C ATOM 1574 CG ASP A 107 -11.609 3.622 0.955 1.00 0.00 C ATOM 1575 OD1 ASP A 107 -11.065 4.732 0.775 1.00 0.00 O ATOM 1576 OD2 ASP A 107 -12.575 3.215 0.276 1.00 0.00 O ATOM 0 H ASP A 107 -9.548 0.977 0.321 1.00 0.00 H new ATOM 0 HA ASP A 107 -8.996 3.297 2.041 1.00 0.00 H new ATOM 0 HB2 ASP A 107 -11.642 1.798 2.073 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -11.210 3.211 3.017 1.00 0.00 H new ATOM 1581 N GLY A 108 -8.122 0.576 2.507 1.00 0.00 N ATOM 1582 CA GLY A 108 -7.631 -0.469 3.386 1.00 0.00 C ATOM 1583 C GLY A 108 -8.597 -1.631 3.502 1.00 0.00 C ATOM 1584 O GLY A 108 -8.654 -2.300 4.533 1.00 0.00 O ATOM 0 H GLY A 108 -7.615 0.669 1.627 1.00 0.00 H new ATOM 0 HA2 GLY A 108 -6.673 -0.833 3.013 1.00 0.00 H new ATOM 0 HA3 GLY A 108 -7.450 -0.051 4.376 1.00 0.00 H new ATOM 1588 N SER A 109 -9.362 -1.869 2.441 1.00 0.00 N ATOM 1589 CA SER A 109 -10.333 -2.958 2.427 1.00 0.00 C ATOM 1590 C SER A 109 -10.710 -3.330 0.997 1.00 0.00 C ATOM 1591 O SER A 109 -11.064 -2.468 0.194 1.00 0.00 O ATOM 1592 CB SER A 109 -11.586 -2.562 3.210 1.00 0.00 C ATOM 1593 OG SER A 109 -11.897 -1.193 3.017 1.00 0.00 O ATOM 0 H SER A 109 -9.328 -1.323 1.580 1.00 0.00 H new ATOM 0 HA SER A 109 -9.876 -3.826 2.902 1.00 0.00 H new ATOM 0 HB2 SER A 109 -12.427 -3.178 2.891 1.00 0.00 H new ATOM 0 HB3 SER A 109 -11.432 -2.757 4.271 1.00 0.00 H new ATOM 0 HG SER A 109 -12.703 -0.966 3.527 1.00 0.00 H new ATOM 1599 N VAL A 110 -10.630 -4.620 0.685 1.00 0.00 N ATOM 1600 CA VAL A 110 -10.963 -5.104 -0.649 1.00 0.00 C ATOM 1601 C VAL A 110 -11.891 -6.313 -0.581 1.00 0.00 C ATOM 1602 O VAL A 110 -11.614 -7.281 0.127 1.00 0.00 O ATOM 1603 CB VAL A 110 -9.700 -5.486 -1.441 1.00 0.00 C ATOM 1604 CG1 VAL A 110 -10.048 -5.795 -2.889 1.00 0.00 C ATOM 1605 CG2 VAL A 110 -8.664 -4.373 -1.360 1.00 0.00 C ATOM 0 H VAL A 110 -10.338 -5.348 1.337 1.00 0.00 H new ATOM 0 HA VAL A 110 -11.471 -4.287 -1.162 1.00 0.00 H new ATOM 0 HB VAL A 110 -9.273 -6.385 -0.996 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -9.142 -6.063 -3.432 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -10.751 -6.627 -2.925 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -10.501 -4.917 -3.350 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -7.777 -4.659 -1.925 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -9.081 -3.457 -1.778 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -8.391 -4.205 -0.318 1.00 0.00 H new ATOM 1615 N ALA A 111 -12.992 -6.249 -1.322 1.00 0.00 N ATOM 1616 CA ALA A 111 -13.961 -7.337 -1.347 1.00 0.00 C ATOM 1617 C ALA A 111 -14.505 -7.625 0.048 1.00 0.00 C ATOM 1618 O ALA A 111 -14.944 -8.738 0.336 1.00 0.00 O ATOM 1619 CB ALA A 111 -13.332 -8.590 -1.938 1.00 0.00 C ATOM 0 H ALA A 111 -13.235 -5.454 -1.913 1.00 0.00 H new ATOM 0 HA ALA A 111 -14.796 -7.029 -1.976 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -14.067 -9.395 -1.951 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -13.001 -8.385 -2.956 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -12.477 -8.889 -1.331 1.00 0.00 H new ATOM 1625 N GLY A 112 -14.474 -6.615 0.913 1.00 0.00 N ATOM 1626 CA GLY A 112 -14.968 -6.784 2.267 1.00 0.00 C ATOM 1627 C GLY A 112 -13.879 -7.194 3.242 1.00 0.00 C ATOM 1628 O GLY A 112 -14.041 -7.055 4.454 1.00 0.00 O ATOM 0 H GLY A 112 -14.116 -5.684 0.700 1.00 0.00 H new ATOM 0 HA2 GLY A 112 -15.419 -5.850 2.604 1.00 0.00 H new ATOM 0 HA3 GLY A 112 -15.755 -7.538 2.270 1.00 0.00 H new ATOM 1632 N VAL A 113 -12.767 -7.700 2.714 1.00 0.00 N ATOM 1633 CA VAL A 113 -11.654 -8.130 3.551 1.00 0.00 C ATOM 1634 C VAL A 113 -10.810 -6.941 3.998 1.00 0.00 C ATOM 1635 O VAL A 113 -10.374 -6.132 3.178 1.00 0.00 O ATOM 1636 CB VAL A 113 -10.751 -9.136 2.812 1.00 0.00 C ATOM 1637 CG1 VAL A 113 -9.688 -9.692 3.748 1.00 0.00 C ATOM 1638 CG2 VAL A 113 -11.582 -10.262 2.211 1.00 0.00 C ATOM 0 H VAL A 113 -12.614 -7.821 1.713 1.00 0.00 H new ATOM 0 HA VAL A 113 -12.086 -8.615 4.426 1.00 0.00 H new ATOM 0 HB VAL A 113 -10.248 -8.612 1.999 1.00 0.00 H new ATOM 0 HG11 VAL A 113 -9.061 -10.400 3.207 1.00 0.00 H new ATOM 0 HG12 VAL A 113 -9.072 -8.876 4.124 1.00 0.00 H new ATOM 0 HG13 VAL A 113 -10.169 -10.199 4.585 1.00 0.00 H new ATOM 0 HG21 VAL A 113 -10.926 -10.962 1.693 1.00 0.00 H new ATOM 0 HG22 VAL A 113 -12.116 -10.784 3.005 1.00 0.00 H new ATOM 0 HG23 VAL A 113 -12.300 -9.847 1.504 1.00 0.00 H new ATOM 1648 N ARG A 114 -10.585 -6.840 5.305 1.00 0.00 N ATOM 1649 CA ARG A 114 -9.795 -5.750 5.862 1.00 0.00 C ATOM 1650 C ARG A 114 -8.350 -6.188 6.087 1.00 0.00 C ATOM 1651 O ARG A 114 -8.093 -7.264 6.626 1.00 0.00 O ATOM 1652 CB ARG A 114 -10.409 -5.269 7.179 1.00 0.00 C ATOM 1653 CG ARG A 114 -10.774 -3.792 7.175 1.00 0.00 C ATOM 1654 CD ARG A 114 -12.240 -3.575 7.510 1.00 0.00 C ATOM 1655 NE ARG A 114 -12.549 -3.950 8.888 1.00 0.00 N ATOM 1656 CZ ARG A 114 -12.178 -3.238 9.950 1.00 0.00 C ATOM 1657 NH1 ARG A 114 -11.487 -2.115 9.797 1.00 0.00 N ATOM 1658 NH2 ARG A 114 -12.499 -3.649 11.169 1.00 0.00 N ATOM 0 H ARG A 114 -10.939 -7.500 5.997 1.00 0.00 H new ATOM 0 HA ARG A 114 -9.799 -4.927 5.148 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -11.303 -5.856 7.389 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -9.705 -5.459 7.989 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -10.153 -3.262 7.897 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -10.558 -3.366 6.195 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -12.496 -2.527 7.354 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -12.858 -4.159 6.828 1.00 0.00 H new ATOM 0 HE ARG A 114 -13.080 -4.807 9.045 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -11.237 -1.793 8.862 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -11.206 -1.574 10.615 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -13.030 -4.511 11.293 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -12.215 -3.103 11.983 1.00 0.00 H new ATOM 1672 N TYR A 115 -7.409 -5.346 5.670 1.00 0.00 N ATOM 1673 CA TYR A 115 -5.991 -5.647 5.826 1.00 0.00 C ATOM 1674 C TYR A 115 -5.317 -4.632 6.744 1.00 0.00 C ATOM 1675 O TYR A 115 -4.499 -4.993 7.591 1.00 0.00 O ATOM 1676 CB TYR A 115 -5.297 -5.658 4.462 1.00 0.00 C ATOM 1677 CG TYR A 115 -5.884 -6.659 3.493 1.00 0.00 C ATOM 1678 CD1 TYR A 115 -7.001 -6.343 2.729 1.00 0.00 C ATOM 1679 CD2 TYR A 115 -5.321 -7.920 3.342 1.00 0.00 C ATOM 1680 CE1 TYR A 115 -7.540 -7.256 1.844 1.00 0.00 C ATOM 1681 CE2 TYR A 115 -5.854 -8.838 2.457 1.00 0.00 C ATOM 1682 CZ TYR A 115 -6.964 -8.501 1.711 1.00 0.00 C ATOM 1683 OH TYR A 115 -7.499 -9.413 0.830 1.00 0.00 O ATOM 0 H TYR A 115 -7.603 -4.451 5.222 1.00 0.00 H new ATOM 0 HA TYR A 115 -5.903 -6.635 6.279 1.00 0.00 H new ATOM 0 HB2 TYR A 115 -5.359 -4.662 4.024 1.00 0.00 H new ATOM 0 HB3 TYR A 115 -4.239 -5.879 4.604 1.00 0.00 H new ATOM 0 HD1 TYR A 115 -7.455 -5.368 2.829 1.00 0.00 H new ATOM 0 HD2 TYR A 115 -4.453 -8.187 3.926 1.00 0.00 H new ATOM 0 HE1 TYR A 115 -8.409 -6.995 1.259 1.00 0.00 H new ATOM 0 HE2 TYR A 115 -5.404 -9.814 2.350 1.00 0.00 H new ATOM 0 HH TYR A 115 -7.549 -9.014 -0.064 1.00 0.00 H new ATOM 1693 N PHE A 116 -5.666 -3.362 6.571 1.00 0.00 N ATOM 1694 CA PHE A 116 -5.094 -2.295 7.385 1.00 0.00 C ATOM 1695 C PHE A 116 -6.024 -1.086 7.428 1.00 0.00 C ATOM 1696 O PHE A 116 -6.466 -0.593 6.389 1.00 0.00 O ATOM 1697 CB PHE A 116 -3.727 -1.883 6.838 1.00 0.00 C ATOM 1698 CG PHE A 116 -3.783 -1.290 5.464 1.00 0.00 C ATOM 1699 CD1 PHE A 116 -3.998 0.067 5.288 1.00 0.00 C ATOM 1700 CD2 PHE A 116 -3.618 -2.090 4.347 1.00 0.00 C ATOM 1701 CE1 PHE A 116 -4.046 0.613 4.022 1.00 0.00 C ATOM 1702 CE2 PHE A 116 -3.666 -1.550 3.079 1.00 0.00 C ATOM 1703 CZ PHE A 116 -3.880 -0.197 2.916 1.00 0.00 C ATOM 0 H PHE A 116 -6.342 -3.046 5.875 1.00 0.00 H new ATOM 0 HA PHE A 116 -4.971 -2.673 8.400 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -3.276 -1.160 7.518 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -3.074 -2.756 6.821 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -4.129 0.704 6.150 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -3.450 -3.150 4.470 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -4.213 1.673 3.896 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -3.536 -2.185 2.215 1.00 0.00 H new ATOM 0 HZ PHE A 116 -3.918 0.228 1.924 1.00 0.00 H new ATOM 1713 N GLN A 117 -6.318 -0.613 8.634 1.00 0.00 N ATOM 1714 CA GLN A 117 -7.195 0.538 8.812 1.00 0.00 C ATOM 1715 C GLN A 117 -6.487 1.829 8.410 1.00 0.00 C ATOM 1716 O GLN A 117 -5.348 2.073 8.809 1.00 0.00 O ATOM 1717 CB GLN A 117 -7.664 0.631 10.264 1.00 0.00 C ATOM 1718 CG GLN A 117 -8.970 1.388 10.436 1.00 0.00 C ATOM 1719 CD GLN A 117 -8.864 2.837 10.002 1.00 0.00 C ATOM 1720 OE1 GLN A 117 -8.091 3.611 10.566 1.00 0.00 O ATOM 1721 NE2 GLN A 117 -9.645 3.212 8.995 1.00 0.00 N ATOM 0 H GLN A 117 -5.961 -1.009 9.504 1.00 0.00 H new ATOM 0 HA GLN A 117 -8.063 0.404 8.166 1.00 0.00 H new ATOM 0 HB2 GLN A 117 -7.783 -0.376 10.664 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -6.890 1.120 10.856 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -9.751 0.895 9.857 1.00 0.00 H new ATOM 0 HG3 GLN A 117 -9.275 1.347 11.482 1.00 0.00 H new ATOM 0 HE21 GLN A 117 -10.271 2.537 8.556 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -9.619 4.175 8.660 1.00 0.00 H new ATOM 1730 N CYS A 118 -7.169 2.651 7.620 1.00 0.00 N ATOM 1731 CA CYS A 118 -6.605 3.917 7.165 1.00 0.00 C ATOM 1732 C CYS A 118 -7.707 4.888 6.756 1.00 0.00 C ATOM 1733 O CYS A 118 -8.893 4.565 6.833 1.00 0.00 O ATOM 1734 CB CYS A 118 -5.655 3.682 5.989 1.00 0.00 C ATOM 1735 SG CYS A 118 -6.456 3.007 4.516 1.00 0.00 S ATOM 0 H CYS A 118 -8.113 2.464 7.281 1.00 0.00 H new ATOM 0 HA CYS A 118 -6.048 4.356 7.992 1.00 0.00 H new ATOM 0 HB2 CYS A 118 -5.176 4.626 5.729 1.00 0.00 H new ATOM 0 HB3 CYS A 118 -4.865 3.000 6.305 1.00 0.00 H new ATOM 0 HG CYS A 118 -5.925 1.858 4.221 1.00 0.00 H new ATOM 1741 N GLU A 119 -7.310 6.079 6.323 1.00 0.00 N ATOM 1742 CA GLU A 119 -8.264 7.098 5.903 1.00 0.00 C ATOM 1743 C GLU A 119 -8.683 6.885 4.450 1.00 0.00 C ATOM 1744 O GLU A 119 -7.927 6.330 3.652 1.00 0.00 O ATOM 1745 CB GLU A 119 -7.661 8.493 6.073 1.00 0.00 C ATOM 1746 CG GLU A 119 -7.549 8.934 7.523 1.00 0.00 C ATOM 1747 CD GLU A 119 -8.855 9.474 8.070 1.00 0.00 C ATOM 1748 OE1 GLU A 119 -9.170 10.653 7.801 1.00 0.00 O ATOM 1749 OE2 GLU A 119 -9.563 8.720 8.769 1.00 0.00 O ATOM 0 H GLU A 119 -6.333 6.363 6.254 1.00 0.00 H new ATOM 0 HA GLU A 119 -9.149 7.014 6.534 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -6.670 8.509 5.619 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -8.272 9.213 5.529 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -7.226 8.090 8.132 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -6.779 9.701 7.607 1.00 0.00 H new ATOM 1756 N PRO A 120 -9.900 7.323 4.085 1.00 0.00 N ATOM 1757 CA PRO A 120 -10.417 7.175 2.719 1.00 0.00 C ATOM 1758 C PRO A 120 -9.516 7.836 1.681 1.00 0.00 C ATOM 1759 O PRO A 120 -8.923 8.884 1.935 1.00 0.00 O ATOM 1760 CB PRO A 120 -11.776 7.883 2.766 1.00 0.00 C ATOM 1761 CG PRO A 120 -12.157 7.890 4.206 1.00 0.00 C ATOM 1762 CD PRO A 120 -10.869 7.991 4.971 1.00 0.00 C ATOM 0 HA PRO A 120 -10.476 6.127 2.424 1.00 0.00 H new ATOM 0 HB2 PRO A 120 -11.707 8.897 2.371 1.00 0.00 H new ATOM 0 HB3 PRO A 120 -12.517 7.356 2.164 1.00 0.00 H new ATOM 0 HG2 PRO A 120 -12.813 8.731 4.433 1.00 0.00 H new ATOM 0 HG3 PRO A 120 -12.699 6.982 4.471 1.00 0.00 H new ATOM 0 HD2 PRO A 120 -10.593 9.028 5.161 1.00 0.00 H new ATOM 0 HD3 PRO A 120 -10.936 7.497 5.940 1.00 0.00 H new ATOM 1770 N LEU A 121 -9.421 7.216 0.509 1.00 0.00 N ATOM 1771 CA LEU A 121 -8.599 7.743 -0.574 1.00 0.00 C ATOM 1772 C LEU A 121 -7.143 7.894 -0.139 1.00 0.00 C ATOM 1773 O LEU A 121 -6.538 8.952 -0.314 1.00 0.00 O ATOM 1774 CB LEU A 121 -9.147 9.093 -1.042 1.00 0.00 C ATOM 1775 CG LEU A 121 -10.643 9.107 -1.365 1.00 0.00 C ATOM 1776 CD1 LEU A 121 -11.268 10.430 -0.950 1.00 0.00 C ATOM 1777 CD2 LEU A 121 -10.869 8.851 -2.847 1.00 0.00 C ATOM 0 H LEU A 121 -9.904 6.346 0.285 1.00 0.00 H new ATOM 0 HA LEU A 121 -8.635 7.033 -1.401 1.00 0.00 H new ATOM 0 HB2 LEU A 121 -8.951 9.836 -0.269 1.00 0.00 H new ATOM 0 HB3 LEU A 121 -8.596 9.404 -1.930 1.00 0.00 H new ATOM 0 HG LEU A 121 -11.125 8.309 -0.800 1.00 0.00 H new ATOM 0 HD11 LEU A 121 -12.332 10.420 -1.188 1.00 0.00 H new ATOM 0 HD12 LEU A 121 -11.137 10.574 0.123 1.00 0.00 H new ATOM 0 HD13 LEU A 121 -10.784 11.246 -1.487 1.00 0.00 H new ATOM 0 HD21 LEU A 121 -11.938 8.864 -3.060 1.00 0.00 H new ATOM 0 HD22 LEU A 121 -10.373 9.627 -3.430 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -10.458 7.878 -3.115 1.00 0.00 H new ATOM 1789 N LYS A 122 -6.584 6.829 0.427 1.00 0.00 N ATOM 1790 CA LYS A 122 -5.199 6.844 0.883 1.00 0.00 C ATOM 1791 C LYS A 122 -4.584 5.451 0.800 1.00 0.00 C ATOM 1792 O LYS A 122 -3.509 5.270 0.229 1.00 0.00 O ATOM 1793 CB LYS A 122 -5.117 7.368 2.317 1.00 0.00 C ATOM 1794 CG LYS A 122 -4.944 8.876 2.405 1.00 0.00 C ATOM 1795 CD LYS A 122 -5.807 9.475 3.504 1.00 0.00 C ATOM 1796 CE LYS A 122 -6.313 10.859 3.126 1.00 0.00 C ATOM 1797 NZ LYS A 122 -5.913 11.888 4.125 1.00 0.00 N ATOM 0 H LYS A 122 -7.069 5.945 0.581 1.00 0.00 H new ATOM 0 HA LYS A 122 -4.635 7.509 0.229 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -6.023 7.083 2.852 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -4.282 6.885 2.824 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -3.897 9.112 2.594 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -5.205 9.329 1.449 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -6.654 8.818 3.701 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -5.231 9.537 4.427 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -5.922 11.133 2.146 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -7.400 10.838 3.042 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -6.277 12.817 3.831 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -6.307 11.640 5.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -4.876 11.927 4.187 1.00 0.00 H new ATOM 1811 N GLY A 123 -5.273 4.470 1.374 1.00 0.00 N ATOM 1812 CA GLY A 123 -4.777 3.106 1.352 1.00 0.00 C ATOM 1813 C GLY A 123 -4.714 2.536 -0.051 1.00 0.00 C ATOM 1814 O GLY A 123 -5.718 2.510 -0.763 1.00 0.00 O ATOM 0 H GLY A 123 -6.165 4.595 1.853 1.00 0.00 H new ATOM 0 HA2 GLY A 123 -3.783 3.077 1.798 1.00 0.00 H new ATOM 0 HA3 GLY A 123 -5.421 2.478 1.968 1.00 0.00 H new ATOM 1818 N ILE A 124 -3.531 2.081 -0.451 1.00 0.00 N ATOM 1819 CA ILE A 124 -3.342 1.512 -1.780 1.00 0.00 C ATOM 1820 C ILE A 124 -2.579 0.191 -1.709 1.00 0.00 C ATOM 1821 O ILE A 124 -1.798 -0.038 -0.787 1.00 0.00 O ATOM 1822 CB ILE A 124 -2.583 2.487 -2.703 1.00 0.00 C ATOM 1823 CG1 ILE A 124 -2.486 1.917 -4.120 1.00 0.00 C ATOM 1824 CG2 ILE A 124 -1.197 2.779 -2.148 1.00 0.00 C ATOM 1825 CD1 ILE A 124 -2.227 2.967 -5.178 1.00 0.00 C ATOM 0 H ILE A 124 -2.690 2.095 0.126 1.00 0.00 H new ATOM 0 HA ILE A 124 -4.334 1.331 -2.194 1.00 0.00 H new ATOM 0 HB ILE A 124 -3.139 3.424 -2.746 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -1.686 1.177 -4.151 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -3.413 1.395 -4.357 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -0.677 3.469 -2.813 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -1.288 3.228 -1.159 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -0.632 1.850 -2.074 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -2.170 2.491 -6.157 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -3.039 3.695 -5.175 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -1.285 3.473 -4.966 1.00 0.00 H new ATOM 1837 N PHE A 125 -2.812 -0.672 -2.694 1.00 0.00 N ATOM 1838 CA PHE A 125 -2.147 -1.969 -2.747 1.00 0.00 C ATOM 1839 C PHE A 125 -1.247 -2.066 -3.974 1.00 0.00 C ATOM 1840 O PHE A 125 -1.729 -2.164 -5.103 1.00 0.00 O ATOM 1841 CB PHE A 125 -3.181 -3.096 -2.769 1.00 0.00 C ATOM 1842 CG PHE A 125 -3.741 -3.425 -1.415 1.00 0.00 C ATOM 1843 CD1 PHE A 125 -2.934 -3.979 -0.434 1.00 0.00 C ATOM 1844 CD2 PHE A 125 -5.073 -3.181 -1.123 1.00 0.00 C ATOM 1845 CE1 PHE A 125 -3.447 -4.283 0.814 1.00 0.00 C ATOM 1846 CE2 PHE A 125 -5.591 -3.484 0.122 1.00 0.00 C ATOM 1847 CZ PHE A 125 -4.776 -4.035 1.091 1.00 0.00 C ATOM 0 H PHE A 125 -3.456 -0.496 -3.465 1.00 0.00 H new ATOM 0 HA PHE A 125 -1.529 -2.070 -1.855 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -3.999 -2.815 -3.432 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -2.722 -3.990 -3.190 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -1.893 -4.175 -0.646 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -5.714 -2.749 -1.877 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -2.808 -4.714 1.571 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -6.632 -3.290 0.337 1.00 0.00 H new ATOM 0 HZ PHE A 125 -5.178 -4.272 2.065 1.00 0.00 H new ATOM 1857 N THR A 126 0.062 -2.035 -3.747 1.00 0.00 N ATOM 1858 CA THR A 126 1.028 -2.117 -4.836 1.00 0.00 C ATOM 1859 C THR A 126 2.161 -3.078 -4.491 1.00 0.00 C ATOM 1860 O THR A 126 2.186 -3.660 -3.406 1.00 0.00 O ATOM 1861 CB THR A 126 1.597 -0.732 -5.146 1.00 0.00 C ATOM 1862 OG1 THR A 126 2.485 -0.790 -6.249 1.00 0.00 O ATOM 1863 CG2 THR A 126 2.351 -0.122 -3.983 1.00 0.00 C ATOM 0 H THR A 126 0.478 -1.954 -2.819 1.00 0.00 H new ATOM 0 HA THR A 126 0.511 -2.497 -5.717 1.00 0.00 H new ATOM 0 HB THR A 126 0.732 -0.107 -5.367 1.00 0.00 H new ATOM 0 HG1 THR A 126 2.837 0.106 -6.433 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.729 0.860 -4.269 1.00 0.00 H new ATOM 0 HG22 THR A 126 1.681 -0.019 -3.129 1.00 0.00 H new ATOM 0 HG23 THR A 126 3.187 -0.767 -3.712 1.00 0.00 H new ATOM 1871 N ARG A 127 3.096 -3.239 -5.422 1.00 0.00 N ATOM 1872 CA ARG A 127 4.234 -4.129 -5.218 1.00 0.00 C ATOM 1873 C ARG A 127 5.346 -3.419 -4.446 1.00 0.00 C ATOM 1874 O ARG A 127 5.744 -2.310 -4.802 1.00 0.00 O ATOM 1875 CB ARG A 127 4.765 -4.620 -6.566 1.00 0.00 C ATOM 1876 CG ARG A 127 5.701 -5.814 -6.453 1.00 0.00 C ATOM 1877 CD ARG A 127 4.981 -7.117 -6.758 1.00 0.00 C ATOM 1878 NE ARG A 127 4.557 -7.195 -8.154 1.00 0.00 N ATOM 1879 CZ ARG A 127 3.623 -8.033 -8.600 1.00 0.00 C ATOM 1880 NH1 ARG A 127 3.014 -8.865 -7.764 1.00 0.00 N ATOM 1881 NH2 ARG A 127 3.296 -8.037 -9.885 1.00 0.00 N ATOM 0 H ARG A 127 3.088 -2.765 -6.325 1.00 0.00 H new ATOM 0 HA ARG A 127 3.899 -4.985 -4.632 1.00 0.00 H new ATOM 0 HB2 ARG A 127 3.922 -4.888 -7.203 1.00 0.00 H new ATOM 0 HB3 ARG A 127 5.290 -3.802 -7.060 1.00 0.00 H new ATOM 0 HG2 ARG A 127 6.537 -5.689 -7.142 1.00 0.00 H new ATOM 0 HG3 ARG A 127 6.120 -5.855 -5.448 1.00 0.00 H new ATOM 0 HD2 ARG A 127 5.639 -7.956 -6.532 1.00 0.00 H new ATOM 0 HD3 ARG A 127 4.110 -7.210 -6.109 1.00 0.00 H new ATOM 0 HE ARG A 127 5.003 -6.571 -8.827 1.00 0.00 H new ATOM 0 HH11 ARG A 127 3.261 -8.865 -6.774 1.00 0.00 H new ATOM 0 HH12 ARG A 127 2.299 -9.505 -8.111 1.00 0.00 H new ATOM 0 HH21 ARG A 127 3.760 -7.398 -10.531 1.00 0.00 H new ATOM 0 HH22 ARG A 127 2.581 -8.679 -10.227 1.00 0.00 H new ATOM 1895 N PRO A 128 5.866 -4.047 -3.375 1.00 0.00 N ATOM 1896 CA PRO A 128 6.937 -3.459 -2.565 1.00 0.00 C ATOM 1897 C PRO A 128 8.140 -3.054 -3.409 1.00 0.00 C ATOM 1898 O PRO A 128 8.789 -2.043 -3.141 1.00 0.00 O ATOM 1899 CB PRO A 128 7.320 -4.581 -1.598 1.00 0.00 C ATOM 1900 CG PRO A 128 6.118 -5.456 -1.527 1.00 0.00 C ATOM 1901 CD PRO A 128 5.458 -5.373 -2.875 1.00 0.00 C ATOM 0 HA PRO A 128 6.612 -2.546 -2.067 1.00 0.00 H new ATOM 0 HB2 PRO A 128 8.189 -5.132 -1.958 1.00 0.00 H new ATOM 0 HB3 PRO A 128 7.578 -4.185 -0.616 1.00 0.00 H new ATOM 0 HG2 PRO A 128 6.398 -6.483 -1.293 1.00 0.00 H new ATOM 0 HG3 PRO A 128 5.440 -5.123 -0.741 1.00 0.00 H new ATOM 0 HD2 PRO A 128 5.793 -6.172 -3.536 1.00 0.00 H new ATOM 0 HD3 PRO A 128 4.374 -5.457 -2.797 1.00 0.00 H new ATOM 1909 N SER A 129 8.432 -3.852 -4.430 1.00 0.00 N ATOM 1910 CA SER A 129 9.557 -3.582 -5.316 1.00 0.00 C ATOM 1911 C SER A 129 9.414 -2.213 -5.976 1.00 0.00 C ATOM 1912 O SER A 129 10.407 -1.565 -6.302 1.00 0.00 O ATOM 1913 CB SER A 129 9.664 -4.669 -6.386 1.00 0.00 C ATOM 1914 OG SER A 129 10.982 -4.751 -6.901 1.00 0.00 O ATOM 0 H SER A 129 7.904 -4.693 -4.664 1.00 0.00 H new ATOM 0 HA SER A 129 10.467 -3.583 -4.716 1.00 0.00 H new ATOM 0 HB2 SER A 129 9.376 -5.631 -5.962 1.00 0.00 H new ATOM 0 HB3 SER A 129 8.966 -4.456 -7.196 1.00 0.00 H new ATOM 0 HG SER A 129 11.024 -5.454 -7.582 1.00 0.00 H new ATOM 1920 N LYS A 130 8.172 -1.782 -6.168 1.00 0.00 N ATOM 1921 CA LYS A 130 7.898 -0.490 -6.788 1.00 0.00 C ATOM 1922 C LYS A 130 8.154 0.647 -5.804 1.00 0.00 C ATOM 1923 O LYS A 130 8.547 1.745 -6.199 1.00 0.00 O ATOM 1924 CB LYS A 130 6.452 -0.437 -7.285 1.00 0.00 C ATOM 1925 CG LYS A 130 6.235 -1.158 -8.604 1.00 0.00 C ATOM 1926 CD LYS A 130 6.170 -0.184 -9.770 1.00 0.00 C ATOM 1927 CE LYS A 130 7.559 0.191 -10.260 1.00 0.00 C ATOM 1928 NZ LYS A 130 8.233 -0.949 -10.941 1.00 0.00 N ATOM 0 H LYS A 130 7.339 -2.308 -5.903 1.00 0.00 H new ATOM 0 HA LYS A 130 8.570 -0.370 -7.638 1.00 0.00 H new ATOM 0 HB2 LYS A 130 5.801 -0.876 -6.529 1.00 0.00 H new ATOM 0 HB3 LYS A 130 6.153 0.605 -7.397 1.00 0.00 H new ATOM 0 HG2 LYS A 130 7.044 -1.869 -8.768 1.00 0.00 H new ATOM 0 HG3 LYS A 130 5.310 -1.733 -8.557 1.00 0.00 H new ATOM 0 HD2 LYS A 130 5.603 -0.630 -10.587 1.00 0.00 H new ATOM 0 HD3 LYS A 130 5.635 0.716 -9.465 1.00 0.00 H new ATOM 0 HE2 LYS A 130 7.486 1.033 -10.948 1.00 0.00 H new ATOM 0 HE3 LYS A 130 8.165 0.520 -9.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 9.000 -0.589 -11.544 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 8.627 -1.595 -10.228 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 7.543 -1.460 -11.527 1.00 0.00 H new ATOM 1942 N LEU A 131 7.929 0.375 -4.524 1.00 0.00 N ATOM 1943 CA LEU A 131 8.135 1.374 -3.483 1.00 0.00 C ATOM 1944 C LEU A 131 9.615 1.716 -3.344 1.00 0.00 C ATOM 1945 O LEU A 131 10.462 0.827 -3.256 1.00 0.00 O ATOM 1946 CB LEU A 131 7.590 0.868 -2.145 1.00 0.00 C ATOM 1947 CG LEU A 131 6.100 0.524 -2.142 1.00 0.00 C ATOM 1948 CD1 LEU A 131 5.722 -0.199 -0.858 1.00 0.00 C ATOM 1949 CD2 LEU A 131 5.263 1.782 -2.314 1.00 0.00 C ATOM 0 H LEU A 131 7.604 -0.529 -4.182 1.00 0.00 H new ATOM 0 HA LEU A 131 7.596 2.277 -3.769 1.00 0.00 H new ATOM 0 HB2 LEU A 131 8.153 -0.019 -1.853 1.00 0.00 H new ATOM 0 HB3 LEU A 131 7.774 1.627 -1.385 1.00 0.00 H new ATOM 0 HG LEU A 131 5.898 -0.141 -2.982 1.00 0.00 H new ATOM 0 HD11 LEU A 131 4.658 -0.436 -0.873 1.00 0.00 H new ATOM 0 HD12 LEU A 131 6.298 -1.121 -0.776 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.939 0.441 -0.003 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.205 1.519 -2.310 1.00 0.00 H new ATOM 0 HD22 LEU A 131 5.469 2.471 -1.495 1.00 0.00 H new ATOM 0 HD23 LEU A 131 5.514 2.259 -3.261 1.00 0.00 H new ATOM 1961 N THR A 132 9.920 3.009 -3.324 1.00 0.00 N ATOM 1962 CA THR A 132 11.298 3.468 -3.197 1.00 0.00 C ATOM 1963 C THR A 132 11.459 4.383 -1.988 1.00 0.00 C ATOM 1964 O THR A 132 10.519 5.072 -1.589 1.00 0.00 O ATOM 1965 CB THR A 132 11.734 4.201 -4.466 1.00 0.00 C ATOM 1966 OG1 THR A 132 11.148 5.490 -4.527 1.00 0.00 O ATOM 1967 CG2 THR A 132 11.364 3.468 -5.738 1.00 0.00 C ATOM 0 H THR A 132 9.231 3.758 -3.394 1.00 0.00 H new ATOM 0 HA THR A 132 11.932 2.593 -3.055 1.00 0.00 H new ATOM 0 HB THR A 132 12.820 4.263 -4.405 1.00 0.00 H new ATOM 0 HG1 THR A 132 11.440 5.944 -5.345 1.00 0.00 H new ATOM 0 HG21 THR A 132 11.702 4.042 -6.600 1.00 0.00 H new ATOM 0 HG22 THR A 132 11.841 2.488 -5.745 1.00 0.00 H new ATOM 0 HG23 THR A 132 10.282 3.345 -5.786 1.00 0.00 H new ATOM 1975 N ARG A 133 12.654 4.385 -1.408 1.00 0.00 N ATOM 1976 CA ARG A 133 12.937 5.215 -0.243 1.00 0.00 C ATOM 1977 C ARG A 133 13.256 6.648 -0.663 1.00 0.00 C ATOM 1978 O ARG A 133 14.247 6.899 -1.348 1.00 0.00 O ATOM 1979 CB ARG A 133 14.104 4.631 0.556 1.00 0.00 C ATOM 1980 CG ARG A 133 13.865 4.611 2.056 1.00 0.00 C ATOM 1981 CD ARG A 133 15.174 4.610 2.830 1.00 0.00 C ATOM 1982 NE ARG A 133 15.566 3.266 3.243 1.00 0.00 N ATOM 1983 CZ ARG A 133 15.031 2.622 4.278 1.00 0.00 C ATOM 1984 NH1 ARG A 133 14.083 3.197 5.006 1.00 0.00 N ATOM 1985 NH2 ARG A 133 15.446 1.400 4.585 1.00 0.00 N ATOM 0 H ARG A 133 13.442 3.821 -1.726 1.00 0.00 H new ATOM 0 HA ARG A 133 12.048 5.229 0.388 1.00 0.00 H new ATOM 0 HB2 ARG A 133 14.295 3.614 0.213 1.00 0.00 H new ATOM 0 HB3 ARG A 133 15.003 5.212 0.347 1.00 0.00 H new ATOM 0 HG2 ARG A 133 13.273 5.480 2.343 1.00 0.00 H new ATOM 0 HG3 ARG A 133 13.284 3.728 2.321 1.00 0.00 H new ATOM 0 HD2 ARG A 133 15.961 5.043 2.212 1.00 0.00 H new ATOM 0 HD3 ARG A 133 15.075 5.245 3.710 1.00 0.00 H new ATOM 0 HE ARG A 133 16.293 2.792 2.707 1.00 0.00 H new ATOM 0 HH11 ARG A 133 13.761 4.137 4.774 1.00 0.00 H new ATOM 0 HH12 ARG A 133 13.676 2.700 5.798 1.00 0.00 H new ATOM 0 HH21 ARG A 133 16.175 0.954 4.028 1.00 0.00 H new ATOM 0 HH22 ARG A 133 15.036 0.906 5.378 1.00 0.00 H new ATOM 1999 N LYS A 134 12.407 7.583 -0.249 1.00 0.00 N ATOM 2000 CA LYS A 134 12.597 8.990 -0.582 1.00 0.00 C ATOM 2001 C LYS A 134 12.582 9.197 -2.093 1.00 0.00 C ATOM 2002 O LYS A 134 12.798 8.259 -2.860 1.00 0.00 O ATOM 2003 CB LYS A 134 13.916 9.501 0.001 1.00 0.00 C ATOM 2004 CG LYS A 134 13.773 10.107 1.389 1.00 0.00 C ATOM 2005 CD LYS A 134 13.119 11.480 1.334 1.00 0.00 C ATOM 2006 CE LYS A 134 13.956 12.526 2.051 1.00 0.00 C ATOM 2007 NZ LYS A 134 14.910 13.201 1.129 1.00 0.00 N ATOM 0 H LYS A 134 11.581 7.392 0.318 1.00 0.00 H new ATOM 0 HA LYS A 134 11.773 9.555 -0.147 1.00 0.00 H new ATOM 0 HB2 LYS A 134 14.628 8.677 0.045 1.00 0.00 H new ATOM 0 HB3 LYS A 134 14.336 10.249 -0.672 1.00 0.00 H new ATOM 0 HG2 LYS A 134 13.178 9.444 2.017 1.00 0.00 H new ATOM 0 HG3 LYS A 134 14.755 10.189 1.854 1.00 0.00 H new ATOM 0 HD2 LYS A 134 12.978 11.776 0.294 1.00 0.00 H new ATOM 0 HD3 LYS A 134 12.129 11.431 1.788 1.00 0.00 H new ATOM 0 HE2 LYS A 134 13.299 13.270 2.502 1.00 0.00 H new ATOM 0 HE3 LYS A 134 14.509 12.054 2.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 15.462 13.907 1.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 15.554 12.495 0.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 14.382 13.673 0.368 1.00 0.00 H new