USER MOD reduce.3.24.130724 H: found=0, std=0, add=1025, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1027 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 979 SER OG : rot -19:sc= 0.782 USER MOD Set 1.2: A1045 LYS NZ :NH3+ 175:sc= -1.32 (180deg=-1.65) USER MOD Set 1.3: A1049 GLN : amide:sc= -0.795 K(o=-1.3,f=-16!) USER MOD Set 2.1: A 951 TYR OH : rot 110:sc= 0.494 USER MOD Set 2.2: A1018 LYS NZ :NH3+ -167:sc= 0.499 (180deg=-0.038) USER MOD Set 3.1: A1006 GLN : amide:sc= -6.26! C(o=-12!,f=-9.8!) USER MOD Set 3.2: A1014 GLN : amide:sc= -5.88! K(o=-12!,f=-9.8) USER MOD Set 4.1: A 986 MET CE :methyl -144:sc= -0.975 (180deg=-1.27!) USER MOD Set 4.2: A1034 ASN : amide:sc= -1.97 K(o=-2.9,f=-2.2!) USER MOD Set 5.1: A 928 ASN : amide:sc= -0.845 K(o=-0.69,f=-1.7!) USER MOD Set 5.2: A 968 THR OG1 : rot 21:sc= 0.159 USER MOD Set 6.1: A 939 MET CE :methyl 179:sc= -0.647 (180deg=-0.638) USER MOD Set 6.2: A 954 MET CE :methyl -127:sc= -1.09 (180deg=-0.831) USER MOD Set 6.3: A1021 MET CE :methyl -159:sc= -0.597 (180deg=-1.63!) USER MOD Single : A 921 SER OG : rot 180:sc= 0 USER MOD Single : A 922 ASN : amide:sc= 0.119 K(o=0.12,f=-0.71) USER MOD Single : A 924 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 926 TYR OH : rot 180:sc= 0 USER MOD Single : A 930 THR OG1 : rot 81:sc= 1.21 USER MOD Single : A 934 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 940 SER OG : rot 65:sc= 0.808 USER MOD Single : A 941 SER OG : rot 180:sc= 0 USER MOD Single : A 942 LYS NZ :NH3+ -172:sc=-0.000164 (180deg=-0.08) USER MOD Single : A 944 GLN : amide:sc= -0.285 K(o=-0.29,f=-0.89) USER MOD Single : A 956 LYS NZ :NH3+ -133:sc= -0.127 (180deg=-0.604) USER MOD Single : A 964 THR OG1 : rot 87:sc= 0.785 USER MOD Single : A 972 SER OG : rot 21:sc= -2.87! USER MOD Single : A 980 THR OG1 : rot 177:sc= -3.73! USER MOD Single : A 981 HIS : no HD1:sc= -0.0968 K(o=-0.097,f=-3.1!) USER MOD Single : A 988 GLN : amide:sc= -0.32 K(o=-0.32,f=-1.1) USER MOD Single : A 989 LYS NZ :NH3+ 152:sc= 0.284 (180deg=-1.97!) USER MOD Single : A 992 ASN : amide:sc= -0.414 K(o=-0.41,f=-1.9!) USER MOD Single : A 993 SER OG : rot 78:sc= 1.26 USER MOD Single : A1000 ASN : amide:sc=-0.00987 K(o=-0.0099,f=-0.65) USER MOD Single : A1001 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1002 MET CE :methyl -141:sc= -6.29! (180deg=-9.1!) USER MOD Single : A1003 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1007 GLN : amide:sc= -1.42 K(o=-1.4,f=-0.23) USER MOD Single : A1008 TYR OH : rot 180:sc= 0 USER MOD Single : A1015 GLN : amide:sc= -2.8! C(o=-2.8!,f=-4.7!) USER MOD Single : A1017 TYR OH : rot 180:sc= 0 USER MOD Single : A1019 LYS NZ :NH3+ -166:sc= 1.25 (180deg=1.07) USER MOD Single : A1020 GLN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A1023 THR OG1 : rot 71:sc= 0.885 USER MOD Single : A1026 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A1033 LYS NZ :NH3+ -160:sc= -0.169 (180deg=-0.664) USER MOD Single : A1041 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A1046 MET CE :methyl 163:sc= -0.0554 (180deg=-0.423) USER MOD Single : A1048 SER OG : rot 180:sc= -0.634 USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 920 -8.432 -19.460 -2.786 1.00 0.00 N ATOM 2 CA ARG A 920 -8.307 -18.962 -1.420 1.00 0.00 C ATOM 3 C ARG A 920 -9.236 -17.774 -1.172 1.00 0.00 C ATOM 4 O ARG A 920 -9.559 -17.466 -0.028 1.00 0.00 O ATOM 5 CB ARG A 920 -6.853 -18.557 -1.158 1.00 0.00 C ATOM 6 CG ARG A 920 -6.608 -17.969 0.221 1.00 0.00 C ATOM 7 CD ARG A 920 -6.875 -18.974 1.329 1.00 0.00 C ATOM 8 NE ARG A 920 -6.912 -18.330 2.642 1.00 0.00 N ATOM 9 CZ ARG A 920 -7.752 -18.670 3.620 1.00 0.00 C ATOM 10 NH1 ARG A 920 -8.628 -19.650 3.435 1.00 0.00 N ATOM 11 NH2 ARG A 920 -7.721 -18.015 4.775 1.00 0.00 N ATOM 0 HA ARG A 920 -8.598 -19.758 -0.735 1.00 0.00 H new ATOM 0 HB2 ARG A 920 -6.216 -19.432 -1.286 1.00 0.00 H new ATOM 0 HB3 ARG A 920 -6.550 -17.829 -1.910 1.00 0.00 H new ATOM 0 HG2 ARG A 920 -5.577 -17.622 0.288 1.00 0.00 H new ATOM 0 HG3 ARG A 920 -7.247 -17.097 0.361 1.00 0.00 H new ATOM 0 HD2 ARG A 920 -7.824 -19.478 1.143 1.00 0.00 H new ATOM 0 HD3 ARG A 920 -6.100 -19.740 1.321 1.00 0.00 H new ATOM 0 HE ARG A 920 -6.253 -17.572 2.821 1.00 0.00 H new ATOM 0 HH11 ARG A 920 -8.659 -20.144 2.543 1.00 0.00 H new ATOM 0 HH12 ARG A 920 -9.270 -19.909 4.184 1.00 0.00 H new ATOM 0 HH21 ARG A 920 -7.056 -17.254 4.912 1.00 0.00 H new ATOM 0 HH22 ARG A 920 -8.362 -18.273 5.525 1.00 0.00 H new ATOM 25 N SER A 921 -9.645 -17.111 -2.256 1.00 0.00 N ATOM 26 CA SER A 921 -10.492 -15.919 -2.191 1.00 0.00 C ATOM 27 C SER A 921 -9.708 -14.731 -1.639 1.00 0.00 C ATOM 28 O SER A 921 -10.260 -13.652 -1.428 1.00 0.00 O ATOM 29 CB SER A 921 -11.748 -16.182 -1.359 1.00 0.00 C ATOM 30 OG SER A 921 -12.433 -17.335 -1.832 1.00 0.00 O ATOM 0 H SER A 921 -9.397 -17.387 -3.206 1.00 0.00 H new ATOM 0 HA SER A 921 -10.811 -15.674 -3.204 1.00 0.00 H new ATOM 0 HB2 SER A 921 -11.475 -16.319 -0.313 1.00 0.00 H new ATOM 0 HB3 SER A 921 -12.409 -15.316 -1.405 1.00 0.00 H new ATOM 0 HG SER A 921 -13.232 -17.488 -1.286 1.00 0.00 H new ATOM 36 N ASN A 922 -8.407 -14.958 -1.437 1.00 0.00 N ATOM 37 CA ASN A 922 -7.450 -13.913 -1.077 1.00 0.00 C ATOM 38 C ASN A 922 -7.882 -13.179 0.169 1.00 0.00 C ATOM 39 O ASN A 922 -8.367 -12.047 0.127 1.00 0.00 O ATOM 40 CB ASN A 922 -7.245 -12.952 -2.241 1.00 0.00 C ATOM 41 CG ASN A 922 -7.486 -13.623 -3.579 1.00 0.00 C ATOM 42 OD1 ASN A 922 -8.578 -13.541 -4.140 1.00 0.00 O ATOM 43 ND2 ASN A 922 -6.490 -14.327 -4.080 1.00 0.00 N ATOM 0 H ASN A 922 -7.986 -15.883 -1.520 1.00 0.00 H new ATOM 0 HA ASN A 922 -6.495 -14.390 -0.858 1.00 0.00 H new ATOM 0 HB2 ASN A 922 -7.920 -12.103 -2.134 1.00 0.00 H new ATOM 0 HB3 ASN A 922 -6.230 -12.557 -2.211 1.00 0.00 H new ATOM 0 HD21 ASN A 922 -6.611 -14.827 -4.961 1.00 0.00 H new ATOM 0 HD22 ASN A 922 -5.598 -14.372 -3.587 1.00 0.00 H new ATOM 50 N ASP A 923 -7.627 -13.862 1.267 1.00 0.00 N ATOM 51 CA ASP A 923 -7.996 -13.465 2.616 1.00 0.00 C ATOM 52 C ASP A 923 -7.474 -12.076 2.973 1.00 0.00 C ATOM 53 O ASP A 923 -7.137 -11.293 2.096 1.00 0.00 O ATOM 54 CB ASP A 923 -7.524 -14.531 3.619 1.00 0.00 C ATOM 55 CG ASP A 923 -6.053 -14.851 3.524 1.00 0.00 C ATOM 56 OD1 ASP A 923 -5.225 -13.936 3.706 1.00 0.00 O ATOM 57 OD2 ASP A 923 -5.724 -16.033 3.261 1.00 0.00 O ATOM 0 H ASP A 923 -7.132 -14.754 1.244 1.00 0.00 H new ATOM 0 HA ASP A 923 -9.083 -13.397 2.666 1.00 0.00 H new ATOM 0 HB2 ASP A 923 -7.747 -14.189 4.630 1.00 0.00 H new ATOM 0 HB3 ASP A 923 -8.096 -15.445 3.459 1.00 0.00 H new ATOM 62 N LYS A 924 -7.573 -11.741 4.251 1.00 0.00 N ATOM 63 CA LYS A 924 -7.080 -10.475 4.844 1.00 0.00 C ATOM 64 C LYS A 924 -5.916 -9.814 4.064 1.00 0.00 C ATOM 65 O LYS A 924 -5.732 -8.604 4.136 1.00 0.00 O ATOM 66 CB LYS A 924 -6.661 -10.750 6.298 1.00 0.00 C ATOM 67 CG LYS A 924 -7.055 -9.651 7.275 1.00 0.00 C ATOM 68 CD LYS A 924 -6.102 -8.470 7.215 1.00 0.00 C ATOM 69 CE LYS A 924 -6.667 -7.239 7.906 1.00 0.00 C ATOM 70 NZ LYS A 924 -6.918 -7.450 9.356 1.00 0.00 N ATOM 0 H LYS A 924 -8.011 -12.353 4.939 1.00 0.00 H new ATOM 0 HA LYS A 924 -7.899 -9.757 4.794 1.00 0.00 H new ATOM 0 HB2 LYS A 924 -7.110 -11.689 6.623 1.00 0.00 H new ATOM 0 HB3 LYS A 924 -5.580 -10.884 6.335 1.00 0.00 H new ATOM 0 HG2 LYS A 924 -8.067 -9.313 7.052 1.00 0.00 H new ATOM 0 HG3 LYS A 924 -7.070 -10.054 8.288 1.00 0.00 H new ATOM 0 HD2 LYS A 924 -5.156 -8.745 7.682 1.00 0.00 H new ATOM 0 HD3 LYS A 924 -5.886 -8.233 6.173 1.00 0.00 H new ATOM 0 HE2 LYS A 924 -5.973 -6.408 7.780 1.00 0.00 H new ATOM 0 HE3 LYS A 924 -7.599 -6.952 7.420 1.00 0.00 H new ATOM 0 HZ1 LYS A 924 -7.302 -6.578 9.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 924 -7.602 -8.224 9.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 924 -6.026 -7.696 9.830 1.00 0.00 H new ATOM 84 N VAL A 925 -5.152 -10.599 3.322 1.00 0.00 N ATOM 85 CA VAL A 925 -4.110 -10.083 2.453 1.00 0.00 C ATOM 86 C VAL A 925 -4.667 -9.184 1.339 1.00 0.00 C ATOM 87 O VAL A 925 -4.240 -8.044 1.205 1.00 0.00 O ATOM 88 CB VAL A 925 -3.334 -11.241 1.803 1.00 0.00 C ATOM 89 CG1 VAL A 925 -2.465 -11.946 2.834 1.00 0.00 C ATOM 90 CG2 VAL A 925 -4.290 -12.222 1.146 1.00 0.00 C ATOM 0 H VAL A 925 -5.238 -11.615 3.306 1.00 0.00 H new ATOM 0 HA VAL A 925 -3.451 -9.484 3.082 1.00 0.00 H new ATOM 0 HB VAL A 925 -2.684 -10.829 1.031 1.00 0.00 H new ATOM 0 HG11 VAL A 925 -1.923 -12.762 2.356 1.00 0.00 H new ATOM 0 HG12 VAL A 925 -1.753 -11.237 3.256 1.00 0.00 H new ATOM 0 HG13 VAL A 925 -3.095 -12.345 3.629 1.00 0.00 H new ATOM 0 HG21 VAL A 925 -3.723 -13.034 0.692 1.00 0.00 H new ATOM 0 HG22 VAL A 925 -4.967 -12.628 1.897 1.00 0.00 H new ATOM 0 HG23 VAL A 925 -4.867 -11.708 0.377 1.00 0.00 H new ATOM 100 N TYR A 926 -5.650 -9.667 0.573 1.00 0.00 N ATOM 101 CA TYR A 926 -6.179 -8.900 -0.547 1.00 0.00 C ATOM 102 C TYR A 926 -7.109 -7.829 -0.004 1.00 0.00 C ATOM 103 O TYR A 926 -7.231 -6.729 -0.547 1.00 0.00 O ATOM 104 CB TYR A 926 -6.906 -9.847 -1.503 1.00 0.00 C ATOM 105 CG TYR A 926 -7.743 -9.185 -2.572 1.00 0.00 C ATOM 106 CD1 TYR A 926 -7.162 -8.657 -3.716 1.00 0.00 C ATOM 107 CD2 TYR A 926 -9.122 -9.120 -2.442 1.00 0.00 C ATOM 108 CE1 TYR A 926 -7.935 -8.071 -4.700 1.00 0.00 C ATOM 109 CE2 TYR A 926 -9.901 -8.540 -3.421 1.00 0.00 C ATOM 110 CZ TYR A 926 -9.304 -8.019 -4.549 1.00 0.00 C ATOM 111 OH TYR A 926 -10.082 -7.452 -5.532 1.00 0.00 O ATOM 0 H TYR A 926 -6.089 -10.578 0.710 1.00 0.00 H new ATOM 0 HA TYR A 926 -5.377 -8.413 -1.102 1.00 0.00 H new ATOM 0 HB2 TYR A 926 -6.165 -10.482 -1.989 1.00 0.00 H new ATOM 0 HB3 TYR A 926 -7.551 -10.501 -0.916 1.00 0.00 H new ATOM 0 HD1 TYR A 926 -6.090 -8.705 -3.839 1.00 0.00 H new ATOM 0 HD2 TYR A 926 -9.593 -9.530 -1.561 1.00 0.00 H new ATOM 0 HE1 TYR A 926 -7.469 -7.656 -5.582 1.00 0.00 H new ATOM 0 HE2 TYR A 926 -10.974 -8.494 -3.305 1.00 0.00 H new ATOM 0 HH TYR A 926 -11.025 -7.497 -5.270 1.00 0.00 H new ATOM 121 N GLU A 927 -7.736 -8.174 1.105 1.00 0.00 N ATOM 122 CA GLU A 927 -8.676 -7.306 1.780 1.00 0.00 C ATOM 123 C GLU A 927 -7.990 -6.085 2.387 1.00 0.00 C ATOM 124 O GLU A 927 -8.422 -4.956 2.175 1.00 0.00 O ATOM 125 CB GLU A 927 -9.399 -8.108 2.858 1.00 0.00 C ATOM 126 CG GLU A 927 -10.435 -9.066 2.298 1.00 0.00 C ATOM 127 CD GLU A 927 -11.243 -9.747 3.378 1.00 0.00 C ATOM 128 OE1 GLU A 927 -10.822 -10.823 3.849 1.00 0.00 O ATOM 129 OE2 GLU A 927 -12.300 -9.202 3.761 1.00 0.00 O ATOM 0 H GLU A 927 -7.604 -9.075 1.565 1.00 0.00 H new ATOM 0 HA GLU A 927 -9.393 -6.933 1.049 1.00 0.00 H new ATOM 0 HB2 GLU A 927 -8.666 -8.672 3.435 1.00 0.00 H new ATOM 0 HB3 GLU A 927 -9.886 -7.419 3.548 1.00 0.00 H new ATOM 0 HG2 GLU A 927 -11.108 -8.521 1.636 1.00 0.00 H new ATOM 0 HG3 GLU A 927 -9.935 -9.822 1.693 1.00 0.00 H new ATOM 136 N ASN A 928 -6.920 -6.312 3.129 1.00 0.00 N ATOM 137 CA ASN A 928 -6.252 -5.229 3.840 1.00 0.00 C ATOM 138 C ASN A 928 -5.459 -4.336 2.897 1.00 0.00 C ATOM 139 O ASN A 928 -5.273 -3.158 3.177 1.00 0.00 O ATOM 140 CB ASN A 928 -5.350 -5.768 4.935 1.00 0.00 C ATOM 141 CG ASN A 928 -5.113 -4.764 6.040 1.00 0.00 C ATOM 142 OD1 ASN A 928 -5.907 -3.853 6.261 1.00 0.00 O ATOM 143 ND2 ASN A 928 -4.044 -4.969 6.776 1.00 0.00 N ATOM 0 H ASN A 928 -6.495 -7.230 3.256 1.00 0.00 H new ATOM 0 HA ASN A 928 -7.033 -4.622 4.298 1.00 0.00 H new ATOM 0 HB2 ASN A 928 -5.796 -6.669 5.357 1.00 0.00 H new ATOM 0 HB3 ASN A 928 -4.393 -6.059 4.502 1.00 0.00 H new ATOM 0 HD21 ASN A 928 -3.846 -4.358 7.569 1.00 0.00 H new ATOM 0 HD22 ASN A 928 -3.412 -5.739 6.555 1.00 0.00 H new ATOM 150 N VAL A 929 -4.947 -4.889 1.803 1.00 0.00 N ATOM 151 CA VAL A 929 -4.309 -4.041 0.802 1.00 0.00 C ATOM 152 C VAL A 929 -5.340 -3.106 0.185 1.00 0.00 C ATOM 153 O VAL A 929 -5.068 -1.927 -0.038 1.00 0.00 O ATOM 154 CB VAL A 929 -3.592 -4.812 -0.314 1.00 0.00 C ATOM 155 CG1 VAL A 929 -2.902 -3.826 -1.226 1.00 0.00 C ATOM 156 CG2 VAL A 929 -2.583 -5.783 0.249 1.00 0.00 C ATOM 0 H VAL A 929 -4.959 -5.886 1.590 1.00 0.00 H new ATOM 0 HA VAL A 929 -3.539 -3.482 1.333 1.00 0.00 H new ATOM 0 HB VAL A 929 -4.331 -5.387 -0.872 1.00 0.00 H new ATOM 0 HG11 VAL A 929 -2.389 -4.365 -2.023 1.00 0.00 H new ATOM 0 HG12 VAL A 929 -3.641 -3.153 -1.660 1.00 0.00 H new ATOM 0 HG13 VAL A 929 -2.177 -3.247 -0.654 1.00 0.00 H new ATOM 0 HG21 VAL A 929 -2.093 -6.313 -0.568 1.00 0.00 H new ATOM 0 HG22 VAL A 929 -1.837 -5.238 0.827 1.00 0.00 H new ATOM 0 HG23 VAL A 929 -3.089 -6.500 0.895 1.00 0.00 H new ATOM 166 N THR A 930 -6.524 -3.637 -0.108 1.00 0.00 N ATOM 167 CA THR A 930 -7.681 -2.798 -0.402 1.00 0.00 C ATOM 168 C THR A 930 -7.855 -1.744 0.693 1.00 0.00 C ATOM 169 O THR A 930 -8.311 -0.631 0.439 1.00 0.00 O ATOM 170 CB THR A 930 -8.966 -3.646 -0.516 1.00 0.00 C ATOM 171 OG1 THR A 930 -8.783 -4.678 -1.498 1.00 0.00 O ATOM 172 CG2 THR A 930 -10.161 -2.782 -0.898 1.00 0.00 C ATOM 0 H THR A 930 -6.707 -4.640 -0.148 1.00 0.00 H new ATOM 0 HA THR A 930 -7.507 -2.304 -1.358 1.00 0.00 H new ATOM 0 HB THR A 930 -9.164 -4.096 0.457 1.00 0.00 H new ATOM 0 HG1 THR A 930 -8.292 -5.426 -1.099 1.00 0.00 H new ATOM 0 HG21 THR A 930 -11.052 -3.405 -0.971 1.00 0.00 H new ATOM 0 HG22 THR A 930 -10.315 -2.017 -0.137 1.00 0.00 H new ATOM 0 HG23 THR A 930 -9.972 -2.305 -1.860 1.00 0.00 H new ATOM 180 N GLY A 931 -7.426 -2.099 1.899 1.00 0.00 N ATOM 181 CA GLY A 931 -7.484 -1.198 3.032 1.00 0.00 C ATOM 182 C GLY A 931 -6.481 -0.067 2.905 1.00 0.00 C ATOM 183 O GLY A 931 -6.703 1.020 3.434 1.00 0.00 O ATOM 0 H GLY A 931 -7.031 -3.015 2.113 1.00 0.00 H new ATOM 0 HA2 GLY A 931 -8.489 -0.785 3.116 1.00 0.00 H new ATOM 0 HA3 GLY A 931 -7.290 -1.754 3.949 1.00 0.00 H new ATOM 187 N LEU A 932 -5.376 -0.313 2.200 1.00 0.00 N ATOM 188 CA LEU A 932 -4.429 0.746 1.895 1.00 0.00 C ATOM 189 C LEU A 932 -5.127 1.754 0.996 1.00 0.00 C ATOM 190 O LEU A 932 -5.048 2.959 1.219 1.00 0.00 O ATOM 191 CB LEU A 932 -3.170 0.180 1.215 1.00 0.00 C ATOM 192 CG LEU A 932 -1.943 1.112 1.174 1.00 0.00 C ATOM 193 CD1 LEU A 932 -0.691 0.327 0.824 1.00 0.00 C ATOM 194 CD2 LEU A 932 -2.129 2.244 0.172 1.00 0.00 C ATOM 0 H LEU A 932 -5.121 -1.230 1.834 1.00 0.00 H new ATOM 0 HA LEU A 932 -4.102 1.231 2.815 1.00 0.00 H new ATOM 0 HB2 LEU A 932 -2.886 -0.738 1.729 1.00 0.00 H new ATOM 0 HB3 LEU A 932 -3.427 -0.094 0.192 1.00 0.00 H new ATOM 0 HG LEU A 932 -1.835 1.548 2.167 1.00 0.00 H new ATOM 0 HD11 LEU A 932 0.166 1.000 0.799 1.00 0.00 H new ATOM 0 HD12 LEU A 932 -0.524 -0.445 1.575 1.00 0.00 H new ATOM 0 HD13 LEU A 932 -0.815 -0.138 -0.154 1.00 0.00 H new ATOM 0 HD21 LEU A 932 -1.243 2.879 0.172 1.00 0.00 H new ATOM 0 HD22 LEU A 932 -2.277 1.827 -0.824 1.00 0.00 H new ATOM 0 HD23 LEU A 932 -3.001 2.837 0.450 1.00 0.00 H new ATOM 206 N VAL A 933 -5.829 1.241 -0.011 1.00 0.00 N ATOM 207 CA VAL A 933 -6.666 2.074 -0.864 1.00 0.00 C ATOM 208 C VAL A 933 -7.690 2.822 -0.010 1.00 0.00 C ATOM 209 O VAL A 933 -7.891 4.017 -0.166 1.00 0.00 O ATOM 210 CB VAL A 933 -7.402 1.233 -1.930 1.00 0.00 C ATOM 211 CG1 VAL A 933 -8.158 2.131 -2.898 1.00 0.00 C ATOM 212 CG2 VAL A 933 -6.422 0.338 -2.678 1.00 0.00 C ATOM 0 H VAL A 933 -5.834 0.251 -0.255 1.00 0.00 H new ATOM 0 HA VAL A 933 -6.018 2.784 -1.378 1.00 0.00 H new ATOM 0 HB VAL A 933 -8.126 0.597 -1.422 1.00 0.00 H new ATOM 0 HG11 VAL A 933 -8.669 1.517 -3.640 1.00 0.00 H new ATOM 0 HG12 VAL A 933 -8.891 2.722 -2.349 1.00 0.00 H new ATOM 0 HG13 VAL A 933 -7.456 2.798 -3.399 1.00 0.00 H new ATOM 0 HG21 VAL A 933 -6.960 -0.246 -3.425 1.00 0.00 H new ATOM 0 HG22 VAL A 933 -5.671 0.954 -3.172 1.00 0.00 H new ATOM 0 HG23 VAL A 933 -5.933 -0.335 -1.973 1.00 0.00 H new ATOM 222 N LYS A 934 -8.315 2.093 0.904 1.00 0.00 N ATOM 223 CA LYS A 934 -9.293 2.668 1.827 1.00 0.00 C ATOM 224 C LYS A 934 -8.678 3.825 2.614 1.00 0.00 C ATOM 225 O LYS A 934 -9.279 4.890 2.742 1.00 0.00 O ATOM 226 CB LYS A 934 -9.831 1.617 2.809 1.00 0.00 C ATOM 227 CG LYS A 934 -10.445 0.371 2.171 1.00 0.00 C ATOM 228 CD LYS A 934 -11.632 0.682 1.267 1.00 0.00 C ATOM 229 CE LYS A 934 -11.193 1.037 -0.148 1.00 0.00 C ATOM 230 NZ LYS A 934 -12.355 1.174 -1.064 1.00 0.00 N ATOM 0 H LYS A 934 -8.162 1.092 1.029 1.00 0.00 H new ATOM 0 HA LYS A 934 -10.123 3.037 1.224 1.00 0.00 H new ATOM 0 HB2 LYS A 934 -9.016 1.305 3.462 1.00 0.00 H new ATOM 0 HB3 LYS A 934 -10.584 2.088 3.441 1.00 0.00 H new ATOM 0 HG2 LYS A 934 -9.681 -0.146 1.591 1.00 0.00 H new ATOM 0 HG3 LYS A 934 -10.765 -0.312 2.958 1.00 0.00 H new ATOM 0 HD2 LYS A 934 -12.299 -0.180 1.234 1.00 0.00 H new ATOM 0 HD3 LYS A 934 -12.202 1.510 1.689 1.00 0.00 H new ATOM 0 HE2 LYS A 934 -10.630 1.970 -0.131 1.00 0.00 H new ATOM 0 HE3 LYS A 934 -10.521 0.266 -0.525 1.00 0.00 H new ATOM 0 HZ1 LYS A 934 -12.018 1.416 -2.018 1.00 0.00 H new ATOM 0 HZ2 LYS A 934 -12.878 0.275 -1.099 1.00 0.00 H new ATOM 0 HZ3 LYS A 934 -12.983 1.927 -0.717 1.00 0.00 H new ATOM 244 N ALA A 935 -7.469 3.618 3.120 1.00 0.00 N ATOM 245 CA ALA A 935 -6.801 4.621 3.935 1.00 0.00 C ATOM 246 C ALA A 935 -6.212 5.746 3.084 1.00 0.00 C ATOM 247 O ALA A 935 -6.035 6.862 3.563 1.00 0.00 O ATOM 248 CB ALA A 935 -5.735 3.979 4.804 1.00 0.00 C ATOM 0 H ALA A 935 -6.931 2.763 2.979 1.00 0.00 H new ATOM 0 HA ALA A 935 -7.552 5.071 4.585 1.00 0.00 H new ATOM 0 HB1 ALA A 935 -5.247 4.745 5.406 1.00 0.00 H new ATOM 0 HB2 ALA A 935 -6.196 3.241 5.460 1.00 0.00 H new ATOM 0 HB3 ALA A 935 -4.995 3.489 4.170 1.00 0.00 H new ATOM 254 N VAL A 936 -5.888 5.471 1.826 1.00 0.00 N ATOM 255 CA VAL A 936 -5.470 6.545 0.933 1.00 0.00 C ATOM 256 C VAL A 936 -6.707 7.281 0.405 1.00 0.00 C ATOM 257 O VAL A 936 -6.619 8.396 -0.111 1.00 0.00 O ATOM 258 CB VAL A 936 -4.566 6.060 -0.232 1.00 0.00 C ATOM 259 CG1 VAL A 936 -5.345 5.237 -1.241 1.00 0.00 C ATOM 260 CG2 VAL A 936 -3.885 7.239 -0.917 1.00 0.00 C ATOM 0 H VAL A 936 -5.905 4.540 1.409 1.00 0.00 H new ATOM 0 HA VAL A 936 -4.854 7.231 1.514 1.00 0.00 H new ATOM 0 HB VAL A 936 -3.798 5.417 0.198 1.00 0.00 H new ATOM 0 HG11 VAL A 936 -4.678 4.916 -2.041 1.00 0.00 H new ATOM 0 HG12 VAL A 936 -5.768 4.362 -0.748 1.00 0.00 H new ATOM 0 HG13 VAL A 936 -6.150 5.841 -1.660 1.00 0.00 H new ATOM 0 HG21 VAL A 936 -3.257 6.874 -1.730 1.00 0.00 H new ATOM 0 HG22 VAL A 936 -4.642 7.914 -1.318 1.00 0.00 H new ATOM 0 HG23 VAL A 936 -3.269 7.773 -0.194 1.00 0.00 H new ATOM 270 N ILE A 937 -7.873 6.651 0.560 1.00 0.00 N ATOM 271 CA ILE A 937 -9.142 7.331 0.334 1.00 0.00 C ATOM 272 C ILE A 937 -9.349 8.367 1.436 1.00 0.00 C ATOM 273 O ILE A 937 -9.981 9.405 1.227 1.00 0.00 O ATOM 274 CB ILE A 937 -10.344 6.347 0.285 1.00 0.00 C ATOM 275 CG1 ILE A 937 -10.281 5.486 -0.981 1.00 0.00 C ATOM 276 CG2 ILE A 937 -11.676 7.086 0.354 1.00 0.00 C ATOM 277 CD1 ILE A 937 -10.281 6.285 -2.267 1.00 0.00 C ATOM 0 H ILE A 937 -7.961 5.674 0.840 1.00 0.00 H new ATOM 0 HA ILE A 937 -9.098 7.817 -0.641 1.00 0.00 H new ATOM 0 HB ILE A 937 -10.275 5.699 1.159 1.00 0.00 H new ATOM 0 HG12 ILE A 937 -9.381 4.872 -0.946 1.00 0.00 H new ATOM 0 HG13 ILE A 937 -11.132 4.805 -0.988 1.00 0.00 H new ATOM 0 HG21 ILE A 937 -12.494 6.366 0.317 1.00 0.00 H new ATOM 0 HG22 ILE A 937 -11.731 7.651 1.285 1.00 0.00 H new ATOM 0 HG23 ILE A 937 -11.757 7.770 -0.491 1.00 0.00 H new ATOM 0 HD11 ILE A 937 -10.235 5.605 -3.118 1.00 0.00 H new ATOM 0 HD12 ILE A 937 -11.193 6.879 -2.326 1.00 0.00 H new ATOM 0 HD13 ILE A 937 -9.415 6.947 -2.284 1.00 0.00 H new ATOM 289 N GLU A 938 -8.766 8.094 2.600 1.00 0.00 N ATOM 290 CA GLU A 938 -8.740 9.067 3.682 1.00 0.00 C ATOM 291 C GLU A 938 -7.965 10.280 3.218 1.00 0.00 C ATOM 292 O GLU A 938 -8.413 11.406 3.361 1.00 0.00 O ATOM 293 CB GLU A 938 -8.069 8.490 4.928 1.00 0.00 C ATOM 294 CG GLU A 938 -8.743 7.235 5.456 1.00 0.00 C ATOM 295 CD GLU A 938 -10.193 7.468 5.812 1.00 0.00 C ATOM 296 OE1 GLU A 938 -11.065 7.295 4.934 1.00 0.00 O ATOM 297 OE2 GLU A 938 -10.472 7.829 6.973 1.00 0.00 O ATOM 0 H GLU A 938 -8.307 7.209 2.816 1.00 0.00 H new ATOM 0 HA GLU A 938 -9.765 9.335 3.940 1.00 0.00 H new ATOM 0 HB2 GLU A 938 -7.028 8.264 4.698 1.00 0.00 H new ATOM 0 HB3 GLU A 938 -8.065 9.247 5.712 1.00 0.00 H new ATOM 0 HG2 GLU A 938 -8.678 6.447 4.705 1.00 0.00 H new ATOM 0 HG3 GLU A 938 -8.207 6.881 6.337 1.00 0.00 H new ATOM 304 N MET A 939 -6.810 10.010 2.625 1.00 0.00 N ATOM 305 CA MET A 939 -5.981 11.042 2.019 1.00 0.00 C ATOM 306 C MET A 939 -6.764 11.809 0.959 1.00 0.00 C ATOM 307 O MET A 939 -6.644 13.027 0.847 1.00 0.00 O ATOM 308 CB MET A 939 -4.737 10.403 1.396 1.00 0.00 C ATOM 309 CG MET A 939 -3.882 11.362 0.583 1.00 0.00 C ATOM 310 SD MET A 939 -2.457 10.548 -0.160 1.00 0.00 S ATOM 311 CE MET A 939 -1.775 11.890 -1.127 1.00 0.00 C ATOM 0 H MET A 939 -6.422 9.070 2.551 1.00 0.00 H new ATOM 0 HA MET A 939 -5.676 11.746 2.793 1.00 0.00 H new ATOM 0 HB2 MET A 939 -4.126 9.974 2.191 1.00 0.00 H new ATOM 0 HB3 MET A 939 -5.049 9.579 0.754 1.00 0.00 H new ATOM 0 HG2 MET A 939 -4.491 11.811 -0.202 1.00 0.00 H new ATOM 0 HG3 MET A 939 -3.540 12.174 1.225 1.00 0.00 H new ATOM 0 HE1 MET A 939 -0.873 11.550 -1.636 1.00 0.00 H new ATOM 0 HE2 MET A 939 -2.508 12.215 -1.865 1.00 0.00 H new ATOM 0 HE3 MET A 939 -1.528 12.723 -0.469 1.00 0.00 H new ATOM 321 N SER A 940 -7.588 11.093 0.208 1.00 0.00 N ATOM 322 CA SER A 940 -8.394 11.703 -0.838 1.00 0.00 C ATOM 323 C SER A 940 -9.457 12.635 -0.244 1.00 0.00 C ATOM 324 O SER A 940 -9.684 13.735 -0.749 1.00 0.00 O ATOM 325 CB SER A 940 -9.051 10.617 -1.690 1.00 0.00 C ATOM 326 OG SER A 940 -8.083 9.704 -2.184 1.00 0.00 O ATOM 0 H SER A 940 -7.716 10.086 0.305 1.00 0.00 H new ATOM 0 HA SER A 940 -7.740 12.304 -1.470 1.00 0.00 H new ATOM 0 HB2 SER A 940 -9.791 10.082 -1.096 1.00 0.00 H new ATOM 0 HB3 SER A 940 -9.583 11.076 -2.524 1.00 0.00 H new ATOM 0 HG SER A 940 -7.679 9.218 -1.435 1.00 0.00 H new ATOM 332 N SER A 941 -10.075 12.214 0.852 1.00 0.00 N ATOM 333 CA SER A 941 -11.134 12.996 1.472 1.00 0.00 C ATOM 334 C SER A 941 -10.492 14.145 2.222 1.00 0.00 C ATOM 335 O SER A 941 -10.935 15.300 2.152 1.00 0.00 O ATOM 336 CB SER A 941 -11.948 12.114 2.423 1.00 0.00 C ATOM 337 OG SER A 941 -13.031 12.824 3.003 1.00 0.00 O ATOM 0 H SER A 941 -9.861 11.338 1.328 1.00 0.00 H new ATOM 0 HA SER A 941 -11.814 13.385 0.715 1.00 0.00 H new ATOM 0 HB2 SER A 941 -12.330 11.249 1.880 1.00 0.00 H new ATOM 0 HB3 SER A 941 -11.299 11.734 3.212 1.00 0.00 H new ATOM 0 HG SER A 941 -13.528 12.229 3.602 1.00 0.00 H new ATOM 343 N LYS A 942 -9.414 13.794 2.904 1.00 0.00 N ATOM 344 CA LYS A 942 -8.587 14.730 3.626 1.00 0.00 C ATOM 345 C LYS A 942 -8.239 15.929 2.771 1.00 0.00 C ATOM 346 O LYS A 942 -8.539 17.054 3.145 1.00 0.00 O ATOM 347 CB LYS A 942 -7.307 14.030 4.065 1.00 0.00 C ATOM 348 CG LYS A 942 -7.265 13.695 5.537 1.00 0.00 C ATOM 349 CD LYS A 942 -7.054 14.949 6.347 1.00 0.00 C ATOM 350 CE LYS A 942 -6.992 14.657 7.839 1.00 0.00 C ATOM 351 NZ LYS A 942 -8.287 14.145 8.366 1.00 0.00 N ATOM 0 H LYS A 942 -9.088 12.830 2.969 1.00 0.00 H new ATOM 0 HA LYS A 942 -9.142 15.083 4.495 1.00 0.00 H new ATOM 0 HB2 LYS A 942 -7.192 13.111 3.490 1.00 0.00 H new ATOM 0 HB3 LYS A 942 -6.456 14.666 3.823 1.00 0.00 H new ATOM 0 HG2 LYS A 942 -8.196 13.212 5.835 1.00 0.00 H new ATOM 0 HG3 LYS A 942 -6.461 12.986 5.734 1.00 0.00 H new ATOM 0 HD2 LYS A 942 -6.129 15.433 6.033 1.00 0.00 H new ATOM 0 HD3 LYS A 942 -7.864 15.651 6.148 1.00 0.00 H new ATOM 0 HE2 LYS A 942 -6.208 13.925 8.032 1.00 0.00 H new ATOM 0 HE3 LYS A 942 -6.718 15.566 8.374 1.00 0.00 H new ATOM 0 HZ1 LYS A 942 -8.242 14.088 9.403 1.00 0.00 H new ATOM 0 HZ2 LYS A 942 -9.054 14.790 8.088 1.00 0.00 H new ATOM 0 HZ3 LYS A 942 -8.471 13.199 7.975 1.00 0.00 H new ATOM 365 N ILE A 943 -7.641 15.673 1.611 1.00 0.00 N ATOM 366 CA ILE A 943 -7.130 16.739 0.761 1.00 0.00 C ATOM 367 C ILE A 943 -8.254 17.608 0.193 1.00 0.00 C ATOM 368 O ILE A 943 -8.027 18.774 -0.128 1.00 0.00 O ATOM 369 CB ILE A 943 -6.262 16.187 -0.399 1.00 0.00 C ATOM 370 CG1 ILE A 943 -5.543 17.329 -1.122 1.00 0.00 C ATOM 371 CG2 ILE A 943 -7.107 15.388 -1.380 1.00 0.00 C ATOM 372 CD1 ILE A 943 -4.602 16.865 -2.213 1.00 0.00 C ATOM 0 H ILE A 943 -7.499 14.734 1.239 1.00 0.00 H new ATOM 0 HA ILE A 943 -6.503 17.360 1.400 1.00 0.00 H new ATOM 0 HB ILE A 943 -5.514 15.519 0.028 1.00 0.00 H new ATOM 0 HG12 ILE A 943 -6.287 17.997 -1.556 1.00 0.00 H new ATOM 0 HG13 ILE A 943 -4.980 17.911 -0.392 1.00 0.00 H new ATOM 0 HG21 ILE A 943 -6.474 15.012 -2.184 1.00 0.00 H new ATOM 0 HG22 ILE A 943 -7.571 14.549 -0.861 1.00 0.00 H new ATOM 0 HG23 ILE A 943 -7.882 16.029 -1.799 1.00 0.00 H new ATOM 0 HD11 ILE A 943 -4.130 17.730 -2.679 1.00 0.00 H new ATOM 0 HD12 ILE A 943 -3.835 16.221 -1.782 1.00 0.00 H new ATOM 0 HD13 ILE A 943 -5.162 16.309 -2.965 1.00 0.00 H new ATOM 384 N GLN A 944 -9.462 17.048 0.078 1.00 0.00 N ATOM 385 CA GLN A 944 -10.595 17.794 -0.468 1.00 0.00 C ATOM 386 C GLN A 944 -10.783 19.143 0.240 1.00 0.00 C ATOM 387 O GLN A 944 -10.732 20.184 -0.417 1.00 0.00 O ATOM 388 CB GLN A 944 -11.886 16.964 -0.433 1.00 0.00 C ATOM 389 CG GLN A 944 -11.846 15.748 -1.341 1.00 0.00 C ATOM 390 CD GLN A 944 -11.546 16.104 -2.787 1.00 0.00 C ATOM 391 OE1 GLN A 944 -11.897 17.185 -3.260 1.00 0.00 O ATOM 392 NE2 GLN A 944 -10.882 15.202 -3.494 1.00 0.00 N ATOM 0 H GLN A 944 -9.678 16.090 0.353 1.00 0.00 H new ATOM 0 HA GLN A 944 -10.365 18.004 -1.513 1.00 0.00 H new ATOM 0 HB2 GLN A 944 -12.072 16.638 0.590 1.00 0.00 H new ATOM 0 HB3 GLN A 944 -12.724 17.597 -0.723 1.00 0.00 H new ATOM 0 HG2 GLN A 944 -11.089 15.053 -0.978 1.00 0.00 H new ATOM 0 HG3 GLN A 944 -12.804 15.230 -1.290 1.00 0.00 H new ATOM 0 HE21 GLN A 944 -10.609 14.318 -3.065 1.00 0.00 H new ATOM 0 HE22 GLN A 944 -10.644 15.392 -4.467 1.00 0.00 H new ATOM 401 N PRO A 945 -11.012 19.179 1.573 1.00 0.00 N ATOM 402 CA PRO A 945 -11.087 20.439 2.302 1.00 0.00 C ATOM 403 C PRO A 945 -9.800 20.784 3.065 1.00 0.00 C ATOM 404 O PRO A 945 -9.802 21.667 3.927 1.00 0.00 O ATOM 405 CB PRO A 945 -12.226 20.161 3.278 1.00 0.00 C ATOM 406 CG PRO A 945 -12.147 18.692 3.563 1.00 0.00 C ATOM 407 CD PRO A 945 -11.309 18.060 2.471 1.00 0.00 C ATOM 0 HA PRO A 945 -11.236 21.293 1.641 1.00 0.00 H new ATOM 0 HB2 PRO A 945 -12.114 20.746 4.191 1.00 0.00 H new ATOM 0 HB3 PRO A 945 -13.190 20.427 2.845 1.00 0.00 H new ATOM 0 HG2 PRO A 945 -11.699 18.515 4.541 1.00 0.00 H new ATOM 0 HG3 PRO A 945 -13.144 18.252 3.585 1.00 0.00 H new ATOM 0 HD2 PRO A 945 -10.398 17.615 2.872 1.00 0.00 H new ATOM 0 HD3 PRO A 945 -11.852 17.267 1.957 1.00 0.00 H new ATOM 415 N ALA A 946 -8.708 20.098 2.741 1.00 0.00 N ATOM 416 CA ALA A 946 -7.453 20.248 3.477 1.00 0.00 C ATOM 417 C ALA A 946 -6.703 21.534 3.151 1.00 0.00 C ATOM 418 O ALA A 946 -6.613 21.948 1.993 1.00 0.00 O ATOM 419 CB ALA A 946 -6.527 19.076 3.201 1.00 0.00 C ATOM 0 H ALA A 946 -8.665 19.430 1.971 1.00 0.00 H new ATOM 0 HA ALA A 946 -7.738 20.283 4.528 1.00 0.00 H new ATOM 0 HB1 ALA A 946 -5.599 19.207 3.758 1.00 0.00 H new ATOM 0 HB2 ALA A 946 -7.010 18.150 3.512 1.00 0.00 H new ATOM 0 HB3 ALA A 946 -6.307 19.030 2.134 1.00 0.00 H new ATOM 425 N PRO A 947 -6.169 22.183 4.192 1.00 0.00 N ATOM 426 CA PRO A 947 -5.095 23.157 4.057 1.00 0.00 C ATOM 427 C PRO A 947 -3.745 22.432 4.057 1.00 0.00 C ATOM 428 O PRO A 947 -3.717 21.207 4.189 1.00 0.00 O ATOM 429 CB PRO A 947 -5.266 24.014 5.312 1.00 0.00 C ATOM 430 CG PRO A 947 -5.788 23.069 6.339 1.00 0.00 C ATOM 431 CD PRO A 947 -6.600 22.034 5.596 1.00 0.00 C ATOM 0 HA PRO A 947 -5.127 23.742 3.138 1.00 0.00 H new ATOM 0 HB2 PRO A 947 -4.319 24.456 5.623 1.00 0.00 H new ATOM 0 HB3 PRO A 947 -5.960 24.837 5.140 1.00 0.00 H new ATOM 0 HG2 PRO A 947 -4.970 22.601 6.887 1.00 0.00 H new ATOM 0 HG3 PRO A 947 -6.403 23.592 7.071 1.00 0.00 H new ATOM 0 HD2 PRO A 947 -6.403 21.029 5.969 1.00 0.00 H new ATOM 0 HD3 PRO A 947 -7.670 22.211 5.706 1.00 0.00 H new ATOM 439 N PRO A 948 -2.612 23.146 3.916 1.00 0.00 N ATOM 440 CA PRO A 948 -1.276 22.530 3.980 1.00 0.00 C ATOM 441 C PRO A 948 -1.102 21.676 5.230 1.00 0.00 C ATOM 442 O PRO A 948 -0.496 20.586 5.204 1.00 0.00 O ATOM 443 CB PRO A 948 -0.316 23.728 4.019 1.00 0.00 C ATOM 444 CG PRO A 948 -1.177 24.930 4.236 1.00 0.00 C ATOM 445 CD PRO A 948 -2.522 24.588 3.663 1.00 0.00 C ATOM 0 HA PRO A 948 -1.100 21.860 3.138 1.00 0.00 H new ATOM 0 HB2 PRO A 948 0.413 23.619 4.822 1.00 0.00 H new ATOM 0 HB3 PRO A 948 0.244 23.811 3.088 1.00 0.00 H new ATOM 0 HG2 PRO A 948 -1.254 25.167 5.297 1.00 0.00 H new ATOM 0 HG3 PRO A 948 -0.755 25.806 3.743 1.00 0.00 H new ATOM 0 HD2 PRO A 948 -3.325 25.138 4.154 1.00 0.00 H new ATOM 0 HD3 PRO A 948 -2.582 24.819 2.599 1.00 0.00 H new ATOM 453 N GLU A 949 -1.697 22.169 6.305 1.00 0.00 N ATOM 454 CA GLU A 949 -1.656 21.519 7.598 1.00 0.00 C ATOM 455 C GLU A 949 -2.254 20.122 7.541 1.00 0.00 C ATOM 456 O GLU A 949 -2.035 19.322 8.441 1.00 0.00 O ATOM 457 CB GLU A 949 -2.418 22.360 8.616 1.00 0.00 C ATOM 458 CG GLU A 949 -1.874 23.769 8.766 1.00 0.00 C ATOM 459 CD GLU A 949 -0.391 23.789 9.074 1.00 0.00 C ATOM 460 OE1 GLU A 949 -0.019 23.531 10.239 1.00 0.00 O ATOM 461 OE2 GLU A 949 0.407 24.064 8.154 1.00 0.00 O ATOM 0 H GLU A 949 -2.226 23.041 6.300 1.00 0.00 H new ATOM 0 HA GLU A 949 -0.612 21.426 7.896 1.00 0.00 H new ATOM 0 HB2 GLU A 949 -3.466 22.413 8.320 1.00 0.00 H new ATOM 0 HB3 GLU A 949 -2.385 21.861 9.585 1.00 0.00 H new ATOM 0 HG2 GLU A 949 -2.058 24.326 7.847 1.00 0.00 H new ATOM 0 HG3 GLU A 949 -2.414 24.281 9.563 1.00 0.00 H new ATOM 468 N GLU A 950 -3.000 19.825 6.482 1.00 0.00 N ATOM 469 CA GLU A 950 -3.610 18.513 6.343 1.00 0.00 C ATOM 470 C GLU A 950 -3.033 17.752 5.164 1.00 0.00 C ATOM 471 O GLU A 950 -3.315 16.571 5.003 1.00 0.00 O ATOM 472 CB GLU A 950 -5.127 18.570 6.198 1.00 0.00 C ATOM 473 CG GLU A 950 -5.890 18.327 7.493 1.00 0.00 C ATOM 474 CD GLU A 950 -5.831 19.491 8.456 1.00 0.00 C ATOM 475 OE1 GLU A 950 -6.662 20.410 8.321 1.00 0.00 O ATOM 476 OE2 GLU A 950 -4.980 19.475 9.365 1.00 0.00 O ATOM 0 H GLU A 950 -3.194 20.470 5.716 1.00 0.00 H new ATOM 0 HA GLU A 950 -3.377 17.989 7.270 1.00 0.00 H new ATOM 0 HB2 GLU A 950 -5.406 19.547 5.804 1.00 0.00 H new ATOM 0 HB3 GLU A 950 -5.438 17.828 5.462 1.00 0.00 H new ATOM 0 HG2 GLU A 950 -6.933 18.114 7.257 1.00 0.00 H new ATOM 0 HG3 GLU A 950 -5.487 17.440 7.982 1.00 0.00 H new ATOM 483 N TYR A 951 -2.240 18.417 4.338 1.00 0.00 N ATOM 484 CA TYR A 951 -1.523 17.722 3.277 1.00 0.00 C ATOM 485 C TYR A 951 -0.637 16.657 3.880 1.00 0.00 C ATOM 486 O TYR A 951 -0.531 15.542 3.370 1.00 0.00 O ATOM 487 CB TYR A 951 -0.648 18.670 2.481 1.00 0.00 C ATOM 488 CG TYR A 951 -1.340 19.412 1.373 1.00 0.00 C ATOM 489 CD1 TYR A 951 -2.143 20.506 1.635 1.00 0.00 C ATOM 490 CD2 TYR A 951 -1.151 19.037 0.055 1.00 0.00 C ATOM 491 CE1 TYR A 951 -2.741 21.212 0.615 1.00 0.00 C ATOM 492 CE2 TYR A 951 -1.747 19.730 -0.972 1.00 0.00 C ATOM 493 CZ TYR A 951 -2.542 20.819 -0.690 1.00 0.00 C ATOM 494 OH TYR A 951 -3.135 21.520 -1.719 1.00 0.00 O ATOM 0 H TYR A 951 -2.077 19.423 4.379 1.00 0.00 H new ATOM 0 HA TYR A 951 -2.266 17.282 2.611 1.00 0.00 H new ATOM 0 HB2 TYR A 951 -0.214 19.398 3.166 1.00 0.00 H new ATOM 0 HB3 TYR A 951 0.178 18.102 2.054 1.00 0.00 H new ATOM 0 HD1 TYR A 951 -2.304 20.813 2.658 1.00 0.00 H new ATOM 0 HD2 TYR A 951 -0.525 18.186 -0.171 1.00 0.00 H new ATOM 0 HE1 TYR A 951 -3.362 22.068 0.837 1.00 0.00 H new ATOM 0 HE2 TYR A 951 -1.593 19.422 -1.996 1.00 0.00 H new ATOM 0 HH TYR A 951 -2.449 22.007 -2.221 1.00 0.00 H new ATOM 504 N VAL A 952 0.011 17.005 4.973 1.00 0.00 N ATOM 505 CA VAL A 952 0.839 16.031 5.658 1.00 0.00 C ATOM 506 C VAL A 952 -0.027 14.984 6.417 1.00 0.00 C ATOM 507 O VAL A 952 0.154 13.792 6.207 1.00 0.00 O ATOM 508 CB VAL A 952 1.959 16.692 6.532 1.00 0.00 C ATOM 509 CG1 VAL A 952 1.557 18.073 7.032 1.00 0.00 C ATOM 510 CG2 VAL A 952 2.349 15.803 7.703 1.00 0.00 C ATOM 0 H VAL A 952 -0.016 17.931 5.399 1.00 0.00 H new ATOM 0 HA VAL A 952 1.386 15.473 4.898 1.00 0.00 H new ATOM 0 HB VAL A 952 2.827 16.811 5.883 1.00 0.00 H new ATOM 0 HG11 VAL A 952 2.364 18.492 7.633 1.00 0.00 H new ATOM 0 HG12 VAL A 952 1.362 18.726 6.181 1.00 0.00 H new ATOM 0 HG13 VAL A 952 0.656 17.992 7.641 1.00 0.00 H new ATOM 0 HG21 VAL A 952 3.128 16.292 8.288 1.00 0.00 H new ATOM 0 HG22 VAL A 952 1.477 15.629 8.334 1.00 0.00 H new ATOM 0 HG23 VAL A 952 2.722 14.850 7.328 1.00 0.00 H new ATOM 520 N PRO A 953 -1.000 15.374 7.277 1.00 0.00 N ATOM 521 CA PRO A 953 -1.932 14.405 7.898 1.00 0.00 C ATOM 522 C PRO A 953 -2.719 13.531 6.910 1.00 0.00 C ATOM 523 O PRO A 953 -3.129 12.428 7.262 1.00 0.00 O ATOM 524 CB PRO A 953 -2.901 15.288 8.662 1.00 0.00 C ATOM 525 CG PRO A 953 -2.100 16.488 8.993 1.00 0.00 C ATOM 526 CD PRO A 953 -1.225 16.724 7.794 1.00 0.00 C ATOM 0 HA PRO A 953 -1.372 13.688 8.498 1.00 0.00 H new ATOM 0 HB2 PRO A 953 -3.772 15.543 8.058 1.00 0.00 H new ATOM 0 HB3 PRO A 953 -3.270 14.793 9.560 1.00 0.00 H new ATOM 0 HG2 PRO A 953 -2.741 17.348 9.187 1.00 0.00 H new ATOM 0 HG3 PRO A 953 -1.503 16.327 9.890 1.00 0.00 H new ATOM 0 HD2 PRO A 953 -1.714 17.362 7.057 1.00 0.00 H new ATOM 0 HD3 PRO A 953 -0.290 17.212 8.067 1.00 0.00 H new ATOM 534 N MET A 954 -2.965 14.010 5.697 1.00 0.00 N ATOM 535 CA MET A 954 -3.707 13.206 4.726 1.00 0.00 C ATOM 536 C MET A 954 -2.863 12.012 4.300 1.00 0.00 C ATOM 537 O MET A 954 -3.345 10.882 4.198 1.00 0.00 O ATOM 538 CB MET A 954 -4.131 14.029 3.498 1.00 0.00 C ATOM 539 CG MET A 954 -3.004 14.350 2.535 1.00 0.00 C ATOM 540 SD MET A 954 -3.531 15.342 1.133 1.00 0.00 S ATOM 541 CE MET A 954 -1.995 15.455 0.222 1.00 0.00 C ATOM 0 H MET A 954 -2.671 14.928 5.364 1.00 0.00 H new ATOM 0 HA MET A 954 -4.620 12.856 5.208 1.00 0.00 H new ATOM 0 HB2 MET A 954 -4.906 13.483 2.961 1.00 0.00 H new ATOM 0 HB3 MET A 954 -4.577 14.963 3.839 1.00 0.00 H new ATOM 0 HG2 MET A 954 -2.217 14.880 3.071 1.00 0.00 H new ATOM 0 HG3 MET A 954 -2.570 13.419 2.170 1.00 0.00 H new ATOM 0 HE1 MET A 954 -1.771 16.501 0.015 1.00 0.00 H new ATOM 0 HE2 MET A 954 -1.189 15.021 0.813 1.00 0.00 H new ATOM 0 HE3 MET A 954 -2.089 14.911 -0.718 1.00 0.00 H new ATOM 551 N VAL A 955 -1.593 12.274 4.064 1.00 0.00 N ATOM 552 CA VAL A 955 -0.649 11.219 3.761 1.00 0.00 C ATOM 553 C VAL A 955 -0.378 10.400 5.017 1.00 0.00 C ATOM 554 O VAL A 955 0.000 9.235 4.947 1.00 0.00 O ATOM 555 CB VAL A 955 0.655 11.764 3.137 1.00 0.00 C ATOM 556 CG1 VAL A 955 1.629 10.638 2.835 1.00 0.00 C ATOM 557 CG2 VAL A 955 0.335 12.541 1.868 1.00 0.00 C ATOM 0 H VAL A 955 -1.191 13.211 4.076 1.00 0.00 H new ATOM 0 HA VAL A 955 -1.092 10.568 3.007 1.00 0.00 H new ATOM 0 HB VAL A 955 1.128 12.432 3.857 1.00 0.00 H new ATOM 0 HG11 VAL A 955 2.538 11.051 2.397 1.00 0.00 H new ATOM 0 HG12 VAL A 955 1.877 10.114 3.758 1.00 0.00 H new ATOM 0 HG13 VAL A 955 1.172 9.940 2.133 1.00 0.00 H new ATOM 0 HG21 VAL A 955 1.258 12.923 1.433 1.00 0.00 H new ATOM 0 HG22 VAL A 955 -0.158 11.883 1.153 1.00 0.00 H new ATOM 0 HG23 VAL A 955 -0.325 13.375 2.108 1.00 0.00 H new ATOM 567 N LYS A 956 -0.575 11.013 6.173 1.00 0.00 N ATOM 568 CA LYS A 956 -0.483 10.284 7.431 1.00 0.00 C ATOM 569 C LYS A 956 -1.457 9.105 7.402 1.00 0.00 C ATOM 570 O LYS A 956 -1.131 7.999 7.838 1.00 0.00 O ATOM 571 CB LYS A 956 -0.810 11.206 8.606 1.00 0.00 C ATOM 572 CG LYS A 956 -0.775 10.527 9.963 1.00 0.00 C ATOM 573 CD LYS A 956 -1.212 11.478 11.064 1.00 0.00 C ATOM 574 CE LYS A 956 -1.474 10.740 12.366 1.00 0.00 C ATOM 575 NZ LYS A 956 -2.556 9.730 12.218 1.00 0.00 N ATOM 0 H LYS A 956 -0.798 12.004 6.268 1.00 0.00 H new ATOM 0 HA LYS A 956 0.534 9.914 7.558 1.00 0.00 H new ATOM 0 HB2 LYS A 956 -0.102 12.035 8.610 1.00 0.00 H new ATOM 0 HB3 LYS A 956 -1.801 11.633 8.452 1.00 0.00 H new ATOM 0 HG2 LYS A 956 -1.427 9.654 9.953 1.00 0.00 H new ATOM 0 HG3 LYS A 956 0.234 10.169 10.167 1.00 0.00 H new ATOM 0 HD2 LYS A 956 -0.442 12.233 11.221 1.00 0.00 H new ATOM 0 HD3 LYS A 956 -2.115 12.004 10.755 1.00 0.00 H new ATOM 0 HE2 LYS A 956 -0.559 10.248 12.696 1.00 0.00 H new ATOM 0 HE3 LYS A 956 -1.748 11.456 13.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 956 -3.225 9.820 13.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 956 -3.057 9.887 11.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 956 -2.143 8.776 12.221 1.00 0.00 H new ATOM 589 N GLU A 957 -2.668 9.369 6.911 1.00 0.00 N ATOM 590 CA GLU A 957 -3.661 8.319 6.692 1.00 0.00 C ATOM 591 C GLU A 957 -3.114 7.179 5.821 1.00 0.00 C ATOM 592 O GLU A 957 -3.237 6.006 6.184 1.00 0.00 O ATOM 593 CB GLU A 957 -4.908 8.917 6.031 1.00 0.00 C ATOM 594 CG GLU A 957 -5.441 10.159 6.731 1.00 0.00 C ATOM 595 CD GLU A 957 -5.929 9.885 8.136 1.00 0.00 C ATOM 596 OE1 GLU A 957 -5.089 9.651 9.029 1.00 0.00 O ATOM 597 OE2 GLU A 957 -7.157 9.917 8.360 1.00 0.00 O ATOM 0 H GLU A 957 -2.985 10.305 6.657 1.00 0.00 H new ATOM 0 HA GLU A 957 -3.916 7.899 7.665 1.00 0.00 H new ATOM 0 HB2 GLU A 957 -4.674 9.167 4.996 1.00 0.00 H new ATOM 0 HB3 GLU A 957 -5.693 8.161 6.007 1.00 0.00 H new ATOM 0 HG2 GLU A 957 -4.656 10.914 6.766 1.00 0.00 H new ATOM 0 HG3 GLU A 957 -6.259 10.577 6.144 1.00 0.00 H new ATOM 604 N VAL A 958 -2.477 7.506 4.695 1.00 0.00 N ATOM 605 CA VAL A 958 -1.896 6.461 3.850 1.00 0.00 C ATOM 606 C VAL A 958 -0.681 5.832 4.548 1.00 0.00 C ATOM 607 O VAL A 958 -0.269 4.714 4.231 1.00 0.00 O ATOM 608 CB VAL A 958 -1.519 6.959 2.433 1.00 0.00 C ATOM 609 CG1 VAL A 958 -0.232 7.759 2.438 1.00 0.00 C ATOM 610 CG2 VAL A 958 -1.418 5.787 1.470 1.00 0.00 C ATOM 0 H VAL A 958 -2.352 8.459 4.354 1.00 0.00 H new ATOM 0 HA VAL A 958 -2.667 5.704 3.709 1.00 0.00 H new ATOM 0 HB VAL A 958 -2.313 7.626 2.097 1.00 0.00 H new ATOM 0 HG11 VAL A 958 -0.005 8.089 1.424 1.00 0.00 H new ATOM 0 HG12 VAL A 958 -0.347 8.628 3.085 1.00 0.00 H new ATOM 0 HG13 VAL A 958 0.582 7.136 2.808 1.00 0.00 H new ATOM 0 HG21 VAL A 958 -1.152 6.153 0.478 1.00 0.00 H new ATOM 0 HG22 VAL A 958 -0.652 5.095 1.819 1.00 0.00 H new ATOM 0 HG23 VAL A 958 -2.377 5.272 1.422 1.00 0.00 H new ATOM 620 N GLY A 959 -0.108 6.559 5.498 1.00 0.00 N ATOM 621 CA GLY A 959 0.910 5.987 6.355 1.00 0.00 C ATOM 622 C GLY A 959 0.343 4.859 7.192 1.00 0.00 C ATOM 623 O GLY A 959 0.968 3.811 7.341 1.00 0.00 O ATOM 0 H GLY A 959 -0.331 7.536 5.690 1.00 0.00 H new ATOM 0 HA2 GLY A 959 1.735 5.615 5.747 1.00 0.00 H new ATOM 0 HA3 GLY A 959 1.318 6.759 7.007 1.00 0.00 H new ATOM 627 N LEU A 960 -0.869 5.066 7.705 1.00 0.00 N ATOM 628 CA LEU A 960 -1.591 4.036 8.450 1.00 0.00 C ATOM 629 C LEU A 960 -2.117 2.964 7.497 1.00 0.00 C ATOM 630 O LEU A 960 -2.556 1.891 7.920 1.00 0.00 O ATOM 631 CB LEU A 960 -2.754 4.660 9.227 1.00 0.00 C ATOM 632 CG LEU A 960 -3.524 3.698 10.133 1.00 0.00 C ATOM 633 CD1 LEU A 960 -2.649 3.236 11.290 1.00 0.00 C ATOM 634 CD2 LEU A 960 -4.797 4.349 10.645 1.00 0.00 C ATOM 0 H LEU A 960 -1.376 5.947 7.617 1.00 0.00 H new ATOM 0 HA LEU A 960 -0.903 3.573 9.157 1.00 0.00 H new ATOM 0 HB2 LEU A 960 -2.366 5.476 9.837 1.00 0.00 H new ATOM 0 HB3 LEU A 960 -3.452 5.099 8.514 1.00 0.00 H new ATOM 0 HG LEU A 960 -3.803 2.822 9.547 1.00 0.00 H new ATOM 0 HD11 LEU A 960 -3.214 2.552 11.923 1.00 0.00 H new ATOM 0 HD12 LEU A 960 -1.769 2.725 10.899 1.00 0.00 H new ATOM 0 HD13 LEU A 960 -2.336 4.100 11.877 1.00 0.00 H new ATOM 0 HD21 LEU A 960 -5.331 3.649 11.288 1.00 0.00 H new ATOM 0 HD22 LEU A 960 -4.545 5.244 11.214 1.00 0.00 H new ATOM 0 HD23 LEU A 960 -5.431 4.622 9.801 1.00 0.00 H new ATOM 646 N ALA A 961 -2.021 3.256 6.208 1.00 0.00 N ATOM 647 CA ALA A 961 -2.524 2.353 5.183 1.00 0.00 C ATOM 648 C ALA A 961 -1.564 1.189 5.019 1.00 0.00 C ATOM 649 O ALA A 961 -1.944 0.033 5.184 1.00 0.00 O ATOM 650 CB ALA A 961 -2.712 3.075 3.859 1.00 0.00 C ATOM 0 H ALA A 961 -1.599 4.112 5.847 1.00 0.00 H new ATOM 0 HA ALA A 961 -3.498 1.978 5.497 1.00 0.00 H new ATOM 0 HB1 ALA A 961 -3.088 2.375 3.113 1.00 0.00 H new ATOM 0 HB2 ALA A 961 -3.426 3.888 3.986 1.00 0.00 H new ATOM 0 HB3 ALA A 961 -1.756 3.480 3.527 1.00 0.00 H new ATOM 656 N LEU A 962 -0.301 1.496 4.730 1.00 0.00 N ATOM 657 CA LEU A 962 0.718 0.466 4.650 1.00 0.00 C ATOM 658 C LEU A 962 1.127 0.008 6.054 1.00 0.00 C ATOM 659 O LEU A 962 1.725 -1.055 6.222 1.00 0.00 O ATOM 660 CB LEU A 962 1.933 0.966 3.861 1.00 0.00 C ATOM 661 CG LEU A 962 3.112 -0.006 3.819 1.00 0.00 C ATOM 662 CD1 LEU A 962 2.726 -1.275 3.078 1.00 0.00 C ATOM 663 CD2 LEU A 962 4.323 0.647 3.182 1.00 0.00 C ATOM 0 H LEU A 962 0.034 2.442 4.550 1.00 0.00 H new ATOM 0 HA LEU A 962 0.303 -0.391 4.119 1.00 0.00 H new ATOM 0 HB2 LEU A 962 1.621 1.182 2.839 1.00 0.00 H new ATOM 0 HB3 LEU A 962 2.270 1.906 4.297 1.00 0.00 H new ATOM 0 HG LEU A 962 3.375 -0.275 4.842 1.00 0.00 H new ATOM 0 HD11 LEU A 962 3.576 -1.957 3.057 1.00 0.00 H new ATOM 0 HD12 LEU A 962 1.890 -1.754 3.587 1.00 0.00 H new ATOM 0 HD13 LEU A 962 2.435 -1.026 2.057 1.00 0.00 H new ATOM 0 HD21 LEU A 962 5.151 -0.062 3.162 1.00 0.00 H new ATOM 0 HD22 LEU A 962 4.080 0.949 2.163 1.00 0.00 H new ATOM 0 HD23 LEU A 962 4.611 1.524 3.762 1.00 0.00 H new ATOM 675 N ARG A 963 0.798 0.809 7.065 1.00 0.00 N ATOM 676 CA ARG A 963 1.071 0.434 8.450 1.00 0.00 C ATOM 677 C ARG A 963 0.251 -0.798 8.821 1.00 0.00 C ATOM 678 O ARG A 963 0.799 -1.874 9.074 1.00 0.00 O ATOM 679 CB ARG A 963 0.740 1.587 9.404 1.00 0.00 C ATOM 680 CG ARG A 963 1.224 1.369 10.832 1.00 0.00 C ATOM 681 CD ARG A 963 2.680 1.782 11.015 1.00 0.00 C ATOM 682 NE ARG A 963 3.588 1.087 10.102 1.00 0.00 N ATOM 683 CZ ARG A 963 4.880 0.879 10.355 1.00 0.00 C ATOM 684 NH1 ARG A 963 5.403 1.267 11.510 1.00 0.00 N ATOM 685 NH2 ARG A 963 5.639 0.272 9.452 1.00 0.00 N ATOM 0 H ARG A 963 0.345 1.716 6.952 1.00 0.00 H new ATOM 0 HA ARG A 963 2.133 0.206 8.543 1.00 0.00 H new ATOM 0 HB2 ARG A 963 1.184 2.504 9.017 1.00 0.00 H new ATOM 0 HB3 ARG A 963 -0.340 1.736 9.416 1.00 0.00 H new ATOM 0 HG2 ARG A 963 0.597 1.939 11.517 1.00 0.00 H new ATOM 0 HG3 ARG A 963 1.110 0.318 11.096 1.00 0.00 H new ATOM 0 HD2 ARG A 963 2.770 2.857 10.860 1.00 0.00 H new ATOM 0 HD3 ARG A 963 2.983 1.582 12.043 1.00 0.00 H new ATOM 0 HE ARG A 963 3.210 0.741 9.220 1.00 0.00 H new ATOM 0 HH11 ARG A 963 4.816 1.726 12.207 1.00 0.00 H new ATOM 0 HH12 ARG A 963 6.392 1.107 11.701 1.00 0.00 H new ATOM 0 HH21 ARG A 963 5.233 -0.034 8.567 1.00 0.00 H new ATOM 0 HH22 ARG A 963 6.628 0.111 9.642 1.00 0.00 H new ATOM 699 N THR A 964 -1.066 -0.636 8.846 1.00 0.00 N ATOM 700 CA THR A 964 -1.977 -1.744 9.088 1.00 0.00 C ATOM 701 C THR A 964 -1.796 -2.853 8.046 1.00 0.00 C ATOM 702 O THR A 964 -2.095 -4.021 8.302 1.00 0.00 O ATOM 703 CB THR A 964 -3.435 -1.240 9.072 1.00 0.00 C ATOM 704 OG1 THR A 964 -3.524 -0.017 9.820 1.00 0.00 O ATOM 705 CG2 THR A 964 -4.384 -2.271 9.668 1.00 0.00 C ATOM 0 H THR A 964 -1.529 0.261 8.700 1.00 0.00 H new ATOM 0 HA THR A 964 -1.747 -2.161 10.068 1.00 0.00 H new ATOM 0 HB THR A 964 -3.727 -1.069 8.036 1.00 0.00 H new ATOM 0 HG1 THR A 964 -3.319 0.741 9.233 1.00 0.00 H new ATOM 0 HG21 THR A 964 -5.403 -1.885 9.642 1.00 0.00 H new ATOM 0 HG22 THR A 964 -4.330 -3.193 9.089 1.00 0.00 H new ATOM 0 HG23 THR A 964 -4.099 -2.474 10.700 1.00 0.00 H new ATOM 713 N LEU A 965 -1.242 -2.491 6.899 1.00 0.00 N ATOM 714 CA LEU A 965 -1.024 -3.451 5.835 1.00 0.00 C ATOM 715 C LEU A 965 0.165 -4.335 6.184 1.00 0.00 C ATOM 716 O LEU A 965 0.176 -5.523 5.881 1.00 0.00 O ATOM 717 CB LEU A 965 -0.799 -2.751 4.500 1.00 0.00 C ATOM 718 CG LEU A 965 -0.665 -3.690 3.307 1.00 0.00 C ATOM 719 CD1 LEU A 965 -1.801 -4.698 3.302 1.00 0.00 C ATOM 720 CD2 LEU A 965 -0.649 -2.901 2.011 1.00 0.00 C ATOM 0 H LEU A 965 -0.937 -1.542 6.684 1.00 0.00 H new ATOM 0 HA LEU A 965 -1.915 -4.070 5.735 1.00 0.00 H new ATOM 0 HB2 LEU A 965 -1.629 -2.069 4.318 1.00 0.00 H new ATOM 0 HB3 LEU A 965 0.103 -2.143 4.571 1.00 0.00 H new ATOM 0 HG LEU A 965 0.278 -4.230 3.392 1.00 0.00 H new ATOM 0 HD11 LEU A 965 -1.694 -5.363 2.445 1.00 0.00 H new ATOM 0 HD12 LEU A 965 -1.772 -5.283 4.221 1.00 0.00 H new ATOM 0 HD13 LEU A 965 -2.754 -4.172 3.236 1.00 0.00 H new ATOM 0 HD21 LEU A 965 -0.553 -3.586 1.169 1.00 0.00 H new ATOM 0 HD22 LEU A 965 -1.577 -2.338 1.916 1.00 0.00 H new ATOM 0 HD23 LEU A 965 0.195 -2.211 2.015 1.00 0.00 H new ATOM 732 N LEU A 966 1.169 -3.731 6.814 1.00 0.00 N ATOM 733 CA LEU A 966 2.309 -4.469 7.357 1.00 0.00 C ATOM 734 C LEU A 966 1.840 -5.590 8.279 1.00 0.00 C ATOM 735 O LEU A 966 2.464 -6.647 8.345 1.00 0.00 O ATOM 736 CB LEU A 966 3.252 -3.527 8.115 1.00 0.00 C ATOM 737 CG LEU A 966 4.514 -4.180 8.686 1.00 0.00 C ATOM 738 CD1 LEU A 966 5.400 -4.708 7.569 1.00 0.00 C ATOM 739 CD2 LEU A 966 5.278 -3.192 9.553 1.00 0.00 C ATOM 0 H LEU A 966 1.217 -2.723 6.963 1.00 0.00 H new ATOM 0 HA LEU A 966 2.851 -4.910 6.521 1.00 0.00 H new ATOM 0 HB2 LEU A 966 3.552 -2.723 7.443 1.00 0.00 H new ATOM 0 HB3 LEU A 966 2.698 -3.068 8.934 1.00 0.00 H new ATOM 0 HG LEU A 966 4.212 -5.023 9.307 1.00 0.00 H new ATOM 0 HD11 LEU A 966 6.291 -5.168 7.997 1.00 0.00 H new ATOM 0 HD12 LEU A 966 4.851 -5.451 6.990 1.00 0.00 H new ATOM 0 HD13 LEU A 966 5.694 -3.885 6.918 1.00 0.00 H new ATOM 0 HD21 LEU A 966 6.172 -3.672 9.951 1.00 0.00 H new ATOM 0 HD22 LEU A 966 5.566 -2.329 8.953 1.00 0.00 H new ATOM 0 HD23 LEU A 966 4.644 -2.866 10.378 1.00 0.00 H new ATOM 751 N ALA A 967 0.741 -5.355 8.993 1.00 0.00 N ATOM 752 CA ALA A 967 0.130 -6.406 9.802 1.00 0.00 C ATOM 753 C ALA A 967 -0.247 -7.598 8.921 1.00 0.00 C ATOM 754 O ALA A 967 0.075 -8.745 9.236 1.00 0.00 O ATOM 755 CB ALA A 967 -1.090 -5.877 10.541 1.00 0.00 C ATOM 0 H ALA A 967 0.260 -4.456 9.028 1.00 0.00 H new ATOM 0 HA ALA A 967 0.856 -6.738 10.544 1.00 0.00 H new ATOM 0 HB1 ALA A 967 -1.529 -6.677 11.137 1.00 0.00 H new ATOM 0 HB2 ALA A 967 -0.792 -5.058 11.196 1.00 0.00 H new ATOM 0 HB3 ALA A 967 -1.824 -5.517 9.820 1.00 0.00 H new ATOM 761 N THR A 968 -0.939 -7.323 7.823 1.00 0.00 N ATOM 762 CA THR A 968 -1.205 -8.345 6.810 1.00 0.00 C ATOM 763 C THR A 968 0.088 -8.926 6.229 1.00 0.00 C ATOM 764 O THR A 968 0.175 -10.131 5.985 1.00 0.00 O ATOM 765 CB THR A 968 -2.070 -7.791 5.670 1.00 0.00 C ATOM 766 OG1 THR A 968 -3.412 -7.629 6.120 1.00 0.00 O ATOM 767 CG2 THR A 968 -2.058 -8.715 4.471 1.00 0.00 C ATOM 0 H THR A 968 -1.327 -6.404 7.608 1.00 0.00 H new ATOM 0 HA THR A 968 -1.748 -9.144 7.315 1.00 0.00 H new ATOM 0 HB THR A 968 -1.655 -6.829 5.371 1.00 0.00 H new ATOM 0 HG1 THR A 968 -3.425 -7.580 7.099 1.00 0.00 H new ATOM 0 HG21 THR A 968 -2.680 -8.294 3.681 1.00 0.00 H new ATOM 0 HG22 THR A 968 -1.036 -8.827 4.108 1.00 0.00 H new ATOM 0 HG23 THR A 968 -2.449 -9.691 4.760 1.00 0.00 H new ATOM 775 N VAL A 969 1.078 -8.078 5.983 1.00 0.00 N ATOM 776 CA VAL A 969 2.386 -8.548 5.534 1.00 0.00 C ATOM 777 C VAL A 969 2.949 -9.586 6.503 1.00 0.00 C ATOM 778 O VAL A 969 3.638 -10.511 6.091 1.00 0.00 O ATOM 779 CB VAL A 969 3.387 -7.378 5.377 1.00 0.00 C ATOM 780 CG1 VAL A 969 4.770 -7.885 4.991 1.00 0.00 C ATOM 781 CG2 VAL A 969 2.885 -6.383 4.341 1.00 0.00 C ATOM 0 H VAL A 969 1.003 -7.066 6.085 1.00 0.00 H new ATOM 0 HA VAL A 969 2.247 -9.011 4.557 1.00 0.00 H new ATOM 0 HB VAL A 969 3.466 -6.875 6.341 1.00 0.00 H new ATOM 0 HG11 VAL A 969 5.451 -7.041 4.888 1.00 0.00 H new ATOM 0 HG12 VAL A 969 5.140 -8.558 5.765 1.00 0.00 H new ATOM 0 HG13 VAL A 969 4.710 -8.420 4.043 1.00 0.00 H new ATOM 0 HG21 VAL A 969 3.601 -5.567 4.243 1.00 0.00 H new ATOM 0 HG22 VAL A 969 2.773 -6.884 3.380 1.00 0.00 H new ATOM 0 HG23 VAL A 969 1.921 -5.984 4.657 1.00 0.00 H new ATOM 791 N ASP A 970 2.623 -9.444 7.781 1.00 0.00 N ATOM 792 CA ASP A 970 3.035 -10.418 8.789 1.00 0.00 C ATOM 793 C ASP A 970 2.312 -11.739 8.607 1.00 0.00 C ATOM 794 O ASP A 970 2.873 -12.780 8.892 1.00 0.00 O ATOM 795 CB ASP A 970 2.812 -9.867 10.204 1.00 0.00 C ATOM 796 CG ASP A 970 3.077 -10.893 11.291 1.00 0.00 C ATOM 797 OD1 ASP A 970 4.231 -10.990 11.760 1.00 0.00 O ATOM 798 OD2 ASP A 970 2.129 -11.601 11.695 1.00 0.00 O ATOM 0 H ASP A 970 2.075 -8.665 8.146 1.00 0.00 H new ATOM 0 HA ASP A 970 4.101 -10.601 8.657 1.00 0.00 H new ATOM 0 HB2 ASP A 970 3.462 -9.006 10.359 1.00 0.00 H new ATOM 0 HB3 ASP A 970 1.786 -9.511 10.291 1.00 0.00 H new ATOM 803 N GLU A 971 1.075 -11.699 8.131 1.00 0.00 N ATOM 804 CA GLU A 971 0.364 -12.925 7.775 1.00 0.00 C ATOM 805 C GLU A 971 1.136 -13.649 6.678 1.00 0.00 C ATOM 806 O GLU A 971 1.571 -14.796 6.824 1.00 0.00 O ATOM 807 CB GLU A 971 -1.042 -12.595 7.255 1.00 0.00 C ATOM 808 CG GLU A 971 -1.866 -11.743 8.199 1.00 0.00 C ATOM 809 CD GLU A 971 -2.410 -12.532 9.371 1.00 0.00 C ATOM 810 OE1 GLU A 971 -2.332 -13.777 9.349 1.00 0.00 O ATOM 811 OE2 GLU A 971 -2.940 -11.907 10.313 1.00 0.00 O ATOM 0 H GLU A 971 0.545 -10.841 7.982 1.00 0.00 H new ATOM 0 HA GLU A 971 0.280 -13.555 8.661 1.00 0.00 H new ATOM 0 HB2 GLU A 971 -0.952 -12.077 6.300 1.00 0.00 H new ATOM 0 HB3 GLU A 971 -1.575 -13.526 7.064 1.00 0.00 H new ATOM 0 HG2 GLU A 971 -1.252 -10.923 8.571 1.00 0.00 H new ATOM 0 HG3 GLU A 971 -2.695 -11.297 7.650 1.00 0.00 H new ATOM 818 N SER A 972 1.327 -12.935 5.586 1.00 0.00 N ATOM 819 CA SER A 972 1.999 -13.459 4.421 1.00 0.00 C ATOM 820 C SER A 972 3.482 -13.750 4.687 1.00 0.00 C ATOM 821 O SER A 972 4.091 -14.503 3.947 1.00 0.00 O ATOM 822 CB SER A 972 1.819 -12.518 3.231 1.00 0.00 C ATOM 823 OG SER A 972 2.524 -12.990 2.101 1.00 0.00 O ATOM 0 H SER A 972 1.017 -11.969 5.485 1.00 0.00 H new ATOM 0 HA SER A 972 1.535 -14.415 4.177 1.00 0.00 H new ATOM 0 HB2 SER A 972 0.760 -12.428 2.991 1.00 0.00 H new ATOM 0 HB3 SER A 972 2.173 -11.521 3.494 1.00 0.00 H new ATOM 0 HG SER A 972 2.696 -13.950 2.200 1.00 0.00 H new ATOM 829 N LEU A 973 4.076 -13.108 5.687 1.00 0.00 N ATOM 830 CA LEU A 973 5.507 -13.280 5.970 1.00 0.00 C ATOM 831 C LEU A 973 5.882 -14.727 6.338 1.00 0.00 C ATOM 832 O LEU A 973 6.857 -15.226 5.808 1.00 0.00 O ATOM 833 CB LEU A 973 5.973 -12.308 7.061 1.00 0.00 C ATOM 834 CG LEU A 973 7.481 -12.303 7.337 1.00 0.00 C ATOM 835 CD1 LEU A 973 8.256 -11.901 6.089 1.00 0.00 C ATOM 836 CD2 LEU A 973 7.809 -11.363 8.486 1.00 0.00 C ATOM 0 H LEU A 973 3.596 -12.465 6.316 1.00 0.00 H new ATOM 0 HA LEU A 973 6.030 -13.048 5.042 1.00 0.00 H new ATOM 0 HB2 LEU A 973 5.669 -11.300 6.780 1.00 0.00 H new ATOM 0 HB3 LEU A 973 5.452 -12.551 7.987 1.00 0.00 H new ATOM 0 HG LEU A 973 7.779 -13.313 7.617 1.00 0.00 H new ATOM 0 HD11 LEU A 973 9.324 -11.904 6.307 1.00 0.00 H new ATOM 0 HD12 LEU A 973 8.047 -12.609 5.287 1.00 0.00 H new ATOM 0 HD13 LEU A 973 7.952 -10.901 5.778 1.00 0.00 H new ATOM 0 HD21 LEU A 973 8.884 -11.372 8.668 1.00 0.00 H new ATOM 0 HD22 LEU A 973 7.493 -10.352 8.230 1.00 0.00 H new ATOM 0 HD23 LEU A 973 7.286 -11.690 9.385 1.00 0.00 H new ATOM 848 N PRO A 974 5.181 -15.429 7.262 1.00 0.00 N ATOM 849 CA PRO A 974 5.374 -16.882 7.418 1.00 0.00 C ATOM 850 C PRO A 974 4.959 -17.619 6.151 1.00 0.00 C ATOM 851 O PRO A 974 5.487 -18.689 5.805 1.00 0.00 O ATOM 852 CB PRO A 974 4.459 -17.258 8.586 1.00 0.00 C ATOM 853 CG PRO A 974 4.233 -15.981 9.309 1.00 0.00 C ATOM 854 CD PRO A 974 4.250 -14.914 8.255 1.00 0.00 C ATOM 0 HA PRO A 974 6.415 -17.149 7.599 1.00 0.00 H new ATOM 0 HB2 PRO A 974 3.520 -17.685 8.233 1.00 0.00 H new ATOM 0 HB3 PRO A 974 4.925 -18.002 9.232 1.00 0.00 H new ATOM 0 HG2 PRO A 974 3.281 -15.994 9.839 1.00 0.00 H new ATOM 0 HG3 PRO A 974 5.010 -15.809 10.054 1.00 0.00 H new ATOM 0 HD2 PRO A 974 3.259 -14.754 7.830 1.00 0.00 H new ATOM 0 HD3 PRO A 974 4.582 -13.957 8.658 1.00 0.00 H new ATOM 862 N VAL A 975 4.042 -17.003 5.422 1.00 0.00 N ATOM 863 CA VAL A 975 3.607 -17.558 4.147 1.00 0.00 C ATOM 864 C VAL A 975 4.706 -17.336 3.085 1.00 0.00 C ATOM 865 O VAL A 975 4.700 -17.946 2.010 1.00 0.00 O ATOM 866 CB VAL A 975 2.255 -16.931 3.717 1.00 0.00 C ATOM 867 CG1 VAL A 975 1.665 -17.633 2.518 1.00 0.00 C ATOM 868 CG2 VAL A 975 1.270 -16.981 4.869 1.00 0.00 C ATOM 0 H VAL A 975 3.588 -16.129 5.686 1.00 0.00 H new ATOM 0 HA VAL A 975 3.447 -18.631 4.251 1.00 0.00 H new ATOM 0 HB VAL A 975 2.449 -15.895 3.439 1.00 0.00 H new ATOM 0 HG11 VAL A 975 0.719 -17.163 2.250 1.00 0.00 H new ATOM 0 HG12 VAL A 975 2.356 -17.562 1.678 1.00 0.00 H new ATOM 0 HG13 VAL A 975 1.493 -18.682 2.759 1.00 0.00 H new ATOM 0 HG21 VAL A 975 0.324 -16.539 4.558 1.00 0.00 H new ATOM 0 HG22 VAL A 975 1.107 -18.018 5.163 1.00 0.00 H new ATOM 0 HG23 VAL A 975 1.671 -16.423 5.715 1.00 0.00 H new ATOM 878 N LEU A 976 5.673 -16.485 3.438 1.00 0.00 N ATOM 879 CA LEU A 976 6.830 -16.173 2.596 1.00 0.00 C ATOM 880 C LEU A 976 7.827 -17.341 2.526 1.00 0.00 C ATOM 881 O LEU A 976 8.141 -17.779 1.421 1.00 0.00 O ATOM 882 CB LEU A 976 7.482 -14.844 3.064 1.00 0.00 C ATOM 883 CG LEU A 976 8.946 -14.567 2.679 1.00 0.00 C ATOM 884 CD1 LEU A 976 9.212 -13.071 2.680 1.00 0.00 C ATOM 885 CD2 LEU A 976 9.920 -15.226 3.642 1.00 0.00 C ATOM 0 H LEU A 976 5.674 -15.987 4.328 1.00 0.00 H new ATOM 0 HA LEU A 976 6.487 -16.029 1.572 1.00 0.00 H new ATOM 0 HB2 LEU A 976 6.877 -14.024 2.677 1.00 0.00 H new ATOM 0 HB3 LEU A 976 7.413 -14.806 4.151 1.00 0.00 H new ATOM 0 HG LEU A 976 9.098 -14.985 1.684 1.00 0.00 H new ATOM 0 HD11 LEU A 976 10.251 -12.886 2.406 1.00 0.00 H new ATOM 0 HD12 LEU A 976 8.555 -12.584 1.960 1.00 0.00 H new ATOM 0 HD13 LEU A 976 9.022 -12.668 3.675 1.00 0.00 H new ATOM 0 HD21 LEU A 976 10.942 -15.005 3.334 1.00 0.00 H new ATOM 0 HD22 LEU A 976 9.753 -14.841 4.648 1.00 0.00 H new ATOM 0 HD23 LEU A 976 9.764 -16.305 3.636 1.00 0.00 H new ATOM 897 N PRO A 977 8.331 -17.898 3.664 1.00 0.00 N ATOM 898 CA PRO A 977 9.261 -19.029 3.613 1.00 0.00 C ATOM 899 C PRO A 977 8.593 -20.242 3.002 1.00 0.00 C ATOM 900 O PRO A 977 9.258 -21.154 2.510 1.00 0.00 O ATOM 901 CB PRO A 977 9.625 -19.300 5.076 1.00 0.00 C ATOM 902 CG PRO A 977 9.231 -18.069 5.804 1.00 0.00 C ATOM 903 CD PRO A 977 8.060 -17.514 5.053 1.00 0.00 C ATOM 0 HA PRO A 977 10.137 -18.813 3.001 1.00 0.00 H new ATOM 0 HB2 PRO A 977 9.095 -20.172 5.460 1.00 0.00 H new ATOM 0 HB3 PRO A 977 10.691 -19.500 5.187 1.00 0.00 H new ATOM 0 HG2 PRO A 977 8.964 -18.293 6.837 1.00 0.00 H new ATOM 0 HG3 PRO A 977 10.052 -17.352 5.835 1.00 0.00 H new ATOM 0 HD2 PRO A 977 7.119 -17.934 5.409 1.00 0.00 H new ATOM 0 HD3 PRO A 977 7.988 -16.432 5.164 1.00 0.00 H new ATOM 911 N ALA A 978 7.265 -20.256 3.062 1.00 0.00 N ATOM 912 CA ALA A 978 6.500 -21.266 2.362 1.00 0.00 C ATOM 913 C ALA A 978 6.677 -21.136 0.840 1.00 0.00 C ATOM 914 O ALA A 978 7.185 -22.058 0.202 1.00 0.00 O ATOM 915 CB ALA A 978 5.037 -21.187 2.760 1.00 0.00 C ATOM 0 H ALA A 978 6.706 -19.583 3.585 1.00 0.00 H new ATOM 0 HA ALA A 978 6.877 -22.248 2.649 1.00 0.00 H new ATOM 0 HB1 ALA A 978 4.473 -21.952 2.226 1.00 0.00 H new ATOM 0 HB2 ALA A 978 4.943 -21.349 3.834 1.00 0.00 H new ATOM 0 HB3 ALA A 978 4.643 -20.203 2.506 1.00 0.00 H new ATOM 921 N SER A 979 6.279 -19.986 0.261 1.00 0.00 N ATOM 922 CA SER A 979 6.384 -19.776 -1.198 1.00 0.00 C ATOM 923 C SER A 979 6.323 -18.282 -1.580 1.00 0.00 C ATOM 924 O SER A 979 7.063 -17.826 -2.450 1.00 0.00 O ATOM 925 CB SER A 979 5.269 -20.528 -1.940 1.00 0.00 C ATOM 926 OG SER A 979 5.262 -21.909 -1.635 1.00 0.00 O ATOM 0 H SER A 979 5.886 -19.196 0.773 1.00 0.00 H new ATOM 0 HA SER A 979 7.357 -20.167 -1.496 1.00 0.00 H new ATOM 0 HB2 SER A 979 4.304 -20.095 -1.678 1.00 0.00 H new ATOM 0 HB3 SER A 979 5.396 -20.395 -3.014 1.00 0.00 H new ATOM 0 HG SER A 979 6.132 -22.167 -1.264 1.00 0.00 H new ATOM 932 N THR A 980 5.409 -17.545 -0.939 1.00 0.00 N ATOM 933 CA THR A 980 5.198 -16.098 -1.177 1.00 0.00 C ATOM 934 C THR A 980 6.480 -15.252 -1.235 1.00 0.00 C ATOM 935 O THR A 980 6.467 -14.175 -1.828 1.00 0.00 O ATOM 936 CB THR A 980 4.298 -15.497 -0.085 1.00 0.00 C ATOM 937 OG1 THR A 980 3.134 -16.303 0.091 1.00 0.00 O ATOM 938 CG2 THR A 980 3.885 -14.083 -0.452 1.00 0.00 C ATOM 0 H THR A 980 4.785 -17.933 -0.232 1.00 0.00 H new ATOM 0 HA THR A 980 4.735 -16.056 -2.163 1.00 0.00 H new ATOM 0 HB THR A 980 4.863 -15.470 0.847 1.00 0.00 H new ATOM 0 HG1 THR A 980 2.592 -15.940 0.822 1.00 0.00 H new ATOM 0 HG21 THR A 980 3.248 -13.675 0.333 1.00 0.00 H new ATOM 0 HG22 THR A 980 4.773 -13.461 -0.559 1.00 0.00 H new ATOM 0 HG23 THR A 980 3.336 -14.097 -1.394 1.00 0.00 H new ATOM 946 N HIS A 981 7.578 -15.745 -0.665 1.00 0.00 N ATOM 947 CA HIS A 981 8.819 -14.961 -0.521 1.00 0.00 C ATOM 948 C HIS A 981 9.221 -14.254 -1.813 1.00 0.00 C ATOM 949 O HIS A 981 9.736 -13.136 -1.772 1.00 0.00 O ATOM 950 CB HIS A 981 9.962 -15.894 -0.085 1.00 0.00 C ATOM 951 CG HIS A 981 11.331 -15.272 -0.092 1.00 0.00 C ATOM 952 ND1 HIS A 981 11.787 -14.420 0.891 1.00 0.00 N ATOM 953 CD2 HIS A 981 12.352 -15.406 -0.971 1.00 0.00 C ATOM 954 CE1 HIS A 981 13.028 -14.062 0.616 1.00 0.00 C ATOM 955 NE2 HIS A 981 13.397 -14.649 -0.509 1.00 0.00 N ATOM 0 H HIS A 981 7.640 -16.692 -0.290 1.00 0.00 H new ATOM 0 HA HIS A 981 8.632 -14.194 0.230 1.00 0.00 H new ATOM 0 HB2 HIS A 981 9.750 -16.257 0.921 1.00 0.00 H new ATOM 0 HB3 HIS A 981 9.971 -16.763 -0.743 1.00 0.00 H new ATOM 0 HD2 HIS A 981 12.344 -16.001 -1.872 1.00 0.00 H new ATOM 0 HE1 HIS A 981 13.639 -13.400 1.211 1.00 0.00 H new ATOM 0 HE2 HIS A 981 14.308 -14.554 -0.959 1.00 0.00 H new ATOM 964 N ARG A 982 9.000 -14.888 -2.943 1.00 0.00 N ATOM 965 CA ARG A 982 9.295 -14.240 -4.215 1.00 0.00 C ATOM 966 C ARG A 982 8.457 -12.966 -4.413 1.00 0.00 C ATOM 967 O ARG A 982 9.012 -11.864 -4.556 1.00 0.00 O ATOM 968 CB ARG A 982 9.056 -15.208 -5.378 1.00 0.00 C ATOM 969 CG ARG A 982 7.730 -15.947 -5.296 1.00 0.00 C ATOM 970 CD ARG A 982 7.363 -16.603 -6.615 1.00 0.00 C ATOM 971 NE ARG A 982 8.387 -17.532 -7.087 1.00 0.00 N ATOM 972 CZ ARG A 982 8.197 -18.392 -8.083 1.00 0.00 C ATOM 973 NH1 ARG A 982 7.007 -18.484 -8.665 1.00 0.00 N ATOM 974 NH2 ARG A 982 9.190 -19.172 -8.487 1.00 0.00 N ATOM 0 H ARG A 982 8.624 -15.834 -3.015 1.00 0.00 H new ATOM 0 HA ARG A 982 10.346 -13.952 -4.197 1.00 0.00 H new ATOM 0 HB2 ARG A 982 9.095 -14.653 -6.315 1.00 0.00 H new ATOM 0 HB3 ARG A 982 9.867 -15.936 -5.405 1.00 0.00 H new ATOM 0 HG2 ARG A 982 7.786 -16.707 -4.516 1.00 0.00 H new ATOM 0 HG3 ARG A 982 6.944 -15.250 -5.006 1.00 0.00 H new ATOM 0 HD2 ARG A 982 6.419 -17.136 -6.501 1.00 0.00 H new ATOM 0 HD3 ARG A 982 7.204 -15.831 -7.368 1.00 0.00 H new ATOM 0 HE ARG A 982 9.297 -17.520 -6.627 1.00 0.00 H new ATOM 0 HH11 ARG A 982 6.237 -17.894 -8.348 1.00 0.00 H new ATOM 0 HH12 ARG A 982 6.863 -19.144 -9.429 1.00 0.00 H new ATOM 0 HH21 ARG A 982 10.102 -19.113 -8.034 1.00 0.00 H new ATOM 0 HH22 ARG A 982 9.042 -19.831 -9.251 1.00 0.00 H new ATOM 988 N GLU A 983 7.135 -13.079 -4.340 1.00 0.00 N ATOM 989 CA GLU A 983 6.288 -11.935 -4.630 1.00 0.00 C ATOM 990 C GLU A 983 6.259 -10.949 -3.489 1.00 0.00 C ATOM 991 O GLU A 983 6.415 -9.751 -3.709 1.00 0.00 O ATOM 992 CB GLU A 983 4.850 -12.323 -4.932 1.00 0.00 C ATOM 993 CG GLU A 983 4.195 -11.316 -5.851 1.00 0.00 C ATOM 994 CD GLU A 983 4.472 -11.611 -7.311 1.00 0.00 C ATOM 995 OE1 GLU A 983 5.658 -11.677 -7.695 1.00 0.00 O ATOM 996 OE2 GLU A 983 3.506 -11.780 -8.081 1.00 0.00 O ATOM 0 H GLU A 983 6.638 -13.933 -4.088 1.00 0.00 H new ATOM 0 HA GLU A 983 6.735 -11.481 -5.514 1.00 0.00 H new ATOM 0 HB2 GLU A 983 4.826 -13.310 -5.393 1.00 0.00 H new ATOM 0 HB3 GLU A 983 4.286 -12.392 -4.002 1.00 0.00 H new ATOM 0 HG2 GLU A 983 3.119 -11.316 -5.680 1.00 0.00 H new ATOM 0 HG3 GLU A 983 4.556 -10.316 -5.609 1.00 0.00 H new ATOM 1003 N ILE A 984 6.022 -11.443 -2.273 1.00 0.00 N ATOM 1004 CA ILE A 984 5.868 -10.551 -1.129 1.00 0.00 C ATOM 1005 C ILE A 984 7.023 -9.570 -1.065 1.00 0.00 C ATOM 1006 O ILE A 984 6.811 -8.377 -0.899 1.00 0.00 O ATOM 1007 CB ILE A 984 5.734 -11.308 0.214 1.00 0.00 C ATOM 1008 CG1 ILE A 984 5.533 -10.321 1.370 1.00 0.00 C ATOM 1009 CG2 ILE A 984 6.943 -12.185 0.468 1.00 0.00 C ATOM 1010 CD1 ILE A 984 5.379 -10.988 2.721 1.00 0.00 C ATOM 0 H ILE A 984 5.934 -12.436 -2.059 1.00 0.00 H new ATOM 0 HA ILE A 984 4.935 -10.008 -1.279 1.00 0.00 H new ATOM 0 HB ILE A 984 4.857 -11.953 0.151 1.00 0.00 H new ATOM 0 HG12 ILE A 984 6.383 -9.640 1.406 1.00 0.00 H new ATOM 0 HG13 ILE A 984 4.648 -9.717 1.170 1.00 0.00 H new ATOM 0 HG21 ILE A 984 6.822 -12.705 1.418 1.00 0.00 H new ATOM 0 HG22 ILE A 984 7.038 -12.915 -0.336 1.00 0.00 H new ATOM 0 HG23 ILE A 984 7.840 -11.567 0.504 1.00 0.00 H new ATOM 0 HD11 ILE A 984 5.241 -10.227 3.489 1.00 0.00 H new ATOM 0 HD12 ILE A 984 4.512 -11.648 2.704 1.00 0.00 H new ATOM 0 HD13 ILE A 984 6.273 -11.570 2.944 1.00 0.00 H new ATOM 1022 N GLU A 985 8.225 -10.066 -1.306 1.00 0.00 N ATOM 1023 CA GLU A 985 9.413 -9.239 -1.214 1.00 0.00 C ATOM 1024 C GLU A 985 9.459 -8.184 -2.310 1.00 0.00 C ATOM 1025 O GLU A 985 10.014 -7.103 -2.094 1.00 0.00 O ATOM 1026 CB GLU A 985 10.678 -10.095 -1.244 1.00 0.00 C ATOM 1027 CG GLU A 985 10.952 -10.795 0.074 1.00 0.00 C ATOM 1028 CD GLU A 985 11.149 -9.811 1.213 1.00 0.00 C ATOM 1029 OE1 GLU A 985 12.287 -9.324 1.384 1.00 0.00 O ATOM 1030 OE2 GLU A 985 10.175 -9.524 1.935 1.00 0.00 O ATOM 0 H GLU A 985 8.402 -11.036 -1.566 1.00 0.00 H new ATOM 0 HA GLU A 985 9.366 -8.718 -0.258 1.00 0.00 H new ATOM 0 HB2 GLU A 985 10.586 -10.841 -2.033 1.00 0.00 H new ATOM 0 HB3 GLU A 985 11.530 -9.465 -1.498 1.00 0.00 H new ATOM 0 HG2 GLU A 985 10.122 -11.461 0.310 1.00 0.00 H new ATOM 0 HG3 GLU A 985 11.841 -11.417 -0.025 1.00 0.00 H new ATOM 1037 N MET A 986 8.879 -8.470 -3.482 1.00 0.00 N ATOM 1038 CA MET A 986 8.890 -7.474 -4.549 1.00 0.00 C ATOM 1039 C MET A 986 8.124 -6.204 -4.131 1.00 0.00 C ATOM 1040 O MET A 986 8.692 -5.115 -4.108 1.00 0.00 O ATOM 1041 CB MET A 986 8.375 -8.032 -5.894 1.00 0.00 C ATOM 1042 CG MET A 986 6.865 -8.094 -6.045 1.00 0.00 C ATOM 1043 SD MET A 986 6.344 -8.478 -7.729 1.00 0.00 S ATOM 1044 CE MET A 986 7.127 -7.152 -8.650 1.00 0.00 C ATOM 0 H MET A 986 8.414 -9.349 -3.707 1.00 0.00 H new ATOM 0 HA MET A 986 9.933 -7.201 -4.713 1.00 0.00 H new ATOM 0 HB2 MET A 986 8.778 -7.418 -6.699 1.00 0.00 H new ATOM 0 HB3 MET A 986 8.777 -9.036 -6.028 1.00 0.00 H new ATOM 0 HG2 MET A 986 6.468 -8.848 -5.366 1.00 0.00 H new ATOM 0 HG3 MET A 986 6.435 -7.138 -5.746 1.00 0.00 H new ATOM 0 HE1 MET A 986 6.476 -6.844 -9.469 1.00 0.00 H new ATOM 0 HE2 MET A 986 7.304 -6.304 -7.988 1.00 0.00 H new ATOM 0 HE3 MET A 986 8.077 -7.501 -9.054 1.00 0.00 H new ATOM 1054 N ALA A 987 6.852 -6.352 -3.762 1.00 0.00 N ATOM 1055 CA ALA A 987 6.015 -5.221 -3.411 1.00 0.00 C ATOM 1056 C ALA A 987 6.270 -4.738 -1.993 1.00 0.00 C ATOM 1057 O ALA A 987 6.195 -3.555 -1.739 1.00 0.00 O ATOM 1058 CB ALA A 987 4.549 -5.560 -3.600 1.00 0.00 C ATOM 0 H ALA A 987 6.382 -7.255 -3.700 1.00 0.00 H new ATOM 0 HA ALA A 987 6.279 -4.406 -4.085 1.00 0.00 H new ATOM 0 HB1 ALA A 987 3.939 -4.698 -3.331 1.00 0.00 H new ATOM 0 HB2 ALA A 987 4.368 -5.822 -4.642 1.00 0.00 H new ATOM 0 HB3 ALA A 987 4.286 -6.404 -2.963 1.00 0.00 H new ATOM 1064 N GLN A 988 6.567 -5.651 -1.074 1.00 0.00 N ATOM 1065 CA GLN A 988 6.773 -5.281 0.331 1.00 0.00 C ATOM 1066 C GLN A 988 7.853 -4.209 0.447 1.00 0.00 C ATOM 1067 O GLN A 988 7.629 -3.143 1.025 1.00 0.00 O ATOM 1068 CB GLN A 988 7.146 -6.527 1.159 1.00 0.00 C ATOM 1069 CG GLN A 988 7.399 -6.298 2.649 1.00 0.00 C ATOM 1070 CD GLN A 988 8.823 -5.874 2.968 1.00 0.00 C ATOM 1071 OE1 GLN A 988 9.118 -4.687 3.098 1.00 0.00 O ATOM 1072 NE2 GLN A 988 9.727 -6.838 3.064 1.00 0.00 N ATOM 0 H GLN A 988 6.671 -6.647 -1.270 1.00 0.00 H new ATOM 0 HA GLN A 988 5.844 -4.870 0.726 1.00 0.00 H new ATOM 0 HB2 GLN A 988 6.345 -7.259 1.056 1.00 0.00 H new ATOM 0 HB3 GLN A 988 8.041 -6.972 0.724 1.00 0.00 H new ATOM 0 HG2 GLN A 988 6.712 -5.534 3.012 1.00 0.00 H new ATOM 0 HG3 GLN A 988 7.172 -7.215 3.192 1.00 0.00 H new ATOM 0 HE21 GLN A 988 9.447 -7.812 2.951 1.00 0.00 H new ATOM 0 HE22 GLN A 988 10.702 -6.606 3.251 1.00 0.00 H new ATOM 1081 N LYS A 989 9.011 -4.478 -0.146 1.00 0.00 N ATOM 1082 CA LYS A 989 10.120 -3.532 -0.105 1.00 0.00 C ATOM 1083 C LYS A 989 9.827 -2.353 -1.019 1.00 0.00 C ATOM 1084 O LYS A 989 10.351 -1.253 -0.837 1.00 0.00 O ATOM 1085 CB LYS A 989 11.430 -4.213 -0.504 1.00 0.00 C ATOM 1086 CG LYS A 989 11.925 -5.215 0.529 1.00 0.00 C ATOM 1087 CD LYS A 989 13.303 -5.766 0.184 1.00 0.00 C ATOM 1088 CE LYS A 989 13.241 -6.928 -0.799 1.00 0.00 C ATOM 1089 NZ LYS A 989 12.744 -6.526 -2.142 1.00 0.00 N ATOM 0 H LYS A 989 9.206 -5.338 -0.658 1.00 0.00 H new ATOM 0 HA LYS A 989 10.231 -3.167 0.916 1.00 0.00 H new ATOM 0 HB2 LYS A 989 11.291 -4.723 -1.457 1.00 0.00 H new ATOM 0 HB3 LYS A 989 12.195 -3.452 -0.658 1.00 0.00 H new ATOM 0 HG2 LYS A 989 11.962 -4.737 1.508 1.00 0.00 H new ATOM 0 HG3 LYS A 989 11.215 -6.038 0.603 1.00 0.00 H new ATOM 0 HD2 LYS A 989 13.913 -4.969 -0.240 1.00 0.00 H new ATOM 0 HD3 LYS A 989 13.798 -6.094 1.098 1.00 0.00 H new ATOM 0 HE2 LYS A 989 14.235 -7.364 -0.901 1.00 0.00 H new ATOM 0 HE3 LYS A 989 12.592 -7.705 -0.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 989 13.144 -7.159 -2.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 989 11.706 -6.590 -2.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 989 13.034 -5.547 -2.341 1.00 0.00 H new ATOM 1103 N LEU A 990 8.971 -2.602 -1.993 1.00 0.00 N ATOM 1104 CA LEU A 990 8.508 -1.578 -2.904 1.00 0.00 C ATOM 1105 C LEU A 990 7.673 -0.544 -2.139 1.00 0.00 C ATOM 1106 O LEU A 990 7.945 0.656 -2.195 1.00 0.00 O ATOM 1107 CB LEU A 990 7.710 -2.272 -4.014 1.00 0.00 C ATOM 1108 CG LEU A 990 6.834 -1.393 -4.884 1.00 0.00 C ATOM 1109 CD1 LEU A 990 7.669 -0.320 -5.564 1.00 0.00 C ATOM 1110 CD2 LEU A 990 6.106 -2.237 -5.916 1.00 0.00 C ATOM 0 H LEU A 990 8.577 -3.525 -2.173 1.00 0.00 H new ATOM 0 HA LEU A 990 9.339 -1.036 -3.355 1.00 0.00 H new ATOM 0 HB2 LEU A 990 8.414 -2.795 -4.661 1.00 0.00 H new ATOM 0 HB3 LEU A 990 7.077 -3.030 -3.553 1.00 0.00 H new ATOM 0 HG LEU A 990 6.094 -0.902 -4.253 1.00 0.00 H new ATOM 0 HD11 LEU A 990 7.025 0.303 -6.185 1.00 0.00 H new ATOM 0 HD12 LEU A 990 8.152 0.299 -4.808 1.00 0.00 H new ATOM 0 HD13 LEU A 990 8.429 -0.791 -6.187 1.00 0.00 H new ATOM 0 HD21 LEU A 990 5.480 -1.595 -6.535 1.00 0.00 H new ATOM 0 HD22 LEU A 990 6.833 -2.750 -6.545 1.00 0.00 H new ATOM 0 HD23 LEU A 990 5.482 -2.973 -5.409 1.00 0.00 H new ATOM 1122 N LEU A 991 6.693 -1.037 -1.393 1.00 0.00 N ATOM 1123 CA LEU A 991 5.859 -0.216 -0.518 1.00 0.00 C ATOM 1124 C LEU A 991 6.719 0.614 0.416 1.00 0.00 C ATOM 1125 O LEU A 991 6.544 1.823 0.530 1.00 0.00 O ATOM 1126 CB LEU A 991 4.968 -1.111 0.334 1.00 0.00 C ATOM 1127 CG LEU A 991 4.150 -2.136 -0.430 1.00 0.00 C ATOM 1128 CD1 LEU A 991 3.812 -3.305 0.474 1.00 0.00 C ATOM 1129 CD2 LEU A 991 2.880 -1.507 -0.968 1.00 0.00 C ATOM 0 H LEU A 991 6.450 -2.028 -1.377 1.00 0.00 H new ATOM 0 HA LEU A 991 5.256 0.440 -1.146 1.00 0.00 H new ATOM 0 HB2 LEU A 991 5.594 -1.636 1.056 1.00 0.00 H new ATOM 0 HB3 LEU A 991 4.286 -0.479 0.903 1.00 0.00 H new ATOM 0 HG LEU A 991 4.740 -2.497 -1.272 1.00 0.00 H new ATOM 0 HD11 LEU A 991 3.225 -4.036 -0.081 1.00 0.00 H new ATOM 0 HD12 LEU A 991 4.732 -3.771 0.826 1.00 0.00 H new ATOM 0 HD13 LEU A 991 3.235 -2.950 1.328 1.00 0.00 H new ATOM 0 HD21 LEU A 991 2.306 -2.256 -1.513 1.00 0.00 H new ATOM 0 HD22 LEU A 991 2.284 -1.125 -0.139 1.00 0.00 H new ATOM 0 HD23 LEU A 991 3.136 -0.687 -1.639 1.00 0.00 H new ATOM 1141 N ASN A 992 7.629 -0.074 1.101 1.00 0.00 N ATOM 1142 CA ASN A 992 8.573 0.555 2.023 1.00 0.00 C ATOM 1143 C ASN A 992 9.231 1.763 1.366 1.00 0.00 C ATOM 1144 O ASN A 992 9.353 2.834 1.972 1.00 0.00 O ATOM 1145 CB ASN A 992 9.632 -0.483 2.425 1.00 0.00 C ATOM 1146 CG ASN A 992 10.598 -0.010 3.500 1.00 0.00 C ATOM 1147 OD1 ASN A 992 10.934 1.172 3.601 1.00 0.00 O ATOM 1148 ND2 ASN A 992 11.070 -0.948 4.306 1.00 0.00 N ATOM 0 H ASN A 992 7.733 -1.086 1.033 1.00 0.00 H new ATOM 0 HA ASN A 992 8.046 0.903 2.911 1.00 0.00 H new ATOM 0 HB2 ASN A 992 9.127 -1.382 2.778 1.00 0.00 H new ATOM 0 HB3 ASN A 992 10.202 -0.764 1.540 1.00 0.00 H new ATOM 0 HD21 ASN A 992 11.734 -0.703 5.040 1.00 0.00 H new ATOM 0 HD22 ASN A 992 10.769 -1.916 4.193 1.00 0.00 H new ATOM 1155 N SER A 993 9.608 1.583 0.111 1.00 0.00 N ATOM 1156 CA SER A 993 10.287 2.615 -0.647 1.00 0.00 C ATOM 1157 C SER A 993 9.395 3.834 -0.876 1.00 0.00 C ATOM 1158 O SER A 993 9.793 4.957 -0.570 1.00 0.00 O ATOM 1159 CB SER A 993 10.759 2.046 -1.986 1.00 0.00 C ATOM 1160 OG SER A 993 11.636 0.945 -1.793 1.00 0.00 O ATOM 0 H SER A 993 9.451 0.719 -0.408 1.00 0.00 H new ATOM 0 HA SER A 993 11.148 2.946 -0.066 1.00 0.00 H new ATOM 0 HB2 SER A 993 9.898 1.730 -2.574 1.00 0.00 H new ATOM 0 HB3 SER A 993 11.267 2.824 -2.557 1.00 0.00 H new ATOM 0 HG SER A 993 11.114 0.146 -1.571 1.00 0.00 H new ATOM 1166 N ASP A 994 8.179 3.619 -1.365 1.00 0.00 N ATOM 1167 CA ASP A 994 7.360 4.739 -1.828 1.00 0.00 C ATOM 1168 C ASP A 994 6.395 5.265 -0.773 1.00 0.00 C ATOM 1169 O ASP A 994 5.993 6.423 -0.847 1.00 0.00 O ATOM 1170 CB ASP A 994 6.635 4.410 -3.124 1.00 0.00 C ATOM 1171 CG ASP A 994 7.498 4.712 -4.333 1.00 0.00 C ATOM 1172 OD1 ASP A 994 8.294 3.839 -4.747 1.00 0.00 O ATOM 1173 OD2 ASP A 994 7.405 5.836 -4.873 1.00 0.00 O ATOM 0 H ASP A 994 7.743 2.701 -1.451 1.00 0.00 H new ATOM 0 HA ASP A 994 8.061 5.550 -2.028 1.00 0.00 H new ATOM 0 HB2 ASP A 994 6.355 3.356 -3.129 1.00 0.00 H new ATOM 0 HB3 ASP A 994 5.711 4.985 -3.182 1.00 0.00 H new ATOM 1178 N LEU A 995 5.992 4.446 0.193 1.00 0.00 N ATOM 1179 CA LEU A 995 5.331 4.990 1.379 1.00 0.00 C ATOM 1180 C LEU A 995 6.205 6.095 1.983 1.00 0.00 C ATOM 1181 O LEU A 995 5.739 7.220 2.163 1.00 0.00 O ATOM 1182 CB LEU A 995 5.007 3.883 2.413 1.00 0.00 C ATOM 1183 CG LEU A 995 4.309 4.326 3.715 1.00 0.00 C ATOM 1184 CD1 LEU A 995 5.300 4.887 4.727 1.00 0.00 C ATOM 1185 CD2 LEU A 995 3.218 5.345 3.419 1.00 0.00 C ATOM 0 H LEU A 995 6.105 3.432 0.184 1.00 0.00 H new ATOM 0 HA LEU A 995 4.374 5.420 1.084 1.00 0.00 H new ATOM 0 HB2 LEU A 995 4.376 3.139 1.927 1.00 0.00 H new ATOM 0 HB3 LEU A 995 5.939 3.385 2.680 1.00 0.00 H new ATOM 0 HG LEU A 995 3.853 3.440 4.157 1.00 0.00 H new ATOM 0 HD11 LEU A 995 4.768 5.187 5.630 1.00 0.00 H new ATOM 0 HD12 LEU A 995 6.036 4.123 4.977 1.00 0.00 H new ATOM 0 HD13 LEU A 995 5.806 5.753 4.299 1.00 0.00 H new ATOM 0 HD21 LEU A 995 2.738 5.645 4.350 1.00 0.00 H new ATOM 0 HD22 LEU A 995 3.657 6.220 2.939 1.00 0.00 H new ATOM 0 HD23 LEU A 995 2.476 4.901 2.755 1.00 0.00 H new ATOM 1197 N ALA A 996 7.467 5.778 2.298 1.00 0.00 N ATOM 1198 CA ALA A 996 8.413 6.802 2.758 1.00 0.00 C ATOM 1199 C ALA A 996 8.477 7.973 1.801 1.00 0.00 C ATOM 1200 O ALA A 996 8.519 9.124 2.228 1.00 0.00 O ATOM 1201 CB ALA A 996 9.809 6.233 2.939 1.00 0.00 C ATOM 0 H ALA A 996 7.853 4.835 2.244 1.00 0.00 H new ATOM 0 HA ALA A 996 8.043 7.150 3.722 1.00 0.00 H new ATOM 0 HB1 ALA A 996 10.481 7.020 3.280 1.00 0.00 H new ATOM 0 HB2 ALA A 996 9.783 5.433 3.678 1.00 0.00 H new ATOM 0 HB3 ALA A 996 10.167 5.837 1.988 1.00 0.00 H new ATOM 1207 N GLU A 997 8.471 7.666 0.516 1.00 0.00 N ATOM 1208 CA GLU A 997 8.497 8.706 -0.496 1.00 0.00 C ATOM 1209 C GLU A 997 7.316 9.623 -0.315 1.00 0.00 C ATOM 1210 O GLU A 997 7.486 10.822 -0.235 1.00 0.00 O ATOM 1211 CB GLU A 997 8.462 8.141 -1.903 1.00 0.00 C ATOM 1212 CG GLU A 997 9.703 7.364 -2.260 1.00 0.00 C ATOM 1213 CD GLU A 997 10.737 8.197 -2.984 1.00 0.00 C ATOM 1214 OE1 GLU A 997 11.328 9.102 -2.362 1.00 0.00 O ATOM 1215 OE2 GLU A 997 10.969 7.941 -4.186 1.00 0.00 O ATOM 0 H GLU A 997 8.449 6.714 0.151 1.00 0.00 H new ATOM 0 HA GLU A 997 9.433 9.251 -0.371 1.00 0.00 H new ATOM 0 HB2 GLU A 997 7.592 7.492 -2.006 1.00 0.00 H new ATOM 0 HB3 GLU A 997 8.336 8.958 -2.613 1.00 0.00 H new ATOM 0 HG2 GLU A 997 10.145 6.958 -1.350 1.00 0.00 H new ATOM 0 HG3 GLU A 997 9.426 6.516 -2.886 1.00 0.00 H new ATOM 1222 N LEU A 998 6.133 9.038 -0.170 1.00 0.00 N ATOM 1223 CA LEU A 998 4.896 9.808 -0.150 1.00 0.00 C ATOM 1224 C LEU A 998 4.778 10.578 1.151 1.00 0.00 C ATOM 1225 O LEU A 998 4.254 11.691 1.183 1.00 0.00 O ATOM 1226 CB LEU A 998 3.679 8.901 -0.353 1.00 0.00 C ATOM 1227 CG LEU A 998 2.333 9.625 -0.331 1.00 0.00 C ATOM 1228 CD1 LEU A 998 2.333 10.785 -1.314 1.00 0.00 C ATOM 1229 CD2 LEU A 998 1.205 8.660 -0.648 1.00 0.00 C ATOM 0 H LEU A 998 6.005 8.032 -0.064 1.00 0.00 H new ATOM 0 HA LEU A 998 4.923 10.519 -0.976 1.00 0.00 H new ATOM 0 HB2 LEU A 998 3.783 8.384 -1.307 1.00 0.00 H new ATOM 0 HB3 LEU A 998 3.678 8.137 0.425 1.00 0.00 H new ATOM 0 HG LEU A 998 2.175 10.024 0.671 1.00 0.00 H new ATOM 0 HD11 LEU A 998 1.366 11.288 -1.284 1.00 0.00 H new ATOM 0 HD12 LEU A 998 3.118 11.491 -1.043 1.00 0.00 H new ATOM 0 HD13 LEU A 998 2.515 10.409 -2.321 1.00 0.00 H new ATOM 0 HD21 LEU A 998 0.254 9.193 -0.628 1.00 0.00 H new ATOM 0 HD22 LEU A 998 1.360 8.232 -1.638 1.00 0.00 H new ATOM 0 HD23 LEU A 998 1.190 7.862 0.094 1.00 0.00 H new ATOM 1241 N ILE A 999 5.301 9.999 2.216 1.00 0.00 N ATOM 1242 CA ILE A 999 5.365 10.696 3.494 1.00 0.00 C ATOM 1243 C ILE A 999 6.268 11.907 3.322 1.00 0.00 C ATOM 1244 O ILE A 999 5.898 13.046 3.566 1.00 0.00 O ATOM 1245 CB ILE A 999 5.930 9.784 4.612 1.00 0.00 C ATOM 1246 CG1 ILE A 999 4.977 8.615 4.893 1.00 0.00 C ATOM 1247 CG2 ILE A 999 6.200 10.576 5.886 1.00 0.00 C ATOM 1248 CD1 ILE A 999 3.608 9.038 5.383 1.00 0.00 C ATOM 0 H ILE A 999 5.686 9.055 2.226 1.00 0.00 H new ATOM 0 HA ILE A 999 4.359 10.993 3.790 1.00 0.00 H new ATOM 0 HB ILE A 999 6.879 9.378 4.263 1.00 0.00 H new ATOM 0 HG12 ILE A 999 4.860 8.029 3.982 1.00 0.00 H new ATOM 0 HG13 ILE A 999 5.431 7.961 5.637 1.00 0.00 H new ATOM 0 HG21 ILE A 999 6.596 9.909 6.652 1.00 0.00 H new ATOM 0 HG22 ILE A 999 6.926 11.362 5.679 1.00 0.00 H new ATOM 0 HG23 ILE A 999 5.271 11.024 6.240 1.00 0.00 H new ATOM 0 HD11 ILE A 999 2.995 8.154 5.558 1.00 0.00 H new ATOM 0 HD12 ILE A 999 3.711 9.598 6.312 1.00 0.00 H new ATOM 0 HD13 ILE A 999 3.131 9.667 4.631 1.00 0.00 H new ATOM 1260 N ASN A1000 7.462 11.616 2.888 1.00 0.00 N ATOM 1261 CA ASN A1000 8.432 12.614 2.493 1.00 0.00 C ATOM 1262 C ASN A1000 7.914 13.523 1.363 1.00 0.00 C ATOM 1263 O ASN A1000 8.510 14.550 1.108 1.00 0.00 O ATOM 1264 CB ASN A1000 9.698 11.850 2.107 1.00 0.00 C ATOM 1265 CG ASN A1000 10.869 12.682 1.658 1.00 0.00 C ATOM 1266 OD1 ASN A1000 11.032 13.843 2.034 1.00 0.00 O ATOM 1267 ND2 ASN A1000 11.711 12.051 0.864 1.00 0.00 N ATOM 0 H ASN A1000 7.801 10.659 2.795 1.00 0.00 H new ATOM 0 HA ASN A1000 8.637 13.303 3.313 1.00 0.00 H new ATOM 0 HB2 ASN A1000 10.011 11.253 2.963 1.00 0.00 H new ATOM 0 HB3 ASN A1000 9.447 11.154 1.307 1.00 0.00 H new ATOM 0 HD21 ASN A1000 12.549 12.526 0.529 1.00 0.00 H new ATOM 0 HD22 ASN A1000 11.524 11.088 0.585 1.00 0.00 H new ATOM 1274 N LYS A1001 6.812 13.165 0.688 1.00 0.00 N ATOM 1275 CA LYS A1001 6.187 14.069 -0.292 1.00 0.00 C ATOM 1276 C LYS A1001 5.192 15.008 0.384 1.00 0.00 C ATOM 1277 O LYS A1001 5.105 16.184 0.030 1.00 0.00 O ATOM 1278 CB LYS A1001 5.474 13.317 -1.417 1.00 0.00 C ATOM 1279 CG LYS A1001 6.363 12.396 -2.228 1.00 0.00 C ATOM 1280 CD LYS A1001 7.567 13.100 -2.831 1.00 0.00 C ATOM 1281 CE LYS A1001 8.535 12.079 -3.411 1.00 0.00 C ATOM 1282 NZ LYS A1001 9.684 12.710 -4.110 1.00 0.00 N ATOM 0 H LYS A1001 6.339 12.268 0.799 1.00 0.00 H new ATOM 0 HA LYS A1001 7.002 14.645 -0.730 1.00 0.00 H new ATOM 0 HB2 LYS A1001 4.663 12.730 -0.986 1.00 0.00 H new ATOM 0 HB3 LYS A1001 5.018 14.044 -2.089 1.00 0.00 H new ATOM 0 HG2 LYS A1001 6.708 11.582 -1.591 1.00 0.00 H new ATOM 0 HG3 LYS A1001 5.775 11.947 -3.028 1.00 0.00 H new ATOM 0 HD2 LYS A1001 7.242 13.788 -3.611 1.00 0.00 H new ATOM 0 HD3 LYS A1001 8.069 13.696 -2.069 1.00 0.00 H new ATOM 0 HE2 LYS A1001 8.908 11.442 -2.609 1.00 0.00 H new ATOM 0 HE3 LYS A1001 8.001 11.433 -4.108 1.00 0.00 H new ATOM 0 HZ1 LYS A1001 10.311 11.970 -4.485 1.00 0.00 H new ATOM 0 HZ2 LYS A1001 9.334 13.297 -4.894 1.00 0.00 H new ATOM 0 HZ3 LYS A1001 10.213 13.305 -3.441 1.00 0.00 H new ATOM 1296 N MET A1002 4.420 14.474 1.340 1.00 0.00 N ATOM 1297 CA MET A1002 3.517 15.287 2.138 1.00 0.00 C ATOM 1298 C MET A1002 4.373 16.265 2.882 1.00 0.00 C ATOM 1299 O MET A1002 4.012 17.419 3.090 1.00 0.00 O ATOM 1300 CB MET A1002 2.708 14.426 3.129 1.00 0.00 C ATOM 1301 CG MET A1002 3.433 14.101 4.435 1.00 0.00 C ATOM 1302 SD MET A1002 2.678 12.760 5.371 1.00 0.00 S ATOM 1303 CE MET A1002 3.711 12.735 6.833 1.00 0.00 C ATOM 0 H MET A1002 4.409 13.481 1.573 1.00 0.00 H new ATOM 0 HA MET A1002 2.793 15.791 1.498 1.00 0.00 H new ATOM 0 HB2 MET A1002 1.779 14.945 3.365 1.00 0.00 H new ATOM 0 HB3 MET A1002 2.436 13.491 2.639 1.00 0.00 H new ATOM 0 HG2 MET A1002 4.467 13.838 4.210 1.00 0.00 H new ATOM 0 HG3 MET A1002 3.460 14.996 5.057 1.00 0.00 H new ATOM 0 HE1 MET A1002 3.885 11.703 7.138 1.00 0.00 H new ATOM 0 HE2 MET A1002 4.665 13.214 6.613 1.00 0.00 H new ATOM 0 HE3 MET A1002 3.213 13.272 7.640 1.00 0.00 H new ATOM 1313 N LYS A1003 5.544 15.781 3.243 1.00 0.00 N ATOM 1314 CA LYS A1003 6.542 16.609 3.818 1.00 0.00 C ATOM 1315 C LYS A1003 7.083 17.523 2.747 1.00 0.00 C ATOM 1316 O LYS A1003 6.929 18.703 2.854 1.00 0.00 O ATOM 1317 CB LYS A1003 7.663 15.756 4.406 1.00 0.00 C ATOM 1318 CG LYS A1003 8.842 16.573 4.885 1.00 0.00 C ATOM 1319 CD LYS A1003 9.994 15.693 5.348 1.00 0.00 C ATOM 1320 CE LYS A1003 9.602 14.815 6.525 1.00 0.00 C ATOM 1321 NZ LYS A1003 10.735 13.969 6.978 1.00 0.00 N ATOM 0 H LYS A1003 5.814 14.803 3.140 1.00 0.00 H new ATOM 0 HA LYS A1003 6.112 17.202 4.625 1.00 0.00 H new ATOM 0 HB2 LYS A1003 7.269 15.174 5.239 1.00 0.00 H new ATOM 0 HB3 LYS A1003 8.003 15.045 3.653 1.00 0.00 H new ATOM 0 HG2 LYS A1003 9.183 17.224 4.080 1.00 0.00 H new ATOM 0 HG3 LYS A1003 8.527 17.219 5.705 1.00 0.00 H new ATOM 0 HD2 LYS A1003 10.325 15.065 4.521 1.00 0.00 H new ATOM 0 HD3 LYS A1003 10.839 16.321 5.630 1.00 0.00 H new ATOM 0 HE2 LYS A1003 9.263 15.442 7.350 1.00 0.00 H new ATOM 0 HE3 LYS A1003 8.763 14.179 6.242 1.00 0.00 H new ATOM 0 HZ1 LYS A1003 10.431 13.383 7.782 1.00 0.00 H new ATOM 0 HZ2 LYS A1003 11.042 13.354 6.198 1.00 0.00 H new ATOM 0 HZ3 LYS A1003 11.526 14.577 7.272 1.00 0.00 H new ATOM 1335 N LEU A1004 7.607 16.942 1.673 1.00 0.00 N ATOM 1336 CA LEU A1004 8.292 17.694 0.614 1.00 0.00 C ATOM 1337 C LEU A1004 7.479 18.896 0.167 1.00 0.00 C ATOM 1338 O LEU A1004 7.946 20.025 0.243 1.00 0.00 O ATOM 1339 CB LEU A1004 8.535 16.804 -0.608 1.00 0.00 C ATOM 1340 CG LEU A1004 9.700 17.207 -1.529 1.00 0.00 C ATOM 1341 CD1 LEU A1004 9.859 16.186 -2.639 1.00 0.00 C ATOM 1342 CD2 LEU A1004 9.499 18.595 -2.130 1.00 0.00 C ATOM 0 H LEU A1004 7.572 15.936 1.507 1.00 0.00 H new ATOM 0 HA LEU A1004 9.240 18.033 1.031 1.00 0.00 H new ATOM 0 HB2 LEU A1004 8.712 15.786 -0.259 1.00 0.00 H new ATOM 0 HB3 LEU A1004 7.621 16.783 -1.202 1.00 0.00 H new ATOM 0 HG LEU A1004 10.604 17.236 -0.921 1.00 0.00 H new ATOM 0 HD11 LEU A1004 10.686 16.478 -3.287 1.00 0.00 H new ATOM 0 HD12 LEU A1004 10.066 15.207 -2.206 1.00 0.00 H new ATOM 0 HD13 LEU A1004 8.940 16.138 -3.223 1.00 0.00 H new ATOM 0 HD21 LEU A1004 10.345 18.839 -2.773 1.00 0.00 H new ATOM 0 HD22 LEU A1004 8.581 18.608 -2.717 1.00 0.00 H new ATOM 0 HD23 LEU A1004 9.428 19.331 -1.329 1.00 0.00 H new ATOM 1354 N ALA A1005 6.264 18.644 -0.284 1.00 0.00 N ATOM 1355 CA ALA A1005 5.434 19.698 -0.828 1.00 0.00 C ATOM 1356 C ALA A1005 5.183 20.773 0.217 1.00 0.00 C ATOM 1357 O ALA A1005 5.370 21.964 -0.038 1.00 0.00 O ATOM 1358 CB ALA A1005 4.119 19.120 -1.330 1.00 0.00 C ATOM 0 H ALA A1005 5.832 17.720 -0.284 1.00 0.00 H new ATOM 0 HA ALA A1005 5.956 20.157 -1.668 1.00 0.00 H new ATOM 0 HB1 ALA A1005 3.502 19.921 -1.737 1.00 0.00 H new ATOM 0 HB2 ALA A1005 4.319 18.384 -2.109 1.00 0.00 H new ATOM 0 HB3 ALA A1005 3.593 18.641 -0.504 1.00 0.00 H new ATOM 1364 N GLN A1006 4.795 20.332 1.403 1.00 0.00 N ATOM 1365 CA GLN A1006 4.441 21.231 2.489 1.00 0.00 C ATOM 1366 C GLN A1006 5.688 21.781 3.176 1.00 0.00 C ATOM 1367 O GLN A1006 5.630 22.743 3.938 1.00 0.00 O ATOM 1368 CB GLN A1006 3.533 20.481 3.460 1.00 0.00 C ATOM 1369 CG GLN A1006 2.377 19.832 2.754 1.00 0.00 C ATOM 1370 CD GLN A1006 1.645 20.801 1.840 1.00 0.00 C ATOM 1371 OE1 GLN A1006 0.771 21.534 2.271 1.00 0.00 O ATOM 1372 NE2 GLN A1006 1.975 20.785 0.562 1.00 0.00 N ATOM 0 H GLN A1006 4.717 19.343 1.639 1.00 0.00 H new ATOM 0 HA GLN A1006 3.904 22.095 2.098 1.00 0.00 H new ATOM 0 HB2 GLN A1006 4.111 19.721 3.985 1.00 0.00 H new ATOM 0 HB3 GLN A1006 3.157 21.173 4.214 1.00 0.00 H new ATOM 0 HG2 GLN A1006 2.739 18.987 2.169 1.00 0.00 H new ATOM 0 HG3 GLN A1006 1.680 19.434 3.492 1.00 0.00 H new ATOM 0 HE21 GLN A1006 2.711 20.160 0.233 1.00 0.00 H new ATOM 0 HE22 GLN A1006 1.494 21.398 -0.097 1.00 0.00 H new ATOM 1381 N GLN A1007 6.808 21.139 2.909 1.00 0.00 N ATOM 1382 CA GLN A1007 8.092 21.557 3.442 1.00 0.00 C ATOM 1383 C GLN A1007 8.751 22.591 2.551 1.00 0.00 C ATOM 1384 O GLN A1007 9.388 23.532 3.024 1.00 0.00 O ATOM 1385 CB GLN A1007 9.006 20.331 3.568 1.00 0.00 C ATOM 1386 CG GLN A1007 9.986 20.380 4.721 1.00 0.00 C ATOM 1387 CD GLN A1007 9.281 20.538 6.051 1.00 0.00 C ATOM 1388 OE1 GLN A1007 9.824 21.108 6.994 1.00 0.00 O ATOM 1389 NE2 GLN A1007 8.051 20.047 6.128 1.00 0.00 N ATOM 0 H GLN A1007 6.855 20.311 2.315 1.00 0.00 H new ATOM 0 HA GLN A1007 7.928 22.010 4.420 1.00 0.00 H new ATOM 0 HB2 GLN A1007 8.384 19.442 3.677 1.00 0.00 H new ATOM 0 HB3 GLN A1007 9.566 20.217 2.640 1.00 0.00 H new ATOM 0 HG2 GLN A1007 10.581 19.467 4.731 1.00 0.00 H new ATOM 0 HG3 GLN A1007 10.678 21.210 4.575 1.00 0.00 H new ATOM 0 HE21 GLN A1007 7.637 19.581 5.321 1.00 0.00 H new ATOM 0 HE22 GLN A1007 7.520 20.136 6.994 1.00 0.00 H new ATOM 1398 N TYR A1008 8.591 22.397 1.262 1.00 0.00 N ATOM 1399 CA TYR A1008 9.214 23.242 0.269 1.00 0.00 C ATOM 1400 C TYR A1008 8.367 24.492 0.047 1.00 0.00 C ATOM 1401 O TYR A1008 8.793 25.418 -0.644 1.00 0.00 O ATOM 1402 CB TYR A1008 9.370 22.426 -1.018 1.00 0.00 C ATOM 1403 CG TYR A1008 10.185 23.072 -2.110 1.00 0.00 C ATOM 1404 CD1 TYR A1008 11.443 23.598 -1.858 1.00 0.00 C ATOM 1405 CD2 TYR A1008 9.692 23.132 -3.401 1.00 0.00 C ATOM 1406 CE1 TYR A1008 12.189 24.172 -2.870 1.00 0.00 C ATOM 1407 CE2 TYR A1008 10.428 23.700 -4.423 1.00 0.00 C ATOM 1408 CZ TYR A1008 11.676 24.222 -4.154 1.00 0.00 C ATOM 1409 OH TYR A1008 12.419 24.791 -5.167 1.00 0.00 O ATOM 0 H TYR A1008 8.023 21.646 0.871 1.00 0.00 H new ATOM 0 HA TYR A1008 10.198 23.574 0.601 1.00 0.00 H new ATOM 0 HB2 TYR A1008 9.828 21.470 -0.766 1.00 0.00 H new ATOM 0 HB3 TYR A1008 8.377 22.210 -1.411 1.00 0.00 H new ATOM 0 HD1 TYR A1008 11.846 23.559 -0.857 1.00 0.00 H new ATOM 0 HD2 TYR A1008 8.714 22.727 -3.614 1.00 0.00 H new ATOM 0 HE1 TYR A1008 13.167 24.579 -2.660 1.00 0.00 H new ATOM 0 HE2 TYR A1008 10.029 23.735 -5.426 1.00 0.00 H new ATOM 0 HH TYR A1008 11.916 24.745 -6.007 1.00 0.00 H new ATOM 1496 N GLN A1014 3.475 26.282 -4.529 1.00 0.00 N ATOM 1497 CA GLN A1014 3.320 25.070 -3.729 1.00 0.00 C ATOM 1498 C GLN A1014 2.724 23.949 -4.584 1.00 0.00 C ATOM 1499 O GLN A1014 3.219 22.828 -4.576 1.00 0.00 O ATOM 1500 CB GLN A1014 2.416 25.369 -2.520 1.00 0.00 C ATOM 1501 CG GLN A1014 2.506 24.364 -1.380 1.00 0.00 C ATOM 1502 CD GLN A1014 1.829 23.056 -1.711 1.00 0.00 C ATOM 1503 OE1 GLN A1014 0.639 22.875 -1.471 1.00 0.00 O ATOM 1504 NE2 GLN A1014 2.586 22.130 -2.256 1.00 0.00 N ATOM 0 HA GLN A1014 4.296 24.743 -3.370 1.00 0.00 H new ATOM 0 HB2 GLN A1014 2.668 26.357 -2.133 1.00 0.00 H new ATOM 0 HB3 GLN A1014 1.382 25.415 -2.862 1.00 0.00 H new ATOM 0 HG2 GLN A1014 3.554 24.178 -1.145 1.00 0.00 H new ATOM 0 HG3 GLN A1014 2.050 24.790 -0.487 1.00 0.00 H new ATOM 0 HE21 GLN A1014 3.571 22.320 -2.440 1.00 0.00 H new ATOM 0 HE22 GLN A1014 2.188 21.222 -2.495 1.00 0.00 H new ATOM 1513 N GLN A1015 1.720 24.289 -5.376 1.00 0.00 N ATOM 1514 CA GLN A1015 1.003 23.321 -6.208 1.00 0.00 C ATOM 1515 C GLN A1015 1.969 22.478 -7.054 1.00 0.00 C ATOM 1516 O GLN A1015 1.727 21.295 -7.301 1.00 0.00 O ATOM 1517 CB GLN A1015 0.067 24.104 -7.113 1.00 0.00 C ATOM 1518 CG GLN A1015 -0.786 23.271 -8.056 1.00 0.00 C ATOM 1519 CD GLN A1015 -1.870 22.502 -7.333 1.00 0.00 C ATOM 1520 OE1 GLN A1015 -1.690 21.339 -6.978 1.00 0.00 O ATOM 1521 NE2 GLN A1015 -2.991 23.160 -7.084 1.00 0.00 N ATOM 0 H GLN A1015 1.374 25.245 -5.464 1.00 0.00 H new ATOM 0 HA GLN A1015 0.450 22.630 -5.572 1.00 0.00 H new ATOM 0 HB2 GLN A1015 -0.594 24.705 -6.489 1.00 0.00 H new ATOM 0 HB3 GLN A1015 0.662 24.798 -7.707 1.00 0.00 H new ATOM 0 HG2 GLN A1015 -1.243 23.924 -8.799 1.00 0.00 H new ATOM 0 HG3 GLN A1015 -0.148 22.572 -8.596 1.00 0.00 H new ATOM 0 HE21 GLN A1015 -3.097 24.125 -7.398 1.00 0.00 H new ATOM 0 HE22 GLN A1015 -3.749 22.702 -6.578 1.00 0.00 H new ATOM 1530 N GLU A1016 3.049 23.101 -7.501 1.00 0.00 N ATOM 1531 CA GLU A1016 4.146 22.399 -8.163 1.00 0.00 C ATOM 1532 C GLU A1016 4.713 21.287 -7.280 1.00 0.00 C ATOM 1533 O GLU A1016 4.757 20.121 -7.669 1.00 0.00 O ATOM 1534 CB GLU A1016 5.254 23.397 -8.456 1.00 0.00 C ATOM 1535 CG GLU A1016 6.483 22.783 -9.078 1.00 0.00 C ATOM 1536 CD GLU A1016 6.448 22.849 -10.588 1.00 0.00 C ATOM 1537 OE1 GLU A1016 6.700 23.939 -11.143 1.00 0.00 O ATOM 1538 OE2 GLU A1016 6.143 21.827 -11.230 1.00 0.00 O ATOM 0 H GLU A1016 3.193 24.107 -7.417 1.00 0.00 H new ATOM 0 HA GLU A1016 3.764 21.950 -9.080 1.00 0.00 H new ATOM 0 HB2 GLU A1016 4.868 24.168 -9.123 1.00 0.00 H new ATOM 0 HB3 GLU A1016 5.538 23.892 -7.527 1.00 0.00 H new ATOM 0 HG2 GLU A1016 7.371 23.300 -8.713 1.00 0.00 H new ATOM 0 HG3 GLU A1016 6.568 21.743 -8.763 1.00 0.00 H new ATOM 1545 N TYR A1017 5.195 21.690 -6.113 1.00 0.00 N ATOM 1546 CA TYR A1017 5.727 20.758 -5.119 1.00 0.00 C ATOM 1547 C TYR A1017 4.712 19.640 -4.904 1.00 0.00 C ATOM 1548 O TYR A1017 5.063 18.471 -4.745 1.00 0.00 O ATOM 1549 CB TYR A1017 6.029 21.444 -3.760 1.00 0.00 C ATOM 1550 CG TYR A1017 6.473 22.893 -3.818 1.00 0.00 C ATOM 1551 CD1 TYR A1017 6.923 23.477 -4.998 1.00 0.00 C ATOM 1552 CD2 TYR A1017 6.426 23.688 -2.673 1.00 0.00 C ATOM 1553 CE1 TYR A1017 7.303 24.798 -5.047 1.00 0.00 C ATOM 1554 CE2 TYR A1017 6.810 25.012 -2.721 1.00 0.00 C ATOM 1555 CZ TYR A1017 7.244 25.562 -3.907 1.00 0.00 C ATOM 1556 OH TYR A1017 7.623 26.881 -3.951 1.00 0.00 O ATOM 0 H TYR A1017 5.230 22.668 -5.826 1.00 0.00 H new ATOM 0 HA TYR A1017 6.670 20.367 -5.500 1.00 0.00 H new ATOM 0 HB2 TYR A1017 5.133 21.386 -3.142 1.00 0.00 H new ATOM 0 HB3 TYR A1017 6.804 20.870 -3.253 1.00 0.00 H new ATOM 0 HD1 TYR A1017 6.975 22.879 -5.896 1.00 0.00 H new ATOM 0 HD2 TYR A1017 6.086 23.263 -1.740 1.00 0.00 H new ATOM 0 HE1 TYR A1017 7.645 25.231 -5.975 1.00 0.00 H new ATOM 0 HE2 TYR A1017 6.770 25.618 -1.828 1.00 0.00 H new ATOM 0 HH TYR A1017 7.521 27.281 -3.062 1.00 0.00 H new ATOM 1566 N LYS A1018 3.445 20.036 -4.892 1.00 0.00 N ATOM 1567 CA LYS A1018 2.321 19.108 -4.758 1.00 0.00 C ATOM 1568 C LYS A1018 2.247 18.081 -5.898 1.00 0.00 C ATOM 1569 O LYS A1018 1.801 16.955 -5.678 1.00 0.00 O ATOM 1570 CB LYS A1018 1.017 19.903 -4.662 1.00 0.00 C ATOM 1571 CG LYS A1018 -0.235 19.049 -4.557 1.00 0.00 C ATOM 1572 CD LYS A1018 -1.469 19.910 -4.357 1.00 0.00 C ATOM 1573 CE LYS A1018 -2.748 19.092 -4.426 1.00 0.00 C ATOM 1574 NZ LYS A1018 -3.947 19.928 -4.160 1.00 0.00 N ATOM 0 H LYS A1018 3.164 21.013 -4.975 1.00 0.00 H new ATOM 0 HA LYS A1018 2.478 18.534 -3.845 1.00 0.00 H new ATOM 0 HB2 LYS A1018 1.069 20.558 -3.792 1.00 0.00 H new ATOM 0 HB3 LYS A1018 0.932 20.544 -5.539 1.00 0.00 H new ATOM 0 HG2 LYS A1018 -0.348 18.451 -5.461 1.00 0.00 H new ATOM 0 HG3 LYS A1018 -0.135 18.352 -3.725 1.00 0.00 H new ATOM 0 HD2 LYS A1018 -1.410 20.410 -3.390 1.00 0.00 H new ATOM 0 HD3 LYS A1018 -1.495 20.690 -5.118 1.00 0.00 H new ATOM 0 HE2 LYS A1018 -2.835 18.634 -5.411 1.00 0.00 H new ATOM 0 HE3 LYS A1018 -2.701 18.280 -3.700 1.00 0.00 H new ATOM 0 HZ1 LYS A1018 -4.770 19.313 -3.997 1.00 0.00 H new ATOM 0 HZ2 LYS A1018 -3.781 20.515 -3.318 1.00 0.00 H new ATOM 0 HZ3 LYS A1018 -4.131 20.542 -4.979 1.00 0.00 H new ATOM 1588 N LYS A1019 2.678 18.455 -7.104 1.00 0.00 N ATOM 1589 CA LYS A1019 2.699 17.509 -8.227 1.00 0.00 C ATOM 1590 C LYS A1019 3.567 16.317 -7.861 1.00 0.00 C ATOM 1591 O LYS A1019 3.182 15.157 -8.037 1.00 0.00 O ATOM 1592 CB LYS A1019 3.283 18.140 -9.494 1.00 0.00 C ATOM 1593 CG LYS A1019 2.634 19.438 -9.942 1.00 0.00 C ATOM 1594 CD LYS A1019 3.411 20.022 -11.110 1.00 0.00 C ATOM 1595 CE LYS A1019 2.900 21.390 -11.522 1.00 0.00 C ATOM 1596 NZ LYS A1019 3.777 21.995 -12.560 1.00 0.00 N ATOM 0 H LYS A1019 3.013 19.392 -7.329 1.00 0.00 H new ATOM 0 HA LYS A1019 1.669 17.211 -8.423 1.00 0.00 H new ATOM 0 HB2 LYS A1019 4.345 18.324 -9.330 1.00 0.00 H new ATOM 0 HB3 LYS A1019 3.206 17.417 -10.306 1.00 0.00 H new ATOM 0 HG2 LYS A1019 1.600 19.257 -10.235 1.00 0.00 H new ATOM 0 HG3 LYS A1019 2.611 20.149 -9.116 1.00 0.00 H new ATOM 0 HD2 LYS A1019 4.464 20.097 -10.840 1.00 0.00 H new ATOM 0 HD3 LYS A1019 3.348 19.343 -11.960 1.00 0.00 H new ATOM 0 HE2 LYS A1019 1.883 21.302 -11.905 1.00 0.00 H new ATOM 0 HE3 LYS A1019 2.857 22.044 -10.651 1.00 0.00 H new ATOM 0 HZ1 LYS A1019 3.556 23.007 -12.655 1.00 0.00 H new ATOM 0 HZ2 LYS A1019 4.773 21.883 -12.281 1.00 0.00 H new ATOM 0 HZ3 LYS A1019 3.617 21.519 -13.471 1.00 0.00 H new ATOM 1610 N GLN A1020 4.759 16.637 -7.363 1.00 0.00 N ATOM 1611 CA GLN A1020 5.719 15.636 -6.908 1.00 0.00 C ATOM 1612 C GLN A1020 5.059 14.676 -5.924 1.00 0.00 C ATOM 1613 O GLN A1020 5.243 13.459 -5.996 1.00 0.00 O ATOM 1614 CB GLN A1020 6.917 16.315 -6.236 1.00 0.00 C ATOM 1615 CG GLN A1020 7.468 17.506 -7.003 1.00 0.00 C ATOM 1616 CD GLN A1020 7.877 17.163 -8.419 1.00 0.00 C ATOM 1617 OE1 GLN A1020 8.287 16.039 -8.711 1.00 0.00 O ATOM 1618 NE2 GLN A1020 7.768 18.139 -9.307 1.00 0.00 N ATOM 0 H GLN A1020 5.086 17.598 -7.264 1.00 0.00 H new ATOM 0 HA GLN A1020 6.066 15.075 -7.776 1.00 0.00 H new ATOM 0 HB2 GLN A1020 6.622 16.644 -5.239 1.00 0.00 H new ATOM 0 HB3 GLN A1020 7.712 15.580 -6.107 1.00 0.00 H new ATOM 0 HG2 GLN A1020 6.715 18.293 -7.029 1.00 0.00 H new ATOM 0 HG3 GLN A1020 8.330 17.907 -6.469 1.00 0.00 H new ATOM 0 HE21 GLN A1020 7.423 19.055 -9.019 1.00 0.00 H new ATOM 0 HE22 GLN A1020 8.029 17.975 -10.279 1.00 0.00 H new ATOM 1627 N MET A1021 4.273 15.245 -5.019 1.00 0.00 N ATOM 1628 CA MET A1021 3.558 14.473 -4.014 1.00 0.00 C ATOM 1629 C MET A1021 2.518 13.566 -4.666 1.00 0.00 C ATOM 1630 O MET A1021 2.461 12.373 -4.380 1.00 0.00 O ATOM 1631 CB MET A1021 2.896 15.431 -3.008 1.00 0.00 C ATOM 1632 CG MET A1021 2.110 14.752 -1.890 1.00 0.00 C ATOM 1633 SD MET A1021 0.472 14.195 -2.406 1.00 0.00 S ATOM 1634 CE MET A1021 -0.264 15.733 -2.955 1.00 0.00 C ATOM 0 H MET A1021 4.114 16.251 -4.962 1.00 0.00 H new ATOM 0 HA MET A1021 4.266 13.835 -3.484 1.00 0.00 H new ATOM 0 HB2 MET A1021 3.670 16.055 -2.560 1.00 0.00 H new ATOM 0 HB3 MET A1021 2.225 16.096 -3.551 1.00 0.00 H new ATOM 0 HG2 MET A1021 2.678 13.897 -1.523 1.00 0.00 H new ATOM 0 HG3 MET A1021 2.004 15.446 -1.056 1.00 0.00 H new ATOM 0 HE1 MET A1021 -1.350 15.640 -2.947 1.00 0.00 H new ATOM 0 HE2 MET A1021 0.036 16.539 -2.285 1.00 0.00 H new ATOM 0 HE3 MET A1021 0.074 15.957 -3.967 1.00 0.00 H new ATOM 1644 N LEU A1022 1.722 14.131 -5.566 1.00 0.00 N ATOM 1645 CA LEU A1022 0.624 13.402 -6.189 1.00 0.00 C ATOM 1646 C LEU A1022 1.138 12.261 -7.065 1.00 0.00 C ATOM 1647 O LEU A1022 0.495 11.215 -7.181 1.00 0.00 O ATOM 1648 CB LEU A1022 -0.243 14.353 -7.016 1.00 0.00 C ATOM 1649 CG LEU A1022 -1.511 13.730 -7.605 1.00 0.00 C ATOM 1650 CD1 LEU A1022 -2.430 13.230 -6.498 1.00 0.00 C ATOM 1651 CD2 LEU A1022 -2.236 14.733 -8.486 1.00 0.00 C ATOM 0 H LEU A1022 1.817 15.096 -5.882 1.00 0.00 H new ATOM 0 HA LEU A1022 0.018 12.968 -5.394 1.00 0.00 H new ATOM 0 HB2 LEU A1022 -0.529 15.197 -6.388 1.00 0.00 H new ATOM 0 HB3 LEU A1022 0.360 14.752 -7.832 1.00 0.00 H new ATOM 0 HG LEU A1022 -1.220 12.877 -8.218 1.00 0.00 H new ATOM 0 HD11 LEU A1022 -3.325 12.791 -6.939 1.00 0.00 H new ATOM 0 HD12 LEU A1022 -1.910 12.477 -5.906 1.00 0.00 H new ATOM 0 HD13 LEU A1022 -2.713 14.064 -5.856 1.00 0.00 H new ATOM 0 HD21 LEU A1022 -3.135 14.274 -8.897 1.00 0.00 H new ATOM 0 HD22 LEU A1022 -2.512 15.605 -7.893 1.00 0.00 H new ATOM 0 HD23 LEU A1022 -1.581 15.041 -9.301 1.00 0.00 H new ATOM 1663 N THR A1023 2.296 12.461 -7.675 1.00 0.00 N ATOM 1664 CA THR A1023 2.909 11.431 -8.498 1.00 0.00 C ATOM 1665 C THR A1023 3.382 10.267 -7.623 1.00 0.00 C ATOM 1666 O THR A1023 3.112 9.099 -7.916 1.00 0.00 O ATOM 1667 CB THR A1023 4.103 12.002 -9.292 1.00 0.00 C ATOM 1668 OG1 THR A1023 3.690 13.170 -10.017 1.00 0.00 O ATOM 1669 CG2 THR A1023 4.657 10.973 -10.266 1.00 0.00 C ATOM 0 H THR A1023 2.830 13.328 -7.615 1.00 0.00 H new ATOM 0 HA THR A1023 2.160 11.071 -9.204 1.00 0.00 H new ATOM 0 HB THR A1023 4.888 12.264 -8.582 1.00 0.00 H new ATOM 0 HG1 THR A1023 3.528 13.905 -9.389 1.00 0.00 H new ATOM 0 HG21 THR A1023 5.497 11.403 -10.811 1.00 0.00 H new ATOM 0 HG22 THR A1023 4.994 10.095 -9.715 1.00 0.00 H new ATOM 0 HG23 THR A1023 3.878 10.682 -10.971 1.00 0.00 H new ATOM 1677 N ALA A1024 4.065 10.611 -6.538 1.00 0.00 N ATOM 1678 CA ALA A1024 4.546 9.622 -5.578 1.00 0.00 C ATOM 1679 C ALA A1024 3.387 8.905 -4.895 1.00 0.00 C ATOM 1680 O ALA A1024 3.465 7.713 -4.603 1.00 0.00 O ATOM 1681 CB ALA A1024 5.448 10.271 -4.547 1.00 0.00 C ATOM 0 H ALA A1024 4.300 11.574 -6.299 1.00 0.00 H new ATOM 0 HA ALA A1024 5.124 8.880 -6.128 1.00 0.00 H new ATOM 0 HB1 ALA A1024 5.795 9.517 -3.841 1.00 0.00 H new ATOM 0 HB2 ALA A1024 6.305 10.723 -5.046 1.00 0.00 H new ATOM 0 HB3 ALA A1024 4.893 11.041 -4.011 1.00 0.00 H new ATOM 1687 N ALA A1025 2.309 9.637 -4.648 1.00 0.00 N ATOM 1688 CA ALA A1025 1.105 9.050 -4.076 1.00 0.00 C ATOM 1689 C ALA A1025 0.551 7.977 -4.994 1.00 0.00 C ATOM 1690 O ALA A1025 0.138 6.907 -4.546 1.00 0.00 O ATOM 1691 CB ALA A1025 0.051 10.121 -3.833 1.00 0.00 C ATOM 0 H ALA A1025 2.244 10.638 -4.835 1.00 0.00 H new ATOM 0 HA ALA A1025 1.368 8.595 -3.121 1.00 0.00 H new ATOM 0 HB1 ALA A1025 -0.841 9.663 -3.406 1.00 0.00 H new ATOM 0 HB2 ALA A1025 0.443 10.867 -3.142 1.00 0.00 H new ATOM 0 HB3 ALA A1025 -0.205 10.601 -4.778 1.00 0.00 H new ATOM 1697 N HIS A1026 0.557 8.269 -6.286 1.00 0.00 N ATOM 1698 CA HIS A1026 0.071 7.328 -7.275 1.00 0.00 C ATOM 1699 C HIS A1026 1.013 6.140 -7.374 1.00 0.00 C ATOM 1700 O HIS A1026 0.582 5.018 -7.616 1.00 0.00 O ATOM 1701 CB HIS A1026 -0.084 8.019 -8.633 1.00 0.00 C ATOM 1702 CG HIS A1026 -0.705 7.157 -9.691 1.00 0.00 C ATOM 1703 ND1 HIS A1026 -2.065 7.054 -9.872 1.00 0.00 N ATOM 1704 CD2 HIS A1026 -0.142 6.361 -10.632 1.00 0.00 C ATOM 1705 CE1 HIS A1026 -2.313 6.233 -10.874 1.00 0.00 C ATOM 1706 NE2 HIS A1026 -1.164 5.800 -11.354 1.00 0.00 N ATOM 0 H HIS A1026 0.894 9.151 -6.671 1.00 0.00 H new ATOM 0 HA HIS A1026 -0.908 6.963 -6.966 1.00 0.00 H new ATOM 0 HB2 HIS A1026 -0.692 8.914 -8.506 1.00 0.00 H new ATOM 0 HB3 HIS A1026 0.897 8.347 -8.976 1.00 0.00 H new ATOM 0 HD2 HIS A1026 0.915 6.199 -10.785 1.00 0.00 H new ATOM 0 HE1 HIS A1026 -3.292 5.961 -11.240 1.00 0.00 H new ATOM 0 HE2 HIS A1026 -1.053 5.153 -12.135 1.00 0.00 H new ATOM 1715 N ALA A1027 2.296 6.395 -7.173 1.00 0.00 N ATOM 1716 CA ALA A1027 3.286 5.332 -7.166 1.00 0.00 C ATOM 1717 C ALA A1027 3.014 4.371 -6.018 1.00 0.00 C ATOM 1718 O ALA A1027 2.988 3.159 -6.211 1.00 0.00 O ATOM 1719 CB ALA A1027 4.687 5.910 -7.060 1.00 0.00 C ATOM 0 H ALA A1027 2.675 7.328 -7.013 1.00 0.00 H new ATOM 0 HA ALA A1027 3.215 4.782 -8.104 1.00 0.00 H new ATOM 0 HB1 ALA A1027 5.416 5.099 -7.056 1.00 0.00 H new ATOM 0 HB2 ALA A1027 4.876 6.564 -7.911 1.00 0.00 H new ATOM 0 HB3 ALA A1027 4.776 6.482 -6.136 1.00 0.00 H new ATOM 1725 N LEU A1028 2.774 4.929 -4.834 1.00 0.00 N ATOM 1726 CA LEU A1028 2.439 4.129 -3.661 1.00 0.00 C ATOM 1727 C LEU A1028 1.176 3.329 -3.914 1.00 0.00 C ATOM 1728 O LEU A1028 1.095 2.151 -3.592 1.00 0.00 O ATOM 1729 CB LEU A1028 2.217 5.014 -2.439 1.00 0.00 C ATOM 1730 CG LEU A1028 2.132 4.255 -1.109 1.00 0.00 C ATOM 1731 CD1 LEU A1028 3.329 3.338 -0.938 1.00 0.00 C ATOM 1732 CD2 LEU A1028 2.032 5.234 0.043 1.00 0.00 C ATOM 0 H LEU A1028 2.806 5.934 -4.662 1.00 0.00 H new ATOM 0 HA LEU A1028 3.276 3.457 -3.471 1.00 0.00 H new ATOM 0 HB2 LEU A1028 3.030 5.738 -2.378 1.00 0.00 H new ATOM 0 HB3 LEU A1028 1.296 5.580 -2.579 1.00 0.00 H new ATOM 0 HG LEU A1028 1.235 3.636 -1.116 1.00 0.00 H new ATOM 0 HD11 LEU A1028 3.249 2.809 0.012 1.00 0.00 H new ATOM 0 HD12 LEU A1028 3.354 2.616 -1.754 1.00 0.00 H new ATOM 0 HD13 LEU A1028 4.245 3.929 -0.948 1.00 0.00 H new ATOM 0 HD21 LEU A1028 1.972 4.685 0.983 1.00 0.00 H new ATOM 0 HD22 LEU A1028 2.913 5.875 0.053 1.00 0.00 H new ATOM 0 HD23 LEU A1028 1.139 5.847 -0.077 1.00 0.00 H new ATOM 1744 N ALA A1029 0.173 4.008 -4.440 1.00 0.00 N ATOM 1745 CA ALA A1029 -1.058 3.351 -4.851 1.00 0.00 C ATOM 1746 C ALA A1029 -0.802 2.197 -5.834 1.00 0.00 C ATOM 1747 O ALA A1029 -1.548 1.219 -5.848 1.00 0.00 O ATOM 1748 CB ALA A1029 -2.017 4.364 -5.457 1.00 0.00 C ATOM 0 H ALA A1029 0.185 5.016 -4.594 1.00 0.00 H new ATOM 0 HA ALA A1029 -1.510 2.917 -3.959 1.00 0.00 H new ATOM 0 HB1 ALA A1029 -2.935 3.860 -5.761 1.00 0.00 H new ATOM 0 HB2 ALA A1029 -2.251 5.130 -4.718 1.00 0.00 H new ATOM 0 HB3 ALA A1029 -1.553 4.829 -6.327 1.00 0.00 H new ATOM 1754 N VAL A1030 0.227 2.313 -6.670 1.00 0.00 N ATOM 1755 CA VAL A1030 0.631 1.195 -7.528 1.00 0.00 C ATOM 1756 C VAL A1030 1.303 0.103 -6.703 1.00 0.00 C ATOM 1757 O VAL A1030 1.082 -1.085 -6.931 1.00 0.00 O ATOM 1758 CB VAL A1030 1.575 1.642 -8.672 1.00 0.00 C ATOM 1759 CG1 VAL A1030 2.017 0.451 -9.512 1.00 0.00 C ATOM 1760 CG2 VAL A1030 0.899 2.681 -9.554 1.00 0.00 C ATOM 0 H VAL A1030 0.791 3.156 -6.774 1.00 0.00 H new ATOM 0 HA VAL A1030 -0.278 0.802 -7.983 1.00 0.00 H new ATOM 0 HB VAL A1030 2.458 2.090 -8.218 1.00 0.00 H new ATOM 0 HG11 VAL A1030 2.679 0.793 -10.308 1.00 0.00 H new ATOM 0 HG12 VAL A1030 2.547 -0.263 -8.881 1.00 0.00 H new ATOM 0 HG13 VAL A1030 1.142 -0.031 -9.949 1.00 0.00 H new ATOM 0 HG21 VAL A1030 1.580 2.981 -10.351 1.00 0.00 H new ATOM 0 HG22 VAL A1030 -0.005 2.255 -9.990 1.00 0.00 H new ATOM 0 HG23 VAL A1030 0.637 3.552 -8.954 1.00 0.00 H new ATOM 1770 N ASP A1031 2.122 0.514 -5.753 1.00 0.00 N ATOM 1771 CA ASP A1031 2.726 -0.422 -4.807 1.00 0.00 C ATOM 1772 C ASP A1031 1.632 -1.184 -4.069 1.00 0.00 C ATOM 1773 O ASP A1031 1.689 -2.412 -3.940 1.00 0.00 O ATOM 1774 CB ASP A1031 3.608 0.317 -3.800 1.00 0.00 C ATOM 1775 CG ASP A1031 4.733 1.086 -4.454 1.00 0.00 C ATOM 1776 OD1 ASP A1031 4.855 1.035 -5.700 1.00 0.00 O ATOM 1777 OD2 ASP A1031 5.498 1.738 -3.729 1.00 0.00 O ATOM 0 H ASP A1031 2.388 1.488 -5.611 1.00 0.00 H new ATOM 0 HA ASP A1031 3.349 -1.122 -5.364 1.00 0.00 H new ATOM 0 HB2 ASP A1031 2.992 1.006 -3.222 1.00 0.00 H new ATOM 0 HB3 ASP A1031 4.028 -0.402 -3.096 1.00 0.00 H new ATOM 1782 N ALA A1032 0.638 -0.439 -3.587 1.00 0.00 N ATOM 1783 CA ALA A1032 -0.591 -1.013 -3.055 1.00 0.00 C ATOM 1784 C ALA A1032 -1.226 -1.974 -4.047 1.00 0.00 C ATOM 1785 O ALA A1032 -1.684 -3.033 -3.668 1.00 0.00 O ATOM 1786 CB ALA A1032 -1.574 0.090 -2.702 1.00 0.00 C ATOM 0 H ALA A1032 0.665 0.580 -3.556 1.00 0.00 H new ATOM 0 HA ALA A1032 -0.337 -1.572 -2.155 1.00 0.00 H new ATOM 0 HB1 ALA A1032 -2.489 -0.351 -2.305 1.00 0.00 H new ATOM 0 HB2 ALA A1032 -1.132 0.745 -1.951 1.00 0.00 H new ATOM 0 HB3 ALA A1032 -1.808 0.669 -3.596 1.00 0.00 H new ATOM 1792 N LYS A1033 -1.196 -1.633 -5.324 1.00 0.00 N ATOM 1793 CA LYS A1033 -1.849 -2.469 -6.318 1.00 0.00 C ATOM 1794 C LYS A1033 -1.048 -3.751 -6.505 1.00 0.00 C ATOM 1795 O LYS A1033 -1.608 -4.828 -6.721 1.00 0.00 O ATOM 1796 CB LYS A1033 -1.997 -1.764 -7.667 1.00 0.00 C ATOM 1797 CG LYS A1033 -2.813 -2.583 -8.653 1.00 0.00 C ATOM 1798 CD LYS A1033 -2.569 -2.175 -10.095 1.00 0.00 C ATOM 1799 CE LYS A1033 -3.310 -3.095 -11.053 1.00 0.00 C ATOM 1800 NZ LYS A1033 -2.994 -4.532 -10.809 1.00 0.00 N ATOM 0 H LYS A1033 -0.736 -0.800 -5.693 1.00 0.00 H new ATOM 0 HA LYS A1033 -2.851 -2.691 -5.952 1.00 0.00 H new ATOM 0 HB2 LYS A1033 -2.474 -0.795 -7.519 1.00 0.00 H new ATOM 0 HB3 LYS A1033 -1.009 -1.572 -8.086 1.00 0.00 H new ATOM 0 HG2 LYS A1033 -2.569 -3.638 -8.532 1.00 0.00 H new ATOM 0 HG3 LYS A1033 -3.873 -2.472 -8.422 1.00 0.00 H new ATOM 0 HD2 LYS A1033 -2.896 -1.146 -10.246 1.00 0.00 H new ATOM 0 HD3 LYS A1033 -1.501 -2.204 -10.310 1.00 0.00 H new ATOM 0 HE2 LYS A1033 -4.384 -2.938 -10.948 1.00 0.00 H new ATOM 0 HE3 LYS A1033 -3.048 -2.836 -12.079 1.00 0.00 H new ATOM 0 HZ1 LYS A1033 -3.229 -5.088 -11.656 1.00 0.00 H new ATOM 0 HZ2 LYS A1033 -1.981 -4.634 -10.598 1.00 0.00 H new ATOM 0 HZ3 LYS A1033 -3.552 -4.878 -10.002 1.00 0.00 H new ATOM 1814 N ASN A1034 0.269 -3.630 -6.405 1.00 0.00 N ATOM 1815 CA ASN A1034 1.137 -4.771 -6.588 1.00 0.00 C ATOM 1816 C ASN A1034 1.004 -5.728 -5.414 1.00 0.00 C ATOM 1817 O ASN A1034 0.681 -6.890 -5.611 1.00 0.00 O ATOM 1818 CB ASN A1034 2.592 -4.338 -6.763 1.00 0.00 C ATOM 1819 CG ASN A1034 3.460 -5.474 -7.272 1.00 0.00 C ATOM 1820 OD1 ASN A1034 2.991 -6.357 -7.990 1.00 0.00 O ATOM 1821 ND2 ASN A1034 4.735 -5.455 -6.922 1.00 0.00 N ATOM 0 H ASN A1034 0.752 -2.755 -6.199 1.00 0.00 H new ATOM 0 HA ASN A1034 0.830 -5.286 -7.499 1.00 0.00 H new ATOM 0 HB2 ASN A1034 2.641 -3.502 -7.461 1.00 0.00 H new ATOM 0 HB3 ASN A1034 2.982 -3.981 -5.810 1.00 0.00 H new ATOM 0 HD21 ASN A1034 5.365 -6.188 -7.249 1.00 0.00 H new ATOM 0 HD22 ASN A1034 5.089 -4.707 -6.325 1.00 0.00 H new ATOM 1828 N LEU A1035 1.197 -5.229 -4.187 1.00 0.00 N ATOM 1829 CA LEU A1035 1.092 -6.090 -3.001 1.00 0.00 C ATOM 1830 C LEU A1035 -0.334 -6.611 -2.866 1.00 0.00 C ATOM 1831 O LEU A1035 -0.554 -7.694 -2.330 1.00 0.00 O ATOM 1832 CB LEU A1035 1.503 -5.375 -1.702 1.00 0.00 C ATOM 1833 CG LEU A1035 1.489 -6.278 -0.465 1.00 0.00 C ATOM 1834 CD1 LEU A1035 2.742 -7.140 -0.422 1.00 0.00 C ATOM 1835 CD2 LEU A1035 1.352 -5.464 0.807 1.00 0.00 C ATOM 0 H LEU A1035 1.422 -4.254 -3.990 1.00 0.00 H new ATOM 0 HA LEU A1035 1.788 -6.916 -3.147 1.00 0.00 H new ATOM 0 HB2 LEU A1035 2.504 -4.962 -1.827 1.00 0.00 H new ATOM 0 HB3 LEU A1035 0.830 -4.534 -1.533 1.00 0.00 H new ATOM 0 HG LEU A1035 0.621 -6.933 -0.535 1.00 0.00 H new ATOM 0 HD11 LEU A1035 2.716 -7.776 0.463 1.00 0.00 H new ATOM 0 HD12 LEU A1035 2.786 -7.763 -1.315 1.00 0.00 H new ATOM 0 HD13 LEU A1035 3.623 -6.499 -0.383 1.00 0.00 H new ATOM 0 HD21 LEU A1035 1.345 -6.133 1.668 1.00 0.00 H new ATOM 0 HD22 LEU A1035 2.192 -4.774 0.890 1.00 0.00 H new ATOM 0 HD23 LEU A1035 0.420 -4.899 0.779 1.00 0.00 H new ATOM 1847 N LEU A1036 -1.287 -5.829 -3.369 1.00 0.00 N ATOM 1848 CA LEU A1036 -2.683 -6.237 -3.435 1.00 0.00 C ATOM 1849 C LEU A1036 -2.786 -7.589 -4.091 1.00 0.00 C ATOM 1850 O LEU A1036 -3.483 -8.456 -3.599 1.00 0.00 O ATOM 1851 CB LEU A1036 -3.510 -5.218 -4.231 1.00 0.00 C ATOM 1852 CG LEU A1036 -4.993 -5.554 -4.410 1.00 0.00 C ATOM 1853 CD1 LEU A1036 -5.723 -5.492 -3.080 1.00 0.00 C ATOM 1854 CD2 LEU A1036 -5.633 -4.608 -5.415 1.00 0.00 C ATOM 0 H LEU A1036 -1.110 -4.896 -3.741 1.00 0.00 H new ATOM 0 HA LEU A1036 -3.076 -6.289 -2.420 1.00 0.00 H new ATOM 0 HB2 LEU A1036 -3.434 -4.250 -3.735 1.00 0.00 H new ATOM 0 HB3 LEU A1036 -3.061 -5.106 -5.218 1.00 0.00 H new ATOM 0 HG LEU A1036 -5.070 -6.571 -4.793 1.00 0.00 H new ATOM 0 HD11 LEU A1036 -6.775 -5.734 -3.231 1.00 0.00 H new ATOM 0 HD12 LEU A1036 -5.281 -6.209 -2.389 1.00 0.00 H new ATOM 0 HD13 LEU A1036 -5.638 -4.488 -2.665 1.00 0.00 H new ATOM 0 HD21 LEU A1036 -6.687 -4.860 -5.531 1.00 0.00 H new ATOM 0 HD22 LEU A1036 -5.542 -3.582 -5.058 1.00 0.00 H new ATOM 0 HD23 LEU A1036 -5.129 -4.704 -6.377 1.00 0.00 H new ATOM 1866 N ASP A1037 -2.048 -7.757 -5.180 1.00 0.00 N ATOM 1867 CA ASP A1037 -2.049 -9.002 -5.935 1.00 0.00 C ATOM 1868 C ASP A1037 -0.948 -9.940 -5.433 1.00 0.00 C ATOM 1869 O ASP A1037 -1.058 -11.150 -5.546 1.00 0.00 O ATOM 1870 CB ASP A1037 -1.856 -8.703 -7.422 1.00 0.00 C ATOM 1871 CG ASP A1037 -2.143 -9.902 -8.300 1.00 0.00 C ATOM 1872 OD1 ASP A1037 -3.332 -10.246 -8.468 1.00 0.00 O ATOM 1873 OD2 ASP A1037 -1.189 -10.491 -8.845 1.00 0.00 O ATOM 0 H ASP A1037 -1.435 -7.038 -5.563 1.00 0.00 H new ATOM 0 HA ASP A1037 -3.009 -9.499 -5.792 1.00 0.00 H new ATOM 0 HB2 ASP A1037 -2.511 -7.881 -7.711 1.00 0.00 H new ATOM 0 HB3 ASP A1037 -0.832 -8.370 -7.592 1.00 0.00 H new ATOM 1878 N VAL A1038 0.108 -9.359 -4.875 1.00 0.00 N ATOM 1879 CA VAL A1038 1.220 -10.113 -4.287 1.00 0.00 C ATOM 1880 C VAL A1038 0.750 -11.058 -3.189 1.00 0.00 C ATOM 1881 O VAL A1038 1.003 -12.254 -3.249 1.00 0.00 O ATOM 1882 CB VAL A1038 2.268 -9.158 -3.682 1.00 0.00 C ATOM 1883 CG1 VAL A1038 3.208 -9.896 -2.749 1.00 0.00 C ATOM 1884 CG2 VAL A1038 3.057 -8.453 -4.773 1.00 0.00 C ATOM 0 H VAL A1038 0.222 -8.347 -4.815 1.00 0.00 H new ATOM 0 HA VAL A1038 1.660 -10.696 -5.096 1.00 0.00 H new ATOM 0 HB VAL A1038 1.731 -8.407 -3.103 1.00 0.00 H new ATOM 0 HG11 VAL A1038 3.936 -9.197 -2.338 1.00 0.00 H new ATOM 0 HG12 VAL A1038 2.636 -10.344 -1.936 1.00 0.00 H new ATOM 0 HG13 VAL A1038 3.729 -10.678 -3.301 1.00 0.00 H new ATOM 0 HG21 VAL A1038 3.789 -7.785 -4.319 1.00 0.00 H new ATOM 0 HG22 VAL A1038 3.572 -9.193 -5.386 1.00 0.00 H new ATOM 0 HG23 VAL A1038 2.377 -7.874 -5.398 1.00 0.00 H new ATOM 1894 N ILE A1039 0.097 -10.512 -2.172 1.00 0.00 N ATOM 1895 CA ILE A1039 -0.363 -11.312 -1.047 1.00 0.00 C ATOM 1896 C ILE A1039 -1.742 -11.906 -1.327 1.00 0.00 C ATOM 1897 O ILE A1039 -2.090 -12.951 -0.777 1.00 0.00 O ATOM 1898 CB ILE A1039 -0.334 -10.532 0.276 1.00 0.00 C ATOM 1899 CG1 ILE A1039 -1.098 -9.221 0.166 1.00 0.00 C ATOM 1900 CG2 ILE A1039 1.108 -10.274 0.685 1.00 0.00 C ATOM 1901 CD1 ILE A1039 -0.933 -8.338 1.381 1.00 0.00 C ATOM 0 H ILE A1039 -0.126 -9.519 -2.104 1.00 0.00 H new ATOM 0 HA ILE A1039 0.338 -12.138 -0.929 1.00 0.00 H new ATOM 0 HB ILE A1039 -0.825 -11.134 1.040 1.00 0.00 H new ATOM 0 HG12 ILE A1039 -0.757 -8.681 -0.718 1.00 0.00 H new ATOM 0 HG13 ILE A1039 -2.157 -9.435 0.020 1.00 0.00 H new ATOM 0 HG21 ILE A1039 1.126 -9.720 1.624 1.00 0.00 H new ATOM 0 HG22 ILE A1039 1.625 -11.225 0.814 1.00 0.00 H new ATOM 0 HG23 ILE A1039 1.607 -9.692 -0.089 1.00 0.00 H new ATOM 0 HD11 ILE A1039 -1.501 -7.418 1.242 1.00 0.00 H new ATOM 0 HD12 ILE A1039 -1.300 -8.862 2.264 1.00 0.00 H new ATOM 0 HD13 ILE A1039 0.121 -8.096 1.515 1.00 0.00 H new ATOM 1913 N ASP A1040 -2.527 -11.231 -2.168 1.00 0.00 N ATOM 1914 CA ASP A1040 -3.623 -11.916 -2.878 1.00 0.00 C ATOM 1915 C ASP A1040 -3.102 -13.244 -3.404 1.00 0.00 C ATOM 1916 O ASP A1040 -3.703 -14.305 -3.189 1.00 0.00 O ATOM 1917 CB ASP A1040 -4.105 -11.060 -4.059 1.00 0.00 C ATOM 1918 CG ASP A1040 -5.067 -11.750 -5.014 1.00 0.00 C ATOM 1919 OD1 ASP A1040 -4.659 -12.711 -5.699 1.00 0.00 O ATOM 1920 OD2 ASP A1040 -6.224 -11.296 -5.125 1.00 0.00 O ATOM 0 H ASP A1040 -2.434 -10.237 -2.375 1.00 0.00 H new ATOM 0 HA ASP A1040 -4.457 -12.076 -2.194 1.00 0.00 H new ATOM 0 HB2 ASP A1040 -4.589 -10.167 -3.665 1.00 0.00 H new ATOM 0 HB3 ASP A1040 -3.234 -10.728 -4.624 1.00 0.00 H new ATOM 1925 N GLN A1041 -1.949 -13.173 -4.049 1.00 0.00 N ATOM 1926 CA GLN A1041 -1.270 -14.348 -4.550 1.00 0.00 C ATOM 1927 C GLN A1041 -0.552 -15.066 -3.425 1.00 0.00 C ATOM 1928 O GLN A1041 -0.256 -16.214 -3.551 1.00 0.00 O ATOM 1929 CB GLN A1041 -0.261 -13.989 -5.636 1.00 0.00 C ATOM 1930 CG GLN A1041 0.338 -15.186 -6.353 1.00 0.00 C ATOM 1931 CD GLN A1041 1.416 -14.787 -7.344 1.00 0.00 C ATOM 1932 OE1 GLN A1041 1.142 -14.545 -8.518 1.00 0.00 O ATOM 1933 NE2 GLN A1041 2.652 -14.717 -6.879 1.00 0.00 N ATOM 0 H GLN A1041 -1.461 -12.298 -4.238 1.00 0.00 H new ATOM 0 HA GLN A1041 -2.029 -15.002 -4.979 1.00 0.00 H new ATOM 0 HB2 GLN A1041 -0.748 -13.347 -6.370 1.00 0.00 H new ATOM 0 HB3 GLN A1041 0.545 -13.407 -5.189 1.00 0.00 H new ATOM 0 HG2 GLN A1041 0.760 -15.872 -5.619 1.00 0.00 H new ATOM 0 HG3 GLN A1041 -0.452 -15.725 -6.877 1.00 0.00 H new ATOM 0 HE21 GLN A1041 2.841 -14.925 -5.898 1.00 0.00 H new ATOM 0 HE22 GLN A1041 3.417 -14.455 -7.501 1.00 0.00 H new ATOM 1942 N ALA A1042 -0.212 -14.379 -2.351 1.00 0.00 N ATOM 1943 CA ALA A1042 0.396 -15.047 -1.202 1.00 0.00 C ATOM 1944 C ALA A1042 -0.484 -16.177 -0.683 1.00 0.00 C ATOM 1945 O ALA A1042 -0.017 -17.272 -0.388 1.00 0.00 O ATOM 1946 CB ALA A1042 0.671 -14.071 -0.077 1.00 0.00 C ATOM 0 H ALA A1042 -0.341 -13.373 -2.244 1.00 0.00 H new ATOM 0 HA ALA A1042 1.341 -15.466 -1.548 1.00 0.00 H new ATOM 0 HB1 ALA A1042 1.123 -14.600 0.762 1.00 0.00 H new ATOM 0 HB2 ALA A1042 1.353 -13.296 -0.426 1.00 0.00 H new ATOM 0 HB3 ALA A1042 -0.265 -13.613 0.245 1.00 0.00 H new ATOM 1952 N ARG A1043 -1.754 -15.908 -0.515 1.00 0.00 N ATOM 1953 CA ARG A1043 -2.674 -16.944 -0.084 1.00 0.00 C ATOM 1954 C ARG A1043 -3.072 -17.842 -1.255 1.00 0.00 C ATOM 1955 O ARG A1043 -3.448 -18.995 -1.063 1.00 0.00 O ATOM 1956 CB ARG A1043 -3.877 -16.295 0.593 1.00 0.00 C ATOM 1957 CG ARG A1043 -3.447 -15.193 1.531 1.00 0.00 C ATOM 1958 CD ARG A1043 -2.381 -15.657 2.503 1.00 0.00 C ATOM 1959 NE ARG A1043 -2.938 -16.406 3.632 1.00 0.00 N ATOM 1960 CZ ARG A1043 -2.496 -16.301 4.888 1.00 0.00 C ATOM 1961 NH1 ARG A1043 -1.523 -15.449 5.185 1.00 0.00 N ATOM 1962 NH2 ARG A1043 -3.035 -17.032 5.854 1.00 0.00 N ATOM 0 H ARG A1043 -2.177 -14.992 -0.667 1.00 0.00 H new ATOM 0 HA ARG A1043 -2.186 -17.593 0.644 1.00 0.00 H new ATOM 0 HB2 ARG A1043 -4.549 -15.890 -0.164 1.00 0.00 H new ATOM 0 HB3 ARG A1043 -4.437 -17.049 1.146 1.00 0.00 H new ATOM 0 HG2 ARG A1043 -3.067 -14.352 0.951 1.00 0.00 H new ATOM 0 HG3 ARG A1043 -4.312 -14.832 2.087 1.00 0.00 H new ATOM 0 HD2 ARG A1043 -1.661 -16.283 1.976 1.00 0.00 H new ATOM 0 HD3 ARG A1043 -1.836 -14.792 2.879 1.00 0.00 H new ATOM 0 HE ARG A1043 -3.710 -17.047 3.448 1.00 0.00 H new ATOM 0 HH11 ARG A1043 -1.110 -14.871 4.453 1.00 0.00 H new ATOM 0 HH12 ARG A1043 -1.188 -15.372 6.145 1.00 0.00 H new ATOM 0 HH21 ARG A1043 -3.793 -17.680 5.640 1.00 0.00 H new ATOM 0 HH22 ARG A1043 -2.692 -16.946 6.811 1.00 0.00 H new ATOM 1976 N LEU A1044 -2.964 -17.314 -2.467 1.00 0.00 N ATOM 1977 CA LEU A1044 -3.220 -18.100 -3.675 1.00 0.00 C ATOM 1978 C LEU A1044 -2.017 -18.996 -3.998 1.00 0.00 C ATOM 1979 O LEU A1044 -2.163 -20.069 -4.570 1.00 0.00 O ATOM 1980 CB LEU A1044 -3.521 -17.167 -4.850 1.00 0.00 C ATOM 1981 CG LEU A1044 -3.911 -17.856 -6.159 1.00 0.00 C ATOM 1982 CD1 LEU A1044 -5.208 -18.630 -5.987 1.00 0.00 C ATOM 1983 CD2 LEU A1044 -4.041 -16.826 -7.272 1.00 0.00 C ATOM 0 H LEU A1044 -2.701 -16.344 -2.644 1.00 0.00 H new ATOM 0 HA LEU A1044 -4.086 -18.739 -3.501 1.00 0.00 H new ATOM 0 HB2 LEU A1044 -4.329 -16.495 -4.559 1.00 0.00 H new ATOM 0 HB3 LEU A1044 -2.642 -16.549 -5.034 1.00 0.00 H new ATOM 0 HG LEU A1044 -3.128 -18.564 -6.431 1.00 0.00 H new ATOM 0 HD11 LEU A1044 -5.471 -19.114 -6.928 1.00 0.00 H new ATOM 0 HD12 LEU A1044 -5.080 -19.387 -5.213 1.00 0.00 H new ATOM 0 HD13 LEU A1044 -6.005 -17.945 -5.697 1.00 0.00 H new ATOM 0 HD21 LEU A1044 -4.319 -17.326 -8.200 1.00 0.00 H new ATOM 0 HD22 LEU A1044 -4.809 -16.099 -7.007 1.00 0.00 H new ATOM 0 HD23 LEU A1044 -3.088 -16.314 -7.407 1.00 0.00 H new ATOM 1995 N LYS A1045 -0.837 -18.540 -3.610 1.00 0.00 N ATOM 1996 CA LYS A1045 0.401 -19.289 -3.767 1.00 0.00 C ATOM 1997 C LYS A1045 0.381 -20.427 -2.793 1.00 0.00 C ATOM 1998 O LYS A1045 1.055 -21.441 -2.953 1.00 0.00 O ATOM 1999 CB LYS A1045 1.638 -18.380 -3.549 1.00 0.00 C ATOM 2000 CG LYS A1045 1.983 -18.053 -2.123 1.00 0.00 C ATOM 2001 CD LYS A1045 2.618 -19.246 -1.480 1.00 0.00 C ATOM 2002 CE LYS A1045 2.464 -19.259 0.016 1.00 0.00 C ATOM 2003 NZ LYS A1045 3.016 -20.497 0.607 1.00 0.00 N ATOM 0 H LYS A1045 -0.710 -17.628 -3.172 1.00 0.00 H new ATOM 0 HA LYS A1045 0.476 -19.675 -4.784 1.00 0.00 H new ATOM 0 HB2 LYS A1045 2.501 -18.862 -4.008 1.00 0.00 H new ATOM 0 HB3 LYS A1045 1.473 -17.445 -4.084 1.00 0.00 H new ATOM 0 HG2 LYS A1045 2.663 -17.202 -2.088 1.00 0.00 H new ATOM 0 HG3 LYS A1045 1.085 -17.766 -1.576 1.00 0.00 H new ATOM 0 HD2 LYS A1045 2.176 -20.153 -1.893 1.00 0.00 H new ATOM 0 HD3 LYS A1045 3.679 -19.266 -1.731 1.00 0.00 H new ATOM 0 HE2 LYS A1045 2.971 -18.394 0.443 1.00 0.00 H new ATOM 0 HE3 LYS A1045 1.409 -19.170 0.275 1.00 0.00 H new ATOM 0 HZ1 LYS A1045 2.971 -20.437 1.644 1.00 0.00 H new ATOM 0 HZ2 LYS A1045 2.460 -21.314 0.283 1.00 0.00 H new ATOM 0 HZ3 LYS A1045 4.006 -20.612 0.310 1.00 0.00 H new ATOM 2017 N MET A1046 -0.358 -20.232 -1.741 1.00 0.00 N ATOM 2018 CA MET A1046 -0.523 -21.293 -0.787 1.00 0.00 C ATOM 2019 C MET A1046 -1.458 -22.346 -1.385 1.00 0.00 C ATOM 2020 O MET A1046 -1.351 -23.542 -1.101 1.00 0.00 O ATOM 2021 CB MET A1046 -1.028 -20.748 0.544 1.00 0.00 C ATOM 2022 CG MET A1046 -1.348 -21.820 1.571 1.00 0.00 C ATOM 2023 SD MET A1046 -1.877 -21.133 3.152 1.00 0.00 S ATOM 2024 CE MET A1046 -3.410 -20.325 2.691 1.00 0.00 C ATOM 0 H MET A1046 -0.849 -19.365 -1.522 1.00 0.00 H new ATOM 0 HA MET A1046 0.436 -21.766 -0.576 1.00 0.00 H new ATOM 0 HB2 MET A1046 -0.276 -20.076 0.958 1.00 0.00 H new ATOM 0 HB3 MET A1046 -1.923 -20.153 0.365 1.00 0.00 H new ATOM 0 HG2 MET A1046 -2.132 -22.469 1.181 1.00 0.00 H new ATOM 0 HG3 MET A1046 -0.467 -22.443 1.727 1.00 0.00 H new ATOM 0 HE1 MET A1046 -3.997 -20.121 3.586 1.00 0.00 H new ATOM 0 HE2 MET A1046 -3.188 -19.388 2.181 1.00 0.00 H new ATOM 0 HE3 MET A1046 -3.978 -20.975 2.025 1.00 0.00 H new ATOM 2034 N ILE A1047 -2.348 -21.888 -2.257 1.00 0.00 N ATOM 2035 CA ILE A1047 -3.129 -22.788 -3.092 1.00 0.00 C ATOM 2036 C ILE A1047 -2.201 -23.429 -4.120 1.00 0.00 C ATOM 2037 O ILE A1047 -2.381 -24.578 -4.507 1.00 0.00 O ATOM 2038 CB ILE A1047 -4.277 -22.049 -3.815 1.00 0.00 C ATOM 2039 CG1 ILE A1047 -5.144 -21.300 -2.804 1.00 0.00 C ATOM 2040 CG2 ILE A1047 -5.121 -23.017 -4.634 1.00 0.00 C ATOM 2041 CD1 ILE A1047 -5.790 -22.191 -1.759 1.00 0.00 C ATOM 0 H ILE A1047 -2.546 -20.898 -2.403 1.00 0.00 H new ATOM 0 HA ILE A1047 -3.580 -23.548 -2.454 1.00 0.00 H new ATOM 0 HB ILE A1047 -3.838 -21.325 -4.502 1.00 0.00 H new ATOM 0 HG12 ILE A1047 -4.531 -20.553 -2.300 1.00 0.00 H new ATOM 0 HG13 ILE A1047 -5.926 -20.762 -3.340 1.00 0.00 H new ATOM 0 HG21 ILE A1047 -5.922 -22.470 -5.132 1.00 0.00 H new ATOM 0 HG22 ILE A1047 -4.494 -23.504 -5.381 1.00 0.00 H new ATOM 0 HG23 ILE A1047 -5.552 -23.771 -3.975 1.00 0.00 H new ATOM 0 HD11 ILE A1047 -6.388 -21.582 -1.081 1.00 0.00 H new ATOM 0 HD12 ILE A1047 -6.431 -22.922 -2.251 1.00 0.00 H new ATOM 0 HD13 ILE A1047 -5.015 -22.710 -1.194 1.00 0.00 H new ATOM 2053 N SER A1048 -1.193 -22.664 -4.537 1.00 0.00 N ATOM 2054 CA SER A1048 -0.122 -23.167 -5.394 1.00 0.00 C ATOM 2055 C SER A1048 0.593 -24.356 -4.748 1.00 0.00 C ATOM 2056 O SER A1048 1.207 -25.170 -5.438 1.00 0.00 O ATOM 2057 CB SER A1048 0.887 -22.050 -5.696 1.00 0.00 C ATOM 2058 OG SER A1048 0.328 -21.085 -6.572 1.00 0.00 O ATOM 0 H SER A1048 -1.096 -21.679 -4.290 1.00 0.00 H new ATOM 0 HA SER A1048 -0.572 -23.506 -6.327 1.00 0.00 H new ATOM 0 HB2 SER A1048 1.192 -21.569 -4.767 1.00 0.00 H new ATOM 0 HB3 SER A1048 1.784 -22.477 -6.144 1.00 0.00 H new ATOM 0 HG SER A1048 0.988 -20.382 -6.749 1.00 0.00 H new ATOM 2064 N GLN A1049 0.522 -24.446 -3.424 1.00 0.00 N ATOM 2065 CA GLN A1049 1.054 -25.598 -2.712 1.00 0.00 C ATOM 2066 C GLN A1049 0.194 -26.817 -3.003 1.00 0.00 C ATOM 2067 O GLN A1049 0.695 -27.864 -3.422 1.00 0.00 O ATOM 2068 CB GLN A1049 1.075 -25.355 -1.207 1.00 0.00 C ATOM 2069 CG GLN A1049 1.905 -24.161 -0.776 1.00 0.00 C ATOM 2070 CD GLN A1049 1.797 -23.904 0.713 1.00 0.00 C ATOM 2071 OE1 GLN A1049 1.873 -22.760 1.160 1.00 0.00 O ATOM 2072 NE2 GLN A1049 1.625 -24.961 1.491 1.00 0.00 N ATOM 0 H GLN A1049 0.102 -23.735 -2.825 1.00 0.00 H new ATOM 0 HA GLN A1049 2.076 -25.764 -3.053 1.00 0.00 H new ATOM 0 HB2 GLN A1049 0.051 -25.215 -0.860 1.00 0.00 H new ATOM 0 HB3 GLN A1049 1.460 -26.247 -0.713 1.00 0.00 H new ATOM 0 HG2 GLN A1049 2.949 -24.331 -1.040 1.00 0.00 H new ATOM 0 HG3 GLN A1049 1.578 -23.276 -1.322 1.00 0.00 H new ATOM 0 HE21 GLN A1049 1.567 -25.893 1.080 1.00 0.00 H new ATOM 0 HE22 GLN A1049 1.550 -24.844 2.501 1.00 0.00 H new