USER MOD reduce.3.24.130724 H: found=0, std=0, add=1319, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1324 hydrogens (29 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 145 SER OG : rot 130:sc= 1.05 USER MOD Set 1.2: A 148 THR OG1 : rot 154:sc= 0.789 USER MOD Set 2.1: A 94 HIS : no HE2:sc= 0.435 K(o=-0.9,f=-5.8) USER MOD Set 2.2: A 137 TYR OH : rot -25:sc= -1.34 USER MOD Set 3.1: A 86 ASN : amide:sc= -0.216 K(o=-1.7,f=-2.6) USER MOD Set 3.2: A 89 SER OG : rot -66:sc= -1.5 USER MOD Set 4.1: A 87 THR OG1 : rot 180:sc= 0.739 USER MOD Set 4.2: A 124 THR OG1 : rot 136:sc= 0.731 USER MOD Set 5.1: A 67 MET CE :methyl -130:sc= -11.7! (180deg=-12.5!) USER MOD Set 5.2: A 71 TYR OH : rot 56:sc= 1.3 USER MOD Set 6.1: A 25 GLN : amide:sc= -0.0663 X(o=-0.44,f=-0.44) USER MOD Set 6.2: A 27 HIS : no HE2:sc= -0.369 K(o=-0.44,f=-9.6!) USER MOD Set 7.1: A 16 LYS NZ :NH3+ 152:sc= 0.117 (180deg=-0.0415) USER MOD Set 7.2: A 58 THR OG1 : rot 180:sc= 0.11 USER MOD Set 8.1: A 4 TYR OH : rot 180:sc= -0.0114 USER MOD Set 8.2: A 51 CYS SG : rot 6:sc= -1.18 USER MOD Set 9.1: A 1 MET CE :methyl -135:sc= -0.347 (180deg=-1.46!) USER MOD Set 9.2: A 43 GLN : amide:sc= -1.09 K(o=-1.4,f=-11!) USER MOD Single : A 1 MET N :NH3+ -141:sc= 1.27 (180deg=0.0648) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 137:sc= -1.4 (180deg=-1.89) USER MOD Single : A 20 THR OG1 : rot -110:sc= 0.0069 USER MOD Single : A 22 GLN : amide:sc= -0.352 K(o=-0.35,f=-2.3) USER MOD Single : A 26 ASN : amide:sc= -0.624 X(o=-0.62,f=-0.35) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= -0.36 USER MOD Single : A 40 TYR OH : rot 150:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ 138:sc= 2.3 (180deg=0.796) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 SER OG : rot -67:sc= -0.0453 USER MOD Single : A 70 GLN : amide:sc= -0.813 K(o=-0.81,f=-7.2!) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 74 THR OG1 : rot -14:sc= -0.315 USER MOD Single : A 80 CYS SG : rot 180:sc= 0 USER MOD Single : A 85 ASN : amide:sc= -4.85! C(o=-4.8!,f=-9.5!) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -1.1 K(o=-1.1,f=-3.7!) USER MOD Single : A 96 TYR OH : rot 110:sc= -1.41 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 LYS NZ :NH3+ -164:sc= -0.414 (180deg=-1.02) USER MOD Single : A 104 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 SER OG : rot 35:sc= 1.06 USER MOD Single : A 111 MET CE :methyl -158:sc= -4.17! (180deg=-7.16!) USER MOD Single : A 116 ASN : amide:sc= -1.37! C(o=-1.4!,f=-12!) USER MOD Single : A 117 LYS NZ :NH3+ -157:sc= -1.38 (180deg=-2.46!) USER MOD Single : A 118 CYS SG : rot -37:sc= -0.0529 USER MOD Single : A 127 SER OG : rot -105:sc= 0.671 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 141 TYR OH : rot 25:sc= 0.00436 USER MOD Single : A 144 THR OG1 : rot -160:sc= -0.0171 USER MOD Single : A 147 LYS NZ :NH3+ -119:sc= 0.691 (180deg=-1.17) USER MOD Single : A 150 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 157 TYR OH : rot 141:sc= 0.8 USER MOD Single : A 158 THR OG1 : rot 63:sc= 0.562 USER MOD Single : A 165 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 166 HIS : no HD1:sc= -0.0786 X(o=-0.079,f=-0.23) USER MOD Single : A 201 GNP O2' : rot -153:sc= -0.0826 USER MOD Single : A 201 GNP O3' : rot 133:sc= 0.092 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.913 -3.280 22.383 1.00 1.51 N ATOM 2 CA MET A 1 -5.219 -2.636 21.080 1.00 21.10 C ATOM 3 C MET A 1 -5.287 -3.663 19.956 1.00 34.04 C ATOM 4 O MET A 1 -4.630 -4.703 20.007 1.00 21.31 O ATOM 5 CB MET A 1 -4.138 -1.595 20.782 1.00 51.20 C ATOM 6 CG MET A 1 -2.749 -2.190 20.621 1.00 0.02 C ATOM 7 SD MET A 1 -1.895 -2.394 22.196 1.00 23.54 S ATOM 8 CE MET A 1 -1.826 -0.698 22.766 1.00 44.15 C ATOM 0 H1 MET A 1 -5.470 -2.825 23.134 1.00 1.51 H new ATOM 0 H2 MET A 1 -5.155 -4.290 22.336 1.00 1.51 H new ATOM 0 H3 MET A 1 -3.900 -3.176 22.592 1.00 1.51 H new ATOM 0 HA MET A 1 -6.195 -2.156 21.142 1.00 21.10 H new ATOM 0 HB2 MET A 1 -4.403 -1.059 19.870 1.00 51.20 H new ATOM 0 HB3 MET A 1 -4.119 -0.862 21.588 1.00 51.20 H new ATOM 0 HG2 MET A 1 -2.828 -3.158 20.127 1.00 0.02 H new ATOM 0 HG3 MET A 1 -2.156 -1.547 19.971 1.00 0.02 H new ATOM 0 HE1 MET A 1 -0.828 -0.483 23.148 1.00 44.15 H new ATOM 0 HE2 MET A 1 -2.050 -0.026 21.937 1.00 44.15 H new ATOM 0 HE3 MET A 1 -2.558 -0.551 23.560 1.00 44.15 H new ATOM 18 N THR A 2 -6.090 -3.360 18.945 1.00 2.01 N ATOM 19 CA THR A 2 -6.257 -4.247 17.802 1.00 72.45 C ATOM 20 C THR A 2 -5.057 -4.152 16.860 1.00 61.43 C ATOM 21 O THR A 2 -4.454 -3.089 16.710 1.00 22.10 O ATOM 22 CB THR A 2 -7.561 -3.903 17.070 1.00 30.23 C ATOM 23 OG1 THR A 2 -8.587 -4.812 17.426 1.00 15.42 O ATOM 24 CG2 THR A 2 -7.445 -3.918 15.562 1.00 22.11 C ATOM 0 H THR A 2 -6.639 -2.502 18.894 1.00 2.01 H new ATOM 0 HA THR A 2 -6.314 -5.276 18.157 1.00 72.45 H new ATOM 0 HB THR A 2 -7.796 -2.885 17.382 1.00 30.23 H new ATOM 0 HG1 THR A 2 -9.412 -4.577 16.951 1.00 15.42 H new ATOM 0 HG21 THR A 2 -8.409 -3.665 15.120 1.00 22.11 H new ATOM 0 HG22 THR A 2 -6.699 -3.189 15.247 1.00 22.11 H new ATOM 0 HG23 THR A 2 -7.144 -4.912 15.230 1.00 22.11 H new ATOM 32 N GLU A 3 -4.720 -5.272 16.226 1.00 65.13 N ATOM 33 CA GLU A 3 -3.596 -5.318 15.297 1.00 64.42 C ATOM 34 C GLU A 3 -4.089 -5.338 13.853 1.00 62.34 C ATOM 35 O GLU A 3 -4.801 -6.255 13.442 1.00 15.55 O ATOM 36 CB GLU A 3 -2.727 -6.548 15.574 1.00 75.21 C ATOM 37 CG GLU A 3 -1.369 -6.212 16.167 1.00 33.04 C ATOM 38 CD GLU A 3 -0.522 -7.444 16.421 1.00 71.34 C ATOM 39 OE1 GLU A 3 -0.879 -8.234 17.321 1.00 3.42 O ATOM 40 OE2 GLU A 3 0.497 -7.620 15.721 1.00 0.23 O ATOM 0 H GLU A 3 -5.210 -6.160 16.339 1.00 65.13 H new ATOM 0 HA GLU A 3 -2.995 -4.421 15.444 1.00 64.42 H new ATOM 0 HB2 GLU A 3 -3.258 -7.212 16.256 1.00 75.21 H new ATOM 0 HB3 GLU A 3 -2.582 -7.097 14.644 1.00 75.21 H new ATOM 0 HG2 GLU A 3 -0.837 -5.543 15.491 1.00 33.04 H new ATOM 0 HG3 GLU A 3 -1.509 -5.673 17.104 1.00 33.04 H new ATOM 47 N TYR A 4 -3.709 -4.319 13.089 1.00 53.22 N ATOM 48 CA TYR A 4 -4.117 -4.218 11.693 1.00 34.01 C ATOM 49 C TYR A 4 -2.956 -4.533 10.756 1.00 74.43 C ATOM 50 O TYR A 4 -1.946 -3.829 10.742 1.00 21.00 O ATOM 51 CB TYR A 4 -4.657 -2.817 11.402 1.00 10.03 C ATOM 52 CG TYR A 4 -6.022 -2.562 12.000 1.00 42.24 C ATOM 53 CD1 TYR A 4 -7.117 -3.332 11.630 1.00 3.42 C ATOM 54 CD2 TYR A 4 -6.215 -1.553 12.935 1.00 2.52 C ATOM 55 CE1 TYR A 4 -8.367 -3.103 12.173 1.00 71.33 C ATOM 56 CE2 TYR A 4 -7.461 -1.318 13.483 1.00 62.24 C ATOM 57 CZ TYR A 4 -8.534 -2.095 13.099 1.00 21.33 C ATOM 58 OH TYR A 4 -9.776 -1.865 13.644 1.00 15.14 O ATOM 0 H TYR A 4 -3.120 -3.552 13.413 1.00 53.22 H new ATOM 0 HA TYR A 4 -4.905 -4.951 11.518 1.00 34.01 H new ATOM 0 HB2 TYR A 4 -3.955 -2.078 11.789 1.00 10.03 H new ATOM 0 HB3 TYR A 4 -4.709 -2.673 10.323 1.00 10.03 H new ATOM 0 HD1 TYR A 4 -6.989 -4.123 10.906 1.00 3.42 H new ATOM 0 HD2 TYR A 4 -5.377 -0.942 13.238 1.00 2.52 H new ATOM 0 HE1 TYR A 4 -9.209 -3.710 11.874 1.00 71.33 H new ATOM 0 HE2 TYR A 4 -7.594 -0.529 14.209 1.00 62.24 H new ATOM 0 HH TYR A 4 -9.722 -1.121 14.280 1.00 15.14 H new ATOM 68 N LYS A 5 -3.111 -5.594 9.970 1.00 51.51 N ATOM 69 CA LYS A 5 -2.080 -6.004 9.025 1.00 74.41 C ATOM 70 C LYS A 5 -2.205 -5.227 7.718 1.00 34.04 C ATOM 71 O LYS A 5 -3.117 -5.468 6.927 1.00 5.01 O ATOM 72 CB LYS A 5 -2.187 -7.505 8.749 1.00 44.33 C ATOM 73 CG LYS A 5 -0.884 -8.260 8.960 1.00 34.54 C ATOM 74 CD LYS A 5 -0.040 -8.279 7.696 1.00 15.02 C ATOM 75 CE LYS A 5 1.184 -9.166 7.859 1.00 20.02 C ATOM 76 NZ LYS A 5 2.313 -8.719 6.997 1.00 40.00 N ATOM 0 H LYS A 5 -3.942 -6.185 9.970 1.00 51.51 H new ATOM 0 HA LYS A 5 -1.107 -5.788 9.465 1.00 74.41 H new ATOM 0 HB2 LYS A 5 -2.953 -7.931 9.398 1.00 44.33 H new ATOM 0 HB3 LYS A 5 -2.521 -7.654 7.722 1.00 44.33 H new ATOM 0 HG2 LYS A 5 -0.320 -7.795 9.768 1.00 34.54 H new ATOM 0 HG3 LYS A 5 -1.101 -9.282 9.269 1.00 34.54 H new ATOM 0 HD2 LYS A 5 -0.642 -8.637 6.860 1.00 15.02 H new ATOM 0 HD3 LYS A 5 0.274 -7.264 7.451 1.00 15.02 H new ATOM 0 HE2 LYS A 5 1.500 -9.161 8.902 1.00 20.02 H new ATOM 0 HE3 LYS A 5 0.923 -10.195 7.610 1.00 20.02 H new ATOM 0 HZ1 LYS A 5 3.200 -8.758 7.539 1.00 40.00 H new ATOM 0 HZ2 LYS A 5 2.386 -9.344 6.169 1.00 40.00 H new ATOM 0 HZ3 LYS A 5 2.143 -7.743 6.681 1.00 40.00 H new ATOM 90 N LEU A 6 -1.285 -4.296 7.497 1.00 4.33 N ATOM 91 CA LEU A 6 -1.298 -3.488 6.284 1.00 65.20 C ATOM 92 C LEU A 6 -0.353 -4.067 5.235 1.00 74.02 C ATOM 93 O LEU A 6 0.847 -3.791 5.246 1.00 51.05 O ATOM 94 CB LEU A 6 -0.905 -2.045 6.605 1.00 63.50 C ATOM 95 CG LEU A 6 -2.005 -1.205 7.256 1.00 24.12 C ATOM 96 CD1 LEU A 6 -3.222 -1.123 6.348 1.00 21.44 C ATOM 97 CD2 LEU A 6 -2.386 -1.787 8.610 1.00 44.20 C ATOM 0 H LEU A 6 -0.523 -4.082 8.140 1.00 4.33 H new ATOM 0 HA LEU A 6 -2.310 -3.499 5.879 1.00 65.20 H new ATOM 0 HB2 LEU A 6 -0.039 -2.059 7.267 1.00 63.50 H new ATOM 0 HB3 LEU A 6 -0.593 -1.556 5.682 1.00 63.50 H new ATOM 0 HG LEU A 6 -1.624 -0.195 7.409 1.00 24.12 H new ATOM 0 HD11 LEU A 6 -3.994 -0.522 6.828 1.00 21.44 H new ATOM 0 HD12 LEU A 6 -2.939 -0.663 5.401 1.00 21.44 H new ATOM 0 HD13 LEU A 6 -3.606 -2.126 6.163 1.00 21.44 H new ATOM 0 HD21 LEU A 6 -3.170 -1.178 9.060 1.00 44.20 H new ATOM 0 HD22 LEU A 6 -2.749 -2.806 8.479 1.00 44.20 H new ATOM 0 HD23 LEU A 6 -1.512 -1.794 9.262 1.00 44.20 H new ATOM 109 N VAL A 7 -0.903 -4.871 4.331 1.00 31.14 N ATOM 110 CA VAL A 7 -0.114 -5.490 3.277 1.00 51.11 C ATOM 111 C VAL A 7 0.068 -4.541 2.098 1.00 63.33 C ATOM 112 O VAL A 7 -0.872 -4.277 1.349 1.00 24.45 O ATOM 113 CB VAL A 7 -0.772 -6.789 2.778 1.00 70.53 C ATOM 114 CG1 VAL A 7 0.144 -7.509 1.804 1.00 54.21 C ATOM 115 CG2 VAL A 7 -1.130 -7.690 3.950 1.00 32.42 C ATOM 0 H VAL A 7 -1.895 -5.108 4.309 1.00 31.14 H new ATOM 0 HA VAL A 7 0.861 -5.724 3.705 1.00 51.11 H new ATOM 0 HB VAL A 7 -1.692 -6.531 2.254 1.00 70.53 H new ATOM 0 HG11 VAL A 7 -0.337 -8.425 1.461 1.00 54.21 H new ATOM 0 HG12 VAL A 7 0.346 -6.863 0.949 1.00 54.21 H new ATOM 0 HG13 VAL A 7 1.082 -7.756 2.301 1.00 54.21 H new ATOM 0 HG21 VAL A 7 -1.594 -8.603 3.578 1.00 32.42 H new ATOM 0 HG22 VAL A 7 -0.226 -7.942 4.505 1.00 32.42 H new ATOM 0 HG23 VAL A 7 -1.827 -7.171 4.608 1.00 32.42 H new ATOM 125 N VAL A 8 1.285 -4.032 1.938 1.00 43.14 N ATOM 126 CA VAL A 8 1.592 -3.115 0.853 1.00 12.55 C ATOM 127 C VAL A 8 2.067 -3.871 -0.384 1.00 74.34 C ATOM 128 O VAL A 8 2.818 -4.841 -0.280 1.00 64.43 O ATOM 129 CB VAL A 8 2.674 -2.103 1.272 1.00 2.21 C ATOM 130 CG1 VAL A 8 2.920 -1.094 0.164 1.00 0.32 C ATOM 131 CG2 VAL A 8 2.277 -1.402 2.562 1.00 45.23 C ATOM 0 H VAL A 8 2.075 -4.241 2.549 1.00 43.14 H new ATOM 0 HA VAL A 8 0.674 -2.578 0.615 1.00 12.55 H new ATOM 0 HB VAL A 8 3.603 -2.645 1.450 1.00 2.21 H new ATOM 0 HG11 VAL A 8 3.688 -0.387 0.479 1.00 0.32 H new ATOM 0 HG12 VAL A 8 3.252 -1.614 -0.734 1.00 0.32 H new ATOM 0 HG13 VAL A 8 1.997 -0.555 -0.049 1.00 0.32 H new ATOM 0 HG21 VAL A 8 3.053 -0.690 2.843 1.00 45.23 H new ATOM 0 HG22 VAL A 8 1.336 -0.873 2.414 1.00 45.23 H new ATOM 0 HG23 VAL A 8 2.157 -2.140 3.355 1.00 45.23 H new ATOM 141 N VAL A 9 1.626 -3.420 -1.552 1.00 53.54 N ATOM 142 CA VAL A 9 2.007 -4.052 -2.808 1.00 60.11 C ATOM 143 C VAL A 9 2.300 -3.008 -3.880 1.00 4.03 C ATOM 144 O VAL A 9 2.241 -1.806 -3.621 1.00 70.43 O ATOM 145 CB VAL A 9 0.908 -5.006 -3.317 1.00 10.03 C ATOM 146 CG1 VAL A 9 0.650 -6.111 -2.304 1.00 45.10 C ATOM 147 CG2 VAL A 9 -0.372 -4.241 -3.618 1.00 31.02 C ATOM 0 H VAL A 9 1.004 -2.618 -1.655 1.00 53.54 H new ATOM 0 HA VAL A 9 2.910 -4.629 -2.611 1.00 60.11 H new ATOM 0 HB VAL A 9 1.254 -5.465 -4.243 1.00 10.03 H new ATOM 0 HG11 VAL A 9 -0.129 -6.775 -2.680 1.00 45.10 H new ATOM 0 HG12 VAL A 9 1.566 -6.680 -2.145 1.00 45.10 H new ATOM 0 HG13 VAL A 9 0.327 -5.671 -1.360 1.00 45.10 H new ATOM 0 HG21 VAL A 9 -1.134 -4.933 -3.976 1.00 31.02 H new ATOM 0 HG22 VAL A 9 -0.725 -3.750 -2.711 1.00 31.02 H new ATOM 0 HG23 VAL A 9 -0.176 -3.490 -4.384 1.00 31.02 H new ATOM 157 N GLY A 10 2.615 -3.473 -5.083 1.00 33.31 N ATOM 158 CA GLY A 10 2.913 -2.565 -6.175 1.00 5.31 C ATOM 159 C GLY A 10 4.209 -2.914 -6.877 1.00 2.21 C ATOM 160 O GLY A 10 5.075 -3.573 -6.302 1.00 32.21 O ATOM 0 H GLY A 10 2.669 -4.463 -5.322 1.00 33.31 H new ATOM 0 HA2 GLY A 10 2.095 -2.586 -6.895 1.00 5.31 H new ATOM 0 HA3 GLY A 10 2.973 -1.547 -5.791 1.00 5.31 H new ATOM 164 N ALA A 11 4.344 -2.470 -8.122 1.00 13.04 N ATOM 165 CA ALA A 11 5.546 -2.741 -8.902 1.00 1.04 C ATOM 166 C ALA A 11 6.794 -2.255 -8.171 1.00 30.44 C ATOM 167 O ALA A 11 6.738 -1.304 -7.392 1.00 1.24 O ATOM 168 CB ALA A 11 5.444 -2.086 -10.271 1.00 44.40 C ATOM 0 H ALA A 11 3.637 -1.922 -8.612 1.00 13.04 H new ATOM 0 HA ALA A 11 5.631 -3.820 -9.033 1.00 1.04 H new ATOM 0 HB1 ALA A 11 6.348 -2.296 -10.843 1.00 44.40 H new ATOM 0 HB2 ALA A 11 4.578 -2.484 -10.801 1.00 44.40 H new ATOM 0 HB3 ALA A 11 5.333 -1.008 -10.151 1.00 44.40 H new ATOM 174 N GLY A 12 7.919 -2.917 -8.425 1.00 43.21 N ATOM 175 CA GLY A 12 9.166 -2.540 -7.781 1.00 13.30 C ATOM 176 C GLY A 12 9.478 -1.062 -7.927 1.00 35.11 C ATOM 177 O GLY A 12 10.203 -0.492 -7.111 1.00 3.21 O ATOM 0 H GLY A 12 7.990 -3.708 -9.065 1.00 43.21 H new ATOM 0 HA2 GLY A 12 9.114 -2.793 -6.722 1.00 13.30 H new ATOM 0 HA3 GLY A 12 9.982 -3.123 -8.209 1.00 13.30 H new ATOM 181 N GLY A 13 8.931 -0.440 -8.967 1.00 1.44 N ATOM 182 CA GLY A 13 9.168 0.973 -9.194 1.00 52.30 C ATOM 183 C GLY A 13 7.916 1.811 -9.018 1.00 65.25 C ATOM 184 O GLY A 13 7.419 2.403 -9.975 1.00 74.42 O ATOM 0 H GLY A 13 8.328 -0.890 -9.656 1.00 1.44 H new ATOM 0 HA2 GLY A 13 9.935 1.324 -8.504 1.00 52.30 H new ATOM 0 HA3 GLY A 13 9.557 1.115 -10.202 1.00 52.30 H new ATOM 188 N VAL A 14 7.407 1.863 -7.791 1.00 2.43 N ATOM 189 CA VAL A 14 6.207 2.638 -7.495 1.00 1.44 C ATOM 190 C VAL A 14 6.317 3.345 -6.145 1.00 31.23 C ATOM 191 O VAL A 14 5.315 3.794 -5.589 1.00 53.41 O ATOM 192 CB VAL A 14 4.948 1.749 -7.495 1.00 4.21 C ATOM 193 CG1 VAL A 14 4.762 1.087 -8.851 1.00 73.23 C ATOM 194 CG2 VAL A 14 5.024 0.706 -6.389 1.00 33.25 C ATOM 0 H VAL A 14 7.806 1.379 -6.987 1.00 2.43 H new ATOM 0 HA VAL A 14 6.117 3.385 -8.283 1.00 1.44 H new ATOM 0 HB VAL A 14 4.082 2.382 -7.303 1.00 4.21 H new ATOM 0 HG11 VAL A 14 3.868 0.463 -8.832 1.00 73.23 H new ATOM 0 HG12 VAL A 14 4.653 1.854 -9.618 1.00 73.23 H new ATOM 0 HG13 VAL A 14 5.631 0.469 -9.076 1.00 73.23 H new ATOM 0 HG21 VAL A 14 4.125 0.090 -6.408 1.00 33.25 H new ATOM 0 HG22 VAL A 14 5.900 0.075 -6.543 1.00 33.25 H new ATOM 0 HG23 VAL A 14 5.102 1.205 -5.423 1.00 33.25 H new ATOM 204 N GLY A 15 7.537 3.442 -5.622 1.00 2.02 N ATOM 205 CA GLY A 15 7.746 4.097 -4.343 1.00 34.21 C ATOM 206 C GLY A 15 6.881 3.517 -3.241 1.00 40.34 C ATOM 207 O GLY A 15 6.568 4.199 -2.265 1.00 62.45 O ATOM 0 H GLY A 15 8.383 3.079 -6.061 1.00 2.02 H new ATOM 0 HA2 GLY A 15 8.795 4.008 -4.061 1.00 34.21 H new ATOM 0 HA3 GLY A 15 7.533 5.161 -4.445 1.00 34.21 H new ATOM 211 N LYS A 16 6.492 2.255 -3.395 1.00 34.24 N ATOM 212 CA LYS A 16 5.658 1.585 -2.404 1.00 42.02 C ATOM 213 C LYS A 16 6.343 1.568 -1.040 1.00 15.23 C ATOM 214 O LYS A 16 5.718 1.847 -0.017 1.00 51.51 O ATOM 215 CB LYS A 16 5.348 0.154 -2.849 1.00 32.20 C ATOM 216 CG LYS A 16 6.589 -0.681 -3.121 1.00 2.55 C ATOM 217 CD LYS A 16 6.246 -1.971 -3.852 1.00 62.14 C ATOM 218 CE LYS A 16 6.671 -3.194 -3.055 1.00 53.11 C ATOM 219 NZ LYS A 16 5.916 -3.315 -1.778 1.00 72.35 N ATOM 0 H LYS A 16 6.741 1.676 -4.197 1.00 34.24 H new ATOM 0 HA LYS A 16 4.724 2.141 -2.316 1.00 42.02 H new ATOM 0 HB2 LYS A 16 4.752 -0.336 -2.079 1.00 32.20 H new ATOM 0 HB3 LYS A 16 4.738 0.187 -3.751 1.00 32.20 H new ATOM 0 HG2 LYS A 16 7.295 -0.102 -3.716 1.00 2.55 H new ATOM 0 HG3 LYS A 16 7.084 -0.916 -2.179 1.00 2.55 H new ATOM 0 HD2 LYS A 16 5.173 -2.011 -4.037 1.00 62.14 H new ATOM 0 HD3 LYS A 16 6.738 -1.981 -4.825 1.00 62.14 H new ATOM 0 HE2 LYS A 16 6.515 -4.090 -3.655 1.00 53.11 H new ATOM 0 HE3 LYS A 16 7.738 -3.135 -2.841 1.00 53.11 H new ATOM 0 HZ1 LYS A 16 5.856 -4.316 -1.504 1.00 72.35 H new ATOM 0 HZ2 LYS A 16 6.406 -2.780 -1.033 1.00 72.35 H new ATOM 0 HZ3 LYS A 16 4.957 -2.933 -1.904 1.00 72.35 H new ATOM 233 N SER A 17 7.631 1.239 -1.034 1.00 54.00 N ATOM 234 CA SER A 17 8.401 1.187 0.203 1.00 21.23 C ATOM 235 C SER A 17 8.608 2.586 0.779 1.00 23.42 C ATOM 236 O SER A 17 8.804 2.748 1.984 1.00 10.40 O ATOM 237 CB SER A 17 9.757 0.521 -0.044 1.00 1.12 C ATOM 238 OG SER A 17 10.477 1.189 -1.066 1.00 45.24 O ATOM 0 H SER A 17 8.163 1.004 -1.872 1.00 54.00 H new ATOM 0 HA SER A 17 7.838 0.597 0.926 1.00 21.23 H new ATOM 0 HB2 SER A 17 10.340 0.524 0.877 1.00 1.12 H new ATOM 0 HB3 SER A 17 9.608 -0.522 -0.323 1.00 1.12 H new ATOM 244 N ALA A 18 8.565 3.593 -0.089 1.00 72.20 N ATOM 245 CA ALA A 18 8.750 4.977 0.333 1.00 62.34 C ATOM 246 C ALA A 18 7.747 5.366 1.415 1.00 54.04 C ATOM 247 O ALA A 18 8.121 5.898 2.460 1.00 62.52 O ATOM 248 CB ALA A 18 8.627 5.910 -0.861 1.00 40.43 C ATOM 0 H ALA A 18 8.404 3.476 -1.089 1.00 72.20 H new ATOM 0 HA ALA A 18 9.750 5.070 0.756 1.00 62.34 H new ATOM 0 HB1 ALA A 18 8.767 6.940 -0.534 1.00 40.43 H new ATOM 0 HB2 ALA A 18 9.388 5.658 -1.600 1.00 40.43 H new ATOM 0 HB3 ALA A 18 7.638 5.802 -1.307 1.00 40.43 H new ATOM 254 N LEU A 19 6.471 5.100 1.155 1.00 31.24 N ATOM 255 CA LEU A 19 5.413 5.426 2.106 1.00 64.10 C ATOM 256 C LEU A 19 5.613 4.680 3.422 1.00 33.41 C ATOM 257 O LEU A 19 5.304 5.199 4.494 1.00 10.22 O ATOM 258 CB LEU A 19 4.044 5.082 1.515 1.00 13.24 C ATOM 259 CG LEU A 19 3.779 5.651 0.120 1.00 24.44 C ATOM 260 CD1 LEU A 19 2.918 4.695 -0.691 1.00 31.41 C ATOM 261 CD2 LEU A 19 3.114 7.016 0.219 1.00 13.23 C ATOM 0 H LEU A 19 6.144 4.660 0.295 1.00 31.24 H new ATOM 0 HA LEU A 19 5.457 6.497 2.306 1.00 64.10 H new ATOM 0 HB2 LEU A 19 3.946 3.997 1.473 1.00 13.24 H new ATOM 0 HB3 LEU A 19 3.271 5.446 2.192 1.00 13.24 H new ATOM 0 HG LEU A 19 4.734 5.770 -0.391 1.00 24.44 H new ATOM 0 HD11 LEU A 19 2.740 5.116 -1.680 1.00 31.41 H new ATOM 0 HD12 LEU A 19 3.431 3.739 -0.791 1.00 31.41 H new ATOM 0 HD13 LEU A 19 1.965 4.544 -0.184 1.00 31.41 H new ATOM 0 HD21 LEU A 19 2.933 7.406 -0.783 1.00 13.23 H new ATOM 0 HD22 LEU A 19 2.166 6.921 0.749 1.00 13.23 H new ATOM 0 HD23 LEU A 19 3.766 7.700 0.762 1.00 13.23 H new ATOM 273 N THR A 20 6.131 3.459 3.331 1.00 62.33 N ATOM 274 CA THR A 20 6.371 2.639 4.514 1.00 32.41 C ATOM 275 C THR A 20 7.296 3.349 5.499 1.00 25.33 C ATOM 276 O THR A 20 6.945 3.546 6.662 1.00 12.20 O ATOM 277 CB THR A 20 6.975 1.293 4.112 1.00 53.41 C ATOM 278 OG1 THR A 20 6.316 0.767 2.973 1.00 33.44 O ATOM 279 CG2 THR A 20 6.899 0.252 5.207 1.00 0.05 C ATOM 0 H THR A 20 6.393 3.015 2.451 1.00 62.33 H new ATOM 0 HA THR A 20 5.412 2.471 5.005 1.00 32.41 H new ATOM 0 HB THR A 20 8.024 1.499 3.901 1.00 53.41 H new ATOM 0 HG1 THR A 20 5.788 -0.017 3.233 1.00 33.44 H new ATOM 0 HG21 THR A 20 7.345 -0.679 4.856 1.00 0.05 H new ATOM 0 HG22 THR A 20 7.441 0.606 6.084 1.00 0.05 H new ATOM 0 HG23 THR A 20 5.856 0.078 5.471 1.00 0.05 H new ATOM 287 N ILE A 21 8.478 3.731 5.026 1.00 43.22 N ATOM 288 CA ILE A 21 9.450 4.415 5.859 1.00 42.32 C ATOM 289 C ILE A 21 8.944 5.801 6.256 1.00 41.53 C ATOM 290 O ILE A 21 9.230 6.286 7.351 1.00 3.31 O ATOM 291 CB ILE A 21 10.803 4.534 5.123 1.00 15.14 C ATOM 292 CG1 ILE A 21 11.572 3.215 5.215 1.00 54.42 C ATOM 293 CG2 ILE A 21 11.633 5.673 5.686 1.00 33.32 C ATOM 294 CD1 ILE A 21 10.946 2.092 4.417 1.00 31.12 C ATOM 0 H ILE A 21 8.783 3.576 4.065 1.00 43.22 H new ATOM 0 HA ILE A 21 9.593 3.827 6.765 1.00 42.32 H new ATOM 0 HB ILE A 21 10.602 4.752 4.074 1.00 15.14 H new ATOM 0 HG12 ILE A 21 12.592 3.374 4.865 1.00 54.42 H new ATOM 0 HG13 ILE A 21 11.637 2.914 6.261 1.00 54.42 H new ATOM 0 HG21 ILE A 21 12.580 5.733 5.149 1.00 33.32 H new ATOM 0 HG22 ILE A 21 11.090 6.611 5.570 1.00 33.32 H new ATOM 0 HG23 ILE A 21 11.826 5.494 6.744 1.00 33.32 H new ATOM 0 HD11 ILE A 21 11.545 1.188 4.529 1.00 31.12 H new ATOM 0 HD12 ILE A 21 9.936 1.906 4.782 1.00 31.12 H new ATOM 0 HD13 ILE A 21 10.906 2.372 3.364 1.00 31.12 H new ATOM 306 N GLN A 22 8.193 6.432 5.360 1.00 41.03 N ATOM 307 CA GLN A 22 7.648 7.759 5.620 1.00 1.14 C ATOM 308 C GLN A 22 6.603 7.709 6.730 1.00 14.54 C ATOM 309 O GLN A 22 6.665 8.478 7.689 1.00 14.42 O ATOM 310 CB GLN A 22 7.031 8.338 4.345 1.00 24.34 C ATOM 311 CG GLN A 22 7.978 9.235 3.565 1.00 63.15 C ATOM 312 CD GLN A 22 8.263 10.541 4.280 1.00 11.30 C ATOM 313 OE1 GLN A 22 7.447 11.025 5.064 1.00 65.13 O ATOM 314 NE2 GLN A 22 9.428 11.120 4.011 1.00 54.34 N ATOM 0 H GLN A 22 7.948 6.046 4.448 1.00 41.03 H new ATOM 0 HA GLN A 22 8.464 8.404 5.944 1.00 1.14 H new ATOM 0 HB2 GLN A 22 6.708 7.519 3.703 1.00 24.34 H new ATOM 0 HB3 GLN A 22 6.139 8.907 4.609 1.00 24.34 H new ATOM 0 HG2 GLN A 22 8.916 8.706 3.394 1.00 63.15 H new ATOM 0 HG3 GLN A 22 7.548 9.447 2.586 1.00 63.15 H new ATOM 0 HE21 GLN A 22 10.075 10.683 3.354 1.00 54.34 H new ATOM 0 HE22 GLN A 22 9.676 12.001 4.461 1.00 54.34 H new ATOM 323 N LEU A 23 5.645 6.798 6.593 1.00 1.31 N ATOM 324 CA LEU A 23 4.588 6.647 7.585 1.00 21.11 C ATOM 325 C LEU A 23 5.159 6.174 8.918 1.00 33.43 C ATOM 326 O LEU A 23 4.907 6.776 9.961 1.00 30.02 O ATOM 327 CB LEU A 23 3.531 5.657 7.090 1.00 64.52 C ATOM 328 CG LEU A 23 2.200 5.697 7.843 1.00 50.23 C ATOM 329 CD1 LEU A 23 2.367 5.149 9.252 1.00 13.22 C ATOM 330 CD2 LEU A 23 1.653 7.116 7.883 1.00 12.45 C ATOM 0 H LEU A 23 5.579 6.154 5.805 1.00 1.31 H new ATOM 0 HA LEU A 23 4.121 7.621 7.734 1.00 21.11 H new ATOM 0 HB2 LEU A 23 3.339 5.852 6.035 1.00 64.52 H new ATOM 0 HB3 LEU A 23 3.939 4.649 7.159 1.00 64.52 H new ATOM 0 HG LEU A 23 1.485 5.068 7.313 1.00 50.23 H new ATOM 0 HD11 LEU A 23 1.410 5.185 9.772 1.00 13.22 H new ATOM 0 HD12 LEU A 23 2.714 4.117 9.202 1.00 13.22 H new ATOM 0 HD13 LEU A 23 3.097 5.751 9.793 1.00 13.22 H new ATOM 0 HD21 LEU A 23 0.706 7.126 8.422 1.00 12.45 H new ATOM 0 HD22 LEU A 23 2.366 7.767 8.390 1.00 12.45 H new ATOM 0 HD23 LEU A 23 1.495 7.474 6.866 1.00 12.45 H new ATOM 342 N ILE A 24 5.930 5.093 8.874 1.00 73.33 N ATOM 343 CA ILE A 24 6.538 4.539 10.077 1.00 24.54 C ATOM 344 C ILE A 24 7.514 5.531 10.701 1.00 51.22 C ATOM 345 O ILE A 24 7.384 5.894 11.870 1.00 32.10 O ATOM 346 CB ILE A 24 7.281 3.222 9.776 1.00 61.24 C ATOM 347 CG1 ILE A 24 6.318 2.193 9.181 1.00 43.42 C ATOM 348 CG2 ILE A 24 7.936 2.676 11.038 1.00 71.01 C ATOM 349 CD1 ILE A 24 5.307 1.666 10.177 1.00 34.51 C ATOM 0 H ILE A 24 6.148 4.583 8.018 1.00 73.33 H new ATOM 0 HA ILE A 24 5.729 4.337 10.779 1.00 24.54 H new ATOM 0 HB ILE A 24 8.064 3.425 9.046 1.00 61.24 H new ATOM 0 HG12 ILE A 24 5.788 2.645 8.342 1.00 43.42 H new ATOM 0 HG13 ILE A 24 6.893 1.357 8.782 1.00 43.42 H new ATOM 0 HG21 ILE A 24 8.455 1.746 10.805 1.00 71.01 H new ATOM 0 HG22 ILE A 24 8.650 3.405 11.422 1.00 71.01 H new ATOM 0 HG23 ILE A 24 7.172 2.486 11.792 1.00 71.01 H new ATOM 0 HD11 ILE A 24 4.657 0.941 9.687 1.00 34.51 H new ATOM 0 HD12 ILE A 24 5.828 1.185 11.004 1.00 34.51 H new ATOM 0 HD13 ILE A 24 4.707 2.492 10.558 1.00 34.51 H new ATOM 361 N GLN A 25 8.492 5.964 9.914 1.00 22.11 N ATOM 362 CA GLN A 25 9.489 6.909 10.386 1.00 62.24 C ATOM 363 C GLN A 25 9.224 8.301 9.789 1.00 14.15 C ATOM 364 O GLN A 25 8.100 8.798 9.863 1.00 11.25 O ATOM 365 CB GLN A 25 10.890 6.386 10.040 1.00 64.15 C ATOM 366 CG GLN A 25 11.140 4.967 10.524 1.00 60.15 C ATOM 367 CD GLN A 25 12.587 4.543 10.362 1.00 53.13 C ATOM 368 OE1 GLN A 25 13.478 5.063 11.033 1.00 45.33 O ATOM 369 NE2 GLN A 25 12.828 3.592 9.466 1.00 14.32 N ATOM 0 H GLN A 25 8.613 5.673 8.944 1.00 22.11 H new ATOM 0 HA GLN A 25 9.427 7.008 11.470 1.00 62.24 H new ATOM 0 HB2 GLN A 25 11.027 6.423 8.959 1.00 64.15 H new ATOM 0 HB3 GLN A 25 11.636 7.049 10.479 1.00 64.15 H new ATOM 0 HG2 GLN A 25 10.858 4.890 11.574 1.00 60.15 H new ATOM 0 HG3 GLN A 25 10.500 4.280 9.971 1.00 60.15 H new ATOM 0 HE21 GLN A 25 12.059 3.188 8.931 1.00 14.32 H new ATOM 0 HE22 GLN A 25 13.782 3.266 9.313 1.00 14.32 H new ATOM 378 N ASN A 26 10.241 8.933 9.200 1.00 62.44 N ATOM 379 CA ASN A 26 10.075 10.258 8.606 1.00 61.03 C ATOM 380 C ASN A 26 11.406 10.788 8.080 1.00 54.44 C ATOM 381 O ASN A 26 11.714 11.972 8.221 1.00 54.43 O ATOM 382 CB ASN A 26 9.492 11.239 9.629 1.00 23.24 C ATOM 383 CG ASN A 26 10.052 11.031 11.024 1.00 40.21 C ATOM 384 OD1 ASN A 26 9.327 10.664 11.949 1.00 41.12 O ATOM 385 ND2 ASN A 26 11.350 11.266 11.183 1.00 30.22 N ATOM 0 H ASN A 26 11.183 8.550 9.122 1.00 62.44 H new ATOM 0 HA ASN A 26 9.381 10.165 7.770 1.00 61.03 H new ATOM 0 HB2 ASN A 26 9.699 12.259 9.307 1.00 23.24 H new ATOM 0 HB3 ASN A 26 8.408 11.128 9.657 1.00 23.24 H new ATOM 0 HD21 ASN A 26 11.782 11.144 12.099 1.00 30.22 H new ATOM 0 HD22 ASN A 26 11.914 11.569 10.389 1.00 30.22 H new ATOM 392 N HIS A 27 12.195 9.904 7.476 1.00 10.23 N ATOM 393 CA HIS A 27 13.496 10.283 6.934 1.00 72.23 C ATOM 394 C HIS A 27 13.632 9.888 5.464 1.00 25.33 C ATOM 395 O HIS A 27 14.601 10.262 4.804 1.00 3.13 O ATOM 396 CB HIS A 27 14.611 9.627 7.744 1.00 60.13 C ATOM 397 CG HIS A 27 14.556 8.131 7.739 1.00 11.12 C ATOM 398 ND1 HIS A 27 14.708 7.375 6.595 1.00 54.52 N ATOM 399 CD2 HIS A 27 14.367 7.248 8.748 1.00 44.45 C ATOM 400 CE1 HIS A 27 14.614 6.093 6.901 1.00 72.53 C ATOM 401 NE2 HIS A 27 14.408 5.989 8.201 1.00 62.45 N ATOM 0 H HIS A 27 11.956 8.920 7.350 1.00 10.23 H new ATOM 0 HA HIS A 27 13.578 11.368 7.002 1.00 72.23 H new ATOM 0 HB2 HIS A 27 15.574 9.948 7.347 1.00 60.13 H new ATOM 0 HB3 HIS A 27 14.557 9.981 8.774 1.00 60.13 H new ATOM 0 HD1 HIS A 27 14.868 7.748 5.659 1.00 54.52 H new ATOM 0 HD2 HIS A 27 14.213 7.489 9.789 1.00 44.45 H new ATOM 0 HE1 HIS A 27 14.692 5.270 6.206 1.00 72.53 H new ATOM 410 N PHE A 28 12.664 9.126 4.961 1.00 51.31 N ATOM 411 CA PHE A 28 12.679 8.671 3.572 1.00 5.14 C ATOM 412 C PHE A 28 13.688 7.544 3.386 1.00 13.44 C ATOM 413 O PHE A 28 14.776 7.572 3.961 1.00 62.34 O ATOM 414 CB PHE A 28 13.004 9.828 2.620 1.00 61.21 C ATOM 415 CG PHE A 28 12.761 9.502 1.174 1.00 4.00 C ATOM 416 CD1 PHE A 28 11.537 9.004 0.757 1.00 25.50 C ATOM 417 CD2 PHE A 28 13.758 9.693 0.231 1.00 44.11 C ATOM 418 CE1 PHE A 28 11.312 8.703 -0.573 1.00 54.21 C ATOM 419 CE2 PHE A 28 13.539 9.393 -1.100 1.00 63.42 C ATOM 420 CZ PHE A 28 12.314 8.898 -1.503 1.00 63.00 C ATOM 0 H PHE A 28 11.856 8.809 5.497 1.00 51.31 H new ATOM 0 HA PHE A 28 11.684 8.295 3.333 1.00 5.14 H new ATOM 0 HB2 PHE A 28 12.402 10.694 2.895 1.00 61.21 H new ATOM 0 HB3 PHE A 28 14.048 10.112 2.749 1.00 61.21 H new ATOM 0 HD1 PHE A 28 10.750 8.849 1.480 1.00 25.50 H new ATOM 0 HD2 PHE A 28 14.717 10.081 0.540 1.00 44.11 H new ATOM 0 HE1 PHE A 28 10.353 8.316 -0.885 1.00 54.21 H new ATOM 0 HE2 PHE A 28 14.325 9.545 -1.825 1.00 63.42 H new ATOM 0 HZ PHE A 28 12.140 8.664 -2.543 1.00 63.00 H new ATOM 430 N VAL A 29 13.320 6.551 2.581 1.00 54.54 N ATOM 431 CA VAL A 29 14.193 5.411 2.323 1.00 64.34 C ATOM 432 C VAL A 29 15.594 5.865 1.922 1.00 53.22 C ATOM 433 O VAL A 29 15.777 6.960 1.389 1.00 11.43 O ATOM 434 CB VAL A 29 13.611 4.495 1.224 1.00 70.12 C ATOM 435 CG1 VAL A 29 14.634 3.463 0.767 1.00 24.03 C ATOM 436 CG2 VAL A 29 12.351 3.809 1.726 1.00 0.40 C ATOM 0 H VAL A 29 12.423 6.513 2.096 1.00 54.54 H new ATOM 0 HA VAL A 29 14.260 4.845 3.252 1.00 64.34 H new ATOM 0 HB VAL A 29 13.357 5.116 0.365 1.00 70.12 H new ATOM 0 HG11 VAL A 29 14.195 2.833 -0.007 1.00 24.03 H new ATOM 0 HG12 VAL A 29 15.510 3.972 0.366 1.00 24.03 H new ATOM 0 HG13 VAL A 29 14.930 2.844 1.614 1.00 24.03 H new ATOM 0 HG21 VAL A 29 11.950 3.166 0.942 1.00 0.40 H new ATOM 0 HG22 VAL A 29 12.589 3.207 2.603 1.00 0.40 H new ATOM 0 HG23 VAL A 29 11.609 4.561 1.993 1.00 0.40 H new ATOM 446 N ASP A 30 16.576 5.012 2.187 1.00 50.33 N ATOM 447 CA ASP A 30 17.965 5.311 1.862 1.00 51.43 C ATOM 448 C ASP A 30 18.874 4.153 2.261 1.00 2.22 C ATOM 449 O ASP A 30 19.823 3.822 1.550 1.00 41.35 O ATOM 450 CB ASP A 30 18.414 6.591 2.573 1.00 40.04 C ATOM 451 CG ASP A 30 19.835 6.983 2.216 1.00 24.11 C ATOM 452 OD1 ASP A 30 20.178 6.944 1.016 1.00 33.03 O ATOM 453 OD2 ASP A 30 20.604 7.329 3.138 1.00 32.24 O ATOM 0 H ASP A 30 16.435 4.103 2.628 1.00 50.33 H new ATOM 0 HA ASP A 30 18.038 5.457 0.784 1.00 51.43 H new ATOM 0 HB2 ASP A 30 17.739 7.405 2.310 1.00 40.04 H new ATOM 0 HB3 ASP A 30 18.339 6.450 3.651 1.00 40.04 H new ATOM 458 N GLU A 31 18.578 3.544 3.405 1.00 21.24 N ATOM 459 CA GLU A 31 19.369 2.427 3.903 1.00 72.12 C ATOM 460 C GLU A 31 18.528 1.526 4.804 1.00 35.51 C ATOM 461 O GLU A 31 17.956 1.981 5.795 1.00 53.11 O ATOM 462 CB GLU A 31 20.592 2.951 4.663 1.00 63.41 C ATOM 463 CG GLU A 31 21.286 1.904 5.521 1.00 65.05 C ATOM 464 CD GLU A 31 21.599 0.633 4.754 1.00 73.15 C ATOM 465 OE1 GLU A 31 21.740 0.706 3.516 1.00 71.11 O ATOM 466 OE2 GLU A 31 21.704 -0.435 5.393 1.00 45.33 O ATOM 0 H GLU A 31 17.795 3.806 4.004 1.00 21.24 H new ATOM 0 HA GLU A 31 19.707 1.834 3.053 1.00 72.12 H new ATOM 0 HB2 GLU A 31 21.309 3.350 3.945 1.00 63.41 H new ATOM 0 HB3 GLU A 31 20.283 3.780 5.300 1.00 63.41 H new ATOM 0 HG2 GLU A 31 22.211 2.321 5.918 1.00 65.05 H new ATOM 0 HG3 GLU A 31 20.653 1.662 6.375 1.00 65.05 H new ATOM 473 N TYR A 32 18.460 0.246 4.454 1.00 53.24 N ATOM 474 CA TYR A 32 17.694 -0.722 5.231 1.00 12.20 C ATOM 475 C TYR A 32 18.381 -2.083 5.227 1.00 62.21 C ATOM 476 O TYR A 32 19.099 -2.424 4.287 1.00 64.11 O ATOM 477 CB TYR A 32 16.275 -0.850 4.673 1.00 73.05 C ATOM 478 CG TYR A 32 16.223 -0.961 3.166 1.00 42.34 C ATOM 479 CD1 TYR A 32 16.506 -2.163 2.529 1.00 22.40 C ATOM 480 CD2 TYR A 32 15.890 0.135 2.381 1.00 22.44 C ATOM 481 CE1 TYR A 32 16.458 -2.269 1.151 1.00 22.23 C ATOM 482 CE2 TYR A 32 15.840 0.037 1.003 1.00 13.35 C ATOM 483 CZ TYR A 32 16.125 -1.166 0.394 1.00 10.10 C ATOM 484 OH TYR A 32 16.077 -1.267 -0.978 1.00 34.35 O ATOM 0 H TYR A 32 18.927 -0.146 3.636 1.00 53.24 H new ATOM 0 HA TYR A 32 17.639 -0.365 6.259 1.00 12.20 H new ATOM 0 HB2 TYR A 32 15.800 -1.728 5.110 1.00 73.05 H new ATOM 0 HB3 TYR A 32 15.692 0.016 4.985 1.00 73.05 H new ATOM 0 HD1 TYR A 32 16.768 -3.029 3.120 1.00 22.40 H new ATOM 0 HD2 TYR A 32 15.666 1.079 2.855 1.00 22.44 H new ATOM 0 HE1 TYR A 32 16.680 -3.210 0.671 1.00 22.23 H new ATOM 0 HE2 TYR A 32 15.579 0.899 0.407 1.00 13.35 H new ATOM 0 HH TYR A 32 15.826 -0.401 -1.361 1.00 34.35 H new ATOM 494 N ASP A 33 18.158 -2.857 6.284 1.00 14.12 N ATOM 495 CA ASP A 33 18.758 -4.181 6.402 1.00 71.51 C ATOM 496 C ASP A 33 18.022 -5.193 5.523 1.00 0.32 C ATOM 497 O ASP A 33 16.804 -5.336 5.620 1.00 42.11 O ATOM 498 CB ASP A 33 18.738 -4.646 7.859 1.00 24.32 C ATOM 499 CG ASP A 33 19.185 -3.562 8.821 1.00 4.40 C ATOM 500 OD1 ASP A 33 20.405 -3.308 8.905 1.00 61.15 O ATOM 501 OD2 ASP A 33 18.314 -2.965 9.489 1.00 64.34 O ATOM 0 H ASP A 33 17.566 -2.590 7.071 1.00 14.12 H new ATOM 0 HA ASP A 33 19.792 -4.115 6.063 1.00 71.51 H new ATOM 0 HB2 ASP A 33 17.730 -4.966 8.121 1.00 24.32 H new ATOM 0 HB3 ASP A 33 19.387 -5.515 7.969 1.00 24.32 H new ATOM 506 N PRO A 34 18.753 -5.912 4.651 1.00 4.11 N ATOM 507 CA PRO A 34 18.157 -6.910 3.759 1.00 54.31 C ATOM 508 C PRO A 34 17.797 -8.202 4.487 1.00 51.41 C ATOM 509 O PRO A 34 16.984 -8.991 4.005 1.00 51.41 O ATOM 510 CB PRO A 34 19.261 -7.163 2.734 1.00 12.32 C ATOM 511 CG PRO A 34 20.526 -6.901 3.474 1.00 72.44 C ATOM 512 CD PRO A 34 20.215 -5.808 4.463 1.00 11.22 C ATOM 0 HA PRO A 34 17.220 -6.563 3.324 1.00 54.31 H new ATOM 0 HB2 PRO A 34 19.226 -8.185 2.358 1.00 12.32 H new ATOM 0 HB3 PRO A 34 19.161 -6.503 1.873 1.00 12.32 H new ATOM 0 HG2 PRO A 34 20.872 -7.800 3.984 1.00 72.44 H new ATOM 0 HG3 PRO A 34 21.320 -6.595 2.792 1.00 72.44 H new ATOM 0 HD2 PRO A 34 20.751 -5.952 5.401 1.00 11.22 H new ATOM 0 HD3 PRO A 34 20.501 -4.828 4.080 1.00 11.22 H new ATOM 520 N SER A 35 18.408 -8.415 5.649 1.00 11.20 N ATOM 521 CA SER A 35 18.153 -9.613 6.441 1.00 71.11 C ATOM 522 C SER A 35 16.676 -9.723 6.810 1.00 74.12 C ATOM 523 O SER A 35 16.149 -10.823 6.978 1.00 60.32 O ATOM 524 CB SER A 35 19.007 -9.601 7.710 1.00 4.45 C ATOM 525 OG SER A 35 20.388 -9.547 7.395 1.00 62.22 O ATOM 0 H SER A 35 19.084 -7.773 6.063 1.00 11.20 H new ATOM 0 HA SER A 35 18.421 -10.479 5.836 1.00 71.11 H new ATOM 0 HB2 SER A 35 18.737 -8.743 8.325 1.00 4.45 H new ATOM 0 HB3 SER A 35 18.800 -10.494 8.300 1.00 4.45 H new ATOM 0 HG SER A 35 20.912 -9.539 8.223 1.00 62.22 H new ATOM 531 N ILE A 36 16.015 -8.578 6.938 1.00 4.20 N ATOM 532 CA ILE A 36 14.599 -8.548 7.290 1.00 63.51 C ATOM 533 C ILE A 36 13.731 -8.260 6.076 1.00 13.10 C ATOM 534 O ILE A 36 14.231 -8.084 4.965 1.00 50.52 O ATOM 535 CB ILE A 36 14.307 -7.498 8.380 1.00 4.44 C ATOM 536 CG1 ILE A 36 14.964 -6.164 8.032 1.00 71.03 C ATOM 537 CG2 ILE A 36 14.799 -7.990 9.728 1.00 1.03 C ATOM 538 CD1 ILE A 36 14.056 -4.971 8.238 1.00 54.44 C ATOM 0 H ILE A 36 16.436 -7.659 6.804 1.00 4.20 H new ATOM 0 HA ILE A 36 14.355 -9.537 7.677 1.00 63.51 H new ATOM 0 HB ILE A 36 13.229 -7.347 8.433 1.00 4.44 H new ATOM 0 HG12 ILE A 36 15.859 -6.039 8.642 1.00 71.03 H new ATOM 0 HG13 ILE A 36 15.288 -6.188 6.992 1.00 71.03 H new ATOM 0 HG21 ILE A 36 14.587 -7.239 10.489 1.00 1.03 H new ATOM 0 HG22 ILE A 36 14.291 -8.920 9.984 1.00 1.03 H new ATOM 0 HG23 ILE A 36 15.874 -8.165 9.681 1.00 1.03 H new ATOM 0 HD11 ILE A 36 14.588 -4.058 7.971 1.00 54.44 H new ATOM 0 HD12 ILE A 36 13.172 -5.073 7.608 1.00 54.44 H new ATOM 0 HD13 ILE A 36 13.752 -4.921 9.284 1.00 54.44 H new ATOM 550 N GLU A 37 12.425 -8.228 6.298 1.00 35.22 N ATOM 551 CA GLU A 37 11.473 -7.977 5.227 1.00 51.20 C ATOM 552 C GLU A 37 11.130 -6.490 5.115 1.00 35.12 C ATOM 553 O GLU A 37 10.165 -6.117 4.447 1.00 1.40 O ATOM 554 CB GLU A 37 10.209 -8.812 5.459 1.00 73.30 C ATOM 555 CG GLU A 37 9.155 -8.127 6.318 1.00 35.40 C ATOM 556 CD GLU A 37 8.308 -9.114 7.098 1.00 1.23 C ATOM 557 OE1 GLU A 37 7.423 -9.749 6.488 1.00 32.05 O ATOM 558 OE2 GLU A 37 8.530 -9.250 8.320 1.00 31.23 O ATOM 0 H GLU A 37 12.000 -8.373 7.214 1.00 35.22 H new ATOM 0 HA GLU A 37 11.930 -8.272 4.283 1.00 51.20 H new ATOM 0 HB2 GLU A 37 9.769 -9.060 4.493 1.00 73.30 H new ATOM 0 HB3 GLU A 37 10.491 -9.753 5.932 1.00 73.30 H new ATOM 0 HG2 GLU A 37 9.645 -7.445 7.013 1.00 35.40 H new ATOM 0 HG3 GLU A 37 8.509 -7.523 5.681 1.00 35.40 H new ATOM 565 N ASP A 38 11.926 -5.645 5.765 1.00 2.31 N ATOM 566 CA ASP A 38 11.705 -4.203 5.727 1.00 13.34 C ATOM 567 C ASP A 38 10.305 -3.840 6.215 1.00 24.14 C ATOM 568 O ASP A 38 9.761 -2.798 5.850 1.00 2.14 O ATOM 569 CB ASP A 38 11.904 -3.680 4.308 1.00 61.24 C ATOM 570 CG ASP A 38 13.277 -4.013 3.756 1.00 21.25 C ATOM 571 OD1 ASP A 38 14.280 -3.698 4.430 1.00 61.54 O ATOM 572 OD2 ASP A 38 13.348 -4.588 2.649 1.00 4.12 O ATOM 0 H ASP A 38 12.729 -5.934 6.324 1.00 2.31 H new ATOM 0 HA ASP A 38 12.430 -3.738 6.394 1.00 13.34 H new ATOM 0 HB2 ASP A 38 11.141 -4.105 3.657 1.00 61.24 H new ATOM 0 HB3 ASP A 38 11.764 -2.599 4.299 1.00 61.24 H new ATOM 577 N SER A 39 9.726 -4.705 7.039 1.00 12.53 N ATOM 578 CA SER A 39 8.388 -4.473 7.574 1.00 52.32 C ATOM 579 C SER A 39 8.455 -3.789 8.936 1.00 63.35 C ATOM 580 O SER A 39 9.404 -3.985 9.695 1.00 0.32 O ATOM 581 CB SER A 39 7.627 -5.795 7.691 1.00 33.24 C ATOM 582 OG SER A 39 6.374 -5.606 8.326 1.00 63.21 O ATOM 0 H SER A 39 10.161 -5.573 7.352 1.00 12.53 H new ATOM 0 HA SER A 39 7.858 -3.816 6.885 1.00 52.32 H new ATOM 0 HB2 SER A 39 7.475 -6.220 6.699 1.00 33.24 H new ATOM 0 HB3 SER A 39 8.221 -6.512 8.258 1.00 33.24 H new ATOM 0 HG SER A 39 5.906 -6.465 8.388 1.00 63.21 H new ATOM 588 N TYR A 40 7.439 -2.986 9.239 1.00 14.42 N ATOM 589 CA TYR A 40 7.381 -2.272 10.512 1.00 43.33 C ATOM 590 C TYR A 40 5.941 -2.161 11.004 1.00 52.01 C ATOM 591 O TYR A 40 5.004 -2.544 10.305 1.00 15.53 O ATOM 592 CB TYR A 40 7.988 -0.872 10.377 1.00 1.21 C ATOM 593 CG TYR A 40 9.085 -0.771 9.341 1.00 44.31 C ATOM 594 CD1 TYR A 40 10.413 -0.995 9.681 1.00 33.50 C ATOM 595 CD2 TYR A 40 8.792 -0.449 8.022 1.00 72.44 C ATOM 596 CE1 TYR A 40 11.418 -0.902 8.737 1.00 21.40 C ATOM 597 CE2 TYR A 40 9.791 -0.354 7.071 1.00 1.51 C ATOM 598 CZ TYR A 40 11.101 -0.581 7.434 1.00 44.43 C ATOM 599 OH TYR A 40 12.099 -0.487 6.490 1.00 3.51 O ATOM 0 H TYR A 40 6.645 -2.813 8.622 1.00 14.42 H new ATOM 0 HA TYR A 40 7.961 -2.840 11.239 1.00 43.33 H new ATOM 0 HB2 TYR A 40 7.196 -0.168 10.122 1.00 1.21 H new ATOM 0 HB3 TYR A 40 8.387 -0.566 11.344 1.00 1.21 H new ATOM 0 HD1 TYR A 40 10.665 -1.246 10.701 1.00 33.50 H new ATOM 0 HD2 TYR A 40 7.767 -0.270 7.734 1.00 72.44 H new ATOM 0 HE1 TYR A 40 12.446 -1.080 9.018 1.00 21.40 H new ATOM 0 HE2 TYR A 40 9.546 -0.103 6.049 1.00 1.51 H new ATOM 0 HH TYR A 40 11.742 -0.731 5.611 1.00 3.51 H new ATOM 609 N ARG A 41 5.774 -1.631 12.212 1.00 73.32 N ATOM 610 CA ARG A 41 4.448 -1.465 12.796 1.00 25.43 C ATOM 611 C ARG A 41 4.390 -0.211 13.663 1.00 55.24 C ATOM 612 O ARG A 41 5.267 0.022 14.494 1.00 2.43 O ATOM 613 CB ARG A 41 4.072 -2.698 13.624 1.00 1.45 C ATOM 614 CG ARG A 41 4.832 -2.811 14.937 1.00 25.50 C ATOM 615 CD ARG A 41 5.143 -4.259 15.277 1.00 74.15 C ATOM 616 NE ARG A 41 6.237 -4.373 16.238 1.00 22.34 N ATOM 617 CZ ARG A 41 6.664 -5.529 16.742 1.00 32.11 C ATOM 618 NH1 ARG A 41 6.093 -6.670 16.379 1.00 60.04 N ATOM 619 NH2 ARG A 41 7.665 -5.543 17.612 1.00 73.01 N ATOM 0 H ARG A 41 6.540 -1.310 12.805 1.00 73.32 H new ATOM 0 HA ARG A 41 3.730 -1.354 11.983 1.00 25.43 H new ATOM 0 HB2 ARG A 41 3.003 -2.670 13.835 1.00 1.45 H new ATOM 0 HB3 ARG A 41 4.256 -3.593 13.030 1.00 1.45 H new ATOM 0 HG2 ARG A 41 5.761 -2.244 14.871 1.00 25.50 H new ATOM 0 HG3 ARG A 41 4.243 -2.366 15.739 1.00 25.50 H new ATOM 0 HD2 ARG A 41 4.251 -4.735 15.685 1.00 74.15 H new ATOM 0 HD3 ARG A 41 5.403 -4.797 14.366 1.00 74.15 H new ATOM 0 HE ARG A 41 6.701 -3.517 16.541 1.00 22.34 H new ATOM 0 HH11 ARG A 41 5.323 -6.665 15.710 1.00 60.04 H new ATOM 0 HH12 ARG A 41 6.424 -7.553 16.768 1.00 60.04 H new ATOM 0 HH21 ARG A 41 8.107 -4.668 17.895 1.00 73.01 H new ATOM 0 HH22 ARG A 41 7.992 -6.428 17.998 1.00 73.01 H new ATOM 633 N LYS A 42 3.352 0.594 13.463 1.00 73.40 N ATOM 634 CA LYS A 42 3.181 1.825 14.226 1.00 62.43 C ATOM 635 C LYS A 42 1.842 1.831 14.956 1.00 62.21 C ATOM 636 O LYS A 42 0.860 1.266 14.478 1.00 12.11 O ATOM 637 CB LYS A 42 3.275 3.040 13.303 1.00 10.23 C ATOM 638 CG LYS A 42 3.522 4.347 14.039 1.00 32.12 C ATOM 639 CD LYS A 42 3.701 5.506 13.073 1.00 43.22 C ATOM 640 CE LYS A 42 4.563 6.604 13.675 1.00 3.22 C ATOM 641 NZ LYS A 42 5.263 7.398 12.628 1.00 11.30 N ATOM 0 H LYS A 42 2.616 0.416 12.779 1.00 73.40 H new ATOM 0 HA LYS A 42 3.979 1.877 14.966 1.00 62.43 H new ATOM 0 HB2 LYS A 42 4.080 2.879 12.586 1.00 10.23 H new ATOM 0 HB3 LYS A 42 2.351 3.124 12.732 1.00 10.23 H new ATOM 0 HG2 LYS A 42 2.685 4.554 14.706 1.00 32.12 H new ATOM 0 HG3 LYS A 42 4.411 4.252 14.663 1.00 32.12 H new ATOM 0 HD2 LYS A 42 4.159 5.146 12.152 1.00 43.22 H new ATOM 0 HD3 LYS A 42 2.726 5.913 12.806 1.00 43.22 H new ATOM 0 HE2 LYS A 42 3.940 7.266 14.276 1.00 3.22 H new ATOM 0 HE3 LYS A 42 5.298 6.161 14.347 1.00 3.22 H new ATOM 0 HZ1 LYS A 42 5.225 8.408 12.875 1.00 11.30 H new ATOM 0 HZ2 LYS A 42 6.256 7.093 12.567 1.00 11.30 H new ATOM 0 HZ3 LYS A 42 4.798 7.248 11.710 1.00 11.30 H new ATOM 655 N GLN A 43 1.811 2.477 16.116 1.00 13.04 N ATOM 656 CA GLN A 43 0.593 2.561 16.913 1.00 25.22 C ATOM 657 C GLN A 43 -0.037 3.945 16.792 1.00 5.53 C ATOM 658 O GLN A 43 0.598 4.955 17.096 1.00 4.10 O ATOM 659 CB GLN A 43 0.894 2.252 18.380 1.00 42.11 C ATOM 660 CG GLN A 43 -0.349 2.045 19.227 1.00 12.13 C ATOM 661 CD GLN A 43 -0.021 1.581 20.626 1.00 61.04 C ATOM 662 OE1 GLN A 43 0.340 0.424 20.844 1.00 2.42 O ATOM 663 NE2 GLN A 43 -0.147 2.485 21.584 1.00 62.35 N ATOM 0 H GLN A 43 2.616 2.951 16.526 1.00 13.04 H new ATOM 0 HA GLN A 43 -0.113 1.823 16.533 1.00 25.22 H new ATOM 0 HB2 GLN A 43 1.513 1.356 18.434 1.00 42.11 H new ATOM 0 HB3 GLN A 43 1.479 3.070 18.802 1.00 42.11 H new ATOM 0 HG2 GLN A 43 -0.910 2.978 19.279 1.00 12.13 H new ATOM 0 HG3 GLN A 43 -0.995 1.311 18.746 1.00 12.13 H new ATOM 0 HE21 GLN A 43 -0.449 3.432 21.355 1.00 62.35 H new ATOM 0 HE22 GLN A 43 0.058 2.235 22.551 1.00 62.35 H new ATOM 672 N VAL A 44 -1.288 3.985 16.343 1.00 71.31 N ATOM 673 CA VAL A 44 -1.999 5.247 16.181 1.00 45.03 C ATOM 674 C VAL A 44 -3.419 5.156 16.729 1.00 74.15 C ATOM 675 O VAL A 44 -3.852 4.100 17.191 1.00 62.43 O ATOM 676 CB VAL A 44 -2.058 5.670 14.701 1.00 62.21 C ATOM 677 CG1 VAL A 44 -0.659 5.917 14.160 1.00 41.24 C ATOM 678 CG2 VAL A 44 -2.779 4.618 13.871 1.00 12.42 C ATOM 0 H VAL A 44 -1.829 3.159 16.086 1.00 71.31 H new ATOM 0 HA VAL A 44 -1.444 5.996 16.745 1.00 45.03 H new ATOM 0 HB VAL A 44 -2.620 6.601 14.632 1.00 62.21 H new ATOM 0 HG11 VAL A 44 -0.721 6.215 13.113 1.00 41.24 H new ATOM 0 HG12 VAL A 44 -0.181 6.710 14.735 1.00 41.24 H new ATOM 0 HG13 VAL A 44 -0.070 5.003 14.243 1.00 41.24 H new ATOM 0 HG21 VAL A 44 -2.810 4.935 12.829 1.00 12.42 H new ATOM 0 HG22 VAL A 44 -2.248 3.669 13.946 1.00 12.42 H new ATOM 0 HG23 VAL A 44 -3.796 4.495 14.243 1.00 12.42 H new ATOM 688 N VAL A 45 -4.140 6.272 16.673 1.00 24.44 N ATOM 689 CA VAL A 45 -5.513 6.322 17.162 1.00 1.41 C ATOM 690 C VAL A 45 -6.481 6.677 16.038 1.00 14.02 C ATOM 691 O VAL A 45 -6.610 7.842 15.662 1.00 51.44 O ATOM 692 CB VAL A 45 -5.668 7.348 18.300 1.00 71.20 C ATOM 693 CG1 VAL A 45 -7.052 7.250 18.923 1.00 73.33 C ATOM 694 CG2 VAL A 45 -4.586 7.149 19.350 1.00 73.20 C ATOM 0 H VAL A 45 -3.796 7.154 16.294 1.00 24.44 H new ATOM 0 HA VAL A 45 -5.750 5.329 17.545 1.00 1.41 H new ATOM 0 HB VAL A 45 -5.554 8.348 17.881 1.00 71.20 H new ATOM 0 HG11 VAL A 45 -7.143 7.983 19.725 1.00 73.33 H new ATOM 0 HG12 VAL A 45 -7.808 7.448 18.163 1.00 73.33 H new ATOM 0 HG13 VAL A 45 -7.199 6.249 19.328 1.00 73.33 H new ATOM 0 HG21 VAL A 45 -4.712 7.883 20.146 1.00 73.20 H new ATOM 0 HG22 VAL A 45 -4.664 6.145 19.767 1.00 73.20 H new ATOM 0 HG23 VAL A 45 -3.606 7.276 18.891 1.00 73.20 H new ATOM 704 N ILE A 46 -7.157 5.665 15.504 1.00 50.30 N ATOM 705 CA ILE A 46 -8.112 5.872 14.421 1.00 12.40 C ATOM 706 C ILE A 46 -9.530 5.526 14.864 1.00 43.44 C ATOM 707 O ILE A 46 -9.752 4.524 15.544 1.00 74.01 O ATOM 708 CB ILE A 46 -7.751 5.027 13.185 1.00 44.34 C ATOM 709 CG1 ILE A 46 -6.278 5.222 12.821 1.00 55.22 C ATOM 710 CG2 ILE A 46 -8.646 5.394 12.011 1.00 11.12 C ATOM 711 CD1 ILE A 46 -5.753 4.184 11.853 1.00 33.13 C ATOM 0 H ILE A 46 -7.062 4.694 15.803 1.00 50.30 H new ATOM 0 HA ILE A 46 -8.065 6.928 14.156 1.00 12.40 H new ATOM 0 HB ILE A 46 -7.912 3.975 13.423 1.00 44.34 H new ATOM 0 HG12 ILE A 46 -6.148 6.213 12.385 1.00 55.22 H new ATOM 0 HG13 ILE A 46 -5.680 5.193 13.732 1.00 55.22 H new ATOM 0 HG21 ILE A 46 -8.378 4.788 11.146 1.00 11.12 H new ATOM 0 HG22 ILE A 46 -9.687 5.209 12.275 1.00 11.12 H new ATOM 0 HG23 ILE A 46 -8.515 6.449 11.770 1.00 11.12 H new ATOM 0 HD11 ILE A 46 -4.703 4.384 11.639 1.00 33.13 H new ATOM 0 HD12 ILE A 46 -5.851 3.192 12.294 1.00 33.13 H new ATOM 0 HD13 ILE A 46 -6.326 4.227 10.927 1.00 33.13 H new ATOM 723 N ASP A 47 -10.486 6.362 14.473 1.00 21.31 N ATOM 724 CA ASP A 47 -11.884 6.145 14.828 1.00 61.22 C ATOM 725 C ASP A 47 -12.067 6.152 16.342 1.00 1.22 C ATOM 726 O ASP A 47 -12.907 5.430 16.879 1.00 42.13 O ATOM 727 CB ASP A 47 -12.380 4.819 14.248 1.00 41.22 C ATOM 728 CG ASP A 47 -13.839 4.877 13.841 1.00 63.12 C ATOM 729 OD1 ASP A 47 -14.680 5.231 14.693 1.00 32.34 O ATOM 730 OD2 ASP A 47 -14.141 4.567 12.669 1.00 32.24 O ATOM 0 H ASP A 47 -10.318 7.196 13.910 1.00 21.31 H new ATOM 0 HA ASP A 47 -12.471 6.960 14.405 1.00 61.22 H new ATOM 0 HB2 ASP A 47 -11.774 4.555 13.381 1.00 41.22 H new ATOM 0 HB3 ASP A 47 -12.242 4.029 14.986 1.00 41.22 H new ATOM 735 N GLY A 48 -11.275 6.973 17.025 1.00 22.30 N ATOM 736 CA GLY A 48 -11.365 7.058 18.470 1.00 63.24 C ATOM 737 C GLY A 48 -11.062 5.737 19.149 1.00 53.33 C ATOM 738 O GLY A 48 -11.562 5.463 20.240 1.00 11.22 O ATOM 0 H GLY A 48 -10.573 7.581 16.603 1.00 22.30 H new ATOM 0 HA2 GLY A 48 -10.669 7.816 18.830 1.00 63.24 H new ATOM 0 HA3 GLY A 48 -12.366 7.385 18.750 1.00 63.24 H new ATOM 742 N GLU A 49 -10.241 4.916 18.502 1.00 43.34 N ATOM 743 CA GLU A 49 -9.873 3.616 19.050 1.00 52.34 C ATOM 744 C GLU A 49 -8.409 3.297 18.761 1.00 10.20 C ATOM 745 O GLU A 49 -8.016 3.124 17.608 1.00 55.33 O ATOM 746 CB GLU A 49 -10.770 2.522 18.467 1.00 41.15 C ATOM 747 CG GLU A 49 -10.462 1.132 19.003 1.00 34.14 C ATOM 748 CD GLU A 49 -11.676 0.459 19.612 1.00 35.43 C ATOM 749 OE1 GLU A 49 -12.140 0.920 20.676 1.00 35.00 O ATOM 750 OE2 GLU A 49 -12.163 -0.531 19.026 1.00 43.33 O ATOM 0 H GLU A 49 -9.818 5.128 17.598 1.00 43.34 H new ATOM 0 HA GLU A 49 -10.011 3.653 20.131 1.00 52.34 H new ATOM 0 HB2 GLU A 49 -11.811 2.763 18.683 1.00 41.15 H new ATOM 0 HB3 GLU A 49 -10.663 2.516 17.382 1.00 41.15 H new ATOM 0 HG2 GLU A 49 -10.075 0.512 18.194 1.00 34.14 H new ATOM 0 HG3 GLU A 49 -9.675 1.203 19.754 1.00 34.14 H new ATOM 757 N THR A 50 -7.607 3.221 19.818 1.00 4.52 N ATOM 758 CA THR A 50 -6.186 2.922 19.680 1.00 5.30 C ATOM 759 C THR A 50 -5.978 1.538 19.072 1.00 22.02 C ATOM 760 O THR A 50 -6.449 0.536 19.609 1.00 41.21 O ATOM 761 CB THR A 50 -5.493 3.004 21.042 1.00 24.32 C ATOM 762 OG1 THR A 50 -5.646 4.295 21.605 1.00 64.03 O ATOM 763 CG2 THR A 50 -4.010 2.704 20.981 1.00 74.31 C ATOM 0 H THR A 50 -7.917 3.362 20.780 1.00 4.52 H new ATOM 0 HA THR A 50 -5.747 3.662 19.011 1.00 5.30 H new ATOM 0 HB THR A 50 -5.975 2.244 21.656 1.00 24.32 H new ATOM 0 HG1 THR A 50 -5.198 4.327 22.476 1.00 64.03 H new ATOM 0 HG21 THR A 50 -3.582 2.780 21.981 1.00 74.31 H new ATOM 0 HG22 THR A 50 -3.858 1.695 20.597 1.00 74.31 H new ATOM 0 HG23 THR A 50 -3.521 3.421 20.321 1.00 74.31 H new ATOM 771 N CYS A 51 -5.268 1.492 17.949 1.00 11.11 N ATOM 772 CA CYS A 51 -4.996 0.232 17.267 1.00 52.02 C ATOM 773 C CYS A 51 -3.614 0.251 16.623 1.00 13.11 C ATOM 774 O CYS A 51 -3.112 1.307 16.237 1.00 73.22 O ATOM 775 CB CYS A 51 -6.063 -0.040 16.205 1.00 72.14 C ATOM 776 SG CYS A 51 -7.727 -0.272 16.872 1.00 12.12 S ATOM 0 H CYS A 51 -4.871 2.313 17.492 1.00 11.11 H new ATOM 0 HA CYS A 51 -5.022 -0.566 18.009 1.00 52.02 H new ATOM 0 HB2 CYS A 51 -6.079 0.791 15.500 1.00 72.14 H new ATOM 0 HB3 CYS A 51 -5.781 -0.930 15.642 1.00 72.14 H new ATOM 0 HG CYS A 51 -7.717 -0.046 18.152 1.00 12.12 H new ATOM 782 N LEU A 52 -3.002 -0.923 16.510 1.00 32.41 N ATOM 783 CA LEU A 52 -1.677 -1.040 15.913 1.00 44.44 C ATOM 784 C LEU A 52 -1.771 -1.117 14.392 1.00 45.12 C ATOM 785 O LEU A 52 -2.736 -1.651 13.845 1.00 4.22 O ATOM 786 CB LEU A 52 -0.956 -2.276 16.459 1.00 64.14 C ATOM 787 CG LEU A 52 0.301 -1.984 17.279 1.00 23.13 C ATOM 788 CD1 LEU A 52 1.323 -1.230 16.442 1.00 31.12 C ATOM 789 CD2 LEU A 52 -0.052 -1.195 18.531 1.00 74.12 C ATOM 0 H LEU A 52 -3.403 -1.807 16.824 1.00 32.41 H new ATOM 0 HA LEU A 52 -1.105 -0.150 16.177 1.00 44.44 H new ATOM 0 HB2 LEU A 52 -1.653 -2.840 17.079 1.00 64.14 H new ATOM 0 HB3 LEU A 52 -0.684 -2.918 15.621 1.00 64.14 H new ATOM 0 HG LEU A 52 0.742 -2.933 17.583 1.00 23.13 H new ATOM 0 HD11 LEU A 52 2.210 -1.031 17.043 1.00 31.12 H new ATOM 0 HD12 LEU A 52 1.599 -1.831 15.576 1.00 31.12 H new ATOM 0 HD13 LEU A 52 0.893 -0.286 16.107 1.00 31.12 H new ATOM 0 HD21 LEU A 52 0.854 -0.996 19.103 1.00 74.12 H new ATOM 0 HD22 LEU A 52 -0.517 -0.251 18.247 1.00 74.12 H new ATOM 0 HD23 LEU A 52 -0.747 -1.772 19.141 1.00 74.12 H new ATOM 801 N LEU A 53 -0.761 -0.581 13.715 1.00 10.33 N ATOM 802 CA LEU A 53 -0.725 -0.588 12.257 1.00 43.40 C ATOM 803 C LEU A 53 0.553 -1.249 11.751 1.00 63.23 C ATOM 804 O LEU A 53 1.597 -0.604 11.646 1.00 31.40 O ATOM 805 CB LEU A 53 -0.822 0.840 11.716 1.00 64.40 C ATOM 806 CG LEU A 53 -2.120 1.577 12.053 1.00 12.12 C ATOM 807 CD1 LEU A 53 -2.161 2.928 11.358 1.00 22.13 C ATOM 808 CD2 LEU A 53 -3.327 0.737 11.662 1.00 22.32 C ATOM 0 H LEU A 53 0.045 -0.135 14.154 1.00 10.33 H new ATOM 0 HA LEU A 53 -1.579 -1.163 11.899 1.00 43.40 H new ATOM 0 HB2 LEU A 53 0.017 1.417 12.106 1.00 64.40 H new ATOM 0 HB3 LEU A 53 -0.711 0.809 10.632 1.00 64.40 H new ATOM 0 HG LEU A 53 -2.152 1.744 13.130 1.00 12.12 H new ATOM 0 HD11 LEU A 53 -3.091 3.438 11.609 1.00 22.13 H new ATOM 0 HD12 LEU A 53 -1.315 3.532 11.687 1.00 22.13 H new ATOM 0 HD13 LEU A 53 -2.106 2.784 10.279 1.00 22.13 H new ATOM 0 HD21 LEU A 53 -4.241 1.277 11.909 1.00 22.32 H new ATOM 0 HD22 LEU A 53 -3.301 0.539 10.590 1.00 22.32 H new ATOM 0 HD23 LEU A 53 -3.305 -0.207 12.206 1.00 22.32 H new ATOM 820 N ASP A 54 0.464 -2.537 11.439 1.00 21.13 N ATOM 821 CA ASP A 54 1.616 -3.283 10.945 1.00 52.12 C ATOM 822 C ASP A 54 1.756 -3.131 9.434 1.00 22.03 C ATOM 823 O ASP A 54 1.107 -3.841 8.666 1.00 62.20 O ATOM 824 CB ASP A 54 1.487 -4.763 11.310 1.00 72.23 C ATOM 825 CG ASP A 54 1.676 -5.012 12.793 1.00 65.32 C ATOM 826 OD1 ASP A 54 0.911 -4.434 13.594 1.00 3.21 O ATOM 827 OD2 ASP A 54 2.589 -5.784 13.154 1.00 75.54 O ATOM 0 H ASP A 54 -0.392 -3.086 11.519 1.00 21.13 H new ATOM 0 HA ASP A 54 2.510 -2.876 11.418 1.00 52.12 H new ATOM 0 HB2 ASP A 54 0.505 -5.125 11.006 1.00 72.23 H new ATOM 0 HB3 ASP A 54 2.225 -5.338 10.751 1.00 72.23 H new ATOM 832 N ILE A 55 2.607 -2.200 9.016 1.00 71.43 N ATOM 833 CA ILE A 55 2.832 -1.955 7.596 1.00 74.40 C ATOM 834 C ILE A 55 3.961 -2.828 7.062 1.00 60.35 C ATOM 835 O ILE A 55 5.131 -2.607 7.374 1.00 62.41 O ATOM 836 CB ILE A 55 3.171 -0.476 7.322 1.00 34.14 C ATOM 837 CG1 ILE A 55 2.268 0.444 8.147 1.00 12.01 C ATOM 838 CG2 ILE A 55 3.033 -0.170 5.839 1.00 65.32 C ATOM 839 CD1 ILE A 55 0.791 0.207 7.919 1.00 12.25 C ATOM 0 H ILE A 55 3.151 -1.604 9.639 1.00 71.43 H new ATOM 0 HA ILE A 55 1.904 -2.206 7.083 1.00 74.40 H new ATOM 0 HB ILE A 55 4.204 -0.296 7.619 1.00 34.14 H new ATOM 0 HG12 ILE A 55 2.491 0.304 9.205 1.00 12.01 H new ATOM 0 HG13 ILE A 55 2.502 1.481 7.906 1.00 12.01 H new ATOM 0 HG21 ILE A 55 3.275 0.877 5.660 1.00 65.32 H new ATOM 0 HG22 ILE A 55 3.716 -0.803 5.272 1.00 65.32 H new ATOM 0 HG23 ILE A 55 2.009 -0.365 5.521 1.00 65.32 H new ATOM 0 HD11 ILE A 55 0.213 0.894 8.536 1.00 12.25 H new ATOM 0 HD12 ILE A 55 0.553 0.375 6.869 1.00 12.25 H new ATOM 0 HD13 ILE A 55 0.541 -0.819 8.188 1.00 12.25 H new ATOM 851 N LEU A 56 3.603 -3.820 6.254 1.00 54.55 N ATOM 852 CA LEU A 56 4.584 -4.726 5.675 1.00 3.55 C ATOM 853 C LEU A 56 5.017 -4.235 4.296 1.00 15.44 C ATOM 854 O LEU A 56 4.183 -3.916 3.448 1.00 53.34 O ATOM 855 CB LEU A 56 3.999 -6.139 5.586 1.00 5.54 C ATOM 856 CG LEU A 56 4.697 -7.083 4.603 1.00 53.44 C ATOM 857 CD1 LEU A 56 5.126 -8.362 5.303 1.00 60.23 C ATOM 858 CD2 LEU A 56 3.781 -7.392 3.430 1.00 0.31 C ATOM 0 H LEU A 56 2.639 -4.016 5.986 1.00 54.55 H new ATOM 0 HA LEU A 56 5.464 -4.751 6.317 1.00 3.55 H new ATOM 0 HB2 LEU A 56 4.030 -6.589 6.578 1.00 5.54 H new ATOM 0 HB3 LEU A 56 2.949 -6.061 5.304 1.00 5.54 H new ATOM 0 HG LEU A 56 5.591 -6.590 4.222 1.00 53.44 H new ATOM 0 HD11 LEU A 56 5.620 -9.020 4.588 1.00 60.23 H new ATOM 0 HD12 LEU A 56 5.816 -8.120 6.111 1.00 60.23 H new ATOM 0 HD13 LEU A 56 4.250 -8.864 5.713 1.00 60.23 H new ATOM 0 HD21 LEU A 56 4.289 -8.064 2.739 1.00 0.31 H new ATOM 0 HD22 LEU A 56 2.870 -7.867 3.795 1.00 0.31 H new ATOM 0 HD23 LEU A 56 3.525 -6.466 2.914 1.00 0.31 H new ATOM 870 N ASP A 57 6.327 -4.176 4.080 1.00 32.24 N ATOM 871 CA ASP A 57 6.872 -3.724 2.806 1.00 13.42 C ATOM 872 C ASP A 57 7.623 -4.851 2.105 1.00 1.13 C ATOM 873 O ASP A 57 8.734 -5.208 2.497 1.00 22.12 O ATOM 874 CB ASP A 57 7.804 -2.530 3.020 1.00 12.52 C ATOM 875 CG ASP A 57 8.344 -1.976 1.716 1.00 34.14 C ATOM 876 OD1 ASP A 57 7.529 -1.654 0.825 1.00 23.45 O ATOM 877 OD2 ASP A 57 9.581 -1.863 1.585 1.00 61.14 O ATOM 0 H ASP A 57 7.031 -4.436 4.771 1.00 32.24 H new ATOM 0 HA ASP A 57 6.040 -3.417 2.172 1.00 13.42 H new ATOM 0 HB2 ASP A 57 7.267 -1.744 3.551 1.00 12.52 H new ATOM 0 HB3 ASP A 57 8.636 -2.832 3.656 1.00 12.52 H new ATOM 882 N THR A 58 7.008 -5.407 1.067 1.00 33.20 N ATOM 883 CA THR A 58 7.618 -6.494 0.310 1.00 45.13 C ATOM 884 C THR A 58 8.722 -5.966 -0.600 1.00 21.52 C ATOM 885 O THR A 58 9.065 -4.784 -0.556 1.00 74.33 O ATOM 886 CB THR A 58 6.561 -7.226 -0.519 1.00 23.34 C ATOM 887 OG1 THR A 58 6.243 -6.490 -1.687 1.00 43.00 O ATOM 888 CG2 THR A 58 5.272 -7.472 0.234 1.00 32.15 C ATOM 0 H THR A 58 6.088 -5.123 0.731 1.00 33.20 H new ATOM 0 HA THR A 58 8.059 -7.195 1.019 1.00 45.13 H new ATOM 0 HB THR A 58 7.006 -8.190 -0.767 1.00 23.34 H new ATOM 0 HG1 THR A 58 5.567 -6.975 -2.205 1.00 43.00 H new ATOM 0 HG21 THR A 58 4.567 -7.995 -0.413 1.00 32.15 H new ATOM 0 HG22 THR A 58 5.476 -8.080 1.115 1.00 32.15 H new ATOM 0 HG23 THR A 58 4.843 -6.519 0.543 1.00 32.15 H new ATOM 896 N ALA A 59 9.275 -6.848 -1.425 1.00 33.43 N ATOM 897 CA ALA A 59 10.340 -6.472 -2.345 1.00 45.23 C ATOM 898 C ALA A 59 10.062 -6.989 -3.748 1.00 64.14 C ATOM 899 O ALA A 59 9.240 -7.885 -3.939 1.00 70.45 O ATOM 900 CB ALA A 59 11.678 -6.997 -1.855 1.00 61.04 C ATOM 0 H ALA A 59 9.002 -7.830 -1.475 1.00 33.43 H new ATOM 0 HA ALA A 59 10.378 -5.383 -2.382 1.00 45.23 H new ATOM 0 HB1 ALA A 59 12.461 -6.706 -2.555 1.00 61.04 H new ATOM 0 HB2 ALA A 59 11.896 -6.578 -0.873 1.00 61.04 H new ATOM 0 HB3 ALA A 59 11.639 -8.084 -1.785 1.00 61.04 H new ATOM 906 N GLY A 60 10.757 -6.423 -4.727 1.00 55.34 N ATOM 907 CA GLY A 60 10.570 -6.849 -6.096 1.00 52.33 C ATOM 908 C GLY A 60 11.558 -7.922 -6.518 1.00 41.25 C ATOM 909 O GLY A 60 11.642 -8.265 -7.698 1.00 13.54 O ATOM 0 H GLY A 60 11.443 -5.680 -4.596 1.00 55.34 H new ATOM 0 HA2 GLY A 60 9.555 -7.227 -6.219 1.00 52.33 H new ATOM 0 HA3 GLY A 60 10.671 -5.988 -6.757 1.00 52.33 H new ATOM 913 N GLN A 61 12.306 -8.457 -5.555 1.00 53.05 N ATOM 914 CA GLN A 61 13.286 -9.496 -5.839 1.00 71.32 C ATOM 915 C GLN A 61 13.355 -10.508 -4.699 1.00 64.44 C ATOM 916 O GLN A 61 13.293 -11.717 -4.925 1.00 45.44 O ATOM 917 CB GLN A 61 14.665 -8.875 -6.070 1.00 1.52 C ATOM 918 CG GLN A 61 15.130 -7.981 -4.933 1.00 62.44 C ATOM 919 CD GLN A 61 16.401 -7.225 -5.269 1.00 43.45 C ATOM 920 OE1 GLN A 61 17.507 -7.716 -5.044 1.00 4.44 O ATOM 921 NE2 GLN A 61 16.248 -6.023 -5.812 1.00 23.24 N ATOM 0 H GLN A 61 12.250 -8.187 -4.573 1.00 53.05 H new ATOM 0 HA GLN A 61 12.973 -10.018 -6.744 1.00 71.32 H new ATOM 0 HB2 GLN A 61 15.393 -9.673 -6.214 1.00 1.52 H new ATOM 0 HB3 GLN A 61 14.642 -8.294 -6.992 1.00 1.52 H new ATOM 0 HG2 GLN A 61 14.341 -7.269 -4.690 1.00 62.44 H new ATOM 0 HG3 GLN A 61 15.297 -8.588 -4.043 1.00 62.44 H new ATOM 0 HE21 GLN A 61 15.312 -5.655 -5.981 1.00 23.24 H new ATOM 0 HE22 GLN A 61 17.067 -5.468 -6.060 1.00 23.24 H new ATOM 930 N GLU A 62 13.487 -10.008 -3.474 1.00 71.11 N ATOM 931 CA GLU A 62 13.567 -10.864 -2.303 1.00 42.24 C ATOM 932 C GLU A 62 12.300 -10.758 -1.461 1.00 53.11 C ATOM 933 O GLU A 62 11.647 -9.715 -1.434 1.00 2.02 O ATOM 934 CB GLU A 62 14.783 -10.481 -1.463 1.00 43.20 C ATOM 935 CG GLU A 62 15.363 -11.644 -0.686 1.00 34.45 C ATOM 936 CD GLU A 62 16.879 -11.639 -0.668 1.00 22.11 C ATOM 937 OE1 GLU A 62 17.485 -11.764 -1.753 1.00 22.11 O ATOM 938 OE2 GLU A 62 17.460 -11.511 0.430 1.00 5.31 O ATOM 0 H GLU A 62 13.541 -9.010 -3.270 1.00 71.11 H new ATOM 0 HA GLU A 62 13.668 -11.896 -2.639 1.00 42.24 H new ATOM 0 HB2 GLU A 62 15.552 -10.069 -2.116 1.00 43.20 H new ATOM 0 HB3 GLU A 62 14.501 -9.692 -0.766 1.00 43.20 H new ATOM 0 HG2 GLU A 62 14.992 -11.612 0.338 1.00 34.45 H new ATOM 0 HG3 GLU A 62 15.012 -12.579 -1.123 1.00 34.45 H new ATOM 945 N GLU A 63 11.958 -11.845 -0.775 1.00 15.02 N ATOM 946 CA GLU A 63 10.767 -11.877 0.070 1.00 74.20 C ATOM 947 C GLU A 63 9.544 -11.366 -0.684 1.00 23.02 C ATOM 948 O GLU A 63 9.093 -10.241 -0.468 1.00 25.42 O ATOM 949 CB GLU A 63 10.985 -11.035 1.327 1.00 43.33 C ATOM 950 CG GLU A 63 12.254 -11.389 2.086 1.00 12.42 C ATOM 951 CD GLU A 63 11.972 -11.939 3.471 1.00 51.24 C ATOM 952 OE1 GLU A 63 11.152 -11.335 4.194 1.00 5.34 O ATOM 953 OE2 GLU A 63 12.572 -12.973 3.833 1.00 32.24 O ATOM 0 H GLU A 63 12.489 -12.716 -0.787 1.00 15.02 H new ATOM 0 HA GLU A 63 10.589 -12.914 0.356 1.00 74.20 H new ATOM 0 HB2 GLU A 63 11.021 -9.982 1.047 1.00 43.33 H new ATOM 0 HB3 GLU A 63 10.129 -11.159 1.990 1.00 43.33 H new ATOM 0 HG2 GLU A 63 12.821 -12.125 1.515 1.00 12.42 H new ATOM 0 HG3 GLU A 63 12.881 -10.501 2.172 1.00 12.42 H new ATOM 960 N TYR A 64 9.014 -12.200 -1.571 1.00 40.25 N ATOM 961 CA TYR A 64 7.845 -11.831 -2.361 1.00 73.25 C ATOM 962 C TYR A 64 7.402 -12.986 -3.258 1.00 41.05 C ATOM 963 O TYR A 64 7.857 -14.117 -3.098 1.00 52.42 O ATOM 964 CB TYR A 64 8.153 -10.595 -3.215 1.00 33.13 C ATOM 965 CG TYR A 64 8.939 -10.903 -4.474 1.00 13.25 C ATOM 966 CD1 TYR A 64 9.964 -11.841 -4.463 1.00 31.11 C ATOM 967 CD2 TYR A 64 8.650 -10.261 -5.671 1.00 71.24 C ATOM 968 CE1 TYR A 64 10.679 -12.131 -5.610 1.00 52.15 C ATOM 969 CE2 TYR A 64 9.360 -10.545 -6.822 1.00 52.52 C ATOM 970 CZ TYR A 64 10.373 -11.480 -6.786 1.00 55.22 C ATOM 971 OH TYR A 64 11.082 -11.766 -7.930 1.00 65.01 O ATOM 0 H TYR A 64 9.374 -13.135 -1.761 1.00 40.25 H new ATOM 0 HA TYR A 64 7.032 -11.599 -1.673 1.00 73.25 H new ATOM 0 HB2 TYR A 64 7.215 -10.113 -3.492 1.00 33.13 H new ATOM 0 HB3 TYR A 64 8.714 -9.880 -2.613 1.00 33.13 H new ATOM 0 HD1 TYR A 64 10.206 -12.352 -3.543 1.00 31.11 H new ATOM 0 HD2 TYR A 64 7.858 -9.528 -5.703 1.00 71.24 H new ATOM 0 HE1 TYR A 64 11.473 -12.863 -5.585 1.00 52.15 H new ATOM 0 HE2 TYR A 64 9.123 -10.037 -7.745 1.00 52.52 H new ATOM 0 HH TYR A 64 10.741 -11.222 -8.671 1.00 65.01 H new ATOM 981 N SER A 65 6.514 -12.681 -4.206 1.00 11.34 N ATOM 982 CA SER A 65 6.001 -13.677 -5.147 1.00 23.11 C ATOM 983 C SER A 65 5.630 -14.981 -4.436 1.00 41.01 C ATOM 984 O SER A 65 4.494 -15.154 -3.994 1.00 40.32 O ATOM 985 CB SER A 65 7.031 -13.944 -6.249 1.00 11.15 C ATOM 986 OG SER A 65 8.334 -13.578 -5.828 1.00 41.24 O ATOM 0 H SER A 65 6.133 -11.745 -4.342 1.00 11.34 H new ATOM 0 HA SER A 65 5.094 -13.276 -5.598 1.00 23.11 H new ATOM 0 HB2 SER A 65 7.015 -15.000 -6.518 1.00 11.15 H new ATOM 0 HB3 SER A 65 6.764 -13.383 -7.145 1.00 11.15 H new ATOM 0 HG SER A 65 8.383 -12.605 -5.723 1.00 41.24 H new ATOM 992 N ALA A 66 6.594 -15.892 -4.325 1.00 71.11 N ATOM 993 CA ALA A 66 6.369 -17.171 -3.666 1.00 42.42 C ATOM 994 C ALA A 66 5.830 -16.969 -2.255 1.00 12.23 C ATOM 995 O ALA A 66 4.878 -17.628 -1.839 1.00 32.11 O ATOM 996 CB ALA A 66 7.662 -17.969 -3.629 1.00 72.10 C ATOM 0 H ALA A 66 7.540 -15.765 -4.685 1.00 71.11 H new ATOM 0 HA ALA A 66 5.624 -17.727 -4.235 1.00 42.42 H new ATOM 0 HB1 ALA A 66 7.486 -18.924 -3.135 1.00 72.10 H new ATOM 0 HB2 ALA A 66 8.010 -18.146 -4.647 1.00 72.10 H new ATOM 0 HB3 ALA A 66 8.419 -17.410 -3.079 1.00 72.10 H new ATOM 1002 N MET A 67 6.448 -16.045 -1.528 1.00 12.14 N ATOM 1003 CA MET A 67 6.038 -15.738 -0.165 1.00 2.32 C ATOM 1004 C MET A 67 4.875 -14.750 -0.156 1.00 15.40 C ATOM 1005 O MET A 67 4.126 -14.671 0.816 1.00 62.31 O ATOM 1006 CB MET A 67 7.219 -15.173 0.626 1.00 50.23 C ATOM 1007 CG MET A 67 8.371 -16.154 0.771 1.00 23.14 C ATOM 1008 SD MET A 67 9.920 -15.347 1.213 1.00 33.22 S ATOM 1009 CE MET A 67 9.444 -14.522 2.728 1.00 2.11 C ATOM 0 H MET A 67 7.238 -15.494 -1.863 1.00 12.14 H new ATOM 0 HA MET A 67 5.704 -16.661 0.308 1.00 2.32 H new ATOM 0 HB2 MET A 67 7.580 -14.271 0.132 1.00 50.23 H new ATOM 0 HB3 MET A 67 6.875 -14.878 1.617 1.00 50.23 H new ATOM 0 HG2 MET A 67 8.120 -16.892 1.533 1.00 23.14 H new ATOM 0 HG3 MET A 67 8.502 -16.695 -0.166 1.00 23.14 H new ATOM 0 HE1 MET A 67 9.745 -13.475 2.682 1.00 2.11 H new ATOM 0 HE2 MET A 67 8.363 -14.584 2.852 1.00 2.11 H new ATOM 0 HE3 MET A 67 9.934 -15.004 3.574 1.00 2.11 H new ATOM 1019 N ARG A 68 4.722 -14.001 -1.247 1.00 72.12 N ATOM 1020 CA ARG A 68 3.641 -13.027 -1.355 1.00 72.23 C ATOM 1021 C ARG A 68 2.302 -13.674 -1.010 1.00 13.13 C ATOM 1022 O ARG A 68 1.449 -13.057 -0.372 1.00 63.45 O ATOM 1023 CB ARG A 68 3.593 -12.436 -2.767 1.00 52.13 C ATOM 1024 CG ARG A 68 3.822 -10.934 -2.802 1.00 45.33 C ATOM 1025 CD ARG A 68 3.713 -10.383 -4.215 1.00 53.33 C ATOM 1026 NE ARG A 68 4.545 -9.195 -4.402 1.00 4.24 N ATOM 1027 CZ ARG A 68 4.762 -8.619 -5.583 1.00 60.15 C ATOM 1028 NH1 ARG A 68 4.208 -9.112 -6.683 1.00 13.02 N ATOM 1029 NH2 ARG A 68 5.536 -7.544 -5.661 1.00 43.34 N ATOM 0 H ARG A 68 5.331 -14.051 -2.064 1.00 72.12 H new ATOM 0 HA ARG A 68 3.832 -12.222 -0.645 1.00 72.23 H new ATOM 0 HB2 ARG A 68 4.347 -12.925 -3.383 1.00 52.13 H new ATOM 0 HB3 ARG A 68 2.624 -12.659 -3.213 1.00 52.13 H new ATOM 0 HG2 ARG A 68 3.092 -10.439 -2.161 1.00 45.33 H new ATOM 0 HG3 ARG A 68 4.808 -10.706 -2.397 1.00 45.33 H new ATOM 0 HD2 ARG A 68 4.011 -11.151 -4.928 1.00 53.33 H new ATOM 0 HD3 ARG A 68 2.673 -10.136 -4.429 1.00 53.33 H new ATOM 0 HE ARG A 68 4.985 -8.783 -3.579 1.00 4.24 H new ATOM 0 HH11 ARG A 68 3.611 -9.937 -6.628 1.00 13.02 H new ATOM 0 HH12 ARG A 68 4.379 -8.666 -7.584 1.00 13.02 H new ATOM 0 HH21 ARG A 68 5.963 -7.161 -4.818 1.00 43.34 H new ATOM 0 HH22 ARG A 68 5.704 -7.101 -6.564 1.00 43.34 H new ATOM 1043 N ASP A 69 2.133 -14.925 -1.428 1.00 63.04 N ATOM 1044 CA ASP A 69 0.906 -15.662 -1.154 1.00 12.24 C ATOM 1045 C ASP A 69 0.711 -15.824 0.349 1.00 11.54 C ATOM 1046 O ASP A 69 -0.415 -15.818 0.846 1.00 33.15 O ATOM 1047 CB ASP A 69 0.946 -17.035 -1.830 1.00 21.04 C ATOM 1048 CG ASP A 69 0.034 -17.111 -3.038 1.00 62.54 C ATOM 1049 OD1 ASP A 69 0.159 -16.246 -3.931 1.00 32.01 O ATOM 1050 OD2 ASP A 69 -0.803 -18.035 -3.093 1.00 71.25 O ATOM 0 H ASP A 69 2.830 -15.448 -1.957 1.00 63.04 H new ATOM 0 HA ASP A 69 0.066 -15.097 -1.559 1.00 12.24 H new ATOM 0 HB2 ASP A 69 1.968 -17.257 -2.136 1.00 21.04 H new ATOM 0 HB3 ASP A 69 0.655 -17.800 -1.110 1.00 21.04 H new ATOM 1055 N GLN A 70 1.821 -15.961 1.067 1.00 11.24 N ATOM 1056 CA GLN A 70 1.782 -16.116 2.515 1.00 75.23 C ATOM 1057 C GLN A 70 1.346 -14.812 3.177 1.00 20.33 C ATOM 1058 O GLN A 70 0.559 -14.818 4.124 1.00 55.43 O ATOM 1059 CB GLN A 70 3.160 -16.546 3.037 1.00 43.44 C ATOM 1060 CG GLN A 70 3.308 -16.458 4.549 1.00 33.52 C ATOM 1061 CD GLN A 70 2.527 -17.536 5.277 1.00 44.12 C ATOM 1062 OE1 GLN A 70 3.099 -18.511 5.766 1.00 53.41 O ATOM 1063 NE2 GLN A 70 1.212 -17.366 5.351 1.00 15.14 N ATOM 0 H GLN A 70 2.760 -15.968 0.668 1.00 11.24 H new ATOM 0 HA GLN A 70 1.056 -16.890 2.765 1.00 75.23 H new ATOM 0 HB2 GLN A 70 3.351 -17.572 2.723 1.00 43.44 H new ATOM 0 HB3 GLN A 70 3.923 -15.923 2.571 1.00 43.44 H new ATOM 0 HG2 GLN A 70 4.363 -16.539 4.812 1.00 33.52 H new ATOM 0 HG3 GLN A 70 2.969 -15.479 4.887 1.00 33.52 H new ATOM 0 HE21 GLN A 70 0.780 -16.543 4.932 1.00 15.14 H new ATOM 0 HE22 GLN A 70 0.634 -18.059 5.827 1.00 15.14 H new ATOM 1072 N TYR A 71 1.861 -13.696 2.670 1.00 72.33 N ATOM 1073 CA TYR A 71 1.524 -12.385 3.213 1.00 1.12 C ATOM 1074 C TYR A 71 0.022 -12.137 3.145 1.00 61.31 C ATOM 1075 O TYR A 71 -0.566 -11.572 4.067 1.00 1.35 O ATOM 1076 CB TYR A 71 2.273 -11.288 2.457 1.00 4.03 C ATOM 1077 CG TYR A 71 3.747 -11.241 2.782 1.00 52.01 C ATOM 1078 CD1 TYR A 71 4.192 -11.378 4.091 1.00 42.40 C ATOM 1079 CD2 TYR A 71 4.693 -11.068 1.781 1.00 13.41 C ATOM 1080 CE1 TYR A 71 5.538 -11.342 4.393 1.00 75.41 C ATOM 1081 CE2 TYR A 71 6.042 -11.030 2.075 1.00 61.34 C ATOM 1082 CZ TYR A 71 6.460 -11.168 3.382 1.00 61.13 C ATOM 1083 OH TYR A 71 7.803 -11.131 3.678 1.00 23.32 O ATOM 0 H TYR A 71 2.512 -13.673 1.885 1.00 72.33 H new ATOM 0 HA TYR A 71 1.828 -12.364 4.260 1.00 1.12 H new ATOM 0 HB2 TYR A 71 2.149 -11.444 1.385 1.00 4.03 H new ATOM 0 HB3 TYR A 71 1.825 -10.323 2.692 1.00 4.03 H new ATOM 0 HD1 TYR A 71 3.473 -11.515 4.885 1.00 42.40 H new ATOM 0 HD2 TYR A 71 4.369 -10.961 0.756 1.00 13.41 H new ATOM 0 HE1 TYR A 71 5.868 -11.450 5.416 1.00 75.41 H new ATOM 0 HE2 TYR A 71 6.766 -10.893 1.285 1.00 61.34 H new ATOM 0 HH TYR A 71 8.056 -11.950 4.153 1.00 23.32 H new ATOM 1093 N MET A 72 -0.594 -12.571 2.051 1.00 25.11 N ATOM 1094 CA MET A 72 -2.029 -12.403 1.868 1.00 2.25 C ATOM 1095 C MET A 72 -2.793 -13.182 2.931 1.00 13.10 C ATOM 1096 O MET A 72 -3.824 -12.731 3.430 1.00 61.03 O ATOM 1097 CB MET A 72 -2.442 -12.871 0.472 1.00 50.04 C ATOM 1098 CG MET A 72 -1.569 -12.307 -0.638 1.00 51.02 C ATOM 1099 SD MET A 72 -2.514 -11.841 -2.101 1.00 54.03 S ATOM 1100 CE MET A 72 -1.546 -10.459 -2.702 1.00 14.35 C ATOM 0 H MET A 72 -0.122 -13.041 1.279 1.00 25.11 H new ATOM 0 HA MET A 72 -2.271 -11.345 1.969 1.00 2.25 H new ATOM 0 HB2 MET A 72 -2.404 -13.960 0.436 1.00 50.04 H new ATOM 0 HB3 MET A 72 -3.477 -12.582 0.292 1.00 50.04 H new ATOM 0 HG2 MET A 72 -1.033 -11.435 -0.264 1.00 51.02 H new ATOM 0 HG3 MET A 72 -0.819 -13.048 -0.916 1.00 51.02 H new ATOM 0 HE1 MET A 72 -2.004 -10.060 -3.607 1.00 14.35 H new ATOM 0 HE2 MET A 72 -1.511 -9.681 -1.940 1.00 14.35 H new ATOM 0 HE3 MET A 72 -0.533 -10.794 -2.926 1.00 14.35 H new ATOM 1110 N ARG A 73 -2.269 -14.352 3.277 1.00 71.12 N ATOM 1111 CA ARG A 73 -2.885 -15.202 4.288 1.00 11.42 C ATOM 1112 C ARG A 73 -2.514 -14.737 5.697 1.00 45.44 C ATOM 1113 O ARG A 73 -3.081 -15.207 6.683 1.00 71.22 O ATOM 1114 CB ARG A 73 -2.453 -16.656 4.089 1.00 43.41 C ATOM 1115 CG ARG A 73 -2.484 -17.106 2.637 1.00 14.53 C ATOM 1116 CD ARG A 73 -3.492 -18.222 2.417 1.00 13.23 C ATOM 1117 NE ARG A 73 -4.809 -17.884 2.951 1.00 23.10 N ATOM 1118 CZ ARG A 73 -5.772 -18.777 3.170 1.00 44.03 C ATOM 1119 NH1 ARG A 73 -5.571 -20.060 2.896 1.00 43.15 N ATOM 1120 NH2 ARG A 73 -6.939 -18.385 3.663 1.00 34.23 N ATOM 0 H ARG A 73 -1.415 -14.735 2.870 1.00 71.12 H new ATOM 0 HA ARG A 73 -3.967 -15.130 4.177 1.00 11.42 H new ATOM 0 HB2 ARG A 73 -1.443 -16.783 4.479 1.00 43.41 H new ATOM 0 HB3 ARG A 73 -3.105 -17.304 4.676 1.00 43.41 H new ATOM 0 HG2 ARG A 73 -2.734 -16.259 1.998 1.00 14.53 H new ATOM 0 HG3 ARG A 73 -1.492 -17.447 2.340 1.00 14.53 H new ATOM 0 HD2 ARG A 73 -3.576 -18.429 1.350 1.00 13.23 H new ATOM 0 HD3 ARG A 73 -3.132 -19.135 2.892 1.00 13.23 H new ATOM 0 HE ARG A 73 -5.002 -16.906 3.169 1.00 23.10 H new ATOM 0 HH11 ARG A 73 -4.675 -20.366 2.516 1.00 43.15 H new ATOM 0 HH12 ARG A 73 -6.312 -20.740 3.066 1.00 43.15 H new ATOM 0 HH21 ARG A 73 -7.098 -17.400 3.874 1.00 34.23 H new ATOM 0 HH22 ARG A 73 -7.677 -19.069 3.831 1.00 34.23 H new ATOM 1134 N THR A 74 -1.560 -13.811 5.784 1.00 12.11 N ATOM 1135 CA THR A 74 -1.118 -13.288 7.070 1.00 4.20 C ATOM 1136 C THR A 74 -1.723 -11.913 7.337 1.00 14.13 C ATOM 1137 O THR A 74 -1.781 -11.462 8.481 1.00 54.33 O ATOM 1138 CB THR A 74 0.406 -13.192 7.112 1.00 53.35 C ATOM 1139 OG1 THR A 74 0.871 -12.203 6.211 1.00 2.04 O ATOM 1140 CG2 THR A 74 1.096 -14.492 6.765 1.00 52.31 C ATOM 0 H THR A 74 -1.080 -13.410 4.978 1.00 12.11 H new ATOM 0 HA THR A 74 -1.457 -13.977 7.844 1.00 4.20 H new ATOM 0 HB THR A 74 0.652 -12.933 8.142 1.00 53.35 H new ATOM 0 HG1 THR A 74 0.150 -11.958 5.594 1.00 2.04 H new ATOM 0 HG21 THR A 74 2.176 -14.355 6.814 1.00 52.31 H new ATOM 0 HG22 THR A 74 0.796 -15.264 7.474 1.00 52.31 H new ATOM 0 HG23 THR A 74 0.814 -14.796 5.757 1.00 52.31 H new ATOM 1148 N GLY A 75 -2.160 -11.243 6.273 1.00 34.13 N ATOM 1149 CA GLY A 75 -2.738 -9.923 6.419 1.00 35.02 C ATOM 1150 C GLY A 75 -4.250 -9.922 6.307 1.00 14.42 C ATOM 1151 O GLY A 75 -4.854 -10.921 5.918 1.00 31.41 O ATOM 0 H GLY A 75 -2.123 -11.592 5.315 1.00 34.13 H new ATOM 0 HA2 GLY A 75 -2.451 -9.512 7.387 1.00 35.02 H new ATOM 0 HA3 GLY A 75 -2.322 -9.264 5.657 1.00 35.02 H new ATOM 1155 N GLU A 76 -4.858 -8.791 6.651 1.00 71.50 N ATOM 1156 CA GLU A 76 -6.308 -8.648 6.590 1.00 50.41 C ATOM 1157 C GLU A 76 -6.719 -7.680 5.482 1.00 62.42 C ATOM 1158 O GLU A 76 -7.884 -7.635 5.087 1.00 3.12 O ATOM 1159 CB GLU A 76 -6.845 -8.158 7.936 1.00 24.02 C ATOM 1160 CG GLU A 76 -6.436 -9.036 9.108 1.00 22.03 C ATOM 1161 CD GLU A 76 -7.602 -9.806 9.696 1.00 61.04 C ATOM 1162 OE1 GLU A 76 -8.704 -9.227 9.800 1.00 3.42 O ATOM 1163 OE2 GLU A 76 -7.414 -10.988 10.053 1.00 71.33 O ATOM 0 H GLU A 76 -4.367 -7.958 6.976 1.00 71.50 H new ATOM 0 HA GLU A 76 -6.735 -9.625 6.366 1.00 50.41 H new ATOM 0 HB2 GLU A 76 -6.490 -7.142 8.112 1.00 24.02 H new ATOM 0 HB3 GLU A 76 -7.933 -8.112 7.889 1.00 24.02 H new ATOM 0 HG2 GLU A 76 -5.670 -9.739 8.780 1.00 22.03 H new ATOM 0 HG3 GLU A 76 -5.988 -8.415 9.883 1.00 22.03 H new ATOM 1170 N GLY A 77 -5.757 -6.907 4.984 1.00 43.02 N ATOM 1171 CA GLY A 77 -6.043 -5.953 3.927 1.00 5.53 C ATOM 1172 C GLY A 77 -4.893 -5.814 2.949 1.00 42.32 C ATOM 1173 O GLY A 77 -3.885 -6.512 3.065 1.00 54.34 O ATOM 0 H GLY A 77 -4.785 -6.925 5.294 1.00 43.02 H new ATOM 0 HA2 GLY A 77 -6.938 -6.267 3.390 1.00 5.53 H new ATOM 0 HA3 GLY A 77 -6.261 -4.980 4.368 1.00 5.53 H new ATOM 1177 N PHE A 78 -5.041 -4.913 1.983 1.00 22.32 N ATOM 1178 CA PHE A 78 -4.003 -4.691 0.982 1.00 73.13 C ATOM 1179 C PHE A 78 -4.090 -3.280 0.408 1.00 30.44 C ATOM 1180 O PHE A 78 -5.180 -2.759 0.174 1.00 64.04 O ATOM 1181 CB PHE A 78 -4.122 -5.719 -0.144 1.00 54.12 C ATOM 1182 CG PHE A 78 -4.118 -7.142 0.339 1.00 1.22 C ATOM 1183 CD1 PHE A 78 -5.297 -7.761 0.720 1.00 62.34 C ATOM 1184 CD2 PHE A 78 -2.934 -7.858 0.413 1.00 23.21 C ATOM 1185 CE1 PHE A 78 -5.296 -9.069 1.167 1.00 31.21 C ATOM 1186 CE2 PHE A 78 -2.927 -9.167 0.858 1.00 62.33 C ATOM 1187 CZ PHE A 78 -4.110 -9.772 1.236 1.00 63.23 C ATOM 0 H PHE A 78 -5.868 -4.326 1.872 1.00 22.32 H new ATOM 0 HA PHE A 78 -3.035 -4.806 1.470 1.00 73.13 H new ATOM 0 HB2 PHE A 78 -5.043 -5.534 -0.698 1.00 54.12 H new ATOM 0 HB3 PHE A 78 -3.297 -5.578 -0.842 1.00 54.12 H new ATOM 0 HD1 PHE A 78 -6.228 -7.216 0.667 1.00 62.34 H new ATOM 0 HD2 PHE A 78 -2.007 -7.388 0.120 1.00 23.21 H new ATOM 0 HE1 PHE A 78 -6.222 -9.540 1.462 1.00 31.21 H new ATOM 0 HE2 PHE A 78 -1.998 -9.716 0.910 1.00 62.33 H new ATOM 0 HZ PHE A 78 -4.107 -10.794 1.585 1.00 63.23 H new ATOM 1197 N LEU A 79 -2.932 -2.667 0.182 1.00 10.24 N ATOM 1198 CA LEU A 79 -2.873 -1.316 -0.366 1.00 64.51 C ATOM 1199 C LEU A 79 -2.124 -1.301 -1.696 1.00 53.40 C ATOM 1200 O LEU A 79 -0.999 -1.791 -1.791 1.00 12.43 O ATOM 1201 CB LEU A 79 -2.193 -0.371 0.627 1.00 33.41 C ATOM 1202 CG LEU A 79 -2.852 1.001 0.771 1.00 12.03 C ATOM 1203 CD1 LEU A 79 -3.897 0.976 1.875 1.00 73.42 C ATOM 1204 CD2 LEU A 79 -1.805 2.069 1.050 1.00 72.34 C ATOM 0 H LEU A 79 -2.021 -3.085 0.370 1.00 10.24 H new ATOM 0 HA LEU A 79 -3.894 -0.975 -0.541 1.00 64.51 H new ATOM 0 HB2 LEU A 79 -2.171 -0.851 1.605 1.00 33.41 H new ATOM 0 HB3 LEU A 79 -1.157 -0.229 0.319 1.00 33.41 H new ATOM 0 HG LEU A 79 -3.349 1.245 -0.168 1.00 12.03 H new ATOM 0 HD11 LEU A 79 -4.356 1.961 1.964 1.00 73.42 H new ATOM 0 HD12 LEU A 79 -4.663 0.239 1.634 1.00 73.42 H new ATOM 0 HD13 LEU A 79 -3.422 0.711 2.820 1.00 73.42 H new ATOM 0 HD21 LEU A 79 -2.292 3.039 1.149 1.00 72.34 H new ATOM 0 HD22 LEU A 79 -1.279 1.830 1.975 1.00 72.34 H new ATOM 0 HD23 LEU A 79 -1.092 2.104 0.226 1.00 72.34 H new ATOM 1216 N CYS A 80 -2.754 -0.734 -2.720 1.00 44.11 N ATOM 1217 CA CYS A 80 -2.145 -0.656 -4.044 1.00 41.40 C ATOM 1218 C CYS A 80 -1.500 0.708 -4.267 1.00 15.11 C ATOM 1219 O CYS A 80 -2.187 1.727 -4.334 1.00 61.43 O ATOM 1220 CB CYS A 80 -3.192 -0.921 -5.128 1.00 61.22 C ATOM 1221 SG CYS A 80 -3.557 -2.672 -5.389 1.00 20.21 S ATOM 0 H CYS A 80 -3.685 -0.322 -2.659 1.00 44.11 H new ATOM 0 HA CYS A 80 -1.369 -1.419 -4.104 1.00 41.40 H new ATOM 0 HB2 CYS A 80 -4.114 -0.404 -4.861 1.00 61.22 H new ATOM 0 HB3 CYS A 80 -2.845 -0.489 -6.067 1.00 61.22 H new ATOM 0 HG CYS A 80 -4.454 -2.794 -6.322 1.00 20.21 H new ATOM 1227 N VAL A 81 -0.176 0.719 -4.382 1.00 20.35 N ATOM 1228 CA VAL A 81 0.562 1.958 -4.599 1.00 11.53 C ATOM 1229 C VAL A 81 1.084 2.044 -6.030 1.00 72.14 C ATOM 1230 O VAL A 81 1.895 1.222 -6.456 1.00 11.31 O ATOM 1231 CB VAL A 81 1.750 2.085 -3.623 1.00 13.12 C ATOM 1232 CG1 VAL A 81 2.495 3.394 -3.845 1.00 61.32 C ATOM 1233 CG2 VAL A 81 1.271 1.976 -2.184 1.00 1.20 C ATOM 0 H VAL A 81 0.408 -0.116 -4.329 1.00 20.35 H new ATOM 0 HA VAL A 81 -0.136 2.776 -4.419 1.00 11.53 H new ATOM 0 HB VAL A 81 2.442 1.265 -3.818 1.00 13.12 H new ATOM 0 HG11 VAL A 81 3.328 3.461 -3.146 1.00 61.32 H new ATOM 0 HG12 VAL A 81 2.875 3.428 -4.866 1.00 61.32 H new ATOM 0 HG13 VAL A 81 1.816 4.231 -3.682 1.00 61.32 H new ATOM 0 HG21 VAL A 81 2.122 2.068 -1.509 1.00 1.20 H new ATOM 0 HG22 VAL A 81 0.556 2.773 -1.977 1.00 1.20 H new ATOM 0 HG23 VAL A 81 0.791 1.009 -2.033 1.00 1.20 H new ATOM 1243 N PHE A 82 0.619 3.049 -6.763 1.00 42.01 N ATOM 1244 CA PHE A 82 1.044 3.250 -8.142 1.00 2.11 C ATOM 1245 C PHE A 82 1.553 4.676 -8.343 1.00 43.24 C ATOM 1246 O PHE A 82 1.152 5.593 -7.628 1.00 1.01 O ATOM 1247 CB PHE A 82 -0.113 2.945 -9.107 1.00 31.31 C ATOM 1248 CG PHE A 82 -0.886 4.159 -9.546 1.00 20.52 C ATOM 1249 CD1 PHE A 82 -1.553 4.945 -8.620 1.00 73.11 C ATOM 1250 CD2 PHE A 82 -0.940 4.516 -10.884 1.00 40.21 C ATOM 1251 CE1 PHE A 82 -2.261 6.062 -9.021 1.00 53.24 C ATOM 1252 CE2 PHE A 82 -1.645 5.632 -11.291 1.00 63.33 C ATOM 1253 CZ PHE A 82 -2.307 6.407 -10.358 1.00 41.33 C ATOM 0 H PHE A 82 -0.053 3.738 -6.424 1.00 42.01 H new ATOM 0 HA PHE A 82 1.862 2.563 -8.357 1.00 2.11 H new ATOM 0 HB2 PHE A 82 0.287 2.444 -9.989 1.00 31.31 H new ATOM 0 HB3 PHE A 82 -0.798 2.246 -8.626 1.00 31.31 H new ATOM 0 HD1 PHE A 82 -1.519 4.682 -7.573 1.00 73.11 H new ATOM 0 HD2 PHE A 82 -0.424 3.914 -11.618 1.00 40.21 H new ATOM 0 HE1 PHE A 82 -2.778 6.665 -8.289 1.00 53.24 H new ATOM 0 HE2 PHE A 82 -1.679 5.898 -12.337 1.00 63.33 H new ATOM 0 HZ PHE A 82 -2.859 7.280 -10.673 1.00 41.33 H new ATOM 1263 N ALA A 83 2.434 4.856 -9.319 1.00 62.51 N ATOM 1264 CA ALA A 83 2.989 6.172 -9.607 1.00 11.22 C ATOM 1265 C ALA A 83 2.250 6.838 -10.761 1.00 11.21 C ATOM 1266 O ALA A 83 2.160 6.284 -11.857 1.00 54.03 O ATOM 1267 CB ALA A 83 4.473 6.064 -9.919 1.00 3.33 C ATOM 0 H ALA A 83 2.779 4.110 -9.923 1.00 62.51 H new ATOM 0 HA ALA A 83 2.861 6.794 -8.721 1.00 11.22 H new ATOM 0 HB1 ALA A 83 4.873 7.055 -10.132 1.00 3.33 H new ATOM 0 HB2 ALA A 83 4.995 5.638 -9.062 1.00 3.33 H new ATOM 0 HB3 ALA A 83 4.616 5.421 -10.787 1.00 3.33 H new ATOM 1273 N ILE A 84 1.723 8.031 -10.508 1.00 34.02 N ATOM 1274 CA ILE A 84 0.992 8.775 -11.526 1.00 34.11 C ATOM 1275 C ILE A 84 1.879 9.076 -12.731 1.00 71.12 C ATOM 1276 O ILE A 84 1.385 9.325 -13.831 1.00 41.51 O ATOM 1277 CB ILE A 84 0.439 10.099 -10.966 1.00 53.54 C ATOM 1278 CG1 ILE A 84 1.536 10.863 -10.222 1.00 73.54 C ATOM 1279 CG2 ILE A 84 -0.744 9.832 -10.046 1.00 31.24 C ATOM 1280 CD1 ILE A 84 1.412 12.366 -10.338 1.00 34.04 C ATOM 0 H ILE A 84 1.789 8.503 -9.606 1.00 34.02 H new ATOM 0 HA ILE A 84 0.159 8.146 -11.840 1.00 34.11 H new ATOM 0 HB ILE A 84 0.096 10.713 -11.799 1.00 53.54 H new ATOM 0 HG12 ILE A 84 1.510 10.585 -9.168 1.00 73.54 H new ATOM 0 HG13 ILE A 84 2.508 10.556 -10.609 1.00 73.54 H new ATOM 0 HG21 ILE A 84 -1.124 10.777 -9.658 1.00 31.24 H new ATOM 0 HG22 ILE A 84 -1.532 9.326 -10.604 1.00 31.24 H new ATOM 0 HG23 ILE A 84 -0.425 9.201 -9.216 1.00 31.24 H new ATOM 0 HD11 ILE A 84 2.223 12.842 -9.786 1.00 34.04 H new ATOM 0 HD12 ILE A 84 1.468 12.656 -11.387 1.00 34.04 H new ATOM 0 HD13 ILE A 84 0.455 12.685 -9.924 1.00 34.04 H new ATOM 1292 N ASN A 85 3.192 9.052 -12.517 1.00 41.32 N ATOM 1293 CA ASN A 85 4.147 9.322 -13.587 1.00 34.04 C ATOM 1294 C ASN A 85 4.403 8.066 -14.414 1.00 1.24 C ATOM 1295 O ASN A 85 4.670 8.144 -15.613 1.00 52.43 O ATOM 1296 CB ASN A 85 5.469 9.842 -13.012 1.00 71.35 C ATOM 1297 CG ASN A 85 5.282 10.635 -11.732 1.00 5.34 C ATOM 1298 OD1 ASN A 85 5.325 10.082 -10.634 1.00 35.31 O ATOM 1299 ND2 ASN A 85 5.070 11.939 -11.869 1.00 64.35 N ATOM 0 H ASN A 85 3.618 8.848 -11.613 1.00 41.32 H new ATOM 0 HA ASN A 85 3.717 10.087 -14.234 1.00 34.04 H new ATOM 0 HB2 ASN A 85 6.132 8.999 -12.818 1.00 71.35 H new ATOM 0 HB3 ASN A 85 5.961 10.470 -13.755 1.00 71.35 H new ATOM 0 HD21 ASN A 85 4.935 12.523 -11.044 1.00 64.35 H new ATOM 0 HD22 ASN A 85 5.042 12.356 -12.799 1.00 64.35 H new ATOM 1306 N ASN A 86 4.321 6.909 -13.765 1.00 72.20 N ATOM 1307 CA ASN A 86 4.547 5.637 -14.440 1.00 64.41 C ATOM 1308 C ASN A 86 3.224 4.975 -14.814 1.00 11.33 C ATOM 1309 O ASN A 86 2.469 4.538 -13.946 1.00 13.04 O ATOM 1310 CB ASN A 86 5.368 4.702 -13.548 1.00 12.05 C ATOM 1311 CG ASN A 86 6.606 4.175 -14.247 1.00 34.43 C ATOM 1312 OD1 ASN A 86 7.204 4.861 -15.076 1.00 62.13 O ATOM 1313 ND2 ASN A 86 6.999 2.951 -13.914 1.00 25.12 N ATOM 0 H ASN A 86 4.100 6.827 -12.773 1.00 72.20 H new ATOM 0 HA ASN A 86 5.103 5.834 -15.357 1.00 64.41 H new ATOM 0 HB2 ASN A 86 5.664 5.234 -12.644 1.00 12.05 H new ATOM 0 HB3 ASN A 86 4.746 3.863 -13.236 1.00 12.05 H new ATOM 0 HD21 ASN A 86 7.826 2.545 -14.351 1.00 25.12 H new ATOM 0 HD22 ASN A 86 6.473 2.417 -13.222 1.00 25.12 H new ATOM 1320 N THR A 87 2.952 4.902 -16.113 1.00 61.22 N ATOM 1321 CA THR A 87 1.722 4.290 -16.605 1.00 74.23 C ATOM 1322 C THR A 87 1.769 2.773 -16.447 1.00 72.42 C ATOM 1323 O THR A 87 0.735 2.123 -16.292 1.00 21.14 O ATOM 1324 CB THR A 87 1.498 4.654 -18.073 1.00 74.21 C ATOM 1325 OG1 THR A 87 1.766 6.027 -18.296 1.00 2.23 O ATOM 1326 CG2 THR A 87 0.088 4.378 -18.549 1.00 41.54 C ATOM 0 H THR A 87 3.567 5.259 -16.844 1.00 61.22 H new ATOM 0 HA THR A 87 0.892 4.674 -16.012 1.00 74.23 H new ATOM 0 HB THR A 87 2.185 4.022 -18.636 1.00 74.21 H new ATOM 0 HG1 THR A 87 1.618 6.240 -19.241 1.00 2.23 H new ATOM 0 HG21 THR A 87 -0.003 4.659 -19.598 1.00 41.54 H new ATOM 0 HG22 THR A 87 -0.133 3.317 -18.437 1.00 41.54 H new ATOM 0 HG23 THR A 87 -0.617 4.960 -17.955 1.00 41.54 H new ATOM 1334 N LYS A 88 2.976 2.216 -16.485 1.00 15.40 N ATOM 1335 CA LYS A 88 3.161 0.781 -16.346 1.00 5.40 C ATOM 1336 C LYS A 88 2.659 0.304 -14.985 1.00 42.13 C ATOM 1337 O LYS A 88 2.040 -0.755 -14.876 1.00 54.45 O ATOM 1338 CB LYS A 88 4.641 0.431 -16.527 1.00 24.44 C ATOM 1339 CG LYS A 88 5.011 -0.953 -16.026 1.00 63.33 C ATOM 1340 CD LYS A 88 6.200 -1.523 -16.782 1.00 24.34 C ATOM 1341 CE LYS A 88 5.788 -2.073 -18.137 1.00 4.41 C ATOM 1342 NZ LYS A 88 6.881 -2.859 -18.773 1.00 61.43 N ATOM 0 H LYS A 88 3.841 2.741 -16.611 1.00 15.40 H new ATOM 0 HA LYS A 88 2.581 0.273 -17.116 1.00 5.40 H new ATOM 0 HB2 LYS A 88 4.895 0.504 -17.585 1.00 24.44 H new ATOM 0 HB3 LYS A 88 5.246 1.170 -16.002 1.00 24.44 H new ATOM 0 HG2 LYS A 88 5.245 -0.905 -14.962 1.00 63.33 H new ATOM 0 HG3 LYS A 88 4.156 -1.620 -16.135 1.00 63.33 H new ATOM 0 HD2 LYS A 88 6.953 -0.746 -16.917 1.00 24.34 H new ATOM 0 HD3 LYS A 88 6.662 -2.315 -16.192 1.00 24.34 H new ATOM 0 HE2 LYS A 88 4.907 -2.705 -18.020 1.00 4.41 H new ATOM 0 HE3 LYS A 88 5.505 -1.249 -18.792 1.00 4.41 H new ATOM 0 HZ1 LYS A 88 6.560 -3.217 -19.695 1.00 61.43 H new ATOM 0 HZ2 LYS A 88 7.713 -2.250 -18.908 1.00 61.43 H new ATOM 0 HZ3 LYS A 88 7.134 -3.660 -18.160 1.00 61.43 H new ATOM 1356 N SER A 89 2.927 1.095 -13.951 1.00 73.21 N ATOM 1357 CA SER A 89 2.500 0.756 -12.600 1.00 15.34 C ATOM 1358 C SER A 89 0.980 0.665 -12.520 1.00 43.21 C ATOM 1359 O SER A 89 0.434 -0.113 -11.738 1.00 45.42 O ATOM 1360 CB SER A 89 3.013 1.796 -11.603 1.00 31.22 C ATOM 1361 OG SER A 89 4.391 2.060 -11.805 1.00 21.21 O ATOM 0 H SER A 89 3.438 1.975 -14.024 1.00 73.21 H new ATOM 0 HA SER A 89 2.920 -0.217 -12.346 1.00 15.34 H new ATOM 0 HB2 SER A 89 2.443 2.719 -11.710 1.00 31.22 H new ATOM 0 HB3 SER A 89 2.853 1.439 -10.586 1.00 31.22 H new ATOM 0 HG SER A 89 4.912 1.258 -11.592 1.00 21.21 H new ATOM 1367 N PHE A 90 0.302 1.464 -13.337 1.00 72.24 N ATOM 1368 CA PHE A 90 -1.156 1.474 -13.362 1.00 50.14 C ATOM 1369 C PHE A 90 -1.701 0.102 -13.742 1.00 21.54 C ATOM 1370 O PHE A 90 -2.538 -0.462 -13.036 1.00 53.24 O ATOM 1371 CB PHE A 90 -1.661 2.527 -14.350 1.00 44.30 C ATOM 1372 CG PHE A 90 -3.133 2.799 -14.236 1.00 10.31 C ATOM 1373 CD1 PHE A 90 -4.060 1.847 -14.629 1.00 55.20 C ATOM 1374 CD2 PHE A 90 -3.590 4.007 -13.735 1.00 21.44 C ATOM 1375 CE1 PHE A 90 -5.415 2.095 -14.525 1.00 5.11 C ATOM 1376 CE2 PHE A 90 -4.944 4.262 -13.629 1.00 25.14 C ATOM 1377 CZ PHE A 90 -5.858 3.304 -14.024 1.00 21.41 C ATOM 0 H PHE A 90 0.739 2.113 -13.991 1.00 72.24 H new ATOM 0 HA PHE A 90 -1.512 1.723 -12.362 1.00 50.14 H new ATOM 0 HB2 PHE A 90 -1.114 3.456 -14.189 1.00 44.30 H new ATOM 0 HB3 PHE A 90 -1.438 2.198 -15.365 1.00 44.30 H new ATOM 0 HD1 PHE A 90 -3.719 0.900 -15.021 1.00 55.20 H new ATOM 0 HD2 PHE A 90 -2.880 4.758 -13.424 1.00 21.44 H new ATOM 0 HE1 PHE A 90 -6.127 1.345 -14.835 1.00 5.11 H new ATOM 0 HE2 PHE A 90 -5.287 5.208 -13.238 1.00 25.14 H new ATOM 0 HZ PHE A 90 -6.917 3.500 -13.941 1.00 21.41 H new ATOM 1387 N GLU A 91 -1.221 -0.430 -14.861 1.00 33.34 N ATOM 1388 CA GLU A 91 -1.659 -1.737 -15.337 1.00 24.40 C ATOM 1389 C GLU A 91 -1.393 -2.816 -14.290 1.00 24.54 C ATOM 1390 O GLU A 91 -2.096 -3.824 -14.231 1.00 22.22 O ATOM 1391 CB GLU A 91 -0.948 -2.092 -16.644 1.00 71.10 C ATOM 1392 CG GLU A 91 -0.995 -0.982 -17.682 1.00 71.11 C ATOM 1393 CD GLU A 91 -1.278 -1.502 -19.078 1.00 0.25 C ATOM 1394 OE1 GLU A 91 -0.544 -2.402 -19.537 1.00 51.40 O ATOM 1395 OE2 GLU A 91 -2.234 -1.007 -19.714 1.00 21.30 O ATOM 0 H GLU A 91 -0.528 0.024 -15.456 1.00 33.34 H new ATOM 0 HA GLU A 91 -2.733 -1.688 -15.517 1.00 24.40 H new ATOM 0 HB2 GLU A 91 0.093 -2.333 -16.428 1.00 71.10 H new ATOM 0 HB3 GLU A 91 -1.402 -2.990 -17.063 1.00 71.10 H new ATOM 0 HG2 GLU A 91 -1.764 -0.261 -17.404 1.00 71.11 H new ATOM 0 HG3 GLU A 91 -0.044 -0.449 -17.682 1.00 71.11 H new ATOM 1402 N ASP A 92 -0.374 -2.596 -13.464 1.00 15.11 N ATOM 1403 CA ASP A 92 -0.018 -3.549 -12.419 1.00 75.11 C ATOM 1404 C ASP A 92 -1.054 -3.539 -11.300 1.00 31.14 C ATOM 1405 O ASP A 92 -1.314 -4.565 -10.673 1.00 61.02 O ATOM 1406 CB ASP A 92 1.366 -3.223 -11.853 1.00 73.33 C ATOM 1407 CG ASP A 92 2.409 -3.048 -12.940 1.00 1.20 C ATOM 1408 OD1 ASP A 92 2.166 -3.507 -14.076 1.00 61.52 O ATOM 1409 OD2 ASP A 92 3.469 -2.452 -12.655 1.00 21.55 O ATOM 0 H ASP A 92 0.219 -1.767 -13.498 1.00 15.11 H new ATOM 0 HA ASP A 92 0.004 -4.545 -12.861 1.00 75.11 H new ATOM 0 HB2 ASP A 92 1.307 -2.311 -11.260 1.00 73.33 H new ATOM 0 HB3 ASP A 92 1.677 -4.022 -11.180 1.00 73.33 H new ATOM 1414 N ILE A 93 -1.646 -2.374 -11.058 1.00 41.00 N ATOM 1415 CA ILE A 93 -2.657 -2.233 -10.017 1.00 4.32 C ATOM 1416 C ILE A 93 -3.853 -3.139 -10.298 1.00 30.44 C ATOM 1417 O ILE A 93 -4.517 -3.613 -9.376 1.00 20.54 O ATOM 1418 CB ILE A 93 -3.141 -0.770 -9.899 1.00 32.13 C ATOM 1419 CG1 ILE A 93 -2.008 0.137 -9.430 1.00 11.43 C ATOM 1420 CG2 ILE A 93 -4.313 -0.659 -8.943 1.00 55.14 C ATOM 1421 CD1 ILE A 93 -1.330 -0.341 -8.163 1.00 54.22 C ATOM 0 H ILE A 93 -1.443 -1.515 -11.568 1.00 41.00 H new ATOM 0 HA ILE A 93 -2.195 -2.527 -9.075 1.00 4.32 H new ATOM 0 HB ILE A 93 -3.466 -0.450 -10.889 1.00 32.13 H new ATOM 0 HG12 ILE A 93 -1.264 0.214 -10.223 1.00 11.43 H new ATOM 0 HG13 ILE A 93 -2.402 1.140 -9.265 1.00 11.43 H new ATOM 0 HG21 ILE A 93 -4.633 0.381 -8.879 1.00 55.14 H new ATOM 0 HG22 ILE A 93 -5.138 -1.271 -9.307 1.00 55.14 H new ATOM 0 HG23 ILE A 93 -4.011 -1.007 -7.955 1.00 55.14 H new ATOM 0 HD11 ILE A 93 -0.535 0.354 -7.891 1.00 54.22 H new ATOM 0 HD12 ILE A 93 -2.061 -0.391 -7.356 1.00 54.22 H new ATOM 0 HD13 ILE A 93 -0.905 -1.331 -8.329 1.00 54.22 H new ATOM 1433 N HIS A 94 -4.123 -3.372 -11.578 1.00 72.22 N ATOM 1434 CA HIS A 94 -5.239 -4.218 -11.982 1.00 40.43 C ATOM 1435 C HIS A 94 -4.954 -5.684 -11.667 1.00 75.45 C ATOM 1436 O HIS A 94 -5.732 -6.344 -10.978 1.00 41.11 O ATOM 1437 CB HIS A 94 -5.517 -4.041 -13.478 1.00 43.12 C ATOM 1438 CG HIS A 94 -6.495 -5.031 -14.035 1.00 41.03 C ATOM 1439 ND1 HIS A 94 -7.862 -4.880 -13.932 1.00 74.31 N ATOM 1440 CD2 HIS A 94 -6.296 -6.190 -14.706 1.00 32.41 C ATOM 1441 CE1 HIS A 94 -8.461 -5.904 -14.513 1.00 64.54 C ATOM 1442 NE2 HIS A 94 -7.534 -6.712 -14.992 1.00 74.11 N ATOM 0 H HIS A 94 -3.584 -2.987 -12.353 1.00 72.22 H new ATOM 0 HA HIS A 94 -6.121 -3.915 -11.418 1.00 40.43 H new ATOM 0 HB2 HIS A 94 -5.896 -3.034 -13.650 1.00 43.12 H new ATOM 0 HB3 HIS A 94 -4.578 -4.126 -14.025 1.00 43.12 H new ATOM 0 HD1 HIS A 94 -8.336 -4.099 -13.478 1.00 74.31 H new ATOM 0 HD2 HIS A 94 -5.342 -6.623 -14.968 1.00 32.41 H new ATOM 0 HE1 HIS A 94 -9.528 -6.054 -14.584 1.00 64.54 H new ATOM 1451 N GLN A 95 -3.836 -6.189 -12.178 1.00 60.01 N ATOM 1452 CA GLN A 95 -3.453 -7.578 -11.953 1.00 74.32 C ATOM 1453 C GLN A 95 -3.128 -7.826 -10.483 1.00 21.33 C ATOM 1454 O GLN A 95 -3.320 -8.930 -9.974 1.00 13.52 O ATOM 1455 CB GLN A 95 -2.251 -7.947 -12.823 1.00 33.55 C ATOM 1456 CG GLN A 95 -1.034 -7.074 -12.580 1.00 3.12 C ATOM 1457 CD GLN A 95 -0.134 -7.620 -11.489 1.00 4.43 C ATOM 1458 OE1 GLN A 95 -0.355 -8.717 -10.977 1.00 51.23 O ATOM 1459 NE2 GLN A 95 0.889 -6.854 -11.127 1.00 15.43 N ATOM 0 H GLN A 95 -3.180 -5.658 -12.750 1.00 60.01 H new ATOM 0 HA GLN A 95 -4.299 -8.208 -12.229 1.00 74.32 H new ATOM 0 HB2 GLN A 95 -1.984 -8.987 -12.637 1.00 33.55 H new ATOM 0 HB3 GLN A 95 -2.537 -7.874 -13.872 1.00 33.55 H new ATOM 0 HG2 GLN A 95 -0.465 -6.985 -13.505 1.00 3.12 H new ATOM 0 HG3 GLN A 95 -1.360 -6.070 -12.309 1.00 3.12 H new ATOM 0 HE21 GLN A 95 1.035 -5.951 -11.578 1.00 15.43 H new ATOM 0 HE22 GLN A 95 1.529 -7.169 -10.398 1.00 15.43 H new ATOM 1468 N TYR A 96 -2.636 -6.794 -9.805 1.00 23.44 N ATOM 1469 CA TYR A 96 -2.286 -6.905 -8.393 1.00 33.51 C ATOM 1470 C TYR A 96 -3.502 -7.302 -7.561 1.00 40.55 C ATOM 1471 O TYR A 96 -3.416 -8.172 -6.695 1.00 21.00 O ATOM 1472 CB TYR A 96 -1.709 -5.583 -7.882 1.00 72.24 C ATOM 1473 CG TYR A 96 -0.199 -5.521 -7.935 1.00 13.22 C ATOM 1474 CD1 TYR A 96 0.577 -6.527 -7.376 1.00 72.12 C ATOM 1475 CD2 TYR A 96 0.450 -4.455 -8.547 1.00 4.31 C ATOM 1476 CE1 TYR A 96 1.957 -6.474 -7.423 1.00 12.32 C ATOM 1477 CE2 TYR A 96 1.829 -4.395 -8.599 1.00 11.13 C ATOM 1478 CZ TYR A 96 2.578 -5.407 -8.036 1.00 2.13 C ATOM 1479 OH TYR A 96 3.952 -5.351 -8.086 1.00 54.14 O ATOM 0 H TYR A 96 -2.471 -5.872 -10.210 1.00 23.44 H new ATOM 0 HA TYR A 96 -1.530 -7.684 -8.291 1.00 33.51 H new ATOM 0 HB2 TYR A 96 -2.119 -4.764 -8.474 1.00 72.24 H new ATOM 0 HB3 TYR A 96 -2.035 -5.427 -6.854 1.00 72.24 H new ATOM 0 HD1 TYR A 96 0.094 -7.365 -6.896 1.00 72.12 H new ATOM 0 HD2 TYR A 96 -0.133 -3.661 -8.989 1.00 4.31 H new ATOM 0 HE1 TYR A 96 2.546 -7.264 -6.982 1.00 12.32 H new ATOM 0 HE2 TYR A 96 2.318 -3.560 -9.078 1.00 11.13 H new ATOM 0 HH TYR A 96 4.252 -5.492 -9.008 1.00 54.14 H new ATOM 1489 N ARG A 97 -4.634 -6.660 -7.832 1.00 52.34 N ATOM 1490 CA ARG A 97 -5.866 -6.946 -7.113 1.00 31.45 C ATOM 1491 C ARG A 97 -6.330 -8.376 -7.374 1.00 3.23 C ATOM 1492 O ARG A 97 -6.909 -9.020 -6.499 1.00 43.44 O ATOM 1493 CB ARG A 97 -6.948 -5.960 -7.533 1.00 64.51 C ATOM 1494 CG ARG A 97 -8.278 -6.192 -6.846 1.00 63.35 C ATOM 1495 CD ARG A 97 -9.428 -5.852 -7.768 1.00 43.21 C ATOM 1496 NE ARG A 97 -9.546 -6.803 -8.872 1.00 51.11 N ATOM 1497 CZ ARG A 97 -10.673 -7.024 -9.546 1.00 53.00 C ATOM 1498 NH1 ARG A 97 -11.788 -6.379 -9.224 1.00 41.43 N ATOM 1499 NH2 ARG A 97 -10.685 -7.896 -10.546 1.00 15.24 N ATOM 0 H ARG A 97 -4.721 -5.937 -8.546 1.00 52.34 H new ATOM 0 HA ARG A 97 -5.676 -6.840 -6.045 1.00 31.45 H new ATOM 0 HB2 ARG A 97 -6.609 -4.947 -7.317 1.00 64.51 H new ATOM 0 HB3 ARG A 97 -7.089 -6.026 -8.612 1.00 64.51 H new ATOM 0 HG2 ARG A 97 -8.353 -7.233 -6.533 1.00 63.35 H new ATOM 0 HG3 ARG A 97 -8.337 -5.583 -5.944 1.00 63.35 H new ATOM 0 HD2 ARG A 97 -10.358 -5.841 -7.199 1.00 43.21 H new ATOM 0 HD3 ARG A 97 -9.287 -4.848 -8.168 1.00 43.21 H new ATOM 0 HE ARG A 97 -8.715 -7.329 -9.142 1.00 51.11 H new ATOM 0 HH11 ARG A 97 -11.785 -5.708 -8.455 1.00 41.43 H new ATOM 0 HH12 ARG A 97 -12.647 -6.554 -9.745 1.00 41.43 H new ATOM 0 HH21 ARG A 97 -9.832 -8.396 -10.797 1.00 15.24 H new ATOM 0 HH22 ARG A 97 -11.547 -8.067 -11.063 1.00 15.24 H new ATOM 1513 N GLU A 98 -6.074 -8.864 -8.583 1.00 31.23 N ATOM 1514 CA GLU A 98 -6.467 -10.217 -8.960 1.00 20.22 C ATOM 1515 C GLU A 98 -5.817 -11.249 -8.044 1.00 71.00 C ATOM 1516 O GLU A 98 -6.398 -12.297 -7.763 1.00 43.42 O ATOM 1517 CB GLU A 98 -6.085 -10.493 -10.415 1.00 74.21 C ATOM 1518 CG GLU A 98 -6.802 -9.597 -11.412 1.00 22.24 C ATOM 1519 CD GLU A 98 -6.711 -10.117 -12.833 1.00 3.25 C ATOM 1520 OE1 GLU A 98 -6.397 -11.313 -13.010 1.00 40.44 O ATOM 1521 OE2 GLU A 98 -6.955 -9.327 -13.770 1.00 40.12 O ATOM 0 H GLU A 98 -5.596 -8.343 -9.318 1.00 31.23 H new ATOM 0 HA GLU A 98 -7.549 -10.298 -8.854 1.00 20.22 H new ATOM 0 HB2 GLU A 98 -5.009 -10.363 -10.530 1.00 74.21 H new ATOM 0 HB3 GLU A 98 -6.307 -11.534 -10.649 1.00 74.21 H new ATOM 0 HG2 GLU A 98 -7.851 -9.509 -11.128 1.00 22.24 H new ATOM 0 HG3 GLU A 98 -6.375 -8.595 -11.367 1.00 22.24 H new ATOM 1528 N GLN A 99 -4.609 -10.945 -7.582 1.00 74.23 N ATOM 1529 CA GLN A 99 -3.880 -11.846 -6.697 1.00 21.22 C ATOM 1530 C GLN A 99 -4.558 -11.934 -5.333 1.00 74.51 C ATOM 1531 O GLN A 99 -4.644 -13.009 -4.739 1.00 73.23 O ATOM 1532 CB GLN A 99 -2.434 -11.375 -6.534 1.00 32.44 C ATOM 1533 CG GLN A 99 -1.456 -12.085 -7.455 1.00 52.43 C ATOM 1534 CD GLN A 99 -0.652 -13.153 -6.740 1.00 14.31 C ATOM 1535 OE1 GLN A 99 -0.974 -14.340 -6.810 1.00 13.32 O ATOM 1536 NE2 GLN A 99 0.401 -12.736 -6.046 1.00 15.51 N ATOM 0 H GLN A 99 -4.114 -10.082 -7.806 1.00 74.23 H new ATOM 0 HA GLN A 99 -3.881 -12.839 -7.147 1.00 21.22 H new ATOM 0 HB2 GLN A 99 -2.386 -10.303 -6.724 1.00 32.44 H new ATOM 0 HB3 GLN A 99 -2.125 -11.530 -5.500 1.00 32.44 H new ATOM 0 HG2 GLN A 99 -2.004 -12.540 -8.280 1.00 52.43 H new ATOM 0 HG3 GLN A 99 -0.775 -11.353 -7.890 1.00 52.43 H new ATOM 0 HE21 GLN A 99 0.631 -11.743 -6.016 1.00 15.51 H new ATOM 0 HE22 GLN A 99 0.980 -13.409 -5.544 1.00 15.51 H new ATOM 1545 N ILE A 100 -5.039 -10.797 -4.842 1.00 10.34 N ATOM 1546 CA ILE A 100 -5.710 -10.745 -3.548 1.00 54.12 C ATOM 1547 C ILE A 100 -7.018 -11.529 -3.578 1.00 30.40 C ATOM 1548 O ILE A 100 -7.303 -12.315 -2.674 1.00 73.03 O ATOM 1549 CB ILE A 100 -6.000 -9.291 -3.124 1.00 21.41 C ATOM 1550 CG1 ILE A 100 -4.709 -8.470 -3.126 1.00 2.45 C ATOM 1551 CG2 ILE A 100 -6.654 -9.254 -1.750 1.00 15.13 C ATOM 1552 CD1 ILE A 100 -4.943 -6.976 -3.077 1.00 13.13 C ATOM 0 H ILE A 100 -4.977 -9.898 -5.321 1.00 10.34 H new ATOM 0 HA ILE A 100 -5.036 -11.198 -2.821 1.00 54.12 H new ATOM 0 HB ILE A 100 -6.692 -8.852 -3.843 1.00 21.41 H new ATOM 0 HG12 ILE A 100 -4.101 -8.763 -2.270 1.00 2.45 H new ATOM 0 HG13 ILE A 100 -4.136 -8.711 -4.022 1.00 2.45 H new ATOM 0 HG21 ILE A 100 -6.851 -8.220 -1.468 1.00 15.13 H new ATOM 0 HG22 ILE A 100 -7.593 -9.807 -1.779 1.00 15.13 H new ATOM 0 HG23 ILE A 100 -5.987 -9.709 -1.017 1.00 15.13 H new ATOM 0 HD11 ILE A 100 -3.984 -6.457 -3.081 1.00 13.13 H new ATOM 0 HD12 ILE A 100 -5.525 -6.670 -3.946 1.00 13.13 H new ATOM 0 HD13 ILE A 100 -5.489 -6.723 -2.168 1.00 13.13 H new ATOM 1564 N LYS A 101 -7.812 -11.309 -4.622 1.00 64.12 N ATOM 1565 CA LYS A 101 -9.091 -11.994 -4.768 1.00 14.54 C ATOM 1566 C LYS A 101 -8.906 -13.508 -4.740 1.00 11.04 C ATOM 1567 O LYS A 101 -9.769 -14.240 -4.257 1.00 61.14 O ATOM 1568 CB LYS A 101 -9.771 -11.575 -6.073 1.00 51.14 C ATOM 1569 CG LYS A 101 -10.304 -10.151 -6.050 1.00 54.22 C ATOM 1570 CD LYS A 101 -10.137 -9.471 -7.399 1.00 43.13 C ATOM 1571 CE LYS A 101 -10.930 -10.180 -8.486 1.00 61.42 C ATOM 1572 NZ LYS A 101 -10.051 -10.680 -9.579 1.00 53.31 N ATOM 0 H LYS A 101 -7.592 -10.662 -5.379 1.00 64.12 H new ATOM 0 HA LYS A 101 -9.725 -11.709 -3.928 1.00 14.54 H new ATOM 0 HB2 LYS A 101 -9.059 -11.675 -6.892 1.00 51.14 H new ATOM 0 HB3 LYS A 101 -10.594 -12.259 -6.280 1.00 51.14 H new ATOM 0 HG2 LYS A 101 -11.359 -10.161 -5.775 1.00 54.22 H new ATOM 0 HG3 LYS A 101 -9.780 -9.578 -5.285 1.00 54.22 H new ATOM 0 HD2 LYS A 101 -10.464 -8.434 -7.327 1.00 43.13 H new ATOM 0 HD3 LYS A 101 -9.081 -9.454 -7.670 1.00 43.13 H new ATOM 0 HE2 LYS A 101 -11.477 -11.016 -8.050 1.00 61.42 H new ATOM 0 HE3 LYS A 101 -11.670 -9.496 -8.900 1.00 61.42 H new ATOM 0 HZ1 LYS A 101 -10.629 -10.908 -10.413 1.00 53.31 H new ATOM 0 HZ2 LYS A 101 -9.357 -9.947 -9.829 1.00 53.31 H new ATOM 0 HZ3 LYS A 101 -9.552 -11.535 -9.260 1.00 53.31 H new ATOM 1586 N ARG A 102 -7.773 -13.970 -5.260 1.00 22.43 N ATOM 1587 CA ARG A 102 -7.473 -15.396 -5.293 1.00 71.54 C ATOM 1588 C ARG A 102 -7.284 -15.943 -3.882 1.00 3.13 C ATOM 1589 O ARG A 102 -7.993 -16.856 -3.458 1.00 74.03 O ATOM 1590 CB ARG A 102 -6.216 -15.652 -6.126 1.00 24.31 C ATOM 1591 CG ARG A 102 -6.386 -16.752 -7.160 1.00 33.35 C ATOM 1592 CD ARG A 102 -5.170 -16.853 -8.065 1.00 65.35 C ATOM 1593 NE ARG A 102 -4.942 -18.221 -8.525 1.00 24.55 N ATOM 1594 CZ ARG A 102 -3.773 -18.666 -8.980 1.00 12.41 C ATOM 1595 NH1 ARG A 102 -2.722 -17.856 -9.036 1.00 54.01 N ATOM 1596 NH2 ARG A 102 -3.653 -19.925 -9.378 1.00 32.32 N ATOM 0 H ARG A 102 -7.048 -13.377 -5.664 1.00 22.43 H new ATOM 0 HA ARG A 102 -8.316 -15.911 -5.753 1.00 71.54 H new ATOM 0 HB2 ARG A 102 -5.932 -14.730 -6.632 1.00 24.31 H new ATOM 0 HB3 ARG A 102 -5.395 -15.916 -5.459 1.00 24.31 H new ATOM 0 HG2 ARG A 102 -6.547 -17.705 -6.657 1.00 33.35 H new ATOM 0 HG3 ARG A 102 -7.274 -16.555 -7.761 1.00 33.35 H new ATOM 0 HD2 ARG A 102 -5.304 -16.198 -8.926 1.00 65.35 H new ATOM 0 HD3 ARG A 102 -4.289 -16.499 -7.529 1.00 65.35 H new ATOM 0 HE ARG A 102 -5.725 -18.874 -8.496 1.00 24.55 H new ATOM 0 HH11 ARG A 102 -2.808 -16.887 -8.729 1.00 54.01 H new ATOM 0 HH12 ARG A 102 -1.829 -18.203 -9.386 1.00 54.01 H new ATOM 0 HH21 ARG A 102 -4.456 -20.552 -9.335 1.00 32.32 H new ATOM 0 HH22 ARG A 102 -2.757 -20.266 -9.727 1.00 32.32 H new ATOM 1610 N VAL A 103 -6.324 -15.377 -3.159 1.00 42.01 N ATOM 1611 CA VAL A 103 -6.039 -15.803 -1.796 1.00 10.22 C ATOM 1612 C VAL A 103 -7.229 -15.536 -0.879 1.00 72.03 C ATOM 1613 O VAL A 103 -7.707 -16.436 -0.188 1.00 41.02 O ATOM 1614 CB VAL A 103 -4.798 -15.083 -1.235 1.00 32.42 C ATOM 1615 CG1 VAL A 103 -4.432 -15.637 0.133 1.00 31.14 C ATOM 1616 CG2 VAL A 103 -3.628 -15.206 -2.200 1.00 70.44 C ATOM 0 H VAL A 103 -5.729 -14.620 -3.496 1.00 42.01 H new ATOM 0 HA VAL A 103 -5.844 -16.875 -1.829 1.00 10.22 H new ATOM 0 HB VAL A 103 -5.035 -14.025 -1.121 1.00 32.42 H new ATOM 0 HG11 VAL A 103 -3.553 -15.116 0.513 1.00 31.14 H new ATOM 0 HG12 VAL A 103 -5.266 -15.491 0.820 1.00 31.14 H new ATOM 0 HG13 VAL A 103 -4.214 -16.702 0.048 1.00 31.14 H new ATOM 0 HG21 VAL A 103 -2.760 -14.691 -1.787 1.00 70.44 H new ATOM 0 HG22 VAL A 103 -3.389 -16.259 -2.349 1.00 70.44 H new ATOM 0 HG23 VAL A 103 -3.896 -14.756 -3.156 1.00 70.44 H new ATOM 1626 N LYS A 104 -7.701 -14.294 -0.879 1.00 12.24 N ATOM 1627 CA LYS A 104 -8.836 -13.907 -0.050 1.00 40.11 C ATOM 1628 C LYS A 104 -10.091 -14.677 -0.449 1.00 2.31 C ATOM 1629 O LYS A 104 -10.981 -14.902 0.371 1.00 72.11 O ATOM 1630 CB LYS A 104 -9.089 -12.403 -0.164 1.00 44.54 C ATOM 1631 CG LYS A 104 -7.911 -11.552 0.281 1.00 12.14 C ATOM 1632 CD LYS A 104 -7.727 -11.600 1.789 1.00 63.23 C ATOM 1633 CE LYS A 104 -8.474 -10.470 2.481 1.00 63.40 C ATOM 1634 NZ LYS A 104 -9.412 -10.978 3.520 1.00 71.41 N ATOM 0 H LYS A 104 -7.315 -13.538 -1.444 1.00 12.24 H new ATOM 0 HA LYS A 104 -8.596 -14.151 0.985 1.00 40.11 H new ATOM 0 HB2 LYS A 104 -9.331 -12.161 -1.199 1.00 44.54 H new ATOM 0 HB3 LYS A 104 -9.961 -12.143 0.436 1.00 44.54 H new ATOM 0 HG2 LYS A 104 -7.002 -11.902 -0.209 1.00 12.14 H new ATOM 0 HG3 LYS A 104 -8.066 -10.520 -0.035 1.00 12.14 H new ATOM 0 HD2 LYS A 104 -8.082 -12.558 2.169 1.00 63.23 H new ATOM 0 HD3 LYS A 104 -6.666 -11.536 2.029 1.00 63.23 H new ATOM 0 HE2 LYS A 104 -7.757 -9.789 2.941 1.00 63.40 H new ATOM 0 HE3 LYS A 104 -9.030 -9.895 1.740 1.00 63.40 H new ATOM 0 HZ1 LYS A 104 -9.901 -10.177 3.968 1.00 71.41 H new ATOM 0 HZ2 LYS A 104 -10.112 -11.608 3.078 1.00 71.41 H new ATOM 0 HZ3 LYS A 104 -8.879 -11.505 4.241 1.00 71.41 H new ATOM 1648 N ASP A 105 -10.156 -15.080 -1.715 1.00 14.30 N ATOM 1649 CA ASP A 105 -11.303 -15.825 -2.223 1.00 4.42 C ATOM 1650 C ASP A 105 -12.570 -14.978 -2.165 1.00 11.33 C ATOM 1651 O ASP A 105 -13.627 -15.449 -1.743 1.00 14.35 O ATOM 1652 CB ASP A 105 -11.496 -17.114 -1.421 1.00 1.42 C ATOM 1653 CG ASP A 105 -12.287 -18.158 -2.184 1.00 12.13 C ATOM 1654 OD1 ASP A 105 -13.532 -18.056 -2.211 1.00 43.41 O ATOM 1655 OD2 ASP A 105 -11.663 -19.077 -2.754 1.00 23.04 O ATOM 0 H ASP A 105 -9.428 -14.903 -2.407 1.00 14.30 H new ATOM 0 HA ASP A 105 -11.108 -16.081 -3.264 1.00 4.42 H new ATOM 0 HB2 ASP A 105 -10.521 -17.523 -1.156 1.00 1.42 H new ATOM 0 HB3 ASP A 105 -12.009 -16.884 -0.487 1.00 1.42 H new ATOM 1660 N SER A 106 -12.456 -13.725 -2.592 1.00 64.11 N ATOM 1661 CA SER A 106 -13.592 -12.810 -2.591 1.00 15.32 C ATOM 1662 C SER A 106 -13.310 -11.593 -3.466 1.00 62.43 C ATOM 1663 O SER A 106 -12.158 -11.195 -3.641 1.00 64.12 O ATOM 1664 CB SER A 106 -13.910 -12.362 -1.163 1.00 11.14 C ATOM 1665 OG SER A 106 -14.774 -13.283 -0.520 1.00 73.21 O ATOM 0 H SER A 106 -11.588 -13.320 -2.943 1.00 64.11 H new ATOM 0 HA SER A 106 -14.453 -13.338 -3.000 1.00 15.32 H new ATOM 0 HB2 SER A 106 -12.985 -12.268 -0.594 1.00 11.14 H new ATOM 0 HB3 SER A 106 -14.374 -11.376 -1.183 1.00 11.14 H new ATOM 0 HG SER A 106 -14.566 -14.192 -0.822 1.00 73.21 H new ATOM 1671 N ASP A 107 -14.369 -11.007 -4.015 1.00 31.43 N ATOM 1672 CA ASP A 107 -14.234 -9.835 -4.873 1.00 53.52 C ATOM 1673 C ASP A 107 -14.219 -8.554 -4.046 1.00 30.01 C ATOM 1674 O ASP A 107 -13.499 -7.607 -4.363 1.00 63.21 O ATOM 1675 CB ASP A 107 -15.376 -9.786 -5.889 1.00 31.51 C ATOM 1676 CG ASP A 107 -16.736 -9.684 -5.226 1.00 3.11 C ATOM 1677 OD1 ASP A 107 -17.025 -10.510 -4.334 1.00 4.52 O ATOM 1678 OD2 ASP A 107 -17.511 -8.779 -5.598 1.00 51.22 O ATOM 0 H ASP A 107 -15.329 -11.324 -3.881 1.00 31.43 H new ATOM 0 HA ASP A 107 -13.286 -9.914 -5.406 1.00 53.52 H new ATOM 0 HB2 ASP A 107 -15.233 -8.932 -6.551 1.00 31.51 H new ATOM 0 HB3 ASP A 107 -15.344 -10.681 -6.511 1.00 31.51 H new ATOM 1683 N ASP A 108 -15.020 -8.531 -2.986 1.00 44.24 N ATOM 1684 CA ASP A 108 -15.099 -7.365 -2.114 1.00 43.34 C ATOM 1685 C ASP A 108 -14.186 -7.527 -0.903 1.00 23.14 C ATOM 1686 O ASP A 108 -14.600 -8.044 0.135 1.00 0.34 O ATOM 1687 CB ASP A 108 -16.542 -7.143 -1.655 1.00 33.00 C ATOM 1688 CG ASP A 108 -17.431 -6.624 -2.768 1.00 41.11 C ATOM 1689 OD1 ASP A 108 -16.897 -6.270 -3.841 1.00 43.35 O ATOM 1690 OD2 ASP A 108 -18.663 -6.573 -2.568 1.00 3.31 O ATOM 0 H ASP A 108 -15.623 -9.306 -2.710 1.00 44.24 H new ATOM 0 HA ASP A 108 -14.767 -6.495 -2.681 1.00 43.34 H new ATOM 0 HB2 ASP A 108 -16.948 -8.081 -1.277 1.00 33.00 H new ATOM 0 HB3 ASP A 108 -16.552 -6.435 -0.826 1.00 33.00 H new ATOM 1695 N VAL A 109 -12.942 -7.081 -1.043 1.00 3.20 N ATOM 1696 CA VAL A 109 -11.970 -7.175 0.039 1.00 65.10 C ATOM 1697 C VAL A 109 -11.512 -5.790 0.490 1.00 63.42 C ATOM 1698 O VAL A 109 -11.536 -4.836 -0.287 1.00 73.24 O ATOM 1699 CB VAL A 109 -10.739 -8.002 -0.379 1.00 23.02 C ATOM 1700 CG1 VAL A 109 -11.151 -9.409 -0.784 1.00 22.22 C ATOM 1701 CG2 VAL A 109 -9.988 -7.314 -1.510 1.00 70.32 C ATOM 0 H VAL A 109 -12.584 -6.651 -1.896 1.00 3.20 H new ATOM 0 HA VAL A 109 -12.469 -7.677 0.868 1.00 65.10 H new ATOM 0 HB VAL A 109 -10.070 -8.076 0.478 1.00 23.02 H new ATOM 0 HG11 VAL A 109 -10.268 -9.977 -1.076 1.00 22.22 H new ATOM 0 HG12 VAL A 109 -11.638 -9.902 0.057 1.00 22.22 H new ATOM 0 HG13 VAL A 109 -11.843 -9.358 -1.624 1.00 22.22 H new ATOM 0 HG21 VAL A 109 -9.122 -7.914 -1.790 1.00 70.32 H new ATOM 0 HG22 VAL A 109 -10.648 -7.204 -2.371 1.00 70.32 H new ATOM 0 HG23 VAL A 109 -9.655 -6.330 -1.180 1.00 70.32 H new ATOM 1711 N PRO A 110 -11.086 -5.663 1.758 1.00 23.23 N ATOM 1712 CA PRO A 110 -10.620 -4.388 2.310 1.00 35.44 C ATOM 1713 C PRO A 110 -9.271 -3.966 1.736 1.00 60.30 C ATOM 1714 O PRO A 110 -8.241 -4.568 2.039 1.00 52.13 O ATOM 1715 CB PRO A 110 -10.498 -4.672 3.808 1.00 52.35 C ATOM 1716 CG PRO A 110 -10.272 -6.142 3.899 1.00 23.13 C ATOM 1717 CD PRO A 110 -11.026 -6.753 2.749 1.00 11.44 C ATOM 0 HA PRO A 110 -11.299 -3.569 2.072 1.00 35.44 H new ATOM 0 HB2 PRO A 110 -9.671 -4.116 4.250 1.00 52.35 H new ATOM 0 HB3 PRO A 110 -11.401 -4.377 4.342 1.00 52.35 H new ATOM 0 HG2 PRO A 110 -9.210 -6.377 3.837 1.00 23.13 H new ATOM 0 HG3 PRO A 110 -10.630 -6.533 4.851 1.00 23.13 H new ATOM 0 HD2 PRO A 110 -10.512 -7.628 2.352 1.00 11.44 H new ATOM 0 HD3 PRO A 110 -12.022 -7.077 3.050 1.00 11.44 H new ATOM 1725 N MET A 111 -9.285 -2.928 0.907 1.00 44.44 N ATOM 1726 CA MET A 111 -8.063 -2.425 0.291 1.00 55.33 C ATOM 1727 C MET A 111 -8.236 -0.979 -0.162 1.00 52.01 C ATOM 1728 O MET A 111 -9.348 -0.450 -0.175 1.00 21.12 O ATOM 1729 CB MET A 111 -7.671 -3.300 -0.901 1.00 2.25 C ATOM 1730 CG MET A 111 -8.781 -3.463 -1.925 1.00 65.42 C ATOM 1731 SD MET A 111 -8.157 -3.860 -3.569 1.00 74.21 S ATOM 1732 CE MET A 111 -7.871 -5.619 -3.404 1.00 51.51 C ATOM 0 H MET A 111 -10.129 -2.419 0.646 1.00 44.44 H new ATOM 0 HA MET A 111 -7.269 -2.461 1.037 1.00 55.33 H new ATOM 0 HB2 MET A 111 -6.799 -2.866 -1.389 1.00 2.25 H new ATOM 0 HB3 MET A 111 -7.376 -4.284 -0.537 1.00 2.25 H new ATOM 0 HG2 MET A 111 -9.459 -4.251 -1.598 1.00 65.42 H new ATOM 0 HG3 MET A 111 -9.363 -2.543 -1.974 1.00 65.42 H new ATOM 0 HE1 MET A 111 -7.147 -5.942 -4.152 1.00 51.51 H new ATOM 0 HE2 MET A 111 -7.483 -5.833 -2.408 1.00 51.51 H new ATOM 0 HE3 MET A 111 -8.808 -6.155 -3.551 1.00 51.51 H new ATOM 1742 N VAL A 112 -7.129 -0.344 -0.531 1.00 44.40 N ATOM 1743 CA VAL A 112 -7.155 1.040 -0.982 1.00 22.12 C ATOM 1744 C VAL A 112 -6.118 1.283 -2.074 1.00 74.24 C ATOM 1745 O VAL A 112 -5.072 0.635 -2.105 1.00 20.42 O ATOM 1746 CB VAL A 112 -6.891 2.009 0.183 1.00 4.20 C ATOM 1747 CG1 VAL A 112 -7.046 3.451 -0.274 1.00 30.21 C ATOM 1748 CG2 VAL A 112 -7.820 1.704 1.348 1.00 61.51 C ATOM 0 H VAL A 112 -6.201 -0.768 -0.526 1.00 44.40 H new ATOM 0 HA VAL A 112 -8.151 1.225 -1.384 1.00 22.12 H new ATOM 0 HB VAL A 112 -5.864 1.872 0.522 1.00 4.20 H new ATOM 0 HG11 VAL A 112 -6.855 4.121 0.564 1.00 30.21 H new ATOM 0 HG12 VAL A 112 -6.334 3.658 -1.073 1.00 30.21 H new ATOM 0 HG13 VAL A 112 -8.060 3.609 -0.641 1.00 30.21 H new ATOM 0 HG21 VAL A 112 -7.620 2.398 2.164 1.00 61.51 H new ATOM 0 HG22 VAL A 112 -8.856 1.811 1.025 1.00 61.51 H new ATOM 0 HG23 VAL A 112 -7.651 0.683 1.691 1.00 61.51 H new ATOM 1758 N LEU A 113 -6.415 2.222 -2.966 1.00 24.02 N ATOM 1759 CA LEU A 113 -5.507 2.553 -4.057 1.00 40.13 C ATOM 1760 C LEU A 113 -4.875 3.924 -3.838 1.00 54.41 C ATOM 1761 O LEU A 113 -5.543 4.951 -3.950 1.00 41.41 O ATOM 1762 CB LEU A 113 -6.250 2.530 -5.395 1.00 52.55 C ATOM 1763 CG LEU A 113 -5.403 2.897 -6.618 1.00 22.24 C ATOM 1764 CD1 LEU A 113 -4.026 2.254 -6.532 1.00 63.54 C ATOM 1765 CD2 LEU A 113 -6.108 2.478 -7.899 1.00 44.33 C ATOM 0 H LEU A 113 -7.277 2.767 -2.955 1.00 24.02 H new ATOM 0 HA LEU A 113 -4.715 1.804 -4.077 1.00 40.13 H new ATOM 0 HB2 LEU A 113 -6.664 1.533 -5.546 1.00 52.55 H new ATOM 0 HB3 LEU A 113 -7.092 3.219 -5.336 1.00 52.55 H new ATOM 0 HG LEU A 113 -5.274 3.979 -6.632 1.00 22.24 H new ATOM 0 HD11 LEU A 113 -3.441 2.528 -7.410 1.00 63.54 H new ATOM 0 HD12 LEU A 113 -3.517 2.603 -5.634 1.00 63.54 H new ATOM 0 HD13 LEU A 113 -4.133 1.170 -6.490 1.00 63.54 H new ATOM 0 HD21 LEU A 113 -5.492 2.746 -8.758 1.00 44.33 H new ATOM 0 HD22 LEU A 113 -6.268 1.400 -7.890 1.00 44.33 H new ATOM 0 HD23 LEU A 113 -7.069 2.987 -7.969 1.00 44.33 H new ATOM 1777 N VAL A 114 -3.584 3.932 -3.523 1.00 53.24 N ATOM 1778 CA VAL A 114 -2.863 5.176 -3.286 1.00 32.22 C ATOM 1779 C VAL A 114 -2.050 5.585 -4.509 1.00 72.21 C ATOM 1780 O VAL A 114 -1.494 4.738 -5.209 1.00 42.04 O ATOM 1781 CB VAL A 114 -1.919 5.059 -2.076 1.00 73.35 C ATOM 1782 CG1 VAL A 114 -1.358 6.422 -1.703 1.00 43.35 C ATOM 1783 CG2 VAL A 114 -2.640 4.430 -0.893 1.00 21.54 C ATOM 0 H VAL A 114 -3.016 3.090 -3.426 1.00 53.24 H new ATOM 0 HA VAL A 114 -3.614 5.938 -3.080 1.00 32.22 H new ATOM 0 HB VAL A 114 -1.087 4.411 -2.350 1.00 73.35 H new ATOM 0 HG11 VAL A 114 -0.693 6.319 -0.846 1.00 43.35 H new ATOM 0 HG12 VAL A 114 -0.802 6.830 -2.547 1.00 43.35 H new ATOM 0 HG13 VAL A 114 -2.177 7.095 -1.449 1.00 43.35 H new ATOM 0 HG21 VAL A 114 -1.956 4.356 -0.048 1.00 21.54 H new ATOM 0 HG22 VAL A 114 -3.493 5.049 -0.616 1.00 21.54 H new ATOM 0 HG23 VAL A 114 -2.988 3.434 -1.167 1.00 21.54 H new ATOM 1793 N GLY A 115 -1.982 6.888 -4.759 1.00 41.10 N ATOM 1794 CA GLY A 115 -1.232 7.389 -5.896 1.00 14.23 C ATOM 1795 C GLY A 115 -0.010 8.182 -5.477 1.00 52.52 C ATOM 1796 O GLY A 115 -0.062 9.408 -5.375 1.00 15.24 O ATOM 0 H GLY A 115 -2.433 7.607 -4.194 1.00 41.10 H new ATOM 0 HA2 GLY A 115 -0.922 6.552 -6.521 1.00 14.23 H new ATOM 0 HA3 GLY A 115 -1.879 8.019 -6.506 1.00 14.23 H new ATOM 1800 N ASN A 116 1.092 7.481 -5.233 1.00 51.52 N ATOM 1801 CA ASN A 116 2.333 8.127 -4.820 1.00 50.54 C ATOM 1802 C ASN A 116 2.833 9.089 -5.894 1.00 20.23 C ATOM 1803 O ASN A 116 2.336 9.091 -7.020 1.00 53.35 O ATOM 1804 CB ASN A 116 3.402 7.074 -4.523 1.00 62.20 C ATOM 1805 CG ASN A 116 4.421 7.554 -3.508 1.00 13.01 C ATOM 1806 OD1 ASN A 116 4.485 8.741 -3.188 1.00 20.31 O ATOM 1807 ND2 ASN A 116 5.225 6.630 -2.994 1.00 4.41 N ATOM 0 H ASN A 116 1.151 6.466 -5.314 1.00 51.52 H new ATOM 0 HA ASN A 116 2.132 8.699 -3.914 1.00 50.54 H new ATOM 0 HB2 ASN A 116 2.922 6.168 -4.152 1.00 62.20 H new ATOM 0 HB3 ASN A 116 3.913 6.808 -5.448 1.00 62.20 H new ATOM 0 HD21 ASN A 116 5.930 6.893 -2.306 1.00 4.41 H new ATOM 0 HD22 ASN A 116 5.137 5.657 -3.288 1.00 4.41 H new ATOM 1814 N LYS A 117 3.820 9.904 -5.536 1.00 24.13 N ATOM 1815 CA LYS A 117 4.390 10.872 -6.466 1.00 23.30 C ATOM 1816 C LYS A 117 3.333 11.868 -6.935 1.00 43.21 C ATOM 1817 O LYS A 117 3.027 11.952 -8.124 1.00 32.35 O ATOM 1818 CB LYS A 117 5.005 10.155 -7.670 1.00 53.02 C ATOM 1819 CG LYS A 117 6.378 9.566 -7.391 1.00 12.15 C ATOM 1820 CD LYS A 117 6.281 8.314 -6.535 1.00 44.15 C ATOM 1821 CE LYS A 117 7.472 7.394 -6.752 1.00 64.34 C ATOM 1822 NZ LYS A 117 7.051 6.040 -7.206 1.00 53.21 N ATOM 0 H LYS A 117 4.242 9.913 -4.607 1.00 24.13 H new ATOM 0 HA LYS A 117 5.172 11.422 -5.942 1.00 23.30 H new ATOM 0 HB2 LYS A 117 4.334 9.357 -7.989 1.00 53.02 H new ATOM 0 HB3 LYS A 117 5.082 10.857 -8.500 1.00 53.02 H new ATOM 0 HG2 LYS A 117 6.871 9.327 -8.333 1.00 12.15 H new ATOM 0 HG3 LYS A 117 6.998 10.307 -6.886 1.00 12.15 H new ATOM 0 HD2 LYS A 117 6.224 8.595 -5.483 1.00 44.15 H new ATOM 0 HD3 LYS A 117 5.361 7.781 -6.772 1.00 44.15 H new ATOM 0 HE2 LYS A 117 8.140 7.834 -7.492 1.00 64.34 H new ATOM 0 HE3 LYS A 117 8.037 7.307 -5.824 1.00 64.34 H new ATOM 0 HZ1 LYS A 117 7.794 5.350 -6.976 1.00 53.21 H new ATOM 0 HZ2 LYS A 117 6.168 5.772 -6.726 1.00 53.21 H new ATOM 0 HZ3 LYS A 117 6.896 6.051 -8.234 1.00 53.21 H new ATOM 1836 N CYS A 118 2.780 12.623 -5.991 1.00 62.31 N ATOM 1837 CA CYS A 118 1.759 13.615 -6.308 1.00 52.31 C ATOM 1838 C CYS A 118 2.344 15.028 -6.334 1.00 1.30 C ATOM 1839 O CYS A 118 1.617 16.004 -6.519 1.00 21.30 O ATOM 1840 CB CYS A 118 0.619 13.544 -5.291 1.00 34.13 C ATOM 1841 SG CYS A 118 -0.841 14.508 -5.750 1.00 0.41 S ATOM 0 H CYS A 118 3.021 12.567 -5.002 1.00 62.31 H new ATOM 0 HA CYS A 118 1.372 13.389 -7.301 1.00 52.31 H new ATOM 0 HB2 CYS A 118 0.327 12.502 -5.161 1.00 34.13 H new ATOM 0 HB3 CYS A 118 0.985 13.895 -4.326 1.00 34.13 H new ATOM 0 HG CYS A 118 -0.468 15.614 -6.323 1.00 0.41 H new ATOM 1847 N ASP A 119 3.659 15.134 -6.148 1.00 42.12 N ATOM 1848 CA ASP A 119 4.329 16.430 -6.153 1.00 24.33 C ATOM 1849 C ASP A 119 5.216 16.589 -7.386 1.00 31.43 C ATOM 1850 O ASP A 119 5.590 17.704 -7.751 1.00 65.40 O ATOM 1851 CB ASP A 119 5.166 16.598 -4.884 1.00 14.31 C ATOM 1852 CG ASP A 119 6.284 15.577 -4.787 1.00 14.42 C ATOM 1853 OD1 ASP A 119 7.384 15.850 -5.313 1.00 71.35 O ATOM 1854 OD2 ASP A 119 6.060 14.506 -4.185 1.00 23.55 O ATOM 0 H ASP A 119 4.279 14.339 -5.992 1.00 42.12 H new ATOM 0 HA ASP A 119 3.562 17.204 -6.183 1.00 24.33 H new ATOM 0 HB2 ASP A 119 5.592 17.601 -4.863 1.00 14.31 H new ATOM 0 HB3 ASP A 119 4.519 16.508 -4.011 1.00 14.31 H new ATOM 1859 N LEU A 120 5.552 15.470 -8.025 1.00 70.12 N ATOM 1860 CA LEU A 120 6.397 15.488 -9.216 1.00 65.20 C ATOM 1861 C LEU A 120 5.874 16.487 -10.246 1.00 50.43 C ATOM 1862 O LEU A 120 4.819 17.093 -10.057 1.00 2.21 O ATOM 1863 CB LEU A 120 6.469 14.090 -9.833 1.00 73.04 C ATOM 1864 CG LEU A 120 7.702 13.274 -9.442 1.00 15.31 C ATOM 1865 CD1 LEU A 120 7.673 11.909 -10.111 1.00 2.13 C ATOM 1866 CD2 LEU A 120 8.973 14.024 -9.810 1.00 55.23 C ATOM 0 H LEU A 120 5.251 14.539 -7.737 1.00 70.12 H new ATOM 0 HA LEU A 120 7.398 15.799 -8.916 1.00 65.20 H new ATOM 0 HB2 LEU A 120 5.577 13.535 -9.543 1.00 73.04 H new ATOM 0 HB3 LEU A 120 6.445 14.187 -10.918 1.00 73.04 H new ATOM 0 HG LEU A 120 7.690 13.126 -8.362 1.00 15.31 H new ATOM 0 HD11 LEU A 120 8.558 11.343 -9.821 1.00 2.13 H new ATOM 0 HD12 LEU A 120 6.779 11.370 -9.799 1.00 2.13 H new ATOM 0 HD13 LEU A 120 7.661 12.035 -11.194 1.00 2.13 H new ATOM 0 HD21 LEU A 120 9.841 13.430 -9.525 1.00 55.23 H new ATOM 0 HD22 LEU A 120 8.992 14.202 -10.885 1.00 55.23 H new ATOM 0 HD23 LEU A 120 8.998 14.978 -9.284 1.00 55.23 H new ATOM 1878 N ALA A 121 6.620 16.656 -11.333 1.00 14.22 N ATOM 1879 CA ALA A 121 6.231 17.583 -12.390 1.00 53.24 C ATOM 1880 C ALA A 121 6.204 16.895 -13.752 1.00 62.54 C ATOM 1881 O ALA A 121 6.331 17.548 -14.788 1.00 41.53 O ATOM 1882 CB ALA A 121 7.179 18.773 -12.418 1.00 1.55 C ATOM 0 H ALA A 121 7.497 16.164 -11.505 1.00 14.22 H new ATOM 0 HA ALA A 121 5.222 17.935 -12.175 1.00 53.24 H new ATOM 0 HB1 ALA A 121 6.879 19.458 -13.211 1.00 1.55 H new ATOM 0 HB2 ALA A 121 7.143 19.290 -11.459 1.00 1.55 H new ATOM 0 HB3 ALA A 121 8.195 18.425 -12.605 1.00 1.55 H new ATOM 1888 N ALA A 122 6.040 15.576 -13.746 1.00 14.40 N ATOM 1889 CA ALA A 122 5.998 14.807 -14.982 1.00 64.25 C ATOM 1890 C ALA A 122 5.040 13.625 -14.863 1.00 12.14 C ATOM 1891 O ALA A 122 5.441 12.470 -15.001 1.00 1.11 O ATOM 1892 CB ALA A 122 7.394 14.323 -15.341 1.00 45.23 C ATOM 0 H ALA A 122 5.934 15.019 -12.898 1.00 14.40 H new ATOM 0 HA ALA A 122 5.631 15.457 -15.776 1.00 64.25 H new ATOM 0 HB1 ALA A 122 7.353 13.749 -16.267 1.00 45.23 H new ATOM 0 HB2 ALA A 122 8.053 15.181 -15.475 1.00 45.23 H new ATOM 0 HB3 ALA A 122 7.778 13.692 -14.539 1.00 45.23 H new ATOM 1898 N ARG A 123 3.770 13.922 -14.604 1.00 51.05 N ATOM 1899 CA ARG A 123 2.757 12.881 -14.464 1.00 52.45 C ATOM 1900 C ARG A 123 2.210 12.464 -15.826 1.00 1.03 C ATOM 1901 O ARG A 123 2.060 13.291 -16.726 1.00 24.42 O ATOM 1902 CB ARG A 123 1.615 13.366 -13.566 1.00 25.44 C ATOM 1903 CG ARG A 123 0.768 14.464 -14.190 1.00 0.21 C ATOM 1904 CD ARG A 123 -0.520 14.683 -13.412 1.00 34.44 C ATOM 1905 NE ARG A 123 -0.268 14.943 -11.997 1.00 41.23 N ATOM 1906 CZ ARG A 123 0.252 16.077 -11.532 1.00 45.23 C ATOM 1907 NH1 ARG A 123 0.573 17.058 -12.366 1.00 53.31 N ATOM 1908 NH2 ARG A 123 0.450 16.231 -10.230 1.00 22.34 N ATOM 0 H ARG A 123 3.418 14.872 -14.487 1.00 51.05 H new ATOM 0 HA ARG A 123 3.227 12.013 -14.002 1.00 52.45 H new ATOM 0 HB2 ARG A 123 0.973 12.520 -13.321 1.00 25.44 H new ATOM 0 HB3 ARG A 123 2.033 13.731 -12.628 1.00 25.44 H new ATOM 0 HG2 ARG A 123 1.338 15.392 -14.220 1.00 0.21 H new ATOM 0 HG3 ARG A 123 0.532 14.201 -15.221 1.00 0.21 H new ATOM 0 HD2 ARG A 123 -1.065 15.522 -13.843 1.00 34.44 H new ATOM 0 HD3 ARG A 123 -1.157 13.804 -13.511 1.00 34.44 H new ATOM 0 HE ARG A 123 -0.504 14.213 -11.325 1.00 41.23 H new ATOM 0 HH11 ARG A 123 0.422 16.945 -13.368 1.00 53.31 H new ATOM 0 HH12 ARG A 123 0.971 17.925 -12.005 1.00 53.31 H new ATOM 0 HH21 ARG A 123 0.204 15.481 -9.584 1.00 22.34 H new ATOM 0 HH22 ARG A 123 0.848 17.100 -9.874 1.00 22.34 H new ATOM 1922 N THR A 124 1.911 11.177 -15.968 1.00 45.14 N ATOM 1923 CA THR A 124 1.377 10.649 -17.217 1.00 35.45 C ATOM 1924 C THR A 124 -0.076 10.218 -17.045 1.00 31.22 C ATOM 1925 O THR A 124 -0.934 10.551 -17.862 1.00 33.20 O ATOM 1926 CB THR A 124 2.219 9.466 -17.697 1.00 34.43 C ATOM 1927 OG1 THR A 124 2.185 8.411 -16.753 1.00 51.54 O ATOM 1928 CG2 THR A 124 3.670 9.822 -17.937 1.00 42.54 C ATOM 0 H THR A 124 2.030 10.480 -15.233 1.00 45.14 H new ATOM 0 HA THR A 124 1.418 11.441 -17.965 1.00 35.45 H new ATOM 0 HB THR A 124 1.776 9.162 -18.645 1.00 34.43 H new ATOM 0 HG1 THR A 124 2.058 7.559 -17.220 1.00 51.54 H new ATOM 0 HG21 THR A 124 4.210 8.938 -18.276 1.00 42.54 H new ATOM 0 HG22 THR A 124 3.733 10.599 -18.698 1.00 42.54 H new ATOM 0 HG23 THR A 124 4.114 10.185 -17.010 1.00 42.54 H new ATOM 1936 N VAL A 125 -0.344 9.477 -15.975 1.00 61.52 N ATOM 1937 CA VAL A 125 -1.688 9.000 -15.692 1.00 11.45 C ATOM 1938 C VAL A 125 -2.416 9.947 -14.742 1.00 71.14 C ATOM 1939 O VAL A 125 -2.125 9.987 -13.546 1.00 3.51 O ATOM 1940 CB VAL A 125 -1.658 7.590 -15.074 1.00 61.41 C ATOM 1941 CG1 VAL A 125 -3.068 7.069 -14.875 1.00 14.13 C ATOM 1942 CG2 VAL A 125 -0.852 6.641 -15.947 1.00 33.22 C ATOM 0 H VAL A 125 0.356 9.194 -15.289 1.00 61.52 H new ATOM 0 HA VAL A 125 -2.222 8.962 -16.641 1.00 11.45 H new ATOM 0 HB VAL A 125 -1.174 7.650 -14.099 1.00 61.41 H new ATOM 0 HG11 VAL A 125 -3.029 6.071 -14.437 1.00 14.13 H new ATOM 0 HG12 VAL A 125 -3.612 7.737 -14.207 1.00 14.13 H new ATOM 0 HG13 VAL A 125 -3.578 7.023 -15.837 1.00 14.13 H new ATOM 0 HG21 VAL A 125 -0.842 5.650 -15.494 1.00 33.22 H new ATOM 0 HG22 VAL A 125 -1.305 6.583 -16.937 1.00 33.22 H new ATOM 0 HG23 VAL A 125 0.170 7.009 -16.037 1.00 33.22 H new ATOM 1952 N GLU A 126 -3.362 10.706 -15.282 1.00 5.20 N ATOM 1953 CA GLU A 126 -4.132 11.652 -14.483 1.00 11.33 C ATOM 1954 C GLU A 126 -4.993 10.923 -13.455 1.00 42.32 C ATOM 1955 O GLU A 126 -5.220 9.718 -13.563 1.00 64.50 O ATOM 1956 CB GLU A 126 -5.015 12.516 -15.385 1.00 4.35 C ATOM 1957 CG GLU A 126 -5.782 11.721 -16.429 1.00 2.24 C ATOM 1958 CD GLU A 126 -6.916 12.514 -17.049 1.00 25.11 C ATOM 1959 OE1 GLU A 126 -7.545 13.315 -16.326 1.00 3.04 O ATOM 1960 OE2 GLU A 126 -7.175 12.333 -18.257 1.00 51.42 O ATOM 0 H GLU A 126 -3.615 10.685 -16.270 1.00 5.20 H new ATOM 0 HA GLU A 126 -3.430 12.295 -13.952 1.00 11.33 H new ATOM 0 HB2 GLU A 126 -5.724 13.066 -14.766 1.00 4.35 H new ATOM 0 HB3 GLU A 126 -4.392 13.255 -15.889 1.00 4.35 H new ATOM 0 HG2 GLU A 126 -5.096 11.401 -17.213 1.00 2.24 H new ATOM 0 HG3 GLU A 126 -6.184 10.818 -15.970 1.00 2.24 H new ATOM 1967 N SER A 127 -5.469 11.663 -12.458 1.00 54.41 N ATOM 1968 CA SER A 127 -6.304 11.088 -11.409 1.00 73.43 C ATOM 1969 C SER A 127 -7.570 10.468 -11.994 1.00 52.52 C ATOM 1970 O SER A 127 -8.107 9.503 -11.451 1.00 11.53 O ATOM 1971 CB SER A 127 -6.676 12.159 -10.381 1.00 61.41 C ATOM 1972 OG SER A 127 -5.519 12.788 -9.858 1.00 41.53 O ATOM 0 H SER A 127 -5.291 12.662 -12.355 1.00 54.41 H new ATOM 0 HA SER A 127 -5.732 10.302 -10.917 1.00 73.43 H new ATOM 0 HB2 SER A 127 -7.321 12.905 -10.846 1.00 61.41 H new ATOM 0 HB3 SER A 127 -7.246 11.706 -9.570 1.00 61.41 H new ATOM 0 HG SER A 127 -5.353 12.463 -8.949 1.00 41.53 H new ATOM 1978 N ARG A 128 -8.041 11.029 -13.104 1.00 13.23 N ATOM 1979 CA ARG A 128 -9.244 10.532 -13.764 1.00 73.40 C ATOM 1980 C ARG A 128 -9.102 9.051 -14.112 1.00 41.54 C ATOM 1981 O ARG A 128 -9.992 8.249 -13.828 1.00 3.03 O ATOM 1982 CB ARG A 128 -9.524 11.347 -15.030 1.00 32.22 C ATOM 1983 CG ARG A 128 -10.649 10.788 -15.888 1.00 63.03 C ATOM 1984 CD ARG A 128 -11.963 10.741 -15.127 1.00 50.12 C ATOM 1985 NE ARG A 128 -13.104 10.553 -16.021 1.00 51.11 N ATOM 1986 CZ ARG A 128 -14.372 10.718 -15.650 1.00 34.52 C ATOM 1987 NH1 ARG A 128 -14.667 11.070 -14.405 1.00 71.21 N ATOM 1988 NH2 ARG A 128 -15.348 10.530 -16.528 1.00 21.03 N ATOM 0 H ARG A 128 -7.607 11.829 -13.566 1.00 13.23 H new ATOM 0 HA ARG A 128 -10.083 10.642 -13.076 1.00 73.40 H new ATOM 0 HB2 ARG A 128 -9.772 12.369 -14.744 1.00 32.22 H new ATOM 0 HB3 ARG A 128 -8.614 11.395 -15.628 1.00 32.22 H new ATOM 0 HG2 ARG A 128 -10.767 11.403 -16.780 1.00 63.03 H new ATOM 0 HG3 ARG A 128 -10.387 9.785 -16.224 1.00 63.03 H new ATOM 0 HD2 ARG A 128 -11.933 9.929 -14.401 1.00 50.12 H new ATOM 0 HD3 ARG A 128 -12.091 11.666 -14.565 1.00 50.12 H new ATOM 0 HE ARG A 128 -12.918 10.279 -16.986 1.00 51.11 H new ATOM 0 HH11 ARG A 128 -13.920 11.216 -13.726 1.00 71.21 H new ATOM 0 HH12 ARG A 128 -15.641 11.195 -14.127 1.00 71.21 H new ATOM 0 HH21 ARG A 128 -15.127 10.259 -17.486 1.00 21.03 H new ATOM 0 HH22 ARG A 128 -16.320 10.656 -16.245 1.00 21.03 H new ATOM 2002 N GLN A 129 -7.980 8.699 -14.729 1.00 73.01 N ATOM 2003 CA GLN A 129 -7.721 7.318 -15.117 1.00 12.24 C ATOM 2004 C GLN A 129 -7.731 6.396 -13.902 1.00 20.31 C ATOM 2005 O GLN A 129 -8.290 5.300 -13.946 1.00 52.43 O ATOM 2006 CB GLN A 129 -6.374 7.215 -15.835 1.00 4.10 C ATOM 2007 CG GLN A 129 -6.185 8.258 -16.925 1.00 31.20 C ATOM 2008 CD GLN A 129 -5.775 7.650 -18.252 1.00 22.31 C ATOM 2009 OE1 GLN A 129 -6.481 6.808 -18.807 1.00 55.10 O ATOM 2010 NE2 GLN A 129 -4.627 8.073 -18.767 1.00 24.22 N ATOM 0 H GLN A 129 -7.235 9.352 -14.971 1.00 73.01 H new ATOM 0 HA GLN A 129 -8.515 7.004 -15.794 1.00 12.24 H new ATOM 0 HB2 GLN A 129 -5.573 7.317 -15.103 1.00 4.10 H new ATOM 0 HB3 GLN A 129 -6.280 6.222 -16.274 1.00 4.10 H new ATOM 0 HG2 GLN A 129 -7.114 8.813 -17.056 1.00 31.20 H new ATOM 0 HG3 GLN A 129 -5.427 8.975 -16.609 1.00 31.20 H new ATOM 0 HE21 GLN A 129 -4.073 8.773 -18.273 1.00 24.22 H new ATOM 0 HE22 GLN A 129 -4.299 7.698 -19.657 1.00 24.22 H new ATOM 2019 N ALA A 130 -7.106 6.847 -12.820 1.00 15.11 N ATOM 2020 CA ALA A 130 -7.039 6.063 -11.593 1.00 44.22 C ATOM 2021 C ALA A 130 -8.405 5.970 -10.921 1.00 52.01 C ATOM 2022 O ALA A 130 -8.764 4.933 -10.364 1.00 64.55 O ATOM 2023 CB ALA A 130 -6.018 6.665 -10.640 1.00 5.41 C ATOM 0 H ALA A 130 -6.638 7.752 -12.768 1.00 15.11 H new ATOM 0 HA ALA A 130 -6.726 5.052 -11.854 1.00 44.22 H new ATOM 0 HB1 ALA A 130 -5.977 6.070 -9.727 1.00 5.41 H new ATOM 0 HB2 ALA A 130 -5.036 6.670 -11.114 1.00 5.41 H new ATOM 0 HB3 ALA A 130 -6.307 7.687 -10.395 1.00 5.41 H new ATOM 2029 N GLN A 131 -9.164 7.060 -10.976 1.00 70.43 N ATOM 2030 CA GLN A 131 -10.490 7.099 -10.372 1.00 5.32 C ATOM 2031 C GLN A 131 -11.453 6.173 -11.109 1.00 22.22 C ATOM 2032 O GLN A 131 -12.309 5.536 -10.495 1.00 64.52 O ATOM 2033 CB GLN A 131 -11.033 8.531 -10.374 1.00 15.24 C ATOM 2034 CG GLN A 131 -10.981 9.202 -9.011 1.00 33.55 C ATOM 2035 CD GLN A 131 -12.357 9.434 -8.421 1.00 32.42 C ATOM 2036 OE1 GLN A 131 -12.889 10.543 -8.473 1.00 11.40 O ATOM 2037 NE2 GLN A 131 -12.942 8.385 -7.855 1.00 53.21 N ATOM 0 H GLN A 131 -8.883 7.928 -11.433 1.00 70.43 H new ATOM 0 HA GLN A 131 -10.403 6.754 -9.342 1.00 5.32 H new ATOM 0 HB2 GLN A 131 -10.461 9.127 -11.085 1.00 15.24 H new ATOM 0 HB3 GLN A 131 -12.065 8.519 -10.725 1.00 15.24 H new ATOM 0 HG2 GLN A 131 -10.397 8.585 -8.329 1.00 33.55 H new ATOM 0 HG3 GLN A 131 -10.463 10.157 -9.100 1.00 33.55 H new ATOM 0 HE21 GLN A 131 -12.464 7.484 -7.834 1.00 53.21 H new ATOM 0 HE22 GLN A 131 -13.869 8.480 -7.441 1.00 53.21 H new ATOM 2046 N ASP A 132 -11.309 6.105 -12.428 1.00 54.53 N ATOM 2047 CA ASP A 132 -12.167 5.257 -13.248 1.00 23.32 C ATOM 2048 C ASP A 132 -11.995 3.787 -12.878 1.00 42.42 C ATOM 2049 O ASP A 132 -12.969 3.038 -12.805 1.00 3.42 O ATOM 2050 CB ASP A 132 -11.854 5.461 -14.731 1.00 30.02 C ATOM 2051 CG ASP A 132 -12.976 4.980 -15.630 1.00 4.01 C ATOM 2052 OD1 ASP A 132 -13.246 3.761 -15.643 1.00 14.13 O ATOM 2053 OD2 ASP A 132 -13.586 5.824 -16.321 1.00 33.04 O ATOM 0 H ASP A 132 -10.607 6.627 -12.952 1.00 54.53 H new ATOM 0 HA ASP A 132 -13.202 5.541 -13.059 1.00 23.32 H new ATOM 0 HB2 ASP A 132 -11.670 6.519 -14.919 1.00 30.02 H new ATOM 0 HB3 ASP A 132 -10.937 4.928 -14.983 1.00 30.02 H new ATOM 2058 N LEU A 133 -10.751 3.381 -12.647 1.00 73.01 N ATOM 2059 CA LEU A 133 -10.453 2.000 -12.286 1.00 43.53 C ATOM 2060 C LEU A 133 -10.858 1.713 -10.844 1.00 74.11 C ATOM 2061 O LEU A 133 -11.563 0.742 -10.568 1.00 31.32 O ATOM 2062 CB LEU A 133 -8.961 1.712 -12.475 1.00 64.33 C ATOM 2063 CG LEU A 133 -8.506 0.326 -12.018 1.00 51.42 C ATOM 2064 CD1 LEU A 133 -9.179 -0.758 -12.847 1.00 11.12 C ATOM 2065 CD2 LEU A 133 -6.991 0.208 -12.106 1.00 61.44 C ATOM 0 H LEU A 133 -9.933 3.988 -12.703 1.00 73.01 H new ATOM 0 HA LEU A 133 -11.029 1.348 -12.942 1.00 43.53 H new ATOM 0 HB2 LEU A 133 -8.715 1.829 -13.530 1.00 64.33 H new ATOM 0 HB3 LEU A 133 -8.390 2.463 -11.930 1.00 64.33 H new ATOM 0 HG LEU A 133 -8.801 0.191 -10.977 1.00 51.42 H new ATOM 0 HD11 LEU A 133 -8.843 -1.738 -12.507 1.00 11.12 H new ATOM 0 HD12 LEU A 133 -10.260 -0.685 -12.732 1.00 11.12 H new ATOM 0 HD13 LEU A 133 -8.917 -0.629 -13.897 1.00 11.12 H new ATOM 0 HD21 LEU A 133 -6.684 -0.785 -11.777 1.00 61.44 H new ATOM 0 HD22 LEU A 133 -6.673 0.363 -13.137 1.00 61.44 H new ATOM 0 HD23 LEU A 133 -6.530 0.961 -11.467 1.00 61.44 H new ATOM 2077 N ALA A 134 -10.404 2.561 -9.927 1.00 41.40 N ATOM 2078 CA ALA A 134 -10.717 2.396 -8.512 1.00 12.33 C ATOM 2079 C ALA A 134 -12.223 2.389 -8.277 1.00 62.25 C ATOM 2080 O ALA A 134 -12.730 1.626 -7.455 1.00 71.31 O ATOM 2081 CB ALA A 134 -10.059 3.498 -7.695 1.00 35.34 C ATOM 0 H ALA A 134 -9.818 3.369 -10.138 1.00 41.40 H new ATOM 0 HA ALA A 134 -10.323 1.432 -8.189 1.00 12.33 H new ATOM 0 HB1 ALA A 134 -10.301 3.363 -6.641 1.00 35.34 H new ATOM 0 HB2 ALA A 134 -8.978 3.454 -7.828 1.00 35.34 H new ATOM 0 HB3 ALA A 134 -10.426 4.468 -8.030 1.00 35.34 H new ATOM 2087 N ARG A 135 -12.934 3.245 -9.004 1.00 70.40 N ATOM 2088 CA ARG A 135 -14.384 3.338 -8.873 1.00 21.15 C ATOM 2089 C ARG A 135 -15.050 2.012 -9.223 1.00 13.14 C ATOM 2090 O ARG A 135 -16.096 1.667 -8.673 1.00 2.31 O ATOM 2091 CB ARG A 135 -14.927 4.448 -9.775 1.00 12.22 C ATOM 2092 CG ARG A 135 -16.424 4.668 -9.631 1.00 31.52 C ATOM 2093 CD ARG A 135 -17.206 3.868 -10.660 1.00 65.01 C ATOM 2094 NE ARG A 135 -18.485 4.495 -10.983 1.00 74.04 N ATOM 2095 CZ ARG A 135 -18.600 5.676 -11.586 1.00 5.53 C ATOM 2096 NH1 ARG A 135 -17.517 6.360 -11.934 1.00 14.04 N ATOM 2097 NH2 ARG A 135 -19.802 6.175 -11.843 1.00 12.13 N ATOM 0 H ARG A 135 -12.530 3.884 -9.689 1.00 70.40 H new ATOM 0 HA ARG A 135 -14.615 3.576 -7.835 1.00 21.15 H new ATOM 0 HB2 ARG A 135 -14.407 5.378 -9.546 1.00 12.22 H new ATOM 0 HB3 ARG A 135 -14.702 4.204 -10.813 1.00 12.22 H new ATOM 0 HG2 ARG A 135 -16.740 4.381 -8.628 1.00 31.52 H new ATOM 0 HG3 ARG A 135 -16.650 5.728 -9.745 1.00 31.52 H new ATOM 0 HD2 ARG A 135 -16.612 3.767 -11.568 1.00 65.01 H new ATOM 0 HD3 ARG A 135 -17.381 2.862 -10.280 1.00 65.01 H new ATOM 0 HE ARG A 135 -19.340 3.999 -10.732 1.00 74.04 H new ATOM 0 HH11 ARG A 135 -16.590 5.981 -11.740 1.00 14.04 H new ATOM 0 HH12 ARG A 135 -17.612 7.265 -12.396 1.00 14.04 H new ATOM 0 HH21 ARG A 135 -20.638 5.654 -11.578 1.00 12.13 H new ATOM 0 HH22 ARG A 135 -19.890 7.080 -12.305 1.00 12.13 H new ATOM 2111 N SER A 136 -14.437 1.271 -10.140 1.00 2.44 N ATOM 2112 CA SER A 136 -14.971 -0.019 -10.561 1.00 53.12 C ATOM 2113 C SER A 136 -14.771 -1.065 -9.470 1.00 4.50 C ATOM 2114 O SER A 136 -15.642 -1.900 -9.228 1.00 52.24 O ATOM 2115 CB SER A 136 -14.296 -0.478 -11.855 1.00 22.10 C ATOM 2116 OG SER A 136 -14.809 -1.728 -12.283 1.00 64.34 O ATOM 0 H SER A 136 -13.571 1.541 -10.606 1.00 2.44 H new ATOM 0 HA SER A 136 -16.040 0.097 -10.742 1.00 53.12 H new ATOM 0 HB2 SER A 136 -14.451 0.268 -12.634 1.00 22.10 H new ATOM 0 HB3 SER A 136 -13.220 -0.557 -11.699 1.00 22.10 H new ATOM 0 HG SER A 136 -14.362 -1.998 -13.112 1.00 64.34 H new ATOM 2122 N TYR A 137 -13.617 -1.009 -8.814 1.00 25.32 N ATOM 2123 CA TYR A 137 -13.298 -1.947 -7.745 1.00 74.54 C ATOM 2124 C TYR A 137 -14.148 -1.673 -6.507 1.00 53.33 C ATOM 2125 O TYR A 137 -14.354 -2.559 -5.677 1.00 52.51 O ATOM 2126 CB TYR A 137 -11.813 -1.856 -7.388 1.00 71.31 C ATOM 2127 CG TYR A 137 -10.886 -2.335 -8.485 1.00 44.43 C ATOM 2128 CD1 TYR A 137 -11.231 -3.409 -9.298 1.00 43.31 C ATOM 2129 CD2 TYR A 137 -9.664 -1.713 -8.705 1.00 34.01 C ATOM 2130 CE1 TYR A 137 -10.384 -3.847 -10.298 1.00 14.54 C ATOM 2131 CE2 TYR A 137 -8.812 -2.146 -9.703 1.00 42.25 C ATOM 2132 CZ TYR A 137 -9.176 -3.213 -10.497 1.00 13.34 C ATOM 2133 OH TYR A 137 -8.330 -3.649 -11.492 1.00 53.13 O ATOM 0 H TYR A 137 -12.887 -0.323 -9.004 1.00 25.32 H new ATOM 0 HA TYR A 137 -13.520 -2.953 -8.100 1.00 74.54 H new ATOM 0 HB2 TYR A 137 -11.570 -0.821 -7.147 1.00 71.31 H new ATOM 0 HB3 TYR A 137 -11.629 -2.444 -6.489 1.00 71.31 H new ATOM 0 HD1 TYR A 137 -12.176 -3.909 -9.145 1.00 43.31 H new ATOM 0 HD2 TYR A 137 -9.375 -0.877 -8.086 1.00 34.01 H new ATOM 0 HE1 TYR A 137 -10.667 -4.682 -10.921 1.00 14.54 H new ATOM 0 HE2 TYR A 137 -7.865 -1.651 -9.860 1.00 42.25 H new ATOM 0 HH TYR A 137 -8.509 -4.593 -11.683 1.00 53.13 H new ATOM 2143 N GLY A 138 -14.636 -0.442 -6.387 1.00 0.10 N ATOM 2144 CA GLY A 138 -15.453 -0.077 -5.245 1.00 62.54 C ATOM 2145 C GLY A 138 -14.624 0.360 -4.052 1.00 4.10 C ATOM 2146 O GLY A 138 -15.122 0.409 -2.928 1.00 41.23 O ATOM 0 H GLY A 138 -14.480 0.308 -7.060 1.00 0.10 H new ATOM 0 HA2 GLY A 138 -16.128 0.730 -5.529 1.00 62.54 H new ATOM 0 HA3 GLY A 138 -16.074 -0.927 -4.960 1.00 62.54 H new ATOM 2150 N ILE A 139 -13.355 0.677 -4.296 1.00 22.12 N ATOM 2151 CA ILE A 139 -12.458 1.111 -3.232 1.00 31.31 C ATOM 2152 C ILE A 139 -12.097 2.586 -3.373 1.00 62.24 C ATOM 2153 O ILE A 139 -12.171 3.151 -4.464 1.00 5.32 O ATOM 2154 CB ILE A 139 -11.168 0.283 -3.208 1.00 42.33 C ATOM 2155 CG1 ILE A 139 -10.651 0.062 -4.624 1.00 65.23 C ATOM 2156 CG2 ILE A 139 -11.407 -1.047 -2.510 1.00 11.13 C ATOM 2157 CD1 ILE A 139 -9.305 -0.608 -4.655 1.00 1.41 C ATOM 0 H ILE A 139 -12.926 0.641 -5.221 1.00 22.12 H new ATOM 0 HA ILE A 139 -12.995 0.961 -2.296 1.00 31.31 H new ATOM 0 HB ILE A 139 -10.411 0.834 -2.650 1.00 42.33 H new ATOM 0 HG12 ILE A 139 -11.367 -0.546 -5.177 1.00 65.23 H new ATOM 0 HG13 ILE A 139 -10.586 1.022 -5.136 1.00 65.23 H new ATOM 0 HG21 ILE A 139 -10.482 -1.624 -2.501 1.00 11.13 H new ATOM 0 HG22 ILE A 139 -11.733 -0.867 -1.486 1.00 11.13 H new ATOM 0 HG23 ILE A 139 -12.177 -1.604 -3.043 1.00 11.13 H new ATOM 0 HD11 ILE A 139 -8.988 -0.739 -5.689 1.00 1.41 H new ATOM 0 HD12 ILE A 139 -8.578 0.011 -4.128 1.00 1.41 H new ATOM 0 HD13 ILE A 139 -9.372 -1.582 -4.170 1.00 1.41 H new ATOM 2169 N PRO A 140 -11.698 3.233 -2.264 1.00 31.33 N ATOM 2170 CA PRO A 140 -11.323 4.649 -2.268 1.00 21.44 C ATOM 2171 C PRO A 140 -9.990 4.892 -2.968 1.00 54.32 C ATOM 2172 O PRO A 140 -9.157 3.991 -3.068 1.00 40.31 O ATOM 2173 CB PRO A 140 -11.220 4.996 -0.782 1.00 61.05 C ATOM 2174 CG PRO A 140 -10.910 3.703 -0.108 1.00 35.21 C ATOM 2175 CD PRO A 140 -11.583 2.631 -0.922 1.00 32.24 C ATOM 0 HA PRO A 140 -12.044 5.260 -2.810 1.00 21.44 H new ATOM 0 HB2 PRO A 140 -10.438 5.733 -0.602 1.00 61.05 H new ATOM 0 HB3 PRO A 140 -12.152 5.422 -0.410 1.00 61.05 H new ATOM 0 HG2 PRO A 140 -9.834 3.537 -0.061 1.00 35.21 H new ATOM 0 HG3 PRO A 140 -11.278 3.701 0.918 1.00 35.21 H new ATOM 0 HD2 PRO A 140 -10.993 1.715 -0.943 1.00 32.24 H new ATOM 0 HD3 PRO A 140 -12.560 2.372 -0.514 1.00 32.24 H new ATOM 2183 N TYR A 141 -9.795 6.115 -3.451 1.00 14.32 N ATOM 2184 CA TYR A 141 -8.563 6.476 -4.143 1.00 64.14 C ATOM 2185 C TYR A 141 -7.947 7.736 -3.539 1.00 71.40 C ATOM 2186 O TYR A 141 -8.555 8.806 -3.556 1.00 31.21 O ATOM 2187 CB TYR A 141 -8.839 6.687 -5.636 1.00 10.15 C ATOM 2188 CG TYR A 141 -7.675 7.286 -6.397 1.00 5.03 C ATOM 2189 CD1 TYR A 141 -6.478 6.594 -6.531 1.00 64.04 C ATOM 2190 CD2 TYR A 141 -7.774 8.544 -6.977 1.00 41.35 C ATOM 2191 CE1 TYR A 141 -5.413 7.139 -7.223 1.00 62.20 C ATOM 2192 CE2 TYR A 141 -6.714 9.096 -7.671 1.00 0.32 C ATOM 2193 CZ TYR A 141 -5.536 8.389 -7.791 1.00 62.31 C ATOM 2194 OH TYR A 141 -4.477 8.935 -8.480 1.00 61.11 O ATOM 0 H TYR A 141 -10.474 6.872 -3.376 1.00 14.32 H new ATOM 0 HA TYR A 141 -7.852 5.658 -4.024 1.00 64.14 H new ATOM 0 HB2 TYR A 141 -9.100 5.729 -6.086 1.00 10.15 H new ATOM 0 HB3 TYR A 141 -9.706 7.338 -5.747 1.00 10.15 H new ATOM 0 HD1 TYR A 141 -6.378 5.614 -6.087 1.00 64.04 H new ATOM 0 HD2 TYR A 141 -8.695 9.100 -6.884 1.00 41.35 H new ATOM 0 HE1 TYR A 141 -4.489 6.588 -7.318 1.00 62.20 H new ATOM 0 HE2 TYR A 141 -6.808 10.075 -8.117 1.00 0.32 H new ATOM 0 HH TYR A 141 -3.900 8.217 -8.815 1.00 61.11 H new ATOM 2204 N ILE A 142 -6.736 7.601 -3.008 1.00 13.55 N ATOM 2205 CA ILE A 142 -6.036 8.723 -2.401 1.00 74.25 C ATOM 2206 C ILE A 142 -4.714 8.994 -3.114 1.00 52.44 C ATOM 2207 O ILE A 142 -4.094 8.083 -3.663 1.00 21.00 O ATOM 2208 CB ILE A 142 -5.761 8.466 -0.908 1.00 70.32 C ATOM 2209 CG1 ILE A 142 -7.067 8.167 -0.172 1.00 33.43 C ATOM 2210 CG2 ILE A 142 -5.058 9.659 -0.283 1.00 43.02 C ATOM 2211 CD1 ILE A 142 -7.400 6.694 -0.113 1.00 62.30 C ATOM 0 H ILE A 142 -6.219 6.722 -2.987 1.00 13.55 H new ATOM 0 HA ILE A 142 -6.682 9.595 -2.499 1.00 74.25 H new ATOM 0 HB ILE A 142 -5.107 7.598 -0.820 1.00 70.32 H new ATOM 0 HG12 ILE A 142 -7.001 8.558 0.843 1.00 33.43 H new ATOM 0 HG13 ILE A 142 -7.882 8.697 -0.665 1.00 33.43 H new ATOM 0 HG21 ILE A 142 -4.872 9.460 0.772 1.00 43.02 H new ATOM 0 HG22 ILE A 142 -4.110 9.831 -0.793 1.00 43.02 H new ATOM 0 HG23 ILE A 142 -5.687 10.544 -0.379 1.00 43.02 H new ATOM 0 HD11 ILE A 142 -8.339 6.554 0.423 1.00 62.30 H new ATOM 0 HD12 ILE A 142 -7.499 6.302 -1.125 1.00 62.30 H new ATOM 0 HD13 ILE A 142 -6.603 6.161 0.406 1.00 62.30 H new ATOM 2223 N GLU A 143 -4.286 10.252 -3.096 1.00 50.33 N ATOM 2224 CA GLU A 143 -3.035 10.646 -3.735 1.00 2.30 C ATOM 2225 C GLU A 143 -2.056 11.200 -2.704 1.00 3.32 C ATOM 2226 O GLU A 143 -2.403 12.081 -1.918 1.00 14.14 O ATOM 2227 CB GLU A 143 -3.300 11.691 -4.822 1.00 43.33 C ATOM 2228 CG GLU A 143 -2.548 11.427 -6.116 1.00 51.11 C ATOM 2229 CD GLU A 143 -3.092 12.232 -7.280 1.00 64.42 C ATOM 2230 OE1 GLU A 143 -4.314 12.489 -7.305 1.00 14.11 O ATOM 2231 OE2 GLU A 143 -2.296 12.607 -8.166 1.00 31.45 O ATOM 0 H GLU A 143 -4.788 11.017 -2.645 1.00 50.33 H new ATOM 0 HA GLU A 143 -2.592 9.763 -4.195 1.00 2.30 H new ATOM 0 HB2 GLU A 143 -4.369 11.721 -5.032 1.00 43.33 H new ATOM 0 HB3 GLU A 143 -3.022 12.675 -4.444 1.00 43.33 H new ATOM 0 HG2 GLU A 143 -1.494 11.666 -5.975 1.00 51.11 H new ATOM 0 HG3 GLU A 143 -2.605 10.365 -6.355 1.00 51.11 H new ATOM 2238 N THR A 144 -0.834 10.676 -2.707 1.00 65.03 N ATOM 2239 CA THR A 144 0.186 11.123 -1.765 1.00 30.34 C ATOM 2240 C THR A 144 1.543 11.263 -2.446 1.00 54.21 C ATOM 2241 O THR A 144 1.704 10.909 -3.614 1.00 12.23 O ATOM 2242 CB THR A 144 0.288 10.144 -0.594 1.00 35.32 C ATOM 2243 OG1 THR A 144 0.943 8.952 -0.993 1.00 33.14 O ATOM 2244 CG2 THR A 144 -1.057 9.757 -0.020 1.00 52.42 C ATOM 0 H THR A 144 -0.527 9.945 -3.348 1.00 65.03 H new ATOM 0 HA THR A 144 -0.109 12.103 -1.390 1.00 30.34 H new ATOM 0 HB THR A 144 0.856 10.669 0.174 1.00 35.32 H new ATOM 0 HG1 THR A 144 0.728 8.234 -0.362 1.00 33.14 H new ATOM 0 HG21 THR A 144 -0.913 9.061 0.807 1.00 52.42 H new ATOM 0 HG22 THR A 144 -1.569 10.649 0.341 1.00 52.42 H new ATOM 0 HG23 THR A 144 -1.660 9.282 -0.794 1.00 52.42 H new ATOM 2252 N SER A 145 2.517 11.782 -1.705 1.00 40.31 N ATOM 2253 CA SER A 145 3.863 11.973 -2.231 1.00 71.43 C ATOM 2254 C SER A 145 4.910 11.522 -1.216 1.00 13.42 C ATOM 2255 O SER A 145 4.923 11.986 -0.076 1.00 25.24 O ATOM 2256 CB SER A 145 4.087 13.442 -2.594 1.00 4.42 C ATOM 2257 OG SER A 145 3.166 14.281 -1.918 1.00 23.45 O ATOM 0 H SER A 145 2.398 12.078 -0.736 1.00 40.31 H new ATOM 0 HA SER A 145 3.967 11.365 -3.130 1.00 71.43 H new ATOM 0 HB2 SER A 145 5.105 13.732 -2.336 1.00 4.42 H new ATOM 0 HB3 SER A 145 3.981 13.574 -3.671 1.00 4.42 H new ATOM 0 HG SER A 145 3.650 15.014 -1.483 1.00 23.45 H new ATOM 2263 N ALA A 146 5.787 10.617 -1.639 1.00 25.23 N ATOM 2264 CA ALA A 146 6.837 10.106 -0.766 1.00 41.13 C ATOM 2265 C ALA A 146 7.979 11.111 -0.616 1.00 42.24 C ATOM 2266 O ALA A 146 8.876 10.922 0.205 1.00 42.13 O ATOM 2267 CB ALA A 146 7.365 8.781 -1.298 1.00 61.30 C ATOM 0 H ALA A 146 5.791 10.223 -2.580 1.00 25.23 H new ATOM 0 HA ALA A 146 6.403 9.946 0.221 1.00 41.13 H new ATOM 0 HB1 ALA A 146 8.149 8.410 -0.637 1.00 61.30 H new ATOM 0 HB2 ALA A 146 6.552 8.056 -1.340 1.00 61.30 H new ATOM 0 HB3 ALA A 146 7.773 8.927 -2.298 1.00 61.30 H new ATOM 2273 N LYS A 147 7.943 12.179 -1.411 1.00 1.00 N ATOM 2274 CA LYS A 147 8.979 13.204 -1.357 1.00 43.44 C ATOM 2275 C LYS A 147 8.539 14.382 -0.494 1.00 3.21 C ATOM 2276 O LYS A 147 9.232 14.767 0.447 1.00 24.12 O ATOM 2277 CB LYS A 147 9.318 13.690 -2.768 1.00 1.14 C ATOM 2278 CG LYS A 147 10.765 14.125 -2.930 1.00 54.32 C ATOM 2279 CD LYS A 147 11.704 12.931 -2.981 1.00 13.20 C ATOM 2280 CE LYS A 147 13.116 13.315 -2.571 1.00 62.34 C ATOM 2281 NZ LYS A 147 13.832 12.184 -1.918 1.00 11.21 N ATOM 0 H LYS A 147 7.209 12.355 -2.097 1.00 1.00 H new ATOM 0 HA LYS A 147 9.868 12.761 -0.907 1.00 43.44 H new ATOM 0 HB2 LYS A 147 9.105 12.892 -3.479 1.00 1.14 H new ATOM 0 HB3 LYS A 147 8.666 14.525 -3.022 1.00 1.14 H new ATOM 0 HG2 LYS A 147 10.870 14.711 -3.843 1.00 54.32 H new ATOM 0 HG3 LYS A 147 11.046 14.775 -2.101 1.00 54.32 H new ATOM 0 HD2 LYS A 147 11.333 12.147 -2.321 1.00 13.20 H new ATOM 0 HD3 LYS A 147 11.716 12.519 -3.990 1.00 13.20 H new ATOM 0 HE2 LYS A 147 13.674 13.639 -3.450 1.00 62.34 H new ATOM 0 HE3 LYS A 147 13.078 14.163 -1.888 1.00 62.34 H new ATOM 0 HZ1 LYS A 147 14.091 12.452 -0.947 1.00 11.21 H new ATOM 0 HZ2 LYS A 147 13.213 11.349 -1.893 1.00 11.21 H new ATOM 0 HZ3 LYS A 147 14.693 11.961 -2.457 1.00 11.21 H new ATOM 2295 N THR A 148 7.384 14.953 -0.821 1.00 33.42 N ATOM 2296 CA THR A 148 6.855 16.090 -0.076 1.00 34.02 C ATOM 2297 C THR A 148 6.049 15.631 1.138 1.00 72.12 C ATOM 2298 O THR A 148 5.857 16.391 2.087 1.00 22.30 O ATOM 2299 CB THR A 148 5.984 16.960 -0.983 1.00 63.11 C ATOM 2300 OG1 THR A 148 5.010 16.176 -1.652 1.00 35.53 O ATOM 2301 CG2 THR A 148 6.776 17.709 -2.034 1.00 32.53 C ATOM 0 H THR A 148 6.797 14.647 -1.597 1.00 33.42 H new ATOM 0 HA THR A 148 7.701 16.678 0.280 1.00 34.02 H new ATOM 0 HB THR A 148 5.514 17.686 -0.320 1.00 63.11 H new ATOM 0 HG1 THR A 148 4.238 16.736 -1.877 1.00 35.53 H new ATOM 0 HG21 THR A 148 6.098 18.307 -2.643 1.00 32.53 H new ATOM 0 HG22 THR A 148 7.499 18.364 -1.547 1.00 32.53 H new ATOM 0 HG23 THR A 148 7.302 16.997 -2.669 1.00 32.53 H new ATOM 2309 N ARG A 149 5.575 14.388 1.103 1.00 31.22 N ATOM 2310 CA ARG A 149 4.788 13.839 2.204 1.00 41.42 C ATOM 2311 C ARG A 149 3.469 14.591 2.350 1.00 32.31 C ATOM 2312 O ARG A 149 3.238 15.276 3.346 1.00 72.33 O ATOM 2313 CB ARG A 149 5.580 13.906 3.513 1.00 14.03 C ATOM 2314 CG ARG A 149 4.928 13.148 4.659 1.00 60.33 C ATOM 2315 CD ARG A 149 5.573 13.488 5.994 1.00 13.35 C ATOM 2316 NE ARG A 149 4.579 13.753 7.032 1.00 42.35 N ATOM 2317 CZ ARG A 149 4.875 13.891 8.323 1.00 41.03 C ATOM 2318 NH1 ARG A 149 6.131 13.784 8.739 1.00 51.11 N ATOM 2319 NH2 ARG A 149 3.911 14.135 9.201 1.00 32.03 N ATOM 0 H ARG A 149 5.722 13.743 0.326 1.00 31.22 H new ATOM 0 HA ARG A 149 4.569 12.795 1.979 1.00 41.42 H new ATOM 0 HB2 ARG A 149 6.579 13.504 3.344 1.00 14.03 H new ATOM 0 HB3 ARG A 149 5.701 14.950 3.802 1.00 14.03 H new ATOM 0 HG2 ARG A 149 3.865 13.387 4.696 1.00 60.33 H new ATOM 0 HG3 ARG A 149 5.007 12.076 4.479 1.00 60.33 H new ATOM 0 HD2 ARG A 149 6.213 12.663 6.308 1.00 13.35 H new ATOM 0 HD3 ARG A 149 6.214 14.362 5.875 1.00 13.35 H new ATOM 0 HE ARG A 149 3.602 13.837 6.751 1.00 42.35 H new ATOM 0 HH11 ARG A 149 6.876 13.595 8.068 1.00 51.11 H new ATOM 0 HH12 ARG A 149 6.351 13.891 9.729 1.00 51.11 H new ATOM 0 HH21 ARG A 149 2.944 14.217 8.887 1.00 32.03 H new ATOM 0 HH22 ARG A 149 4.137 14.241 10.190 1.00 32.03 H new ATOM 2333 N GLN A 150 2.608 14.462 1.345 1.00 42.24 N ATOM 2334 CA GLN A 150 1.314 15.132 1.354 1.00 24.11 C ATOM 2335 C GLN A 150 0.172 14.120 1.337 1.00 72.24 C ATOM 2336 O GLN A 150 -0.140 13.539 0.298 1.00 13.03 O ATOM 2337 CB GLN A 150 1.200 16.070 0.149 1.00 63.23 C ATOM 2338 CG GLN A 150 -0.147 16.765 0.036 1.00 13.51 C ATOM 2339 CD GLN A 150 -0.026 18.187 -0.471 1.00 43.53 C ATOM 2340 OE1 GLN A 150 -0.239 19.145 0.272 1.00 1.51 O ATOM 2341 NE2 GLN A 150 0.317 18.330 -1.744 1.00 30.24 N ATOM 0 H GLN A 150 2.784 13.898 0.513 1.00 42.24 H new ATOM 0 HA GLN A 150 1.240 15.715 2.272 1.00 24.11 H new ATOM 0 HB2 GLN A 150 1.983 16.825 0.213 1.00 63.23 H new ATOM 0 HB3 GLN A 150 1.381 15.499 -0.762 1.00 63.23 H new ATOM 0 HG2 GLN A 150 -0.790 16.197 -0.636 1.00 13.51 H new ATOM 0 HG3 GLN A 150 -0.632 16.771 1.012 1.00 13.51 H new ATOM 0 HE21 GLN A 150 0.484 17.507 -2.323 1.00 30.24 H new ATOM 0 HE22 GLN A 150 0.414 19.263 -2.144 1.00 30.24 H new ATOM 2350 N GLY A 151 -0.452 13.919 2.494 1.00 62.32 N ATOM 2351 CA GLY A 151 -1.556 12.981 2.590 1.00 73.20 C ATOM 2352 C GLY A 151 -1.101 11.535 2.649 1.00 1.11 C ATOM 2353 O GLY A 151 -1.896 10.621 2.432 1.00 61.23 O ATOM 0 H GLY A 151 -0.213 14.389 3.367 1.00 62.32 H new ATOM 0 HA2 GLY A 151 -2.142 13.208 3.480 1.00 73.20 H new ATOM 0 HA3 GLY A 151 -2.215 13.114 1.732 1.00 73.20 H new ATOM 2357 N VAL A 152 0.179 11.324 2.946 1.00 52.30 N ATOM 2358 CA VAL A 152 0.735 9.990 3.037 1.00 1.45 C ATOM 2359 C VAL A 152 -0.020 9.148 4.062 1.00 24.51 C ATOM 2360 O VAL A 152 -0.497 8.056 3.753 1.00 14.20 O ATOM 2361 CB VAL A 152 2.222 10.058 3.423 1.00 13.34 C ATOM 2362 CG1 VAL A 152 2.812 8.669 3.502 1.00 4.43 C ATOM 2363 CG2 VAL A 152 2.996 10.914 2.431 1.00 61.23 C ATOM 0 H VAL A 152 0.850 12.071 3.128 1.00 52.30 H new ATOM 0 HA VAL A 152 0.634 9.519 2.059 1.00 1.45 H new ATOM 0 HB VAL A 152 2.301 10.521 4.406 1.00 13.34 H new ATOM 0 HG11 VAL A 152 3.865 8.736 3.776 1.00 4.43 H new ATOM 0 HG12 VAL A 152 2.277 8.089 4.254 1.00 4.43 H new ATOM 0 HG13 VAL A 152 2.720 8.179 2.533 1.00 4.43 H new ATOM 0 HG21 VAL A 152 4.046 10.949 2.722 1.00 61.23 H new ATOM 0 HG22 VAL A 152 2.910 10.483 1.434 1.00 61.23 H new ATOM 0 HG23 VAL A 152 2.587 11.924 2.426 1.00 61.23 H new ATOM 2373 N GLU A 153 -0.125 9.665 5.281 1.00 44.14 N ATOM 2374 CA GLU A 153 -0.823 8.963 6.351 1.00 24.31 C ATOM 2375 C GLU A 153 -2.298 8.775 6.006 1.00 61.15 C ATOM 2376 O GLU A 153 -2.925 7.804 6.430 1.00 54.44 O ATOM 2377 CB GLU A 153 -0.690 9.733 7.667 1.00 20.54 C ATOM 2378 CG GLU A 153 0.716 10.246 7.933 1.00 12.44 C ATOM 2379 CD GLU A 153 1.157 10.022 9.366 1.00 54.32 C ATOM 2380 OE1 GLU A 153 0.294 10.072 10.268 1.00 25.31 O ATOM 2381 OE2 GLU A 153 2.365 9.795 9.587 1.00 30.51 O ATOM 0 H GLU A 153 0.264 10.568 5.553 1.00 44.14 H new ATOM 0 HA GLU A 153 -0.366 7.980 6.465 1.00 24.31 H new ATOM 0 HB2 GLU A 153 -1.380 10.577 7.656 1.00 20.54 H new ATOM 0 HB3 GLU A 153 -0.993 9.085 8.490 1.00 20.54 H new ATOM 0 HG2 GLU A 153 1.414 9.748 7.260 1.00 12.44 H new ATOM 0 HG3 GLU A 153 0.759 11.311 7.706 1.00 12.44 H new ATOM 2388 N ASP A 154 -2.844 9.710 5.235 1.00 64.40 N ATOM 2389 CA ASP A 154 -4.245 9.648 4.832 1.00 75.41 C ATOM 2390 C ASP A 154 -4.529 8.376 4.040 1.00 1.22 C ATOM 2391 O ASP A 154 -5.428 7.608 4.382 1.00 44.32 O ATOM 2392 CB ASP A 154 -4.611 10.876 3.997 1.00 74.54 C ATOM 2393 CG ASP A 154 -6.008 11.384 4.297 1.00 51.22 C ATOM 2394 OD1 ASP A 154 -6.972 10.610 4.115 1.00 61.12 O ATOM 2395 OD2 ASP A 154 -6.138 12.554 4.712 1.00 11.11 O ATOM 0 H ASP A 154 -2.338 10.520 4.877 1.00 64.40 H new ATOM 0 HA ASP A 154 -4.856 9.635 5.734 1.00 75.41 H new ATOM 0 HB2 ASP A 154 -3.890 11.670 4.189 1.00 74.54 H new ATOM 0 HB3 ASP A 154 -4.537 10.627 2.938 1.00 74.54 H new ATOM 2400 N ALA A 155 -3.757 8.160 2.978 1.00 10.24 N ATOM 2401 CA ALA A 155 -3.924 6.981 2.134 1.00 72.21 C ATOM 2402 C ALA A 155 -3.967 5.704 2.969 1.00 63.13 C ATOM 2403 O ALA A 155 -4.750 4.795 2.692 1.00 70.43 O ATOM 2404 CB ALA A 155 -2.801 6.907 1.109 1.00 45.32 C ATOM 0 H ALA A 155 -3.009 8.787 2.682 1.00 10.24 H new ATOM 0 HA ALA A 155 -4.876 7.071 1.612 1.00 72.21 H new ATOM 0 HB1 ALA A 155 -2.936 6.024 0.485 1.00 45.32 H new ATOM 0 HB2 ALA A 155 -2.820 7.800 0.484 1.00 45.32 H new ATOM 0 HB3 ALA A 155 -1.842 6.845 1.624 1.00 45.32 H new ATOM 2410 N PHE A 156 -3.123 5.645 3.993 1.00 12.24 N ATOM 2411 CA PHE A 156 -3.067 4.482 4.871 1.00 62.42 C ATOM 2412 C PHE A 156 -4.292 4.431 5.777 1.00 42.51 C ATOM 2413 O PHE A 156 -4.924 3.385 5.928 1.00 51.50 O ATOM 2414 CB PHE A 156 -1.794 4.516 5.718 1.00 53.20 C ATOM 2415 CG PHE A 156 -0.556 4.137 4.956 1.00 5.41 C ATOM 2416 CD1 PHE A 156 -0.431 2.876 4.398 1.00 32.42 C ATOM 2417 CD2 PHE A 156 0.481 5.042 4.800 1.00 71.30 C ATOM 2418 CE1 PHE A 156 0.707 2.523 3.697 1.00 75.31 C ATOM 2419 CE2 PHE A 156 1.621 4.696 4.100 1.00 31.42 C ATOM 2420 CZ PHE A 156 1.734 3.435 3.548 1.00 63.44 C ATOM 0 H PHE A 156 -2.468 6.389 4.236 1.00 12.24 H new ATOM 0 HA PHE A 156 -3.056 3.587 4.249 1.00 62.42 H new ATOM 0 HB2 PHE A 156 -1.666 5.518 6.127 1.00 53.20 H new ATOM 0 HB3 PHE A 156 -1.912 3.839 6.564 1.00 53.20 H new ATOM 0 HD1 PHE A 156 -1.232 2.160 4.512 1.00 32.42 H new ATOM 0 HD2 PHE A 156 0.398 6.029 5.230 1.00 71.30 H new ATOM 0 HE1 PHE A 156 0.793 1.536 3.267 1.00 75.31 H new ATOM 0 HE2 PHE A 156 2.423 5.411 3.985 1.00 31.42 H new ATOM 0 HZ PHE A 156 2.624 3.162 3.001 1.00 63.44 H new ATOM 2430 N TYR A 157 -4.622 5.569 6.378 1.00 53.25 N ATOM 2431 CA TYR A 157 -5.772 5.660 7.270 1.00 55.41 C ATOM 2432 C TYR A 157 -7.055 5.247 6.554 1.00 61.03 C ATOM 2433 O TYR A 157 -7.991 4.746 7.177 1.00 25.31 O ATOM 2434 CB TYR A 157 -5.914 7.085 7.810 1.00 15.32 C ATOM 2435 CG TYR A 157 -4.827 7.475 8.786 1.00 52.21 C ATOM 2436 CD1 TYR A 157 -4.408 6.596 9.776 1.00 43.35 C ATOM 2437 CD2 TYR A 157 -4.221 8.723 8.716 1.00 31.55 C ATOM 2438 CE1 TYR A 157 -3.415 6.950 10.670 1.00 45.01 C ATOM 2439 CE2 TYR A 157 -3.227 9.084 9.606 1.00 44.43 C ATOM 2440 CZ TYR A 157 -2.828 8.194 10.581 1.00 61.23 C ATOM 2441 OH TYR A 157 -1.839 8.550 11.469 1.00 25.14 O ATOM 0 H TYR A 157 -4.108 6.443 6.263 1.00 53.25 H new ATOM 0 HA TYR A 157 -5.606 4.976 8.102 1.00 55.41 H new ATOM 0 HB2 TYR A 157 -5.907 7.784 6.973 1.00 15.32 H new ATOM 0 HB3 TYR A 157 -6.883 7.184 8.300 1.00 15.32 H new ATOM 0 HD1 TYR A 157 -4.865 5.620 9.849 1.00 43.35 H new ATOM 0 HD2 TYR A 157 -4.532 9.422 7.954 1.00 31.55 H new ATOM 0 HE1 TYR A 157 -3.101 6.255 11.435 1.00 45.01 H new ATOM 0 HE2 TYR A 157 -2.765 10.058 9.538 1.00 44.43 H new ATOM 0 HH TYR A 157 -1.147 9.062 11.000 1.00 25.14 H new ATOM 2451 N THR A 158 -7.091 5.462 5.243 1.00 63.21 N ATOM 2452 CA THR A 158 -8.254 5.115 4.443 1.00 74.13 C ATOM 2453 C THR A 158 -8.555 3.622 4.535 1.00 23.33 C ATOM 2454 O THR A 158 -9.709 3.220 4.684 1.00 43.40 O ATOM 2455 CB THR A 158 -8.017 5.515 2.987 1.00 14.12 C ATOM 2456 OG1 THR A 158 -7.848 6.917 2.873 1.00 50.33 O ATOM 2457 CG2 THR A 158 -9.144 5.115 2.065 1.00 10.00 C ATOM 0 H THR A 158 -6.324 5.876 4.713 1.00 63.21 H new ATOM 0 HA THR A 158 -9.115 5.658 4.832 1.00 74.13 H new ATOM 0 HB THR A 158 -7.116 4.981 2.686 1.00 14.12 H new ATOM 0 HG1 THR A 158 -7.047 7.191 3.367 1.00 50.33 H new ATOM 0 HG21 THR A 158 -8.911 5.429 1.048 1.00 10.00 H new ATOM 0 HG22 THR A 158 -9.269 4.032 2.091 1.00 10.00 H new ATOM 0 HG23 THR A 158 -10.067 5.594 2.390 1.00 10.00 H new ATOM 2465 N LEU A 159 -7.512 2.805 4.443 1.00 64.12 N ATOM 2466 CA LEU A 159 -7.668 1.357 4.513 1.00 65.01 C ATOM 2467 C LEU A 159 -8.138 0.921 5.897 1.00 43.45 C ATOM 2468 O LEU A 159 -8.903 -0.034 6.029 1.00 14.12 O ATOM 2469 CB LEU A 159 -6.351 0.661 4.165 1.00 60.02 C ATOM 2470 CG LEU A 159 -6.381 -0.867 4.253 1.00 55.45 C ATOM 2471 CD1 LEU A 159 -7.580 -1.424 3.500 1.00 52.22 C ATOM 2472 CD2 LEU A 159 -5.089 -1.456 3.709 1.00 64.42 C ATOM 0 H LEU A 159 -6.550 3.120 4.320 1.00 64.12 H new ATOM 0 HA LEU A 159 -8.427 1.067 3.786 1.00 65.01 H new ATOM 0 HB2 LEU A 159 -6.064 0.946 3.153 1.00 60.02 H new ATOM 0 HB3 LEU A 159 -5.574 1.033 4.833 1.00 60.02 H new ATOM 0 HG LEU A 159 -6.475 -1.149 5.302 1.00 55.45 H new ATOM 0 HD11 LEU A 159 -7.583 -2.511 3.575 1.00 52.22 H new ATOM 0 HD12 LEU A 159 -8.498 -1.028 3.934 1.00 52.22 H new ATOM 0 HD13 LEU A 159 -7.519 -1.132 2.452 1.00 52.22 H new ATOM 0 HD21 LEU A 159 -5.127 -2.543 3.779 1.00 64.42 H new ATOM 0 HD22 LEU A 159 -4.967 -1.164 2.666 1.00 64.42 H new ATOM 0 HD23 LEU A 159 -4.246 -1.084 4.291 1.00 64.42 H new ATOM 2484 N VAL A 160 -7.677 1.625 6.927 1.00 54.22 N ATOM 2485 CA VAL A 160 -8.054 1.305 8.298 1.00 34.42 C ATOM 2486 C VAL A 160 -9.570 1.326 8.470 1.00 15.55 C ATOM 2487 O VAL A 160 -10.138 0.481 9.162 1.00 23.40 O ATOM 2488 CB VAL A 160 -7.417 2.288 9.299 1.00 60.12 C ATOM 2489 CG1 VAL A 160 -7.744 1.886 10.729 1.00 45.31 C ATOM 2490 CG2 VAL A 160 -5.912 2.362 9.088 1.00 54.23 C ATOM 0 H VAL A 160 -7.043 2.419 6.837 1.00 54.22 H new ATOM 0 HA VAL A 160 -7.684 0.301 8.504 1.00 34.42 H new ATOM 0 HB VAL A 160 -7.836 3.279 9.123 1.00 60.12 H new ATOM 0 HG11 VAL A 160 -7.285 2.593 11.420 1.00 45.31 H new ATOM 0 HG12 VAL A 160 -8.825 1.891 10.870 1.00 45.31 H new ATOM 0 HG13 VAL A 160 -7.357 0.886 10.923 1.00 45.31 H new ATOM 0 HG21 VAL A 160 -5.478 3.061 9.803 1.00 54.23 H new ATOM 0 HG22 VAL A 160 -5.475 1.374 9.235 1.00 54.23 H new ATOM 0 HG23 VAL A 160 -5.703 2.704 8.074 1.00 54.23 H new ATOM 2500 N ARG A 161 -10.220 2.294 7.832 1.00 14.11 N ATOM 2501 CA ARG A 161 -11.671 2.420 7.911 1.00 20.53 C ATOM 2502 C ARG A 161 -12.355 1.314 7.114 1.00 42.32 C ATOM 2503 O ARG A 161 -13.467 0.898 7.438 1.00 23.04 O ATOM 2504 CB ARG A 161 -12.116 3.788 7.392 1.00 61.34 C ATOM 2505 CG ARG A 161 -11.537 4.956 8.175 1.00 12.11 C ATOM 2506 CD ARG A 161 -12.050 6.286 7.649 1.00 70.30 C ATOM 2507 NE ARG A 161 -12.155 7.286 8.694 1.00 32.02 N ATOM 2508 CZ ARG A 161 -12.633 8.505 8.490 1.00 62.11 C ATOM 2509 NH1 ARG A 161 -13.046 8.875 7.283 1.00 11.24 N ATOM 2510 NH2 ARG A 161 -12.697 9.355 9.491 1.00 53.30 N ATOM 0 H ARG A 161 -9.766 3.002 7.255 1.00 14.11 H new ATOM 0 HA ARG A 161 -11.963 2.325 8.957 1.00 20.53 H new ATOM 0 HB2 ARG A 161 -11.824 3.883 6.346 1.00 61.34 H new ATOM 0 HB3 ARG A 161 -13.204 3.843 7.425 1.00 61.34 H new ATOM 0 HG2 ARG A 161 -11.798 4.855 9.228 1.00 12.11 H new ATOM 0 HG3 ARG A 161 -10.449 4.934 8.113 1.00 12.11 H new ATOM 0 HD2 ARG A 161 -11.381 6.648 6.868 1.00 70.30 H new ATOM 0 HD3 ARG A 161 -13.027 6.140 7.189 1.00 70.30 H new ATOM 0 HE ARG A 161 -11.845 7.039 9.634 1.00 32.02 H new ATOM 0 HH11 ARG A 161 -12.997 8.219 6.504 1.00 11.24 H new ATOM 0 HH12 ARG A 161 -13.412 9.815 7.135 1.00 11.24 H new ATOM 0 HH21 ARG A 161 -12.380 9.075 10.419 1.00 53.30 H new ATOM 0 HH22 ARG A 161 -13.064 10.295 9.340 1.00 53.30 H new ATOM 2524 N GLU A 162 -11.682 0.843 6.068 1.00 12.22 N ATOM 2525 CA GLU A 162 -12.224 -0.214 5.222 1.00 55.22 C ATOM 2526 C GLU A 162 -12.197 -1.558 5.943 1.00 63.02 C ATOM 2527 O GLU A 162 -13.205 -2.261 6.002 1.00 14.13 O ATOM 2528 CB GLU A 162 -11.431 -0.307 3.917 1.00 4.20 C ATOM 2529 CG GLU A 162 -11.975 0.581 2.811 1.00 52.31 C ATOM 2530 CD GLU A 162 -13.440 0.319 2.520 1.00 4.32 C ATOM 2531 OE1 GLU A 162 -13.738 -0.667 1.813 1.00 4.05 O ATOM 2532 OE2 GLU A 162 -14.289 1.099 3.000 1.00 42.12 O ATOM 0 H GLU A 162 -10.760 1.177 5.786 1.00 12.22 H new ATOM 0 HA GLU A 162 -13.261 0.034 4.994 1.00 55.22 H new ATOM 0 HB2 GLU A 162 -10.393 -0.036 4.112 1.00 4.20 H new ATOM 0 HB3 GLU A 162 -11.431 -1.342 3.574 1.00 4.20 H new ATOM 0 HG2 GLU A 162 -11.846 1.626 3.092 1.00 52.31 H new ATOM 0 HG3 GLU A 162 -11.394 0.421 1.903 1.00 52.31 H new ATOM 2539 N ILE A 163 -11.037 -1.910 6.489 1.00 44.23 N ATOM 2540 CA ILE A 163 -10.877 -3.164 7.202 1.00 71.31 C ATOM 2541 C ILE A 163 -11.849 -3.259 8.375 1.00 34.10 C ATOM 2542 O ILE A 163 -12.380 -4.331 8.669 1.00 32.10 O ATOM 2543 CB ILE A 163 -9.438 -3.317 7.710 1.00 15.34 C ATOM 2544 CG1 ILE A 163 -8.472 -3.283 6.531 1.00 41.54 C ATOM 2545 CG2 ILE A 163 -9.281 -4.610 8.489 1.00 71.33 C ATOM 2546 CD1 ILE A 163 -7.038 -3.093 6.944 1.00 30.14 C ATOM 0 H ILE A 163 -10.193 -1.339 6.449 1.00 44.23 H new ATOM 0 HA ILE A 163 -11.097 -3.971 6.503 1.00 71.31 H new ATOM 0 HB ILE A 163 -9.210 -2.489 8.381 1.00 15.34 H new ATOM 0 HG12 ILE A 163 -8.561 -4.213 5.970 1.00 41.54 H new ATOM 0 HG13 ILE A 163 -8.759 -2.475 5.858 1.00 41.54 H new ATOM 0 HG21 ILE A 163 -8.253 -4.700 8.841 1.00 71.33 H new ATOM 0 HG22 ILE A 163 -9.958 -4.605 9.343 1.00 71.33 H new ATOM 0 HG23 ILE A 163 -9.519 -5.455 7.843 1.00 71.33 H new ATOM 0 HD11 ILE A 163 -6.403 -3.078 6.058 1.00 30.14 H new ATOM 0 HD12 ILE A 163 -6.936 -2.149 7.480 1.00 30.14 H new ATOM 0 HD13 ILE A 163 -6.735 -3.914 7.594 1.00 30.14 H new ATOM 2558 N ARG A 164 -12.079 -2.131 9.039 1.00 33.40 N ATOM 2559 CA ARG A 164 -12.990 -2.086 10.176 1.00 24.22 C ATOM 2560 C ARG A 164 -14.408 -2.447 9.748 1.00 71.12 C ATOM 2561 O ARG A 164 -15.141 -3.108 10.484 1.00 3.10 O ATOM 2562 CB ARG A 164 -12.973 -0.695 10.814 1.00 61.53 C ATOM 2563 CG ARG A 164 -12.012 -0.574 11.984 1.00 53.42 C ATOM 2564 CD ARG A 164 -12.079 0.804 12.621 1.00 32.54 C ATOM 2565 NE ARG A 164 -13.456 1.235 12.853 1.00 54.01 N ATOM 2566 CZ ARG A 164 -14.243 0.725 13.798 1.00 33.34 C ATOM 2567 NH1 ARG A 164 -13.796 -0.236 14.597 1.00 63.03 N ATOM 2568 NH2 ARG A 164 -15.481 1.177 13.944 1.00 22.22 N ATOM 0 H ARG A 164 -11.647 -1.236 8.809 1.00 33.40 H new ATOM 0 HA ARG A 164 -12.654 -2.818 10.911 1.00 24.22 H new ATOM 0 HB2 ARG A 164 -12.703 0.040 10.056 1.00 61.53 H new ATOM 0 HB3 ARG A 164 -13.979 -0.448 11.154 1.00 61.53 H new ATOM 0 HG2 ARG A 164 -12.249 -1.333 12.730 1.00 53.42 H new ATOM 0 HG3 ARG A 164 -10.995 -0.769 11.643 1.00 53.42 H new ATOM 0 HD2 ARG A 164 -11.539 0.792 13.568 1.00 32.54 H new ATOM 0 HD3 ARG A 164 -11.577 1.526 11.977 1.00 32.54 H new ATOM 0 HE ARG A 164 -13.836 1.969 12.256 1.00 54.01 H new ATOM 0 HH11 ARG A 164 -12.845 -0.588 14.489 1.00 63.03 H new ATOM 0 HH12 ARG A 164 -14.404 -0.623 15.319 1.00 63.03 H new ATOM 0 HH21 ARG A 164 -15.830 1.915 13.332 1.00 22.22 H new ATOM 0 HH22 ARG A 164 -16.084 0.787 14.668 1.00 22.22 H new ATOM 2582 N GLN A 165 -14.787 -2.010 8.552 1.00 64.45 N ATOM 2583 CA GLN A 165 -16.116 -2.288 8.022 1.00 63.34 C ATOM 2584 C GLN A 165 -16.200 -3.714 7.488 1.00 25.02 C ATOM 2585 O GLN A 165 -17.266 -4.329 7.498 1.00 64.52 O ATOM 2586 CB GLN A 165 -16.465 -1.293 6.913 1.00 10.14 C ATOM 2587 CG GLN A 165 -17.016 0.026 7.429 1.00 51.20 C ATOM 2588 CD GLN A 165 -17.980 0.676 6.457 1.00 63.24 C ATOM 2589 OE1 GLN A 165 -19.111 1.006 6.813 1.00 32.05 O ATOM 2590 NE2 GLN A 165 -17.536 0.862 5.219 1.00 1.33 N ATOM 0 H GLN A 165 -14.192 -1.461 7.931 1.00 64.45 H new ATOM 0 HA GLN A 165 -16.834 -2.180 8.835 1.00 63.34 H new ATOM 0 HB2 GLN A 165 -15.573 -1.097 6.319 1.00 10.14 H new ATOM 0 HB3 GLN A 165 -17.198 -1.747 6.246 1.00 10.14 H new ATOM 0 HG2 GLN A 165 -17.523 -0.143 8.379 1.00 51.20 H new ATOM 0 HG3 GLN A 165 -16.189 0.709 7.626 1.00 51.20 H new ATOM 0 HE21 GLN A 165 -16.591 0.573 4.967 1.00 1.33 H new ATOM 0 HE22 GLN A 165 -18.140 1.294 4.520 1.00 1.33 H new ATOM 2599 N HIS A 166 -15.068 -4.235 7.023 1.00 52.13 N ATOM 2600 CA HIS A 166 -15.014 -5.590 6.486 1.00 42.13 C ATOM 2601 C HIS A 166 -14.120 -6.479 7.344 1.00 65.11 C ATOM 2602 O HIS A 166 -14.660 -7.207 8.203 1.00 32.04 O ATOM 2603 CB HIS A 166 -14.505 -5.569 5.042 1.00 72.21 C ATOM 2604 CG HIS A 166 -15.452 -6.194 4.066 1.00 2.24 C ATOM 2605 ND1 HIS A 166 -16.131 -7.367 4.321 1.00 72.01 N ATOM 2606 CD2 HIS A 166 -15.835 -5.802 2.827 1.00 41.05 C ATOM 2607 CE1 HIS A 166 -16.890 -7.670 3.283 1.00 20.21 C ATOM 2608 NE2 HIS A 166 -16.729 -6.736 2.363 1.00 2.52 N ATOM 2609 OXT HIS A 166 -12.886 -6.439 7.150 1.00 30.05 O ATOM 0 H HIS A 166 -14.177 -3.739 7.007 1.00 52.13 H new ATOM 0 HA HIS A 166 -16.023 -6.002 6.500 1.00 42.13 H new ATOM 0 HB2 HIS A 166 -14.319 -4.537 4.746 1.00 72.21 H new ATOM 0 HB3 HIS A 166 -13.549 -6.091 4.994 1.00 72.21 H new ATOM 0 HD2 HIS A 166 -15.500 -4.920 2.302 1.00 41.05 H new ATOM 0 HE1 HIS A 166 -17.533 -8.534 3.201 1.00 20.21 H new ATOM 0 HE2 HIS A 166 -17.193 -6.712 1.455 1.00 2.52 H new TER 2618 HIS A 166 HETATM 2619 PG GNP A 201 13.455 -0.912 -4.879 1.00 65.21 P HETATM 2620 O1G GNP A 201 14.468 0.113 -4.161 1.00 43.31 O HETATM 2621 O2G GNP A 201 12.494 -1.471 -3.714 1.00 12.52 O HETATM 2622 O3G GNP A 201 14.154 -1.990 -5.612 1.00 14.14 O HETATM 2623 N3B GNP A 201 12.512 -0.006 -5.839 1.00 23.05 N HETATM 2624 PB GNP A 201 12.417 1.496 -5.237 1.00 33.43 P HETATM 2625 O1B GNP A 201 11.447 2.247 -6.066 1.00 53.13 O HETATM 2626 O2B GNP A 201 12.176 1.405 -3.780 1.00 41.02 O HETATM 2627 O3A GNP A 201 13.898 2.071 -5.501 1.00 32.33 O HETATM 2628 PA GNP A 201 14.322 2.552 -6.977 1.00 62.23 P HETATM 2629 O1A GNP A 201 13.196 2.287 -7.900 1.00 11.25 O HETATM 2630 O2A GNP A 201 15.638 1.945 -7.280 1.00 62.04 O HETATM 2631 O5' GNP A 201 14.501 4.143 -6.805 1.00 24.10 O HETATM 2632 C5' GNP A 201 13.366 5.011 -6.873 1.00 53.41 C HETATM 2633 C4' GNP A 201 13.806 6.476 -6.860 1.00 51.12 C HETATM 2634 O4' GNP A 201 12.631 7.308 -6.811 1.00 43.12 O HETATM 2635 C3' GNP A 201 14.566 6.760 -5.563 1.00 4.12 C HETATM 2636 O3' GNP A 201 15.356 7.945 -5.694 1.00 63.44 O HETATM 2637 C2' GNP A 201 13.391 7.001 -4.620 1.00 21.51 C HETATM 2638 O2' GNP A 201 13.838 7.690 -3.450 1.00 33.01 O HETATM 2639 C1' GNP A 201 12.620 7.958 -5.528 1.00 53.25 C HETATM 2640 N9 GNP A 201 11.241 8.186 -5.039 1.00 14.15 N HETATM 2641 C8 GNP A 201 10.520 7.338 -4.310 1.00 33.43 C HETATM 2642 N7 GNP A 201 9.331 7.878 -4.052 1.00 13.13 N HETATM 2643 C5 GNP A 201 9.292 9.080 -4.619 1.00 72.32 C HETATM 2644 C6 GNP A 201 8.321 10.071 -4.675 1.00 31.05 C HETATM 2645 O6 GNP A 201 7.233 9.917 -4.121 1.00 44.41 O HETATM 2646 N1 GNP A 201 8.604 11.250 -5.374 1.00 52.21 N HETATM 2647 C2 GNP A 201 9.852 11.396 -5.992 1.00 32.02 C HETATM 2648 N2 GNP A 201 10.134 12.512 -6.659 1.00 62.04 N HETATM 2649 N3 GNP A 201 10.765 10.416 -5.915 1.00 72.35 N HETATM 2650 C4 GNP A 201 10.513 9.278 -5.251 1.00 42.10 C HETATM 0 HO3' GNP A 201 15.220 8.517 -4.910 1.00 63.44 H new HETATM 0 HO2' GNP A 201 13.244 7.479 -2.699 1.00 33.01 H new HETATM 0 HNB3 GNP A 201 12.051 -0.331 -6.689 1.00 23.05 H new HETATM 0 HN22 GNP A 201 11.042 12.621 -7.110 1.00 62.04 H new HETATM 0 HN21 GNP A 201 9.442 13.259 -6.719 1.00 62.04 H new HETATM 0 H5'2 GNP A 201 12.703 4.818 -6.030 1.00 53.41 H new HETATM 0 H5'1 GNP A 201 12.798 4.805 -7.780 1.00 53.41 H new HETATM 0 HN1 GNP A 201 7.909 11.994 -5.433 1.00 52.21 H new HETATM 0 H8 GNP A 201 10.851 6.355 -3.976 1.00 33.43 H new HETATM 0 H4' GNP A 201 14.418 6.672 -7.741 1.00 51.12 H new HETATM 0 H3' GNP A 201 15.261 5.981 -5.250 1.00 4.12 H new HETATM 0 H2' GNP A 201 12.857 6.123 -4.256 1.00 21.51 H new HETATM 0 H1' GNP A 201 13.070 8.950 -5.563 1.00 53.25 H new HETATM 2664 MG MG A 202 11.673 -0.248 -2.243 1.00 53.43 MG HETATM 2665 C13 KOB A 203 3.997 -13.269 7.683 1.00 72.02 C HETATM 2666 C12 KOB A 203 3.486 -12.142 8.315 1.00 72.13 C HETATM 2667 C11 KOB A 203 2.956 -12.249 9.596 1.00 0.42 C HETATM 2668 F11 KOB A 203 2.459 -11.158 10.213 1.00 41.50 F HETATM 2669 C10 KOB A 203 2.939 -13.479 10.243 1.00 42.53 C HETATM 2670 C9 KOB A 203 3.451 -14.607 9.612 1.00 52.33 C HETATM 2671 C8 KOB A 203 3.978 -14.500 8.330 1.00 64.30 C HETATM 2672 N8 KOB A 203 4.474 -15.559 7.695 1.00 41.10 N HETATM 2673 C7 KOB A 203 4.498 -16.778 8.228 1.00 4.15 C HETATM 2674 S7 KOB A 203 3.856 -17.114 9.821 1.00 33.33 S HETATM 2675 N7 KOB A 203 5.025 -17.757 7.498 1.00 72.04 N HETATM 2676 N6 KOB A 203 5.449 -17.469 6.380 1.00 54.34 N HETATM 2677 C6 KOB A 203 6.503 -16.668 6.249 1.00 15.42 C HETATM 2678 C5 KOB A 203 6.754 -16.103 5.004 1.00 30.12 C HETATM 2679 C4 KOB A 203 7.643 -15.040 4.890 1.00 4.11 C HETATM 2680 C3 KOB A 203 8.285 -14.548 6.021 1.00 75.12 C HETATM 2681 N3 KOB A 203 9.105 -13.506 5.923 1.00 43.51 N HETATM 2682 O3B KOB A 203 9.757 -13.003 7.081 1.00 61.43 O HETATM 2683 O3A KOB A 203 9.327 -12.892 4.661 1.00 33.13 O HETATM 2684 C2 KOB A 203 8.049 -15.126 7.264 1.00 60.14 C HETATM 2685 C1 KOB A 203 7.164 -16.191 7.377 1.00 40.23 C HETATM 2686 N1 KOB A 203 7.067 -16.824 8.543 1.00 44.02 N HETATM 2687 O1B KOB A 203 7.755 -16.313 9.677 1.00 4.34 O HETATM 2688 O1A KOB A 203 6.296 -18.011 8.667 1.00 2.43 O HETATM 0 HE2 KOB A 203 3.501 -11.177 7.808 1.00 72.13 H new HETATM 0 HE1 KOB A 203 2.523 -13.559 11.247 1.00 42.53 H new HETATM 0 HD2 KOB A 203 4.413 -13.188 6.679 1.00 72.02 H new HETATM 0 HD1 KOB A 203 3.439 -15.571 10.120 1.00 52.33 H new HETATM 0 HAD KOB A 203 4.853 -15.430 6.757 1.00 41.10 H new HETATM 0 HAC KOB A 203 5.076 -18.712 7.853 1.00 72.04 H new HETATM 0 HAB KOB A 203 4.991 -17.846 5.550 1.00 54.34 H new HETATM 0 H5 KOB A 203 6.254 -16.493 4.117 1.00 30.12 H new HETATM 0 H4 KOB A 203 7.836 -14.593 3.915 1.00 4.11 H new HETATM 0 H2 KOB A 203 8.558 -14.744 8.149 1.00 60.14 H new HETATM 2699 O HOH A 301 9.699 -0.878 -3.226 1.00 31.43 O HETATM 2702 O HOH A 302 13.608 0.521 -1.429 1.00 52.54 O HETATM 2705 O HOH A 303 11.314 -1.889 -0.768 1.00 11.25 O