USER MOD reduce.3.24.130724 H: found=0, std=0, add=1216, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1210 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 118 LYS NZ :NH3+ -111:sc= 3 (180deg=-0.898) USER MOD Set 1.2: A 123 GLN : amide:sc= 1.13 K(o=4.1,f=-10!) USER MOD Set 2.1: A 110 SER OG : rot -56:sc= 0.172 USER MOD Set 2.2: A 115 SER OG : rot 80:sc= 0.0171 USER MOD Set 3.1: A 50 THR OG1 : rot -101:sc= -0.173 USER MOD Set 3.2: A 54 THR OG1 : rot -61:sc= 0.826 USER MOD Set 3.3: A 56 LYS NZ :NH3+ 160:sc= 1.15 (180deg=0.0364) USER MOD Set 4.1: A 28 GLN : amide:sc= 0.652 K(o=1.2,f=0) USER MOD Set 4.2: A 47 ASN : amide:sc= 0.584 K(o=1.2,f=-1.1!) USER MOD Set 5.1: A 21 ASN : amide:sc= -0.31 K(o=-0.6,f=-5.1!) USER MOD Set 5.2: A 34 CYS SG : rot 45:sc= -0.292 USER MOD Single : A 1 ALA N :NH3+ -129:sc= 0.317 (180deg=0) USER MOD Single : A 4 TYR OH : rot -44:sc= 0.762 USER MOD Single : A 5 THR OG1 : rot -62:sc= 0.0638 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot -49:sc= 0.525 USER MOD Single : A 24 ASN : amide:sc= -0.201 K(o=-0.2,f=-4.7!) USER MOD Single : A 25 HIS : no HD1:sc= -0.533 X(o=-0.53,f=-0.055) USER MOD Single : A 40 LYS NZ :NH3+ -118:sc= 0.291 (180deg=-0.218) USER MOD Single : A 43 GLN : amide:sc= 0 X(o=0,f=-0.093) USER MOD Single : A 57 THR OG1 : rot 142:sc= 0.95 USER MOD Single : A 59 LYS NZ :NH3+ 161:sc= 0.347 (180deg=0.198) USER MOD Single : A 60 CYS SG : rot -160:sc= -0.186 USER MOD Single : A 63 THR OG1 : rot 33:sc= 0.671 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 HIS : no HE2:sc= -1.28 K(o=-1.3,f=-3.3!) USER MOD Single : A 72 ASN : amide:sc= 0.0308 K(o=0.031,f=-1.3) USER MOD Single : A 74 ASN : amide:sc= 0.231 K(o=0.23,f=-3.9!) USER MOD Single : A 75 ASN : amide:sc= 0.244 X(o=0.24,f=-0.015) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 89 TYR OH : rot -30:sc= -0.792 USER MOD Single : A 97 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 SER OG : rot 28:sc= 0.792 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= -0.0718 USER MOD Single : A 111 THR OG1 : rot 180:sc=0.000668 USER MOD Single : A 122 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 124 SER OG : rot -154:sc= 0.136 USER MOD Single : A 126 SER OG : rot 83:sc= 0.859 USER MOD Single : A 127 HIS : no HD1:sc= -0.143 X(o=-0.14,f=0.00029) USER MOD Single : A 132 MET CE :methyl 137:sc= -0.843 (180deg=-1.26) USER MOD Single : A 134 THR OG1 : rot -70:sc= 0.939 USER MOD Single : A 135 THR OG1 : rot -78:sc= 0.752 USER MOD Single : A 140 THR OG1 : rot -170:sc=-0.00386 USER MOD Single : A 142 TYR OH : rot 15:sc= -0.207 USER MOD Single : A 143 CYS SG : rot -135:sc= 0.836 USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 GLN : amide:sc=-0.00219 X(o=-0.0022,f=-0.29) USER MOD Single : A 151 LYS NZ :NH3+ -120:sc= 1.19 (180deg=0.0182) USER MOD Single : A 153 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 GLN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 158 ASN : amide:sc= 0.575 K(o=0.57,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 11.414 9.373 -16.396 1.00 3.77 N ATOM 2 CA ALA A 1 11.330 8.081 -15.689 1.00 2.62 C ATOM 3 C ALA A 1 10.108 8.153 -14.773 1.00 2.00 C ATOM 4 O ALA A 1 9.422 9.174 -14.834 1.00 2.22 O ATOM 5 CB ALA A 1 12.651 7.809 -14.959 1.00 2.71 C ATOM 0 H1 ALA A 1 11.503 9.204 -17.418 1.00 3.77 H new ATOM 0 H2 ALA A 1 10.554 9.927 -16.210 1.00 3.77 H new ATOM 0 H3 ALA A 1 12.245 9.900 -16.059 1.00 3.77 H new ATOM 0 HA ALA A 1 11.195 7.236 -16.364 1.00 2.62 H new ATOM 0 HB1 ALA A 1 12.588 6.854 -14.437 1.00 2.71 H new ATOM 0 HB2 ALA A 1 13.466 7.774 -15.682 1.00 2.71 H new ATOM 0 HB3 ALA A 1 12.839 8.605 -14.238 1.00 2.71 H new ATOM 11 N PRO A 2 9.771 7.137 -13.966 1.00 1.65 N ATOM 12 CA PRO A 2 8.640 7.259 -13.065 1.00 1.21 C ATOM 13 C PRO A 2 8.973 8.239 -11.941 1.00 0.85 C ATOM 14 O PRO A 2 10.129 8.623 -11.764 1.00 1.22 O ATOM 15 CB PRO A 2 8.387 5.848 -12.556 1.00 1.66 C ATOM 16 CG PRO A 2 9.767 5.210 -12.570 1.00 2.17 C ATOM 17 CD PRO A 2 10.424 5.846 -13.794 1.00 2.17 C ATOM 0 HA PRO A 2 7.747 7.657 -13.548 1.00 1.21 H new ATOM 0 HB2 PRO A 2 7.958 5.854 -11.554 1.00 1.66 H new ATOM 0 HB3 PRO A 2 7.690 5.309 -13.198 1.00 1.66 H new ATOM 0 HG2 PRO A 2 10.321 5.425 -11.656 1.00 2.17 H new ATOM 0 HG3 PRO A 2 9.710 4.125 -12.660 1.00 2.17 H new ATOM 0 HD2 PRO A 2 11.497 5.967 -13.644 1.00 2.17 H new ATOM 0 HD3 PRO A 2 10.294 5.221 -14.677 1.00 2.17 H new ATOM 25 N ALA A 3 7.955 8.675 -11.199 1.00 0.76 N ATOM 26 CA ALA A 3 8.093 9.683 -10.165 1.00 1.29 C ATOM 27 C ALA A 3 6.841 9.651 -9.306 1.00 1.04 C ATOM 28 O ALA A 3 5.805 9.182 -9.772 1.00 0.70 O ATOM 29 CB ALA A 3 8.199 11.068 -10.804 1.00 1.84 C ATOM 0 H ALA A 3 7.001 8.329 -11.306 1.00 0.76 H new ATOM 0 HA ALA A 3 8.985 9.484 -9.572 1.00 1.29 H new ATOM 0 HB1 ALA A 3 8.302 11.822 -10.024 1.00 1.84 H new ATOM 0 HB2 ALA A 3 9.070 11.101 -11.458 1.00 1.84 H new ATOM 0 HB3 ALA A 3 7.300 11.270 -11.386 1.00 1.84 H new ATOM 35 N TYR A 4 6.952 10.168 -8.085 1.00 1.40 N ATOM 36 CA TYR A 4 5.885 10.243 -7.096 1.00 1.25 C ATOM 37 C TYR A 4 5.094 11.528 -7.320 1.00 1.04 C ATOM 38 O TYR A 4 5.605 12.480 -7.905 1.00 1.30 O ATOM 39 CB TYR A 4 6.462 10.193 -5.673 1.00 1.80 C ATOM 40 CG TYR A 4 7.727 9.368 -5.559 1.00 2.75 C ATOM 41 CD1 TYR A 4 8.955 9.969 -5.878 1.00 1.72 C ATOM 42 CD2 TYR A 4 7.684 8.007 -5.215 1.00 5.24 C ATOM 43 CE1 TYR A 4 10.152 9.236 -5.840 1.00 2.68 C ATOM 44 CE2 TYR A 4 8.876 7.262 -5.171 1.00 6.20 C ATOM 45 CZ TYR A 4 10.112 7.874 -5.475 1.00 4.78 C ATOM 46 OH TYR A 4 11.254 7.152 -5.374 1.00 5.83 O ATOM 0 H TYR A 4 7.829 10.563 -7.745 1.00 1.40 H new ATOM 0 HA TYR A 4 5.220 9.387 -7.209 1.00 1.25 H new ATOM 0 HB2 TYR A 4 6.670 11.209 -5.339 1.00 1.80 H new ATOM 0 HB3 TYR A 4 5.709 9.783 -4.999 1.00 1.80 H new ATOM 0 HD1 TYR A 4 8.979 11.012 -6.157 1.00 1.72 H new ATOM 0 HD2 TYR A 4 6.740 7.535 -4.985 1.00 5.24 H new ATOM 0 HE1 TYR A 4 11.091 9.709 -6.087 1.00 2.68 H new ATOM 0 HE2 TYR A 4 8.846 6.216 -4.903 1.00 6.20 H new ATOM 0 HH TYR A 4 11.835 7.350 -6.138 1.00 5.83 H new ATOM 56 N THR A 5 3.857 11.572 -6.833 1.00 0.74 N ATOM 57 CA THR A 5 2.935 12.685 -7.009 1.00 0.76 C ATOM 58 C THR A 5 1.906 12.594 -5.878 1.00 0.59 C ATOM 59 O THR A 5 1.984 11.671 -5.070 1.00 0.51 O ATOM 60 CB THR A 5 2.256 12.615 -8.389 1.00 0.87 C ATOM 61 OG1 THR A 5 1.770 11.319 -8.634 1.00 1.17 O ATOM 62 CG2 THR A 5 3.163 13.008 -9.555 1.00 1.96 C ATOM 0 H THR A 5 3.458 10.808 -6.288 1.00 0.74 H new ATOM 0 HA THR A 5 3.461 13.639 -6.968 1.00 0.76 H new ATOM 0 HB THR A 5 1.446 13.343 -8.341 1.00 0.87 H new ATOM 0 HG1 THR A 5 2.518 10.687 -8.650 1.00 1.17 H new ATOM 0 HG21 THR A 5 2.608 12.931 -10.490 1.00 1.96 H new ATOM 0 HG22 THR A 5 3.506 14.034 -9.420 1.00 1.96 H new ATOM 0 HG23 THR A 5 4.023 12.339 -9.588 1.00 1.96 H new ATOM 70 N VAL A 6 0.946 13.519 -5.804 1.00 0.67 N ATOM 71 CA VAL A 6 -0.033 13.587 -4.728 1.00 0.72 C ATOM 72 C VAL A 6 -1.422 13.559 -5.340 1.00 0.63 C ATOM 73 O VAL A 6 -1.665 14.253 -6.328 1.00 0.63 O ATOM 74 CB VAL A 6 0.220 14.830 -3.849 1.00 0.88 C ATOM 75 CG1 VAL A 6 0.103 16.161 -4.600 1.00 1.84 C ATOM 76 CG2 VAL A 6 -0.709 14.846 -2.631 1.00 1.67 C ATOM 0 H VAL A 6 0.829 14.252 -6.504 1.00 0.67 H new ATOM 0 HA VAL A 6 0.058 12.728 -4.064 1.00 0.72 H new ATOM 0 HB VAL A 6 1.257 14.740 -3.525 1.00 0.88 H new ATOM 0 HG11 VAL A 6 0.295 16.985 -3.912 1.00 1.84 H new ATOM 0 HG12 VAL A 6 0.832 16.187 -5.410 1.00 1.84 H new ATOM 0 HG13 VAL A 6 -0.901 16.259 -5.013 1.00 1.84 H new ATOM 0 HG21 VAL A 6 -0.507 15.733 -2.031 1.00 1.67 H new ATOM 0 HG22 VAL A 6 -1.746 14.862 -2.965 1.00 1.67 H new ATOM 0 HG23 VAL A 6 -0.535 13.954 -2.029 1.00 1.67 H new ATOM 86 N LYS A 7 -2.339 12.769 -4.773 1.00 0.63 N ATOM 87 CA LYS A 7 -3.705 12.738 -5.263 1.00 0.64 C ATOM 88 C LYS A 7 -4.698 12.768 -4.104 1.00 0.70 C ATOM 89 O LYS A 7 -4.515 12.092 -3.094 1.00 0.88 O ATOM 90 CB LYS A 7 -3.891 11.491 -6.129 1.00 0.74 C ATOM 91 CG LYS A 7 -5.100 11.656 -7.058 1.00 1.02 C ATOM 92 CD LYS A 7 -4.649 11.790 -8.513 1.00 1.03 C ATOM 93 CE LYS A 7 -5.884 11.979 -9.396 1.00 1.59 C ATOM 94 NZ LYS A 7 -5.536 11.954 -10.832 1.00 1.85 N ATOM 0 H LYS A 7 -2.155 12.151 -3.983 1.00 0.63 H new ATOM 0 HA LYS A 7 -3.898 13.623 -5.869 1.00 0.64 H new ATOM 0 HB2 LYS A 7 -2.992 11.315 -6.720 1.00 0.74 H new ATOM 0 HB3 LYS A 7 -4.031 10.617 -5.493 1.00 0.74 H new ATOM 0 HG2 LYS A 7 -5.764 10.797 -6.955 1.00 1.02 H new ATOM 0 HG3 LYS A 7 -5.671 12.537 -6.766 1.00 1.02 H new ATOM 0 HD2 LYS A 7 -3.973 12.638 -8.622 1.00 1.03 H new ATOM 0 HD3 LYS A 7 -4.097 10.902 -8.821 1.00 1.03 H new ATOM 0 HE2 LYS A 7 -6.608 11.192 -9.183 1.00 1.59 H new ATOM 0 HE3 LYS A 7 -6.363 12.928 -9.154 1.00 1.59 H new ATOM 0 HZ1 LYS A 7 -6.397 12.085 -11.400 1.00 1.85 H new ATOM 0 HZ2 LYS A 7 -4.864 12.720 -11.040 1.00 1.85 H new ATOM 0 HZ3 LYS A 7 -5.101 11.039 -11.068 1.00 1.85 H new ATOM 108 N ARG A 8 -5.763 13.551 -4.278 1.00 0.83 N ATOM 109 CA ARG A 8 -6.944 13.563 -3.432 1.00 1.06 C ATOM 110 C ARG A 8 -7.971 12.661 -4.092 1.00 1.28 C ATOM 111 O ARG A 8 -8.453 13.019 -5.165 1.00 1.75 O ATOM 112 CB ARG A 8 -7.503 14.992 -3.383 1.00 1.46 C ATOM 113 CG ARG A 8 -6.914 15.803 -2.239 1.00 1.68 C ATOM 114 CD ARG A 8 -7.389 15.251 -0.891 1.00 1.94 C ATOM 115 NE ARG A 8 -7.391 16.313 0.111 1.00 2.75 N ATOM 116 CZ ARG A 8 -8.289 17.294 0.157 1.00 3.28 C ATOM 117 NH1 ARG A 8 -7.918 18.452 0.695 1.00 4.29 N ATOM 118 NH2 ARG A 8 -9.512 17.126 -0.351 1.00 4.00 N ATOM 0 H ARG A 8 -5.823 14.220 -5.046 1.00 0.83 H new ATOM 0 HA ARG A 8 -6.710 13.226 -2.422 1.00 1.06 H new ATOM 0 HB2 ARG A 8 -7.293 15.494 -4.327 1.00 1.46 H new ATOM 0 HB3 ARG A 8 -8.587 14.952 -3.277 1.00 1.46 H new ATOM 0 HG2 ARG A 8 -5.825 15.774 -2.287 1.00 1.68 H new ATOM 0 HG3 ARG A 8 -7.210 16.848 -2.336 1.00 1.68 H new ATOM 0 HD2 ARG A 8 -8.391 14.834 -0.992 1.00 1.94 H new ATOM 0 HD3 ARG A 8 -6.736 14.439 -0.571 1.00 1.94 H new ATOM 0 HE ARG A 8 -6.658 16.302 0.820 1.00 2.75 H new ATOM 0 HH11 ARG A 8 -6.971 18.566 1.056 1.00 4.29 H new ATOM 0 HH12 ARG A 8 -8.581 19.226 0.747 1.00 4.29 H new ATOM 0 HH21 ARG A 8 -9.768 16.237 -0.781 1.00 4.00 H new ATOM 0 HH22 ARG A 8 -10.191 17.886 -0.309 1.00 4.00 H new ATOM 132 N ALA A 9 -8.229 11.493 -3.504 1.00 1.15 N ATOM 133 CA ALA A 9 -9.308 10.572 -3.842 1.00 1.24 C ATOM 134 C ALA A 9 -9.067 9.279 -3.067 1.00 1.23 C ATOM 135 O ALA A 9 -7.990 9.087 -2.504 1.00 1.18 O ATOM 136 CB ALA A 9 -9.375 10.277 -5.347 1.00 1.26 C ATOM 0 H ALA A 9 -7.656 11.147 -2.735 1.00 1.15 H new ATOM 0 HA ALA A 9 -10.261 11.027 -3.573 1.00 1.24 H new ATOM 0 HB1 ALA A 9 -10.195 9.587 -5.546 1.00 1.26 H new ATOM 0 HB2 ALA A 9 -9.542 11.206 -5.893 1.00 1.26 H new ATOM 0 HB3 ALA A 9 -8.436 9.829 -5.672 1.00 1.26 H new ATOM 142 N ASP A 10 -10.036 8.368 -3.067 1.00 1.33 N ATOM 143 CA ASP A 10 -9.821 7.042 -2.510 1.00 1.31 C ATOM 144 C ASP A 10 -8.839 6.260 -3.376 1.00 1.15 C ATOM 145 O ASP A 10 -8.811 6.416 -4.600 1.00 1.25 O ATOM 146 CB ASP A 10 -11.129 6.259 -2.463 1.00 1.59 C ATOM 147 CG ASP A 10 -12.113 6.847 -1.461 1.00 1.96 C ATOM 148 OD1 ASP A 10 -12.079 6.390 -0.297 1.00 2.40 O ATOM 149 OD2 ASP A 10 -12.874 7.744 -1.884 1.00 3.13 O ATOM 0 H ASP A 10 -10.971 8.525 -3.444 1.00 1.33 H new ATOM 0 HA ASP A 10 -9.425 7.167 -1.502 1.00 1.31 H new ATOM 0 HB2 ASP A 10 -11.582 6.252 -3.454 1.00 1.59 H new ATOM 0 HB3 ASP A 10 -10.921 5.222 -2.200 1.00 1.59 H new ATOM 154 N ILE A 11 -8.111 5.321 -2.772 1.00 1.05 N ATOM 155 CA ILE A 11 -7.152 4.474 -3.474 1.00 0.98 C ATOM 156 C ILE A 11 -7.878 3.295 -4.163 1.00 1.36 C ATOM 157 O ILE A 11 -7.481 2.141 -4.075 1.00 2.09 O ATOM 158 CB ILE A 11 -6.019 4.118 -2.481 1.00 0.77 C ATOM 159 CG1 ILE A 11 -4.663 3.884 -3.171 1.00 0.90 C ATOM 160 CG2 ILE A 11 -6.372 3.021 -1.464 1.00 1.04 C ATOM 161 CD1 ILE A 11 -4.624 2.741 -4.178 1.00 0.73 C ATOM 0 H ILE A 11 -8.172 5.127 -1.773 1.00 1.05 H new ATOM 0 HA ILE A 11 -6.666 4.981 -4.308 1.00 0.98 H new ATOM 0 HB ILE A 11 -5.905 5.017 -1.876 1.00 0.77 H new ATOM 0 HG12 ILE A 11 -4.372 4.803 -3.680 1.00 0.90 H new ATOM 0 HG13 ILE A 11 -3.913 3.693 -2.403 1.00 0.90 H new ATOM 0 HG21 ILE A 11 -5.517 2.841 -0.812 1.00 1.04 H new ATOM 0 HG22 ILE A 11 -7.224 3.341 -0.865 1.00 1.04 H new ATOM 0 HG23 ILE A 11 -6.625 2.102 -1.993 1.00 1.04 H new ATOM 0 HD11 ILE A 11 -3.623 2.665 -4.603 1.00 0.73 H new ATOM 0 HD12 ILE A 11 -4.878 1.806 -3.678 1.00 0.73 H new ATOM 0 HD13 ILE A 11 -5.343 2.933 -4.974 1.00 0.73 H new ATOM 173 N ALA A 12 -8.959 3.583 -4.892 1.00 1.02 N ATOM 174 CA ALA A 12 -9.635 2.656 -5.789 1.00 1.43 C ATOM 175 C ALA A 12 -10.268 3.402 -6.970 1.00 1.29 C ATOM 176 O ALA A 12 -11.193 2.918 -7.630 1.00 1.70 O ATOM 177 CB ALA A 12 -10.707 1.909 -5.010 1.00 1.69 C ATOM 0 H ALA A 12 -9.400 4.503 -4.870 1.00 1.02 H new ATOM 0 HA ALA A 12 -8.906 1.951 -6.188 1.00 1.43 H new ATOM 0 HB1 ALA A 12 -11.219 1.212 -5.673 1.00 1.69 H new ATOM 0 HB2 ALA A 12 -10.244 1.358 -4.191 1.00 1.69 H new ATOM 0 HB3 ALA A 12 -11.427 2.621 -4.607 1.00 1.69 H new ATOM 183 N THR A 13 -9.775 4.609 -7.237 1.00 1.59 N ATOM 184 CA THR A 13 -10.287 5.473 -8.282 1.00 1.58 C ATOM 185 C THR A 13 -9.122 6.109 -9.037 1.00 1.58 C ATOM 186 O THR A 13 -9.301 7.057 -9.792 1.00 1.84 O ATOM 187 CB THR A 13 -11.215 6.517 -7.653 1.00 1.78 C ATOM 188 OG1 THR A 13 -10.577 7.264 -6.642 1.00 3.35 O ATOM 189 CG2 THR A 13 -12.480 5.872 -7.082 1.00 1.57 C ATOM 0 H THR A 13 -8.995 5.015 -6.721 1.00 1.59 H new ATOM 0 HA THR A 13 -10.868 4.902 -9.007 1.00 1.58 H new ATOM 0 HB THR A 13 -11.490 7.197 -8.459 1.00 1.78 H new ATOM 0 HG1 THR A 13 -10.119 6.655 -6.025 1.00 3.35 H new ATOM 0 HG21 THR A 13 -13.115 6.642 -6.644 1.00 1.57 H new ATOM 0 HG22 THR A 13 -13.022 5.365 -7.880 1.00 1.57 H new ATOM 0 HG23 THR A 13 -12.205 5.149 -6.314 1.00 1.57 H new ATOM 197 N ALA A 14 -7.921 5.548 -8.868 1.00 1.44 N ATOM 198 CA ALA A 14 -6.712 6.108 -9.436 1.00 1.43 C ATOM 199 C ALA A 14 -6.680 6.022 -10.960 1.00 1.59 C ATOM 200 O ALA A 14 -5.880 6.716 -11.572 1.00 3.24 O ATOM 201 CB ALA A 14 -5.511 5.369 -8.844 1.00 1.40 C ATOM 0 H ALA A 14 -7.770 4.693 -8.332 1.00 1.44 H new ATOM 0 HA ALA A 14 -6.679 7.168 -9.185 1.00 1.43 H new ATOM 0 HB1 ALA A 14 -4.591 5.778 -9.261 1.00 1.40 H new ATOM 0 HB2 ALA A 14 -5.505 5.493 -7.761 1.00 1.40 H new ATOM 0 HB3 ALA A 14 -5.580 4.309 -9.088 1.00 1.40 H new ATOM 207 N ILE A 15 -7.488 5.126 -11.546 1.00 1.00 N ATOM 208 CA ILE A 15 -7.450 4.662 -12.937 1.00 1.20 C ATOM 209 C ILE A 15 -6.072 4.164 -13.381 1.00 1.09 C ATOM 210 O ILE A 15 -5.822 3.993 -14.570 1.00 1.46 O ATOM 211 CB ILE A 15 -8.123 5.650 -13.914 1.00 1.74 C ATOM 212 CG1 ILE A 15 -7.473 7.036 -14.095 1.00 2.03 C ATOM 213 CG2 ILE A 15 -9.570 5.874 -13.448 1.00 1.88 C ATOM 214 CD1 ILE A 15 -6.084 7.026 -14.744 1.00 2.71 C ATOM 0 H ILE A 15 -8.238 4.676 -11.021 1.00 1.00 H new ATOM 0 HA ILE A 15 -8.071 3.767 -12.973 1.00 1.20 H new ATOM 0 HB ILE A 15 -8.023 5.169 -14.887 1.00 1.74 H new ATOM 0 HG12 ILE A 15 -8.135 7.654 -14.701 1.00 2.03 H new ATOM 0 HG13 ILE A 15 -7.397 7.514 -13.118 1.00 2.03 H new ATOM 0 HG21 ILE A 15 -10.066 6.570 -14.124 1.00 1.88 H new ATOM 0 HG22 ILE A 15 -10.104 4.924 -13.449 1.00 1.88 H new ATOM 0 HG23 ILE A 15 -9.568 6.288 -12.439 1.00 1.88 H new ATOM 0 HD11 ILE A 15 -5.714 8.048 -14.827 1.00 2.71 H new ATOM 0 HD12 ILE A 15 -5.400 6.441 -14.130 1.00 2.71 H new ATOM 0 HD13 ILE A 15 -6.150 6.582 -15.738 1.00 2.71 H new ATOM 226 N GLU A 16 -5.186 3.894 -12.425 1.00 0.70 N ATOM 227 CA GLU A 16 -3.873 3.354 -12.706 1.00 0.66 C ATOM 228 C GLU A 16 -3.955 1.845 -12.936 1.00 0.65 C ATOM 229 O GLU A 16 -4.937 1.192 -12.587 1.00 0.68 O ATOM 230 CB GLU A 16 -2.913 3.738 -11.574 1.00 0.56 C ATOM 231 CG GLU A 16 -2.698 5.255 -11.631 1.00 0.65 C ATOM 232 CD GLU A 16 -1.666 5.767 -10.635 1.00 1.59 C ATOM 233 OE1 GLU A 16 -0.463 5.733 -10.976 1.00 3.32 O ATOM 234 OE2 GLU A 16 -2.079 6.268 -9.564 1.00 1.91 O ATOM 0 H GLU A 16 -5.366 4.047 -11.433 1.00 0.70 H new ATOM 0 HA GLU A 16 -3.479 3.782 -13.627 1.00 0.66 H new ATOM 0 HB2 GLU A 16 -3.327 3.448 -10.608 1.00 0.56 H new ATOM 0 HB3 GLU A 16 -1.964 3.214 -11.685 1.00 0.56 H new ATOM 0 HG2 GLU A 16 -2.385 5.531 -12.638 1.00 0.65 H new ATOM 0 HG3 GLU A 16 -3.649 5.755 -11.444 1.00 0.65 H new ATOM 241 N ASP A 17 -2.912 1.318 -13.575 1.00 0.65 N ATOM 242 CA ASP A 17 -2.816 -0.038 -14.097 1.00 0.68 C ATOM 243 C ASP A 17 -2.873 -1.029 -12.932 1.00 0.69 C ATOM 244 O ASP A 17 -3.704 -1.945 -12.893 1.00 0.61 O ATOM 245 CB ASP A 17 -1.488 -0.092 -14.864 1.00 0.61 C ATOM 246 CG ASP A 17 -1.362 -1.227 -15.870 1.00 1.94 C ATOM 247 OD1 ASP A 17 -2.170 -2.177 -15.794 1.00 3.16 O ATOM 248 OD2 ASP A 17 -0.425 -1.111 -16.693 1.00 2.69 O ATOM 0 H ASP A 17 -2.065 1.859 -13.751 1.00 0.65 H new ATOM 0 HA ASP A 17 -3.636 -0.305 -14.764 1.00 0.68 H new ATOM 0 HB2 ASP A 17 -1.352 0.853 -15.389 1.00 0.61 H new ATOM 0 HB3 ASP A 17 -0.675 -0.176 -14.143 1.00 0.61 H new ATOM 253 N ALA A 18 -2.028 -0.774 -11.927 1.00 0.79 N ATOM 254 CA ALA A 18 -2.162 -1.388 -10.618 1.00 0.57 C ATOM 255 C ALA A 18 -2.631 -0.376 -9.580 1.00 0.39 C ATOM 256 O ALA A 18 -2.531 0.839 -9.742 1.00 0.39 O ATOM 257 CB ALA A 18 -0.831 -1.991 -10.180 1.00 0.64 C ATOM 0 H ALA A 18 -1.236 -0.136 -12.006 1.00 0.79 H new ATOM 0 HA ALA A 18 -2.911 -2.176 -10.694 1.00 0.57 H new ATOM 0 HB1 ALA A 18 -0.945 -2.448 -9.197 1.00 0.64 H new ATOM 0 HB2 ALA A 18 -0.521 -2.749 -10.899 1.00 0.64 H new ATOM 0 HB3 ALA A 18 -0.075 -1.207 -10.130 1.00 0.64 H new ATOM 263 N VAL A 19 -3.093 -0.914 -8.458 1.00 0.35 N ATOM 264 CA VAL A 19 -3.580 -0.186 -7.303 1.00 0.28 C ATOM 265 C VAL A 19 -3.034 -0.964 -6.120 1.00 0.24 C ATOM 266 O VAL A 19 -3.187 -2.179 -6.105 1.00 0.38 O ATOM 267 CB VAL A 19 -5.119 -0.197 -7.352 1.00 0.39 C ATOM 268 CG1 VAL A 19 -5.791 0.171 -6.021 1.00 0.54 C ATOM 269 CG2 VAL A 19 -5.609 0.753 -8.449 1.00 0.75 C ATOM 0 H VAL A 19 -3.139 -1.925 -8.327 1.00 0.35 H new ATOM 0 HA VAL A 19 -3.270 0.858 -7.253 1.00 0.28 H new ATOM 0 HB VAL A 19 -5.406 -1.226 -7.568 1.00 0.39 H new ATOM 0 HG11 VAL A 19 -6.874 0.140 -6.139 1.00 0.54 H new ATOM 0 HG12 VAL A 19 -5.490 -0.541 -5.252 1.00 0.54 H new ATOM 0 HG13 VAL A 19 -5.487 1.175 -5.725 1.00 0.54 H new ATOM 0 HG21 VAL A 19 -6.699 0.742 -8.480 1.00 0.75 H new ATOM 0 HG22 VAL A 19 -5.262 1.764 -8.236 1.00 0.75 H new ATOM 0 HG23 VAL A 19 -5.215 0.430 -9.413 1.00 0.75 H new ATOM 279 N VAL A 20 -2.397 -0.317 -5.147 1.00 0.20 N ATOM 280 CA VAL A 20 -1.874 -1.007 -3.977 1.00 0.23 C ATOM 281 C VAL A 20 -2.800 -0.701 -2.804 1.00 0.20 C ATOM 282 O VAL A 20 -3.314 0.407 -2.700 1.00 0.29 O ATOM 283 CB VAL A 20 -0.437 -0.551 -3.691 1.00 0.35 C ATOM 284 CG1 VAL A 20 0.158 -1.345 -2.519 1.00 1.16 C ATOM 285 CG2 VAL A 20 0.475 -0.719 -4.914 1.00 1.06 C ATOM 0 H VAL A 20 -2.231 0.689 -5.149 1.00 0.20 H new ATOM 0 HA VAL A 20 -1.841 -2.083 -4.145 1.00 0.23 H new ATOM 0 HB VAL A 20 -0.489 0.508 -3.439 1.00 0.35 H new ATOM 0 HG11 VAL A 20 1.177 -1.008 -2.331 1.00 1.16 H new ATOM 0 HG12 VAL A 20 -0.447 -1.185 -1.627 1.00 1.16 H new ATOM 0 HG13 VAL A 20 0.167 -2.407 -2.766 1.00 1.16 H new ATOM 0 HG21 VAL A 20 1.482 -0.384 -4.666 1.00 1.06 H new ATOM 0 HG22 VAL A 20 0.503 -1.769 -5.205 1.00 1.06 H new ATOM 0 HG23 VAL A 20 0.088 -0.124 -5.741 1.00 1.06 H new ATOM 295 N ASN A 21 -3.003 -1.656 -1.899 1.00 0.21 N ATOM 296 CA ASN A 21 -3.872 -1.483 -0.748 1.00 0.31 C ATOM 297 C ASN A 21 -3.026 -1.526 0.517 1.00 0.36 C ATOM 298 O ASN A 21 -2.053 -2.283 0.576 1.00 0.42 O ATOM 299 CB ASN A 21 -4.923 -2.599 -0.721 1.00 0.43 C ATOM 300 CG ASN A 21 -6.109 -2.220 0.158 1.00 1.15 C ATOM 301 OD1 ASN A 21 -6.092 -1.196 0.827 1.00 1.99 O ATOM 302 ND2 ASN A 21 -7.164 -3.025 0.180 1.00 1.84 N ATOM 0 H ASN A 21 -2.564 -2.576 -1.948 1.00 0.21 H new ATOM 0 HA ASN A 21 -4.386 -0.524 -0.810 1.00 0.31 H new ATOM 0 HB2 ASN A 21 -5.269 -2.801 -1.735 1.00 0.43 H new ATOM 0 HB3 ASN A 21 -4.471 -3.519 -0.349 1.00 0.43 H new ATOM 0 HD21 ASN A 21 -7.971 -2.792 0.759 1.00 1.84 H new ATOM 0 HD22 ASN A 21 -7.168 -3.876 -0.382 1.00 1.84 H new ATOM 309 N ALA A 22 -3.421 -0.760 1.536 1.00 0.49 N ATOM 310 CA ALA A 22 -2.870 -0.866 2.875 1.00 0.57 C ATOM 311 C ALA A 22 -3.464 -2.113 3.528 1.00 0.54 C ATOM 312 O ALA A 22 -4.346 -2.023 4.382 1.00 0.82 O ATOM 313 CB ALA A 22 -3.203 0.406 3.664 1.00 0.71 C ATOM 0 H ALA A 22 -4.141 -0.043 1.446 1.00 0.49 H new ATOM 0 HA ALA A 22 -1.784 -0.961 2.853 1.00 0.57 H new ATOM 0 HB1 ALA A 22 -2.790 0.329 4.670 1.00 0.71 H new ATOM 0 HB2 ALA A 22 -2.771 1.270 3.160 1.00 0.71 H new ATOM 0 HB3 ALA A 22 -4.285 0.524 3.724 1.00 0.71 H new ATOM 319 N ALA A 23 -3.012 -3.288 3.091 1.00 0.45 N ATOM 320 CA ALA A 23 -3.503 -4.542 3.621 1.00 0.51 C ATOM 321 C ALA A 23 -2.914 -4.761 5.013 1.00 0.68 C ATOM 322 O ALA A 23 -1.792 -4.364 5.319 1.00 0.94 O ATOM 323 CB ALA A 23 -3.192 -5.687 2.644 1.00 0.54 C ATOM 0 H ALA A 23 -2.302 -3.389 2.366 1.00 0.45 H new ATOM 0 HA ALA A 23 -4.588 -4.516 3.727 1.00 0.51 H new ATOM 0 HB1 ALA A 23 -3.566 -6.626 3.053 1.00 0.54 H new ATOM 0 HB2 ALA A 23 -3.675 -5.490 1.687 1.00 0.54 H new ATOM 0 HB3 ALA A 23 -2.114 -5.758 2.498 1.00 0.54 H new ATOM 329 N ASN A 24 -3.685 -5.408 5.883 1.00 0.81 N ATOM 330 CA ASN A 24 -3.372 -5.501 7.300 1.00 1.05 C ATOM 331 C ASN A 24 -3.372 -6.970 7.693 1.00 1.26 C ATOM 332 O ASN A 24 -4.134 -7.405 8.550 1.00 2.72 O ATOM 333 CB ASN A 24 -4.356 -4.640 8.111 1.00 1.86 C ATOM 334 CG ASN A 24 -5.812 -5.090 7.997 1.00 1.66 C ATOM 335 OD1 ASN A 24 -6.230 -5.640 6.984 1.00 2.74 O ATOM 336 ND2 ASN A 24 -6.624 -4.838 9.018 1.00 2.05 N ATOM 0 H ASN A 24 -4.548 -5.884 5.620 1.00 0.81 H new ATOM 0 HA ASN A 24 -2.381 -5.104 7.519 1.00 1.05 H new ATOM 0 HB2 ASN A 24 -4.061 -4.659 9.160 1.00 1.86 H new ATOM 0 HB3 ASN A 24 -4.279 -3.605 7.777 1.00 1.86 H new ATOM 0 HD21 ASN A 24 -7.608 -5.103 8.965 1.00 2.05 H new ATOM 0 HD22 ASN A 24 -6.264 -4.380 9.855 1.00 2.05 H new ATOM 343 N HIS A 25 -2.507 -7.736 7.024 1.00 0.91 N ATOM 344 CA HIS A 25 -2.327 -9.177 7.186 1.00 0.83 C ATOM 345 C HIS A 25 -3.641 -9.959 6.989 1.00 1.17 C ATOM 346 O HIS A 25 -3.709 -11.152 7.269 1.00 1.91 O ATOM 347 CB HIS A 25 -1.644 -9.441 8.543 1.00 0.88 C ATOM 348 CG HIS A 25 -1.063 -10.820 8.778 1.00 1.00 C ATOM 349 ND1 HIS A 25 -0.505 -11.249 9.963 1.00 2.04 N ATOM 350 CD2 HIS A 25 -0.987 -11.866 7.894 1.00 1.18 C ATOM 351 CE1 HIS A 25 -0.113 -12.524 9.794 1.00 2.17 C ATOM 352 NE2 HIS A 25 -0.377 -12.940 8.547 1.00 1.54 N ATOM 0 H HIS A 25 -1.882 -7.346 6.319 1.00 0.91 H new ATOM 0 HA HIS A 25 -1.674 -9.554 6.399 1.00 0.83 H new ATOM 0 HB2 HIS A 25 -0.841 -8.713 8.663 1.00 0.88 H new ATOM 0 HB3 HIS A 25 -2.372 -9.245 9.330 1.00 0.88 H new ATOM 0 HD2 HIS A 25 -1.337 -11.860 6.872 1.00 1.18 H new ATOM 0 HE1 HIS A 25 0.351 -13.130 10.558 1.00 2.17 H new ATOM 0 HE2 HIS A 25 -0.173 -13.859 8.153 1.00 1.54 H new ATOM 360 N ARG A 26 -4.702 -9.328 6.474 1.00 1.91 N ATOM 361 CA ARG A 26 -6.014 -9.941 6.377 1.00 2.29 C ATOM 362 C ARG A 26 -6.667 -9.498 5.080 1.00 2.17 C ATOM 363 O ARG A 26 -7.128 -8.369 4.967 1.00 3.15 O ATOM 364 CB ARG A 26 -6.872 -9.521 7.581 1.00 3.04 C ATOM 365 CG ARG A 26 -6.473 -10.307 8.834 1.00 3.49 C ATOM 366 CD ARG A 26 -7.423 -10.005 9.996 1.00 4.53 C ATOM 367 NE ARG A 26 -7.377 -11.076 11.003 1.00 4.88 N ATOM 368 CZ ARG A 26 -8.097 -11.111 12.130 1.00 5.78 C ATOM 369 NH1 ARG A 26 -8.067 -12.195 12.907 1.00 6.15 N ATOM 370 NH2 ARG A 26 -8.848 -10.064 12.478 1.00 6.47 N ATOM 0 H ARG A 26 -4.666 -8.374 6.114 1.00 1.91 H new ATOM 0 HA ARG A 26 -5.921 -11.027 6.382 1.00 2.29 H new ATOM 0 HB2 ARG A 26 -6.753 -8.453 7.763 1.00 3.04 H new ATOM 0 HB3 ARG A 26 -7.926 -9.691 7.360 1.00 3.04 H new ATOM 0 HG2 ARG A 26 -6.486 -11.375 8.617 1.00 3.49 H new ATOM 0 HG3 ARG A 26 -5.452 -10.052 9.118 1.00 3.49 H new ATOM 0 HD2 ARG A 26 -7.150 -9.055 10.456 1.00 4.53 H new ATOM 0 HD3 ARG A 26 -8.441 -9.897 9.620 1.00 4.53 H new ATOM 0 HE ARG A 26 -6.744 -11.856 10.828 1.00 4.88 H new ATOM 0 HH11 ARG A 26 -7.495 -12.997 12.642 1.00 6.15 H new ATOM 0 HH12 ARG A 26 -8.616 -12.222 13.766 1.00 6.15 H new ATOM 0 HH21 ARG A 26 -8.874 -9.235 11.884 1.00 6.47 H new ATOM 0 HH22 ARG A 26 -9.396 -10.093 13.338 1.00 6.47 H new ATOM 384 N GLY A 27 -6.780 -10.407 4.114 1.00 1.40 N ATOM 385 CA GLY A 27 -7.611 -10.174 2.939 1.00 1.35 C ATOM 386 C GLY A 27 -9.059 -10.529 3.260 1.00 1.47 C ATOM 387 O GLY A 27 -9.661 -11.347 2.570 1.00 1.90 O ATOM 0 H GLY A 27 -6.306 -11.310 4.123 1.00 1.40 H new ATOM 0 HA2 GLY A 27 -7.541 -9.130 2.632 1.00 1.35 H new ATOM 0 HA3 GLY A 27 -7.255 -10.776 2.103 1.00 1.35 H new ATOM 391 N GLN A 28 -9.604 -9.936 4.323 1.00 1.68 N ATOM 392 CA GLN A 28 -10.962 -10.166 4.792 1.00 2.02 C ATOM 393 C GLN A 28 -11.478 -8.871 5.419 1.00 1.97 C ATOM 394 O GLN A 28 -11.798 -8.835 6.600 1.00 3.33 O ATOM 395 CB GLN A 28 -11.003 -11.316 5.810 1.00 2.69 C ATOM 396 CG GLN A 28 -10.598 -12.667 5.211 1.00 3.34 C ATOM 397 CD GLN A 28 -10.887 -13.799 6.190 1.00 4.08 C ATOM 398 OE1 GLN A 28 -10.271 -13.888 7.246 1.00 4.24 O ATOM 399 NE2 GLN A 28 -11.825 -14.679 5.866 1.00 5.09 N ATOM 0 H GLN A 28 -9.094 -9.263 4.895 1.00 1.68 H new ATOM 0 HA GLN A 28 -11.597 -10.453 3.954 1.00 2.02 H new ATOM 0 HB2 GLN A 28 -10.339 -11.081 6.641 1.00 2.69 H new ATOM 0 HB3 GLN A 28 -12.010 -11.395 6.219 1.00 2.69 H new ATOM 0 HG2 GLN A 28 -11.142 -12.836 4.281 1.00 3.34 H new ATOM 0 HG3 GLN A 28 -9.537 -12.657 4.962 1.00 3.34 H new ATOM 0 HE21 GLN A 28 -12.327 -14.588 4.983 1.00 5.09 H new ATOM 0 HE22 GLN A 28 -12.045 -15.447 6.500 1.00 5.09 H new ATOM 408 N VAL A 29 -11.559 -7.821 4.599 1.00 1.68 N ATOM 409 CA VAL A 29 -12.035 -6.486 4.963 1.00 1.81 C ATOM 410 C VAL A 29 -11.101 -5.815 5.980 1.00 1.97 C ATOM 411 O VAL A 29 -11.207 -6.023 7.186 1.00 2.70 O ATOM 412 CB VAL A 29 -13.509 -6.533 5.420 1.00 2.66 C ATOM 413 CG1 VAL A 29 -14.073 -5.117 5.599 1.00 3.49 C ATOM 414 CG2 VAL A 29 -14.375 -7.249 4.373 1.00 2.96 C ATOM 0 H VAL A 29 -11.282 -7.882 3.619 1.00 1.68 H new ATOM 0 HA VAL A 29 -12.009 -5.854 4.076 1.00 1.81 H new ATOM 0 HB VAL A 29 -13.535 -7.069 6.369 1.00 2.66 H new ATOM 0 HG11 VAL A 29 -15.113 -5.177 5.921 1.00 3.49 H new ATOM 0 HG12 VAL A 29 -13.490 -4.586 6.351 1.00 3.49 H new ATOM 0 HG13 VAL A 29 -14.017 -4.581 4.652 1.00 3.49 H new ATOM 0 HG21 VAL A 29 -15.411 -7.273 4.712 1.00 2.96 H new ATOM 0 HG22 VAL A 29 -14.316 -6.715 3.425 1.00 2.96 H new ATOM 0 HG23 VAL A 29 -14.014 -8.269 4.238 1.00 2.96 H new ATOM 424 N GLY A 30 -10.188 -4.970 5.494 1.00 2.34 N ATOM 425 CA GLY A 30 -9.302 -4.218 6.368 1.00 3.17 C ATOM 426 C GLY A 30 -10.010 -2.988 6.940 1.00 2.47 C ATOM 427 O GLY A 30 -11.013 -2.524 6.400 1.00 2.70 O ATOM 0 H GLY A 30 -10.048 -4.794 4.499 1.00 2.34 H new ATOM 0 HA2 GLY A 30 -8.960 -4.857 7.182 1.00 3.17 H new ATOM 0 HA3 GLY A 30 -8.416 -3.907 5.814 1.00 3.17 H new ATOM 431 N ASP A 31 -9.468 -2.468 8.043 1.00 2.49 N ATOM 432 CA ASP A 31 -10.117 -1.481 8.908 1.00 2.34 C ATOM 433 C ASP A 31 -9.864 -0.039 8.441 1.00 2.20 C ATOM 434 O ASP A 31 -10.698 0.854 8.591 1.00 3.31 O ATOM 435 CB ASP A 31 -9.554 -1.691 10.320 1.00 3.21 C ATOM 436 CG ASP A 31 -10.348 -0.966 11.403 1.00 4.00 C ATOM 437 OD1 ASP A 31 -9.747 -0.740 12.474 1.00 5.16 O ATOM 438 OD2 ASP A 31 -11.542 -0.689 11.161 1.00 4.18 O ATOM 0 H ASP A 31 -8.538 -2.730 8.369 1.00 2.49 H new ATOM 0 HA ASP A 31 -11.197 -1.622 8.880 1.00 2.34 H new ATOM 0 HB2 ASP A 31 -9.540 -2.758 10.543 1.00 3.21 H new ATOM 0 HB3 ASP A 31 -8.520 -1.347 10.346 1.00 3.21 H new ATOM 443 N GLY A 32 -8.677 0.213 7.885 1.00 2.49 N ATOM 444 CA GLY A 32 -8.258 1.558 7.522 1.00 2.45 C ATOM 445 C GLY A 32 -8.820 1.975 6.166 1.00 1.91 C ATOM 446 O GLY A 32 -10.019 1.875 5.900 1.00 1.95 O ATOM 0 H GLY A 32 -7.987 -0.508 7.677 1.00 2.49 H new ATOM 0 HA2 GLY A 32 -8.590 2.261 8.286 1.00 2.45 H new ATOM 0 HA3 GLY A 32 -7.169 1.606 7.496 1.00 2.45 H new ATOM 450 N VAL A 33 -7.974 2.514 5.288 1.00 2.00 N ATOM 451 CA VAL A 33 -8.413 2.724 3.921 1.00 1.67 C ATOM 452 C VAL A 33 -8.529 1.341 3.283 1.00 1.53 C ATOM 453 O VAL A 33 -7.533 0.683 3.007 1.00 2.62 O ATOM 454 CB VAL A 33 -7.496 3.717 3.185 1.00 2.14 C ATOM 455 CG1 VAL A 33 -6.039 3.273 3.022 1.00 2.75 C ATOM 456 CG2 VAL A 33 -8.100 4.054 1.819 1.00 2.80 C ATOM 0 H VAL A 33 -7.017 2.802 5.493 1.00 2.00 H new ATOM 0 HA VAL A 33 -9.390 3.205 3.866 1.00 1.67 H new ATOM 0 HB VAL A 33 -7.448 4.597 3.826 1.00 2.14 H new ATOM 0 HG11 VAL A 33 -5.481 4.044 2.491 1.00 2.75 H new ATOM 0 HG12 VAL A 33 -5.595 3.115 4.005 1.00 2.75 H new ATOM 0 HG13 VAL A 33 -6.003 2.343 2.454 1.00 2.75 H new ATOM 0 HG21 VAL A 33 -7.451 4.757 1.298 1.00 2.80 H new ATOM 0 HG22 VAL A 33 -8.196 3.143 1.229 1.00 2.80 H new ATOM 0 HG23 VAL A 33 -9.084 4.502 1.957 1.00 2.80 H new ATOM 466 N CYS A 34 -9.762 0.858 3.130 1.00 1.42 N ATOM 467 CA CYS A 34 -10.028 -0.459 2.573 1.00 1.79 C ATOM 468 C CYS A 34 -11.387 -0.487 1.889 1.00 1.72 C ATOM 469 O CYS A 34 -11.484 -0.997 0.778 1.00 1.59 O ATOM 470 CB CYS A 34 -9.931 -1.531 3.666 1.00 2.46 C ATOM 471 SG CYS A 34 -8.393 -2.465 3.429 1.00 3.19 S ATOM 0 H CYS A 34 -10.603 1.373 3.391 1.00 1.42 H new ATOM 0 HA CYS A 34 -9.273 -0.679 1.819 1.00 1.79 H new ATOM 0 HB2 CYS A 34 -9.943 -1.067 4.652 1.00 2.46 H new ATOM 0 HB3 CYS A 34 -10.791 -2.199 3.617 1.00 2.46 H new ATOM 0 HG CYS A 34 -7.418 -1.640 3.187 1.00 3.19 H new ATOM 477 N ARG A 35 -12.433 0.069 2.516 1.00 1.96 N ATOM 478 CA ARG A 35 -13.791 0.070 1.958 1.00 2.10 C ATOM 479 C ARG A 35 -13.819 0.440 0.475 1.00 1.67 C ATOM 480 O ARG A 35 -14.514 -0.213 -0.293 1.00 1.50 O ATOM 481 CB ARG A 35 -14.732 0.983 2.767 1.00 2.71 C ATOM 482 CG ARG A 35 -15.810 0.172 3.495 1.00 2.76 C ATOM 483 CD ARG A 35 -15.240 -0.537 4.731 1.00 2.65 C ATOM 484 NE ARG A 35 -16.125 -1.609 5.216 1.00 3.41 N ATOM 485 CZ ARG A 35 -17.330 -1.457 5.785 1.00 3.90 C ATOM 486 NH1 ARG A 35 -18.037 -2.532 6.138 1.00 4.97 N ATOM 487 NH2 ARG A 35 -17.832 -0.241 5.996 1.00 3.90 N ATOM 0 H ARG A 35 -12.361 0.530 3.423 1.00 1.96 H new ATOM 0 HA ARG A 35 -14.154 -0.955 2.038 1.00 2.10 H new ATOM 0 HB2 ARG A 35 -14.152 1.554 3.492 1.00 2.71 H new ATOM 0 HB3 ARG A 35 -15.205 1.703 2.099 1.00 2.71 H new ATOM 0 HG2 ARG A 35 -16.623 0.833 3.796 1.00 2.76 H new ATOM 0 HG3 ARG A 35 -16.234 -0.566 2.814 1.00 2.76 H new ATOM 0 HD2 ARG A 35 -14.263 -0.956 4.489 1.00 2.65 H new ATOM 0 HD3 ARG A 35 -15.086 0.192 5.527 1.00 2.65 H new ATOM 0 HE ARG A 35 -15.787 -2.565 5.108 1.00 3.41 H new ATOM 0 HH11 ARG A 35 -17.661 -3.466 5.975 1.00 4.97 H new ATOM 0 HH12 ARG A 35 -18.954 -2.420 6.571 1.00 4.97 H new ATOM 0 HH21 ARG A 35 -17.299 0.585 5.724 1.00 3.90 H new ATOM 0 HH22 ARG A 35 -18.749 -0.136 6.429 1.00 3.90 H new ATOM 501 N ALA A 36 -13.078 1.471 0.070 1.00 1.58 N ATOM 502 CA ALA A 36 -13.011 1.893 -1.323 1.00 1.39 C ATOM 503 C ALA A 36 -12.601 0.743 -2.242 1.00 0.96 C ATOM 504 O ALA A 36 -13.266 0.465 -3.237 1.00 0.98 O ATOM 505 CB ALA A 36 -12.020 3.045 -1.447 1.00 1.47 C ATOM 0 H ALA A 36 -12.508 2.035 0.701 1.00 1.58 H new ATOM 0 HA ALA A 36 -14.004 2.219 -1.634 1.00 1.39 H new ATOM 0 HB1 ALA A 36 -11.964 3.367 -2.487 1.00 1.47 H new ATOM 0 HB2 ALA A 36 -12.351 3.878 -0.827 1.00 1.47 H new ATOM 0 HB3 ALA A 36 -11.035 2.715 -1.116 1.00 1.47 H new ATOM 511 N VAL A 37 -11.504 0.067 -1.909 1.00 0.73 N ATOM 512 CA VAL A 37 -11.014 -1.077 -2.662 1.00 0.53 C ATOM 513 C VAL A 37 -12.060 -2.197 -2.629 1.00 0.58 C ATOM 514 O VAL A 37 -12.319 -2.832 -3.647 1.00 0.60 O ATOM 515 CB VAL A 37 -9.635 -1.477 -2.107 1.00 0.78 C ATOM 516 CG1 VAL A 37 -9.133 -2.796 -2.685 1.00 1.23 C ATOM 517 CG2 VAL A 37 -8.608 -0.390 -2.444 1.00 0.74 C ATOM 0 H VAL A 37 -10.928 0.303 -1.101 1.00 0.73 H new ATOM 0 HA VAL A 37 -10.869 -0.838 -3.716 1.00 0.53 H new ATOM 0 HB VAL A 37 -9.751 -1.594 -1.030 1.00 0.78 H new ATOM 0 HG11 VAL A 37 -8.157 -3.031 -2.260 1.00 1.23 H new ATOM 0 HG12 VAL A 37 -9.837 -3.592 -2.440 1.00 1.23 H new ATOM 0 HG13 VAL A 37 -9.046 -2.709 -3.768 1.00 1.23 H new ATOM 0 HG21 VAL A 37 -7.633 -0.676 -2.050 1.00 0.74 H new ATOM 0 HG22 VAL A 37 -8.542 -0.274 -3.526 1.00 0.74 H new ATOM 0 HG23 VAL A 37 -8.918 0.554 -1.996 1.00 0.74 H new ATOM 527 N ALA A 38 -12.724 -2.418 -1.492 1.00 0.93 N ATOM 528 CA ALA A 38 -13.813 -3.380 -1.393 1.00 1.26 C ATOM 529 C ALA A 38 -15.044 -2.959 -2.209 1.00 1.38 C ATOM 530 O ALA A 38 -15.904 -3.783 -2.496 1.00 1.84 O ATOM 531 CB ALA A 38 -14.182 -3.591 0.078 1.00 1.67 C ATOM 0 H ALA A 38 -12.519 -1.934 -0.618 1.00 0.93 H new ATOM 0 HA ALA A 38 -13.465 -4.321 -1.820 1.00 1.26 H new ATOM 0 HB1 ALA A 38 -14.997 -4.311 0.149 1.00 1.67 H new ATOM 0 HB2 ALA A 38 -13.315 -3.969 0.620 1.00 1.67 H new ATOM 0 HB3 ALA A 38 -14.497 -2.643 0.514 1.00 1.67 H new ATOM 537 N ARG A 39 -15.149 -1.690 -2.606 1.00 1.51 N ATOM 538 CA ARG A 39 -16.237 -1.189 -3.439 1.00 1.78 C ATOM 539 C ARG A 39 -15.860 -1.163 -4.917 1.00 1.93 C ATOM 540 O ARG A 39 -16.618 -0.627 -5.723 1.00 2.96 O ATOM 541 CB ARG A 39 -16.634 0.211 -2.950 1.00 1.85 C ATOM 542 CG ARG A 39 -17.854 0.108 -2.035 1.00 2.13 C ATOM 543 CD ARG A 39 -18.216 1.486 -1.473 1.00 2.72 C ATOM 544 NE ARG A 39 -19.666 1.609 -1.251 1.00 2.57 N ATOM 545 CZ ARG A 39 -20.269 2.604 -0.589 1.00 2.77 C ATOM 546 NH1 ARG A 39 -21.601 2.664 -0.550 1.00 2.87 N ATOM 547 NH2 ARG A 39 -19.542 3.537 0.027 1.00 3.48 N ATOM 0 H ARG A 39 -14.469 -0.973 -2.353 1.00 1.51 H new ATOM 0 HA ARG A 39 -17.086 -1.866 -3.347 1.00 1.78 H new ATOM 0 HB2 ARG A 39 -15.803 0.669 -2.414 1.00 1.85 H new ATOM 0 HB3 ARG A 39 -16.858 0.854 -3.801 1.00 1.85 H new ATOM 0 HG2 ARG A 39 -18.699 -0.299 -2.590 1.00 2.13 H new ATOM 0 HG3 ARG A 39 -17.646 -0.582 -1.217 1.00 2.13 H new ATOM 0 HD2 ARG A 39 -17.687 1.648 -0.534 1.00 2.72 H new ATOM 0 HD3 ARG A 39 -17.885 2.261 -2.164 1.00 2.72 H new ATOM 0 HE ARG A 39 -20.261 0.874 -1.634 1.00 2.57 H new ATOM 0 HH11 ARG A 39 -22.158 1.953 -1.024 1.00 2.87 H new ATOM 0 HH12 ARG A 39 -22.063 3.421 -0.046 1.00 2.87 H new ATOM 0 HH21 ARG A 39 -18.523 3.494 -0.005 1.00 3.48 H new ATOM 0 HH22 ARG A 39 -20.005 4.294 0.531 1.00 3.48 H new ATOM 561 N LYS A 40 -14.723 -1.745 -5.303 1.00 1.12 N ATOM 562 CA LYS A 40 -14.302 -1.734 -6.697 1.00 1.37 C ATOM 563 C LYS A 40 -13.834 -3.115 -7.121 1.00 1.16 C ATOM 564 O LYS A 40 -14.283 -3.631 -8.139 1.00 1.20 O ATOM 565 CB LYS A 40 -13.237 -0.646 -6.894 1.00 1.60 C ATOM 566 CG LYS A 40 -13.421 0.092 -8.221 1.00 2.14 C ATOM 567 CD LYS A 40 -14.644 1.021 -8.164 1.00 2.14 C ATOM 568 CE LYS A 40 -14.736 1.880 -9.424 1.00 3.17 C ATOM 569 NZ LYS A 40 -13.641 2.874 -9.484 1.00 4.30 N ATOM 0 H LYS A 40 -14.083 -2.226 -4.671 1.00 1.12 H new ATOM 0 HA LYS A 40 -15.143 -1.488 -7.346 1.00 1.37 H new ATOM 0 HB2 LYS A 40 -13.288 0.067 -6.071 1.00 1.60 H new ATOM 0 HB3 LYS A 40 -12.245 -1.098 -6.863 1.00 1.60 H new ATOM 0 HG2 LYS A 40 -12.527 0.674 -8.446 1.00 2.14 H new ATOM 0 HG3 LYS A 40 -13.544 -0.629 -9.029 1.00 2.14 H new ATOM 0 HD2 LYS A 40 -15.552 0.427 -8.057 1.00 2.14 H new ATOM 0 HD3 LYS A 40 -14.577 1.663 -7.286 1.00 2.14 H new ATOM 0 HE2 LYS A 40 -14.697 1.240 -10.306 1.00 3.17 H new ATOM 0 HE3 LYS A 40 -15.697 2.394 -9.446 1.00 3.17 H new ATOM 0 HZ1 LYS A 40 -14.042 3.833 -9.474 1.00 4.30 H new ATOM 0 HZ2 LYS A 40 -13.016 2.752 -8.662 1.00 4.30 H new ATOM 0 HZ3 LYS A 40 -13.095 2.736 -10.358 1.00 4.30 H new ATOM 583 N TRP A 41 -12.967 -3.734 -6.323 1.00 1.09 N ATOM 584 CA TRP A 41 -12.445 -5.061 -6.610 1.00 0.91 C ATOM 585 C TRP A 41 -12.413 -5.925 -5.342 1.00 0.89 C ATOM 586 O TRP A 41 -11.369 -6.481 -5.008 1.00 0.86 O ATOM 587 CB TRP A 41 -11.052 -4.912 -7.235 1.00 1.12 C ATOM 588 CG TRP A 41 -10.909 -3.834 -8.265 1.00 1.20 C ATOM 589 CD1 TRP A 41 -11.404 -3.838 -9.523 1.00 1.62 C ATOM 590 CD2 TRP A 41 -10.279 -2.534 -8.092 1.00 1.14 C ATOM 591 NE1 TRP A 41 -11.114 -2.637 -10.138 1.00 1.75 N ATOM 592 CE2 TRP A 41 -10.440 -1.783 -9.290 1.00 1.44 C ATOM 593 CE3 TRP A 41 -9.623 -1.906 -7.016 1.00 1.23 C ATOM 594 CZ2 TRP A 41 -9.974 -0.468 -9.415 1.00 1.59 C ATOM 595 CZ3 TRP A 41 -9.151 -0.588 -7.127 1.00 1.46 C ATOM 596 CH2 TRP A 41 -9.331 0.133 -8.321 1.00 1.54 C ATOM 0 H TRP A 41 -12.608 -3.326 -5.459 1.00 1.09 H new ATOM 0 HA TRP A 41 -13.099 -5.573 -7.316 1.00 0.91 H new ATOM 0 HB2 TRP A 41 -10.335 -4.722 -6.436 1.00 1.12 H new ATOM 0 HB3 TRP A 41 -10.776 -5.863 -7.691 1.00 1.12 H new ATOM 0 HD1 TRP A 41 -11.944 -4.656 -9.977 1.00 1.62 H new ATOM 0 HE1 TRP A 41 -11.367 -2.409 -11.100 1.00 1.75 H new ATOM 0 HE3 TRP A 41 -9.481 -2.446 -6.092 1.00 1.23 H new ATOM 0 HZ2 TRP A 41 -10.107 0.075 -10.339 1.00 1.59 H new ATOM 0 HZ3 TRP A 41 -8.647 -0.126 -6.291 1.00 1.46 H new ATOM 0 HH2 TRP A 41 -8.974 1.150 -8.396 1.00 1.54 H new ATOM 607 N PRO A 42 -13.544 -6.106 -4.643 1.00 1.19 N ATOM 608 CA PRO A 42 -13.596 -6.901 -3.422 1.00 1.41 C ATOM 609 C PRO A 42 -13.156 -8.337 -3.678 1.00 1.23 C ATOM 610 O PRO A 42 -12.386 -8.913 -2.913 1.00 1.27 O ATOM 611 CB PRO A 42 -15.042 -6.834 -2.927 1.00 1.81 C ATOM 612 CG PRO A 42 -15.844 -6.424 -4.164 1.00 1.86 C ATOM 613 CD PRO A 42 -14.858 -5.592 -4.982 1.00 1.53 C ATOM 0 HA PRO A 42 -12.911 -6.511 -2.669 1.00 1.41 H new ATOM 0 HB2 PRO A 42 -15.375 -7.796 -2.538 1.00 1.81 H new ATOM 0 HB3 PRO A 42 -15.154 -6.108 -2.121 1.00 1.81 H new ATOM 0 HG2 PRO A 42 -16.191 -7.294 -4.721 1.00 1.86 H new ATOM 0 HG3 PRO A 42 -16.727 -5.845 -3.894 1.00 1.86 H new ATOM 0 HD2 PRO A 42 -15.054 -5.689 -6.050 1.00 1.53 H new ATOM 0 HD3 PRO A 42 -14.940 -4.533 -4.737 1.00 1.53 H new ATOM 621 N GLN A 43 -13.657 -8.932 -4.762 1.00 1.20 N ATOM 622 CA GLN A 43 -13.367 -10.321 -5.067 1.00 1.29 C ATOM 623 C GLN A 43 -11.878 -10.541 -5.345 1.00 0.94 C ATOM 624 O GLN A 43 -11.394 -11.662 -5.216 1.00 0.98 O ATOM 625 CB GLN A 43 -14.245 -10.798 -6.228 1.00 1.75 C ATOM 626 CG GLN A 43 -14.173 -12.326 -6.365 1.00 1.58 C ATOM 627 CD GLN A 43 -15.214 -12.864 -7.337 1.00 2.20 C ATOM 628 OE1 GLN A 43 -16.397 -12.572 -7.210 1.00 3.40 O ATOM 629 NE2 GLN A 43 -14.805 -13.683 -8.298 1.00 2.14 N ATOM 0 H GLN A 43 -14.264 -8.469 -5.438 1.00 1.20 H new ATOM 0 HA GLN A 43 -13.607 -10.924 -4.191 1.00 1.29 H new ATOM 0 HB2 GLN A 43 -15.277 -10.490 -6.061 1.00 1.75 H new ATOM 0 HB3 GLN A 43 -13.918 -10.328 -7.156 1.00 1.75 H new ATOM 0 HG2 GLN A 43 -13.178 -12.612 -6.705 1.00 1.58 H new ATOM 0 HG3 GLN A 43 -14.320 -12.784 -5.387 1.00 1.58 H new ATOM 0 HE21 GLN A 43 -13.815 -13.913 -8.385 1.00 2.14 H new ATOM 0 HE22 GLN A 43 -15.481 -14.083 -8.949 1.00 2.14 H new ATOM 638 N ALA A 44 -11.135 -9.492 -5.704 1.00 0.78 N ATOM 639 CA ALA A 44 -9.726 -9.627 -6.020 1.00 0.95 C ATOM 640 C ALA A 44 -8.974 -10.264 -4.851 1.00 1.10 C ATOM 641 O ALA A 44 -8.172 -11.172 -5.048 1.00 1.68 O ATOM 642 CB ALA A 44 -9.167 -8.253 -6.387 1.00 0.90 C ATOM 0 H ALA A 44 -11.494 -8.540 -5.781 1.00 0.78 H new ATOM 0 HA ALA A 44 -9.595 -10.290 -6.875 1.00 0.95 H new ATOM 0 HB1 ALA A 44 -8.107 -8.343 -6.626 1.00 0.90 H new ATOM 0 HB2 ALA A 44 -9.702 -7.862 -7.252 1.00 0.90 H new ATOM 0 HB3 ALA A 44 -9.292 -7.573 -5.545 1.00 0.90 H new ATOM 648 N PHE A 45 -9.256 -9.825 -3.622 1.00 1.01 N ATOM 649 CA PHE A 45 -8.575 -10.320 -2.432 1.00 1.55 C ATOM 650 C PHE A 45 -9.497 -11.223 -1.621 1.00 0.91 C ATOM 651 O PHE A 45 -9.409 -11.241 -0.395 1.00 1.03 O ATOM 652 CB PHE A 45 -8.065 -9.141 -1.591 1.00 2.64 C ATOM 653 CG PHE A 45 -9.115 -8.105 -1.238 1.00 1.42 C ATOM 654 CD1 PHE A 45 -9.455 -7.116 -2.177 1.00 0.99 C ATOM 655 CD2 PHE A 45 -9.780 -8.148 0.002 1.00 1.54 C ATOM 656 CE1 PHE A 45 -10.469 -6.192 -1.892 1.00 1.72 C ATOM 657 CE2 PHE A 45 -10.777 -7.202 0.300 1.00 2.19 C ATOM 658 CZ PHE A 45 -11.122 -6.223 -0.648 1.00 2.53 C ATOM 0 H PHE A 45 -9.964 -9.116 -3.428 1.00 1.01 H new ATOM 0 HA PHE A 45 -7.716 -10.918 -2.738 1.00 1.55 H new ATOM 0 HB2 PHE A 45 -7.636 -9.531 -0.668 1.00 2.64 H new ATOM 0 HB3 PHE A 45 -7.258 -8.649 -2.134 1.00 2.64 H new ATOM 0 HD1 PHE A 45 -8.933 -7.068 -3.121 1.00 0.99 H new ATOM 0 HD2 PHE A 45 -9.524 -8.908 0.725 1.00 1.54 H new ATOM 0 HE1 PHE A 45 -10.749 -5.455 -2.630 1.00 1.72 H new ATOM 0 HE2 PHE A 45 -11.277 -7.228 1.257 1.00 2.19 H new ATOM 0 HZ PHE A 45 -11.888 -5.496 -0.421 1.00 2.53 H new ATOM 668 N ARG A 46 -10.385 -11.975 -2.277 1.00 0.73 N ATOM 669 CA ARG A 46 -11.422 -12.731 -1.590 1.00 1.22 C ATOM 670 C ARG A 46 -10.791 -13.803 -0.706 1.00 1.62 C ATOM 671 O ARG A 46 -10.505 -14.902 -1.172 1.00 1.98 O ATOM 672 CB ARG A 46 -12.392 -13.349 -2.611 1.00 1.45 C ATOM 673 CG ARG A 46 -13.723 -13.731 -1.959 1.00 2.14 C ATOM 674 CD ARG A 46 -14.601 -12.481 -1.812 1.00 3.63 C ATOM 675 NE ARG A 46 -15.705 -12.694 -0.868 1.00 4.62 N ATOM 676 CZ ARG A 46 -16.849 -13.341 -1.123 1.00 4.96 C ATOM 677 NH1 ARG A 46 -17.767 -13.461 -0.164 1.00 5.96 N ATOM 678 NH2 ARG A 46 -17.073 -13.866 -2.329 1.00 4.82 N ATOM 0 H ARG A 46 -10.401 -12.073 -3.292 1.00 0.73 H new ATOM 0 HA ARG A 46 -11.992 -12.058 -0.950 1.00 1.22 H new ATOM 0 HB2 ARG A 46 -12.572 -12.640 -3.419 1.00 1.45 H new ATOM 0 HB3 ARG A 46 -11.937 -14.233 -3.058 1.00 1.45 H new ATOM 0 HG2 ARG A 46 -14.235 -14.478 -2.565 1.00 2.14 H new ATOM 0 HG3 ARG A 46 -13.545 -14.180 -0.982 1.00 2.14 H new ATOM 0 HD2 ARG A 46 -13.989 -11.646 -1.472 1.00 3.63 H new ATOM 0 HD3 ARG A 46 -15.005 -12.205 -2.786 1.00 3.63 H new ATOM 0 HE ARG A 46 -15.590 -12.313 0.071 1.00 4.62 H new ATOM 0 HH11 ARG A 46 -17.596 -13.061 0.759 1.00 5.96 H new ATOM 0 HH12 ARG A 46 -18.640 -13.953 -0.353 1.00 5.96 H new ATOM 0 HH21 ARG A 46 -16.371 -13.776 -3.063 1.00 4.82 H new ATOM 0 HH22 ARG A 46 -17.947 -14.358 -2.517 1.00 4.82 H new ATOM 692 N ASN A 47 -10.610 -13.498 0.579 1.00 2.50 N ATOM 693 CA ASN A 47 -9.901 -14.343 1.526 1.00 3.04 C ATOM 694 C ASN A 47 -8.490 -14.649 1.026 1.00 2.64 C ATOM 695 O ASN A 47 -8.034 -15.785 1.104 1.00 3.45 O ATOM 696 CB ASN A 47 -10.681 -15.632 1.827 1.00 4.28 C ATOM 697 CG ASN A 47 -12.162 -15.397 2.088 1.00 5.29 C ATOM 698 OD1 ASN A 47 -12.539 -14.721 3.040 1.00 5.76 O ATOM 699 ND2 ASN A 47 -13.031 -15.944 1.249 1.00 6.05 N ATOM 0 H ASN A 47 -10.962 -12.636 0.995 1.00 2.50 H new ATOM 0 HA ASN A 47 -9.815 -13.794 2.464 1.00 3.04 H new ATOM 0 HB2 ASN A 47 -10.572 -16.318 0.987 1.00 4.28 H new ATOM 0 HB3 ASN A 47 -10.240 -16.120 2.696 1.00 4.28 H new ATOM 0 HD21 ASN A 47 -14.032 -15.806 1.389 1.00 6.05 H new ATOM 0 HD22 ASN A 47 -12.699 -16.503 0.463 1.00 6.05 H new ATOM 706 N ALA A 48 -7.796 -13.632 0.514 1.00 1.66 N ATOM 707 CA ALA A 48 -6.464 -13.797 -0.048 1.00 1.96 C ATOM 708 C ALA A 48 -5.456 -13.964 1.084 1.00 1.98 C ATOM 709 O ALA A 48 -4.886 -15.035 1.266 1.00 3.72 O ATOM 710 CB ALA A 48 -6.133 -12.591 -0.931 1.00 1.83 C ATOM 0 H ALA A 48 -8.145 -12.674 0.479 1.00 1.66 H new ATOM 0 HA ALA A 48 -6.421 -14.691 -0.671 1.00 1.96 H new ATOM 0 HB1 ALA A 48 -5.135 -12.712 -1.353 1.00 1.83 H new ATOM 0 HB2 ALA A 48 -6.862 -12.520 -1.738 1.00 1.83 H new ATOM 0 HB3 ALA A 48 -6.165 -11.681 -0.331 1.00 1.83 H new ATOM 716 N ALA A 49 -5.266 -12.876 1.835 1.00 1.00 N ATOM 717 CA ALA A 49 -4.316 -12.719 2.920 1.00 1.01 C ATOM 718 C ALA A 49 -2.865 -12.879 2.448 1.00 0.98 C ATOM 719 O ALA A 49 -2.559 -13.515 1.438 1.00 1.06 O ATOM 720 CB ALA A 49 -4.719 -13.632 4.081 1.00 1.29 C ATOM 0 H ALA A 49 -5.813 -12.028 1.684 1.00 1.00 H new ATOM 0 HA ALA A 49 -4.351 -11.696 3.296 1.00 1.01 H new ATOM 0 HB1 ALA A 49 -4.007 -13.517 4.898 1.00 1.29 H new ATOM 0 HB2 ALA A 49 -5.716 -13.361 4.427 1.00 1.29 H new ATOM 0 HB3 ALA A 49 -4.721 -14.669 3.745 1.00 1.29 H new ATOM 726 N THR A 50 -1.936 -12.240 3.152 1.00 0.91 N ATOM 727 CA THR A 50 -0.525 -12.412 2.859 1.00 0.80 C ATOM 728 C THR A 50 0.246 -12.021 4.121 1.00 0.72 C ATOM 729 O THR A 50 -0.257 -11.198 4.889 1.00 0.75 O ATOM 730 CB THR A 50 -0.144 -11.597 1.606 1.00 0.80 C ATOM 731 OG1 THR A 50 0.893 -12.230 0.881 1.00 1.06 O ATOM 732 CG2 THR A 50 0.236 -10.142 1.869 1.00 1.06 C ATOM 0 H THR A 50 -2.137 -11.604 3.923 1.00 0.91 H new ATOM 0 HA THR A 50 -0.272 -13.444 2.614 1.00 0.80 H new ATOM 0 HB THR A 50 -1.061 -11.569 1.017 1.00 0.80 H new ATOM 0 HG1 THR A 50 1.747 -11.794 1.084 1.00 1.06 H new ATOM 0 HG21 THR A 50 0.487 -9.655 0.926 1.00 1.06 H new ATOM 0 HG22 THR A 50 -0.604 -9.625 2.332 1.00 1.06 H new ATOM 0 HG23 THR A 50 1.097 -10.106 2.536 1.00 1.06 H new ATOM 740 N PRO A 51 1.423 -12.608 4.371 1.00 0.68 N ATOM 741 CA PRO A 51 2.182 -12.339 5.578 1.00 0.66 C ATOM 742 C PRO A 51 2.777 -10.932 5.551 1.00 0.52 C ATOM 743 O PRO A 51 2.797 -10.257 4.521 1.00 0.54 O ATOM 744 CB PRO A 51 3.273 -13.413 5.619 1.00 0.75 C ATOM 745 CG PRO A 51 3.487 -13.747 4.146 1.00 0.74 C ATOM 746 CD PRO A 51 2.082 -13.618 3.563 1.00 0.74 C ATOM 0 HA PRO A 51 1.555 -12.376 6.469 1.00 0.66 H new ATOM 0 HB2 PRO A 51 4.186 -13.042 6.085 1.00 0.75 H new ATOM 0 HB3 PRO A 51 2.957 -14.287 6.188 1.00 0.75 H new ATOM 0 HG2 PRO A 51 4.186 -13.058 3.672 1.00 0.74 H new ATOM 0 HG3 PRO A 51 3.890 -14.751 4.013 1.00 0.74 H new ATOM 0 HD2 PRO A 51 2.117 -13.322 2.515 1.00 0.74 H new ATOM 0 HD3 PRO A 51 1.549 -14.568 3.608 1.00 0.74 H new ATOM 754 N VAL A 52 3.293 -10.508 6.701 1.00 0.41 N ATOM 755 CA VAL A 52 3.993 -9.246 6.846 1.00 0.35 C ATOM 756 C VAL A 52 5.180 -9.191 5.886 1.00 0.29 C ATOM 757 O VAL A 52 5.804 -10.209 5.599 1.00 0.35 O ATOM 758 CB VAL A 52 4.438 -9.110 8.313 1.00 0.45 C ATOM 759 CG1 VAL A 52 5.389 -7.937 8.534 1.00 0.95 C ATOM 760 CG2 VAL A 52 3.218 -8.929 9.227 1.00 0.70 C ATOM 0 H VAL A 52 3.233 -11.043 7.568 1.00 0.41 H new ATOM 0 HA VAL A 52 3.339 -8.411 6.594 1.00 0.35 H new ATOM 0 HB VAL A 52 4.969 -10.030 8.558 1.00 0.45 H new ATOM 0 HG11 VAL A 52 5.670 -7.889 9.586 1.00 0.95 H new ATOM 0 HG12 VAL A 52 6.283 -8.074 7.926 1.00 0.95 H new ATOM 0 HG13 VAL A 52 4.894 -7.009 8.248 1.00 0.95 H new ATOM 0 HG21 VAL A 52 3.549 -8.834 10.261 1.00 0.70 H new ATOM 0 HG22 VAL A 52 2.675 -8.030 8.936 1.00 0.70 H new ATOM 0 HG23 VAL A 52 2.562 -9.795 9.134 1.00 0.70 H new ATOM 770 N GLY A 53 5.498 -7.989 5.398 1.00 0.28 N ATOM 771 CA GLY A 53 6.702 -7.752 4.628 1.00 0.28 C ATOM 772 C GLY A 53 6.596 -8.316 3.219 1.00 0.32 C ATOM 773 O GLY A 53 7.617 -8.558 2.582 1.00 0.40 O ATOM 0 H GLY A 53 4.921 -7.158 5.531 1.00 0.28 H new ATOM 0 HA2 GLY A 53 6.895 -6.680 4.576 1.00 0.28 H new ATOM 0 HA3 GLY A 53 7.553 -8.205 5.137 1.00 0.28 H new ATOM 777 N THR A 54 5.376 -8.503 2.708 1.00 0.32 N ATOM 778 CA THR A 54 5.191 -8.986 1.346 1.00 0.39 C ATOM 779 C THR A 54 4.114 -8.165 0.643 1.00 0.28 C ATOM 780 O THR A 54 3.488 -7.291 1.250 1.00 0.26 O ATOM 781 CB THR A 54 4.898 -10.499 1.321 1.00 0.57 C ATOM 782 OG1 THR A 54 3.619 -10.812 1.841 1.00 0.80 O ATOM 783 CG2 THR A 54 5.959 -11.290 2.090 1.00 0.65 C ATOM 0 H THR A 54 4.510 -8.327 3.217 1.00 0.32 H new ATOM 0 HA THR A 54 6.120 -8.851 0.793 1.00 0.39 H new ATOM 0 HB THR A 54 4.922 -10.788 0.270 1.00 0.57 H new ATOM 0 HG1 THR A 54 3.569 -10.530 2.778 1.00 0.80 H new ATOM 0 HG21 THR A 54 5.720 -12.353 2.051 1.00 0.65 H new ATOM 0 HG22 THR A 54 6.937 -11.121 1.639 1.00 0.65 H new ATOM 0 HG23 THR A 54 5.977 -10.960 3.129 1.00 0.65 H new ATOM 791 N ALA A 55 3.915 -8.455 -0.645 1.00 0.25 N ATOM 792 CA ALA A 55 2.913 -7.837 -1.486 1.00 0.25 C ATOM 793 C ALA A 55 2.233 -8.968 -2.251 1.00 0.32 C ATOM 794 O ALA A 55 2.905 -9.701 -2.971 1.00 0.65 O ATOM 795 CB ALA A 55 3.587 -6.833 -2.431 1.00 0.31 C ATOM 0 H ALA A 55 4.472 -9.152 -1.139 1.00 0.25 H new ATOM 0 HA ALA A 55 2.174 -7.282 -0.908 1.00 0.25 H new ATOM 0 HB1 ALA A 55 2.833 -6.367 -3.065 1.00 0.31 H new ATOM 0 HB2 ALA A 55 4.093 -6.066 -1.845 1.00 0.31 H new ATOM 0 HB3 ALA A 55 4.315 -7.352 -3.055 1.00 0.31 H new ATOM 801 N LYS A 56 0.922 -9.150 -2.076 1.00 0.35 N ATOM 802 CA LYS A 56 0.176 -10.163 -2.812 1.00 0.39 C ATOM 803 C LYS A 56 -0.548 -9.483 -3.956 1.00 0.32 C ATOM 804 O LYS A 56 -1.465 -8.699 -3.723 1.00 0.36 O ATOM 805 CB LYS A 56 -0.793 -10.909 -1.884 1.00 0.51 C ATOM 806 CG LYS A 56 -1.875 -11.672 -2.666 1.00 0.87 C ATOM 807 CD LYS A 56 -2.371 -12.941 -1.970 1.00 1.10 C ATOM 808 CE LYS A 56 -1.310 -14.047 -1.972 1.00 1.26 C ATOM 809 NZ LYS A 56 -0.678 -14.225 -0.646 1.00 2.53 N ATOM 0 H LYS A 56 0.356 -8.604 -1.426 1.00 0.35 H new ATOM 0 HA LYS A 56 0.857 -10.913 -3.216 1.00 0.39 H new ATOM 0 HB2 LYS A 56 -0.233 -11.609 -1.264 1.00 0.51 H new ATOM 0 HB3 LYS A 56 -1.269 -10.197 -1.210 1.00 0.51 H new ATOM 0 HG2 LYS A 56 -2.723 -11.008 -2.834 1.00 0.87 H new ATOM 0 HG3 LYS A 56 -1.480 -11.939 -3.646 1.00 0.87 H new ATOM 0 HD2 LYS A 56 -2.649 -12.706 -0.942 1.00 1.10 H new ATOM 0 HD3 LYS A 56 -3.271 -13.301 -2.469 1.00 1.10 H new ATOM 0 HE2 LYS A 56 -1.769 -14.986 -2.282 1.00 1.26 H new ATOM 0 HE3 LYS A 56 -0.542 -13.809 -2.708 1.00 1.26 H new ATOM 0 HZ1 LYS A 56 -0.237 -15.165 -0.595 1.00 2.53 H new ATOM 0 HZ2 LYS A 56 0.048 -13.494 -0.507 1.00 2.53 H new ATOM 0 HZ3 LYS A 56 -1.401 -14.141 0.097 1.00 2.53 H new ATOM 823 N THR A 57 -0.150 -9.791 -5.181 1.00 0.39 N ATOM 824 CA THR A 57 -0.849 -9.343 -6.366 1.00 0.39 C ATOM 825 C THR A 57 -2.002 -10.294 -6.654 1.00 0.37 C ATOM 826 O THR A 57 -1.827 -11.509 -6.583 1.00 0.45 O ATOM 827 CB THR A 57 0.144 -9.340 -7.522 1.00 0.56 C ATOM 828 OG1 THR A 57 1.281 -8.632 -7.099 1.00 0.83 O ATOM 829 CG2 THR A 57 -0.429 -8.659 -8.759 1.00 0.71 C ATOM 0 H THR A 57 0.672 -10.362 -5.377 1.00 0.39 H new ATOM 0 HA THR A 57 -1.254 -8.341 -6.228 1.00 0.39 H new ATOM 0 HB THR A 57 0.381 -10.369 -7.791 1.00 0.56 H new ATOM 0 HG1 THR A 57 2.086 -9.067 -7.449 1.00 0.83 H new ATOM 0 HG21 THR A 57 0.310 -8.678 -9.560 1.00 0.71 H new ATOM 0 HG22 THR A 57 -1.327 -9.186 -9.081 1.00 0.71 H new ATOM 0 HG23 THR A 57 -0.680 -7.625 -8.522 1.00 0.71 H new ATOM 837 N VAL A 58 -3.165 -9.755 -7.008 1.00 0.41 N ATOM 838 CA VAL A 58 -4.306 -10.517 -7.477 1.00 0.43 C ATOM 839 C VAL A 58 -4.946 -9.729 -8.624 1.00 0.50 C ATOM 840 O VAL A 58 -4.721 -8.527 -8.767 1.00 1.27 O ATOM 841 CB VAL A 58 -5.274 -10.792 -6.310 1.00 0.53 C ATOM 842 CG1 VAL A 58 -4.666 -11.774 -5.306 1.00 2.36 C ATOM 843 CG2 VAL A 58 -5.641 -9.516 -5.544 1.00 2.40 C ATOM 0 H VAL A 58 -3.339 -8.751 -6.974 1.00 0.41 H new ATOM 0 HA VAL A 58 -4.011 -11.496 -7.854 1.00 0.43 H new ATOM 0 HB VAL A 58 -6.171 -11.213 -6.765 1.00 0.53 H new ATOM 0 HG11 VAL A 58 -5.372 -11.948 -4.494 1.00 2.36 H new ATOM 0 HG12 VAL A 58 -4.448 -12.718 -5.806 1.00 2.36 H new ATOM 0 HG13 VAL A 58 -3.744 -11.357 -4.901 1.00 2.36 H new ATOM 0 HG21 VAL A 58 -6.325 -9.763 -4.732 1.00 2.40 H new ATOM 0 HG22 VAL A 58 -4.737 -9.066 -5.133 1.00 2.40 H new ATOM 0 HG23 VAL A 58 -6.122 -8.811 -6.222 1.00 2.40 H new ATOM 853 N LYS A 59 -5.720 -10.399 -9.477 1.00 0.59 N ATOM 854 CA LYS A 59 -6.354 -9.777 -10.630 1.00 0.56 C ATOM 855 C LYS A 59 -7.849 -9.845 -10.396 1.00 0.62 C ATOM 856 O LYS A 59 -8.344 -10.911 -10.046 1.00 0.82 O ATOM 857 CB LYS A 59 -5.971 -10.543 -11.901 1.00 0.73 C ATOM 858 CG LYS A 59 -4.468 -10.414 -12.175 1.00 1.03 C ATOM 859 CD LYS A 59 -4.180 -9.592 -13.427 1.00 2.06 C ATOM 860 CE LYS A 59 -4.542 -10.342 -14.710 1.00 1.66 C ATOM 861 NZ LYS A 59 -4.491 -9.450 -15.890 1.00 3.51 N ATOM 0 H LYS A 59 -5.924 -11.394 -9.384 1.00 0.59 H new ATOM 0 HA LYS A 59 -6.033 -8.743 -10.755 1.00 0.56 H new ATOM 0 HB2 LYS A 59 -6.238 -11.594 -11.793 1.00 0.73 H new ATOM 0 HB3 LYS A 59 -6.536 -10.156 -12.749 1.00 0.73 H new ATOM 0 HG2 LYS A 59 -3.982 -9.949 -11.317 1.00 1.03 H new ATOM 0 HG3 LYS A 59 -4.034 -11.408 -12.287 1.00 1.03 H new ATOM 0 HD2 LYS A 59 -4.742 -8.659 -13.383 1.00 2.06 H new ATOM 0 HD3 LYS A 59 -3.123 -9.327 -13.450 1.00 2.06 H new ATOM 0 HE2 LYS A 59 -3.854 -11.176 -14.852 1.00 1.66 H new ATOM 0 HE3 LYS A 59 -5.542 -10.766 -14.616 1.00 1.66 H new ATOM 0 HZ1 LYS A 59 -4.420 -10.023 -16.755 1.00 3.51 H new ATOM 0 HZ2 LYS A 59 -5.356 -8.873 -15.927 1.00 3.51 H new ATOM 0 HZ3 LYS A 59 -3.662 -8.827 -15.818 1.00 3.51 H new ATOM 875 N CYS A 60 -8.562 -8.728 -10.557 1.00 0.54 N ATOM 876 CA CYS A 60 -10.015 -8.803 -10.447 1.00 0.62 C ATOM 877 C CYS A 60 -10.569 -9.271 -11.788 1.00 0.71 C ATOM 878 O CYS A 60 -11.267 -10.274 -11.873 1.00 1.64 O ATOM 879 CB CYS A 60 -10.602 -7.447 -10.041 1.00 0.82 C ATOM 880 SG CYS A 60 -12.214 -7.742 -9.256 1.00 1.14 S ATOM 0 H CYS A 60 -8.178 -7.804 -10.755 1.00 0.54 H new ATOM 0 HA CYS A 60 -10.296 -9.513 -9.669 1.00 0.62 H new ATOM 0 HB2 CYS A 60 -9.932 -6.933 -9.352 1.00 0.82 H new ATOM 0 HB3 CYS A 60 -10.716 -6.805 -10.914 1.00 0.82 H new ATOM 0 HG CYS A 60 -12.916 -6.648 -9.282 1.00 1.14 H new ATOM 886 N ASP A 61 -10.202 -8.533 -12.834 1.00 0.67 N ATOM 887 CA ASP A 61 -10.520 -8.819 -14.222 1.00 0.74 C ATOM 888 C ASP A 61 -9.249 -8.476 -14.990 1.00 0.74 C ATOM 889 O ASP A 61 -8.418 -9.338 -15.268 1.00 0.95 O ATOM 890 CB ASP A 61 -11.731 -7.980 -14.683 1.00 0.87 C ATOM 891 CG ASP A 61 -13.011 -8.808 -14.735 1.00 1.39 C ATOM 892 OD1 ASP A 61 -13.001 -9.808 -15.487 1.00 2.56 O ATOM 893 OD2 ASP A 61 -13.981 -8.410 -14.053 1.00 1.67 O ATOM 0 H ASP A 61 -9.650 -7.682 -12.727 1.00 0.67 H new ATOM 0 HA ASP A 61 -10.809 -9.857 -14.387 1.00 0.74 H new ATOM 0 HB2 ASP A 61 -11.870 -7.139 -14.003 1.00 0.87 H new ATOM 0 HB3 ASP A 61 -11.529 -7.562 -15.669 1.00 0.87 H new ATOM 898 N GLU A 62 -9.036 -7.182 -15.236 1.00 0.65 N ATOM 899 CA GLU A 62 -7.936 -6.718 -16.069 1.00 0.69 C ATOM 900 C GLU A 62 -6.933 -5.859 -15.295 1.00 0.82 C ATOM 901 O GLU A 62 -5.852 -5.591 -15.810 1.00 1.64 O ATOM 902 CB GLU A 62 -8.495 -6.019 -17.318 1.00 0.82 C ATOM 903 CG GLU A 62 -9.331 -4.774 -16.995 1.00 2.61 C ATOM 904 CD GLU A 62 -9.902 -4.147 -18.268 1.00 2.81 C ATOM 905 OE1 GLU A 62 -11.147 -4.109 -18.379 1.00 3.92 O ATOM 906 OE2 GLU A 62 -9.086 -3.715 -19.111 1.00 2.90 O ATOM 0 H GLU A 62 -9.620 -6.433 -14.864 1.00 0.65 H new ATOM 0 HA GLU A 62 -7.360 -7.583 -16.398 1.00 0.69 H new ATOM 0 HB2 GLU A 62 -7.667 -5.734 -17.967 1.00 0.82 H new ATOM 0 HB3 GLU A 62 -9.109 -6.725 -17.877 1.00 0.82 H new ATOM 0 HG2 GLU A 62 -10.145 -5.044 -16.322 1.00 2.61 H new ATOM 0 HG3 GLU A 62 -8.714 -4.044 -16.472 1.00 2.61 H new ATOM 913 N THR A 63 -7.241 -5.475 -14.051 1.00 0.52 N ATOM 914 CA THR A 63 -6.336 -4.668 -13.241 1.00 0.45 C ATOM 915 C THR A 63 -5.463 -5.574 -12.385 1.00 0.37 C ATOM 916 O THR A 63 -5.837 -6.713 -12.092 1.00 0.50 O ATOM 917 CB THR A 63 -7.112 -3.644 -12.396 1.00 0.54 C ATOM 918 OG1 THR A 63 -6.228 -2.759 -11.737 1.00 0.83 O ATOM 919 CG2 THR A 63 -7.979 -4.307 -11.317 1.00 0.68 C ATOM 0 H THR A 63 -8.117 -5.714 -13.586 1.00 0.52 H new ATOM 0 HA THR A 63 -5.683 -4.096 -13.900 1.00 0.45 H new ATOM 0 HB THR A 63 -7.752 -3.109 -13.098 1.00 0.54 H new ATOM 0 HG1 THR A 63 -5.435 -2.614 -12.294 1.00 0.83 H new ATOM 0 HG21 THR A 63 -8.505 -3.539 -10.750 1.00 0.68 H new ATOM 0 HG22 THR A 63 -8.704 -4.970 -11.789 1.00 0.68 H new ATOM 0 HG23 THR A 63 -7.345 -4.884 -10.644 1.00 0.68 H new ATOM 927 N TYR A 64 -4.312 -5.049 -11.963 1.00 0.33 N ATOM 928 CA TYR A 64 -3.315 -5.789 -11.223 1.00 0.36 C ATOM 929 C TYR A 64 -3.243 -5.175 -9.832 1.00 0.40 C ATOM 930 O TYR A 64 -2.431 -4.293 -9.572 1.00 0.65 O ATOM 931 CB TYR A 64 -1.970 -5.694 -11.950 1.00 0.50 C ATOM 932 CG TYR A 64 -1.993 -6.036 -13.426 1.00 0.45 C ATOM 933 CD1 TYR A 64 -1.586 -7.306 -13.863 1.00 0.74 C ATOM 934 CD2 TYR A 64 -2.378 -5.065 -14.369 1.00 0.63 C ATOM 935 CE1 TYR A 64 -1.606 -7.632 -15.230 1.00 0.84 C ATOM 936 CE2 TYR A 64 -2.415 -5.381 -15.737 1.00 0.81 C ATOM 937 CZ TYR A 64 -2.041 -6.673 -16.171 1.00 0.79 C ATOM 938 OH TYR A 64 -2.108 -7.018 -17.486 1.00 1.04 O ATOM 0 H TYR A 64 -4.051 -4.078 -12.134 1.00 0.33 H new ATOM 0 HA TYR A 64 -3.570 -6.846 -11.144 1.00 0.36 H new ATOM 0 HB2 TYR A 64 -1.588 -4.679 -11.837 1.00 0.50 H new ATOM 0 HB3 TYR A 64 -1.262 -6.358 -11.453 1.00 0.50 H new ATOM 0 HD1 TYR A 64 -1.255 -8.039 -13.143 1.00 0.74 H new ATOM 0 HD2 TYR A 64 -2.646 -4.072 -14.039 1.00 0.63 H new ATOM 0 HE1 TYR A 64 -1.290 -8.611 -15.559 1.00 0.84 H new ATOM 0 HE2 TYR A 64 -2.729 -4.638 -16.456 1.00 0.81 H new ATOM 0 HH TYR A 64 -2.426 -6.253 -18.009 1.00 1.04 H new ATOM 948 N ILE A 65 -4.133 -5.578 -8.936 1.00 0.29 N ATOM 949 CA ILE A 65 -4.189 -4.957 -7.626 1.00 0.28 C ATOM 950 C ILE A 65 -3.203 -5.682 -6.709 1.00 0.27 C ATOM 951 O ILE A 65 -2.956 -6.871 -6.871 1.00 0.42 O ATOM 952 CB ILE A 65 -5.641 -4.907 -7.128 1.00 0.31 C ATOM 953 CG1 ILE A 65 -5.638 -4.574 -5.635 1.00 0.42 C ATOM 954 CG2 ILE A 65 -6.401 -6.208 -7.401 1.00 0.33 C ATOM 955 CD1 ILE A 65 -6.994 -4.093 -5.145 1.00 0.65 C ATOM 0 H ILE A 65 -4.815 -6.321 -9.091 1.00 0.29 H new ATOM 0 HA ILE A 65 -3.875 -3.914 -7.651 1.00 0.28 H new ATOM 0 HB ILE A 65 -6.168 -4.130 -7.682 1.00 0.31 H new ATOM 0 HG12 ILE A 65 -5.343 -5.458 -5.069 1.00 0.42 H new ATOM 0 HG13 ILE A 65 -4.890 -3.806 -5.439 1.00 0.42 H new ATOM 0 HG21 ILE A 65 -7.422 -6.118 -7.029 1.00 0.33 H new ATOM 0 HG22 ILE A 65 -6.421 -6.399 -8.474 1.00 0.33 H new ATOM 0 HG23 ILE A 65 -5.902 -7.034 -6.895 1.00 0.33 H new ATOM 0 HD11 ILE A 65 -6.938 -3.870 -4.079 1.00 0.65 H new ATOM 0 HD12 ILE A 65 -7.279 -3.193 -5.689 1.00 0.65 H new ATOM 0 HD13 ILE A 65 -7.739 -4.871 -5.314 1.00 0.65 H new ATOM 967 N ILE A 66 -2.575 -4.958 -5.787 1.00 0.23 N ATOM 968 CA ILE A 66 -1.497 -5.448 -4.947 1.00 0.25 C ATOM 969 C ILE A 66 -1.892 -5.156 -3.498 1.00 0.29 C ATOM 970 O ILE A 66 -2.461 -4.106 -3.216 1.00 0.48 O ATOM 971 CB ILE A 66 -0.187 -4.761 -5.383 1.00 0.25 C ATOM 972 CG1 ILE A 66 0.199 -5.084 -6.846 1.00 0.66 C ATOM 973 CG2 ILE A 66 0.964 -5.190 -4.468 1.00 0.39 C ATOM 974 CD1 ILE A 66 1.098 -4.008 -7.468 1.00 0.78 C ATOM 0 H ILE A 66 -2.813 -3.984 -5.601 1.00 0.23 H new ATOM 0 HA ILE A 66 -1.330 -6.521 -5.041 1.00 0.25 H new ATOM 0 HB ILE A 66 -0.361 -3.688 -5.308 1.00 0.25 H new ATOM 0 HG12 ILE A 66 0.712 -6.045 -6.879 1.00 0.66 H new ATOM 0 HG13 ILE A 66 -0.707 -5.186 -7.443 1.00 0.66 H new ATOM 0 HG21 ILE A 66 1.884 -4.699 -4.785 1.00 0.39 H new ATOM 0 HG22 ILE A 66 0.737 -4.906 -3.440 1.00 0.39 H new ATOM 0 HG23 ILE A 66 1.091 -6.271 -4.526 1.00 0.39 H new ATOM 0 HD11 ILE A 66 1.339 -4.284 -8.495 1.00 0.78 H new ATOM 0 HD12 ILE A 66 0.577 -3.051 -7.462 1.00 0.78 H new ATOM 0 HD13 ILE A 66 2.018 -3.924 -6.890 1.00 0.78 H new ATOM 986 N HIS A 67 -1.597 -6.057 -2.563 1.00 0.32 N ATOM 987 CA HIS A 67 -1.939 -5.921 -1.159 1.00 0.34 C ATOM 988 C HIS A 67 -0.650 -5.963 -0.353 1.00 0.35 C ATOM 989 O HIS A 67 -0.060 -7.032 -0.215 1.00 0.44 O ATOM 990 CB HIS A 67 -2.898 -7.058 -0.795 1.00 0.39 C ATOM 991 CG HIS A 67 -4.168 -6.969 -1.594 1.00 0.96 C ATOM 992 ND1 HIS A 67 -5.190 -6.073 -1.382 1.00 2.30 N ATOM 993 CD2 HIS A 67 -4.442 -7.654 -2.746 1.00 2.23 C ATOM 994 CE1 HIS A 67 -6.060 -6.212 -2.397 1.00 2.61 C ATOM 995 NE2 HIS A 67 -5.652 -7.166 -3.244 1.00 2.62 N ATOM 0 H HIS A 67 -1.100 -6.923 -2.772 1.00 0.32 H new ATOM 0 HA HIS A 67 -2.438 -4.977 -0.941 1.00 0.34 H new ATOM 0 HB2 HIS A 67 -2.415 -8.018 -0.978 1.00 0.39 H new ATOM 0 HB3 HIS A 67 -3.130 -7.016 0.269 1.00 0.39 H new ATOM 0 HD1 HIS A 67 -5.272 -5.424 -0.600 1.00 2.30 H new ATOM 0 HD2 HIS A 67 -3.834 -8.429 -3.189 1.00 2.23 H new ATOM 0 HE1 HIS A 67 -6.964 -5.633 -2.514 1.00 2.61 H new ATOM 1003 N ALA A 68 -0.193 -4.813 0.146 1.00 0.33 N ATOM 1004 CA ALA A 68 1.059 -4.728 0.891 1.00 0.34 C ATOM 1005 C ALA A 68 0.764 -4.825 2.380 1.00 0.36 C ATOM 1006 O ALA A 68 -0.234 -4.258 2.816 1.00 0.42 O ATOM 1007 CB ALA A 68 1.718 -3.382 0.589 1.00 0.37 C ATOM 0 H ALA A 68 -0.678 -3.922 0.045 1.00 0.33 H new ATOM 0 HA ALA A 68 1.724 -5.541 0.601 1.00 0.34 H new ATOM 0 HB1 ALA A 68 2.656 -3.304 1.139 1.00 0.37 H new ATOM 0 HB2 ALA A 68 1.917 -3.306 -0.480 1.00 0.37 H new ATOM 0 HB3 ALA A 68 1.051 -2.574 0.892 1.00 0.37 H new ATOM 1013 N VAL A 69 1.624 -5.485 3.166 1.00 0.51 N ATOM 1014 CA VAL A 69 1.367 -5.673 4.595 1.00 0.57 C ATOM 1015 C VAL A 69 2.538 -5.174 5.426 1.00 0.53 C ATOM 1016 O VAL A 69 3.677 -5.583 5.210 1.00 0.42 O ATOM 1017 CB VAL A 69 1.086 -7.147 4.898 1.00 0.58 C ATOM 1018 CG1 VAL A 69 0.870 -7.377 6.398 1.00 0.95 C ATOM 1019 CG2 VAL A 69 -0.180 -7.596 4.175 1.00 0.84 C ATOM 0 H VAL A 69 2.498 -5.895 2.837 1.00 0.51 H new ATOM 0 HA VAL A 69 0.487 -5.088 4.862 1.00 0.57 H new ATOM 0 HB VAL A 69 1.952 -7.717 4.561 1.00 0.58 H new ATOM 0 HG11 VAL A 69 0.673 -8.434 6.579 1.00 0.95 H new ATOM 0 HG12 VAL A 69 1.764 -7.076 6.945 1.00 0.95 H new ATOM 0 HG13 VAL A 69 0.020 -6.786 6.738 1.00 0.95 H new ATOM 0 HG21 VAL A 69 -0.372 -8.646 4.396 1.00 0.84 H new ATOM 0 HG22 VAL A 69 -1.024 -6.994 4.511 1.00 0.84 H new ATOM 0 HG23 VAL A 69 -0.049 -7.470 3.100 1.00 0.84 H new ATOM 1029 N GLY A 70 2.237 -4.338 6.420 1.00 0.74 N ATOM 1030 CA GLY A 70 3.227 -3.737 7.301 1.00 0.84 C ATOM 1031 C GLY A 70 3.357 -4.531 8.602 1.00 0.84 C ATOM 1032 O GLY A 70 2.453 -5.286 8.952 1.00 0.85 O ATOM 0 H GLY A 70 1.280 -4.057 6.636 1.00 0.74 H new ATOM 0 HA2 GLY A 70 4.192 -3.698 6.796 1.00 0.84 H new ATOM 0 HA3 GLY A 70 2.943 -2.709 7.525 1.00 0.84 H new ATOM 1036 N PRO A 71 4.482 -4.383 9.312 1.00 0.84 N ATOM 1037 CA PRO A 71 4.789 -5.130 10.522 1.00 0.91 C ATOM 1038 C PRO A 71 4.189 -4.520 11.780 1.00 1.14 C ATOM 1039 O PRO A 71 3.820 -3.347 11.836 1.00 1.20 O ATOM 1040 CB PRO A 71 6.309 -5.095 10.638 1.00 0.89 C ATOM 1041 CG PRO A 71 6.671 -3.770 9.975 1.00 0.88 C ATOM 1042 CD PRO A 71 5.631 -3.619 8.872 1.00 0.83 C ATOM 0 HA PRO A 71 4.370 -6.133 10.446 1.00 0.91 H new ATOM 0 HB2 PRO A 71 6.636 -5.129 11.677 1.00 0.89 H new ATOM 0 HB3 PRO A 71 6.773 -5.941 10.130 1.00 0.89 H new ATOM 0 HG2 PRO A 71 6.626 -2.943 10.683 1.00 0.88 H new ATOM 0 HG3 PRO A 71 7.683 -3.788 9.571 1.00 0.88 H new ATOM 0 HD2 PRO A 71 5.370 -2.572 8.720 1.00 0.83 H new ATOM 0 HD3 PRO A 71 6.010 -3.994 7.922 1.00 0.83 H new ATOM 1050 N ASN A 72 4.139 -5.334 12.835 1.00 1.34 N ATOM 1051 CA ASN A 72 3.691 -4.916 14.151 1.00 1.61 C ATOM 1052 C ASN A 72 4.776 -4.066 14.802 1.00 1.33 C ATOM 1053 O ASN A 72 5.481 -4.550 15.677 1.00 1.61 O ATOM 1054 CB ASN A 72 3.422 -6.144 15.038 1.00 2.38 C ATOM 1055 CG ASN A 72 2.478 -7.154 14.414 1.00 2.24 C ATOM 1056 OD1 ASN A 72 2.857 -7.865 13.491 1.00 3.06 O ATOM 1057 ND2 ASN A 72 1.250 -7.247 14.903 1.00 2.33 N ATOM 0 H ASN A 72 4.414 -6.315 12.792 1.00 1.34 H new ATOM 0 HA ASN A 72 2.771 -4.341 14.045 1.00 1.61 H new ATOM 0 HB2 ASN A 72 4.370 -6.635 15.260 1.00 2.38 H new ATOM 0 HB3 ASN A 72 3.006 -5.810 15.988 1.00 2.38 H new ATOM 0 HD21 ASN A 72 0.595 -7.923 14.510 1.00 2.33 H new ATOM 0 HD22 ASN A 72 0.960 -6.643 15.672 1.00 2.33 H new ATOM 1064 N PHE A 73 4.912 -2.792 14.441 1.00 1.05 N ATOM 1065 CA PHE A 73 5.894 -1.912 15.079 1.00 1.14 C ATOM 1066 C PHE A 73 5.644 -1.781 16.593 1.00 1.41 C ATOM 1067 O PHE A 73 6.529 -1.384 17.339 1.00 1.77 O ATOM 1068 CB PHE A 73 5.919 -0.547 14.376 1.00 1.24 C ATOM 1069 CG PHE A 73 7.289 -0.112 13.897 1.00 1.92 C ATOM 1070 CD1 PHE A 73 8.177 0.516 14.790 1.00 1.59 C ATOM 1071 CD2 PHE A 73 7.653 -0.273 12.546 1.00 3.59 C ATOM 1072 CE1 PHE A 73 9.416 0.996 14.332 1.00 2.38 C ATOM 1073 CE2 PHE A 73 8.886 0.225 12.087 1.00 4.41 C ATOM 1074 CZ PHE A 73 9.771 0.850 12.981 1.00 3.66 C ATOM 0 H PHE A 73 4.357 -2.345 13.712 1.00 1.05 H new ATOM 0 HA PHE A 73 6.880 -2.363 14.971 1.00 1.14 H new ATOM 0 HB2 PHE A 73 5.243 -0.580 13.522 1.00 1.24 H new ATOM 0 HB3 PHE A 73 5.531 0.207 15.061 1.00 1.24 H new ATOM 0 HD1 PHE A 73 7.906 0.629 15.829 1.00 1.59 H new ATOM 0 HD2 PHE A 73 6.986 -0.778 11.863 1.00 3.59 H new ATOM 0 HE1 PHE A 73 10.096 1.478 15.019 1.00 2.38 H new ATOM 0 HE2 PHE A 73 9.153 0.127 11.045 1.00 4.41 H new ATOM 0 HZ PHE A 73 10.724 1.218 12.630 1.00 3.66 H new ATOM 1084 N ASN A 74 4.429 -2.101 17.052 1.00 1.42 N ATOM 1085 CA ASN A 74 4.015 -2.048 18.452 1.00 1.67 C ATOM 1086 C ASN A 74 4.424 -3.311 19.200 1.00 1.87 C ATOM 1087 O ASN A 74 4.427 -3.326 20.426 1.00 2.21 O ATOM 1088 CB ASN A 74 2.486 -1.920 18.540 1.00 1.65 C ATOM 1089 CG ASN A 74 1.788 -3.178 18.027 1.00 2.45 C ATOM 1090 OD1 ASN A 74 2.043 -3.615 16.909 1.00 3.96 O ATOM 1091 ND2 ASN A 74 0.926 -3.788 18.828 1.00 2.79 N ATOM 0 H ASN A 74 3.682 -2.415 16.433 1.00 1.42 H new ATOM 0 HA ASN A 74 4.504 -1.185 18.905 1.00 1.67 H new ATOM 0 HB2 ASN A 74 2.194 -1.737 19.574 1.00 1.65 H new ATOM 0 HB3 ASN A 74 2.158 -1.058 17.959 1.00 1.65 H new ATOM 0 HD21 ASN A 74 0.458 -4.640 18.519 1.00 2.79 H new ATOM 0 HD22 ASN A 74 0.731 -3.405 19.753 1.00 2.79 H new ATOM 1098 N ASN A 75 4.695 -4.386 18.464 1.00 1.70 N ATOM 1099 CA ASN A 75 4.981 -5.704 18.995 1.00 1.88 C ATOM 1100 C ASN A 75 6.231 -6.258 18.305 1.00 1.68 C ATOM 1101 O ASN A 75 6.413 -7.471 18.261 1.00 1.63 O ATOM 1102 CB ASN A 75 3.744 -6.594 18.778 1.00 2.00 C ATOM 1103 CG ASN A 75 3.648 -7.765 19.748 1.00 2.45 C ATOM 1104 OD1 ASN A 75 2.882 -7.718 20.702 1.00 2.44 O ATOM 1105 ND2 ASN A 75 4.375 -8.846 19.512 1.00 3.61 N ATOM 0 H ASN A 75 4.721 -4.355 17.445 1.00 1.70 H new ATOM 0 HA ASN A 75 5.187 -5.670 20.065 1.00 1.88 H new ATOM 0 HB2 ASN A 75 2.847 -5.982 18.873 1.00 2.00 H new ATOM 0 HB3 ASN A 75 3.760 -6.980 17.759 1.00 2.00 H new ATOM 0 HD21 ASN A 75 4.301 -9.655 20.129 1.00 3.61 H new ATOM 0 HD22 ASN A 75 5.009 -8.870 18.713 1.00 3.61 H new ATOM 1112 N THR A 76 7.099 -5.398 17.757 1.00 1.61 N ATOM 1113 CA THR A 76 8.363 -5.878 17.198 1.00 1.49 C ATOM 1114 C THR A 76 9.471 -4.862 17.463 1.00 1.62 C ATOM 1115 O THR A 76 9.188 -3.759 17.930 1.00 1.83 O ATOM 1116 CB THR A 76 8.176 -6.225 15.711 1.00 1.23 C ATOM 1117 OG1 THR A 76 9.119 -7.205 15.345 1.00 1.10 O ATOM 1118 CG2 THR A 76 8.334 -5.036 14.765 1.00 1.33 C ATOM 0 H THR A 76 6.953 -4.391 17.690 1.00 1.61 H new ATOM 0 HA THR A 76 8.674 -6.799 17.691 1.00 1.49 H new ATOM 0 HB THR A 76 7.150 -6.578 15.611 1.00 1.23 H new ATOM 0 HG1 THR A 76 9.004 -7.432 14.399 1.00 1.10 H new ATOM 0 HG21 THR A 76 8.187 -5.367 13.737 1.00 1.33 H new ATOM 0 HG22 THR A 76 7.594 -4.275 15.011 1.00 1.33 H new ATOM 0 HG23 THR A 76 9.334 -4.617 14.871 1.00 1.33 H new ATOM 1126 N SER A 77 10.732 -5.221 17.204 1.00 1.62 N ATOM 1127 CA SER A 77 11.834 -4.282 17.373 1.00 1.74 C ATOM 1128 C SER A 77 11.704 -3.146 16.363 1.00 1.42 C ATOM 1129 O SER A 77 11.092 -3.307 15.312 1.00 1.18 O ATOM 1130 CB SER A 77 13.162 -5.018 17.176 1.00 1.92 C ATOM 1131 OG SER A 77 14.265 -4.150 17.359 1.00 3.46 O ATOM 0 H SER A 77 11.009 -6.148 16.880 1.00 1.62 H new ATOM 0 HA SER A 77 11.805 -3.861 18.378 1.00 1.74 H new ATOM 0 HB2 SER A 77 13.228 -5.847 17.881 1.00 1.92 H new ATOM 0 HB3 SER A 77 13.197 -5.447 16.175 1.00 1.92 H new ATOM 0 HG SER A 77 15.099 -4.648 17.229 1.00 3.46 H new ATOM 1137 N GLU A 78 12.351 -2.009 16.623 1.00 1.51 N ATOM 1138 CA GLU A 78 12.430 -0.945 15.631 1.00 1.34 C ATOM 1139 C GLU A 78 13.124 -1.465 14.375 1.00 1.18 C ATOM 1140 O GLU A 78 12.718 -1.151 13.263 1.00 0.98 O ATOM 1141 CB GLU A 78 13.186 0.265 16.188 1.00 1.55 C ATOM 1142 CG GLU A 78 12.446 0.889 17.372 1.00 1.84 C ATOM 1143 CD GLU A 78 13.119 2.191 17.802 1.00 2.48 C ATOM 1144 OE1 GLU A 78 14.021 2.110 18.666 1.00 3.22 O ATOM 1145 OE2 GLU A 78 12.729 3.244 17.251 1.00 3.27 O ATOM 0 H GLU A 78 12.823 -1.806 17.504 1.00 1.51 H new ATOM 0 HA GLU A 78 11.418 -0.627 15.380 1.00 1.34 H new ATOM 0 HB2 GLU A 78 14.184 -0.041 16.501 1.00 1.55 H new ATOM 0 HB3 GLU A 78 13.312 1.010 15.402 1.00 1.55 H new ATOM 0 HG2 GLU A 78 11.409 1.083 17.098 1.00 1.84 H new ATOM 0 HG3 GLU A 78 12.430 0.189 18.207 1.00 1.84 H new ATOM 1152 N ALA A 79 14.167 -2.281 14.548 1.00 1.34 N ATOM 1153 CA ALA A 79 14.939 -2.823 13.441 1.00 1.32 C ATOM 1154 C ALA A 79 14.076 -3.721 12.564 1.00 1.15 C ATOM 1155 O ALA A 79 14.002 -3.543 11.351 1.00 1.03 O ATOM 1156 CB ALA A 79 16.097 -3.638 14.006 1.00 1.61 C ATOM 0 H ALA A 79 14.496 -2.582 15.465 1.00 1.34 H new ATOM 0 HA ALA A 79 15.309 -1.999 12.831 1.00 1.32 H new ATOM 0 HB1 ALA A 79 16.685 -4.051 13.187 1.00 1.61 H new ATOM 0 HB2 ALA A 79 16.729 -2.995 14.619 1.00 1.61 H new ATOM 0 HB3 ALA A 79 15.706 -4.451 14.617 1.00 1.61 H new ATOM 1162 N GLU A 80 13.454 -4.722 13.187 1.00 1.18 N ATOM 1163 CA GLU A 80 12.559 -5.660 12.524 1.00 1.03 C ATOM 1164 C GLU A 80 11.422 -4.888 11.870 1.00 0.93 C ATOM 1165 O GLU A 80 10.959 -5.245 10.795 1.00 0.82 O ATOM 1166 CB GLU A 80 11.999 -6.645 13.556 1.00 1.15 C ATOM 1167 CG GLU A 80 13.100 -7.540 14.135 1.00 1.46 C ATOM 1168 CD GLU A 80 12.600 -8.308 15.359 1.00 1.86 C ATOM 1169 OE1 GLU A 80 12.279 -7.625 16.361 1.00 2.86 O ATOM 1170 OE2 GLU A 80 12.585 -9.555 15.290 1.00 2.04 O ATOM 0 H GLU A 80 13.563 -4.904 14.185 1.00 1.18 H new ATOM 0 HA GLU A 80 13.103 -6.216 11.760 1.00 1.03 H new ATOM 0 HB2 GLU A 80 11.516 -6.093 14.362 1.00 1.15 H new ATOM 0 HB3 GLU A 80 11.233 -7.265 13.090 1.00 1.15 H new ATOM 0 HG2 GLU A 80 13.439 -8.243 13.374 1.00 1.46 H new ATOM 0 HG3 GLU A 80 13.960 -6.930 14.411 1.00 1.46 H new ATOM 1177 N GLY A 81 10.989 -3.811 12.520 1.00 1.00 N ATOM 1178 CA GLY A 81 9.876 -3.004 12.071 1.00 0.98 C ATOM 1179 C GLY A 81 10.229 -2.310 10.765 1.00 0.90 C ATOM 1180 O GLY A 81 9.457 -2.326 9.814 1.00 0.81 O ATOM 0 H GLY A 81 11.413 -3.476 13.385 1.00 1.00 H new ATOM 0 HA2 GLY A 81 8.995 -3.630 11.933 1.00 0.98 H new ATOM 0 HA3 GLY A 81 9.624 -2.263 12.830 1.00 0.98 H new ATOM 1184 N ASP A 82 11.388 -1.665 10.708 1.00 0.99 N ATOM 1185 CA ASP A 82 11.804 -0.933 9.520 1.00 0.96 C ATOM 1186 C ASP A 82 12.105 -1.905 8.388 1.00 0.83 C ATOM 1187 O ASP A 82 11.789 -1.630 7.235 1.00 0.79 O ATOM 1188 CB ASP A 82 13.023 -0.048 9.821 1.00 1.18 C ATOM 1189 CG ASP A 82 12.635 1.423 9.967 1.00 1.31 C ATOM 1190 OD1 ASP A 82 11.475 1.686 10.362 1.00 1.53 O ATOM 1191 OD2 ASP A 82 13.508 2.264 9.661 1.00 2.70 O ATOM 0 H ASP A 82 12.059 -1.635 11.476 1.00 0.99 H new ATOM 0 HA ASP A 82 10.988 -0.280 9.210 1.00 0.96 H new ATOM 0 HB2 ASP A 82 13.503 -0.390 10.738 1.00 1.18 H new ATOM 0 HB3 ASP A 82 13.755 -0.153 9.020 1.00 1.18 H new ATOM 1196 N ARG A 83 12.718 -3.048 8.699 1.00 0.81 N ATOM 1197 CA ARG A 83 13.043 -4.057 7.698 1.00 0.75 C ATOM 1198 C ARG A 83 11.778 -4.600 7.060 1.00 0.60 C ATOM 1199 O ARG A 83 11.665 -4.566 5.842 1.00 0.54 O ATOM 1200 CB ARG A 83 13.906 -5.161 8.323 1.00 0.86 C ATOM 1201 CG ARG A 83 15.365 -4.697 8.267 1.00 1.39 C ATOM 1202 CD ARG A 83 16.215 -5.179 9.443 1.00 2.28 C ATOM 1203 NE ARG A 83 16.322 -6.641 9.527 1.00 2.27 N ATOM 1204 CZ ARG A 83 17.124 -7.268 10.395 1.00 3.23 C ATOM 1205 NH1 ARG A 83 17.187 -8.600 10.419 1.00 3.96 N ATOM 1206 NH2 ARG A 83 17.870 -6.556 11.241 1.00 4.30 N ATOM 0 H ARG A 83 13.001 -3.297 9.647 1.00 0.81 H new ATOM 0 HA ARG A 83 13.629 -3.600 6.900 1.00 0.75 H new ATOM 0 HB2 ARG A 83 13.603 -5.347 9.353 1.00 0.86 H new ATOM 0 HB3 ARG A 83 13.781 -6.098 7.780 1.00 0.86 H new ATOM 0 HG2 ARG A 83 15.813 -5.051 7.339 1.00 1.39 H new ATOM 0 HG3 ARG A 83 15.388 -3.608 8.237 1.00 1.39 H new ATOM 0 HD2 ARG A 83 17.215 -4.754 9.357 1.00 2.28 H new ATOM 0 HD3 ARG A 83 15.786 -4.800 10.371 1.00 2.28 H new ATOM 0 HE ARG A 83 15.757 -7.206 8.893 1.00 2.27 H new ATOM 0 HH11 ARG A 83 16.621 -9.149 9.772 1.00 3.96 H new ATOM 0 HH12 ARG A 83 17.801 -9.070 11.084 1.00 3.96 H new ATOM 0 HH21 ARG A 83 17.828 -5.537 11.225 1.00 4.30 H new ATOM 0 HH22 ARG A 83 18.483 -7.031 11.904 1.00 4.30 H new ATOM 1220 N ASP A 84 10.833 -5.090 7.850 1.00 0.60 N ATOM 1221 CA ASP A 84 9.606 -5.677 7.322 1.00 0.53 C ATOM 1222 C ASP A 84 8.769 -4.620 6.609 1.00 0.50 C ATOM 1223 O ASP A 84 8.177 -4.896 5.572 1.00 0.50 O ATOM 1224 CB ASP A 84 8.787 -6.326 8.437 1.00 0.60 C ATOM 1225 CG ASP A 84 9.201 -7.763 8.751 1.00 0.75 C ATOM 1226 OD1 ASP A 84 8.513 -8.366 9.603 1.00 1.55 O ATOM 1227 OD2 ASP A 84 10.171 -8.243 8.124 1.00 1.71 O ATOM 0 H ASP A 84 10.893 -5.093 8.868 1.00 0.60 H new ATOM 0 HA ASP A 84 9.886 -6.448 6.604 1.00 0.53 H new ATOM 0 HB2 ASP A 84 8.882 -5.725 9.341 1.00 0.60 H new ATOM 0 HB3 ASP A 84 7.734 -6.315 8.155 1.00 0.60 H new ATOM 1232 N LEU A 85 8.706 -3.394 7.127 1.00 0.49 N ATOM 1233 CA LEU A 85 8.005 -2.307 6.465 1.00 0.48 C ATOM 1234 C LEU A 85 8.637 -2.034 5.101 1.00 0.41 C ATOM 1235 O LEU A 85 7.945 -1.880 4.094 1.00 0.40 O ATOM 1236 CB LEU A 85 8.058 -1.095 7.400 1.00 0.51 C ATOM 1237 CG LEU A 85 7.339 0.149 6.880 1.00 0.52 C ATOM 1238 CD1 LEU A 85 5.926 -0.188 6.400 1.00 0.58 C ATOM 1239 CD2 LEU A 85 7.247 1.147 8.037 1.00 0.59 C ATOM 0 H LEU A 85 9.139 -3.132 8.013 1.00 0.49 H new ATOM 0 HA LEU A 85 6.962 -2.556 6.271 1.00 0.48 H new ATOM 0 HB2 LEU A 85 7.622 -1.375 8.359 1.00 0.51 H new ATOM 0 HB3 LEU A 85 9.102 -0.843 7.586 1.00 0.51 H new ATOM 0 HG LEU A 85 7.892 0.561 6.036 1.00 0.52 H new ATOM 0 HD11 LEU A 85 5.440 0.717 6.036 1.00 0.58 H new ATOM 0 HD12 LEU A 85 5.980 -0.920 5.594 1.00 0.58 H new ATOM 0 HD13 LEU A 85 5.350 -0.602 7.228 1.00 0.58 H new ATOM 0 HD21 LEU A 85 6.738 2.050 7.699 1.00 0.59 H new ATOM 0 HD22 LEU A 85 6.688 0.700 8.859 1.00 0.59 H new ATOM 0 HD23 LEU A 85 8.250 1.403 8.378 1.00 0.59 H new ATOM 1251 N ALA A 86 9.968 -2.017 5.049 1.00 0.38 N ATOM 1252 CA ALA A 86 10.702 -1.824 3.816 1.00 0.33 C ATOM 1253 C ALA A 86 10.517 -3.031 2.904 1.00 0.34 C ATOM 1254 O ALA A 86 10.569 -2.877 1.693 1.00 0.40 O ATOM 1255 CB ALA A 86 12.184 -1.580 4.112 1.00 0.31 C ATOM 0 H ALA A 86 10.563 -2.138 5.869 1.00 0.38 H new ATOM 0 HA ALA A 86 10.312 -0.945 3.303 1.00 0.33 H new ATOM 0 HB1 ALA A 86 12.723 -1.437 3.176 1.00 0.31 H new ATOM 0 HB2 ALA A 86 12.289 -0.689 4.732 1.00 0.31 H new ATOM 0 HB3 ALA A 86 12.596 -2.440 4.640 1.00 0.31 H new ATOM 1261 N ALA A 87 10.301 -4.223 3.460 1.00 0.32 N ATOM 1262 CA ALA A 87 10.074 -5.443 2.707 1.00 0.32 C ATOM 1263 C ALA A 87 8.726 -5.366 2.010 1.00 0.28 C ATOM 1264 O ALA A 87 8.619 -5.733 0.847 1.00 0.30 O ATOM 1265 CB ALA A 87 10.127 -6.651 3.641 1.00 0.36 C ATOM 0 H ALA A 87 10.280 -4.364 4.470 1.00 0.32 H new ATOM 0 HA ALA A 87 10.854 -5.556 1.954 1.00 0.32 H new ATOM 0 HB1 ALA A 87 9.956 -7.562 3.068 1.00 0.36 H new ATOM 0 HB2 ALA A 87 11.106 -6.700 4.117 1.00 0.36 H new ATOM 0 HB3 ALA A 87 9.357 -6.554 4.406 1.00 0.36 H new ATOM 1271 N ALA A 88 7.703 -4.861 2.703 1.00 0.26 N ATOM 1272 CA ALA A 88 6.379 -4.660 2.147 1.00 0.23 C ATOM 1273 C ALA A 88 6.495 -3.759 0.925 1.00 0.23 C ATOM 1274 O ALA A 88 6.082 -4.120 -0.174 1.00 0.22 O ATOM 1275 CB ALA A 88 5.466 -4.047 3.214 1.00 0.25 C ATOM 0 H ALA A 88 7.781 -4.579 3.680 1.00 0.26 H new ATOM 0 HA ALA A 88 5.941 -5.609 1.838 1.00 0.23 H new ATOM 0 HB1 ALA A 88 4.470 -3.895 2.797 1.00 0.25 H new ATOM 0 HB2 ALA A 88 5.403 -4.720 4.069 1.00 0.25 H new ATOM 0 HB3 ALA A 88 5.874 -3.089 3.536 1.00 0.25 H new ATOM 1281 N TYR A 89 7.090 -2.581 1.102 1.00 0.27 N ATOM 1282 CA TYR A 89 7.228 -1.630 0.017 1.00 0.28 C ATOM 1283 C TYR A 89 8.082 -2.174 -1.128 1.00 0.26 C ATOM 1284 O TYR A 89 7.734 -2.008 -2.292 1.00 0.28 O ATOM 1285 CB TYR A 89 7.823 -0.346 0.575 1.00 0.34 C ATOM 1286 CG TYR A 89 6.954 0.366 1.597 1.00 0.47 C ATOM 1287 CD1 TYR A 89 5.569 0.535 1.391 1.00 0.69 C ATOM 1288 CD2 TYR A 89 7.551 0.899 2.749 1.00 0.54 C ATOM 1289 CE1 TYR A 89 4.799 1.273 2.306 1.00 0.95 C ATOM 1290 CE2 TYR A 89 6.792 1.642 3.666 1.00 0.75 C ATOM 1291 CZ TYR A 89 5.415 1.834 3.446 1.00 0.96 C ATOM 1292 OH TYR A 89 4.697 2.562 4.341 1.00 1.29 O ATOM 0 H TYR A 89 7.482 -2.268 1.990 1.00 0.27 H new ATOM 0 HA TYR A 89 6.242 -1.436 -0.406 1.00 0.28 H new ATOM 0 HB2 TYR A 89 8.784 -0.577 1.034 1.00 0.34 H new ATOM 0 HB3 TYR A 89 8.020 0.336 -0.252 1.00 0.34 H new ATOM 0 HD1 TYR A 89 5.097 0.095 0.525 1.00 0.69 H new ATOM 0 HD2 TYR A 89 8.603 0.736 2.932 1.00 0.54 H new ATOM 0 HE1 TYR A 89 3.741 1.410 2.138 1.00 0.95 H new ATOM 0 HE2 TYR A 89 7.264 2.066 4.540 1.00 0.75 H new ATOM 0 HH TYR A 89 3.956 3.009 3.880 1.00 1.29 H new ATOM 1302 N ARG A 90 9.207 -2.816 -0.821 1.00 0.27 N ATOM 1303 CA ARG A 90 10.102 -3.389 -1.821 1.00 0.28 C ATOM 1304 C ARG A 90 9.371 -4.462 -2.614 1.00 0.26 C ATOM 1305 O ARG A 90 9.584 -4.593 -3.813 1.00 0.28 O ATOM 1306 CB ARG A 90 11.336 -3.975 -1.125 1.00 0.31 C ATOM 1307 CG ARG A 90 12.484 -4.309 -2.085 1.00 0.40 C ATOM 1308 CD ARG A 90 13.377 -3.080 -2.319 1.00 1.77 C ATOM 1309 NE ARG A 90 14.717 -3.465 -2.789 1.00 2.01 N ATOM 1310 CZ ARG A 90 15.667 -4.027 -2.027 1.00 2.01 C ATOM 1311 NH1 ARG A 90 16.848 -4.350 -2.555 1.00 2.57 N ATOM 1312 NH2 ARG A 90 15.436 -4.271 -0.735 1.00 2.08 N ATOM 0 H ARG A 90 9.525 -2.954 0.138 1.00 0.27 H new ATOM 0 HA ARG A 90 10.425 -2.611 -2.513 1.00 0.28 H new ATOM 0 HB2 ARG A 90 11.693 -3.265 -0.379 1.00 0.31 H new ATOM 0 HB3 ARG A 90 11.046 -4.880 -0.591 1.00 0.31 H new ATOM 0 HG2 ARG A 90 13.080 -5.124 -1.676 1.00 0.40 H new ATOM 0 HG3 ARG A 90 12.079 -4.656 -3.036 1.00 0.40 H new ATOM 0 HD2 ARG A 90 12.908 -2.424 -3.052 1.00 1.77 H new ATOM 0 HD3 ARG A 90 13.465 -2.512 -1.393 1.00 1.77 H new ATOM 0 HE ARG A 90 14.941 -3.291 -3.769 1.00 2.01 H new ATOM 0 HH11 ARG A 90 17.032 -4.170 -3.542 1.00 2.57 H new ATOM 0 HH12 ARG A 90 17.568 -4.777 -1.972 1.00 2.57 H new ATOM 0 HH21 ARG A 90 14.534 -4.030 -0.324 1.00 2.08 H new ATOM 0 HH22 ARG A 90 16.161 -4.699 -0.159 1.00 2.08 H new ATOM 1326 N ALA A 91 8.522 -5.242 -1.946 1.00 0.26 N ATOM 1327 CA ALA A 91 7.729 -6.270 -2.582 1.00 0.26 C ATOM 1328 C ALA A 91 6.786 -5.609 -3.577 1.00 0.28 C ATOM 1329 O ALA A 91 6.742 -6.028 -4.725 1.00 0.37 O ATOM 1330 CB ALA A 91 6.984 -7.105 -1.535 1.00 0.25 C ATOM 0 H ALA A 91 8.371 -5.170 -0.940 1.00 0.26 H new ATOM 0 HA ALA A 91 8.372 -6.963 -3.124 1.00 0.26 H new ATOM 0 HB1 ALA A 91 6.393 -7.873 -2.035 1.00 0.25 H new ATOM 0 HB2 ALA A 91 7.704 -7.578 -0.868 1.00 0.25 H new ATOM 0 HB3 ALA A 91 6.324 -6.459 -0.957 1.00 0.25 H new ATOM 1336 N VAL A 92 6.069 -4.555 -3.172 1.00 0.26 N ATOM 1337 CA VAL A 92 5.177 -3.834 -4.073 1.00 0.28 C ATOM 1338 C VAL A 92 5.953 -3.405 -5.309 1.00 0.28 C ATOM 1339 O VAL A 92 5.566 -3.741 -6.423 1.00 0.30 O ATOM 1340 CB VAL A 92 4.551 -2.621 -3.372 1.00 0.33 C ATOM 1341 CG1 VAL A 92 3.749 -1.772 -4.357 1.00 0.61 C ATOM 1342 CG2 VAL A 92 3.603 -3.055 -2.258 1.00 0.58 C ATOM 0 H VAL A 92 6.093 -4.185 -2.222 1.00 0.26 H new ATOM 0 HA VAL A 92 4.363 -4.494 -4.372 1.00 0.28 H new ATOM 0 HB VAL A 92 5.375 -2.041 -2.957 1.00 0.33 H new ATOM 0 HG11 VAL A 92 3.316 -0.919 -3.834 1.00 0.61 H new ATOM 0 HG12 VAL A 92 4.407 -1.416 -5.150 1.00 0.61 H new ATOM 0 HG13 VAL A 92 2.951 -2.374 -4.791 1.00 0.61 H new ATOM 0 HG21 VAL A 92 3.175 -2.174 -1.780 1.00 0.58 H new ATOM 0 HG22 VAL A 92 2.803 -3.664 -2.678 1.00 0.58 H new ATOM 0 HG23 VAL A 92 4.153 -3.638 -1.519 1.00 0.58 H new ATOM 1352 N ALA A 93 7.052 -2.676 -5.104 1.00 0.30 N ATOM 1353 CA ALA A 93 7.921 -2.202 -6.160 1.00 0.30 C ATOM 1354 C ALA A 93 8.297 -3.336 -7.119 1.00 0.29 C ATOM 1355 O ALA A 93 8.235 -3.166 -8.336 1.00 0.32 O ATOM 1356 CB ALA A 93 9.160 -1.571 -5.531 1.00 0.31 C ATOM 0 H ALA A 93 7.362 -2.397 -4.173 1.00 0.30 H new ATOM 0 HA ALA A 93 7.397 -1.451 -6.752 1.00 0.30 H new ATOM 0 HB1 ALA A 93 9.823 -1.210 -6.317 1.00 0.31 H new ATOM 0 HB2 ALA A 93 8.861 -0.737 -4.896 1.00 0.31 H new ATOM 0 HB3 ALA A 93 9.682 -2.315 -4.930 1.00 0.31 H new ATOM 1362 N ALA A 94 8.661 -4.505 -6.590 1.00 0.31 N ATOM 1363 CA ALA A 94 8.961 -5.647 -7.430 1.00 0.33 C ATOM 1364 C ALA A 94 7.762 -5.951 -8.318 1.00 0.34 C ATOM 1365 O ALA A 94 7.922 -5.991 -9.534 1.00 0.36 O ATOM 1366 CB ALA A 94 9.355 -6.867 -6.602 1.00 0.36 C ATOM 0 H ALA A 94 8.753 -4.678 -5.589 1.00 0.31 H new ATOM 0 HA ALA A 94 9.818 -5.402 -8.057 1.00 0.33 H new ATOM 0 HB1 ALA A 94 9.572 -7.703 -7.267 1.00 0.36 H new ATOM 0 HB2 ALA A 94 10.240 -6.634 -6.010 1.00 0.36 H new ATOM 0 HB3 ALA A 94 8.534 -7.136 -5.937 1.00 0.36 H new ATOM 1372 N GLU A 95 6.571 -6.126 -7.735 1.00 0.35 N ATOM 1373 CA GLU A 95 5.356 -6.426 -8.480 1.00 0.37 C ATOM 1374 C GLU A 95 5.115 -5.434 -9.616 1.00 0.37 C ATOM 1375 O GLU A 95 4.582 -5.824 -10.644 1.00 0.38 O ATOM 1376 CB GLU A 95 4.133 -6.532 -7.553 1.00 0.37 C ATOM 1377 CG GLU A 95 4.296 -7.637 -6.500 1.00 0.83 C ATOM 1378 CD GLU A 95 4.692 -8.968 -7.137 1.00 1.05 C ATOM 1379 OE1 GLU A 95 3.839 -9.552 -7.843 1.00 1.82 O ATOM 1380 OE2 GLU A 95 5.865 -9.370 -6.967 1.00 1.82 O ATOM 0 H GLU A 95 6.428 -6.062 -6.727 1.00 0.35 H new ATOM 0 HA GLU A 95 5.503 -7.403 -8.940 1.00 0.37 H new ATOM 0 HB2 GLU A 95 3.975 -5.577 -7.053 1.00 0.37 H new ATOM 0 HB3 GLU A 95 3.243 -6.730 -8.150 1.00 0.37 H new ATOM 0 HG2 GLU A 95 5.054 -7.340 -5.775 1.00 0.83 H new ATOM 0 HG3 GLU A 95 3.362 -7.759 -5.952 1.00 0.83 H new ATOM 1387 N ILE A 96 5.527 -4.174 -9.500 1.00 0.38 N ATOM 1388 CA ILE A 96 5.346 -3.195 -10.562 1.00 0.37 C ATOM 1389 C ILE A 96 6.086 -3.651 -11.817 1.00 0.37 C ATOM 1390 O ILE A 96 5.519 -3.725 -12.908 1.00 0.40 O ATOM 1391 CB ILE A 96 5.875 -1.837 -10.091 1.00 0.38 C ATOM 1392 CG1 ILE A 96 5.384 -1.471 -8.691 1.00 0.47 C ATOM 1393 CG2 ILE A 96 5.506 -0.725 -11.056 1.00 0.40 C ATOM 1394 CD1 ILE A 96 3.913 -1.744 -8.392 1.00 1.93 C ATOM 0 H ILE A 96 5.993 -3.807 -8.670 1.00 0.38 H new ATOM 0 HA ILE A 96 4.287 -3.101 -10.801 1.00 0.37 H new ATOM 0 HB ILE A 96 6.960 -1.939 -10.059 1.00 0.38 H new ATOM 0 HG12 ILE A 96 5.987 -2.017 -7.965 1.00 0.47 H new ATOM 0 HG13 ILE A 96 5.574 -0.410 -8.530 1.00 0.47 H new ATOM 0 HG21 ILE A 96 5.899 0.222 -10.687 1.00 0.40 H new ATOM 0 HG22 ILE A 96 5.932 -0.938 -12.036 1.00 0.40 H new ATOM 0 HG23 ILE A 96 4.421 -0.660 -11.139 1.00 0.40 H new ATOM 0 HD11 ILE A 96 3.688 -1.442 -7.369 1.00 1.93 H new ATOM 0 HD12 ILE A 96 3.290 -1.177 -9.083 1.00 1.93 H new ATOM 0 HD13 ILE A 96 3.709 -2.808 -8.510 1.00 1.93 H new ATOM 1406 N ASN A 97 7.377 -3.957 -11.664 1.00 0.37 N ATOM 1407 CA ASN A 97 8.166 -4.435 -12.789 1.00 0.41 C ATOM 1408 C ASN A 97 7.674 -5.815 -13.220 1.00 0.40 C ATOM 1409 O ASN A 97 7.680 -6.142 -14.402 1.00 0.56 O ATOM 1410 CB ASN A 97 9.647 -4.485 -12.409 1.00 0.50 C ATOM 1411 CG ASN A 97 10.476 -5.072 -13.544 1.00 1.36 C ATOM 1412 OD1 ASN A 97 11.018 -6.162 -13.419 1.00 3.06 O ATOM 1413 ND2 ASN A 97 10.579 -4.372 -14.666 1.00 2.38 N ATOM 0 H ASN A 97 7.887 -3.882 -10.784 1.00 0.37 H new ATOM 0 HA ASN A 97 8.049 -3.747 -13.626 1.00 0.41 H new ATOM 0 HB2 ASN A 97 10.001 -3.481 -12.175 1.00 0.50 H new ATOM 0 HB3 ASN A 97 9.776 -5.086 -11.509 1.00 0.50 H new ATOM 0 HD21 ASN A 97 11.119 -4.740 -15.449 1.00 2.38 H new ATOM 0 HD22 ASN A 97 10.118 -3.466 -14.746 1.00 2.38 H new ATOM 1420 N ARG A 98 7.230 -6.619 -12.256 1.00 0.43 N ATOM 1421 CA ARG A 98 6.865 -8.018 -12.462 1.00 0.45 C ATOM 1422 C ARG A 98 5.670 -8.119 -13.396 1.00 0.46 C ATOM 1423 O ARG A 98 5.640 -8.938 -14.308 1.00 0.54 O ATOM 1424 CB ARG A 98 6.562 -8.648 -11.094 1.00 0.47 C ATOM 1425 CG ARG A 98 7.066 -10.084 -10.976 1.00 0.88 C ATOM 1426 CD ARG A 98 7.023 -10.480 -9.496 1.00 1.43 C ATOM 1427 NE ARG A 98 7.893 -11.631 -9.221 1.00 2.08 N ATOM 1428 CZ ARG A 98 8.408 -11.909 -8.017 1.00 3.08 C ATOM 1429 NH1 ARG A 98 9.312 -12.881 -7.888 1.00 3.71 N ATOM 1430 NH2 ARG A 98 8.032 -11.216 -6.944 1.00 4.00 N ATOM 0 H ARG A 98 7.112 -6.310 -11.291 1.00 0.43 H new ATOM 0 HA ARG A 98 7.688 -8.558 -12.930 1.00 0.45 H new ATOM 0 HB2 ARG A 98 7.019 -8.042 -10.312 1.00 0.47 H new ATOM 0 HB3 ARG A 98 5.486 -8.631 -10.922 1.00 0.47 H new ATOM 0 HG2 ARG A 98 6.445 -10.756 -11.569 1.00 0.88 H new ATOM 0 HG3 ARG A 98 8.082 -10.165 -11.363 1.00 0.88 H new ATOM 0 HD2 ARG A 98 7.333 -9.634 -8.883 1.00 1.43 H new ATOM 0 HD3 ARG A 98 5.999 -10.721 -9.212 1.00 1.43 H new ATOM 0 HE ARG A 98 8.118 -12.257 -9.994 1.00 2.08 H new ATOM 0 HH11 ARG A 98 9.610 -13.412 -8.706 1.00 3.71 H new ATOM 0 HH12 ARG A 98 9.705 -13.094 -6.971 1.00 3.71 H new ATOM 0 HH21 ARG A 98 7.346 -10.466 -7.036 1.00 4.00 H new ATOM 0 HH22 ARG A 98 8.430 -11.435 -6.031 1.00 4.00 H new ATOM 1444 N LEU A 99 4.678 -7.274 -13.136 1.00 0.44 N ATOM 1445 CA LEU A 99 3.480 -7.108 -13.931 1.00 0.47 C ATOM 1446 C LEU A 99 3.819 -6.363 -15.218 1.00 0.53 C ATOM 1447 O LEU A 99 3.115 -6.523 -16.210 1.00 0.63 O ATOM 1448 CB LEU A 99 2.458 -6.310 -13.116 1.00 0.62 C ATOM 1449 CG LEU A 99 2.008 -7.026 -11.836 1.00 0.97 C ATOM 1450 CD1 LEU A 99 1.337 -5.987 -10.933 1.00 3.09 C ATOM 1451 CD2 LEU A 99 1.129 -8.236 -12.157 1.00 1.72 C ATOM 0 H LEU A 99 4.695 -6.658 -12.323 1.00 0.44 H new ATOM 0 HA LEU A 99 3.064 -8.082 -14.190 1.00 0.47 H new ATOM 0 HB2 LEU A 99 2.889 -5.345 -12.851 1.00 0.62 H new ATOM 0 HB3 LEU A 99 1.585 -6.109 -13.737 1.00 0.62 H new ATOM 0 HG LEU A 99 2.859 -7.445 -11.299 1.00 0.97 H new ATOM 0 HD11 LEU A 99 1.005 -6.466 -10.012 1.00 3.09 H new ATOM 0 HD12 LEU A 99 2.050 -5.197 -10.695 1.00 3.09 H new ATOM 0 HD13 LEU A 99 0.478 -5.557 -11.449 1.00 3.09 H new ATOM 0 HD21 LEU A 99 0.826 -8.722 -11.230 1.00 1.72 H new ATOM 0 HD22 LEU A 99 0.243 -7.908 -12.701 1.00 1.72 H new ATOM 0 HD23 LEU A 99 1.690 -8.941 -12.770 1.00 1.72 H new ATOM 1463 N SER A 100 4.884 -5.550 -15.203 1.00 0.58 N ATOM 1464 CA SER A 100 5.289 -4.704 -16.315 1.00 0.67 C ATOM 1465 C SER A 100 4.158 -3.747 -16.674 1.00 0.73 C ATOM 1466 O SER A 100 3.610 -3.773 -17.773 1.00 0.95 O ATOM 1467 CB SER A 100 5.785 -5.563 -17.482 1.00 0.85 C ATOM 1468 OG SER A 100 7.115 -5.972 -17.230 1.00 1.09 O ATOM 0 H SER A 100 5.498 -5.466 -14.393 1.00 0.58 H new ATOM 0 HA SER A 100 6.136 -4.078 -16.032 1.00 0.67 H new ATOM 0 HB2 SER A 100 5.142 -6.434 -17.606 1.00 0.85 H new ATOM 0 HB3 SER A 100 5.737 -4.996 -18.412 1.00 0.85 H new ATOM 0 HG SER A 100 7.266 -6.015 -16.263 1.00 1.09 H new ATOM 1474 N ILE A 101 3.844 -2.871 -15.719 1.00 0.65 N ATOM 1475 CA ILE A 101 2.804 -1.861 -15.846 1.00 0.76 C ATOM 1476 C ILE A 101 3.423 -0.480 -15.928 1.00 0.62 C ATOM 1477 O ILE A 101 4.631 -0.331 -15.757 1.00 0.68 O ATOM 1478 CB ILE A 101 1.834 -1.947 -14.663 1.00 1.00 C ATOM 1479 CG1 ILE A 101 2.500 -1.671 -13.302 1.00 1.13 C ATOM 1480 CG2 ILE A 101 1.102 -3.283 -14.761 1.00 2.55 C ATOM 1481 CD1 ILE A 101 1.643 -2.163 -12.144 1.00 0.80 C ATOM 0 H ILE A 101 4.319 -2.847 -14.817 1.00 0.65 H new ATOM 0 HA ILE A 101 2.245 -2.045 -16.764 1.00 0.76 H new ATOM 0 HB ILE A 101 1.099 -1.144 -14.722 1.00 1.00 H new ATOM 0 HG12 ILE A 101 3.473 -2.160 -13.268 1.00 1.13 H new ATOM 0 HG13 ILE A 101 2.677 -0.601 -13.194 1.00 1.13 H new ATOM 0 HG21 ILE A 101 0.402 -3.376 -13.931 1.00 2.55 H new ATOM 0 HG22 ILE A 101 0.556 -3.331 -15.703 1.00 2.55 H new ATOM 0 HG23 ILE A 101 1.825 -4.098 -14.719 1.00 2.55 H new ATOM 0 HD11 ILE A 101 2.148 -1.950 -11.202 1.00 0.80 H new ATOM 0 HD12 ILE A 101 0.679 -1.654 -12.163 1.00 0.80 H new ATOM 0 HD13 ILE A 101 1.488 -3.238 -12.237 1.00 0.80 H new ATOM 1493 N SER A 102 2.590 0.536 -16.160 1.00 0.56 N ATOM 1494 CA SER A 102 3.091 1.893 -16.353 1.00 0.63 C ATOM 1495 C SER A 102 2.422 2.923 -15.439 1.00 0.42 C ATOM 1496 O SER A 102 2.785 4.099 -15.483 1.00 0.54 O ATOM 1497 CB SER A 102 2.992 2.269 -17.836 1.00 1.07 C ATOM 1498 OG SER A 102 4.185 2.895 -18.264 1.00 2.04 O ATOM 0 H SER A 102 1.576 0.444 -16.218 1.00 0.56 H new ATOM 0 HA SER A 102 4.140 1.908 -16.057 1.00 0.63 H new ATOM 0 HB2 SER A 102 2.807 1.376 -18.433 1.00 1.07 H new ATOM 0 HB3 SER A 102 2.146 2.938 -17.993 1.00 1.07 H new ATOM 0 HG SER A 102 4.110 3.129 -19.213 1.00 2.04 H new ATOM 1504 N SER A 103 1.497 2.531 -14.556 1.00 0.46 N ATOM 1505 CA SER A 103 0.997 3.455 -13.542 1.00 0.42 C ATOM 1506 C SER A 103 0.571 2.654 -12.322 1.00 0.42 C ATOM 1507 O SER A 103 0.056 1.548 -12.485 1.00 0.60 O ATOM 1508 CB SER A 103 -0.191 4.264 -14.078 1.00 0.68 C ATOM 1509 OG SER A 103 0.025 4.726 -15.397 1.00 1.49 O ATOM 0 H SER A 103 1.088 1.597 -14.525 1.00 0.46 H new ATOM 0 HA SER A 103 1.787 4.156 -13.274 1.00 0.42 H new ATOM 0 HB2 SER A 103 -1.089 3.646 -14.054 1.00 0.68 H new ATOM 0 HB3 SER A 103 -0.373 5.116 -13.422 1.00 0.68 H new ATOM 0 HG SER A 103 -0.757 5.234 -15.698 1.00 1.49 H new ATOM 1515 N VAL A 104 0.768 3.184 -11.114 1.00 0.32 N ATOM 1516 CA VAL A 104 0.340 2.492 -9.917 1.00 0.34 C ATOM 1517 C VAL A 104 0.141 3.469 -8.757 1.00 0.34 C ATOM 1518 O VAL A 104 0.988 4.310 -8.446 1.00 0.41 O ATOM 1519 CB VAL A 104 1.315 1.349 -9.591 1.00 0.39 C ATOM 1520 CG1 VAL A 104 2.768 1.821 -9.589 1.00 0.39 C ATOM 1521 CG2 VAL A 104 0.954 0.677 -8.261 1.00 0.42 C ATOM 0 H VAL A 104 1.219 4.084 -10.948 1.00 0.32 H new ATOM 0 HA VAL A 104 -0.635 2.037 -10.092 1.00 0.34 H new ATOM 0 HB VAL A 104 1.217 0.607 -10.384 1.00 0.39 H new ATOM 0 HG11 VAL A 104 3.423 0.982 -9.354 1.00 0.39 H new ATOM 0 HG12 VAL A 104 3.023 2.217 -10.572 1.00 0.39 H new ATOM 0 HG13 VAL A 104 2.896 2.602 -8.839 1.00 0.39 H new ATOM 0 HG21 VAL A 104 1.660 -0.127 -8.056 1.00 0.42 H new ATOM 0 HG22 VAL A 104 0.999 1.412 -7.458 1.00 0.42 H new ATOM 0 HG23 VAL A 104 -0.054 0.268 -8.322 1.00 0.42 H new ATOM 1531 N ALA A 105 -0.991 3.300 -8.077 1.00 0.30 N ATOM 1532 CA ALA A 105 -1.340 4.074 -6.901 1.00 0.28 C ATOM 1533 C ALA A 105 -0.793 3.376 -5.660 1.00 0.24 C ATOM 1534 O ALA A 105 -0.852 2.151 -5.575 1.00 0.29 O ATOM 1535 CB ALA A 105 -2.861 4.156 -6.815 1.00 0.35 C ATOM 0 H ALA A 105 -1.697 2.611 -8.336 1.00 0.30 H new ATOM 0 HA ALA A 105 -0.915 5.076 -6.964 1.00 0.28 H new ATOM 0 HB1 ALA A 105 -3.145 4.735 -5.936 1.00 0.35 H new ATOM 0 HB2 ALA A 105 -3.250 4.641 -7.710 1.00 0.35 H new ATOM 0 HB3 ALA A 105 -3.276 3.151 -6.737 1.00 0.35 H new ATOM 1541 N ILE A 106 -0.298 4.142 -4.686 1.00 0.21 N ATOM 1542 CA ILE A 106 0.349 3.610 -3.499 1.00 0.23 C ATOM 1543 C ILE A 106 -0.117 4.403 -2.269 1.00 0.26 C ATOM 1544 O ILE A 106 0.101 5.609 -2.187 1.00 0.30 O ATOM 1545 CB ILE A 106 1.876 3.615 -3.723 1.00 0.27 C ATOM 1546 CG1 ILE A 106 2.632 3.040 -2.520 1.00 0.38 C ATOM 1547 CG2 ILE A 106 2.458 4.995 -4.057 1.00 0.40 C ATOM 1548 CD1 ILE A 106 2.610 1.514 -2.520 1.00 0.70 C ATOM 0 H ILE A 106 -0.339 5.161 -4.706 1.00 0.21 H new ATOM 0 HA ILE A 106 0.068 2.574 -3.310 1.00 0.23 H new ATOM 0 HB ILE A 106 2.019 2.977 -4.595 1.00 0.27 H new ATOM 0 HG12 ILE A 106 3.664 3.390 -2.537 1.00 0.38 H new ATOM 0 HG13 ILE A 106 2.185 3.411 -1.598 1.00 0.38 H new ATOM 0 HG21 ILE A 106 3.535 4.911 -4.199 1.00 0.40 H new ATOM 0 HG22 ILE A 106 2.000 5.372 -4.971 1.00 0.40 H new ATOM 0 HG23 ILE A 106 2.253 5.684 -3.238 1.00 0.40 H new ATOM 0 HD11 ILE A 106 3.156 1.142 -1.653 1.00 0.70 H new ATOM 0 HD12 ILE A 106 1.578 1.165 -2.477 1.00 0.70 H new ATOM 0 HD13 ILE A 106 3.080 1.143 -3.431 1.00 0.70 H new ATOM 1560 N PRO A 107 -0.801 3.768 -1.308 1.00 0.28 N ATOM 1561 CA PRO A 107 -1.251 4.432 -0.100 1.00 0.32 C ATOM 1562 C PRO A 107 -0.134 4.454 0.943 1.00 0.36 C ATOM 1563 O PRO A 107 0.617 3.488 1.088 1.00 0.50 O ATOM 1564 CB PRO A 107 -2.435 3.598 0.387 1.00 0.36 C ATOM 1565 CG PRO A 107 -2.083 2.184 -0.074 1.00 0.33 C ATOM 1566 CD PRO A 107 -1.292 2.405 -1.365 1.00 0.30 C ATOM 0 HA PRO A 107 -1.531 5.471 -0.276 1.00 0.32 H new ATOM 0 HB2 PRO A 107 -2.546 3.652 1.470 1.00 0.36 H new ATOM 0 HB3 PRO A 107 -3.374 3.941 -0.048 1.00 0.36 H new ATOM 0 HG2 PRO A 107 -1.490 1.656 0.673 1.00 0.33 H new ATOM 0 HG3 PRO A 107 -2.978 1.587 -0.251 1.00 0.33 H new ATOM 0 HD2 PRO A 107 -0.467 1.697 -1.443 1.00 0.30 H new ATOM 0 HD3 PRO A 107 -1.924 2.255 -2.240 1.00 0.30 H new ATOM 1574 N LEU A 108 -0.045 5.533 1.722 1.00 0.33 N ATOM 1575 CA LEU A 108 0.841 5.570 2.870 1.00 0.37 C ATOM 1576 C LEU A 108 0.320 4.585 3.926 1.00 0.49 C ATOM 1577 O LEU A 108 -0.600 4.910 4.674 1.00 0.58 O ATOM 1578 CB LEU A 108 0.919 7.020 3.386 1.00 0.36 C ATOM 1579 CG LEU A 108 2.116 7.291 4.312 1.00 0.50 C ATOM 1580 CD1 LEU A 108 2.011 6.511 5.618 1.00 0.77 C ATOM 1581 CD2 LEU A 108 3.419 7.016 3.567 1.00 0.73 C ATOM 0 H LEU A 108 -0.579 6.389 1.573 1.00 0.33 H new ATOM 0 HA LEU A 108 1.854 5.262 2.610 1.00 0.37 H new ATOM 0 HB2 LEU A 108 0.973 7.696 2.533 1.00 0.36 H new ATOM 0 HB3 LEU A 108 -0.001 7.254 3.921 1.00 0.36 H new ATOM 0 HG LEU A 108 2.108 8.343 4.596 1.00 0.50 H new ATOM 0 HD11 LEU A 108 2.876 6.731 6.244 1.00 0.77 H new ATOM 0 HD12 LEU A 108 1.101 6.801 6.143 1.00 0.77 H new ATOM 0 HD13 LEU A 108 1.981 5.443 5.402 1.00 0.77 H new ATOM 0 HD21 LEU A 108 4.264 7.210 4.228 1.00 0.73 H new ATOM 0 HD22 LEU A 108 3.441 5.975 3.245 1.00 0.73 H new ATOM 0 HD23 LEU A 108 3.484 7.667 2.695 1.00 0.73 H new ATOM 1593 N LEU A 109 0.903 3.381 3.996 1.00 0.60 N ATOM 1594 CA LEU A 109 0.569 2.401 5.033 1.00 0.77 C ATOM 1595 C LEU A 109 0.745 3.029 6.417 1.00 1.01 C ATOM 1596 O LEU A 109 1.858 3.401 6.799 1.00 1.05 O ATOM 1597 CB LEU A 109 1.438 1.134 4.937 1.00 0.83 C ATOM 1598 CG LEU A 109 0.838 0.017 4.074 1.00 0.84 C ATOM 1599 CD1 LEU A 109 0.636 0.462 2.626 1.00 1.17 C ATOM 1600 CD2 LEU A 109 1.772 -1.195 4.119 1.00 1.39 C ATOM 0 H LEU A 109 1.615 3.062 3.339 1.00 0.60 H new ATOM 0 HA LEU A 109 -0.469 2.108 4.879 1.00 0.77 H new ATOM 0 HB2 LEU A 109 2.412 1.406 4.531 1.00 0.83 H new ATOM 0 HB3 LEU A 109 1.608 0.748 5.942 1.00 0.83 H new ATOM 0 HG LEU A 109 -0.142 -0.240 4.475 1.00 0.84 H new ATOM 0 HD11 LEU A 109 0.209 -0.359 2.049 1.00 1.17 H new ATOM 0 HD12 LEU A 109 -0.042 1.315 2.599 1.00 1.17 H new ATOM 0 HD13 LEU A 109 1.596 0.747 2.196 1.00 1.17 H new ATOM 0 HD21 LEU A 109 1.357 -1.997 3.509 1.00 1.39 H new ATOM 0 HD22 LEU A 109 2.751 -0.914 3.732 1.00 1.39 H new ATOM 0 HD23 LEU A 109 1.874 -1.538 5.149 1.00 1.39 H new ATOM 1612 N SER A 110 -0.358 3.115 7.162 1.00 1.78 N ATOM 1613 CA SER A 110 -0.378 3.582 8.539 1.00 2.00 C ATOM 1614 C SER A 110 -1.689 3.132 9.199 1.00 2.23 C ATOM 1615 O SER A 110 -2.441 3.954 9.721 1.00 3.25 O ATOM 1616 CB SER A 110 -0.232 5.110 8.551 1.00 3.43 C ATOM 1617 OG SER A 110 -0.131 5.611 9.868 1.00 4.31 O ATOM 0 H SER A 110 -1.280 2.855 6.812 1.00 1.78 H new ATOM 0 HA SER A 110 0.451 3.158 9.106 1.00 2.00 H new ATOM 0 HB2 SER A 110 0.653 5.396 7.983 1.00 3.43 H new ATOM 0 HB3 SER A 110 -1.090 5.562 8.054 1.00 3.43 H new ATOM 0 HG SER A 110 -0.910 5.322 10.388 1.00 4.31 H new ATOM 1623 N THR A 111 -1.996 1.833 9.161 1.00 1.97 N ATOM 1624 CA THR A 111 -3.243 1.308 9.706 1.00 3.06 C ATOM 1625 C THR A 111 -3.074 1.094 11.211 1.00 2.57 C ATOM 1626 O THR A 111 -2.018 0.620 11.637 1.00 3.01 O ATOM 1627 CB THR A 111 -3.569 -0.017 9.002 1.00 4.75 C ATOM 1628 OG1 THR A 111 -3.192 0.062 7.642 1.00 5.22 O ATOM 1629 CG2 THR A 111 -5.060 -0.353 9.093 1.00 5.47 C ATOM 0 H THR A 111 -1.389 1.122 8.753 1.00 1.97 H new ATOM 0 HA THR A 111 -4.062 2.008 9.541 1.00 3.06 H new ATOM 0 HB THR A 111 -3.010 -0.807 9.504 1.00 4.75 H new ATOM 0 HG1 THR A 111 -3.399 -0.785 7.195 1.00 5.22 H new ATOM 0 HG21 THR A 111 -5.252 -1.297 8.584 1.00 5.47 H new ATOM 0 HG22 THR A 111 -5.350 -0.440 10.140 1.00 5.47 H new ATOM 0 HG23 THR A 111 -5.641 0.439 8.620 1.00 5.47 H new ATOM 1637 N GLY A 112 -4.096 1.409 12.017 1.00 2.69 N ATOM 1638 CA GLY A 112 -4.045 1.322 13.476 1.00 2.94 C ATOM 1639 C GLY A 112 -4.063 -0.127 13.959 1.00 2.76 C ATOM 1640 O GLY A 112 -5.076 -0.611 14.446 1.00 3.59 O ATOM 0 H GLY A 112 -4.995 1.737 11.664 1.00 2.69 H new ATOM 0 HA2 GLY A 112 -3.143 1.815 13.838 1.00 2.94 H new ATOM 0 HA3 GLY A 112 -4.893 1.858 13.902 1.00 2.94 H new ATOM 1644 N ILE A 113 -2.931 -0.809 13.790 1.00 2.60 N ATOM 1645 CA ILE A 113 -2.707 -2.235 14.002 1.00 2.62 C ATOM 1646 C ILE A 113 -1.248 -2.528 13.619 1.00 2.39 C ATOM 1647 O ILE A 113 -0.539 -3.207 14.354 1.00 2.83 O ATOM 1648 CB ILE A 113 -3.735 -3.090 13.218 1.00 2.75 C ATOM 1649 CG1 ILE A 113 -3.465 -4.602 13.331 1.00 4.27 C ATOM 1650 CG2 ILE A 113 -3.839 -2.683 11.741 1.00 3.01 C ATOM 1651 CD1 ILE A 113 -3.930 -5.148 14.683 1.00 5.07 C ATOM 0 H ILE A 113 -2.081 -0.340 13.477 1.00 2.60 H new ATOM 0 HA ILE A 113 -2.861 -2.508 15.046 1.00 2.62 H new ATOM 0 HB ILE A 113 -4.694 -2.885 13.694 1.00 2.75 H new ATOM 0 HG12 ILE A 113 -3.981 -5.127 12.527 1.00 4.27 H new ATOM 0 HG13 ILE A 113 -2.399 -4.794 13.205 1.00 4.27 H new ATOM 0 HG21 ILE A 113 -4.573 -3.314 11.240 1.00 3.01 H new ATOM 0 HG22 ILE A 113 -4.150 -1.641 11.672 1.00 3.01 H new ATOM 0 HG23 ILE A 113 -2.868 -2.805 11.261 1.00 3.01 H new ATOM 0 HD11 ILE A 113 -3.726 -6.218 14.733 1.00 5.07 H new ATOM 0 HD12 ILE A 113 -3.395 -4.639 15.485 1.00 5.07 H new ATOM 0 HD13 ILE A 113 -5.001 -4.977 14.796 1.00 5.07 H new ATOM 1663 N PHE A 114 -0.775 -1.958 12.503 1.00 1.91 N ATOM 1664 CA PHE A 114 0.581 -2.142 11.994 1.00 1.83 C ATOM 1665 C PHE A 114 1.257 -0.778 11.800 1.00 1.75 C ATOM 1666 O PHE A 114 1.997 -0.563 10.845 1.00 2.48 O ATOM 1667 CB PHE A 114 0.537 -2.963 10.695 1.00 2.07 C ATOM 1668 CG PHE A 114 -0.015 -4.369 10.861 1.00 3.06 C ATOM 1669 CD1 PHE A 114 0.731 -5.339 11.555 1.00 4.77 C ATOM 1670 CD2 PHE A 114 -1.264 -4.725 10.323 1.00 3.57 C ATOM 1671 CE1 PHE A 114 0.246 -6.649 11.697 1.00 5.99 C ATOM 1672 CE2 PHE A 114 -1.783 -6.015 10.534 1.00 4.84 C ATOM 1673 CZ PHE A 114 -1.023 -6.983 11.207 1.00 5.77 C ATOM 0 H PHE A 114 -1.341 -1.343 11.919 1.00 1.91 H new ATOM 0 HA PHE A 114 1.179 -2.699 12.715 1.00 1.83 H new ATOM 0 HB2 PHE A 114 -0.071 -2.431 9.963 1.00 2.07 H new ATOM 0 HB3 PHE A 114 1.545 -3.027 10.286 1.00 2.07 H new ATOM 0 HD1 PHE A 114 1.686 -5.073 11.983 1.00 4.77 H new ATOM 0 HD2 PHE A 114 -1.827 -4.006 9.746 1.00 3.57 H new ATOM 0 HE1 PHE A 114 0.851 -7.399 12.184 1.00 5.99 H new ATOM 0 HE2 PHE A 114 -2.772 -6.262 10.176 1.00 4.84 H new ATOM 0 HZ PHE A 114 -1.414 -7.980 11.347 1.00 5.77 H new ATOM 1683 N SER A 115 1.008 0.151 12.731 1.00 1.42 N ATOM 1684 CA SER A 115 1.675 1.452 12.787 1.00 1.42 C ATOM 1685 C SER A 115 2.415 1.657 14.105 1.00 1.45 C ATOM 1686 O SER A 115 3.555 2.106 14.087 1.00 2.16 O ATOM 1687 CB SER A 115 0.664 2.578 12.588 1.00 1.51 C ATOM 1688 OG SER A 115 0.080 2.436 11.324 1.00 2.24 O ATOM 0 H SER A 115 0.326 0.015 13.477 1.00 1.42 H new ATOM 0 HA SER A 115 2.409 1.472 11.981 1.00 1.42 H new ATOM 0 HB2 SER A 115 -0.100 2.541 13.364 1.00 1.51 H new ATOM 0 HB3 SER A 115 1.156 3.547 12.671 1.00 1.51 H new ATOM 0 HG SER A 115 -0.614 1.745 11.360 1.00 2.24 H new ATOM 1694 N ALA A 116 1.762 1.370 15.238 1.00 1.04 N ATOM 1695 CA ALA A 116 2.268 1.669 16.575 1.00 0.97 C ATOM 1696 C ALA A 116 2.354 3.183 16.802 1.00 1.20 C ATOM 1697 O ALA A 116 3.363 3.692 17.278 1.00 1.80 O ATOM 1698 CB ALA A 116 3.604 0.949 16.811 1.00 1.30 C ATOM 0 H ALA A 116 0.849 0.914 15.246 1.00 1.04 H new ATOM 0 HA ALA A 116 1.567 1.289 17.318 1.00 0.97 H new ATOM 0 HB1 ALA A 116 3.970 1.180 17.811 1.00 1.30 H new ATOM 0 HB2 ALA A 116 3.459 -0.127 16.718 1.00 1.30 H new ATOM 0 HB3 ALA A 116 4.332 1.282 16.072 1.00 1.30 H new ATOM 1704 N GLY A 117 1.283 3.909 16.464 1.00 1.82 N ATOM 1705 CA GLY A 117 1.220 5.356 16.646 1.00 2.57 C ATOM 1706 C GLY A 117 2.298 6.077 15.840 1.00 2.21 C ATOM 1707 O GLY A 117 2.873 7.058 16.304 1.00 2.27 O ATOM 0 H GLY A 117 0.438 3.507 16.057 1.00 1.82 H new ATOM 0 HA2 GLY A 117 0.237 5.718 16.344 1.00 2.57 H new ATOM 0 HA3 GLY A 117 1.336 5.595 17.703 1.00 2.57 H new ATOM 1711 N LYS A 118 2.594 5.580 14.636 1.00 2.01 N ATOM 1712 CA LYS A 118 3.701 6.092 13.840 1.00 1.63 C ATOM 1713 C LYS A 118 3.445 7.529 13.398 1.00 1.67 C ATOM 1714 O LYS A 118 4.345 8.363 13.461 1.00 2.71 O ATOM 1715 CB LYS A 118 3.942 5.202 12.609 1.00 2.22 C ATOM 1716 CG LYS A 118 5.443 5.103 12.330 1.00 2.38 C ATOM 1717 CD LYS A 118 6.072 3.994 13.187 1.00 2.84 C ATOM 1718 CE LYS A 118 5.991 2.652 12.454 1.00 4.04 C ATOM 1719 NZ LYS A 118 7.042 2.540 11.419 1.00 4.83 N ATOM 0 H LYS A 118 2.077 4.820 14.194 1.00 2.01 H new ATOM 0 HA LYS A 118 4.592 6.078 14.468 1.00 1.63 H new ATOM 0 HB2 LYS A 118 3.528 4.208 12.780 1.00 2.22 H new ATOM 0 HB3 LYS A 118 3.428 5.617 11.742 1.00 2.22 H new ATOM 0 HG2 LYS A 118 5.611 4.895 11.273 1.00 2.38 H new ATOM 0 HG3 LYS A 118 5.924 6.057 12.547 1.00 2.38 H new ATOM 0 HD2 LYS A 118 7.112 4.237 13.403 1.00 2.84 H new ATOM 0 HD3 LYS A 118 5.555 3.926 14.144 1.00 2.84 H new ATOM 0 HE2 LYS A 118 6.095 1.837 13.170 1.00 4.04 H new ATOM 0 HE3 LYS A 118 5.010 2.547 11.992 1.00 4.04 H new ATOM 0 HZ1 LYS A 118 6.604 2.564 10.476 1.00 4.83 H new ATOM 0 HZ2 LYS A 118 7.707 3.334 11.512 1.00 4.83 H new ATOM 0 HZ3 LYS A 118 7.554 1.643 11.540 1.00 4.83 H new ATOM 1733 N ASP A 119 2.241 7.755 12.861 1.00 2.52 N ATOM 1734 CA ASP A 119 1.732 8.977 12.244 1.00 2.92 C ATOM 1735 C ASP A 119 2.824 9.865 11.648 1.00 2.08 C ATOM 1736 O ASP A 119 2.932 11.056 11.940 1.00 2.69 O ATOM 1737 CB ASP A 119 0.789 9.701 13.210 1.00 4.09 C ATOM 1738 CG ASP A 119 -0.558 8.984 13.189 1.00 5.18 C ATOM 1739 OD1 ASP A 119 -1.473 9.512 12.516 1.00 6.19 O ATOM 1740 OD2 ASP A 119 -0.615 7.872 13.762 1.00 5.61 O ATOM 0 H ASP A 119 1.537 7.017 12.848 1.00 2.52 H new ATOM 0 HA ASP A 119 1.144 8.692 11.372 1.00 2.92 H new ATOM 0 HB2 ASP A 119 1.204 9.701 14.218 1.00 4.09 H new ATOM 0 HB3 ASP A 119 0.669 10.743 12.915 1.00 4.09 H new ATOM 1745 N ARG A 120 3.600 9.299 10.720 1.00 1.34 N ATOM 1746 CA ARG A 120 4.503 10.078 9.891 1.00 0.73 C ATOM 1747 C ARG A 120 4.516 9.502 8.493 1.00 0.58 C ATOM 1748 O ARG A 120 5.169 8.496 8.228 1.00 0.60 O ATOM 1749 CB ARG A 120 5.928 10.111 10.472 1.00 1.16 C ATOM 1750 CG ARG A 120 6.205 11.417 11.223 1.00 1.58 C ATOM 1751 CD ARG A 120 6.073 11.239 12.733 1.00 2.53 C ATOM 1752 NE ARG A 120 5.942 12.544 13.393 1.00 2.50 N ATOM 1753 CZ ARG A 120 5.992 12.743 14.712 1.00 3.22 C ATOM 1754 NH1 ARG A 120 5.790 13.966 15.205 1.00 3.38 N ATOM 1755 NH2 ARG A 120 6.243 11.721 15.530 1.00 4.31 N ATOM 0 H ARG A 120 3.616 8.297 10.529 1.00 1.34 H new ATOM 0 HA ARG A 120 4.144 11.107 9.864 1.00 0.73 H new ATOM 0 HB2 ARG A 120 6.065 9.267 11.148 1.00 1.16 H new ATOM 0 HB3 ARG A 120 6.652 9.994 9.666 1.00 1.16 H new ATOM 0 HG2 ARG A 120 7.209 11.768 10.984 1.00 1.58 H new ATOM 0 HG3 ARG A 120 5.510 12.186 10.885 1.00 1.58 H new ATOM 0 HD2 ARG A 120 5.203 10.622 12.958 1.00 2.53 H new ATOM 0 HD3 ARG A 120 6.946 10.714 13.121 1.00 2.53 H new ATOM 0 HE ARG A 120 5.802 13.361 12.798 1.00 2.50 H new ATOM 0 HH11 ARG A 120 5.598 14.745 14.575 1.00 3.38 H new ATOM 0 HH12 ARG A 120 5.827 14.122 16.212 1.00 3.38 H new ATOM 0 HH21 ARG A 120 6.397 10.788 15.148 1.00 4.31 H new ATOM 0 HH22 ARG A 120 6.281 11.872 16.538 1.00 4.31 H new ATOM 1769 N VAL A 121 3.866 10.198 7.565 1.00 0.49 N ATOM 1770 CA VAL A 121 4.000 9.854 6.163 1.00 0.38 C ATOM 1771 C VAL A 121 5.458 9.989 5.760 1.00 0.31 C ATOM 1772 O VAL A 121 5.981 9.102 5.117 1.00 0.35 O ATOM 1773 CB VAL A 121 3.053 10.678 5.289 1.00 0.39 C ATOM 1774 CG1 VAL A 121 1.652 10.643 5.911 1.00 0.43 C ATOM 1775 CG2 VAL A 121 3.531 12.114 5.150 1.00 0.42 C ATOM 0 H VAL A 121 3.252 10.990 7.758 1.00 0.49 H new ATOM 0 HA VAL A 121 3.702 8.817 6.007 1.00 0.38 H new ATOM 0 HB VAL A 121 3.031 10.245 4.289 1.00 0.39 H new ATOM 0 HG11 VAL A 121 0.967 11.227 5.297 1.00 0.43 H new ATOM 0 HG12 VAL A 121 1.303 9.612 5.964 1.00 0.43 H new ATOM 0 HG13 VAL A 121 1.689 11.065 6.915 1.00 0.43 H new ATOM 0 HG21 VAL A 121 2.834 12.670 4.523 1.00 0.42 H new ATOM 0 HG22 VAL A 121 3.582 12.578 6.135 1.00 0.42 H new ATOM 0 HG23 VAL A 121 4.520 12.126 4.692 1.00 0.42 H new ATOM 1785 N HIS A 122 6.149 11.040 6.199 1.00 0.39 N ATOM 1786 CA HIS A 122 7.564 11.218 5.902 1.00 0.50 C ATOM 1787 C HIS A 122 8.367 9.960 6.243 1.00 0.47 C ATOM 1788 O HIS A 122 9.331 9.641 5.557 1.00 0.56 O ATOM 1789 CB HIS A 122 8.128 12.447 6.626 1.00 0.70 C ATOM 1790 CG HIS A 122 9.610 12.624 6.393 1.00 1.21 C ATOM 1791 ND1 HIS A 122 10.217 12.951 5.199 1.00 2.35 N ATOM 1792 CD2 HIS A 122 10.599 12.400 7.313 1.00 2.30 C ATOM 1793 CE1 HIS A 122 11.547 12.928 5.405 1.00 2.97 C ATOM 1794 NE2 HIS A 122 11.825 12.604 6.678 1.00 2.92 N ATOM 0 H HIS A 122 5.745 11.785 6.766 1.00 0.39 H new ATOM 0 HA HIS A 122 7.658 11.388 4.830 1.00 0.50 H new ATOM 0 HB2 HIS A 122 7.601 13.339 6.287 1.00 0.70 H new ATOM 0 HB3 HIS A 122 7.940 12.353 7.696 1.00 0.70 H new ATOM 0 HD2 HIS A 122 10.456 12.116 8.345 1.00 2.30 H new ATOM 0 HE1 HIS A 122 12.289 13.141 4.650 1.00 2.97 H new ATOM 0 HE2 HIS A 122 12.751 12.523 7.099 1.00 2.92 H new ATOM 1802 N GLN A 123 7.974 9.228 7.287 1.00 0.44 N ATOM 1803 CA GLN A 123 8.680 8.016 7.656 1.00 0.46 C ATOM 1804 C GLN A 123 8.299 6.920 6.670 1.00 0.42 C ATOM 1805 O GLN A 123 9.163 6.373 5.990 1.00 0.45 O ATOM 1806 CB GLN A 123 8.345 7.628 9.099 1.00 0.60 C ATOM 1807 CG GLN A 123 9.188 6.439 9.571 1.00 1.17 C ATOM 1808 CD GLN A 123 8.757 5.990 10.961 1.00 2.21 C ATOM 1809 OE1 GLN A 123 8.236 4.895 11.133 1.00 3.42 O ATOM 1810 NE2 GLN A 123 8.921 6.835 11.970 1.00 3.15 N ATOM 0 H GLN A 123 7.178 9.456 7.882 1.00 0.44 H new ATOM 0 HA GLN A 123 9.758 8.171 7.610 1.00 0.46 H new ATOM 0 HB2 GLN A 123 8.517 8.481 9.756 1.00 0.60 H new ATOM 0 HB3 GLN A 123 7.287 7.377 9.173 1.00 0.60 H new ATOM 0 HG2 GLN A 123 9.085 5.612 8.868 1.00 1.17 H new ATOM 0 HG3 GLN A 123 10.242 6.717 9.584 1.00 1.17 H new ATOM 0 HE21 GLN A 123 9.357 7.743 11.809 1.00 3.15 H new ATOM 0 HE22 GLN A 123 8.611 6.577 12.907 1.00 3.15 H new ATOM 1819 N SER A 124 7.006 6.601 6.571 1.00 0.46 N ATOM 1820 CA SER A 124 6.574 5.437 5.807 1.00 0.54 C ATOM 1821 C SER A 124 7.017 5.592 4.349 1.00 0.52 C ATOM 1822 O SER A 124 7.670 4.724 3.770 1.00 0.62 O ATOM 1823 CB SER A 124 5.056 5.321 5.942 1.00 0.59 C ATOM 1824 OG SER A 124 4.690 4.786 7.200 1.00 1.24 O ATOM 0 H SER A 124 6.250 7.129 7.007 1.00 0.46 H new ATOM 0 HA SER A 124 7.027 4.521 6.185 1.00 0.54 H new ATOM 0 HB2 SER A 124 4.602 6.304 5.817 1.00 0.59 H new ATOM 0 HB3 SER A 124 4.666 4.686 5.147 1.00 0.59 H new ATOM 0 HG SER A 124 3.817 4.347 7.127 1.00 1.24 H new ATOM 1830 N LEU A 125 6.692 6.747 3.777 1.00 0.53 N ATOM 1831 CA LEU A 125 7.027 7.156 2.429 1.00 0.60 C ATOM 1832 C LEU A 125 8.527 7.265 2.211 1.00 0.53 C ATOM 1833 O LEU A 125 8.935 7.159 1.071 1.00 0.56 O ATOM 1834 CB LEU A 125 6.231 8.408 1.987 1.00 0.87 C ATOM 1835 CG LEU A 125 7.013 9.606 1.422 1.00 0.88 C ATOM 1836 CD1 LEU A 125 5.993 10.674 1.018 1.00 1.85 C ATOM 1837 CD2 LEU A 125 7.991 10.204 2.436 1.00 2.46 C ATOM 0 H LEU A 125 6.157 7.459 4.275 1.00 0.53 H new ATOM 0 HA LEU A 125 6.705 6.358 1.759 1.00 0.60 H new ATOM 0 HB2 LEU A 125 5.511 8.095 1.231 1.00 0.87 H new ATOM 0 HB3 LEU A 125 5.659 8.759 2.846 1.00 0.87 H new ATOM 0 HG LEU A 125 7.606 9.263 0.574 1.00 0.88 H new ATOM 0 HD11 LEU A 125 6.515 11.540 0.612 1.00 1.85 H new ATOM 0 HD12 LEU A 125 5.321 10.268 0.262 1.00 1.85 H new ATOM 0 HD13 LEU A 125 5.416 10.975 1.892 1.00 1.85 H new ATOM 0 HD21 LEU A 125 8.515 11.046 1.983 1.00 2.46 H new ATOM 0 HD22 LEU A 125 7.442 10.548 3.312 1.00 2.46 H new ATOM 0 HD23 LEU A 125 8.714 9.445 2.736 1.00 2.46 H new ATOM 1849 N SER A 126 9.387 7.442 3.218 1.00 0.47 N ATOM 1850 CA SER A 126 10.815 7.345 2.916 1.00 0.46 C ATOM 1851 C SER A 126 11.145 5.932 2.440 1.00 0.39 C ATOM 1852 O SER A 126 11.849 5.762 1.443 1.00 0.42 O ATOM 1853 CB SER A 126 11.682 7.725 4.115 1.00 0.50 C ATOM 1854 OG SER A 126 11.778 9.129 4.207 1.00 0.86 O ATOM 0 H SER A 126 9.142 7.640 4.188 1.00 0.47 H new ATOM 0 HA SER A 126 11.040 8.058 2.122 1.00 0.46 H new ATOM 0 HB2 SER A 126 11.251 7.320 5.030 1.00 0.50 H new ATOM 0 HB3 SER A 126 12.676 7.289 4.010 1.00 0.50 H new ATOM 0 HG SER A 126 10.992 9.481 4.676 1.00 0.86 H new ATOM 1860 N HIS A 127 10.628 4.908 3.122 1.00 0.33 N ATOM 1861 CA HIS A 127 10.927 3.538 2.731 1.00 0.32 C ATOM 1862 C HIS A 127 10.271 3.248 1.381 1.00 0.33 C ATOM 1863 O HIS A 127 10.896 2.691 0.479 1.00 0.51 O ATOM 1864 CB HIS A 127 10.444 2.568 3.812 1.00 0.35 C ATOM 1865 CG HIS A 127 10.929 2.918 5.196 1.00 0.66 C ATOM 1866 ND1 HIS A 127 12.197 2.736 5.703 1.00 1.01 N ATOM 1867 CD2 HIS A 127 10.178 3.528 6.162 1.00 1.04 C ATOM 1868 CE1 HIS A 127 12.200 3.232 6.955 1.00 1.26 C ATOM 1869 NE2 HIS A 127 10.995 3.732 7.271 1.00 1.32 N ATOM 0 H HIS A 127 10.013 5.002 3.931 1.00 0.33 H new ATOM 0 HA HIS A 127 12.004 3.405 2.627 1.00 0.32 H new ATOM 0 HB2 HIS A 127 9.354 2.550 3.812 1.00 0.35 H new ATOM 0 HB3 HIS A 127 10.780 1.562 3.562 1.00 0.35 H new ATOM 0 HD2 HIS A 127 9.137 3.803 6.080 1.00 1.04 H new ATOM 0 HE1 HIS A 127 13.055 3.228 7.615 1.00 1.26 H new ATOM 0 HE2 HIS A 127 10.730 4.175 8.151 1.00 1.32 H new ATOM 1877 N LEU A 128 9.003 3.645 1.230 1.00 0.32 N ATOM 1878 CA LEU A 128 8.278 3.448 -0.018 1.00 0.40 C ATOM 1879 C LEU A 128 8.917 4.230 -1.161 1.00 0.53 C ATOM 1880 O LEU A 128 8.818 3.810 -2.304 1.00 0.89 O ATOM 1881 CB LEU A 128 6.795 3.796 0.161 1.00 0.66 C ATOM 1882 CG LEU A 128 5.885 3.502 -1.046 1.00 0.96 C ATOM 1883 CD1 LEU A 128 5.842 4.677 -2.035 1.00 1.77 C ATOM 1884 CD2 LEU A 128 6.180 2.170 -1.754 1.00 2.09 C ATOM 0 H LEU A 128 8.461 4.105 1.962 1.00 0.32 H new ATOM 0 HA LEU A 128 8.339 2.394 -0.288 1.00 0.40 H new ATOM 0 HB2 LEU A 128 6.414 3.246 1.021 1.00 0.66 H new ATOM 0 HB3 LEU A 128 6.717 4.856 0.401 1.00 0.66 H new ATOM 0 HG LEU A 128 4.888 3.384 -0.622 1.00 0.96 H new ATOM 0 HD11 LEU A 128 5.188 4.426 -2.870 1.00 1.77 H new ATOM 0 HD12 LEU A 128 5.460 5.564 -1.530 1.00 1.77 H new ATOM 0 HD13 LEU A 128 6.847 4.876 -2.408 1.00 1.77 H new ATOM 0 HD21 LEU A 128 5.494 2.043 -2.591 1.00 2.09 H new ATOM 0 HD22 LEU A 128 7.206 2.173 -2.123 1.00 2.09 H new ATOM 0 HD23 LEU A 128 6.050 1.348 -1.051 1.00 2.09 H new ATOM 1896 N LEU A 129 9.569 5.357 -0.903 1.00 0.59 N ATOM 1897 CA LEU A 129 10.270 6.081 -1.950 1.00 0.70 C ATOM 1898 C LEU A 129 11.396 5.191 -2.436 1.00 0.56 C ATOM 1899 O LEU A 129 11.350 4.728 -3.565 1.00 0.66 O ATOM 1900 CB LEU A 129 10.764 7.450 -1.463 1.00 0.90 C ATOM 1901 CG LEU A 129 9.834 8.613 -1.852 1.00 1.00 C ATOM 1902 CD1 LEU A 129 8.328 8.303 -1.860 1.00 2.04 C ATOM 1903 CD2 LEU A 129 10.111 9.805 -0.932 1.00 3.47 C ATOM 0 H LEU A 129 9.626 5.787 0.020 1.00 0.59 H new ATOM 0 HA LEU A 129 9.597 6.304 -2.778 1.00 0.70 H new ATOM 0 HB2 LEU A 129 10.867 7.425 -0.378 1.00 0.90 H new ATOM 0 HB3 LEU A 129 11.756 7.636 -1.873 1.00 0.90 H new ATOM 0 HG LEU A 129 10.072 8.832 -2.893 1.00 1.00 H new ATOM 0 HD11 LEU A 129 7.774 9.196 -2.149 1.00 2.04 H new ATOM 0 HD12 LEU A 129 8.125 7.504 -2.573 1.00 2.04 H new ATOM 0 HD13 LEU A 129 8.016 7.989 -0.864 1.00 2.04 H new ATOM 0 HD21 LEU A 129 9.455 10.633 -1.202 1.00 3.47 H new ATOM 0 HD22 LEU A 129 9.925 9.517 0.103 1.00 3.47 H new ATOM 0 HD23 LEU A 129 11.150 10.115 -1.041 1.00 3.47 H new ATOM 1915 N ALA A 130 12.364 4.882 -1.575 1.00 0.54 N ATOM 1916 CA ALA A 130 13.515 4.067 -1.954 1.00 0.54 C ATOM 1917 C ALA A 130 13.133 2.743 -2.635 1.00 0.47 C ATOM 1918 O ALA A 130 13.902 2.221 -3.435 1.00 0.57 O ATOM 1919 CB ALA A 130 14.388 3.822 -0.723 1.00 0.70 C ATOM 0 H ALA A 130 12.372 5.187 -0.602 1.00 0.54 H new ATOM 0 HA ALA A 130 14.076 4.626 -2.703 1.00 0.54 H new ATOM 0 HB1 ALA A 130 15.248 3.214 -1.002 1.00 0.70 H new ATOM 0 HB2 ALA A 130 14.732 4.777 -0.325 1.00 0.70 H new ATOM 0 HB3 ALA A 130 13.807 3.301 0.037 1.00 0.70 H new ATOM 1925 N ALA A 131 11.968 2.180 -2.317 1.00 0.45 N ATOM 1926 CA ALA A 131 11.429 0.993 -2.953 1.00 0.52 C ATOM 1927 C ALA A 131 10.876 1.303 -4.343 1.00 0.47 C ATOM 1928 O ALA A 131 11.265 0.679 -5.321 1.00 0.45 O ATOM 1929 CB ALA A 131 10.304 0.427 -2.089 1.00 0.64 C ATOM 0 H ALA A 131 11.360 2.553 -1.588 1.00 0.45 H new ATOM 0 HA ALA A 131 12.237 0.269 -3.058 1.00 0.52 H new ATOM 0 HB1 ALA A 131 9.895 -0.466 -2.563 1.00 0.64 H new ATOM 0 HB2 ALA A 131 10.696 0.169 -1.105 1.00 0.64 H new ATOM 0 HB3 ALA A 131 9.517 1.173 -1.982 1.00 0.64 H new ATOM 1935 N MET A 132 9.903 2.201 -4.445 1.00 0.49 N ATOM 1936 CA MET A 132 9.166 2.425 -5.680 1.00 0.49 C ATOM 1937 C MET A 132 10.036 3.140 -6.714 1.00 0.52 C ATOM 1938 O MET A 132 9.752 3.091 -7.909 1.00 0.53 O ATOM 1939 CB MET A 132 7.894 3.218 -5.391 1.00 0.62 C ATOM 1940 CG MET A 132 6.757 2.806 -6.318 1.00 1.72 C ATOM 1941 SD MET A 132 5.910 1.293 -5.799 1.00 3.68 S ATOM 1942 CE MET A 132 4.368 1.600 -6.686 1.00 4.59 C ATOM 0 H MET A 132 9.603 2.795 -3.671 1.00 0.49 H new ATOM 0 HA MET A 132 8.885 1.459 -6.099 1.00 0.49 H new ATOM 0 HB2 MET A 132 7.594 3.062 -4.355 1.00 0.62 H new ATOM 0 HB3 MET A 132 8.093 4.283 -5.509 1.00 0.62 H new ATOM 0 HG2 MET A 132 6.032 3.618 -6.373 1.00 1.72 H new ATOM 0 HG3 MET A 132 7.153 2.664 -7.324 1.00 1.72 H new ATOM 0 HE1 MET A 132 4.034 0.679 -7.164 1.00 4.59 H new ATOM 0 HE2 MET A 132 3.607 1.941 -5.985 1.00 4.59 H new ATOM 0 HE3 MET A 132 4.531 2.365 -7.445 1.00 4.59 H new ATOM 1952 N ASP A 133 11.126 3.767 -6.267 1.00 0.54 N ATOM 1953 CA ASP A 133 12.169 4.325 -7.115 1.00 0.59 C ATOM 1954 C ASP A 133 12.687 3.245 -8.060 1.00 0.61 C ATOM 1955 O ASP A 133 13.052 3.523 -9.197 1.00 0.74 O ATOM 1956 CB ASP A 133 13.320 4.854 -6.246 1.00 0.64 C ATOM 1957 CG ASP A 133 14.085 5.971 -6.948 1.00 0.93 C ATOM 1958 OD1 ASP A 133 13.480 7.062 -7.075 1.00 2.13 O ATOM 1959 OD2 ASP A 133 15.264 5.745 -7.292 1.00 1.37 O ATOM 0 H ASP A 133 11.308 3.902 -5.273 1.00 0.54 H new ATOM 0 HA ASP A 133 11.758 5.149 -7.699 1.00 0.59 H new ATOM 0 HB2 ASP A 133 12.923 5.223 -5.300 1.00 0.64 H new ATOM 0 HB3 ASP A 133 14.003 4.038 -6.009 1.00 0.64 H new ATOM 1964 N THR A 134 12.701 1.991 -7.594 1.00 0.52 N ATOM 1965 CA THR A 134 13.285 0.894 -8.348 1.00 0.52 C ATOM 1966 C THR A 134 12.354 0.378 -9.463 1.00 0.47 C ATOM 1967 O THR A 134 12.685 -0.611 -10.114 1.00 0.69 O ATOM 1968 CB THR A 134 13.753 -0.219 -7.383 1.00 0.56 C ATOM 1969 OG1 THR A 134 12.714 -1.083 -6.975 1.00 0.57 O ATOM 1970 CG2 THR A 134 14.415 0.343 -6.112 1.00 0.63 C ATOM 0 H THR A 134 12.310 1.717 -6.692 1.00 0.52 H new ATOM 0 HA THR A 134 14.164 1.269 -8.873 1.00 0.52 H new ATOM 0 HB THR A 134 14.479 -0.783 -7.968 1.00 0.56 H new ATOM 0 HG1 THR A 134 12.106 -0.603 -6.374 1.00 0.57 H new ATOM 0 HG21 THR A 134 14.725 -0.480 -5.469 1.00 0.63 H new ATOM 0 HG22 THR A 134 15.287 0.936 -6.388 1.00 0.63 H new ATOM 0 HG23 THR A 134 13.702 0.972 -5.578 1.00 0.63 H new ATOM 1978 N THR A 135 11.190 1.001 -9.694 1.00 0.39 N ATOM 1979 CA THR A 135 10.215 0.496 -10.655 1.00 0.49 C ATOM 1980 C THR A 135 10.360 1.181 -12.016 1.00 0.72 C ATOM 1981 O THR A 135 11.314 1.917 -12.259 1.00 1.04 O ATOM 1982 CB THR A 135 8.793 0.676 -10.111 1.00 0.51 C ATOM 1983 OG1 THR A 135 8.354 2.016 -10.182 1.00 0.47 O ATOM 1984 CG2 THR A 135 8.669 0.164 -8.681 1.00 0.69 C ATOM 0 H THR A 135 10.905 1.860 -9.223 1.00 0.39 H new ATOM 0 HA THR A 135 10.407 -0.567 -10.800 1.00 0.49 H new ATOM 0 HB THR A 135 8.147 0.078 -10.754 1.00 0.51 H new ATOM 0 HG1 THR A 135 8.754 2.530 -9.450 1.00 0.47 H new ATOM 0 HG21 THR A 135 7.647 0.309 -8.330 1.00 0.69 H new ATOM 0 HG22 THR A 135 8.916 -0.897 -8.652 1.00 0.69 H new ATOM 0 HG23 THR A 135 9.355 0.714 -8.037 1.00 0.69 H new ATOM 1992 N GLU A 136 9.385 0.969 -12.905 1.00 0.85 N ATOM 1993 CA GLU A 136 9.334 1.647 -14.190 1.00 1.17 C ATOM 1994 C GLU A 136 7.900 2.123 -14.472 1.00 1.15 C ATOM 1995 O GLU A 136 7.475 2.170 -15.622 1.00 1.71 O ATOM 1996 CB GLU A 136 9.869 0.704 -15.280 1.00 1.60 C ATOM 1997 CG GLU A 136 10.506 1.501 -16.432 1.00 2.03 C ATOM 1998 CD GLU A 136 10.010 1.082 -17.817 1.00 3.06 C ATOM 1999 OE1 GLU A 136 9.969 -0.143 -18.069 1.00 3.92 O ATOM 2000 OE2 GLU A 136 9.730 1.999 -18.623 1.00 3.68 O ATOM 0 H GLU A 136 8.612 0.322 -12.748 1.00 0.85 H new ATOM 0 HA GLU A 136 9.967 2.534 -14.180 1.00 1.17 H new ATOM 0 HB2 GLU A 136 10.607 0.026 -14.850 1.00 1.60 H new ATOM 0 HB3 GLU A 136 9.056 0.088 -15.665 1.00 1.60 H new ATOM 0 HG2 GLU A 136 10.299 2.561 -16.287 1.00 2.03 H new ATOM 0 HG3 GLU A 136 11.588 1.379 -16.391 1.00 2.03 H new ATOM 2007 N ALA A 137 7.139 2.489 -13.431 1.00 0.61 N ATOM 2008 CA ALA A 137 5.737 2.871 -13.584 1.00 0.64 C ATOM 2009 C ALA A 137 5.456 4.127 -12.771 1.00 0.68 C ATOM 2010 O ALA A 137 6.045 4.301 -11.708 1.00 0.94 O ATOM 2011 CB ALA A 137 4.848 1.731 -13.092 1.00 0.70 C ATOM 0 H ALA A 137 7.478 2.527 -12.470 1.00 0.61 H new ATOM 0 HA ALA A 137 5.526 3.071 -14.635 1.00 0.64 H new ATOM 0 HB1 ALA A 137 3.801 2.012 -13.204 1.00 0.70 H new ATOM 0 HB2 ALA A 137 5.048 0.834 -13.679 1.00 0.70 H new ATOM 0 HB3 ALA A 137 5.060 1.532 -12.041 1.00 0.70 H new ATOM 2017 N ARG A 138 4.576 5.009 -13.262 1.00 0.58 N ATOM 2018 CA ARG A 138 4.240 6.256 -12.577 1.00 0.62 C ATOM 2019 C ARG A 138 3.814 5.952 -11.141 1.00 0.59 C ATOM 2020 O ARG A 138 3.193 4.917 -10.905 1.00 0.65 O ATOM 2021 CB ARG A 138 3.132 6.984 -13.354 1.00 0.79 C ATOM 2022 CG ARG A 138 2.853 8.377 -12.773 1.00 1.20 C ATOM 2023 CD ARG A 138 1.724 9.076 -13.532 1.00 1.53 C ATOM 2024 NE ARG A 138 2.187 9.705 -14.780 1.00 1.56 N ATOM 2025 CZ ARG A 138 1.404 10.436 -15.585 1.00 2.06 C ATOM 2026 NH1 ARG A 138 1.926 11.091 -16.623 1.00 2.47 N ATOM 2027 NH2 ARG A 138 0.096 10.516 -15.340 1.00 2.85 N ATOM 0 H ARG A 138 4.080 4.875 -14.143 1.00 0.58 H new ATOM 0 HA ARG A 138 5.111 6.910 -12.538 1.00 0.62 H new ATOM 0 HB2 ARG A 138 3.423 7.078 -14.400 1.00 0.79 H new ATOM 0 HB3 ARG A 138 2.219 6.389 -13.329 1.00 0.79 H new ATOM 0 HG2 ARG A 138 2.586 8.288 -11.720 1.00 1.20 H new ATOM 0 HG3 ARG A 138 3.758 8.983 -12.823 1.00 1.20 H new ATOM 0 HD2 ARG A 138 0.943 8.352 -13.762 1.00 1.53 H new ATOM 0 HD3 ARG A 138 1.276 9.835 -12.891 1.00 1.53 H new ATOM 0 HE ARG A 138 3.163 9.577 -15.048 1.00 1.56 H new ATOM 0 HH11 ARG A 138 2.928 11.037 -16.808 1.00 2.47 H new ATOM 0 HH12 ARG A 138 1.324 11.645 -17.231 1.00 2.47 H new ATOM 0 HH21 ARG A 138 -0.305 10.022 -14.543 1.00 2.85 H new ATOM 0 HH22 ARG A 138 -0.504 11.071 -15.950 1.00 2.85 H new ATOM 2041 N VAL A 139 4.129 6.845 -10.198 1.00 0.62 N ATOM 2042 CA VAL A 139 3.921 6.595 -8.787 1.00 0.63 C ATOM 2043 C VAL A 139 3.052 7.723 -8.264 1.00 0.60 C ATOM 2044 O VAL A 139 3.353 8.902 -8.446 1.00 0.93 O ATOM 2045 CB VAL A 139 5.261 6.486 -8.026 1.00 0.71 C ATOM 2046 CG1 VAL A 139 4.967 6.024 -6.599 1.00 1.07 C ATOM 2047 CG2 VAL A 139 6.190 5.465 -8.687 1.00 0.90 C ATOM 0 H VAL A 139 4.535 7.758 -10.401 1.00 0.62 H new ATOM 0 HA VAL A 139 3.425 5.637 -8.632 1.00 0.63 H new ATOM 0 HB VAL A 139 5.751 7.459 -8.036 1.00 0.71 H new ATOM 0 HG11 VAL A 139 5.901 5.940 -6.044 1.00 1.07 H new ATOM 0 HG12 VAL A 139 4.317 6.749 -6.109 1.00 1.07 H new ATOM 0 HG13 VAL A 139 4.473 5.053 -6.626 1.00 1.07 H new ATOM 0 HG21 VAL A 139 7.125 5.410 -8.130 1.00 0.90 H new ATOM 0 HG22 VAL A 139 5.711 4.486 -8.690 1.00 0.90 H new ATOM 0 HG23 VAL A 139 6.396 5.771 -9.713 1.00 0.90 H new ATOM 2057 N THR A 140 1.960 7.372 -7.604 1.00 0.36 N ATOM 2058 CA THR A 140 0.987 8.352 -7.206 1.00 0.38 C ATOM 2059 C THR A 140 0.602 8.020 -5.780 1.00 0.31 C ATOM 2060 O THR A 140 0.058 6.949 -5.529 1.00 0.32 O ATOM 2061 CB THR A 140 -0.173 8.235 -8.187 1.00 0.46 C ATOM 2062 OG1 THR A 140 0.292 8.109 -9.514 1.00 0.65 O ATOM 2063 CG2 THR A 140 -1.027 9.485 -8.099 1.00 0.53 C ATOM 0 H THR A 140 1.734 6.414 -7.337 1.00 0.36 H new ATOM 0 HA THR A 140 1.344 9.382 -7.228 1.00 0.38 H new ATOM 0 HB THR A 140 -0.750 7.347 -7.927 1.00 0.46 H new ATOM 0 HG1 THR A 140 -0.462 8.194 -10.134 1.00 0.65 H new ATOM 0 HG21 THR A 140 -1.859 9.407 -8.799 1.00 0.53 H new ATOM 0 HG22 THR A 140 -1.414 9.591 -7.086 1.00 0.53 H new ATOM 0 HG23 THR A 140 -0.423 10.357 -8.349 1.00 0.53 H new ATOM 2071 N ILE A 141 0.943 8.889 -4.828 1.00 0.30 N ATOM 2072 CA ILE A 141 0.687 8.607 -3.432 1.00 0.29 C ATOM 2073 C ILE A 141 -0.771 8.981 -3.156 1.00 0.31 C ATOM 2074 O ILE A 141 -1.263 9.997 -3.654 1.00 0.38 O ATOM 2075 CB ILE A 141 1.709 9.350 -2.544 1.00 0.34 C ATOM 2076 CG1 ILE A 141 2.099 8.530 -1.300 1.00 0.38 C ATOM 2077 CG2 ILE A 141 1.223 10.718 -2.079 1.00 0.41 C ATOM 2078 CD1 ILE A 141 3.500 7.933 -1.458 1.00 0.59 C ATOM 0 H ILE A 141 1.394 9.786 -5.005 1.00 0.30 H new ATOM 0 HA ILE A 141 0.818 7.552 -3.192 1.00 0.29 H new ATOM 0 HB ILE A 141 2.578 9.489 -3.187 1.00 0.34 H new ATOM 0 HG12 ILE A 141 2.068 9.166 -0.415 1.00 0.38 H new ATOM 0 HG13 ILE A 141 1.374 7.731 -1.144 1.00 0.38 H new ATOM 0 HG21 ILE A 141 1.989 11.185 -1.460 1.00 0.41 H new ATOM 0 HG22 ILE A 141 1.024 11.347 -2.946 1.00 0.41 H new ATOM 0 HG23 ILE A 141 0.308 10.601 -1.498 1.00 0.41 H new ATOM 0 HD11 ILE A 141 3.753 7.358 -0.567 1.00 0.59 H new ATOM 0 HD12 ILE A 141 3.521 7.279 -2.330 1.00 0.59 H new ATOM 0 HD13 ILE A 141 4.225 8.736 -1.590 1.00 0.59 H new ATOM 2090 N TYR A 142 -1.457 8.168 -2.356 1.00 0.33 N ATOM 2091 CA TYR A 142 -2.853 8.379 -2.003 1.00 0.41 C ATOM 2092 C TYR A 142 -2.999 8.305 -0.492 1.00 0.52 C ATOM 2093 O TYR A 142 -2.164 7.730 0.211 1.00 0.51 O ATOM 2094 CB TYR A 142 -3.741 7.314 -2.658 1.00 0.46 C ATOM 2095 CG TYR A 142 -4.049 7.557 -4.121 1.00 0.49 C ATOM 2096 CD1 TYR A 142 -3.098 7.220 -5.095 1.00 0.51 C ATOM 2097 CD2 TYR A 142 -5.291 8.090 -4.516 1.00 0.66 C ATOM 2098 CE1 TYR A 142 -3.360 7.445 -6.455 1.00 0.62 C ATOM 2099 CE2 TYR A 142 -5.562 8.316 -5.878 1.00 0.81 C ATOM 2100 CZ TYR A 142 -4.582 8.025 -6.853 1.00 0.78 C ATOM 2101 OH TYR A 142 -4.799 8.298 -8.171 1.00 1.00 O ATOM 0 H TYR A 142 -1.051 7.334 -1.931 1.00 0.33 H new ATOM 0 HA TYR A 142 -3.167 9.359 -2.361 1.00 0.41 H new ATOM 0 HB2 TYR A 142 -3.254 6.344 -2.560 1.00 0.46 H new ATOM 0 HB3 TYR A 142 -4.680 7.256 -2.108 1.00 0.46 H new ATOM 0 HD1 TYR A 142 -2.156 6.784 -4.796 1.00 0.51 H new ATOM 0 HD2 TYR A 142 -6.037 8.326 -3.772 1.00 0.66 H new ATOM 0 HE1 TYR A 142 -2.625 7.174 -7.198 1.00 0.62 H new ATOM 0 HE2 TYR A 142 -6.521 8.713 -6.179 1.00 0.81 H new ATOM 0 HH TYR A 142 -4.136 7.826 -8.716 1.00 1.00 H new ATOM 2111 N CYS A 143 -4.097 8.865 0.007 1.00 0.79 N ATOM 2112 CA CYS A 143 -4.504 8.707 1.387 1.00 1.00 C ATOM 2113 C CYS A 143 -6.015 8.913 1.461 1.00 1.13 C ATOM 2114 O CYS A 143 -6.658 9.118 0.434 1.00 2.19 O ATOM 2115 CB CYS A 143 -3.742 9.713 2.253 1.00 1.11 C ATOM 2116 SG CYS A 143 -3.414 8.957 3.865 1.00 2.65 S ATOM 0 H CYS A 143 -4.730 9.444 -0.545 1.00 0.79 H new ATOM 0 HA CYS A 143 -4.271 7.710 1.762 1.00 1.00 H new ATOM 0 HB2 CYS A 143 -2.806 9.995 1.770 1.00 1.11 H new ATOM 0 HB3 CYS A 143 -4.326 10.625 2.375 1.00 1.11 H new ATOM 0 HG CYS A 143 -3.678 9.813 4.807 1.00 2.65 H new ATOM 2122 N ARG A 144 -6.595 8.877 2.661 1.00 1.34 N ATOM 2123 CA ARG A 144 -8.007 9.216 2.816 1.00 1.42 C ATOM 2124 C ARG A 144 -8.201 10.660 2.355 1.00 1.31 C ATOM 2125 O ARG A 144 -7.446 11.537 2.776 1.00 2.14 O ATOM 2126 CB ARG A 144 -8.444 9.015 4.276 1.00 1.78 C ATOM 2127 CG ARG A 144 -8.788 7.540 4.529 1.00 1.95 C ATOM 2128 CD ARG A 144 -9.043 7.259 6.016 1.00 2.33 C ATOM 2129 NE ARG A 144 -9.626 5.919 6.234 1.00 3.08 N ATOM 2130 CZ ARG A 144 -9.876 5.363 7.431 1.00 3.73 C ATOM 2131 NH1 ARG A 144 -10.468 4.169 7.520 1.00 4.69 N ATOM 2132 NH2 ARG A 144 -9.526 6.006 8.546 1.00 4.09 N ATOM 0 H ARG A 144 -6.118 8.621 3.525 1.00 1.34 H new ATOM 0 HA ARG A 144 -8.631 8.562 2.207 1.00 1.42 H new ATOM 0 HB2 ARG A 144 -7.646 9.330 4.949 1.00 1.78 H new ATOM 0 HB3 ARG A 144 -9.310 9.640 4.493 1.00 1.78 H new ATOM 0 HG2 ARG A 144 -9.672 7.269 3.952 1.00 1.95 H new ATOM 0 HG3 ARG A 144 -7.971 6.911 4.175 1.00 1.95 H new ATOM 0 HD2 ARG A 144 -8.106 7.340 6.566 1.00 2.33 H new ATOM 0 HD3 ARG A 144 -9.716 8.017 6.418 1.00 2.33 H new ATOM 0 HE ARG A 144 -9.858 5.370 5.406 1.00 3.08 H new ATOM 0 HH11 ARG A 144 -10.736 3.668 6.673 1.00 4.69 H new ATOM 0 HH12 ARG A 144 -10.652 3.758 8.435 1.00 4.69 H new ATOM 0 HH21 ARG A 144 -9.070 6.917 8.488 1.00 4.09 H new ATOM 0 HH22 ARG A 144 -9.714 5.587 9.457 1.00 4.09 H new ATOM 2146 N ASP A 145 -9.188 10.902 1.486 1.00 1.45 N ATOM 2147 CA ASP A 145 -9.435 12.233 0.948 1.00 1.43 C ATOM 2148 C ASP A 145 -9.807 13.170 2.089 1.00 1.68 C ATOM 2149 O ASP A 145 -10.891 13.054 2.656 1.00 2.81 O ATOM 2150 CB ASP A 145 -10.539 12.211 -0.111 1.00 2.46 C ATOM 2151 CG ASP A 145 -10.523 13.540 -0.859 1.00 3.74 C ATOM 2152 OD1 ASP A 145 -10.098 13.516 -2.030 1.00 5.09 O ATOM 2153 OD2 ASP A 145 -10.776 14.593 -0.233 1.00 4.27 O ATOM 0 H ASP A 145 -9.828 10.186 1.142 1.00 1.45 H new ATOM 0 HA ASP A 145 -8.527 12.590 0.462 1.00 1.43 H new ATOM 0 HB2 ASP A 145 -10.382 11.385 -0.804 1.00 2.46 H new ATOM 0 HB3 ASP A 145 -11.510 12.053 0.358 1.00 2.46 H new ATOM 2158 N LYS A 146 -8.868 14.030 2.488 1.00 1.26 N ATOM 2159 CA LYS A 146 -8.970 14.929 3.625 1.00 1.90 C ATOM 2160 C LYS A 146 -7.654 15.705 3.730 1.00 1.50 C ATOM 2161 O LYS A 146 -6.754 15.532 2.909 1.00 1.46 O ATOM 2162 CB LYS A 146 -9.217 14.114 4.918 1.00 2.75 C ATOM 2163 CG LYS A 146 -10.437 14.617 5.695 1.00 3.10 C ATOM 2164 CD LYS A 146 -11.741 13.944 5.248 1.00 3.86 C ATOM 2165 CE LYS A 146 -12.850 14.130 6.287 1.00 4.39 C ATOM 2166 NZ LYS A 146 -13.784 12.982 6.289 1.00 5.71 N ATOM 0 H LYS A 146 -7.976 14.118 2.000 1.00 1.26 H new ATOM 0 HA LYS A 146 -9.803 15.620 3.494 1.00 1.90 H new ATOM 0 HB2 LYS A 146 -9.359 13.064 4.662 1.00 2.75 H new ATOM 0 HB3 LYS A 146 -8.334 14.170 5.555 1.00 2.75 H new ATOM 0 HG2 LYS A 146 -10.285 14.436 6.759 1.00 3.10 H new ATOM 0 HG3 LYS A 146 -10.526 15.696 5.565 1.00 3.10 H new ATOM 0 HD2 LYS A 146 -12.060 14.363 4.294 1.00 3.86 H new ATOM 0 HD3 LYS A 146 -11.566 12.880 5.086 1.00 3.86 H new ATOM 0 HE2 LYS A 146 -12.408 14.244 7.277 1.00 4.39 H new ATOM 0 HE3 LYS A 146 -13.399 15.048 6.076 1.00 4.39 H new ATOM 0 HZ1 LYS A 146 -14.524 13.138 7.003 1.00 5.71 H new ATOM 0 HZ2 LYS A 146 -14.223 12.890 5.351 1.00 5.71 H new ATOM 0 HZ3 LYS A 146 -13.263 12.111 6.515 1.00 5.71 H new ATOM 2180 N THR A 147 -7.481 16.451 4.820 1.00 1.44 N ATOM 2181 CA THR A 147 -6.202 16.998 5.266 1.00 1.38 C ATOM 2182 C THR A 147 -5.093 15.942 5.398 1.00 1.52 C ATOM 2183 O THR A 147 -3.918 16.298 5.478 1.00 1.64 O ATOM 2184 CB THR A 147 -6.466 17.767 6.571 1.00 1.66 C ATOM 2185 OG1 THR A 147 -7.063 18.988 6.195 1.00 2.05 O ATOM 2186 CG2 THR A 147 -5.243 18.029 7.453 1.00 1.99 C ATOM 0 H THR A 147 -8.254 16.699 5.437 1.00 1.44 H new ATOM 0 HA THR A 147 -5.809 17.675 4.507 1.00 1.38 H new ATOM 0 HB THR A 147 -7.103 17.143 7.198 1.00 1.66 H new ATOM 0 HG1 THR A 147 -7.254 19.519 6.996 1.00 2.05 H new ATOM 0 HG21 THR A 147 -5.548 18.577 8.344 1.00 1.99 H new ATOM 0 HG22 THR A 147 -4.796 17.079 7.746 1.00 1.99 H new ATOM 0 HG23 THR A 147 -4.513 18.617 6.897 1.00 1.99 H new ATOM 2194 N TRP A 148 -5.411 14.640 5.391 1.00 1.65 N ATOM 2195 CA TRP A 148 -4.365 13.632 5.333 1.00 1.81 C ATOM 2196 C TRP A 148 -3.488 13.839 4.102 1.00 1.53 C ATOM 2197 O TRP A 148 -2.268 13.734 4.206 1.00 1.65 O ATOM 2198 CB TRP A 148 -4.925 12.207 5.405 1.00 2.06 C ATOM 2199 CG TRP A 148 -4.542 11.482 6.660 1.00 2.28 C ATOM 2200 CD1 TRP A 148 -3.448 10.703 6.821 1.00 2.94 C ATOM 2201 CD2 TRP A 148 -5.227 11.475 7.946 1.00 2.47 C ATOM 2202 NE1 TRP A 148 -3.426 10.189 8.103 1.00 3.19 N ATOM 2203 CE2 TRP A 148 -4.494 10.646 8.846 1.00 2.78 C ATOM 2204 CE3 TRP A 148 -6.389 12.098 8.444 1.00 3.07 C ATOM 2205 CZ2 TRP A 148 -4.892 10.447 10.174 1.00 3.10 C ATOM 2206 CZ3 TRP A 148 -6.802 11.903 9.775 1.00 3.69 C ATOM 2207 CH2 TRP A 148 -6.057 11.079 10.639 1.00 3.49 C ATOM 0 H TRP A 148 -6.363 14.275 5.424 1.00 1.65 H new ATOM 0 HA TRP A 148 -3.739 13.756 6.217 1.00 1.81 H new ATOM 0 HB2 TRP A 148 -6.012 12.247 5.334 1.00 2.06 H new ATOM 0 HB3 TRP A 148 -4.570 11.641 4.544 1.00 2.06 H new ATOM 0 HD1 TRP A 148 -2.704 10.512 6.062 1.00 2.94 H new ATOM 0 HE1 TRP A 148 -2.711 9.553 8.455 1.00 3.19 H new ATOM 0 HE3 TRP A 148 -6.971 12.735 7.794 1.00 3.07 H new ATOM 0 HZ2 TRP A 148 -4.311 9.817 10.831 1.00 3.10 H new ATOM 0 HZ3 TRP A 148 -7.697 12.389 10.136 1.00 3.69 H new ATOM 0 HH2 TRP A 148 -6.381 10.933 11.659 1.00 3.49 H new ATOM 2218 N GLU A 149 -4.091 14.168 2.957 1.00 1.27 N ATOM 2219 CA GLU A 149 -3.321 14.562 1.792 1.00 1.05 C ATOM 2220 C GLU A 149 -2.481 15.789 2.103 1.00 1.17 C ATOM 2221 O GLU A 149 -1.306 15.757 1.784 1.00 1.31 O ATOM 2222 CB GLU A 149 -4.208 14.756 0.560 1.00 1.04 C ATOM 2223 CG GLU A 149 -3.595 15.707 -0.490 1.00 2.25 C ATOM 2224 CD GLU A 149 -3.928 17.200 -0.269 1.00 3.58 C ATOM 2225 OE1 GLU A 149 -4.902 17.501 0.470 1.00 4.36 O ATOM 2226 OE2 GLU A 149 -3.197 18.041 -0.838 1.00 4.65 O ATOM 0 H GLU A 149 -5.102 14.167 2.820 1.00 1.27 H new ATOM 0 HA GLU A 149 -2.638 13.750 1.544 1.00 1.05 H new ATOM 0 HB2 GLU A 149 -4.393 13.786 0.098 1.00 1.04 H new ATOM 0 HB3 GLU A 149 -5.175 15.149 0.875 1.00 1.04 H new ATOM 0 HG2 GLU A 149 -2.512 15.584 -0.486 1.00 2.25 H new ATOM 0 HG3 GLU A 149 -3.945 15.411 -1.479 1.00 2.25 H new ATOM 2233 N GLN A 150 -3.026 16.860 2.690 1.00 1.27 N ATOM 2234 CA GLN A 150 -2.258 18.095 2.847 1.00 1.40 C ATOM 2235 C GLN A 150 -0.882 17.845 3.468 1.00 1.35 C ATOM 2236 O GLN A 150 0.115 18.371 2.970 1.00 1.37 O ATOM 2237 CB GLN A 150 -3.014 19.160 3.651 1.00 1.58 C ATOM 2238 CG GLN A 150 -4.151 19.807 2.846 1.00 2.65 C ATOM 2239 CD GLN A 150 -4.282 21.300 3.143 1.00 2.41 C ATOM 2240 OE1 GLN A 150 -4.008 21.760 4.243 1.00 2.45 O ATOM 2241 NE2 GLN A 150 -4.690 22.093 2.159 1.00 2.82 N ATOM 0 H GLN A 150 -3.977 16.896 3.057 1.00 1.27 H new ATOM 0 HA GLN A 150 -2.112 18.479 1.837 1.00 1.40 H new ATOM 0 HB2 GLN A 150 -3.424 18.706 4.553 1.00 1.58 H new ATOM 0 HB3 GLN A 150 -2.315 19.932 3.972 1.00 1.58 H new ATOM 0 HG2 GLN A 150 -3.969 19.663 1.781 1.00 2.65 H new ATOM 0 HG3 GLN A 150 -5.091 19.307 3.079 1.00 2.65 H new ATOM 0 HE21 GLN A 150 -4.916 21.698 1.246 1.00 2.82 H new ATOM 0 HE22 GLN A 150 -4.778 23.097 2.316 1.00 2.82 H new ATOM 2250 N LYS A 151 -0.792 17.037 4.531 1.00 1.31 N ATOM 2251 CA LYS A 151 0.517 16.770 5.125 1.00 1.26 C ATOM 2252 C LYS A 151 1.433 16.070 4.111 1.00 1.07 C ATOM 2253 O LYS A 151 2.619 16.368 4.019 1.00 1.12 O ATOM 2254 CB LYS A 151 0.375 16.039 6.471 1.00 1.31 C ATOM 2255 CG LYS A 151 0.380 14.510 6.364 1.00 3.12 C ATOM 2256 CD LYS A 151 -0.107 13.843 7.654 1.00 3.46 C ATOM 2257 CE LYS A 151 -1.636 13.818 7.688 1.00 4.44 C ATOM 2258 NZ LYS A 151 -2.163 13.021 8.820 1.00 5.64 N ATOM 0 H LYS A 151 -1.580 16.573 4.982 1.00 1.31 H new ATOM 0 HA LYS A 151 1.009 17.712 5.366 1.00 1.26 H new ATOM 0 HB2 LYS A 151 1.189 16.348 7.126 1.00 1.31 H new ATOM 0 HB3 LYS A 151 -0.554 16.355 6.946 1.00 1.31 H new ATOM 0 HG2 LYS A 151 -0.257 14.203 5.534 1.00 3.12 H new ATOM 0 HG3 LYS A 151 1.389 14.166 6.136 1.00 3.12 H new ATOM 0 HD2 LYS A 151 0.283 12.827 7.717 1.00 3.46 H new ATOM 0 HD3 LYS A 151 0.275 14.385 8.519 1.00 3.46 H new ATOM 0 HE2 LYS A 151 -2.012 14.839 7.760 1.00 4.44 H new ATOM 0 HE3 LYS A 151 -2.011 13.406 6.751 1.00 4.44 H new ATOM 0 HZ1 LYS A 151 -2.744 12.240 8.454 1.00 5.64 H new ATOM 0 HZ2 LYS A 151 -1.370 12.634 9.371 1.00 5.64 H new ATOM 0 HZ3 LYS A 151 -2.745 13.629 9.431 1.00 5.64 H new ATOM 2272 N ILE A 152 0.890 15.146 3.319 1.00 0.91 N ATOM 2273 CA ILE A 152 1.639 14.446 2.286 1.00 0.80 C ATOM 2274 C ILE A 152 2.072 15.406 1.172 1.00 0.89 C ATOM 2275 O ILE A 152 3.163 15.255 0.636 1.00 0.93 O ATOM 2276 CB ILE A 152 0.812 13.269 1.743 1.00 0.75 C ATOM 2277 CG1 ILE A 152 0.525 12.247 2.855 1.00 0.85 C ATOM 2278 CG2 ILE A 152 1.586 12.563 0.630 1.00 0.89 C ATOM 2279 CD1 ILE A 152 -0.652 11.328 2.527 1.00 1.15 C ATOM 0 H ILE A 152 -0.088 14.863 3.380 1.00 0.91 H new ATOM 0 HA ILE A 152 2.551 14.041 2.724 1.00 0.80 H new ATOM 0 HB ILE A 152 -0.129 13.665 1.361 1.00 0.75 H new ATOM 0 HG12 ILE A 152 1.416 11.642 3.025 1.00 0.85 H new ATOM 0 HG13 ILE A 152 0.318 12.777 3.785 1.00 0.85 H new ATOM 0 HG21 ILE A 152 0.996 11.730 0.249 1.00 0.89 H new ATOM 0 HG22 ILE A 152 1.785 13.267 -0.178 1.00 0.89 H new ATOM 0 HG23 ILE A 152 2.530 12.188 1.025 1.00 0.89 H new ATOM 0 HD11 ILE A 152 -0.807 10.628 3.348 1.00 1.15 H new ATOM 0 HD12 ILE A 152 -1.552 11.926 2.385 1.00 1.15 H new ATOM 0 HD13 ILE A 152 -0.437 10.773 1.614 1.00 1.15 H new ATOM 2291 N LYS A 153 1.251 16.391 0.811 1.00 1.00 N ATOM 2292 CA LYS A 153 1.550 17.377 -0.218 1.00 1.16 C ATOM 2293 C LYS A 153 2.805 18.135 0.176 1.00 1.15 C ATOM 2294 O LYS A 153 3.749 18.202 -0.609 1.00 1.18 O ATOM 2295 CB LYS A 153 0.348 18.315 -0.410 1.00 1.35 C ATOM 2296 CG LYS A 153 0.624 19.404 -1.452 1.00 1.47 C ATOM 2297 CD LYS A 153 -0.605 20.302 -1.608 1.00 1.87 C ATOM 2298 CE LYS A 153 -0.292 21.422 -2.604 1.00 1.97 C ATOM 2299 NZ LYS A 153 -1.445 22.330 -2.784 1.00 2.77 N ATOM 0 H LYS A 153 0.335 16.526 1.240 1.00 1.00 H new ATOM 0 HA LYS A 153 1.733 16.886 -1.174 1.00 1.16 H new ATOM 0 HB2 LYS A 153 -0.520 17.732 -0.718 1.00 1.35 H new ATOM 0 HB3 LYS A 153 0.097 18.781 0.543 1.00 1.35 H new ATOM 0 HG2 LYS A 153 1.484 20.000 -1.148 1.00 1.47 H new ATOM 0 HG3 LYS A 153 0.875 18.948 -2.409 1.00 1.47 H new ATOM 0 HD2 LYS A 153 -1.455 19.716 -1.958 1.00 1.87 H new ATOM 0 HD3 LYS A 153 -0.885 20.726 -0.643 1.00 1.87 H new ATOM 0 HE2 LYS A 153 0.569 21.991 -2.253 1.00 1.97 H new ATOM 0 HE3 LYS A 153 -0.017 20.988 -3.565 1.00 1.97 H new ATOM 0 HZ1 LYS A 153 -1.197 23.076 -3.465 1.00 2.77 H new ATOM 0 HZ2 LYS A 153 -2.259 21.791 -3.143 1.00 2.77 H new ATOM 0 HZ3 LYS A 153 -1.692 22.763 -1.871 1.00 2.77 H new ATOM 2313 N THR A 154 2.826 18.714 1.380 1.00 1.16 N ATOM 2314 CA THR A 154 4.018 19.428 1.812 1.00 1.17 C ATOM 2315 C THR A 154 5.223 18.494 1.804 1.00 1.10 C ATOM 2316 O THR A 154 6.272 18.911 1.337 1.00 1.16 O ATOM 2317 CB THR A 154 3.817 20.186 3.136 1.00 1.19 C ATOM 2318 OG1 THR A 154 5.021 20.770 3.577 1.00 2.13 O ATOM 2319 CG2 THR A 154 3.290 19.336 4.288 1.00 2.51 C ATOM 0 H THR A 154 2.056 18.702 2.049 1.00 1.16 H new ATOM 0 HA THR A 154 4.224 20.218 1.090 1.00 1.17 H new ATOM 0 HB THR A 154 3.063 20.934 2.891 1.00 1.19 H new ATOM 0 HG1 THR A 154 4.864 21.246 4.419 1.00 2.13 H new ATOM 0 HG21 THR A 154 3.181 19.956 5.178 1.00 2.51 H new ATOM 0 HG22 THR A 154 2.321 18.916 4.017 1.00 2.51 H new ATOM 0 HG23 THR A 154 3.991 18.527 4.494 1.00 2.51 H new ATOM 2327 N VAL A 155 5.098 17.236 2.238 1.00 1.03 N ATOM 2328 CA VAL A 155 6.230 16.312 2.262 1.00 1.03 C ATOM 2329 C VAL A 155 6.784 16.101 0.855 1.00 1.02 C ATOM 2330 O VAL A 155 7.991 16.170 0.644 1.00 1.09 O ATOM 2331 CB VAL A 155 5.799 14.995 2.926 1.00 1.07 C ATOM 2332 CG1 VAL A 155 6.804 13.862 2.712 1.00 1.02 C ATOM 2333 CG2 VAL A 155 5.667 15.235 4.428 1.00 1.73 C ATOM 0 H VAL A 155 4.223 16.837 2.577 1.00 1.03 H new ATOM 0 HA VAL A 155 7.040 16.737 2.854 1.00 1.03 H new ATOM 0 HB VAL A 155 4.856 14.692 2.470 1.00 1.07 H new ATOM 0 HG11 VAL A 155 6.444 12.959 3.204 1.00 1.02 H new ATOM 0 HG12 VAL A 155 6.917 13.673 1.645 1.00 1.02 H new ATOM 0 HG13 VAL A 155 7.768 14.146 3.135 1.00 1.02 H new ATOM 0 HG21 VAL A 155 5.361 14.311 4.919 1.00 1.73 H new ATOM 0 HG22 VAL A 155 6.627 15.559 4.830 1.00 1.73 H new ATOM 0 HG23 VAL A 155 4.919 16.006 4.609 1.00 1.73 H new ATOM 2343 N LEU A 156 5.910 15.845 -0.112 1.00 1.00 N ATOM 2344 CA LEU A 156 6.298 15.636 -1.500 1.00 1.06 C ATOM 2345 C LEU A 156 6.906 16.894 -2.120 1.00 1.25 C ATOM 2346 O LEU A 156 7.680 16.774 -3.065 1.00 1.46 O ATOM 2347 CB LEU A 156 5.117 15.110 -2.329 1.00 1.02 C ATOM 2348 CG LEU A 156 4.842 13.603 -2.153 1.00 0.82 C ATOM 2349 CD1 LEU A 156 3.929 13.113 -3.273 1.00 1.11 C ATOM 2350 CD2 LEU A 156 6.100 12.727 -2.204 1.00 1.03 C ATOM 0 H LEU A 156 4.905 15.776 0.048 1.00 1.00 H new ATOM 0 HA LEU A 156 7.077 14.874 -1.509 1.00 1.06 H new ATOM 0 HB2 LEU A 156 4.220 15.666 -2.056 1.00 1.02 H new ATOM 0 HB3 LEU A 156 5.309 15.312 -3.383 1.00 1.02 H new ATOM 0 HG LEU A 156 4.393 13.508 -1.164 1.00 0.82 H new ATOM 0 HD11 LEU A 156 3.737 12.048 -3.146 1.00 1.11 H new ATOM 0 HD12 LEU A 156 2.986 13.659 -3.239 1.00 1.11 H new ATOM 0 HD13 LEU A 156 4.411 13.282 -4.236 1.00 1.11 H new ATOM 0 HD21 LEU A 156 5.821 11.682 -2.072 1.00 1.03 H new ATOM 0 HD22 LEU A 156 6.592 12.853 -3.169 1.00 1.03 H new ATOM 0 HD23 LEU A 156 6.782 13.023 -1.407 1.00 1.03 H new ATOM 2362 N GLN A 157 6.600 18.085 -1.603 1.00 1.24 N ATOM 2363 CA GLN A 157 7.353 19.286 -1.961 1.00 1.35 C ATOM 2364 C GLN A 157 8.689 19.373 -1.215 1.00 1.41 C ATOM 2365 O GLN A 157 9.633 19.964 -1.728 1.00 1.58 O ATOM 2366 CB GLN A 157 6.530 20.552 -1.678 1.00 1.39 C ATOM 2367 CG GLN A 157 5.731 20.965 -2.917 1.00 1.59 C ATOM 2368 CD GLN A 157 5.035 22.312 -2.727 1.00 2.69 C ATOM 2369 OE1 GLN A 157 5.300 23.051 -1.787 1.00 3.40 O ATOM 2370 NE2 GLN A 157 4.126 22.671 -3.625 1.00 3.75 N ATOM 0 H GLN A 157 5.841 18.243 -0.940 1.00 1.24 H new ATOM 0 HA GLN A 157 7.562 19.217 -3.029 1.00 1.35 H new ATOM 0 HB2 GLN A 157 5.851 20.372 -0.845 1.00 1.39 H new ATOM 0 HB3 GLN A 157 7.193 21.364 -1.379 1.00 1.39 H new ATOM 0 HG2 GLN A 157 6.398 21.020 -3.777 1.00 1.59 H new ATOM 0 HG3 GLN A 157 4.987 20.201 -3.140 1.00 1.59 H new ATOM 0 HE21 GLN A 157 3.909 22.052 -4.406 1.00 3.75 H new ATOM 0 HE22 GLN A 157 3.645 23.566 -3.534 1.00 3.75 H new ATOM 2379 N ASN A 158 8.759 18.872 0.018 1.00 1.35 N ATOM 2380 CA ASN A 158 9.901 19.087 0.904 1.00 1.55 C ATOM 2381 C ASN A 158 11.033 18.082 0.660 1.00 1.57 C ATOM 2382 O ASN A 158 12.145 18.300 1.141 1.00 1.86 O ATOM 2383 CB ASN A 158 9.445 19.012 2.373 1.00 1.60 C ATOM 2384 CG ASN A 158 10.085 20.095 3.229 1.00 1.60 C ATOM 2385 OD1 ASN A 158 9.394 20.829 3.923 1.00 2.79 O ATOM 2386 ND2 ASN A 158 11.401 20.231 3.197 1.00 2.23 N ATOM 0 H ASN A 158 8.021 18.303 0.432 1.00 1.35 H new ATOM 0 HA ASN A 158 10.296 20.079 0.684 1.00 1.55 H new ATOM 0 HB2 ASN A 158 8.360 19.107 2.420 1.00 1.60 H new ATOM 0 HB3 ASN A 158 9.697 18.033 2.780 1.00 1.60 H new ATOM 0 HD21 ASN A 158 11.853 20.955 3.756 1.00 2.23 H new ATOM 0 HD22 ASN A 158 11.964 19.612 2.614 1.00 2.23 H new ATOM 2393 N ARG A 159 10.725 16.950 0.021 1.00 1.38 N ATOM 2394 CA ARG A 159 11.655 15.865 -0.290 1.00 1.44 C ATOM 2395 C ARG A 159 12.456 16.153 -1.558 1.00 1.77 C ATOM 2396 O ARG A 159 13.190 15.236 -1.995 1.00 1.92 O ATOM 2397 CB ARG A 159 10.857 14.560 -0.442 1.00 1.36 C ATOM 2398 CG ARG A 159 9.890 14.554 -1.641 1.00 2.30 C ATOM 2399 CD ARG A 159 10.509 14.234 -3.008 1.00 3.54 C ATOM 2400 NE ARG A 159 11.130 12.899 -3.027 1.00 3.90 N ATOM 2401 CZ ARG A 159 12.235 12.568 -3.706 1.00 4.49 C ATOM 2402 NH1 ARG A 159 12.548 11.277 -3.860 1.00 5.86 N ATOM 2403 NH2 ARG A 159 13.013 13.509 -4.235 1.00 4.46 N ATOM 0 H ARG A 159 9.779 16.758 -0.307 1.00 1.38 H new ATOM 0 HA ARG A 159 12.372 15.772 0.525 1.00 1.44 H new ATOM 0 HB2 ARG A 159 11.555 13.729 -0.547 1.00 1.36 H new ATOM 0 HB3 ARG A 159 10.288 14.385 0.471 1.00 1.36 H new ATOM 0 HG2 ARG A 159 9.103 13.827 -1.443 1.00 2.30 H new ATOM 0 HG3 ARG A 159 9.413 15.532 -1.701 1.00 2.30 H new ATOM 0 HD2 ARG A 159 9.739 14.288 -3.777 1.00 3.54 H new ATOM 0 HD3 ARG A 159 11.258 14.987 -3.253 1.00 3.54 H new ATOM 0 HE ARG A 159 10.681 12.166 -2.478 1.00 3.90 H new ATOM 0 HH11 ARG A 159 11.947 10.555 -3.462 1.00 5.86 H new ATOM 0 HH12 ARG A 159 13.388 11.014 -4.376 1.00 5.86 H new ATOM 0 HH21 ARG A 159 12.770 14.493 -4.125 1.00 4.46 H new ATOM 0 HH22 ARG A 159 13.853 13.246 -4.751 1.00 4.46 H new TER 2417 ARG A 159