USER MOD reduce.3.24.130724 H: found=0, std=0, add=1052, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1052 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 20 LYS NZ :NH3+ -119:sc= 0.742 (180deg=0) USER MOD Set 1.2: A 84 SER OG : rot -77:sc= -0.505! USER MOD Set 1.3: A 85 MET CE :methyl 173:sc= -2.99! (180deg=-3.42!) USER MOD Set 1.4: A 91 CYS SG : rot 48:sc= 0.473 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 160:sc= 1.22 (180deg=0.765) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.0957 USER MOD Single : A 5 GLN : amide:sc= 0.854 K(o=0.85,f=-6.2!) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0.159 USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.215 USER MOD Single : A 24 LYS NZ :NH3+ -157:sc= -0.0183 (180deg=-0.208) USER MOD Single : A 25 LYS NZ :NH3+ -167:sc= 1.18 (180deg=0.951) USER MOD Single : A 32 ASN : amide:sc= -1.14 K(o=-1.1,f=-0.029) USER MOD Single : A 35 LYS NZ :NH3+ -175:sc= 1.25 (180deg=1.09) USER MOD Single : A 36 LYS NZ :NH3+ 162:sc= -0.857 (180deg=-1.39!) USER MOD Single : A 38 ASN : amide:sc= -0.515 K(o=-0.51,f=-1.4) USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HE2:sc= 0.534 K(o=0.53,f=-6.5!) USER MOD Single : A 44 TYR OH : rot -131:sc= 1.22 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 SER OG : rot -127:sc= 0.288 USER MOD Single : A 58 SER OG : rot 180:sc= 0.0196 USER MOD Single : A 62 ASN : amide:sc= -2.18! K(o=-2.2!,f=-0.13) USER MOD Single : A 66 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.12) USER MOD Single : A 68 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 71 GLN : amide:sc= 0.0123 K(o=0.012,f=-9!) USER MOD Single : A 76 LYS NZ :NH3+ -147:sc= 0.932 (180deg=0.368) USER MOD Single : A 81 CYS SG : rot -20:sc= -5.39! USER MOD Single : A 83 SER OG : rot 83:sc= 1.28 USER MOD Single : A 87 LYS NZ :NH3+ -170:sc= -0.0141 (180deg=-0.126) USER MOD Single : A 88 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 LYS NZ :NH3+ -116:sc= 0.171 (180deg=0) USER MOD Single : A 97 SER OG : rot 180:sc= 0.154 USER MOD Single : A 98 MET CE :methyl 161:sc= -0.105 (180deg=-0.525) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 TYR OH : rot 51:sc= 0.392 USER MOD Single : A 106 CYS SG : rot 180:sc= 0.00181 USER MOD Single : A 109 SER OG : rot -101:sc= 1.33 USER MOD Single : A 113 ASN : amide:sc= 0.987 K(o=0.99,f=-6.2!) USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 124 SER OG : rot 180:sc= -0.035 USER MOD Single : A 130 HIS : no HD1:sc= -0.0739 X(o=-0.074,f=-0.074) USER MOD Single : A 131 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 133 HIS : no HD1:sc= 0.692 K(o=0.69,f=-4.1!) USER MOD Single : A 134 HIS : no HD1:sc= -1.13 X(o=-1.1,f=-1.6) USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.480 -0.528 0.589 1.00 5.93 N ATOM 2 CA MET A 1 1.812 -1.104 -0.734 1.00 5.55 C ATOM 3 C MET A 1 3.318 -1.136 -0.947 1.00 5.18 C ATOM 4 O MET A 1 3.923 -0.125 -1.301 1.00 5.39 O ATOM 5 CB MET A 1 1.151 -0.293 -1.855 1.00 5.94 C ATOM 6 CG MET A 1 -0.362 -0.453 -1.944 1.00 6.32 C ATOM 7 SD MET A 1 -1.231 0.070 -0.448 1.00 7.08 S ATOM 8 CE MET A 1 -2.929 -0.024 -1.007 1.00 7.48 C ATOM 0 H1 MET A 1 0.492 -0.202 0.588 1.00 5.93 H new ATOM 0 H2 MET A 1 1.605 -1.253 1.324 1.00 5.93 H new ATOM 0 H3 MET A 1 2.109 0.276 0.785 1.00 5.93 H new ATOM 0 HA MET A 1 1.431 -2.125 -0.760 1.00 5.55 H new ATOM 0 HB2 MET A 1 1.384 0.762 -1.709 1.00 5.94 H new ATOM 0 HB3 MET A 1 1.591 -0.588 -2.808 1.00 5.94 H new ATOM 0 HG2 MET A 1 -0.732 0.126 -2.790 1.00 6.32 H new ATOM 0 HG3 MET A 1 -0.598 -1.498 -2.145 1.00 6.32 H new ATOM 0 HE1 MET A 1 -3.596 0.269 -0.196 1.00 7.48 H new ATOM 0 HE2 MET A 1 -3.071 0.647 -1.854 1.00 7.48 H new ATOM 0 HE3 MET A 1 -3.156 -1.046 -1.312 1.00 7.48 H new ATOM 20 N THR A 2 3.922 -2.288 -0.717 1.00 4.95 N ATOM 21 CA THR A 2 5.354 -2.450 -0.911 1.00 4.71 C ATOM 22 C THR A 2 5.689 -2.430 -2.404 1.00 3.87 C ATOM 23 O THR A 2 4.814 -2.643 -3.246 1.00 3.96 O ATOM 24 CB THR A 2 5.858 -3.763 -0.269 1.00 5.39 C ATOM 25 OG1 THR A 2 7.290 -3.795 -0.249 1.00 5.76 O ATOM 26 CG2 THR A 2 5.328 -4.980 -1.014 1.00 5.90 C ATOM 0 H THR A 2 3.442 -3.128 -0.395 1.00 4.95 H new ATOM 0 HA THR A 2 5.859 -1.618 -0.421 1.00 4.71 H new ATOM 0 HB THR A 2 5.484 -3.795 0.754 1.00 5.39 H new ATOM 0 HG1 THR A 2 7.593 -4.632 0.162 1.00 5.76 H new ATOM 0 HG21 THR A 2 5.700 -5.888 -0.539 1.00 5.90 H new ATOM 0 HG22 THR A 2 4.238 -4.977 -0.988 1.00 5.90 H new ATOM 0 HG23 THR A 2 5.666 -4.948 -2.050 1.00 5.90 H new ATOM 34 N THR A 3 6.942 -2.152 -2.735 1.00 3.53 N ATOM 35 CA THR A 3 7.358 -2.075 -4.130 1.00 3.16 C ATOM 36 C THR A 3 8.829 -2.463 -4.281 1.00 2.69 C ATOM 37 O THR A 3 9.153 -3.490 -4.883 1.00 3.09 O ATOM 38 CB THR A 3 7.124 -0.658 -4.701 1.00 3.92 C ATOM 39 OG1 THR A 3 5.759 -0.269 -4.480 1.00 4.44 O ATOM 40 CG2 THR A 3 7.429 -0.607 -6.193 1.00 4.35 C ATOM 0 H THR A 3 7.686 -1.976 -2.060 1.00 3.53 H new ATOM 0 HA THR A 3 6.750 -2.781 -4.696 1.00 3.16 H new ATOM 0 HB THR A 3 7.797 0.030 -4.189 1.00 3.92 H new ATOM 0 HG1 THR A 3 5.613 0.630 -4.841 1.00 4.44 H new ATOM 0 HG21 THR A 3 7.255 0.402 -6.566 1.00 4.35 H new ATOM 0 HG22 THR A 3 8.470 -0.881 -6.361 1.00 4.35 H new ATOM 0 HG23 THR A 3 6.780 -1.306 -6.721 1.00 4.35 H new ATOM 48 N GLU A 4 9.715 -1.653 -3.722 1.00 2.34 N ATOM 49 CA GLU A 4 11.141 -1.940 -3.764 1.00 2.09 C ATOM 50 C GLU A 4 11.681 -2.142 -2.360 1.00 1.62 C ATOM 51 O GLU A 4 10.955 -1.995 -1.376 1.00 1.79 O ATOM 52 CB GLU A 4 11.915 -0.819 -4.460 1.00 2.45 C ATOM 53 CG GLU A 4 11.745 -0.796 -5.968 1.00 3.05 C ATOM 54 CD GLU A 4 12.643 0.229 -6.625 1.00 3.65 C ATOM 55 OE1 GLU A 4 13.880 0.141 -6.449 1.00 3.66 O ATOM 56 OE2 GLU A 4 12.124 1.130 -7.308 1.00 4.44 O ATOM 0 H GLU A 4 9.472 -0.791 -3.234 1.00 2.34 H new ATOM 0 HA GLU A 4 11.277 -2.857 -4.338 1.00 2.09 H new ATOM 0 HB2 GLU A 4 11.591 0.139 -4.053 1.00 2.45 H new ATOM 0 HB3 GLU A 4 12.974 -0.923 -4.226 1.00 2.45 H new ATOM 0 HG2 GLU A 4 11.966 -1.784 -6.373 1.00 3.05 H new ATOM 0 HG3 GLU A 4 10.706 -0.577 -6.212 1.00 3.05 H new ATOM 63 N GLN A 5 12.957 -2.480 -2.275 1.00 1.60 N ATOM 64 CA GLN A 5 13.611 -2.708 -1.001 1.00 1.37 C ATOM 65 C GLN A 5 13.909 -1.386 -0.312 1.00 1.11 C ATOM 66 O GLN A 5 14.865 -0.692 -0.655 1.00 1.32 O ATOM 67 CB GLN A 5 14.904 -3.506 -1.192 1.00 1.77 C ATOM 68 CG GLN A 5 14.702 -4.852 -1.879 1.00 2.47 C ATOM 69 CD GLN A 5 14.822 -4.785 -3.392 1.00 3.35 C ATOM 70 OE1 GLN A 5 14.550 -3.756 -4.016 1.00 3.77 O ATOM 71 NE2 GLN A 5 15.213 -5.895 -3.997 1.00 4.15 N ATOM 0 H GLN A 5 13.565 -2.603 -3.085 1.00 1.60 H new ATOM 0 HA GLN A 5 12.936 -3.287 -0.371 1.00 1.37 H new ATOM 0 HB2 GLN A 5 15.604 -2.911 -1.779 1.00 1.77 H new ATOM 0 HB3 GLN A 5 15.365 -3.671 -0.218 1.00 1.77 H new ATOM 0 HG2 GLN A 5 15.436 -5.560 -1.495 1.00 2.47 H new ATOM 0 HG3 GLN A 5 13.718 -5.240 -1.617 1.00 2.47 H new ATOM 0 HE21 GLN A 5 15.429 -6.726 -3.447 1.00 4.15 H new ATOM 0 HE22 GLN A 5 15.298 -5.919 -5.013 1.00 4.15 H new ATOM 80 N GLU A 6 13.075 -1.043 0.654 1.00 1.06 N ATOM 81 CA GLU A 6 13.230 0.190 1.415 1.00 1.21 C ATOM 82 C GLU A 6 14.070 -0.087 2.664 1.00 1.08 C ATOM 83 O GLU A 6 13.857 0.492 3.727 1.00 1.33 O ATOM 84 CB GLU A 6 11.843 0.726 1.787 1.00 1.65 C ATOM 85 CG GLU A 6 11.830 2.170 2.261 1.00 2.45 C ATOM 86 CD GLU A 6 10.423 2.693 2.458 1.00 3.07 C ATOM 87 OE1 GLU A 6 9.845 2.474 3.541 1.00 3.61 O ATOM 88 OE2 GLU A 6 9.882 3.324 1.523 1.00 3.52 O ATOM 0 H GLU A 6 12.273 -1.607 0.934 1.00 1.06 H new ATOM 0 HA GLU A 6 13.744 0.943 0.818 1.00 1.21 H new ATOM 0 HB2 GLU A 6 11.188 0.636 0.920 1.00 1.65 H new ATOM 0 HB3 GLU A 6 11.423 0.096 2.571 1.00 1.65 H new ATOM 0 HG2 GLU A 6 12.380 2.248 3.199 1.00 2.45 H new ATOM 0 HG3 GLU A 6 12.350 2.794 1.534 1.00 2.45 H new ATOM 95 N PHE A 7 15.030 -0.991 2.513 1.00 0.87 N ATOM 96 CA PHE A 7 15.893 -1.398 3.614 1.00 0.77 C ATOM 97 C PHE A 7 17.229 -0.666 3.543 1.00 0.72 C ATOM 98 O PHE A 7 17.404 0.252 2.740 1.00 0.87 O ATOM 99 CB PHE A 7 16.118 -2.914 3.582 1.00 0.77 C ATOM 100 CG PHE A 7 14.849 -3.712 3.665 1.00 1.61 C ATOM 101 CD1 PHE A 7 14.116 -3.748 4.841 1.00 1.82 C ATOM 102 CD2 PHE A 7 14.392 -4.434 2.573 1.00 2.72 C ATOM 103 CE1 PHE A 7 12.952 -4.485 4.926 1.00 2.63 C ATOM 104 CE2 PHE A 7 13.227 -5.173 2.652 1.00 3.60 C ATOM 105 CZ PHE A 7 12.493 -5.180 3.808 1.00 3.44 C ATOM 0 H PHE A 7 15.231 -1.460 1.630 1.00 0.87 H new ATOM 0 HA PHE A 7 15.403 -1.136 4.552 1.00 0.77 H new ATOM 0 HB2 PHE A 7 16.642 -3.176 2.663 1.00 0.77 H new ATOM 0 HB3 PHE A 7 16.768 -3.194 4.411 1.00 0.77 H new ATOM 0 HD1 PHE A 7 14.460 -3.193 5.701 1.00 1.82 H new ATOM 0 HD2 PHE A 7 14.953 -4.419 1.650 1.00 2.72 H new ATOM 0 HE1 PHE A 7 12.400 -4.523 5.853 1.00 2.63 H new ATOM 0 HE2 PHE A 7 12.894 -5.747 1.800 1.00 3.60 H new ATOM 0 HZ PHE A 7 11.560 -5.723 3.854 1.00 3.44 H new ATOM 115 N GLU A 8 18.170 -1.081 4.373 1.00 0.72 N ATOM 116 CA GLU A 8 19.448 -0.407 4.468 1.00 0.76 C ATOM 117 C GLU A 8 20.596 -1.395 4.295 1.00 0.62 C ATOM 118 O GLU A 8 20.470 -2.581 4.618 1.00 0.61 O ATOM 119 CB GLU A 8 19.548 0.298 5.821 1.00 1.01 C ATOM 120 CG GLU A 8 20.794 1.144 5.985 1.00 1.20 C ATOM 121 CD GLU A 8 20.840 1.832 7.328 1.00 1.97 C ATOM 122 OE1 GLU A 8 21.261 1.192 8.312 1.00 2.71 O ATOM 123 OE2 GLU A 8 20.449 3.014 7.410 1.00 2.22 O ATOM 0 H GLU A 8 18.070 -1.885 4.992 1.00 0.72 H new ATOM 0 HA GLU A 8 19.521 0.331 3.669 1.00 0.76 H new ATOM 0 HB2 GLU A 8 18.671 0.931 5.955 1.00 1.01 H new ATOM 0 HB3 GLU A 8 19.523 -0.451 6.612 1.00 1.01 H new ATOM 0 HG2 GLU A 8 21.677 0.515 5.870 1.00 1.20 H new ATOM 0 HG3 GLU A 8 20.831 1.892 5.193 1.00 1.20 H new ATOM 130 N LYS A 9 21.704 -0.907 3.760 1.00 0.60 N ATOM 131 CA LYS A 9 22.908 -1.707 3.647 1.00 0.53 C ATOM 132 C LYS A 9 23.771 -1.504 4.877 1.00 0.50 C ATOM 133 O LYS A 9 23.836 -0.403 5.423 1.00 0.56 O ATOM 134 CB LYS A 9 23.721 -1.338 2.399 1.00 0.63 C ATOM 135 CG LYS A 9 23.017 -1.627 1.086 1.00 0.72 C ATOM 136 CD LYS A 9 22.385 -0.384 0.486 1.00 0.95 C ATOM 137 CE LYS A 9 23.437 0.637 0.082 1.00 1.49 C ATOM 138 NZ LYS A 9 22.852 1.741 -0.717 1.00 1.88 N ATOM 0 H LYS A 9 21.792 0.042 3.397 1.00 0.60 H new ATOM 0 HA LYS A 9 22.605 -2.751 3.562 1.00 0.53 H new ATOM 0 HB2 LYS A 9 23.966 -0.277 2.440 1.00 0.63 H new ATOM 0 HB3 LYS A 9 24.664 -1.884 2.420 1.00 0.63 H new ATOM 0 HG2 LYS A 9 23.731 -2.047 0.378 1.00 0.72 H new ATOM 0 HG3 LYS A 9 22.247 -2.382 1.247 1.00 0.72 H new ATOM 0 HD2 LYS A 9 21.792 -0.661 -0.385 1.00 0.95 H new ATOM 0 HD3 LYS A 9 21.702 0.063 1.208 1.00 0.95 H new ATOM 0 HE2 LYS A 9 23.910 1.045 0.975 1.00 1.49 H new ATOM 0 HE3 LYS A 9 24.219 0.144 -0.496 1.00 1.49 H new ATOM 0 HZ1 LYS A 9 23.599 2.417 -0.974 1.00 1.88 H new ATOM 0 HZ2 LYS A 9 22.423 1.354 -1.582 1.00 1.88 H new ATOM 0 HZ3 LYS A 9 22.123 2.227 -0.156 1.00 1.88 H new ATOM 152 N VAL A 10 24.437 -2.559 5.305 1.00 0.46 N ATOM 153 CA VAL A 10 25.353 -2.464 6.425 1.00 0.46 C ATOM 154 C VAL A 10 26.771 -2.403 5.882 1.00 0.48 C ATOM 155 O VAL A 10 27.325 -3.402 5.422 1.00 0.54 O ATOM 156 CB VAL A 10 25.213 -3.668 7.388 1.00 0.51 C ATOM 157 CG1 VAL A 10 26.105 -3.487 8.609 1.00 0.54 C ATOM 158 CG2 VAL A 10 23.760 -3.857 7.807 1.00 0.59 C ATOM 0 H VAL A 10 24.361 -3.490 4.895 1.00 0.46 H new ATOM 0 HA VAL A 10 25.117 -1.565 6.994 1.00 0.46 H new ATOM 0 HB VAL A 10 25.535 -4.565 6.860 1.00 0.51 H new ATOM 0 HG11 VAL A 10 25.991 -4.344 9.273 1.00 0.54 H new ATOM 0 HG12 VAL A 10 27.145 -3.409 8.292 1.00 0.54 H new ATOM 0 HG13 VAL A 10 25.818 -2.578 9.138 1.00 0.54 H new ATOM 0 HG21 VAL A 10 23.684 -4.708 8.484 1.00 0.59 H new ATOM 0 HG22 VAL A 10 23.408 -2.958 8.313 1.00 0.59 H new ATOM 0 HG23 VAL A 10 23.148 -4.040 6.924 1.00 0.59 H new ATOM 168 N GLU A 11 27.330 -1.205 5.905 1.00 0.53 N ATOM 169 CA GLU A 11 28.633 -0.950 5.313 1.00 0.63 C ATOM 170 C GLU A 11 29.702 -0.845 6.392 1.00 0.55 C ATOM 171 O GLU A 11 29.675 0.077 7.210 1.00 0.59 O ATOM 172 CB GLU A 11 28.572 0.335 4.482 1.00 0.88 C ATOM 173 CG GLU A 11 27.506 0.284 3.399 1.00 1.37 C ATOM 174 CD GLU A 11 27.243 1.631 2.754 1.00 1.72 C ATOM 175 OE1 GLU A 11 26.552 2.464 3.371 1.00 2.16 O ATOM 176 OE2 GLU A 11 27.719 1.856 1.622 1.00 2.02 O ATOM 0 H GLU A 11 26.897 -0.386 6.332 1.00 0.53 H new ATOM 0 HA GLU A 11 28.899 -1.782 4.662 1.00 0.63 H new ATOM 0 HB2 GLU A 11 28.374 1.180 5.141 1.00 0.88 H new ATOM 0 HB3 GLU A 11 29.544 0.511 4.021 1.00 0.88 H new ATOM 0 HG2 GLU A 11 27.812 -0.426 2.630 1.00 1.37 H new ATOM 0 HG3 GLU A 11 26.578 -0.093 3.829 1.00 1.37 H new ATOM 183 N LEU A 12 30.622 -1.811 6.388 1.00 0.52 N ATOM 184 CA LEU A 12 31.725 -1.858 7.347 1.00 0.51 C ATOM 185 C LEU A 12 31.210 -1.960 8.772 1.00 0.52 C ATOM 186 O LEU A 12 31.547 -1.147 9.632 1.00 0.61 O ATOM 187 CB LEU A 12 32.652 -0.651 7.192 1.00 0.57 C ATOM 188 CG LEU A 12 33.558 -0.696 5.961 1.00 0.88 C ATOM 189 CD1 LEU A 12 34.411 0.561 5.874 1.00 1.35 C ATOM 190 CD2 LEU A 12 34.437 -1.936 6.003 1.00 1.45 C ATOM 0 H LEU A 12 30.623 -2.582 5.720 1.00 0.52 H new ATOM 0 HA LEU A 12 32.305 -2.755 7.131 1.00 0.51 H new ATOM 0 HB2 LEU A 12 32.045 0.253 7.147 1.00 0.57 H new ATOM 0 HB3 LEU A 12 33.275 -0.572 8.083 1.00 0.57 H new ATOM 0 HG LEU A 12 32.931 -0.742 5.071 1.00 0.88 H new ATOM 0 HD11 LEU A 12 35.048 0.508 4.991 1.00 1.35 H new ATOM 0 HD12 LEU A 12 33.764 1.435 5.803 1.00 1.35 H new ATOM 0 HD13 LEU A 12 35.033 0.641 6.766 1.00 1.35 H new ATOM 0 HD21 LEU A 12 35.078 -1.958 5.122 1.00 1.45 H new ATOM 0 HD22 LEU A 12 35.055 -1.914 6.901 1.00 1.45 H new ATOM 0 HD23 LEU A 12 33.809 -2.827 6.017 1.00 1.45 H new ATOM 202 N THR A 13 30.384 -2.964 9.000 1.00 0.50 N ATOM 203 CA THR A 13 29.886 -3.272 10.328 1.00 0.56 C ATOM 204 C THR A 13 31.044 -3.525 11.291 1.00 0.53 C ATOM 205 O THR A 13 32.099 -4.030 10.891 1.00 0.50 O ATOM 206 CB THR A 13 28.963 -4.513 10.285 1.00 0.68 C ATOM 207 OG1 THR A 13 28.616 -4.938 11.609 1.00 0.78 O ATOM 208 CG2 THR A 13 29.627 -5.661 9.536 1.00 0.69 C ATOM 0 H THR A 13 30.040 -3.589 8.271 1.00 0.50 H new ATOM 0 HA THR A 13 29.313 -2.415 10.682 1.00 0.56 H new ATOM 0 HB THR A 13 28.054 -4.227 9.756 1.00 0.68 H new ATOM 0 HG1 THR A 13 28.031 -5.723 11.558 1.00 0.78 H new ATOM 0 HG21 THR A 13 28.957 -6.521 9.520 1.00 0.69 H new ATOM 0 HG22 THR A 13 29.844 -5.351 8.514 1.00 0.69 H new ATOM 0 HG23 THR A 13 30.556 -5.934 10.037 1.00 0.69 H new ATOM 216 N ALA A 14 30.844 -3.188 12.562 1.00 0.61 N ATOM 217 CA ALA A 14 31.851 -3.422 13.595 1.00 0.66 C ATOM 218 C ALA A 14 32.001 -4.918 13.867 1.00 0.69 C ATOM 219 O ALA A 14 32.789 -5.338 14.713 1.00 0.79 O ATOM 220 CB ALA A 14 31.478 -2.679 14.872 1.00 0.81 C ATOM 0 H ALA A 14 29.989 -2.749 12.904 1.00 0.61 H new ATOM 0 HA ALA A 14 32.809 -3.042 13.240 1.00 0.66 H new ATOM 0 HB1 ALA A 14 32.236 -2.861 15.634 1.00 0.81 H new ATOM 0 HB2 ALA A 14 31.419 -1.610 14.667 1.00 0.81 H new ATOM 0 HB3 ALA A 14 30.511 -3.033 15.230 1.00 0.81 H new ATOM 226 N ASP A 15 31.239 -5.710 13.125 1.00 0.71 N ATOM 227 CA ASP A 15 31.251 -7.160 13.243 1.00 0.85 C ATOM 228 C ASP A 15 32.341 -7.773 12.353 1.00 0.74 C ATOM 229 O ASP A 15 32.346 -8.969 12.088 1.00 0.86 O ATOM 230 CB ASP A 15 29.868 -7.687 12.858 1.00 1.08 C ATOM 231 CG ASP A 15 29.641 -9.139 13.210 1.00 1.69 C ATOM 232 OD1 ASP A 15 29.715 -9.470 14.410 1.00 1.87 O ATOM 233 OD2 ASP A 15 29.444 -9.955 12.281 1.00 2.40 O ATOM 0 H ASP A 15 30.591 -5.361 12.419 1.00 0.71 H new ATOM 0 HA ASP A 15 31.479 -7.444 14.270 1.00 0.85 H new ATOM 0 HB2 ASP A 15 29.109 -7.081 13.354 1.00 1.08 H new ATOM 0 HB3 ASP A 15 29.728 -7.558 11.785 1.00 1.08 H new ATOM 238 N GLY A 16 33.286 -6.945 11.913 1.00 0.64 N ATOM 239 CA GLY A 16 34.402 -7.452 11.125 1.00 0.68 C ATOM 240 C GLY A 16 34.539 -6.808 9.759 1.00 0.57 C ATOM 241 O GLY A 16 35.392 -7.216 8.960 1.00 0.63 O ATOM 0 H GLY A 16 33.301 -5.940 12.085 1.00 0.64 H new ATOM 0 HA2 GLY A 16 35.326 -7.297 11.682 1.00 0.68 H new ATOM 0 HA3 GLY A 16 34.283 -8.528 10.997 1.00 0.68 H new ATOM 245 N GLY A 17 33.711 -5.808 9.489 1.00 0.54 N ATOM 246 CA GLY A 17 33.853 -5.019 8.278 1.00 0.52 C ATOM 247 C GLY A 17 33.489 -5.773 7.015 1.00 0.46 C ATOM 248 O GLY A 17 34.363 -6.145 6.236 1.00 0.61 O ATOM 0 H GLY A 17 32.937 -5.526 10.091 1.00 0.54 H new ATOM 0 HA2 GLY A 17 33.223 -4.133 8.356 1.00 0.52 H new ATOM 0 HA3 GLY A 17 34.883 -4.672 8.199 1.00 0.52 H new ATOM 252 N VAL A 18 32.200 -6.013 6.820 1.00 0.36 N ATOM 253 CA VAL A 18 31.710 -6.596 5.581 1.00 0.34 C ATOM 254 C VAL A 18 30.465 -5.850 5.117 1.00 0.32 C ATOM 255 O VAL A 18 29.656 -5.410 5.935 1.00 0.36 O ATOM 256 CB VAL A 18 31.405 -8.108 5.742 1.00 0.40 C ATOM 257 CG1 VAL A 18 30.694 -8.670 4.520 1.00 0.47 C ATOM 258 CG2 VAL A 18 32.684 -8.887 5.994 1.00 0.49 C ATOM 0 H VAL A 18 31.473 -5.812 7.507 1.00 0.36 H new ATOM 0 HA VAL A 18 32.492 -6.498 4.828 1.00 0.34 H new ATOM 0 HB VAL A 18 30.743 -8.215 6.601 1.00 0.40 H new ATOM 0 HG11 VAL A 18 30.497 -9.732 4.670 1.00 0.47 H new ATOM 0 HG12 VAL A 18 29.751 -8.143 4.373 1.00 0.47 H new ATOM 0 HG13 VAL A 18 31.324 -8.539 3.640 1.00 0.47 H new ATOM 0 HG21 VAL A 18 32.449 -9.946 6.104 1.00 0.49 H new ATOM 0 HG22 VAL A 18 33.364 -8.752 5.153 1.00 0.49 H new ATOM 0 HG23 VAL A 18 33.158 -8.523 6.906 1.00 0.49 H new ATOM 268 N ILE A 19 30.339 -5.679 3.808 1.00 0.31 N ATOM 269 CA ILE A 19 29.198 -4.990 3.227 1.00 0.31 C ATOM 270 C ILE A 19 28.074 -5.984 2.970 1.00 0.30 C ATOM 271 O ILE A 19 28.223 -6.895 2.159 1.00 0.30 O ATOM 272 CB ILE A 19 29.563 -4.305 1.885 1.00 0.34 C ATOM 273 CG1 ILE A 19 30.902 -3.550 1.979 1.00 0.41 C ATOM 274 CG2 ILE A 19 28.443 -3.363 1.454 1.00 0.36 C ATOM 275 CD1 ILE A 19 30.927 -2.438 3.008 1.00 0.47 C ATOM 0 H ILE A 19 31.020 -6.011 3.125 1.00 0.31 H new ATOM 0 HA ILE A 19 28.883 -4.225 3.936 1.00 0.31 H new ATOM 0 HB ILE A 19 29.680 -5.084 1.131 1.00 0.34 H new ATOM 0 HG12 ILE A 19 31.691 -4.264 2.215 1.00 0.41 H new ATOM 0 HG13 ILE A 19 31.136 -3.128 1.001 1.00 0.41 H new ATOM 0 HG21 ILE A 19 28.710 -2.888 0.510 1.00 0.36 H new ATOM 0 HG22 ILE A 19 27.520 -3.929 1.326 1.00 0.36 H new ATOM 0 HG23 ILE A 19 28.297 -2.598 2.217 1.00 0.36 H new ATOM 0 HD11 ILE A 19 31.907 -1.962 3.005 1.00 0.47 H new ATOM 0 HD12 ILE A 19 30.164 -1.699 2.764 1.00 0.47 H new ATOM 0 HD13 ILE A 19 30.728 -2.852 3.996 1.00 0.47 H new ATOM 287 N LYS A 20 26.965 -5.837 3.674 1.00 0.33 N ATOM 288 CA LYS A 20 25.824 -6.705 3.438 1.00 0.37 C ATOM 289 C LYS A 20 24.510 -5.942 3.558 1.00 0.33 C ATOM 290 O LYS A 20 24.337 -5.102 4.439 1.00 0.37 O ATOM 291 CB LYS A 20 25.852 -7.926 4.370 1.00 0.53 C ATOM 292 CG LYS A 20 25.698 -7.624 5.852 1.00 0.59 C ATOM 293 CD LYS A 20 26.210 -8.787 6.689 1.00 0.76 C ATOM 294 CE LYS A 20 25.734 -8.711 8.129 1.00 0.83 C ATOM 295 NZ LYS A 20 24.369 -9.288 8.295 1.00 1.34 N ATOM 0 H LYS A 20 26.830 -5.136 4.403 1.00 0.33 H new ATOM 0 HA LYS A 20 25.895 -7.071 2.414 1.00 0.37 H new ATOM 0 HB2 LYS A 20 25.055 -8.607 4.071 1.00 0.53 H new ATOM 0 HB3 LYS A 20 26.794 -8.453 4.221 1.00 0.53 H new ATOM 0 HG2 LYS A 20 26.248 -6.717 6.103 1.00 0.59 H new ATOM 0 HG3 LYS A 20 24.650 -7.435 6.084 1.00 0.59 H new ATOM 0 HD2 LYS A 20 25.876 -9.725 6.247 1.00 0.76 H new ATOM 0 HD3 LYS A 20 27.300 -8.795 6.668 1.00 0.76 H new ATOM 0 HE2 LYS A 20 26.434 -9.245 8.771 1.00 0.83 H new ATOM 0 HE3 LYS A 20 25.731 -7.671 8.456 1.00 0.83 H new ATOM 0 HZ1 LYS A 20 23.721 -8.553 8.644 1.00 1.34 H new ATOM 0 HZ2 LYS A 20 24.028 -9.643 7.379 1.00 1.34 H new ATOM 0 HZ3 LYS A 20 24.404 -10.071 8.979 1.00 1.34 H new ATOM 309 N THR A 21 23.597 -6.235 2.648 1.00 0.34 N ATOM 310 CA THR A 21 22.302 -5.586 2.601 1.00 0.36 C ATOM 311 C THR A 21 21.247 -6.478 3.233 1.00 0.36 C ATOM 312 O THR A 21 21.072 -7.624 2.825 1.00 0.40 O ATOM 313 CB THR A 21 21.903 -5.279 1.148 1.00 0.44 C ATOM 314 OG1 THR A 21 22.981 -4.589 0.503 1.00 0.49 O ATOM 315 CG2 THR A 21 20.632 -4.436 1.089 1.00 0.50 C ATOM 0 H THR A 21 23.736 -6.934 1.918 1.00 0.34 H new ATOM 0 HA THR A 21 22.370 -4.651 3.157 1.00 0.36 H new ATOM 0 HB THR A 21 21.701 -6.219 0.634 1.00 0.44 H new ATOM 0 HG1 THR A 21 22.734 -4.391 -0.425 1.00 0.49 H new ATOM 0 HG21 THR A 21 20.376 -4.236 0.049 1.00 0.50 H new ATOM 0 HG22 THR A 21 19.815 -4.976 1.566 1.00 0.50 H new ATOM 0 HG23 THR A 21 20.796 -3.493 1.610 1.00 0.50 H new ATOM 323 N ILE A 22 20.553 -5.955 4.231 1.00 0.40 N ATOM 324 CA ILE A 22 19.536 -6.725 4.918 1.00 0.43 C ATOM 325 C ILE A 22 18.242 -6.727 4.107 1.00 0.44 C ATOM 326 O ILE A 22 17.809 -5.691 3.601 1.00 0.55 O ATOM 327 CB ILE A 22 19.278 -6.193 6.349 1.00 0.56 C ATOM 328 CG1 ILE A 22 18.269 -7.085 7.074 1.00 0.63 C ATOM 329 CG2 ILE A 22 18.795 -4.747 6.330 1.00 0.67 C ATOM 330 CD1 ILE A 22 18.754 -8.503 7.293 1.00 0.66 C ATOM 0 H ILE A 22 20.676 -5.005 4.580 1.00 0.40 H new ATOM 0 HA ILE A 22 19.901 -7.748 5.013 1.00 0.43 H new ATOM 0 HB ILE A 22 20.224 -6.218 6.890 1.00 0.56 H new ATOM 0 HG12 ILE A 22 18.032 -6.639 8.040 1.00 0.63 H new ATOM 0 HG13 ILE A 22 17.343 -7.112 6.499 1.00 0.63 H new ATOM 0 HG21 ILE A 22 18.624 -4.407 7.351 1.00 0.67 H new ATOM 0 HG22 ILE A 22 19.550 -4.117 5.859 1.00 0.67 H new ATOM 0 HG23 ILE A 22 17.865 -4.681 5.765 1.00 0.67 H new ATOM 0 HD11 ILE A 22 17.985 -9.075 7.812 1.00 0.66 H new ATOM 0 HD12 ILE A 22 18.964 -8.969 6.330 1.00 0.66 H new ATOM 0 HD13 ILE A 22 19.663 -8.488 7.894 1.00 0.66 H new ATOM 342 N LEU A 23 17.659 -7.905 3.945 1.00 0.41 N ATOM 343 CA LEU A 23 16.405 -8.041 3.221 1.00 0.47 C ATOM 344 C LEU A 23 15.285 -8.481 4.150 1.00 0.50 C ATOM 345 O LEU A 23 14.223 -7.864 4.193 1.00 0.67 O ATOM 346 CB LEU A 23 16.532 -9.043 2.066 1.00 0.54 C ATOM 347 CG LEU A 23 17.118 -8.487 0.759 1.00 0.53 C ATOM 348 CD1 LEU A 23 16.340 -7.262 0.310 1.00 0.83 C ATOM 349 CD2 LEU A 23 18.594 -8.158 0.912 1.00 0.64 C ATOM 0 H LEU A 23 18.035 -8.782 4.306 1.00 0.41 H new ATOM 0 HA LEU A 23 16.165 -7.061 2.810 1.00 0.47 H new ATOM 0 HB2 LEU A 23 17.156 -9.873 2.397 1.00 0.54 H new ATOM 0 HB3 LEU A 23 15.544 -9.451 1.854 1.00 0.54 H new ATOM 0 HG LEU A 23 17.028 -9.258 -0.006 1.00 0.53 H new ATOM 0 HD11 LEU A 23 16.767 -6.879 -0.617 1.00 0.83 H new ATOM 0 HD12 LEU A 23 15.297 -7.534 0.144 1.00 0.83 H new ATOM 0 HD13 LEU A 23 16.397 -6.493 1.080 1.00 0.83 H new ATOM 0 HD21 LEU A 23 18.979 -7.767 -0.030 1.00 0.64 H new ATOM 0 HD22 LEU A 23 18.721 -7.410 1.695 1.00 0.64 H new ATOM 0 HD23 LEU A 23 19.142 -9.061 1.181 1.00 0.64 H new ATOM 361 N LYS A 24 15.527 -9.544 4.905 1.00 0.49 N ATOM 362 CA LYS A 24 14.500 -10.108 5.757 1.00 0.60 C ATOM 363 C LYS A 24 15.036 -10.317 7.167 1.00 0.60 C ATOM 364 O LYS A 24 15.978 -11.084 7.372 1.00 0.76 O ATOM 365 CB LYS A 24 14.001 -11.432 5.156 1.00 0.78 C ATOM 366 CG LYS A 24 12.680 -11.923 5.735 1.00 1.05 C ATOM 367 CD LYS A 24 12.873 -12.693 7.033 1.00 1.11 C ATOM 368 CE LYS A 24 12.547 -14.169 6.858 1.00 1.12 C ATOM 369 NZ LYS A 24 11.106 -14.390 6.557 1.00 1.56 N ATOM 0 H LYS A 24 16.424 -10.029 4.942 1.00 0.49 H new ATOM 0 HA LYS A 24 13.661 -9.414 5.818 1.00 0.60 H new ATOM 0 HB2 LYS A 24 13.889 -11.310 4.079 1.00 0.78 H new ATOM 0 HB3 LYS A 24 14.760 -12.198 5.313 1.00 0.78 H new ATOM 0 HG2 LYS A 24 12.024 -11.071 5.914 1.00 1.05 H new ATOM 0 HG3 LYS A 24 12.181 -12.562 5.006 1.00 1.05 H new ATOM 0 HD2 LYS A 24 13.903 -12.584 7.372 1.00 1.11 H new ATOM 0 HD3 LYS A 24 12.236 -12.268 7.808 1.00 1.11 H new ATOM 0 HE2 LYS A 24 13.153 -14.581 6.051 1.00 1.12 H new ATOM 0 HE3 LYS A 24 12.815 -14.710 7.766 1.00 1.12 H new ATOM 0 HZ1 LYS A 24 10.840 -15.360 6.823 1.00 1.56 H new ATOM 0 HZ2 LYS A 24 10.531 -13.713 7.097 1.00 1.56 H new ATOM 0 HZ3 LYS A 24 10.939 -14.252 5.540 1.00 1.56 H new ATOM 383 N LYS A 25 14.443 -9.620 8.127 1.00 0.61 N ATOM 384 CA LYS A 25 14.806 -9.783 9.526 1.00 0.64 C ATOM 385 C LYS A 25 13.780 -10.638 10.239 1.00 0.72 C ATOM 386 O LYS A 25 12.654 -10.796 9.767 1.00 0.90 O ATOM 387 CB LYS A 25 14.939 -8.427 10.230 1.00 0.76 C ATOM 388 CG LYS A 25 16.259 -7.730 9.958 1.00 1.52 C ATOM 389 CD LYS A 25 16.386 -6.436 10.743 1.00 1.72 C ATOM 390 CE LYS A 25 17.777 -5.832 10.616 1.00 2.60 C ATOM 391 NZ LYS A 25 18.808 -6.635 11.331 1.00 2.95 N ATOM 0 H LYS A 25 13.706 -8.934 7.960 1.00 0.61 H new ATOM 0 HA LYS A 25 15.775 -10.281 9.563 1.00 0.64 H new ATOM 0 HB2 LYS A 25 14.123 -7.779 9.910 1.00 0.76 H new ATOM 0 HB3 LYS A 25 14.829 -8.572 11.305 1.00 0.76 H new ATOM 0 HG2 LYS A 25 17.082 -8.396 10.219 1.00 1.52 H new ATOM 0 HG3 LYS A 25 16.346 -7.519 8.892 1.00 1.52 H new ATOM 0 HD2 LYS A 25 15.645 -5.720 10.386 1.00 1.72 H new ATOM 0 HD3 LYS A 25 16.166 -6.625 11.794 1.00 1.72 H new ATOM 0 HE2 LYS A 25 18.044 -5.758 9.562 1.00 2.60 H new ATOM 0 HE3 LYS A 25 17.768 -4.818 11.015 1.00 2.60 H new ATOM 0 HZ1 LYS A 25 19.686 -6.084 11.407 1.00 2.95 H new ATOM 0 HZ2 LYS A 25 18.464 -6.872 12.284 1.00 2.95 H new ATOM 0 HZ3 LYS A 25 18.994 -7.511 10.802 1.00 2.95 H new ATOM 405 N GLY A 26 14.177 -11.186 11.374 1.00 0.69 N ATOM 406 CA GLY A 26 13.284 -12.018 12.145 1.00 0.85 C ATOM 407 C GLY A 26 12.716 -11.283 13.336 1.00 0.88 C ATOM 408 O GLY A 26 12.449 -10.082 13.266 1.00 1.32 O ATOM 0 H GLY A 26 15.107 -11.068 11.776 1.00 0.69 H new ATOM 0 HA2 GLY A 26 12.469 -12.363 11.509 1.00 0.85 H new ATOM 0 HA3 GLY A 26 13.818 -12.905 12.487 1.00 0.85 H new ATOM 412 N ASP A 27 12.573 -11.990 14.443 1.00 0.84 N ATOM 413 CA ASP A 27 11.957 -11.421 15.636 1.00 1.01 C ATOM 414 C ASP A 27 12.849 -11.643 16.847 1.00 0.93 C ATOM 415 O ASP A 27 13.528 -10.723 17.313 1.00 1.24 O ATOM 416 CB ASP A 27 10.572 -12.037 15.888 1.00 1.33 C ATOM 417 CG ASP A 27 9.557 -11.689 14.816 1.00 2.08 C ATOM 418 OD1 ASP A 27 9.538 -12.373 13.771 1.00 2.77 O ATOM 419 OD2 ASP A 27 8.790 -10.719 15.003 1.00 2.38 O ATOM 0 H ASP A 27 12.874 -12.959 14.544 1.00 0.84 H new ATOM 0 HA ASP A 27 11.834 -10.350 15.473 1.00 1.01 H new ATOM 0 HB2 ASP A 27 10.670 -13.121 15.948 1.00 1.33 H new ATOM 0 HB3 ASP A 27 10.201 -11.696 16.855 1.00 1.33 H new ATOM 424 N GLU A 28 12.854 -12.867 17.351 1.00 0.91 N ATOM 425 CA GLU A 28 13.726 -13.232 18.452 1.00 0.91 C ATOM 426 C GLU A 28 14.729 -14.284 17.999 1.00 0.96 C ATOM 427 O GLU A 28 14.749 -14.677 16.831 1.00 1.22 O ATOM 428 CB GLU A 28 12.921 -13.746 19.656 1.00 1.11 C ATOM 429 CG GLU A 28 12.143 -15.029 19.396 1.00 1.59 C ATOM 430 CD GLU A 28 10.915 -14.818 18.538 1.00 2.09 C ATOM 431 OE1 GLU A 28 9.835 -14.542 19.098 1.00 2.64 O ATOM 432 OE2 GLU A 28 11.029 -14.920 17.296 1.00 2.56 O ATOM 0 H GLU A 28 12.261 -13.625 17.013 1.00 0.91 H new ATOM 0 HA GLU A 28 14.264 -12.338 18.767 1.00 0.91 H new ATOM 0 HB2 GLU A 28 13.604 -13.913 20.489 1.00 1.11 H new ATOM 0 HB3 GLU A 28 12.222 -12.970 19.968 1.00 1.11 H new ATOM 0 HG2 GLU A 28 12.798 -15.751 18.910 1.00 1.59 H new ATOM 0 HG3 GLU A 28 11.842 -15.463 20.349 1.00 1.59 H new ATOM 439 N GLY A 29 15.563 -14.722 18.921 1.00 0.88 N ATOM 440 CA GLY A 29 16.570 -15.708 18.611 1.00 1.04 C ATOM 441 C GLY A 29 17.613 -15.782 19.703 1.00 0.79 C ATOM 442 O GLY A 29 18.808 -15.694 19.438 1.00 0.90 O ATOM 0 H GLY A 29 15.560 -14.408 19.891 1.00 0.88 H new ATOM 0 HA2 GLY A 29 16.101 -16.684 18.485 1.00 1.04 H new ATOM 0 HA3 GLY A 29 17.048 -15.459 17.664 1.00 1.04 H new ATOM 446 N GLU A 30 17.147 -15.950 20.934 1.00 0.73 N ATOM 447 CA GLU A 30 18.015 -15.957 22.107 1.00 0.80 C ATOM 448 C GLU A 30 19.037 -17.088 22.023 1.00 0.78 C ATOM 449 O GLU A 30 20.207 -16.911 22.361 1.00 0.96 O ATOM 450 CB GLU A 30 17.165 -16.108 23.370 1.00 1.08 C ATOM 451 CG GLU A 30 17.966 -16.123 24.662 1.00 1.35 C ATOM 452 CD GLU A 30 17.094 -16.353 25.876 1.00 1.68 C ATOM 453 OE1 GLU A 30 16.781 -17.523 26.177 1.00 2.29 O ATOM 454 OE2 GLU A 30 16.722 -15.364 26.543 1.00 1.89 O ATOM 0 H GLU A 30 16.159 -16.085 21.148 1.00 0.73 H new ATOM 0 HA GLU A 30 18.559 -15.013 22.145 1.00 0.80 H new ATOM 0 HB2 GLU A 30 16.446 -15.290 23.411 1.00 1.08 H new ATOM 0 HB3 GLU A 30 16.592 -17.032 23.300 1.00 1.08 H new ATOM 0 HG2 GLU A 30 18.723 -16.905 24.608 1.00 1.35 H new ATOM 0 HG3 GLU A 30 18.494 -15.175 24.771 1.00 1.35 H new ATOM 461 N GLU A 31 18.588 -18.243 21.558 1.00 0.76 N ATOM 462 CA GLU A 31 19.448 -19.409 21.438 1.00 0.86 C ATOM 463 C GLU A 31 19.744 -19.704 19.974 1.00 0.78 C ATOM 464 O GLU A 31 20.323 -20.739 19.639 1.00 1.11 O ATOM 465 CB GLU A 31 18.806 -20.632 22.115 1.00 1.09 C ATOM 466 CG GLU A 31 17.434 -21.026 21.567 1.00 1.56 C ATOM 467 CD GLU A 31 16.351 -20.016 21.893 1.00 2.17 C ATOM 468 OE1 GLU A 31 15.898 -19.979 23.053 1.00 2.54 O ATOM 469 OE2 GLU A 31 15.966 -19.238 20.991 1.00 2.64 O ATOM 0 H GLU A 31 17.626 -18.398 21.256 1.00 0.76 H new ATOM 0 HA GLU A 31 20.389 -19.193 21.945 1.00 0.86 H new ATOM 0 HB2 GLU A 31 19.480 -21.482 22.011 1.00 1.09 H new ATOM 0 HB3 GLU A 31 18.710 -20.430 23.182 1.00 1.09 H new ATOM 0 HG2 GLU A 31 17.501 -21.142 20.485 1.00 1.56 H new ATOM 0 HG3 GLU A 31 17.152 -21.997 21.974 1.00 1.56 H new ATOM 476 N ASN A 32 19.358 -18.787 19.101 1.00 0.51 N ATOM 477 CA ASN A 32 19.597 -18.956 17.678 1.00 0.55 C ATOM 478 C ASN A 32 20.619 -17.942 17.191 1.00 0.49 C ATOM 479 O ASN A 32 20.273 -16.938 16.566 1.00 0.57 O ATOM 480 CB ASN A 32 18.297 -18.825 16.876 1.00 0.71 C ATOM 481 CG ASN A 32 17.284 -19.912 17.190 1.00 0.95 C ATOM 482 OD1 ASN A 32 16.078 -19.699 17.079 1.00 1.45 O ATOM 483 ND2 ASN A 32 17.763 -21.081 17.588 1.00 1.19 N ATOM 0 H ASN A 32 18.880 -17.922 19.352 1.00 0.51 H new ATOM 0 HA ASN A 32 19.990 -19.960 17.521 1.00 0.55 H new ATOM 0 HB2 ASN A 32 17.850 -17.852 17.079 1.00 0.71 H new ATOM 0 HB3 ASN A 32 18.531 -18.853 15.812 1.00 0.71 H new ATOM 0 HD21 ASN A 32 17.124 -21.843 17.815 1.00 1.19 H new ATOM 0 HD22 ASN A 32 18.770 -21.219 17.668 1.00 1.19 H new ATOM 490 N ILE A 33 21.879 -18.220 17.485 1.00 0.47 N ATOM 491 CA ILE A 33 22.976 -17.339 17.116 1.00 0.51 C ATOM 492 C ILE A 33 24.108 -18.147 16.481 1.00 0.44 C ATOM 493 O ILE A 33 24.640 -19.069 17.096 1.00 0.47 O ATOM 494 CB ILE A 33 23.519 -16.566 18.344 1.00 0.66 C ATOM 495 CG1 ILE A 33 22.446 -15.631 18.923 1.00 0.74 C ATOM 496 CG2 ILE A 33 24.774 -15.784 17.980 1.00 0.76 C ATOM 497 CD1 ILE A 33 22.046 -14.507 17.992 1.00 0.81 C ATOM 0 H ILE A 33 22.170 -19.060 17.985 1.00 0.47 H new ATOM 0 HA ILE A 33 22.592 -16.615 16.397 1.00 0.51 H new ATOM 0 HB ILE A 33 23.782 -17.295 19.110 1.00 0.66 H new ATOM 0 HG12 ILE A 33 21.561 -16.218 19.170 1.00 0.74 H new ATOM 0 HG13 ILE A 33 22.815 -15.204 19.855 1.00 0.74 H new ATOM 0 HG21 ILE A 33 25.137 -15.249 18.858 1.00 0.76 H new ATOM 0 HG22 ILE A 33 25.543 -16.473 17.631 1.00 0.76 H new ATOM 0 HG23 ILE A 33 24.541 -15.069 17.191 1.00 0.76 H new ATOM 0 HD11 ILE A 33 21.285 -13.891 18.471 1.00 0.81 H new ATOM 0 HD12 ILE A 33 22.919 -13.895 17.765 1.00 0.81 H new ATOM 0 HD13 ILE A 33 21.645 -14.925 17.068 1.00 0.81 H new ATOM 509 N PRO A 34 24.469 -17.830 15.233 1.00 0.46 N ATOM 510 CA PRO A 34 25.543 -18.516 14.522 1.00 0.44 C ATOM 511 C PRO A 34 26.918 -17.902 14.800 1.00 0.52 C ATOM 512 O PRO A 34 27.169 -16.744 14.463 1.00 0.75 O ATOM 513 CB PRO A 34 25.149 -18.304 13.065 1.00 0.51 C ATOM 514 CG PRO A 34 24.487 -16.963 13.050 1.00 0.54 C ATOM 515 CD PRO A 34 23.850 -16.779 14.406 1.00 0.62 C ATOM 0 HA PRO A 34 25.643 -19.560 14.819 1.00 0.44 H new ATOM 0 HB2 PRO A 34 26.021 -18.324 12.411 1.00 0.51 H new ATOM 0 HB3 PRO A 34 24.472 -19.085 12.719 1.00 0.51 H new ATOM 0 HG2 PRO A 34 25.214 -16.175 12.854 1.00 0.54 H new ATOM 0 HG3 PRO A 34 23.738 -16.910 12.260 1.00 0.54 H new ATOM 0 HD2 PRO A 34 24.047 -15.786 14.809 1.00 0.62 H new ATOM 0 HD3 PRO A 34 22.767 -16.894 14.358 1.00 0.62 H new ATOM 523 N LYS A 35 27.809 -18.663 15.424 1.00 0.49 N ATOM 524 CA LYS A 35 29.145 -18.156 15.715 1.00 0.60 C ATOM 525 C LYS A 35 30.222 -19.130 15.257 1.00 0.56 C ATOM 526 O LYS A 35 29.970 -20.324 15.087 1.00 0.58 O ATOM 527 CB LYS A 35 29.310 -17.847 17.206 1.00 0.83 C ATOM 528 CG LYS A 35 28.467 -16.674 17.684 1.00 1.17 C ATOM 529 CD LYS A 35 28.742 -15.413 16.875 1.00 1.46 C ATOM 530 CE LYS A 35 27.809 -14.282 17.275 1.00 1.98 C ATOM 531 NZ LYS A 35 27.900 -13.117 16.353 1.00 2.66 N ATOM 0 H LYS A 35 27.635 -19.619 15.734 1.00 0.49 H new ATOM 0 HA LYS A 35 29.264 -17.228 15.156 1.00 0.60 H new ATOM 0 HB2 LYS A 35 29.045 -18.733 17.783 1.00 0.83 H new ATOM 0 HB3 LYS A 35 30.360 -17.636 17.410 1.00 0.83 H new ATOM 0 HG2 LYS A 35 27.410 -16.931 17.609 1.00 1.17 H new ATOM 0 HG3 LYS A 35 28.674 -16.483 18.737 1.00 1.17 H new ATOM 0 HD2 LYS A 35 29.776 -15.103 17.023 1.00 1.46 H new ATOM 0 HD3 LYS A 35 28.622 -15.627 15.813 1.00 1.46 H new ATOM 0 HE2 LYS A 35 26.783 -14.650 17.291 1.00 1.98 H new ATOM 0 HE3 LYS A 35 28.048 -13.959 18.288 1.00 1.98 H new ATOM 0 HZ1 LYS A 35 27.310 -12.341 16.715 1.00 2.66 H new ATOM 0 HZ2 LYS A 35 28.889 -12.800 16.291 1.00 2.66 H new ATOM 0 HZ3 LYS A 35 27.566 -13.395 15.408 1.00 2.66 H new ATOM 545 N LYS A 36 31.422 -18.594 15.061 1.00 0.67 N ATOM 546 CA LYS A 36 32.553 -19.356 14.548 1.00 0.82 C ATOM 547 C LYS A 36 32.983 -20.444 15.531 1.00 0.84 C ATOM 548 O LYS A 36 32.830 -20.291 16.742 1.00 0.91 O ATOM 549 CB LYS A 36 33.726 -18.416 14.288 1.00 1.09 C ATOM 550 CG LYS A 36 34.859 -19.048 13.500 1.00 1.26 C ATOM 551 CD LYS A 36 36.200 -18.425 13.843 1.00 1.36 C ATOM 552 CE LYS A 36 36.228 -16.922 13.577 1.00 2.14 C ATOM 553 NZ LYS A 36 36.056 -16.589 12.134 1.00 2.51 N ATOM 0 H LYS A 36 31.637 -17.616 15.254 1.00 0.67 H new ATOM 0 HA LYS A 36 32.245 -19.837 13.620 1.00 0.82 H new ATOM 0 HB2 LYS A 36 33.365 -17.541 13.747 1.00 1.09 H new ATOM 0 HB3 LYS A 36 34.114 -18.063 15.243 1.00 1.09 H new ATOM 0 HG2 LYS A 36 34.892 -20.118 13.705 1.00 1.26 H new ATOM 0 HG3 LYS A 36 34.667 -18.934 12.433 1.00 1.26 H new ATOM 0 HD2 LYS A 36 36.425 -18.610 14.893 1.00 1.36 H new ATOM 0 HD3 LYS A 36 36.983 -18.909 13.259 1.00 1.36 H new ATOM 0 HE2 LYS A 36 35.438 -16.441 14.153 1.00 2.14 H new ATOM 0 HE3 LYS A 36 37.175 -16.512 13.930 1.00 2.14 H new ATOM 0 HZ1 LYS A 36 35.779 -15.591 12.039 1.00 2.51 H new ATOM 0 HZ2 LYS A 36 36.952 -16.749 11.631 1.00 2.51 H new ATOM 0 HZ3 LYS A 36 35.316 -17.194 11.724 1.00 2.51 H new ATOM 567 N GLY A 37 33.524 -21.534 14.999 1.00 0.92 N ATOM 568 CA GLY A 37 33.937 -22.646 15.832 1.00 1.04 C ATOM 569 C GLY A 37 32.854 -23.693 15.909 1.00 0.96 C ATOM 570 O GLY A 37 33.074 -24.813 16.379 1.00 1.12 O ATOM 0 H GLY A 37 33.684 -21.667 14.000 1.00 0.92 H new ATOM 0 HA2 GLY A 37 34.848 -23.089 15.429 1.00 1.04 H new ATOM 0 HA3 GLY A 37 34.173 -22.287 16.834 1.00 1.04 H new ATOM 574 N ASN A 38 31.677 -23.321 15.433 1.00 0.79 N ATOM 575 CA ASN A 38 30.535 -24.222 15.410 1.00 0.75 C ATOM 576 C ASN A 38 30.271 -24.727 13.999 1.00 0.72 C ATOM 577 O ASN A 38 30.637 -24.083 13.013 1.00 0.79 O ATOM 578 CB ASN A 38 29.280 -23.533 15.951 1.00 0.75 C ATOM 579 CG ASN A 38 29.330 -23.299 17.448 1.00 0.87 C ATOM 580 OD1 ASN A 38 28.987 -24.183 18.234 1.00 1.38 O ATOM 581 ND2 ASN A 38 29.730 -22.103 17.847 1.00 0.98 N ATOM 0 H ASN A 38 31.486 -22.393 15.054 1.00 0.79 H new ATOM 0 HA ASN A 38 30.775 -25.070 16.051 1.00 0.75 H new ATOM 0 HB2 ASN A 38 29.150 -22.577 15.444 1.00 0.75 H new ATOM 0 HB3 ASN A 38 28.407 -24.141 15.713 1.00 0.75 H new ATOM 0 HD21 ASN A 38 29.764 -21.882 18.842 1.00 0.98 H new ATOM 0 HD22 ASN A 38 30.005 -21.402 17.159 1.00 0.98 H new ATOM 588 N GLU A 39 29.629 -25.881 13.912 1.00 0.71 N ATOM 589 CA GLU A 39 29.293 -26.477 12.628 1.00 0.73 C ATOM 590 C GLU A 39 27.980 -25.917 12.103 1.00 0.63 C ATOM 591 O GLU A 39 26.906 -26.266 12.596 1.00 0.69 O ATOM 592 CB GLU A 39 29.204 -27.995 12.760 1.00 0.86 C ATOM 593 CG GLU A 39 30.542 -28.650 13.048 1.00 1.37 C ATOM 594 CD GLU A 39 30.403 -30.110 13.412 1.00 1.73 C ATOM 595 OE1 GLU A 39 30.397 -30.949 12.491 1.00 2.20 O ATOM 596 OE2 GLU A 39 30.302 -30.424 14.614 1.00 2.17 O ATOM 0 H GLU A 39 29.329 -26.426 14.720 1.00 0.71 H new ATOM 0 HA GLU A 39 30.081 -26.230 11.916 1.00 0.73 H new ATOM 0 HB2 GLU A 39 28.506 -28.243 13.559 1.00 0.86 H new ATOM 0 HB3 GLU A 39 28.795 -28.410 11.839 1.00 0.86 H new ATOM 0 HG2 GLU A 39 31.185 -28.556 12.173 1.00 1.37 H new ATOM 0 HG3 GLU A 39 31.034 -28.120 13.864 1.00 1.37 H new ATOM 603 N VAL A 40 28.078 -25.029 11.121 1.00 0.60 N ATOM 604 CA VAL A 40 26.899 -24.450 10.492 1.00 0.54 C ATOM 605 C VAL A 40 26.850 -24.807 9.008 1.00 0.54 C ATOM 606 O VAL A 40 27.859 -25.210 8.427 1.00 0.67 O ATOM 607 CB VAL A 40 26.865 -22.909 10.640 1.00 0.57 C ATOM 608 CG1 VAL A 40 27.058 -22.501 12.092 1.00 0.61 C ATOM 609 CG2 VAL A 40 27.912 -22.249 9.758 1.00 0.67 C ATOM 0 H VAL A 40 28.964 -24.694 10.743 1.00 0.60 H new ATOM 0 HA VAL A 40 26.031 -24.868 11.002 1.00 0.54 H new ATOM 0 HB VAL A 40 25.883 -22.566 10.313 1.00 0.57 H new ATOM 0 HG11 VAL A 40 27.030 -21.414 12.171 1.00 0.61 H new ATOM 0 HG12 VAL A 40 26.261 -22.929 12.699 1.00 0.61 H new ATOM 0 HG13 VAL A 40 28.021 -22.866 12.448 1.00 0.61 H new ATOM 0 HG21 VAL A 40 27.864 -21.167 9.883 1.00 0.67 H new ATOM 0 HG22 VAL A 40 28.903 -22.604 10.042 1.00 0.67 H new ATOM 0 HG23 VAL A 40 27.721 -22.502 8.715 1.00 0.67 H new ATOM 619 N THR A 41 25.673 -24.662 8.419 1.00 0.46 N ATOM 620 CA THR A 41 25.467 -24.890 6.999 1.00 0.48 C ATOM 621 C THR A 41 24.660 -23.742 6.409 1.00 0.42 C ATOM 622 O THR A 41 23.545 -23.469 6.858 1.00 0.44 O ATOM 623 CB THR A 41 24.714 -26.210 6.748 1.00 0.56 C ATOM 624 OG1 THR A 41 25.383 -27.289 7.415 1.00 0.65 O ATOM 625 CG2 THR A 41 24.633 -26.509 5.262 1.00 0.63 C ATOM 0 H THR A 41 24.829 -24.381 8.917 1.00 0.46 H new ATOM 0 HA THR A 41 26.446 -24.950 6.523 1.00 0.48 H new ATOM 0 HB THR A 41 23.703 -26.106 7.141 1.00 0.56 H new ATOM 0 HG1 THR A 41 24.898 -28.125 7.252 1.00 0.65 H new ATOM 0 HG21 THR A 41 24.097 -27.446 5.108 1.00 0.63 H new ATOM 0 HG22 THR A 41 24.104 -25.701 4.757 1.00 0.63 H new ATOM 0 HG23 THR A 41 25.640 -26.595 4.853 1.00 0.63 H new ATOM 633 N VAL A 42 25.225 -23.057 5.427 1.00 0.40 N ATOM 634 CA VAL A 42 24.537 -21.940 4.798 1.00 0.42 C ATOM 635 C VAL A 42 24.519 -22.076 3.278 1.00 0.43 C ATOM 636 O VAL A 42 25.431 -22.647 2.683 1.00 0.49 O ATOM 637 CB VAL A 42 25.178 -20.585 5.178 1.00 0.46 C ATOM 638 CG1 VAL A 42 25.041 -20.314 6.670 1.00 0.80 C ATOM 639 CG2 VAL A 42 26.643 -20.544 4.758 1.00 0.87 C ATOM 0 H VAL A 42 26.152 -23.253 5.050 1.00 0.40 H new ATOM 0 HA VAL A 42 23.513 -21.963 5.170 1.00 0.42 H new ATOM 0 HB VAL A 42 24.644 -19.800 4.642 1.00 0.46 H new ATOM 0 HG11 VAL A 42 25.500 -19.355 6.909 1.00 0.80 H new ATOM 0 HG12 VAL A 42 23.985 -20.288 6.940 1.00 0.80 H new ATOM 0 HG13 VAL A 42 25.539 -21.105 7.231 1.00 0.80 H new ATOM 0 HG21 VAL A 42 27.074 -19.582 5.035 1.00 0.87 H new ATOM 0 HG22 VAL A 42 27.188 -21.344 5.260 1.00 0.87 H new ATOM 0 HG23 VAL A 42 26.716 -20.677 3.679 1.00 0.87 H new ATOM 649 N HIS A 43 23.467 -21.561 2.658 1.00 0.44 N ATOM 650 CA HIS A 43 23.380 -21.526 1.203 1.00 0.49 C ATOM 651 C HIS A 43 23.722 -20.129 0.713 1.00 0.47 C ATOM 652 O HIS A 43 23.383 -19.146 1.374 1.00 0.53 O ATOM 653 CB HIS A 43 21.976 -21.894 0.707 1.00 0.64 C ATOM 654 CG HIS A 43 21.537 -23.288 1.032 1.00 1.16 C ATOM 655 ND1 HIS A 43 20.316 -23.571 1.598 1.00 2.00 N ATOM 656 CD2 HIS A 43 22.140 -24.486 0.827 1.00 2.04 C ATOM 657 CE1 HIS A 43 20.183 -24.874 1.729 1.00 2.74 C ATOM 658 NE2 HIS A 43 21.275 -25.458 1.271 1.00 2.75 N ATOM 0 H HIS A 43 22.661 -21.161 3.139 1.00 0.44 H new ATOM 0 HA HIS A 43 24.085 -22.259 0.810 1.00 0.49 H new ATOM 0 HB2 HIS A 43 21.260 -21.194 1.137 1.00 0.64 H new ATOM 0 HB3 HIS A 43 21.942 -21.761 -0.374 1.00 0.64 H new ATOM 0 HD1 HIS A 43 19.620 -22.878 1.874 1.00 2.00 H new ATOM 0 HD2 HIS A 43 23.117 -24.646 0.396 1.00 2.04 H new ATOM 0 HE1 HIS A 43 19.324 -25.381 2.142 1.00 2.74 H new ATOM 667 N TYR A 44 24.393 -20.039 -0.425 1.00 0.44 N ATOM 668 CA TYR A 44 24.712 -18.746 -1.014 1.00 0.42 C ATOM 669 C TYR A 44 24.589 -18.806 -2.534 1.00 0.41 C ATOM 670 O TYR A 44 24.997 -19.785 -3.159 1.00 0.47 O ATOM 671 CB TYR A 44 26.114 -18.277 -0.600 1.00 0.46 C ATOM 672 CG TYR A 44 27.247 -19.152 -1.091 1.00 0.50 C ATOM 673 CD1 TYR A 44 27.546 -20.357 -0.467 1.00 0.52 C ATOM 674 CD2 TYR A 44 28.023 -18.764 -2.174 1.00 0.60 C ATOM 675 CE1 TYR A 44 28.587 -21.149 -0.910 1.00 0.60 C ATOM 676 CE2 TYR A 44 29.063 -19.549 -2.624 1.00 0.68 C ATOM 677 CZ TYR A 44 29.340 -20.741 -1.989 1.00 0.66 C ATOM 678 OH TYR A 44 30.383 -21.523 -2.432 1.00 0.76 O ATOM 0 H TYR A 44 24.726 -20.842 -0.958 1.00 0.44 H new ATOM 0 HA TYR A 44 23.994 -18.018 -0.637 1.00 0.42 H new ATOM 0 HB2 TYR A 44 26.268 -17.264 -0.973 1.00 0.46 H new ATOM 0 HB3 TYR A 44 26.158 -18.226 0.488 1.00 0.46 H new ATOM 0 HD1 TYR A 44 26.955 -20.679 0.378 1.00 0.52 H new ATOM 0 HD2 TYR A 44 27.808 -17.831 -2.673 1.00 0.60 H new ATOM 0 HE1 TYR A 44 28.809 -22.082 -0.414 1.00 0.60 H new ATOM 0 HE2 TYR A 44 29.657 -19.232 -3.469 1.00 0.68 H new ATOM 0 HH TYR A 44 31.183 -20.968 -2.543 1.00 0.76 H new ATOM 688 N VAL A 45 23.991 -17.771 -3.109 1.00 0.35 N ATOM 689 CA VAL A 45 23.825 -17.670 -4.555 1.00 0.36 C ATOM 690 C VAL A 45 23.390 -16.245 -4.912 1.00 0.30 C ATOM 691 O VAL A 45 22.906 -15.516 -4.046 1.00 0.30 O ATOM 692 CB VAL A 45 22.784 -18.698 -5.074 1.00 0.44 C ATOM 693 CG1 VAL A 45 21.379 -18.338 -4.609 1.00 0.47 C ATOM 694 CG2 VAL A 45 22.844 -18.831 -6.591 1.00 0.49 C ATOM 0 H VAL A 45 23.609 -16.981 -2.590 1.00 0.35 H new ATOM 0 HA VAL A 45 24.777 -17.895 -5.035 1.00 0.36 H new ATOM 0 HB VAL A 45 23.038 -19.669 -4.648 1.00 0.44 H new ATOM 0 HG11 VAL A 45 20.671 -19.075 -4.987 1.00 0.47 H new ATOM 0 HG12 VAL A 45 21.347 -18.330 -3.519 1.00 0.47 H new ATOM 0 HG13 VAL A 45 21.112 -17.351 -4.987 1.00 0.47 H new ATOM 0 HG21 VAL A 45 22.103 -19.558 -6.922 1.00 0.49 H new ATOM 0 HG22 VAL A 45 22.634 -17.865 -7.050 1.00 0.49 H new ATOM 0 HG23 VAL A 45 23.838 -19.165 -6.888 1.00 0.49 H new ATOM 704 N GLY A 46 23.577 -15.840 -6.164 1.00 0.31 N ATOM 705 CA GLY A 46 23.178 -14.507 -6.575 1.00 0.30 C ATOM 706 C GLY A 46 23.558 -14.202 -8.009 1.00 0.30 C ATOM 707 O GLY A 46 23.111 -14.886 -8.936 1.00 0.36 O ATOM 0 H GLY A 46 23.996 -16.409 -6.899 1.00 0.31 H new ATOM 0 HA2 GLY A 46 22.099 -14.403 -6.459 1.00 0.30 H new ATOM 0 HA3 GLY A 46 23.642 -13.773 -5.916 1.00 0.30 H new ATOM 711 N LYS A 47 24.392 -13.185 -8.190 1.00 0.27 N ATOM 712 CA LYS A 47 24.828 -12.763 -9.517 1.00 0.29 C ATOM 713 C LYS A 47 26.231 -12.164 -9.443 1.00 0.25 C ATOM 714 O LYS A 47 26.767 -11.933 -8.356 1.00 0.26 O ATOM 715 CB LYS A 47 23.867 -11.717 -10.103 1.00 0.36 C ATOM 716 CG LYS A 47 23.841 -10.422 -9.315 1.00 0.42 C ATOM 717 CD LYS A 47 23.209 -9.270 -10.089 1.00 0.66 C ATOM 718 CE LYS A 47 23.281 -7.979 -9.282 1.00 0.83 C ATOM 719 NZ LYS A 47 22.744 -6.803 -10.018 1.00 1.43 N ATOM 0 H LYS A 47 24.783 -12.632 -7.427 1.00 0.27 H new ATOM 0 HA LYS A 47 24.834 -13.641 -10.163 1.00 0.29 H new ATOM 0 HB2 LYS A 47 24.157 -11.503 -11.132 1.00 0.36 H new ATOM 0 HB3 LYS A 47 22.861 -12.135 -10.136 1.00 0.36 H new ATOM 0 HG2 LYS A 47 23.288 -10.577 -8.388 1.00 0.42 H new ATOM 0 HG3 LYS A 47 24.860 -10.151 -9.037 1.00 0.42 H new ATOM 0 HD2 LYS A 47 23.723 -9.139 -11.041 1.00 0.66 H new ATOM 0 HD3 LYS A 47 22.169 -9.505 -10.317 1.00 0.66 H new ATOM 0 HE2 LYS A 47 22.723 -8.106 -8.354 1.00 0.83 H new ATOM 0 HE3 LYS A 47 24.318 -7.786 -9.007 1.00 0.83 H new ATOM 0 HZ1 LYS A 47 22.819 -5.955 -9.420 1.00 1.43 H new ATOM 0 HZ2 LYS A 47 23.291 -6.661 -10.891 1.00 1.43 H new ATOM 0 HZ3 LYS A 47 21.746 -6.970 -10.258 1.00 1.43 H new ATOM 733 N LEU A 48 26.811 -11.908 -10.603 1.00 0.27 N ATOM 734 CA LEU A 48 28.093 -11.224 -10.689 1.00 0.26 C ATOM 735 C LEU A 48 27.866 -9.716 -10.710 1.00 0.25 C ATOM 736 O LEU A 48 27.563 -9.147 -11.754 1.00 0.27 O ATOM 737 CB LEU A 48 28.849 -11.675 -11.944 1.00 0.29 C ATOM 738 CG LEU A 48 30.179 -10.960 -12.214 1.00 0.32 C ATOM 739 CD1 LEU A 48 31.140 -11.152 -11.054 1.00 0.36 C ATOM 740 CD2 LEU A 48 30.796 -11.463 -13.509 1.00 0.38 C ATOM 0 H LEU A 48 26.412 -12.165 -11.506 1.00 0.27 H new ATOM 0 HA LEU A 48 28.697 -11.477 -9.818 1.00 0.26 H new ATOM 0 HB2 LEU A 48 29.043 -12.745 -11.864 1.00 0.29 H new ATOM 0 HB3 LEU A 48 28.199 -11.532 -12.808 1.00 0.29 H new ATOM 0 HG LEU A 48 29.981 -9.893 -12.316 1.00 0.32 H new ATOM 0 HD11 LEU A 48 32.076 -10.636 -11.268 1.00 0.36 H new ATOM 0 HD12 LEU A 48 30.700 -10.742 -10.145 1.00 0.36 H new ATOM 0 HD13 LEU A 48 31.335 -12.215 -10.915 1.00 0.36 H new ATOM 0 HD21 LEU A 48 31.739 -10.947 -13.687 1.00 0.38 H new ATOM 0 HD22 LEU A 48 30.978 -12.535 -13.433 1.00 0.38 H new ATOM 0 HD23 LEU A 48 30.114 -11.269 -14.337 1.00 0.38 H new ATOM 752 N GLU A 49 28.008 -9.087 -9.549 1.00 0.29 N ATOM 753 CA GLU A 49 27.678 -7.668 -9.368 1.00 0.36 C ATOM 754 C GLU A 49 28.456 -6.762 -10.320 1.00 0.34 C ATOM 755 O GLU A 49 27.933 -5.754 -10.793 1.00 0.41 O ATOM 756 CB GLU A 49 27.958 -7.256 -7.922 1.00 0.50 C ATOM 757 CG GLU A 49 27.755 -5.773 -7.646 1.00 0.63 C ATOM 758 CD GLU A 49 26.300 -5.350 -7.691 1.00 1.20 C ATOM 759 OE1 GLU A 49 25.653 -5.508 -8.745 1.00 1.75 O ATOM 760 OE2 GLU A 49 25.803 -4.838 -6.670 1.00 1.96 O ATOM 0 H GLU A 49 28.354 -9.541 -8.704 1.00 0.29 H new ATOM 0 HA GLU A 49 26.619 -7.548 -9.597 1.00 0.36 H new ATOM 0 HB2 GLU A 49 27.309 -7.830 -7.260 1.00 0.50 H new ATOM 0 HB3 GLU A 49 28.985 -7.524 -7.672 1.00 0.50 H new ATOM 0 HG2 GLU A 49 28.166 -5.533 -6.665 1.00 0.63 H new ATOM 0 HG3 GLU A 49 28.318 -5.194 -8.378 1.00 0.63 H new ATOM 767 N SER A 50 29.696 -7.132 -10.606 1.00 0.33 N ATOM 768 CA SER A 50 30.583 -6.309 -11.425 1.00 0.40 C ATOM 769 C SER A 50 30.000 -6.030 -12.820 1.00 0.45 C ATOM 770 O SER A 50 30.414 -5.080 -13.486 1.00 0.55 O ATOM 771 CB SER A 50 31.952 -6.986 -11.543 1.00 0.46 C ATOM 772 OG SER A 50 32.900 -6.146 -12.183 1.00 0.67 O ATOM 0 H SER A 50 30.116 -8.003 -10.281 1.00 0.33 H new ATOM 0 HA SER A 50 30.691 -5.345 -10.929 1.00 0.40 H new ATOM 0 HB2 SER A 50 32.313 -7.252 -10.550 1.00 0.46 H new ATOM 0 HB3 SER A 50 31.851 -7.915 -12.104 1.00 0.46 H new ATOM 0 HG SER A 50 33.762 -6.609 -12.240 1.00 0.67 H new ATOM 778 N THR A 51 29.047 -6.845 -13.259 1.00 0.44 N ATOM 779 CA THR A 51 28.403 -6.623 -14.549 1.00 0.53 C ATOM 780 C THR A 51 26.879 -6.758 -14.427 1.00 0.54 C ATOM 781 O THR A 51 26.124 -6.086 -15.133 1.00 0.73 O ATOM 782 CB THR A 51 28.955 -7.585 -15.632 1.00 0.59 C ATOM 783 OG1 THR A 51 28.392 -7.276 -16.910 1.00 0.72 O ATOM 784 CG2 THR A 51 28.664 -9.035 -15.288 1.00 0.53 C ATOM 0 H THR A 51 28.706 -7.658 -12.746 1.00 0.44 H new ATOM 0 HA THR A 51 28.634 -5.605 -14.863 1.00 0.53 H new ATOM 0 HB THR A 51 30.036 -7.449 -15.668 1.00 0.59 H new ATOM 0 HG1 THR A 51 28.751 -7.891 -17.583 1.00 0.72 H new ATOM 0 HG21 THR A 51 29.065 -9.682 -16.069 1.00 0.53 H new ATOM 0 HG22 THR A 51 29.131 -9.284 -14.335 1.00 0.53 H new ATOM 0 HG23 THR A 51 27.587 -9.182 -15.213 1.00 0.53 H new ATOM 792 N GLY A 52 26.432 -7.606 -13.506 1.00 0.48 N ATOM 793 CA GLY A 52 25.011 -7.784 -13.273 1.00 0.51 C ATOM 794 C GLY A 52 24.459 -9.051 -13.896 1.00 0.54 C ATOM 795 O GLY A 52 23.246 -9.201 -14.029 1.00 0.78 O ATOM 0 H GLY A 52 27.034 -8.177 -12.913 1.00 0.48 H new ATOM 0 HA2 GLY A 52 24.825 -7.804 -12.199 1.00 0.51 H new ATOM 0 HA3 GLY A 52 24.473 -6.925 -13.674 1.00 0.51 H new ATOM 799 N LYS A 53 25.340 -9.970 -14.270 1.00 0.44 N ATOM 800 CA LYS A 53 24.911 -11.244 -14.836 1.00 0.49 C ATOM 801 C LYS A 53 24.515 -12.214 -13.735 1.00 0.41 C ATOM 802 O LYS A 53 25.295 -12.481 -12.819 1.00 0.38 O ATOM 803 CB LYS A 53 26.011 -11.867 -15.700 1.00 0.60 C ATOM 804 CG LYS A 53 26.152 -11.240 -17.081 1.00 0.84 C ATOM 805 CD LYS A 53 24.865 -11.358 -17.888 1.00 1.47 C ATOM 806 CE LYS A 53 24.430 -12.810 -18.063 1.00 2.09 C ATOM 807 NZ LYS A 53 25.360 -13.592 -18.921 1.00 2.89 N ATOM 0 H LYS A 53 26.351 -9.859 -14.193 1.00 0.44 H new ATOM 0 HA LYS A 53 24.045 -11.046 -15.467 1.00 0.49 H new ATOM 0 HB2 LYS A 53 26.962 -11.780 -15.175 1.00 0.60 H new ATOM 0 HB3 LYS A 53 25.807 -12.931 -15.816 1.00 0.60 H new ATOM 0 HG2 LYS A 53 26.421 -10.189 -16.978 1.00 0.84 H new ATOM 0 HG3 LYS A 53 26.965 -11.726 -17.620 1.00 0.84 H new ATOM 0 HD2 LYS A 53 24.072 -10.800 -17.390 1.00 1.47 H new ATOM 0 HD3 LYS A 53 25.008 -10.902 -18.868 1.00 1.47 H new ATOM 0 HE2 LYS A 53 24.361 -13.284 -17.084 1.00 2.09 H new ATOM 0 HE3 LYS A 53 23.432 -12.835 -18.500 1.00 2.09 H new ATOM 0 HZ1 LYS A 53 25.016 -14.570 -19.005 1.00 2.89 H new ATOM 0 HZ2 LYS A 53 25.408 -13.159 -19.866 1.00 2.89 H new ATOM 0 HZ3 LYS A 53 26.308 -13.594 -18.493 1.00 2.89 H new ATOM 821 N VAL A 54 23.302 -12.733 -13.832 1.00 0.44 N ATOM 822 CA VAL A 54 22.798 -13.695 -12.865 1.00 0.44 C ATOM 823 C VAL A 54 23.422 -15.072 -13.120 1.00 0.46 C ATOM 824 O VAL A 54 23.852 -15.369 -14.238 1.00 0.51 O ATOM 825 CB VAL A 54 21.252 -13.782 -12.927 1.00 0.52 C ATOM 826 CG1 VAL A 54 20.791 -14.392 -14.245 1.00 0.59 C ATOM 827 CG2 VAL A 54 20.699 -14.559 -11.739 1.00 0.57 C ATOM 0 H VAL A 54 22.644 -12.502 -14.576 1.00 0.44 H new ATOM 0 HA VAL A 54 23.078 -13.359 -11.866 1.00 0.44 H new ATOM 0 HB VAL A 54 20.858 -12.767 -12.873 1.00 0.52 H new ATOM 0 HG11 VAL A 54 19.702 -14.441 -14.262 1.00 0.59 H new ATOM 0 HG12 VAL A 54 21.139 -13.775 -15.073 1.00 0.59 H new ATOM 0 HG13 VAL A 54 21.201 -15.397 -14.344 1.00 0.59 H new ATOM 0 HG21 VAL A 54 19.612 -14.604 -11.808 1.00 0.57 H new ATOM 0 HG22 VAL A 54 21.106 -15.570 -11.745 1.00 0.57 H new ATOM 0 HG23 VAL A 54 20.983 -14.059 -10.813 1.00 0.57 H new ATOM 837 N PHE A 55 23.486 -15.898 -12.083 1.00 0.48 N ATOM 838 CA PHE A 55 24.117 -17.208 -12.193 1.00 0.54 C ATOM 839 C PHE A 55 23.239 -18.201 -12.945 1.00 0.61 C ATOM 840 O PHE A 55 22.285 -18.752 -12.395 1.00 0.78 O ATOM 841 CB PHE A 55 24.456 -17.775 -10.810 1.00 0.59 C ATOM 842 CG PHE A 55 25.514 -17.010 -10.070 1.00 0.47 C ATOM 843 CD1 PHE A 55 26.380 -16.157 -10.739 1.00 0.52 C ATOM 844 CD2 PHE A 55 25.647 -17.152 -8.701 1.00 0.58 C ATOM 845 CE1 PHE A 55 27.355 -15.459 -10.053 1.00 0.46 C ATOM 846 CE2 PHE A 55 26.620 -16.457 -8.010 1.00 0.70 C ATOM 847 CZ PHE A 55 27.475 -15.610 -8.686 1.00 0.56 C ATOM 0 H PHE A 55 23.110 -15.685 -11.159 1.00 0.48 H new ATOM 0 HA PHE A 55 25.037 -17.064 -12.759 1.00 0.54 H new ATOM 0 HB2 PHE A 55 23.549 -17.794 -10.206 1.00 0.59 H new ATOM 0 HB3 PHE A 55 24.784 -18.808 -10.925 1.00 0.59 H new ATOM 0 HD1 PHE A 55 26.291 -16.037 -11.809 1.00 0.52 H new ATOM 0 HD2 PHE A 55 24.982 -17.814 -8.166 1.00 0.58 H new ATOM 0 HE1 PHE A 55 28.022 -14.797 -10.585 1.00 0.46 H new ATOM 0 HE2 PHE A 55 26.712 -16.576 -6.941 1.00 0.70 H new ATOM 0 HZ PHE A 55 28.236 -15.066 -8.146 1.00 0.56 H new ATOM 857 N ASP A 56 23.554 -18.392 -14.213 1.00 0.61 N ATOM 858 CA ASP A 56 22.974 -19.476 -14.988 1.00 0.71 C ATOM 859 C ASP A 56 24.091 -20.415 -15.408 1.00 0.70 C ATOM 860 O ASP A 56 24.686 -20.265 -16.475 1.00 0.87 O ATOM 861 CB ASP A 56 22.223 -18.954 -16.217 1.00 0.91 C ATOM 862 CG ASP A 56 21.563 -20.072 -17.004 1.00 1.59 C ATOM 863 OD1 ASP A 56 20.545 -20.624 -16.531 1.00 2.18 O ATOM 864 OD2 ASP A 56 22.061 -20.409 -18.100 1.00 2.14 O ATOM 0 H ASP A 56 24.211 -17.808 -14.731 1.00 0.61 H new ATOM 0 HA ASP A 56 22.246 -20.005 -14.372 1.00 0.71 H new ATOM 0 HB2 ASP A 56 21.464 -18.238 -15.900 1.00 0.91 H new ATOM 0 HB3 ASP A 56 22.917 -18.417 -16.864 1.00 0.91 H new ATOM 869 N SER A 57 24.413 -21.347 -14.531 1.00 0.61 N ATOM 870 CA SER A 57 25.536 -22.239 -14.745 1.00 0.67 C ATOM 871 C SER A 57 25.144 -23.671 -14.405 1.00 0.68 C ATOM 872 O SER A 57 24.203 -23.894 -13.646 1.00 0.75 O ATOM 873 CB SER A 57 26.724 -21.771 -13.898 1.00 0.75 C ATOM 874 OG SER A 57 27.769 -22.721 -13.884 1.00 1.24 O ATOM 0 H SER A 57 23.909 -21.506 -13.659 1.00 0.61 H new ATOM 0 HA SER A 57 25.828 -22.217 -15.795 1.00 0.67 H new ATOM 0 HB2 SER A 57 27.099 -20.825 -14.290 1.00 0.75 H new ATOM 0 HB3 SER A 57 26.390 -21.584 -12.877 1.00 0.75 H new ATOM 0 HG SER A 57 28.010 -22.928 -12.957 1.00 1.24 H new ATOM 880 N SER A 58 25.885 -24.624 -14.964 1.00 0.75 N ATOM 881 CA SER A 58 25.567 -26.047 -14.869 1.00 0.82 C ATOM 882 C SER A 58 25.263 -26.484 -13.436 1.00 0.70 C ATOM 883 O SER A 58 24.323 -27.239 -13.197 1.00 0.70 O ATOM 884 CB SER A 58 26.739 -26.851 -15.435 1.00 1.03 C ATOM 885 OG SER A 58 27.157 -26.311 -16.685 1.00 1.49 O ATOM 0 H SER A 58 26.730 -24.429 -15.500 1.00 0.75 H new ATOM 0 HA SER A 58 24.663 -26.234 -15.448 1.00 0.82 H new ATOM 0 HB2 SER A 58 27.570 -26.838 -14.730 1.00 1.03 H new ATOM 0 HB3 SER A 58 26.445 -27.893 -15.562 1.00 1.03 H new ATOM 0 HG SER A 58 27.908 -26.835 -17.033 1.00 1.49 H new ATOM 891 N PHE A 59 26.045 -25.997 -12.491 1.00 0.69 N ATOM 892 CA PHE A 59 25.858 -26.360 -11.097 1.00 0.70 C ATOM 893 C PHE A 59 24.977 -25.339 -10.391 1.00 0.64 C ATOM 894 O PHE A 59 23.987 -25.696 -9.752 1.00 0.67 O ATOM 895 CB PHE A 59 27.211 -26.470 -10.400 1.00 0.85 C ATOM 896 CG PHE A 59 28.124 -27.463 -11.057 1.00 1.08 C ATOM 897 CD1 PHE A 59 27.803 -28.811 -11.068 1.00 1.28 C ATOM 898 CD2 PHE A 59 29.299 -27.051 -11.664 1.00 1.39 C ATOM 899 CE1 PHE A 59 28.637 -29.731 -11.673 1.00 1.58 C ATOM 900 CE2 PHE A 59 30.138 -27.967 -12.270 1.00 1.77 C ATOM 901 CZ PHE A 59 29.807 -29.310 -12.274 1.00 1.80 C ATOM 0 H PHE A 59 26.815 -25.350 -12.662 1.00 0.69 H new ATOM 0 HA PHE A 59 25.360 -27.328 -11.052 1.00 0.70 H new ATOM 0 HB2 PHE A 59 27.691 -25.492 -10.392 1.00 0.85 H new ATOM 0 HB3 PHE A 59 27.057 -26.758 -9.360 1.00 0.85 H new ATOM 0 HD1 PHE A 59 26.890 -29.146 -10.598 1.00 1.28 H new ATOM 0 HD2 PHE A 59 29.562 -26.004 -11.664 1.00 1.39 H new ATOM 0 HE1 PHE A 59 28.374 -30.779 -11.676 1.00 1.58 H new ATOM 0 HE2 PHE A 59 31.052 -27.634 -12.740 1.00 1.77 H new ATOM 0 HZ PHE A 59 30.462 -30.028 -12.746 1.00 1.80 H new ATOM 911 N ASP A 60 25.340 -24.071 -10.546 1.00 0.66 N ATOM 912 CA ASP A 60 24.670 -22.951 -9.881 1.00 0.72 C ATOM 913 C ASP A 60 23.156 -22.953 -10.106 1.00 0.71 C ATOM 914 O ASP A 60 22.387 -22.634 -9.200 1.00 0.86 O ATOM 915 CB ASP A 60 25.250 -21.625 -10.394 1.00 0.83 C ATOM 916 CG ASP A 60 26.767 -21.578 -10.329 1.00 1.54 C ATOM 917 OD1 ASP A 60 27.425 -22.376 -11.027 1.00 1.89 O ATOM 918 OD2 ASP A 60 27.300 -20.755 -9.546 1.00 2.19 O ATOM 0 H ASP A 60 26.116 -23.785 -11.143 1.00 0.66 H new ATOM 0 HA ASP A 60 24.846 -23.063 -8.811 1.00 0.72 H new ATOM 0 HB2 ASP A 60 24.931 -21.469 -11.424 1.00 0.83 H new ATOM 0 HB3 ASP A 60 24.841 -20.804 -9.806 1.00 0.83 H new ATOM 923 N ARG A 61 22.730 -23.323 -11.310 1.00 0.68 N ATOM 924 CA ARG A 61 21.314 -23.250 -11.674 1.00 0.80 C ATOM 925 C ARG A 61 20.559 -24.496 -11.215 1.00 0.75 C ATOM 926 O ARG A 61 19.340 -24.578 -11.357 1.00 0.92 O ATOM 927 CB ARG A 61 21.162 -23.082 -13.192 1.00 0.97 C ATOM 928 CG ARG A 61 21.284 -24.388 -13.964 1.00 1.23 C ATOM 929 CD ARG A 61 21.602 -24.161 -15.434 1.00 1.65 C ATOM 930 NE ARG A 61 20.615 -23.314 -16.104 1.00 1.75 N ATOM 931 CZ ARG A 61 19.778 -23.751 -17.041 1.00 2.15 C ATOM 932 NH1 ARG A 61 19.782 -25.030 -17.393 1.00 2.58 N ATOM 933 NH2 ARG A 61 18.940 -22.904 -17.628 1.00 2.78 N ATOM 0 H ARG A 61 23.339 -23.675 -12.048 1.00 0.68 H new ATOM 0 HA ARG A 61 20.886 -22.384 -11.170 1.00 0.80 H new ATOM 0 HB2 ARG A 61 20.192 -22.633 -13.404 1.00 0.97 H new ATOM 0 HB3 ARG A 61 21.920 -22.386 -13.550 1.00 0.97 H new ATOM 0 HG2 ARG A 61 22.066 -25.001 -13.516 1.00 1.23 H new ATOM 0 HG3 ARG A 61 20.352 -24.947 -13.878 1.00 1.23 H new ATOM 0 HD2 ARG A 61 22.587 -23.702 -15.521 1.00 1.65 H new ATOM 0 HD3 ARG A 61 21.653 -25.124 -15.943 1.00 1.65 H new ATOM 0 HE ARG A 61 20.566 -22.331 -15.837 1.00 1.75 H new ATOM 0 HH11 ARG A 61 20.428 -25.680 -16.945 1.00 2.58 H new ATOM 0 HH12 ARG A 61 19.139 -25.363 -18.112 1.00 2.58 H new ATOM 0 HH21 ARG A 61 18.939 -21.920 -17.360 1.00 2.78 H new ATOM 0 HH22 ARG A 61 18.298 -23.238 -18.347 1.00 2.78 H new ATOM 947 N ASN A 62 21.281 -25.466 -10.671 1.00 0.64 N ATOM 948 CA ASN A 62 20.665 -26.721 -10.268 1.00 0.68 C ATOM 949 C ASN A 62 20.757 -26.902 -8.756 1.00 0.73 C ATOM 950 O ASN A 62 19.738 -27.001 -8.071 1.00 0.89 O ATOM 951 CB ASN A 62 21.335 -27.902 -10.983 1.00 0.71 C ATOM 952 CG ASN A 62 20.480 -29.166 -10.992 1.00 0.83 C ATOM 953 OD1 ASN A 62 20.578 -29.982 -11.908 1.00 0.93 O ATOM 954 ND2 ASN A 62 19.631 -29.340 -9.987 1.00 1.10 N ATOM 0 H ASN A 62 22.285 -25.409 -10.500 1.00 0.64 H new ATOM 0 HA ASN A 62 19.613 -26.692 -10.552 1.00 0.68 H new ATOM 0 HB2 ASN A 62 21.559 -27.616 -12.011 1.00 0.71 H new ATOM 0 HB3 ASN A 62 22.287 -28.119 -10.498 1.00 0.71 H new ATOM 0 HD21 ASN A 62 19.036 -30.168 -9.959 1.00 1.10 H new ATOM 0 HD22 ASN A 62 19.573 -28.645 -9.242 1.00 1.10 H new ATOM 961 N VAL A 63 21.979 -26.960 -8.244 1.00 0.68 N ATOM 962 CA VAL A 63 22.213 -27.143 -6.816 1.00 0.83 C ATOM 963 C VAL A 63 23.375 -26.272 -6.357 1.00 0.62 C ATOM 964 O VAL A 63 24.523 -26.521 -6.722 1.00 0.64 O ATOM 965 CB VAL A 63 22.519 -28.622 -6.453 1.00 1.16 C ATOM 966 CG1 VAL A 63 22.778 -28.768 -4.960 1.00 1.76 C ATOM 967 CG2 VAL A 63 21.380 -29.539 -6.879 1.00 2.03 C ATOM 0 H VAL A 63 22.830 -26.882 -8.801 1.00 0.68 H new ATOM 0 HA VAL A 63 21.295 -26.850 -6.306 1.00 0.83 H new ATOM 0 HB VAL A 63 23.418 -28.917 -6.995 1.00 1.16 H new ATOM 0 HG11 VAL A 63 22.990 -29.812 -4.728 1.00 1.76 H new ATOM 0 HG12 VAL A 63 23.632 -28.152 -4.677 1.00 1.76 H new ATOM 0 HG13 VAL A 63 21.898 -28.445 -4.405 1.00 1.76 H new ATOM 0 HG21 VAL A 63 21.622 -30.568 -6.612 1.00 2.03 H new ATOM 0 HG22 VAL A 63 20.463 -29.239 -6.373 1.00 2.03 H new ATOM 0 HG23 VAL A 63 21.239 -29.467 -7.957 1.00 2.03 H new ATOM 977 N PRO A 64 23.089 -25.221 -5.574 1.00 0.91 N ATOM 978 CA PRO A 64 24.121 -24.336 -5.029 1.00 1.03 C ATOM 979 C PRO A 64 25.019 -25.051 -4.022 1.00 0.81 C ATOM 980 O PRO A 64 24.648 -26.089 -3.468 1.00 0.86 O ATOM 981 CB PRO A 64 23.328 -23.216 -4.336 1.00 1.53 C ATOM 982 CG PRO A 64 21.935 -23.342 -4.856 1.00 1.76 C ATOM 983 CD PRO A 64 21.742 -24.796 -5.174 1.00 1.40 C ATOM 0 HA PRO A 64 24.789 -23.972 -5.809 1.00 1.03 H new ATOM 0 HB2 PRO A 64 23.355 -23.327 -3.252 1.00 1.53 H new ATOM 0 HB3 PRO A 64 23.747 -22.236 -4.566 1.00 1.53 H new ATOM 0 HG2 PRO A 64 21.210 -23.005 -4.115 1.00 1.76 H new ATOM 0 HG3 PRO A 64 21.793 -22.726 -5.744 1.00 1.76 H new ATOM 0 HD2 PRO A 64 21.381 -25.355 -4.311 1.00 1.40 H new ATOM 0 HD3 PRO A 64 21.017 -24.943 -5.974 1.00 1.40 H new ATOM 991 N PHE A 65 26.185 -24.477 -3.772 1.00 0.68 N ATOM 992 CA PHE A 65 27.161 -25.081 -2.876 1.00 0.53 C ATOM 993 C PHE A 65 26.998 -24.525 -1.464 1.00 0.47 C ATOM 994 O PHE A 65 26.477 -23.424 -1.278 1.00 0.54 O ATOM 995 CB PHE A 65 28.582 -24.816 -3.399 1.00 0.62 C ATOM 996 CG PHE A 65 29.672 -25.513 -2.629 1.00 0.72 C ATOM 997 CD1 PHE A 65 29.857 -26.880 -2.747 1.00 1.06 C ATOM 998 CD2 PHE A 65 30.513 -24.796 -1.789 1.00 0.71 C ATOM 999 CE1 PHE A 65 30.855 -27.523 -2.040 1.00 1.31 C ATOM 1000 CE2 PHE A 65 31.515 -25.434 -1.081 1.00 0.95 C ATOM 1001 CZ PHE A 65 31.686 -26.801 -1.206 1.00 1.24 C ATOM 0 H PHE A 65 26.480 -23.589 -4.179 1.00 0.68 H new ATOM 0 HA PHE A 65 26.994 -26.158 -2.842 1.00 0.53 H new ATOM 0 HB2 PHE A 65 28.635 -25.128 -4.442 1.00 0.62 H new ATOM 0 HB3 PHE A 65 28.769 -23.742 -3.377 1.00 0.62 H new ATOM 0 HD1 PHE A 65 29.213 -27.451 -3.400 1.00 1.06 H new ATOM 0 HD2 PHE A 65 30.383 -23.729 -1.687 1.00 0.71 H new ATOM 0 HE1 PHE A 65 30.985 -28.590 -2.140 1.00 1.31 H new ATOM 0 HE2 PHE A 65 32.164 -24.865 -0.431 1.00 0.95 H new ATOM 0 HZ PHE A 65 32.467 -27.302 -0.653 1.00 1.24 H new ATOM 1011 N LYS A 66 27.405 -25.306 -0.473 1.00 0.41 N ATOM 1012 CA LYS A 66 27.387 -24.858 0.907 1.00 0.39 C ATOM 1013 C LYS A 66 28.698 -25.218 1.596 1.00 0.38 C ATOM 1014 O LYS A 66 29.354 -26.194 1.227 1.00 0.48 O ATOM 1015 CB LYS A 66 26.170 -25.431 1.657 1.00 0.45 C ATOM 1016 CG LYS A 66 26.033 -26.951 1.641 1.00 0.60 C ATOM 1017 CD LYS A 66 26.944 -27.619 2.661 1.00 0.67 C ATOM 1018 CE LYS A 66 26.541 -29.063 2.924 1.00 0.93 C ATOM 1019 NZ LYS A 66 26.397 -29.847 1.671 1.00 1.36 N ATOM 0 H LYS A 66 27.752 -26.256 -0.603 1.00 0.41 H new ATOM 0 HA LYS A 66 27.290 -23.772 0.921 1.00 0.39 H new ATOM 0 HB2 LYS A 66 26.218 -25.101 2.695 1.00 0.45 H new ATOM 0 HB3 LYS A 66 25.266 -24.999 1.227 1.00 0.45 H new ATOM 0 HG2 LYS A 66 24.998 -27.223 1.847 1.00 0.60 H new ATOM 0 HG3 LYS A 66 26.269 -27.325 0.645 1.00 0.60 H new ATOM 0 HD2 LYS A 66 27.973 -27.589 2.303 1.00 0.67 H new ATOM 0 HD3 LYS A 66 26.915 -27.058 3.595 1.00 0.67 H new ATOM 0 HE2 LYS A 66 27.288 -29.536 3.561 1.00 0.93 H new ATOM 0 HE3 LYS A 66 25.598 -29.081 3.471 1.00 0.93 H new ATOM 0 HZ1 LYS A 66 26.324 -30.859 1.901 1.00 1.36 H new ATOM 0 HZ2 LYS A 66 25.539 -29.543 1.168 1.00 1.36 H new ATOM 0 HZ3 LYS A 66 27.228 -29.689 1.065 1.00 1.36 H new ATOM 1033 N PHE A 67 29.083 -24.421 2.581 1.00 0.39 N ATOM 1034 CA PHE A 67 30.350 -24.613 3.275 1.00 0.42 C ATOM 1035 C PHE A 67 30.149 -24.622 4.786 1.00 0.42 C ATOM 1036 O PHE A 67 29.017 -24.615 5.271 1.00 0.46 O ATOM 1037 CB PHE A 67 31.341 -23.509 2.885 1.00 0.46 C ATOM 1038 CG PHE A 67 30.813 -22.110 3.091 1.00 0.45 C ATOM 1039 CD1 PHE A 67 30.811 -21.526 4.350 1.00 0.43 C ATOM 1040 CD2 PHE A 67 30.325 -21.378 2.021 1.00 0.55 C ATOM 1041 CE1 PHE A 67 30.326 -20.248 4.535 1.00 0.46 C ATOM 1042 CE2 PHE A 67 29.840 -20.097 2.202 1.00 0.57 C ATOM 1043 CZ PHE A 67 29.843 -19.532 3.461 1.00 0.51 C ATOM 0 H PHE A 67 28.534 -23.631 2.920 1.00 0.39 H new ATOM 0 HA PHE A 67 30.756 -25.580 2.977 1.00 0.42 H new ATOM 0 HB2 PHE A 67 32.254 -23.631 3.468 1.00 0.46 H new ATOM 0 HB3 PHE A 67 31.613 -23.633 1.837 1.00 0.46 H new ATOM 0 HD1 PHE A 67 31.194 -22.079 5.195 1.00 0.43 H new ATOM 0 HD2 PHE A 67 30.324 -21.814 1.033 1.00 0.55 H new ATOM 0 HE1 PHE A 67 30.325 -19.808 5.522 1.00 0.46 H new ATOM 0 HE2 PHE A 67 29.459 -19.539 1.360 1.00 0.57 H new ATOM 0 HZ PHE A 67 29.467 -18.530 3.605 1.00 0.51 H new ATOM 1053 N HIS A 68 31.255 -24.622 5.524 1.00 0.42 N ATOM 1054 CA HIS A 68 31.210 -24.582 6.981 1.00 0.44 C ATOM 1055 C HIS A 68 31.863 -23.297 7.469 1.00 0.42 C ATOM 1056 O HIS A 68 32.760 -22.775 6.815 1.00 0.44 O ATOM 1057 CB HIS A 68 31.913 -25.799 7.603 1.00 0.53 C ATOM 1058 CG HIS A 68 31.197 -27.101 7.398 1.00 0.89 C ATOM 1059 ND1 HIS A 68 30.356 -27.656 8.339 1.00 1.68 N ATOM 1060 CD2 HIS A 68 31.225 -27.973 6.362 1.00 1.56 C ATOM 1061 CE1 HIS A 68 29.899 -28.809 7.890 1.00 1.98 C ATOM 1062 NE2 HIS A 68 30.409 -29.025 6.693 1.00 1.87 N ATOM 0 H HIS A 68 32.197 -24.649 5.134 1.00 0.42 H new ATOM 0 HA HIS A 68 30.166 -24.611 7.293 1.00 0.44 H new ATOM 0 HB2 HIS A 68 32.915 -25.879 7.181 1.00 0.53 H new ATOM 0 HB3 HIS A 68 32.030 -25.628 8.673 1.00 0.53 H new ATOM 0 HD2 HIS A 68 31.786 -27.861 5.446 1.00 1.56 H new ATOM 0 HE1 HIS A 68 29.221 -29.466 8.415 1.00 1.98 H new ATOM 0 HE2 HIS A 68 30.227 -29.841 6.109 1.00 1.87 H new ATOM 1071 N LEU A 69 31.396 -22.783 8.599 1.00 0.44 N ATOM 1072 CA LEU A 69 31.906 -21.526 9.137 1.00 0.47 C ATOM 1073 C LEU A 69 33.352 -21.654 9.609 1.00 0.49 C ATOM 1074 O LEU A 69 33.643 -22.354 10.580 1.00 0.58 O ATOM 1075 CB LEU A 69 31.008 -21.027 10.276 1.00 0.59 C ATOM 1076 CG LEU A 69 31.450 -19.728 10.963 1.00 0.71 C ATOM 1077 CD1 LEU A 69 31.905 -18.694 9.943 1.00 0.74 C ATOM 1078 CD2 LEU A 69 30.311 -19.171 11.802 1.00 0.95 C ATOM 0 H LEU A 69 30.664 -23.216 9.162 1.00 0.44 H new ATOM 0 HA LEU A 69 31.891 -20.794 8.330 1.00 0.47 H new ATOM 0 HB2 LEU A 69 30.002 -20.882 9.882 1.00 0.59 H new ATOM 0 HB3 LEU A 69 30.944 -21.810 11.031 1.00 0.59 H new ATOM 0 HG LEU A 69 32.296 -19.956 11.611 1.00 0.71 H new ATOM 0 HD11 LEU A 69 32.212 -17.784 10.459 1.00 0.74 H new ATOM 0 HD12 LEU A 69 32.746 -19.090 9.374 1.00 0.74 H new ATOM 0 HD13 LEU A 69 31.083 -18.466 9.264 1.00 0.74 H new ATOM 0 HD21 LEU A 69 30.633 -18.249 12.286 1.00 0.95 H new ATOM 0 HD22 LEU A 69 29.454 -18.964 11.161 1.00 0.95 H new ATOM 0 HD23 LEU A 69 30.028 -19.900 12.561 1.00 0.95 H new ATOM 1090 N GLU A 70 34.228 -20.956 8.889 1.00 0.59 N ATOM 1091 CA GLU A 70 35.649 -20.871 9.196 1.00 0.69 C ATOM 1092 C GLU A 70 36.296 -22.251 9.250 1.00 0.69 C ATOM 1093 O GLU A 70 36.592 -22.782 10.321 1.00 0.96 O ATOM 1094 CB GLU A 70 35.877 -20.107 10.500 1.00 0.95 C ATOM 1095 CG GLU A 70 37.181 -19.321 10.542 1.00 1.12 C ATOM 1096 CD GLU A 70 38.410 -20.203 10.516 1.00 1.47 C ATOM 1097 OE1 GLU A 70 38.866 -20.625 11.600 1.00 2.08 O ATOM 1098 OE2 GLU A 70 38.917 -20.487 9.410 1.00 1.79 O ATOM 0 H GLU A 70 33.962 -20.424 8.060 1.00 0.59 H new ATOM 0 HA GLU A 70 36.129 -20.319 8.388 1.00 0.69 H new ATOM 0 HB2 GLU A 70 35.046 -19.419 10.655 1.00 0.95 H new ATOM 0 HB3 GLU A 70 35.865 -20.814 11.329 1.00 0.95 H new ATOM 0 HG2 GLU A 70 37.214 -18.638 9.693 1.00 1.12 H new ATOM 0 HG3 GLU A 70 37.200 -18.709 11.444 1.00 1.12 H new ATOM 1105 N GLN A 71 36.468 -22.843 8.083 1.00 0.68 N ATOM 1106 CA GLN A 71 37.264 -24.046 7.953 1.00 0.86 C ATOM 1107 C GLN A 71 38.501 -23.711 7.129 1.00 0.83 C ATOM 1108 O GLN A 71 39.200 -24.588 6.613 1.00 0.96 O ATOM 1109 CB GLN A 71 36.445 -25.198 7.331 1.00 1.05 C ATOM 1110 CG GLN A 71 36.350 -25.229 5.803 1.00 0.96 C ATOM 1111 CD GLN A 71 35.542 -24.097 5.183 1.00 1.14 C ATOM 1112 OE1 GLN A 71 35.536 -22.965 5.660 1.00 1.98 O ATOM 1113 NE2 GLN A 71 34.836 -24.410 4.107 1.00 0.97 N ATOM 0 H GLN A 71 36.064 -22.507 7.208 1.00 0.68 H new ATOM 0 HA GLN A 71 37.573 -24.397 8.938 1.00 0.86 H new ATOM 0 HB2 GLN A 71 36.878 -26.141 7.664 1.00 1.05 H new ATOM 0 HB3 GLN A 71 35.433 -25.152 7.734 1.00 1.05 H new ATOM 0 HG2 GLN A 71 37.359 -25.202 5.391 1.00 0.96 H new ATOM 0 HG3 GLN A 71 35.907 -26.178 5.501 1.00 0.96 H new ATOM 0 HE21 GLN A 71 34.864 -25.360 3.737 1.00 0.97 H new ATOM 0 HE22 GLN A 71 34.264 -23.701 3.648 1.00 0.97 H new ATOM 1122 N GLY A 72 38.769 -22.413 7.037 1.00 0.72 N ATOM 1123 CA GLY A 72 39.907 -21.925 6.290 1.00 0.72 C ATOM 1124 C GLY A 72 39.538 -21.417 4.910 1.00 0.67 C ATOM 1125 O GLY A 72 40.298 -20.667 4.298 1.00 0.70 O ATOM 0 H GLY A 72 38.207 -21.683 7.475 1.00 0.72 H new ATOM 0 HA2 GLY A 72 40.385 -21.122 6.851 1.00 0.72 H new ATOM 0 HA3 GLY A 72 40.640 -22.725 6.192 1.00 0.72 H new ATOM 1129 N GLU A 73 38.368 -21.807 4.418 1.00 0.63 N ATOM 1130 CA GLU A 73 37.988 -21.487 3.049 1.00 0.62 C ATOM 1131 C GLU A 73 37.204 -20.183 2.979 1.00 0.57 C ATOM 1132 O GLU A 73 37.027 -19.614 1.906 1.00 0.66 O ATOM 1133 CB GLU A 73 37.168 -22.625 2.442 1.00 0.67 C ATOM 1134 CG GLU A 73 37.807 -23.995 2.610 1.00 0.73 C ATOM 1135 CD GLU A 73 39.130 -24.138 1.882 1.00 0.81 C ATOM 1136 OE1 GLU A 73 40.093 -23.410 2.213 1.00 0.92 O ATOM 1137 OE2 GLU A 73 39.220 -25.005 0.993 1.00 0.97 O ATOM 0 H GLU A 73 37.673 -22.340 4.941 1.00 0.63 H new ATOM 0 HA GLU A 73 38.905 -21.362 2.473 1.00 0.62 H new ATOM 0 HB2 GLU A 73 36.180 -22.635 2.903 1.00 0.67 H new ATOM 0 HB3 GLU A 73 37.022 -22.430 1.380 1.00 0.67 H new ATOM 0 HG2 GLU A 73 37.963 -24.187 3.672 1.00 0.73 H new ATOM 0 HG3 GLU A 73 37.117 -24.756 2.246 1.00 0.73 H new ATOM 1144 N VAL A 74 36.731 -19.705 4.123 1.00 0.50 N ATOM 1145 CA VAL A 74 36.025 -18.433 4.162 1.00 0.45 C ATOM 1146 C VAL A 74 36.808 -17.436 5.003 1.00 0.41 C ATOM 1147 O VAL A 74 37.114 -17.676 6.170 1.00 0.46 O ATOM 1148 CB VAL A 74 34.573 -18.584 4.690 1.00 0.50 C ATOM 1149 CG1 VAL A 74 33.766 -19.465 3.748 1.00 0.58 C ATOM 1150 CG2 VAL A 74 34.553 -19.158 6.096 1.00 0.55 C ATOM 0 H VAL A 74 36.822 -20.173 5.025 1.00 0.50 H new ATOM 0 HA VAL A 74 35.949 -18.060 3.140 1.00 0.45 H new ATOM 0 HB VAL A 74 34.121 -17.593 4.729 1.00 0.50 H new ATOM 0 HG11 VAL A 74 32.749 -19.566 4.126 1.00 0.58 H new ATOM 0 HG12 VAL A 74 33.742 -19.012 2.757 1.00 0.58 H new ATOM 0 HG13 VAL A 74 34.229 -20.450 3.685 1.00 0.58 H new ATOM 0 HG21 VAL A 74 33.522 -19.251 6.436 1.00 0.55 H new ATOM 0 HG22 VAL A 74 35.025 -20.141 6.095 1.00 0.55 H new ATOM 0 HG23 VAL A 74 35.098 -18.495 6.768 1.00 0.55 H new ATOM 1160 N ILE A 75 37.158 -16.333 4.378 1.00 0.38 N ATOM 1161 CA ILE A 75 38.042 -15.354 4.985 1.00 0.40 C ATOM 1162 C ILE A 75 37.290 -14.172 5.585 1.00 0.39 C ATOM 1163 O ILE A 75 37.340 -13.943 6.789 1.00 0.47 O ATOM 1164 CB ILE A 75 39.106 -14.865 3.980 1.00 0.45 C ATOM 1165 CG1 ILE A 75 38.501 -14.709 2.576 1.00 0.46 C ATOM 1166 CG2 ILE A 75 40.285 -15.829 3.963 1.00 0.53 C ATOM 1167 CD1 ILE A 75 39.528 -14.569 1.485 1.00 0.62 C ATOM 0 H ILE A 75 36.842 -16.088 3.440 1.00 0.38 H new ATOM 0 HA ILE A 75 38.544 -15.863 5.807 1.00 0.40 H new ATOM 0 HB ILE A 75 39.463 -13.885 4.296 1.00 0.45 H new ATOM 0 HG12 ILE A 75 37.873 -15.574 2.363 1.00 0.46 H new ATOM 0 HG13 ILE A 75 37.851 -13.834 2.565 1.00 0.46 H new ATOM 0 HG21 ILE A 75 41.032 -15.478 3.251 1.00 0.53 H new ATOM 0 HG22 ILE A 75 40.727 -15.880 4.958 1.00 0.53 H new ATOM 0 HG23 ILE A 75 39.940 -16.820 3.668 1.00 0.53 H new ATOM 0 HD11 ILE A 75 39.025 -14.463 0.524 1.00 0.62 H new ATOM 0 HD12 ILE A 75 40.141 -13.687 1.673 1.00 0.62 H new ATOM 0 HD13 ILE A 75 40.163 -15.455 1.467 1.00 0.62 H new ATOM 1179 N LYS A 76 36.592 -13.420 4.743 1.00 0.33 N ATOM 1180 CA LYS A 76 35.951 -12.186 5.185 1.00 0.35 C ATOM 1181 C LYS A 76 34.467 -12.158 4.857 1.00 0.29 C ATOM 1182 O LYS A 76 33.629 -12.194 5.758 1.00 0.31 O ATOM 1183 CB LYS A 76 36.633 -10.973 4.548 1.00 0.48 C ATOM 1184 CG LYS A 76 38.047 -10.716 5.045 1.00 0.62 C ATOM 1185 CD LYS A 76 38.081 -9.650 6.138 1.00 0.98 C ATOM 1186 CE LYS A 76 37.436 -10.124 7.431 1.00 1.18 C ATOM 1187 NZ LYS A 76 37.515 -9.095 8.506 1.00 2.04 N ATOM 0 H LYS A 76 36.455 -13.640 3.756 1.00 0.33 H new ATOM 0 HA LYS A 76 36.057 -12.146 6.269 1.00 0.35 H new ATOM 0 HB2 LYS A 76 36.660 -11.112 3.467 1.00 0.48 H new ATOM 0 HB3 LYS A 76 36.027 -10.088 4.740 1.00 0.48 H new ATOM 0 HG2 LYS A 76 38.471 -11.644 5.429 1.00 0.62 H new ATOM 0 HG3 LYS A 76 38.673 -10.401 4.211 1.00 0.62 H new ATOM 0 HD2 LYS A 76 39.115 -9.367 6.334 1.00 0.98 H new ATOM 0 HD3 LYS A 76 37.567 -8.756 5.785 1.00 0.98 H new ATOM 0 HE2 LYS A 76 36.391 -10.374 7.244 1.00 1.18 H new ATOM 0 HE3 LYS A 76 37.927 -11.037 7.767 1.00 1.18 H new ATOM 0 HZ1 LYS A 76 37.607 -9.564 9.430 1.00 2.04 H new ATOM 0 HZ2 LYS A 76 38.342 -8.486 8.343 1.00 2.04 H new ATOM 0 HZ3 LYS A 76 36.651 -8.516 8.497 1.00 2.04 H new ATOM 1201 N GLY A 77 34.155 -12.110 3.562 1.00 0.29 N ATOM 1202 CA GLY A 77 32.790 -11.860 3.121 1.00 0.30 C ATOM 1203 C GLY A 77 31.770 -12.783 3.754 1.00 0.27 C ATOM 1204 O GLY A 77 30.787 -12.326 4.333 1.00 0.32 O ATOM 0 H GLY A 77 34.828 -12.241 2.806 1.00 0.29 H new ATOM 0 HA2 GLY A 77 32.526 -10.828 3.351 1.00 0.30 H new ATOM 0 HA3 GLY A 77 32.742 -11.967 2.037 1.00 0.30 H new ATOM 1208 N TRP A 78 32.010 -14.081 3.666 1.00 0.24 N ATOM 1209 CA TRP A 78 31.082 -15.057 4.219 1.00 0.26 C ATOM 1210 C TRP A 78 31.202 -15.103 5.734 1.00 0.29 C ATOM 1211 O TRP A 78 30.202 -15.057 6.445 1.00 0.30 O ATOM 1212 CB TRP A 78 31.359 -16.446 3.652 1.00 0.28 C ATOM 1213 CG TRP A 78 31.519 -16.465 2.163 1.00 0.29 C ATOM 1214 CD1 TRP A 78 30.524 -16.536 1.230 1.00 0.32 C ATOM 1215 CD2 TRP A 78 32.754 -16.412 1.433 1.00 0.34 C ATOM 1216 NE1 TRP A 78 31.063 -16.525 -0.033 1.00 0.36 N ATOM 1217 CE2 TRP A 78 32.428 -16.457 0.065 1.00 0.37 C ATOM 1218 CE3 TRP A 78 34.103 -16.342 1.802 1.00 0.40 C ATOM 1219 CZ2 TRP A 78 33.398 -16.414 -0.932 1.00 0.43 C ATOM 1220 CZ3 TRP A 78 35.064 -16.304 0.811 1.00 0.48 C ATOM 1221 CH2 TRP A 78 34.706 -16.345 -0.543 1.00 0.49 C ATOM 0 H TRP A 78 32.834 -14.483 3.220 1.00 0.24 H new ATOM 0 HA TRP A 78 30.072 -14.753 3.944 1.00 0.26 H new ATOM 0 HB2 TRP A 78 32.264 -16.843 4.111 1.00 0.28 H new ATOM 0 HB3 TRP A 78 30.542 -17.112 3.930 1.00 0.28 H new ATOM 0 HD1 TRP A 78 29.469 -16.592 1.453 1.00 0.32 H new ATOM 0 HE1 TRP A 78 30.533 -16.562 -0.904 1.00 0.36 H new ATOM 0 HE3 TRP A 78 34.387 -16.318 2.844 1.00 0.40 H new ATOM 0 HZ2 TRP A 78 33.126 -16.434 -1.977 1.00 0.43 H new ATOM 0 HZ3 TRP A 78 36.107 -16.242 1.084 1.00 0.48 H new ATOM 0 HH2 TRP A 78 35.481 -16.322 -1.295 1.00 0.49 H new ATOM 1232 N ASP A 79 32.446 -15.155 6.198 1.00 0.35 N ATOM 1233 CA ASP A 79 32.770 -15.392 7.606 1.00 0.42 C ATOM 1234 C ASP A 79 32.030 -14.433 8.540 1.00 0.43 C ATOM 1235 O ASP A 79 31.416 -14.861 9.518 1.00 0.47 O ATOM 1236 CB ASP A 79 34.285 -15.266 7.812 1.00 0.52 C ATOM 1237 CG ASP A 79 34.693 -15.381 9.268 1.00 0.76 C ATOM 1238 OD1 ASP A 79 34.376 -16.410 9.895 1.00 1.14 O ATOM 1239 OD2 ASP A 79 35.334 -14.446 9.792 1.00 0.90 O ATOM 0 H ASP A 79 33.267 -15.033 5.605 1.00 0.35 H new ATOM 0 HA ASP A 79 32.443 -16.401 7.857 1.00 0.42 H new ATOM 0 HB2 ASP A 79 34.791 -16.041 7.236 1.00 0.52 H new ATOM 0 HB3 ASP A 79 34.622 -14.306 7.420 1.00 0.52 H new ATOM 1244 N ILE A 80 32.070 -13.148 8.220 1.00 0.45 N ATOM 1245 CA ILE A 80 31.418 -12.137 9.053 1.00 0.52 C ATOM 1246 C ILE A 80 29.898 -12.189 8.885 1.00 0.47 C ATOM 1247 O ILE A 80 29.157 -12.183 9.866 1.00 0.56 O ATOM 1248 CB ILE A 80 31.939 -10.707 8.740 1.00 0.63 C ATOM 1249 CG1 ILE A 80 33.305 -10.464 9.393 1.00 0.75 C ATOM 1250 CG2 ILE A 80 30.950 -9.646 9.201 1.00 0.78 C ATOM 1251 CD1 ILE A 80 34.419 -11.296 8.806 1.00 0.70 C ATOM 0 H ILE A 80 32.543 -12.778 7.396 1.00 0.45 H new ATOM 0 HA ILE A 80 31.668 -12.367 10.089 1.00 0.52 H new ATOM 0 HB ILE A 80 32.049 -10.632 7.658 1.00 0.63 H new ATOM 0 HG12 ILE A 80 33.562 -9.409 9.294 1.00 0.75 H new ATOM 0 HG13 ILE A 80 33.230 -10.675 10.460 1.00 0.75 H new ATOM 0 HG21 ILE A 80 31.343 -8.656 8.968 1.00 0.78 H new ATOM 0 HG22 ILE A 80 29.999 -9.788 8.689 1.00 0.78 H new ATOM 0 HG23 ILE A 80 30.799 -9.732 10.277 1.00 0.78 H new ATOM 0 HD11 ILE A 80 35.353 -11.068 9.320 1.00 0.70 H new ATOM 0 HD12 ILE A 80 34.186 -12.354 8.928 1.00 0.70 H new ATOM 0 HD13 ILE A 80 34.523 -11.068 7.745 1.00 0.70 H new ATOM 1263 N CYS A 81 29.435 -12.276 7.639 1.00 0.38 N ATOM 1264 CA CYS A 81 28.007 -12.230 7.350 1.00 0.40 C ATOM 1265 C CYS A 81 27.271 -13.415 7.967 1.00 0.35 C ATOM 1266 O CYS A 81 26.191 -13.247 8.533 1.00 0.42 O ATOM 1267 CB CYS A 81 27.763 -12.184 5.840 1.00 0.44 C ATOM 1268 SG CYS A 81 26.019 -12.093 5.367 1.00 0.55 S ATOM 0 H CYS A 81 30.029 -12.379 6.816 1.00 0.38 H new ATOM 0 HA CYS A 81 27.612 -11.319 7.799 1.00 0.40 H new ATOM 0 HB2 CYS A 81 28.285 -11.321 5.426 1.00 0.44 H new ATOM 0 HB3 CYS A 81 28.204 -13.071 5.386 1.00 0.44 H new ATOM 0 HG CYS A 81 25.279 -12.494 6.358 1.00 0.55 H new ATOM 1274 N VAL A 82 27.857 -14.603 7.884 1.00 0.30 N ATOM 1275 CA VAL A 82 27.210 -15.793 8.423 1.00 0.34 C ATOM 1276 C VAL A 82 27.134 -15.726 9.947 1.00 0.39 C ATOM 1277 O VAL A 82 26.187 -16.217 10.550 1.00 0.48 O ATOM 1278 CB VAL A 82 27.900 -17.105 7.991 1.00 0.36 C ATOM 1279 CG1 VAL A 82 27.863 -17.252 6.480 1.00 0.84 C ATOM 1280 CG2 VAL A 82 29.326 -17.175 8.501 1.00 0.73 C ATOM 0 H VAL A 82 28.767 -14.768 7.454 1.00 0.30 H new ATOM 0 HA VAL A 82 26.203 -15.805 8.006 1.00 0.34 H new ATOM 0 HB VAL A 82 27.349 -17.934 8.435 1.00 0.36 H new ATOM 0 HG11 VAL A 82 28.354 -18.182 6.193 1.00 0.84 H new ATOM 0 HG12 VAL A 82 26.827 -17.269 6.141 1.00 0.84 H new ATOM 0 HG13 VAL A 82 28.382 -16.411 6.020 1.00 0.84 H new ATOM 0 HG21 VAL A 82 29.782 -18.111 8.179 1.00 0.73 H new ATOM 0 HG22 VAL A 82 29.897 -16.337 8.101 1.00 0.73 H new ATOM 0 HG23 VAL A 82 29.326 -17.127 9.590 1.00 0.73 H new ATOM 1290 N SER A 83 28.131 -15.093 10.562 1.00 0.39 N ATOM 1291 CA SER A 83 28.189 -14.977 12.014 1.00 0.49 C ATOM 1292 C SER A 83 27.266 -13.864 12.517 1.00 0.48 C ATOM 1293 O SER A 83 27.118 -13.659 13.728 1.00 0.60 O ATOM 1294 CB SER A 83 29.626 -14.700 12.460 1.00 0.63 C ATOM 1295 OG SER A 83 30.523 -15.662 11.927 1.00 1.43 O ATOM 0 H SER A 83 28.911 -14.652 10.074 1.00 0.39 H new ATOM 0 HA SER A 83 27.851 -15.921 12.442 1.00 0.49 H new ATOM 0 HB2 SER A 83 29.924 -13.703 12.137 1.00 0.63 H new ATOM 0 HB3 SER A 83 29.680 -14.712 13.549 1.00 0.63 H new ATOM 0 HG SER A 83 30.766 -15.411 11.012 1.00 1.43 H new ATOM 1301 N SER A 84 26.645 -13.148 11.586 1.00 0.50 N ATOM 1302 CA SER A 84 25.762 -12.040 11.927 1.00 0.53 C ATOM 1303 C SER A 84 24.373 -12.237 11.321 1.00 0.51 C ATOM 1304 O SER A 84 23.743 -11.288 10.840 1.00 0.64 O ATOM 1305 CB SER A 84 26.376 -10.725 11.448 1.00 0.69 C ATOM 1306 OG SER A 84 26.861 -10.838 10.120 1.00 1.23 O ATOM 0 H SER A 84 26.738 -13.317 10.584 1.00 0.50 H new ATOM 0 HA SER A 84 25.649 -12.007 13.011 1.00 0.53 H new ATOM 0 HB2 SER A 84 25.629 -9.932 11.499 1.00 0.69 H new ATOM 0 HB3 SER A 84 27.191 -10.438 12.112 1.00 0.69 H new ATOM 0 HG SER A 84 27.710 -11.328 10.122 1.00 1.23 H new ATOM 1312 N MET A 85 23.904 -13.479 11.343 1.00 0.46 N ATOM 1313 CA MET A 85 22.569 -13.808 10.861 1.00 0.49 C ATOM 1314 C MET A 85 21.704 -14.334 12.002 1.00 0.49 C ATOM 1315 O MET A 85 22.180 -14.516 13.121 1.00 0.74 O ATOM 1316 CB MET A 85 22.643 -14.858 9.742 1.00 0.54 C ATOM 1317 CG MET A 85 23.347 -14.377 8.480 1.00 0.63 C ATOM 1318 SD MET A 85 22.254 -13.554 7.297 1.00 1.05 S ATOM 1319 CE MET A 85 21.589 -12.209 8.274 1.00 2.27 C ATOM 0 H MET A 85 24.432 -14.279 11.692 1.00 0.46 H new ATOM 0 HA MET A 85 22.119 -12.898 10.464 1.00 0.49 H new ATOM 0 HB2 MET A 85 23.161 -15.739 10.120 1.00 0.54 H new ATOM 0 HB3 MET A 85 21.631 -15.169 9.484 1.00 0.54 H new ATOM 0 HG2 MET A 85 24.145 -13.690 8.761 1.00 0.63 H new ATOM 0 HG3 MET A 85 23.818 -15.230 7.991 1.00 0.63 H new ATOM 0 HE1 MET A 85 20.999 -11.552 7.635 1.00 2.27 H new ATOM 0 HE2 MET A 85 20.955 -12.612 9.064 1.00 2.27 H new ATOM 0 HE3 MET A 85 22.407 -11.643 8.719 1.00 2.27 H new ATOM 1329 N ARG A 86 20.436 -14.561 11.708 1.00 0.45 N ATOM 1330 CA ARG A 86 19.515 -15.159 12.661 1.00 0.46 C ATOM 1331 C ARG A 86 18.856 -16.343 11.973 1.00 0.49 C ATOM 1332 O ARG A 86 18.898 -16.436 10.750 1.00 0.57 O ATOM 1333 CB ARG A 86 18.447 -14.144 13.097 1.00 0.49 C ATOM 1334 CG ARG A 86 17.791 -14.456 14.430 1.00 0.96 C ATOM 1335 CD ARG A 86 16.669 -13.473 14.724 1.00 1.24 C ATOM 1336 NE ARG A 86 17.042 -12.096 14.390 1.00 2.20 N ATOM 1337 CZ ARG A 86 16.938 -11.063 15.225 1.00 3.10 C ATOM 1338 NH1 ARG A 86 16.557 -11.246 16.487 1.00 3.34 N ATOM 1339 NH2 ARG A 86 17.251 -9.846 14.795 1.00 4.19 N ATOM 0 H ARG A 86 20.016 -14.337 10.806 1.00 0.45 H new ATOM 0 HA ARG A 86 20.052 -15.476 13.555 1.00 0.46 H new ATOM 0 HB2 ARG A 86 18.904 -13.156 13.153 1.00 0.49 H new ATOM 0 HB3 ARG A 86 17.675 -14.095 12.329 1.00 0.49 H new ATOM 0 HG2 ARG A 86 17.396 -15.472 14.417 1.00 0.96 H new ATOM 0 HG3 ARG A 86 18.535 -14.414 15.225 1.00 0.96 H new ATOM 0 HD2 ARG A 86 15.782 -13.756 14.157 1.00 1.24 H new ATOM 0 HD3 ARG A 86 16.404 -13.531 15.780 1.00 1.24 H new ATOM 0 HE ARG A 86 17.406 -11.916 13.454 1.00 2.20 H new ATOM 0 HH11 ARG A 86 16.341 -12.184 16.824 1.00 3.34 H new ATOM 0 HH12 ARG A 86 16.481 -10.448 17.118 1.00 3.34 H new ATOM 0 HH21 ARG A 86 17.567 -9.710 13.835 1.00 4.19 H new ATOM 0 HH22 ARG A 86 17.175 -9.047 15.425 1.00 4.19 H new ATOM 1353 N LYS A 87 18.240 -17.236 12.733 1.00 0.51 N ATOM 1354 CA LYS A 87 17.586 -18.400 12.140 1.00 0.59 C ATOM 1355 C LYS A 87 16.413 -17.973 11.253 1.00 0.59 C ATOM 1356 O LYS A 87 15.935 -18.736 10.419 1.00 0.74 O ATOM 1357 CB LYS A 87 17.103 -19.357 13.230 1.00 0.68 C ATOM 1358 CG LYS A 87 16.648 -20.705 12.691 1.00 0.84 C ATOM 1359 CD LYS A 87 16.126 -21.607 13.795 1.00 1.03 C ATOM 1360 CE LYS A 87 15.790 -22.993 13.266 1.00 1.26 C ATOM 1361 NZ LYS A 87 14.787 -22.948 12.169 1.00 1.94 N ATOM 0 H LYS A 87 18.177 -17.182 13.750 1.00 0.51 H new ATOM 0 HA LYS A 87 18.316 -18.918 11.518 1.00 0.59 H new ATOM 0 HB2 LYS A 87 17.908 -19.514 13.948 1.00 0.68 H new ATOM 0 HB3 LYS A 87 16.278 -18.893 13.771 1.00 0.68 H new ATOM 0 HG2 LYS A 87 15.867 -20.554 11.946 1.00 0.84 H new ATOM 0 HG3 LYS A 87 17.481 -21.194 12.185 1.00 0.84 H new ATOM 0 HD2 LYS A 87 16.873 -21.688 14.584 1.00 1.03 H new ATOM 0 HD3 LYS A 87 15.237 -21.161 14.242 1.00 1.03 H new ATOM 0 HE2 LYS A 87 16.700 -23.472 12.905 1.00 1.26 H new ATOM 0 HE3 LYS A 87 15.408 -23.608 14.081 1.00 1.26 H new ATOM 0 HZ1 LYS A 87 14.463 -23.913 11.955 1.00 1.94 H new ATOM 0 HZ2 LYS A 87 13.976 -22.367 12.464 1.00 1.94 H new ATOM 0 HZ3 LYS A 87 15.220 -22.532 11.320 1.00 1.94 H new ATOM 1375 N ASN A 88 15.958 -16.740 11.441 1.00 0.55 N ATOM 1376 CA ASN A 88 14.864 -16.200 10.640 1.00 0.66 C ATOM 1377 C ASN A 88 15.295 -14.920 9.932 1.00 0.60 C ATOM 1378 O ASN A 88 14.461 -14.153 9.461 1.00 0.71 O ATOM 1379 CB ASN A 88 13.632 -15.911 11.511 1.00 0.79 C ATOM 1380 CG ASN A 88 13.014 -17.165 12.109 1.00 0.96 C ATOM 1381 OD1 ASN A 88 12.182 -17.816 11.484 1.00 1.23 O ATOM 1382 ND2 ASN A 88 13.390 -17.494 13.340 1.00 1.20 N ATOM 0 H ASN A 88 16.328 -16.096 12.140 1.00 0.55 H new ATOM 0 HA ASN A 88 14.601 -16.951 9.895 1.00 0.66 H new ATOM 0 HB2 ASN A 88 13.915 -15.234 12.317 1.00 0.79 H new ATOM 0 HB3 ASN A 88 12.883 -15.396 10.910 1.00 0.79 H new ATOM 0 HD21 ASN A 88 12.984 -18.311 13.796 1.00 1.20 H new ATOM 0 HD22 ASN A 88 14.084 -16.929 13.829 1.00 1.20 H new ATOM 1389 N GLU A 89 16.602 -14.693 9.855 1.00 0.50 N ATOM 1390 CA GLU A 89 17.126 -13.469 9.258 1.00 0.46 C ATOM 1391 C GLU A 89 18.088 -13.795 8.119 1.00 0.47 C ATOM 1392 O GLU A 89 19.016 -14.584 8.285 1.00 0.65 O ATOM 1393 CB GLU A 89 17.809 -12.621 10.331 1.00 0.50 C ATOM 1394 CG GLU A 89 18.171 -11.217 9.888 1.00 0.48 C ATOM 1395 CD GLU A 89 18.320 -10.267 11.063 1.00 1.01 C ATOM 1396 OE1 GLU A 89 17.746 -10.544 12.139 1.00 1.38 O ATOM 1397 OE2 GLU A 89 19.038 -9.247 10.920 1.00 1.60 O ATOM 0 H GLU A 89 17.315 -15.337 10.197 1.00 0.50 H new ATOM 0 HA GLU A 89 16.299 -12.896 8.838 1.00 0.46 H new ATOM 0 HB2 GLU A 89 17.151 -12.556 11.198 1.00 0.50 H new ATOM 0 HB3 GLU A 89 18.716 -13.131 10.656 1.00 0.50 H new ATOM 0 HG2 GLU A 89 19.104 -11.244 9.324 1.00 0.48 H new ATOM 0 HG3 GLU A 89 17.402 -10.841 9.214 1.00 0.48 H new ATOM 1404 N LYS A 90 17.859 -13.169 6.975 1.00 0.39 N ATOM 1405 CA LYS A 90 18.634 -13.433 5.768 1.00 0.40 C ATOM 1406 C LYS A 90 18.984 -12.117 5.077 1.00 0.39 C ATOM 1407 O LYS A 90 18.177 -11.180 5.070 1.00 0.47 O ATOM 1408 CB LYS A 90 17.822 -14.316 4.815 1.00 0.50 C ATOM 1409 CG LYS A 90 18.500 -14.565 3.478 1.00 0.56 C ATOM 1410 CD LYS A 90 17.595 -15.323 2.525 1.00 0.93 C ATOM 1411 CE LYS A 90 18.268 -15.524 1.181 1.00 0.85 C ATOM 1412 NZ LYS A 90 17.416 -16.294 0.237 1.00 1.17 N ATOM 0 H LYS A 90 17.132 -12.464 6.855 1.00 0.39 H new ATOM 0 HA LYS A 90 19.554 -13.949 6.041 1.00 0.40 H new ATOM 0 HB2 LYS A 90 17.630 -15.274 5.298 1.00 0.50 H new ATOM 0 HB3 LYS A 90 16.853 -13.848 4.639 1.00 0.50 H new ATOM 0 HG2 LYS A 90 18.784 -13.613 3.031 1.00 0.56 H new ATOM 0 HG3 LYS A 90 19.419 -15.130 3.635 1.00 0.56 H new ATOM 0 HD2 LYS A 90 17.337 -16.291 2.955 1.00 0.93 H new ATOM 0 HD3 LYS A 90 16.662 -14.775 2.390 1.00 0.93 H new ATOM 0 HE2 LYS A 90 18.504 -14.553 0.746 1.00 0.85 H new ATOM 0 HE3 LYS A 90 19.213 -16.047 1.324 1.00 0.85 H new ATOM 0 HZ1 LYS A 90 17.880 -17.196 0.007 1.00 1.17 H new ATOM 0 HZ2 LYS A 90 16.492 -16.482 0.677 1.00 1.17 H new ATOM 0 HZ3 LYS A 90 17.279 -15.744 -0.635 1.00 1.17 H new ATOM 1426 N CYS A 91 20.175 -12.039 4.491 1.00 0.35 N ATOM 1427 CA CYS A 91 20.589 -10.828 3.796 1.00 0.38 C ATOM 1428 C CYS A 91 21.540 -11.136 2.640 1.00 0.32 C ATOM 1429 O CYS A 91 22.082 -12.245 2.538 1.00 0.37 O ATOM 1430 CB CYS A 91 21.244 -9.848 4.781 1.00 0.48 C ATOM 1431 SG CYS A 91 22.744 -10.465 5.580 1.00 1.20 S ATOM 0 H CYS A 91 20.863 -12.792 4.484 1.00 0.35 H new ATOM 0 HA CYS A 91 19.696 -10.367 3.373 1.00 0.38 H new ATOM 0 HB2 CYS A 91 21.485 -8.927 4.250 1.00 0.48 H new ATOM 0 HB3 CYS A 91 20.518 -9.590 5.552 1.00 0.48 H new ATOM 0 HG CYS A 91 23.532 -10.980 4.684 1.00 1.20 H new ATOM 1437 N LEU A 92 21.722 -10.144 1.775 1.00 0.31 N ATOM 1438 CA LEU A 92 22.640 -10.239 0.648 1.00 0.32 C ATOM 1439 C LEU A 92 24.005 -9.712 1.045 1.00 0.28 C ATOM 1440 O LEU A 92 24.147 -8.549 1.426 1.00 0.39 O ATOM 1441 CB LEU A 92 22.108 -9.433 -0.541 1.00 0.40 C ATOM 1442 CG LEU A 92 21.262 -10.202 -1.557 1.00 0.79 C ATOM 1443 CD1 LEU A 92 20.457 -9.239 -2.418 1.00 1.39 C ATOM 1444 CD2 LEU A 92 22.156 -11.056 -2.437 1.00 1.73 C ATOM 0 H LEU A 92 21.235 -9.250 1.837 1.00 0.31 H new ATOM 0 HA LEU A 92 22.726 -11.286 0.359 1.00 0.32 H new ATOM 0 HB2 LEU A 92 21.511 -8.607 -0.155 1.00 0.40 H new ATOM 0 HB3 LEU A 92 22.958 -8.995 -1.065 1.00 0.40 H new ATOM 0 HG LEU A 92 20.571 -10.847 -1.015 1.00 0.79 H new ATOM 0 HD11 LEU A 92 19.861 -9.803 -3.135 1.00 1.39 H new ATOM 0 HD12 LEU A 92 19.797 -8.648 -1.783 1.00 1.39 H new ATOM 0 HD13 LEU A 92 21.136 -8.575 -2.953 1.00 1.39 H new ATOM 0 HD21 LEU A 92 21.545 -11.600 -3.157 1.00 1.73 H new ATOM 0 HD22 LEU A 92 22.861 -10.417 -2.969 1.00 1.73 H new ATOM 0 HD23 LEU A 92 22.705 -11.766 -1.818 1.00 1.73 H new ATOM 1456 N VAL A 93 25.008 -10.558 0.945 1.00 0.25 N ATOM 1457 CA VAL A 93 26.358 -10.167 1.313 1.00 0.25 C ATOM 1458 C VAL A 93 27.161 -9.816 0.064 1.00 0.23 C ATOM 1459 O VAL A 93 27.106 -10.524 -0.946 1.00 0.26 O ATOM 1460 CB VAL A 93 27.083 -11.269 2.125 1.00 0.34 C ATOM 1461 CG1 VAL A 93 27.167 -12.565 1.335 1.00 0.74 C ATOM 1462 CG2 VAL A 93 28.467 -10.801 2.554 1.00 0.60 C ATOM 0 H VAL A 93 24.918 -11.518 0.613 1.00 0.25 H new ATOM 0 HA VAL A 93 26.282 -9.289 1.954 1.00 0.25 H new ATOM 0 HB VAL A 93 26.498 -11.465 3.024 1.00 0.34 H new ATOM 0 HG11 VAL A 93 27.681 -13.321 1.929 1.00 0.74 H new ATOM 0 HG12 VAL A 93 26.161 -12.912 1.097 1.00 0.74 H new ATOM 0 HG13 VAL A 93 27.719 -12.393 0.411 1.00 0.74 H new ATOM 0 HG21 VAL A 93 28.958 -11.591 3.123 1.00 0.60 H new ATOM 0 HG22 VAL A 93 29.062 -10.566 1.671 1.00 0.60 H new ATOM 0 HG23 VAL A 93 28.373 -9.911 3.176 1.00 0.60 H new ATOM 1472 N ARG A 94 27.880 -8.709 0.128 1.00 0.25 N ATOM 1473 CA ARG A 94 28.667 -8.250 -1.003 1.00 0.30 C ATOM 1474 C ARG A 94 30.105 -8.722 -0.845 1.00 0.33 C ATOM 1475 O ARG A 94 30.820 -8.266 0.046 1.00 0.38 O ATOM 1476 CB ARG A 94 28.632 -6.718 -1.095 1.00 0.40 C ATOM 1477 CG ARG A 94 27.261 -6.117 -0.822 1.00 0.92 C ATOM 1478 CD ARG A 94 26.264 -6.384 -1.943 1.00 0.65 C ATOM 1479 NE ARG A 94 26.490 -5.522 -3.105 1.00 0.89 N ATOM 1480 CZ ARG A 94 26.163 -4.225 -3.151 1.00 1.05 C ATOM 1481 NH1 ARG A 94 25.671 -3.614 -2.077 1.00 1.71 N ATOM 1482 NH2 ARG A 94 26.324 -3.540 -4.274 1.00 1.58 N ATOM 0 H ARG A 94 27.935 -8.111 0.952 1.00 0.25 H new ATOM 0 HA ARG A 94 28.244 -8.664 -1.918 1.00 0.30 H new ATOM 0 HB2 ARG A 94 29.348 -6.304 -0.384 1.00 0.40 H new ATOM 0 HB3 ARG A 94 28.959 -6.416 -2.090 1.00 0.40 H new ATOM 0 HG2 ARG A 94 26.870 -6.525 0.110 1.00 0.92 H new ATOM 0 HG3 ARG A 94 27.363 -5.041 -0.681 1.00 0.92 H new ATOM 0 HD2 ARG A 94 26.335 -7.428 -2.249 1.00 0.65 H new ATOM 0 HD3 ARG A 94 25.251 -6.229 -1.570 1.00 0.65 H new ATOM 0 HE ARG A 94 26.923 -5.936 -3.930 1.00 0.89 H new ATOM 0 HH11 ARG A 94 25.540 -4.134 -1.209 1.00 1.71 H new ATOM 0 HH12 ARG A 94 25.424 -2.625 -2.121 1.00 1.71 H new ATOM 0 HH21 ARG A 94 26.697 -4.001 -5.104 1.00 1.58 H new ATOM 0 HH22 ARG A 94 26.075 -2.552 -4.309 1.00 1.58 H new ATOM 1496 N ILE A 95 30.523 -9.638 -1.700 1.00 0.35 N ATOM 1497 CA ILE A 95 31.888 -10.123 -1.674 1.00 0.38 C ATOM 1498 C ILE A 95 32.730 -9.279 -2.610 1.00 0.41 C ATOM 1499 O ILE A 95 32.664 -9.418 -3.832 1.00 0.45 O ATOM 1500 CB ILE A 95 32.004 -11.625 -2.053 1.00 0.43 C ATOM 1501 CG1 ILE A 95 31.493 -12.525 -0.918 1.00 0.47 C ATOM 1502 CG2 ILE A 95 33.446 -11.989 -2.388 1.00 0.52 C ATOM 1503 CD1 ILE A 95 30.000 -12.458 -0.693 1.00 0.51 C ATOM 0 H ILE A 95 29.936 -10.060 -2.420 1.00 0.35 H new ATOM 0 HA ILE A 95 32.251 -10.035 -0.650 1.00 0.38 H new ATOM 0 HB ILE A 95 31.383 -11.789 -2.933 1.00 0.43 H new ATOM 0 HG12 ILE A 95 31.769 -13.557 -1.136 1.00 0.47 H new ATOM 0 HG13 ILE A 95 32.000 -12.247 0.006 1.00 0.47 H new ATOM 0 HG21 ILE A 95 33.503 -13.045 -2.650 1.00 0.52 H new ATOM 0 HG22 ILE A 95 33.787 -11.387 -3.230 1.00 0.52 H new ATOM 0 HG23 ILE A 95 34.081 -11.795 -1.523 1.00 0.52 H new ATOM 0 HD11 ILE A 95 29.725 -13.123 0.125 1.00 0.51 H new ATOM 0 HD12 ILE A 95 29.715 -11.436 -0.441 1.00 0.51 H new ATOM 0 HD13 ILE A 95 29.481 -12.766 -1.601 1.00 0.51 H new ATOM 1515 N GLU A 96 33.469 -8.356 -2.026 1.00 0.43 N ATOM 1516 CA GLU A 96 34.378 -7.523 -2.780 1.00 0.49 C ATOM 1517 C GLU A 96 35.657 -8.298 -3.066 1.00 0.45 C ATOM 1518 O GLU A 96 35.880 -9.368 -2.495 1.00 0.45 O ATOM 1519 CB GLU A 96 34.679 -6.236 -2.001 1.00 0.55 C ATOM 1520 CG GLU A 96 35.561 -5.250 -2.747 1.00 0.77 C ATOM 1521 CD GLU A 96 35.759 -3.956 -1.998 1.00 0.88 C ATOM 1522 OE1 GLU A 96 36.485 -3.957 -0.987 1.00 1.37 O ATOM 1523 OE2 GLU A 96 35.199 -2.926 -2.428 1.00 1.19 O ATOM 0 H GLU A 96 33.455 -8.165 -1.024 1.00 0.43 H new ATOM 0 HA GLU A 96 33.919 -7.245 -3.729 1.00 0.49 H new ATOM 0 HB2 GLU A 96 33.737 -5.747 -1.751 1.00 0.55 H new ATOM 0 HB3 GLU A 96 35.162 -6.499 -1.060 1.00 0.55 H new ATOM 0 HG2 GLU A 96 36.532 -5.708 -2.934 1.00 0.77 H new ATOM 0 HG3 GLU A 96 35.117 -5.037 -3.719 1.00 0.77 H new ATOM 1530 N SER A 97 36.482 -7.752 -3.944 1.00 0.49 N ATOM 1531 CA SER A 97 37.741 -8.355 -4.336 1.00 0.54 C ATOM 1532 C SER A 97 38.554 -8.800 -3.115 1.00 0.52 C ATOM 1533 O SER A 97 39.031 -9.930 -3.050 1.00 0.59 O ATOM 1534 CB SER A 97 38.526 -7.324 -5.150 1.00 0.64 C ATOM 1535 OG SER A 97 37.683 -6.243 -5.528 1.00 1.00 O ATOM 0 H SER A 97 36.291 -6.865 -4.410 1.00 0.49 H new ATOM 0 HA SER A 97 37.546 -9.246 -4.932 1.00 0.54 H new ATOM 0 HB2 SER A 97 39.365 -6.951 -4.563 1.00 0.64 H new ATOM 0 HB3 SER A 97 38.944 -7.796 -6.039 1.00 0.64 H new ATOM 0 HG SER A 97 38.199 -5.591 -6.047 1.00 1.00 H new ATOM 1541 N MET A 98 38.685 -7.907 -2.142 1.00 0.48 N ATOM 1542 CA MET A 98 39.473 -8.187 -0.944 1.00 0.53 C ATOM 1543 C MET A 98 38.718 -9.068 0.058 1.00 0.49 C ATOM 1544 O MET A 98 39.289 -9.507 1.052 1.00 0.58 O ATOM 1545 CB MET A 98 39.918 -6.884 -0.272 1.00 0.59 C ATOM 1546 CG MET A 98 38.780 -6.054 0.296 1.00 0.57 C ATOM 1547 SD MET A 98 39.355 -4.534 1.069 1.00 0.79 S ATOM 1548 CE MET A 98 40.024 -3.658 -0.346 1.00 1.79 C ATOM 0 H MET A 98 38.256 -6.982 -2.157 1.00 0.48 H new ATOM 0 HA MET A 98 40.354 -8.742 -1.267 1.00 0.53 H new ATOM 0 HB2 MET A 98 40.614 -7.123 0.532 1.00 0.59 H new ATOM 0 HB3 MET A 98 40.464 -6.282 -0.999 1.00 0.59 H new ATOM 0 HG2 MET A 98 38.079 -5.809 -0.502 1.00 0.57 H new ATOM 0 HG3 MET A 98 38.233 -6.647 1.029 1.00 0.57 H new ATOM 0 HE1 MET A 98 40.106 -2.597 -0.111 1.00 1.79 H new ATOM 0 HE2 MET A 98 41.011 -4.054 -0.586 1.00 1.79 H new ATOM 0 HE3 MET A 98 39.362 -3.790 -1.202 1.00 1.79 H new ATOM 1558 N TYR A 99 37.436 -9.318 -0.192 1.00 0.41 N ATOM 1559 CA TYR A 99 36.635 -10.136 0.719 1.00 0.43 C ATOM 1560 C TYR A 99 36.582 -11.580 0.245 1.00 0.49 C ATOM 1561 O TYR A 99 36.157 -12.471 0.988 1.00 0.48 O ATOM 1562 CB TYR A 99 35.200 -9.602 0.844 1.00 0.43 C ATOM 1563 CG TYR A 99 35.075 -8.228 1.472 1.00 0.46 C ATOM 1564 CD1 TYR A 99 36.089 -7.690 2.252 1.00 0.51 C ATOM 1565 CD2 TYR A 99 33.919 -7.475 1.292 1.00 0.53 C ATOM 1566 CE1 TYR A 99 35.959 -6.438 2.829 1.00 0.59 C ATOM 1567 CE2 TYR A 99 33.782 -6.225 1.864 1.00 0.62 C ATOM 1568 CZ TYR A 99 34.801 -5.711 2.632 1.00 0.63 C ATOM 1569 OH TYR A 99 34.662 -4.465 3.201 1.00 0.75 O ATOM 0 H TYR A 99 36.932 -8.971 -1.008 1.00 0.41 H new ATOM 0 HA TYR A 99 37.117 -10.087 1.695 1.00 0.43 H new ATOM 0 HB2 TYR A 99 34.753 -9.572 -0.150 1.00 0.43 H new ATOM 0 HB3 TYR A 99 34.617 -10.308 1.435 1.00 0.43 H new ATOM 0 HD1 TYR A 99 36.994 -8.257 2.412 1.00 0.51 H new ATOM 0 HD2 TYR A 99 33.114 -7.875 0.694 1.00 0.53 H new ATOM 0 HE1 TYR A 99 36.759 -6.032 3.430 1.00 0.59 H new ATOM 0 HE2 TYR A 99 32.879 -5.654 1.709 1.00 0.62 H new ATOM 0 HH TYR A 99 33.788 -4.092 2.961 1.00 0.75 H new ATOM 1579 N GLY A 100 37.010 -11.803 -0.991 1.00 0.60 N ATOM 1580 CA GLY A 100 36.936 -13.126 -1.575 1.00 0.71 C ATOM 1581 C GLY A 100 38.297 -13.769 -1.717 1.00 0.67 C ATOM 1582 O GLY A 100 39.318 -13.142 -1.430 1.00 0.67 O ATOM 0 H GLY A 100 37.408 -11.088 -1.600 1.00 0.60 H new ATOM 0 HA2 GLY A 100 36.301 -13.759 -0.955 1.00 0.71 H new ATOM 0 HA3 GLY A 100 36.463 -13.062 -2.555 1.00 0.71 H new ATOM 1586 N TYR A 101 38.307 -15.020 -2.171 1.00 0.76 N ATOM 1587 CA TYR A 101 39.542 -15.786 -2.327 1.00 0.86 C ATOM 1588 C TYR A 101 40.478 -15.116 -3.328 1.00 0.93 C ATOM 1589 O TYR A 101 41.689 -15.040 -3.110 1.00 1.52 O ATOM 1590 CB TYR A 101 39.223 -17.214 -2.784 1.00 1.01 C ATOM 1591 CG TYR A 101 39.752 -18.283 -1.853 1.00 0.86 C ATOM 1592 CD1 TYR A 101 39.149 -18.522 -0.625 1.00 0.75 C ATOM 1593 CD2 TYR A 101 40.856 -19.052 -2.203 1.00 1.09 C ATOM 1594 CE1 TYR A 101 39.628 -19.495 0.229 1.00 0.74 C ATOM 1595 CE2 TYR A 101 41.342 -20.029 -1.353 1.00 1.14 C ATOM 1596 CZ TYR A 101 40.726 -20.245 -0.138 1.00 0.92 C ATOM 1597 OH TYR A 101 41.207 -21.216 0.714 1.00 1.09 O ATOM 0 H TYR A 101 37.465 -15.529 -2.440 1.00 0.76 H new ATOM 0 HA TYR A 101 40.043 -15.822 -1.360 1.00 0.86 H new ATOM 0 HB2 TYR A 101 38.142 -17.325 -2.873 1.00 1.01 H new ATOM 0 HB3 TYR A 101 39.642 -17.370 -3.778 1.00 1.01 H new ATOM 0 HD1 TYR A 101 38.290 -17.936 -0.333 1.00 0.75 H new ATOM 0 HD2 TYR A 101 41.342 -18.884 -3.153 1.00 1.09 H new ATOM 0 HE1 TYR A 101 39.146 -19.668 1.180 1.00 0.74 H new ATOM 0 HE2 TYR A 101 42.200 -20.620 -1.639 1.00 1.14 H new ATOM 0 HH TYR A 101 40.472 -21.802 0.990 1.00 1.09 H new ATOM 1607 N GLY A 102 39.908 -14.623 -4.417 1.00 1.06 N ATOM 1608 CA GLY A 102 40.699 -13.934 -5.414 1.00 1.21 C ATOM 1609 C GLY A 102 40.797 -14.709 -6.711 1.00 1.78 C ATOM 1610 O GLY A 102 40.476 -15.897 -6.762 1.00 2.30 O ATOM 0 H GLY A 102 38.912 -14.688 -4.628 1.00 1.06 H new ATOM 0 HA2 GLY A 102 40.259 -12.956 -5.611 1.00 1.21 H new ATOM 0 HA3 GLY A 102 41.701 -13.760 -5.022 1.00 1.21 H new ATOM 1614 N ASP A 103 41.241 -14.034 -7.760 1.00 2.37 N ATOM 1615 CA ASP A 103 41.385 -14.649 -9.076 1.00 3.29 C ATOM 1616 C ASP A 103 42.570 -15.611 -9.104 1.00 2.98 C ATOM 1617 O ASP A 103 42.616 -16.546 -9.902 1.00 3.44 O ATOM 1618 CB ASP A 103 41.560 -13.558 -10.139 1.00 4.29 C ATOM 1619 CG ASP A 103 41.803 -14.115 -11.525 1.00 5.21 C ATOM 1620 OD1 ASP A 103 40.818 -14.462 -12.208 1.00 5.86 O ATOM 1621 OD2 ASP A 103 42.979 -14.201 -11.937 1.00 5.54 O ATOM 0 H ASP A 103 41.511 -13.051 -7.727 1.00 2.37 H new ATOM 0 HA ASP A 103 40.483 -15.222 -9.292 1.00 3.29 H new ATOM 0 HB2 ASP A 103 40.669 -12.930 -10.157 1.00 4.29 H new ATOM 0 HB3 ASP A 103 42.396 -12.917 -9.859 1.00 4.29 H new ATOM 1626 N GLU A 104 43.512 -15.390 -8.198 1.00 2.45 N ATOM 1627 CA GLU A 104 44.727 -16.192 -8.130 1.00 2.35 C ATOM 1628 C GLU A 104 44.509 -17.435 -7.260 1.00 1.99 C ATOM 1629 O GLU A 104 45.455 -18.139 -6.905 1.00 2.35 O ATOM 1630 CB GLU A 104 45.864 -15.339 -7.559 1.00 2.63 C ATOM 1631 CG GLU A 104 47.248 -15.909 -7.815 1.00 2.96 C ATOM 1632 CD GLU A 104 48.320 -15.187 -7.030 1.00 3.62 C ATOM 1633 OE1 GLU A 104 48.742 -14.095 -7.458 1.00 4.27 O ATOM 1634 OE2 GLU A 104 48.746 -15.714 -5.980 1.00 3.81 O ATOM 0 H GLU A 104 43.457 -14.655 -7.493 1.00 2.45 H new ATOM 0 HA GLU A 104 44.990 -16.525 -9.134 1.00 2.35 H new ATOM 0 HB2 GLU A 104 45.808 -14.340 -7.991 1.00 2.63 H new ATOM 0 HB3 GLU A 104 45.719 -15.231 -6.484 1.00 2.63 H new ATOM 0 HG2 GLU A 104 47.258 -16.967 -7.551 1.00 2.96 H new ATOM 0 HG3 GLU A 104 47.474 -15.844 -8.879 1.00 2.96 H new ATOM 1641 N GLY A 105 43.257 -17.699 -6.915 1.00 1.73 N ATOM 1642 CA GLY A 105 42.950 -18.838 -6.077 1.00 2.16 C ATOM 1643 C GLY A 105 41.804 -19.658 -6.624 1.00 1.86 C ATOM 1644 O GLY A 105 41.469 -19.552 -7.805 1.00 1.83 O ATOM 0 H GLY A 105 42.450 -17.145 -7.200 1.00 1.73 H new ATOM 0 HA2 GLY A 105 43.834 -19.469 -5.986 1.00 2.16 H new ATOM 0 HA3 GLY A 105 42.700 -18.492 -5.074 1.00 2.16 H new ATOM 1648 N CYS A 106 41.209 -20.481 -5.772 1.00 2.02 N ATOM 1649 CA CYS A 106 40.079 -21.306 -6.168 1.00 1.91 C ATOM 1650 C CYS A 106 38.833 -20.446 -6.349 1.00 1.52 C ATOM 1651 O CYS A 106 38.456 -19.687 -5.456 1.00 1.85 O ATOM 1652 CB CYS A 106 39.816 -22.380 -5.113 1.00 2.62 C ATOM 1653 SG CYS A 106 41.277 -23.343 -4.670 1.00 3.34 S ATOM 0 H CYS A 106 41.492 -20.594 -4.799 1.00 2.02 H new ATOM 0 HA CYS A 106 40.317 -21.788 -7.116 1.00 1.91 H new ATOM 0 HB2 CYS A 106 39.420 -21.905 -4.215 1.00 2.62 H new ATOM 0 HB3 CYS A 106 39.045 -23.057 -5.482 1.00 2.62 H new ATOM 0 HG CYS A 106 40.959 -24.225 -3.770 1.00 3.34 H new ATOM 1659 N GLY A 107 38.212 -20.556 -7.511 1.00 1.20 N ATOM 1660 CA GLY A 107 36.993 -19.824 -7.773 1.00 1.16 C ATOM 1661 C GLY A 107 35.764 -20.690 -7.593 1.00 1.09 C ATOM 1662 O GLY A 107 35.782 -21.879 -7.919 1.00 1.19 O ATOM 0 H GLY A 107 38.532 -21.143 -8.282 1.00 1.20 H new ATOM 0 HA2 GLY A 107 36.934 -18.966 -7.103 1.00 1.16 H new ATOM 0 HA3 GLY A 107 37.016 -19.433 -8.790 1.00 1.16 H new ATOM 1666 N GLU A 108 34.705 -20.102 -7.058 1.00 1.15 N ATOM 1667 CA GLU A 108 33.448 -20.813 -6.887 1.00 1.27 C ATOM 1668 C GLU A 108 32.681 -20.819 -8.203 1.00 1.10 C ATOM 1669 O GLU A 108 32.598 -21.842 -8.884 1.00 1.19 O ATOM 1670 CB GLU A 108 32.622 -20.143 -5.792 1.00 1.53 C ATOM 1671 CG GLU A 108 33.401 -19.925 -4.506 1.00 1.74 C ATOM 1672 CD GLU A 108 32.659 -19.053 -3.520 1.00 2.49 C ATOM 1673 OE1 GLU A 108 32.550 -17.837 -3.772 1.00 3.02 O ATOM 1674 OE2 GLU A 108 32.186 -19.589 -2.497 1.00 3.08 O ATOM 0 H GLU A 108 34.691 -19.135 -6.735 1.00 1.15 H new ATOM 0 HA GLU A 108 33.649 -21.843 -6.592 1.00 1.27 H new ATOM 0 HB2 GLU A 108 32.258 -19.182 -6.156 1.00 1.53 H new ATOM 0 HB3 GLU A 108 31.746 -20.756 -5.580 1.00 1.53 H new ATOM 0 HG2 GLU A 108 33.612 -20.890 -4.045 1.00 1.74 H new ATOM 0 HG3 GLU A 108 34.362 -19.466 -4.740 1.00 1.74 H new ATOM 1681 N SER A 109 32.162 -19.662 -8.573 1.00 0.97 N ATOM 1682 CA SER A 109 31.534 -19.489 -9.870 1.00 0.88 C ATOM 1683 C SER A 109 32.474 -18.698 -10.781 1.00 0.77 C ATOM 1684 O SER A 109 33.085 -19.258 -11.688 1.00 0.85 O ATOM 1685 CB SER A 109 30.191 -18.771 -9.716 1.00 0.92 C ATOM 1686 OG SER A 109 29.426 -19.339 -8.663 1.00 1.52 O ATOM 0 H SER A 109 32.163 -18.825 -7.990 1.00 0.97 H new ATOM 0 HA SER A 109 31.343 -20.464 -10.318 1.00 0.88 H new ATOM 0 HB2 SER A 109 30.361 -17.713 -9.516 1.00 0.92 H new ATOM 0 HB3 SER A 109 29.633 -18.833 -10.650 1.00 0.92 H new ATOM 0 HG SER A 109 28.739 -19.928 -9.039 1.00 1.52 H new ATOM 1692 N ILE A 110 32.614 -17.400 -10.504 1.00 0.68 N ATOM 1693 CA ILE A 110 33.552 -16.539 -11.224 1.00 0.65 C ATOM 1694 C ILE A 110 34.168 -15.515 -10.266 1.00 0.63 C ATOM 1695 O ILE A 110 33.471 -14.646 -9.747 1.00 0.75 O ATOM 1696 CB ILE A 110 32.912 -15.789 -12.437 1.00 0.64 C ATOM 1697 CG1 ILE A 110 31.657 -14.984 -12.041 1.00 0.66 C ATOM 1698 CG2 ILE A 110 32.591 -16.760 -13.560 1.00 0.72 C ATOM 1699 CD1 ILE A 110 30.396 -15.811 -11.844 1.00 0.74 C ATOM 0 H ILE A 110 32.083 -16.919 -9.778 1.00 0.68 H new ATOM 0 HA ILE A 110 34.318 -17.201 -11.628 1.00 0.65 H new ATOM 0 HB ILE A 110 33.652 -15.071 -12.790 1.00 0.64 H new ATOM 0 HG12 ILE A 110 31.867 -14.444 -11.118 1.00 0.66 H new ATOM 0 HG13 ILE A 110 31.466 -14.236 -12.811 1.00 0.66 H new ATOM 0 HG21 ILE A 110 32.146 -16.217 -14.394 1.00 0.72 H new ATOM 0 HG22 ILE A 110 33.507 -17.248 -13.892 1.00 0.72 H new ATOM 0 HG23 ILE A 110 31.889 -17.512 -13.201 1.00 0.72 H new ATOM 0 HD11 ILE A 110 29.570 -15.155 -11.568 1.00 0.74 H new ATOM 0 HD12 ILE A 110 30.153 -16.330 -12.771 1.00 0.74 H new ATOM 0 HD13 ILE A 110 30.560 -16.541 -11.052 1.00 0.74 H new ATOM 1711 N PRO A 111 35.480 -15.631 -9.995 1.00 0.70 N ATOM 1712 CA PRO A 111 36.182 -14.710 -9.107 1.00 0.78 C ATOM 1713 C PRO A 111 36.622 -13.422 -9.813 1.00 0.79 C ATOM 1714 O PRO A 111 35.942 -12.400 -9.732 1.00 1.58 O ATOM 1715 CB PRO A 111 37.386 -15.529 -8.640 1.00 1.10 C ATOM 1716 CG PRO A 111 37.652 -16.517 -9.732 1.00 1.22 C ATOM 1717 CD PRO A 111 36.370 -16.684 -10.518 1.00 0.89 C ATOM 0 HA PRO A 111 35.548 -14.361 -8.292 1.00 0.78 H new ATOM 0 HB2 PRO A 111 38.252 -14.890 -8.471 1.00 1.10 H new ATOM 0 HB3 PRO A 111 37.174 -16.034 -7.698 1.00 1.10 H new ATOM 0 HG2 PRO A 111 38.455 -16.166 -10.379 1.00 1.22 H new ATOM 0 HG3 PRO A 111 37.973 -17.472 -9.315 1.00 1.22 H new ATOM 0 HD2 PRO A 111 36.541 -16.564 -11.588 1.00 0.89 H new ATOM 0 HD3 PRO A 111 35.941 -17.675 -10.373 1.00 0.89 H new ATOM 1725 N GLY A 112 37.766 -13.477 -10.492 1.00 0.95 N ATOM 1726 CA GLY A 112 38.252 -12.341 -11.262 1.00 1.02 C ATOM 1727 C GLY A 112 38.557 -11.115 -10.416 1.00 1.09 C ATOM 1728 O GLY A 112 38.641 -10.009 -10.946 1.00 2.05 O ATOM 0 H GLY A 112 38.371 -14.297 -10.523 1.00 0.95 H new ATOM 0 HA2 GLY A 112 39.154 -12.636 -11.797 1.00 1.02 H new ATOM 0 HA3 GLY A 112 37.507 -12.077 -12.013 1.00 1.02 H new ATOM 1732 N ASN A 113 38.715 -11.308 -9.101 1.00 0.74 N ATOM 1733 CA ASN A 113 38.989 -10.201 -8.177 1.00 0.84 C ATOM 1734 C ASN A 113 37.963 -9.085 -8.335 1.00 0.75 C ATOM 1735 O ASN A 113 38.284 -7.905 -8.199 1.00 1.00 O ATOM 1736 CB ASN A 113 40.410 -9.655 -8.393 1.00 1.00 C ATOM 1737 CG ASN A 113 41.424 -10.296 -7.460 1.00 1.49 C ATOM 1738 OD1 ASN A 113 41.921 -11.395 -7.721 1.00 2.03 O ATOM 1739 ND2 ASN A 113 41.754 -9.614 -6.373 1.00 1.79 N ATOM 0 H ASN A 113 38.658 -12.222 -8.652 1.00 0.74 H new ATOM 0 HA ASN A 113 38.914 -10.588 -7.161 1.00 0.84 H new ATOM 0 HB2 ASN A 113 40.710 -9.829 -9.426 1.00 1.00 H new ATOM 0 HB3 ASN A 113 40.409 -8.576 -8.239 1.00 1.00 H new ATOM 0 HD21 ASN A 113 42.439 -9.995 -5.720 1.00 1.79 H new ATOM 0 HD22 ASN A 113 41.323 -8.708 -6.189 1.00 1.79 H new ATOM 1746 N SER A 114 36.725 -9.467 -8.613 1.00 0.57 N ATOM 1747 CA SER A 114 35.657 -8.506 -8.808 1.00 0.58 C ATOM 1748 C SER A 114 34.696 -8.521 -7.623 1.00 0.50 C ATOM 1749 O SER A 114 34.879 -9.288 -6.672 1.00 0.59 O ATOM 1750 CB SER A 114 34.907 -8.834 -10.094 1.00 0.65 C ATOM 1751 OG SER A 114 35.818 -9.010 -11.164 1.00 1.14 O ATOM 0 H SER A 114 36.438 -10.441 -8.708 1.00 0.57 H new ATOM 0 HA SER A 114 36.090 -7.509 -8.884 1.00 0.58 H new ATOM 0 HB2 SER A 114 34.317 -9.740 -9.958 1.00 0.65 H new ATOM 0 HB3 SER A 114 34.209 -8.031 -10.330 1.00 0.65 H new ATOM 0 HG SER A 114 35.324 -9.222 -11.983 1.00 1.14 H new ATOM 1757 N VAL A 115 33.678 -7.674 -7.679 1.00 0.44 N ATOM 1758 CA VAL A 115 32.669 -7.632 -6.637 1.00 0.38 C ATOM 1759 C VAL A 115 31.454 -8.490 -7.013 1.00 0.31 C ATOM 1760 O VAL A 115 30.928 -8.401 -8.129 1.00 0.31 O ATOM 1761 CB VAL A 115 32.236 -6.178 -6.333 1.00 0.44 C ATOM 1762 CG1 VAL A 115 31.694 -5.491 -7.574 1.00 0.48 C ATOM 1763 CG2 VAL A 115 31.197 -6.138 -5.225 1.00 0.42 C ATOM 0 H VAL A 115 33.531 -7.007 -8.437 1.00 0.44 H new ATOM 0 HA VAL A 115 33.113 -8.047 -5.732 1.00 0.38 H new ATOM 0 HB VAL A 115 33.124 -5.640 -6.001 1.00 0.44 H new ATOM 0 HG11 VAL A 115 31.399 -4.471 -7.326 1.00 0.48 H new ATOM 0 HG12 VAL A 115 32.466 -5.468 -8.344 1.00 0.48 H new ATOM 0 HG13 VAL A 115 30.828 -6.039 -7.945 1.00 0.48 H new ATOM 0 HG21 VAL A 115 30.911 -5.104 -5.032 1.00 0.42 H new ATOM 0 HG22 VAL A 115 30.319 -6.707 -5.529 1.00 0.42 H new ATOM 0 HG23 VAL A 115 31.615 -6.574 -4.318 1.00 0.42 H new ATOM 1773 N LEU A 116 31.050 -9.355 -6.092 1.00 0.28 N ATOM 1774 CA LEU A 116 29.879 -10.203 -6.271 1.00 0.25 C ATOM 1775 C LEU A 116 28.951 -10.036 -5.079 1.00 0.28 C ATOM 1776 O LEU A 116 29.284 -9.343 -4.120 1.00 0.37 O ATOM 1777 CB LEU A 116 30.264 -11.687 -6.398 1.00 0.30 C ATOM 1778 CG LEU A 116 31.035 -12.079 -7.661 1.00 0.33 C ATOM 1779 CD1 LEU A 116 32.510 -11.721 -7.546 1.00 0.51 C ATOM 1780 CD2 LEU A 116 30.872 -13.565 -7.949 1.00 0.50 C ATOM 0 H LEU A 116 31.525 -9.489 -5.199 1.00 0.28 H new ATOM 0 HA LEU A 116 29.383 -9.898 -7.193 1.00 0.25 H new ATOM 0 HB2 LEU A 116 30.865 -11.961 -5.531 1.00 0.30 H new ATOM 0 HB3 LEU A 116 29.352 -12.283 -6.354 1.00 0.30 H new ATOM 0 HG LEU A 116 30.616 -11.512 -8.493 1.00 0.33 H new ATOM 0 HD11 LEU A 116 33.028 -12.013 -8.460 1.00 0.51 H new ATOM 0 HD12 LEU A 116 32.613 -10.646 -7.398 1.00 0.51 H new ATOM 0 HD13 LEU A 116 32.947 -12.247 -6.697 1.00 0.51 H new ATOM 0 HD21 LEU A 116 31.427 -13.824 -8.850 1.00 0.50 H new ATOM 0 HD22 LEU A 116 31.255 -14.143 -7.108 1.00 0.50 H new ATOM 0 HD23 LEU A 116 29.816 -13.794 -8.095 1.00 0.50 H new ATOM 1792 N LEU A 117 27.790 -10.662 -5.142 1.00 0.31 N ATOM 1793 CA LEU A 117 26.859 -10.665 -4.023 1.00 0.38 C ATOM 1794 C LEU A 117 26.088 -11.974 -3.973 1.00 0.31 C ATOM 1795 O LEU A 117 25.591 -12.464 -4.990 1.00 0.38 O ATOM 1796 CB LEU A 117 25.885 -9.474 -4.070 1.00 0.61 C ATOM 1797 CG LEU A 117 25.751 -8.750 -5.414 1.00 0.38 C ATOM 1798 CD1 LEU A 117 25.182 -9.664 -6.482 1.00 0.70 C ATOM 1799 CD2 LEU A 117 24.873 -7.520 -5.265 1.00 0.59 C ATOM 0 H LEU A 117 27.466 -11.178 -5.960 1.00 0.31 H new ATOM 0 HA LEU A 117 27.452 -10.564 -3.114 1.00 0.38 H new ATOM 0 HB2 LEU A 117 24.898 -9.829 -3.775 1.00 0.61 H new ATOM 0 HB3 LEU A 117 26.199 -8.747 -3.321 1.00 0.61 H new ATOM 0 HG LEU A 117 26.750 -8.444 -5.726 1.00 0.38 H new ATOM 0 HD11 LEU A 117 25.100 -9.118 -7.422 1.00 0.70 H new ATOM 0 HD12 LEU A 117 25.841 -10.521 -6.616 1.00 0.70 H new ATOM 0 HD13 LEU A 117 24.195 -10.010 -6.176 1.00 0.70 H new ATOM 0 HD21 LEU A 117 24.787 -7.016 -6.227 1.00 0.59 H new ATOM 0 HD22 LEU A 117 23.883 -7.819 -4.922 1.00 0.59 H new ATOM 0 HD23 LEU A 117 25.319 -6.841 -4.538 1.00 0.59 H new ATOM 1811 N PHE A 118 26.014 -12.547 -2.785 1.00 0.30 N ATOM 1812 CA PHE A 118 25.306 -13.802 -2.580 1.00 0.34 C ATOM 1813 C PHE A 118 24.313 -13.662 -1.438 1.00 0.34 C ATOM 1814 O PHE A 118 24.588 -12.987 -0.447 1.00 0.37 O ATOM 1815 CB PHE A 118 26.283 -14.936 -2.245 1.00 0.43 C ATOM 1816 CG PHE A 118 27.432 -15.076 -3.203 1.00 0.37 C ATOM 1817 CD1 PHE A 118 27.222 -15.460 -4.517 1.00 0.39 C ATOM 1818 CD2 PHE A 118 28.729 -14.830 -2.782 1.00 0.38 C ATOM 1819 CE1 PHE A 118 28.284 -15.590 -5.390 1.00 0.38 C ATOM 1820 CE2 PHE A 118 29.794 -14.960 -3.652 1.00 0.40 C ATOM 1821 CZ PHE A 118 29.570 -15.340 -4.959 1.00 0.38 C ATOM 0 H PHE A 118 26.438 -12.162 -1.941 1.00 0.30 H new ATOM 0 HA PHE A 118 24.782 -14.042 -3.505 1.00 0.34 H new ATOM 0 HB2 PHE A 118 26.680 -14.771 -1.243 1.00 0.43 H new ATOM 0 HB3 PHE A 118 25.732 -15.876 -2.219 1.00 0.43 H new ATOM 0 HD1 PHE A 118 26.218 -15.660 -4.862 1.00 0.39 H new ATOM 0 HD2 PHE A 118 28.910 -14.533 -1.760 1.00 0.38 H new ATOM 0 HE1 PHE A 118 28.107 -15.888 -6.413 1.00 0.38 H new ATOM 0 HE2 PHE A 118 30.800 -14.765 -3.310 1.00 0.40 H new ATOM 0 HZ PHE A 118 30.400 -15.441 -5.643 1.00 0.38 H new ATOM 1831 N GLU A 119 23.156 -14.279 -1.588 1.00 0.33 N ATOM 1832 CA GLU A 119 22.216 -14.392 -0.489 1.00 0.37 C ATOM 1833 C GLU A 119 22.702 -15.463 0.471 1.00 0.34 C ATOM 1834 O GLU A 119 22.973 -16.583 0.048 1.00 0.47 O ATOM 1835 CB GLU A 119 20.822 -14.770 -0.993 1.00 0.56 C ATOM 1836 CG GLU A 119 20.173 -13.729 -1.885 1.00 0.82 C ATOM 1837 CD GLU A 119 18.758 -14.108 -2.272 1.00 1.18 C ATOM 1838 OE1 GLU A 119 17.827 -13.825 -1.495 1.00 1.46 O ATOM 1839 OE2 GLU A 119 18.573 -14.671 -3.369 1.00 1.43 O ATOM 0 H GLU A 119 22.845 -14.709 -2.459 1.00 0.33 H new ATOM 0 HA GLU A 119 22.153 -13.427 0.013 1.00 0.37 H new ATOM 0 HB2 GLU A 119 20.890 -15.709 -1.542 1.00 0.56 H new ATOM 0 HB3 GLU A 119 20.175 -14.949 -0.134 1.00 0.56 H new ATOM 0 HG2 GLU A 119 20.162 -12.768 -1.370 1.00 0.82 H new ATOM 0 HG3 GLU A 119 20.772 -13.601 -2.786 1.00 0.82 H new ATOM 1846 N ILE A 120 22.814 -15.135 1.749 1.00 0.29 N ATOM 1847 CA ILE A 120 23.244 -16.122 2.730 1.00 0.31 C ATOM 1848 C ILE A 120 22.060 -16.574 3.576 1.00 0.31 C ATOM 1849 O ILE A 120 21.411 -15.778 4.255 1.00 0.33 O ATOM 1850 CB ILE A 120 24.400 -15.611 3.632 1.00 0.34 C ATOM 1851 CG1 ILE A 120 25.710 -15.561 2.830 1.00 0.33 C ATOM 1852 CG2 ILE A 120 24.560 -16.499 4.861 1.00 0.48 C ATOM 1853 CD1 ILE A 120 26.935 -15.205 3.657 1.00 0.39 C ATOM 0 H ILE A 120 22.617 -14.209 2.128 1.00 0.29 H new ATOM 0 HA ILE A 120 23.637 -16.974 2.175 1.00 0.31 H new ATOM 0 HB ILE A 120 24.156 -14.604 3.972 1.00 0.34 H new ATOM 0 HG12 ILE A 120 25.872 -16.531 2.360 1.00 0.33 H new ATOM 0 HG13 ILE A 120 25.603 -14.832 2.027 1.00 0.33 H new ATOM 0 HG21 ILE A 120 25.375 -16.122 5.478 1.00 0.48 H new ATOM 0 HG22 ILE A 120 23.635 -16.492 5.438 1.00 0.48 H new ATOM 0 HG23 ILE A 120 24.784 -17.518 4.547 1.00 0.48 H new ATOM 0 HD11 ILE A 120 27.816 -15.192 3.015 1.00 0.39 H new ATOM 0 HD12 ILE A 120 26.798 -14.221 4.106 1.00 0.39 H new ATOM 0 HD13 ILE A 120 27.071 -15.947 4.444 1.00 0.39 H new ATOM 1865 N GLU A 121 21.775 -17.858 3.483 1.00 0.36 N ATOM 1866 CA GLU A 121 20.647 -18.466 4.162 1.00 0.40 C ATOM 1867 C GLU A 121 21.130 -19.387 5.279 1.00 0.35 C ATOM 1868 O GLU A 121 21.808 -20.389 5.018 1.00 0.40 O ATOM 1869 CB GLU A 121 19.825 -19.251 3.142 1.00 0.60 C ATOM 1870 CG GLU A 121 18.609 -19.943 3.717 1.00 1.06 C ATOM 1871 CD GLU A 121 17.905 -20.792 2.682 1.00 1.43 C ATOM 1872 OE1 GLU A 121 18.438 -21.862 2.323 1.00 1.67 O ATOM 1873 OE2 GLU A 121 16.803 -20.400 2.237 1.00 1.88 O ATOM 0 H GLU A 121 22.325 -18.515 2.929 1.00 0.36 H new ATOM 0 HA GLU A 121 20.028 -17.689 4.612 1.00 0.40 H new ATOM 0 HB2 GLU A 121 19.502 -18.571 2.354 1.00 0.60 H new ATOM 0 HB3 GLU A 121 20.466 -19.999 2.675 1.00 0.60 H new ATOM 0 HG2 GLU A 121 18.910 -20.569 4.557 1.00 1.06 H new ATOM 0 HG3 GLU A 121 17.917 -19.197 4.107 1.00 1.06 H new ATOM 1880 N LEU A 122 20.793 -19.038 6.516 1.00 0.33 N ATOM 1881 CA LEU A 122 21.187 -19.826 7.678 1.00 0.33 C ATOM 1882 C LEU A 122 20.100 -20.845 8.010 1.00 0.38 C ATOM 1883 O LEU A 122 19.183 -20.559 8.779 1.00 0.54 O ATOM 1884 CB LEU A 122 21.422 -18.898 8.876 1.00 0.38 C ATOM 1885 CG LEU A 122 22.016 -19.550 10.127 1.00 0.43 C ATOM 1886 CD1 LEU A 122 23.451 -19.973 9.877 1.00 0.80 C ATOM 1887 CD2 LEU A 122 21.932 -18.595 11.305 1.00 1.12 C ATOM 0 H LEU A 122 20.244 -18.208 6.740 1.00 0.33 H new ATOM 0 HA LEU A 122 22.111 -20.359 7.453 1.00 0.33 H new ATOM 0 HB2 LEU A 122 22.086 -18.093 8.561 1.00 0.38 H new ATOM 0 HB3 LEU A 122 20.471 -18.440 9.147 1.00 0.38 H new ATOM 0 HG LEU A 122 21.438 -20.443 10.365 1.00 0.43 H new ATOM 0 HD11 LEU A 122 23.856 -20.434 10.777 1.00 0.80 H new ATOM 0 HD12 LEU A 122 23.481 -20.690 9.057 1.00 0.80 H new ATOM 0 HD13 LEU A 122 24.048 -19.099 9.617 1.00 0.80 H new ATOM 0 HD21 LEU A 122 22.357 -19.070 12.189 1.00 1.12 H new ATOM 0 HD22 LEU A 122 22.489 -17.686 11.077 1.00 1.12 H new ATOM 0 HD23 LEU A 122 20.889 -18.343 11.495 1.00 1.12 H new ATOM 1899 N LEU A 123 20.200 -22.030 7.416 1.00 0.39 N ATOM 1900 CA LEU A 123 19.192 -23.067 7.619 1.00 0.47 C ATOM 1901 C LEU A 123 19.611 -24.029 8.727 1.00 0.47 C ATOM 1902 O LEU A 123 18.772 -24.550 9.459 1.00 0.59 O ATOM 1903 CB LEU A 123 18.929 -23.854 6.325 1.00 0.55 C ATOM 1904 CG LEU A 123 20.091 -24.710 5.819 1.00 0.58 C ATOM 1905 CD1 LEU A 123 19.572 -25.865 4.980 1.00 1.00 C ATOM 1906 CD2 LEU A 123 21.062 -23.872 5.005 1.00 0.77 C ATOM 0 H LEU A 123 20.963 -22.296 6.794 1.00 0.39 H new ATOM 0 HA LEU A 123 18.271 -22.565 7.915 1.00 0.47 H new ATOM 0 HB2 LEU A 123 18.068 -24.502 6.485 1.00 0.55 H new ATOM 0 HB3 LEU A 123 18.655 -23.147 5.542 1.00 0.55 H new ATOM 0 HG LEU A 123 20.619 -25.111 6.684 1.00 0.58 H new ATOM 0 HD11 LEU A 123 20.411 -26.465 4.627 1.00 1.00 H new ATOM 0 HD12 LEU A 123 18.911 -26.486 5.585 1.00 1.00 H new ATOM 0 HD13 LEU A 123 19.021 -25.474 4.125 1.00 1.00 H new ATOM 0 HD21 LEU A 123 21.881 -24.501 4.655 1.00 0.77 H new ATOM 0 HD22 LEU A 123 20.543 -23.443 4.148 1.00 0.77 H new ATOM 0 HD23 LEU A 123 21.461 -23.070 5.627 1.00 0.77 H new ATOM 1918 N SER A 124 20.909 -24.268 8.850 1.00 0.44 N ATOM 1919 CA SER A 124 21.411 -25.208 9.835 1.00 0.47 C ATOM 1920 C SER A 124 22.610 -24.616 10.555 1.00 0.43 C ATOM 1921 O SER A 124 23.547 -24.140 9.919 1.00 0.48 O ATOM 1922 CB SER A 124 21.792 -26.525 9.158 1.00 0.63 C ATOM 1923 OG SER A 124 20.740 -26.993 8.330 1.00 1.19 O ATOM 0 H SER A 124 21.630 -23.824 8.281 1.00 0.44 H new ATOM 0 HA SER A 124 20.628 -25.407 10.567 1.00 0.47 H new ATOM 0 HB2 SER A 124 22.694 -26.384 8.562 1.00 0.63 H new ATOM 0 HB3 SER A 124 22.024 -27.274 9.915 1.00 0.63 H new ATOM 0 HG SER A 124 21.007 -27.835 7.907 1.00 1.19 H new ATOM 1929 N PHE A 125 22.567 -24.627 11.873 1.00 0.39 N ATOM 1930 CA PHE A 125 23.628 -24.047 12.681 1.00 0.43 C ATOM 1931 C PHE A 125 23.462 -24.482 14.126 1.00 0.46 C ATOM 1932 O PHE A 125 22.443 -25.072 14.485 1.00 0.46 O ATOM 1933 CB PHE A 125 23.596 -22.512 12.603 1.00 0.46 C ATOM 1934 CG PHE A 125 22.426 -21.887 13.318 1.00 0.46 C ATOM 1935 CD1 PHE A 125 21.137 -22.339 13.094 1.00 0.44 C ATOM 1936 CD2 PHE A 125 22.618 -20.846 14.208 1.00 0.62 C ATOM 1937 CE1 PHE A 125 20.063 -21.767 13.745 1.00 0.54 C ATOM 1938 CE2 PHE A 125 21.550 -20.271 14.863 1.00 0.72 C ATOM 1939 CZ PHE A 125 20.269 -20.732 14.631 1.00 0.67 C ATOM 0 H PHE A 125 21.803 -25.034 12.413 1.00 0.39 H new ATOM 0 HA PHE A 125 24.586 -24.396 12.296 1.00 0.43 H new ATOM 0 HB2 PHE A 125 24.520 -22.117 13.026 1.00 0.46 H new ATOM 0 HB3 PHE A 125 23.571 -22.212 11.555 1.00 0.46 H new ATOM 0 HD1 PHE A 125 20.970 -23.150 12.401 1.00 0.44 H new ATOM 0 HD2 PHE A 125 23.617 -20.479 14.392 1.00 0.62 H new ATOM 0 HE1 PHE A 125 19.063 -22.130 13.560 1.00 0.54 H new ATOM 0 HE2 PHE A 125 21.715 -19.460 15.557 1.00 0.72 H new ATOM 0 HZ PHE A 125 19.431 -20.282 15.143 1.00 0.67 H new ATOM 1949 N ARG A 126 24.452 -24.183 14.950 1.00 0.60 N ATOM 1950 CA ARG A 126 24.377 -24.457 16.370 1.00 0.71 C ATOM 1951 C ARG A 126 25.417 -23.637 17.113 1.00 0.76 C ATOM 1952 O ARG A 126 26.288 -23.030 16.489 1.00 0.90 O ATOM 1953 CB ARG A 126 24.548 -25.953 16.652 1.00 0.83 C ATOM 1954 CG ARG A 126 25.805 -26.579 16.065 1.00 0.85 C ATOM 1955 CD ARG A 126 25.722 -28.095 16.162 1.00 1.12 C ATOM 1956 NE ARG A 126 27.014 -28.767 16.014 1.00 1.57 N ATOM 1957 CZ ARG A 126 27.338 -29.875 16.692 1.00 2.14 C ATOM 1958 NH1 ARG A 126 26.497 -30.371 17.591 1.00 2.47 N ATOM 1959 NH2 ARG A 126 28.496 -30.481 16.481 1.00 2.98 N ATOM 0 H ARG A 126 25.325 -23.746 14.653 1.00 0.60 H new ATOM 0 HA ARG A 126 23.389 -24.169 16.728 1.00 0.71 H new ATOM 0 HB2 ARG A 126 24.554 -26.105 17.731 1.00 0.83 H new ATOM 0 HB3 ARG A 126 23.680 -26.483 16.260 1.00 0.83 H new ATOM 0 HG2 ARG A 126 25.919 -26.278 15.024 1.00 0.85 H new ATOM 0 HG3 ARG A 126 26.684 -26.219 16.599 1.00 0.85 H new ATOM 0 HD2 ARG A 126 25.291 -28.365 17.126 1.00 1.12 H new ATOM 0 HD3 ARG A 126 25.042 -28.462 15.394 1.00 1.12 H new ATOM 0 HE ARG A 126 27.697 -28.374 15.366 1.00 1.57 H new ATOM 0 HH11 ARG A 126 25.605 -29.908 17.765 1.00 2.47 H new ATOM 0 HH12 ARG A 126 26.743 -31.215 18.108 1.00 2.47 H new ATOM 0 HH21 ARG A 126 29.151 -30.104 15.796 1.00 2.98 H new ATOM 0 HH22 ARG A 126 28.733 -31.325 17.003 1.00 2.98 H new ATOM 1973 N GLU A 127 25.303 -23.611 18.431 1.00 0.82 N ATOM 1974 CA GLU A 127 26.214 -22.862 19.282 1.00 0.88 C ATOM 1975 C GLU A 127 26.433 -23.661 20.562 1.00 1.01 C ATOM 1976 O GLU A 127 25.562 -24.439 20.957 1.00 1.11 O ATOM 1977 CB GLU A 127 25.619 -21.481 19.591 1.00 1.10 C ATOM 1978 CG GLU A 127 26.636 -20.347 19.599 1.00 1.68 C ATOM 1979 CD GLU A 127 27.661 -20.477 20.706 1.00 2.69 C ATOM 1980 OE1 GLU A 127 28.681 -21.170 20.493 1.00 3.38 O ATOM 1981 OE2 GLU A 127 27.460 -19.872 21.783 1.00 3.18 O ATOM 0 H GLU A 127 24.575 -24.110 18.942 1.00 0.82 H new ATOM 0 HA GLU A 127 27.170 -22.709 18.781 1.00 0.88 H new ATOM 0 HB2 GLU A 127 24.849 -21.257 18.853 1.00 1.10 H new ATOM 0 HB3 GLU A 127 25.128 -21.519 20.563 1.00 1.10 H new ATOM 0 HG2 GLU A 127 27.149 -20.320 18.638 1.00 1.68 H new ATOM 0 HG3 GLU A 127 26.112 -19.397 19.707 1.00 1.68 H new ATOM 1988 N LEU A 128 27.584 -23.495 21.197 1.00 1.18 N ATOM 1989 CA LEU A 128 27.910 -24.294 22.370 1.00 1.39 C ATOM 1990 C LEU A 128 28.944 -23.618 23.265 1.00 1.83 C ATOM 1991 O LEU A 128 28.848 -23.700 24.492 1.00 2.41 O ATOM 1992 CB LEU A 128 28.425 -25.673 21.946 1.00 1.95 C ATOM 1993 CG LEU A 128 28.769 -26.622 23.096 1.00 2.44 C ATOM 1994 CD1 LEU A 128 27.527 -26.952 23.911 1.00 2.79 C ATOM 1995 CD2 LEU A 128 29.412 -27.892 22.566 1.00 3.35 C ATOM 0 H LEU A 128 28.301 -22.822 20.924 1.00 1.18 H new ATOM 0 HA LEU A 128 26.991 -24.401 22.946 1.00 1.39 H new ATOM 0 HB2 LEU A 128 27.671 -26.147 21.318 1.00 1.95 H new ATOM 0 HB3 LEU A 128 29.314 -25.537 21.330 1.00 1.95 H new ATOM 0 HG LEU A 128 29.483 -26.121 23.749 1.00 2.44 H new ATOM 0 HD11 LEU A 128 27.794 -27.628 24.723 1.00 2.79 H new ATOM 0 HD12 LEU A 128 27.109 -26.034 24.325 1.00 2.79 H new ATOM 0 HD13 LEU A 128 26.787 -27.430 23.269 1.00 2.79 H new ATOM 0 HD21 LEU A 128 29.649 -28.554 23.398 1.00 3.35 H new ATOM 0 HD22 LEU A 128 28.721 -28.394 21.888 1.00 3.35 H new ATOM 0 HD23 LEU A 128 30.327 -27.640 22.030 1.00 3.35 H new ATOM 2007 N GLU A 129 29.924 -22.945 22.678 1.00 2.29 N ATOM 2008 CA GLU A 129 31.042 -22.451 23.466 1.00 3.05 C ATOM 2009 C GLU A 129 31.005 -20.939 23.620 1.00 3.49 C ATOM 2010 O GLU A 129 31.429 -20.194 22.739 1.00 3.72 O ATOM 2011 CB GLU A 129 32.380 -22.895 22.870 1.00 3.72 C ATOM 2012 CG GLU A 129 33.576 -22.518 23.731 1.00 4.36 C ATOM 2013 CD GLU A 129 34.862 -23.171 23.274 1.00 4.88 C ATOM 2014 OE1 GLU A 129 35.126 -24.325 23.665 1.00 5.04 O ATOM 2015 OE2 GLU A 129 35.612 -22.529 22.510 1.00 5.39 O ATOM 0 H GLU A 129 29.968 -22.732 21.681 1.00 2.29 H new ATOM 0 HA GLU A 129 30.945 -22.888 24.460 1.00 3.05 H new ATOM 0 HB2 GLU A 129 32.367 -23.976 22.731 1.00 3.72 H new ATOM 0 HB3 GLU A 129 32.496 -22.448 21.883 1.00 3.72 H new ATOM 0 HG2 GLU A 129 33.700 -21.435 23.717 1.00 4.36 H new ATOM 0 HG3 GLU A 129 33.377 -22.803 24.764 1.00 4.36 H new ATOM 2022 N HIS A 130 30.493 -20.503 24.757 1.00 4.02 N ATOM 2023 CA HIS A 130 30.509 -19.097 25.124 1.00 4.65 C ATOM 2024 C HIS A 130 31.806 -18.796 25.882 1.00 4.79 C ATOM 2025 O HIS A 130 31.797 -18.297 27.009 1.00 5.17 O ATOM 2026 CB HIS A 130 29.270 -18.785 25.972 1.00 5.23 C ATOM 2027 CG HIS A 130 29.081 -17.336 26.302 1.00 5.76 C ATOM 2028 ND1 HIS A 130 29.049 -16.866 27.594 1.00 6.35 N ATOM 2029 CD2 HIS A 130 28.891 -16.255 25.505 1.00 6.21 C ATOM 2030 CE1 HIS A 130 28.840 -15.564 27.583 1.00 7.04 C ATOM 2031 NE2 HIS A 130 28.741 -15.164 26.327 1.00 6.98 N ATOM 0 H HIS A 130 30.056 -21.110 25.450 1.00 4.02 H new ATOM 0 HA HIS A 130 30.478 -18.464 24.237 1.00 4.65 H new ATOM 0 HB2 HIS A 130 28.386 -19.140 25.442 1.00 5.23 H new ATOM 0 HB3 HIS A 130 29.333 -19.350 26.902 1.00 5.23 H new ATOM 0 HD2 HIS A 130 28.863 -16.252 24.425 1.00 6.21 H new ATOM 0 HE1 HIS A 130 28.763 -14.931 28.454 1.00 7.04 H new ATOM 0 HE2 HIS A 130 28.580 -14.205 26.019 1.00 6.98 H new ATOM 2040 N HIS A 131 32.922 -19.118 25.245 1.00 4.87 N ATOM 2041 CA HIS A 131 34.237 -18.997 25.863 1.00 5.24 C ATOM 2042 C HIS A 131 35.218 -18.363 24.886 1.00 5.58 C ATOM 2043 O HIS A 131 35.227 -18.696 23.705 1.00 5.71 O ATOM 2044 CB HIS A 131 34.730 -20.387 26.296 1.00 5.62 C ATOM 2045 CG HIS A 131 36.014 -20.388 27.076 1.00 6.06 C ATOM 2046 ND1 HIS A 131 36.061 -20.276 28.450 1.00 6.53 N ATOM 2047 CD2 HIS A 131 37.302 -20.510 26.673 1.00 6.53 C ATOM 2048 CE1 HIS A 131 37.315 -20.333 28.854 1.00 7.20 C ATOM 2049 NE2 HIS A 131 38.093 -20.476 27.798 1.00 7.21 N ATOM 0 H HIS A 131 32.943 -19.470 24.288 1.00 4.87 H new ATOM 0 HA HIS A 131 34.166 -18.357 26.742 1.00 5.24 H new ATOM 0 HB2 HIS A 131 33.955 -20.860 26.899 1.00 5.62 H new ATOM 0 HB3 HIS A 131 34.862 -21.003 25.407 1.00 5.62 H new ATOM 0 HD2 HIS A 131 37.645 -20.615 25.654 1.00 6.53 H new ATOM 0 HE1 HIS A 131 37.650 -20.273 29.879 1.00 7.20 H new ATOM 0 HE2 HIS A 131 39.110 -20.549 27.813 1.00 7.21 H new ATOM 2058 N HIS A 132 36.030 -17.440 25.374 1.00 6.07 N ATOM 2059 CA HIS A 132 37.015 -16.784 24.526 1.00 6.73 C ATOM 2060 C HIS A 132 38.422 -17.008 25.062 1.00 7.16 C ATOM 2061 O HIS A 132 38.740 -16.618 26.185 1.00 7.46 O ATOM 2062 CB HIS A 132 36.714 -15.283 24.407 1.00 7.36 C ATOM 2063 CG HIS A 132 37.701 -14.528 23.562 1.00 7.90 C ATOM 2064 ND1 HIS A 132 37.830 -14.710 22.202 1.00 8.29 N ATOM 2065 CD2 HIS A 132 38.622 -13.592 23.900 1.00 8.39 C ATOM 2066 CE1 HIS A 132 38.784 -13.919 21.741 1.00 8.95 C ATOM 2067 NE2 HIS A 132 39.283 -13.232 22.751 1.00 9.02 N ATOM 0 H HIS A 132 36.028 -17.129 26.345 1.00 6.07 H new ATOM 0 HA HIS A 132 36.955 -17.225 23.531 1.00 6.73 H new ATOM 0 HB2 HIS A 132 35.717 -15.155 23.985 1.00 7.36 H new ATOM 0 HB3 HIS A 132 36.696 -14.846 25.405 1.00 7.36 H new ATOM 0 HD2 HIS A 132 38.803 -13.201 24.891 1.00 8.39 H new ATOM 0 HE1 HIS A 132 39.101 -13.847 20.711 1.00 8.95 H new ATOM 0 HE2 HIS A 132 40.036 -12.546 22.689 1.00 9.02 H new ATOM 2076 N HIS A 133 39.252 -17.642 24.252 1.00 7.47 N ATOM 2077 CA HIS A 133 40.642 -17.882 24.606 1.00 8.09 C ATOM 2078 C HIS A 133 41.433 -16.584 24.457 1.00 8.82 C ATOM 2079 O HIS A 133 41.372 -15.943 23.410 1.00 9.23 O ATOM 2080 CB HIS A 133 41.210 -18.984 23.703 1.00 8.42 C ATOM 2081 CG HIS A 133 42.619 -19.381 24.016 1.00 8.83 C ATOM 2082 ND1 HIS A 133 42.943 -20.341 24.947 1.00 9.20 N ATOM 2083 CD2 HIS A 133 43.791 -18.943 23.510 1.00 9.20 C ATOM 2084 CE1 HIS A 133 44.252 -20.474 25.001 1.00 9.73 C ATOM 2085 NE2 HIS A 133 44.791 -19.636 24.138 1.00 9.75 N ATOM 0 H HIS A 133 38.985 -18.003 23.336 1.00 7.47 H new ATOM 0 HA HIS A 133 40.717 -18.212 25.642 1.00 8.09 H new ATOM 0 HB2 HIS A 133 40.572 -19.865 23.781 1.00 8.42 H new ATOM 0 HB3 HIS A 133 41.163 -18.647 22.667 1.00 8.42 H new ATOM 0 HD2 HIS A 133 43.917 -18.186 22.750 1.00 9.20 H new ATOM 0 HE1 HIS A 133 44.792 -21.154 25.643 1.00 9.73 H new ATOM 0 HE2 HIS A 133 45.790 -19.522 23.966 1.00 9.75 H new ATOM 2094 N HIS A 134 42.159 -16.186 25.502 1.00 9.17 N ATOM 2095 CA HIS A 134 42.859 -14.901 25.483 1.00 10.02 C ATOM 2096 C HIS A 134 43.962 -14.889 24.418 1.00 10.42 C ATOM 2097 O HIS A 134 43.918 -14.065 23.505 1.00 10.82 O ATOM 2098 CB HIS A 134 43.409 -14.514 26.881 1.00 10.46 C ATOM 2099 CG HIS A 134 44.586 -15.314 27.382 1.00 11.09 C ATOM 2100 ND1 HIS A 134 45.895 -14.927 27.185 1.00 11.60 N ATOM 2101 CD2 HIS A 134 44.645 -16.467 28.092 1.00 11.51 C ATOM 2102 CE1 HIS A 134 46.705 -15.806 27.745 1.00 12.26 C ATOM 2103 NE2 HIS A 134 45.973 -16.750 28.304 1.00 12.22 N ATOM 0 H HIS A 134 42.277 -16.725 26.360 1.00 9.17 H new ATOM 0 HA HIS A 134 42.128 -14.139 25.213 1.00 10.02 H new ATOM 0 HB2 HIS A 134 43.696 -13.463 26.857 1.00 10.46 H new ATOM 0 HB3 HIS A 134 42.599 -14.607 27.605 1.00 10.46 H new ATOM 0 HD2 HIS A 134 43.804 -17.055 28.429 1.00 11.51 H new ATOM 0 HE1 HIS A 134 47.784 -15.760 27.745 1.00 12.26 H new ATOM 0 HE2 HIS A 134 46.334 -17.558 28.811 1.00 12.22 H new ATOM 2112 N HIS A 135 44.912 -15.820 24.531 1.00 10.51 N ATOM 2113 CA HIS A 135 46.029 -15.946 23.591 1.00 11.06 C ATOM 2114 C HIS A 135 47.070 -16.898 24.165 1.00 11.14 C ATOM 2115 O HIS A 135 48.048 -16.417 24.762 1.00 11.30 O ATOM 2116 CB HIS A 135 46.689 -14.591 23.310 1.00 11.78 C ATOM 2117 CG HIS A 135 47.712 -14.637 22.222 1.00 12.27 C ATOM 2118 ND1 HIS A 135 47.381 -14.632 20.887 1.00 12.92 N ATOM 2119 CD2 HIS A 135 49.062 -14.681 22.275 1.00 12.37 C ATOM 2120 CE1 HIS A 135 48.482 -14.672 20.164 1.00 13.35 C ATOM 2121 NE2 HIS A 135 49.516 -14.704 20.980 1.00 13.03 N ATOM 2122 OXT HIS A 135 46.880 -18.121 24.053 1.00 11.24 O ATOM 0 H HIS A 135 44.928 -16.511 25.281 1.00 10.51 H new ATOM 0 HA HIS A 135 45.634 -16.334 22.652 1.00 11.06 H new ATOM 0 HB2 HIS A 135 45.917 -13.869 23.041 1.00 11.78 H new ATOM 0 HB3 HIS A 135 47.159 -14.229 24.224 1.00 11.78 H new ATOM 0 HD2 HIS A 135 49.669 -14.695 23.168 1.00 12.37 H new ATOM 0 HE1 HIS A 135 48.529 -14.678 19.085 1.00 13.35 H new ATOM 0 HE2 HIS A 135 50.495 -14.740 20.695 1.00 13.03 H new TER 2131 HIS A 135