USER MOD reduce.3.24.130724 H: found=0, std=0, add=1274, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1272 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: B 74 ASN : amide:sc= -1.47 K(o=-1.5,f=-7.7!) USER MOD Set 1.2: B 75 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: B 58 TYR OH : rot -43:sc= 0.597 USER MOD Set 2.2: B 61 GLN : amide:sc= -6.99! C(o=-9.7!,f=-2.7!) USER MOD Set 2.3: B 62 HIS : no HD1:sc= -3.28! C(o=-9.7!,f=-14!) USER MOD Set 3.1: B 22 TYR OH : rot -49:sc= -1.74! USER MOD Set 3.2: B 52 GLN : amide:sc= -3.79! C(o=-5.5!,f=-5.4!) USER MOD Set 4.1: A 58 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 61 GLN : amide:sc= -1.45 K(o=-4.1,f=-1.3) USER MOD Set 4.3: A 62 HIS : no HD1:sc= -2.64 K(o=-4.1,f=-2) USER MOD Set 5.1: A 22 TYR OH : rot -75:sc= -1.94! USER MOD Set 5.2: A 52 GLN : amide:sc= -4.66! C(o=-6.6!,f=-5.9!) USER MOD Set 6.1: A 31 TYR OH : rot 180:sc= 0 USER MOD Set 6.2: A 35 LYS NZ :NH3+ -153:sc= 0 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc=-0.00622 (180deg=-0.00622) USER MOD Single : A 2 SER OG : rot 66:sc= 0.163 USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 TYR OH : rot 180:sc= 0 USER MOD Single : A 13 CYS SG : rot -64:sc= -0.638 USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ -162:sc= -0.0885 (180deg=-0.707) USER MOD Single : A 27 MET CE :methyl 174:sc= 0 (180deg=-0.0156) USER MOD Single : A 30 MET CE :methyl -152:sc= -0.0534 (180deg=-2.26) USER MOD Single : A 40 ASN : amide:sc= -2.04 K(o=-2,f=-0.054) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 53 TYR OH : rot 180:sc= -0.162 USER MOD Single : A 56 ASN : amide:sc= -2.16! C(o=-2.2!,f=-5.1!) USER MOD Single : A 59 SER OG : rot 92:sc= 0.992 USER MOD Single : A 63 ASN : amide:sc= -4.66! C(o=-4.7!,f=-4.5!) USER MOD Single : A 65 ASN : amide:sc= -0.723 K(o=-0.72,f=-0.044) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= -0.0495 K(o=-0.05,f=-2.9!) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot 46:sc= 0.76 USER MOD Single : A 78 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 79 CYS SG : rot 180:sc= 0 USER MOD Single : B 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= -0.368 USER MOD Single : B 6 GLN : amide:sc= -0.487 K(o=-0.49,f=-4!) USER MOD Single : B 12 TYR OH : rot 180:sc= 0 USER MOD Single : B 13 CYS SG : rot 80:sc= -1.23 USER MOD Single : B 14 GLN : amide:sc= 0 X(o=0,f=-0.0012) USER MOD Single : B 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.36) USER MOD Single : B 27 MET CE :methyl -102:sc= -0.0089 (180deg=-2.53!) USER MOD Single : B 30 MET CE :methyl -166:sc= -0.201 (180deg=-1.1) USER MOD Single : B 31 TYR OH : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ 164:sc= -0.0183 (180deg=-0.282) USER MOD Single : B 40 ASN : amide:sc= -0.948 K(o=-0.95,f=-0.24) USER MOD Single : B 45 SER OG : rot 180:sc= 0 USER MOD Single : B 53 TYR OH : rot 14:sc= -2.6! USER MOD Single : B 56 ASN : amide:sc= -2.67! K(o=-2.7!,f=-1.5) USER MOD Single : B 59 SER OG : rot -86:sc= -1.66! USER MOD Single : B 63 ASN : amide:sc= -1.82! K(o=-1.8!,f=-0.01) USER MOD Single : B 65 ASN : amide:sc=-0.00639 X(o=-0.0064,f=-0.12) USER MOD Single : B 67 TYR OH : rot 180:sc= 0 USER MOD Single : B 76 THR OG1 : rot 180:sc= 0 USER MOD Single : B 78 GLN : amide:sc= 0 X(o=0,f=-0.0023) USER MOD Single : B 79 CYS SG : rot 180:sc= 0.0129 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 48.943 17.607 32.576 1.00 6.58 N ATOM 2 CA GLY A 1 47.553 17.061 32.904 1.00 5.97 C ATOM 3 C GLY A 1 46.356 17.618 32.213 1.00 5.09 C ATOM 4 O GLY A 1 45.262 17.104 32.334 1.00 5.27 O ATOM 0 H1 GLY A 1 49.655 17.108 33.146 1.00 6.58 H new ATOM 0 H2 GLY A 1 49.144 17.461 31.566 1.00 6.58 H new ATOM 0 H3 GLY A 1 48.977 18.624 32.793 1.00 6.58 H new ATOM 0 HA2 GLY A 1 47.571 15.989 32.710 1.00 5.97 H new ATOM 0 HA3 GLY A 1 47.398 17.188 33.975 1.00 5.97 H new ATOM 10 N SER A 2 46.528 18.678 31.469 1.00 4.50 N ATOM 11 CA SER A 2 45.371 19.282 30.749 1.00 3.95 C ATOM 12 C SER A 2 45.812 20.553 29.986 1.00 3.15 C ATOM 13 O SER A 2 45.532 20.666 28.809 1.00 3.20 O ATOM 14 CB SER A 2 44.230 19.595 31.741 1.00 4.48 C ATOM 15 OG SER A 2 43.112 18.770 31.437 1.00 5.04 O ATOM 0 H SER A 2 47.421 19.151 31.329 1.00 4.50 H new ATOM 0 HA SER A 2 44.998 18.565 30.017 1.00 3.95 H new ATOM 0 HB2 SER A 2 44.562 19.418 32.764 1.00 4.48 H new ATOM 0 HB3 SER A 2 43.951 20.647 31.674 1.00 4.48 H new ATOM 0 HG SER A 2 43.342 17.832 31.604 1.00 5.04 H new ATOM 21 N PRO A 3 46.479 21.481 30.652 1.00 2.92 N ATOM 22 CA PRO A 3 46.921 22.721 29.981 1.00 2.64 C ATOM 23 C PRO A 3 47.917 22.384 28.859 1.00 2.05 C ATOM 24 O PRO A 3 48.195 23.197 28.000 1.00 2.43 O ATOM 25 CB PRO A 3 47.583 23.569 31.095 1.00 3.31 C ATOM 26 CG PRO A 3 47.477 22.761 32.422 1.00 3.84 C ATOM 27 CD PRO A 3 46.842 21.391 32.086 1.00 3.57 C ATOM 0 HA PRO A 3 46.099 23.262 29.511 1.00 2.64 H new ATOM 0 HB2 PRO A 3 48.626 23.774 30.853 1.00 3.31 H new ATOM 0 HB3 PRO A 3 47.083 24.533 31.192 1.00 3.31 H new ATOM 0 HG2 PRO A 3 48.462 22.627 32.869 1.00 3.84 H new ATOM 0 HG3 PRO A 3 46.868 23.297 33.149 1.00 3.84 H new ATOM 0 HD2 PRO A 3 47.543 20.576 32.266 1.00 3.57 H new ATOM 0 HD3 PRO A 3 45.965 21.200 32.704 1.00 3.57 H new ATOM 35 N LEU A 4 48.452 21.193 28.861 1.00 1.82 N ATOM 36 CA LEU A 4 49.423 20.812 27.796 1.00 1.56 C ATOM 37 C LEU A 4 48.659 20.454 26.517 1.00 1.26 C ATOM 38 O LEU A 4 48.838 21.067 25.484 1.00 1.39 O ATOM 39 CB LEU A 4 50.242 19.598 28.256 1.00 2.02 C ATOM 40 CG LEU A 4 51.315 20.028 29.271 1.00 2.71 C ATOM 41 CD1 LEU A 4 52.398 20.893 28.592 1.00 3.37 C ATOM 42 CD2 LEU A 4 50.656 20.819 30.409 1.00 3.27 C ATOM 0 H LEU A 4 48.259 20.469 29.553 1.00 1.82 H new ATOM 0 HA LEU A 4 50.094 21.649 27.601 1.00 1.56 H new ATOM 0 HB2 LEU A 4 49.583 18.856 28.707 1.00 2.02 H new ATOM 0 HB3 LEU A 4 50.715 19.124 27.396 1.00 2.02 H new ATOM 0 HG LEU A 4 51.792 19.134 29.673 1.00 2.71 H new ATOM 0 HD11 LEU A 4 53.146 21.185 29.329 1.00 3.37 H new ATOM 0 HD12 LEU A 4 52.876 20.320 27.798 1.00 3.37 H new ATOM 0 HD13 LEU A 4 51.938 21.786 28.169 1.00 3.37 H new ATOM 0 HD21 LEU A 4 51.416 21.124 31.128 1.00 3.27 H new ATOM 0 HD22 LEU A 4 50.167 21.704 30.001 1.00 3.27 H new ATOM 0 HD23 LEU A 4 49.916 20.192 30.907 1.00 3.27 H new ATOM 54 N GLY A 5 47.809 19.465 26.579 1.00 1.15 N ATOM 55 CA GLY A 5 47.037 19.068 25.367 1.00 1.08 C ATOM 56 C GLY A 5 46.059 20.183 24.992 1.00 0.85 C ATOM 57 O GLY A 5 45.678 20.328 23.847 1.00 0.91 O ATOM 0 H GLY A 5 47.616 18.915 27.416 1.00 1.15 H new ATOM 0 HA2 GLY A 5 47.717 18.874 24.538 1.00 1.08 H new ATOM 0 HA3 GLY A 5 46.493 18.143 25.557 1.00 1.08 H new ATOM 61 N GLN A 6 45.648 20.971 25.947 1.00 0.75 N ATOM 62 CA GLN A 6 44.695 22.075 25.644 1.00 0.73 C ATOM 63 C GLN A 6 45.365 23.085 24.715 1.00 0.58 C ATOM 64 O GLN A 6 44.755 23.605 23.802 1.00 0.62 O ATOM 65 CB GLN A 6 44.287 22.771 26.945 1.00 0.91 C ATOM 66 CG GLN A 6 43.148 23.753 26.666 1.00 1.13 C ATOM 67 CD GLN A 6 42.616 24.311 27.988 1.00 1.99 C ATOM 68 OE1 GLN A 6 41.785 23.698 28.628 1.00 2.72 O ATOM 69 NE2 GLN A 6 43.064 25.455 28.427 1.00 2.62 N ATOM 0 H GLN A 6 45.931 20.898 26.924 1.00 0.75 H new ATOM 0 HA GLN A 6 43.809 21.666 25.159 1.00 0.73 H new ATOM 0 HB2 GLN A 6 43.971 22.032 27.681 1.00 0.91 H new ATOM 0 HB3 GLN A 6 45.140 23.299 27.370 1.00 0.91 H new ATOM 0 HG2 GLN A 6 43.502 24.566 26.033 1.00 1.13 H new ATOM 0 HG3 GLN A 6 42.347 23.252 26.123 1.00 1.13 H new ATOM 0 HE21 GLN A 6 43.762 25.970 27.890 1.00 2.62 H new ATOM 0 HE22 GLN A 6 42.717 25.835 29.308 1.00 2.62 H new ATOM 78 N ASP A 7 46.616 23.366 24.938 1.00 0.55 N ATOM 79 CA ASP A 7 47.327 24.341 24.071 1.00 0.53 C ATOM 80 C ASP A 7 47.215 23.901 22.610 1.00 0.43 C ATOM 81 O ASP A 7 46.759 24.641 21.761 1.00 0.48 O ATOM 82 CB ASP A 7 48.798 24.393 24.481 1.00 0.67 C ATOM 83 CG ASP A 7 48.941 25.190 25.780 1.00 1.37 C ATOM 84 OD1 ASP A 7 48.371 26.266 25.857 1.00 2.11 O ATOM 85 OD2 ASP A 7 49.617 24.710 26.675 1.00 1.94 O ATOM 0 H ASP A 7 47.178 22.961 25.686 1.00 0.55 H new ATOM 0 HA ASP A 7 46.881 25.329 24.183 1.00 0.53 H new ATOM 0 HB2 ASP A 7 49.184 23.383 24.618 1.00 0.67 H new ATOM 0 HB3 ASP A 7 49.390 24.856 23.691 1.00 0.67 H new ATOM 90 N VAL A 8 47.622 22.699 22.311 1.00 0.38 N ATOM 91 CA VAL A 8 47.532 22.212 20.905 1.00 0.43 C ATOM 92 C VAL A 8 46.084 22.331 20.431 1.00 0.40 C ATOM 93 O VAL A 8 45.813 22.736 19.318 1.00 0.55 O ATOM 94 CB VAL A 8 47.974 20.748 20.840 1.00 0.52 C ATOM 95 CG1 VAL A 8 48.177 20.341 19.379 1.00 1.02 C ATOM 96 CG2 VAL A 8 49.290 20.579 21.603 1.00 1.23 C ATOM 0 H VAL A 8 48.013 22.033 22.978 1.00 0.38 H new ATOM 0 HA VAL A 8 48.181 22.810 20.265 1.00 0.43 H new ATOM 0 HB VAL A 8 47.208 20.117 21.290 1.00 0.52 H new ATOM 0 HG11 VAL A 8 48.492 19.299 19.332 1.00 1.02 H new ATOM 0 HG12 VAL A 8 47.241 20.462 18.834 1.00 1.02 H new ATOM 0 HG13 VAL A 8 48.943 20.972 18.929 1.00 1.02 H new ATOM 0 HG21 VAL A 8 49.606 19.537 21.557 1.00 1.23 H new ATOM 0 HG22 VAL A 8 50.056 21.210 21.152 1.00 1.23 H new ATOM 0 HG23 VAL A 8 49.147 20.870 22.644 1.00 1.23 H new ATOM 106 N PHE A 9 45.151 21.987 21.273 1.00 0.27 N ATOM 107 CA PHE A 9 43.717 22.086 20.885 1.00 0.25 C ATOM 108 C PHE A 9 43.445 23.480 20.319 1.00 0.25 C ATOM 109 O PHE A 9 42.843 23.629 19.274 1.00 0.36 O ATOM 110 CB PHE A 9 42.851 21.850 22.127 1.00 0.23 C ATOM 111 CG PHE A 9 41.443 21.513 21.712 1.00 0.19 C ATOM 112 CD1 PHE A 9 40.509 22.535 21.520 1.00 0.20 C ATOM 113 CD2 PHE A 9 41.072 20.178 21.519 1.00 0.19 C ATOM 114 CE1 PHE A 9 39.203 22.223 21.136 1.00 0.21 C ATOM 115 CE2 PHE A 9 39.765 19.867 21.133 1.00 0.19 C ATOM 116 CZ PHE A 9 38.831 20.891 20.942 1.00 0.20 C ATOM 0 H PHE A 9 45.321 21.640 22.217 1.00 0.27 H new ATOM 0 HA PHE A 9 43.479 21.339 20.128 1.00 0.25 H new ATOM 0 HB2 PHE A 9 43.268 21.038 22.723 1.00 0.23 H new ATOM 0 HB3 PHE A 9 42.851 22.740 22.756 1.00 0.23 H new ATOM 0 HD1 PHE A 9 40.797 23.565 21.668 1.00 0.20 H new ATOM 0 HD2 PHE A 9 41.794 19.389 21.668 1.00 0.19 H new ATOM 0 HE1 PHE A 9 38.480 23.012 20.989 1.00 0.21 H new ATOM 0 HE2 PHE A 9 39.476 18.837 20.982 1.00 0.19 H new ATOM 0 HZ PHE A 9 37.821 20.651 20.644 1.00 0.20 H new ATOM 126 N LEU A 10 43.890 24.503 20.995 1.00 0.21 N ATOM 127 CA LEU A 10 43.663 25.883 20.485 1.00 0.21 C ATOM 128 C LEU A 10 44.359 26.033 19.132 1.00 0.22 C ATOM 129 O LEU A 10 43.915 26.766 18.270 1.00 0.27 O ATOM 130 CB LEU A 10 44.242 26.900 21.470 1.00 0.24 C ATOM 131 CG LEU A 10 43.649 26.672 22.865 1.00 0.27 C ATOM 132 CD1 LEU A 10 44.385 27.554 23.874 1.00 0.31 C ATOM 133 CD2 LEU A 10 42.153 27.026 22.869 1.00 0.28 C ATOM 0 H LEU A 10 44.400 24.443 21.876 1.00 0.21 H new ATOM 0 HA LEU A 10 42.593 26.061 20.375 1.00 0.21 H new ATOM 0 HB2 LEU A 10 45.327 26.806 21.507 1.00 0.24 H new ATOM 0 HB3 LEU A 10 44.021 27.913 21.133 1.00 0.24 H new ATOM 0 HG LEU A 10 43.764 25.623 23.137 1.00 0.27 H new ATOM 0 HD11 LEU A 10 43.967 27.396 24.868 1.00 0.31 H new ATOM 0 HD12 LEU A 10 45.444 27.295 23.880 1.00 0.31 H new ATOM 0 HD13 LEU A 10 44.270 28.601 23.594 1.00 0.31 H new ATOM 0 HD21 LEU A 10 41.743 26.860 23.865 1.00 0.28 H new ATOM 0 HD22 LEU A 10 42.026 28.073 22.594 1.00 0.28 H new ATOM 0 HD23 LEU A 10 41.628 26.396 22.151 1.00 0.28 H new ATOM 145 N ASP A 11 45.448 25.338 18.937 1.00 0.21 N ATOM 146 CA ASP A 11 46.172 25.436 17.639 1.00 0.23 C ATOM 147 C ASP A 11 45.237 24.998 16.510 1.00 0.20 C ATOM 148 O ASP A 11 44.957 25.749 15.597 1.00 0.29 O ATOM 149 CB ASP A 11 47.409 24.530 17.669 1.00 0.27 C ATOM 150 CG ASP A 11 48.380 24.946 16.561 1.00 1.08 C ATOM 151 OD1 ASP A 11 47.975 24.934 15.410 1.00 1.64 O ATOM 152 OD2 ASP A 11 49.511 25.270 16.882 1.00 1.92 O ATOM 0 H ASP A 11 45.866 24.707 19.621 1.00 0.21 H new ATOM 0 HA ASP A 11 46.489 26.465 17.472 1.00 0.23 H new ATOM 0 HB2 ASP A 11 47.899 24.599 18.640 1.00 0.27 H new ATOM 0 HB3 ASP A 11 47.113 23.490 17.535 1.00 0.27 H new ATOM 157 N TYR A 12 44.744 23.790 16.566 1.00 0.14 N ATOM 158 CA TYR A 12 43.823 23.316 15.497 1.00 0.12 C ATOM 159 C TYR A 12 42.712 24.345 15.307 1.00 0.11 C ATOM 160 O TYR A 12 42.427 24.781 14.209 1.00 0.15 O ATOM 161 CB TYR A 12 43.209 21.968 15.902 1.00 0.12 C ATOM 162 CG TYR A 12 44.288 20.901 15.943 1.00 0.16 C ATOM 163 CD1 TYR A 12 44.992 20.568 14.778 1.00 0.22 C ATOM 164 CD2 TYR A 12 44.582 20.243 17.145 1.00 0.20 C ATOM 165 CE1 TYR A 12 45.985 19.582 14.815 1.00 0.28 C ATOM 166 CE2 TYR A 12 45.576 19.257 17.181 1.00 0.27 C ATOM 167 CZ TYR A 12 46.277 18.927 16.016 1.00 0.30 C ATOM 168 OH TYR A 12 47.257 17.956 16.052 1.00 0.37 O ATOM 0 H TYR A 12 44.939 23.114 17.304 1.00 0.14 H new ATOM 0 HA TYR A 12 44.376 23.191 14.566 1.00 0.12 H new ATOM 0 HB2 TYR A 12 42.733 22.054 16.879 1.00 0.12 H new ATOM 0 HB3 TYR A 12 42.432 21.685 15.192 1.00 0.12 H new ATOM 0 HD1 TYR A 12 44.768 21.073 13.850 1.00 0.22 H new ATOM 0 HD2 TYR A 12 44.041 20.497 18.045 1.00 0.20 H new ATOM 0 HE1 TYR A 12 46.526 19.327 13.916 1.00 0.28 H new ATOM 0 HE2 TYR A 12 45.801 18.751 18.108 1.00 0.27 H new ATOM 0 HH TYR A 12 47.334 17.603 16.963 1.00 0.37 H new ATOM 178 N CYS A 13 42.089 24.740 16.378 1.00 0.12 N ATOM 179 CA CYS A 13 41.000 25.746 16.291 1.00 0.15 C ATOM 180 C CYS A 13 41.474 26.936 15.458 1.00 0.16 C ATOM 181 O CYS A 13 40.787 27.399 14.570 1.00 0.19 O ATOM 182 CB CYS A 13 40.642 26.217 17.700 1.00 0.19 C ATOM 183 SG CYS A 13 39.806 24.880 18.589 1.00 1.38 S ATOM 0 H CYS A 13 42.290 24.405 17.320 1.00 0.12 H new ATOM 0 HA CYS A 13 40.123 25.302 15.819 1.00 0.15 H new ATOM 0 HB2 CYS A 13 41.543 26.516 18.235 1.00 0.19 H new ATOM 0 HB3 CYS A 13 39.996 27.094 17.649 1.00 0.19 H new ATOM 0 HG CYS A 13 38.673 24.615 18.009 1.00 1.38 H new ATOM 189 N GLN A 14 42.646 27.432 15.737 1.00 0.17 N ATOM 190 CA GLN A 14 43.169 28.589 14.963 1.00 0.21 C ATOM 191 C GLN A 14 43.009 28.315 13.465 1.00 0.21 C ATOM 192 O GLN A 14 42.396 29.080 12.750 1.00 0.28 O ATOM 193 CB GLN A 14 44.649 28.795 15.292 1.00 0.25 C ATOM 194 CG GLN A 14 45.132 30.107 14.674 1.00 0.64 C ATOM 195 CD GLN A 14 46.526 30.443 15.210 1.00 0.78 C ATOM 196 OE1 GLN A 14 46.661 31.189 16.159 1.00 1.68 O ATOM 197 NE2 GLN A 14 47.575 29.921 14.637 1.00 1.31 N ATOM 0 H GLN A 14 43.265 27.085 16.469 1.00 0.17 H new ATOM 0 HA GLN A 14 42.611 29.487 15.228 1.00 0.21 H new ATOM 0 HB2 GLN A 14 44.793 28.815 16.372 1.00 0.25 H new ATOM 0 HB3 GLN A 14 45.237 27.962 14.908 1.00 0.25 H new ATOM 0 HG2 GLN A 14 45.160 30.021 13.588 1.00 0.64 H new ATOM 0 HG3 GLN A 14 44.436 30.911 14.912 1.00 0.64 H new ATOM 0 HE21 GLN A 14 47.462 29.294 13.840 1.00 1.31 H new ATOM 0 HE22 GLN A 14 48.508 30.139 14.986 1.00 1.31 H new ATOM 206 N LYS A 15 43.550 27.227 12.984 1.00 0.20 N ATOM 207 CA LYS A 15 43.420 26.913 11.532 1.00 0.22 C ATOM 208 C LYS A 15 41.943 26.960 11.134 1.00 0.19 C ATOM 209 O LYS A 15 41.548 27.709 10.263 1.00 0.22 O ATOM 210 CB LYS A 15 43.981 25.517 11.259 1.00 0.25 C ATOM 211 CG LYS A 15 45.476 25.499 11.587 1.00 0.57 C ATOM 212 CD LYS A 15 45.976 24.052 11.640 1.00 1.16 C ATOM 213 CE LYS A 15 45.895 23.424 10.246 1.00 1.52 C ATOM 214 NZ LYS A 15 46.725 22.187 10.212 1.00 2.24 N ATOM 0 H LYS A 15 44.074 26.545 13.532 1.00 0.20 H new ATOM 0 HA LYS A 15 43.977 27.646 10.948 1.00 0.22 H new ATOM 0 HB2 LYS A 15 43.456 24.777 11.863 1.00 0.25 H new ATOM 0 HB3 LYS A 15 43.823 25.247 10.215 1.00 0.25 H new ATOM 0 HG2 LYS A 15 46.030 26.058 10.833 1.00 0.57 H new ATOM 0 HG3 LYS A 15 45.654 25.991 12.543 1.00 0.57 H new ATOM 0 HD2 LYS A 15 47.004 24.026 12.002 1.00 1.16 H new ATOM 0 HD3 LYS A 15 45.376 23.476 12.344 1.00 1.16 H new ATOM 0 HE2 LYS A 15 44.860 23.187 10.001 1.00 1.52 H new ATOM 0 HE3 LYS A 15 46.246 24.132 9.495 1.00 1.52 H new ATOM 0 HZ1 LYS A 15 46.671 21.759 9.266 1.00 2.24 H new ATOM 0 HZ2 LYS A 15 47.714 22.426 10.428 1.00 2.24 H new ATOM 0 HZ3 LYS A 15 46.370 21.511 10.918 1.00 2.24 H new ATOM 228 N LEU A 16 41.126 26.166 11.770 1.00 0.15 N ATOM 229 CA LEU A 16 39.671 26.158 11.443 1.00 0.13 C ATOM 230 C LEU A 16 39.162 27.601 11.344 1.00 0.13 C ATOM 231 O LEU A 16 38.189 27.887 10.675 1.00 0.17 O ATOM 232 CB LEU A 16 38.925 25.414 12.573 1.00 0.11 C ATOM 233 CG LEU A 16 37.817 24.525 11.995 1.00 0.14 C ATOM 234 CD1 LEU A 16 38.434 23.338 11.215 1.00 0.26 C ATOM 235 CD2 LEU A 16 36.943 24.021 13.153 1.00 0.17 C ATOM 0 H LEU A 16 41.405 25.518 12.507 1.00 0.15 H new ATOM 0 HA LEU A 16 39.498 25.658 10.490 1.00 0.13 H new ATOM 0 HB2 LEU A 16 39.628 24.805 13.141 1.00 0.11 H new ATOM 0 HB3 LEU A 16 38.495 26.135 13.268 1.00 0.11 H new ATOM 0 HG LEU A 16 37.204 25.097 11.298 1.00 0.14 H new ATOM 0 HD11 LEU A 16 37.637 22.715 10.810 1.00 0.26 H new ATOM 0 HD12 LEU A 16 39.047 23.719 10.398 1.00 0.26 H new ATOM 0 HD13 LEU A 16 39.053 22.744 11.887 1.00 0.26 H new ATOM 0 HD21 LEU A 16 36.149 23.386 12.760 1.00 0.17 H new ATOM 0 HD22 LEU A 16 37.556 23.447 13.848 1.00 0.17 H new ATOM 0 HD23 LEU A 16 36.503 24.872 13.674 1.00 0.17 H new ATOM 247 N LEU A 17 39.808 28.502 12.024 1.00 0.12 N ATOM 248 CA LEU A 17 39.368 29.922 12.000 1.00 0.13 C ATOM 249 C LEU A 17 39.894 30.620 10.741 1.00 0.15 C ATOM 250 O LEU A 17 39.135 31.133 9.943 1.00 0.22 O ATOM 251 CB LEU A 17 39.913 30.620 13.255 1.00 0.12 C ATOM 252 CG LEU A 17 39.084 31.883 13.571 1.00 0.12 C ATOM 253 CD1 LEU A 17 37.836 31.504 14.384 1.00 0.12 C ATOM 254 CD2 LEU A 17 39.922 32.870 14.396 1.00 0.13 C ATOM 0 H LEU A 17 40.629 28.315 12.600 1.00 0.12 H new ATOM 0 HA LEU A 17 38.279 29.972 11.987 1.00 0.13 H new ATOM 0 HB2 LEU A 17 39.882 29.935 14.102 1.00 0.12 H new ATOM 0 HB3 LEU A 17 40.958 30.891 13.103 1.00 0.12 H new ATOM 0 HG LEU A 17 38.788 32.344 12.629 1.00 0.12 H new ATOM 0 HD11 LEU A 17 37.257 32.402 14.602 1.00 0.12 H new ATOM 0 HD12 LEU A 17 37.224 30.809 13.809 1.00 0.12 H new ATOM 0 HD13 LEU A 17 38.140 31.032 15.318 1.00 0.12 H new ATOM 0 HD21 LEU A 17 39.328 33.758 14.614 1.00 0.13 H new ATOM 0 HD22 LEU A 17 40.225 32.398 15.330 1.00 0.13 H new ATOM 0 HD23 LEU A 17 40.809 33.156 13.830 1.00 0.13 H new ATOM 266 N GLU A 18 41.184 30.653 10.562 1.00 0.20 N ATOM 267 CA GLU A 18 41.751 31.330 9.358 1.00 0.25 C ATOM 268 C GLU A 18 41.214 30.651 8.096 1.00 0.21 C ATOM 269 O GLU A 18 40.799 31.300 7.156 1.00 0.25 O ATOM 270 CB GLU A 18 43.298 31.254 9.381 1.00 0.32 C ATOM 271 CG GLU A 18 43.794 31.022 10.815 1.00 1.41 C ATOM 272 CD GLU A 18 45.252 31.474 10.942 1.00 2.13 C ATOM 273 OE1 GLU A 18 46.114 30.773 10.439 1.00 2.77 O ATOM 274 OE2 GLU A 18 45.480 32.512 11.540 1.00 2.62 O ATOM 0 H GLU A 18 41.871 30.242 11.194 1.00 0.20 H new ATOM 0 HA GLU A 18 41.454 32.379 9.362 1.00 0.25 H new ATOM 0 HB2 GLU A 18 43.640 30.446 8.735 1.00 0.32 H new ATOM 0 HB3 GLU A 18 43.721 32.178 8.987 1.00 0.32 H new ATOM 0 HG2 GLU A 18 43.171 31.574 11.518 1.00 1.41 H new ATOM 0 HG3 GLU A 18 43.708 29.966 11.073 1.00 1.41 H new ATOM 281 N LYS A 19 41.231 29.349 8.066 1.00 0.20 N ATOM 282 CA LYS A 19 40.734 28.629 6.859 1.00 0.20 C ATOM 283 C LYS A 19 39.346 29.151 6.484 1.00 0.18 C ATOM 284 O LYS A 19 39.108 29.546 5.360 1.00 0.24 O ATOM 285 CB LYS A 19 40.675 27.125 7.148 1.00 0.22 C ATOM 286 CG LYS A 19 40.661 26.344 5.831 1.00 0.30 C ATOM 287 CD LYS A 19 40.657 24.847 6.133 1.00 0.37 C ATOM 288 CE LYS A 19 40.893 24.059 4.843 1.00 0.92 C ATOM 289 NZ LYS A 19 40.075 24.646 3.744 1.00 1.77 N ATOM 0 H LYS A 19 41.566 28.752 8.822 1.00 0.20 H new ATOM 0 HA LYS A 19 41.413 28.803 6.024 1.00 0.20 H new ATOM 0 HB2 LYS A 19 41.534 26.827 7.749 1.00 0.22 H new ATOM 0 HB3 LYS A 19 39.783 26.892 7.729 1.00 0.22 H new ATOM 0 HG2 LYS A 19 39.781 26.611 5.246 1.00 0.30 H new ATOM 0 HG3 LYS A 19 41.534 26.604 5.231 1.00 0.30 H new ATOM 0 HD2 LYS A 19 41.433 24.611 6.861 1.00 0.37 H new ATOM 0 HD3 LYS A 19 39.704 24.559 6.577 1.00 0.37 H new ATOM 0 HE2 LYS A 19 41.950 24.084 4.577 1.00 0.92 H new ATOM 0 HE3 LYS A 19 40.626 23.012 4.990 1.00 0.92 H new ATOM 0 HZ1 LYS A 19 39.990 23.958 2.969 1.00 1.77 H new ATOM 0 HZ2 LYS A 19 39.128 24.882 4.104 1.00 1.77 H new ATOM 0 HZ3 LYS A 19 40.536 25.509 3.391 1.00 1.77 H new ATOM 303 N PHE A 20 38.432 29.180 7.415 1.00 0.16 N ATOM 304 CA PHE A 20 37.076 29.702 7.105 1.00 0.16 C ATOM 305 C PHE A 20 37.119 31.225 7.224 1.00 0.19 C ATOM 306 O PHE A 20 36.127 31.907 7.059 1.00 0.30 O ATOM 307 CB PHE A 20 36.073 29.124 8.101 1.00 0.14 C ATOM 308 CG PHE A 20 35.779 27.683 7.747 1.00 0.13 C ATOM 309 CD1 PHE A 20 36.710 26.692 8.077 1.00 0.13 C ATOM 310 CD2 PHE A 20 34.586 27.332 7.089 1.00 0.13 C ATOM 311 CE1 PHE A 20 36.458 25.355 7.756 1.00 0.12 C ATOM 312 CE2 PHE A 20 34.338 25.991 6.767 1.00 0.13 C ATOM 313 CZ PHE A 20 35.274 25.004 7.101 1.00 0.12 C ATOM 0 H PHE A 20 38.568 28.865 8.375 1.00 0.16 H new ATOM 0 HA PHE A 20 36.771 29.416 6.098 1.00 0.16 H new ATOM 0 HB2 PHE A 20 36.473 29.186 9.113 1.00 0.14 H new ATOM 0 HB3 PHE A 20 35.153 29.708 8.086 1.00 0.14 H new ATOM 0 HD1 PHE A 20 37.626 26.961 8.581 1.00 0.13 H new ATOM 0 HD2 PHE A 20 33.864 28.093 6.833 1.00 0.13 H new ATOM 0 HE1 PHE A 20 37.178 24.593 8.014 1.00 0.12 H new ATOM 0 HE2 PHE A 20 33.424 25.718 6.261 1.00 0.13 H new ATOM 0 HZ PHE A 20 35.081 23.971 6.852 1.00 0.12 H new ATOM 323 N ARG A 21 38.283 31.755 7.493 1.00 0.18 N ATOM 324 CA ARG A 21 38.439 33.236 7.610 1.00 0.21 C ATOM 325 C ARG A 21 37.447 33.822 8.626 1.00 0.18 C ATOM 326 O ARG A 21 36.890 34.879 8.407 1.00 0.19 O ATOM 327 CB ARG A 21 38.197 33.871 6.239 1.00 0.29 C ATOM 328 CG ARG A 21 38.870 33.021 5.159 1.00 0.65 C ATOM 329 CD ARG A 21 38.760 33.728 3.807 1.00 1.12 C ATOM 330 NE ARG A 21 39.677 34.901 3.783 1.00 1.93 N ATOM 331 CZ ARG A 21 39.979 35.467 2.647 1.00 2.67 C ATOM 332 NH1 ARG A 21 39.480 35.003 1.535 1.00 2.95 N ATOM 333 NH2 ARG A 21 40.781 36.496 2.623 1.00 3.64 N ATOM 0 H ARG A 21 39.140 31.221 7.638 1.00 0.18 H new ATOM 0 HA ARG A 21 39.449 33.453 7.958 1.00 0.21 H new ATOM 0 HB2 ARG A 21 37.127 33.946 6.044 1.00 0.29 H new ATOM 0 HB3 ARG A 21 38.596 34.885 6.220 1.00 0.29 H new ATOM 0 HG2 ARG A 21 39.918 32.858 5.411 1.00 0.65 H new ATOM 0 HG3 ARG A 21 38.398 32.040 5.107 1.00 0.65 H new ATOM 0 HD2 ARG A 21 39.014 33.038 3.002 1.00 1.12 H new ATOM 0 HD3 ARG A 21 37.733 34.052 3.637 1.00 1.12 H new ATOM 0 HE ARG A 21 40.068 35.261 4.653 1.00 1.93 H new ATOM 0 HH11 ARG A 21 38.854 34.198 1.554 1.00 2.95 H new ATOM 0 HH12 ARG A 21 39.716 35.445 0.647 1.00 2.95 H new ATOM 0 HH21 ARG A 21 41.172 36.858 3.493 1.00 3.64 H new ATOM 0 HH22 ARG A 21 41.017 36.938 1.735 1.00 3.64 H new ATOM 347 N TYR A 22 37.223 33.165 9.737 1.00 0.15 N ATOM 348 CA TYR A 22 36.268 33.722 10.747 1.00 0.13 C ATOM 349 C TYR A 22 37.026 34.710 11.674 1.00 0.14 C ATOM 350 O TYR A 22 38.208 34.536 11.893 1.00 0.15 O ATOM 351 CB TYR A 22 35.709 32.577 11.610 1.00 0.11 C ATOM 352 CG TYR A 22 34.543 31.878 10.924 1.00 0.11 C ATOM 353 CD1 TYR A 22 33.402 32.597 10.522 1.00 0.12 C ATOM 354 CD2 TYR A 22 34.600 30.494 10.702 1.00 0.11 C ATOM 355 CE1 TYR A 22 32.336 31.932 9.905 1.00 0.13 C ATOM 356 CE2 TYR A 22 33.533 29.835 10.084 1.00 0.12 C ATOM 357 CZ TYR A 22 32.403 30.554 9.686 1.00 0.13 C ATOM 358 OH TYR A 22 31.350 29.903 9.081 1.00 0.15 O ATOM 0 H TYR A 22 37.655 32.276 9.988 1.00 0.15 H new ATOM 0 HA TYR A 22 35.455 34.233 10.232 1.00 0.13 H new ATOM 0 HB2 TYR A 22 36.499 31.854 11.813 1.00 0.11 H new ATOM 0 HB3 TYR A 22 35.383 32.971 12.572 1.00 0.11 H new ATOM 0 HD1 TYR A 22 33.349 33.663 10.690 1.00 0.12 H new ATOM 0 HD2 TYR A 22 35.472 29.935 11.010 1.00 0.11 H new ATOM 0 HE1 TYR A 22 31.461 32.485 9.598 1.00 0.13 H new ATOM 0 HE2 TYR A 22 33.582 28.770 9.914 1.00 0.12 H new ATOM 0 HH TYR A 22 30.613 29.810 9.720 1.00 0.15 H new ATOM 368 N PRO A 23 36.333 35.701 12.222 1.00 0.14 N ATOM 369 CA PRO A 23 36.965 36.668 13.146 1.00 0.16 C ATOM 370 C PRO A 23 37.486 35.938 14.398 1.00 0.16 C ATOM 371 O PRO A 23 37.306 34.749 14.560 1.00 0.15 O ATOM 372 CB PRO A 23 35.844 37.668 13.513 1.00 0.17 C ATOM 373 CG PRO A 23 34.528 37.139 12.882 1.00 0.15 C ATOM 374 CD PRO A 23 34.898 35.950 11.968 1.00 0.14 C ATOM 0 HA PRO A 23 37.821 37.174 12.699 1.00 0.16 H new ATOM 0 HB2 PRO A 23 35.744 37.753 14.595 1.00 0.17 H new ATOM 0 HB3 PRO A 23 36.078 38.663 13.135 1.00 0.17 H new ATOM 0 HG2 PRO A 23 33.830 36.824 13.658 1.00 0.15 H new ATOM 0 HG3 PRO A 23 34.035 37.924 12.309 1.00 0.15 H new ATOM 0 HD2 PRO A 23 34.298 35.071 12.202 1.00 0.14 H new ATOM 0 HD3 PRO A 23 34.719 36.188 10.920 1.00 0.14 H new ATOM 382 N TRP A 24 38.138 36.657 15.270 1.00 0.18 N ATOM 383 CA TRP A 24 38.701 36.043 16.514 1.00 0.19 C ATOM 384 C TRP A 24 37.608 35.826 17.573 1.00 0.19 C ATOM 385 O TRP A 24 37.820 35.141 18.553 1.00 0.21 O ATOM 386 CB TRP A 24 39.775 36.982 17.074 1.00 0.21 C ATOM 387 CG TRP A 24 40.272 36.472 18.389 1.00 0.28 C ATOM 388 CD1 TRP A 24 39.825 36.882 19.598 1.00 0.34 C ATOM 389 CD2 TRP A 24 41.304 35.476 18.651 1.00 0.33 C ATOM 390 NE1 TRP A 24 40.516 36.203 20.585 1.00 0.42 N ATOM 391 CE2 TRP A 24 41.438 35.325 20.052 1.00 0.42 C ATOM 392 CE3 TRP A 24 42.129 34.698 17.818 1.00 0.35 C ATOM 393 CZ2 TRP A 24 42.357 34.434 20.607 1.00 0.50 C ATOM 394 CZ3 TRP A 24 43.055 33.799 18.374 1.00 0.45 C ATOM 395 CH2 TRP A 24 43.169 33.669 19.766 1.00 0.52 C ATOM 0 H TRP A 24 38.309 37.658 15.175 1.00 0.18 H new ATOM 0 HA TRP A 24 39.127 35.070 16.268 1.00 0.19 H new ATOM 0 HB2 TRP A 24 40.603 37.060 16.370 1.00 0.21 H new ATOM 0 HB3 TRP A 24 39.364 37.984 17.196 1.00 0.21 H new ATOM 0 HD1 TRP A 24 39.054 37.620 19.765 1.00 0.34 H new ATOM 0 HE1 TRP A 24 40.363 36.335 21.585 1.00 0.42 H new ATOM 0 HE3 TRP A 24 42.050 34.792 16.745 1.00 0.35 H new ATOM 0 HZ2 TRP A 24 42.440 34.336 21.679 1.00 0.50 H new ATOM 0 HZ3 TRP A 24 43.682 33.205 17.726 1.00 0.45 H new ATOM 0 HH2 TRP A 24 43.884 32.978 20.187 1.00 0.52 H new ATOM 406 N GLU A 25 36.458 36.417 17.407 1.00 0.18 N ATOM 407 CA GLU A 25 35.383 36.252 18.435 1.00 0.21 C ATOM 408 C GLU A 25 34.666 34.902 18.277 1.00 0.17 C ATOM 409 O GLU A 25 33.924 34.491 19.147 1.00 0.20 O ATOM 410 CB GLU A 25 34.362 37.397 18.294 1.00 0.29 C ATOM 411 CG GLU A 25 35.061 38.656 17.778 1.00 1.15 C ATOM 412 CD GLU A 25 36.310 38.942 18.617 1.00 1.55 C ATOM 413 OE1 GLU A 25 36.218 38.851 19.830 1.00 2.18 O ATOM 414 OE2 GLU A 25 37.336 39.247 18.032 1.00 1.97 O ATOM 0 H GLU A 25 36.213 37.005 16.610 1.00 0.18 H new ATOM 0 HA GLU A 25 35.844 36.280 19.423 1.00 0.21 H new ATOM 0 HB2 GLU A 25 33.567 37.105 17.608 1.00 0.29 H new ATOM 0 HB3 GLU A 25 33.894 37.599 19.257 1.00 0.29 H new ATOM 0 HG2 GLU A 25 35.338 38.526 16.732 1.00 1.15 H new ATOM 0 HG3 GLU A 25 34.379 39.505 17.824 1.00 1.15 H new ATOM 421 N LEU A 26 34.853 34.218 17.176 1.00 0.13 N ATOM 422 CA LEU A 26 34.147 32.909 16.977 1.00 0.11 C ATOM 423 C LEU A 26 35.050 31.739 17.361 1.00 0.10 C ATOM 424 O LEU A 26 34.917 30.651 16.837 1.00 0.11 O ATOM 425 CB LEU A 26 33.744 32.763 15.511 1.00 0.10 C ATOM 426 CG LEU A 26 33.103 34.058 15.009 1.00 0.10 C ATOM 427 CD1 LEU A 26 32.465 33.800 13.646 1.00 0.11 C ATOM 428 CD2 LEU A 26 32.023 34.529 15.994 1.00 0.12 C ATOM 0 H LEU A 26 35.460 34.505 16.408 1.00 0.13 H new ATOM 0 HA LEU A 26 33.263 32.897 17.615 1.00 0.11 H new ATOM 0 HB2 LEU A 26 34.620 32.524 14.907 1.00 0.10 H new ATOM 0 HB3 LEU A 26 33.044 31.935 15.399 1.00 0.10 H new ATOM 0 HG LEU A 26 33.868 34.830 14.925 1.00 0.10 H new ATOM 0 HD11 LEU A 26 32.005 34.718 13.280 1.00 0.11 H new ATOM 0 HD12 LEU A 26 33.230 33.472 12.942 1.00 0.11 H new ATOM 0 HD13 LEU A 26 31.704 33.026 13.741 1.00 0.11 H new ATOM 0 HD21 LEU A 26 31.573 35.452 15.627 1.00 0.12 H new ATOM 0 HD22 LEU A 26 31.254 33.762 16.085 1.00 0.12 H new ATOM 0 HD23 LEU A 26 32.474 34.709 16.970 1.00 0.12 H new ATOM 440 N MET A 27 35.962 31.934 18.270 1.00 0.12 N ATOM 441 CA MET A 27 36.842 30.807 18.664 1.00 0.13 C ATOM 442 C MET A 27 36.057 29.758 19.497 1.00 0.11 C ATOM 443 O MET A 27 36.300 28.578 19.336 1.00 0.13 O ATOM 444 CB MET A 27 38.055 31.337 19.459 1.00 0.18 C ATOM 445 CG MET A 27 39.180 31.749 18.501 1.00 0.19 C ATOM 446 SD MET A 27 40.645 32.195 19.460 1.00 1.17 S ATOM 447 CE MET A 27 41.325 30.527 19.639 1.00 0.31 C ATOM 0 H MET A 27 36.134 32.817 18.752 1.00 0.12 H new ATOM 0 HA MET A 27 37.202 30.315 17.760 1.00 0.13 H new ATOM 0 HB2 MET A 27 37.755 32.190 20.067 1.00 0.18 H new ATOM 0 HB3 MET A 27 38.414 30.568 20.143 1.00 0.18 H new ATOM 0 HG2 MET A 27 39.412 30.930 17.820 1.00 0.19 H new ATOM 0 HG3 MET A 27 38.861 32.592 17.888 1.00 0.19 H new ATOM 0 HE1 MET A 27 42.303 30.582 20.118 1.00 0.31 H new ATOM 0 HE2 MET A 27 40.654 29.924 20.252 1.00 0.31 H new ATOM 0 HE3 MET A 27 41.428 30.069 18.655 1.00 0.31 H new ATOM 457 N PRO A 28 35.143 30.179 20.367 1.00 0.10 N ATOM 458 CA PRO A 28 34.372 29.218 21.189 1.00 0.09 C ATOM 459 C PRO A 28 33.608 28.222 20.304 1.00 0.10 C ATOM 460 O PRO A 28 33.287 27.132 20.727 1.00 0.19 O ATOM 461 CB PRO A 28 33.413 30.094 22.025 1.00 0.09 C ATOM 462 CG PRO A 28 33.907 31.555 21.878 1.00 0.11 C ATOM 463 CD PRO A 28 34.798 31.598 20.624 1.00 0.11 C ATOM 0 HA PRO A 28 35.015 28.608 21.823 1.00 0.09 H new ATOM 0 HB2 PRO A 28 32.388 29.994 21.669 1.00 0.09 H new ATOM 0 HB3 PRO A 28 33.419 29.786 23.071 1.00 0.09 H new ATOM 0 HG2 PRO A 28 33.065 32.240 21.778 1.00 0.11 H new ATOM 0 HG3 PRO A 28 34.466 31.865 22.761 1.00 0.11 H new ATOM 0 HD2 PRO A 28 34.271 32.038 19.777 1.00 0.11 H new ATOM 0 HD3 PRO A 28 35.691 32.200 20.792 1.00 0.11 H new ATOM 471 N LEU A 29 33.320 28.572 19.080 1.00 0.11 N ATOM 472 CA LEU A 29 32.594 27.615 18.194 1.00 0.09 C ATOM 473 C LEU A 29 33.622 26.694 17.547 1.00 0.10 C ATOM 474 O LEU A 29 33.483 25.487 17.561 1.00 0.19 O ATOM 475 CB LEU A 29 31.810 28.378 17.123 1.00 0.08 C ATOM 476 CG LEU A 29 30.903 29.420 17.792 1.00 0.08 C ATOM 477 CD1 LEU A 29 30.311 30.339 16.722 1.00 0.09 C ATOM 478 CD2 LEU A 29 29.761 28.716 18.541 1.00 0.08 C ATOM 0 H LEU A 29 33.553 29.470 18.657 1.00 0.11 H new ATOM 0 HA LEU A 29 31.883 27.028 18.775 1.00 0.09 H new ATOM 0 HB2 LEU A 29 32.498 28.869 16.435 1.00 0.08 H new ATOM 0 HB3 LEU A 29 31.210 27.684 16.534 1.00 0.08 H new ATOM 0 HG LEU A 29 31.491 30.005 18.499 1.00 0.08 H new ATOM 0 HD11 LEU A 29 29.666 31.080 17.195 1.00 0.09 H new ATOM 0 HD12 LEU A 29 31.117 30.845 16.191 1.00 0.09 H new ATOM 0 HD13 LEU A 29 29.727 29.747 16.017 1.00 0.09 H new ATOM 0 HD21 LEU A 29 29.121 29.462 19.013 1.00 0.08 H new ATOM 0 HD22 LEU A 29 29.173 28.127 17.837 1.00 0.08 H new ATOM 0 HD23 LEU A 29 30.177 28.059 19.305 1.00 0.08 H new ATOM 490 N MET A 30 34.675 27.245 17.015 1.00 0.10 N ATOM 491 CA MET A 30 35.724 26.384 16.414 1.00 0.12 C ATOM 492 C MET A 30 36.218 25.440 17.507 1.00 0.10 C ATOM 493 O MET A 30 36.823 24.418 17.248 1.00 0.11 O ATOM 494 CB MET A 30 36.883 27.255 15.924 1.00 0.16 C ATOM 495 CG MET A 30 36.510 27.905 14.592 1.00 0.19 C ATOM 496 SD MET A 30 34.974 28.848 14.792 1.00 1.16 S ATOM 497 CE MET A 30 34.133 28.283 13.290 1.00 0.20 C ATOM 0 H MET A 30 34.853 28.248 16.971 1.00 0.10 H new ATOM 0 HA MET A 30 35.328 25.823 15.567 1.00 0.12 H new ATOM 0 HB2 MET A 30 37.112 28.023 16.663 1.00 0.16 H new ATOM 0 HB3 MET A 30 37.781 26.649 15.805 1.00 0.16 H new ATOM 0 HG2 MET A 30 37.313 28.563 14.258 1.00 0.19 H new ATOM 0 HG3 MET A 30 36.384 27.141 13.825 1.00 0.19 H new ATOM 0 HE1 MET A 30 33.441 29.053 12.949 1.00 0.20 H new ATOM 0 HE2 MET A 30 34.871 28.088 12.512 1.00 0.20 H new ATOM 0 HE3 MET A 30 33.581 27.368 13.504 1.00 0.20 H new ATOM 507 N TYR A 31 35.950 25.790 18.735 1.00 0.09 N ATOM 508 CA TYR A 31 36.378 24.945 19.882 1.00 0.09 C ATOM 509 C TYR A 31 35.420 23.760 20.020 1.00 0.09 C ATOM 510 O TYR A 31 35.824 22.615 20.014 1.00 0.10 O ATOM 511 CB TYR A 31 36.340 25.795 21.159 1.00 0.09 C ATOM 512 CG TYR A 31 36.495 24.923 22.383 1.00 0.10 C ATOM 513 CD1 TYR A 31 37.769 24.645 22.888 1.00 0.11 C ATOM 514 CD2 TYR A 31 35.361 24.403 23.017 1.00 0.10 C ATOM 515 CE1 TYR A 31 37.910 23.842 24.026 1.00 0.12 C ATOM 516 CE2 TYR A 31 35.500 23.602 24.156 1.00 0.11 C ATOM 517 CZ TYR A 31 36.776 23.321 24.660 1.00 0.12 C ATOM 518 OH TYR A 31 36.914 22.533 25.785 1.00 0.14 O ATOM 0 H TYR A 31 35.445 26.638 18.994 1.00 0.09 H new ATOM 0 HA TYR A 31 37.389 24.571 19.719 1.00 0.09 H new ATOM 0 HB2 TYR A 31 37.137 26.538 21.132 1.00 0.09 H new ATOM 0 HB3 TYR A 31 35.398 26.340 21.211 1.00 0.09 H new ATOM 0 HD1 TYR A 31 38.644 25.050 22.400 1.00 0.11 H new ATOM 0 HD2 TYR A 31 34.378 24.620 22.627 1.00 0.10 H new ATOM 0 HE1 TYR A 31 38.894 23.624 24.415 1.00 0.12 H new ATOM 0 HE2 TYR A 31 34.625 23.201 24.646 1.00 0.11 H new ATOM 0 HH TYR A 31 36.029 22.255 26.100 1.00 0.14 H new ATOM 528 N VAL A 32 34.151 24.032 20.149 1.00 0.09 N ATOM 529 CA VAL A 32 33.162 22.930 20.294 1.00 0.09 C ATOM 530 C VAL A 32 33.223 22.016 19.070 1.00 0.09 C ATOM 531 O VAL A 32 33.385 20.818 19.191 1.00 0.12 O ATOM 532 CB VAL A 32 31.756 23.522 20.419 1.00 0.09 C ATOM 533 CG1 VAL A 32 30.724 22.390 20.426 1.00 0.09 C ATOM 534 CG2 VAL A 32 31.650 24.328 21.720 1.00 0.12 C ATOM 0 H VAL A 32 33.756 24.973 20.160 1.00 0.09 H new ATOM 0 HA VAL A 32 33.396 22.351 21.187 1.00 0.09 H new ATOM 0 HB VAL A 32 31.563 24.181 19.573 1.00 0.09 H new ATOM 0 HG11 VAL A 32 29.723 22.811 20.515 1.00 0.09 H new ATOM 0 HG12 VAL A 32 30.798 21.824 19.497 1.00 0.09 H new ATOM 0 HG13 VAL A 32 30.916 21.728 21.271 1.00 0.09 H new ATOM 0 HG21 VAL A 32 30.648 24.749 21.807 1.00 0.12 H new ATOM 0 HG22 VAL A 32 31.844 23.674 22.570 1.00 0.12 H new ATOM 0 HG23 VAL A 32 32.383 25.135 21.709 1.00 0.12 H new ATOM 544 N ILE A 33 33.090 22.569 17.892 1.00 0.09 N ATOM 545 CA ILE A 33 33.138 21.734 16.658 1.00 0.09 C ATOM 546 C ILE A 33 34.299 20.732 16.762 1.00 0.10 C ATOM 547 O ILE A 33 34.087 19.538 16.837 1.00 0.11 O ATOM 548 CB ILE A 33 33.304 22.667 15.454 1.00 0.09 C ATOM 549 CG1 ILE A 33 32.072 23.579 15.389 1.00 0.10 C ATOM 550 CG2 ILE A 33 33.413 21.860 14.158 1.00 0.10 C ATOM 551 CD1 ILE A 33 32.185 24.537 14.206 1.00 0.09 C ATOM 0 H ILE A 33 32.950 23.567 17.733 1.00 0.09 H new ATOM 0 HA ILE A 33 32.218 21.162 16.537 1.00 0.09 H new ATOM 0 HB ILE A 33 34.215 23.255 15.566 1.00 0.09 H new ATOM 0 HG12 ILE A 33 31.169 22.976 15.293 1.00 0.10 H new ATOM 0 HG13 ILE A 33 31.980 24.144 16.316 1.00 0.10 H new ATOM 0 HG21 ILE A 33 33.530 22.540 13.315 1.00 0.10 H new ATOM 0 HG22 ILE A 33 34.277 21.198 14.213 1.00 0.10 H new ATOM 0 HG23 ILE A 33 32.509 21.266 14.022 1.00 0.10 H new ATOM 0 HD11 ILE A 33 31.304 25.178 14.172 1.00 0.09 H new ATOM 0 HD12 ILE A 33 33.078 25.152 14.320 1.00 0.09 H new ATOM 0 HD13 ILE A 33 32.254 23.966 13.280 1.00 0.09 H new ATOM 563 N LEU A 34 35.517 21.200 16.797 1.00 0.10 N ATOM 564 CA LEU A 34 36.671 20.264 16.930 1.00 0.11 C ATOM 565 C LEU A 34 36.406 19.329 18.122 1.00 0.13 C ATOM 566 O LEU A 34 36.527 18.126 18.017 1.00 0.20 O ATOM 567 CB LEU A 34 37.953 21.109 17.180 1.00 0.09 C ATOM 568 CG LEU A 34 38.894 21.235 15.930 1.00 0.09 C ATOM 569 CD1 LEU A 34 38.152 21.077 14.590 1.00 0.10 C ATOM 570 CD2 LEU A 34 39.570 22.612 15.961 1.00 0.10 C ATOM 0 H LEU A 34 35.763 22.188 16.739 1.00 0.10 H new ATOM 0 HA LEU A 34 36.801 19.665 16.029 1.00 0.11 H new ATOM 0 HB2 LEU A 34 37.659 22.108 17.502 1.00 0.09 H new ATOM 0 HB3 LEU A 34 38.515 20.662 18.000 1.00 0.09 H new ATOM 0 HG LEU A 34 39.621 20.425 15.991 1.00 0.09 H new ATOM 0 HD11 LEU A 34 38.861 21.175 13.768 1.00 0.10 H new ATOM 0 HD12 LEU A 34 37.681 20.095 14.548 1.00 0.10 H new ATOM 0 HD13 LEU A 34 37.388 21.849 14.504 1.00 0.10 H new ATOM 0 HD21 LEU A 34 40.228 22.714 15.098 1.00 0.10 H new ATOM 0 HD22 LEU A 34 38.809 23.392 15.932 1.00 0.10 H new ATOM 0 HD23 LEU A 34 40.155 22.710 16.876 1.00 0.10 H new ATOM 582 N LYS A 35 36.050 19.874 19.249 1.00 0.12 N ATOM 583 CA LYS A 35 35.787 19.018 20.441 1.00 0.15 C ATOM 584 C LYS A 35 34.856 17.864 20.057 1.00 0.21 C ATOM 585 O LYS A 35 34.987 16.760 20.549 1.00 0.29 O ATOM 586 CB LYS A 35 35.133 19.868 21.537 1.00 0.13 C ATOM 587 CG LYS A 35 35.281 19.172 22.892 1.00 0.17 C ATOM 588 CD LYS A 35 34.534 19.974 23.960 1.00 0.26 C ATOM 589 CE LYS A 35 34.501 19.180 25.266 1.00 0.80 C ATOM 590 NZ LYS A 35 34.091 20.079 26.381 1.00 1.49 N ATOM 0 H LYS A 35 35.929 20.876 19.399 1.00 0.12 H new ATOM 0 HA LYS A 35 36.727 18.607 20.809 1.00 0.15 H new ATOM 0 HB2 LYS A 35 35.598 20.853 21.572 1.00 0.13 H new ATOM 0 HB3 LYS A 35 34.078 20.021 21.310 1.00 0.13 H new ATOM 0 HG2 LYS A 35 34.883 18.159 22.838 1.00 0.17 H new ATOM 0 HG3 LYS A 35 36.335 19.087 23.156 1.00 0.17 H new ATOM 0 HD2 LYS A 35 35.025 20.934 24.118 1.00 0.26 H new ATOM 0 HD3 LYS A 35 33.519 20.187 23.626 1.00 0.26 H new ATOM 0 HE2 LYS A 35 33.803 18.347 25.181 1.00 0.80 H new ATOM 0 HE3 LYS A 35 35.483 18.754 25.470 1.00 0.80 H new ATOM 0 HZ1 LYS A 35 34.487 19.725 27.275 1.00 1.49 H new ATOM 0 HZ2 LYS A 35 34.446 21.040 26.201 1.00 1.49 H new ATOM 0 HZ3 LYS A 35 33.053 20.100 26.446 1.00 1.49 H new ATOM 604 N ASP A 36 33.914 18.109 19.189 1.00 0.24 N ATOM 605 CA ASP A 36 32.970 17.029 18.781 1.00 0.32 C ATOM 606 C ASP A 36 33.559 16.229 17.617 1.00 0.26 C ATOM 607 O ASP A 36 33.442 15.021 17.558 1.00 0.36 O ATOM 608 CB ASP A 36 31.648 17.657 18.346 1.00 0.42 C ATOM 609 CG ASP A 36 30.985 18.334 19.546 1.00 0.84 C ATOM 610 OD1 ASP A 36 31.291 19.488 19.794 1.00 1.56 O ATOM 611 OD2 ASP A 36 30.184 17.686 20.199 1.00 1.42 O ATOM 0 H ASP A 36 33.756 19.013 18.743 1.00 0.24 H new ATOM 0 HA ASP A 36 32.804 16.359 19.625 1.00 0.32 H new ATOM 0 HB2 ASP A 36 31.823 18.386 17.555 1.00 0.42 H new ATOM 0 HB3 ASP A 36 30.988 16.893 17.936 1.00 0.42 H new ATOM 616 N ALA A 37 34.179 16.895 16.684 1.00 0.18 N ATOM 617 CA ALA A 37 34.763 16.184 15.514 1.00 0.17 C ATOM 618 C ALA A 37 36.078 15.513 15.927 1.00 0.16 C ATOM 619 O ALA A 37 37.017 15.432 15.160 1.00 0.21 O ATOM 620 CB ALA A 37 35.005 17.221 14.400 1.00 0.19 C ATOM 0 H ALA A 37 34.307 17.907 16.682 1.00 0.18 H new ATOM 0 HA ALA A 37 34.087 15.409 15.153 1.00 0.17 H new ATOM 0 HB1 ALA A 37 35.434 16.726 13.529 1.00 0.19 H new ATOM 0 HB2 ALA A 37 34.059 17.686 14.124 1.00 0.19 H new ATOM 0 HB3 ALA A 37 35.694 17.986 14.758 1.00 0.19 H new ATOM 626 N ASP A 38 36.163 15.034 17.132 1.00 0.18 N ATOM 627 CA ASP A 38 37.428 14.388 17.562 1.00 0.20 C ATOM 628 C ASP A 38 38.564 15.383 17.327 1.00 0.18 C ATOM 629 O ASP A 38 39.727 15.034 17.271 1.00 0.22 O ATOM 630 CB ASP A 38 37.653 13.114 16.730 1.00 0.25 C ATOM 631 CG ASP A 38 38.519 12.122 17.513 1.00 1.00 C ATOM 632 OD1 ASP A 38 38.136 11.775 18.618 1.00 1.82 O ATOM 633 OD2 ASP A 38 39.549 11.726 16.992 1.00 1.65 O ATOM 0 H ASP A 38 35.421 15.061 17.831 1.00 0.18 H new ATOM 0 HA ASP A 38 37.388 14.112 18.616 1.00 0.20 H new ATOM 0 HB2 ASP A 38 36.695 12.657 16.484 1.00 0.25 H new ATOM 0 HB3 ASP A 38 38.138 13.367 15.787 1.00 0.25 H new ATOM 638 N ALA A 39 38.207 16.626 17.176 1.00 0.14 N ATOM 639 CA ALA A 39 39.206 17.690 16.926 1.00 0.14 C ATOM 640 C ALA A 39 39.908 17.433 15.596 1.00 0.14 C ATOM 641 O ALA A 39 40.918 18.036 15.288 1.00 0.16 O ATOM 642 CB ALA A 39 40.226 17.733 18.057 1.00 0.16 C ATOM 0 H ALA A 39 37.242 16.953 17.217 1.00 0.14 H new ATOM 0 HA ALA A 39 38.696 18.652 16.882 1.00 0.14 H new ATOM 0 HB1 ALA A 39 40.954 18.520 17.860 1.00 0.16 H new ATOM 0 HB2 ALA A 39 39.717 17.937 18.999 1.00 0.16 H new ATOM 0 HB3 ALA A 39 40.738 16.773 18.122 1.00 0.16 H new ATOM 648 N ASN A 40 39.373 16.554 14.797 1.00 0.14 N ATOM 649 CA ASN A 40 39.999 16.272 13.478 1.00 0.16 C ATOM 650 C ASN A 40 39.557 17.357 12.500 1.00 0.14 C ATOM 651 O ASN A 40 38.471 17.306 11.957 1.00 0.15 O ATOM 652 CB ASN A 40 39.540 14.895 12.976 1.00 0.20 C ATOM 653 CG ASN A 40 40.531 14.363 11.937 1.00 0.78 C ATOM 654 OD1 ASN A 40 40.522 13.192 11.615 1.00 1.77 O ATOM 655 ND2 ASN A 40 41.392 15.181 11.396 1.00 1.19 N ATOM 0 H ASN A 40 38.529 16.019 15.001 1.00 0.14 H new ATOM 0 HA ASN A 40 41.086 16.268 13.565 1.00 0.16 H new ATOM 0 HB2 ASN A 40 39.467 14.199 13.812 1.00 0.20 H new ATOM 0 HB3 ASN A 40 38.545 14.971 12.537 1.00 0.20 H new ATOM 0 HD21 ASN A 40 42.057 14.837 10.703 1.00 1.19 H new ATOM 0 HD22 ASN A 40 41.400 16.165 11.666 1.00 1.19 H new ATOM 662 N ILE A 41 40.377 18.351 12.285 1.00 0.13 N ATOM 663 CA ILE A 41 39.987 19.448 11.356 1.00 0.12 C ATOM 664 C ILE A 41 39.391 18.852 10.076 1.00 0.13 C ATOM 665 O ILE A 41 38.395 19.328 9.569 1.00 0.14 O ATOM 666 CB ILE A 41 41.214 20.321 11.049 1.00 0.13 C ATOM 667 CG1 ILE A 41 41.482 21.212 12.279 1.00 0.13 C ATOM 668 CG2 ILE A 41 40.938 21.180 9.801 1.00 0.15 C ATOM 669 CD1 ILE A 41 42.691 22.121 12.048 1.00 0.16 C ATOM 0 H ILE A 41 41.298 18.450 12.712 1.00 0.13 H new ATOM 0 HA ILE A 41 39.228 20.078 11.821 1.00 0.12 H new ATOM 0 HB ILE A 41 42.089 19.703 10.846 1.00 0.13 H new ATOM 0 HG12 ILE A 41 40.602 21.819 12.491 1.00 0.13 H new ATOM 0 HG13 ILE A 41 41.656 20.586 13.154 1.00 0.13 H new ATOM 0 HG21 ILE A 41 41.809 21.798 9.585 1.00 0.15 H new ATOM 0 HG22 ILE A 41 40.734 20.530 8.950 1.00 0.15 H new ATOM 0 HG23 ILE A 41 40.075 21.820 9.984 1.00 0.15 H new ATOM 0 HD11 ILE A 41 42.856 22.738 12.931 1.00 0.16 H new ATOM 0 HD12 ILE A 41 43.575 21.511 11.861 1.00 0.16 H new ATOM 0 HD13 ILE A 41 42.504 22.763 11.187 1.00 0.16 H new ATOM 681 N GLU A 42 39.971 17.806 9.563 1.00 0.15 N ATOM 682 CA GLU A 42 39.405 17.185 8.337 1.00 0.16 C ATOM 683 C GLU A 42 37.929 16.884 8.591 1.00 0.16 C ATOM 684 O GLU A 42 37.065 17.297 7.847 1.00 0.19 O ATOM 685 CB GLU A 42 40.155 15.888 8.022 1.00 0.19 C ATOM 686 CG GLU A 42 41.534 16.225 7.448 1.00 0.26 C ATOM 687 CD GLU A 42 42.379 14.953 7.367 1.00 1.04 C ATOM 688 OE1 GLU A 42 42.304 14.278 6.353 1.00 1.67 O ATOM 689 OE2 GLU A 42 43.089 14.675 8.320 1.00 1.80 O ATOM 0 H GLU A 42 40.807 17.357 9.937 1.00 0.15 H new ATOM 0 HA GLU A 42 39.508 17.862 7.489 1.00 0.16 H new ATOM 0 HB2 GLU A 42 40.262 15.288 8.926 1.00 0.19 H new ATOM 0 HB3 GLU A 42 39.588 15.291 7.308 1.00 0.19 H new ATOM 0 HG2 GLU A 42 41.429 16.668 6.458 1.00 0.26 H new ATOM 0 HG3 GLU A 42 42.030 16.964 8.077 1.00 0.26 H new ATOM 696 N GLU A 43 37.632 16.185 9.653 1.00 0.15 N ATOM 697 CA GLU A 43 36.208 15.881 9.964 1.00 0.16 C ATOM 698 C GLU A 43 35.455 17.194 10.150 1.00 0.15 C ATOM 699 O GLU A 43 34.458 17.442 9.511 1.00 0.21 O ATOM 700 CB GLU A 43 36.107 15.069 11.262 1.00 0.18 C ATOM 701 CG GLU A 43 34.658 14.573 11.464 1.00 0.33 C ATOM 702 CD GLU A 43 34.458 13.236 10.742 1.00 1.21 C ATOM 703 OE1 GLU A 43 35.140 12.288 11.095 1.00 1.95 O ATOM 704 OE2 GLU A 43 33.628 13.185 9.850 1.00 1.84 O ATOM 0 H GLU A 43 38.312 15.813 10.316 1.00 0.15 H new ATOM 0 HA GLU A 43 35.780 15.303 9.145 1.00 0.16 H new ATOM 0 HB2 GLU A 43 36.789 14.219 11.223 1.00 0.18 H new ATOM 0 HB3 GLU A 43 36.411 15.683 12.109 1.00 0.18 H new ATOM 0 HG2 GLU A 43 34.449 14.457 12.527 1.00 0.33 H new ATOM 0 HG3 GLU A 43 33.955 15.312 11.080 1.00 0.33 H new ATOM 711 N ALA A 44 35.917 18.031 11.035 1.00 0.13 N ATOM 712 CA ALA A 44 35.207 19.317 11.270 1.00 0.14 C ATOM 713 C ALA A 44 35.113 20.123 9.977 1.00 0.16 C ATOM 714 O ALA A 44 34.037 20.466 9.529 1.00 0.20 O ATOM 715 CB ALA A 44 35.936 20.132 12.338 1.00 0.14 C ATOM 0 H ALA A 44 36.751 17.881 11.603 1.00 0.13 H new ATOM 0 HA ALA A 44 34.198 19.095 11.616 1.00 0.14 H new ATOM 0 HB1 ALA A 44 35.408 21.071 12.502 1.00 0.14 H new ATOM 0 HB2 ALA A 44 35.968 19.566 13.269 1.00 0.14 H new ATOM 0 HB3 ALA A 44 36.953 20.341 12.005 1.00 0.14 H new ATOM 721 N SER A 45 36.221 20.434 9.376 1.00 0.16 N ATOM 722 CA SER A 45 36.182 21.225 8.114 1.00 0.21 C ATOM 723 C SER A 45 35.138 20.638 7.158 1.00 0.20 C ATOM 724 O SER A 45 34.653 21.310 6.271 1.00 0.32 O ATOM 725 CB SER A 45 37.556 21.190 7.449 1.00 0.26 C ATOM 726 OG SER A 45 37.451 21.704 6.127 1.00 1.01 O ATOM 0 H SER A 45 37.153 20.177 9.701 1.00 0.16 H new ATOM 0 HA SER A 45 35.913 22.255 8.347 1.00 0.21 H new ATOM 0 HB2 SER A 45 38.267 21.781 8.026 1.00 0.26 H new ATOM 0 HB3 SER A 45 37.936 20.168 7.425 1.00 0.26 H new ATOM 0 HG SER A 45 38.332 21.684 5.698 1.00 1.01 H new ATOM 732 N ARG A 46 34.802 19.382 7.316 1.00 0.18 N ATOM 733 CA ARG A 46 33.806 18.755 6.394 1.00 0.20 C ATOM 734 C ARG A 46 32.365 19.010 6.869 1.00 0.16 C ATOM 735 O ARG A 46 31.455 19.044 6.065 1.00 0.22 O ATOM 736 CB ARG A 46 34.073 17.248 6.301 1.00 0.23 C ATOM 737 CG ARG A 46 35.359 17.010 5.493 1.00 0.85 C ATOM 738 CD ARG A 46 35.914 15.610 5.781 1.00 1.14 C ATOM 739 NE ARG A 46 34.992 14.585 5.216 1.00 1.59 N ATOM 740 CZ ARG A 46 35.394 13.352 5.072 1.00 2.17 C ATOM 741 NH1 ARG A 46 36.606 13.014 5.421 1.00 2.66 N ATOM 742 NH2 ARG A 46 34.584 12.456 4.578 1.00 2.87 N ATOM 0 H ARG A 46 35.172 18.766 8.040 1.00 0.18 H new ATOM 0 HA ARG A 46 33.916 19.208 5.409 1.00 0.20 H new ATOM 0 HB2 ARG A 46 34.173 16.822 7.299 1.00 0.23 H new ATOM 0 HB3 ARG A 46 33.231 16.746 5.823 1.00 0.23 H new ATOM 0 HG2 ARG A 46 35.153 17.115 4.428 1.00 0.85 H new ATOM 0 HG3 ARG A 46 36.103 17.764 5.750 1.00 0.85 H new ATOM 0 HD2 ARG A 46 36.906 15.503 5.343 1.00 1.14 H new ATOM 0 HD3 ARG A 46 36.023 15.464 6.856 1.00 1.14 H new ATOM 0 HE ARG A 46 34.045 14.847 4.941 1.00 1.59 H new ATOM 0 HH11 ARG A 46 37.240 13.714 5.807 1.00 2.66 H new ATOM 0 HH12 ARG A 46 36.919 12.050 5.308 1.00 2.66 H new ATOM 0 HH21 ARG A 46 33.637 12.720 4.305 1.00 2.87 H new ATOM 0 HH22 ARG A 46 34.898 11.492 4.465 1.00 2.87 H new ATOM 756 N ARG A 47 32.129 19.207 8.151 1.00 0.13 N ATOM 757 CA ARG A 47 30.713 19.473 8.598 1.00 0.13 C ATOM 758 C ARG A 47 30.430 20.969 8.429 1.00 0.11 C ATOM 759 O ARG A 47 29.374 21.358 7.973 1.00 0.13 O ATOM 760 CB ARG A 47 30.403 19.020 10.074 1.00 0.18 C ATOM 761 CG ARG A 47 31.671 18.641 10.892 1.00 0.49 C ATOM 762 CD ARG A 47 31.383 17.477 11.877 1.00 0.62 C ATOM 763 NE ARG A 47 30.907 17.987 13.207 1.00 0.81 N ATOM 764 CZ ARG A 47 31.670 18.705 13.978 1.00 1.20 C ATOM 765 NH1 ARG A 47 32.883 18.978 13.614 1.00 1.99 N ATOM 766 NH2 ARG A 47 31.237 19.103 15.139 1.00 1.63 N ATOM 0 H ARG A 47 32.832 19.196 8.890 1.00 0.13 H new ATOM 0 HA ARG A 47 30.056 18.869 7.972 1.00 0.13 H new ATOM 0 HB2 ARG A 47 29.877 19.824 10.588 1.00 0.18 H new ATOM 0 HB3 ARG A 47 29.729 18.164 10.048 1.00 0.18 H new ATOM 0 HG2 ARG A 47 32.472 18.354 10.211 1.00 0.49 H new ATOM 0 HG3 ARG A 47 32.021 19.511 11.447 1.00 0.49 H new ATOM 0 HD2 ARG A 47 30.630 16.815 11.449 1.00 0.62 H new ATOM 0 HD3 ARG A 47 32.287 16.884 12.016 1.00 0.62 H new ATOM 0 HE ARG A 47 29.960 17.764 13.514 1.00 0.81 H new ATOM 0 HH11 ARG A 47 33.239 18.630 12.724 1.00 1.99 H new ATOM 0 HH12 ARG A 47 33.482 19.541 14.218 1.00 1.99 H new ATOM 0 HH21 ARG A 47 30.297 18.852 15.446 1.00 1.63 H new ATOM 0 HH22 ARG A 47 31.837 19.666 15.742 1.00 1.63 H new ATOM 780 N ILE A 48 31.366 21.811 8.768 1.00 0.10 N ATOM 781 CA ILE A 48 31.133 23.271 8.590 1.00 0.10 C ATOM 782 C ILE A 48 30.747 23.511 7.135 1.00 0.11 C ATOM 783 O ILE A 48 29.682 24.012 6.837 1.00 0.13 O ATOM 784 CB ILE A 48 32.406 24.041 8.932 1.00 0.10 C ATOM 785 CG1 ILE A 48 32.893 23.596 10.313 1.00 0.09 C ATOM 786 CG2 ILE A 48 32.097 25.540 8.951 1.00 0.11 C ATOM 787 CD1 ILE A 48 34.049 24.486 10.777 1.00 0.10 C ATOM 0 H ILE A 48 32.274 21.555 9.157 1.00 0.10 H new ATOM 0 HA ILE A 48 30.337 23.615 9.250 1.00 0.10 H new ATOM 0 HB ILE A 48 33.178 23.843 8.189 1.00 0.10 H new ATOM 0 HG12 ILE A 48 32.074 23.648 11.030 1.00 0.09 H new ATOM 0 HG13 ILE A 48 33.217 22.556 10.275 1.00 0.09 H new ATOM 0 HG21 ILE A 48 33.003 26.095 9.195 1.00 0.11 H new ATOM 0 HG22 ILE A 48 31.735 25.849 7.971 1.00 0.11 H new ATOM 0 HG23 ILE A 48 31.333 25.745 9.701 1.00 0.11 H new ATOM 0 HD11 ILE A 48 34.387 24.160 11.761 1.00 0.10 H new ATOM 0 HD12 ILE A 48 34.873 24.412 10.067 1.00 0.10 H new ATOM 0 HD13 ILE A 48 33.711 25.521 10.834 1.00 0.10 H new ATOM 799 N GLU A 49 31.596 23.125 6.225 1.00 0.11 N ATOM 800 CA GLU A 49 31.273 23.297 4.780 1.00 0.12 C ATOM 801 C GLU A 49 29.878 22.742 4.528 1.00 0.12 C ATOM 802 O GLU A 49 28.973 23.449 4.131 1.00 0.13 O ATOM 803 CB GLU A 49 32.267 22.497 3.950 1.00 0.13 C ATOM 804 CG GLU A 49 33.619 23.211 3.925 1.00 0.15 C ATOM 805 CD GLU A 49 34.560 22.488 2.959 1.00 0.17 C ATOM 806 OE1 GLU A 49 34.879 21.340 3.222 1.00 1.08 O ATOM 807 OE2 GLU A 49 34.946 23.095 1.973 1.00 1.09 O ATOM 0 H GLU A 49 32.501 22.697 6.419 1.00 0.11 H new ATOM 0 HA GLU A 49 31.322 24.352 4.509 1.00 0.12 H new ATOM 0 HB2 GLU A 49 32.382 21.497 4.369 1.00 0.13 H new ATOM 0 HB3 GLU A 49 31.891 22.376 2.934 1.00 0.13 H new ATOM 0 HG2 GLU A 49 33.489 24.248 3.615 1.00 0.15 H new ATOM 0 HG3 GLU A 49 34.051 23.229 4.925 1.00 0.15 H new ATOM 814 N GLU A 50 29.694 21.474 4.785 1.00 0.12 N ATOM 815 CA GLU A 50 28.353 20.865 4.596 1.00 0.13 C ATOM 816 C GLU A 50 27.356 21.730 5.350 1.00 0.12 C ATOM 817 O GLU A 50 26.179 21.732 5.078 1.00 0.12 O ATOM 818 CB GLU A 50 28.344 19.443 5.163 1.00 0.14 C ATOM 819 CG GLU A 50 26.987 18.791 4.889 1.00 0.17 C ATOM 820 CD GLU A 50 27.025 17.327 5.332 1.00 1.15 C ATOM 821 OE1 GLU A 50 27.313 17.087 6.493 1.00 2.03 O ATOM 822 OE2 GLU A 50 26.767 16.471 4.502 1.00 1.74 O ATOM 0 H GLU A 50 30.417 20.837 5.118 1.00 0.12 H new ATOM 0 HA GLU A 50 28.096 20.811 3.538 1.00 0.13 H new ATOM 0 HB2 GLU A 50 29.140 18.854 4.708 1.00 0.14 H new ATOM 0 HB3 GLU A 50 28.538 19.467 6.235 1.00 0.14 H new ATOM 0 HG2 GLU A 50 26.201 19.324 5.424 1.00 0.17 H new ATOM 0 HG3 GLU A 50 26.749 18.855 3.827 1.00 0.17 H new ATOM 829 N GLY A 51 27.848 22.487 6.288 1.00 0.11 N ATOM 830 CA GLY A 51 26.954 23.392 7.067 1.00 0.10 C ATOM 831 C GLY A 51 26.711 24.650 6.235 1.00 0.10 C ATOM 832 O GLY A 51 25.588 25.024 5.960 1.00 0.11 O ATOM 0 H GLY A 51 28.833 22.520 6.551 1.00 0.11 H new ATOM 0 HA2 GLY A 51 26.010 22.895 7.290 1.00 0.10 H new ATOM 0 HA3 GLY A 51 27.412 23.650 8.022 1.00 0.10 H new ATOM 836 N GLN A 52 27.768 25.289 5.814 1.00 0.10 N ATOM 837 CA GLN A 52 27.631 26.512 4.972 1.00 0.12 C ATOM 838 C GLN A 52 26.678 26.208 3.825 1.00 0.12 C ATOM 839 O GLN A 52 25.775 26.965 3.529 1.00 0.13 O ATOM 840 CB GLN A 52 29.005 26.892 4.419 1.00 0.14 C ATOM 841 CG GLN A 52 29.975 27.098 5.586 1.00 0.19 C ATOM 842 CD GLN A 52 29.636 28.399 6.307 1.00 0.42 C ATOM 843 OE1 GLN A 52 28.936 29.239 5.775 1.00 0.95 O ATOM 844 NE2 GLN A 52 30.103 28.603 7.506 1.00 0.39 N ATOM 0 H GLN A 52 28.729 25.014 6.019 1.00 0.10 H new ATOM 0 HA GLN A 52 27.240 27.340 5.563 1.00 0.12 H new ATOM 0 HB2 GLN A 52 29.374 26.108 3.757 1.00 0.14 H new ATOM 0 HB3 GLN A 52 28.932 27.803 3.825 1.00 0.14 H new ATOM 0 HG2 GLN A 52 29.911 26.259 6.279 1.00 0.19 H new ATOM 0 HG3 GLN A 52 31.001 27.130 5.219 1.00 0.19 H new ATOM 0 HE21 GLN A 52 30.690 27.898 7.951 1.00 0.39 H new ATOM 0 HE22 GLN A 52 29.882 29.468 7.999 1.00 0.39 H new ATOM 853 N TYR A 53 26.867 25.093 3.187 1.00 0.12 N ATOM 854 CA TYR A 53 25.962 24.722 2.064 1.00 0.13 C ATOM 855 C TYR A 53 24.521 24.628 2.594 1.00 0.13 C ATOM 856 O TYR A 53 23.602 25.163 2.006 1.00 0.15 O ATOM 857 CB TYR A 53 26.407 23.373 1.459 1.00 0.14 C ATOM 858 CG TYR A 53 25.264 22.745 0.687 1.00 0.15 C ATOM 859 CD1 TYR A 53 24.281 22.033 1.377 1.00 0.16 C ATOM 860 CD2 TYR A 53 25.179 22.887 -0.702 1.00 0.17 C ATOM 861 CE1 TYR A 53 23.211 21.460 0.690 1.00 0.18 C ATOM 862 CE2 TYR A 53 24.105 22.314 -1.398 1.00 0.19 C ATOM 863 CZ TYR A 53 23.119 21.600 -0.701 1.00 0.19 C ATOM 864 OH TYR A 53 22.061 21.036 -1.384 1.00 0.22 O ATOM 0 H TYR A 53 27.607 24.421 3.391 1.00 0.12 H new ATOM 0 HA TYR A 53 26.007 25.480 1.282 1.00 0.13 H new ATOM 0 HB2 TYR A 53 27.261 23.526 0.799 1.00 0.14 H new ATOM 0 HB3 TYR A 53 26.733 22.700 2.252 1.00 0.14 H new ATOM 0 HD1 TYR A 53 24.350 21.925 2.449 1.00 0.16 H new ATOM 0 HD2 TYR A 53 25.939 23.437 -1.237 1.00 0.17 H new ATOM 0 HE1 TYR A 53 22.455 20.909 1.229 1.00 0.18 H new ATOM 0 HE2 TYR A 53 24.037 22.422 -2.470 1.00 0.19 H new ATOM 0 HH TYR A 53 22.149 21.228 -2.341 1.00 0.22 H new ATOM 874 N VAL A 54 24.314 23.953 3.695 1.00 0.15 N ATOM 875 CA VAL A 54 22.927 23.836 4.239 1.00 0.14 C ATOM 876 C VAL A 54 22.320 25.233 4.357 1.00 0.14 C ATOM 877 O VAL A 54 21.349 25.561 3.704 1.00 0.15 O ATOM 878 CB VAL A 54 22.944 23.181 5.633 1.00 0.13 C ATOM 879 CG1 VAL A 54 21.514 23.177 6.188 1.00 0.14 C ATOM 880 CG2 VAL A 54 23.477 21.723 5.562 1.00 0.14 C ATOM 0 H VAL A 54 25.038 23.481 4.237 1.00 0.15 H new ATOM 0 HA VAL A 54 22.336 23.217 3.564 1.00 0.14 H new ATOM 0 HB VAL A 54 23.607 23.751 6.284 1.00 0.13 H new ATOM 0 HG11 VAL A 54 21.508 22.716 7.176 1.00 0.14 H new ATOM 0 HG12 VAL A 54 21.150 24.202 6.264 1.00 0.14 H new ATOM 0 HG13 VAL A 54 20.866 22.610 5.519 1.00 0.14 H new ATOM 0 HG21 VAL A 54 23.477 21.287 6.561 1.00 0.14 H new ATOM 0 HG22 VAL A 54 22.835 21.132 4.908 1.00 0.14 H new ATOM 0 HG23 VAL A 54 24.493 21.726 5.167 1.00 0.14 H new ATOM 890 N VAL A 55 22.888 26.054 5.190 1.00 0.15 N ATOM 891 CA VAL A 55 22.358 27.432 5.368 1.00 0.16 C ATOM 892 C VAL A 55 22.307 28.137 4.011 1.00 0.19 C ATOM 893 O VAL A 55 21.270 28.598 3.575 1.00 0.22 O ATOM 894 CB VAL A 55 23.281 28.202 6.316 1.00 0.19 C ATOM 895 CG1 VAL A 55 22.641 29.540 6.688 1.00 0.29 C ATOM 896 CG2 VAL A 55 23.507 27.375 7.585 1.00 0.13 C ATOM 0 H VAL A 55 23.703 25.829 5.760 1.00 0.15 H new ATOM 0 HA VAL A 55 21.353 27.392 5.788 1.00 0.16 H new ATOM 0 HB VAL A 55 24.235 28.385 5.822 1.00 0.19 H new ATOM 0 HG11 VAL A 55 23.302 30.084 7.363 1.00 0.29 H new ATOM 0 HG12 VAL A 55 22.479 30.129 5.785 1.00 0.29 H new ATOM 0 HG13 VAL A 55 21.686 29.362 7.181 1.00 0.29 H new ATOM 0 HG21 VAL A 55 24.164 27.920 8.263 1.00 0.13 H new ATOM 0 HG22 VAL A 55 22.551 27.192 8.075 1.00 0.13 H new ATOM 0 HG23 VAL A 55 23.967 26.423 7.322 1.00 0.13 H new ATOM 906 N ASN A 56 23.422 28.229 3.344 1.00 0.22 N ATOM 907 CA ASN A 56 23.449 28.908 2.017 1.00 0.27 C ATOM 908 C ASN A 56 22.366 28.321 1.109 1.00 0.26 C ATOM 909 O ASN A 56 21.580 29.038 0.521 1.00 0.33 O ATOM 910 CB ASN A 56 24.819 28.702 1.367 1.00 0.35 C ATOM 911 CG ASN A 56 25.905 29.324 2.246 1.00 0.71 C ATOM 912 OD1 ASN A 56 25.634 29.770 3.344 1.00 1.56 O ATOM 913 ND2 ASN A 56 27.133 29.374 1.807 1.00 0.90 N ATOM 0 H ASN A 56 24.320 27.862 3.661 1.00 0.22 H new ATOM 0 HA ASN A 56 23.264 29.973 2.157 1.00 0.27 H new ATOM 0 HB2 ASN A 56 25.012 27.638 1.232 1.00 0.35 H new ATOM 0 HB3 ASN A 56 24.834 29.157 0.377 1.00 0.35 H new ATOM 0 HD21 ASN A 56 27.865 29.787 2.385 1.00 0.90 H new ATOM 0 HD22 ASN A 56 27.361 29.000 0.886 1.00 0.90 H new ATOM 920 N GLU A 57 22.322 27.023 0.983 1.00 0.24 N ATOM 921 CA GLU A 57 21.294 26.393 0.104 1.00 0.26 C ATOM 922 C GLU A 57 19.899 26.622 0.693 1.00 0.25 C ATOM 923 O GLU A 57 19.031 27.182 0.054 1.00 0.32 O ATOM 924 CB GLU A 57 21.567 24.887 -0.002 1.00 0.29 C ATOM 925 CG GLU A 57 20.815 24.300 -1.203 1.00 0.50 C ATOM 926 CD GLU A 57 19.307 24.344 -0.941 1.00 1.58 C ATOM 927 OE1 GLU A 57 18.895 23.886 0.112 1.00 2.37 O ATOM 928 OE2 GLU A 57 18.591 24.835 -1.798 1.00 2.31 O ATOM 0 H GLU A 57 22.952 26.371 1.450 1.00 0.24 H new ATOM 0 HA GLU A 57 21.342 26.842 -0.888 1.00 0.26 H new ATOM 0 HB2 GLU A 57 22.637 24.710 -0.111 1.00 0.29 H new ATOM 0 HB3 GLU A 57 21.253 24.387 0.914 1.00 0.29 H new ATOM 0 HG2 GLU A 57 21.054 24.864 -2.105 1.00 0.50 H new ATOM 0 HG3 GLU A 57 21.134 23.272 -1.377 1.00 0.50 H new ATOM 935 N TYR A 58 19.675 26.187 1.902 1.00 0.22 N ATOM 936 CA TYR A 58 18.334 26.373 2.528 1.00 0.26 C ATOM 937 C TYR A 58 17.867 27.818 2.328 1.00 0.32 C ATOM 938 O TYR A 58 16.686 28.103 2.317 1.00 0.46 O ATOM 939 CB TYR A 58 18.426 26.049 4.025 1.00 0.33 C ATOM 940 CG TYR A 58 17.167 26.505 4.733 1.00 0.77 C ATOM 941 CD1 TYR A 58 15.983 25.770 4.602 1.00 0.82 C ATOM 942 CD2 TYR A 58 17.189 27.665 5.516 1.00 1.98 C ATOM 943 CE1 TYR A 58 14.820 26.195 5.255 1.00 0.99 C ATOM 944 CE2 TYR A 58 16.026 28.090 6.170 1.00 2.44 C ATOM 945 CZ TYR A 58 14.841 27.355 6.040 1.00 1.71 C ATOM 946 OH TYR A 58 13.695 27.774 6.684 1.00 2.18 O ATOM 0 H TYR A 58 20.363 25.710 2.485 1.00 0.22 H new ATOM 0 HA TYR A 58 17.613 25.703 2.059 1.00 0.26 H new ATOM 0 HB2 TYR A 58 18.564 24.977 4.165 1.00 0.33 H new ATOM 0 HB3 TYR A 58 19.296 26.542 4.459 1.00 0.33 H new ATOM 0 HD1 TYR A 58 15.967 24.875 3.997 1.00 0.82 H new ATOM 0 HD2 TYR A 58 18.103 28.232 5.616 1.00 1.98 H new ATOM 0 HE1 TYR A 58 13.906 25.628 5.154 1.00 0.99 H new ATOM 0 HE2 TYR A 58 16.043 28.985 6.775 1.00 2.44 H new ATOM 0 HH TYR A 58 13.883 28.594 7.186 1.00 2.18 H new ATOM 956 N SER A 59 18.783 28.726 2.174 1.00 0.40 N ATOM 957 CA SER A 59 18.397 30.148 1.980 1.00 0.52 C ATOM 958 C SER A 59 17.891 30.357 0.551 1.00 0.55 C ATOM 959 O SER A 59 16.878 30.987 0.327 1.00 0.70 O ATOM 960 CB SER A 59 19.617 31.035 2.220 1.00 0.61 C ATOM 961 OG SER A 59 20.191 30.711 3.480 1.00 1.22 O ATOM 0 H SER A 59 19.787 28.545 2.174 1.00 0.40 H new ATOM 0 HA SER A 59 17.605 30.408 2.683 1.00 0.52 H new ATOM 0 HB2 SER A 59 20.349 30.890 1.426 1.00 0.61 H new ATOM 0 HB3 SER A 59 19.327 32.086 2.198 1.00 0.61 H new ATOM 0 HG SER A 59 20.888 30.033 3.357 1.00 1.22 H new ATOM 967 N ARG A 60 18.593 29.841 -0.419 1.00 0.55 N ATOM 968 CA ARG A 60 18.157 30.020 -1.832 1.00 0.68 C ATOM 969 C ARG A 60 16.859 29.247 -2.078 1.00 0.68 C ATOM 970 O ARG A 60 16.040 29.636 -2.886 1.00 0.81 O ATOM 971 CB ARG A 60 19.253 29.497 -2.770 1.00 0.80 C ATOM 972 CG ARG A 60 20.450 30.472 -2.784 1.00 1.08 C ATOM 973 CD ARG A 60 20.273 31.526 -3.894 1.00 1.52 C ATOM 974 NE ARG A 60 18.824 31.767 -4.140 1.00 2.16 N ATOM 975 CZ ARG A 60 18.442 32.832 -4.789 1.00 2.72 C ATOM 976 NH1 ARG A 60 19.329 33.693 -5.205 1.00 2.84 N ATOM 977 NH2 ARG A 60 17.173 33.038 -5.018 1.00 3.69 N ATOM 0 H ARG A 60 19.450 29.303 -0.294 1.00 0.55 H new ATOM 0 HA ARG A 60 17.983 31.078 -2.026 1.00 0.68 H new ATOM 0 HB2 ARG A 60 19.582 28.510 -2.443 1.00 0.80 H new ATOM 0 HB3 ARG A 60 18.855 29.383 -3.778 1.00 0.80 H new ATOM 0 HG2 ARG A 60 20.536 30.965 -1.816 1.00 1.08 H new ATOM 0 HG3 ARG A 60 21.376 29.919 -2.943 1.00 1.08 H new ATOM 0 HD2 ARG A 60 20.761 32.457 -3.605 1.00 1.52 H new ATOM 0 HD3 ARG A 60 20.754 31.185 -4.811 1.00 1.52 H new ATOM 0 HE ARG A 60 18.131 31.100 -3.801 1.00 2.16 H new ATOM 0 HH11 ARG A 60 20.320 33.533 -5.023 1.00 2.84 H new ATOM 0 HH12 ARG A 60 19.032 34.526 -5.713 1.00 2.84 H new ATOM 0 HH21 ARG A 60 16.480 32.366 -4.689 1.00 3.69 H new ATOM 0 HH22 ARG A 60 16.875 33.871 -5.526 1.00 3.69 H new ATOM 991 N GLN A 61 16.666 28.156 -1.393 1.00 0.65 N ATOM 992 CA GLN A 61 15.420 27.363 -1.597 1.00 0.75 C ATOM 993 C GLN A 61 14.211 28.158 -1.093 1.00 0.82 C ATOM 994 O GLN A 61 13.216 28.291 -1.777 1.00 0.98 O ATOM 995 CB GLN A 61 15.518 26.046 -0.824 1.00 0.78 C ATOM 996 CG GLN A 61 14.225 25.250 -1.007 1.00 1.35 C ATOM 997 CD GLN A 61 14.412 23.836 -0.457 1.00 1.81 C ATOM 998 OE1 GLN A 61 15.052 23.010 -1.078 1.00 2.46 O ATOM 999 NE2 GLN A 61 13.875 23.519 0.688 1.00 2.39 N ATOM 0 H GLN A 61 17.314 27.778 -0.702 1.00 0.65 H new ATOM 0 HA GLN A 61 15.299 27.155 -2.660 1.00 0.75 H new ATOM 0 HB2 GLN A 61 16.369 25.465 -1.180 1.00 0.78 H new ATOM 0 HB3 GLN A 61 15.689 26.245 0.234 1.00 0.78 H new ATOM 0 HG2 GLN A 61 13.404 25.747 -0.490 1.00 1.35 H new ATOM 0 HG3 GLN A 61 13.958 25.208 -2.063 1.00 1.35 H new ATOM 0 HE21 GLN A 61 13.338 24.212 1.209 1.00 2.39 H new ATOM 0 HE22 GLN A 61 13.992 22.578 1.063 1.00 2.39 H new ATOM 1008 N HIS A 62 14.286 28.684 0.103 1.00 0.86 N ATOM 1009 CA HIS A 62 13.137 29.466 0.657 1.00 1.04 C ATOM 1010 C HIS A 62 13.326 30.953 0.347 1.00 1.08 C ATOM 1011 O HIS A 62 12.415 31.741 0.495 1.00 1.27 O ATOM 1012 CB HIS A 62 13.078 29.271 2.174 1.00 1.15 C ATOM 1013 CG HIS A 62 12.586 27.884 2.484 1.00 1.32 C ATOM 1014 ND1 HIS A 62 12.363 26.938 1.491 1.00 1.81 N ATOM 1015 CD2 HIS A 62 12.270 27.265 3.670 1.00 1.57 C ATOM 1016 CE1 HIS A 62 11.933 25.813 2.092 1.00 1.95 C ATOM 1017 NE2 HIS A 62 11.861 25.962 3.415 1.00 1.81 N ATOM 0 H HIS A 62 15.094 28.606 0.721 1.00 0.86 H new ATOM 0 HA HIS A 62 12.210 29.117 0.202 1.00 1.04 H new ATOM 0 HB2 HIS A 62 14.066 29.424 2.609 1.00 1.15 H new ATOM 0 HB3 HIS A 62 12.415 30.012 2.621 1.00 1.15 H new ATOM 0 HD2 HIS A 62 12.330 27.720 4.647 1.00 1.57 H new ATOM 0 HE1 HIS A 62 11.678 24.904 1.568 1.00 1.95 H new ATOM 0 HE2 HIS A 62 11.567 25.264 4.098 1.00 1.81 H new ATOM 1025 N ASN A 63 14.503 31.335 -0.075 1.00 1.07 N ATOM 1026 CA ASN A 63 14.773 32.770 -0.396 1.00 1.28 C ATOM 1027 C ASN A 63 14.376 33.656 0.795 1.00 1.39 C ATOM 1028 O ASN A 63 13.732 33.216 1.726 1.00 1.84 O ATOM 1029 CB ASN A 63 14.001 33.178 -1.668 1.00 1.47 C ATOM 1030 CG ASN A 63 12.556 33.572 -1.335 1.00 1.99 C ATOM 1031 OD1 ASN A 63 11.647 32.780 -1.486 1.00 2.62 O ATOM 1032 ND2 ASN A 63 12.309 34.773 -0.888 1.00 2.68 N ATOM 0 H ASN A 63 15.297 30.709 -0.213 1.00 1.07 H new ATOM 0 HA ASN A 63 15.838 32.905 -0.584 1.00 1.28 H new ATOM 0 HB2 ASN A 63 14.507 34.014 -2.152 1.00 1.47 H new ATOM 0 HB3 ASN A 63 14.001 32.351 -2.378 1.00 1.47 H new ATOM 0 HD21 ASN A 63 11.352 35.047 -0.665 1.00 2.68 H new ATOM 0 HD22 ASN A 63 13.073 35.437 -0.762 1.00 2.68 H new ATOM 1039 N LEU A 64 14.767 34.904 0.777 1.00 1.34 N ATOM 1040 CA LEU A 64 14.420 35.819 1.906 1.00 1.51 C ATOM 1041 C LEU A 64 13.127 36.568 1.570 1.00 1.81 C ATOM 1042 O LEU A 64 12.065 36.233 2.055 1.00 2.42 O ATOM 1043 CB LEU A 64 15.564 36.821 2.116 1.00 1.61 C ATOM 1044 CG LEU A 64 16.723 36.157 2.884 1.00 1.76 C ATOM 1045 CD1 LEU A 64 16.334 35.900 4.354 1.00 1.87 C ATOM 1046 CD2 LEU A 64 17.093 34.830 2.208 1.00 2.54 C ATOM 0 H LEU A 64 15.313 35.330 0.028 1.00 1.34 H new ATOM 0 HA LEU A 64 14.275 35.242 2.819 1.00 1.51 H new ATOM 0 HB2 LEU A 64 15.919 37.185 1.152 1.00 1.61 H new ATOM 0 HB3 LEU A 64 15.201 37.687 2.670 1.00 1.61 H new ATOM 0 HG LEU A 64 17.580 36.831 2.868 1.00 1.76 H new ATOM 0 HD11 LEU A 64 17.169 35.431 4.875 1.00 1.87 H new ATOM 0 HD12 LEU A 64 16.091 36.847 4.837 1.00 1.87 H new ATOM 0 HD13 LEU A 64 15.467 35.241 4.391 1.00 1.87 H new ATOM 0 HD21 LEU A 64 17.913 34.361 2.752 1.00 2.54 H new ATOM 0 HD22 LEU A 64 16.228 34.166 2.212 1.00 2.54 H new ATOM 0 HD23 LEU A 64 17.401 35.019 1.180 1.00 2.54 H new ATOM 1058 N ASN A 65 13.203 37.578 0.740 1.00 2.02 N ATOM 1059 CA ASN A 65 11.974 38.342 0.371 1.00 2.49 C ATOM 1060 C ASN A 65 12.072 38.777 -1.089 1.00 3.04 C ATOM 1061 O ASN A 65 11.172 38.554 -1.875 1.00 3.62 O ATOM 1062 CB ASN A 65 11.851 39.579 1.264 1.00 3.04 C ATOM 1063 CG ASN A 65 10.516 40.275 0.991 1.00 3.59 C ATOM 1064 OD1 ASN A 65 10.454 41.486 0.915 1.00 4.09 O ATOM 1065 ND2 ASN A 65 9.438 39.556 0.840 1.00 4.13 N ATOM 0 H ASN A 65 14.064 37.906 0.302 1.00 2.02 H new ATOM 0 HA ASN A 65 11.097 37.710 0.508 1.00 2.49 H new ATOM 0 HB2 ASN A 65 11.915 39.291 2.313 1.00 3.04 H new ATOM 0 HB3 ASN A 65 12.677 40.264 1.070 1.00 3.04 H new ATOM 0 HD21 ASN A 65 8.543 40.011 0.658 1.00 4.13 H new ATOM 0 HD22 ASN A 65 9.490 38.539 0.904 1.00 4.13 H new ATOM 1072 N ILE A 66 13.161 39.392 -1.460 1.00 0.00 N ATOM 1073 CA ILE A 66 13.326 39.844 -2.873 1.00 0.00 C ATOM 1074 C ILE A 66 14.819 39.866 -3.233 1.00 0.00 C ATOM 1075 O ILE A 66 15.235 40.563 -4.137 1.00 0.00 O ATOM 1076 CB ILE A 66 12.717 41.252 -3.044 1.00 0.00 C ATOM 1077 CG1 ILE A 66 12.920 42.058 -1.759 1.00 0.00 C ATOM 1078 CG2 ILE A 66 11.213 41.154 -3.331 1.00 0.00 C ATOM 1079 CD1 ILE A 66 14.406 42.111 -1.413 1.00 0.00 C ATOM 0 H ILE A 66 13.947 39.602 -0.845 1.00 0.00 H new ATOM 0 HA ILE A 66 12.809 39.153 -3.539 1.00 0.00 H new ATOM 0 HB ILE A 66 13.213 41.744 -3.880 1.00 0.00 H new ATOM 0 HG12 ILE A 66 12.530 43.068 -1.887 1.00 0.00 H new ATOM 0 HG13 ILE A 66 12.362 41.602 -0.941 1.00 0.00 H new ATOM 0 HG21 ILE A 66 10.799 42.155 -3.449 1.00 0.00 H new ATOM 0 HG22 ILE A 66 11.054 40.585 -4.247 1.00 0.00 H new ATOM 0 HG23 ILE A 66 10.716 40.651 -2.501 1.00 0.00 H new ATOM 0 HD11 ILE A 66 14.546 42.686 -0.498 1.00 0.00 H new ATOM 0 HD12 ILE A 66 14.782 41.098 -1.267 1.00 0.00 H new ATOM 0 HD13 ILE A 66 14.952 42.587 -2.227 1.00 0.00 H new ATOM 1091 N TYR A 67 15.627 39.103 -2.542 1.00 0.00 N ATOM 1092 CA TYR A 67 17.080 39.076 -2.854 1.00 0.00 C ATOM 1093 C TYR A 67 17.265 38.872 -4.362 1.00 0.00 C ATOM 1094 O TYR A 67 18.330 39.090 -4.903 1.00 0.00 O ATOM 1095 CB TYR A 67 17.717 37.910 -2.088 1.00 0.00 C ATOM 1096 CG TYR A 67 18.047 38.307 -0.660 1.00 0.00 C ATOM 1097 CD1 TYR A 67 17.341 39.324 0.012 1.00 0.00 C ATOM 1098 CD2 TYR A 67 19.079 37.639 -0.007 1.00 0.00 C ATOM 1099 CE1 TYR A 67 17.682 39.657 1.329 1.00 0.00 C ATOM 1100 CE2 TYR A 67 19.421 37.972 1.308 1.00 0.00 C ATOM 1101 CZ TYR A 67 18.723 38.983 1.976 1.00 0.00 C ATOM 1102 OH TYR A 67 19.058 39.312 3.274 1.00 0.00 O ATOM 0 H TYR A 67 15.338 38.497 -1.774 1.00 0.00 H new ATOM 0 HA TYR A 67 17.553 40.013 -2.560 1.00 0.00 H new ATOM 0 HB2 TYR A 67 17.036 37.059 -2.084 1.00 0.00 H new ATOM 0 HB3 TYR A 67 18.625 37.589 -2.598 1.00 0.00 H new ATOM 0 HD1 TYR A 67 16.538 39.846 -0.487 1.00 0.00 H new ATOM 0 HD2 TYR A 67 19.620 36.857 -0.520 1.00 0.00 H new ATOM 0 HE1 TYR A 67 17.140 40.435 1.846 1.00 0.00 H new ATOM 0 HE2 TYR A 67 20.223 37.449 1.807 1.00 0.00 H new ATOM 0 HH TYR A 67 19.801 38.748 3.573 1.00 0.00 H new ATOM 1112 N ASP A 68 16.232 38.454 -5.040 1.00 0.00 N ATOM 1113 CA ASP A 68 16.341 38.233 -6.508 1.00 0.00 C ATOM 1114 C ASP A 68 14.939 38.094 -7.103 1.00 0.00 C ATOM 1115 O ASP A 68 14.684 38.495 -8.221 1.00 0.00 O ATOM 1116 CB ASP A 68 17.139 36.955 -6.772 1.00 0.00 C ATOM 1117 CG ASP A 68 17.463 36.852 -8.264 1.00 0.00 C ATOM 1118 OD1 ASP A 68 16.595 36.429 -9.010 1.00 0.00 O ATOM 1119 OD2 ASP A 68 18.572 37.198 -8.635 1.00 0.00 O ATOM 0 H ASP A 68 15.315 38.256 -4.639 1.00 0.00 H new ATOM 0 HA ASP A 68 16.850 39.079 -6.970 1.00 0.00 H new ATOM 0 HB2 ASP A 68 18.060 36.962 -6.189 1.00 0.00 H new ATOM 0 HB3 ASP A 68 16.567 36.084 -6.453 1.00 0.00 H new ATOM 1124 N GLY A 69 14.027 37.527 -6.361 1.00 0.00 N ATOM 1125 CA GLY A 69 12.639 37.361 -6.880 1.00 0.00 C ATOM 1126 C GLY A 69 12.126 38.703 -7.406 1.00 0.00 C ATOM 1127 O GLY A 69 11.333 38.757 -8.325 1.00 0.00 O ATOM 0 H GLY A 69 14.183 37.171 -5.418 1.00 0.00 H new ATOM 0 HA2 GLY A 69 12.624 36.617 -7.676 1.00 0.00 H new ATOM 0 HA3 GLY A 69 11.985 36.995 -6.089 1.00 0.00 H new ATOM 1131 N GLY A 70 12.572 39.786 -6.831 1.00 0.00 N ATOM 1132 CA GLY A 70 12.109 41.123 -7.300 1.00 0.00 C ATOM 1133 C GLY A 70 12.790 41.464 -8.627 1.00 0.00 C ATOM 1134 O GLY A 70 12.385 42.369 -9.329 1.00 0.00 O ATOM 0 H GLY A 70 13.236 39.803 -6.057 1.00 0.00 H new ATOM 0 HA2 GLY A 70 11.026 41.121 -7.425 1.00 0.00 H new ATOM 0 HA3 GLY A 70 12.342 41.883 -6.554 1.00 0.00 H new ATOM 1138 N GLU A 71 13.822 40.746 -8.977 1.00 0.00 N ATOM 1139 CA GLU A 71 14.527 41.030 -10.259 1.00 0.00 C ATOM 1140 C GLU A 71 14.911 42.510 -10.312 1.00 0.00 C ATOM 1141 O GLU A 71 14.843 43.142 -11.347 1.00 0.00 O ATOM 1142 CB GLU A 71 13.602 40.699 -11.433 1.00 0.00 C ATOM 1143 CG GLU A 71 13.017 39.297 -11.246 1.00 0.00 C ATOM 1144 CD GLU A 71 14.153 38.283 -11.104 1.00 0.00 C ATOM 1145 OE1 GLU A 71 15.121 38.400 -11.837 1.00 0.00 O ATOM 1146 OE2 GLU A 71 14.036 37.405 -10.264 1.00 0.00 O ATOM 0 H GLU A 71 14.207 39.975 -8.431 1.00 0.00 H new ATOM 0 HA GLU A 71 15.427 40.419 -10.323 1.00 0.00 H new ATOM 0 HB2 GLU A 71 12.799 41.434 -11.495 1.00 0.00 H new ATOM 0 HB3 GLU A 71 14.155 40.751 -12.371 1.00 0.00 H new ATOM 0 HG2 GLU A 71 12.381 39.272 -10.361 1.00 0.00 H new ATOM 0 HG3 GLU A 71 12.388 39.037 -12.098 1.00 0.00 H new ATOM 1153 N LEU A 72 15.313 43.067 -9.203 1.00 0.00 N ATOM 1154 CA LEU A 72 15.701 44.505 -9.190 1.00 0.00 C ATOM 1155 C LEU A 72 16.886 44.725 -10.129 1.00 0.00 C ATOM 1156 O LEU A 72 17.633 43.814 -10.428 1.00 0.00 O ATOM 1157 CB LEU A 72 16.095 44.914 -7.769 1.00 0.00 C ATOM 1158 CG LEU A 72 14.981 44.530 -6.790 1.00 0.00 C ATOM 1159 CD1 LEU A 72 15.441 44.825 -5.360 1.00 0.00 C ATOM 1160 CD2 LEU A 72 13.711 45.339 -7.101 1.00 0.00 C ATOM 0 H LEU A 72 15.389 42.588 -8.306 1.00 0.00 H new ATOM 0 HA LEU A 72 14.858 45.110 -9.523 1.00 0.00 H new ATOM 0 HB2 LEU A 72 17.026 44.424 -7.485 1.00 0.00 H new ATOM 0 HB3 LEU A 72 16.274 45.988 -7.727 1.00 0.00 H new ATOM 0 HG LEU A 72 14.760 43.467 -6.892 1.00 0.00 H new ATOM 0 HD11 LEU A 72 14.651 44.553 -4.660 1.00 0.00 H new ATOM 0 HD12 LEU A 72 16.337 44.245 -5.139 1.00 0.00 H new ATOM 0 HD13 LEU A 72 15.663 45.888 -5.261 1.00 0.00 H new ATOM 0 HD21 LEU A 72 12.922 45.061 -6.402 1.00 0.00 H new ATOM 0 HD22 LEU A 72 13.925 46.403 -7.003 1.00 0.00 H new ATOM 0 HD23 LEU A 72 13.384 45.126 -8.119 1.00 0.00 H new ATOM 1172 N ARG A 73 17.059 45.929 -10.603 1.00 0.00 N ATOM 1173 CA ARG A 73 18.192 46.210 -11.528 1.00 0.00 C ATOM 1174 C ARG A 73 19.502 45.711 -10.915 1.00 0.00 C ATOM 1175 O ARG A 73 19.519 45.116 -9.856 1.00 0.00 O ATOM 1176 CB ARG A 73 18.291 47.720 -11.809 1.00 0.00 C ATOM 1177 CG ARG A 73 18.520 48.520 -10.508 1.00 0.00 C ATOM 1178 CD ARG A 73 17.242 48.569 -9.654 1.00 0.00 C ATOM 1179 NE ARG A 73 17.256 49.803 -8.819 1.00 0.00 N ATOM 1180 CZ ARG A 73 16.159 50.213 -8.244 1.00 0.00 C ATOM 1181 NH1 ARG A 73 15.049 49.546 -8.406 1.00 0.00 N ATOM 1182 NH2 ARG A 73 16.172 51.291 -7.508 1.00 0.00 N ATOM 0 H ARG A 73 16.464 46.730 -10.389 1.00 0.00 H new ATOM 0 HA ARG A 73 18.013 45.688 -12.468 1.00 0.00 H new ATOM 0 HB2 ARG A 73 19.109 47.910 -12.504 1.00 0.00 H new ATOM 0 HB3 ARG A 73 17.376 48.063 -12.293 1.00 0.00 H new ATOM 0 HG2 ARG A 73 19.327 48.064 -9.934 1.00 0.00 H new ATOM 0 HG3 ARG A 73 18.837 49.534 -10.752 1.00 0.00 H new ATOM 0 HD2 ARG A 73 16.361 48.560 -10.296 1.00 0.00 H new ATOM 0 HD3 ARG A 73 17.182 47.686 -9.018 1.00 0.00 H new ATOM 0 HE ARG A 73 18.123 50.327 -8.697 1.00 0.00 H new ATOM 0 HH11 ARG A 73 15.039 48.704 -8.982 1.00 0.00 H new ATOM 0 HH12 ARG A 73 14.191 49.866 -7.957 1.00 0.00 H new ATOM 0 HH21 ARG A 73 17.040 51.812 -7.383 1.00 0.00 H new ATOM 0 HH22 ARG A 73 15.315 51.612 -7.058 1.00 0.00 H new ATOM 1196 N ASN A 74 20.601 45.953 -11.577 1.00 0.00 N ATOM 1197 CA ASN A 74 21.922 45.500 -11.044 1.00 0.00 C ATOM 1198 C ASN A 74 22.579 46.644 -10.268 1.00 0.00 C ATOM 1199 O ASN A 74 22.008 47.703 -10.104 1.00 0.00 O ATOM 1200 CB ASN A 74 22.826 45.092 -12.209 1.00 0.00 C ATOM 1201 CG ASN A 74 22.349 43.756 -12.780 1.00 0.00 C ATOM 1202 OD1 ASN A 74 21.210 43.374 -12.594 1.00 0.00 O ATOM 1203 ND2 ASN A 74 23.177 43.022 -13.473 1.00 0.00 N ATOM 0 H ASN A 74 20.643 46.447 -12.468 1.00 0.00 H new ATOM 0 HA ASN A 74 21.774 44.648 -10.380 1.00 0.00 H new ATOM 0 HB2 ASN A 74 22.807 45.858 -12.984 1.00 0.00 H new ATOM 0 HB3 ASN A 74 23.858 45.007 -11.870 1.00 0.00 H new ATOM 0 HD21 ASN A 74 22.868 42.129 -13.858 1.00 0.00 H new ATOM 0 HD22 ASN A 74 24.133 43.341 -13.630 1.00 0.00 H new ATOM 1210 N THR A 75 23.776 46.438 -9.789 1.00 0.00 N ATOM 1211 CA THR A 75 24.470 47.513 -9.024 1.00 0.00 C ATOM 1212 C THR A 75 25.143 48.482 -9.999 1.00 0.00 C ATOM 1213 O THR A 75 24.908 49.673 -9.967 1.00 0.00 O ATOM 1214 CB THR A 75 25.530 46.887 -8.115 1.00 0.00 C ATOM 1215 OG1 THR A 75 24.952 45.811 -7.390 1.00 0.00 O ATOM 1216 CG2 THR A 75 26.055 47.940 -7.138 1.00 0.00 C ATOM 0 H THR A 75 24.303 45.571 -9.895 1.00 0.00 H new ATOM 0 HA THR A 75 23.744 48.054 -8.418 1.00 0.00 H new ATOM 0 HB THR A 75 26.356 46.516 -8.721 1.00 0.00 H new ATOM 0 HG1 THR A 75 25.629 45.407 -6.808 1.00 0.00 H new ATOM 0 HG21 THR A 75 26.810 47.492 -6.491 1.00 0.00 H new ATOM 0 HG22 THR A 75 26.498 48.765 -7.696 1.00 0.00 H new ATOM 0 HG23 THR A 75 25.232 48.314 -6.529 1.00 0.00 H new ATOM 1224 N THR A 76 25.981 47.980 -10.865 1.00 0.00 N ATOM 1225 CA THR A 76 26.670 48.873 -11.839 1.00 0.00 C ATOM 1226 C THR A 76 25.651 49.422 -12.840 1.00 0.00 C ATOM 1227 O THR A 76 25.239 48.742 -13.759 1.00 0.00 O ATOM 1228 CB THR A 76 27.744 48.079 -12.588 1.00 0.00 C ATOM 1229 OG1 THR A 76 27.157 46.922 -13.168 1.00 0.00 O ATOM 1230 CG2 THR A 76 28.846 47.662 -11.614 1.00 0.00 C ATOM 0 H THR A 76 26.218 46.991 -10.940 1.00 0.00 H new ATOM 0 HA THR A 76 27.136 49.701 -11.305 1.00 0.00 H new ATOM 0 HB THR A 76 28.174 48.701 -13.373 1.00 0.00 H new ATOM 0 HG1 THR A 76 26.317 47.167 -13.609 1.00 0.00 H new ATOM 0 HG21 THR A 76 29.610 47.097 -12.149 1.00 0.00 H new ATOM 0 HG22 THR A 76 29.296 48.551 -11.171 1.00 0.00 H new ATOM 0 HG23 THR A 76 28.420 47.041 -10.827 1.00 0.00 H new ATOM 1238 N ARG A 77 25.242 50.650 -12.670 1.00 0.00 N ATOM 1239 CA ARG A 77 24.252 51.244 -13.613 1.00 0.00 C ATOM 1240 C ARG A 77 24.110 52.742 -13.332 1.00 0.00 C ATOM 1241 O ARG A 77 23.832 53.525 -14.219 1.00 0.00 O ATOM 1242 CB ARG A 77 22.895 50.562 -13.431 1.00 0.00 C ATOM 1243 CG ARG A 77 21.976 50.939 -14.595 1.00 0.00 C ATOM 1244 CD ARG A 77 20.638 50.211 -14.449 1.00 0.00 C ATOM 1245 NE ARG A 77 19.782 50.505 -15.634 1.00 0.00 N ATOM 1246 CZ ARG A 77 18.729 49.773 -15.875 1.00 0.00 C ATOM 1247 NH1 ARG A 77 18.423 48.787 -15.078 1.00 0.00 N ATOM 1248 NH2 ARG A 77 17.981 50.030 -16.914 1.00 0.00 N ATOM 0 H ARG A 77 25.551 51.267 -11.919 1.00 0.00 H new ATOM 0 HA ARG A 77 24.598 51.097 -14.636 1.00 0.00 H new ATOM 0 HB2 ARG A 77 23.022 49.480 -13.389 1.00 0.00 H new ATOM 0 HB3 ARG A 77 22.446 50.867 -12.486 1.00 0.00 H new ATOM 0 HG2 ARG A 77 21.815 52.017 -14.610 1.00 0.00 H new ATOM 0 HG3 ARG A 77 22.445 50.673 -15.542 1.00 0.00 H new ATOM 0 HD2 ARG A 77 20.803 49.137 -14.364 1.00 0.00 H new ATOM 0 HD3 ARG A 77 20.136 50.530 -13.536 1.00 0.00 H new ATOM 0 HE ARG A 77 20.019 51.278 -16.256 1.00 0.00 H new ATOM 0 HH11 ARG A 77 19.007 48.588 -14.266 1.00 0.00 H new ATOM 0 HH12 ARG A 77 17.600 48.215 -15.267 1.00 0.00 H new ATOM 0 HH21 ARG A 77 18.220 50.802 -17.536 1.00 0.00 H new ATOM 0 HH22 ARG A 77 17.158 49.459 -17.104 1.00 0.00 H new ATOM 1262 N GLN A 78 24.298 53.148 -12.106 1.00 0.00 N ATOM 1263 CA GLN A 78 24.173 54.596 -11.771 1.00 0.00 C ATOM 1264 C GLN A 78 25.006 55.426 -12.750 1.00 0.00 C ATOM 1265 O GLN A 78 24.908 56.637 -12.787 1.00 0.00 O ATOM 1266 CB GLN A 78 24.676 54.835 -10.346 1.00 0.00 C ATOM 1267 CG GLN A 78 23.676 54.253 -9.345 1.00 0.00 C ATOM 1268 CD GLN A 78 24.131 54.576 -7.921 1.00 0.00 C ATOM 1269 OE1 GLN A 78 24.979 53.899 -7.373 1.00 0.00 O ATOM 1270 NE2 GLN A 78 23.601 55.590 -7.293 1.00 0.00 N ATOM 0 H GLN A 78 24.533 52.540 -11.321 1.00 0.00 H new ATOM 0 HA GLN A 78 23.127 54.894 -11.844 1.00 0.00 H new ATOM 0 HB2 GLN A 78 25.653 54.370 -10.212 1.00 0.00 H new ATOM 0 HB3 GLN A 78 24.804 55.903 -10.169 1.00 0.00 H new ATOM 0 HG2 GLN A 78 22.684 54.667 -9.524 1.00 0.00 H new ATOM 0 HG3 GLN A 78 23.599 53.174 -9.477 1.00 0.00 H new ATOM 0 HE21 GLN A 78 22.889 56.159 -7.752 1.00 0.00 H new ATOM 0 HE22 GLN A 78 23.898 55.814 -6.343 1.00 0.00 H new ATOM 1279 N CYS A 79 25.827 54.782 -13.543 1.00 0.00 N ATOM 1280 CA CYS A 79 26.680 55.518 -14.531 1.00 0.00 C ATOM 1281 C CYS A 79 26.489 54.905 -15.919 1.00 0.00 C ATOM 1282 O CYS A 79 27.418 54.798 -16.695 1.00 0.00 O ATOM 1283 CB CYS A 79 28.149 55.395 -14.120 1.00 0.00 C ATOM 1284 SG CYS A 79 28.450 56.406 -12.649 1.00 0.00 S ATOM 0 H CYS A 79 25.944 53.769 -13.549 1.00 0.00 H new ATOM 0 HA CYS A 79 26.393 56.569 -14.553 1.00 0.00 H new ATOM 0 HB2 CYS A 79 28.394 54.353 -13.915 1.00 0.00 H new ATOM 0 HB3 CYS A 79 28.795 55.720 -14.936 1.00 0.00 H new ATOM 0 HG CYS A 79 29.697 56.301 -12.298 1.00 0.00 H new ATOM 1290 N GLY A 80 25.290 54.501 -16.239 1.00 0.00 N ATOM 1291 CA GLY A 80 25.039 53.895 -17.577 1.00 0.00 C ATOM 1292 C GLY A 80 25.914 52.652 -17.748 1.00 0.00 C ATOM 1293 O GLY A 80 26.654 52.342 -16.829 1.00 0.00 O ATOM 1294 OXT GLY A 80 25.828 52.031 -18.795 1.00 0.00 O ATOM 0 H GLY A 80 24.473 54.564 -15.631 1.00 0.00 H new ATOM 0 HA2 GLY A 80 23.987 53.628 -17.675 1.00 0.00 H new ATOM 0 HA3 GLY A 80 25.259 54.618 -18.362 1.00 0.00 H new TER 1298 GLY A 80 ATOM 1299 N GLY B 1 5.059 10.420 8.656 1.00 6.48 N ATOM 1300 CA GLY B 1 4.961 10.910 10.102 1.00 5.73 C ATOM 1301 C GLY B 1 5.175 12.353 10.410 1.00 4.94 C ATOM 1302 O GLY B 1 4.776 12.841 11.448 1.00 5.12 O ATOM 0 H1 GLY B 1 4.883 9.395 8.624 1.00 6.48 H new ATOM 0 H2 GLY B 1 4.351 10.911 8.074 1.00 6.48 H new ATOM 0 H3 GLY B 1 6.010 10.620 8.285 1.00 6.48 H new ATOM 0 HA2 GLY B 1 3.971 10.642 10.470 1.00 5.73 H new ATOM 0 HA3 GLY B 1 5.683 10.342 10.688 1.00 5.73 H new ATOM 1308 N SER B 2 5.806 13.072 9.521 1.00 4.43 N ATOM 1309 CA SER B 2 6.050 14.521 9.773 1.00 3.98 C ATOM 1310 C SER B 2 6.780 15.126 8.558 1.00 2.98 C ATOM 1311 O SER B 2 7.313 14.393 7.748 1.00 3.23 O ATOM 1312 CB SER B 2 6.912 14.670 11.042 1.00 4.81 C ATOM 1313 OG SER B 2 8.085 15.423 10.747 1.00 5.35 O ATOM 0 H SER B 2 6.162 12.719 8.633 1.00 4.43 H new ATOM 0 HA SER B 2 5.106 15.045 9.919 1.00 3.98 H new ATOM 0 HB2 SER B 2 6.339 15.166 11.825 1.00 4.81 H new ATOM 0 HB3 SER B 2 7.187 13.686 11.423 1.00 4.81 H new ATOM 0 HG SER B 2 8.627 15.515 11.558 1.00 5.35 H new ATOM 1319 N PRO B 3 6.796 16.443 8.461 1.00 2.36 N ATOM 1320 CA PRO B 3 7.478 17.124 7.342 1.00 2.03 C ATOM 1321 C PRO B 3 8.958 16.707 7.303 1.00 1.67 C ATOM 1322 O PRO B 3 9.322 15.636 7.747 1.00 2.17 O ATOM 1323 CB PRO B 3 7.315 18.637 7.637 1.00 2.59 C ATOM 1324 CG PRO B 3 6.538 18.771 8.980 1.00 2.98 C ATOM 1325 CD PRO B 3 6.150 17.348 9.438 1.00 2.84 C ATOM 0 HA PRO B 3 7.061 16.867 6.368 1.00 2.03 H new ATOM 0 HB2 PRO B 3 8.289 19.121 7.708 1.00 2.59 H new ATOM 0 HB3 PRO B 3 6.773 19.129 6.830 1.00 2.59 H new ATOM 0 HG2 PRO B 3 7.156 19.261 9.733 1.00 2.98 H new ATOM 0 HG3 PRO B 3 5.648 19.387 8.848 1.00 2.98 H new ATOM 0 HD2 PRO B 3 6.500 17.150 10.451 1.00 2.84 H new ATOM 0 HD3 PRO B 3 5.068 17.216 9.443 1.00 2.84 H new ATOM 1333 N LEU B 4 9.813 17.549 6.783 1.00 1.47 N ATOM 1334 CA LEU B 4 11.257 17.216 6.720 1.00 1.38 C ATOM 1335 C LEU B 4 11.929 17.721 7.989 1.00 1.11 C ATOM 1336 O LEU B 4 11.774 18.857 8.392 1.00 1.29 O ATOM 1337 CB LEU B 4 11.898 17.888 5.498 1.00 1.71 C ATOM 1338 CG LEU B 4 11.594 17.083 4.226 1.00 2.15 C ATOM 1339 CD1 LEU B 4 10.148 17.327 3.785 1.00 2.81 C ATOM 1340 CD2 LEU B 4 12.544 17.528 3.115 1.00 2.82 C ATOM 0 H LEU B 4 9.565 18.460 6.397 1.00 1.47 H new ATOM 0 HA LEU B 4 11.381 16.137 6.633 1.00 1.38 H new ATOM 0 HB2 LEU B 4 11.518 18.904 5.393 1.00 1.71 H new ATOM 0 HB3 LEU B 4 12.976 17.963 5.640 1.00 1.71 H new ATOM 0 HG LEU B 4 11.730 16.021 4.430 1.00 2.15 H new ATOM 0 HD11 LEU B 4 9.941 16.752 2.882 1.00 2.81 H new ATOM 0 HD12 LEU B 4 9.468 17.015 4.578 1.00 2.81 H new ATOM 0 HD13 LEU B 4 10.004 18.388 3.581 1.00 2.81 H new ATOM 0 HD21 LEU B 4 12.334 16.961 2.208 1.00 2.82 H new ATOM 0 HD22 LEU B 4 12.402 18.591 2.919 1.00 2.82 H new ATOM 0 HD23 LEU B 4 13.574 17.350 3.424 1.00 2.82 H new ATOM 1352 N GLY B 5 12.669 16.870 8.612 1.00 0.96 N ATOM 1353 CA GLY B 5 13.374 17.251 9.869 1.00 0.91 C ATOM 1354 C GLY B 5 14.401 18.345 9.575 1.00 0.71 C ATOM 1355 O GLY B 5 14.741 19.136 10.433 1.00 0.79 O ATOM 0 H GLY B 5 12.825 15.909 8.307 1.00 0.96 H new ATOM 0 HA2 GLY B 5 12.654 17.604 10.608 1.00 0.91 H new ATOM 0 HA3 GLY B 5 13.870 16.380 10.297 1.00 0.91 H new ATOM 1359 N GLN B 6 14.901 18.398 8.371 1.00 0.61 N ATOM 1360 CA GLN B 6 15.908 19.442 8.031 1.00 0.58 C ATOM 1361 C GLN B 6 15.367 20.816 8.416 1.00 0.45 C ATOM 1362 O GLN B 6 16.098 21.679 8.851 1.00 0.53 O ATOM 1363 CB GLN B 6 16.190 19.415 6.522 1.00 0.73 C ATOM 1364 CG GLN B 6 17.509 20.144 6.222 1.00 0.92 C ATOM 1365 CD GLN B 6 18.694 19.210 6.489 1.00 1.60 C ATOM 1366 OE1 GLN B 6 18.645 18.385 7.379 1.00 2.37 O ATOM 1367 NE2 GLN B 6 19.763 19.305 5.746 1.00 2.15 N ATOM 0 H GLN B 6 14.656 17.765 7.610 1.00 0.61 H new ATOM 0 HA GLN B 6 16.830 19.244 8.578 1.00 0.58 H new ATOM 0 HB2 GLN B 6 16.247 18.384 6.172 1.00 0.73 H new ATOM 0 HB3 GLN B 6 15.371 19.890 5.982 1.00 0.73 H new ATOM 0 HG2 GLN B 6 17.523 20.476 5.184 1.00 0.92 H new ATOM 0 HG3 GLN B 6 17.591 21.036 6.843 1.00 0.92 H new ATOM 0 HE21 GLN B 6 19.805 19.998 4.998 1.00 2.15 H new ATOM 0 HE22 GLN B 6 20.557 18.687 5.913 1.00 2.15 H new ATOM 1376 N ASP B 7 14.095 21.025 8.246 1.00 0.40 N ATOM 1377 CA ASP B 7 13.502 22.345 8.585 1.00 0.38 C ATOM 1378 C ASP B 7 13.594 22.595 10.094 1.00 0.33 C ATOM 1379 O ASP B 7 14.120 23.597 10.535 1.00 0.39 O ATOM 1380 CB ASP B 7 12.035 22.353 8.147 1.00 0.48 C ATOM 1381 CG ASP B 7 11.949 22.557 6.632 1.00 1.12 C ATOM 1382 OD1 ASP B 7 12.346 23.615 6.173 1.00 1.78 O ATOM 1383 OD2 ASP B 7 11.488 21.651 5.958 1.00 1.86 O ATOM 0 H ASP B 7 13.436 20.335 7.885 1.00 0.40 H new ATOM 0 HA ASP B 7 14.049 23.134 8.069 1.00 0.38 H new ATOM 0 HB2 ASP B 7 11.558 21.413 8.425 1.00 0.48 H new ATOM 0 HB3 ASP B 7 11.496 23.149 8.662 1.00 0.48 H new ATOM 1388 N VAL B 8 13.079 21.700 10.887 1.00 0.33 N ATOM 1389 CA VAL B 8 13.130 21.900 12.364 1.00 0.39 C ATOM 1390 C VAL B 8 14.585 21.979 12.830 1.00 0.36 C ATOM 1391 O VAL B 8 14.885 22.545 13.860 1.00 0.48 O ATOM 1392 CB VAL B 8 12.430 20.738 13.069 1.00 0.50 C ATOM 1393 CG1 VAL B 8 12.169 21.115 14.530 1.00 0.98 C ATOM 1394 CG2 VAL B 8 11.099 20.450 12.373 1.00 1.19 C ATOM 0 H VAL B 8 12.625 20.840 10.579 1.00 0.33 H new ATOM 0 HA VAL B 8 12.622 22.832 12.612 1.00 0.39 H new ATOM 0 HB VAL B 8 13.062 19.851 13.028 1.00 0.50 H new ATOM 0 HG11 VAL B 8 11.670 20.288 15.035 1.00 0.98 H new ATOM 0 HG12 VAL B 8 13.116 21.325 15.026 1.00 0.98 H new ATOM 0 HG13 VAL B 8 11.535 22.001 14.570 1.00 0.98 H new ATOM 0 HG21 VAL B 8 10.598 19.622 12.874 1.00 1.19 H new ATOM 0 HG22 VAL B 8 10.466 21.336 12.417 1.00 1.19 H new ATOM 0 HG23 VAL B 8 11.283 20.186 11.331 1.00 1.19 H new ATOM 1404 N PHE B 9 15.496 21.418 12.086 1.00 0.28 N ATOM 1405 CA PHE B 9 16.922 21.478 12.509 1.00 0.27 C ATOM 1406 C PHE B 9 17.381 22.938 12.514 1.00 0.25 C ATOM 1407 O PHE B 9 18.060 23.381 13.419 1.00 0.32 O ATOM 1408 CB PHE B 9 17.786 20.655 11.542 1.00 0.26 C ATOM 1409 CG PHE B 9 19.077 20.276 12.230 1.00 0.21 C ATOM 1410 CD1 PHE B 9 20.051 21.251 12.464 1.00 0.23 C ATOM 1411 CD2 PHE B 9 19.291 18.956 12.647 1.00 0.18 C ATOM 1412 CE1 PHE B 9 21.240 20.908 13.112 1.00 0.23 C ATOM 1413 CE2 PHE B 9 20.482 18.615 13.298 1.00 0.18 C ATOM 1414 CZ PHE B 9 21.455 19.593 13.529 1.00 0.20 C ATOM 0 H PHE B 9 15.318 20.925 11.211 1.00 0.28 H new ATOM 0 HA PHE B 9 17.027 21.062 13.511 1.00 0.27 H new ATOM 0 HB2 PHE B 9 17.250 19.759 11.229 1.00 0.26 H new ATOM 0 HB3 PHE B 9 17.996 21.232 10.641 1.00 0.26 H new ATOM 0 HD1 PHE B 9 19.884 22.269 12.144 1.00 0.23 H new ATOM 0 HD2 PHE B 9 18.538 18.203 12.466 1.00 0.18 H new ATOM 0 HE1 PHE B 9 21.994 21.661 13.291 1.00 0.23 H new ATOM 0 HE2 PHE B 9 20.650 17.598 13.622 1.00 0.18 H new ATOM 0 HZ PHE B 9 22.374 19.330 14.031 1.00 0.20 H new ATOM 1424 N LEU B 10 17.005 23.693 11.519 1.00 0.23 N ATOM 1425 CA LEU B 10 17.410 25.125 11.482 1.00 0.23 C ATOM 1426 C LEU B 10 16.661 25.872 12.585 1.00 0.24 C ATOM 1427 O LEU B 10 17.156 26.823 13.155 1.00 0.28 O ATOM 1428 CB LEU B 10 17.064 25.721 10.116 1.00 0.25 C ATOM 1429 CG LEU B 10 17.460 24.729 9.022 1.00 0.24 C ATOM 1430 CD1 LEU B 10 17.220 25.354 7.651 1.00 0.30 C ATOM 1431 CD2 LEU B 10 18.942 24.366 9.167 1.00 0.23 C ATOM 0 H LEU B 10 16.436 23.381 10.732 1.00 0.23 H new ATOM 0 HA LEU B 10 18.485 25.216 11.641 1.00 0.23 H new ATOM 0 HB2 LEU B 10 15.997 25.937 10.059 1.00 0.25 H new ATOM 0 HB3 LEU B 10 17.588 26.666 9.974 1.00 0.25 H new ATOM 0 HG LEU B 10 16.856 23.827 9.119 1.00 0.24 H new ATOM 0 HD11 LEU B 10 17.503 24.645 6.873 1.00 0.30 H new ATOM 0 HD12 LEU B 10 16.165 25.606 7.546 1.00 0.30 H new ATOM 0 HD13 LEU B 10 17.820 26.258 7.553 1.00 0.30 H new ATOM 0 HD21 LEU B 10 19.221 23.659 8.386 1.00 0.23 H new ATOM 0 HD22 LEU B 10 19.548 25.267 9.074 1.00 0.23 H new ATOM 0 HD23 LEU B 10 19.112 23.913 10.144 1.00 0.23 H new ATOM 1443 N ASP B 11 15.471 25.438 12.900 1.00 0.23 N ATOM 1444 CA ASP B 11 14.700 26.113 13.981 1.00 0.25 C ATOM 1445 C ASP B 11 15.528 26.075 15.267 1.00 0.22 C ATOM 1446 O ASP B 11 15.825 27.096 15.854 1.00 0.30 O ATOM 1447 CB ASP B 11 13.370 25.385 14.200 1.00 0.30 C ATOM 1448 CG ASP B 11 12.553 25.413 12.907 1.00 0.97 C ATOM 1449 OD1 ASP B 11 13.156 25.370 11.848 1.00 1.67 O ATOM 1450 OD2 ASP B 11 11.338 25.475 12.999 1.00 1.67 O ATOM 0 H ASP B 11 15.001 24.648 12.457 1.00 0.23 H new ATOM 0 HA ASP B 11 14.493 27.146 13.702 1.00 0.25 H new ATOM 0 HB2 ASP B 11 13.553 24.355 14.504 1.00 0.30 H new ATOM 0 HB3 ASP B 11 12.811 25.861 15.006 1.00 0.30 H new ATOM 1455 N TYR B 12 15.915 24.904 15.703 1.00 0.17 N ATOM 1456 CA TYR B 12 16.735 24.807 16.941 1.00 0.15 C ATOM 1457 C TYR B 12 17.942 25.736 16.810 1.00 0.16 C ATOM 1458 O TYR B 12 18.261 26.490 17.707 1.00 0.23 O ATOM 1459 CB TYR B 12 17.216 23.360 17.128 1.00 0.14 C ATOM 1460 CG TYR B 12 16.035 22.456 17.441 1.00 0.17 C ATOM 1461 CD1 TYR B 12 15.258 22.681 18.587 1.00 0.23 C ATOM 1462 CD2 TYR B 12 15.719 21.390 16.588 1.00 0.20 C ATOM 1463 CE1 TYR B 12 14.172 21.845 18.875 1.00 0.27 C ATOM 1464 CE2 TYR B 12 14.633 20.555 16.877 1.00 0.24 C ATOM 1465 CZ TYR B 12 13.860 20.782 18.020 1.00 0.27 C ATOM 1466 OH TYR B 12 12.790 19.959 18.305 1.00 0.32 O ATOM 0 H TYR B 12 15.698 24.014 15.254 1.00 0.17 H new ATOM 0 HA TYR B 12 16.137 25.099 17.804 1.00 0.15 H new ATOM 0 HB2 TYR B 12 17.719 23.016 16.224 1.00 0.14 H new ATOM 0 HB3 TYR B 12 17.945 23.312 17.936 1.00 0.14 H new ATOM 0 HD1 TYR B 12 15.498 23.500 19.248 1.00 0.23 H new ATOM 0 HD2 TYR B 12 16.315 21.212 15.705 1.00 0.20 H new ATOM 0 HE1 TYR B 12 13.575 22.021 19.758 1.00 0.27 H new ATOM 0 HE2 TYR B 12 14.392 19.735 16.217 1.00 0.24 H new ATOM 0 HH TYR B 12 12.711 19.272 17.610 1.00 0.32 H new ATOM 1476 N CYS B 13 18.610 25.690 15.692 1.00 0.19 N ATOM 1477 CA CYS B 13 19.790 26.571 15.488 1.00 0.24 C ATOM 1478 C CYS B 13 19.383 28.021 15.740 1.00 0.26 C ATOM 1479 O CYS B 13 20.081 28.769 16.397 1.00 0.33 O ATOM 1480 CB CYS B 13 20.290 26.427 14.050 1.00 0.30 C ATOM 1481 SG CYS B 13 20.933 24.756 13.791 1.00 1.27 S ATOM 0 H CYS B 13 18.387 25.077 14.908 1.00 0.19 H new ATOM 0 HA CYS B 13 20.584 26.287 16.179 1.00 0.24 H new ATOM 0 HB2 CYS B 13 19.478 26.627 13.351 1.00 0.30 H new ATOM 0 HB3 CYS B 13 21.070 27.162 13.851 1.00 0.30 H new ATOM 0 HG CYS B 13 19.944 23.936 13.596 1.00 1.27 H new ATOM 1487 N GLN B 14 18.255 28.423 15.226 1.00 0.24 N ATOM 1488 CA GLN B 14 17.795 29.823 15.436 1.00 0.27 C ATOM 1489 C GLN B 14 17.870 30.153 16.927 1.00 0.24 C ATOM 1490 O GLN B 14 18.351 31.198 17.319 1.00 0.29 O ATOM 1491 CB GLN B 14 16.352 29.963 14.948 1.00 0.32 C ATOM 1492 CG GLN B 14 15.972 31.443 14.907 1.00 0.62 C ATOM 1493 CD GLN B 14 14.601 31.602 14.246 1.00 0.88 C ATOM 1494 OE1 GLN B 14 13.639 30.986 14.661 1.00 1.69 O ATOM 1495 NE2 GLN B 14 14.469 32.407 13.227 1.00 1.44 N ATOM 0 H GLN B 14 17.630 27.841 14.668 1.00 0.24 H new ATOM 0 HA GLN B 14 18.430 30.510 14.877 1.00 0.27 H new ATOM 0 HB2 GLN B 14 16.247 29.522 13.957 1.00 0.32 H new ATOM 0 HB3 GLN B 14 15.678 29.421 15.611 1.00 0.32 H new ATOM 0 HG2 GLN B 14 15.950 31.851 15.917 1.00 0.62 H new ATOM 0 HG3 GLN B 14 16.722 32.006 14.352 1.00 0.62 H new ATOM 0 HE21 GLN B 14 15.276 32.924 12.878 1.00 1.44 H new ATOM 0 HE22 GLN B 14 13.559 32.519 12.780 1.00 1.44 H new ATOM 1504 N LYS B 15 17.409 29.263 17.762 1.00 0.23 N ATOM 1505 CA LYS B 15 17.466 29.519 19.227 1.00 0.23 C ATOM 1506 C LYS B 15 18.934 29.592 19.654 1.00 0.20 C ATOM 1507 O LYS B 15 19.391 30.584 20.184 1.00 0.23 O ATOM 1508 CB LYS B 15 16.768 28.378 19.967 1.00 0.24 C ATOM 1509 CG LYS B 15 15.293 28.342 19.562 1.00 0.55 C ATOM 1510 CD LYS B 15 14.652 27.045 20.065 1.00 1.19 C ATOM 1511 CE LYS B 15 14.581 27.056 21.596 1.00 1.47 C ATOM 1512 NZ LYS B 15 13.608 26.024 22.052 1.00 2.21 N ATOM 0 H LYS B 15 16.996 28.370 17.492 1.00 0.23 H new ATOM 0 HA LYS B 15 16.966 30.458 19.466 1.00 0.23 H new ATOM 0 HB2 LYS B 15 17.246 27.428 19.728 1.00 0.24 H new ATOM 0 HB3 LYS B 15 16.858 28.519 21.044 1.00 0.24 H new ATOM 0 HG2 LYS B 15 14.770 29.203 19.979 1.00 0.55 H new ATOM 0 HG3 LYS B 15 15.202 28.408 18.478 1.00 0.55 H new ATOM 0 HD2 LYS B 15 13.651 26.938 19.647 1.00 1.19 H new ATOM 0 HD3 LYS B 15 15.232 26.187 19.726 1.00 1.19 H new ATOM 0 HE2 LYS B 15 15.566 26.856 22.018 1.00 1.47 H new ATOM 0 HE3 LYS B 15 14.277 28.041 21.950 1.00 1.47 H new ATOM 0 HZ1 LYS B 15 13.558 26.029 23.091 1.00 2.21 H new ATOM 0 HZ2 LYS B 15 12.669 26.235 21.659 1.00 2.21 H new ATOM 0 HZ3 LYS B 15 13.918 25.087 21.725 1.00 2.21 H new ATOM 1526 N LEU B 16 19.679 28.550 19.410 1.00 0.18 N ATOM 1527 CA LEU B 16 21.123 28.549 19.778 1.00 0.17 C ATOM 1528 C LEU B 16 21.760 29.857 19.288 1.00 0.18 C ATOM 1529 O LEU B 16 22.772 30.300 19.793 1.00 0.23 O ATOM 1530 CB LEU B 16 21.795 27.335 19.091 1.00 0.15 C ATOM 1531 CG LEU B 16 22.773 26.631 20.045 1.00 0.15 C ATOM 1532 CD1 LEU B 16 22.001 25.882 21.157 1.00 0.25 C ATOM 1533 CD2 LEU B 16 23.628 25.652 19.230 1.00 0.18 C ATOM 0 H LEU B 16 19.347 27.693 18.968 1.00 0.18 H new ATOM 0 HA LEU B 16 21.251 28.476 20.858 1.00 0.17 H new ATOM 0 HB2 LEU B 16 21.031 26.630 18.763 1.00 0.15 H new ATOM 0 HB3 LEU B 16 22.327 27.666 18.199 1.00 0.15 H new ATOM 0 HG LEU B 16 23.415 27.369 20.526 1.00 0.15 H new ATOM 0 HD11 LEU B 16 22.709 25.389 21.823 1.00 0.25 H new ATOM 0 HD12 LEU B 16 21.402 26.593 21.726 1.00 0.25 H new ATOM 0 HD13 LEU B 16 21.347 25.135 20.706 1.00 0.25 H new ATOM 0 HD21 LEU B 16 24.329 25.143 19.892 1.00 0.18 H new ATOM 0 HD22 LEU B 16 22.982 24.917 18.751 1.00 0.18 H new ATOM 0 HD23 LEU B 16 24.182 26.200 18.468 1.00 0.18 H new ATOM 1545 N LEU B 17 21.178 30.459 18.290 1.00 0.17 N ATOM 1546 CA LEU B 17 21.740 31.719 17.735 1.00 0.19 C ATOM 1547 C LEU B 17 21.275 32.933 18.550 1.00 0.22 C ATOM 1548 O LEU B 17 22.074 33.678 19.081 1.00 0.30 O ATOM 1549 CB LEU B 17 21.255 31.861 16.289 1.00 0.19 C ATOM 1550 CG LEU B 17 22.130 32.879 15.530 1.00 0.22 C ATOM 1551 CD1 LEU B 17 23.378 32.182 14.971 1.00 0.14 C ATOM 1552 CD2 LEU B 17 21.338 33.482 14.362 1.00 0.33 C ATOM 0 H LEU B 17 20.329 30.128 17.831 1.00 0.17 H new ATOM 0 HA LEU B 17 22.828 31.679 17.778 1.00 0.19 H new ATOM 0 HB2 LEU B 17 21.293 30.893 15.788 1.00 0.19 H new ATOM 0 HB3 LEU B 17 20.214 32.185 16.277 1.00 0.19 H new ATOM 0 HG LEU B 17 22.426 33.668 16.222 1.00 0.22 H new ATOM 0 HD11 LEU B 17 23.991 32.907 14.436 1.00 0.14 H new ATOM 0 HD12 LEU B 17 23.954 31.755 15.792 1.00 0.14 H new ATOM 0 HD13 LEU B 17 23.076 31.388 14.288 1.00 0.14 H new ATOM 0 HD21 LEU B 17 21.963 34.200 13.831 1.00 0.33 H new ATOM 0 HD22 LEU B 17 21.036 32.688 13.679 1.00 0.33 H new ATOM 0 HD23 LEU B 17 20.451 33.987 14.746 1.00 0.33 H new ATOM 1564 N GLU B 18 19.993 33.151 18.631 1.00 0.20 N ATOM 1565 CA GLU B 18 19.480 34.330 19.385 1.00 0.24 C ATOM 1566 C GLU B 18 19.939 34.272 20.847 1.00 0.22 C ATOM 1567 O GLU B 18 20.274 35.279 21.439 1.00 0.26 O ATOM 1568 CB GLU B 18 17.945 34.351 19.308 1.00 0.30 C ATOM 1569 CG GLU B 18 17.343 33.318 20.272 1.00 1.05 C ATOM 1570 CD GLU B 18 15.908 32.989 19.851 1.00 1.67 C ATOM 1571 OE1 GLU B 18 15.383 33.697 19.007 1.00 2.29 O ATOM 1572 OE2 GLU B 18 15.360 32.036 20.379 1.00 2.17 O ATOM 0 H GLU B 18 19.276 32.563 18.207 1.00 0.20 H new ATOM 0 HA GLU B 18 19.877 35.242 18.940 1.00 0.24 H new ATOM 0 HB2 GLU B 18 17.576 35.346 19.556 1.00 0.30 H new ATOM 0 HB3 GLU B 18 17.623 34.137 18.289 1.00 0.30 H new ATOM 0 HG2 GLU B 18 17.948 32.412 20.272 1.00 1.05 H new ATOM 0 HG3 GLU B 18 17.353 33.708 21.290 1.00 1.05 H new ATOM 1579 N LYS B 19 19.951 33.109 21.436 1.00 0.19 N ATOM 1580 CA LYS B 19 20.380 33.003 22.858 1.00 0.20 C ATOM 1581 C LYS B 19 21.800 33.567 22.996 1.00 0.19 C ATOM 1582 O LYS B 19 22.064 34.412 23.828 1.00 0.26 O ATOM 1583 CB LYS B 19 20.332 31.514 23.285 1.00 0.21 C ATOM 1584 CG LYS B 19 19.435 31.331 24.520 1.00 0.29 C ATOM 1585 CD LYS B 19 19.397 29.848 24.917 1.00 0.33 C ATOM 1586 CE LYS B 19 18.163 29.573 25.780 1.00 0.95 C ATOM 1587 NZ LYS B 19 18.104 30.559 26.896 1.00 1.68 N ATOM 0 H LYS B 19 19.683 32.229 20.995 1.00 0.19 H new ATOM 0 HA LYS B 19 19.715 33.575 23.504 1.00 0.20 H new ATOM 0 HB2 LYS B 19 19.955 30.907 22.462 1.00 0.21 H new ATOM 0 HB3 LYS B 19 21.339 31.161 23.506 1.00 0.21 H new ATOM 0 HG2 LYS B 19 19.814 31.930 25.348 1.00 0.29 H new ATOM 0 HG3 LYS B 19 18.427 31.686 24.305 1.00 0.29 H new ATOM 0 HD2 LYS B 19 19.374 29.224 24.024 1.00 0.33 H new ATOM 0 HD3 LYS B 19 20.302 29.586 25.466 1.00 0.33 H new ATOM 0 HE2 LYS B 19 17.260 29.641 25.173 1.00 0.95 H new ATOM 0 HE3 LYS B 19 18.204 28.559 26.179 1.00 0.95 H new ATOM 0 HZ1 LYS B 19 17.496 30.189 27.654 1.00 1.68 H new ATOM 0 HZ2 LYS B 19 19.062 30.720 27.268 1.00 1.68 H new ATOM 0 HZ3 LYS B 19 17.713 31.457 26.546 1.00 1.68 H new ATOM 1601 N PHE B 20 22.710 33.111 22.184 1.00 0.15 N ATOM 1602 CA PHE B 20 24.101 33.622 22.260 1.00 0.15 C ATOM 1603 C PHE B 20 24.178 34.957 21.515 1.00 0.16 C ATOM 1604 O PHE B 20 25.236 35.530 21.344 1.00 0.25 O ATOM 1605 CB PHE B 20 25.032 32.603 21.611 1.00 0.14 C ATOM 1606 CG PHE B 20 25.196 31.412 22.529 1.00 0.13 C ATOM 1607 CD1 PHE B 20 24.161 30.475 22.632 1.00 0.14 C ATOM 1608 CD2 PHE B 20 26.374 31.237 23.275 1.00 0.14 C ATOM 1609 CE1 PHE B 20 24.297 29.367 23.473 1.00 0.14 C ATOM 1610 CE2 PHE B 20 26.507 30.125 24.117 1.00 0.15 C ATOM 1611 CZ PHE B 20 25.469 29.191 24.215 1.00 0.14 C ATOM 0 H PHE B 20 22.547 32.403 21.468 1.00 0.15 H new ATOM 0 HA PHE B 20 24.399 33.773 23.298 1.00 0.15 H new ATOM 0 HB2 PHE B 20 24.626 32.283 20.652 1.00 0.14 H new ATOM 0 HB3 PHE B 20 26.002 33.057 21.410 1.00 0.14 H new ATOM 0 HD1 PHE B 20 23.255 30.609 22.060 1.00 0.14 H new ATOM 0 HD2 PHE B 20 27.175 31.958 23.200 1.00 0.14 H new ATOM 0 HE1 PHE B 20 23.496 28.646 23.550 1.00 0.14 H new ATOM 0 HE2 PHE B 20 27.411 29.988 24.691 1.00 0.15 H new ATOM 0 HZ PHE B 20 25.573 28.334 24.864 1.00 0.14 H new ATOM 1621 N ARG B 21 23.050 35.458 21.082 1.00 0.15 N ATOM 1622 CA ARG B 21 23.023 36.764 20.357 1.00 0.17 C ATOM 1623 C ARG B 21 24.018 36.762 19.187 1.00 0.14 C ATOM 1624 O ARG B 21 24.673 37.753 18.929 1.00 0.18 O ATOM 1625 CB ARG B 21 23.396 37.892 21.332 1.00 0.23 C ATOM 1626 CG ARG B 21 22.241 38.152 22.328 1.00 0.58 C ATOM 1627 CD ARG B 21 21.334 39.284 21.815 1.00 1.16 C ATOM 1628 NE ARG B 21 21.260 39.238 20.328 1.00 1.87 N ATOM 1629 CZ ARG B 21 20.316 39.891 19.705 1.00 2.62 C ATOM 1630 NH1 ARG B 21 19.444 40.583 20.386 1.00 2.94 N ATOM 1631 NH2 ARG B 21 20.246 39.855 18.402 1.00 3.56 N ATOM 0 H ARG B 21 22.139 35.015 21.201 1.00 0.15 H new ATOM 0 HA ARG B 21 22.019 36.920 19.962 1.00 0.17 H new ATOM 0 HB2 ARG B 21 24.301 37.625 21.877 1.00 0.23 H new ATOM 0 HB3 ARG B 21 23.616 38.803 20.776 1.00 0.23 H new ATOM 0 HG2 ARG B 21 21.656 37.242 22.462 1.00 0.58 H new ATOM 0 HG3 ARG B 21 22.647 38.417 23.304 1.00 0.58 H new ATOM 0 HD2 ARG B 21 20.336 39.184 22.241 1.00 1.16 H new ATOM 0 HD3 ARG B 21 21.723 40.249 22.139 1.00 1.16 H new ATOM 0 HE ARG B 21 21.944 38.698 19.798 1.00 1.87 H new ATOM 0 HH11 ARG B 21 19.500 40.614 21.404 1.00 2.94 H new ATOM 0 HH12 ARG B 21 18.706 41.093 19.900 1.00 2.94 H new ATOM 0 HH21 ARG B 21 20.929 39.316 17.869 1.00 3.56 H new ATOM 0 HH22 ARG B 21 19.508 40.365 17.917 1.00 3.56 H new ATOM 1645 N TYR B 22 24.143 35.673 18.468 1.00 0.14 N ATOM 1646 CA TYR B 22 25.103 35.652 17.319 1.00 0.13 C ATOM 1647 C TYR B 22 24.399 36.213 16.056 1.00 0.15 C ATOM 1648 O TYR B 22 23.197 36.084 15.934 1.00 0.16 O ATOM 1649 CB TYR B 22 25.536 34.201 17.035 1.00 0.12 C ATOM 1650 CG TYR B 22 26.683 33.769 17.944 1.00 0.13 C ATOM 1651 CD1 TYR B 22 27.877 34.515 18.018 1.00 0.14 C ATOM 1652 CD2 TYR B 22 26.550 32.604 18.714 1.00 0.14 C ATOM 1653 CE1 TYR B 22 28.916 34.093 18.856 1.00 0.17 C ATOM 1654 CE2 TYR B 22 27.592 32.187 19.549 1.00 0.17 C ATOM 1655 CZ TYR B 22 28.773 32.931 19.620 1.00 0.18 C ATOM 1656 OH TYR B 22 29.800 32.519 20.443 1.00 0.21 O ATOM 0 H TYR B 22 23.628 34.806 18.624 1.00 0.14 H new ATOM 0 HA TYR B 22 25.974 36.258 17.567 1.00 0.13 H new ATOM 0 HB2 TYR B 22 24.687 33.533 17.177 1.00 0.12 H new ATOM 0 HB3 TYR B 22 25.842 34.109 15.993 1.00 0.12 H new ATOM 0 HD1 TYR B 22 27.990 35.412 17.428 1.00 0.14 H new ATOM 0 HD2 TYR B 22 25.639 32.026 18.662 1.00 0.14 H new ATOM 0 HE1 TYR B 22 29.830 34.666 18.912 1.00 0.17 H new ATOM 0 HE2 TYR B 22 27.484 31.289 20.139 1.00 0.17 H new ATOM 0 HH TYR B 22 30.642 32.521 19.941 1.00 0.21 H new ATOM 1666 N PRO B 23 25.156 36.796 15.132 1.00 0.16 N ATOM 1667 CA PRO B 23 24.574 37.329 13.882 1.00 0.18 C ATOM 1668 C PRO B 23 23.966 36.181 13.054 1.00 0.19 C ATOM 1669 O PRO B 23 24.048 35.026 13.418 1.00 0.19 O ATOM 1670 CB PRO B 23 25.754 37.989 13.136 1.00 0.19 C ATOM 1671 CG PRO B 23 27.048 37.644 13.921 1.00 0.17 C ATOM 1672 CD PRO B 23 26.620 36.981 15.250 1.00 0.15 C ATOM 0 HA PRO B 23 23.771 38.043 14.066 1.00 0.18 H new ATOM 0 HB2 PRO B 23 25.816 37.620 12.112 1.00 0.19 H new ATOM 0 HB3 PRO B 23 25.616 39.069 13.078 1.00 0.19 H new ATOM 0 HG2 PRO B 23 27.680 36.970 13.342 1.00 0.17 H new ATOM 0 HG3 PRO B 23 27.632 38.544 14.112 1.00 0.17 H new ATOM 0 HD2 PRO B 23 27.128 36.028 15.397 1.00 0.15 H new ATOM 0 HD3 PRO B 23 26.871 37.611 16.104 1.00 0.15 H new ATOM 1680 N TRP B 24 23.350 36.506 11.949 1.00 0.22 N ATOM 1681 CA TRP B 24 22.715 35.458 11.089 1.00 0.24 C ATOM 1682 C TRP B 24 23.759 34.733 10.226 1.00 0.25 C ATOM 1683 O TRP B 24 23.477 33.701 9.649 1.00 0.34 O ATOM 1684 CB TRP B 24 21.677 36.128 10.180 1.00 0.28 C ATOM 1685 CG TRP B 24 21.129 35.131 9.207 1.00 0.53 C ATOM 1686 CD1 TRP B 24 21.456 35.069 7.895 1.00 1.45 C ATOM 1687 CD2 TRP B 24 20.169 34.059 9.440 1.00 0.35 C ATOM 1688 NE1 TRP B 24 20.758 34.029 7.309 1.00 1.68 N ATOM 1689 CE2 TRP B 24 19.952 33.377 8.220 1.00 0.93 C ATOM 1690 CE3 TRP B 24 19.473 33.618 10.580 1.00 0.96 C ATOM 1691 CZ2 TRP B 24 19.075 32.295 8.133 1.00 0.85 C ATOM 1692 CZ3 TRP B 24 18.590 32.528 10.496 1.00 1.15 C ATOM 1693 CH2 TRP B 24 18.392 31.869 9.274 1.00 0.63 C ATOM 0 H TRP B 24 23.257 37.460 11.600 1.00 0.22 H new ATOM 0 HA TRP B 24 22.240 34.719 11.734 1.00 0.24 H new ATOM 0 HB2 TRP B 24 20.869 36.543 10.782 1.00 0.28 H new ATOM 0 HB3 TRP B 24 22.134 36.959 9.643 1.00 0.28 H new ATOM 0 HD1 TRP B 24 22.149 35.725 7.389 1.00 1.45 H new ATOM 0 HE1 TRP B 24 20.830 33.775 6.324 1.00 1.68 H new ATOM 0 HE3 TRP B 24 19.618 34.120 11.525 1.00 0.96 H new ATOM 0 HZ2 TRP B 24 18.926 31.791 7.190 1.00 0.85 H new ATOM 0 HZ3 TRP B 24 18.061 32.196 11.377 1.00 1.15 H new ATOM 0 HH2 TRP B 24 17.712 31.032 9.215 1.00 0.63 H new ATOM 1704 N GLU B 25 24.948 35.257 10.105 1.00 0.21 N ATOM 1705 CA GLU B 25 25.968 34.577 9.247 1.00 0.24 C ATOM 1706 C GLU B 25 26.576 33.368 9.980 1.00 0.21 C ATOM 1707 O GLU B 25 27.239 32.549 9.375 1.00 0.24 O ATOM 1708 CB GLU B 25 27.078 35.577 8.869 1.00 0.31 C ATOM 1709 CG GLU B 25 27.257 36.603 9.992 1.00 1.20 C ATOM 1710 CD GLU B 25 28.617 37.292 9.853 1.00 1.43 C ATOM 1711 OE1 GLU B 25 29.186 37.225 8.776 1.00 1.99 O ATOM 1712 OE2 GLU B 25 29.067 37.875 10.826 1.00 1.86 O ATOM 0 H GLU B 25 25.258 36.117 10.557 1.00 0.21 H new ATOM 0 HA GLU B 25 25.479 34.219 8.341 1.00 0.24 H new ATOM 0 HB2 GLU B 25 28.014 35.047 8.696 1.00 0.31 H new ATOM 0 HB3 GLU B 25 26.822 36.084 7.938 1.00 0.31 H new ATOM 0 HG2 GLU B 25 26.458 37.343 9.951 1.00 1.20 H new ATOM 0 HG3 GLU B 25 27.186 36.110 10.962 1.00 1.20 H new ATOM 1719 N LEU B 26 26.375 33.245 11.269 1.00 0.16 N ATOM 1720 CA LEU B 26 26.968 32.082 12.009 1.00 0.15 C ATOM 1721 C LEU B 26 25.961 30.936 12.116 1.00 0.15 C ATOM 1722 O LEU B 26 26.012 30.147 13.036 1.00 0.19 O ATOM 1723 CB LEU B 26 27.369 32.517 13.417 1.00 0.13 C ATOM 1724 CG LEU B 26 28.169 33.822 13.363 1.00 0.13 C ATOM 1725 CD1 LEU B 26 28.801 34.070 14.732 1.00 0.14 C ATOM 1726 CD2 LEU B 26 29.275 33.724 12.304 1.00 0.14 C ATOM 0 H LEU B 26 25.831 33.893 11.839 1.00 0.16 H new ATOM 0 HA LEU B 26 27.843 31.739 11.457 1.00 0.15 H new ATOM 0 HB2 LEU B 26 26.478 32.654 14.030 1.00 0.13 H new ATOM 0 HB3 LEU B 26 27.965 31.737 13.890 1.00 0.13 H new ATOM 0 HG LEU B 26 27.502 34.643 13.100 1.00 0.13 H new ATOM 0 HD11 LEU B 26 29.374 34.997 14.706 1.00 0.14 H new ATOM 0 HD12 LEU B 26 28.017 34.149 15.486 1.00 0.14 H new ATOM 0 HD13 LEU B 26 29.463 33.241 14.982 1.00 0.14 H new ATOM 0 HD21 LEU B 26 29.836 34.658 12.276 1.00 0.14 H new ATOM 0 HD22 LEU B 26 29.948 32.904 12.555 1.00 0.14 H new ATOM 0 HD23 LEU B 26 28.828 33.540 11.327 1.00 0.14 H new ATOM 1738 N MET B 27 25.057 30.818 11.185 1.00 0.15 N ATOM 1739 CA MET B 27 24.081 29.704 11.260 1.00 0.17 C ATOM 1740 C MET B 27 24.774 28.348 10.949 1.00 0.14 C ATOM 1741 O MET B 27 24.444 27.361 11.575 1.00 0.19 O ATOM 1742 CB MET B 27 22.910 29.966 10.285 1.00 0.20 C ATOM 1743 CG MET B 27 21.814 30.774 10.990 1.00 0.39 C ATOM 1744 SD MET B 27 20.910 29.697 12.126 1.00 1.31 S ATOM 1745 CE MET B 27 19.711 29.073 10.925 1.00 0.45 C ATOM 0 H MET B 27 24.954 31.440 10.383 1.00 0.15 H new ATOM 0 HA MET B 27 23.683 29.649 12.273 1.00 0.17 H new ATOM 0 HB2 MET B 27 23.268 30.509 9.410 1.00 0.20 H new ATOM 0 HB3 MET B 27 22.504 29.020 9.928 1.00 0.20 H new ATOM 0 HG2 MET B 27 22.256 31.608 11.536 1.00 0.39 H new ATOM 0 HG3 MET B 27 21.131 31.200 10.255 1.00 0.39 H new ATOM 0 HE1 MET B 27 18.759 29.586 11.061 1.00 0.45 H new ATOM 0 HE2 MET B 27 20.080 29.254 9.915 1.00 0.45 H new ATOM 0 HE3 MET B 27 19.570 28.002 11.074 1.00 0.45 H new ATOM 1755 N PRO B 28 25.714 28.309 10.008 1.00 0.09 N ATOM 1756 CA PRO B 28 26.411 27.044 9.674 1.00 0.09 C ATOM 1757 C PRO B 28 27.129 26.472 10.908 1.00 0.09 C ATOM 1758 O PRO B 28 27.324 25.279 11.019 1.00 0.14 O ATOM 1759 CB PRO B 28 27.413 27.432 8.562 1.00 0.10 C ATOM 1760 CG PRO B 28 27.022 28.855 8.088 1.00 0.12 C ATOM 1761 CD PRO B 28 26.155 29.470 9.200 1.00 0.12 C ATOM 0 HA PRO B 28 25.724 26.264 9.345 1.00 0.09 H new ATOM 0 HB2 PRO B 28 28.435 27.417 8.940 1.00 0.10 H new ATOM 0 HB3 PRO B 28 27.368 26.723 7.736 1.00 0.10 H new ATOM 0 HG2 PRO B 28 27.910 29.461 7.910 1.00 0.12 H new ATOM 0 HG3 PRO B 28 26.472 28.812 7.148 1.00 0.12 H new ATOM 0 HD2 PRO B 28 26.724 30.179 9.801 1.00 0.12 H new ATOM 0 HD3 PRO B 28 25.305 30.012 8.787 1.00 0.12 H new ATOM 1769 N LEU B 29 27.519 27.302 11.835 1.00 0.10 N ATOM 1770 CA LEU B 29 28.210 26.777 13.048 1.00 0.09 C ATOM 1771 C LEU B 29 27.156 26.233 14.011 1.00 0.10 C ATOM 1772 O LEU B 29 27.304 25.162 14.567 1.00 0.16 O ATOM 1773 CB LEU B 29 29.008 27.896 13.717 1.00 0.08 C ATOM 1774 CG LEU B 29 29.837 28.626 12.658 1.00 0.09 C ATOM 1775 CD1 LEU B 29 30.707 29.688 13.335 1.00 0.12 C ATOM 1776 CD2 LEU B 29 30.728 27.616 11.915 1.00 0.09 C ATOM 0 H LEU B 29 27.391 28.314 11.807 1.00 0.10 H new ATOM 0 HA LEU B 29 28.900 25.981 12.769 1.00 0.09 H new ATOM 0 HB2 LEU B 29 28.333 28.594 14.212 1.00 0.08 H new ATOM 0 HB3 LEU B 29 29.661 27.483 14.486 1.00 0.08 H new ATOM 0 HG LEU B 29 29.172 29.109 11.943 1.00 0.09 H new ATOM 0 HD11 LEU B 29 31.298 30.209 12.581 1.00 0.12 H new ATOM 0 HD12 LEU B 29 30.070 30.404 13.854 1.00 0.12 H new ATOM 0 HD13 LEU B 29 31.374 29.209 14.052 1.00 0.12 H new ATOM 0 HD21 LEU B 29 31.318 28.137 11.161 1.00 0.09 H new ATOM 0 HD22 LEU B 29 31.396 27.129 12.625 1.00 0.09 H new ATOM 0 HD23 LEU B 29 30.102 26.866 11.432 1.00 0.09 H new ATOM 1788 N MET B 30 26.080 26.947 14.192 1.00 0.10 N ATOM 1789 CA MET B 30 25.008 26.452 15.092 1.00 0.12 C ATOM 1790 C MET B 30 24.439 25.174 14.480 1.00 0.10 C ATOM 1791 O MET B 30 23.782 24.387 15.133 1.00 0.13 O ATOM 1792 CB MET B 30 23.902 27.506 15.192 1.00 0.16 C ATOM 1793 CG MET B 30 24.333 28.617 16.149 1.00 0.19 C ATOM 1794 SD MET B 30 25.915 29.307 15.599 1.00 1.23 S ATOM 1795 CE MET B 30 26.691 29.458 17.226 1.00 0.22 C ATOM 0 H MET B 30 25.899 27.851 13.755 1.00 0.10 H new ATOM 0 HA MET B 30 25.403 26.256 16.089 1.00 0.12 H new ATOM 0 HB2 MET B 30 23.693 27.923 14.207 1.00 0.16 H new ATOM 0 HB3 MET B 30 22.979 27.046 15.546 1.00 0.16 H new ATOM 0 HG2 MET B 30 23.574 29.399 16.181 1.00 0.19 H new ATOM 0 HG3 MET B 30 24.428 28.224 17.161 1.00 0.19 H new ATOM 0 HE1 MET B 30 27.576 30.090 17.150 1.00 0.22 H new ATOM 0 HE2 MET B 30 25.985 29.905 17.926 1.00 0.22 H new ATOM 0 HE3 MET B 30 26.981 28.470 17.584 1.00 0.22 H new ATOM 1805 N TYR B 31 24.690 24.976 13.214 1.00 0.08 N ATOM 1806 CA TYR B 31 24.176 23.766 12.518 1.00 0.08 C ATOM 1807 C TYR B 31 25.035 22.549 12.885 1.00 0.08 C ATOM 1808 O TYR B 31 24.526 21.506 13.246 1.00 0.09 O ATOM 1809 CB TYR B 31 24.231 24.005 11.004 1.00 0.09 C ATOM 1810 CG TYR B 31 23.906 22.731 10.262 1.00 0.09 C ATOM 1811 CD1 TYR B 31 22.577 22.422 9.953 1.00 0.10 C ATOM 1812 CD2 TYR B 31 24.936 21.865 9.877 1.00 0.10 C ATOM 1813 CE1 TYR B 31 22.277 21.243 9.259 1.00 0.11 C ATOM 1814 CE2 TYR B 31 24.638 20.688 9.183 1.00 0.11 C ATOM 1815 CZ TYR B 31 23.307 20.376 8.874 1.00 0.11 C ATOM 1816 OH TYR B 31 23.012 19.215 8.190 1.00 0.13 O ATOM 0 H TYR B 31 25.235 25.609 12.628 1.00 0.08 H new ATOM 0 HA TYR B 31 23.148 23.574 12.824 1.00 0.08 H new ATOM 0 HB2 TYR B 31 23.524 24.787 10.726 1.00 0.09 H new ATOM 0 HB3 TYR B 31 25.223 24.357 10.720 1.00 0.09 H new ATOM 0 HD1 TYR B 31 21.783 23.092 10.249 1.00 0.10 H new ATOM 0 HD2 TYR B 31 25.961 22.106 10.116 1.00 0.10 H new ATOM 0 HE1 TYR B 31 21.251 21.003 9.021 1.00 0.11 H new ATOM 0 HE2 TYR B 31 25.433 20.020 8.885 1.00 0.11 H new ATOM 0 HH TYR B 31 23.841 18.729 7.998 1.00 0.13 H new ATOM 1826 N VAL B 32 26.332 22.670 12.792 1.00 0.08 N ATOM 1827 CA VAL B 32 27.217 21.517 13.130 1.00 0.08 C ATOM 1828 C VAL B 32 27.116 21.209 14.628 1.00 0.08 C ATOM 1829 O VAL B 32 26.892 20.084 15.023 1.00 0.10 O ATOM 1830 CB VAL B 32 28.665 21.860 12.769 1.00 0.08 C ATOM 1831 CG1 VAL B 32 29.573 20.671 13.105 1.00 0.08 C ATOM 1832 CG2 VAL B 32 28.757 22.173 11.269 1.00 0.08 C ATOM 0 H VAL B 32 26.817 23.517 12.497 1.00 0.08 H new ATOM 0 HA VAL B 32 26.901 20.641 12.563 1.00 0.08 H new ATOM 0 HB VAL B 32 28.986 22.731 13.341 1.00 0.08 H new ATOM 0 HG11 VAL B 32 30.603 20.916 12.848 1.00 0.08 H new ATOM 0 HG12 VAL B 32 29.507 20.453 14.171 1.00 0.08 H new ATOM 0 HG13 VAL B 32 29.255 19.798 12.536 1.00 0.08 H new ATOM 0 HG21 VAL B 32 29.787 22.417 11.011 1.00 0.08 H new ATOM 0 HG22 VAL B 32 28.436 21.304 10.696 1.00 0.08 H new ATOM 0 HG23 VAL B 32 28.113 23.021 11.034 1.00 0.08 H new ATOM 1842 N ILE B 33 27.282 22.196 15.467 1.00 0.08 N ATOM 1843 CA ILE B 33 27.195 21.949 16.935 1.00 0.08 C ATOM 1844 C ILE B 33 25.955 21.086 17.246 1.00 0.09 C ATOM 1845 O ILE B 33 26.057 20.054 17.878 1.00 0.10 O ATOM 1846 CB ILE B 33 27.131 23.303 17.654 1.00 0.08 C ATOM 1847 CG1 ILE B 33 28.507 23.974 17.559 1.00 0.09 C ATOM 1848 CG2 ILE B 33 26.771 23.104 19.124 1.00 0.09 C ATOM 1849 CD1 ILE B 33 28.433 25.427 18.044 1.00 0.08 C ATOM 0 H ILE B 33 27.474 23.161 15.200 1.00 0.08 H new ATOM 0 HA ILE B 33 28.072 21.405 17.285 1.00 0.08 H new ATOM 0 HB ILE B 33 26.369 23.926 17.185 1.00 0.08 H new ATOM 0 HG12 ILE B 33 29.230 23.421 18.159 1.00 0.09 H new ATOM 0 HG13 ILE B 33 28.861 23.946 16.528 1.00 0.09 H new ATOM 0 HG21 ILE B 33 26.729 24.072 19.623 1.00 0.09 H new ATOM 0 HG22 ILE B 33 25.799 22.615 19.198 1.00 0.09 H new ATOM 0 HG23 ILE B 33 27.527 22.482 19.603 1.00 0.09 H new ATOM 0 HD11 ILE B 33 29.419 25.886 17.969 1.00 0.08 H new ATOM 0 HD12 ILE B 33 27.727 25.981 17.426 1.00 0.08 H new ATOM 0 HD13 ILE B 33 28.101 25.448 19.082 1.00 0.08 H new ATOM 1861 N LEU B 34 24.792 21.482 16.788 1.00 0.08 N ATOM 1862 CA LEU B 34 23.561 20.664 17.038 1.00 0.09 C ATOM 1863 C LEU B 34 23.727 19.288 16.354 1.00 0.12 C ATOM 1864 O LEU B 34 23.128 18.313 16.758 1.00 0.16 O ATOM 1865 CB LEU B 34 22.340 21.419 16.426 1.00 0.10 C ATOM 1866 CG LEU B 34 21.412 22.146 17.472 1.00 0.10 C ATOM 1867 CD1 LEU B 34 22.090 22.418 18.826 1.00 0.10 C ATOM 1868 CD2 LEU B 34 20.951 23.486 16.882 1.00 0.11 C ATOM 0 H LEU B 34 24.641 22.336 16.252 1.00 0.08 H new ATOM 0 HA LEU B 34 23.405 20.515 18.107 1.00 0.09 H new ATOM 0 HB2 LEU B 34 22.709 22.158 15.715 1.00 0.10 H new ATOM 0 HB3 LEU B 34 21.738 20.707 15.862 1.00 0.10 H new ATOM 0 HG LEU B 34 20.577 21.472 17.664 1.00 0.10 H new ATOM 0 HD11 LEU B 34 21.387 22.920 19.491 1.00 0.10 H new ATOM 0 HD12 LEU B 34 22.401 21.474 19.273 1.00 0.10 H new ATOM 0 HD13 LEU B 34 22.963 23.053 18.675 1.00 0.10 H new ATOM 0 HD21 LEU B 34 20.308 23.997 17.599 1.00 0.11 H new ATOM 0 HD22 LEU B 34 21.820 24.107 16.667 1.00 0.11 H new ATOM 0 HD23 LEU B 34 20.397 23.306 15.961 1.00 0.11 H new ATOM 1880 N LYS B 35 24.523 19.201 15.323 1.00 0.13 N ATOM 1881 CA LYS B 35 24.698 17.888 14.629 1.00 0.17 C ATOM 1882 C LYS B 35 25.323 16.860 15.575 1.00 0.19 C ATOM 1883 O LYS B 35 24.932 15.709 15.593 1.00 0.28 O ATOM 1884 CB LYS B 35 25.599 18.065 13.402 1.00 0.16 C ATOM 1885 CG LYS B 35 25.474 16.835 12.481 1.00 0.19 C ATOM 1886 CD LYS B 35 24.295 17.008 11.514 1.00 0.26 C ATOM 1887 CE LYS B 35 24.256 15.827 10.543 1.00 0.70 C ATOM 1888 NZ LYS B 35 23.924 14.581 11.291 1.00 1.58 N ATOM 0 H LYS B 35 25.058 19.976 14.931 1.00 0.13 H new ATOM 0 HA LYS B 35 23.718 17.529 14.315 1.00 0.17 H new ATOM 0 HB2 LYS B 35 25.317 18.967 12.859 1.00 0.16 H new ATOM 0 HB3 LYS B 35 26.635 18.192 13.716 1.00 0.16 H new ATOM 0 HG2 LYS B 35 26.397 16.699 11.918 1.00 0.19 H new ATOM 0 HG3 LYS B 35 25.331 15.936 13.081 1.00 0.19 H new ATOM 0 HD2 LYS B 35 23.360 17.066 12.071 1.00 0.26 H new ATOM 0 HD3 LYS B 35 24.397 17.943 10.963 1.00 0.26 H new ATOM 0 HE2 LYS B 35 23.514 16.006 9.765 1.00 0.70 H new ATOM 0 HE3 LYS B 35 25.220 15.719 10.045 1.00 0.70 H new ATOM 0 HZ1 LYS B 35 23.632 13.841 10.621 1.00 1.58 H new ATOM 0 HZ2 LYS B 35 24.760 14.260 11.819 1.00 1.58 H new ATOM 0 HZ3 LYS B 35 23.147 14.772 11.956 1.00 1.58 H new ATOM 1902 N ASP B 36 26.294 17.249 16.354 1.00 0.23 N ATOM 1903 CA ASP B 36 26.939 16.273 17.282 1.00 0.28 C ATOM 1904 C ASP B 36 26.173 16.211 18.605 1.00 0.26 C ATOM 1905 O ASP B 36 26.081 15.173 19.229 1.00 0.39 O ATOM 1906 CB ASP B 36 28.379 16.702 17.550 1.00 0.34 C ATOM 1907 CG ASP B 36 29.066 17.035 16.224 1.00 1.23 C ATOM 1908 OD1 ASP B 36 28.847 18.126 15.723 1.00 1.92 O ATOM 1909 OD2 ASP B 36 29.799 16.193 15.732 1.00 1.96 O ATOM 0 H ASP B 36 26.669 18.197 16.390 1.00 0.23 H new ATOM 0 HA ASP B 36 26.927 15.286 16.820 1.00 0.28 H new ATOM 0 HB2 ASP B 36 28.395 17.571 18.208 1.00 0.34 H new ATOM 0 HB3 ASP B 36 28.918 15.905 18.061 1.00 0.34 H new ATOM 1914 N ALA B 37 25.632 17.312 19.045 1.00 0.21 N ATOM 1915 CA ALA B 37 24.887 17.308 20.334 1.00 0.21 C ATOM 1916 C ALA B 37 23.507 16.695 20.134 1.00 0.20 C ATOM 1917 O ALA B 37 22.554 17.071 20.787 1.00 0.24 O ATOM 1918 CB ALA B 37 24.721 18.743 20.818 1.00 0.22 C ATOM 0 H ALA B 37 25.673 18.213 18.569 1.00 0.21 H new ATOM 0 HA ALA B 37 25.442 16.723 21.067 1.00 0.21 H new ATOM 0 HB1 ALA B 37 24.176 18.748 21.762 1.00 0.22 H new ATOM 0 HB2 ALA B 37 25.703 19.194 20.963 1.00 0.22 H new ATOM 0 HB3 ALA B 37 24.165 19.315 20.075 1.00 0.22 H new ATOM 1924 N ASP B 38 23.376 15.765 19.234 1.00 0.20 N ATOM 1925 CA ASP B 38 22.040 15.161 19.008 1.00 0.21 C ATOM 1926 C ASP B 38 21.049 16.293 18.736 1.00 0.18 C ATOM 1927 O ASP B 38 19.851 16.143 18.869 1.00 0.21 O ATOM 1928 CB ASP B 38 21.621 14.381 20.263 1.00 0.28 C ATOM 1929 CG ASP B 38 20.591 13.311 19.893 1.00 1.00 C ATOM 1930 OD1 ASP B 38 19.464 13.677 19.602 1.00 1.59 O ATOM 1931 OD2 ASP B 38 20.946 12.144 19.908 1.00 1.86 O ATOM 0 H ASP B 38 24.129 15.400 18.651 1.00 0.20 H new ATOM 0 HA ASP B 38 22.062 14.476 18.160 1.00 0.21 H new ATOM 0 HB2 ASP B 38 22.494 13.915 20.720 1.00 0.28 H new ATOM 0 HB3 ASP B 38 21.200 15.063 21.002 1.00 0.28 H new ATOM 1936 N ALA B 39 21.565 17.430 18.367 1.00 0.14 N ATOM 1937 CA ALA B 39 20.706 18.606 18.089 1.00 0.14 C ATOM 1938 C ALA B 39 19.960 19.006 19.362 1.00 0.15 C ATOM 1939 O ALA B 39 19.060 19.822 19.336 1.00 0.18 O ATOM 1940 CB ALA B 39 19.710 18.273 16.982 1.00 0.16 C ATOM 0 H ALA B 39 22.564 17.594 18.245 1.00 0.14 H new ATOM 0 HA ALA B 39 21.329 19.438 17.762 1.00 0.14 H new ATOM 0 HB1 ALA B 39 19.083 19.142 16.784 1.00 0.16 H new ATOM 0 HB2 ALA B 39 20.251 18.001 16.075 1.00 0.16 H new ATOM 0 HB3 ALA B 39 19.084 17.437 17.295 1.00 0.16 H new ATOM 1946 N ASN B 40 20.334 18.445 20.480 1.00 0.15 N ATOM 1947 CA ASN B 40 19.654 18.801 21.757 1.00 0.18 C ATOM 1948 C ASN B 40 20.248 20.112 22.277 1.00 0.15 C ATOM 1949 O ASN B 40 21.298 20.130 22.888 1.00 0.15 O ATOM 1950 CB ASN B 40 19.874 17.672 22.782 1.00 0.23 C ATOM 1951 CG ASN B 40 18.674 17.576 23.732 1.00 0.91 C ATOM 1952 OD1 ASN B 40 17.965 16.589 23.736 1.00 1.90 O ATOM 1953 ND2 ASN B 40 18.416 18.566 24.541 1.00 1.32 N ATOM 0 H ASN B 40 21.081 17.756 20.564 1.00 0.15 H new ATOM 0 HA ASN B 40 18.583 18.926 21.596 1.00 0.18 H new ATOM 0 HB2 ASN B 40 20.014 16.723 22.264 1.00 0.23 H new ATOM 0 HB3 ASN B 40 20.784 17.861 23.352 1.00 0.23 H new ATOM 0 HD21 ASN B 40 17.620 18.511 25.176 1.00 1.32 H new ATOM 0 HD22 ASN B 40 19.010 19.395 24.538 1.00 1.32 H new ATOM 1960 N ILE B 41 19.591 21.210 22.029 1.00 0.15 N ATOM 1961 CA ILE B 41 20.125 22.518 22.497 1.00 0.15 C ATOM 1962 C ILE B 41 20.567 22.410 23.961 1.00 0.15 C ATOM 1963 O ILE B 41 21.644 22.841 24.324 1.00 0.14 O ATOM 1964 CB ILE B 41 19.042 23.592 22.334 1.00 0.19 C ATOM 1965 CG1 ILE B 41 18.891 23.892 20.832 1.00 0.21 C ATOM 1966 CG2 ILE B 41 19.441 24.868 23.110 1.00 0.21 C ATOM 1967 CD1 ILE B 41 17.749 24.882 20.598 1.00 0.24 C ATOM 0 H ILE B 41 18.707 21.258 21.522 1.00 0.15 H new ATOM 0 HA ILE B 41 20.993 22.797 21.900 1.00 0.15 H new ATOM 0 HB ILE B 41 18.092 23.241 22.737 1.00 0.19 H new ATOM 0 HG12 ILE B 41 19.822 24.302 20.441 1.00 0.21 H new ATOM 0 HG13 ILE B 41 18.697 22.968 20.288 1.00 0.21 H new ATOM 0 HG21 ILE B 41 18.666 25.625 22.988 1.00 0.21 H new ATOM 0 HG22 ILE B 41 19.553 24.630 24.168 1.00 0.21 H new ATOM 0 HG23 ILE B 41 20.385 25.250 22.722 1.00 0.21 H new ATOM 0 HD11 ILE B 41 17.655 25.084 19.531 1.00 0.24 H new ATOM 0 HD12 ILE B 41 16.817 24.457 20.970 1.00 0.24 H new ATOM 0 HD13 ILE B 41 17.960 25.812 21.126 1.00 0.24 H new ATOM 1979 N GLU B 42 19.756 21.837 24.802 1.00 0.17 N ATOM 1980 CA GLU B 42 20.146 21.706 26.230 1.00 0.17 C ATOM 1981 C GLU B 42 21.531 21.065 26.317 1.00 0.16 C ATOM 1982 O GLU B 42 22.289 21.339 27.219 1.00 0.18 O ATOM 1983 CB GLU B 42 19.128 20.832 26.966 1.00 0.20 C ATOM 1984 CG GLU B 42 17.770 21.537 26.989 1.00 0.30 C ATOM 1985 CD GLU B 42 16.728 20.618 27.631 1.00 1.03 C ATOM 1986 OE1 GLU B 42 17.107 19.548 28.079 1.00 1.65 O ATOM 1987 OE2 GLU B 42 15.570 20.999 27.663 1.00 1.78 O ATOM 0 H GLU B 42 18.841 21.454 24.563 1.00 0.17 H new ATOM 0 HA GLU B 42 20.170 22.693 26.693 1.00 0.17 H new ATOM 0 HB2 GLU B 42 19.039 19.865 26.472 1.00 0.20 H new ATOM 0 HB3 GLU B 42 19.467 20.640 27.984 1.00 0.20 H new ATOM 0 HG2 GLU B 42 17.842 22.470 27.549 1.00 0.30 H new ATOM 0 HG3 GLU B 42 17.466 21.797 25.975 1.00 0.30 H new ATOM 1994 N GLU B 43 21.867 20.211 25.385 1.00 0.16 N ATOM 1995 CA GLU B 43 23.212 19.556 25.414 1.00 0.16 C ATOM 1996 C GLU B 43 24.226 20.427 24.664 1.00 0.14 C ATOM 1997 O GLU B 43 25.357 20.579 25.080 1.00 0.20 O ATOM 1998 CB GLU B 43 23.130 18.183 24.744 1.00 0.18 C ATOM 1999 CG GLU B 43 24.401 17.388 25.048 1.00 0.30 C ATOM 2000 CD GLU B 43 24.397 16.961 26.518 1.00 1.21 C ATOM 2001 OE1 GLU B 43 23.381 17.149 27.166 1.00 1.89 O ATOM 2002 OE2 GLU B 43 25.411 16.454 26.969 1.00 1.96 O ATOM 0 H GLU B 43 21.269 19.938 24.605 1.00 0.16 H new ATOM 0 HA GLU B 43 23.530 19.437 26.450 1.00 0.16 H new ATOM 0 HB2 GLU B 43 22.255 17.642 25.105 1.00 0.18 H new ATOM 0 HB3 GLU B 43 23.010 18.299 23.667 1.00 0.18 H new ATOM 0 HG2 GLU B 43 24.457 16.511 24.404 1.00 0.30 H new ATOM 0 HG3 GLU B 43 25.281 17.995 24.837 1.00 0.30 H new ATOM 2009 N ALA B 44 23.833 20.990 23.553 1.00 0.12 N ATOM 2010 CA ALA B 44 24.780 21.843 22.772 1.00 0.12 C ATOM 2011 C ALA B 44 25.040 23.157 23.524 1.00 0.12 C ATOM 2012 O ALA B 44 26.155 23.637 23.587 1.00 0.14 O ATOM 2013 CB ALA B 44 24.172 22.147 21.387 1.00 0.13 C ATOM 0 H ALA B 44 22.900 20.898 23.152 1.00 0.12 H new ATOM 0 HA ALA B 44 25.724 21.313 22.646 1.00 0.12 H new ATOM 0 HB1 ALA B 44 24.861 22.769 20.816 1.00 0.13 H new ATOM 0 HB2 ALA B 44 23.998 21.213 20.853 1.00 0.13 H new ATOM 0 HB3 ALA B 44 23.226 22.674 21.513 1.00 0.13 H new ATOM 2019 N SER B 45 24.019 23.747 24.074 1.00 0.12 N ATOM 2020 CA SER B 45 24.202 25.037 24.800 1.00 0.16 C ATOM 2021 C SER B 45 25.273 24.890 25.884 1.00 0.15 C ATOM 2022 O SER B 45 25.879 25.858 26.299 1.00 0.16 O ATOM 2023 CB SER B 45 22.879 25.447 25.446 1.00 0.19 C ATOM 2024 OG SER B 45 23.141 26.295 26.556 1.00 0.82 O ATOM 0 H SER B 45 23.063 23.393 24.054 1.00 0.12 H new ATOM 0 HA SER B 45 24.520 25.800 24.090 1.00 0.16 H new ATOM 0 HB2 SER B 45 22.251 25.963 24.720 1.00 0.19 H new ATOM 0 HB3 SER B 45 22.330 24.563 25.771 1.00 0.19 H new ATOM 0 HG SER B 45 22.294 26.561 26.972 1.00 0.82 H new ATOM 2030 N ARG B 46 25.511 23.696 26.353 1.00 0.17 N ATOM 2031 CA ARG B 46 26.543 23.512 27.415 1.00 0.20 C ATOM 2032 C ARG B 46 27.935 23.548 26.775 1.00 0.17 C ATOM 2033 O ARG B 46 28.876 24.075 27.336 1.00 0.23 O ATOM 2034 CB ARG B 46 26.328 22.164 28.136 1.00 0.24 C ATOM 2035 CG ARG B 46 24.850 21.758 28.082 1.00 0.84 C ATOM 2036 CD ARG B 46 23.954 22.888 28.626 1.00 1.21 C ATOM 2037 NE ARG B 46 24.700 23.692 29.634 1.00 1.63 N ATOM 2038 CZ ARG B 46 24.260 24.872 29.979 1.00 2.08 C ATOM 2039 NH1 ARG B 46 23.178 25.350 29.428 1.00 2.50 N ATOM 2040 NH2 ARG B 46 24.902 25.573 30.873 1.00 2.80 N ATOM 0 H ARG B 46 25.039 22.844 26.050 1.00 0.17 H new ATOM 0 HA ARG B 46 26.457 24.315 28.147 1.00 0.20 H new ATOM 0 HB2 ARG B 46 26.941 21.393 27.669 1.00 0.24 H new ATOM 0 HB3 ARG B 46 26.652 22.244 29.174 1.00 0.24 H new ATOM 0 HG2 ARG B 46 24.569 21.527 27.055 1.00 0.84 H new ATOM 0 HG3 ARG B 46 24.695 20.851 28.667 1.00 0.84 H new ATOM 0 HD2 ARG B 46 23.627 23.529 27.808 1.00 1.21 H new ATOM 0 HD3 ARG B 46 23.057 22.466 29.078 1.00 1.21 H new ATOM 0 HE ARG B 46 25.553 23.322 30.054 1.00 1.63 H new ATOM 0 HH11 ARG B 46 22.677 24.802 28.729 1.00 2.50 H new ATOM 0 HH12 ARG B 46 22.833 26.272 29.697 1.00 2.50 H new ATOM 0 HH21 ARG B 46 25.748 25.199 31.303 1.00 2.80 H new ATOM 0 HH22 ARG B 46 24.558 26.495 31.142 1.00 2.80 H new ATOM 2054 N ARG B 47 28.070 22.990 25.604 1.00 0.13 N ATOM 2055 CA ARG B 47 29.396 22.990 24.925 1.00 0.12 C ATOM 2056 C ARG B 47 29.823 24.430 24.645 1.00 0.11 C ATOM 2057 O ARG B 47 30.839 24.894 25.121 1.00 0.12 O ATOM 2058 CB ARG B 47 29.289 22.229 23.602 1.00 0.15 C ATOM 2059 CG ARG B 47 28.543 20.910 23.821 1.00 0.32 C ATOM 2060 CD ARG B 47 28.535 20.102 22.521 1.00 0.54 C ATOM 2061 NE ARG B 47 28.193 18.686 22.827 1.00 0.95 N ATOM 2062 CZ ARG B 47 27.876 17.866 21.864 1.00 1.20 C ATOM 2063 NH1 ARG B 47 27.855 18.287 20.629 1.00 1.81 N ATOM 2064 NH2 ARG B 47 27.583 16.625 22.137 1.00 1.62 N ATOM 0 H ARG B 47 27.318 22.533 25.087 1.00 0.13 H new ATOM 0 HA ARG B 47 30.133 22.508 25.567 1.00 0.12 H new ATOM 0 HB2 ARG B 47 28.764 22.836 22.864 1.00 0.15 H new ATOM 0 HB3 ARG B 47 30.284 22.033 23.203 1.00 0.15 H new ATOM 0 HG2 ARG B 47 29.023 20.337 24.614 1.00 0.32 H new ATOM 0 HG3 ARG B 47 27.521 21.108 24.144 1.00 0.32 H new ATOM 0 HD2 ARG B 47 27.810 20.521 21.823 1.00 0.54 H new ATOM 0 HD3 ARG B 47 29.511 20.157 22.039 1.00 0.54 H new ATOM 0 HE ARG B 47 28.207 18.356 23.792 1.00 0.95 H new ATOM 0 HH11 ARG B 47 28.087 19.257 20.417 1.00 1.81 H new ATOM 0 HH12 ARG B 47 27.607 17.646 19.876 1.00 1.81 H new ATOM 0 HH21 ARG B 47 27.602 16.297 23.103 1.00 1.62 H new ATOM 0 HH22 ARG B 47 27.335 15.982 21.385 1.00 1.62 H new ATOM 2078 N ILE B 48 29.045 25.140 23.876 1.00 0.10 N ATOM 2079 CA ILE B 48 29.386 26.557 23.557 1.00 0.09 C ATOM 2080 C ILE B 48 29.790 27.283 24.839 1.00 0.10 C ATOM 2081 O ILE B 48 30.877 27.815 24.949 1.00 0.10 O ATOM 2082 CB ILE B 48 28.169 27.233 22.932 1.00 0.10 C ATOM 2083 CG1 ILE B 48 27.645 26.342 21.796 1.00 0.10 C ATOM 2084 CG2 ILE B 48 28.586 28.597 22.381 1.00 0.10 C ATOM 2085 CD1 ILE B 48 26.568 27.077 20.999 1.00 0.10 C ATOM 0 H ILE B 48 28.182 24.799 23.452 1.00 0.10 H new ATOM 0 HA ILE B 48 30.218 26.591 22.854 1.00 0.09 H new ATOM 0 HB ILE B 48 27.384 27.374 23.675 1.00 0.10 H new ATOM 0 HG12 ILE B 48 28.466 26.061 21.137 1.00 0.10 H new ATOM 0 HG13 ILE B 48 27.236 25.419 22.208 1.00 0.10 H new ATOM 0 HG21 ILE B 48 27.722 29.088 21.932 1.00 0.10 H new ATOM 0 HG22 ILE B 48 28.973 29.214 23.192 1.00 0.10 H new ATOM 0 HG23 ILE B 48 29.360 28.463 21.626 1.00 0.10 H new ATOM 0 HD11 ILE B 48 26.206 26.433 20.197 1.00 0.10 H new ATOM 0 HD12 ILE B 48 25.740 27.336 21.659 1.00 0.10 H new ATOM 0 HD13 ILE B 48 26.989 27.987 20.572 1.00 0.10 H new ATOM 2097 N GLU B 49 28.929 27.294 25.816 1.00 0.10 N ATOM 2098 CA GLU B 49 29.266 27.969 27.103 1.00 0.11 C ATOM 2099 C GLU B 49 30.637 27.493 27.569 1.00 0.11 C ATOM 2100 O GLU B 49 31.570 28.262 27.693 1.00 0.12 O ATOM 2101 CB GLU B 49 28.235 27.569 28.152 1.00 0.13 C ATOM 2102 CG GLU B 49 26.939 28.358 27.939 1.00 0.14 C ATOM 2103 CD GLU B 49 27.105 29.780 28.480 1.00 0.16 C ATOM 2104 OE1 GLU B 49 28.220 30.135 28.825 1.00 1.07 O ATOM 2105 OE2 GLU B 49 26.114 30.489 28.541 1.00 1.10 O ATOM 0 H GLU B 49 28.004 26.865 25.781 1.00 0.10 H new ATOM 0 HA GLU B 49 29.269 29.050 26.965 1.00 0.11 H new ATOM 0 HB2 GLU B 49 28.034 26.500 28.088 1.00 0.13 H new ATOM 0 HB3 GLU B 49 28.627 27.760 29.151 1.00 0.13 H new ATOM 0 HG2 GLU B 49 26.691 28.389 26.878 1.00 0.14 H new ATOM 0 HG3 GLU B 49 26.112 27.860 28.445 1.00 0.14 H new ATOM 2112 N GLU B 50 30.767 26.216 27.810 1.00 0.12 N ATOM 2113 CA GLU B 50 32.079 25.673 28.246 1.00 0.12 C ATOM 2114 C GLU B 50 33.119 26.132 27.236 1.00 0.11 C ATOM 2115 O GLU B 50 34.297 26.182 27.509 1.00 0.11 O ATOM 2116 CB GLU B 50 32.023 24.143 28.272 1.00 0.14 C ATOM 2117 CG GLU B 50 33.283 23.594 28.944 1.00 0.17 C ATOM 2118 CD GLU B 50 33.240 23.899 30.443 1.00 1.14 C ATOM 2119 OE1 GLU B 50 32.156 23.876 31.002 1.00 1.97 O ATOM 2120 OE2 GLU B 50 34.293 24.149 31.007 1.00 1.78 O ATOM 0 H GLU B 50 30.019 25.528 27.723 1.00 0.12 H new ATOM 0 HA GLU B 50 32.330 26.026 29.246 1.00 0.12 H new ATOM 0 HB2 GLU B 50 31.137 23.811 28.812 1.00 0.14 H new ATOM 0 HB3 GLU B 50 31.942 23.755 27.257 1.00 0.14 H new ATOM 0 HG2 GLU B 50 33.354 22.518 28.783 1.00 0.17 H new ATOM 0 HG3 GLU B 50 34.170 24.042 28.497 1.00 0.17 H new ATOM 2127 N GLY B 51 32.669 26.485 26.067 1.00 0.10 N ATOM 2128 CA GLY B 51 33.614 26.965 25.016 1.00 0.09 C ATOM 2129 C GLY B 51 33.962 28.425 25.300 1.00 0.09 C ATOM 2130 O GLY B 51 35.113 28.788 25.443 1.00 0.10 O ATOM 0 H GLY B 51 31.687 26.463 25.791 1.00 0.10 H new ATOM 0 HA2 GLY B 51 34.517 26.355 25.013 1.00 0.09 H new ATOM 0 HA3 GLY B 51 33.162 26.870 24.029 1.00 0.09 H new ATOM 2134 N GLN B 52 32.966 29.263 25.401 1.00 0.10 N ATOM 2135 CA GLN B 52 33.215 30.703 25.700 1.00 0.11 C ATOM 2136 C GLN B 52 34.156 30.795 26.892 1.00 0.11 C ATOM 2137 O GLN B 52 35.113 31.544 26.894 1.00 0.13 O ATOM 2138 CB GLN B 52 31.884 31.375 26.040 1.00 0.13 C ATOM 2139 CG GLN B 52 30.915 31.184 24.870 1.00 0.19 C ATOM 2140 CD GLN B 52 31.342 32.074 23.706 1.00 0.54 C ATOM 2141 OE1 GLN B 52 32.162 32.956 23.869 1.00 1.37 O ATOM 2142 NE2 GLN B 52 30.817 31.880 22.529 1.00 0.74 N ATOM 0 H GLN B 52 31.984 29.010 25.289 1.00 0.10 H new ATOM 0 HA GLN B 52 33.662 31.200 24.839 1.00 0.11 H new ATOM 0 HB2 GLN B 52 31.466 30.943 26.949 1.00 0.13 H new ATOM 0 HB3 GLN B 52 32.037 32.437 26.233 1.00 0.13 H new ATOM 0 HG2 GLN B 52 30.905 30.139 24.559 1.00 0.19 H new ATOM 0 HG3 GLN B 52 29.900 31.434 25.180 1.00 0.19 H new ATOM 0 HE21 GLN B 52 30.129 31.139 22.393 1.00 0.74 H new ATOM 0 HE22 GLN B 52 31.094 32.469 21.744 1.00 0.74 H new ATOM 2151 N TYR B 53 33.893 30.022 27.900 1.00 0.11 N ATOM 2152 CA TYR B 53 34.775 30.039 29.098 1.00 0.13 C ATOM 2153 C TYR B 53 36.197 29.627 28.676 1.00 0.13 C ATOM 2154 O TYR B 53 37.168 30.248 29.061 1.00 0.16 O ATOM 2155 CB TYR B 53 34.216 29.073 30.164 1.00 0.14 C ATOM 2156 CG TYR B 53 35.306 28.676 31.139 1.00 0.17 C ATOM 2157 CD1 TYR B 53 36.217 27.685 30.777 1.00 0.17 C ATOM 2158 CD2 TYR B 53 35.411 29.301 32.386 1.00 0.22 C ATOM 2159 CE1 TYR B 53 37.238 27.309 31.650 1.00 0.22 C ATOM 2160 CE2 TYR B 53 36.435 28.928 33.268 1.00 0.26 C ATOM 2161 CZ TYR B 53 37.350 27.932 32.898 1.00 0.25 C ATOM 2162 OH TYR B 53 38.358 27.563 33.766 1.00 0.30 O ATOM 0 H TYR B 53 33.105 29.377 27.949 1.00 0.11 H new ATOM 0 HA TYR B 53 34.810 31.040 29.528 1.00 0.13 H new ATOM 0 HB2 TYR B 53 33.395 29.549 30.700 1.00 0.14 H new ATOM 0 HB3 TYR B 53 33.809 28.184 29.681 1.00 0.14 H new ATOM 0 HD1 TYR B 53 36.132 27.205 29.813 1.00 0.17 H new ATOM 0 HD2 TYR B 53 34.706 30.068 32.668 1.00 0.22 H new ATOM 0 HE1 TYR B 53 37.940 26.540 31.364 1.00 0.22 H new ATOM 0 HE2 TYR B 53 36.519 29.408 34.232 1.00 0.26 H new ATOM 0 HH TYR B 53 39.025 27.031 33.285 1.00 0.30 H new ATOM 2172 N VAL B 54 36.330 28.588 27.890 1.00 0.11 N ATOM 2173 CA VAL B 54 37.697 28.158 27.460 1.00 0.12 C ATOM 2174 C VAL B 54 38.406 29.343 26.807 1.00 0.12 C ATOM 2175 O VAL B 54 39.397 29.842 27.302 1.00 0.13 O ATOM 2176 CB VAL B 54 37.612 27.007 26.438 1.00 0.11 C ATOM 2177 CG1 VAL B 54 39.031 26.683 25.952 1.00 0.13 C ATOM 2178 CG2 VAL B 54 36.977 25.736 27.070 1.00 0.12 C ATOM 0 H VAL B 54 35.560 28.024 27.530 1.00 0.11 H new ATOM 0 HA VAL B 54 38.247 27.813 28.335 1.00 0.12 H new ATOM 0 HB VAL B 54 36.980 27.319 25.606 1.00 0.11 H new ATOM 0 HG11 VAL B 54 38.991 25.870 25.227 1.00 0.13 H new ATOM 0 HG12 VAL B 54 39.465 27.566 25.483 1.00 0.13 H new ATOM 0 HG13 VAL B 54 39.646 26.383 26.800 1.00 0.13 H new ATOM 0 HG21 VAL B 54 36.931 24.943 26.324 1.00 0.12 H new ATOM 0 HG22 VAL B 54 37.584 25.407 27.913 1.00 0.12 H new ATOM 0 HG23 VAL B 54 35.970 25.967 27.417 1.00 0.12 H new ATOM 2188 N VAL B 55 37.901 29.792 25.696 1.00 0.11 N ATOM 2189 CA VAL B 55 38.532 30.940 24.994 1.00 0.11 C ATOM 2190 C VAL B 55 38.724 32.093 25.983 1.00 0.14 C ATOM 2191 O VAL B 55 39.806 32.625 26.134 1.00 0.17 O ATOM 2192 CB VAL B 55 37.621 31.385 23.845 1.00 0.11 C ATOM 2193 CG1 VAL B 55 38.312 32.480 23.033 1.00 0.13 C ATOM 2194 CG2 VAL B 55 37.333 30.184 22.939 1.00 0.10 C ATOM 0 H VAL B 55 37.072 29.410 25.240 1.00 0.11 H new ATOM 0 HA VAL B 55 39.502 30.646 24.594 1.00 0.11 H new ATOM 0 HB VAL B 55 36.687 31.774 24.251 1.00 0.11 H new ATOM 0 HG11 VAL B 55 37.661 32.794 22.217 1.00 0.13 H new ATOM 0 HG12 VAL B 55 38.522 33.333 23.678 1.00 0.13 H new ATOM 0 HG13 VAL B 55 39.246 32.095 22.624 1.00 0.13 H new ATOM 0 HG21 VAL B 55 36.685 30.494 22.119 1.00 0.10 H new ATOM 0 HG22 VAL B 55 38.270 29.800 22.536 1.00 0.10 H new ATOM 0 HG23 VAL B 55 36.839 29.403 23.517 1.00 0.10 H new ATOM 2204 N ASN B 56 37.677 32.481 26.655 1.00 0.16 N ATOM 2205 CA ASN B 56 37.783 33.599 27.636 1.00 0.20 C ATOM 2206 C ASN B 56 38.861 33.281 28.679 1.00 0.22 C ATOM 2207 O ASN B 56 39.557 34.158 29.152 1.00 0.31 O ATOM 2208 CB ASN B 56 36.438 33.785 28.342 1.00 0.26 C ATOM 2209 CG ASN B 56 35.433 34.417 27.378 1.00 0.52 C ATOM 2210 OD1 ASN B 56 35.704 35.442 26.784 1.00 1.35 O ATOM 2211 ND2 ASN B 56 34.273 33.846 27.198 1.00 0.91 N ATOM 0 H ASN B 56 36.747 32.071 26.567 1.00 0.16 H new ATOM 0 HA ASN B 56 38.053 34.513 27.107 1.00 0.20 H new ATOM 0 HB2 ASN B 56 36.064 32.823 28.693 1.00 0.26 H new ATOM 0 HB3 ASN B 56 36.562 34.418 29.220 1.00 0.26 H new ATOM 0 HD21 ASN B 56 33.594 34.260 26.559 1.00 0.91 H new ATOM 0 HD22 ASN B 56 34.045 32.986 27.696 1.00 0.91 H new ATOM 2218 N GLU B 57 39.001 32.036 29.051 1.00 0.19 N ATOM 2219 CA GLU B 57 40.029 31.673 30.071 1.00 0.22 C ATOM 2220 C GLU B 57 41.398 31.535 29.399 1.00 0.22 C ATOM 2221 O GLU B 57 42.422 31.804 29.995 1.00 0.27 O ATOM 2222 CB GLU B 57 39.650 30.342 30.726 1.00 0.25 C ATOM 2223 CG GLU B 57 40.562 30.083 31.928 1.00 0.55 C ATOM 2224 CD GLU B 57 40.348 28.655 32.434 1.00 1.65 C ATOM 2225 OE1 GLU B 57 39.895 27.833 31.655 1.00 2.43 O ATOM 2226 OE2 GLU B 57 40.641 28.408 33.592 1.00 2.39 O ATOM 0 H GLU B 57 38.449 31.256 28.694 1.00 0.19 H new ATOM 0 HA GLU B 57 40.075 32.455 30.829 1.00 0.22 H new ATOM 0 HB2 GLU B 57 38.608 30.366 31.046 1.00 0.25 H new ATOM 0 HB3 GLU B 57 39.743 29.530 30.004 1.00 0.25 H new ATOM 0 HG2 GLU B 57 41.605 30.227 31.644 1.00 0.55 H new ATOM 0 HG3 GLU B 57 40.346 30.798 32.722 1.00 0.55 H new ATOM 2233 N TYR B 58 41.426 31.112 28.167 1.00 0.20 N ATOM 2234 CA TYR B 58 42.728 30.951 27.461 1.00 0.24 C ATOM 2235 C TYR B 58 43.306 32.334 27.133 1.00 0.24 C ATOM 2236 O TYR B 58 44.480 32.476 26.853 1.00 0.33 O ATOM 2237 CB TYR B 58 42.497 30.129 26.177 1.00 0.29 C ATOM 2238 CG TYR B 58 43.581 30.408 25.152 1.00 0.97 C ATOM 2239 CD1 TYR B 58 44.929 30.262 25.501 1.00 0.61 C ATOM 2240 CD2 TYR B 58 43.233 30.817 23.858 1.00 2.18 C ATOM 2241 CE1 TYR B 58 45.929 30.524 24.557 1.00 1.22 C ATOM 2242 CE2 TYR B 58 44.233 31.078 22.914 1.00 2.88 C ATOM 2243 CZ TYR B 58 45.581 30.932 23.263 1.00 2.36 C ATOM 2244 OH TYR B 58 46.566 31.190 22.332 1.00 3.06 O ATOM 0 H TYR B 58 40.602 30.870 27.617 1.00 0.20 H new ATOM 0 HA TYR B 58 43.443 30.425 28.094 1.00 0.24 H new ATOM 0 HB2 TYR B 58 42.484 29.066 26.418 1.00 0.29 H new ATOM 0 HB3 TYR B 58 41.522 30.372 25.756 1.00 0.29 H new ATOM 0 HD1 TYR B 58 45.197 29.947 26.499 1.00 0.61 H new ATOM 0 HD2 TYR B 58 42.193 30.931 23.589 1.00 2.18 H new ATOM 0 HE1 TYR B 58 46.969 30.412 24.826 1.00 1.22 H new ATOM 0 HE2 TYR B 58 43.965 31.392 21.916 1.00 2.88 H new ATOM 0 HH TYR B 58 47.287 31.704 22.752 1.00 3.06 H new ATOM 2254 N SER B 59 42.494 33.350 27.164 1.00 0.27 N ATOM 2255 CA SER B 59 42.999 34.715 26.853 1.00 0.34 C ATOM 2256 C SER B 59 43.842 35.229 28.022 1.00 0.37 C ATOM 2257 O SER B 59 45.000 35.563 27.866 1.00 0.52 O ATOM 2258 CB SER B 59 41.813 35.652 26.631 1.00 0.41 C ATOM 2259 OG SER B 59 40.858 35.453 27.664 1.00 1.45 O ATOM 0 H SER B 59 41.501 33.295 27.391 1.00 0.27 H new ATOM 0 HA SER B 59 43.613 34.680 25.953 1.00 0.34 H new ATOM 0 HB2 SER B 59 42.150 36.689 26.626 1.00 0.41 H new ATOM 0 HB3 SER B 59 41.360 35.459 25.659 1.00 0.41 H new ATOM 0 HG SER B 59 40.255 34.721 27.416 1.00 1.45 H new ATOM 2265 N ARG B 60 43.269 35.298 29.193 1.00 0.42 N ATOM 2266 CA ARG B 60 44.034 35.792 30.374 1.00 0.54 C ATOM 2267 C ARG B 60 45.399 35.102 30.433 1.00 0.61 C ATOM 2268 O ARG B 60 46.289 35.527 31.142 1.00 0.78 O ATOM 2269 CB ARG B 60 43.250 35.482 31.649 1.00 0.66 C ATOM 2270 CG ARG B 60 42.757 34.036 31.604 1.00 0.93 C ATOM 2271 CD ARG B 60 42.201 33.641 32.973 1.00 1.26 C ATOM 2272 NE ARG B 60 43.330 33.401 33.916 1.00 1.94 N ATOM 2273 CZ ARG B 60 43.108 33.343 35.200 1.00 2.56 C ATOM 2274 NH1 ARG B 60 41.897 33.498 35.662 1.00 2.77 N ATOM 2275 NH2 ARG B 60 44.098 33.131 36.024 1.00 3.52 N ATOM 0 H ARG B 60 42.303 35.033 29.383 1.00 0.42 H new ATOM 0 HA ARG B 60 44.181 36.868 30.286 1.00 0.54 H new ATOM 0 HB2 ARG B 60 43.882 35.635 32.524 1.00 0.66 H new ATOM 0 HB3 ARG B 60 42.404 36.163 31.744 1.00 0.66 H new ATOM 0 HG2 ARG B 60 41.985 33.928 30.842 1.00 0.93 H new ATOM 0 HG3 ARG B 60 43.575 33.371 31.327 1.00 0.93 H new ATOM 0 HD2 ARG B 60 41.554 34.430 33.356 1.00 1.26 H new ATOM 0 HD3 ARG B 60 41.590 32.743 32.884 1.00 1.26 H new ATOM 0 HE ARG B 60 44.277 33.282 33.557 1.00 1.94 H new ATOM 0 HH11 ARG B 60 41.123 33.665 35.019 1.00 2.77 H new ATOM 0 HH12 ARG B 60 41.725 33.452 36.666 1.00 2.77 H new ATOM 0 HH21 ARG B 60 45.045 33.011 35.664 1.00 3.52 H new ATOM 0 HH22 ARG B 60 43.925 33.086 37.028 1.00 3.52 H new ATOM 2289 N GLN B 61 45.573 34.042 29.692 1.00 0.61 N ATOM 2290 CA GLN B 61 46.882 33.331 29.709 1.00 0.76 C ATOM 2291 C GLN B 61 47.936 34.200 29.014 1.00 0.85 C ATOM 2292 O GLN B 61 49.045 34.347 29.489 1.00 1.06 O ATOM 2293 CB GLN B 61 46.743 31.990 28.971 1.00 0.79 C ATOM 2294 CG GLN B 61 47.862 31.034 29.404 1.00 1.26 C ATOM 2295 CD GLN B 61 49.223 31.641 29.057 1.00 1.65 C ATOM 2296 OE1 GLN B 61 50.057 31.824 29.921 1.00 2.28 O ATOM 2297 NE2 GLN B 61 49.484 31.963 27.820 1.00 2.31 N ATOM 0 H GLN B 61 44.867 33.638 29.077 1.00 0.61 H new ATOM 0 HA GLN B 61 47.188 33.144 30.738 1.00 0.76 H new ATOM 0 HB2 GLN B 61 45.771 31.546 29.186 1.00 0.79 H new ATOM 0 HB3 GLN B 61 46.788 32.152 27.894 1.00 0.79 H new ATOM 0 HG2 GLN B 61 47.799 30.847 30.476 1.00 1.26 H new ATOM 0 HG3 GLN B 61 47.745 30.072 28.905 1.00 1.26 H new ATOM 0 HE21 GLN B 61 48.784 31.809 27.094 1.00 2.31 H new ATOM 0 HE22 GLN B 61 50.388 32.368 27.578 1.00 2.31 H new ATOM 2306 N HIS B 62 47.597 34.774 27.891 1.00 0.79 N ATOM 2307 CA HIS B 62 48.576 35.631 27.161 1.00 0.97 C ATOM 2308 C HIS B 62 48.549 37.048 27.737 1.00 1.01 C ATOM 2309 O HIS B 62 48.812 38.014 27.048 1.00 1.27 O ATOM 2310 CB HIS B 62 48.202 35.677 25.679 1.00 1.05 C ATOM 2311 CG HIS B 62 48.531 34.358 25.036 1.00 1.28 C ATOM 2312 ND1 HIS B 62 48.874 33.236 25.781 1.00 1.77 N ATOM 2313 CD2 HIS B 62 48.577 33.963 23.721 1.00 1.57 C ATOM 2314 CE1 HIS B 62 49.109 32.231 24.916 1.00 1.97 C ATOM 2315 NE2 HIS B 62 48.941 32.624 23.654 1.00 1.83 N ATOM 0 H HIS B 62 46.683 34.686 27.447 1.00 0.79 H new ATOM 0 HA HIS B 62 49.577 35.215 27.274 1.00 0.97 H new ATOM 0 HB2 HIS B 62 47.139 35.892 25.568 1.00 1.05 H new ATOM 0 HB3 HIS B 62 48.744 36.481 25.181 1.00 1.05 H new ATOM 0 HD2 HIS B 62 48.363 34.595 22.872 1.00 1.57 H new ATOM 0 HE1 HIS B 62 49.397 31.232 25.208 1.00 1.97 H new ATOM 0 HE2 HIS B 62 49.056 32.059 22.813 1.00 1.83 H new ATOM 2323 N ASN B 63 48.236 37.182 28.996 1.00 1.00 N ATOM 2324 CA ASN B 63 48.197 38.537 29.616 1.00 1.16 C ATOM 2325 C ASN B 63 47.350 39.477 28.753 1.00 1.28 C ATOM 2326 O ASN B 63 47.580 40.669 28.710 1.00 1.86 O ATOM 2327 CB ASN B 63 49.621 39.087 29.722 1.00 1.33 C ATOM 2328 CG ASN B 63 50.388 38.313 30.796 1.00 1.93 C ATOM 2329 OD1 ASN B 63 51.545 38.585 31.048 1.00 2.59 O ATOM 2330 ND2 ASN B 63 49.788 37.353 31.445 1.00 2.66 N ATOM 0 H ASN B 63 48.005 36.411 29.623 1.00 1.00 H new ATOM 0 HA ASN B 63 47.756 38.467 30.610 1.00 1.16 H new ATOM 0 HB2 ASN B 63 50.129 38.998 28.762 1.00 1.33 H new ATOM 0 HB3 ASN B 63 49.595 40.148 29.972 1.00 1.33 H new ATOM 0 HD21 ASN B 63 50.290 36.831 32.163 1.00 2.66 H new ATOM 0 HD22 ASN B 63 48.817 37.124 31.234 1.00 2.66 H new ATOM 2337 N LEU B 64 46.369 38.952 28.071 1.00 1.29 N ATOM 2338 CA LEU B 64 45.506 39.820 27.218 1.00 1.43 C ATOM 2339 C LEU B 64 44.579 40.638 28.125 1.00 1.74 C ATOM 2340 O LEU B 64 44.402 41.827 27.943 1.00 2.20 O ATOM 2341 CB LEU B 64 44.669 38.930 26.270 1.00 1.43 C ATOM 2342 CG LEU B 64 45.358 38.801 24.898 1.00 1.54 C ATOM 2343 CD1 LEU B 64 44.869 37.532 24.191 1.00 1.59 C ATOM 2344 CD2 LEU B 64 45.015 40.017 24.029 1.00 2.41 C ATOM 0 H LEU B 64 46.127 37.961 28.067 1.00 1.29 H new ATOM 0 HA LEU B 64 46.120 40.495 26.622 1.00 1.43 H new ATOM 0 HB2 LEU B 64 44.538 37.942 26.711 1.00 1.43 H new ATOM 0 HB3 LEU B 64 43.674 39.358 26.145 1.00 1.43 H new ATOM 0 HG LEU B 64 46.436 38.748 25.048 1.00 1.54 H new ATOM 0 HD11 LEU B 64 45.359 37.444 23.221 1.00 1.59 H new ATOM 0 HD12 LEU B 64 45.110 36.660 24.799 1.00 1.59 H new ATOM 0 HD13 LEU B 64 43.790 37.588 24.049 1.00 1.59 H new ATOM 0 HD21 LEU B 64 45.505 39.921 23.060 1.00 2.41 H new ATOM 0 HD22 LEU B 64 43.936 40.070 23.887 1.00 2.41 H new ATOM 0 HD23 LEU B 64 45.361 40.926 24.522 1.00 2.41 H new ATOM 2356 N ASN B 65 43.990 39.997 29.101 1.00 2.14 N ATOM 2357 CA ASN B 65 43.068 40.696 30.044 1.00 2.59 C ATOM 2358 C ASN B 65 43.712 40.708 31.430 1.00 3.01 C ATOM 2359 O ASN B 65 43.913 39.675 32.037 1.00 3.52 O ATOM 2360 CB ASN B 65 41.738 39.933 30.098 1.00 3.25 C ATOM 2361 CG ASN B 65 40.856 40.341 28.914 1.00 3.82 C ATOM 2362 OD1 ASN B 65 40.553 41.504 28.740 1.00 4.30 O ATOM 2363 ND2 ASN B 65 40.429 39.425 28.089 1.00 4.34 N ATOM 0 H ASN B 65 44.112 39.001 29.287 1.00 2.14 H new ATOM 0 HA ASN B 65 42.884 41.718 29.713 1.00 2.59 H new ATOM 0 HB2 ASN B 65 41.923 38.859 30.072 1.00 3.25 H new ATOM 0 HB3 ASN B 65 41.224 40.145 31.036 1.00 3.25 H new ATOM 0 HD21 ASN B 65 39.841 39.686 27.298 1.00 4.34 H new ATOM 0 HD22 ASN B 65 40.684 38.448 28.235 1.00 4.34 H new ATOM 2370 N ILE B 66 44.045 41.870 31.929 1.00 0.00 N ATOM 2371 CA ILE B 66 44.690 41.967 33.275 1.00 0.00 C ATOM 2372 C ILE B 66 43.675 42.492 34.292 1.00 0.00 C ATOM 2373 O ILE B 66 43.914 42.485 35.483 1.00 0.00 O ATOM 2374 CB ILE B 66 45.893 42.913 33.189 1.00 0.00 C ATOM 2375 CG1 ILE B 66 46.766 42.522 31.967 1.00 0.00 C ATOM 2376 CG2 ILE B 66 46.719 42.798 34.477 1.00 0.00 C ATOM 2377 CD1 ILE B 66 46.302 43.261 30.702 1.00 0.00 C ATOM 0 H ILE B 66 43.897 42.763 31.459 1.00 0.00 H new ATOM 0 HA ILE B 66 45.031 40.982 33.595 1.00 0.00 H new ATOM 0 HB ILE B 66 45.549 43.941 33.071 1.00 0.00 H new ATOM 0 HG12 ILE B 66 47.810 42.760 32.170 1.00 0.00 H new ATOM 0 HG13 ILE B 66 46.711 41.446 31.805 1.00 0.00 H new ATOM 0 HG21 ILE B 66 47.576 43.469 34.421 1.00 0.00 H new ATOM 0 HG22 ILE B 66 46.100 43.071 35.332 1.00 0.00 H new ATOM 0 HG23 ILE B 66 47.068 41.772 34.595 1.00 0.00 H new ATOM 0 HD11 ILE B 66 46.930 42.970 29.860 1.00 0.00 H new ATOM 0 HD12 ILE B 66 45.265 43.001 30.489 1.00 0.00 H new ATOM 0 HD13 ILE B 66 46.382 44.337 30.859 1.00 0.00 H new ATOM 2389 N TYR B 67 42.536 42.931 33.832 1.00 0.00 N ATOM 2390 CA TYR B 67 41.501 43.439 34.774 1.00 0.00 C ATOM 2391 C TYR B 67 40.910 42.251 35.539 1.00 0.00 C ATOM 2392 O TYR B 67 41.360 41.907 36.614 1.00 0.00 O ATOM 2393 CB TYR B 67 40.400 44.153 33.979 1.00 0.00 C ATOM 2394 CG TYR B 67 39.213 44.436 34.874 1.00 0.00 C ATOM 2395 CD1 TYR B 67 39.283 45.457 35.830 1.00 0.00 C ATOM 2396 CD2 TYR B 67 38.042 43.678 34.745 1.00 0.00 C ATOM 2397 CE1 TYR B 67 38.183 45.718 36.657 1.00 0.00 C ATOM 2398 CE2 TYR B 67 36.943 43.939 35.571 1.00 0.00 C ATOM 2399 CZ TYR B 67 37.013 44.960 36.527 1.00 0.00 C ATOM 2400 OH TYR B 67 35.929 45.218 37.340 1.00 0.00 O ATOM 0 H TYR B 67 42.278 42.960 32.846 1.00 0.00 H new ATOM 0 HA TYR B 67 41.943 44.144 35.479 1.00 0.00 H new ATOM 0 HB2 TYR B 67 40.785 45.086 33.567 1.00 0.00 H new ATOM 0 HB3 TYR B 67 40.091 43.535 33.136 1.00 0.00 H new ATOM 0 HD1 TYR B 67 40.185 46.043 35.930 1.00 0.00 H new ATOM 0 HD2 TYR B 67 37.987 42.891 34.007 1.00 0.00 H new ATOM 0 HE1 TYR B 67 38.237 46.504 37.395 1.00 0.00 H new ATOM 0 HE2 TYR B 67 36.041 43.353 35.471 1.00 0.00 H new ATOM 0 HH TYR B 67 35.200 44.602 37.118 1.00 0.00 H new ATOM 2410 N ASP B 68 39.907 41.622 34.988 1.00 0.00 N ATOM 2411 CA ASP B 68 39.284 40.452 35.672 1.00 0.00 C ATOM 2412 C ASP B 68 38.679 40.887 37.011 1.00 0.00 C ATOM 2413 O ASP B 68 38.020 40.117 37.681 1.00 0.00 O ATOM 2414 CB ASP B 68 40.348 39.373 35.911 1.00 0.00 C ATOM 2415 CG ASP B 68 41.289 39.311 34.707 1.00 0.00 C ATOM 2416 OD1 ASP B 68 40.889 38.760 33.695 1.00 0.00 O ATOM 2417 OD2 ASP B 68 42.394 39.817 34.817 1.00 0.00 O ATOM 0 H ASP B 68 39.491 41.869 34.090 1.00 0.00 H new ATOM 0 HA ASP B 68 38.492 40.049 35.041 1.00 0.00 H new ATOM 0 HB2 ASP B 68 40.912 39.597 36.816 1.00 0.00 H new ATOM 0 HB3 ASP B 68 39.872 38.405 36.064 1.00 0.00 H new ATOM 2422 N GLY B 69 38.895 42.113 37.409 1.00 0.00 N ATOM 2423 CA GLY B 69 38.330 42.588 38.706 1.00 0.00 C ATOM 2424 C GLY B 69 38.600 41.549 39.796 1.00 0.00 C ATOM 2425 O GLY B 69 37.761 40.725 40.102 1.00 0.00 O ATOM 0 H GLY B 69 39.438 42.805 36.893 1.00 0.00 H new ATOM 0 HA2 GLY B 69 38.778 43.543 38.981 1.00 0.00 H new ATOM 0 HA3 GLY B 69 37.258 42.756 38.607 1.00 0.00 H new ATOM 2429 N GLY B 70 39.766 41.578 40.382 1.00 0.00 N ATOM 2430 CA GLY B 70 40.093 40.588 41.451 1.00 0.00 C ATOM 2431 C GLY B 70 41.131 41.184 42.402 1.00 0.00 C ATOM 2432 O GLY B 70 41.464 42.350 42.323 1.00 0.00 O ATOM 0 H GLY B 70 40.508 42.245 40.167 1.00 0.00 H new ATOM 0 HA2 GLY B 70 39.191 40.321 42.002 1.00 0.00 H new ATOM 0 HA3 GLY B 70 40.478 39.670 41.006 1.00 0.00 H new ATOM 2436 N GLU B 71 41.644 40.393 43.307 1.00 0.00 N ATOM 2437 CA GLU B 71 42.659 40.909 44.269 1.00 0.00 C ATOM 2438 C GLU B 71 44.054 40.823 43.637 1.00 0.00 C ATOM 2439 O GLU B 71 45.053 40.742 44.324 1.00 0.00 O ATOM 2440 CB GLU B 71 42.610 40.061 45.549 1.00 0.00 C ATOM 2441 CG GLU B 71 43.212 40.845 46.719 1.00 0.00 C ATOM 2442 CD GLU B 71 42.232 41.932 47.164 1.00 0.00 C ATOM 2443 OE1 GLU B 71 41.190 42.053 46.541 1.00 0.00 O ATOM 2444 OE2 GLU B 71 42.539 42.625 48.119 1.00 0.00 O ATOM 0 H GLU B 71 41.402 39.409 43.421 1.00 0.00 H new ATOM 0 HA GLU B 71 42.445 41.949 44.513 1.00 0.00 H new ATOM 0 HB2 GLU B 71 41.579 39.788 45.775 1.00 0.00 H new ATOM 0 HB3 GLU B 71 43.161 39.132 45.401 1.00 0.00 H new ATOM 0 HG2 GLU B 71 43.427 40.172 47.549 1.00 0.00 H new ATOM 0 HG3 GLU B 71 44.159 41.295 46.420 1.00 0.00 H new ATOM 2451 N LEU B 72 44.131 40.837 42.333 1.00 0.00 N ATOM 2452 CA LEU B 72 45.462 40.756 41.665 1.00 0.00 C ATOM 2453 C LEU B 72 46.380 41.854 42.211 1.00 0.00 C ATOM 2454 O LEU B 72 46.046 42.540 43.157 1.00 0.00 O ATOM 2455 CB LEU B 72 45.296 40.905 40.141 1.00 0.00 C ATOM 2456 CG LEU B 72 45.020 42.365 39.757 1.00 0.00 C ATOM 2457 CD1 LEU B 72 44.662 42.436 38.271 1.00 0.00 C ATOM 2458 CD2 LEU B 72 43.853 42.905 40.584 1.00 0.00 C ATOM 0 H LEU B 72 43.332 40.901 41.703 1.00 0.00 H new ATOM 0 HA LEU B 72 45.911 39.785 41.872 1.00 0.00 H new ATOM 0 HB2 LEU B 72 46.198 40.557 39.638 1.00 0.00 H new ATOM 0 HB3 LEU B 72 44.476 40.274 39.798 1.00 0.00 H new ATOM 0 HG LEU B 72 45.909 42.965 39.953 1.00 0.00 H new ATOM 0 HD11 LEU B 72 44.465 43.471 37.993 1.00 0.00 H new ATOM 0 HD12 LEU B 72 45.492 42.053 37.678 1.00 0.00 H new ATOM 0 HD13 LEU B 72 43.773 41.834 38.082 1.00 0.00 H new ATOM 0 HD21 LEU B 72 43.661 43.942 40.308 1.00 0.00 H new ATOM 0 HD22 LEU B 72 42.963 42.307 40.391 1.00 0.00 H new ATOM 0 HD23 LEU B 72 44.103 42.852 41.644 1.00 0.00 H new ATOM 2470 N ARG B 73 47.532 42.029 41.624 1.00 0.00 N ATOM 2471 CA ARG B 73 48.460 43.085 42.116 1.00 0.00 C ATOM 2472 C ARG B 73 47.740 44.432 42.123 1.00 0.00 C ATOM 2473 O ARG B 73 46.597 44.540 41.729 1.00 0.00 O ATOM 2474 CB ARG B 73 49.682 43.175 41.196 1.00 0.00 C ATOM 2475 CG ARG B 73 50.426 41.833 41.174 1.00 0.00 C ATOM 2476 CD ARG B 73 51.312 41.690 42.418 1.00 0.00 C ATOM 2477 NE ARG B 73 52.202 40.506 42.255 1.00 0.00 N ATOM 2478 CZ ARG B 73 53.232 40.351 43.041 1.00 0.00 C ATOM 2479 NH1 ARG B 73 53.485 41.234 43.968 1.00 0.00 N ATOM 2480 NH2 ARG B 73 54.010 39.313 42.899 1.00 0.00 N ATOM 0 H ARG B 73 47.870 41.488 40.828 1.00 0.00 H new ATOM 0 HA ARG B 73 48.784 42.832 43.126 1.00 0.00 H new ATOM 0 HB2 ARG B 73 49.368 43.442 40.187 1.00 0.00 H new ATOM 0 HB3 ARG B 73 50.350 43.964 41.542 1.00 0.00 H new ATOM 0 HG2 ARG B 73 49.709 41.013 41.135 1.00 0.00 H new ATOM 0 HG3 ARG B 73 51.038 41.764 40.275 1.00 0.00 H new ATOM 0 HD2 ARG B 73 51.909 42.591 42.559 1.00 0.00 H new ATOM 0 HD3 ARG B 73 50.693 41.575 43.308 1.00 0.00 H new ATOM 0 HE ARG B 73 52.006 39.817 41.529 1.00 0.00 H new ATOM 0 HH11 ARG B 73 52.877 42.046 44.078 1.00 0.00 H new ATOM 0 HH12 ARG B 73 54.290 41.112 44.582 1.00 0.00 H new ATOM 0 HH21 ARG B 73 53.813 38.623 42.174 1.00 0.00 H new ATOM 0 HH22 ARG B 73 54.815 39.191 43.513 1.00 0.00 H new ATOM 2494 N ASN B 74 48.408 45.459 42.567 1.00 0.00 N ATOM 2495 CA ASN B 74 47.777 46.809 42.604 1.00 0.00 C ATOM 2496 C ASN B 74 48.765 47.810 43.215 1.00 0.00 C ATOM 2497 O ASN B 74 49.740 48.183 42.597 1.00 0.00 O ATOM 2498 CB ASN B 74 46.499 46.754 43.453 1.00 0.00 C ATOM 2499 CG ASN B 74 46.721 45.827 44.649 1.00 0.00 C ATOM 2500 OD1 ASN B 74 47.648 46.012 45.413 1.00 0.00 O ATOM 2501 ND2 ASN B 74 45.905 44.828 44.844 1.00 0.00 N ATOM 0 H ASN B 74 49.369 45.422 42.908 1.00 0.00 H new ATOM 0 HA ASN B 74 47.520 47.124 41.593 1.00 0.00 H new ATOM 0 HB2 ASN B 74 46.236 47.754 43.798 1.00 0.00 H new ATOM 0 HB3 ASN B 74 45.665 46.395 42.851 1.00 0.00 H new ATOM 0 HD21 ASN B 74 46.045 44.202 45.637 1.00 0.00 H new ATOM 0 HD22 ASN B 74 45.127 44.672 44.203 1.00 0.00 H new ATOM 2508 N THR B 75 48.519 48.238 44.425 1.00 0.00 N ATOM 2509 CA THR B 75 49.434 49.207 45.087 1.00 0.00 C ATOM 2510 C THR B 75 49.648 50.430 44.184 1.00 0.00 C ATOM 2511 O THR B 75 49.003 51.447 44.345 1.00 0.00 O ATOM 2512 CB THR B 75 50.773 48.522 45.380 1.00 0.00 C ATOM 2513 OG1 THR B 75 50.530 47.218 45.890 1.00 0.00 O ATOM 2514 CG2 THR B 75 51.545 49.337 46.415 1.00 0.00 C ATOM 0 H THR B 75 47.716 47.954 44.986 1.00 0.00 H new ATOM 0 HA THR B 75 48.990 49.543 46.024 1.00 0.00 H new ATOM 0 HB THR B 75 51.358 48.453 44.463 1.00 0.00 H new ATOM 0 HG1 THR B 75 51.384 46.776 46.077 1.00 0.00 H new ATOM 0 HG21 THR B 75 52.498 48.851 46.624 1.00 0.00 H new ATOM 0 HG22 THR B 75 51.727 50.339 46.027 1.00 0.00 H new ATOM 0 HG23 THR B 75 50.962 49.404 47.334 1.00 0.00 H new ATOM 2522 N THR B 76 50.544 50.345 43.236 1.00 0.00 N ATOM 2523 CA THR B 76 50.787 51.507 42.334 1.00 0.00 C ATOM 2524 C THR B 76 49.721 51.535 41.237 1.00 0.00 C ATOM 2525 O THR B 76 48.698 50.891 41.341 1.00 0.00 O ATOM 2526 CB THR B 76 52.171 51.372 41.694 1.00 0.00 C ATOM 2527 OG1 THR B 76 52.231 50.162 40.951 1.00 0.00 O ATOM 2528 CG2 THR B 76 53.243 51.357 42.785 1.00 0.00 C ATOM 0 H THR B 76 51.117 49.522 43.048 1.00 0.00 H new ATOM 0 HA THR B 76 50.739 52.431 42.911 1.00 0.00 H new ATOM 0 HB THR B 76 52.347 52.217 41.029 1.00 0.00 H new ATOM 0 HG1 THR B 76 53.116 50.075 40.539 1.00 0.00 H new ATOM 0 HG21 THR B 76 54.227 51.261 42.327 1.00 0.00 H new ATOM 0 HG22 THR B 76 53.197 52.286 43.353 1.00 0.00 H new ATOM 0 HG23 THR B 76 53.070 50.514 43.453 1.00 0.00 H new ATOM 2536 N ARG B 77 49.963 52.279 40.189 1.00 0.00 N ATOM 2537 CA ARG B 77 48.979 52.367 39.068 1.00 0.00 C ATOM 2538 C ARG B 77 47.608 52.793 39.601 1.00 0.00 C ATOM 2539 O ARG B 77 47.223 53.939 39.491 1.00 0.00 O ATOM 2540 CB ARG B 77 48.864 51.007 38.371 1.00 0.00 C ATOM 2541 CG ARG B 77 50.146 50.728 37.584 1.00 0.00 C ATOM 2542 CD ARG B 77 49.973 49.450 36.762 1.00 0.00 C ATOM 2543 NE ARG B 77 51.285 49.056 36.176 1.00 0.00 N ATOM 2544 CZ ARG B 77 51.449 47.856 35.689 1.00 0.00 C ATOM 2545 NH1 ARG B 77 50.464 47.001 35.716 1.00 0.00 N ATOM 2546 NH2 ARG B 77 52.597 47.512 35.175 1.00 0.00 N ATOM 0 H ARG B 77 50.809 52.835 40.060 1.00 0.00 H new ATOM 0 HA ARG B 77 49.326 53.111 38.351 1.00 0.00 H new ATOM 0 HB2 ARG B 77 48.699 50.221 39.108 1.00 0.00 H new ATOM 0 HB3 ARG B 77 48.004 51.001 37.701 1.00 0.00 H new ATOM 0 HG2 ARG B 77 50.372 51.568 36.927 1.00 0.00 H new ATOM 0 HG3 ARG B 77 50.989 50.622 38.267 1.00 0.00 H new ATOM 0 HD2 ARG B 77 49.589 48.648 37.393 1.00 0.00 H new ATOM 0 HD3 ARG B 77 49.242 49.611 35.970 1.00 0.00 H new ATOM 0 HE ARG B 77 52.055 49.724 36.155 1.00 0.00 H new ATOM 0 HH11 ARG B 77 49.566 47.270 36.118 1.00 0.00 H new ATOM 0 HH12 ARG B 77 50.592 46.063 35.335 1.00 0.00 H new ATOM 0 HH21 ARG B 77 53.367 48.181 35.153 1.00 0.00 H new ATOM 0 HH22 ARG B 77 52.725 46.574 34.795 1.00 0.00 H new ATOM 2560 N GLN B 78 46.869 51.880 40.171 1.00 0.00 N ATOM 2561 CA GLN B 78 45.520 52.229 40.707 1.00 0.00 C ATOM 2562 C GLN B 78 44.640 52.755 39.570 1.00 0.00 C ATOM 2563 O GLN B 78 44.925 53.774 38.972 1.00 0.00 O ATOM 2564 CB GLN B 78 45.656 53.303 41.793 1.00 0.00 C ATOM 2565 CG GLN B 78 44.371 53.360 42.623 1.00 0.00 C ATOM 2566 CD GLN B 78 44.425 54.563 43.566 1.00 0.00 C ATOM 2567 OE1 GLN B 78 44.423 55.696 43.125 1.00 0.00 O ATOM 2568 NE2 GLN B 78 44.473 54.366 44.855 1.00 0.00 N ATOM 0 H GLN B 78 47.141 50.904 40.289 1.00 0.00 H new ATOM 0 HA GLN B 78 45.062 51.339 41.139 1.00 0.00 H new ATOM 0 HB2 GLN B 78 46.507 53.078 42.436 1.00 0.00 H new ATOM 0 HB3 GLN B 78 45.849 54.274 41.336 1.00 0.00 H new ATOM 0 HG2 GLN B 78 43.505 53.438 41.966 1.00 0.00 H new ATOM 0 HG3 GLN B 78 44.255 52.440 43.196 1.00 0.00 H new ATOM 0 HE21 GLN B 78 44.475 53.416 45.226 1.00 0.00 H new ATOM 0 HE22 GLN B 78 44.509 55.162 45.492 1.00 0.00 H new ATOM 2577 N CYS B 79 43.574 52.068 39.264 1.00 0.00 N ATOM 2578 CA CYS B 79 42.681 52.529 38.164 1.00 0.00 C ATOM 2579 C CYS B 79 43.498 52.685 36.880 1.00 0.00 C ATOM 2580 O CYS B 79 44.693 52.467 36.864 1.00 0.00 O ATOM 2581 CB CYS B 79 42.060 53.876 38.541 1.00 0.00 C ATOM 2582 SG CYS B 79 40.674 54.232 37.431 1.00 0.00 S ATOM 0 H CYS B 79 43.283 51.208 39.728 1.00 0.00 H new ATOM 0 HA CYS B 79 41.889 51.797 38.006 1.00 0.00 H new ATOM 0 HB2 CYS B 79 41.716 53.853 39.575 1.00 0.00 H new ATOM 0 HB3 CYS B 79 42.808 54.666 38.471 1.00 0.00 H new ATOM 0 HG CYS B 79 40.144 55.375 37.751 1.00 0.00 H new ATOM 2588 N GLY B 80 42.865 53.061 35.803 1.00 0.00 N ATOM 2589 CA GLY B 80 43.609 53.229 34.523 1.00 0.00 C ATOM 2590 C GLY B 80 43.909 51.855 33.921 1.00 0.00 C ATOM 2591 O GLY B 80 42.988 51.241 33.408 1.00 0.00 O ATOM 2592 OXT GLY B 80 45.055 51.441 33.983 1.00 0.00 O ATOM 0 H GLY B 80 41.866 53.259 35.754 1.00 0.00 H new ATOM 0 HA2 GLY B 80 43.021 53.823 33.824 1.00 0.00 H new ATOM 0 HA3 GLY B 80 44.538 53.771 34.699 1.00 0.00 H new TER 2596 GLY B 80