USER MOD reduce.3.24.130724 H: found=0, std=0, add=1284, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1284 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 100 TYR OH : rot 180:sc= 0.412 USER MOD Set 1.2: A 112 TYR OH : rot -142:sc= -0.679 USER MOD Set 1.3: A 138 ASN : amide:sc= 0.437 K(o=0.17,f=-0.6) USER MOD Set 2.1: A 84 LYS NZ :NH3+ -115:sc= 1.3 (180deg=-0.152) USER MOD Set 2.2: A 88 TYR OH : rot 30:sc= 0.396 USER MOD Set 3.1: A 63 MET CE :methyl 179:sc= -1.26 (180deg=-1.24) USER MOD Set 3.2: A 82 CYS SG : rot 65:sc= 0.0426 USER MOD Set 4.1: A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 51 ASN : amide:sc= 0.126 X(o=0.13,f=0) USER MOD Set 5.1: A 16 ASN : amide:sc= 0 K(o=-0.19,f=-1.2) USER MOD Set 5.2: A 19 GLN : amide:sc= -0.191 X(o=-0.19,f=-0.053) USER MOD Single : A 1 MET CE :methyl -167:sc= -0.133 (180deg=-0.472) USER MOD Single : A 1 MET N :NH3+ -169:sc=-0.00405 (180deg=-0.14) USER MOD Single : A 3 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS : no HE2:sc= 0.28 K(o=0.28,f=-1.2) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= -0.0781 X(o=-0.078,f=0) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=-0.0024) USER MOD Single : A 9 SER OG : rot 28:sc= 0.0596 USER MOD Single : A 10 HIS : no HD1:sc= 0 X(o=0,f=-0.0063) USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 MET CE :methyl -161:sc= -1.04 (180deg=-1.37) USER MOD Single : A 24 HIS : no HD1:sc= -0.584 K(o=-0.58,f=0.15) USER MOD Single : A 25 MET CE :methyl -125:sc= -0.223 (180deg=-3.14) USER MOD Single : A 26 GLN : amide:sc= 0.0172 X(o=0.017,f=-0.17) USER MOD Single : A 27 SER OG : rot -32:sc= 0.498 USER MOD Single : A 28 TYR OH : rot 100:sc= -0.177 USER MOD Single : A 29 LYS NZ :NH3+ 169:sc= -0.023 (180deg=-0.201) USER MOD Single : A 31 ASN : amide:sc= -0.212 K(o=-0.21,f=-2.9!) USER MOD Single : A 40 TYR OH : rot 30:sc= 0 USER MOD Single : A 42 GLN : amide:sc= 0.403 X(o=0.4,f=0) USER MOD Single : A 47 ASN : amide:sc= -0.604 X(o=-0.6,f=-0.36) USER MOD Single : A 52 LYS NZ :NH3+ -142:sc= -0.0656 (180deg=-0.593) USER MOD Single : A 54 TYR OH : rot 25:sc= 0.502 USER MOD Single : A 57 THR OG1 : rot 92:sc= 0.865 USER MOD Single : A 61 HIS : no HD1:sc= -1.84 K(o=-1.8,f=-0.86) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0231) USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 TYR OH : rot 8:sc= -0.499 USER MOD Single : A 73 HIS : no HD1:sc= -3.37! C(o=-3.2!,f=-8.5!) USER MOD Single : A 74 ASN : amide:sc= -3.16! K(o=-3.2!,f=-1.2) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot 166:sc= 0.254 USER MOD Single : A 89 ASN : amide:sc= 0.565 K(o=0.56,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 93 HIS : no HD1:sc= -1.08 K(o=-1.1,f=-0.29) USER MOD Single : A 94 GLN : amide:sc= -0.692 K(o=-0.69,f=0) USER MOD Single : A 101 ASN : amide:sc= -1.5 K(o=-1.5,f=-0.84) USER MOD Single : A 102 HIS : no HD1:sc= -1.96 K(o=-1.9,f=-3!) USER MOD Single : A 106 THR OG1 : rot -84:sc= 0.0384 USER MOD Single : A 108 SER OG : rot -160:sc= 0 USER MOD Single : A 109 SER OG : rot -80:sc= -1.25 USER MOD Single : A 118 HIS : no HD1:sc= -1.43 K(o=-1.4,f=-2.3!) USER MOD Single : A 122 GLN : amide:sc=-0.00621 X(o=-0.0062,f=0) USER MOD Single : A 126 GLN : amide:sc= -0.592 K(o=-0.59,f=-0.066) USER MOD Single : A 127 HIS : no HD1:sc= -0.016 K(o=-0.016,f=-0.74) USER MOD Single : A 129 SER OG : rot -76:sc= 0.136 USER MOD Single : A 133 GLN : amide:sc= -0.12 X(o=-0.12,f=-0.37) USER MOD Single : A 137 GLN : amide:sc= 0.086 X(o=0.086,f=0) USER MOD Single : A 139 GLN : amide:sc= -0.0951 X(o=-0.095,f=0) USER MOD Single : A 147 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 148 GLN : amide:sc= -0.572 K(o=-0.57,f=-3.1!) USER MOD Single : A 149 GLN : amide:sc= -1.05 K(o=-1,f=-0.022) USER MOD Single : A 150 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 GLN : amide:sc= -2.04 X(o=-2,f=-2!) USER MOD Single : A 155 THR OG1 : rot -34:sc= 0.0856 USER MOD Single : A 158 THR OG1 : rot 180:sc= 0 USER MOD Single : A 160 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 29.070 31.805 -1.700 1.00 33.24 N ATOM 2 CA MET A 1 28.096 31.127 -0.796 1.00 11.55 C ATOM 3 C MET A 1 27.031 32.130 -0.283 1.00 73.04 C ATOM 4 O MET A 1 25.861 31.774 -0.092 1.00 74.33 O ATOM 5 CB MET A 1 28.858 30.477 0.392 1.00 51.52 C ATOM 6 CG MET A 1 28.004 29.575 1.298 1.00 72.24 C ATOM 7 SD MET A 1 28.917 28.948 2.728 1.00 70.52 S ATOM 8 CE MET A 1 30.313 28.124 1.956 1.00 22.02 C ATOM 0 H1 MET A 1 29.657 31.091 -2.177 1.00 33.24 H new ATOM 0 H2 MET A 1 28.554 32.361 -2.412 1.00 33.24 H new ATOM 0 H3 MET A 1 29.679 32.437 -1.142 1.00 33.24 H new ATOM 0 HA MET A 1 27.576 30.348 -1.354 1.00 11.55 H new ATOM 0 HB2 MET A 1 29.685 29.888 -0.005 1.00 51.52 H new ATOM 0 HB3 MET A 1 29.294 31.269 1.001 1.00 51.52 H new ATOM 0 HG2 MET A 1 27.135 30.135 1.645 1.00 72.24 H new ATOM 0 HG3 MET A 1 27.629 28.734 0.715 1.00 72.24 H new ATOM 0 HE1 MET A 1 30.823 27.505 2.694 1.00 22.02 H new ATOM 0 HE2 MET A 1 29.958 27.497 1.138 1.00 22.02 H new ATOM 0 HE3 MET A 1 31.006 28.870 1.567 1.00 22.02 H new ATOM 20 N GLY A 2 27.457 33.393 -0.070 1.00 51.00 N ATOM 21 CA GLY A 2 26.581 34.457 0.442 1.00 1.20 C ATOM 22 C GLY A 2 25.529 34.942 -0.556 1.00 33.35 C ATOM 23 O GLY A 2 24.531 35.547 -0.154 1.00 73.50 O ATOM 0 H GLY A 2 28.414 33.698 -0.248 1.00 51.00 H new ATOM 0 HA2 GLY A 2 26.076 34.096 1.338 1.00 1.20 H new ATOM 0 HA3 GLY A 2 27.197 35.304 0.743 1.00 1.20 H new ATOM 27 N HIS A 3 25.746 34.682 -1.858 1.00 73.13 N ATOM 28 CA HIS A 3 24.759 35.012 -2.907 1.00 61.44 C ATOM 29 C HIS A 3 23.650 33.930 -2.966 1.00 2.32 C ATOM 30 O HIS A 3 23.788 32.907 -3.651 1.00 43.45 O ATOM 31 CB HIS A 3 25.453 35.175 -4.282 1.00 74.50 C ATOM 32 CG HIS A 3 26.521 36.241 -4.328 1.00 14.22 C ATOM 33 ND1 HIS A 3 27.598 36.177 -5.183 1.00 74.42 N ATOM 34 CD2 HIS A 3 26.674 37.404 -3.636 1.00 22.22 C ATOM 35 CE1 HIS A 3 28.358 37.234 -5.018 1.00 14.21 C ATOM 36 NE2 HIS A 3 27.827 37.997 -4.088 1.00 63.52 N ATOM 0 H HIS A 3 26.597 34.244 -2.211 1.00 73.13 H new ATOM 0 HA HIS A 3 24.291 35.964 -2.655 1.00 61.44 H new ATOM 0 HB2 HIS A 3 25.899 34.221 -4.564 1.00 74.50 H new ATOM 0 HB3 HIS A 3 24.695 35.407 -5.031 1.00 74.50 H new ATOM 0 HD2 HIS A 3 26.012 37.788 -2.874 1.00 22.22 H new ATOM 0 HE1 HIS A 3 29.270 37.443 -5.558 1.00 14.21 H new ATOM 0 HE2 HIS A 3 28.209 38.883 -3.757 1.00 63.52 H new ATOM 45 N HIS A 4 22.568 34.152 -2.197 1.00 70.10 N ATOM 46 CA HIS A 4 21.409 33.238 -2.155 1.00 13.44 C ATOM 47 C HIS A 4 20.423 33.576 -3.301 1.00 61.30 C ATOM 48 O HIS A 4 19.571 34.450 -3.155 1.00 64.44 O ATOM 49 CB HIS A 4 20.714 33.327 -0.772 1.00 74.51 C ATOM 50 CG HIS A 4 21.595 32.907 0.382 1.00 43.53 C ATOM 51 ND1 HIS A 4 22.567 33.721 0.930 1.00 23.24 N ATOM 52 CD2 HIS A 4 21.658 31.748 1.084 1.00 14.55 C ATOM 53 CE1 HIS A 4 23.182 33.083 1.903 1.00 65.31 C ATOM 54 NE2 HIS A 4 22.649 31.889 2.018 1.00 40.43 N ATOM 0 H HIS A 4 22.472 34.966 -1.590 1.00 70.10 H new ATOM 0 HA HIS A 4 21.752 32.213 -2.297 1.00 13.44 H new ATOM 0 HB2 HIS A 4 20.381 34.352 -0.608 1.00 74.51 H new ATOM 0 HB3 HIS A 4 19.822 32.700 -0.783 1.00 74.51 H new ATOM 0 HD1 HIS A 4 22.776 34.672 0.627 1.00 23.24 H new ATOM 0 HD2 HIS A 4 21.040 30.875 0.934 1.00 14.55 H new ATOM 0 HE1 HIS A 4 23.988 33.475 2.505 1.00 65.31 H new ATOM 63 N HIS A 5 20.567 32.879 -4.446 1.00 63.41 N ATOM 64 CA HIS A 5 19.778 33.153 -5.677 1.00 51.32 C ATOM 65 C HIS A 5 18.283 32.791 -5.499 1.00 73.24 C ATOM 66 O HIS A 5 17.405 33.413 -6.110 1.00 32.33 O ATOM 67 CB HIS A 5 20.381 32.372 -6.873 1.00 42.41 C ATOM 68 CG HIS A 5 19.822 32.753 -8.224 1.00 61.33 C ATOM 69 ND1 HIS A 5 20.217 33.887 -8.902 1.00 1.53 N ATOM 70 CD2 HIS A 5 18.903 32.150 -9.023 1.00 52.32 C ATOM 71 CE1 HIS A 5 19.573 33.966 -10.045 1.00 21.00 C ATOM 72 NE2 HIS A 5 18.773 32.928 -10.144 1.00 11.04 N ATOM 0 H HIS A 5 21.230 32.111 -4.550 1.00 63.41 H new ATOM 0 HA HIS A 5 19.832 34.223 -5.876 1.00 51.32 H new ATOM 0 HB2 HIS A 5 21.460 32.528 -6.884 1.00 42.41 H new ATOM 0 HB3 HIS A 5 20.215 31.307 -6.714 1.00 42.41 H new ATOM 0 HD2 HIS A 5 18.375 31.231 -8.814 1.00 52.32 H new ATOM 0 HE1 HIS A 5 19.683 34.751 -10.779 1.00 21.00 H new ATOM 0 HE2 HIS A 5 18.154 32.732 -10.930 1.00 11.04 H new ATOM 81 N HIS A 6 18.018 31.782 -4.655 1.00 3.35 N ATOM 82 CA HIS A 6 16.665 31.241 -4.426 1.00 23.01 C ATOM 83 C HIS A 6 15.774 32.240 -3.633 1.00 21.21 C ATOM 84 O HIS A 6 15.858 32.330 -2.406 1.00 50.21 O ATOM 85 CB HIS A 6 16.783 29.880 -3.694 1.00 22.34 C ATOM 86 CG HIS A 6 15.479 29.144 -3.484 1.00 24.02 C ATOM 87 ND1 HIS A 6 14.958 28.266 -4.408 1.00 20.41 N ATOM 88 CD2 HIS A 6 14.612 29.130 -2.438 1.00 21.34 C ATOM 89 CE1 HIS A 6 13.841 27.754 -3.947 1.00 13.23 C ATOM 90 NE2 HIS A 6 13.610 28.259 -2.755 1.00 31.04 N ATOM 0 H HIS A 6 18.740 31.314 -4.107 1.00 3.35 H new ATOM 0 HA HIS A 6 16.175 31.089 -5.388 1.00 23.01 H new ATOM 0 HB2 HIS A 6 17.456 29.238 -4.262 1.00 22.34 H new ATOM 0 HB3 HIS A 6 17.247 30.048 -2.722 1.00 22.34 H new ATOM 0 HD2 HIS A 6 14.699 29.701 -1.526 1.00 21.34 H new ATOM 0 HE1 HIS A 6 13.216 27.038 -4.460 1.00 13.23 H new ATOM 0 HE2 HIS A 6 12.810 28.036 -2.162 1.00 31.04 H new ATOM 99 N HIS A 7 14.962 33.021 -4.363 1.00 51.04 N ATOM 100 CA HIS A 7 13.950 33.942 -3.784 1.00 73.32 C ATOM 101 C HIS A 7 12.579 33.796 -4.486 1.00 72.45 C ATOM 102 O HIS A 7 11.563 34.293 -3.985 1.00 53.52 O ATOM 103 CB HIS A 7 14.442 35.410 -3.872 1.00 52.23 C ATOM 104 CG HIS A 7 15.594 35.738 -2.956 1.00 62.51 C ATOM 105 ND1 HIS A 7 16.764 36.334 -3.372 1.00 35.35 N ATOM 106 CD2 HIS A 7 15.719 35.585 -1.619 1.00 5.12 C ATOM 107 CE1 HIS A 7 17.546 36.529 -2.331 1.00 44.25 C ATOM 108 NE2 HIS A 7 16.936 36.083 -1.261 1.00 11.12 N ATOM 0 H HIS A 7 14.984 33.037 -5.383 1.00 51.04 H new ATOM 0 HA HIS A 7 13.819 33.671 -2.736 1.00 73.32 H new ATOM 0 HB2 HIS A 7 14.740 35.619 -4.899 1.00 52.23 H new ATOM 0 HB3 HIS A 7 13.609 36.074 -3.640 1.00 52.23 H new ATOM 0 HD2 HIS A 7 14.988 35.148 -0.955 1.00 5.12 H new ATOM 0 HE1 HIS A 7 18.527 36.981 -2.355 1.00 44.25 H new ATOM 0 HE2 HIS A 7 17.311 36.105 -0.313 1.00 11.12 H new ATOM 117 N HIS A 8 12.554 33.107 -5.639 1.00 2.34 N ATOM 118 CA HIS A 8 11.317 32.866 -6.417 1.00 14.23 C ATOM 119 C HIS A 8 10.833 31.407 -6.254 1.00 75.33 C ATOM 120 O HIS A 8 11.647 30.482 -6.166 1.00 22.43 O ATOM 121 CB HIS A 8 11.556 33.155 -7.918 1.00 4.43 C ATOM 122 CG HIS A 8 12.067 34.539 -8.226 1.00 61.53 C ATOM 123 ND1 HIS A 8 13.356 34.791 -8.645 1.00 55.50 N ATOM 124 CD2 HIS A 8 11.447 35.745 -8.211 1.00 20.23 C ATOM 125 CE1 HIS A 8 13.503 36.077 -8.869 1.00 72.35 C ATOM 126 NE2 HIS A 8 12.366 36.676 -8.617 1.00 64.52 N ATOM 0 H HIS A 8 13.388 32.700 -6.062 1.00 2.34 H new ATOM 0 HA HIS A 8 10.551 33.539 -6.033 1.00 14.23 H new ATOM 0 HB2 HIS A 8 12.269 32.426 -8.304 1.00 4.43 H new ATOM 0 HB3 HIS A 8 10.620 33.001 -8.456 1.00 4.43 H new ATOM 0 HD2 HIS A 8 10.421 35.936 -7.931 1.00 20.23 H new ATOM 0 HE1 HIS A 8 14.409 36.559 -9.205 1.00 72.35 H new ATOM 0 HE2 HIS A 8 12.192 37.677 -8.709 1.00 64.52 H new ATOM 135 N SER A 9 9.501 31.220 -6.218 1.00 25.21 N ATOM 136 CA SER A 9 8.872 29.879 -6.243 1.00 13.42 C ATOM 137 C SER A 9 8.660 29.411 -7.700 1.00 24.03 C ATOM 138 O SER A 9 8.143 30.165 -8.529 1.00 63.24 O ATOM 139 CB SER A 9 7.523 29.899 -5.496 1.00 43.31 C ATOM 140 OG SER A 9 6.639 30.865 -6.045 1.00 54.41 O ATOM 0 H SER A 9 8.830 31.987 -6.171 1.00 25.21 H new ATOM 0 HA SER A 9 9.540 29.179 -5.741 1.00 13.42 H new ATOM 0 HB2 SER A 9 7.063 28.912 -5.547 1.00 43.31 H new ATOM 0 HB3 SER A 9 7.693 30.117 -4.442 1.00 43.31 H new ATOM 0 HG SER A 9 6.850 31.001 -6.992 1.00 54.41 H new ATOM 146 N HIS A 10 9.064 28.166 -8.006 1.00 22.21 N ATOM 147 CA HIS A 10 8.955 27.595 -9.373 1.00 50.13 C ATOM 148 C HIS A 10 8.822 26.053 -9.341 1.00 51.30 C ATOM 149 O HIS A 10 8.680 25.452 -8.272 1.00 43.04 O ATOM 150 CB HIS A 10 10.175 28.036 -10.232 1.00 0.33 C ATOM 151 CG HIS A 10 11.513 27.528 -9.760 1.00 12.21 C ATOM 152 ND1 HIS A 10 12.179 26.490 -10.370 1.00 53.21 N ATOM 153 CD2 HIS A 10 12.319 27.936 -8.749 1.00 3.02 C ATOM 154 CE1 HIS A 10 13.322 26.282 -9.758 1.00 32.31 C ATOM 155 NE2 HIS A 10 13.434 27.143 -8.771 1.00 2.34 N ATOM 0 H HIS A 10 9.473 27.527 -7.324 1.00 22.21 H new ATOM 0 HA HIS A 10 8.045 27.982 -9.832 1.00 50.13 H new ATOM 0 HB2 HIS A 10 10.018 27.699 -11.257 1.00 0.33 H new ATOM 0 HB3 HIS A 10 10.206 29.125 -10.256 1.00 0.33 H new ATOM 0 HD2 HIS A 10 12.118 28.738 -8.055 1.00 3.02 H new ATOM 0 HE1 HIS A 10 14.049 25.529 -10.022 1.00 32.31 H new ATOM 0 HE2 HIS A 10 14.222 27.209 -8.127 1.00 2.34 H new ATOM 164 N MET A 11 8.852 25.427 -10.530 1.00 42.25 N ATOM 165 CA MET A 11 8.790 23.960 -10.668 1.00 53.24 C ATOM 166 C MET A 11 10.197 23.337 -10.506 1.00 53.14 C ATOM 167 O MET A 11 10.894 23.068 -11.492 1.00 64.21 O ATOM 168 CB MET A 11 8.162 23.582 -12.035 1.00 12.23 C ATOM 169 CG MET A 11 6.690 23.989 -12.183 1.00 43.32 C ATOM 170 SD MET A 11 5.628 23.169 -10.970 1.00 1.03 S ATOM 171 CE MET A 11 3.994 23.753 -11.435 1.00 41.43 C ATOM 0 H MET A 11 8.920 25.921 -11.420 1.00 42.25 H new ATOM 0 HA MET A 11 8.157 23.557 -9.877 1.00 53.24 H new ATOM 0 HB2 MET A 11 8.740 24.053 -12.830 1.00 12.23 H new ATOM 0 HB3 MET A 11 8.246 22.504 -12.175 1.00 12.23 H new ATOM 0 HG2 MET A 11 6.601 25.069 -12.070 1.00 43.32 H new ATOM 0 HG3 MET A 11 6.347 23.744 -13.188 1.00 43.32 H new ATOM 0 HE1 MET A 11 3.249 23.322 -10.766 1.00 41.43 H new ATOM 0 HE2 MET A 11 3.962 24.840 -11.361 1.00 41.43 H new ATOM 0 HE3 MET A 11 3.778 23.452 -12.460 1.00 41.43 H new ATOM 181 N ASP A 12 10.622 23.174 -9.243 1.00 31.10 N ATOM 182 CA ASP A 12 11.873 22.462 -8.887 1.00 62.11 C ATOM 183 C ASP A 12 11.726 20.951 -9.155 1.00 61.13 C ATOM 184 O ASP A 12 10.608 20.442 -9.204 1.00 33.14 O ATOM 185 CB ASP A 12 12.207 22.689 -7.393 1.00 33.42 C ATOM 186 CG ASP A 12 12.377 24.174 -7.045 1.00 51.02 C ATOM 187 OD1 ASP A 12 11.357 24.885 -6.956 1.00 75.50 O ATOM 188 OD2 ASP A 12 13.523 24.634 -6.855 1.00 23.40 O ATOM 0 H ASP A 12 10.112 23.530 -8.435 1.00 31.10 H new ATOM 0 HA ASP A 12 12.681 22.857 -9.503 1.00 62.11 H new ATOM 0 HB2 ASP A 12 11.413 22.264 -6.779 1.00 33.42 H new ATOM 0 HB3 ASP A 12 13.124 22.154 -7.144 1.00 33.42 H new ATOM 193 N THR A 13 12.851 20.237 -9.325 1.00 1.13 N ATOM 194 CA THR A 13 12.819 18.772 -9.528 1.00 70.14 C ATOM 195 C THR A 13 12.275 18.028 -8.269 1.00 43.14 C ATOM 196 O THR A 13 12.672 18.346 -7.135 1.00 63.33 O ATOM 197 CB THR A 13 14.210 18.181 -9.945 1.00 52.14 C ATOM 198 OG1 THR A 13 14.140 16.743 -10.049 1.00 1.44 O ATOM 199 CG2 THR A 13 15.323 18.557 -8.966 1.00 40.44 C ATOM 0 H THR A 13 13.787 20.642 -9.327 1.00 1.13 H new ATOM 0 HA THR A 13 12.133 18.605 -10.358 1.00 70.14 H new ATOM 0 HB THR A 13 14.452 18.615 -10.915 1.00 52.14 H new ATOM 0 HG1 THR A 13 15.016 16.391 -10.312 1.00 1.44 H new ATOM 0 HG21 THR A 13 16.265 18.123 -9.301 1.00 40.44 H new ATOM 0 HG22 THR A 13 15.419 19.642 -8.923 1.00 40.44 H new ATOM 0 HG23 THR A 13 15.080 18.175 -7.975 1.00 40.44 H new ATOM 207 N PRO A 14 11.329 17.041 -8.467 1.00 61.22 N ATOM 208 CA PRO A 14 10.794 16.167 -7.379 1.00 34.33 C ATOM 209 C PRO A 14 11.888 15.542 -6.483 1.00 2.43 C ATOM 210 O PRO A 14 11.677 15.321 -5.277 1.00 71.24 O ATOM 211 CB PRO A 14 10.045 15.062 -8.159 1.00 32.24 C ATOM 212 CG PRO A 14 9.618 15.712 -9.440 1.00 62.34 C ATOM 213 CD PRO A 14 10.690 16.730 -9.774 1.00 23.00 C ATOM 0 HA PRO A 14 10.176 16.735 -6.684 1.00 34.33 H new ATOM 0 HB2 PRO A 14 10.692 14.205 -8.348 1.00 32.24 H new ATOM 0 HB3 PRO A 14 9.186 14.696 -7.597 1.00 32.24 H new ATOM 0 HG2 PRO A 14 9.519 14.975 -10.237 1.00 62.34 H new ATOM 0 HG3 PRO A 14 8.646 16.192 -9.328 1.00 62.34 H new ATOM 0 HD2 PRO A 14 11.413 16.327 -10.483 1.00 23.00 H new ATOM 0 HD3 PRO A 14 10.261 17.623 -10.229 1.00 23.00 H new ATOM 221 N GLU A 15 13.056 15.268 -7.108 1.00 1.22 N ATOM 222 CA GLU A 15 14.238 14.723 -6.433 1.00 1.53 C ATOM 223 C GLU A 15 14.713 15.639 -5.283 1.00 51.44 C ATOM 224 O GLU A 15 14.767 15.186 -4.150 1.00 60.13 O ATOM 225 CB GLU A 15 15.377 14.489 -7.461 1.00 43.15 C ATOM 226 CG GLU A 15 15.093 13.370 -8.487 1.00 52.02 C ATOM 227 CD GLU A 15 16.291 13.093 -9.415 1.00 74.51 C ATOM 228 OE1 GLU A 15 17.251 12.420 -8.970 1.00 44.15 O ATOM 229 OE2 GLU A 15 16.291 13.558 -10.577 1.00 60.13 O ATOM 0 H GLU A 15 13.197 15.424 -8.106 1.00 1.22 H new ATOM 0 HA GLU A 15 13.962 13.767 -5.988 1.00 1.53 H new ATOM 0 HB2 GLU A 15 15.561 15.419 -7.998 1.00 43.15 H new ATOM 0 HB3 GLU A 15 16.292 14.246 -6.921 1.00 43.15 H new ATOM 0 HG2 GLU A 15 14.831 12.455 -7.956 1.00 52.02 H new ATOM 0 HG3 GLU A 15 14.228 13.647 -9.090 1.00 52.02 H new ATOM 236 N ASN A 16 15.011 16.932 -5.580 1.00 45.31 N ATOM 237 CA ASN A 16 15.462 17.917 -4.550 1.00 72.40 C ATOM 238 C ASN A 16 14.394 18.152 -3.457 1.00 31.24 C ATOM 239 O ASN A 16 14.738 18.257 -2.270 1.00 33.21 O ATOM 240 CB ASN A 16 15.886 19.271 -5.188 1.00 15.25 C ATOM 241 CG ASN A 16 17.163 19.178 -6.027 1.00 3.51 C ATOM 242 OD1 ASN A 16 17.991 18.302 -5.834 1.00 13.12 O ATOM 243 ND2 ASN A 16 17.346 20.106 -6.941 1.00 70.31 N ATOM 0 H ASN A 16 14.948 17.320 -6.521 1.00 45.31 H new ATOM 0 HA ASN A 16 16.337 17.475 -4.073 1.00 72.40 H new ATOM 0 HB2 ASN A 16 15.074 19.638 -5.816 1.00 15.25 H new ATOM 0 HB3 ASN A 16 16.033 20.006 -4.397 1.00 15.25 H new ATOM 0 HD21 ASN A 16 18.194 20.104 -7.507 1.00 70.31 H new ATOM 0 HD22 ASN A 16 16.639 20.828 -7.084 1.00 70.31 H new ATOM 250 N VAL A 17 13.107 18.206 -3.868 1.00 64.44 N ATOM 251 CA VAL A 17 11.960 18.320 -2.932 1.00 45.12 C ATOM 252 C VAL A 17 12.016 17.211 -1.848 1.00 74.01 C ATOM 253 O VAL A 17 11.922 17.484 -0.655 1.00 72.40 O ATOM 254 CB VAL A 17 10.588 18.261 -3.710 1.00 32.32 C ATOM 255 CG1 VAL A 17 9.371 18.229 -2.746 1.00 52.33 C ATOM 256 CG2 VAL A 17 10.470 19.442 -4.707 1.00 21.23 C ATOM 0 H VAL A 17 12.833 18.172 -4.850 1.00 64.44 H new ATOM 0 HA VAL A 17 12.031 19.288 -2.436 1.00 45.12 H new ATOM 0 HB VAL A 17 10.577 17.328 -4.274 1.00 32.32 H new ATOM 0 HG11 VAL A 17 8.449 18.189 -3.326 1.00 52.33 H new ATOM 0 HG12 VAL A 17 9.436 17.349 -2.106 1.00 52.33 H new ATOM 0 HG13 VAL A 17 9.372 19.127 -2.128 1.00 52.33 H new ATOM 0 HG21 VAL A 17 9.517 19.381 -5.232 1.00 21.23 H new ATOM 0 HG22 VAL A 17 10.525 20.385 -4.163 1.00 21.23 H new ATOM 0 HG23 VAL A 17 11.285 19.392 -5.429 1.00 21.23 H new ATOM 266 N LEU A 18 12.227 15.975 -2.302 1.00 34.15 N ATOM 267 CA LEU A 18 12.430 14.803 -1.427 1.00 21.25 C ATOM 268 C LEU A 18 13.780 14.884 -0.641 1.00 53.33 C ATOM 269 O LEU A 18 13.812 14.606 0.561 1.00 64.20 O ATOM 270 CB LEU A 18 12.318 13.534 -2.315 1.00 20.42 C ATOM 271 CG LEU A 18 12.823 12.178 -1.735 1.00 11.14 C ATOM 272 CD1 LEU A 18 12.230 11.845 -0.356 1.00 44.33 C ATOM 273 CD2 LEU A 18 12.532 11.055 -2.729 1.00 4.23 C ATOM 0 H LEU A 18 12.263 15.749 -3.296 1.00 34.15 H new ATOM 0 HA LEU A 18 11.665 14.770 -0.652 1.00 21.25 H new ATOM 0 HB2 LEU A 18 11.270 13.410 -2.586 1.00 20.42 H new ATOM 0 HB3 LEU A 18 12.865 13.725 -3.238 1.00 20.42 H new ATOM 0 HG LEU A 18 13.898 12.276 -1.585 1.00 11.14 H new ATOM 0 HD11 LEU A 18 12.624 10.889 -0.012 1.00 44.33 H new ATOM 0 HD12 LEU A 18 12.501 12.626 0.355 1.00 44.33 H new ATOM 0 HD13 LEU A 18 11.144 11.784 -0.432 1.00 44.33 H new ATOM 0 HD21 LEU A 18 12.886 10.108 -2.322 1.00 4.23 H new ATOM 0 HD22 LEU A 18 11.458 10.995 -2.906 1.00 4.23 H new ATOM 0 HD23 LEU A 18 13.044 11.260 -3.669 1.00 4.23 H new ATOM 285 N GLN A 19 14.865 15.322 -1.311 1.00 13.23 N ATOM 286 CA GLN A 19 16.216 15.460 -0.694 1.00 4.25 C ATOM 287 C GLN A 19 16.215 16.432 0.515 1.00 13.10 C ATOM 288 O GLN A 19 17.089 16.336 1.391 1.00 15.35 O ATOM 289 CB GLN A 19 17.258 15.908 -1.761 1.00 1.21 C ATOM 290 CG GLN A 19 17.581 14.844 -2.843 1.00 1.35 C ATOM 291 CD GLN A 19 18.435 15.353 -4.015 1.00 41.44 C ATOM 292 OE1 GLN A 19 18.308 14.879 -5.140 1.00 4.11 O ATOM 293 NE2 GLN A 19 19.322 16.301 -3.773 1.00 51.14 N ATOM 0 H GLN A 19 14.838 15.592 -2.294 1.00 13.23 H new ATOM 0 HA GLN A 19 16.499 14.479 -0.313 1.00 4.25 H new ATOM 0 HB2 GLN A 19 16.888 16.807 -2.255 1.00 1.21 H new ATOM 0 HB3 GLN A 19 18.183 16.181 -1.253 1.00 1.21 H new ATOM 0 HG2 GLN A 19 18.100 14.011 -2.369 1.00 1.35 H new ATOM 0 HG3 GLN A 19 16.644 14.453 -3.238 1.00 1.35 H new ATOM 0 HE21 GLN A 19 19.415 16.684 -2.832 1.00 51.14 H new ATOM 0 HE22 GLN A 19 19.914 16.650 -4.527 1.00 51.14 H new ATOM 302 N MET A 20 15.221 17.359 0.549 1.00 53.35 N ATOM 303 CA MET A 20 15.017 18.277 1.695 1.00 21.31 C ATOM 304 C MET A 20 14.809 17.504 3.025 1.00 53.30 C ATOM 305 O MET A 20 15.411 17.862 4.036 1.00 14.23 O ATOM 306 CB MET A 20 13.835 19.260 1.448 1.00 5.32 C ATOM 307 CG MET A 20 14.010 20.185 0.231 1.00 22.21 C ATOM 308 SD MET A 20 12.772 21.509 0.136 1.00 1.44 S ATOM 309 CE MET A 20 11.218 20.619 0.093 1.00 2.31 C ATOM 0 H MET A 20 14.549 17.488 -0.207 1.00 53.35 H new ATOM 0 HA MET A 20 15.931 18.865 1.786 1.00 21.31 H new ATOM 0 HB2 MET A 20 12.920 18.681 1.319 1.00 5.32 H new ATOM 0 HB3 MET A 20 13.700 19.875 2.338 1.00 5.32 H new ATOM 0 HG2 MET A 20 15.004 20.631 0.265 1.00 22.21 H new ATOM 0 HG3 MET A 20 13.960 19.587 -0.679 1.00 22.21 H new ATOM 0 HE1 MET A 20 10.436 21.271 -0.297 1.00 2.31 H new ATOM 0 HE2 MET A 20 11.317 19.745 -0.551 1.00 2.31 H new ATOM 0 HE3 MET A 20 10.954 20.298 1.101 1.00 2.31 H new ATOM 319 N LEU A 21 13.971 16.432 3.021 1.00 31.20 N ATOM 320 CA LEU A 21 13.795 15.565 4.223 1.00 70.40 C ATOM 321 C LEU A 21 14.963 14.557 4.374 1.00 3.04 C ATOM 322 O LEU A 21 15.377 14.252 5.496 1.00 10.41 O ATOM 323 CB LEU A 21 12.386 14.857 4.249 1.00 13.31 C ATOM 324 CG LEU A 21 11.985 13.829 3.111 1.00 72.25 C ATOM 325 CD1 LEU A 21 12.684 12.458 3.256 1.00 33.23 C ATOM 326 CD2 LEU A 21 10.453 13.628 3.046 1.00 50.04 C ATOM 0 H LEU A 21 13.415 16.149 2.214 1.00 31.20 H new ATOM 0 HA LEU A 21 13.823 16.218 5.095 1.00 70.40 H new ATOM 0 HB2 LEU A 21 12.307 14.332 5.201 1.00 13.31 H new ATOM 0 HB3 LEU A 21 11.630 15.643 4.255 1.00 13.31 H new ATOM 0 HG LEU A 21 12.331 14.275 2.179 1.00 72.25 H new ATOM 0 HD11 LEU A 21 12.367 11.801 2.447 1.00 33.23 H new ATOM 0 HD12 LEU A 21 13.765 12.594 3.211 1.00 33.23 H new ATOM 0 HD13 LEU A 21 12.414 12.011 4.213 1.00 33.23 H new ATOM 0 HD21 LEU A 21 10.213 12.917 2.255 1.00 50.04 H new ATOM 0 HD22 LEU A 21 10.096 13.243 4.001 1.00 50.04 H new ATOM 0 HD23 LEU A 21 9.969 14.582 2.836 1.00 50.04 H new ATOM 338 N GLU A 22 15.501 14.064 3.230 1.00 23.01 N ATOM 339 CA GLU A 22 16.562 13.022 3.212 1.00 64.53 C ATOM 340 C GLU A 22 17.837 13.472 3.943 1.00 3.03 C ATOM 341 O GLU A 22 18.483 12.655 4.603 1.00 44.21 O ATOM 342 CB GLU A 22 16.900 12.585 1.762 1.00 54.50 C ATOM 343 CG GLU A 22 15.736 11.896 1.021 1.00 71.40 C ATOM 344 CD GLU A 22 16.143 11.318 -0.343 1.00 70.22 C ATOM 345 OE1 GLU A 22 16.241 12.087 -1.317 1.00 70.40 O ATOM 346 OE2 GLU A 22 16.383 10.094 -0.443 1.00 14.11 O ATOM 0 H GLU A 22 15.215 14.374 2.301 1.00 23.01 H new ATOM 0 HA GLU A 22 16.159 12.164 3.751 1.00 64.53 H new ATOM 0 HB2 GLU A 22 17.209 13.462 1.193 1.00 54.50 H new ATOM 0 HB3 GLU A 22 17.752 11.905 1.789 1.00 54.50 H new ATOM 0 HG2 GLU A 22 15.341 11.094 1.645 1.00 71.40 H new ATOM 0 HG3 GLU A 22 14.929 12.615 0.877 1.00 71.40 H new ATOM 353 N ALA A 23 18.172 14.776 3.828 1.00 1.20 N ATOM 354 CA ALA A 23 19.294 15.392 4.576 1.00 12.45 C ATOM 355 C ALA A 23 19.177 15.162 6.105 1.00 5.32 C ATOM 356 O ALA A 23 20.175 14.898 6.785 1.00 73.23 O ATOM 357 CB ALA A 23 19.362 16.898 4.270 1.00 74.22 C ATOM 0 H ALA A 23 17.677 15.428 3.219 1.00 1.20 H new ATOM 0 HA ALA A 23 20.213 14.908 4.246 1.00 12.45 H new ATOM 0 HB1 ALA A 23 20.188 17.345 4.823 1.00 74.22 H new ATOM 0 HB2 ALA A 23 19.518 17.045 3.201 1.00 74.22 H new ATOM 0 HB3 ALA A 23 18.427 17.373 4.569 1.00 74.22 H new ATOM 363 N HIS A 24 17.935 15.254 6.620 1.00 62.13 N ATOM 364 CA HIS A 24 17.627 14.998 8.043 1.00 21.13 C ATOM 365 C HIS A 24 17.723 13.492 8.365 1.00 2.32 C ATOM 366 O HIS A 24 18.319 13.120 9.369 1.00 50.24 O ATOM 367 CB HIS A 24 16.221 15.533 8.408 1.00 73.44 C ATOM 368 CG HIS A 24 16.063 17.016 8.205 1.00 0.32 C ATOM 369 ND1 HIS A 24 16.100 17.935 9.232 1.00 73.12 N ATOM 370 CD2 HIS A 24 15.886 17.739 7.076 1.00 20.30 C ATOM 371 CE1 HIS A 24 15.956 19.152 8.740 1.00 1.34 C ATOM 372 NE2 HIS A 24 15.826 19.055 7.438 1.00 32.24 N ATOM 0 H HIS A 24 17.118 15.507 6.064 1.00 62.13 H new ATOM 0 HA HIS A 24 18.366 15.528 8.644 1.00 21.13 H new ATOM 0 HB2 HIS A 24 15.477 15.012 7.806 1.00 73.44 H new ATOM 0 HB3 HIS A 24 16.011 15.294 9.451 1.00 73.44 H new ATOM 0 HD2 HIS A 24 15.807 17.348 6.072 1.00 20.30 H new ATOM 0 HE1 HIS A 24 15.947 20.069 9.311 1.00 1.34 H new ATOM 0 HE2 HIS A 24 15.700 19.839 6.797 1.00 32.24 H new ATOM 381 N MET A 25 17.145 12.645 7.481 1.00 1.43 N ATOM 382 CA MET A 25 17.186 11.159 7.611 1.00 40.21 C ATOM 383 C MET A 25 18.627 10.599 7.751 1.00 41.35 C ATOM 384 O MET A 25 18.829 9.603 8.446 1.00 31.21 O ATOM 385 CB MET A 25 16.465 10.489 6.403 1.00 62.24 C ATOM 386 CG MET A 25 14.939 10.435 6.527 1.00 14.34 C ATOM 387 SD MET A 25 14.214 12.048 6.870 1.00 23.22 S ATOM 388 CE MET A 25 12.495 11.616 7.050 1.00 24.55 C ATOM 0 H MET A 25 16.637 12.966 6.657 1.00 1.43 H new ATOM 0 HA MET A 25 16.662 10.914 8.535 1.00 40.21 H new ATOM 0 HB2 MET A 25 16.724 11.032 5.494 1.00 62.24 H new ATOM 0 HB3 MET A 25 16.844 9.474 6.287 1.00 62.24 H new ATOM 0 HG2 MET A 25 14.517 10.040 5.603 1.00 14.34 H new ATOM 0 HG3 MET A 25 14.667 9.742 7.323 1.00 14.34 H new ATOM 0 HE1 MET A 25 11.896 12.216 6.365 1.00 24.55 H new ATOM 0 HE2 MET A 25 12.360 10.559 6.821 1.00 24.55 H new ATOM 0 HE3 MET A 25 12.177 11.809 8.075 1.00 24.55 H new ATOM 398 N GLN A 26 19.609 11.236 7.074 1.00 32.31 N ATOM 399 CA GLN A 26 21.050 10.871 7.208 1.00 54.34 C ATOM 400 C GLN A 26 21.550 10.866 8.682 1.00 43.23 C ATOM 401 O GLN A 26 22.437 10.086 9.037 1.00 62.20 O ATOM 402 CB GLN A 26 21.953 11.809 6.356 1.00 23.31 C ATOM 403 CG GLN A 26 21.520 11.952 4.883 1.00 71.41 C ATOM 404 CD GLN A 26 21.294 10.623 4.142 1.00 1.14 C ATOM 405 OE1 GLN A 26 21.967 9.629 4.380 1.00 22.24 O ATOM 406 NE2 GLN A 26 20.311 10.593 3.265 1.00 74.12 N ATOM 0 H GLN A 26 19.437 12.006 6.428 1.00 32.31 H new ATOM 0 HA GLN A 26 21.127 9.850 6.834 1.00 54.34 H new ATOM 0 HB2 GLN A 26 21.964 12.797 6.816 1.00 23.31 H new ATOM 0 HB3 GLN A 26 22.976 11.433 6.386 1.00 23.31 H new ATOM 0 HG2 GLN A 26 20.599 12.533 4.845 1.00 71.41 H new ATOM 0 HG3 GLN A 26 22.280 12.524 4.350 1.00 71.41 H new ATOM 0 HE21 GLN A 26 19.764 11.434 3.083 1.00 74.12 H new ATOM 0 HE22 GLN A 26 20.097 9.728 2.768 1.00 74.12 H new ATOM 415 N SER A 27 20.948 11.717 9.536 1.00 71.21 N ATOM 416 CA SER A 27 21.354 11.876 10.961 1.00 50.31 C ATOM 417 C SER A 27 20.156 11.705 11.943 1.00 72.32 C ATOM 418 O SER A 27 20.307 11.916 13.156 1.00 12.43 O ATOM 419 CB SER A 27 22.028 13.266 11.147 1.00 72.01 C ATOM 420 OG SER A 27 22.543 13.446 12.461 1.00 43.13 O ATOM 0 H SER A 27 20.168 12.316 9.266 1.00 71.21 H new ATOM 0 HA SER A 27 22.064 11.085 11.202 1.00 50.31 H new ATOM 0 HB2 SER A 27 22.837 13.374 10.424 1.00 72.01 H new ATOM 0 HB3 SER A 27 21.302 14.051 10.933 1.00 72.01 H new ATOM 0 HG SER A 27 21.977 12.968 13.102 1.00 43.13 H new ATOM 426 N TYR A 28 18.974 11.284 11.434 1.00 45.00 N ATOM 427 CA TYR A 28 17.745 11.170 12.266 1.00 60.30 C ATOM 428 C TYR A 28 17.518 9.714 12.739 1.00 44.10 C ATOM 429 O TYR A 28 17.082 8.855 11.965 1.00 53.45 O ATOM 430 CB TYR A 28 16.501 11.689 11.490 1.00 40.41 C ATOM 431 CG TYR A 28 15.231 11.830 12.357 1.00 3.04 C ATOM 432 CD1 TYR A 28 14.979 12.998 13.084 1.00 21.31 C ATOM 433 CD2 TYR A 28 14.297 10.792 12.465 1.00 24.44 C ATOM 434 CE1 TYR A 28 13.856 13.122 13.881 1.00 52.11 C ATOM 435 CE2 TYR A 28 13.177 10.919 13.257 1.00 12.35 C ATOM 436 CZ TYR A 28 12.959 12.078 13.963 1.00 41.02 C ATOM 437 OH TYR A 28 11.840 12.194 14.757 1.00 61.44 O ATOM 0 H TYR A 28 18.842 11.018 10.458 1.00 45.00 H new ATOM 0 HA TYR A 28 17.887 11.793 13.149 1.00 60.30 H new ATOM 0 HB2 TYR A 28 16.738 12.658 11.051 1.00 40.41 H new ATOM 0 HB3 TYR A 28 16.291 11.009 10.665 1.00 40.41 H new ATOM 0 HD1 TYR A 28 15.676 13.820 13.022 1.00 21.31 H new ATOM 0 HD2 TYR A 28 14.458 9.875 11.917 1.00 24.44 H new ATOM 0 HE1 TYR A 28 13.682 14.032 14.436 1.00 52.11 H new ATOM 0 HE2 TYR A 28 12.469 10.106 13.323 1.00 12.35 H new ATOM 0 HH TYR A 28 11.065 12.418 14.200 1.00 61.44 H new ATOM 447 N LYS A 29 17.855 9.452 14.017 1.00 74.21 N ATOM 448 CA LYS A 29 17.503 8.201 14.733 1.00 45.14 C ATOM 449 C LYS A 29 17.023 8.553 16.161 1.00 52.44 C ATOM 450 O LYS A 29 17.837 8.686 17.086 1.00 21.14 O ATOM 451 CB LYS A 29 18.713 7.215 14.787 1.00 33.22 C ATOM 452 CG LYS A 29 19.106 6.585 13.432 1.00 61.43 C ATOM 453 CD LYS A 29 17.991 5.686 12.843 1.00 22.42 C ATOM 454 CE LYS A 29 18.405 5.032 11.515 1.00 43.44 C ATOM 455 NZ LYS A 29 19.626 4.199 11.661 1.00 1.10 N ATOM 0 H LYS A 29 18.385 10.108 14.591 1.00 74.21 H new ATOM 0 HA LYS A 29 16.702 7.699 14.191 1.00 45.14 H new ATOM 0 HB2 LYS A 29 19.577 7.746 15.187 1.00 33.22 H new ATOM 0 HB3 LYS A 29 18.478 6.414 15.488 1.00 33.22 H new ATOM 0 HG2 LYS A 29 19.340 7.378 12.722 1.00 61.43 H new ATOM 0 HG3 LYS A 29 20.013 5.994 13.560 1.00 61.43 H new ATOM 0 HD2 LYS A 29 17.736 4.909 13.564 1.00 22.42 H new ATOM 0 HD3 LYS A 29 17.092 6.282 12.686 1.00 22.42 H new ATOM 0 HE2 LYS A 29 17.587 4.414 11.145 1.00 43.44 H new ATOM 0 HE3 LYS A 29 18.582 5.807 10.769 1.00 43.44 H new ATOM 0 HZ1 LYS A 29 19.765 3.632 10.800 1.00 1.10 H new ATOM 0 HZ2 LYS A 29 20.451 4.815 11.807 1.00 1.10 H new ATOM 0 HZ3 LYS A 29 19.518 3.566 12.479 1.00 1.10 H new ATOM 469 N GLY A 30 15.698 8.754 16.324 1.00 23.33 N ATOM 470 CA GLY A 30 15.129 9.136 17.623 1.00 1.10 C ATOM 471 C GLY A 30 13.645 8.819 17.760 1.00 42.12 C ATOM 472 O GLY A 30 13.286 7.815 18.368 1.00 55.21 O ATOM 0 H GLY A 30 15.012 8.658 15.576 1.00 23.33 H new ATOM 0 HA2 GLY A 30 15.675 8.622 18.414 1.00 1.10 H new ATOM 0 HA3 GLY A 30 15.278 10.205 17.775 1.00 1.10 H new ATOM 476 N ASN A 31 12.769 9.679 17.203 1.00 3.54 N ATOM 477 CA ASN A 31 11.302 9.563 17.404 1.00 1.54 C ATOM 478 C ASN A 31 10.614 8.846 16.211 1.00 25.40 C ATOM 479 O ASN A 31 10.437 7.622 16.241 1.00 24.33 O ATOM 480 CB ASN A 31 10.668 10.964 17.663 1.00 11.31 C ATOM 481 CG ASN A 31 11.241 11.688 18.890 1.00 61.25 C ATOM 482 OD1 ASN A 31 12.417 11.580 19.205 1.00 41.44 O ATOM 483 ND2 ASN A 31 10.411 12.425 19.599 1.00 22.15 N ATOM 0 H ASN A 31 13.047 10.462 16.611 1.00 3.54 H new ATOM 0 HA ASN A 31 11.137 8.946 18.288 1.00 1.54 H new ATOM 0 HB2 ASN A 31 10.818 11.588 16.782 1.00 11.31 H new ATOM 0 HB3 ASN A 31 9.592 10.847 17.792 1.00 11.31 H new ATOM 0 HD21 ASN A 31 10.746 12.918 20.427 1.00 22.15 H new ATOM 0 HD22 ASN A 31 9.433 12.503 19.320 1.00 22.15 H new ATOM 490 N ASP A 32 10.260 9.603 15.149 1.00 55.05 N ATOM 491 CA ASP A 32 9.487 9.064 14.006 1.00 32.53 C ATOM 492 C ASP A 32 9.794 9.855 12.704 1.00 2.41 C ATOM 493 O ASP A 32 9.412 11.025 12.577 1.00 33.51 O ATOM 494 CB ASP A 32 7.967 9.109 14.325 1.00 61.33 C ATOM 495 CG ASP A 32 7.116 8.355 13.291 1.00 74.20 C ATOM 496 OD1 ASP A 32 6.909 7.141 13.460 1.00 4.04 O ATOM 497 OD2 ASP A 32 6.655 8.972 12.308 1.00 22.14 O ATOM 0 H ASP A 32 10.497 10.591 15.059 1.00 55.05 H new ATOM 0 HA ASP A 32 9.785 8.028 13.846 1.00 32.53 H new ATOM 0 HB2 ASP A 32 7.795 8.680 15.312 1.00 61.33 H new ATOM 0 HB3 ASP A 32 7.641 10.148 14.368 1.00 61.33 H new ATOM 502 N PRO A 33 10.505 9.229 11.709 1.00 71.53 N ATOM 503 CA PRO A 33 10.801 9.874 10.407 1.00 22.13 C ATOM 504 C PRO A 33 9.597 9.861 9.429 1.00 55.32 C ATOM 505 O PRO A 33 9.543 10.685 8.519 1.00 4.23 O ATOM 506 CB PRO A 33 11.977 9.021 9.874 1.00 3.52 C ATOM 507 CG PRO A 33 11.719 7.651 10.420 1.00 3.15 C ATOM 508 CD PRO A 33 11.102 7.863 11.789 1.00 1.44 C ATOM 0 HA PRO A 33 11.031 10.934 10.510 1.00 22.13 H new ATOM 0 HB2 PRO A 33 12.003 9.016 8.784 1.00 3.52 H new ATOM 0 HB3 PRO A 33 12.937 9.410 10.214 1.00 3.52 H new ATOM 0 HG2 PRO A 33 11.047 7.091 9.770 1.00 3.15 H new ATOM 0 HG3 PRO A 33 12.643 7.078 10.492 1.00 3.15 H new ATOM 0 HD2 PRO A 33 10.346 7.109 12.007 1.00 1.44 H new ATOM 0 HD3 PRO A 33 11.851 7.800 12.578 1.00 1.44 H new ATOM 516 N LEU A 34 8.631 8.932 9.642 1.00 71.12 N ATOM 517 CA LEU A 34 7.463 8.757 8.741 1.00 23.55 C ATOM 518 C LEU A 34 6.571 10.019 8.707 1.00 14.24 C ATOM 519 O LEU A 34 6.044 10.371 7.652 1.00 24.42 O ATOM 520 CB LEU A 34 6.625 7.515 9.162 1.00 4.14 C ATOM 521 CG LEU A 34 5.360 7.198 8.281 1.00 50.34 C ATOM 522 CD1 LEU A 34 5.744 6.907 6.820 1.00 74.31 C ATOM 523 CD2 LEU A 34 4.522 6.044 8.866 1.00 45.21 C ATOM 0 H LEU A 34 8.638 8.289 10.434 1.00 71.12 H new ATOM 0 HA LEU A 34 7.850 8.597 7.735 1.00 23.55 H new ATOM 0 HB2 LEU A 34 7.277 6.642 9.151 1.00 4.14 H new ATOM 0 HB3 LEU A 34 6.298 7.656 10.192 1.00 4.14 H new ATOM 0 HG LEU A 34 4.740 8.094 8.294 1.00 50.34 H new ATOM 0 HD11 LEU A 34 4.844 6.693 6.243 1.00 74.31 H new ATOM 0 HD12 LEU A 34 6.248 7.776 6.396 1.00 74.31 H new ATOM 0 HD13 LEU A 34 6.412 6.046 6.784 1.00 74.31 H new ATOM 0 HD21 LEU A 34 3.659 5.860 8.226 1.00 45.21 H new ATOM 0 HD22 LEU A 34 5.132 5.143 8.921 1.00 45.21 H new ATOM 0 HD23 LEU A 34 4.181 6.313 9.866 1.00 45.21 H new ATOM 535 N GLY A 35 6.431 10.695 9.868 1.00 64.43 N ATOM 536 CA GLY A 35 5.673 11.953 9.965 1.00 43.21 C ATOM 537 C GLY A 35 6.228 13.056 9.065 1.00 35.23 C ATOM 538 O GLY A 35 5.465 13.812 8.459 1.00 40.31 O ATOM 0 H GLY A 35 6.836 10.386 10.752 1.00 64.43 H new ATOM 0 HA2 GLY A 35 4.632 11.765 9.700 1.00 43.21 H new ATOM 0 HA3 GLY A 35 5.682 12.297 10.999 1.00 43.21 H new ATOM 542 N GLU A 36 7.572 13.103 8.960 1.00 51.24 N ATOM 543 CA GLU A 36 8.294 14.026 8.061 1.00 43.13 C ATOM 544 C GLU A 36 7.934 13.764 6.579 1.00 42.10 C ATOM 545 O GLU A 36 7.700 14.701 5.814 1.00 12.13 O ATOM 546 CB GLU A 36 9.820 13.870 8.279 1.00 63.51 C ATOM 547 CG GLU A 36 10.704 14.907 7.552 1.00 33.40 C ATOM 548 CD GLU A 36 10.536 16.326 8.107 1.00 24.01 C ATOM 549 OE1 GLU A 36 11.041 16.589 9.221 1.00 41.22 O ATOM 550 OE2 GLU A 36 9.900 17.176 7.451 1.00 0.34 O ATOM 0 H GLU A 36 8.190 12.498 9.500 1.00 51.24 H new ATOM 0 HA GLU A 36 7.994 15.047 8.299 1.00 43.13 H new ATOM 0 HB2 GLU A 36 10.025 13.929 9.348 1.00 63.51 H new ATOM 0 HB3 GLU A 36 10.116 12.873 7.953 1.00 63.51 H new ATOM 0 HG2 GLU A 36 11.749 14.610 7.638 1.00 33.40 H new ATOM 0 HG3 GLU A 36 10.458 14.906 6.490 1.00 33.40 H new ATOM 557 N TRP A 37 7.885 12.472 6.198 1.00 13.54 N ATOM 558 CA TRP A 37 7.428 12.044 4.858 1.00 40.10 C ATOM 559 C TRP A 37 5.980 12.489 4.584 1.00 4.51 C ATOM 560 O TRP A 37 5.709 13.074 3.540 1.00 44.05 O ATOM 561 CB TRP A 37 7.526 10.510 4.709 1.00 72.35 C ATOM 562 CG TRP A 37 8.932 9.984 4.565 1.00 1.55 C ATOM 563 CD1 TRP A 37 9.817 9.691 5.557 1.00 12.24 C ATOM 564 CD2 TRP A 37 9.599 9.674 3.336 1.00 42.14 C ATOM 565 NE1 TRP A 37 10.988 9.221 5.024 1.00 74.32 N ATOM 566 CE2 TRP A 37 10.875 9.198 3.663 1.00 52.31 C ATOM 567 CE3 TRP A 37 9.231 9.750 1.990 1.00 2.54 C ATOM 568 CZ2 TRP A 37 11.788 8.799 2.699 1.00 24.13 C ATOM 569 CZ3 TRP A 37 10.139 9.354 1.035 1.00 21.44 C ATOM 570 CH2 TRP A 37 11.405 8.881 1.394 1.00 5.04 C ATOM 0 H TRP A 37 8.159 11.699 6.805 1.00 13.54 H new ATOM 0 HA TRP A 37 8.083 12.522 4.130 1.00 40.10 H new ATOM 0 HB2 TRP A 37 7.064 10.043 5.579 1.00 72.35 H new ATOM 0 HB3 TRP A 37 6.946 10.205 3.838 1.00 72.35 H new ATOM 0 HD1 TRP A 37 9.624 9.812 6.613 1.00 12.24 H new ATOM 0 HE1 TRP A 37 11.810 8.935 5.556 1.00 74.32 H new ATOM 0 HE3 TRP A 37 8.254 10.112 1.705 1.00 2.54 H new ATOM 0 HZ2 TRP A 37 12.768 8.436 2.973 1.00 24.13 H new ATOM 0 HZ3 TRP A 37 9.869 9.409 -0.009 1.00 21.44 H new ATOM 0 HH2 TRP A 37 12.094 8.574 0.621 1.00 5.04 H new ATOM 581 N GLU A 38 5.068 12.220 5.550 1.00 20.44 N ATOM 582 CA GLU A 38 3.628 12.546 5.423 1.00 61.13 C ATOM 583 C GLU A 38 3.405 14.047 5.148 1.00 33.24 C ATOM 584 O GLU A 38 2.485 14.409 4.412 1.00 14.24 O ATOM 585 CB GLU A 38 2.839 12.148 6.692 1.00 42.13 C ATOM 586 CG GLU A 38 2.894 10.655 7.065 1.00 53.41 C ATOM 587 CD GLU A 38 1.914 10.303 8.194 1.00 50.34 C ATOM 588 OE1 GLU A 38 2.112 10.795 9.322 1.00 24.21 O ATOM 589 OE2 GLU A 38 0.917 9.584 7.953 1.00 5.12 O ATOM 0 H GLU A 38 5.309 11.773 6.435 1.00 20.44 H new ATOM 0 HA GLU A 38 3.259 11.969 4.575 1.00 61.13 H new ATOM 0 HB2 GLU A 38 3.219 12.729 7.532 1.00 42.13 H new ATOM 0 HB3 GLU A 38 1.796 12.432 6.554 1.00 42.13 H new ATOM 0 HG2 GLU A 38 2.664 10.054 6.186 1.00 53.41 H new ATOM 0 HG3 GLU A 38 3.907 10.396 7.372 1.00 53.41 H new ATOM 596 N ARG A 39 4.268 14.899 5.751 1.00 20.33 N ATOM 597 CA ARG A 39 4.274 16.357 5.513 1.00 61.42 C ATOM 598 C ARG A 39 4.499 16.692 4.030 1.00 62.44 C ATOM 599 O ARG A 39 3.876 17.604 3.514 1.00 15.01 O ATOM 600 CB ARG A 39 5.357 17.052 6.379 1.00 1.11 C ATOM 601 CG ARG A 39 5.098 16.967 7.895 1.00 44.33 C ATOM 602 CD ARG A 39 3.806 17.689 8.327 1.00 33.41 C ATOM 603 NE ARG A 39 3.537 17.488 9.755 1.00 42.44 N ATOM 604 CZ ARG A 39 2.629 18.114 10.465 1.00 45.14 C ATOM 605 NH1 ARG A 39 1.886 19.054 9.958 1.00 20.11 N ATOM 606 NH2 ARG A 39 2.476 17.796 11.705 1.00 73.21 N ATOM 0 H ARG A 39 4.978 14.592 6.416 1.00 20.33 H new ATOM 0 HA ARG A 39 3.292 16.732 5.800 1.00 61.42 H new ATOM 0 HB2 ARG A 39 6.326 16.602 6.161 1.00 1.11 H new ATOM 0 HB3 ARG A 39 5.420 18.101 6.090 1.00 1.11 H new ATOM 0 HG2 ARG A 39 5.038 15.919 8.190 1.00 44.33 H new ATOM 0 HG3 ARG A 39 5.945 17.400 8.428 1.00 44.33 H new ATOM 0 HD2 ARG A 39 3.895 18.755 8.118 1.00 33.41 H new ATOM 0 HD3 ARG A 39 2.966 17.318 7.740 1.00 33.41 H new ATOM 0 HE ARG A 39 4.109 16.797 10.241 1.00 42.44 H new ATOM 0 HH11 ARG A 39 2.001 19.324 8.981 1.00 20.11 H new ATOM 0 HH12 ARG A 39 1.189 19.521 10.538 1.00 20.11 H new ATOM 0 HH21 ARG A 39 3.057 17.067 12.120 1.00 73.21 H new ATOM 0 HH22 ARG A 39 1.774 18.273 12.271 1.00 73.21 H new ATOM 620 N TYR A 40 5.378 15.932 3.361 1.00 14.00 N ATOM 621 CA TYR A 40 5.708 16.134 1.930 1.00 62.25 C ATOM 622 C TYR A 40 4.644 15.502 0.995 1.00 73.31 C ATOM 623 O TYR A 40 4.367 16.060 -0.069 1.00 25.04 O ATOM 624 CB TYR A 40 7.123 15.586 1.623 1.00 72.53 C ATOM 625 CG TYR A 40 8.279 16.410 2.232 1.00 14.34 C ATOM 626 CD1 TYR A 40 8.311 16.730 3.595 1.00 62.25 C ATOM 627 CD2 TYR A 40 9.354 16.846 1.451 1.00 74.33 C ATOM 628 CE1 TYR A 40 9.353 17.441 4.149 1.00 52.41 C ATOM 629 CE2 TYR A 40 10.397 17.562 2.008 1.00 3.51 C ATOM 630 CZ TYR A 40 10.393 17.856 3.353 1.00 73.22 C ATOM 631 OH TYR A 40 11.446 18.553 3.902 1.00 12.34 O ATOM 0 H TYR A 40 5.884 15.158 3.791 1.00 14.00 H new ATOM 0 HA TYR A 40 5.702 17.206 1.734 1.00 62.25 H new ATOM 0 HB2 TYR A 40 7.190 14.563 1.993 1.00 72.53 H new ATOM 0 HB3 TYR A 40 7.255 15.544 0.542 1.00 72.53 H new ATOM 0 HD1 TYR A 40 7.497 16.411 4.229 1.00 62.25 H new ATOM 0 HD2 TYR A 40 9.370 16.620 0.395 1.00 74.33 H new ATOM 0 HE1 TYR A 40 9.352 17.671 5.204 1.00 52.41 H new ATOM 0 HE2 TYR A 40 11.217 17.891 1.387 1.00 3.51 H new ATOM 0 HH TYR A 40 11.571 18.277 4.834 1.00 12.34 H new ATOM 641 N ILE A 41 4.048 14.350 1.404 1.00 44.01 N ATOM 642 CA ILE A 41 2.929 13.710 0.652 1.00 60.11 C ATOM 643 C ILE A 41 1.708 14.667 0.564 1.00 73.40 C ATOM 644 O ILE A 41 1.161 14.874 -0.516 1.00 14.32 O ATOM 645 CB ILE A 41 2.485 12.294 1.257 1.00 34.14 C ATOM 646 CG1 ILE A 41 3.434 11.123 0.801 1.00 22.33 C ATOM 647 CG2 ILE A 41 1.012 11.932 0.891 1.00 33.22 C ATOM 648 CD1 ILE A 41 4.862 11.169 1.305 1.00 62.33 C ATOM 0 H ILE A 41 4.321 13.845 2.247 1.00 44.01 H new ATOM 0 HA ILE A 41 3.309 13.514 -0.350 1.00 60.11 H new ATOM 0 HB ILE A 41 2.562 12.404 2.339 1.00 34.14 H new ATOM 0 HG12 ILE A 41 2.990 10.181 1.122 1.00 22.33 H new ATOM 0 HG13 ILE A 41 3.458 11.109 -0.289 1.00 22.33 H new ATOM 0 HG21 ILE A 41 0.757 10.964 1.323 1.00 33.22 H new ATOM 0 HG22 ILE A 41 0.341 12.694 1.287 1.00 33.22 H new ATOM 0 HG23 ILE A 41 0.908 11.884 -0.193 1.00 33.22 H new ATOM 0 HD11 ILE A 41 5.411 10.309 0.921 1.00 62.33 H new ATOM 0 HD12 ILE A 41 5.339 12.087 0.962 1.00 62.33 H new ATOM 0 HD13 ILE A 41 4.864 11.144 2.395 1.00 62.33 H new ATOM 660 N GLN A 42 1.287 15.246 1.706 1.00 55.14 N ATOM 661 CA GLN A 42 0.187 16.239 1.718 1.00 23.00 C ATOM 662 C GLN A 42 0.617 17.559 1.032 1.00 1.01 C ATOM 663 O GLN A 42 -0.204 18.220 0.397 1.00 61.04 O ATOM 664 CB GLN A 42 -0.299 16.543 3.159 1.00 64.40 C ATOM 665 CG GLN A 42 0.785 17.133 4.090 1.00 4.21 C ATOM 666 CD GLN A 42 0.232 17.885 5.290 1.00 20.15 C ATOM 667 OE1 GLN A 42 0.024 17.327 6.359 1.00 45.31 O ATOM 668 NE2 GLN A 42 -0.020 19.165 5.100 1.00 1.33 N ATOM 0 H GLN A 42 1.685 15.048 2.624 1.00 55.14 H new ATOM 0 HA GLN A 42 -0.638 15.797 1.160 1.00 23.00 H new ATOM 0 HB2 GLN A 42 -1.135 17.241 3.107 1.00 64.40 H new ATOM 0 HB3 GLN A 42 -0.679 15.623 3.602 1.00 64.40 H new ATOM 0 HG2 GLN A 42 1.423 16.324 4.445 1.00 4.21 H new ATOM 0 HG3 GLN A 42 1.417 17.807 3.512 1.00 4.21 H new ATOM 0 HE21 GLN A 42 0.168 19.593 4.193 1.00 1.33 H new ATOM 0 HE22 GLN A 42 -0.403 19.728 5.860 1.00 1.33 H new ATOM 677 N TRP A 43 1.921 17.914 1.170 1.00 13.14 N ATOM 678 CA TRP A 43 2.484 19.178 0.647 1.00 41.05 C ATOM 679 C TRP A 43 2.371 19.258 -0.890 1.00 5.04 C ATOM 680 O TRP A 43 2.027 20.301 -1.430 1.00 4.12 O ATOM 681 CB TRP A 43 3.961 19.341 1.072 1.00 33.44 C ATOM 682 CG TRP A 43 4.601 20.651 0.679 1.00 61.31 C ATOM 683 CD1 TRP A 43 4.521 21.842 1.348 1.00 32.23 C ATOM 684 CD2 TRP A 43 5.425 20.894 -0.472 1.00 32.30 C ATOM 685 NE1 TRP A 43 5.228 22.803 0.676 1.00 64.13 N ATOM 686 CE2 TRP A 43 5.793 22.245 -0.439 1.00 64.41 C ATOM 687 CE3 TRP A 43 5.880 20.092 -1.530 1.00 12.53 C ATOM 688 CZ2 TRP A 43 6.597 22.818 -1.413 1.00 10.12 C ATOM 689 CZ3 TRP A 43 6.680 20.665 -2.499 1.00 0.32 C ATOM 690 CH2 TRP A 43 7.032 22.016 -2.433 1.00 22.45 C ATOM 0 H TRP A 43 2.608 17.330 1.647 1.00 13.14 H new ATOM 0 HA TRP A 43 1.899 19.991 1.076 1.00 41.05 H new ATOM 0 HB2 TRP A 43 4.025 19.234 2.155 1.00 33.44 H new ATOM 0 HB3 TRP A 43 4.540 18.527 0.636 1.00 33.44 H new ATOM 0 HD1 TRP A 43 3.980 22.001 2.269 1.00 32.23 H new ATOM 0 HE1 TRP A 43 5.319 23.778 0.961 1.00 64.13 H new ATOM 0 HE3 TRP A 43 5.610 19.048 -1.585 1.00 12.53 H new ATOM 0 HZ2 TRP A 43 6.871 23.862 -1.368 1.00 10.12 H new ATOM 0 HZ3 TRP A 43 7.039 20.061 -3.319 1.00 0.32 H new ATOM 0 HH2 TRP A 43 7.661 22.436 -3.204 1.00 22.45 H new ATOM 701 N VAL A 44 2.714 18.166 -1.589 1.00 54.13 N ATOM 702 CA VAL A 44 2.497 18.079 -3.051 1.00 31.12 C ATOM 703 C VAL A 44 0.986 18.071 -3.388 1.00 4.04 C ATOM 704 O VAL A 44 0.564 18.749 -4.304 1.00 31.03 O ATOM 705 CB VAL A 44 3.224 16.845 -3.708 1.00 73.54 C ATOM 706 CG1 VAL A 44 2.979 15.553 -2.919 1.00 35.12 C ATOM 707 CG2 VAL A 44 2.813 16.667 -5.198 1.00 73.34 C ATOM 0 H VAL A 44 3.139 17.336 -1.176 1.00 54.13 H new ATOM 0 HA VAL A 44 2.948 18.972 -3.483 1.00 31.12 H new ATOM 0 HB VAL A 44 4.293 17.055 -3.676 1.00 73.54 H new ATOM 0 HG11 VAL A 44 3.497 14.726 -3.405 1.00 35.12 H new ATOM 0 HG12 VAL A 44 3.356 15.670 -1.903 1.00 35.12 H new ATOM 0 HG13 VAL A 44 1.910 15.343 -2.888 1.00 35.12 H new ATOM 0 HG21 VAL A 44 3.334 15.807 -5.619 1.00 73.34 H new ATOM 0 HG22 VAL A 44 1.737 16.507 -5.262 1.00 73.34 H new ATOM 0 HG23 VAL A 44 3.080 17.563 -5.759 1.00 73.34 H new ATOM 717 N GLU A 45 0.173 17.357 -2.605 1.00 31.12 N ATOM 718 CA GLU A 45 -1.283 17.254 -2.867 1.00 50.12 C ATOM 719 C GLU A 45 -2.021 18.613 -2.699 1.00 33.15 C ATOM 720 O GLU A 45 -3.090 18.812 -3.278 1.00 72.32 O ATOM 721 CB GLU A 45 -1.917 16.144 -1.984 1.00 22.30 C ATOM 722 CG GLU A 45 -1.447 14.710 -2.343 1.00 62.12 C ATOM 723 CD GLU A 45 -1.906 14.246 -3.745 1.00 30.41 C ATOM 724 OE1 GLU A 45 -1.328 14.678 -4.769 1.00 63.52 O ATOM 725 OE2 GLU A 45 -2.862 13.451 -3.832 1.00 50.32 O ATOM 0 H GLU A 45 0.488 16.840 -1.784 1.00 31.12 H new ATOM 0 HA GLU A 45 -1.405 16.974 -3.913 1.00 50.12 H new ATOM 0 HB2 GLU A 45 -1.678 16.343 -0.939 1.00 22.30 H new ATOM 0 HB3 GLU A 45 -3.002 16.194 -2.078 1.00 22.30 H new ATOM 0 HG2 GLU A 45 -0.359 14.669 -2.293 1.00 62.12 H new ATOM 0 HG3 GLU A 45 -1.827 14.013 -1.596 1.00 62.12 H new ATOM 732 N GLU A 46 -1.444 19.543 -1.906 1.00 61.12 N ATOM 733 CA GLU A 46 -1.989 20.922 -1.738 1.00 75.40 C ATOM 734 C GLU A 46 -1.302 21.956 -2.695 1.00 65.34 C ATOM 735 O GLU A 46 -1.989 22.738 -3.358 1.00 14.25 O ATOM 736 CB GLU A 46 -1.869 21.368 -0.248 1.00 52.30 C ATOM 737 CG GLU A 46 -0.431 21.410 0.293 1.00 14.43 C ATOM 738 CD GLU A 46 -0.320 21.764 1.781 1.00 13.11 C ATOM 739 OE1 GLU A 46 -0.371 22.961 2.127 1.00 4.25 O ATOM 740 OE2 GLU A 46 -0.172 20.845 2.609 1.00 23.11 O ATOM 0 H GLU A 46 -0.596 19.369 -1.367 1.00 61.12 H new ATOM 0 HA GLU A 46 -3.043 20.896 -2.016 1.00 75.40 H new ATOM 0 HB2 GLU A 46 -2.312 22.358 -0.142 1.00 52.30 H new ATOM 0 HB3 GLU A 46 -2.456 20.688 0.370 1.00 52.30 H new ATOM 0 HG2 GLU A 46 0.034 20.438 0.128 1.00 14.43 H new ATOM 0 HG3 GLU A 46 0.139 22.138 -0.284 1.00 14.43 H new ATOM 747 N ASN A 47 0.054 21.942 -2.771 1.00 71.02 N ATOM 748 CA ASN A 47 0.854 22.929 -3.561 1.00 22.51 C ATOM 749 C ASN A 47 0.919 22.579 -5.067 1.00 5.12 C ATOM 750 O ASN A 47 0.817 23.462 -5.916 1.00 14.04 O ATOM 751 CB ASN A 47 2.302 23.047 -2.999 1.00 12.33 C ATOM 752 CG ASN A 47 2.380 23.804 -1.672 1.00 44.45 C ATOM 753 OD1 ASN A 47 2.535 25.018 -1.649 1.00 24.03 O ATOM 754 ND2 ASN A 47 2.285 23.109 -0.564 1.00 55.34 N ATOM 0 H ASN A 47 0.628 21.250 -2.289 1.00 71.02 H new ATOM 0 HA ASN A 47 0.339 23.884 -3.462 1.00 22.51 H new ATOM 0 HB2 ASN A 47 2.713 22.047 -2.863 1.00 12.33 H new ATOM 0 HB3 ASN A 47 2.929 23.552 -3.734 1.00 12.33 H new ATOM 0 HD21 ASN A 47 2.340 23.579 0.339 1.00 55.34 H new ATOM 0 HD22 ASN A 47 2.156 22.098 -0.606 1.00 55.34 H new ATOM 761 N PHE A 48 1.094 21.290 -5.385 1.00 75.35 N ATOM 762 CA PHE A 48 1.225 20.789 -6.785 1.00 51.43 C ATOM 763 C PHE A 48 0.221 19.616 -7.059 1.00 21.30 C ATOM 764 O PHE A 48 0.649 18.501 -7.400 1.00 35.31 O ATOM 765 CB PHE A 48 2.688 20.309 -7.034 1.00 24.55 C ATOM 766 CG PHE A 48 3.774 21.381 -6.891 1.00 64.01 C ATOM 767 CD1 PHE A 48 3.966 22.343 -7.885 1.00 3.13 C ATOM 768 CD2 PHE A 48 4.616 21.419 -5.775 1.00 43.21 C ATOM 769 CE1 PHE A 48 4.956 23.305 -7.766 1.00 12.02 C ATOM 770 CE2 PHE A 48 5.606 22.381 -5.665 1.00 1.30 C ATOM 771 CZ PHE A 48 5.775 23.323 -6.657 1.00 44.42 C ATOM 0 H PHE A 48 1.151 20.551 -4.684 1.00 75.35 H new ATOM 0 HA PHE A 48 0.987 21.604 -7.468 1.00 51.43 H new ATOM 0 HB2 PHE A 48 2.909 19.500 -6.338 1.00 24.55 H new ATOM 0 HB3 PHE A 48 2.747 19.890 -8.039 1.00 24.55 H new ATOM 0 HD1 PHE A 48 3.333 22.337 -8.760 1.00 3.13 H new ATOM 0 HD2 PHE A 48 4.493 20.689 -4.989 1.00 43.21 H new ATOM 0 HE1 PHE A 48 5.086 24.043 -8.544 1.00 12.02 H new ATOM 0 HE2 PHE A 48 6.249 22.393 -4.797 1.00 1.30 H new ATOM 0 HZ PHE A 48 6.547 24.073 -6.566 1.00 44.42 H new ATOM 781 N PRO A 49 -1.137 19.836 -6.915 1.00 22.04 N ATOM 782 CA PRO A 49 -2.137 18.727 -6.976 1.00 10.25 C ATOM 783 C PRO A 49 -2.219 18.050 -8.370 1.00 21.11 C ATOM 784 O PRO A 49 -2.482 16.855 -8.476 1.00 60.21 O ATOM 785 CB PRO A 49 -3.471 19.429 -6.601 1.00 62.33 C ATOM 786 CG PRO A 49 -3.263 20.869 -6.968 1.00 54.12 C ATOM 787 CD PRO A 49 -1.801 21.154 -6.701 1.00 54.15 C ATOM 0 HA PRO A 49 -1.874 17.906 -6.309 1.00 10.25 H new ATOM 0 HB2 PRO A 49 -4.311 18.999 -7.147 1.00 62.33 H new ATOM 0 HB3 PRO A 49 -3.691 19.319 -5.539 1.00 62.33 H new ATOM 0 HG2 PRO A 49 -3.511 21.046 -8.014 1.00 54.12 H new ATOM 0 HG3 PRO A 49 -3.904 21.521 -6.374 1.00 54.12 H new ATOM 0 HD2 PRO A 49 -1.411 21.913 -7.379 1.00 54.15 H new ATOM 0 HD3 PRO A 49 -1.644 21.521 -5.687 1.00 54.15 H new ATOM 795 N GLU A 50 -1.977 18.834 -9.428 1.00 34.35 N ATOM 796 CA GLU A 50 -1.989 18.348 -10.826 1.00 54.24 C ATOM 797 C GLU A 50 -0.600 17.793 -11.248 1.00 32.13 C ATOM 798 O GLU A 50 -0.452 17.231 -12.339 1.00 63.14 O ATOM 799 CB GLU A 50 -2.438 19.500 -11.762 1.00 22.32 C ATOM 800 CG GLU A 50 -3.763 20.173 -11.333 1.00 3.20 C ATOM 801 CD GLU A 50 -4.195 21.320 -12.260 1.00 43.41 C ATOM 802 OE1 GLU A 50 -3.710 22.457 -12.081 1.00 13.31 O ATOM 803 OE2 GLU A 50 -5.019 21.089 -13.174 1.00 44.33 O ATOM 0 H GLU A 50 -1.766 19.828 -9.345 1.00 34.35 H new ATOM 0 HA GLU A 50 -2.697 17.523 -10.906 1.00 54.24 H new ATOM 0 HB2 GLU A 50 -1.652 20.255 -11.796 1.00 22.32 H new ATOM 0 HB3 GLU A 50 -2.550 19.111 -12.774 1.00 22.32 H new ATOM 0 HG2 GLU A 50 -4.552 19.421 -11.307 1.00 3.20 H new ATOM 0 HG3 GLU A 50 -3.655 20.557 -10.319 1.00 3.20 H new ATOM 810 N ASN A 51 0.414 17.962 -10.375 1.00 50.25 N ATOM 811 CA ASN A 51 1.770 17.408 -10.582 1.00 4.31 C ATOM 812 C ASN A 51 2.013 16.181 -9.658 1.00 25.35 C ATOM 813 O ASN A 51 2.586 16.303 -8.565 1.00 21.33 O ATOM 814 CB ASN A 51 2.846 18.489 -10.322 1.00 55.13 C ATOM 815 CG ASN A 51 2.777 19.694 -11.254 1.00 51.44 C ATOM 816 OD1 ASN A 51 2.145 20.698 -10.951 1.00 32.11 O ATOM 817 ND2 ASN A 51 3.433 19.608 -12.393 1.00 71.41 N ATOM 0 H ASN A 51 0.317 18.487 -9.506 1.00 50.25 H new ATOM 0 HA ASN A 51 1.845 17.081 -11.619 1.00 4.31 H new ATOM 0 HB2 ASN A 51 2.751 18.837 -9.293 1.00 55.13 H new ATOM 0 HB3 ASN A 51 3.831 18.031 -10.414 1.00 55.13 H new ATOM 0 HD21 ASN A 51 3.423 20.390 -13.048 1.00 71.41 H new ATOM 0 HD22 ASN A 51 3.951 18.759 -12.620 1.00 71.41 H new ATOM 824 N LYS A 52 1.563 14.994 -10.113 1.00 44.33 N ATOM 825 CA LYS A 52 1.821 13.704 -9.417 1.00 70.33 C ATOM 826 C LYS A 52 3.301 13.264 -9.544 1.00 44.13 C ATOM 827 O LYS A 52 3.732 12.339 -8.856 1.00 2.11 O ATOM 828 CB LYS A 52 0.872 12.599 -9.961 1.00 10.31 C ATOM 829 CG LYS A 52 -0.616 12.807 -9.592 1.00 35.02 C ATOM 830 CD LYS A 52 -0.854 12.738 -8.064 1.00 51.43 C ATOM 831 CE LYS A 52 -2.330 12.912 -7.669 1.00 62.15 C ATOM 832 NZ LYS A 52 -2.845 14.264 -7.982 1.00 35.54 N ATOM 0 H LYS A 52 1.014 14.896 -10.967 1.00 44.33 H new ATOM 0 HA LYS A 52 1.619 13.855 -8.357 1.00 70.33 H new ATOM 0 HB2 LYS A 52 0.964 12.558 -11.046 1.00 10.31 H new ATOM 0 HB3 LYS A 52 1.199 11.633 -9.577 1.00 10.31 H new ATOM 0 HG2 LYS A 52 -0.950 13.775 -9.967 1.00 35.02 H new ATOM 0 HG3 LYS A 52 -1.221 12.047 -10.087 1.00 35.02 H new ATOM 0 HD2 LYS A 52 -0.496 11.779 -7.691 1.00 51.43 H new ATOM 0 HD3 LYS A 52 -0.261 13.511 -7.576 1.00 51.43 H new ATOM 0 HE2 LYS A 52 -2.932 12.168 -8.190 1.00 62.15 H new ATOM 0 HE3 LYS A 52 -2.442 12.722 -6.601 1.00 62.15 H new ATOM 0 HZ1 LYS A 52 -3.488 14.574 -7.226 1.00 35.54 H new ATOM 0 HZ2 LYS A 52 -2.050 14.930 -8.055 1.00 35.54 H new ATOM 0 HZ3 LYS A 52 -3.360 14.239 -8.885 1.00 35.54 H new ATOM 846 N GLU A 53 4.059 13.944 -10.431 1.00 22.42 N ATOM 847 CA GLU A 53 5.521 13.762 -10.591 1.00 3.22 C ATOM 848 C GLU A 53 6.284 13.884 -9.246 1.00 43.44 C ATOM 849 O GLU A 53 7.207 13.113 -8.994 1.00 11.20 O ATOM 850 CB GLU A 53 6.077 14.780 -11.627 1.00 43.01 C ATOM 851 CG GLU A 53 5.720 16.243 -11.324 1.00 1.31 C ATOM 852 CD GLU A 53 6.331 17.240 -12.313 1.00 75.53 C ATOM 853 OE1 GLU A 53 7.467 17.698 -12.077 1.00 43.22 O ATOM 854 OE2 GLU A 53 5.678 17.577 -13.323 1.00 0.34 O ATOM 0 H GLU A 53 3.670 14.643 -11.064 1.00 22.42 H new ATOM 0 HA GLU A 53 5.683 12.748 -10.957 1.00 3.22 H new ATOM 0 HB2 GLU A 53 7.162 14.683 -11.669 1.00 43.01 H new ATOM 0 HB3 GLU A 53 5.696 14.521 -12.615 1.00 43.01 H new ATOM 0 HG2 GLU A 53 4.636 16.353 -11.333 1.00 1.31 H new ATOM 0 HG3 GLU A 53 6.057 16.490 -10.317 1.00 1.31 H new ATOM 861 N TYR A 54 5.878 14.848 -8.385 1.00 15.42 N ATOM 862 CA TYR A 54 6.468 15.010 -7.038 1.00 1.02 C ATOM 863 C TYR A 54 5.978 13.886 -6.093 1.00 3.13 C ATOM 864 O TYR A 54 6.790 13.198 -5.480 1.00 41.03 O ATOM 865 CB TYR A 54 6.117 16.390 -6.426 1.00 43.14 C ATOM 866 CG TYR A 54 6.549 17.623 -7.240 1.00 71.04 C ATOM 867 CD1 TYR A 54 5.730 18.151 -8.238 1.00 52.20 C ATOM 868 CD2 TYR A 54 7.758 18.270 -6.996 1.00 2.13 C ATOM 869 CE1 TYR A 54 6.101 19.267 -8.963 1.00 42.11 C ATOM 870 CE2 TYR A 54 8.130 19.392 -7.716 1.00 43.43 C ATOM 871 CZ TYR A 54 7.298 19.885 -8.701 1.00 1.12 C ATOM 872 OH TYR A 54 7.662 21.006 -9.418 1.00 52.31 O ATOM 0 H TYR A 54 5.145 15.524 -8.601 1.00 15.42 H new ATOM 0 HA TYR A 54 7.551 14.947 -7.147 1.00 1.02 H new ATOM 0 HB2 TYR A 54 5.038 16.436 -6.281 1.00 43.14 H new ATOM 0 HB3 TYR A 54 6.574 16.454 -5.439 1.00 43.14 H new ATOM 0 HD1 TYR A 54 4.783 17.676 -8.449 1.00 52.20 H new ATOM 0 HD2 TYR A 54 8.418 17.889 -6.230 1.00 2.13 H new ATOM 0 HE1 TYR A 54 5.450 19.652 -9.734 1.00 42.11 H new ATOM 0 HE2 TYR A 54 9.070 19.881 -7.507 1.00 43.43 H new ATOM 0 HH TYR A 54 6.859 21.450 -9.761 1.00 52.31 H new ATOM 882 N LEU A 55 4.639 13.702 -6.023 1.00 12.45 N ATOM 883 CA LEU A 55 3.983 12.745 -5.096 1.00 72.41 C ATOM 884 C LEU A 55 4.538 11.313 -5.222 1.00 44.32 C ATOM 885 O LEU A 55 4.989 10.741 -4.231 1.00 61.34 O ATOM 886 CB LEU A 55 2.447 12.726 -5.322 1.00 11.23 C ATOM 887 CG LEU A 55 1.636 11.755 -4.397 1.00 63.55 C ATOM 888 CD1 LEU A 55 1.741 12.143 -2.907 1.00 22.10 C ATOM 889 CD2 LEU A 55 0.173 11.656 -4.843 1.00 53.45 C ATOM 0 H LEU A 55 3.979 14.214 -6.609 1.00 12.45 H new ATOM 0 HA LEU A 55 4.205 13.097 -4.088 1.00 72.41 H new ATOM 0 HB2 LEU A 55 2.065 13.737 -5.180 1.00 11.23 H new ATOM 0 HB3 LEU A 55 2.254 12.455 -6.360 1.00 11.23 H new ATOM 0 HG LEU A 55 2.088 10.768 -4.500 1.00 63.55 H new ATOM 0 HD11 LEU A 55 1.163 11.441 -2.307 1.00 22.10 H new ATOM 0 HD12 LEU A 55 2.785 12.112 -2.596 1.00 22.10 H new ATOM 0 HD13 LEU A 55 1.349 13.150 -2.765 1.00 22.10 H new ATOM 0 HD21 LEU A 55 -0.364 10.975 -4.182 1.00 53.45 H new ATOM 0 HD22 LEU A 55 -0.288 12.643 -4.800 1.00 53.45 H new ATOM 0 HD23 LEU A 55 0.129 11.279 -5.865 1.00 53.45 H new ATOM 901 N ILE A 56 4.512 10.769 -6.452 1.00 63.14 N ATOM 902 CA ILE A 56 4.972 9.398 -6.743 1.00 41.54 C ATOM 903 C ILE A 56 6.441 9.188 -6.311 1.00 65.14 C ATOM 904 O ILE A 56 6.751 8.163 -5.727 1.00 5.21 O ATOM 905 CB ILE A 56 4.779 9.046 -8.263 1.00 64.31 C ATOM 906 CG1 ILE A 56 3.265 9.139 -8.649 1.00 15.34 C ATOM 907 CG2 ILE A 56 5.353 7.643 -8.593 1.00 12.22 C ATOM 908 CD1 ILE A 56 2.971 8.961 -10.129 1.00 2.25 C ATOM 0 H ILE A 56 4.171 11.268 -7.274 1.00 63.14 H new ATOM 0 HA ILE A 56 4.355 8.717 -6.157 1.00 41.54 H new ATOM 0 HB ILE A 56 5.334 9.772 -8.857 1.00 64.31 H new ATOM 0 HG12 ILE A 56 2.715 8.381 -8.090 1.00 15.34 H new ATOM 0 HG13 ILE A 56 2.883 10.109 -8.331 1.00 15.34 H new ATOM 0 HG21 ILE A 56 5.204 7.429 -9.651 1.00 12.22 H new ATOM 0 HG22 ILE A 56 6.419 7.623 -8.365 1.00 12.22 H new ATOM 0 HG23 ILE A 56 4.840 6.890 -7.995 1.00 12.22 H new ATOM 0 HD11 ILE A 56 1.897 9.041 -10.299 1.00 2.25 H new ATOM 0 HD12 ILE A 56 3.487 9.734 -10.698 1.00 2.25 H new ATOM 0 HD13 ILE A 56 3.317 7.980 -10.453 1.00 2.25 H new ATOM 920 N THR A 57 7.305 10.201 -6.553 1.00 42.51 N ATOM 921 CA THR A 57 8.728 10.208 -6.099 1.00 11.25 C ATOM 922 C THR A 57 8.841 9.970 -4.571 1.00 25.14 C ATOM 923 O THR A 57 9.667 9.176 -4.107 1.00 21.34 O ATOM 924 CB THR A 57 9.421 11.565 -6.468 1.00 64.14 C ATOM 925 OG1 THR A 57 9.449 11.719 -7.890 1.00 52.10 O ATOM 926 CG2 THR A 57 10.855 11.693 -5.925 1.00 35.05 C ATOM 0 H THR A 57 7.041 11.041 -7.069 1.00 42.51 H new ATOM 0 HA THR A 57 9.233 9.391 -6.614 1.00 11.25 H new ATOM 0 HB THR A 57 8.829 12.349 -5.996 1.00 64.14 H new ATOM 0 HG1 THR A 57 8.648 12.203 -8.182 1.00 52.10 H new ATOM 0 HG21 THR A 57 11.271 12.657 -6.219 1.00 35.05 H new ATOM 0 HG22 THR A 57 10.840 11.621 -4.837 1.00 35.05 H new ATOM 0 HG23 THR A 57 11.471 10.892 -6.333 1.00 35.05 H new ATOM 934 N LEU A 58 7.981 10.663 -3.811 1.00 45.12 N ATOM 935 CA LEU A 58 7.899 10.524 -2.342 1.00 42.13 C ATOM 936 C LEU A 58 7.361 9.123 -1.924 1.00 13.34 C ATOM 937 O LEU A 58 7.819 8.559 -0.939 1.00 20.15 O ATOM 938 CB LEU A 58 7.011 11.666 -1.748 1.00 74.23 C ATOM 939 CG LEU A 58 7.705 13.054 -1.493 1.00 2.20 C ATOM 940 CD1 LEU A 58 8.781 12.946 -0.400 1.00 72.13 C ATOM 941 CD2 LEU A 58 8.284 13.683 -2.785 1.00 33.21 C ATOM 0 H LEU A 58 7.319 11.338 -4.194 1.00 45.12 H new ATOM 0 HA LEU A 58 8.907 10.612 -1.936 1.00 42.13 H new ATOM 0 HB2 LEU A 58 6.171 11.827 -2.423 1.00 74.23 H new ATOM 0 HB3 LEU A 58 6.597 11.316 -0.802 1.00 74.23 H new ATOM 0 HG LEU A 58 6.925 13.729 -1.141 1.00 2.20 H new ATOM 0 HD11 LEU A 58 9.243 13.921 -0.246 1.00 72.13 H new ATOM 0 HD12 LEU A 58 8.322 12.611 0.530 1.00 72.13 H new ATOM 0 HD13 LEU A 58 9.542 12.229 -0.708 1.00 72.13 H new ATOM 0 HD21 LEU A 58 8.750 14.639 -2.547 1.00 33.21 H new ATOM 0 HD22 LEU A 58 9.029 13.013 -3.214 1.00 33.21 H new ATOM 0 HD23 LEU A 58 7.481 13.840 -3.505 1.00 33.21 H new ATOM 953 N LEU A 59 6.417 8.566 -2.708 1.00 0.52 N ATOM 954 CA LEU A 59 5.734 7.277 -2.393 1.00 32.33 C ATOM 955 C LEU A 59 6.628 6.034 -2.650 1.00 53.23 C ATOM 956 O LEU A 59 6.707 5.133 -1.807 1.00 4.51 O ATOM 957 CB LEU A 59 4.440 7.167 -3.229 1.00 61.24 C ATOM 958 CG LEU A 59 3.357 8.253 -2.967 1.00 61.43 C ATOM 959 CD1 LEU A 59 2.217 8.143 -4.000 1.00 3.01 C ATOM 960 CD2 LEU A 59 2.823 8.176 -1.517 1.00 33.53 C ATOM 0 H LEU A 59 6.100 8.990 -3.580 1.00 0.52 H new ATOM 0 HA LEU A 59 5.507 7.286 -1.327 1.00 32.33 H new ATOM 0 HB2 LEU A 59 4.710 7.201 -4.284 1.00 61.24 H new ATOM 0 HB3 LEU A 59 3.996 6.189 -3.045 1.00 61.24 H new ATOM 0 HG LEU A 59 3.821 9.232 -3.085 1.00 61.43 H new ATOM 0 HD11 LEU A 59 1.470 8.911 -3.800 1.00 3.01 H new ATOM 0 HD12 LEU A 59 2.620 8.282 -5.003 1.00 3.01 H new ATOM 0 HD13 LEU A 59 1.754 7.159 -3.928 1.00 3.01 H new ATOM 0 HD21 LEU A 59 2.068 8.948 -1.366 1.00 33.53 H new ATOM 0 HD22 LEU A 59 2.379 7.195 -1.344 1.00 33.53 H new ATOM 0 HD23 LEU A 59 3.645 8.331 -0.818 1.00 33.53 H new ATOM 972 N GLU A 60 7.257 5.977 -3.840 1.00 55.25 N ATOM 973 CA GLU A 60 8.190 4.890 -4.214 1.00 63.45 C ATOM 974 C GLU A 60 9.395 4.828 -3.240 1.00 0.11 C ATOM 975 O GLU A 60 9.738 3.758 -2.739 1.00 14.11 O ATOM 976 CB GLU A 60 8.673 5.056 -5.688 1.00 24.24 C ATOM 977 CG GLU A 60 9.315 6.420 -6.000 1.00 63.54 C ATOM 978 CD GLU A 60 9.966 6.515 -7.386 1.00 30.41 C ATOM 979 OE1 GLU A 60 9.248 6.736 -8.379 1.00 43.00 O ATOM 980 OE2 GLU A 60 11.204 6.359 -7.483 1.00 63.14 O ATOM 0 H GLU A 60 7.135 6.680 -4.569 1.00 55.25 H new ATOM 0 HA GLU A 60 7.651 3.945 -4.138 1.00 63.45 H new ATOM 0 HB2 GLU A 60 9.394 4.270 -5.911 1.00 24.24 H new ATOM 0 HB3 GLU A 60 7.823 4.908 -6.354 1.00 24.24 H new ATOM 0 HG2 GLU A 60 8.552 7.194 -5.917 1.00 63.54 H new ATOM 0 HG3 GLU A 60 10.069 6.634 -5.243 1.00 63.54 H new ATOM 987 N HIS A 61 9.994 6.001 -2.937 1.00 20.45 N ATOM 988 CA HIS A 61 11.122 6.109 -1.987 1.00 30.02 C ATOM 989 C HIS A 61 10.677 5.852 -0.533 1.00 63.43 C ATOM 990 O HIS A 61 11.505 5.506 0.298 1.00 32.50 O ATOM 991 CB HIS A 61 11.797 7.495 -2.088 1.00 14.00 C ATOM 992 CG HIS A 61 12.701 7.679 -3.280 1.00 20.24 C ATOM 993 ND1 HIS A 61 14.063 7.853 -3.155 1.00 22.42 N ATOM 994 CD2 HIS A 61 12.441 7.785 -4.606 1.00 63.14 C ATOM 995 CE1 HIS A 61 14.591 8.058 -4.340 1.00 61.15 C ATOM 996 NE2 HIS A 61 13.632 8.021 -5.234 1.00 71.31 N ATOM 0 H HIS A 61 9.711 6.894 -3.341 1.00 20.45 H new ATOM 0 HA HIS A 61 11.842 5.339 -2.262 1.00 30.02 H new ATOM 0 HB2 HIS A 61 11.020 8.259 -2.119 1.00 14.00 H new ATOM 0 HB3 HIS A 61 12.377 7.667 -1.181 1.00 14.00 H new ATOM 0 HD2 HIS A 61 11.474 7.699 -5.078 1.00 63.14 H new ATOM 0 HE1 HIS A 61 15.638 8.228 -4.544 1.00 61.15 H new ATOM 0 HE2 HIS A 61 13.755 8.148 -6.238 1.00 71.31 H new ATOM 1005 N LEU A 62 9.381 6.050 -0.239 1.00 3.40 N ATOM 1006 CA LEU A 62 8.804 5.775 1.092 1.00 0.44 C ATOM 1007 C LEU A 62 8.863 4.269 1.417 1.00 22.34 C ATOM 1008 O LEU A 62 9.376 3.868 2.468 1.00 44.21 O ATOM 1009 CB LEU A 62 7.341 6.296 1.147 1.00 44.04 C ATOM 1010 CG LEU A 62 6.589 6.132 2.497 1.00 51.42 C ATOM 1011 CD1 LEU A 62 7.375 6.766 3.651 1.00 30.42 C ATOM 1012 CD2 LEU A 62 5.162 6.713 2.413 1.00 70.44 C ATOM 0 H LEU A 62 8.703 6.404 -0.914 1.00 3.40 H new ATOM 0 HA LEU A 62 9.393 6.298 1.845 1.00 0.44 H new ATOM 0 HB2 LEU A 62 7.348 7.355 0.888 1.00 44.04 H new ATOM 0 HB3 LEU A 62 6.768 5.783 0.375 1.00 44.04 H new ATOM 0 HG LEU A 62 6.504 5.065 2.700 1.00 51.42 H new ATOM 0 HD11 LEU A 62 6.823 6.635 4.582 1.00 30.42 H new ATOM 0 HD12 LEU A 62 8.349 6.284 3.736 1.00 30.42 H new ATOM 0 HD13 LEU A 62 7.512 7.830 3.457 1.00 30.42 H new ATOM 0 HD21 LEU A 62 4.660 6.584 3.372 1.00 70.44 H new ATOM 0 HD22 LEU A 62 5.215 7.774 2.171 1.00 70.44 H new ATOM 0 HD23 LEU A 62 4.602 6.191 1.637 1.00 70.44 H new ATOM 1024 N MET A 63 8.357 3.439 0.489 1.00 62.32 N ATOM 1025 CA MET A 63 8.341 1.974 0.667 1.00 1.23 C ATOM 1026 C MET A 63 9.747 1.360 0.517 1.00 63.40 C ATOM 1027 O MET A 63 9.990 0.297 1.045 1.00 13.23 O ATOM 1028 CB MET A 63 7.331 1.303 -0.294 1.00 32.42 C ATOM 1029 CG MET A 63 7.691 1.396 -1.784 1.00 60.33 C ATOM 1030 SD MET A 63 6.340 0.883 -2.862 1.00 3.12 S ATOM 1031 CE MET A 63 5.069 2.065 -2.404 1.00 50.30 C ATOM 0 H MET A 63 7.953 3.756 -0.392 1.00 62.32 H new ATOM 0 HA MET A 63 8.012 1.779 1.688 1.00 1.23 H new ATOM 0 HB2 MET A 63 7.239 0.251 -0.023 1.00 32.42 H new ATOM 0 HB3 MET A 63 6.352 1.758 -0.143 1.00 32.42 H new ATOM 0 HG2 MET A 63 7.970 2.422 -2.022 1.00 60.33 H new ATOM 0 HG3 MET A 63 8.564 0.774 -1.982 1.00 60.33 H new ATOM 0 HE1 MET A 63 4.174 1.887 -3.001 1.00 50.30 H new ATOM 0 HE2 MET A 63 4.829 1.950 -1.347 1.00 50.30 H new ATOM 0 HE3 MET A 63 5.431 3.077 -2.586 1.00 50.30 H new ATOM 1041 N LYS A 64 10.649 2.031 -0.230 1.00 22.03 N ATOM 1042 CA LYS A 64 12.086 1.658 -0.299 1.00 0.24 C ATOM 1043 C LYS A 64 12.803 1.925 1.048 1.00 33.03 C ATOM 1044 O LYS A 64 13.460 1.039 1.602 1.00 22.15 O ATOM 1045 CB LYS A 64 12.785 2.454 -1.436 1.00 51.13 C ATOM 1046 CG LYS A 64 12.371 2.058 -2.868 1.00 34.13 C ATOM 1047 CD LYS A 64 12.887 0.662 -3.278 1.00 4.44 C ATOM 1048 CE LYS A 64 12.554 0.321 -4.738 1.00 52.41 C ATOM 1049 NZ LYS A 64 13.155 -0.971 -5.156 1.00 21.42 N ATOM 0 H LYS A 64 10.408 2.842 -0.800 1.00 22.03 H new ATOM 0 HA LYS A 64 12.148 0.590 -0.509 1.00 0.24 H new ATOM 0 HB2 LYS A 64 12.577 3.515 -1.295 1.00 51.13 H new ATOM 0 HB3 LYS A 64 13.863 2.325 -1.338 1.00 51.13 H new ATOM 0 HG2 LYS A 64 11.284 2.075 -2.944 1.00 34.13 H new ATOM 0 HG3 LYS A 64 12.751 2.801 -3.569 1.00 34.13 H new ATOM 0 HD2 LYS A 64 13.967 0.620 -3.135 1.00 4.44 H new ATOM 0 HD3 LYS A 64 12.449 -0.091 -2.623 1.00 4.44 H new ATOM 0 HE2 LYS A 64 11.472 0.275 -4.862 1.00 52.41 H new ATOM 0 HE3 LYS A 64 12.916 1.117 -5.388 1.00 52.41 H new ATOM 0 HZ1 LYS A 64 12.907 -1.165 -6.147 1.00 21.42 H new ATOM 0 HZ2 LYS A 64 14.189 -0.919 -5.062 1.00 21.42 H new ATOM 0 HZ3 LYS A 64 12.790 -1.735 -4.552 1.00 21.42 H new ATOM 1063 N GLU A 65 12.645 3.157 1.562 1.00 74.13 N ATOM 1064 CA GLU A 65 13.319 3.638 2.787 1.00 51.44 C ATOM 1065 C GLU A 65 12.883 2.833 4.033 1.00 72.33 C ATOM 1066 O GLU A 65 13.702 2.499 4.886 1.00 64.25 O ATOM 1067 CB GLU A 65 13.021 5.152 2.984 1.00 54.54 C ATOM 1068 CG GLU A 65 13.687 5.822 4.208 1.00 44.44 C ATOM 1069 CD GLU A 65 15.225 5.726 4.199 1.00 33.21 C ATOM 1070 OE1 GLU A 65 15.875 6.457 3.421 1.00 0.21 O ATOM 1071 OE2 GLU A 65 15.792 4.924 4.979 1.00 22.04 O ATOM 0 H GLU A 65 12.039 3.858 1.135 1.00 74.13 H new ATOM 0 HA GLU A 65 14.392 3.491 2.667 1.00 51.44 H new ATOM 0 HB2 GLU A 65 13.338 5.684 2.087 1.00 54.54 H new ATOM 0 HB3 GLU A 65 11.942 5.281 3.067 1.00 54.54 H new ATOM 0 HG2 GLU A 65 13.396 6.872 4.241 1.00 44.44 H new ATOM 0 HG3 GLU A 65 13.307 5.358 5.118 1.00 44.44 H new ATOM 1078 N PHE A 66 11.584 2.520 4.116 1.00 41.42 N ATOM 1079 CA PHE A 66 11.003 1.787 5.266 1.00 64.11 C ATOM 1080 C PHE A 66 10.805 0.279 4.996 1.00 50.15 C ATOM 1081 O PHE A 66 10.317 -0.415 5.887 1.00 4.01 O ATOM 1082 CB PHE A 66 9.661 2.432 5.681 1.00 1.41 C ATOM 1083 CG PHE A 66 9.802 3.837 6.266 1.00 64.23 C ATOM 1084 CD1 PHE A 66 9.968 4.948 5.443 1.00 10.43 C ATOM 1085 CD2 PHE A 66 9.775 4.047 7.641 1.00 32.45 C ATOM 1086 CE1 PHE A 66 10.099 6.209 5.974 1.00 22.03 C ATOM 1087 CE2 PHE A 66 9.904 5.313 8.172 1.00 33.02 C ATOM 1088 CZ PHE A 66 10.066 6.396 7.336 1.00 72.24 C ATOM 0 H PHE A 66 10.903 2.763 3.396 1.00 41.42 H new ATOM 0 HA PHE A 66 11.724 1.864 6.080 1.00 64.11 H new ATOM 0 HB2 PHE A 66 9.006 2.476 4.811 1.00 1.41 H new ATOM 0 HB3 PHE A 66 9.173 1.791 6.415 1.00 1.41 H new ATOM 0 HD1 PHE A 66 9.994 4.817 4.371 1.00 10.43 H new ATOM 0 HD2 PHE A 66 9.651 3.204 8.304 1.00 32.45 H new ATOM 0 HE1 PHE A 66 10.229 7.057 5.318 1.00 22.03 H new ATOM 0 HE2 PHE A 66 9.878 5.455 9.242 1.00 33.02 H new ATOM 0 HZ PHE A 66 10.167 7.389 7.749 1.00 72.24 H new ATOM 1098 N LEU A 67 11.173 -0.215 3.786 1.00 42.42 N ATOM 1099 CA LEU A 67 10.975 -1.641 3.371 1.00 72.04 C ATOM 1100 C LEU A 67 11.359 -2.673 4.462 1.00 61.24 C ATOM 1101 O LEU A 67 10.555 -3.536 4.821 1.00 74.04 O ATOM 1102 CB LEU A 67 11.758 -1.959 2.058 1.00 24.53 C ATOM 1103 CG LEU A 67 11.242 -3.197 1.247 1.00 2.23 C ATOM 1104 CD1 LEU A 67 9.769 -3.003 0.804 1.00 4.42 C ATOM 1105 CD2 LEU A 67 12.140 -3.488 0.028 1.00 61.33 C ATOM 0 H LEU A 67 11.615 0.358 3.067 1.00 42.42 H new ATOM 0 HA LEU A 67 9.903 -1.741 3.201 1.00 72.04 H new ATOM 0 HB2 LEU A 67 11.720 -1.082 1.412 1.00 24.53 H new ATOM 0 HB3 LEU A 67 12.805 -2.123 2.311 1.00 24.53 H new ATOM 0 HG LEU A 67 11.288 -4.060 1.911 1.00 2.23 H new ATOM 0 HD11 LEU A 67 9.439 -3.878 0.244 1.00 4.42 H new ATOM 0 HD12 LEU A 67 9.138 -2.877 1.684 1.00 4.42 H new ATOM 0 HD13 LEU A 67 9.693 -2.118 0.173 1.00 4.42 H new ATOM 0 HD21 LEU A 67 11.753 -4.353 -0.511 1.00 61.33 H new ATOM 0 HD22 LEU A 67 12.148 -2.622 -0.633 1.00 61.33 H new ATOM 0 HD23 LEU A 67 13.155 -3.696 0.365 1.00 61.33 H new ATOM 1117 N ASP A 68 12.582 -2.561 4.985 1.00 1.33 N ATOM 1118 CA ASP A 68 13.100 -3.475 6.028 1.00 61.24 C ATOM 1119 C ASP A 68 12.682 -3.053 7.464 1.00 61.43 C ATOM 1120 O ASP A 68 12.837 -3.842 8.405 1.00 22.45 O ATOM 1121 CB ASP A 68 14.633 -3.589 5.892 1.00 33.54 C ATOM 1122 CG ASP A 68 15.043 -4.167 4.527 1.00 61.52 C ATOM 1123 OD1 ASP A 68 15.034 -5.411 4.372 1.00 61.03 O ATOM 1124 OD2 ASP A 68 15.344 -3.385 3.600 1.00 24.00 O ATOM 0 H ASP A 68 13.246 -1.839 4.704 1.00 1.33 H new ATOM 0 HA ASP A 68 12.650 -4.455 5.870 1.00 61.24 H new ATOM 0 HB2 ASP A 68 15.084 -2.605 6.020 1.00 33.54 H new ATOM 0 HB3 ASP A 68 15.022 -4.224 6.688 1.00 33.54 H new ATOM 1129 N LYS A 69 12.159 -1.816 7.636 1.00 55.31 N ATOM 1130 CA LYS A 69 11.544 -1.382 8.918 1.00 15.00 C ATOM 1131 C LYS A 69 10.165 -2.083 9.097 1.00 42.24 C ATOM 1132 O LYS A 69 9.119 -1.519 8.740 1.00 64.40 O ATOM 1133 CB LYS A 69 11.376 0.168 8.971 1.00 20.21 C ATOM 1134 CG LYS A 69 12.651 0.983 8.673 1.00 25.33 C ATOM 1135 CD LYS A 69 13.837 0.625 9.601 1.00 30.43 C ATOM 1136 CE LYS A 69 15.070 1.519 9.363 1.00 24.22 C ATOM 1137 NZ LYS A 69 15.569 1.445 7.964 1.00 14.24 N ATOM 0 H LYS A 69 12.149 -1.102 6.908 1.00 55.31 H new ATOM 0 HA LYS A 69 12.207 -1.670 9.734 1.00 15.00 H new ATOM 0 HB2 LYS A 69 10.605 0.457 8.257 1.00 20.21 H new ATOM 0 HB3 LYS A 69 11.013 0.443 9.961 1.00 20.21 H new ATOM 0 HG2 LYS A 69 12.946 0.817 7.637 1.00 25.33 H new ATOM 0 HG3 LYS A 69 12.427 2.045 8.774 1.00 25.33 H new ATOM 0 HD2 LYS A 69 13.521 0.718 10.640 1.00 30.43 H new ATOM 0 HD3 LYS A 69 14.114 -0.418 9.444 1.00 30.43 H new ATOM 0 HE2 LYS A 69 14.816 2.552 9.600 1.00 24.22 H new ATOM 0 HE3 LYS A 69 15.867 1.222 10.045 1.00 24.22 H new ATOM 0 HZ1 LYS A 69 16.437 2.011 7.875 1.00 14.24 H new ATOM 0 HZ2 LYS A 69 15.774 0.455 7.720 1.00 14.24 H new ATOM 0 HZ3 LYS A 69 14.845 1.818 7.317 1.00 14.24 H new ATOM 1151 N LYS A 70 10.191 -3.327 9.625 1.00 14.05 N ATOM 1152 CA LYS A 70 9.001 -4.223 9.710 1.00 75.34 C ATOM 1153 C LYS A 70 7.852 -3.626 10.572 1.00 41.41 C ATOM 1154 O LYS A 70 6.666 -3.890 10.330 1.00 72.51 O ATOM 1155 CB LYS A 70 9.413 -5.609 10.260 1.00 41.34 C ATOM 1156 CG LYS A 70 10.521 -6.319 9.443 1.00 24.15 C ATOM 1157 CD LYS A 70 10.786 -7.768 9.920 1.00 3.03 C ATOM 1158 CE LYS A 70 11.175 -7.863 11.411 1.00 63.31 C ATOM 1159 NZ LYS A 70 11.478 -9.262 11.811 1.00 14.53 N ATOM 0 H LYS A 70 11.039 -3.746 10.008 1.00 14.05 H new ATOM 0 HA LYS A 70 8.614 -4.328 8.696 1.00 75.34 H new ATOM 0 HB2 LYS A 70 9.756 -5.491 11.288 1.00 41.34 H new ATOM 0 HB3 LYS A 70 8.533 -6.251 10.289 1.00 41.34 H new ATOM 0 HG2 LYS A 70 10.236 -6.334 8.391 1.00 24.15 H new ATOM 0 HG3 LYS A 70 11.444 -5.744 9.515 1.00 24.15 H new ATOM 0 HD2 LYS A 70 9.893 -8.368 9.747 1.00 3.03 H new ATOM 0 HD3 LYS A 70 11.583 -8.201 9.316 1.00 3.03 H new ATOM 0 HE2 LYS A 70 12.044 -7.234 11.601 1.00 63.31 H new ATOM 0 HE3 LYS A 70 10.361 -7.477 12.025 1.00 63.31 H new ATOM 0 HZ1 LYS A 70 11.735 -9.287 12.818 1.00 14.53 H new ATOM 0 HZ2 LYS A 70 10.640 -9.858 11.653 1.00 14.53 H new ATOM 0 HZ3 LYS A 70 12.271 -9.622 11.242 1.00 14.53 H new ATOM 1173 N LYS A 71 8.244 -2.822 11.564 1.00 31.22 N ATOM 1174 CA LYS A 71 7.332 -2.125 12.496 1.00 3.33 C ATOM 1175 C LYS A 71 6.333 -1.159 11.782 1.00 50.04 C ATOM 1176 O LYS A 71 5.169 -1.058 12.186 1.00 24.13 O ATOM 1177 CB LYS A 71 8.187 -1.383 13.559 1.00 15.42 C ATOM 1178 CG LYS A 71 9.269 -0.437 12.975 1.00 62.44 C ATOM 1179 CD LYS A 71 10.194 0.159 14.065 1.00 25.31 C ATOM 1180 CE LYS A 71 11.300 1.054 13.483 1.00 13.41 C ATOM 1181 NZ LYS A 71 12.232 1.546 14.534 1.00 12.44 N ATOM 0 H LYS A 71 9.228 -2.628 11.752 1.00 31.22 H new ATOM 0 HA LYS A 71 6.701 -2.872 12.978 1.00 3.33 H new ATOM 0 HB2 LYS A 71 7.523 -0.802 14.199 1.00 15.42 H new ATOM 0 HB3 LYS A 71 8.675 -2.123 14.194 1.00 15.42 H new ATOM 0 HG2 LYS A 71 9.873 -0.985 12.252 1.00 62.44 H new ATOM 0 HG3 LYS A 71 8.782 0.374 12.434 1.00 62.44 H new ATOM 0 HD2 LYS A 71 9.595 0.740 14.766 1.00 25.31 H new ATOM 0 HD3 LYS A 71 10.650 -0.653 14.632 1.00 25.31 H new ATOM 0 HE2 LYS A 71 11.861 0.495 12.734 1.00 13.41 H new ATOM 0 HE3 LYS A 71 10.847 1.905 12.973 1.00 13.41 H new ATOM 0 HZ1 LYS A 71 12.962 2.145 14.098 1.00 12.44 H new ATOM 0 HZ2 LYS A 71 11.702 2.101 15.236 1.00 12.44 H new ATOM 0 HZ3 LYS A 71 12.685 0.736 15.004 1.00 12.44 H new ATOM 1195 N TYR A 72 6.786 -0.483 10.699 1.00 20.13 N ATOM 1196 CA TYR A 72 5.928 0.447 9.905 1.00 54.40 C ATOM 1197 C TYR A 72 5.021 -0.297 8.890 1.00 24.04 C ATOM 1198 O TYR A 72 4.262 0.331 8.150 1.00 12.41 O ATOM 1199 CB TYR A 72 6.809 1.490 9.166 1.00 14.40 C ATOM 1200 CG TYR A 72 7.452 2.529 10.102 1.00 62.15 C ATOM 1201 CD1 TYR A 72 6.742 3.661 10.515 1.00 34.51 C ATOM 1202 CD2 TYR A 72 8.758 2.381 10.580 1.00 21.33 C ATOM 1203 CE1 TYR A 72 7.308 4.594 11.363 1.00 24.50 C ATOM 1204 CE2 TYR A 72 9.324 3.319 11.426 1.00 70.45 C ATOM 1205 CZ TYR A 72 8.596 4.420 11.815 1.00 3.40 C ATOM 1206 OH TYR A 72 9.155 5.346 12.670 1.00 52.11 O ATOM 0 H TYR A 72 7.741 -0.561 10.350 1.00 20.13 H new ATOM 0 HA TYR A 72 5.271 0.955 10.611 1.00 54.40 H new ATOM 0 HB2 TYR A 72 7.596 0.968 8.622 1.00 14.40 H new ATOM 0 HB3 TYR A 72 6.200 2.008 8.426 1.00 14.40 H new ATOM 0 HD1 TYR A 72 5.731 3.809 10.164 1.00 34.51 H new ATOM 0 HD2 TYR A 72 9.336 1.518 10.283 1.00 21.33 H new ATOM 0 HE1 TYR A 72 6.740 5.459 11.671 1.00 24.50 H new ATOM 0 HE2 TYR A 72 10.336 3.187 11.780 1.00 70.45 H new ATOM 0 HH TYR A 72 8.468 5.983 12.957 1.00 52.11 H new ATOM 1216 N HIS A 73 5.118 -1.630 8.844 1.00 41.24 N ATOM 1217 CA HIS A 73 4.284 -2.467 7.945 1.00 32.31 C ATOM 1218 C HIS A 73 3.012 -2.974 8.637 1.00 62.44 C ATOM 1219 O HIS A 73 2.115 -3.511 7.987 1.00 12.25 O ATOM 1220 CB HIS A 73 5.142 -3.607 7.385 1.00 34.20 C ATOM 1221 CG HIS A 73 6.369 -3.073 6.709 1.00 1.42 C ATOM 1222 ND1 HIS A 73 6.377 -1.864 6.045 1.00 3.44 N ATOM 1223 CD2 HIS A 73 7.638 -3.505 6.687 1.00 52.32 C ATOM 1224 CE1 HIS A 73 7.588 -1.587 5.662 1.00 52.54 C ATOM 1225 NE2 HIS A 73 8.377 -2.558 6.037 1.00 32.33 N ATOM 0 H HIS A 73 5.768 -2.165 9.420 1.00 41.24 H new ATOM 0 HA HIS A 73 3.933 -1.854 7.115 1.00 32.31 H new ATOM 0 HB2 HIS A 73 5.431 -4.280 8.192 1.00 34.20 H new ATOM 0 HB3 HIS A 73 4.557 -4.193 6.676 1.00 34.20 H new ATOM 0 HD2 HIS A 73 8.007 -4.430 7.105 1.00 52.32 H new ATOM 0 HE1 HIS A 73 7.891 -0.701 5.123 1.00 52.54 H new ATOM 0 HE2 HIS A 73 9.382 -2.602 5.871 1.00 32.33 H new ATOM 1234 N ASN A 74 2.962 -2.837 9.961 1.00 42.40 N ATOM 1235 CA ASN A 74 1.698 -2.909 10.720 1.00 70.23 C ATOM 1236 C ASN A 74 0.911 -1.582 10.620 1.00 60.11 C ATOM 1237 O ASN A 74 -0.302 -1.559 10.831 1.00 34.44 O ATOM 1238 CB ASN A 74 2.010 -3.225 12.203 1.00 33.05 C ATOM 1239 CG ASN A 74 2.921 -4.439 12.397 1.00 72.44 C ATOM 1240 OD1 ASN A 74 3.700 -4.496 13.338 1.00 44.52 O ATOM 1241 ND2 ASN A 74 2.839 -5.420 11.522 1.00 64.31 N ATOM 0 H ASN A 74 3.785 -2.674 10.541 1.00 42.40 H new ATOM 0 HA ASN A 74 1.081 -3.700 10.294 1.00 70.23 H new ATOM 0 HB2 ASN A 74 2.479 -2.354 12.660 1.00 33.05 H new ATOM 0 HB3 ASN A 74 1.073 -3.397 12.733 1.00 33.05 H new ATOM 0 HD21 ASN A 74 3.431 -6.244 11.623 1.00 64.31 H new ATOM 0 HD22 ASN A 74 2.183 -5.355 10.743 1.00 64.31 H new ATOM 1248 N ASP A 75 1.633 -0.493 10.291 1.00 61.40 N ATOM 1249 CA ASP A 75 1.091 0.873 10.286 1.00 12.01 C ATOM 1250 C ASP A 75 0.126 1.111 9.086 1.00 20.33 C ATOM 1251 O ASP A 75 0.563 1.125 7.921 1.00 25.54 O ATOM 1252 CB ASP A 75 2.249 1.896 10.264 1.00 22.15 C ATOM 1253 CG ASP A 75 1.756 3.347 10.296 1.00 3.10 C ATOM 1254 OD1 ASP A 75 1.179 3.754 11.317 1.00 44.13 O ATOM 1255 OD2 ASP A 75 1.927 4.071 9.313 1.00 23.04 O ATOM 0 H ASP A 75 2.615 -0.541 10.020 1.00 61.40 H new ATOM 0 HA ASP A 75 0.509 1.007 11.198 1.00 12.01 H new ATOM 0 HB2 ASP A 75 2.901 1.719 11.119 1.00 22.15 H new ATOM 0 HB3 ASP A 75 2.849 1.740 9.368 1.00 22.15 H new ATOM 1260 N PRO A 76 -1.202 1.361 9.357 1.00 53.30 N ATOM 1261 CA PRO A 76 -2.216 1.550 8.286 1.00 65.42 C ATOM 1262 C PRO A 76 -2.015 2.847 7.461 1.00 63.32 C ATOM 1263 O PRO A 76 -2.594 2.973 6.384 1.00 12.31 O ATOM 1264 CB PRO A 76 -3.556 1.583 9.068 1.00 5.14 C ATOM 1265 CG PRO A 76 -3.186 2.065 10.440 1.00 30.22 C ATOM 1266 CD PRO A 76 -1.817 1.480 10.716 1.00 62.23 C ATOM 0 HA PRO A 76 -2.160 0.760 7.538 1.00 65.42 H new ATOM 0 HB2 PRO A 76 -4.274 2.252 8.594 1.00 5.14 H new ATOM 0 HB3 PRO A 76 -4.016 0.596 9.106 1.00 5.14 H new ATOM 0 HG2 PRO A 76 -3.163 3.154 10.481 1.00 30.22 H new ATOM 0 HG3 PRO A 76 -3.912 1.733 11.182 1.00 30.22 H new ATOM 0 HD2 PRO A 76 -1.229 2.127 11.367 1.00 62.23 H new ATOM 0 HD3 PRO A 76 -1.888 0.511 11.210 1.00 62.23 H new ATOM 1274 N ARG A 77 -1.209 3.805 7.979 1.00 40.24 N ATOM 1275 CA ARG A 77 -0.920 5.083 7.274 1.00 5.42 C ATOM 1276 C ARG A 77 0.080 4.828 6.126 1.00 5.33 C ATOM 1277 O ARG A 77 -0.163 5.226 4.986 1.00 12.23 O ATOM 1278 CB ARG A 77 -0.363 6.184 8.237 1.00 44.00 C ATOM 1279 CG ARG A 77 -1.342 6.703 9.323 1.00 65.24 C ATOM 1280 CD ARG A 77 -1.664 5.673 10.421 1.00 72.01 C ATOM 1281 NE ARG A 77 -2.543 6.227 11.467 1.00 2.40 N ATOM 1282 CZ ARG A 77 -3.834 6.000 11.590 1.00 10.20 C ATOM 1283 NH1 ARG A 77 -4.492 5.330 10.696 1.00 4.23 N ATOM 1284 NH2 ARG A 77 -4.473 6.483 12.601 1.00 62.43 N ATOM 0 H ARG A 77 -0.746 3.719 8.884 1.00 40.24 H new ATOM 0 HA ARG A 77 -1.862 5.456 6.872 1.00 5.42 H new ATOM 0 HB2 ARG A 77 0.522 5.788 8.735 1.00 44.00 H new ATOM 0 HB3 ARG A 77 -0.037 7.033 7.635 1.00 44.00 H new ATOM 0 HG2 ARG A 77 -0.915 7.592 9.787 1.00 65.24 H new ATOM 0 HG3 ARG A 77 -2.271 7.009 8.843 1.00 65.24 H new ATOM 0 HD2 ARG A 77 -2.142 4.803 9.971 1.00 72.01 H new ATOM 0 HD3 ARG A 77 -0.736 5.327 10.875 1.00 72.01 H new ATOM 0 HE ARG A 77 -2.112 6.842 12.158 1.00 2.40 H new ATOM 0 HH11 ARG A 77 -4.010 4.965 9.875 1.00 4.23 H new ATOM 0 HH12 ARG A 77 -5.492 5.167 10.814 1.00 4.23 H new ATOM 0 HH21 ARG A 77 -3.978 7.037 13.300 1.00 62.43 H new ATOM 0 HH22 ARG A 77 -5.473 6.311 12.702 1.00 62.43 H new ATOM 1298 N PHE A 78 1.183 4.133 6.454 1.00 31.21 N ATOM 1299 CA PHE A 78 2.220 3.722 5.493 1.00 3.35 C ATOM 1300 C PHE A 78 1.628 2.784 4.416 1.00 34.41 C ATOM 1301 O PHE A 78 1.900 2.952 3.218 1.00 10.15 O ATOM 1302 CB PHE A 78 3.395 3.033 6.249 1.00 70.33 C ATOM 1303 CG PHE A 78 4.477 2.438 5.339 1.00 13.21 C ATOM 1304 CD1 PHE A 78 5.521 3.222 4.848 1.00 10.42 C ATOM 1305 CD2 PHE A 78 4.435 1.093 4.960 1.00 1.05 C ATOM 1306 CE1 PHE A 78 6.479 2.675 4.013 1.00 70.10 C ATOM 1307 CE2 PHE A 78 5.385 0.559 4.128 1.00 22.40 C ATOM 1308 CZ PHE A 78 6.409 1.341 3.656 1.00 23.33 C ATOM 0 H PHE A 78 1.382 3.837 7.410 1.00 31.21 H new ATOM 0 HA PHE A 78 2.603 4.607 4.985 1.00 3.35 H new ATOM 0 HB2 PHE A 78 3.858 3.761 6.915 1.00 70.33 H new ATOM 0 HB3 PHE A 78 2.990 2.240 6.877 1.00 70.33 H new ATOM 0 HD1 PHE A 78 5.582 4.265 5.122 1.00 10.42 H new ATOM 0 HD2 PHE A 78 3.639 0.463 5.329 1.00 1.05 H new ATOM 0 HE1 PHE A 78 7.283 3.291 3.639 1.00 70.10 H new ATOM 0 HE2 PHE A 78 5.327 -0.481 3.843 1.00 22.40 H new ATOM 0 HZ PHE A 78 7.159 0.915 3.006 1.00 23.33 H new ATOM 1318 N ILE A 79 0.827 1.786 4.864 1.00 44.45 N ATOM 1319 CA ILE A 79 0.074 0.889 3.954 1.00 43.43 C ATOM 1320 C ILE A 79 -0.871 1.701 3.045 1.00 61.35 C ATOM 1321 O ILE A 79 -0.936 1.440 1.846 1.00 63.34 O ATOM 1322 CB ILE A 79 -0.709 -0.253 4.751 1.00 3.21 C ATOM 1323 CG1 ILE A 79 0.232 -1.467 5.063 1.00 42.41 C ATOM 1324 CG2 ILE A 79 -1.991 -0.757 4.016 1.00 33.34 C ATOM 1325 CD1 ILE A 79 1.465 -1.161 5.894 1.00 0.41 C ATOM 0 H ILE A 79 0.686 1.582 5.853 1.00 44.45 H new ATOM 0 HA ILE A 79 0.799 0.382 3.317 1.00 43.43 H new ATOM 0 HB ILE A 79 -1.035 0.210 5.683 1.00 3.21 H new ATOM 0 HG12 ILE A 79 -0.351 -2.228 5.582 1.00 42.41 H new ATOM 0 HG13 ILE A 79 0.555 -1.902 4.117 1.00 42.41 H new ATOM 0 HG21 ILE A 79 -2.472 -1.531 4.614 1.00 33.34 H new ATOM 0 HG22 ILE A 79 -2.681 0.075 3.876 1.00 33.34 H new ATOM 0 HG23 ILE A 79 -1.716 -1.167 3.044 1.00 33.34 H new ATOM 0 HD11 ILE A 79 2.038 -2.076 6.045 1.00 0.41 H new ATOM 0 HD12 ILE A 79 2.082 -0.428 5.374 1.00 0.41 H new ATOM 0 HD13 ILE A 79 1.162 -0.759 6.861 1.00 0.41 H new ATOM 1337 N SER A 80 -1.562 2.710 3.621 1.00 24.42 N ATOM 1338 CA SER A 80 -2.444 3.629 2.853 1.00 72.51 C ATOM 1339 C SER A 80 -1.677 4.392 1.751 1.00 21.55 C ATOM 1340 O SER A 80 -2.259 4.717 0.721 1.00 20.33 O ATOM 1341 CB SER A 80 -3.141 4.643 3.792 1.00 63.23 C ATOM 1342 OG SER A 80 -3.971 5.557 3.079 1.00 51.22 O ATOM 0 H SER A 80 -1.528 2.912 4.620 1.00 24.42 H new ATOM 0 HA SER A 80 -3.196 3.004 2.371 1.00 72.51 H new ATOM 0 HB2 SER A 80 -3.743 4.104 4.523 1.00 63.23 H new ATOM 0 HB3 SER A 80 -2.386 5.199 4.348 1.00 63.23 H new ATOM 0 HG SER A 80 -4.392 6.177 3.710 1.00 51.22 H new ATOM 1348 N TYR A 81 -0.372 4.676 1.981 1.00 41.21 N ATOM 1349 CA TYR A 81 0.495 5.354 0.984 1.00 65.42 C ATOM 1350 C TYR A 81 0.984 4.395 -0.122 1.00 4.03 C ATOM 1351 O TYR A 81 1.267 4.838 -1.237 1.00 20.55 O ATOM 1352 CB TYR A 81 1.691 6.059 1.669 1.00 51.52 C ATOM 1353 CG TYR A 81 1.272 7.216 2.590 1.00 5.21 C ATOM 1354 CD1 TYR A 81 0.383 8.200 2.145 1.00 61.30 C ATOM 1355 CD2 TYR A 81 1.742 7.323 3.904 1.00 31.14 C ATOM 1356 CE1 TYR A 81 -0.021 9.229 2.970 1.00 21.32 C ATOM 1357 CE2 TYR A 81 1.341 8.357 4.725 1.00 72.24 C ATOM 1358 CZ TYR A 81 0.458 9.305 4.252 1.00 61.43 C ATOM 1359 OH TYR A 81 0.037 10.330 5.071 1.00 51.21 O ATOM 0 H TYR A 81 0.106 4.445 2.852 1.00 41.21 H new ATOM 0 HA TYR A 81 -0.121 6.112 0.500 1.00 65.42 H new ATOM 0 HB2 TYR A 81 2.251 5.326 2.250 1.00 51.52 H new ATOM 0 HB3 TYR A 81 2.366 6.441 0.903 1.00 51.52 H new ATOM 0 HD1 TYR A 81 0.005 8.153 1.134 1.00 61.30 H new ATOM 0 HD2 TYR A 81 2.431 6.583 4.282 1.00 31.14 H new ATOM 0 HE1 TYR A 81 -0.714 9.974 2.606 1.00 21.32 H new ATOM 0 HE2 TYR A 81 1.718 8.424 5.735 1.00 72.24 H new ATOM 0 HH TYR A 81 0.280 10.128 5.999 1.00 51.21 H new ATOM 1369 N CYS A 82 1.110 3.091 0.197 1.00 63.34 N ATOM 1370 CA CYS A 82 1.345 2.046 -0.828 1.00 32.01 C ATOM 1371 C CYS A 82 0.076 1.836 -1.694 1.00 12.41 C ATOM 1372 O CYS A 82 0.175 1.645 -2.905 1.00 31.25 O ATOM 1373 CB CYS A 82 1.792 0.717 -0.182 1.00 70.30 C ATOM 1374 SG CYS A 82 3.283 0.854 0.833 1.00 71.35 S ATOM 0 H CYS A 82 1.054 2.734 1.151 1.00 63.34 H new ATOM 0 HA CYS A 82 2.152 2.388 -1.476 1.00 32.01 H new ATOM 0 HB2 CYS A 82 0.979 0.334 0.435 1.00 70.30 H new ATOM 0 HB3 CYS A 82 1.967 -0.016 -0.969 1.00 70.30 H new ATOM 0 HG CYS A 82 3.039 1.608 1.863 1.00 71.35 H new ATOM 1380 N LEU A 83 -1.120 1.904 -1.055 1.00 43.34 N ATOM 1381 CA LEU A 83 -2.432 1.835 -1.756 1.00 52.24 C ATOM 1382 C LEU A 83 -2.642 3.097 -2.631 1.00 65.13 C ATOM 1383 O LEU A 83 -3.188 3.030 -3.736 1.00 22.01 O ATOM 1384 CB LEU A 83 -3.612 1.696 -0.742 1.00 33.01 C ATOM 1385 CG LEU A 83 -3.531 0.523 0.294 1.00 62.42 C ATOM 1386 CD1 LEU A 83 -4.812 0.434 1.151 1.00 2.42 C ATOM 1387 CD2 LEU A 83 -3.211 -0.827 -0.379 1.00 60.34 C ATOM 0 H LEU A 83 -1.204 2.008 -0.044 1.00 43.34 H new ATOM 0 HA LEU A 83 -2.421 0.950 -2.393 1.00 52.24 H new ATOM 0 HB2 LEU A 83 -3.693 2.631 -0.188 1.00 33.01 H new ATOM 0 HB3 LEU A 83 -4.535 1.581 -1.311 1.00 33.01 H new ATOM 0 HG LEU A 83 -2.701 0.750 0.962 1.00 62.42 H new ATOM 0 HD11 LEU A 83 -4.720 -0.390 1.858 1.00 2.42 H new ATOM 0 HD12 LEU A 83 -4.950 1.367 1.697 1.00 2.42 H new ATOM 0 HD13 LEU A 83 -5.672 0.263 0.503 1.00 2.42 H new ATOM 0 HD21 LEU A 83 -3.165 -1.609 0.379 1.00 60.34 H new ATOM 0 HD22 LEU A 83 -3.991 -1.067 -1.102 1.00 60.34 H new ATOM 0 HD23 LEU A 83 -2.251 -0.760 -0.890 1.00 60.34 H new ATOM 1399 N LYS A 84 -2.180 4.241 -2.100 1.00 23.53 N ATOM 1400 CA LYS A 84 -2.170 5.549 -2.788 1.00 50.52 C ATOM 1401 C LYS A 84 -1.231 5.508 -4.018 1.00 33.31 C ATOM 1402 O LYS A 84 -1.562 6.032 -5.069 1.00 23.24 O ATOM 1403 CB LYS A 84 -1.756 6.656 -1.745 1.00 35.20 C ATOM 1404 CG LYS A 84 -0.834 7.792 -2.238 1.00 62.33 C ATOM 1405 CD LYS A 84 -1.530 8.826 -3.143 1.00 41.54 C ATOM 1406 CE LYS A 84 -2.408 9.810 -2.369 1.00 31.03 C ATOM 1407 NZ LYS A 84 -3.124 10.737 -3.276 1.00 22.33 N ATOM 0 H LYS A 84 -1.793 4.286 -1.157 1.00 23.53 H new ATOM 0 HA LYS A 84 -3.162 5.790 -3.171 1.00 50.52 H new ATOM 0 HB2 LYS A 84 -2.668 7.108 -1.355 1.00 35.20 H new ATOM 0 HB3 LYS A 84 -1.262 6.162 -0.908 1.00 35.20 H new ATOM 0 HG2 LYS A 84 -0.417 8.307 -1.373 1.00 62.33 H new ATOM 0 HG3 LYS A 84 0.003 7.354 -2.783 1.00 62.33 H new ATOM 0 HD2 LYS A 84 -0.774 9.382 -3.697 1.00 41.54 H new ATOM 0 HD3 LYS A 84 -2.142 8.303 -3.877 1.00 41.54 H new ATOM 0 HE2 LYS A 84 -3.131 9.258 -1.768 1.00 31.03 H new ATOM 0 HE3 LYS A 84 -1.790 10.383 -1.677 1.00 31.03 H new ATOM 0 HZ1 LYS A 84 -2.788 11.708 -3.116 1.00 22.33 H new ATOM 0 HZ2 LYS A 84 -2.942 10.466 -4.263 1.00 22.33 H new ATOM 0 HZ3 LYS A 84 -4.145 10.688 -3.087 1.00 22.33 H new ATOM 1421 N PHE A 85 -0.057 4.888 -3.859 1.00 52.32 N ATOM 1422 CA PHE A 85 0.905 4.684 -4.961 1.00 2.13 C ATOM 1423 C PHE A 85 0.358 3.685 -6.010 1.00 33.22 C ATOM 1424 O PHE A 85 0.611 3.829 -7.208 1.00 51.32 O ATOM 1425 CB PHE A 85 2.245 4.200 -4.358 1.00 30.41 C ATOM 1426 CG PHE A 85 3.346 3.852 -5.358 1.00 22.13 C ATOM 1427 CD1 PHE A 85 4.150 4.843 -5.913 1.00 61.33 C ATOM 1428 CD2 PHE A 85 3.600 2.526 -5.713 1.00 23.20 C ATOM 1429 CE1 PHE A 85 5.168 4.519 -6.788 1.00 5.32 C ATOM 1430 CE2 PHE A 85 4.611 2.203 -6.588 1.00 64.42 C ATOM 1431 CZ PHE A 85 5.398 3.198 -7.126 1.00 13.21 C ATOM 0 H PHE A 85 0.258 4.511 -2.965 1.00 52.32 H new ATOM 0 HA PHE A 85 1.064 5.625 -5.487 1.00 2.13 H new ATOM 0 HB2 PHE A 85 2.621 4.976 -3.690 1.00 30.41 H new ATOM 0 HB3 PHE A 85 2.048 3.320 -3.745 1.00 30.41 H new ATOM 0 HD1 PHE A 85 3.976 5.878 -5.656 1.00 61.33 H new ATOM 0 HD2 PHE A 85 2.991 1.739 -5.293 1.00 23.20 H new ATOM 0 HE1 PHE A 85 5.786 5.299 -7.209 1.00 5.32 H new ATOM 0 HE2 PHE A 85 4.788 1.171 -6.853 1.00 64.42 H new ATOM 0 HZ PHE A 85 6.194 2.946 -7.811 1.00 13.21 H new ATOM 1441 N ALA A 86 -0.420 2.699 -5.528 1.00 25.10 N ATOM 1442 CA ALA A 86 -0.976 1.606 -6.348 1.00 73.22 C ATOM 1443 C ALA A 86 -1.898 2.104 -7.487 1.00 32.21 C ATOM 1444 O ALA A 86 -1.813 1.623 -8.609 1.00 41.43 O ATOM 1445 CB ALA A 86 -1.732 0.620 -5.451 1.00 72.12 C ATOM 0 H ALA A 86 -0.684 2.638 -4.545 1.00 25.10 H new ATOM 0 HA ALA A 86 -0.133 1.109 -6.828 1.00 73.22 H new ATOM 0 HB1 ALA A 86 -2.141 -0.186 -6.060 1.00 72.12 H new ATOM 0 HB2 ALA A 86 -1.049 0.204 -4.711 1.00 72.12 H new ATOM 0 HB3 ALA A 86 -2.545 1.140 -4.943 1.00 72.12 H new ATOM 1451 N GLU A 87 -2.766 3.085 -7.200 1.00 22.41 N ATOM 1452 CA GLU A 87 -3.718 3.632 -8.208 1.00 43.42 C ATOM 1453 C GLU A 87 -2.997 4.358 -9.389 1.00 11.13 C ATOM 1454 O GLU A 87 -3.598 4.606 -10.438 1.00 33.51 O ATOM 1455 CB GLU A 87 -4.736 4.567 -7.509 1.00 73.44 C ATOM 1456 CG GLU A 87 -4.099 5.784 -6.822 1.00 4.12 C ATOM 1457 CD GLU A 87 -5.091 6.600 -5.986 1.00 10.52 C ATOM 1458 OE1 GLU A 87 -5.795 7.464 -6.555 1.00 14.22 O ATOM 1459 OE2 GLU A 87 -5.185 6.372 -4.758 1.00 24.23 O ATOM 0 H GLU A 87 -2.837 3.523 -6.282 1.00 22.41 H new ATOM 0 HA GLU A 87 -4.249 2.791 -8.654 1.00 43.42 H new ATOM 0 HB2 GLU A 87 -5.459 4.916 -8.247 1.00 73.44 H new ATOM 0 HB3 GLU A 87 -5.290 3.993 -6.767 1.00 73.44 H new ATOM 0 HG2 GLU A 87 -3.286 5.445 -6.179 1.00 4.12 H new ATOM 0 HG3 GLU A 87 -3.657 6.430 -7.581 1.00 4.12 H new ATOM 1466 N TYR A 88 -1.693 4.659 -9.206 1.00 62.42 N ATOM 1467 CA TYR A 88 -0.828 5.258 -10.255 1.00 23.50 C ATOM 1468 C TYR A 88 -0.053 4.166 -11.044 1.00 24.44 C ATOM 1469 O TYR A 88 0.840 4.486 -11.828 1.00 51.41 O ATOM 1470 CB TYR A 88 0.168 6.269 -9.605 1.00 14.00 C ATOM 1471 CG TYR A 88 -0.504 7.309 -8.691 1.00 23.01 C ATOM 1472 CD1 TYR A 88 -1.664 7.973 -9.094 1.00 4.13 C ATOM 1473 CD2 TYR A 88 -0.005 7.605 -7.417 1.00 32.53 C ATOM 1474 CE1 TYR A 88 -2.296 8.880 -8.274 1.00 24.14 C ATOM 1475 CE2 TYR A 88 -0.639 8.509 -6.594 1.00 31.22 C ATOM 1476 CZ TYR A 88 -1.783 9.144 -7.023 1.00 51.23 C ATOM 1477 OH TYR A 88 -2.427 10.035 -6.191 1.00 10.05 O ATOM 0 H TYR A 88 -1.206 4.494 -8.325 1.00 62.42 H new ATOM 0 HA TYR A 88 -1.467 5.786 -10.963 1.00 23.50 H new ATOM 0 HB2 TYR A 88 0.906 5.715 -9.026 1.00 14.00 H new ATOM 0 HB3 TYR A 88 0.708 6.790 -10.395 1.00 14.00 H new ATOM 0 HD1 TYR A 88 -2.075 7.770 -10.072 1.00 4.13 H new ATOM 0 HD2 TYR A 88 0.894 7.115 -7.073 1.00 32.53 H new ATOM 0 HE1 TYR A 88 -3.191 9.383 -8.610 1.00 24.14 H new ATOM 0 HE2 TYR A 88 -0.239 8.720 -5.613 1.00 31.22 H new ATOM 0 HH TYR A 88 -3.389 10.022 -6.379 1.00 10.05 H new ATOM 1487 N ASN A 89 -0.404 2.880 -10.823 1.00 24.43 N ATOM 1488 CA ASN A 89 0.235 1.709 -11.483 1.00 52.05 C ATOM 1489 C ASN A 89 -0.823 0.705 -12.014 1.00 15.41 C ATOM 1490 O ASN A 89 -1.908 0.569 -11.446 1.00 40.42 O ATOM 1491 CB ASN A 89 1.188 0.980 -10.493 1.00 45.02 C ATOM 1492 CG ASN A 89 2.428 1.798 -10.134 1.00 20.00 C ATOM 1493 OD1 ASN A 89 3.464 1.691 -10.773 1.00 53.11 O ATOM 1494 ND2 ASN A 89 2.327 2.631 -9.123 1.00 40.20 N ATOM 0 H ASN A 89 -1.147 2.618 -10.175 1.00 24.43 H new ATOM 0 HA ASN A 89 0.807 2.087 -12.330 1.00 52.05 H new ATOM 0 HB2 ASN A 89 0.641 0.743 -9.581 1.00 45.02 H new ATOM 0 HB3 ASN A 89 1.501 0.033 -10.932 1.00 45.02 H new ATOM 0 HD21 ASN A 89 3.125 3.207 -8.855 1.00 40.20 H new ATOM 0 HD22 ASN A 89 1.451 2.701 -8.606 1.00 40.20 H new ATOM 1501 N SER A 90 -0.478 0.000 -13.110 1.00 10.42 N ATOM 1502 CA SER A 90 -1.307 -1.099 -13.676 1.00 45.02 C ATOM 1503 C SER A 90 -0.747 -2.488 -13.281 1.00 23.10 C ATOM 1504 O SER A 90 -1.459 -3.486 -13.361 1.00 23.42 O ATOM 1505 CB SER A 90 -1.370 -0.992 -15.219 1.00 32.44 C ATOM 1506 OG SER A 90 -0.096 -1.210 -15.808 1.00 54.40 O ATOM 0 H SER A 90 0.381 0.171 -13.632 1.00 10.42 H new ATOM 0 HA SER A 90 -2.310 -0.997 -13.263 1.00 45.02 H new ATOM 0 HB2 SER A 90 -2.081 -1.722 -15.607 1.00 32.44 H new ATOM 0 HB3 SER A 90 -1.739 -0.006 -15.502 1.00 32.44 H new ATOM 0 HG SER A 90 -0.169 -1.137 -16.783 1.00 54.40 H new ATOM 1512 N ASP A 91 0.532 -2.537 -12.853 1.00 12.40 N ATOM 1513 CA ASP A 91 1.237 -3.793 -12.469 1.00 34.13 C ATOM 1514 C ASP A 91 0.971 -4.186 -10.981 1.00 44.13 C ATOM 1515 O ASP A 91 1.876 -4.633 -10.275 1.00 1.42 O ATOM 1516 CB ASP A 91 2.757 -3.605 -12.725 1.00 34.43 C ATOM 1517 CG ASP A 91 3.101 -3.443 -14.216 1.00 4.50 C ATOM 1518 OD1 ASP A 91 3.308 -4.463 -14.897 1.00 3.13 O ATOM 1519 OD2 ASP A 91 3.148 -2.305 -14.723 1.00 62.23 O ATOM 0 H ASP A 91 1.114 -1.705 -12.761 1.00 12.40 H new ATOM 0 HA ASP A 91 0.852 -4.611 -13.078 1.00 34.13 H new ATOM 0 HB2 ASP A 91 3.106 -2.728 -12.180 1.00 34.43 H new ATOM 0 HB3 ASP A 91 3.296 -4.464 -12.325 1.00 34.43 H new ATOM 1524 N LEU A 92 -0.301 -4.083 -10.551 1.00 30.14 N ATOM 1525 CA LEU A 92 -0.713 -4.242 -9.134 1.00 22.14 C ATOM 1526 C LEU A 92 -0.582 -5.674 -8.596 1.00 51.14 C ATOM 1527 O LEU A 92 -0.182 -5.855 -7.445 1.00 31.13 O ATOM 1528 CB LEU A 92 -2.155 -3.721 -8.940 1.00 11.11 C ATOM 1529 CG LEU A 92 -2.357 -2.210 -9.247 1.00 4.13 C ATOM 1530 CD1 LEU A 92 -3.758 -1.722 -8.819 1.00 50.40 C ATOM 1531 CD2 LEU A 92 -1.238 -1.378 -8.593 1.00 55.20 C ATOM 0 H LEU A 92 -1.081 -3.886 -11.178 1.00 30.14 H new ATOM 0 HA LEU A 92 -0.015 -3.644 -8.548 1.00 22.14 H new ATOM 0 HB2 LEU A 92 -2.823 -4.298 -9.580 1.00 11.11 H new ATOM 0 HB3 LEU A 92 -2.458 -3.910 -7.910 1.00 11.11 H new ATOM 0 HG LEU A 92 -2.296 -2.071 -10.326 1.00 4.13 H new ATOM 0 HD11 LEU A 92 -3.860 -0.662 -9.050 1.00 50.40 H new ATOM 0 HD12 LEU A 92 -4.520 -2.286 -9.357 1.00 50.40 H new ATOM 0 HD13 LEU A 92 -3.884 -1.874 -7.747 1.00 50.40 H new ATOM 0 HD21 LEU A 92 -1.392 -0.322 -8.816 1.00 55.20 H new ATOM 0 HD22 LEU A 92 -1.257 -1.527 -7.513 1.00 55.20 H new ATOM 0 HD23 LEU A 92 -0.272 -1.695 -8.986 1.00 55.20 H new ATOM 1543 N HIS A 93 -0.944 -6.688 -9.399 1.00 73.14 N ATOM 1544 CA HIS A 93 -0.749 -8.101 -9.009 1.00 43.32 C ATOM 1545 C HIS A 93 0.741 -8.425 -8.706 1.00 4.13 C ATOM 1546 O HIS A 93 1.028 -9.306 -7.907 1.00 73.03 O ATOM 1547 CB HIS A 93 -1.345 -9.064 -10.073 1.00 63.03 C ATOM 1548 CG HIS A 93 -0.792 -8.956 -11.481 1.00 13.02 C ATOM 1549 ND1 HIS A 93 -1.586 -8.674 -12.573 1.00 34.24 N ATOM 1550 CD2 HIS A 93 0.444 -9.174 -11.993 1.00 25.32 C ATOM 1551 CE1 HIS A 93 -0.874 -8.727 -13.668 1.00 4.33 C ATOM 1552 NE2 HIS A 93 0.355 -9.029 -13.346 1.00 4.04 N ATOM 0 H HIS A 93 -1.371 -6.561 -10.317 1.00 73.14 H new ATOM 0 HA HIS A 93 -1.296 -8.258 -8.079 1.00 43.32 H new ATOM 0 HB2 HIS A 93 -1.195 -10.087 -9.727 1.00 63.03 H new ATOM 0 HB3 HIS A 93 -2.421 -8.897 -10.117 1.00 63.03 H new ATOM 0 HD2 HIS A 93 1.335 -9.418 -11.433 1.00 25.32 H new ATOM 0 HE1 HIS A 93 -1.240 -8.551 -14.669 1.00 4.33 H new ATOM 0 HE2 HIS A 93 1.127 -9.139 -14.003 1.00 4.04 H new ATOM 1561 N GLN A 94 1.676 -7.690 -9.346 1.00 34.10 N ATOM 1562 CA GLN A 94 3.119 -7.787 -9.037 1.00 71.21 C ATOM 1563 C GLN A 94 3.480 -6.908 -7.812 1.00 0.02 C ATOM 1564 O GLN A 94 4.224 -7.343 -6.939 1.00 41.05 O ATOM 1565 CB GLN A 94 3.977 -7.370 -10.263 1.00 45.42 C ATOM 1566 CG GLN A 94 3.789 -8.252 -11.521 1.00 21.14 C ATOM 1567 CD GLN A 94 4.755 -7.943 -12.675 1.00 65.10 C ATOM 1568 OE1 GLN A 94 4.415 -8.085 -13.843 1.00 33.54 O ATOM 1569 NE2 GLN A 94 5.977 -7.574 -12.365 1.00 52.43 N ATOM 0 H GLN A 94 1.456 -7.020 -10.083 1.00 34.10 H new ATOM 0 HA GLN A 94 3.339 -8.827 -8.797 1.00 71.21 H new ATOM 0 HB2 GLN A 94 3.738 -6.338 -10.521 1.00 45.42 H new ATOM 0 HB3 GLN A 94 5.028 -7.391 -9.976 1.00 45.42 H new ATOM 0 HG2 GLN A 94 3.909 -9.297 -11.236 1.00 21.14 H new ATOM 0 HG3 GLN A 94 2.767 -8.135 -11.880 1.00 21.14 H new ATOM 0 HE21 GLN A 94 6.243 -7.461 -11.387 1.00 52.43 H new ATOM 0 HE22 GLN A 94 6.660 -7.401 -13.102 1.00 52.43 H new ATOM 1578 N PHE A 95 2.928 -5.680 -7.768 1.00 64.52 N ATOM 1579 CA PHE A 95 3.214 -4.678 -6.712 1.00 54.40 C ATOM 1580 C PHE A 95 2.811 -5.179 -5.299 1.00 64.33 C ATOM 1581 O PHE A 95 3.659 -5.280 -4.409 1.00 72.12 O ATOM 1582 CB PHE A 95 2.496 -3.338 -7.054 1.00 41.32 C ATOM 1583 CG PHE A 95 2.540 -2.296 -5.937 1.00 25.32 C ATOM 1584 CD1 PHE A 95 3.757 -1.766 -5.499 1.00 63.31 C ATOM 1585 CD2 PHE A 95 1.369 -1.865 -5.303 1.00 25.02 C ATOM 1586 CE1 PHE A 95 3.797 -0.848 -4.470 1.00 50.15 C ATOM 1587 CE2 PHE A 95 1.416 -0.945 -4.281 1.00 40.13 C ATOM 1588 CZ PHE A 95 2.628 -0.438 -3.862 1.00 12.22 C ATOM 0 H PHE A 95 2.265 -5.349 -8.469 1.00 64.52 H new ATOM 0 HA PHE A 95 4.291 -4.515 -6.687 1.00 54.40 H new ATOM 0 HB2 PHE A 95 2.952 -2.914 -7.949 1.00 41.32 H new ATOM 0 HB3 PHE A 95 1.455 -3.549 -7.296 1.00 41.32 H new ATOM 0 HD1 PHE A 95 4.676 -2.079 -5.972 1.00 63.31 H new ATOM 0 HD2 PHE A 95 0.415 -2.260 -5.620 1.00 25.02 H new ATOM 0 HE1 PHE A 95 4.745 -0.449 -4.140 1.00 50.15 H new ATOM 0 HE2 PHE A 95 0.502 -0.619 -3.806 1.00 40.13 H new ATOM 0 HZ PHE A 95 2.662 0.281 -3.057 1.00 12.22 H new ATOM 1598 N PHE A 96 1.515 -5.476 -5.114 1.00 75.23 N ATOM 1599 CA PHE A 96 0.981 -6.007 -3.842 1.00 0.03 C ATOM 1600 C PHE A 96 1.590 -7.382 -3.468 1.00 35.12 C ATOM 1601 O PHE A 96 1.645 -7.736 -2.286 1.00 50.23 O ATOM 1602 CB PHE A 96 -0.550 -6.136 -3.915 1.00 70.22 C ATOM 1603 CG PHE A 96 -1.317 -4.824 -4.050 1.00 11.44 C ATOM 1604 CD1 PHE A 96 -1.241 -3.851 -3.056 1.00 40.44 C ATOM 1605 CD2 PHE A 96 -2.143 -4.575 -5.148 1.00 35.05 C ATOM 1606 CE1 PHE A 96 -1.957 -2.677 -3.158 1.00 21.30 C ATOM 1607 CE2 PHE A 96 -2.864 -3.404 -5.244 1.00 63.33 C ATOM 1608 CZ PHE A 96 -2.771 -2.456 -4.249 1.00 65.53 C ATOM 0 H PHE A 96 0.806 -5.356 -5.838 1.00 75.23 H new ATOM 0 HA PHE A 96 1.262 -5.295 -3.066 1.00 0.03 H new ATOM 0 HB2 PHE A 96 -0.803 -6.773 -4.763 1.00 70.22 H new ATOM 0 HB3 PHE A 96 -0.897 -6.648 -3.017 1.00 70.22 H new ATOM 0 HD1 PHE A 96 -0.613 -4.018 -2.194 1.00 40.44 H new ATOM 0 HD2 PHE A 96 -2.218 -5.311 -5.934 1.00 35.05 H new ATOM 0 HE1 PHE A 96 -1.880 -1.929 -2.382 1.00 21.30 H new ATOM 0 HE2 PHE A 96 -3.501 -3.230 -6.098 1.00 63.33 H new ATOM 0 HZ PHE A 96 -3.336 -1.539 -4.323 1.00 65.53 H new ATOM 1618 N GLU A 97 2.023 -8.157 -4.489 1.00 23.14 N ATOM 1619 CA GLU A 97 2.728 -9.436 -4.272 1.00 54.43 C ATOM 1620 C GLU A 97 4.119 -9.192 -3.661 1.00 1.23 C ATOM 1621 O GLU A 97 4.485 -9.852 -2.703 1.00 32.53 O ATOM 1622 CB GLU A 97 2.854 -10.234 -5.589 1.00 62.41 C ATOM 1623 CG GLU A 97 3.490 -11.631 -5.438 1.00 74.13 C ATOM 1624 CD GLU A 97 3.614 -12.383 -6.771 1.00 32.11 C ATOM 1625 OE1 GLU A 97 2.595 -12.927 -7.250 1.00 74.31 O ATOM 1626 OE2 GLU A 97 4.726 -12.445 -7.340 1.00 43.51 O ATOM 0 H GLU A 97 1.895 -7.916 -5.472 1.00 23.14 H new ATOM 0 HA GLU A 97 2.137 -10.027 -3.572 1.00 54.43 H new ATOM 0 HB2 GLU A 97 1.862 -10.347 -6.026 1.00 62.41 H new ATOM 0 HB3 GLU A 97 3.449 -9.653 -6.294 1.00 62.41 H new ATOM 0 HG2 GLU A 97 4.479 -11.527 -4.993 1.00 74.13 H new ATOM 0 HG3 GLU A 97 2.890 -12.224 -4.747 1.00 74.13 H new ATOM 1633 N PHE A 98 4.861 -8.216 -4.226 1.00 60.32 N ATOM 1634 CA PHE A 98 6.183 -7.763 -3.719 1.00 21.32 C ATOM 1635 C PHE A 98 6.084 -7.340 -2.232 1.00 14.44 C ATOM 1636 O PHE A 98 6.939 -7.707 -1.398 1.00 33.44 O ATOM 1637 CB PHE A 98 6.708 -6.599 -4.642 1.00 12.21 C ATOM 1638 CG PHE A 98 7.502 -5.479 -3.956 1.00 24.42 C ATOM 1639 CD1 PHE A 98 8.850 -5.636 -3.629 1.00 50.33 C ATOM 1640 CD2 PHE A 98 6.887 -4.262 -3.631 1.00 45.13 C ATOM 1641 CE1 PHE A 98 9.551 -4.621 -3.000 1.00 34.44 C ATOM 1642 CE2 PHE A 98 7.589 -3.252 -3.006 1.00 43.34 C ATOM 1643 CZ PHE A 98 8.920 -3.430 -2.689 1.00 52.11 C ATOM 0 H PHE A 98 4.558 -7.711 -5.059 1.00 60.32 H new ATOM 0 HA PHE A 98 6.901 -8.582 -3.757 1.00 21.32 H new ATOM 0 HB2 PHE A 98 7.338 -7.037 -5.417 1.00 12.21 H new ATOM 0 HB3 PHE A 98 5.851 -6.150 -5.144 1.00 12.21 H new ATOM 0 HD1 PHE A 98 9.353 -6.561 -3.870 1.00 50.33 H new ATOM 0 HD2 PHE A 98 5.845 -4.112 -3.874 1.00 45.13 H new ATOM 0 HE1 PHE A 98 10.593 -4.760 -2.752 1.00 34.44 H new ATOM 0 HE2 PHE A 98 7.096 -2.322 -2.765 1.00 43.34 H new ATOM 0 HZ PHE A 98 9.469 -2.640 -2.198 1.00 52.11 H new ATOM 1653 N LEU A 99 5.020 -6.580 -1.924 1.00 34.14 N ATOM 1654 CA LEU A 99 4.693 -6.174 -0.555 1.00 1.44 C ATOM 1655 C LEU A 99 4.505 -7.413 0.353 1.00 13.40 C ATOM 1656 O LEU A 99 5.200 -7.557 1.353 1.00 53.32 O ATOM 1657 CB LEU A 99 3.425 -5.273 -0.548 1.00 32.14 C ATOM 1658 CG LEU A 99 3.537 -3.923 -1.339 1.00 34.13 C ATOM 1659 CD1 LEU A 99 2.201 -3.153 -1.337 1.00 54.00 C ATOM 1660 CD2 LEU A 99 4.687 -3.037 -0.799 1.00 31.10 C ATOM 0 H LEU A 99 4.363 -6.231 -2.622 1.00 34.14 H new ATOM 0 HA LEU A 99 5.524 -5.593 -0.155 1.00 1.44 H new ATOM 0 HB2 LEU A 99 2.594 -5.845 -0.961 1.00 32.14 H new ATOM 0 HB3 LEU A 99 3.171 -5.045 0.487 1.00 32.14 H new ATOM 0 HG LEU A 99 3.773 -4.178 -2.372 1.00 34.13 H new ATOM 0 HD11 LEU A 99 2.316 -2.223 -1.894 1.00 54.00 H new ATOM 0 HD12 LEU A 99 1.429 -3.763 -1.805 1.00 54.00 H new ATOM 0 HD13 LEU A 99 1.913 -2.928 -0.310 1.00 54.00 H new ATOM 0 HD21 LEU A 99 4.733 -2.111 -1.372 1.00 31.10 H new ATOM 0 HD22 LEU A 99 4.506 -2.806 0.251 1.00 31.10 H new ATOM 0 HD23 LEU A 99 5.633 -3.570 -0.895 1.00 31.10 H new ATOM 1672 N TYR A 100 3.622 -8.336 -0.062 1.00 74.12 N ATOM 1673 CA TYR A 100 3.328 -9.575 0.695 1.00 40.43 C ATOM 1674 C TYR A 100 4.599 -10.450 0.905 1.00 73.22 C ATOM 1675 O TYR A 100 4.798 -11.014 1.984 1.00 4.13 O ATOM 1676 CB TYR A 100 2.226 -10.392 -0.026 1.00 31.55 C ATOM 1677 CG TYR A 100 1.753 -11.625 0.765 1.00 5.32 C ATOM 1678 CD1 TYR A 100 0.872 -11.494 1.843 1.00 63.23 C ATOM 1679 CD2 TYR A 100 2.203 -12.916 0.455 1.00 71.33 C ATOM 1680 CE1 TYR A 100 0.463 -12.594 2.573 1.00 52.41 C ATOM 1681 CE2 TYR A 100 1.790 -14.014 1.182 1.00 2.21 C ATOM 1682 CZ TYR A 100 0.921 -13.846 2.241 1.00 52.01 C ATOM 1683 OH TYR A 100 0.506 -14.939 2.971 1.00 2.43 O ATOM 0 H TYR A 100 3.091 -8.250 -0.928 1.00 74.12 H new ATOM 0 HA TYR A 100 2.972 -9.279 1.682 1.00 40.43 H new ATOM 0 HB2 TYR A 100 1.371 -9.743 -0.216 1.00 31.55 H new ATOM 0 HB3 TYR A 100 2.602 -10.716 -0.996 1.00 31.55 H new ATOM 0 HD1 TYR A 100 0.504 -10.514 2.110 1.00 63.23 H new ATOM 0 HD2 TYR A 100 2.887 -13.054 -0.369 1.00 71.33 H new ATOM 0 HE1 TYR A 100 -0.216 -12.469 3.404 1.00 52.41 H new ATOM 0 HE2 TYR A 100 2.145 -15.001 0.923 1.00 2.21 H new ATOM 0 HH TYR A 100 0.919 -15.750 2.609 1.00 2.43 H new ATOM 1693 N ASN A 101 5.454 -10.529 -0.133 1.00 23.44 N ATOM 1694 CA ASN A 101 6.689 -11.342 -0.119 1.00 22.31 C ATOM 1695 C ASN A 101 7.723 -10.800 0.896 1.00 71.03 C ATOM 1696 O ASN A 101 8.403 -11.582 1.568 1.00 31.41 O ATOM 1697 CB ASN A 101 7.318 -11.417 -1.536 1.00 45.23 C ATOM 1698 CG ASN A 101 6.448 -12.166 -2.557 1.00 0.21 C ATOM 1699 OD1 ASN A 101 5.678 -13.057 -2.215 1.00 72.45 O ATOM 1700 ND2 ASN A 101 6.563 -11.813 -3.818 1.00 12.32 N ATOM 0 H ASN A 101 5.308 -10.029 -1.010 1.00 23.44 H new ATOM 0 HA ASN A 101 6.408 -12.347 0.195 1.00 22.31 H new ATOM 0 HB2 ASN A 101 7.498 -10.405 -1.898 1.00 45.23 H new ATOM 0 HB3 ASN A 101 8.288 -11.909 -1.468 1.00 45.23 H new ATOM 0 HD21 ASN A 101 6.006 -12.283 -4.532 1.00 12.32 H new ATOM 0 HD22 ASN A 101 7.209 -11.069 -4.083 1.00 12.32 H new ATOM 1707 N HIS A 102 7.833 -9.458 1.019 1.00 23.11 N ATOM 1708 CA HIS A 102 8.730 -8.840 2.032 1.00 53.41 C ATOM 1709 C HIS A 102 8.013 -8.685 3.415 1.00 13.34 C ATOM 1710 O HIS A 102 8.620 -8.235 4.386 1.00 13.33 O ATOM 1711 CB HIS A 102 9.287 -7.474 1.521 1.00 31.15 C ATOM 1712 CG HIS A 102 10.499 -6.990 2.295 1.00 23.05 C ATOM 1713 ND1 HIS A 102 10.402 -6.430 3.550 1.00 61.32 N ATOM 1714 CD2 HIS A 102 11.833 -7.069 2.036 1.00 21.23 C ATOM 1715 CE1 HIS A 102 11.595 -6.200 4.028 1.00 25.05 C ATOM 1716 NE2 HIS A 102 12.483 -6.572 3.139 1.00 71.25 N ATOM 0 H HIS A 102 7.323 -8.789 0.442 1.00 23.11 H new ATOM 0 HA HIS A 102 9.576 -9.511 2.182 1.00 53.41 H new ATOM 0 HB2 HIS A 102 9.552 -7.569 0.468 1.00 31.15 H new ATOM 0 HB3 HIS A 102 8.500 -6.722 1.585 1.00 31.15 H new ATOM 0 HD2 HIS A 102 12.292 -7.450 1.136 1.00 21.23 H new ATOM 0 HE1 HIS A 102 11.814 -5.774 4.996 1.00 25.05 H new ATOM 0 HE2 HIS A 102 13.495 -6.503 3.249 1.00 71.25 H new ATOM 1725 N GLY A 103 6.740 -9.105 3.514 1.00 45.32 N ATOM 1726 CA GLY A 103 5.968 -8.994 4.768 1.00 22.21 C ATOM 1727 C GLY A 103 5.353 -7.613 5.029 1.00 12.23 C ATOM 1728 O GLY A 103 4.920 -7.327 6.152 1.00 32.35 O ATOM 0 H GLY A 103 6.222 -9.525 2.742 1.00 45.32 H new ATOM 0 HA2 GLY A 103 5.168 -9.734 4.752 1.00 22.21 H new ATOM 0 HA3 GLY A 103 6.621 -9.248 5.603 1.00 22.21 H new ATOM 1732 N ILE A 104 5.322 -6.759 4.000 1.00 23.10 N ATOM 1733 CA ILE A 104 4.703 -5.421 4.081 1.00 12.11 C ATOM 1734 C ILE A 104 3.161 -5.565 4.145 1.00 71.33 C ATOM 1735 O ILE A 104 2.572 -6.144 3.233 1.00 11.14 O ATOM 1736 CB ILE A 104 5.059 -4.505 2.836 1.00 74.52 C ATOM 1737 CG1 ILE A 104 6.542 -4.685 2.359 1.00 41.04 C ATOM 1738 CG2 ILE A 104 4.737 -3.015 3.127 1.00 15.13 C ATOM 1739 CD1 ILE A 104 7.604 -4.412 3.389 1.00 71.14 C ATOM 0 H ILE A 104 5.723 -6.971 3.086 1.00 23.10 H new ATOM 0 HA ILE A 104 5.098 -4.947 4.979 1.00 12.11 H new ATOM 0 HB ILE A 104 4.426 -4.835 2.012 1.00 74.52 H new ATOM 0 HG12 ILE A 104 6.666 -5.707 2.000 1.00 41.04 H new ATOM 0 HG13 ILE A 104 6.711 -4.026 1.508 1.00 41.04 H new ATOM 0 HG21 ILE A 104 4.991 -2.411 2.256 1.00 15.13 H new ATOM 0 HG22 ILE A 104 3.674 -2.908 3.345 1.00 15.13 H new ATOM 0 HG23 ILE A 104 5.319 -2.678 3.985 1.00 15.13 H new ATOM 0 HD11 ILE A 104 8.588 -4.568 2.947 1.00 71.14 H new ATOM 0 HD12 ILE A 104 7.520 -3.381 3.733 1.00 71.14 H new ATOM 0 HD13 ILE A 104 7.474 -5.089 4.234 1.00 71.14 H new ATOM 1751 N GLY A 105 2.533 -5.061 5.228 1.00 20.34 N ATOM 1752 CA GLY A 105 1.066 -5.023 5.345 1.00 12.51 C ATOM 1753 C GLY A 105 0.397 -6.379 5.566 1.00 55.32 C ATOM 1754 O GLY A 105 -0.808 -6.516 5.332 1.00 34.44 O ATOM 0 H GLY A 105 3.024 -4.674 6.034 1.00 20.34 H new ATOM 0 HA2 GLY A 105 0.800 -4.365 6.172 1.00 12.51 H new ATOM 0 HA3 GLY A 105 0.656 -4.577 4.439 1.00 12.51 H new ATOM 1758 N THR A 106 1.169 -7.381 6.030 1.00 40.21 N ATOM 1759 CA THR A 106 0.637 -8.737 6.312 1.00 40.21 C ATOM 1760 C THR A 106 -0.238 -8.772 7.583 1.00 3.21 C ATOM 1761 O THR A 106 -1.011 -9.714 7.783 1.00 3.55 O ATOM 1762 CB THR A 106 1.771 -9.806 6.421 1.00 41.22 C ATOM 1763 OG1 THR A 106 2.736 -9.414 7.415 1.00 13.24 O ATOM 1764 CG2 THR A 106 2.471 -10.025 5.068 1.00 23.31 C ATOM 0 H THR A 106 2.166 -7.280 6.219 1.00 40.21 H new ATOM 0 HA THR A 106 0.008 -8.988 5.458 1.00 40.21 H new ATOM 0 HB THR A 106 1.310 -10.747 6.720 1.00 41.22 H new ATOM 0 HG1 THR A 106 3.390 -8.804 7.014 1.00 13.24 H new ATOM 0 HG21 THR A 106 3.254 -10.775 5.181 1.00 23.31 H new ATOM 0 HG22 THR A 106 1.743 -10.368 4.333 1.00 23.31 H new ATOM 0 HG23 THR A 106 2.912 -9.087 4.731 1.00 23.31 H new ATOM 1772 N LEU A 107 -0.088 -7.746 8.446 1.00 14.44 N ATOM 1773 CA LEU A 107 -0.987 -7.506 9.597 1.00 41.33 C ATOM 1774 C LEU A 107 -1.993 -6.359 9.304 1.00 42.41 C ATOM 1775 O LEU A 107 -2.699 -5.909 10.203 1.00 2.13 O ATOM 1776 CB LEU A 107 -0.161 -7.221 10.887 1.00 41.24 C ATOM 1777 CG LEU A 107 0.656 -8.434 11.452 1.00 42.04 C ATOM 1778 CD1 LEU A 107 1.426 -8.056 12.738 1.00 51.32 C ATOM 1779 CD2 LEU A 107 -0.267 -9.648 11.701 1.00 24.23 C ATOM 0 H LEU A 107 0.661 -7.058 8.365 1.00 14.44 H new ATOM 0 HA LEU A 107 -1.571 -8.411 9.762 1.00 41.33 H new ATOM 0 HB2 LEU A 107 0.531 -6.405 10.680 1.00 41.24 H new ATOM 0 HB3 LEU A 107 -0.842 -6.872 11.663 1.00 41.24 H new ATOM 0 HG LEU A 107 1.394 -8.711 10.699 1.00 42.04 H new ATOM 0 HD11 LEU A 107 1.980 -8.923 13.099 1.00 51.32 H new ATOM 0 HD12 LEU A 107 2.122 -7.246 12.521 1.00 51.32 H new ATOM 0 HD13 LEU A 107 0.720 -7.732 13.503 1.00 51.32 H new ATOM 0 HD21 LEU A 107 0.321 -10.478 12.093 1.00 24.23 H new ATOM 0 HD22 LEU A 107 -1.038 -9.377 12.422 1.00 24.23 H new ATOM 0 HD23 LEU A 107 -0.736 -9.947 10.764 1.00 24.23 H new ATOM 1791 N SER A 108 -2.103 -5.940 8.029 1.00 33.11 N ATOM 1792 CA SER A 108 -3.024 -4.853 7.609 1.00 1.13 C ATOM 1793 C SER A 108 -4.062 -5.372 6.585 1.00 5.34 C ATOM 1794 O SER A 108 -3.711 -5.683 5.444 1.00 50.11 O ATOM 1795 CB SER A 108 -2.223 -3.680 7.005 1.00 63.00 C ATOM 1796 OG SER A 108 -1.279 -3.166 7.936 1.00 21.34 O ATOM 0 H SER A 108 -1.562 -6.339 7.262 1.00 33.11 H new ATOM 0 HA SER A 108 -3.560 -4.501 8.491 1.00 1.13 H new ATOM 0 HB2 SER A 108 -1.705 -4.015 6.106 1.00 63.00 H new ATOM 0 HB3 SER A 108 -2.907 -2.887 6.702 1.00 63.00 H new ATOM 0 HG SER A 108 -1.018 -2.259 7.671 1.00 21.34 H new ATOM 1802 N SER A 109 -5.342 -5.451 7.014 1.00 44.55 N ATOM 1803 CA SER A 109 -6.493 -5.831 6.138 1.00 31.32 C ATOM 1804 C SER A 109 -6.614 -4.982 4.832 1.00 63.41 C ATOM 1805 O SER A 109 -6.702 -5.583 3.750 1.00 11.53 O ATOM 1806 CB SER A 109 -7.817 -5.773 6.937 1.00 31.42 C ATOM 1807 OG SER A 109 -8.960 -6.001 6.127 1.00 22.23 O ATOM 0 H SER A 109 -5.615 -5.254 7.977 1.00 44.55 H new ATOM 0 HA SER A 109 -6.293 -6.852 5.813 1.00 31.32 H new ATOM 0 HB2 SER A 109 -7.788 -6.517 7.734 1.00 31.42 H new ATOM 0 HB3 SER A 109 -7.905 -4.797 7.415 1.00 31.42 H new ATOM 0 HG SER A 109 -9.191 -5.178 5.647 1.00 22.23 H new ATOM 1813 N PRO A 110 -6.590 -3.585 4.882 1.00 0.41 N ATOM 1814 CA PRO A 110 -6.753 -2.715 3.664 1.00 73.00 C ATOM 1815 C PRO A 110 -5.838 -3.088 2.459 1.00 73.23 C ATOM 1816 O PRO A 110 -6.193 -2.822 1.302 1.00 52.43 O ATOM 1817 CB PRO A 110 -6.421 -1.284 4.190 1.00 14.34 C ATOM 1818 CG PRO A 110 -5.772 -1.495 5.528 1.00 75.30 C ATOM 1819 CD PRO A 110 -6.421 -2.727 6.094 1.00 22.04 C ATOM 0 HA PRO A 110 -7.756 -2.825 3.252 1.00 73.00 H new ATOM 0 HB2 PRO A 110 -5.753 -0.759 3.507 1.00 14.34 H new ATOM 0 HB3 PRO A 110 -7.323 -0.679 4.281 1.00 14.34 H new ATOM 0 HG2 PRO A 110 -4.695 -1.629 5.426 1.00 75.30 H new ATOM 0 HG3 PRO A 110 -5.926 -0.635 6.180 1.00 75.30 H new ATOM 0 HD2 PRO A 110 -5.796 -3.206 6.847 1.00 22.04 H new ATOM 0 HD3 PRO A 110 -7.376 -2.502 6.569 1.00 22.04 H new ATOM 1827 N LEU A 111 -4.669 -3.699 2.743 1.00 71.13 N ATOM 1828 CA LEU A 111 -3.741 -4.184 1.700 1.00 15.43 C ATOM 1829 C LEU A 111 -4.390 -5.300 0.845 1.00 53.23 C ATOM 1830 O LEU A 111 -4.477 -5.190 -0.384 1.00 43.32 O ATOM 1831 CB LEU A 111 -2.435 -4.729 2.332 1.00 71.02 C ATOM 1832 CG LEU A 111 -1.336 -5.133 1.296 1.00 14.30 C ATOM 1833 CD1 LEU A 111 -0.715 -3.887 0.634 1.00 0.24 C ATOM 1834 CD2 LEU A 111 -0.265 -6.051 1.912 1.00 4.34 C ATOM 0 H LEU A 111 -4.343 -3.869 3.695 1.00 71.13 H new ATOM 0 HA LEU A 111 -3.508 -3.334 1.059 1.00 15.43 H new ATOM 0 HB2 LEU A 111 -2.026 -3.972 3.001 1.00 71.02 H new ATOM 0 HB3 LEU A 111 -2.677 -5.598 2.944 1.00 71.02 H new ATOM 0 HG LEU A 111 -1.825 -5.714 0.514 1.00 14.30 H new ATOM 0 HD11 LEU A 111 0.046 -4.197 -0.082 1.00 0.24 H new ATOM 0 HD12 LEU A 111 -1.492 -3.324 0.117 1.00 0.24 H new ATOM 0 HD13 LEU A 111 -0.259 -3.258 1.399 1.00 0.24 H new ATOM 0 HD21 LEU A 111 0.476 -6.305 1.154 1.00 4.34 H new ATOM 0 HD22 LEU A 111 0.223 -5.536 2.739 1.00 4.34 H new ATOM 0 HD23 LEU A 111 -0.735 -6.963 2.279 1.00 4.34 H new ATOM 1846 N TYR A 112 -4.854 -6.364 1.532 1.00 1.23 N ATOM 1847 CA TYR A 112 -5.496 -7.538 0.901 1.00 34.23 C ATOM 1848 C TYR A 112 -6.821 -7.157 0.211 1.00 42.15 C ATOM 1849 O TYR A 112 -7.163 -7.704 -0.836 1.00 23.22 O ATOM 1850 CB TYR A 112 -5.772 -8.625 1.967 1.00 21.34 C ATOM 1851 CG TYR A 112 -4.521 -9.155 2.682 1.00 11.23 C ATOM 1852 CD1 TYR A 112 -3.822 -10.253 2.181 1.00 14.41 C ATOM 1853 CD2 TYR A 112 -4.052 -8.574 3.870 1.00 64.02 C ATOM 1854 CE1 TYR A 112 -2.720 -10.758 2.833 1.00 31.54 C ATOM 1855 CE2 TYR A 112 -2.940 -9.073 4.519 1.00 61.11 C ATOM 1856 CZ TYR A 112 -2.282 -10.169 3.998 1.00 61.44 C ATOM 1857 OH TYR A 112 -1.197 -10.697 4.656 1.00 43.12 O ATOM 0 H TYR A 112 -4.794 -6.434 2.548 1.00 1.23 H new ATOM 0 HA TYR A 112 -4.812 -7.921 0.144 1.00 34.23 H new ATOM 0 HB2 TYR A 112 -6.455 -8.218 2.713 1.00 21.34 H new ATOM 0 HB3 TYR A 112 -6.283 -9.461 1.490 1.00 21.34 H new ATOM 0 HD1 TYR A 112 -4.152 -10.716 1.263 1.00 14.41 H new ATOM 0 HD2 TYR A 112 -4.570 -7.722 4.284 1.00 64.02 H new ATOM 0 HE1 TYR A 112 -2.200 -11.615 2.431 1.00 31.54 H new ATOM 0 HE2 TYR A 112 -2.587 -8.609 5.428 1.00 61.11 H new ATOM 0 HH TYR A 112 -1.345 -10.647 5.623 1.00 43.12 H new ATOM 1867 N ILE A 113 -7.561 -6.229 0.842 1.00 43.21 N ATOM 1868 CA ILE A 113 -8.828 -5.683 0.308 1.00 31.40 C ATOM 1869 C ILE A 113 -8.612 -4.957 -1.053 1.00 42.22 C ATOM 1870 O ILE A 113 -9.392 -5.145 -1.999 1.00 72.24 O ATOM 1871 CB ILE A 113 -9.485 -4.712 1.366 1.00 5.34 C ATOM 1872 CG1 ILE A 113 -9.754 -5.461 2.717 1.00 35.13 C ATOM 1873 CG2 ILE A 113 -10.781 -4.053 0.836 1.00 61.20 C ATOM 1874 CD1 ILE A 113 -10.684 -6.664 2.632 1.00 32.30 C ATOM 0 H ILE A 113 -7.298 -5.832 1.744 1.00 43.21 H new ATOM 0 HA ILE A 113 -9.506 -6.516 0.124 1.00 31.40 H new ATOM 0 HB ILE A 113 -8.771 -3.909 1.548 1.00 5.34 H new ATOM 0 HG12 ILE A 113 -8.799 -5.792 3.124 1.00 35.13 H new ATOM 0 HG13 ILE A 113 -10.174 -4.750 3.428 1.00 35.13 H new ATOM 0 HG21 ILE A 113 -11.194 -3.395 1.601 1.00 61.20 H new ATOM 0 HG22 ILE A 113 -10.555 -3.473 -0.058 1.00 61.20 H new ATOM 0 HG23 ILE A 113 -11.509 -4.827 0.592 1.00 61.20 H new ATOM 0 HD11 ILE A 113 -10.800 -7.105 3.622 1.00 32.30 H new ATOM 0 HD12 ILE A 113 -11.658 -6.345 2.261 1.00 32.30 H new ATOM 0 HD13 ILE A 113 -10.261 -7.404 1.952 1.00 32.30 H new ATOM 1886 N ALA A 114 -7.529 -4.155 -1.141 1.00 41.43 N ATOM 1887 CA ALA A 114 -7.157 -3.432 -2.385 1.00 11.15 C ATOM 1888 C ALA A 114 -6.623 -4.392 -3.472 1.00 34.20 C ATOM 1889 O ALA A 114 -6.933 -4.235 -4.660 1.00 53.02 O ATOM 1890 CB ALA A 114 -6.113 -2.350 -2.080 1.00 54.42 C ATOM 0 H ALA A 114 -6.891 -3.989 -0.363 1.00 41.43 H new ATOM 0 HA ALA A 114 -8.061 -2.963 -2.773 1.00 11.15 H new ATOM 0 HB1 ALA A 114 -5.850 -1.829 -3.000 1.00 54.42 H new ATOM 0 HB2 ALA A 114 -6.525 -1.638 -1.365 1.00 54.42 H new ATOM 0 HB3 ALA A 114 -5.221 -2.813 -1.658 1.00 54.42 H new ATOM 1896 N TRP A 115 -5.814 -5.374 -3.039 1.00 61.04 N ATOM 1897 CA TRP A 115 -5.217 -6.398 -3.919 1.00 62.23 C ATOM 1898 C TRP A 115 -6.330 -7.241 -4.595 1.00 60.03 C ATOM 1899 O TRP A 115 -6.463 -7.229 -5.818 1.00 32.44 O ATOM 1900 CB TRP A 115 -4.255 -7.290 -3.078 1.00 51.21 C ATOM 1901 CG TRP A 115 -3.345 -8.232 -3.856 1.00 10.01 C ATOM 1902 CD1 TRP A 115 -3.218 -8.372 -5.218 1.00 41.42 C ATOM 1903 CD2 TRP A 115 -2.388 -9.141 -3.281 1.00 71.11 C ATOM 1904 NE1 TRP A 115 -2.280 -9.328 -5.511 1.00 61.11 N ATOM 1905 CE2 TRP A 115 -1.756 -9.810 -4.343 1.00 62.25 C ATOM 1906 CE3 TRP A 115 -2.017 -9.458 -1.967 1.00 61.45 C ATOM 1907 CZ2 TRP A 115 -0.778 -10.772 -4.135 1.00 33.43 C ATOM 1908 CZ3 TRP A 115 -1.044 -10.416 -1.762 1.00 74.12 C ATOM 1909 CH2 TRP A 115 -0.434 -11.066 -2.842 1.00 21.35 C ATOM 0 H TRP A 115 -5.552 -5.482 -2.059 1.00 61.04 H new ATOM 0 HA TRP A 115 -4.645 -5.919 -4.713 1.00 62.23 H new ATOM 0 HB2 TRP A 115 -3.629 -6.637 -2.469 1.00 51.21 H new ATOM 0 HB3 TRP A 115 -4.856 -7.886 -2.391 1.00 51.21 H new ATOM 0 HD1 TRP A 115 -3.777 -7.810 -5.951 1.00 41.42 H new ATOM 0 HE1 TRP A 115 -2.016 -9.631 -6.448 1.00 61.11 H new ATOM 0 HE3 TRP A 115 -2.484 -8.961 -1.129 1.00 61.45 H new ATOM 0 HZ2 TRP A 115 -0.303 -11.273 -4.966 1.00 33.43 H new ATOM 0 HZ3 TRP A 115 -0.749 -10.668 -0.754 1.00 74.12 H new ATOM 0 HH2 TRP A 115 0.322 -11.813 -2.652 1.00 21.35 H new ATOM 1920 N ALA A 116 -7.143 -7.917 -3.766 1.00 34.33 N ATOM 1921 CA ALA A 116 -8.286 -8.746 -4.212 1.00 2.42 C ATOM 1922 C ALA A 116 -9.355 -7.932 -4.977 1.00 51.02 C ATOM 1923 O ALA A 116 -9.971 -8.446 -5.928 1.00 14.23 O ATOM 1924 CB ALA A 116 -8.918 -9.435 -3.003 1.00 0.03 C ATOM 0 H ALA A 116 -7.027 -7.906 -2.753 1.00 34.33 H new ATOM 0 HA ALA A 116 -7.897 -9.488 -4.910 1.00 2.42 H new ATOM 0 HB1 ALA A 116 -9.759 -10.045 -3.331 1.00 0.03 H new ATOM 0 HB2 ALA A 116 -8.177 -10.070 -2.517 1.00 0.03 H new ATOM 0 HB3 ALA A 116 -9.269 -8.682 -2.297 1.00 0.03 H new ATOM 1930 N GLY A 117 -9.564 -6.666 -4.539 1.00 3.50 N ATOM 1931 CA GLY A 117 -10.458 -5.721 -5.228 1.00 14.42 C ATOM 1932 C GLY A 117 -10.059 -5.475 -6.686 1.00 13.13 C ATOM 1933 O GLY A 117 -10.915 -5.443 -7.580 1.00 5.02 O ATOM 0 H GLY A 117 -9.119 -6.280 -3.706 1.00 3.50 H new ATOM 0 HA2 GLY A 117 -11.478 -6.105 -5.196 1.00 14.42 H new ATOM 0 HA3 GLY A 117 -10.457 -4.772 -4.692 1.00 14.42 H new ATOM 1937 N HIS A 118 -8.740 -5.331 -6.917 1.00 31.10 N ATOM 1938 CA HIS A 118 -8.166 -5.200 -8.268 1.00 5.43 C ATOM 1939 C HIS A 118 -8.297 -6.517 -9.069 1.00 13.24 C ATOM 1940 O HIS A 118 -8.765 -6.509 -10.211 1.00 31.43 O ATOM 1941 CB HIS A 118 -6.675 -4.777 -8.176 1.00 31.21 C ATOM 1942 CG HIS A 118 -5.957 -4.725 -9.506 1.00 74.21 C ATOM 1943 ND1 HIS A 118 -6.133 -3.711 -10.420 1.00 31.21 N ATOM 1944 CD2 HIS A 118 -5.080 -5.586 -10.084 1.00 62.41 C ATOM 1945 CE1 HIS A 118 -5.408 -3.945 -11.489 1.00 35.25 C ATOM 1946 NE2 HIS A 118 -4.759 -5.074 -11.314 1.00 24.30 N ATOM 0 H HIS A 118 -8.044 -5.302 -6.172 1.00 31.10 H new ATOM 0 HA HIS A 118 -8.727 -4.429 -8.797 1.00 5.43 H new ATOM 0 HB2 HIS A 118 -6.617 -3.795 -7.707 1.00 31.21 H new ATOM 0 HB3 HIS A 118 -6.152 -5.474 -7.522 1.00 31.21 H new ATOM 0 HD2 HIS A 118 -4.705 -6.503 -9.654 1.00 62.41 H new ATOM 0 HE1 HIS A 118 -5.354 -3.316 -12.365 1.00 35.25 H new ATOM 0 HE2 HIS A 118 -4.120 -5.500 -11.985 1.00 24.30 H new ATOM 1955 N LEU A 119 -7.884 -7.638 -8.437 1.00 61.13 N ATOM 1956 CA LEU A 119 -7.775 -8.960 -9.091 1.00 15.33 C ATOM 1957 C LEU A 119 -9.126 -9.431 -9.695 1.00 75.54 C ATOM 1958 O LEU A 119 -9.172 -9.844 -10.854 1.00 13.12 O ATOM 1959 CB LEU A 119 -7.241 -10.004 -8.076 1.00 62.15 C ATOM 1960 CG LEU A 119 -5.782 -9.817 -7.545 1.00 13.24 C ATOM 1961 CD1 LEU A 119 -5.413 -10.912 -6.519 1.00 53.10 C ATOM 1962 CD2 LEU A 119 -4.759 -9.768 -8.694 1.00 54.42 C ATOM 0 H LEU A 119 -7.615 -7.650 -7.453 1.00 61.13 H new ATOM 0 HA LEU A 119 -7.073 -8.863 -9.920 1.00 15.33 H new ATOM 0 HB2 LEU A 119 -7.913 -10.012 -7.217 1.00 62.15 H new ATOM 0 HB3 LEU A 119 -7.306 -10.988 -8.541 1.00 62.15 H new ATOM 0 HG LEU A 119 -5.746 -8.854 -7.035 1.00 13.24 H new ATOM 0 HD11 LEU A 119 -4.393 -10.754 -6.169 1.00 53.10 H new ATOM 0 HD12 LEU A 119 -6.098 -10.864 -5.673 1.00 53.10 H new ATOM 0 HD13 LEU A 119 -5.487 -11.892 -6.990 1.00 53.10 H new ATOM 0 HD21 LEU A 119 -3.757 -9.637 -8.284 1.00 54.42 H new ATOM 0 HD22 LEU A 119 -4.801 -10.699 -9.259 1.00 54.42 H new ATOM 0 HD23 LEU A 119 -4.993 -8.933 -9.354 1.00 54.42 H new ATOM 1974 N GLU A 120 -10.218 -9.325 -8.903 1.00 3.51 N ATOM 1975 CA GLU A 120 -11.601 -9.649 -9.355 1.00 41.31 C ATOM 1976 C GLU A 120 -11.972 -8.933 -10.678 1.00 3.14 C ATOM 1977 O GLU A 120 -12.451 -9.566 -11.623 1.00 24.21 O ATOM 1978 CB GLU A 120 -12.613 -9.236 -8.263 1.00 54.33 C ATOM 1979 CG GLU A 120 -14.094 -9.442 -8.649 1.00 71.13 C ATOM 1980 CD GLU A 120 -15.069 -8.922 -7.588 1.00 20.43 C ATOM 1981 OE1 GLU A 120 -15.077 -9.466 -6.474 1.00 13.24 O ATOM 1982 OE2 GLU A 120 -15.819 -7.960 -7.856 1.00 74.34 O ATOM 0 H GLU A 120 -10.171 -9.013 -7.933 1.00 3.51 H new ATOM 0 HA GLU A 120 -11.639 -10.724 -9.532 1.00 41.31 H new ATOM 0 HB2 GLU A 120 -12.404 -9.806 -7.358 1.00 54.33 H new ATOM 0 HB3 GLU A 120 -12.457 -8.185 -8.020 1.00 54.33 H new ATOM 0 HG2 GLU A 120 -14.291 -8.936 -9.594 1.00 71.13 H new ATOM 0 HG3 GLU A 120 -14.276 -10.504 -8.812 1.00 71.13 H new ATOM 1989 N ALA A 121 -11.712 -7.612 -10.727 1.00 51.14 N ATOM 1990 CA ALA A 121 -12.015 -6.762 -11.902 1.00 5.11 C ATOM 1991 C ALA A 121 -11.226 -7.199 -13.161 1.00 14.51 C ATOM 1992 O ALA A 121 -11.657 -6.954 -14.295 1.00 33.43 O ATOM 1993 CB ALA A 121 -11.730 -5.293 -11.554 1.00 70.21 C ATOM 0 H ALA A 121 -11.286 -7.101 -9.954 1.00 51.14 H new ATOM 0 HA ALA A 121 -13.071 -6.880 -12.145 1.00 5.11 H new ATOM 0 HB1 ALA A 121 -11.952 -4.665 -12.417 1.00 70.21 H new ATOM 0 HB2 ALA A 121 -12.355 -4.990 -10.714 1.00 70.21 H new ATOM 0 HB3 ALA A 121 -10.680 -5.180 -11.284 1.00 70.21 H new ATOM 1999 N GLN A 122 -10.061 -7.841 -12.939 1.00 33.33 N ATOM 2000 CA GLN A 122 -9.225 -8.404 -14.023 1.00 24.21 C ATOM 2001 C GLN A 122 -9.638 -9.867 -14.362 1.00 31.32 C ATOM 2002 O GLN A 122 -9.331 -10.363 -15.448 1.00 54.15 O ATOM 2003 CB GLN A 122 -7.726 -8.349 -13.620 1.00 53.04 C ATOM 2004 CG GLN A 122 -7.245 -6.993 -13.050 1.00 65.40 C ATOM 2005 CD GLN A 122 -7.561 -5.779 -13.932 1.00 53.11 C ATOM 2006 OE1 GLN A 122 -6.807 -5.433 -14.830 1.00 75.24 O ATOM 2007 NE2 GLN A 122 -8.644 -5.088 -13.637 1.00 62.54 N ATOM 0 H GLN A 122 -9.673 -7.984 -12.007 1.00 33.33 H new ATOM 0 HA GLN A 122 -9.381 -7.800 -14.917 1.00 24.21 H new ATOM 0 HB2 GLN A 122 -7.538 -9.124 -12.877 1.00 53.04 H new ATOM 0 HB3 GLN A 122 -7.122 -8.592 -14.494 1.00 53.04 H new ATOM 0 HG2 GLN A 122 -7.702 -6.843 -12.072 1.00 65.40 H new ATOM 0 HG3 GLN A 122 -6.167 -7.041 -12.895 1.00 65.40 H new ATOM 0 HE21 GLN A 122 -9.257 -5.398 -12.883 1.00 62.54 H new ATOM 0 HE22 GLN A 122 -8.869 -4.243 -14.163 1.00 62.54 H new ATOM 2016 N GLY A 123 -10.319 -10.551 -13.415 1.00 33.10 N ATOM 2017 CA GLY A 123 -10.793 -11.937 -13.617 1.00 70.11 C ATOM 2018 C GLY A 123 -9.960 -12.979 -12.869 1.00 23.14 C ATOM 2019 O GLY A 123 -10.036 -14.172 -13.158 1.00 63.31 O ATOM 0 H GLY A 123 -10.553 -10.163 -12.501 1.00 33.10 H new ATOM 0 HA2 GLY A 123 -11.830 -12.010 -13.290 1.00 70.11 H new ATOM 0 HA3 GLY A 123 -10.777 -12.167 -14.682 1.00 70.11 H new ATOM 2023 N GLU A 124 -9.157 -12.511 -11.906 1.00 43.42 N ATOM 2024 CA GLU A 124 -8.319 -13.356 -11.029 1.00 2.11 C ATOM 2025 C GLU A 124 -9.075 -13.700 -9.713 1.00 61.31 C ATOM 2026 O GLU A 124 -8.495 -13.659 -8.628 1.00 52.31 O ATOM 2027 CB GLU A 124 -7.001 -12.596 -10.716 1.00 21.33 C ATOM 2028 CG GLU A 124 -6.242 -12.067 -11.946 1.00 33.11 C ATOM 2029 CD GLU A 124 -5.639 -13.177 -12.816 1.00 1.40 C ATOM 2030 OE1 GLU A 124 -4.622 -13.773 -12.400 1.00 20.53 O ATOM 2031 OE2 GLU A 124 -6.177 -13.464 -13.907 1.00 11.14 O ATOM 0 H GLU A 124 -9.066 -11.515 -11.706 1.00 43.42 H new ATOM 0 HA GLU A 124 -8.091 -14.294 -11.536 1.00 2.11 H new ATOM 0 HB2 GLU A 124 -7.232 -11.755 -10.062 1.00 21.33 H new ATOM 0 HB3 GLU A 124 -6.340 -13.261 -10.159 1.00 21.33 H new ATOM 0 HG2 GLU A 124 -6.922 -11.469 -12.553 1.00 33.11 H new ATOM 0 HG3 GLU A 124 -5.444 -11.403 -11.613 1.00 33.11 H new ATOM 2038 N LEU A 125 -10.359 -14.088 -9.856 1.00 73.14 N ATOM 2039 CA LEU A 125 -11.289 -14.386 -8.733 1.00 2.30 C ATOM 2040 C LEU A 125 -10.734 -15.413 -7.716 1.00 3.12 C ATOM 2041 O LEU A 125 -10.696 -15.141 -6.516 1.00 70.31 O ATOM 2042 CB LEU A 125 -12.642 -14.890 -9.319 1.00 34.35 C ATOM 2043 CG LEU A 125 -13.618 -13.784 -9.836 1.00 4.34 C ATOM 2044 CD1 LEU A 125 -14.610 -14.344 -10.870 1.00 1.22 C ATOM 2045 CD2 LEU A 125 -14.369 -13.122 -8.656 1.00 53.03 C ATOM 0 H LEU A 125 -10.793 -14.207 -10.771 1.00 73.14 H new ATOM 0 HA LEU A 125 -11.425 -13.460 -8.175 1.00 2.30 H new ATOM 0 HB2 LEU A 125 -12.427 -15.571 -10.142 1.00 34.35 H new ATOM 0 HB3 LEU A 125 -13.155 -15.469 -8.551 1.00 34.35 H new ATOM 0 HG LEU A 125 -13.019 -13.022 -10.335 1.00 4.34 H new ATOM 0 HD11 LEU A 125 -15.273 -13.547 -11.207 1.00 1.22 H new ATOM 0 HD12 LEU A 125 -14.060 -14.744 -11.722 1.00 1.22 H new ATOM 0 HD13 LEU A 125 -15.201 -15.139 -10.414 1.00 1.22 H new ATOM 0 HD21 LEU A 125 -15.043 -12.355 -9.038 1.00 53.03 H new ATOM 0 HD22 LEU A 125 -14.945 -13.878 -8.121 1.00 53.03 H new ATOM 0 HD23 LEU A 125 -13.649 -12.666 -7.976 1.00 53.03 H new ATOM 2057 N GLN A 126 -10.297 -16.579 -8.210 1.00 72.41 N ATOM 2058 CA GLN A 126 -9.855 -17.696 -7.344 1.00 45.21 C ATOM 2059 C GLN A 126 -8.536 -17.370 -6.595 1.00 23.35 C ATOM 2060 O GLN A 126 -8.300 -17.891 -5.504 1.00 35.40 O ATOM 2061 CB GLN A 126 -9.723 -19.001 -8.171 1.00 43.21 C ATOM 2062 CG GLN A 126 -11.015 -19.442 -8.907 1.00 64.24 C ATOM 2063 CD GLN A 126 -12.238 -19.617 -7.991 1.00 23.25 C ATOM 2064 OE1 GLN A 126 -12.471 -20.684 -7.439 1.00 71.40 O ATOM 2065 NE2 GLN A 126 -13.043 -18.579 -7.843 1.00 64.20 N ATOM 0 H GLN A 126 -10.238 -16.780 -9.208 1.00 72.41 H new ATOM 0 HA GLN A 126 -10.620 -17.843 -6.581 1.00 45.21 H new ATOM 0 HB2 GLN A 126 -8.930 -18.869 -8.907 1.00 43.21 H new ATOM 0 HB3 GLN A 126 -9.409 -19.805 -7.506 1.00 43.21 H new ATOM 0 HG2 GLN A 126 -11.252 -18.704 -9.673 1.00 64.24 H new ATOM 0 HG3 GLN A 126 -10.823 -20.384 -9.421 1.00 64.24 H new ATOM 0 HE21 GLN A 126 -12.831 -17.698 -8.312 1.00 64.20 H new ATOM 0 HE22 GLN A 126 -13.876 -18.659 -7.260 1.00 64.20 H new ATOM 2074 N HIS A 127 -7.687 -16.500 -7.181 1.00 22.22 N ATOM 2075 CA HIS A 127 -6.462 -16.015 -6.511 1.00 45.45 C ATOM 2076 C HIS A 127 -6.774 -14.878 -5.506 1.00 51.51 C ATOM 2077 O HIS A 127 -6.137 -14.777 -4.467 1.00 53.50 O ATOM 2078 CB HIS A 127 -5.406 -15.539 -7.537 1.00 55.15 C ATOM 2079 CG HIS A 127 -4.122 -15.100 -6.885 1.00 63.32 C ATOM 2080 ND1 HIS A 127 -3.628 -13.822 -6.958 1.00 65.15 N ATOM 2081 CD2 HIS A 127 -3.265 -15.779 -6.085 1.00 30.14 C ATOM 2082 CE1 HIS A 127 -2.537 -13.735 -6.236 1.00 53.25 C ATOM 2083 NE2 HIS A 127 -2.288 -14.906 -5.696 1.00 44.32 N ATOM 0 H HIS A 127 -7.827 -16.119 -8.117 1.00 22.22 H new ATOM 0 HA HIS A 127 -6.051 -16.859 -5.958 1.00 45.45 H new ATOM 0 HB2 HIS A 127 -5.196 -16.347 -8.238 1.00 55.15 H new ATOM 0 HB3 HIS A 127 -5.816 -14.712 -8.117 1.00 55.15 H new ATOM 0 HD2 HIS A 127 -3.340 -16.820 -5.806 1.00 30.14 H new ATOM 0 HE1 HIS A 127 -1.940 -12.845 -6.106 1.00 53.25 H new ATOM 0 HE2 HIS A 127 -1.499 -15.127 -5.089 1.00 44.32 H new ATOM 2092 N ALA A 128 -7.726 -14.012 -5.853 1.00 52.13 N ATOM 2093 CA ALA A 128 -8.150 -12.872 -5.014 1.00 62.34 C ATOM 2094 C ALA A 128 -8.829 -13.315 -3.699 1.00 23.33 C ATOM 2095 O ALA A 128 -8.611 -12.719 -2.645 1.00 14.14 O ATOM 2096 CB ALA A 128 -9.075 -11.991 -5.833 1.00 20.43 C ATOM 0 H ALA A 128 -8.236 -14.076 -6.734 1.00 52.13 H new ATOM 0 HA ALA A 128 -7.262 -12.315 -4.715 1.00 62.34 H new ATOM 0 HB1 ALA A 128 -9.399 -11.143 -5.229 1.00 20.43 H new ATOM 0 HB2 ALA A 128 -8.546 -11.628 -6.714 1.00 20.43 H new ATOM 0 HB3 ALA A 128 -9.946 -12.568 -6.144 1.00 20.43 H new ATOM 2102 N SER A 129 -9.668 -14.349 -3.792 1.00 63.51 N ATOM 2103 CA SER A 129 -10.214 -15.049 -2.613 1.00 32.14 C ATOM 2104 C SER A 129 -9.076 -15.740 -1.823 1.00 74.23 C ATOM 2105 O SER A 129 -9.039 -15.685 -0.587 1.00 71.10 O ATOM 2106 CB SER A 129 -11.263 -16.076 -3.063 1.00 62.42 C ATOM 2107 OG SER A 129 -10.714 -16.998 -3.989 1.00 22.44 O ATOM 0 H SER A 129 -9.991 -14.729 -4.682 1.00 63.51 H new ATOM 0 HA SER A 129 -10.692 -14.323 -1.955 1.00 32.14 H new ATOM 0 HB2 SER A 129 -11.646 -16.613 -2.195 1.00 62.42 H new ATOM 0 HB3 SER A 129 -12.109 -15.560 -3.517 1.00 62.42 H new ATOM 0 HG SER A 129 -10.635 -16.571 -4.868 1.00 22.44 H new ATOM 2113 N ALA A 130 -8.117 -16.340 -2.570 1.00 71.31 N ATOM 2114 CA ALA A 130 -6.888 -16.926 -1.993 1.00 3.12 C ATOM 2115 C ALA A 130 -5.983 -15.849 -1.335 1.00 4.31 C ATOM 2116 O ALA A 130 -5.116 -16.191 -0.552 1.00 30.13 O ATOM 2117 CB ALA A 130 -6.107 -17.722 -3.052 1.00 21.44 C ATOM 0 H ALA A 130 -8.176 -16.430 -3.584 1.00 71.31 H new ATOM 0 HA ALA A 130 -7.200 -17.613 -1.206 1.00 3.12 H new ATOM 0 HB1 ALA A 130 -5.208 -18.142 -2.601 1.00 21.44 H new ATOM 0 HB2 ALA A 130 -6.732 -18.529 -3.435 1.00 21.44 H new ATOM 0 HB3 ALA A 130 -5.827 -17.060 -3.871 1.00 21.44 H new ATOM 2123 N VAL A 131 -6.194 -14.561 -1.686 1.00 71.35 N ATOM 2124 CA VAL A 131 -5.526 -13.400 -1.045 1.00 4.34 C ATOM 2125 C VAL A 131 -6.254 -12.975 0.262 1.00 43.24 C ATOM 2126 O VAL A 131 -5.604 -12.734 1.285 1.00 22.31 O ATOM 2127 CB VAL A 131 -5.423 -12.183 -2.058 1.00 51.32 C ATOM 2128 CG1 VAL A 131 -5.152 -10.829 -1.354 1.00 25.40 C ATOM 2129 CG2 VAL A 131 -4.345 -12.461 -3.142 1.00 12.34 C ATOM 0 H VAL A 131 -6.839 -14.293 -2.429 1.00 71.35 H new ATOM 0 HA VAL A 131 -4.516 -13.706 -0.773 1.00 4.34 H new ATOM 0 HB VAL A 131 -6.398 -12.095 -2.537 1.00 51.32 H new ATOM 0 HG11 VAL A 131 -5.092 -10.037 -2.100 1.00 25.40 H new ATOM 0 HG12 VAL A 131 -5.963 -10.612 -0.658 1.00 25.40 H new ATOM 0 HG13 VAL A 131 -4.210 -10.885 -0.808 1.00 25.40 H new ATOM 0 HG21 VAL A 131 -4.290 -11.614 -3.826 1.00 12.34 H new ATOM 0 HG22 VAL A 131 -3.376 -12.604 -2.663 1.00 12.34 H new ATOM 0 HG23 VAL A 131 -4.611 -13.360 -3.698 1.00 12.34 H new ATOM 2139 N LEU A 132 -7.595 -12.881 0.220 1.00 22.12 N ATOM 2140 CA LEU A 132 -8.415 -12.489 1.399 1.00 10.10 C ATOM 2141 C LEU A 132 -8.268 -13.493 2.570 1.00 64.20 C ATOM 2142 O LEU A 132 -8.210 -13.090 3.741 1.00 62.35 O ATOM 2143 CB LEU A 132 -9.903 -12.333 0.991 1.00 40.44 C ATOM 2144 CG LEU A 132 -10.205 -11.199 -0.037 1.00 65.31 C ATOM 2145 CD1 LEU A 132 -11.664 -11.253 -0.530 1.00 2.20 C ATOM 2146 CD2 LEU A 132 -9.862 -9.806 0.544 1.00 51.23 C ATOM 0 H LEU A 132 -8.144 -13.071 -0.619 1.00 22.12 H new ATOM 0 HA LEU A 132 -8.043 -11.528 1.754 1.00 10.10 H new ATOM 0 HB2 LEU A 132 -10.248 -13.279 0.573 1.00 40.44 H new ATOM 0 HB3 LEU A 132 -10.490 -12.149 1.891 1.00 40.44 H new ATOM 0 HG LEU A 132 -9.562 -11.366 -0.901 1.00 65.31 H new ATOM 0 HD11 LEU A 132 -11.837 -10.448 -1.244 1.00 2.20 H new ATOM 0 HD12 LEU A 132 -11.850 -12.213 -1.013 1.00 2.20 H new ATOM 0 HD13 LEU A 132 -12.339 -11.137 0.318 1.00 2.20 H new ATOM 0 HD21 LEU A 132 -10.084 -9.038 -0.197 1.00 51.23 H new ATOM 0 HD22 LEU A 132 -10.457 -9.629 1.440 1.00 51.23 H new ATOM 0 HD23 LEU A 132 -8.803 -9.769 0.799 1.00 51.23 H new ATOM 2158 N GLN A 133 -8.172 -14.799 2.234 1.00 33.11 N ATOM 2159 CA GLN A 133 -7.927 -15.858 3.245 1.00 41.21 C ATOM 2160 C GLN A 133 -6.505 -15.760 3.849 1.00 63.33 C ATOM 2161 O GLN A 133 -6.299 -16.187 4.988 1.00 14.20 O ATOM 2162 CB GLN A 133 -8.151 -17.275 2.669 1.00 54.14 C ATOM 2163 CG GLN A 133 -7.209 -17.652 1.522 1.00 1.42 C ATOM 2164 CD GLN A 133 -7.312 -19.115 1.103 1.00 74.11 C ATOM 2165 OE1 GLN A 133 -8.119 -19.480 0.258 1.00 4.01 O ATOM 2166 NE2 GLN A 133 -6.478 -19.957 1.674 1.00 35.43 N ATOM 0 H GLN A 133 -8.259 -15.146 1.279 1.00 33.11 H new ATOM 0 HA GLN A 133 -8.655 -15.691 4.039 1.00 41.21 H new ATOM 0 HB2 GLN A 133 -8.034 -18.002 3.472 1.00 54.14 H new ATOM 0 HB3 GLN A 133 -9.180 -17.352 2.317 1.00 54.14 H new ATOM 0 HG2 GLN A 133 -7.427 -17.020 0.661 1.00 1.42 H new ATOM 0 HG3 GLN A 133 -6.183 -17.440 1.821 1.00 1.42 H new ATOM 0 HE21 GLN A 133 -5.817 -19.623 2.375 1.00 35.43 H new ATOM 0 HE22 GLN A 133 -6.493 -20.944 1.416 1.00 35.43 H new ATOM 2175 N ARG A 134 -5.525 -15.208 3.076 1.00 22.11 N ATOM 2176 CA ARG A 134 -4.162 -14.943 3.597 1.00 20.13 C ATOM 2177 C ARG A 134 -4.230 -13.952 4.762 1.00 43.51 C ATOM 2178 O ARG A 134 -3.658 -14.204 5.804 1.00 54.33 O ATOM 2179 CB ARG A 134 -3.208 -14.374 2.524 1.00 10.54 C ATOM 2180 CG ARG A 134 -2.925 -15.302 1.337 1.00 74.13 C ATOM 2181 CD ARG A 134 -2.052 -14.621 0.257 1.00 12.12 C ATOM 2182 NE ARG A 134 -1.785 -15.497 -0.895 1.00 0.12 N ATOM 2183 CZ ARG A 134 -0.844 -15.300 -1.803 1.00 41.14 C ATOM 2184 NH1 ARG A 134 -0.055 -14.262 -1.759 1.00 2.13 N ATOM 2185 NH2 ARG A 134 -0.700 -16.154 -2.757 1.00 63.12 N ATOM 0 H ARG A 134 -5.657 -14.942 2.100 1.00 22.11 H new ATOM 0 HA ARG A 134 -3.765 -15.904 3.924 1.00 20.13 H new ATOM 0 HB2 ARG A 134 -3.630 -13.444 2.144 1.00 10.54 H new ATOM 0 HB3 ARG A 134 -2.261 -14.123 3.001 1.00 10.54 H new ATOM 0 HG2 ARG A 134 -2.423 -16.202 1.693 1.00 74.13 H new ATOM 0 HG3 ARG A 134 -3.869 -15.618 0.892 1.00 74.13 H new ATOM 0 HD2 ARG A 134 -2.550 -13.715 -0.089 1.00 12.12 H new ATOM 0 HD3 ARG A 134 -1.105 -14.314 0.702 1.00 12.12 H new ATOM 0 HE ARG A 134 -2.374 -16.323 -1.002 1.00 0.12 H new ATOM 0 HH11 ARG A 134 -0.155 -13.577 -1.010 1.00 2.13 H new ATOM 0 HH12 ARG A 134 0.662 -14.136 -2.473 1.00 2.13 H new ATOM 0 HH21 ARG A 134 -1.308 -16.971 -2.806 1.00 63.12 H new ATOM 0 HH22 ARG A 134 0.022 -16.013 -3.463 1.00 63.12 H new ATOM 2199 N GLY A 135 -4.947 -12.831 4.562 1.00 31.31 N ATOM 2200 CA GLY A 135 -5.140 -11.832 5.618 1.00 74.50 C ATOM 2201 C GLY A 135 -5.737 -12.406 6.907 1.00 21.13 C ATOM 2202 O GLY A 135 -5.260 -12.120 8.006 1.00 22.10 O ATOM 0 H GLY A 135 -5.400 -12.598 3.678 1.00 31.31 H new ATOM 0 HA2 GLY A 135 -4.180 -11.369 5.847 1.00 74.50 H new ATOM 0 HA3 GLY A 135 -5.794 -11.044 5.245 1.00 74.50 H new ATOM 2206 N ILE A 136 -6.779 -13.228 6.751 1.00 43.05 N ATOM 2207 CA ILE A 136 -7.424 -13.949 7.864 1.00 2.01 C ATOM 2208 C ILE A 136 -6.400 -14.808 8.668 1.00 72.04 C ATOM 2209 O ILE A 136 -6.202 -14.586 9.865 1.00 44.43 O ATOM 2210 CB ILE A 136 -8.589 -14.854 7.309 1.00 54.32 C ATOM 2211 CG1 ILE A 136 -9.690 -13.970 6.627 1.00 3.02 C ATOM 2212 CG2 ILE A 136 -9.192 -15.748 8.421 1.00 60.20 C ATOM 2213 CD1 ILE A 136 -10.679 -14.729 5.761 1.00 35.21 C ATOM 0 H ILE A 136 -7.205 -13.416 5.844 1.00 43.05 H new ATOM 0 HA ILE A 136 -7.836 -13.210 8.551 1.00 2.01 H new ATOM 0 HB ILE A 136 -8.170 -15.520 6.555 1.00 54.32 H new ATOM 0 HG12 ILE A 136 -10.242 -13.441 7.404 1.00 3.02 H new ATOM 0 HG13 ILE A 136 -9.199 -13.214 6.014 1.00 3.02 H new ATOM 0 HG21 ILE A 136 -9.992 -16.359 8.003 1.00 60.20 H new ATOM 0 HG22 ILE A 136 -8.416 -16.396 8.828 1.00 60.20 H new ATOM 0 HG23 ILE A 136 -9.593 -15.119 9.216 1.00 60.20 H new ATOM 0 HD11 ILE A 136 -11.399 -14.031 5.334 1.00 35.21 H new ATOM 0 HD12 ILE A 136 -10.145 -15.236 4.957 1.00 35.21 H new ATOM 0 HD13 ILE A 136 -11.204 -15.466 6.369 1.00 35.21 H new ATOM 2225 N GLN A 137 -5.711 -15.735 7.977 1.00 51.12 N ATOM 2226 CA GLN A 137 -4.774 -16.697 8.622 1.00 41.01 C ATOM 2227 C GLN A 137 -3.480 -16.008 9.150 1.00 72.44 C ATOM 2228 O GLN A 137 -2.885 -16.474 10.126 1.00 22.30 O ATOM 2229 CB GLN A 137 -4.424 -17.851 7.644 1.00 41.10 C ATOM 2230 CG GLN A 137 -3.657 -17.410 6.383 1.00 35.21 C ATOM 2231 CD GLN A 137 -3.454 -18.525 5.359 1.00 65.33 C ATOM 2232 OE1 GLN A 137 -2.490 -19.277 5.422 1.00 33.23 O ATOM 2233 NE2 GLN A 137 -4.355 -18.637 4.399 1.00 11.14 N ATOM 0 H GLN A 137 -5.781 -15.845 6.965 1.00 51.12 H new ATOM 0 HA GLN A 137 -5.286 -17.111 9.491 1.00 41.01 H new ATOM 0 HB2 GLN A 137 -3.828 -18.592 8.176 1.00 41.10 H new ATOM 0 HB3 GLN A 137 -5.347 -18.344 7.339 1.00 41.10 H new ATOM 0 HG2 GLN A 137 -4.197 -16.590 5.910 1.00 35.21 H new ATOM 0 HG3 GLN A 137 -2.683 -17.021 6.680 1.00 35.21 H new ATOM 0 HE21 GLN A 137 -5.150 -17.998 4.368 1.00 11.14 H new ATOM 0 HE22 GLN A 137 -4.256 -19.362 3.689 1.00 11.14 H new ATOM 2242 N ASN A 138 -3.076 -14.883 8.516 1.00 14.34 N ATOM 2243 CA ASN A 138 -1.906 -14.065 8.939 1.00 2.24 C ATOM 2244 C ASN A 138 -2.265 -13.098 10.093 1.00 4.14 C ATOM 2245 O ASN A 138 -1.402 -12.354 10.553 1.00 24.32 O ATOM 2246 CB ASN A 138 -1.335 -13.258 7.740 1.00 15.13 C ATOM 2247 CG ASN A 138 -0.759 -14.138 6.631 1.00 24.24 C ATOM 2248 OD1 ASN A 138 -0.313 -15.250 6.868 1.00 54.23 O ATOM 2249 ND2 ASN A 138 -0.759 -13.646 5.410 1.00 33.12 N ATOM 0 H ASN A 138 -3.551 -14.512 7.693 1.00 14.34 H new ATOM 0 HA ASN A 138 -1.147 -14.759 9.301 1.00 2.24 H new ATOM 0 HB2 ASN A 138 -2.125 -12.633 7.324 1.00 15.13 H new ATOM 0 HB3 ASN A 138 -0.556 -12.587 8.102 1.00 15.13 H new ATOM 0 HD21 ASN A 138 -0.381 -14.196 4.639 1.00 33.12 H new ATOM 0 HD22 ASN A 138 -1.137 -12.715 5.235 1.00 33.12 H new ATOM 2256 N GLN A 139 -3.558 -13.102 10.508 1.00 22.34 N ATOM 2257 CA GLN A 139 -4.085 -12.331 11.673 1.00 41.15 C ATOM 2258 C GLN A 139 -4.180 -10.813 11.366 1.00 53.44 C ATOM 2259 O GLN A 139 -4.245 -9.988 12.284 1.00 62.11 O ATOM 2260 CB GLN A 139 -3.259 -12.592 12.983 1.00 73.13 C ATOM 2261 CG GLN A 139 -3.010 -14.081 13.325 1.00 2.14 C ATOM 2262 CD GLN A 139 -4.290 -14.912 13.456 1.00 14.30 C ATOM 2263 OE1 GLN A 139 -4.862 -15.025 14.525 1.00 40.52 O ATOM 2264 NE2 GLN A 139 -4.740 -15.505 12.371 1.00 54.52 N ATOM 0 H GLN A 139 -4.279 -13.649 10.037 1.00 22.34 H new ATOM 0 HA GLN A 139 -5.096 -12.697 11.851 1.00 41.15 H new ATOM 0 HB2 GLN A 139 -2.295 -12.092 12.890 1.00 73.13 H new ATOM 0 HB3 GLN A 139 -3.780 -12.127 13.820 1.00 73.13 H new ATOM 0 HG2 GLN A 139 -2.381 -14.521 12.551 1.00 2.14 H new ATOM 0 HG3 GLN A 139 -2.453 -14.140 14.260 1.00 2.14 H new ATOM 0 HE21 GLN A 139 -4.244 -15.395 11.487 1.00 54.52 H new ATOM 0 HE22 GLN A 139 -5.585 -16.074 12.414 1.00 54.52 H new ATOM 2273 N ALA A 140 -4.217 -10.469 10.066 1.00 22.11 N ATOM 2274 CA ALA A 140 -4.352 -9.079 9.588 1.00 44.23 C ATOM 2275 C ALA A 140 -5.695 -8.451 10.014 1.00 25.34 C ATOM 2276 O ALA A 140 -6.767 -8.920 9.618 1.00 12.15 O ATOM 2277 CB ALA A 140 -4.194 -9.019 8.060 1.00 43.52 C ATOM 0 H ALA A 140 -4.154 -11.152 9.311 1.00 22.11 H new ATOM 0 HA ALA A 140 -3.556 -8.496 10.052 1.00 44.23 H new ATOM 0 HB1 ALA A 140 -4.296 -7.987 7.724 1.00 43.52 H new ATOM 0 HB2 ALA A 140 -3.210 -9.396 7.781 1.00 43.52 H new ATOM 0 HB3 ALA A 140 -4.964 -9.632 7.590 1.00 43.52 H new ATOM 2283 N GLU A 141 -5.617 -7.400 10.844 1.00 64.35 N ATOM 2284 CA GLU A 141 -6.802 -6.674 11.339 1.00 24.51 C ATOM 2285 C GLU A 141 -7.060 -5.390 10.497 1.00 1.10 C ATOM 2286 O GLU A 141 -6.100 -4.804 9.978 1.00 24.43 O ATOM 2287 CB GLU A 141 -6.635 -6.334 12.838 1.00 71.23 C ATOM 2288 CG GLU A 141 -6.503 -7.567 13.752 1.00 43.13 C ATOM 2289 CD GLU A 141 -6.401 -7.198 15.239 1.00 31.54 C ATOM 2290 OE1 GLU A 141 -5.285 -6.909 15.715 1.00 50.54 O ATOM 2291 OE2 GLU A 141 -7.437 -7.190 15.934 1.00 52.52 O ATOM 0 H GLU A 141 -4.733 -7.028 11.192 1.00 64.35 H new ATOM 0 HA GLU A 141 -7.673 -7.320 11.230 1.00 24.51 H new ATOM 0 HB2 GLU A 141 -5.751 -5.708 12.961 1.00 71.23 H new ATOM 0 HB3 GLU A 141 -7.492 -5.744 13.163 1.00 71.23 H new ATOM 0 HG2 GLU A 141 -7.364 -8.218 13.602 1.00 43.13 H new ATOM 0 HG3 GLU A 141 -5.619 -8.135 13.462 1.00 43.13 H new ATOM 2298 N PRO A 142 -8.354 -4.921 10.318 1.00 32.15 N ATOM 2299 CA PRO A 142 -9.606 -5.594 10.825 1.00 12.32 C ATOM 2300 C PRO A 142 -9.897 -7.021 10.225 1.00 55.30 C ATOM 2301 O PRO A 142 -10.112 -7.185 9.015 1.00 10.23 O ATOM 2302 CB PRO A 142 -10.721 -4.578 10.446 1.00 4.11 C ATOM 2303 CG PRO A 142 -10.145 -3.776 9.320 1.00 63.33 C ATOM 2304 CD PRO A 142 -8.680 -3.628 9.653 1.00 51.35 C ATOM 0 HA PRO A 142 -9.526 -5.808 11.891 1.00 12.32 H new ATOM 0 HB2 PRO A 142 -11.634 -5.089 10.140 1.00 4.11 H new ATOM 0 HB3 PRO A 142 -10.980 -3.942 11.292 1.00 4.11 H new ATOM 0 HG2 PRO A 142 -10.283 -4.282 8.364 1.00 63.33 H new ATOM 0 HG3 PRO A 142 -10.631 -2.804 9.239 1.00 63.33 H new ATOM 0 HD2 PRO A 142 -8.077 -3.471 8.759 1.00 51.35 H new ATOM 0 HD3 PRO A 142 -8.500 -2.779 10.312 1.00 51.35 H new ATOM 2312 N ARG A 143 -9.892 -8.031 11.130 1.00 32.53 N ATOM 2313 CA ARG A 143 -10.063 -9.472 10.811 1.00 64.42 C ATOM 2314 C ARG A 143 -11.469 -9.796 10.247 1.00 41.44 C ATOM 2315 O ARG A 143 -11.591 -10.342 9.147 1.00 22.41 O ATOM 2316 CB ARG A 143 -9.781 -10.317 12.105 1.00 12.32 C ATOM 2317 CG ARG A 143 -8.330 -10.868 12.247 1.00 24.42 C ATOM 2318 CD ARG A 143 -8.174 -12.286 11.656 1.00 42.45 C ATOM 2319 NE ARG A 143 -9.117 -13.239 12.292 1.00 43.22 N ATOM 2320 CZ ARG A 143 -8.964 -14.548 12.382 1.00 62.42 C ATOM 2321 NH1 ARG A 143 -7.909 -15.141 11.928 1.00 63.44 N ATOM 2322 NH2 ARG A 143 -9.884 -15.255 12.956 1.00 33.23 N ATOM 0 H ARG A 143 -9.766 -7.862 12.128 1.00 32.53 H new ATOM 0 HA ARG A 143 -9.351 -9.731 10.028 1.00 64.42 H new ATOM 0 HB2 ARG A 143 -10.003 -9.700 12.976 1.00 12.32 H new ATOM 0 HB3 ARG A 143 -10.474 -11.158 12.126 1.00 12.32 H new ATOM 0 HG2 ARG A 143 -7.638 -10.191 11.746 1.00 24.42 H new ATOM 0 HG3 ARG A 143 -8.053 -10.885 13.301 1.00 24.42 H new ATOM 0 HD2 ARG A 143 -8.352 -12.257 10.581 1.00 42.45 H new ATOM 0 HD3 ARG A 143 -7.151 -12.632 11.800 1.00 42.45 H new ATOM 0 HE ARG A 143 -9.965 -12.845 12.699 1.00 43.22 H new ATOM 0 HH11 ARG A 143 -7.168 -14.596 11.487 1.00 63.44 H new ATOM 0 HH12 ARG A 143 -7.817 -16.153 12.011 1.00 63.44 H new ATOM 0 HH21 ARG A 143 -10.716 -14.801 13.333 1.00 33.23 H new ATOM 0 HH22 ARG A 143 -9.777 -16.267 13.031 1.00 33.23 H new ATOM 2336 N GLU A 144 -12.520 -9.458 11.025 1.00 24.12 N ATOM 2337 CA GLU A 144 -13.931 -9.734 10.653 1.00 12.21 C ATOM 2338 C GLU A 144 -14.326 -9.000 9.347 1.00 43.03 C ATOM 2339 O GLU A 144 -15.172 -9.481 8.591 1.00 32.13 O ATOM 2340 CB GLU A 144 -14.880 -9.341 11.819 1.00 23.01 C ATOM 2341 CG GLU A 144 -16.349 -9.758 11.619 1.00 75.51 C ATOM 2342 CD GLU A 144 -17.273 -9.302 12.760 1.00 54.25 C ATOM 2343 OE1 GLU A 144 -17.815 -8.175 12.689 1.00 65.44 O ATOM 2344 OE2 GLU A 144 -17.470 -10.073 13.728 1.00 32.33 O ATOM 0 H GLU A 144 -12.419 -8.988 11.925 1.00 24.12 H new ATOM 0 HA GLU A 144 -14.030 -10.804 10.468 1.00 12.21 H new ATOM 0 HB2 GLU A 144 -14.510 -9.793 12.739 1.00 23.01 H new ATOM 0 HB3 GLU A 144 -14.838 -8.260 11.955 1.00 23.01 H new ATOM 0 HG2 GLU A 144 -16.712 -9.343 10.679 1.00 75.51 H new ATOM 0 HG3 GLU A 144 -16.402 -10.843 11.530 1.00 75.51 H new ATOM 2351 N PHE A 145 -13.679 -7.844 9.088 1.00 52.04 N ATOM 2352 CA PHE A 145 -13.820 -7.109 7.820 1.00 23.32 C ATOM 2353 C PHE A 145 -13.268 -7.934 6.627 1.00 65.51 C ATOM 2354 O PHE A 145 -13.893 -7.990 5.574 1.00 30.42 O ATOM 2355 CB PHE A 145 -13.121 -5.733 7.915 1.00 42.13 C ATOM 2356 CG PHE A 145 -13.264 -4.861 6.668 1.00 50.24 C ATOM 2357 CD1 PHE A 145 -14.516 -4.373 6.281 1.00 11.34 C ATOM 2358 CD2 PHE A 145 -12.155 -4.519 5.889 1.00 74.10 C ATOM 2359 CE1 PHE A 145 -14.652 -3.580 5.156 1.00 33.40 C ATOM 2360 CE2 PHE A 145 -12.296 -3.728 4.766 1.00 34.32 C ATOM 2361 CZ PHE A 145 -13.542 -3.256 4.401 1.00 12.02 C ATOM 0 H PHE A 145 -13.047 -7.398 9.752 1.00 52.04 H new ATOM 0 HA PHE A 145 -14.882 -6.943 7.639 1.00 23.32 H new ATOM 0 HB2 PHE A 145 -13.527 -5.192 8.770 1.00 42.13 H new ATOM 0 HB3 PHE A 145 -12.061 -5.891 8.112 1.00 42.13 H new ATOM 0 HD1 PHE A 145 -15.388 -4.619 6.868 1.00 11.34 H new ATOM 0 HD2 PHE A 145 -11.176 -4.878 6.169 1.00 74.10 H new ATOM 0 HE1 PHE A 145 -15.626 -3.214 4.868 1.00 33.40 H new ATOM 0 HE2 PHE A 145 -11.430 -3.478 4.171 1.00 34.32 H new ATOM 0 HZ PHE A 145 -13.648 -2.633 3.525 1.00 12.02 H new ATOM 2371 N LEU A 146 -12.116 -8.601 6.822 1.00 22.42 N ATOM 2372 CA LEU A 146 -11.520 -9.505 5.801 1.00 20.24 C ATOM 2373 C LEU A 146 -12.436 -10.711 5.518 1.00 42.12 C ATOM 2374 O LEU A 146 -12.586 -11.130 4.372 1.00 52.42 O ATOM 2375 CB LEU A 146 -10.109 -9.988 6.265 1.00 72.31 C ATOM 2376 CG LEU A 146 -8.905 -9.208 5.666 1.00 44.41 C ATOM 2377 CD1 LEU A 146 -7.631 -9.432 6.487 1.00 61.34 C ATOM 2378 CD2 LEU A 146 -8.689 -9.584 4.182 1.00 41.14 C ATOM 0 H LEU A 146 -11.570 -8.535 7.681 1.00 22.42 H new ATOM 0 HA LEU A 146 -11.414 -8.943 4.873 1.00 20.24 H new ATOM 0 HB2 LEU A 146 -10.060 -9.919 7.352 1.00 72.31 H new ATOM 0 HB3 LEU A 146 -10.002 -11.042 6.007 1.00 72.31 H new ATOM 0 HG LEU A 146 -9.140 -8.145 5.712 1.00 44.41 H new ATOM 0 HD11 LEU A 146 -6.808 -8.873 6.042 1.00 61.34 H new ATOM 0 HD12 LEU A 146 -7.792 -9.089 7.509 1.00 61.34 H new ATOM 0 HD13 LEU A 146 -7.386 -10.494 6.495 1.00 61.34 H new ATOM 0 HD21 LEU A 146 -7.841 -9.026 3.785 1.00 41.14 H new ATOM 0 HD22 LEU A 146 -8.489 -10.653 4.103 1.00 41.14 H new ATOM 0 HD23 LEU A 146 -9.584 -9.339 3.611 1.00 41.14 H new ATOM 2390 N GLN A 147 -13.039 -11.246 6.590 1.00 11.00 N ATOM 2391 CA GLN A 147 -13.924 -12.430 6.524 1.00 53.43 C ATOM 2392 C GLN A 147 -15.289 -12.107 5.862 1.00 54.32 C ATOM 2393 O GLN A 147 -15.827 -12.930 5.108 1.00 20.34 O ATOM 2394 CB GLN A 147 -14.111 -12.996 7.954 1.00 62.45 C ATOM 2395 CG GLN A 147 -12.776 -13.289 8.675 1.00 3.31 C ATOM 2396 CD GLN A 147 -12.943 -13.889 10.063 1.00 52.14 C ATOM 2397 OE1 GLN A 147 -13.066 -13.174 11.050 1.00 63.22 O ATOM 2398 NE2 GLN A 147 -12.918 -15.201 10.151 1.00 20.22 N ATOM 0 H GLN A 147 -12.929 -10.872 7.533 1.00 11.00 H new ATOM 0 HA GLN A 147 -13.453 -13.182 5.891 1.00 53.43 H new ATOM 0 HB2 GLN A 147 -14.687 -12.285 8.546 1.00 62.45 H new ATOM 0 HB3 GLN A 147 -14.696 -13.914 7.900 1.00 62.45 H new ATOM 0 HG2 GLN A 147 -12.186 -13.972 8.063 1.00 3.31 H new ATOM 0 HG3 GLN A 147 -12.208 -12.363 8.756 1.00 3.31 H new ATOM 0 HE21 GLN A 147 -12.814 -15.767 9.309 1.00 20.22 H new ATOM 0 HE22 GLN A 147 -13.002 -15.653 11.062 1.00 20.22 H new ATOM 2407 N GLN A 148 -15.843 -10.905 6.142 1.00 72.43 N ATOM 2408 CA GLN A 148 -17.103 -10.445 5.516 1.00 11.55 C ATOM 2409 C GLN A 148 -16.879 -10.115 4.020 1.00 4.35 C ATOM 2410 O GLN A 148 -17.722 -10.423 3.187 1.00 3.44 O ATOM 2411 CB GLN A 148 -17.727 -9.236 6.277 1.00 25.24 C ATOM 2412 CG GLN A 148 -17.067 -7.867 6.023 1.00 14.15 C ATOM 2413 CD GLN A 148 -17.631 -6.742 6.886 1.00 2.14 C ATOM 2414 OE1 GLN A 148 -17.121 -6.446 7.957 1.00 13.21 O ATOM 2415 NE2 GLN A 148 -18.719 -6.147 6.457 1.00 53.33 N ATOM 0 H GLN A 148 -15.437 -10.237 6.797 1.00 72.43 H new ATOM 0 HA GLN A 148 -17.821 -11.262 5.583 1.00 11.55 H new ATOM 0 HB2 GLN A 148 -18.780 -9.166 6.006 1.00 25.24 H new ATOM 0 HB3 GLN A 148 -17.686 -9.444 7.346 1.00 25.24 H new ATOM 0 HG2 GLN A 148 -15.996 -7.951 6.206 1.00 14.15 H new ATOM 0 HG3 GLN A 148 -17.191 -7.604 4.973 1.00 14.15 H new ATOM 0 HE21 GLN A 148 -19.125 -6.412 5.560 1.00 53.33 H new ATOM 0 HE22 GLN A 148 -19.159 -5.419 7.021 1.00 53.33 H new ATOM 2424 N GLN A 149 -15.717 -9.513 3.683 1.00 21.34 N ATOM 2425 CA GLN A 149 -15.348 -9.232 2.278 1.00 64.15 C ATOM 2426 C GLN A 149 -14.998 -10.535 1.524 1.00 13.32 C ATOM 2427 O GLN A 149 -15.187 -10.611 0.314 1.00 74.03 O ATOM 2428 CB GLN A 149 -14.171 -8.221 2.191 1.00 34.42 C ATOM 2429 CG GLN A 149 -14.464 -6.820 2.785 1.00 52.41 C ATOM 2430 CD GLN A 149 -15.594 -6.066 2.086 1.00 75.32 C ATOM 2431 OE1 GLN A 149 -15.368 -5.334 1.135 1.00 52.21 O ATOM 2432 NE2 GLN A 149 -16.813 -6.224 2.563 1.00 73.45 N ATOM 0 H GLN A 149 -15.019 -9.213 4.364 1.00 21.34 H new ATOM 0 HA GLN A 149 -16.216 -8.780 1.798 1.00 64.15 H new ATOM 0 HB2 GLN A 149 -13.309 -8.645 2.707 1.00 34.42 H new ATOM 0 HB3 GLN A 149 -13.890 -8.104 1.145 1.00 34.42 H new ATOM 0 HG2 GLN A 149 -14.715 -6.930 3.840 1.00 52.41 H new ATOM 0 HG3 GLN A 149 -13.556 -6.219 2.734 1.00 52.41 H new ATOM 0 HE21 GLN A 149 -16.973 -6.842 3.359 1.00 73.45 H new ATOM 0 HE22 GLN A 149 -17.596 -5.728 2.136 1.00 73.45 H new ATOM 2441 N TYR A 150 -14.486 -11.547 2.261 1.00 10.40 N ATOM 2442 CA TYR A 150 -14.206 -12.892 1.716 1.00 5.10 C ATOM 2443 C TYR A 150 -15.512 -13.596 1.286 1.00 50.23 C ATOM 2444 O TYR A 150 -15.614 -14.040 0.152 1.00 72.10 O ATOM 2445 CB TYR A 150 -13.428 -13.754 2.750 1.00 0.23 C ATOM 2446 CG TYR A 150 -13.035 -15.171 2.265 1.00 43.10 C ATOM 2447 CD1 TYR A 150 -11.842 -15.404 1.570 1.00 23.14 C ATOM 2448 CD2 TYR A 150 -13.859 -16.282 2.501 1.00 23.23 C ATOM 2449 CE1 TYR A 150 -11.494 -16.672 1.138 1.00 34.13 C ATOM 2450 CE2 TYR A 150 -13.509 -17.548 2.068 1.00 63.50 C ATOM 2451 CZ TYR A 150 -12.326 -17.737 1.388 1.00 30.21 C ATOM 2452 OH TYR A 150 -11.979 -18.997 0.947 1.00 50.53 O ATOM 0 H TYR A 150 -14.256 -11.452 3.250 1.00 10.40 H new ATOM 0 HA TYR A 150 -13.580 -12.775 0.831 1.00 5.10 H new ATOM 0 HB2 TYR A 150 -12.521 -13.220 3.035 1.00 0.23 H new ATOM 0 HB3 TYR A 150 -14.036 -13.851 3.649 1.00 0.23 H new ATOM 0 HD1 TYR A 150 -11.179 -14.576 1.367 1.00 23.14 H new ATOM 0 HD2 TYR A 150 -14.789 -16.145 3.033 1.00 23.23 H new ATOM 0 HE1 TYR A 150 -10.568 -16.825 0.604 1.00 34.13 H new ATOM 0 HE2 TYR A 150 -14.162 -18.386 2.263 1.00 63.50 H new ATOM 0 HH TYR A 150 -12.674 -19.637 1.206 1.00 50.53 H new ATOM 2462 N ARG A 151 -16.504 -13.682 2.198 1.00 2.10 N ATOM 2463 CA ARG A 151 -17.795 -14.370 1.916 1.00 42.12 C ATOM 2464 C ARG A 151 -18.640 -13.633 0.840 1.00 4.55 C ATOM 2465 O ARG A 151 -19.301 -14.277 0.007 1.00 34.14 O ATOM 2466 CB ARG A 151 -18.614 -14.573 3.216 1.00 34.13 C ATOM 2467 CG ARG A 151 -19.024 -13.280 3.947 1.00 3.35 C ATOM 2468 CD ARG A 151 -19.849 -13.544 5.217 1.00 71.52 C ATOM 2469 NE ARG A 151 -21.134 -14.205 4.930 1.00 51.41 N ATOM 2470 CZ ARG A 151 -21.974 -14.674 5.838 1.00 10.23 C ATOM 2471 NH1 ARG A 151 -21.688 -14.649 7.110 1.00 73.25 N ATOM 2472 NH2 ARG A 151 -23.103 -15.174 5.457 1.00 43.34 N ATOM 0 H ARG A 151 -16.442 -13.286 3.136 1.00 2.10 H new ATOM 0 HA ARG A 151 -17.545 -15.349 1.508 1.00 42.12 H new ATOM 0 HB2 ARG A 151 -19.516 -15.135 2.973 1.00 34.13 H new ATOM 0 HB3 ARG A 151 -18.030 -15.188 3.901 1.00 34.13 H new ATOM 0 HG2 ARG A 151 -18.128 -12.719 4.213 1.00 3.35 H new ATOM 0 HG3 ARG A 151 -19.602 -12.653 3.268 1.00 3.35 H new ATOM 0 HD2 ARG A 151 -19.269 -14.165 5.900 1.00 71.52 H new ATOM 0 HD3 ARG A 151 -20.036 -12.599 5.727 1.00 71.52 H new ATOM 0 HE ARG A 151 -21.398 -14.310 3.950 1.00 51.41 H new ATOM 0 HH11 ARG A 151 -20.799 -14.261 7.425 1.00 73.25 H new ATOM 0 HH12 ARG A 151 -22.353 -15.017 7.790 1.00 73.25 H new ATOM 0 HH21 ARG A 151 -23.339 -15.204 4.465 1.00 43.34 H new ATOM 0 HH22 ARG A 151 -23.759 -15.539 6.148 1.00 43.34 H new ATOM 2486 N LEU A 152 -18.593 -12.279 0.838 1.00 31.14 N ATOM 2487 CA LEU A 152 -19.259 -11.464 -0.202 1.00 21.31 C ATOM 2488 C LEU A 152 -18.544 -11.637 -1.556 1.00 3.14 C ATOM 2489 O LEU A 152 -19.171 -11.577 -2.606 1.00 42.24 O ATOM 2490 CB LEU A 152 -19.300 -9.967 0.199 1.00 43.23 C ATOM 2491 CG LEU A 152 -20.183 -9.605 1.435 1.00 70.41 C ATOM 2492 CD1 LEU A 152 -20.074 -8.104 1.767 1.00 45.14 C ATOM 2493 CD2 LEU A 152 -21.657 -10.035 1.235 1.00 44.03 C ATOM 0 H LEU A 152 -18.102 -11.731 1.544 1.00 31.14 H new ATOM 0 HA LEU A 152 -20.287 -11.814 -0.298 1.00 21.31 H new ATOM 0 HB2 LEU A 152 -18.280 -9.639 0.399 1.00 43.23 H new ATOM 0 HB3 LEU A 152 -19.657 -9.394 -0.656 1.00 43.23 H new ATOM 0 HG LEU A 152 -19.801 -10.167 2.288 1.00 70.41 H new ATOM 0 HD11 LEU A 152 -20.698 -7.876 2.631 1.00 45.14 H new ATOM 0 HD12 LEU A 152 -19.037 -7.856 1.992 1.00 45.14 H new ATOM 0 HD13 LEU A 152 -20.410 -7.517 0.912 1.00 45.14 H new ATOM 0 HD21 LEU A 152 -22.238 -9.765 2.117 1.00 44.03 H new ATOM 0 HD22 LEU A 152 -22.068 -9.529 0.361 1.00 44.03 H new ATOM 0 HD23 LEU A 152 -21.704 -11.114 1.085 1.00 44.03 H new ATOM 2505 N PHE A 153 -17.217 -11.830 -1.509 1.00 52.22 N ATOM 2506 CA PHE A 153 -16.424 -12.221 -2.688 1.00 61.10 C ATOM 2507 C PHE A 153 -16.843 -13.630 -3.202 1.00 1.42 C ATOM 2508 O PHE A 153 -16.914 -13.860 -4.413 1.00 62.32 O ATOM 2509 CB PHE A 153 -14.914 -12.189 -2.329 1.00 41.15 C ATOM 2510 CG PHE A 153 -13.988 -12.161 -3.527 1.00 13.44 C ATOM 2511 CD1 PHE A 153 -13.722 -13.316 -4.250 1.00 24.52 C ATOM 2512 CD2 PHE A 153 -13.405 -10.970 -3.952 1.00 50.25 C ATOM 2513 CE1 PHE A 153 -12.914 -13.287 -5.349 1.00 5.55 C ATOM 2514 CE2 PHE A 153 -12.594 -10.948 -5.058 1.00 43.32 C ATOM 2515 CZ PHE A 153 -12.354 -12.106 -5.756 1.00 71.53 C ATOM 0 H PHE A 153 -16.665 -11.721 -0.659 1.00 52.22 H new ATOM 0 HA PHE A 153 -16.614 -11.511 -3.493 1.00 61.10 H new ATOM 0 HB2 PHE A 153 -14.718 -11.312 -1.713 1.00 41.15 H new ATOM 0 HB3 PHE A 153 -14.678 -13.064 -1.723 1.00 41.15 H new ATOM 0 HD1 PHE A 153 -14.161 -14.252 -3.938 1.00 24.52 H new ATOM 0 HD2 PHE A 153 -13.593 -10.057 -3.407 1.00 50.25 H new ATOM 0 HE1 PHE A 153 -12.716 -14.196 -5.898 1.00 5.55 H new ATOM 0 HE2 PHE A 153 -12.144 -10.020 -5.380 1.00 43.32 H new ATOM 0 HZ PHE A 153 -11.720 -12.085 -6.630 1.00 71.53 H new ATOM 2525 N GLN A 154 -17.122 -14.559 -2.263 1.00 70.34 N ATOM 2526 CA GLN A 154 -17.528 -15.946 -2.591 1.00 55.10 C ATOM 2527 C GLN A 154 -18.887 -15.987 -3.313 1.00 30.43 C ATOM 2528 O GLN A 154 -19.048 -16.726 -4.299 1.00 41.14 O ATOM 2529 CB GLN A 154 -17.558 -16.837 -1.318 1.00 44.14 C ATOM 2530 CG GLN A 154 -16.181 -17.013 -0.643 1.00 14.15 C ATOM 2531 CD GLN A 154 -15.128 -17.668 -1.541 1.00 12.31 C ATOM 2532 OE1 GLN A 154 -15.423 -18.555 -2.328 1.00 65.34 O ATOM 2533 NE2 GLN A 154 -13.897 -17.209 -1.459 1.00 55.12 N ATOM 0 H GLN A 154 -17.073 -14.372 -1.261 1.00 70.34 H new ATOM 0 HA GLN A 154 -16.778 -16.347 -3.273 1.00 55.10 H new ATOM 0 HB2 GLN A 154 -18.251 -16.401 -0.598 1.00 44.14 H new ATOM 0 HB3 GLN A 154 -17.949 -17.819 -1.583 1.00 44.14 H new ATOM 0 HG2 GLN A 154 -15.816 -16.036 -0.325 1.00 14.15 H new ATOM 0 HG3 GLN A 154 -16.303 -17.616 0.257 1.00 14.15 H new ATOM 0 HE21 GLN A 154 -13.672 -16.468 -0.795 1.00 55.12 H new ATOM 0 HE22 GLN A 154 -13.168 -17.594 -2.059 1.00 55.12 H new ATOM 2542 N THR A 155 -19.841 -15.145 -2.860 1.00 64.02 N ATOM 2543 CA THR A 155 -21.188 -15.082 -3.484 1.00 4.14 C ATOM 2544 C THR A 155 -21.121 -14.469 -4.911 1.00 63.01 C ATOM 2545 O THR A 155 -22.058 -14.619 -5.704 1.00 74.03 O ATOM 2546 CB THR A 155 -22.244 -14.329 -2.596 1.00 10.43 C ATOM 2547 OG1 THR A 155 -23.570 -14.556 -3.112 1.00 22.22 O ATOM 2548 CG2 THR A 155 -22.005 -12.817 -2.509 1.00 63.21 C ATOM 0 H THR A 155 -19.710 -14.506 -2.076 1.00 64.02 H new ATOM 0 HA THR A 155 -21.533 -16.113 -3.567 1.00 4.14 H new ATOM 0 HB THR A 155 -22.136 -14.735 -1.590 1.00 10.43 H new ATOM 0 HG1 THR A 155 -23.535 -14.616 -4.090 1.00 22.22 H new ATOM 0 HG21 THR A 155 -22.771 -12.363 -1.881 1.00 63.21 H new ATOM 0 HG22 THR A 155 -21.022 -12.628 -2.077 1.00 63.21 H new ATOM 0 HG23 THR A 155 -22.051 -12.383 -3.508 1.00 63.21 H new ATOM 2556 N ARG A 156 -19.997 -13.781 -5.231 1.00 51.54 N ATOM 2557 CA ARG A 156 -19.703 -13.296 -6.592 1.00 45.31 C ATOM 2558 C ARG A 156 -19.164 -14.442 -7.478 1.00 64.43 C ATOM 2559 O ARG A 156 -19.793 -14.793 -8.476 1.00 74.22 O ATOM 2560 CB ARG A 156 -18.679 -12.125 -6.531 1.00 5.21 C ATOM 2561 CG ARG A 156 -19.142 -10.930 -5.672 1.00 72.20 C ATOM 2562 CD ARG A 156 -18.064 -9.855 -5.501 1.00 63.30 C ATOM 2563 NE ARG A 156 -18.506 -8.759 -4.628 1.00 63.43 N ATOM 2564 CZ ARG A 156 -17.926 -7.579 -4.524 1.00 53.23 C ATOM 2565 NH1 ARG A 156 -16.879 -7.274 -5.226 1.00 2.33 N ATOM 2566 NH2 ARG A 156 -18.408 -6.700 -3.710 1.00 14.35 N ATOM 0 H ARG A 156 -19.273 -13.550 -4.550 1.00 51.54 H new ATOM 0 HA ARG A 156 -20.628 -12.931 -7.038 1.00 45.31 H new ATOM 0 HB2 ARG A 156 -17.736 -12.501 -6.134 1.00 5.21 H new ATOM 0 HB3 ARG A 156 -18.481 -11.776 -7.544 1.00 5.21 H new ATOM 0 HG2 ARG A 156 -20.023 -10.482 -6.130 1.00 72.20 H new ATOM 0 HG3 ARG A 156 -19.443 -11.293 -4.689 1.00 72.20 H new ATOM 0 HD2 ARG A 156 -17.164 -10.308 -5.085 1.00 63.30 H new ATOM 0 HD3 ARG A 156 -17.796 -9.453 -6.478 1.00 63.30 H new ATOM 0 HE ARG A 156 -19.332 -8.925 -4.053 1.00 63.43 H new ATOM 0 HH11 ARG A 156 -16.486 -7.954 -5.877 1.00 2.33 H new ATOM 0 HH12 ARG A 156 -16.449 -6.354 -5.127 1.00 2.33 H new ATOM 0 HH21 ARG A 156 -19.233 -6.920 -3.152 1.00 14.35 H new ATOM 0 HH22 ARG A 156 -17.964 -5.786 -3.625 1.00 14.35 H new ATOM 2580 N LEU A 157 -18.013 -15.045 -7.076 1.00 64.22 N ATOM 2581 CA LEU A 157 -17.297 -16.062 -7.899 1.00 34.25 C ATOM 2582 C LEU A 157 -18.145 -17.330 -8.192 1.00 64.23 C ATOM 2583 O LEU A 157 -17.971 -17.958 -9.236 1.00 21.21 O ATOM 2584 CB LEU A 157 -15.902 -16.418 -7.281 1.00 63.33 C ATOM 2585 CG LEU A 157 -15.838 -16.851 -5.768 1.00 23.25 C ATOM 2586 CD1 LEU A 157 -16.375 -18.280 -5.513 1.00 42.43 C ATOM 2587 CD2 LEU A 157 -14.406 -16.707 -5.214 1.00 41.33 C ATOM 0 H LEU A 157 -17.559 -14.845 -6.185 1.00 64.22 H new ATOM 0 HA LEU A 157 -17.123 -15.598 -8.870 1.00 34.25 H new ATOM 0 HB2 LEU A 157 -15.473 -17.225 -7.875 1.00 63.33 H new ATOM 0 HB3 LEU A 157 -15.253 -15.551 -7.405 1.00 63.33 H new ATOM 0 HG LEU A 157 -16.501 -16.171 -5.233 1.00 23.25 H new ATOM 0 HD11 LEU A 157 -16.301 -18.512 -4.451 1.00 42.43 H new ATOM 0 HD12 LEU A 157 -17.418 -18.338 -5.825 1.00 42.43 H new ATOM 0 HD13 LEU A 157 -15.785 -18.998 -6.083 1.00 42.43 H new ATOM 0 HD21 LEU A 157 -14.388 -17.012 -4.168 1.00 41.33 H new ATOM 0 HD22 LEU A 157 -13.729 -17.339 -5.788 1.00 41.33 H new ATOM 0 HD23 LEU A 157 -14.088 -15.668 -5.294 1.00 41.33 H new ATOM 2599 N THR A 158 -19.066 -17.702 -7.268 1.00 34.43 N ATOM 2600 CA THR A 158 -19.987 -18.856 -7.491 1.00 3.21 C ATOM 2601 C THR A 158 -21.003 -18.576 -8.630 1.00 4.21 C ATOM 2602 O THR A 158 -21.531 -19.508 -9.239 1.00 22.11 O ATOM 2603 CB THR A 158 -20.756 -19.265 -6.182 1.00 74.22 C ATOM 2604 OG1 THR A 158 -21.569 -20.443 -6.393 1.00 43.31 O ATOM 2605 CG2 THR A 158 -21.643 -18.130 -5.654 1.00 75.44 C ATOM 0 H THR A 158 -19.194 -17.231 -6.373 1.00 34.43 H new ATOM 0 HA THR A 158 -19.352 -19.691 -7.789 1.00 3.21 H new ATOM 0 HB THR A 158 -19.991 -19.483 -5.437 1.00 74.22 H new ATOM 0 HG1 THR A 158 -22.033 -20.673 -5.561 1.00 43.31 H new ATOM 0 HG21 THR A 158 -22.154 -18.459 -4.749 1.00 75.44 H new ATOM 0 HG22 THR A 158 -21.025 -17.261 -5.427 1.00 75.44 H new ATOM 0 HG23 THR A 158 -22.381 -17.863 -6.411 1.00 75.44 H new ATOM 2613 N GLU A 159 -21.270 -17.285 -8.891 1.00 5.34 N ATOM 2614 CA GLU A 159 -22.191 -16.831 -9.963 1.00 40.31 C ATOM 2615 C GLU A 159 -21.441 -16.390 -11.249 1.00 61.54 C ATOM 2616 O GLU A 159 -22.080 -16.113 -12.271 1.00 12.14 O ATOM 2617 CB GLU A 159 -23.077 -15.680 -9.423 1.00 61.13 C ATOM 2618 CG GLU A 159 -24.007 -16.090 -8.254 1.00 74.15 C ATOM 2619 CD GLU A 159 -24.947 -14.965 -7.782 1.00 72.41 C ATOM 2620 OE1 GLU A 159 -25.560 -14.295 -8.638 1.00 70.13 O ATOM 2621 OE2 GLU A 159 -25.066 -14.734 -6.562 1.00 41.33 O ATOM 0 H GLU A 159 -20.853 -16.517 -8.364 1.00 5.34 H new ATOM 0 HA GLU A 159 -22.816 -17.678 -10.248 1.00 40.31 H new ATOM 0 HB2 GLU A 159 -22.433 -14.865 -9.092 1.00 61.13 H new ATOM 0 HB3 GLU A 159 -23.687 -15.292 -10.239 1.00 61.13 H new ATOM 0 HG2 GLU A 159 -24.607 -16.946 -8.563 1.00 74.15 H new ATOM 0 HG3 GLU A 159 -23.395 -16.416 -7.413 1.00 74.15 H new ATOM 2628 N THR A 160 -20.094 -16.312 -11.200 1.00 31.25 N ATOM 2629 CA THR A 160 -19.249 -15.998 -12.392 1.00 41.42 C ATOM 2630 C THR A 160 -17.979 -16.910 -12.444 1.00 21.14 C ATOM 2631 O THR A 160 -16.972 -16.617 -11.768 1.00 43.30 O ATOM 2632 CB THR A 160 -18.868 -14.462 -12.483 1.00 54.33 C ATOM 2633 OG1 THR A 160 -17.861 -14.254 -13.493 1.00 73.12 O ATOM 2634 CG2 THR A 160 -18.391 -13.859 -11.146 1.00 43.13 C ATOM 2635 OXT THR A 160 -17.998 -17.932 -13.164 1.00 37.31 O ATOM 0 H THR A 160 -19.557 -16.462 -10.346 1.00 31.25 H new ATOM 0 HA THR A 160 -19.855 -16.217 -13.271 1.00 41.42 H new ATOM 0 HB THR A 160 -19.788 -13.942 -12.751 1.00 54.33 H new ATOM 0 HG1 THR A 160 -17.636 -13.301 -13.540 1.00 73.12 H new ATOM 0 HG21 THR A 160 -18.149 -12.806 -11.288 1.00 43.13 H new ATOM 0 HG22 THR A 160 -19.182 -13.952 -10.402 1.00 43.13 H new ATOM 0 HG23 THR A 160 -17.505 -14.392 -10.802 1.00 43.13 H new TER 2643 THR A 160