USER MOD reduce.3.24.130724 H: found=0, std=0, add=1108, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1108 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 23 MET CE :methyl -161:sc= -1.49 (180deg=-2.58) USER MOD Set 1.2: A 126 THR OG1 : rot -30:sc= 0.495 USER MOD Set 2.1: A 53 ASN : amide:sc= 1.11 K(o=2.3,f=-0.13) USER MOD Set 2.2: A 103 TYR OH : rot 142:sc= 1.23 USER MOD Set 3.1: A 10 HIS : no HD1:sc= 0 X(o=0,f=0.049) USER MOD Set 3.2: A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -174:sc= 0 (180deg=-0.0656) USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 HIS : no HD1:sc= -0.0814 X(o=-0.081,f=-0.011) USER MOD Single : A 6 HIS : no HD1:sc=-0.00972 X(o=-0.0097,f=-0.0017) USER MOD Single : A 7 HIS : no HD1:sc= -0.0382 X(o=-0.038,f=0) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 9 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 11 SER OG : rot 44:sc= 0.369 USER MOD Single : A 16 ASN : amide:sc= -0.0217 K(o=-0.022,f=-1.1) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 HIS : no HD1:sc= -0.143 X(o=-0.14,f=-0.0016) USER MOD Single : A 30 SER OG : rot 31:sc= -3.38! USER MOD Single : A 33 THR OG1 : rot 130:sc= -1.22 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=-0.024) USER MOD Single : A 36 GLN : amide:sc= -2.26 X(o=-2.3,f=-2.7!) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 165:sc= -0.029 (180deg=-0.267) USER MOD Single : A 45 THR OG1 : rot -167:sc= -0.0248 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 ASN : amide:sc= -0.254 K(o=-0.25,f=-1.4) USER MOD Single : A 54 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= 1.54 K(o=1.5,f=-4.8!) USER MOD Single : A 63 ASN : amide:sc= 1.63 K(o=1.6,f=-0.063) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 74 LYS NZ :NH3+ 160:sc= 1.17 (180deg=0.722) USER MOD Single : A 76 LYS NZ :NH3+ 151:sc= 1.04 (180deg=-0.428) USER MOD Single : A 77 THR OG1 : rot -80:sc= 0.352 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 LYS NZ :NH3+ 144:sc= 0.861 (180deg=-0.662!) USER MOD Single : A 93 LYS NZ :NH3+ 169:sc= 1.23 (180deg=1.12) USER MOD Single : A 95 MET CE :methyl -130:sc= -0.0786 (180deg=-3.28!) USER MOD Single : A 100 MET CE :methyl -128:sc= -0.678 (180deg=-2.71) USER MOD Single : A 105 ASN : amide:sc= -0.0474 X(o=-0.047,f=-0.025) USER MOD Single : A 106 MET CE :methyl 151:sc= -0.18 (180deg=-0.93) USER MOD Single : A 111 SER OG : rot -40:sc= 0.612 USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= -0.22 USER MOD Single : A 117 MET CE :methyl -113:sc= -0.169 (180deg=-1.4) USER MOD Single : A 119 GLN : amide:sc= -1.09 K(o=-1.1,f=-5.6!) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 150:sc= 2.14 (180deg=-0.552) USER MOD Single : A 130 THR OG1 : rot 167:sc= 0.219 USER MOD Single : A 133 LYS NZ :NH3+ -154:sc= 1.15 (180deg=0.596) USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 50.131 -47.609 43.289 1.00 41.55 N ATOM 2 CA MET A 1 49.491 -48.942 43.479 1.00 3.54 C ATOM 3 C MET A 1 48.028 -48.937 42.996 1.00 13.40 C ATOM 4 O MET A 1 47.659 -49.684 42.088 1.00 40.21 O ATOM 5 CB MET A 1 49.548 -49.359 44.957 1.00 21.11 C ATOM 6 CG MET A 1 50.961 -49.503 45.508 1.00 54.52 C ATOM 7 SD MET A 1 51.941 -50.705 44.587 1.00 4.23 S ATOM 8 CE MET A 1 53.475 -50.675 45.517 1.00 15.33 C ATOM 0 H1 MET A 1 51.141 -47.672 43.528 1.00 41.55 H new ATOM 0 H2 MET A 1 50.028 -47.312 42.298 1.00 41.55 H new ATOM 0 H3 MET A 1 49.671 -46.912 43.909 1.00 41.55 H new ATOM 0 HA MET A 1 50.047 -49.663 42.879 1.00 3.54 H new ATOM 0 HB2 MET A 1 49.011 -48.621 45.553 1.00 21.11 H new ATOM 0 HB3 MET A 1 49.024 -50.308 45.076 1.00 21.11 H new ATOM 0 HG2 MET A 1 51.459 -48.534 45.479 1.00 54.52 H new ATOM 0 HG3 MET A 1 50.911 -49.805 46.554 1.00 54.52 H new ATOM 0 HE1 MET A 1 54.186 -51.369 45.069 1.00 15.33 H new ATOM 0 HE2 MET A 1 53.891 -49.668 45.499 1.00 15.33 H new ATOM 0 HE3 MET A 1 53.281 -50.969 46.548 1.00 15.33 H new ATOM 20 N GLY A 2 47.197 -48.095 43.610 1.00 23.04 N ATOM 21 CA GLY A 2 45.781 -48.030 43.249 1.00 34.45 C ATOM 22 C GLY A 2 45.451 -46.929 42.242 1.00 4.04 C ATOM 23 O GLY A 2 46.219 -45.983 42.057 1.00 4.32 O ATOM 0 H GLY A 2 47.476 -47.454 44.353 1.00 23.04 H new ATOM 0 HA2 GLY A 2 45.477 -48.991 42.835 1.00 34.45 H new ATOM 0 HA3 GLY A 2 45.192 -47.871 44.153 1.00 34.45 H new ATOM 27 N SER A 3 44.289 -47.051 41.602 1.00 43.22 N ATOM 28 CA SER A 3 43.854 -46.101 40.564 1.00 71.44 C ATOM 29 C SER A 3 42.778 -45.135 41.082 1.00 2.23 C ATOM 30 O SER A 3 41.943 -45.501 41.912 1.00 4.50 O ATOM 31 CB SER A 3 43.313 -46.859 39.341 1.00 44.34 C ATOM 32 OG SER A 3 42.243 -47.729 39.696 1.00 41.13 O ATOM 0 H SER A 3 43.623 -47.803 41.782 1.00 43.22 H new ATOM 0 HA SER A 3 44.727 -45.514 40.280 1.00 71.44 H new ATOM 0 HB2 SER A 3 42.969 -46.145 38.592 1.00 44.34 H new ATOM 0 HB3 SER A 3 44.117 -47.437 38.885 1.00 44.34 H new ATOM 0 HG SER A 3 41.921 -48.194 38.896 1.00 41.13 H new ATOM 38 N SER A 4 42.811 -43.900 40.577 1.00 72.30 N ATOM 39 CA SER A 4 41.838 -42.858 40.950 1.00 12.24 C ATOM 40 C SER A 4 42.082 -41.577 40.141 1.00 4.40 C ATOM 41 O SER A 4 43.079 -40.881 40.353 1.00 34.21 O ATOM 42 CB SER A 4 41.920 -42.541 42.452 1.00 72.41 C ATOM 43 OG SER A 4 41.014 -41.505 42.816 1.00 50.13 O ATOM 0 H SER A 4 43.508 -43.590 39.900 1.00 72.30 H new ATOM 0 HA SER A 4 40.842 -43.239 40.725 1.00 12.24 H new ATOM 0 HB2 SER A 4 41.697 -43.440 43.027 1.00 72.41 H new ATOM 0 HB3 SER A 4 42.937 -42.243 42.707 1.00 72.41 H new ATOM 0 HG SER A 4 41.089 -41.328 43.777 1.00 50.13 H new ATOM 49 N HIS A 5 41.172 -41.264 39.215 1.00 43.12 N ATOM 50 CA HIS A 5 41.343 -40.101 38.334 1.00 23.42 C ATOM 51 C HIS A 5 40.022 -39.729 37.629 1.00 75.05 C ATOM 52 O HIS A 5 39.470 -40.527 36.869 1.00 53.45 O ATOM 53 CB HIS A 5 42.444 -40.397 37.297 1.00 3.21 C ATOM 54 CG HIS A 5 43.376 -39.247 37.059 1.00 15.41 C ATOM 55 ND1 HIS A 5 43.686 -38.766 35.807 1.00 35.12 N ATOM 56 CD2 HIS A 5 44.096 -38.499 37.930 1.00 50.32 C ATOM 57 CE1 HIS A 5 44.551 -37.782 35.917 1.00 62.33 C ATOM 58 NE2 HIS A 5 44.816 -37.600 37.190 1.00 70.12 N ATOM 0 H HIS A 5 40.315 -41.794 39.055 1.00 43.12 H new ATOM 0 HA HIS A 5 41.640 -39.247 38.943 1.00 23.42 H new ATOM 0 HB2 HIS A 5 43.023 -41.258 37.631 1.00 3.21 H new ATOM 0 HB3 HIS A 5 41.976 -40.674 36.353 1.00 3.21 H new ATOM 0 HD2 HIS A 5 44.101 -38.594 39.006 1.00 50.32 H new ATOM 0 HE1 HIS A 5 44.973 -37.218 35.098 1.00 62.33 H new ATOM 0 HE2 HIS A 5 45.456 -36.901 37.567 1.00 70.12 H new ATOM 67 N HIS A 6 39.526 -38.510 37.869 1.00 30.22 N ATOM 68 CA HIS A 6 38.237 -38.073 37.303 1.00 31.10 C ATOM 69 C HIS A 6 38.116 -36.538 37.216 1.00 41.03 C ATOM 70 O HIS A 6 38.838 -35.806 37.897 1.00 71.21 O ATOM 71 CB HIS A 6 37.081 -38.649 38.135 1.00 43.01 C ATOM 72 CG HIS A 6 37.258 -38.482 39.617 1.00 64.31 C ATOM 73 ND1 HIS A 6 37.381 -39.547 40.484 1.00 25.35 N ATOM 74 CD2 HIS A 6 37.327 -37.369 40.388 1.00 45.20 C ATOM 75 CE1 HIS A 6 37.519 -39.101 41.715 1.00 51.35 C ATOM 76 NE2 HIS A 6 37.489 -37.786 41.684 1.00 24.42 N ATOM 0 H HIS A 6 39.991 -37.810 38.447 1.00 30.22 H new ATOM 0 HA HIS A 6 38.186 -38.453 36.283 1.00 31.10 H new ATOM 0 HB2 HIS A 6 36.152 -38.165 37.833 1.00 43.01 H new ATOM 0 HB3 HIS A 6 36.976 -39.710 37.908 1.00 43.01 H new ATOM 0 HD2 HIS A 6 37.266 -36.346 40.046 1.00 45.20 H new ATOM 0 HE1 HIS A 6 37.637 -39.710 42.599 1.00 51.35 H new ATOM 0 HE2 HIS A 6 37.573 -37.174 42.496 1.00 24.42 H new ATOM 85 N HIS A 7 37.199 -36.065 36.361 1.00 72.31 N ATOM 86 CA HIS A 7 36.920 -34.627 36.207 1.00 35.31 C ATOM 87 C HIS A 7 35.600 -34.399 35.440 1.00 3.14 C ATOM 88 O HIS A 7 35.072 -35.322 34.817 1.00 42.22 O ATOM 89 CB HIS A 7 38.082 -33.924 35.487 1.00 23.53 C ATOM 90 CG HIS A 7 38.287 -34.367 34.067 1.00 52.51 C ATOM 91 ND1 HIS A 7 38.196 -33.505 32.996 1.00 3.54 N ATOM 92 CD2 HIS A 7 38.592 -35.578 33.541 1.00 34.53 C ATOM 93 CE1 HIS A 7 38.432 -34.162 31.881 1.00 14.23 C ATOM 94 NE2 HIS A 7 38.676 -35.420 32.180 1.00 63.44 N ATOM 0 H HIS A 7 36.632 -36.662 35.759 1.00 72.31 H new ATOM 0 HA HIS A 7 36.816 -34.197 37.203 1.00 35.31 H new ATOM 0 HB2 HIS A 7 37.903 -32.849 35.498 1.00 23.53 H new ATOM 0 HB3 HIS A 7 39.001 -34.100 36.047 1.00 23.53 H new ATOM 0 HD2 HIS A 7 38.741 -36.496 34.090 1.00 34.53 H new ATOM 0 HE1 HIS A 7 38.426 -33.740 30.887 1.00 14.23 H new ATOM 0 HE2 HIS A 7 38.892 -36.158 31.510 1.00 63.44 H new ATOM 103 N HIS A 8 35.068 -33.173 35.481 1.00 63.42 N ATOM 104 CA HIS A 8 33.796 -32.858 34.801 1.00 31.12 C ATOM 105 C HIS A 8 33.861 -31.563 33.975 1.00 52.02 C ATOM 106 O HIS A 8 34.651 -30.659 34.254 1.00 71.22 O ATOM 107 CB HIS A 8 32.657 -32.736 35.824 1.00 3.02 C ATOM 108 CG HIS A 8 32.234 -34.038 36.428 1.00 41.50 C ATOM 109 ND1 HIS A 8 32.559 -34.414 37.711 1.00 52.33 N ATOM 110 CD2 HIS A 8 31.484 -35.046 35.923 1.00 42.25 C ATOM 111 CE1 HIS A 8 32.035 -35.592 37.969 1.00 3.13 C ATOM 112 NE2 HIS A 8 31.376 -36.001 36.904 1.00 14.30 N ATOM 0 H HIS A 8 35.490 -32.385 35.972 1.00 63.42 H new ATOM 0 HA HIS A 8 33.607 -33.683 34.114 1.00 31.12 H new ATOM 0 HB2 HIS A 8 32.971 -32.063 36.622 1.00 3.02 H new ATOM 0 HB3 HIS A 8 31.796 -32.276 35.339 1.00 3.02 H new ATOM 0 HD2 HIS A 8 31.052 -35.091 34.934 1.00 42.25 H new ATOM 0 HE1 HIS A 8 32.129 -36.134 38.899 1.00 3.13 H new ATOM 0 HE2 HIS A 8 30.869 -36.882 36.822 1.00 14.30 H new ATOM 121 N HIS A 9 33.011 -31.499 32.948 1.00 4.03 N ATOM 122 CA HIS A 9 32.783 -30.274 32.167 1.00 1.33 C ATOM 123 C HIS A 9 31.327 -29.813 32.328 1.00 61.41 C ATOM 124 O HIS A 9 30.456 -30.611 32.679 1.00 20.21 O ATOM 125 CB HIS A 9 33.073 -30.514 30.678 1.00 52.11 C ATOM 126 CG HIS A 9 34.508 -30.802 30.371 1.00 14.41 C ATOM 127 ND1 HIS A 9 35.401 -29.829 29.993 1.00 42.42 N ATOM 128 CD2 HIS A 9 35.204 -31.963 30.378 1.00 32.23 C ATOM 129 CE1 HIS A 9 36.580 -30.372 29.783 1.00 53.13 C ATOM 130 NE2 HIS A 9 36.492 -31.669 30.007 1.00 51.25 N ATOM 0 H HIS A 9 32.458 -32.296 32.631 1.00 4.03 H new ATOM 0 HA HIS A 9 33.458 -29.504 32.540 1.00 1.33 H new ATOM 0 HB2 HIS A 9 32.464 -31.349 30.331 1.00 52.11 H new ATOM 0 HB3 HIS A 9 32.761 -29.636 30.113 1.00 52.11 H new ATOM 0 HD2 HIS A 9 34.817 -32.940 30.629 1.00 32.23 H new ATOM 0 HE1 HIS A 9 37.472 -29.844 29.478 1.00 53.13 H new ATOM 0 HE2 HIS A 9 37.254 -32.341 29.919 1.00 51.25 H new ATOM 139 N HIS A 10 31.060 -28.539 32.071 1.00 3.03 N ATOM 140 CA HIS A 10 29.690 -28.017 32.143 1.00 75.24 C ATOM 141 C HIS A 10 29.508 -26.791 31.236 1.00 23.33 C ATOM 142 O HIS A 10 30.272 -25.828 31.309 1.00 10.44 O ATOM 143 CB HIS A 10 29.327 -27.655 33.590 1.00 41.22 C ATOM 144 CG HIS A 10 27.871 -27.355 33.785 1.00 11.12 C ATOM 145 ND1 HIS A 10 27.316 -26.113 33.559 1.00 43.43 N ATOM 146 CD2 HIS A 10 26.847 -28.153 34.176 1.00 51.45 C ATOM 147 CE1 HIS A 10 26.022 -26.160 33.802 1.00 34.21 C ATOM 148 NE2 HIS A 10 25.713 -27.382 34.177 1.00 33.13 N ATOM 0 H HIS A 10 31.764 -27.848 31.812 1.00 3.03 H new ATOM 0 HA HIS A 10 29.020 -28.802 31.792 1.00 75.24 H new ATOM 0 HB2 HIS A 10 29.611 -28.479 34.244 1.00 41.22 H new ATOM 0 HB3 HIS A 10 29.913 -26.788 33.897 1.00 41.22 H new ATOM 0 HD2 HIS A 10 26.912 -29.199 34.437 1.00 51.45 H new ATOM 0 HE1 HIS A 10 25.332 -25.335 33.709 1.00 34.21 H new ATOM 0 HE2 HIS A 10 24.779 -27.705 34.429 1.00 33.13 H new ATOM 157 N SER A 11 28.481 -26.833 30.390 1.00 3.14 N ATOM 158 CA SER A 11 28.178 -25.729 29.468 1.00 53.01 C ATOM 159 C SER A 11 26.712 -25.776 29.012 1.00 70.33 C ATOM 160 O SER A 11 26.356 -26.521 28.095 1.00 71.40 O ATOM 161 CB SER A 11 29.116 -25.765 28.248 1.00 42.42 C ATOM 162 OG SER A 11 29.090 -27.033 27.605 1.00 73.23 O ATOM 0 H SER A 11 27.839 -27.622 30.320 1.00 3.14 H new ATOM 0 HA SER A 11 28.339 -24.794 30.005 1.00 53.01 H new ATOM 0 HB2 SER A 11 28.822 -24.991 27.539 1.00 42.42 H new ATOM 0 HB3 SER A 11 30.134 -25.538 28.564 1.00 42.42 H new ATOM 0 HG SER A 11 28.163 -27.342 27.528 1.00 73.23 H new ATOM 168 N SER A 12 25.864 -24.979 29.661 1.00 22.13 N ATOM 169 CA SER A 12 24.419 -24.973 29.374 1.00 41.04 C ATOM 170 C SER A 12 23.947 -23.605 28.864 1.00 63.43 C ATOM 171 O SER A 12 24.224 -22.574 29.480 1.00 12.13 O ATOM 172 CB SER A 12 23.622 -25.343 30.637 1.00 13.44 C ATOM 173 OG SER A 12 24.022 -26.607 31.153 1.00 53.33 O ATOM 0 H SER A 12 26.148 -24.326 30.391 1.00 22.13 H new ATOM 0 HA SER A 12 24.242 -25.712 28.593 1.00 41.04 H new ATOM 0 HB2 SER A 12 23.767 -24.576 31.398 1.00 13.44 H new ATOM 0 HB3 SER A 12 22.557 -25.364 30.404 1.00 13.44 H new ATOM 0 HG SER A 12 23.499 -26.813 31.956 1.00 53.33 H new ATOM 179 N GLY A 13 23.247 -23.597 27.729 1.00 0.55 N ATOM 180 CA GLY A 13 22.638 -22.364 27.235 1.00 41.54 C ATOM 181 C GLY A 13 22.938 -22.052 25.768 1.00 12.00 C ATOM 182 O GLY A 13 24.095 -21.871 25.378 1.00 41.52 O ATOM 0 H GLY A 13 23.090 -24.417 27.143 1.00 0.55 H new ATOM 0 HA2 GLY A 13 21.558 -22.429 27.366 1.00 41.54 H new ATOM 0 HA3 GLY A 13 22.984 -21.532 27.848 1.00 41.54 H new ATOM 186 N ARG A 14 21.886 -21.991 24.952 1.00 54.02 N ATOM 187 CA ARG A 14 21.992 -21.503 23.570 1.00 63.45 C ATOM 188 C ARG A 14 21.405 -20.085 23.484 1.00 73.14 C ATOM 189 O ARG A 14 20.186 -19.901 23.510 1.00 2.02 O ATOM 190 CB ARG A 14 21.274 -22.453 22.594 1.00 63.24 C ATOM 191 CG ARG A 14 21.777 -23.896 22.665 1.00 41.53 C ATOM 192 CD ARG A 14 21.237 -24.746 21.519 1.00 41.25 C ATOM 193 NE ARG A 14 21.767 -24.322 20.221 1.00 53.12 N ATOM 194 CZ ARG A 14 21.404 -24.833 19.071 1.00 1.21 C ATOM 195 NH1 ARG A 14 20.515 -25.771 19.015 1.00 51.44 N ATOM 196 NH2 ARG A 14 21.938 -24.403 17.977 1.00 33.32 N ATOM 0 H ARG A 14 20.944 -22.274 25.223 1.00 54.02 H new ATOM 0 HA ARG A 14 23.043 -21.473 23.284 1.00 63.45 H new ATOM 0 HB2 ARG A 14 20.205 -22.439 22.806 1.00 63.24 H new ATOM 0 HB3 ARG A 14 21.402 -22.082 21.577 1.00 63.24 H new ATOM 0 HG2 ARG A 14 22.867 -23.902 22.639 1.00 41.53 H new ATOM 0 HG3 ARG A 14 21.479 -24.338 23.616 1.00 41.53 H new ATOM 0 HD2 ARG A 14 21.494 -25.791 21.691 1.00 41.25 H new ATOM 0 HD3 ARG A 14 20.149 -24.684 21.504 1.00 41.25 H new ATOM 0 HE ARG A 14 22.466 -23.579 20.212 1.00 53.12 H new ATOM 0 HH11 ARG A 14 20.088 -26.121 19.873 1.00 51.44 H new ATOM 0 HH12 ARG A 14 20.241 -26.161 18.113 1.00 51.44 H new ATOM 0 HH21 ARG A 14 22.642 -23.666 18.009 1.00 33.32 H new ATOM 0 HH22 ARG A 14 21.656 -24.801 17.081 1.00 33.32 H new ATOM 210 N GLU A 15 22.281 -19.088 23.404 1.00 55.32 N ATOM 211 CA GLU A 15 21.878 -17.681 23.531 1.00 21.52 C ATOM 212 C GLU A 15 21.654 -17.006 22.160 1.00 24.41 C ATOM 213 O GLU A 15 21.920 -17.602 21.114 1.00 32.40 O ATOM 214 CB GLU A 15 22.949 -16.925 24.345 1.00 4.14 C ATOM 215 CG GLU A 15 22.558 -15.505 24.750 1.00 41.41 C ATOM 216 CD GLU A 15 23.594 -14.838 25.640 1.00 24.43 C ATOM 217 OE1 GLU A 15 23.594 -15.112 26.857 1.00 62.31 O ATOM 218 OE2 GLU A 15 24.399 -14.032 25.132 1.00 2.13 O ATOM 0 H GLU A 15 23.280 -19.224 23.251 1.00 55.32 H new ATOM 0 HA GLU A 15 20.920 -17.645 24.050 1.00 21.52 H new ATOM 0 HB2 GLU A 15 23.172 -17.497 25.246 1.00 4.14 H new ATOM 0 HB3 GLU A 15 23.867 -16.881 23.759 1.00 4.14 H new ATOM 0 HG2 GLU A 15 22.415 -14.903 23.853 1.00 41.41 H new ATOM 0 HG3 GLU A 15 21.601 -15.532 25.272 1.00 41.41 H new ATOM 225 N ASN A 16 21.148 -15.760 22.207 1.00 44.45 N ATOM 226 CA ASN A 16 20.904 -14.908 21.026 1.00 22.22 C ATOM 227 C ASN A 16 19.524 -15.145 20.395 1.00 72.14 C ATOM 228 O ASN A 16 19.061 -16.277 20.259 1.00 54.01 O ATOM 229 CB ASN A 16 22.014 -15.046 19.973 1.00 54.35 C ATOM 230 CG ASN A 16 23.345 -14.523 20.475 1.00 62.30 C ATOM 231 OD1 ASN A 16 23.403 -13.613 21.295 1.00 15.35 O ATOM 232 ND2 ASN A 16 24.427 -15.092 19.993 1.00 71.43 N ATOM 0 H ASN A 16 20.892 -15.307 23.084 1.00 44.45 H new ATOM 0 HA ASN A 16 20.917 -13.883 21.396 1.00 22.22 H new ATOM 0 HB2 ASN A 16 22.119 -16.094 19.693 1.00 54.35 H new ATOM 0 HB3 ASN A 16 21.728 -14.503 19.072 1.00 54.35 H new ATOM 0 HD21 ASN A 16 25.348 -14.779 20.300 1.00 71.43 H new ATOM 0 HD22 ASN A 16 24.346 -15.847 19.312 1.00 71.43 H new ATOM 239 N LEU A 17 18.872 -14.044 20.020 1.00 70.25 N ATOM 240 CA LEU A 17 17.546 -14.080 19.394 1.00 22.10 C ATOM 241 C LEU A 17 17.537 -13.174 18.150 1.00 34.51 C ATOM 242 O LEU A 17 18.205 -12.139 18.123 1.00 52.44 O ATOM 243 CB LEU A 17 16.484 -13.634 20.425 1.00 60.11 C ATOM 244 CG LEU A 17 15.000 -13.870 20.056 1.00 4.35 C ATOM 245 CD1 LEU A 17 14.473 -12.791 19.109 1.00 21.03 C ATOM 246 CD2 LEU A 17 14.807 -15.262 19.454 1.00 63.13 C ATOM 0 H LEU A 17 19.246 -13.103 20.141 1.00 70.25 H new ATOM 0 HA LEU A 17 17.308 -15.094 19.073 1.00 22.10 H new ATOM 0 HB2 LEU A 17 16.686 -14.151 21.363 1.00 60.11 H new ATOM 0 HB3 LEU A 17 16.621 -12.569 20.612 1.00 60.11 H new ATOM 0 HG LEU A 17 14.420 -13.808 20.977 1.00 4.35 H new ATOM 0 HD11 LEU A 17 13.428 -12.992 18.874 1.00 21.03 H new ATOM 0 HD12 LEU A 17 14.556 -11.815 19.587 1.00 21.03 H new ATOM 0 HD13 LEU A 17 15.059 -12.796 18.190 1.00 21.03 H new ATOM 0 HD21 LEU A 17 13.757 -15.407 19.202 1.00 63.13 H new ATOM 0 HD22 LEU A 17 15.413 -15.356 18.553 1.00 63.13 H new ATOM 0 HD23 LEU A 17 15.114 -16.017 20.178 1.00 63.13 H new ATOM 258 N TYR A 18 16.798 -13.574 17.117 1.00 44.30 N ATOM 259 CA TYR A 18 16.762 -12.824 15.853 1.00 22.25 C ATOM 260 C TYR A 18 15.822 -11.609 15.939 1.00 50.21 C ATOM 261 O TYR A 18 14.598 -11.756 15.976 1.00 60.33 O ATOM 262 CB TYR A 18 16.314 -13.739 14.709 1.00 45.52 C ATOM 263 CG TYR A 18 17.176 -14.976 14.539 1.00 52.11 C ATOM 264 CD1 TYR A 18 18.344 -14.935 13.787 1.00 21.03 C ATOM 265 CD2 TYR A 18 16.820 -16.184 15.133 1.00 41.11 C ATOM 266 CE1 TYR A 18 19.130 -16.060 13.627 1.00 45.23 C ATOM 267 CE2 TYR A 18 17.602 -17.312 14.978 1.00 12.40 C ATOM 268 CZ TYR A 18 18.755 -17.246 14.225 1.00 61.24 C ATOM 269 OH TYR A 18 19.532 -18.372 14.062 1.00 3.03 O ATOM 0 H TYR A 18 16.215 -14.411 17.126 1.00 44.30 H new ATOM 0 HA TYR A 18 17.771 -12.459 15.659 1.00 22.25 H new ATOM 0 HB2 TYR A 18 15.284 -14.047 14.886 1.00 45.52 H new ATOM 0 HB3 TYR A 18 16.322 -13.172 13.778 1.00 45.52 H new ATOM 0 HD1 TYR A 18 18.642 -14.008 13.320 1.00 21.03 H new ATOM 0 HD2 TYR A 18 15.918 -16.240 15.724 1.00 41.11 H new ATOM 0 HE1 TYR A 18 20.033 -16.012 13.037 1.00 45.23 H new ATOM 0 HE2 TYR A 18 17.311 -18.242 15.445 1.00 12.40 H new ATOM 0 HH TYR A 18 19.129 -19.121 14.548 1.00 3.03 H new ATOM 279 N PHE A 19 16.399 -10.414 15.958 1.00 22.34 N ATOM 280 CA PHE A 19 15.613 -9.177 16.041 1.00 5.00 C ATOM 281 C PHE A 19 15.321 -8.603 14.643 1.00 52.02 C ATOM 282 O PHE A 19 16.088 -8.806 13.700 1.00 1.14 O ATOM 283 CB PHE A 19 16.354 -8.137 16.897 1.00 23.31 C ATOM 284 CG PHE A 19 15.550 -6.883 17.164 1.00 44.20 C ATOM 285 CD1 PHE A 19 14.515 -6.892 18.091 1.00 63.24 C ATOM 286 CD2 PHE A 19 15.821 -5.700 16.485 1.00 3.33 C ATOM 287 CE1 PHE A 19 13.773 -5.753 18.334 1.00 32.31 C ATOM 288 CE2 PHE A 19 15.079 -4.559 16.727 1.00 53.44 C ATOM 289 CZ PHE A 19 14.054 -4.587 17.652 1.00 74.45 C ATOM 0 H PHE A 19 17.408 -10.269 15.917 1.00 22.34 H new ATOM 0 HA PHE A 19 14.659 -9.415 16.511 1.00 5.00 H new ATOM 0 HB2 PHE A 19 16.628 -8.592 17.849 1.00 23.31 H new ATOM 0 HB3 PHE A 19 17.282 -7.863 16.396 1.00 23.31 H new ATOM 0 HD1 PHE A 19 14.288 -7.801 18.628 1.00 63.24 H new ATOM 0 HD2 PHE A 19 16.621 -5.672 15.760 1.00 3.33 H new ATOM 0 HE1 PHE A 19 12.972 -5.775 19.058 1.00 32.31 H new ATOM 0 HE2 PHE A 19 15.301 -3.647 16.193 1.00 53.44 H new ATOM 0 HZ PHE A 19 13.473 -3.697 17.841 1.00 74.45 H new ATOM 299 N GLN A 20 14.209 -7.880 14.522 1.00 44.40 N ATOM 300 CA GLN A 20 13.792 -7.273 13.250 1.00 4.04 C ATOM 301 C GLN A 20 13.174 -5.882 13.479 1.00 65.02 C ATOM 302 O GLN A 20 12.283 -5.723 14.315 1.00 12.44 O ATOM 303 CB GLN A 20 12.770 -8.186 12.555 1.00 51.42 C ATOM 304 CG GLN A 20 12.179 -7.609 11.269 1.00 44.00 C ATOM 305 CD GLN A 20 10.967 -8.391 10.787 1.00 71.23 C ATOM 306 OE1 GLN A 20 9.835 -8.100 11.167 1.00 52.04 O ATOM 307 NE2 GLN A 20 11.188 -9.381 9.947 1.00 11.51 N ATOM 0 H GLN A 20 13.571 -7.696 15.297 1.00 44.40 H new ATOM 0 HA GLN A 20 14.672 -7.157 12.618 1.00 4.04 H new ATOM 0 HB2 GLN A 20 13.249 -9.138 12.325 1.00 51.42 H new ATOM 0 HB3 GLN A 20 11.958 -8.397 13.251 1.00 51.42 H new ATOM 0 HG2 GLN A 20 11.895 -6.570 11.437 1.00 44.00 H new ATOM 0 HG3 GLN A 20 12.941 -7.609 10.490 1.00 44.00 H new ATOM 0 HE21 GLN A 20 12.140 -9.596 9.652 1.00 11.51 H new ATOM 0 HE22 GLN A 20 10.407 -9.932 9.592 1.00 11.51 H new ATOM 316 N GLY A 21 13.650 -4.881 12.740 1.00 34.20 N ATOM 317 CA GLY A 21 13.082 -3.538 12.847 1.00 71.11 C ATOM 318 C GLY A 21 13.716 -2.531 11.888 1.00 33.15 C ATOM 319 O GLY A 21 14.818 -2.037 12.136 1.00 30.22 O ATOM 0 H GLY A 21 14.415 -4.971 12.071 1.00 34.20 H new ATOM 0 HA2 GLY A 21 12.011 -3.588 12.653 1.00 71.11 H new ATOM 0 HA3 GLY A 21 13.204 -3.181 13.870 1.00 71.11 H new ATOM 323 N HIS A 22 13.018 -2.215 10.793 1.00 50.11 N ATOM 324 CA HIS A 22 13.530 -1.270 9.789 1.00 61.21 C ATOM 325 C HIS A 22 12.432 -0.853 8.795 1.00 30.15 C ATOM 326 O HIS A 22 12.181 -1.551 7.815 1.00 74.54 O ATOM 327 CB HIS A 22 14.712 -1.899 9.027 1.00 11.12 C ATOM 328 CG HIS A 22 15.395 -0.971 8.062 1.00 43.30 C ATOM 329 ND1 HIS A 22 16.627 -0.409 8.310 1.00 43.12 N ATOM 330 CD2 HIS A 22 15.020 -0.515 6.840 1.00 64.12 C ATOM 331 CE1 HIS A 22 16.980 0.347 7.291 1.00 62.11 C ATOM 332 NE2 HIS A 22 16.027 0.301 6.388 1.00 52.22 N ATOM 0 H HIS A 22 12.098 -2.598 10.577 1.00 50.11 H new ATOM 0 HA HIS A 22 13.867 -0.376 10.314 1.00 61.21 H new ATOM 0 HB2 HIS A 22 15.446 -2.255 9.750 1.00 11.12 H new ATOM 0 HB3 HIS A 22 14.353 -2.771 8.481 1.00 11.12 H new ATOM 0 HD2 HIS A 22 14.102 -0.750 6.321 1.00 64.12 H new ATOM 0 HE1 HIS A 22 17.898 0.910 7.211 1.00 62.11 H new ATOM 0 HE2 HIS A 22 16.034 0.793 5.494 1.00 52.22 H new ATOM 341 N MET A 23 11.772 0.277 9.054 1.00 64.35 N ATOM 342 CA MET A 23 10.791 0.824 8.115 1.00 1.11 C ATOM 343 C MET A 23 11.458 1.785 7.115 1.00 1.41 C ATOM 344 O MET A 23 12.594 2.224 7.318 1.00 12.42 O ATOM 345 CB MET A 23 9.684 1.543 8.884 1.00 41.12 C ATOM 346 CG MET A 23 10.164 2.763 9.659 1.00 74.24 C ATOM 347 SD MET A 23 8.872 3.448 10.707 1.00 54.42 S ATOM 348 CE MET A 23 7.526 3.477 9.530 1.00 21.51 C ATOM 0 H MET A 23 11.898 0.829 9.902 1.00 64.35 H new ATOM 0 HA MET A 23 10.358 -0.001 7.549 1.00 1.11 H new ATOM 0 HB2 MET A 23 8.909 1.852 8.182 1.00 41.12 H new ATOM 0 HB3 MET A 23 9.223 0.841 9.579 1.00 41.12 H new ATOM 0 HG2 MET A 23 11.021 2.488 10.274 1.00 74.24 H new ATOM 0 HG3 MET A 23 10.505 3.526 8.959 1.00 74.24 H new ATOM 0 HE1 MET A 23 6.754 4.164 9.877 1.00 21.51 H new ATOM 0 HE2 MET A 23 7.898 3.808 8.560 1.00 21.51 H new ATOM 0 HE3 MET A 23 7.104 2.476 9.435 1.00 21.51 H new ATOM 358 N LEU A 24 10.747 2.122 6.043 1.00 25.14 N ATOM 359 CA LEU A 24 11.307 2.970 4.981 1.00 72.13 C ATOM 360 C LEU A 24 10.419 4.169 4.651 1.00 3.24 C ATOM 361 O LEU A 24 9.194 4.105 4.748 1.00 70.33 O ATOM 362 CB LEU A 24 11.523 2.137 3.712 1.00 61.02 C ATOM 363 CG LEU A 24 12.742 1.210 3.747 1.00 65.14 C ATOM 364 CD1 LEU A 24 12.638 0.151 2.661 1.00 21.43 C ATOM 365 CD2 LEU A 24 14.029 2.015 3.590 1.00 24.14 C ATOM 0 H LEU A 24 9.785 1.825 5.882 1.00 25.14 H new ATOM 0 HA LEU A 24 12.256 3.358 5.352 1.00 72.13 H new ATOM 0 HB2 LEU A 24 10.632 1.535 3.535 1.00 61.02 H new ATOM 0 HB3 LEU A 24 11.624 2.814 2.864 1.00 61.02 H new ATOM 0 HG LEU A 24 12.766 0.708 4.714 1.00 65.14 H new ATOM 0 HD11 LEU A 24 13.513 -0.498 2.701 1.00 21.43 H new ATOM 0 HD12 LEU A 24 11.738 -0.443 2.817 1.00 21.43 H new ATOM 0 HD13 LEU A 24 12.589 0.634 1.685 1.00 21.43 H new ATOM 0 HD21 LEU A 24 14.885 1.341 3.617 1.00 24.14 H new ATOM 0 HD22 LEU A 24 14.013 2.544 2.637 1.00 24.14 H new ATOM 0 HD23 LEU A 24 14.109 2.736 4.404 1.00 24.14 H new ATOM 377 N GLU A 25 11.062 5.260 4.255 1.00 32.42 N ATOM 378 CA GLU A 25 10.360 6.433 3.728 1.00 13.01 C ATOM 379 C GLU A 25 10.222 6.328 2.212 1.00 64.44 C ATOM 380 O GLU A 25 11.209 6.216 1.484 1.00 3.11 O ATOM 381 CB GLU A 25 11.086 7.726 4.110 1.00 40.23 C ATOM 382 CG GLU A 25 10.675 8.258 5.476 1.00 3.20 C ATOM 383 CD GLU A 25 11.549 9.407 5.956 1.00 32.42 C ATOM 384 OE1 GLU A 25 11.256 10.570 5.605 1.00 22.25 O ATOM 385 OE2 GLU A 25 12.537 9.154 6.679 1.00 14.33 O ATOM 0 H GLU A 25 12.076 5.361 4.288 1.00 32.42 H new ATOM 0 HA GLU A 25 9.365 6.462 4.171 1.00 13.01 H new ATOM 0 HB2 GLU A 25 12.161 7.548 4.104 1.00 40.23 H new ATOM 0 HB3 GLU A 25 10.885 8.486 3.355 1.00 40.23 H new ATOM 0 HG2 GLU A 25 9.638 8.591 5.433 1.00 3.20 H new ATOM 0 HG3 GLU A 25 10.719 7.447 6.203 1.00 3.20 H new ATOM 392 N VAL A 26 8.988 6.366 1.745 1.00 34.21 N ATOM 393 CA VAL A 26 8.688 6.145 0.326 1.00 2.22 C ATOM 394 C VAL A 26 7.663 7.149 -0.211 1.00 32.53 C ATOM 395 O VAL A 26 6.902 7.747 0.547 1.00 41.04 O ATOM 396 CB VAL A 26 8.153 4.708 0.081 1.00 44.24 C ATOM 397 CG1 VAL A 26 9.234 3.662 0.359 1.00 45.54 C ATOM 398 CG2 VAL A 26 6.912 4.449 0.935 1.00 73.31 C ATOM 0 H VAL A 26 8.168 6.548 2.323 1.00 34.21 H new ATOM 0 HA VAL A 26 9.628 6.284 -0.207 1.00 2.22 H new ATOM 0 HB VAL A 26 7.873 4.624 -0.969 1.00 44.24 H new ATOM 0 HG11 VAL A 26 8.831 2.665 0.179 1.00 45.54 H new ATOM 0 HG12 VAL A 26 10.085 3.834 -0.301 1.00 45.54 H new ATOM 0 HG13 VAL A 26 9.558 3.740 1.397 1.00 45.54 H new ATOM 0 HG21 VAL A 26 6.549 3.438 0.752 1.00 73.31 H new ATOM 0 HG22 VAL A 26 7.167 4.558 1.989 1.00 73.31 H new ATOM 0 HG23 VAL A 26 6.134 5.167 0.674 1.00 73.31 H new ATOM 408 N GLU A 27 7.661 7.340 -1.527 1.00 74.50 N ATOM 409 CA GLU A 27 6.630 8.152 -2.182 1.00 11.43 C ATOM 410 C GLU A 27 5.558 7.239 -2.806 1.00 65.54 C ATOM 411 O GLU A 27 5.840 6.465 -3.721 1.00 33.42 O ATOM 412 CB GLU A 27 7.251 9.072 -3.245 1.00 54.51 C ATOM 413 CG GLU A 27 6.276 10.107 -3.799 1.00 71.40 C ATOM 414 CD GLU A 27 6.937 11.121 -4.719 1.00 3.13 C ATOM 415 OE1 GLU A 27 7.993 11.669 -4.343 1.00 45.55 O ATOM 416 OE2 GLU A 27 6.396 11.394 -5.813 1.00 54.01 O ATOM 0 H GLU A 27 8.356 6.947 -2.162 1.00 74.50 H new ATOM 0 HA GLU A 27 6.156 8.784 -1.431 1.00 11.43 H new ATOM 0 HB2 GLU A 27 8.108 9.587 -2.812 1.00 54.51 H new ATOM 0 HB3 GLU A 27 7.627 8.462 -4.067 1.00 54.51 H new ATOM 0 HG2 GLU A 27 5.483 9.595 -4.344 1.00 71.40 H new ATOM 0 HG3 GLU A 27 5.804 10.633 -2.969 1.00 71.40 H new ATOM 423 N VAL A 28 4.338 7.333 -2.286 1.00 15.31 N ATOM 424 CA VAL A 28 3.234 6.445 -2.678 1.00 64.22 C ATOM 425 C VAL A 28 2.448 6.998 -3.876 1.00 62.54 C ATOM 426 O VAL A 28 1.813 8.051 -3.791 1.00 24.14 O ATOM 427 CB VAL A 28 2.260 6.234 -1.492 1.00 31.30 C ATOM 428 CG1 VAL A 28 1.140 5.266 -1.871 1.00 31.52 C ATOM 429 CG2 VAL A 28 3.015 5.752 -0.255 1.00 24.30 C ATOM 0 H VAL A 28 4.081 8.024 -1.581 1.00 15.31 H new ATOM 0 HA VAL A 28 3.681 5.494 -2.968 1.00 64.22 H new ATOM 0 HB VAL A 28 1.800 7.193 -1.252 1.00 31.30 H new ATOM 0 HG11 VAL A 28 0.470 5.135 -1.022 1.00 31.52 H new ATOM 0 HG12 VAL A 28 0.581 5.669 -2.715 1.00 31.52 H new ATOM 0 HG13 VAL A 28 1.569 4.303 -2.147 1.00 31.52 H new ATOM 0 HG21 VAL A 28 2.313 5.610 0.567 1.00 24.30 H new ATOM 0 HG22 VAL A 28 3.511 4.807 -0.477 1.00 24.30 H new ATOM 0 HG23 VAL A 28 3.760 6.495 0.029 1.00 24.30 H new ATOM 439 N ILE A 29 2.481 6.278 -4.991 1.00 15.31 N ATOM 440 CA ILE A 29 1.783 6.712 -6.205 1.00 54.51 C ATOM 441 C ILE A 29 0.471 5.939 -6.408 1.00 71.02 C ATOM 442 O ILE A 29 0.308 4.829 -5.909 1.00 42.41 O ATOM 443 CB ILE A 29 2.667 6.523 -7.465 1.00 42.02 C ATOM 444 CG1 ILE A 29 4.156 6.558 -7.088 1.00 23.42 C ATOM 445 CG2 ILE A 29 2.346 7.607 -8.498 1.00 51.21 C ATOM 446 CD1 ILE A 29 5.092 6.260 -8.238 1.00 50.22 C ATOM 0 H ILE A 29 2.980 5.394 -5.084 1.00 15.31 H new ATOM 0 HA ILE A 29 1.562 7.771 -6.071 1.00 54.51 H new ATOM 0 HB ILE A 29 2.450 5.549 -7.903 1.00 42.02 H new ATOM 0 HG12 ILE A 29 4.395 7.542 -6.685 1.00 23.42 H new ATOM 0 HG13 ILE A 29 4.335 5.836 -6.291 1.00 23.42 H new ATOM 0 HG21 ILE A 29 2.972 7.466 -9.379 1.00 51.21 H new ATOM 0 HG22 ILE A 29 1.296 7.538 -8.783 1.00 51.21 H new ATOM 0 HG23 ILE A 29 2.541 8.589 -8.067 1.00 51.21 H new ATOM 0 HD11 ILE A 29 6.123 6.305 -7.889 1.00 50.22 H new ATOM 0 HD12 ILE A 29 4.884 5.264 -8.628 1.00 50.22 H new ATOM 0 HD13 ILE A 29 4.944 6.997 -9.028 1.00 50.22 H new ATOM 458 N SER A 30 -0.459 6.533 -7.154 1.00 24.01 N ATOM 459 CA SER A 30 -1.722 5.862 -7.496 1.00 52.42 C ATOM 460 C SER A 30 -1.960 5.875 -9.010 1.00 43.31 C ATOM 461 O SER A 30 -2.325 6.898 -9.583 1.00 33.31 O ATOM 462 CB SER A 30 -2.903 6.518 -6.768 1.00 52.05 C ATOM 463 OG SER A 30 -2.816 6.321 -5.363 1.00 40.34 O ATOM 0 H SER A 30 -0.367 7.475 -7.534 1.00 24.01 H new ATOM 0 HA SER A 30 -1.645 4.825 -7.170 1.00 52.42 H new ATOM 0 HB2 SER A 30 -2.921 7.586 -6.987 1.00 52.05 H new ATOM 0 HB3 SER A 30 -3.839 6.101 -7.139 1.00 52.05 H new ATOM 0 HG SER A 30 -1.874 6.271 -5.097 1.00 40.34 H new ATOM 469 N GLY A 31 -1.746 4.727 -9.651 1.00 21.41 N ATOM 470 CA GLY A 31 -1.859 4.644 -11.106 1.00 53.04 C ATOM 471 C GLY A 31 -3.199 4.100 -11.583 1.00 2.21 C ATOM 472 O GLY A 31 -3.878 3.362 -10.865 1.00 25.21 O ATOM 0 H GLY A 31 -1.496 3.851 -9.192 1.00 21.41 H new ATOM 0 HA2 GLY A 31 -1.707 5.636 -11.531 1.00 53.04 H new ATOM 0 HA3 GLY A 31 -1.061 4.008 -11.488 1.00 53.04 H new ATOM 476 N ARG A 32 -3.561 4.444 -12.813 1.00 54.22 N ATOM 477 CA ARG A 32 -4.848 4.048 -13.394 1.00 75.03 C ATOM 478 C ARG A 32 -4.839 2.588 -13.883 1.00 71.12 C ATOM 479 O ARG A 32 -4.791 2.313 -15.083 1.00 45.34 O ATOM 480 CB ARG A 32 -5.223 5.009 -14.538 1.00 4.42 C ATOM 481 CG ARG A 32 -4.108 5.213 -15.563 1.00 52.40 C ATOM 482 CD ARG A 32 -4.448 6.283 -16.597 1.00 3.34 C ATOM 483 NE ARG A 32 -3.300 6.596 -17.446 1.00 0.21 N ATOM 484 CZ ARG A 32 -3.261 7.577 -18.311 1.00 2.43 C ATOM 485 NH1 ARG A 32 -4.289 8.350 -18.492 1.00 55.04 N ATOM 486 NH2 ARG A 32 -2.182 7.788 -18.996 1.00 71.51 N ATOM 0 H ARG A 32 -2.978 5.002 -13.437 1.00 54.22 H new ATOM 0 HA ARG A 32 -5.603 4.112 -12.611 1.00 75.03 H new ATOM 0 HB2 ARG A 32 -6.106 4.625 -15.048 1.00 4.42 H new ATOM 0 HB3 ARG A 32 -5.495 5.975 -14.114 1.00 4.42 H new ATOM 0 HG2 ARG A 32 -3.190 5.492 -15.045 1.00 52.40 H new ATOM 0 HG3 ARG A 32 -3.912 4.270 -16.073 1.00 52.40 H new ATOM 0 HD2 ARG A 32 -5.277 5.940 -17.217 1.00 3.34 H new ATOM 0 HD3 ARG A 32 -4.783 7.187 -16.089 1.00 3.34 H new ATOM 0 HE ARG A 32 -2.471 6.008 -17.358 1.00 0.21 H new ATOM 0 HH11 ARG A 32 -5.143 8.197 -17.956 1.00 55.04 H new ATOM 0 HH12 ARG A 32 -4.242 9.110 -19.170 1.00 55.04 H new ATOM 0 HH21 ARG A 32 -1.367 7.190 -18.860 1.00 71.51 H new ATOM 0 HH22 ARG A 32 -2.148 8.552 -19.671 1.00 71.51 H new ATOM 500 N THR A 33 -4.859 1.649 -12.938 1.00 20.54 N ATOM 501 CA THR A 33 -4.989 0.220 -13.262 1.00 72.11 C ATOM 502 C THR A 33 -6.439 -0.111 -13.627 1.00 2.41 C ATOM 503 O THR A 33 -6.709 -0.910 -14.526 1.00 53.35 O ATOM 504 CB THR A 33 -4.553 -0.678 -12.080 1.00 34.42 C ATOM 505 OG1 THR A 33 -5.344 -0.380 -10.918 1.00 73.20 O ATOM 506 CG2 THR A 33 -3.074 -0.482 -11.755 1.00 21.23 C ATOM 0 H THR A 33 -4.787 1.847 -11.940 1.00 20.54 H new ATOM 0 HA THR A 33 -4.334 0.021 -14.110 1.00 72.11 H new ATOM 0 HB THR A 33 -4.708 -1.717 -12.372 1.00 34.42 H new ATOM 0 HG1 THR A 33 -5.701 -1.212 -10.543 1.00 73.20 H new ATOM 0 HG21 THR A 33 -2.796 -1.126 -10.920 1.00 21.23 H new ATOM 0 HG22 THR A 33 -2.473 -0.739 -12.627 1.00 21.23 H new ATOM 0 HG23 THR A 33 -2.896 0.559 -11.485 1.00 21.23 H new ATOM 514 N LEU A 34 -7.365 0.503 -12.897 1.00 32.52 N ATOM 515 CA LEU A 34 -8.794 0.440 -13.216 1.00 23.04 C ATOM 516 C LEU A 34 -9.274 1.787 -13.781 1.00 32.30 C ATOM 517 O LEU A 34 -8.598 2.806 -13.637 1.00 62.55 O ATOM 518 CB LEU A 34 -9.608 0.081 -11.963 1.00 62.24 C ATOM 519 CG LEU A 34 -9.273 -1.278 -11.323 1.00 51.40 C ATOM 520 CD1 LEU A 34 -10.101 -1.499 -10.057 1.00 24.21 C ATOM 521 CD2 LEU A 34 -9.496 -2.416 -12.323 1.00 73.22 C ATOM 0 H LEU A 34 -7.150 1.058 -12.069 1.00 32.52 H new ATOM 0 HA LEU A 34 -8.944 -0.335 -13.968 1.00 23.04 H new ATOM 0 HB2 LEU A 34 -9.457 0.861 -11.217 1.00 62.24 H new ATOM 0 HB3 LEU A 34 -10.666 0.089 -12.224 1.00 62.24 H new ATOM 0 HG LEU A 34 -8.220 -1.272 -11.043 1.00 51.40 H new ATOM 0 HD11 LEU A 34 -9.848 -2.466 -9.621 1.00 24.21 H new ATOM 0 HD12 LEU A 34 -9.884 -0.709 -9.338 1.00 24.21 H new ATOM 0 HD13 LEU A 34 -11.162 -1.480 -10.308 1.00 24.21 H new ATOM 0 HD21 LEU A 34 -9.253 -3.368 -11.851 1.00 73.22 H new ATOM 0 HD22 LEU A 34 -10.539 -2.423 -12.639 1.00 73.22 H new ATOM 0 HD23 LEU A 34 -8.854 -2.268 -13.192 1.00 73.22 H new ATOM 533 N ASN A 35 -10.437 1.784 -14.426 1.00 35.21 N ATOM 534 CA ASN A 35 -11.013 3.012 -14.987 1.00 4.32 C ATOM 535 C ASN A 35 -11.403 4.016 -13.887 1.00 61.24 C ATOM 536 O ASN A 35 -12.339 3.785 -13.118 1.00 40.03 O ATOM 537 CB ASN A 35 -12.238 2.677 -15.856 1.00 60.14 C ATOM 538 CG ASN A 35 -12.965 3.922 -16.338 1.00 1.43 C ATOM 539 OD1 ASN A 35 -13.928 4.370 -15.724 1.00 21.51 O ATOM 540 ND2 ASN A 35 -12.504 4.500 -17.428 1.00 11.11 N ATOM 0 H ASN A 35 -11.002 0.948 -14.575 1.00 35.21 H new ATOM 0 HA ASN A 35 -10.248 3.480 -15.606 1.00 4.32 H new ATOM 0 HB2 ASN A 35 -11.919 2.089 -16.717 1.00 60.14 H new ATOM 0 HB3 ASN A 35 -12.927 2.056 -15.284 1.00 60.14 H new ATOM 0 HD21 ASN A 35 -12.950 5.345 -17.785 1.00 11.11 H new ATOM 0 HD22 ASN A 35 -11.701 4.102 -17.916 1.00 11.11 H new ATOM 547 N GLN A 36 -10.676 5.131 -13.811 1.00 42.44 N ATOM 548 CA GLN A 36 -11.018 6.203 -12.874 1.00 31.11 C ATOM 549 C GLN A 36 -12.291 6.928 -13.338 1.00 1.31 C ATOM 550 O GLN A 36 -12.279 7.683 -14.315 1.00 1.50 O ATOM 551 CB GLN A 36 -9.856 7.195 -12.735 1.00 41.45 C ATOM 552 CG GLN A 36 -8.556 6.556 -12.258 1.00 21.14 C ATOM 553 CD GLN A 36 -7.428 7.564 -12.119 1.00 35.21 C ATOM 554 OE1 GLN A 36 -7.217 8.142 -11.058 1.00 72.14 O ATOM 555 NE2 GLN A 36 -6.709 7.794 -13.198 1.00 1.34 N ATOM 0 H GLN A 36 -9.852 5.316 -14.383 1.00 42.44 H new ATOM 0 HA GLN A 36 -11.205 5.759 -11.896 1.00 31.11 H new ATOM 0 HB2 GLN A 36 -9.682 7.674 -13.698 1.00 41.45 H new ATOM 0 HB3 GLN A 36 -10.142 7.980 -12.035 1.00 41.45 H new ATOM 0 HG2 GLN A 36 -8.725 6.070 -11.297 1.00 21.14 H new ATOM 0 HG3 GLN A 36 -8.259 5.778 -12.961 1.00 21.14 H new ATOM 0 HE21 GLN A 36 -6.914 7.294 -14.063 1.00 1.34 H new ATOM 0 HE22 GLN A 36 -5.948 8.472 -13.168 1.00 1.34 H new ATOM 564 N GLY A 37 -13.390 6.668 -12.643 1.00 63.11 N ATOM 565 CA GLY A 37 -14.678 7.243 -13.007 1.00 33.23 C ATOM 566 C GLY A 37 -15.831 6.535 -12.312 1.00 15.35 C ATOM 567 O GLY A 37 -16.738 7.175 -11.776 1.00 23.12 O ATOM 0 H GLY A 37 -13.415 6.062 -11.823 1.00 63.11 H new ATOM 0 HA2 GLY A 37 -14.691 8.301 -12.745 1.00 33.23 H new ATOM 0 HA3 GLY A 37 -14.811 7.181 -14.087 1.00 33.23 H new ATOM 571 N ALA A 38 -15.790 5.204 -12.316 1.00 32.34 N ATOM 572 CA ALA A 38 -16.776 4.399 -11.594 1.00 64.43 C ATOM 573 C ALA A 38 -16.332 4.166 -10.145 1.00 64.20 C ATOM 574 O ALA A 38 -15.208 3.729 -9.894 1.00 63.22 O ATOM 575 CB ALA A 38 -17.001 3.064 -12.295 1.00 2.42 C ATOM 0 H ALA A 38 -15.084 4.659 -12.811 1.00 32.34 H new ATOM 0 HA ALA A 38 -17.717 4.950 -11.585 1.00 64.43 H new ATOM 0 HB1 ALA A 38 -17.738 2.482 -11.741 1.00 2.42 H new ATOM 0 HB2 ALA A 38 -17.365 3.241 -13.307 1.00 2.42 H new ATOM 0 HB3 ALA A 38 -16.061 2.513 -12.339 1.00 2.42 H new ATOM 581 N THR A 39 -17.210 4.471 -9.198 1.00 32.11 N ATOM 582 CA THR A 39 -16.915 4.250 -7.777 1.00 74.01 C ATOM 583 C THR A 39 -16.910 2.757 -7.443 1.00 1.42 C ATOM 584 O THR A 39 -17.448 1.941 -8.192 1.00 5.44 O ATOM 585 CB THR A 39 -17.942 4.956 -6.862 1.00 20.23 C ATOM 586 OG1 THR A 39 -19.258 4.429 -7.098 1.00 44.43 O ATOM 587 CG2 THR A 39 -17.938 6.463 -7.104 1.00 65.01 C ATOM 0 H THR A 39 -18.130 4.871 -9.381 1.00 32.11 H new ATOM 0 HA THR A 39 -15.927 4.673 -7.596 1.00 74.01 H new ATOM 0 HB THR A 39 -17.660 4.770 -5.826 1.00 20.23 H new ATOM 0 HG1 THR A 39 -19.901 4.881 -6.513 1.00 44.43 H new ATOM 0 HG21 THR A 39 -18.668 6.939 -6.449 1.00 65.01 H new ATOM 0 HG22 THR A 39 -16.946 6.863 -6.892 1.00 65.01 H new ATOM 0 HG23 THR A 39 -18.197 6.665 -8.143 1.00 65.01 H new ATOM 595 N VAL A 40 -16.303 2.397 -6.318 1.00 44.30 N ATOM 596 CA VAL A 40 -16.272 0.999 -5.888 1.00 14.24 C ATOM 597 C VAL A 40 -17.690 0.416 -5.752 1.00 31.43 C ATOM 598 O VAL A 40 -17.905 -0.764 -6.010 1.00 30.41 O ATOM 599 CB VAL A 40 -15.494 0.817 -4.561 1.00 1.42 C ATOM 600 CG1 VAL A 40 -16.144 1.598 -3.423 1.00 31.34 C ATOM 601 CG2 VAL A 40 -15.370 -0.663 -4.208 1.00 61.24 C ATOM 0 H VAL A 40 -15.829 3.046 -5.690 1.00 44.30 H new ATOM 0 HA VAL A 40 -15.745 0.449 -6.668 1.00 14.24 H new ATOM 0 HB VAL A 40 -14.491 1.220 -4.704 1.00 1.42 H new ATOM 0 HG11 VAL A 40 -15.573 1.448 -2.507 1.00 31.34 H new ATOM 0 HG12 VAL A 40 -16.159 2.659 -3.672 1.00 31.34 H new ATOM 0 HG13 VAL A 40 -17.165 1.245 -3.276 1.00 31.34 H new ATOM 0 HG21 VAL A 40 -14.820 -0.769 -3.273 1.00 61.24 H new ATOM 0 HG22 VAL A 40 -16.364 -1.095 -4.095 1.00 61.24 H new ATOM 0 HG23 VAL A 40 -14.836 -1.183 -5.003 1.00 61.24 H new ATOM 611 N GLU A 41 -18.657 1.253 -5.367 1.00 65.31 N ATOM 612 CA GLU A 41 -20.062 0.827 -5.304 1.00 5.25 C ATOM 613 C GLU A 41 -20.581 0.422 -6.698 1.00 31.32 C ATOM 614 O GLU A 41 -21.381 -0.511 -6.833 1.00 30.34 O ATOM 615 CB GLU A 41 -20.935 1.940 -4.708 1.00 24.22 C ATOM 616 CG GLU A 41 -22.407 1.561 -4.581 1.00 3.12 C ATOM 617 CD GLU A 41 -23.217 2.591 -3.810 1.00 62.25 C ATOM 618 OE1 GLU A 41 -23.371 3.723 -4.302 1.00 15.52 O ATOM 619 OE2 GLU A 41 -23.697 2.274 -2.700 1.00 24.51 O ATOM 0 H GLU A 41 -18.497 2.223 -5.096 1.00 65.31 H new ATOM 0 HA GLU A 41 -20.121 -0.047 -4.655 1.00 5.25 H new ATOM 0 HB2 GLU A 41 -20.550 2.204 -3.723 1.00 24.22 H new ATOM 0 HB3 GLU A 41 -20.850 2.830 -5.332 1.00 24.22 H new ATOM 0 HG2 GLU A 41 -22.834 1.442 -5.577 1.00 3.12 H new ATOM 0 HG3 GLU A 41 -22.487 0.595 -4.082 1.00 3.12 H new ATOM 626 N GLU A 42 -20.123 1.132 -7.727 1.00 41.33 N ATOM 627 CA GLU A 42 -20.403 0.767 -9.122 1.00 72.23 C ATOM 628 C GLU A 42 -19.750 -0.573 -9.493 1.00 14.44 C ATOM 629 O GLU A 42 -20.306 -1.360 -10.259 1.00 42.52 O ATOM 630 CB GLU A 42 -19.886 1.867 -10.067 1.00 75.13 C ATOM 631 CG GLU A 42 -20.845 3.034 -10.258 1.00 35.02 C ATOM 632 CD GLU A 42 -22.077 2.635 -11.050 1.00 33.21 C ATOM 633 OE1 GLU A 42 -21.919 2.156 -12.194 1.00 62.04 O ATOM 634 OE2 GLU A 42 -23.206 2.781 -10.537 1.00 71.10 O ATOM 0 H GLU A 42 -19.552 1.971 -7.624 1.00 41.33 H new ATOM 0 HA GLU A 42 -21.483 0.664 -9.229 1.00 72.23 H new ATOM 0 HB2 GLU A 42 -18.942 2.248 -9.679 1.00 75.13 H new ATOM 0 HB3 GLU A 42 -19.675 1.423 -11.040 1.00 75.13 H new ATOM 0 HG2 GLU A 42 -21.149 3.417 -9.284 1.00 35.02 H new ATOM 0 HG3 GLU A 42 -20.330 3.845 -10.773 1.00 35.02 H new ATOM 641 N LYS A 43 -18.567 -0.823 -8.936 1.00 51.14 N ATOM 642 CA LYS A 43 -17.749 -1.980 -9.317 1.00 54.33 C ATOM 643 C LYS A 43 -17.512 -2.945 -8.135 1.00 61.41 C ATOM 644 O LYS A 43 -16.426 -3.513 -7.998 1.00 60.40 O ATOM 645 CB LYS A 43 -16.407 -1.476 -9.867 1.00 63.14 C ATOM 646 CG LYS A 43 -16.553 -0.437 -10.978 1.00 12.45 C ATOM 647 CD LYS A 43 -15.213 0.170 -11.394 1.00 1.31 C ATOM 648 CE LYS A 43 -14.322 -0.825 -12.125 1.00 14.13 C ATOM 649 NZ LYS A 43 -14.942 -1.307 -13.388 1.00 65.20 N ATOM 0 H LYS A 43 -18.148 -0.237 -8.214 1.00 51.14 H new ATOM 0 HA LYS A 43 -18.287 -2.543 -10.080 1.00 54.33 H new ATOM 0 HB2 LYS A 43 -15.828 -1.044 -9.051 1.00 63.14 H new ATOM 0 HB3 LYS A 43 -15.838 -2.324 -10.247 1.00 63.14 H new ATOM 0 HG2 LYS A 43 -17.022 -0.901 -11.845 1.00 12.45 H new ATOM 0 HG3 LYS A 43 -17.219 0.358 -10.642 1.00 12.45 H new ATOM 0 HD2 LYS A 43 -15.393 1.032 -12.037 1.00 1.31 H new ATOM 0 HD3 LYS A 43 -14.693 0.535 -10.508 1.00 1.31 H new ATOM 0 HE2 LYS A 43 -13.363 -0.357 -12.348 1.00 14.13 H new ATOM 0 HE3 LYS A 43 -14.118 -1.675 -11.474 1.00 14.13 H new ATOM 0 HZ1 LYS A 43 -14.220 -1.772 -13.974 1.00 65.20 H new ATOM 0 HZ2 LYS A 43 -15.698 -1.986 -13.167 1.00 65.20 H new ATOM 0 HZ3 LYS A 43 -15.343 -0.500 -13.908 1.00 65.20 H new ATOM 663 N LEU A 44 -18.532 -3.146 -7.296 1.00 53.21 N ATOM 664 CA LEU A 44 -18.433 -4.090 -6.171 1.00 33.14 C ATOM 665 C LEU A 44 -18.295 -5.540 -6.661 1.00 62.30 C ATOM 666 O LEU A 44 -19.277 -6.282 -6.746 1.00 12.41 O ATOM 667 CB LEU A 44 -19.645 -3.966 -5.231 1.00 70.31 C ATOM 668 CG LEU A 44 -19.678 -2.706 -4.345 1.00 61.22 C ATOM 669 CD1 LEU A 44 -20.960 -2.655 -3.518 1.00 12.01 C ATOM 670 CD2 LEU A 44 -18.451 -2.656 -3.434 1.00 53.22 C ATOM 0 H LEU A 44 -19.432 -2.672 -7.371 1.00 53.21 H new ATOM 0 HA LEU A 44 -17.532 -3.829 -5.615 1.00 33.14 H new ATOM 0 HB2 LEU A 44 -20.553 -3.987 -5.834 1.00 70.31 H new ATOM 0 HB3 LEU A 44 -19.671 -4.843 -4.584 1.00 70.31 H new ATOM 0 HG LEU A 44 -19.659 -1.833 -4.998 1.00 61.22 H new ATOM 0 HD11 LEU A 44 -20.959 -1.756 -2.901 1.00 12.01 H new ATOM 0 HD12 LEU A 44 -21.822 -2.637 -4.184 1.00 12.01 H new ATOM 0 HD13 LEU A 44 -21.015 -3.535 -2.877 1.00 12.01 H new ATOM 0 HD21 LEU A 44 -18.493 -1.759 -2.816 1.00 53.22 H new ATOM 0 HD22 LEU A 44 -18.437 -3.538 -2.793 1.00 53.22 H new ATOM 0 HD23 LEU A 44 -17.547 -2.636 -4.042 1.00 53.22 H new ATOM 682 N THR A 45 -17.067 -5.919 -7.000 1.00 31.22 N ATOM 683 CA THR A 45 -16.753 -7.279 -7.459 1.00 5.23 C ATOM 684 C THR A 45 -15.386 -7.729 -6.932 1.00 62.33 C ATOM 685 O THR A 45 -14.566 -6.905 -6.518 1.00 11.24 O ATOM 686 CB THR A 45 -16.753 -7.376 -9.007 1.00 41.15 C ATOM 687 OG1 THR A 45 -16.294 -8.672 -9.428 1.00 34.41 O ATOM 688 CG2 THR A 45 -15.872 -6.297 -9.630 1.00 20.24 C ATOM 0 H THR A 45 -16.259 -5.298 -6.966 1.00 31.22 H new ATOM 0 HA THR A 45 -17.532 -7.933 -7.067 1.00 5.23 H new ATOM 0 HB THR A 45 -17.778 -7.225 -9.346 1.00 41.15 H new ATOM 0 HG1 THR A 45 -16.101 -8.655 -10.389 1.00 34.41 H new ATOM 0 HG21 THR A 45 -15.893 -6.392 -10.716 1.00 20.24 H new ATOM 0 HG22 THR A 45 -16.245 -5.313 -9.344 1.00 20.24 H new ATOM 0 HG23 THR A 45 -14.848 -6.414 -9.276 1.00 20.24 H new ATOM 696 N GLU A 46 -15.142 -9.039 -6.947 1.00 32.24 N ATOM 697 CA GLU A 46 -13.862 -9.589 -6.483 1.00 21.22 C ATOM 698 C GLU A 46 -12.710 -9.093 -7.371 1.00 42.31 C ATOM 699 O GLU A 46 -11.571 -8.945 -6.921 1.00 4.25 O ATOM 700 CB GLU A 46 -13.915 -11.127 -6.474 1.00 15.14 C ATOM 701 CG GLU A 46 -12.682 -11.799 -5.859 1.00 21.12 C ATOM 702 CD GLU A 46 -12.511 -11.547 -4.360 1.00 34.34 C ATOM 703 OE1 GLU A 46 -13.370 -10.875 -3.740 1.00 74.42 O ATOM 704 OE2 GLU A 46 -11.510 -12.037 -3.790 1.00 5.22 O ATOM 0 H GLU A 46 -15.808 -9.739 -7.273 1.00 32.24 H new ATOM 0 HA GLU A 46 -13.683 -9.243 -5.465 1.00 21.22 H new ATOM 0 HB2 GLU A 46 -14.800 -11.445 -5.923 1.00 15.14 H new ATOM 0 HB3 GLU A 46 -14.034 -11.480 -7.498 1.00 15.14 H new ATOM 0 HG2 GLU A 46 -12.745 -12.874 -6.030 1.00 21.12 H new ATOM 0 HG3 GLU A 46 -11.792 -11.445 -6.379 1.00 21.12 H new ATOM 711 N GLU A 47 -13.032 -8.820 -8.634 1.00 24.24 N ATOM 712 CA GLU A 47 -12.079 -8.236 -9.584 1.00 25.34 C ATOM 713 C GLU A 47 -11.491 -6.923 -9.041 1.00 61.23 C ATOM 714 O GLU A 47 -10.292 -6.665 -9.159 1.00 73.30 O ATOM 715 CB GLU A 47 -12.789 -7.968 -10.914 1.00 65.11 C ATOM 716 CG GLU A 47 -13.433 -9.203 -11.534 1.00 32.35 C ATOM 717 CD GLU A 47 -14.365 -8.853 -12.684 1.00 62.03 C ATOM 718 OE1 GLU A 47 -13.865 -8.545 -13.788 1.00 70.04 O ATOM 719 OE2 GLU A 47 -15.601 -8.876 -12.482 1.00 73.21 O ATOM 0 H GLU A 47 -13.956 -8.995 -9.029 1.00 24.24 H new ATOM 0 HA GLU A 47 -11.261 -8.942 -9.732 1.00 25.34 H new ATOM 0 HB2 GLU A 47 -13.557 -7.210 -10.758 1.00 65.11 H new ATOM 0 HB3 GLU A 47 -12.070 -7.552 -11.620 1.00 65.11 H new ATOM 0 HG2 GLU A 47 -12.653 -9.875 -11.893 1.00 32.35 H new ATOM 0 HG3 GLU A 47 -13.991 -9.742 -10.768 1.00 32.35 H new ATOM 726 N TYR A 48 -12.353 -6.104 -8.436 1.00 11.10 N ATOM 727 CA TYR A 48 -11.944 -4.814 -7.866 1.00 71.13 C ATOM 728 C TYR A 48 -10.963 -5.026 -6.700 1.00 61.43 C ATOM 729 O TYR A 48 -10.004 -4.273 -6.531 1.00 25.32 O ATOM 730 CB TYR A 48 -13.185 -4.044 -7.378 1.00 11.13 C ATOM 731 CG TYR A 48 -13.001 -2.534 -7.284 1.00 71.44 C ATOM 732 CD1 TYR A 48 -12.252 -1.950 -6.266 1.00 72.44 C ATOM 733 CD2 TYR A 48 -13.591 -1.689 -8.221 1.00 13.22 C ATOM 734 CE1 TYR A 48 -12.097 -0.577 -6.189 1.00 34.12 C ATOM 735 CE2 TYR A 48 -13.440 -0.317 -8.150 1.00 32.02 C ATOM 736 CZ TYR A 48 -12.693 0.234 -7.135 1.00 10.25 C ATOM 737 OH TYR A 48 -12.549 1.600 -7.057 1.00 21.45 O ATOM 0 H TYR A 48 -13.346 -6.311 -8.327 1.00 11.10 H new ATOM 0 HA TYR A 48 -11.441 -4.233 -8.639 1.00 71.13 H new ATOM 0 HB2 TYR A 48 -14.015 -4.254 -8.053 1.00 11.13 H new ATOM 0 HB3 TYR A 48 -13.469 -4.424 -6.396 1.00 11.13 H new ATOM 0 HD1 TYR A 48 -11.784 -2.579 -5.524 1.00 72.44 H new ATOM 0 HD2 TYR A 48 -14.179 -2.115 -9.020 1.00 13.22 H new ATOM 0 HE1 TYR A 48 -11.512 -0.141 -5.392 1.00 34.12 H new ATOM 0 HE2 TYR A 48 -13.906 0.319 -8.888 1.00 32.02 H new ATOM 0 HH TYR A 48 -13.029 2.023 -7.799 1.00 21.45 H new ATOM 747 N PHE A 49 -11.211 -6.071 -5.911 1.00 71.54 N ATOM 748 CA PHE A 49 -10.364 -6.413 -4.766 1.00 2.21 C ATOM 749 C PHE A 49 -8.939 -6.750 -5.226 1.00 54.31 C ATOM 750 O PHE A 49 -7.993 -6.004 -4.969 1.00 65.53 O ATOM 751 CB PHE A 49 -10.981 -7.606 -4.008 1.00 32.14 C ATOM 752 CG PHE A 49 -10.240 -8.014 -2.750 1.00 74.20 C ATOM 753 CD1 PHE A 49 -9.148 -8.871 -2.813 1.00 21.42 C ATOM 754 CD2 PHE A 49 -10.642 -7.545 -1.506 1.00 25.04 C ATOM 755 CE1 PHE A 49 -8.476 -9.249 -1.666 1.00 21.04 C ATOM 756 CE2 PHE A 49 -9.973 -7.921 -0.357 1.00 1.34 C ATOM 757 CZ PHE A 49 -8.889 -8.773 -0.438 1.00 33.23 C ATOM 0 H PHE A 49 -12.001 -6.702 -6.045 1.00 71.54 H new ATOM 0 HA PHE A 49 -10.308 -5.553 -4.098 1.00 2.21 H new ATOM 0 HB2 PHE A 49 -12.008 -7.357 -3.743 1.00 32.14 H new ATOM 0 HB3 PHE A 49 -11.024 -8.462 -4.681 1.00 32.14 H new ATOM 0 HD1 PHE A 49 -8.820 -9.247 -3.771 1.00 21.42 H new ATOM 0 HD2 PHE A 49 -11.488 -6.878 -1.436 1.00 25.04 H new ATOM 0 HE1 PHE A 49 -7.629 -9.916 -1.730 1.00 21.04 H new ATOM 0 HE2 PHE A 49 -10.297 -7.549 0.604 1.00 1.34 H new ATOM 0 HZ PHE A 49 -8.365 -9.067 0.459 1.00 33.23 H new ATOM 767 N ASN A 50 -8.809 -7.855 -5.951 1.00 52.25 N ATOM 768 CA ASN A 50 -7.500 -8.361 -6.377 1.00 25.41 C ATOM 769 C ASN A 50 -6.683 -7.316 -7.168 1.00 23.54 C ATOM 770 O ASN A 50 -5.456 -7.406 -7.242 1.00 3.13 O ATOM 771 CB ASN A 50 -7.692 -9.626 -7.220 1.00 54.22 C ATOM 772 CG ASN A 50 -8.425 -10.721 -6.459 1.00 34.03 C ATOM 773 OD1 ASN A 50 -8.291 -10.853 -5.247 1.00 14.32 O ATOM 774 ND2 ASN A 50 -9.211 -11.514 -7.159 1.00 61.42 N ATOM 0 H ASN A 50 -9.597 -8.424 -6.260 1.00 52.25 H new ATOM 0 HA ASN A 50 -6.930 -8.590 -5.477 1.00 25.41 H new ATOM 0 HB2 ASN A 50 -8.251 -9.377 -8.122 1.00 54.22 H new ATOM 0 HB3 ASN A 50 -6.719 -9.998 -7.540 1.00 54.22 H new ATOM 0 HD21 ASN A 50 -9.727 -12.261 -6.694 1.00 61.42 H new ATOM 0 HD22 ASN A 50 -9.303 -11.381 -8.166 1.00 61.42 H new ATOM 781 N ALA A 51 -7.364 -6.326 -7.743 1.00 43.34 N ATOM 782 CA ALA A 51 -6.708 -5.303 -8.568 1.00 3.02 C ATOM 783 C ALA A 51 -6.044 -4.193 -7.731 1.00 11.22 C ATOM 784 O ALA A 51 -4.988 -3.684 -8.101 1.00 30.21 O ATOM 785 CB ALA A 51 -7.716 -4.692 -9.536 1.00 44.13 C ATOM 0 H ALA A 51 -8.373 -6.207 -7.654 1.00 43.34 H new ATOM 0 HA ALA A 51 -5.912 -5.802 -9.121 1.00 3.02 H new ATOM 0 HB1 ALA A 51 -7.223 -3.934 -10.145 1.00 44.13 H new ATOM 0 HB2 ALA A 51 -8.118 -5.472 -10.183 1.00 44.13 H new ATOM 0 HB3 ALA A 51 -8.529 -4.233 -8.973 1.00 44.13 H new ATOM 791 N VAL A 52 -6.662 -3.811 -6.610 1.00 23.10 N ATOM 792 CA VAL A 52 -6.174 -2.668 -5.811 1.00 13.55 C ATOM 793 C VAL A 52 -5.717 -3.070 -4.395 1.00 23.15 C ATOM 794 O VAL A 52 -5.572 -2.216 -3.519 1.00 41.30 O ATOM 795 CB VAL A 52 -7.262 -1.568 -5.695 1.00 0.43 C ATOM 796 CG1 VAL A 52 -7.656 -1.044 -7.076 1.00 11.30 C ATOM 797 CG2 VAL A 52 -8.488 -2.085 -4.935 1.00 22.11 C ATOM 0 H VAL A 52 -7.493 -4.267 -6.233 1.00 23.10 H new ATOM 0 HA VAL A 52 -5.306 -2.283 -6.346 1.00 13.55 H new ATOM 0 HB VAL A 52 -6.842 -0.738 -5.127 1.00 0.43 H new ATOM 0 HG11 VAL A 52 -8.420 -0.274 -6.969 1.00 11.30 H new ATOM 0 HG12 VAL A 52 -6.780 -0.620 -7.568 1.00 11.30 H new ATOM 0 HG13 VAL A 52 -8.049 -1.864 -7.678 1.00 11.30 H new ATOM 0 HG21 VAL A 52 -9.235 -1.294 -4.868 1.00 22.11 H new ATOM 0 HG22 VAL A 52 -8.910 -2.939 -5.464 1.00 22.11 H new ATOM 0 HG23 VAL A 52 -8.192 -2.390 -3.931 1.00 22.11 H new ATOM 807 N ASN A 53 -5.466 -4.357 -4.178 1.00 30.52 N ATOM 808 CA ASN A 53 -5.082 -4.863 -2.848 1.00 62.22 C ATOM 809 C ASN A 53 -3.576 -5.150 -2.722 1.00 21.03 C ATOM 810 O ASN A 53 -3.165 -5.954 -1.887 1.00 63.41 O ATOM 811 CB ASN A 53 -5.892 -6.128 -2.525 1.00 0.35 C ATOM 812 CG ASN A 53 -7.182 -5.802 -1.801 1.00 11.11 C ATOM 813 OD1 ASN A 53 -7.324 -6.061 -0.612 1.00 2.03 O ATOM 814 ND2 ASN A 53 -8.116 -5.182 -2.495 1.00 72.33 N ATOM 0 H ASN A 53 -5.519 -5.075 -4.900 1.00 30.52 H new ATOM 0 HA ASN A 53 -5.308 -4.076 -2.128 1.00 62.22 H new ATOM 0 HB2 ASN A 53 -6.119 -6.660 -3.449 1.00 0.35 H new ATOM 0 HB3 ASN A 53 -5.290 -6.798 -1.911 1.00 0.35 H new ATOM 0 HD21 ASN A 53 -8.987 -4.904 -2.043 1.00 72.33 H new ATOM 0 HD22 ASN A 53 -7.967 -4.981 -3.484 1.00 72.33 H new ATOM 821 N TYR A 54 -2.749 -4.470 -3.512 1.00 72.33 N ATOM 822 CA TYR A 54 -1.297 -4.681 -3.442 1.00 61.44 C ATOM 823 C TYR A 54 -0.502 -3.403 -3.753 1.00 4.14 C ATOM 824 O TYR A 54 -1.035 -2.438 -4.303 1.00 2.21 O ATOM 825 CB TYR A 54 -0.866 -5.805 -4.395 1.00 34.15 C ATOM 826 CG TYR A 54 -1.001 -5.465 -5.870 1.00 74.13 C ATOM 827 CD1 TYR A 54 -2.185 -5.704 -6.556 1.00 3.21 C ATOM 828 CD2 TYR A 54 0.060 -4.901 -6.572 1.00 74.53 C ATOM 829 CE1 TYR A 54 -2.306 -5.398 -7.899 1.00 12.40 C ATOM 830 CE2 TYR A 54 -0.055 -4.592 -7.912 1.00 0.53 C ATOM 831 CZ TYR A 54 -1.240 -4.836 -8.570 1.00 40.45 C ATOM 832 OH TYR A 54 -1.355 -4.528 -9.907 1.00 11.15 O ATOM 0 H TYR A 54 -3.048 -3.778 -4.199 1.00 72.33 H new ATOM 0 HA TYR A 54 -1.072 -4.968 -2.415 1.00 61.44 H new ATOM 0 HB2 TYR A 54 0.173 -6.062 -4.188 1.00 34.15 H new ATOM 0 HB3 TYR A 54 -1.462 -6.693 -4.183 1.00 34.15 H new ATOM 0 HD1 TYR A 54 -3.025 -6.136 -6.032 1.00 3.21 H new ATOM 0 HD2 TYR A 54 0.989 -4.702 -6.059 1.00 74.53 H new ATOM 0 HE1 TYR A 54 -3.231 -5.598 -8.420 1.00 12.40 H new ATOM 0 HE2 TYR A 54 0.781 -4.161 -8.443 1.00 0.53 H new ATOM 0 HH TYR A 54 -0.514 -4.138 -10.226 1.00 11.15 H new ATOM 842 N ALA A 55 0.782 -3.418 -3.399 1.00 40.22 N ATOM 843 CA ALA A 55 1.701 -2.315 -3.705 1.00 64.42 C ATOM 844 C ALA A 55 2.980 -2.837 -4.377 1.00 0.24 C ATOM 845 O ALA A 55 3.560 -3.826 -3.926 1.00 13.24 O ATOM 846 CB ALA A 55 2.045 -1.556 -2.426 1.00 44.22 C ATOM 0 H ALA A 55 1.216 -4.190 -2.894 1.00 40.22 H new ATOM 0 HA ALA A 55 1.208 -1.636 -4.401 1.00 64.42 H new ATOM 0 HB1 ALA A 55 2.727 -0.739 -2.660 1.00 44.22 H new ATOM 0 HB2 ALA A 55 1.133 -1.152 -1.986 1.00 44.22 H new ATOM 0 HB3 ALA A 55 2.521 -2.234 -1.717 1.00 44.22 H new ATOM 852 N GLU A 56 3.407 -2.182 -5.457 1.00 50.04 N ATOM 853 CA GLU A 56 4.640 -2.566 -6.159 1.00 21.22 C ATOM 854 C GLU A 56 5.859 -1.845 -5.562 1.00 24.24 C ATOM 855 O GLU A 56 5.922 -0.613 -5.531 1.00 51.25 O ATOM 856 CB GLU A 56 4.531 -2.275 -7.663 1.00 12.11 C ATOM 857 CG GLU A 56 3.372 -2.998 -8.346 1.00 72.22 C ATOM 858 CD GLU A 56 3.484 -3.006 -9.864 1.00 60.54 C ATOM 859 OE1 GLU A 56 3.382 -1.928 -10.483 1.00 1.32 O ATOM 860 OE2 GLU A 56 3.680 -4.095 -10.447 1.00 3.02 O ATOM 0 H GLU A 56 2.921 -1.384 -5.867 1.00 50.04 H new ATOM 0 HA GLU A 56 4.776 -3.639 -6.027 1.00 21.22 H new ATOM 0 HB2 GLU A 56 4.414 -1.201 -7.809 1.00 12.11 H new ATOM 0 HB3 GLU A 56 5.464 -2.563 -8.148 1.00 12.11 H new ATOM 0 HG2 GLU A 56 3.330 -4.026 -7.985 1.00 72.22 H new ATOM 0 HG3 GLU A 56 2.435 -2.521 -8.059 1.00 72.22 H new ATOM 867 N ILE A 57 6.827 -2.635 -5.101 1.00 23.55 N ATOM 868 CA ILE A 57 7.975 -2.130 -4.342 1.00 71.55 C ATOM 869 C ILE A 57 9.308 -2.404 -5.070 1.00 41.14 C ATOM 870 O ILE A 57 9.433 -3.390 -5.805 1.00 25.13 O ATOM 871 CB ILE A 57 8.002 -2.809 -2.949 1.00 63.21 C ATOM 872 CG1 ILE A 57 6.624 -2.667 -2.277 1.00 43.21 C ATOM 873 CG2 ILE A 57 9.100 -2.213 -2.067 1.00 21.41 C ATOM 874 CD1 ILE A 57 6.427 -3.575 -1.086 1.00 70.41 C ATOM 0 H ILE A 57 6.840 -3.645 -5.242 1.00 23.55 H new ATOM 0 HA ILE A 57 7.865 -1.050 -4.240 1.00 71.55 H new ATOM 0 HB ILE A 57 8.226 -3.868 -3.081 1.00 63.21 H new ATOM 0 HG12 ILE A 57 6.491 -1.633 -1.959 1.00 43.21 H new ATOM 0 HG13 ILE A 57 5.848 -2.877 -3.013 1.00 43.21 H new ATOM 0 HG21 ILE A 57 9.096 -2.708 -1.096 1.00 21.41 H new ATOM 0 HG22 ILE A 57 10.069 -2.359 -2.544 1.00 21.41 H new ATOM 0 HG23 ILE A 57 8.919 -1.147 -1.931 1.00 21.41 H new ATOM 0 HD11 ILE A 57 5.433 -3.416 -0.668 1.00 70.41 H new ATOM 0 HD12 ILE A 57 6.527 -4.614 -1.400 1.00 70.41 H new ATOM 0 HD13 ILE A 57 7.179 -3.351 -0.329 1.00 70.41 H new ATOM 886 N ASN A 58 10.296 -1.529 -4.866 1.00 51.54 N ATOM 887 CA ASN A 58 11.633 -1.714 -5.447 1.00 43.13 C ATOM 888 C ASN A 58 12.395 -2.850 -4.739 1.00 0.33 C ATOM 889 O ASN A 58 12.136 -3.148 -3.574 1.00 41.34 O ATOM 890 CB ASN A 58 12.430 -0.405 -5.352 1.00 54.22 C ATOM 891 CG ASN A 58 13.825 -0.513 -5.951 1.00 34.21 C ATOM 892 OD1 ASN A 58 14.782 -0.862 -5.272 1.00 13.51 O ATOM 893 ND2 ASN A 58 13.956 -0.216 -7.228 1.00 10.34 N ATOM 0 H ASN A 58 10.198 -0.684 -4.303 1.00 51.54 H new ATOM 0 HA ASN A 58 11.514 -1.989 -6.495 1.00 43.13 H new ATOM 0 HB2 ASN A 58 11.881 0.386 -5.863 1.00 54.22 H new ATOM 0 HB3 ASN A 58 12.512 -0.111 -4.306 1.00 54.22 H new ATOM 0 HD21 ASN A 58 14.872 -0.274 -7.674 1.00 10.34 H new ATOM 0 HD22 ASN A 58 13.142 0.072 -7.771 1.00 10.34 H new ATOM 900 N GLU A 59 13.339 -3.476 -5.447 1.00 75.44 N ATOM 901 CA GLU A 59 14.129 -4.587 -4.891 1.00 11.10 C ATOM 902 C GLU A 59 14.855 -4.178 -3.595 1.00 21.35 C ATOM 903 O GLU A 59 14.835 -4.907 -2.599 1.00 60.12 O ATOM 904 CB GLU A 59 15.151 -5.073 -5.927 1.00 64.23 C ATOM 905 CG GLU A 59 15.896 -6.348 -5.532 1.00 5.20 C ATOM 906 CD GLU A 59 15.002 -7.583 -5.521 1.00 51.31 C ATOM 907 OE1 GLU A 59 14.644 -8.073 -6.611 1.00 60.02 O ATOM 908 OE2 GLU A 59 14.644 -8.069 -4.427 1.00 13.00 O ATOM 0 H GLU A 59 13.578 -3.234 -6.409 1.00 75.44 H new ATOM 0 HA GLU A 59 13.439 -5.395 -4.648 1.00 11.10 H new ATOM 0 HB2 GLU A 59 14.637 -5.246 -6.873 1.00 64.23 H new ATOM 0 HB3 GLU A 59 15.879 -4.281 -6.100 1.00 64.23 H new ATOM 0 HG2 GLU A 59 16.721 -6.510 -6.226 1.00 5.20 H new ATOM 0 HG3 GLU A 59 16.334 -6.215 -4.543 1.00 5.20 H new ATOM 915 N GLU A 60 15.491 -3.010 -3.617 1.00 72.53 N ATOM 916 CA GLU A 60 16.199 -2.472 -2.449 1.00 71.10 C ATOM 917 C GLU A 60 15.269 -2.345 -1.234 1.00 30.04 C ATOM 918 O GLU A 60 15.544 -2.893 -0.163 1.00 71.12 O ATOM 919 CB GLU A 60 16.792 -1.101 -2.796 1.00 53.22 C ATOM 920 CG GLU A 60 17.958 -1.154 -3.779 1.00 10.22 C ATOM 921 CD GLU A 60 19.235 -1.666 -3.136 1.00 4.21 C ATOM 922 OE1 GLU A 60 19.871 -0.890 -2.392 1.00 12.42 O ATOM 923 OE2 GLU A 60 19.601 -2.842 -3.354 1.00 1.35 O ATOM 0 H GLU A 60 15.533 -2.408 -4.440 1.00 72.53 H new ATOM 0 HA GLU A 60 16.997 -3.166 -2.187 1.00 71.10 H new ATOM 0 HB2 GLU A 60 16.006 -0.473 -3.216 1.00 53.22 H new ATOM 0 HB3 GLU A 60 17.128 -0.620 -1.877 1.00 53.22 H new ATOM 0 HG2 GLU A 60 17.693 -1.798 -4.618 1.00 10.22 H new ATOM 0 HG3 GLU A 60 18.133 -0.158 -4.185 1.00 10.22 H new ATOM 930 N ASP A 61 14.166 -1.624 -1.413 1.00 22.23 N ATOM 931 CA ASP A 61 13.189 -1.423 -0.342 1.00 63.24 C ATOM 932 C ASP A 61 12.585 -2.763 0.112 1.00 50.11 C ATOM 933 O ASP A 61 12.326 -2.978 1.298 1.00 12.41 O ATOM 934 CB ASP A 61 12.085 -0.471 -0.816 1.00 64.52 C ATOM 935 CG ASP A 61 12.636 0.879 -1.251 1.00 13.40 C ATOM 936 OD1 ASP A 61 13.145 0.976 -2.385 1.00 44.13 O ATOM 937 OD2 ASP A 61 12.587 1.842 -0.455 1.00 32.13 O ATOM 0 H ASP A 61 13.924 -1.167 -2.292 1.00 22.23 H new ATOM 0 HA ASP A 61 13.699 -0.979 0.513 1.00 63.24 H new ATOM 0 HB2 ASP A 61 11.547 -0.927 -1.647 1.00 64.52 H new ATOM 0 HB3 ASP A 61 11.364 -0.325 -0.012 1.00 64.52 H new ATOM 942 N TRP A 62 12.389 -3.663 -0.848 1.00 12.01 N ATOM 943 CA TRP A 62 11.860 -5.005 -0.583 1.00 64.12 C ATOM 944 C TRP A 62 12.719 -5.764 0.444 1.00 23.13 C ATOM 945 O TRP A 62 12.211 -6.260 1.454 1.00 43.22 O ATOM 946 CB TRP A 62 11.799 -5.789 -1.902 1.00 15.32 C ATOM 947 CG TRP A 62 11.216 -7.164 -1.774 1.00 63.20 C ATOM 948 CD1 TRP A 62 11.886 -8.318 -1.485 1.00 3.31 C ATOM 949 CD2 TRP A 62 9.844 -7.527 -1.938 1.00 10.15 C ATOM 950 NE1 TRP A 62 11.011 -9.373 -1.453 1.00 24.02 N ATOM 951 CE2 TRP A 62 9.753 -8.914 -1.732 1.00 62.42 C ATOM 952 CE3 TRP A 62 8.682 -6.812 -2.240 1.00 74.22 C ATOM 953 CZ2 TRP A 62 8.548 -9.600 -1.816 1.00 51.35 C ATOM 954 CZ3 TRP A 62 7.486 -7.496 -2.322 1.00 11.11 C ATOM 955 CH2 TRP A 62 7.426 -8.878 -2.111 1.00 34.01 C ATOM 0 H TRP A 62 12.591 -3.486 -1.832 1.00 12.01 H new ATOM 0 HA TRP A 62 10.861 -4.904 -0.160 1.00 64.12 H new ATOM 0 HB2 TRP A 62 11.208 -5.222 -2.622 1.00 15.32 H new ATOM 0 HB3 TRP A 62 12.806 -5.870 -2.310 1.00 15.32 H new ATOM 0 HD1 TRP A 62 12.949 -8.389 -1.308 1.00 3.31 H new ATOM 0 HE1 TRP A 62 11.258 -10.342 -1.254 1.00 24.02 H new ATOM 0 HE3 TRP A 62 8.719 -5.745 -2.406 1.00 74.22 H new ATOM 0 HZ2 TRP A 62 8.500 -10.667 -1.654 1.00 51.35 H new ATOM 0 HZ3 TRP A 62 6.580 -6.955 -2.553 1.00 11.11 H new ATOM 0 HH2 TRP A 62 6.474 -9.384 -2.183 1.00 34.01 H new ATOM 966 N ASN A 63 14.021 -5.855 0.179 1.00 22.23 N ATOM 967 CA ASN A 63 14.942 -6.555 1.083 1.00 61.11 C ATOM 968 C ASN A 63 15.225 -5.745 2.358 1.00 45.33 C ATOM 969 O ASN A 63 15.505 -6.316 3.412 1.00 44.30 O ATOM 970 CB ASN A 63 16.248 -6.892 0.361 1.00 21.03 C ATOM 971 CG ASN A 63 16.024 -7.867 -0.778 1.00 43.14 C ATOM 972 OD1 ASN A 63 16.012 -9.079 -0.583 1.00 14.14 O ATOM 973 ND2 ASN A 63 15.851 -7.352 -1.973 1.00 72.03 N ATOM 0 H ASN A 63 14.464 -5.456 -0.649 1.00 22.23 H new ATOM 0 HA ASN A 63 14.456 -7.482 1.388 1.00 61.11 H new ATOM 0 HB2 ASN A 63 16.696 -5.977 -0.026 1.00 21.03 H new ATOM 0 HB3 ASN A 63 16.957 -7.318 1.071 1.00 21.03 H new ATOM 0 HD21 ASN A 63 15.701 -7.964 -2.775 1.00 72.03 H new ATOM 0 HD22 ASN A 63 15.867 -6.340 -2.099 1.00 72.03 H new ATOM 980 N ALA A 64 15.148 -4.420 2.262 1.00 63.15 N ATOM 981 CA ALA A 64 15.332 -3.552 3.433 1.00 24.15 C ATOM 982 C ALA A 64 14.240 -3.793 4.489 1.00 35.42 C ATOM 983 O ALA A 64 14.476 -3.652 5.690 1.00 14.35 O ATOM 984 CB ALA A 64 15.344 -2.091 3.005 1.00 63.30 C ATOM 0 H ALA A 64 14.961 -3.921 1.392 1.00 63.15 H new ATOM 0 HA ALA A 64 16.292 -3.798 3.887 1.00 24.15 H new ATOM 0 HB1 ALA A 64 15.481 -1.456 3.881 1.00 63.30 H new ATOM 0 HB2 ALA A 64 16.162 -1.924 2.304 1.00 63.30 H new ATOM 0 HB3 ALA A 64 14.398 -1.845 2.523 1.00 63.30 H new ATOM 990 N LEU A 65 13.041 -4.143 4.025 1.00 4.41 N ATOM 991 CA LEU A 65 11.917 -4.487 4.909 1.00 71.35 C ATOM 992 C LEU A 65 11.870 -5.999 5.208 1.00 53.34 C ATOM 993 O LEU A 65 11.045 -6.459 6.000 1.00 21.25 O ATOM 994 CB LEU A 65 10.597 -4.051 4.255 1.00 63.21 C ATOM 995 CG LEU A 65 10.475 -2.547 3.951 1.00 63.12 C ATOM 996 CD1 LEU A 65 9.227 -2.260 3.121 1.00 65.21 C ATOM 997 CD2 LEU A 65 10.458 -1.732 5.242 1.00 71.12 C ATOM 0 H LEU A 65 12.817 -4.197 3.031 1.00 4.41 H new ATOM 0 HA LEU A 65 12.059 -3.962 5.854 1.00 71.35 H new ATOM 0 HB2 LEU A 65 10.473 -4.604 3.324 1.00 63.21 H new ATOM 0 HB3 LEU A 65 9.774 -4.340 4.909 1.00 63.21 H new ATOM 0 HG LEU A 65 11.348 -2.250 3.370 1.00 63.12 H new ATOM 0 HD11 LEU A 65 9.162 -1.191 2.919 1.00 65.21 H new ATOM 0 HD12 LEU A 65 9.284 -2.805 2.179 1.00 65.21 H new ATOM 0 HD13 LEU A 65 8.342 -2.579 3.672 1.00 65.21 H new ATOM 0 HD21 LEU A 65 10.371 -0.672 5.002 1.00 71.12 H new ATOM 0 HD22 LEU A 65 9.608 -2.036 5.853 1.00 71.12 H new ATOM 0 HD23 LEU A 65 11.382 -1.905 5.793 1.00 71.12 H new ATOM 1009 N GLY A 66 12.760 -6.762 4.565 1.00 1.12 N ATOM 1010 CA GLY A 66 12.770 -8.217 4.719 1.00 21.35 C ATOM 1011 C GLY A 66 11.469 -8.870 4.260 1.00 60.03 C ATOM 1012 O GLY A 66 10.912 -9.729 4.947 1.00 52.05 O ATOM 0 H GLY A 66 13.477 -6.398 3.938 1.00 1.12 H new ATOM 0 HA2 GLY A 66 13.601 -8.632 4.148 1.00 21.35 H new ATOM 0 HA3 GLY A 66 12.946 -8.466 5.765 1.00 21.35 H new ATOM 1016 N LEU A 67 10.986 -8.465 3.092 1.00 64.21 N ATOM 1017 CA LEU A 67 9.696 -8.936 2.577 1.00 24.33 C ATOM 1018 C LEU A 67 9.791 -10.268 1.818 1.00 21.42 C ATOM 1019 O LEU A 67 10.849 -10.658 1.318 1.00 44.31 O ATOM 1020 CB LEU A 67 9.081 -7.869 1.665 1.00 3.14 C ATOM 1021 CG LEU A 67 8.643 -6.582 2.379 1.00 54.40 C ATOM 1022 CD1 LEU A 67 8.201 -5.530 1.368 1.00 23.32 C ATOM 1023 CD2 LEU A 67 7.525 -6.878 3.376 1.00 73.04 C ATOM 0 H LEU A 67 11.467 -7.808 2.477 1.00 64.21 H new ATOM 0 HA LEU A 67 9.061 -9.113 3.445 1.00 24.33 H new ATOM 0 HB2 LEU A 67 9.806 -7.610 0.893 1.00 3.14 H new ATOM 0 HB3 LEU A 67 8.216 -8.299 1.159 1.00 3.14 H new ATOM 0 HG LEU A 67 9.496 -6.186 2.929 1.00 54.40 H new ATOM 0 HD11 LEU A 67 7.895 -4.626 1.894 1.00 23.32 H new ATOM 0 HD12 LEU A 67 9.030 -5.297 0.699 1.00 23.32 H new ATOM 0 HD13 LEU A 67 7.362 -5.914 0.787 1.00 23.32 H new ATOM 0 HD21 LEU A 67 7.227 -5.955 3.873 1.00 73.04 H new ATOM 0 HD22 LEU A 67 6.669 -7.299 2.848 1.00 73.04 H new ATOM 0 HD23 LEU A 67 7.880 -7.592 4.119 1.00 73.04 H new ATOM 1035 N GLN A 68 8.659 -10.958 1.769 1.00 72.12 N ATOM 1036 CA GLN A 68 8.481 -12.181 0.984 1.00 50.14 C ATOM 1037 C GLN A 68 7.230 -12.031 0.099 1.00 62.31 C ATOM 1038 O GLN A 68 6.259 -11.386 0.499 1.00 71.33 O ATOM 1039 CB GLN A 68 8.335 -13.382 1.933 1.00 42.41 C ATOM 1040 CG GLN A 68 8.024 -14.704 1.239 1.00 0.54 C ATOM 1041 CD GLN A 68 7.804 -15.848 2.219 1.00 42.32 C ATOM 1042 OE1 GLN A 68 8.384 -15.887 3.302 1.00 0.40 O ATOM 1043 NE2 GLN A 68 6.961 -16.789 1.849 1.00 45.33 N ATOM 0 H GLN A 68 7.821 -10.682 2.281 1.00 72.12 H new ATOM 0 HA GLN A 68 9.348 -12.348 0.345 1.00 50.14 H new ATOM 0 HB2 GLN A 68 9.258 -13.493 2.502 1.00 42.41 H new ATOM 0 HB3 GLN A 68 7.543 -13.168 2.650 1.00 42.41 H new ATOM 0 HG2 GLN A 68 7.134 -14.584 0.622 1.00 0.54 H new ATOM 0 HG3 GLN A 68 8.845 -14.959 0.569 1.00 0.54 H new ATOM 0 HE21 GLN A 68 6.495 -16.729 0.944 1.00 45.33 H new ATOM 0 HE22 GLN A 68 6.774 -17.578 2.468 1.00 45.33 H new ATOM 1052 N GLU A 69 7.254 -12.602 -1.103 1.00 41.31 N ATOM 1053 CA GLU A 69 6.142 -12.446 -2.048 1.00 31.24 C ATOM 1054 C GLU A 69 4.835 -13.032 -1.495 1.00 51.24 C ATOM 1055 O GLU A 69 4.610 -14.243 -1.525 1.00 65.04 O ATOM 1056 CB GLU A 69 6.501 -13.075 -3.398 1.00 34.53 C ATOM 1057 CG GLU A 69 7.548 -12.274 -4.164 1.00 10.31 C ATOM 1058 CD GLU A 69 8.142 -13.021 -5.349 1.00 13.01 C ATOM 1059 OE1 GLU A 69 7.436 -13.858 -5.958 1.00 22.44 O ATOM 1060 OE2 GLU A 69 9.319 -12.772 -5.676 1.00 52.34 O ATOM 0 H GLU A 69 8.025 -13.174 -1.448 1.00 41.31 H new ATOM 0 HA GLU A 69 5.975 -11.379 -2.194 1.00 31.24 H new ATOM 0 HB2 GLU A 69 6.872 -14.087 -3.235 1.00 34.53 H new ATOM 0 HB3 GLU A 69 5.600 -13.160 -4.005 1.00 34.53 H new ATOM 0 HG2 GLU A 69 7.096 -11.348 -4.519 1.00 10.31 H new ATOM 0 HG3 GLU A 69 8.351 -11.996 -3.481 1.00 10.31 H new ATOM 1067 N GLY A 70 3.981 -12.147 -0.988 1.00 23.04 N ATOM 1068 CA GLY A 70 2.729 -12.563 -0.359 1.00 65.33 C ATOM 1069 C GLY A 70 2.553 -12.009 1.056 1.00 14.31 C ATOM 1070 O GLY A 70 1.506 -12.201 1.678 1.00 24.22 O ATOM 0 H GLY A 70 4.132 -11.138 -1.000 1.00 23.04 H new ATOM 0 HA2 GLY A 70 1.893 -12.236 -0.977 1.00 65.33 H new ATOM 0 HA3 GLY A 70 2.692 -13.652 -0.323 1.00 65.33 H new ATOM 1074 N ASP A 71 3.586 -11.342 1.577 1.00 34.35 N ATOM 1075 CA ASP A 71 3.517 -10.714 2.905 1.00 70.41 C ATOM 1076 C ASP A 71 2.544 -9.521 2.931 1.00 4.14 C ATOM 1077 O ASP A 71 2.236 -8.921 1.898 1.00 0.32 O ATOM 1078 CB ASP A 71 4.909 -10.242 3.358 1.00 33.22 C ATOM 1079 CG ASP A 71 5.849 -11.378 3.738 1.00 42.35 C ATOM 1080 OD1 ASP A 71 5.414 -12.549 3.762 1.00 21.55 O ATOM 1081 OD2 ASP A 71 7.034 -11.092 4.028 1.00 60.13 O ATOM 0 H ASP A 71 4.481 -11.221 1.102 1.00 34.35 H new ATOM 0 HA ASP A 71 3.145 -11.474 3.592 1.00 70.41 H new ATOM 0 HB2 ASP A 71 5.363 -9.659 2.557 1.00 33.22 H new ATOM 0 HB3 ASP A 71 4.796 -9.575 4.213 1.00 33.22 H new ATOM 1086 N ARG A 72 2.081 -9.178 4.129 1.00 54.22 N ATOM 1087 CA ARG A 72 1.167 -8.049 4.320 1.00 61.12 C ATOM 1088 C ARG A 72 1.922 -6.827 4.866 1.00 33.11 C ATOM 1089 O ARG A 72 2.637 -6.919 5.865 1.00 65.23 O ATOM 1090 CB ARG A 72 0.039 -8.452 5.278 1.00 3.11 C ATOM 1091 CG ARG A 72 -0.739 -9.682 4.813 1.00 61.13 C ATOM 1092 CD ARG A 72 -1.728 -10.170 5.868 1.00 64.10 C ATOM 1093 NE ARG A 72 -1.073 -10.430 7.150 1.00 3.31 N ATOM 1094 CZ ARG A 72 -0.400 -11.515 7.431 1.00 50.44 C ATOM 1095 NH1 ARG A 72 -0.344 -12.497 6.584 1.00 34.04 N ATOM 1096 NH2 ARG A 72 0.195 -11.628 8.575 1.00 1.41 N ATOM 0 H ARG A 72 2.324 -9.668 4.990 1.00 54.22 H new ATOM 0 HA ARG A 72 0.736 -7.779 3.356 1.00 61.12 H new ATOM 0 HB2 ARG A 72 0.462 -8.649 6.263 1.00 3.11 H new ATOM 0 HB3 ARG A 72 -0.651 -7.615 5.389 1.00 3.11 H new ATOM 0 HG2 ARG A 72 -1.277 -9.444 3.895 1.00 61.13 H new ATOM 0 HG3 ARG A 72 -0.040 -10.483 4.574 1.00 61.13 H new ATOM 0 HD2 ARG A 72 -2.511 -9.424 6.005 1.00 64.10 H new ATOM 0 HD3 ARG A 72 -2.214 -11.081 5.517 1.00 64.10 H new ATOM 0 HE ARG A 72 -1.146 -9.716 7.874 1.00 3.31 H new ATOM 0 HH11 ARG A 72 -0.828 -12.427 5.689 1.00 34.04 H new ATOM 0 HH12 ARG A 72 0.184 -13.339 6.814 1.00 34.04 H new ATOM 0 HH21 ARG A 72 0.138 -10.871 9.256 1.00 1.41 H new ATOM 0 HH22 ARG A 72 0.720 -12.474 8.795 1.00 1.41 H new ATOM 1110 N VAL A 73 1.767 -5.684 4.201 1.00 3.24 N ATOM 1111 CA VAL A 73 2.471 -4.454 4.591 1.00 24.11 C ATOM 1112 C VAL A 73 1.502 -3.300 4.866 1.00 34.43 C ATOM 1113 O VAL A 73 0.421 -3.222 4.280 1.00 2.05 O ATOM 1114 CB VAL A 73 3.479 -4.006 3.500 1.00 12.42 C ATOM 1115 CG1 VAL A 73 4.581 -5.043 3.328 1.00 72.20 C ATOM 1116 CG2 VAL A 73 2.766 -3.746 2.172 1.00 22.21 C ATOM 0 H VAL A 73 1.160 -5.579 3.388 1.00 3.24 H new ATOM 0 HA VAL A 73 3.008 -4.693 5.509 1.00 24.11 H new ATOM 0 HB VAL A 73 3.937 -3.072 3.825 1.00 12.42 H new ATOM 0 HG11 VAL A 73 5.277 -4.710 2.558 1.00 72.20 H new ATOM 0 HG12 VAL A 73 5.114 -5.167 4.271 1.00 72.20 H new ATOM 0 HG13 VAL A 73 4.141 -5.995 3.032 1.00 72.20 H new ATOM 0 HG21 VAL A 73 3.494 -3.433 1.423 1.00 22.21 H new ATOM 0 HG22 VAL A 73 2.273 -4.659 1.839 1.00 22.21 H new ATOM 0 HG23 VAL A 73 2.023 -2.960 2.306 1.00 22.21 H new ATOM 1126 N LYS A 74 1.900 -2.399 5.762 1.00 5.23 N ATOM 1127 CA LYS A 74 1.114 -1.199 6.054 1.00 62.22 C ATOM 1128 C LYS A 74 1.863 0.069 5.628 1.00 45.33 C ATOM 1129 O LYS A 74 3.065 0.210 5.860 1.00 0.03 O ATOM 1130 CB LYS A 74 0.758 -1.113 7.548 1.00 54.43 C ATOM 1131 CG LYS A 74 0.136 0.228 7.942 1.00 31.31 C ATOM 1132 CD LYS A 74 -0.270 0.285 9.411 1.00 14.05 C ATOM 1133 CE LYS A 74 -1.539 -0.507 9.692 1.00 21.33 C ATOM 1134 NZ LYS A 74 -1.916 -0.448 11.128 1.00 60.13 N ATOM 0 H LYS A 74 2.763 -2.476 6.300 1.00 5.23 H new ATOM 0 HA LYS A 74 0.191 -1.273 5.480 1.00 62.22 H new ATOM 0 HB2 LYS A 74 0.063 -1.915 7.796 1.00 54.43 H new ATOM 0 HB3 LYS A 74 1.659 -1.276 8.140 1.00 54.43 H new ATOM 0 HG2 LYS A 74 0.848 1.027 7.736 1.00 31.31 H new ATOM 0 HG3 LYS A 74 -0.740 0.413 7.321 1.00 31.31 H new ATOM 0 HD2 LYS A 74 0.542 -0.105 10.025 1.00 14.05 H new ATOM 0 HD3 LYS A 74 -0.421 1.324 9.704 1.00 14.05 H new ATOM 0 HE2 LYS A 74 -2.355 -0.115 9.085 1.00 21.33 H new ATOM 0 HE3 LYS A 74 -1.393 -1.546 9.396 1.00 21.33 H new ATOM 0 HZ1 LYS A 74 -2.922 -0.691 11.233 1.00 60.13 H new ATOM 0 HZ2 LYS A 74 -1.338 -1.125 11.667 1.00 60.13 H new ATOM 0 HZ3 LYS A 74 -1.752 0.513 11.491 1.00 60.13 H new ATOM 1148 N VAL A 75 1.135 0.989 5.011 1.00 62.45 N ATOM 1149 CA VAL A 75 1.692 2.272 4.577 1.00 41.43 C ATOM 1150 C VAL A 75 1.135 3.420 5.431 1.00 71.32 C ATOM 1151 O VAL A 75 -0.078 3.607 5.506 1.00 22.32 O ATOM 1152 CB VAL A 75 1.371 2.543 3.085 1.00 42.34 C ATOM 1153 CG1 VAL A 75 1.956 3.880 2.632 1.00 31.34 C ATOM 1154 CG2 VAL A 75 1.877 1.402 2.204 1.00 45.42 C ATOM 0 H VAL A 75 0.145 0.872 4.796 1.00 62.45 H new ATOM 0 HA VAL A 75 2.773 2.219 4.702 1.00 41.43 H new ATOM 0 HB VAL A 75 0.287 2.598 2.980 1.00 42.34 H new ATOM 0 HG11 VAL A 75 1.716 4.045 1.582 1.00 31.34 H new ATOM 0 HG12 VAL A 75 1.531 4.685 3.232 1.00 31.34 H new ATOM 0 HG13 VAL A 75 3.038 3.865 2.759 1.00 31.34 H new ATOM 0 HG21 VAL A 75 1.640 1.615 1.162 1.00 45.42 H new ATOM 0 HG22 VAL A 75 2.957 1.305 2.318 1.00 45.42 H new ATOM 0 HG23 VAL A 75 1.396 0.471 2.503 1.00 45.42 H new ATOM 1164 N LYS A 76 2.021 4.173 6.082 1.00 32.32 N ATOM 1165 CA LYS A 76 1.617 5.326 6.900 1.00 11.22 C ATOM 1166 C LYS A 76 2.075 6.651 6.271 1.00 54.40 C ATOM 1167 O LYS A 76 3.268 6.874 6.071 1.00 71.05 O ATOM 1168 CB LYS A 76 2.196 5.216 8.320 1.00 5.20 C ATOM 1169 CG LYS A 76 1.526 4.160 9.211 1.00 50.04 C ATOM 1170 CD LYS A 76 2.506 3.074 9.669 1.00 63.33 C ATOM 1171 CE LYS A 76 2.028 2.386 10.949 1.00 15.04 C ATOM 1172 NZ LYS A 76 2.958 1.314 11.400 1.00 11.23 N ATOM 0 H LYS A 76 3.027 4.008 6.061 1.00 32.32 H new ATOM 0 HA LYS A 76 0.528 5.318 6.948 1.00 11.22 H new ATOM 0 HB2 LYS A 76 3.259 4.987 8.247 1.00 5.20 H new ATOM 0 HB3 LYS A 76 2.112 6.187 8.807 1.00 5.20 H new ATOM 0 HG2 LYS A 76 1.094 4.647 10.085 1.00 50.04 H new ATOM 0 HG3 LYS A 76 0.704 3.697 8.665 1.00 50.04 H new ATOM 0 HD2 LYS A 76 2.623 2.332 8.879 1.00 63.33 H new ATOM 0 HD3 LYS A 76 3.487 3.517 9.838 1.00 63.33 H new ATOM 0 HE2 LYS A 76 1.924 3.129 11.740 1.00 15.04 H new ATOM 0 HE3 LYS A 76 1.040 1.958 10.781 1.00 15.04 H new ATOM 0 HZ1 LYS A 76 2.903 1.219 12.434 1.00 11.23 H new ATOM 0 HZ2 LYS A 76 2.691 0.413 10.955 1.00 11.23 H new ATOM 0 HZ3 LYS A 76 3.931 1.560 11.126 1.00 11.23 H new ATOM 1186 N THR A 77 1.123 7.529 5.975 1.00 14.31 N ATOM 1187 CA THR A 77 1.428 8.866 5.436 1.00 22.01 C ATOM 1188 C THR A 77 0.845 9.964 6.334 1.00 61.43 C ATOM 1189 O THR A 77 0.247 9.681 7.374 1.00 1.23 O ATOM 1190 CB THR A 77 0.857 9.064 4.009 1.00 42.23 C ATOM 1191 OG1 THR A 77 -0.576 9.171 4.061 1.00 34.23 O ATOM 1192 CG2 THR A 77 1.251 7.911 3.088 1.00 11.12 C ATOM 0 H THR A 77 0.127 7.346 6.097 1.00 14.31 H new ATOM 0 HA THR A 77 2.515 8.938 5.401 1.00 22.01 H new ATOM 0 HB THR A 77 1.279 9.985 3.606 1.00 42.23 H new ATOM 0 HG1 THR A 77 -0.968 8.276 4.134 1.00 34.23 H new ATOM 0 HG21 THR A 77 0.835 8.080 2.095 1.00 11.12 H new ATOM 0 HG22 THR A 77 2.337 7.854 3.021 1.00 11.12 H new ATOM 0 HG23 THR A 77 0.862 6.975 3.490 1.00 11.12 H new ATOM 1200 N GLU A 78 1.011 11.217 5.922 1.00 1.43 N ATOM 1201 CA GLU A 78 0.426 12.352 6.647 1.00 23.40 C ATOM 1202 C GLU A 78 -1.108 12.394 6.494 1.00 71.34 C ATOM 1203 O GLU A 78 -1.792 13.144 7.195 1.00 15.52 O ATOM 1204 CB GLU A 78 1.053 13.668 6.160 1.00 1.33 C ATOM 1205 CG GLU A 78 0.907 13.915 4.660 1.00 12.44 C ATOM 1206 CD GLU A 78 1.661 15.150 4.192 1.00 22.15 C ATOM 1207 OE1 GLU A 78 2.885 15.048 3.943 1.00 72.43 O ATOM 1208 OE2 GLU A 78 1.042 16.228 4.077 1.00 42.32 O ATOM 0 H GLU A 78 1.544 11.477 5.092 1.00 1.43 H new ATOM 0 HA GLU A 78 0.645 12.223 7.707 1.00 23.40 H new ATOM 0 HB2 GLU A 78 0.595 14.497 6.699 1.00 1.33 H new ATOM 0 HB3 GLU A 78 2.113 13.669 6.415 1.00 1.33 H new ATOM 0 HG2 GLU A 78 1.271 13.044 4.115 1.00 12.44 H new ATOM 0 HG3 GLU A 78 -0.149 14.025 4.415 1.00 12.44 H new ATOM 1215 N PHE A 79 -1.646 11.584 5.579 1.00 1.33 N ATOM 1216 CA PHE A 79 -3.098 11.503 5.368 1.00 43.34 C ATOM 1217 C PHE A 79 -3.729 10.353 6.176 1.00 40.14 C ATOM 1218 O PHE A 79 -4.731 10.551 6.865 1.00 2.31 O ATOM 1219 CB PHE A 79 -3.414 11.339 3.872 1.00 54.14 C ATOM 1220 CG PHE A 79 -3.069 12.559 3.050 1.00 32.34 C ATOM 1221 CD1 PHE A 79 -4.002 13.571 2.858 1.00 21.11 C ATOM 1222 CD2 PHE A 79 -1.812 12.697 2.477 1.00 72.35 C ATOM 1223 CE1 PHE A 79 -3.687 14.691 2.111 1.00 71.31 C ATOM 1224 CE2 PHE A 79 -1.493 13.816 1.732 1.00 23.24 C ATOM 1225 CZ PHE A 79 -2.431 14.814 1.549 1.00 13.24 C ATOM 0 H PHE A 79 -1.100 10.974 4.971 1.00 1.33 H new ATOM 0 HA PHE A 79 -3.534 12.436 5.724 1.00 43.34 H new ATOM 0 HB2 PHE A 79 -2.865 10.481 3.484 1.00 54.14 H new ATOM 0 HB3 PHE A 79 -4.475 11.118 3.754 1.00 54.14 H new ATOM 0 HD1 PHE A 79 -4.985 13.482 3.297 1.00 21.11 H new ATOM 0 HD2 PHE A 79 -1.075 11.920 2.615 1.00 72.35 H new ATOM 0 HE1 PHE A 79 -4.422 15.469 1.967 1.00 71.31 H new ATOM 0 HE2 PHE A 79 -0.511 13.911 1.293 1.00 23.24 H new ATOM 0 HZ PHE A 79 -2.182 15.689 0.967 1.00 13.24 H new ATOM 1235 N GLY A 80 -3.142 9.158 6.094 1.00 14.52 N ATOM 1236 CA GLY A 80 -3.692 8.007 6.813 1.00 74.53 C ATOM 1237 C GLY A 80 -2.787 6.774 6.779 1.00 5.42 C ATOM 1238 O GLY A 80 -1.568 6.891 6.645 1.00 5.24 O ATOM 0 H GLY A 80 -2.302 8.963 5.549 1.00 14.52 H new ATOM 0 HA2 GLY A 80 -3.869 8.289 7.851 1.00 74.53 H new ATOM 0 HA3 GLY A 80 -4.660 7.749 6.383 1.00 74.53 H new ATOM 1242 N GLU A 81 -3.385 5.590 6.919 1.00 44.43 N ATOM 1243 CA GLU A 81 -2.634 4.326 6.893 1.00 5.40 C ATOM 1244 C GLU A 81 -3.524 3.147 6.453 1.00 71.32 C ATOM 1245 O GLU A 81 -4.695 3.066 6.825 1.00 2.22 O ATOM 1246 CB GLU A 81 -2.015 4.034 8.270 1.00 42.32 C ATOM 1247 CG GLU A 81 -3.032 3.925 9.403 1.00 32.44 C ATOM 1248 CD GLU A 81 -2.384 3.635 10.748 1.00 23.23 C ATOM 1249 OE1 GLU A 81 -1.980 4.595 11.440 1.00 52.12 O ATOM 1250 OE2 GLU A 81 -2.276 2.445 11.121 1.00 55.50 O ATOM 0 H GLU A 81 -4.390 5.476 7.052 1.00 44.43 H new ATOM 0 HA GLU A 81 -1.834 4.437 6.161 1.00 5.40 H new ATOM 0 HB2 GLU A 81 -1.451 3.103 8.212 1.00 42.32 H new ATOM 0 HB3 GLU A 81 -1.303 4.824 8.511 1.00 42.32 H new ATOM 0 HG2 GLU A 81 -3.597 4.855 9.469 1.00 32.44 H new ATOM 0 HG3 GLU A 81 -3.746 3.135 9.170 1.00 32.44 H new ATOM 1257 N VAL A 82 -2.955 2.230 5.668 1.00 15.52 N ATOM 1258 CA VAL A 82 -3.707 1.077 5.143 1.00 33.34 C ATOM 1259 C VAL A 82 -2.820 -0.186 5.048 1.00 61.11 C ATOM 1260 O VAL A 82 -1.607 -0.085 4.853 1.00 45.02 O ATOM 1261 CB VAL A 82 -4.298 1.404 3.743 1.00 0.44 C ATOM 1262 CG1 VAL A 82 -3.188 1.648 2.719 1.00 42.40 C ATOM 1263 CG2 VAL A 82 -5.254 0.307 3.267 1.00 31.40 C ATOM 0 H VAL A 82 -1.977 2.259 5.379 1.00 15.52 H new ATOM 0 HA VAL A 82 -4.519 0.874 5.842 1.00 33.34 H new ATOM 0 HB VAL A 82 -4.875 2.324 3.838 1.00 0.44 H new ATOM 0 HG11 VAL A 82 -3.631 1.874 1.749 1.00 42.40 H new ATOM 0 HG12 VAL A 82 -2.573 2.488 3.042 1.00 42.40 H new ATOM 0 HG13 VAL A 82 -2.568 0.756 2.635 1.00 42.40 H new ATOM 0 HG21 VAL A 82 -5.648 0.569 2.285 1.00 31.40 H new ATOM 0 HG22 VAL A 82 -4.718 -0.640 3.202 1.00 31.40 H new ATOM 0 HG23 VAL A 82 -6.077 0.210 3.974 1.00 31.40 H new ATOM 1273 N VAL A 83 -3.429 -1.372 5.208 1.00 74.30 N ATOM 1274 CA VAL A 83 -2.699 -2.649 5.079 1.00 61.43 C ATOM 1275 C VAL A 83 -3.040 -3.356 3.753 1.00 33.10 C ATOM 1276 O VAL A 83 -4.194 -3.740 3.524 1.00 71.12 O ATOM 1277 CB VAL A 83 -3.011 -3.632 6.243 1.00 1.35 C ATOM 1278 CG1 VAL A 83 -2.097 -4.857 6.169 1.00 24.20 C ATOM 1279 CG2 VAL A 83 -2.885 -2.958 7.606 1.00 60.44 C ATOM 0 H VAL A 83 -4.420 -1.476 5.426 1.00 74.30 H new ATOM 0 HA VAL A 83 -1.641 -2.388 5.108 1.00 61.43 H new ATOM 0 HB VAL A 83 -4.046 -3.953 6.130 1.00 1.35 H new ATOM 0 HG11 VAL A 83 -2.329 -5.534 6.991 1.00 24.20 H new ATOM 0 HG12 VAL A 83 -2.253 -5.371 5.220 1.00 24.20 H new ATOM 0 HG13 VAL A 83 -1.057 -4.540 6.243 1.00 24.20 H new ATOM 0 HG21 VAL A 83 -3.111 -3.680 8.391 1.00 60.44 H new ATOM 0 HG22 VAL A 83 -1.868 -2.587 7.736 1.00 60.44 H new ATOM 0 HG23 VAL A 83 -3.585 -2.125 7.666 1.00 60.44 H new ATOM 1289 N VAL A 84 -2.026 -3.533 2.898 1.00 35.55 N ATOM 1290 CA VAL A 84 -2.188 -4.194 1.589 1.00 13.01 C ATOM 1291 C VAL A 84 -1.160 -5.330 1.398 1.00 62.50 C ATOM 1292 O VAL A 84 -0.313 -5.564 2.260 1.00 12.11 O ATOM 1293 CB VAL A 84 -2.033 -3.181 0.421 1.00 70.22 C ATOM 1294 CG1 VAL A 84 -3.103 -2.095 0.492 1.00 24.43 C ATOM 1295 CG2 VAL A 84 -0.633 -2.563 0.419 1.00 64.11 C ATOM 0 H VAL A 84 -1.072 -3.225 3.089 1.00 35.55 H new ATOM 0 HA VAL A 84 -3.194 -4.613 1.575 1.00 13.01 H new ATOM 0 HB VAL A 84 -2.167 -3.725 -0.514 1.00 70.22 H new ATOM 0 HG11 VAL A 84 -2.971 -1.400 -0.337 1.00 24.43 H new ATOM 0 HG12 VAL A 84 -4.090 -2.552 0.428 1.00 24.43 H new ATOM 0 HG13 VAL A 84 -3.013 -1.556 1.435 1.00 24.43 H new ATOM 0 HG21 VAL A 84 -0.548 -1.857 -0.407 1.00 64.11 H new ATOM 0 HG22 VAL A 84 -0.464 -2.041 1.361 1.00 64.11 H new ATOM 0 HG23 VAL A 84 0.112 -3.350 0.302 1.00 64.11 H new ATOM 1305 N PHE A 85 -1.239 -6.037 0.267 1.00 30.20 N ATOM 1306 CA PHE A 85 -0.264 -7.092 -0.058 1.00 71.32 C ATOM 1307 C PHE A 85 1.017 -6.506 -0.681 1.00 63.04 C ATOM 1308 O PHE A 85 0.966 -5.552 -1.461 1.00 72.52 O ATOM 1309 CB PHE A 85 -0.877 -8.126 -1.016 1.00 24.05 C ATOM 1310 CG PHE A 85 -1.951 -8.981 -0.389 1.00 15.20 C ATOM 1311 CD1 PHE A 85 -1.614 -9.985 0.506 1.00 63.42 C ATOM 1312 CD2 PHE A 85 -3.291 -8.785 -0.697 1.00 53.13 C ATOM 1313 CE1 PHE A 85 -2.589 -10.776 1.081 1.00 44.52 C ATOM 1314 CE2 PHE A 85 -4.271 -9.573 -0.126 1.00 23.34 C ATOM 1315 CZ PHE A 85 -3.919 -10.570 0.765 1.00 32.00 C ATOM 0 H PHE A 85 -1.963 -5.902 -0.439 1.00 30.20 H new ATOM 0 HA PHE A 85 0.002 -7.584 0.878 1.00 71.32 H new ATOM 0 HB2 PHE A 85 -1.297 -7.605 -1.876 1.00 24.05 H new ATOM 0 HB3 PHE A 85 -0.084 -8.773 -1.391 1.00 24.05 H new ATOM 0 HD1 PHE A 85 -0.577 -10.150 0.756 1.00 63.42 H new ATOM 0 HD2 PHE A 85 -3.570 -8.007 -1.392 1.00 53.13 H new ATOM 0 HE1 PHE A 85 -2.313 -11.555 1.777 1.00 44.52 H new ATOM 0 HE2 PHE A 85 -5.309 -9.411 -0.375 1.00 23.34 H new ATOM 0 HZ PHE A 85 -4.683 -11.188 1.214 1.00 32.00 H new ATOM 1325 N ALA A 86 2.163 -7.089 -0.339 1.00 13.12 N ATOM 1326 CA ALA A 86 3.457 -6.624 -0.849 1.00 5.43 C ATOM 1327 C ALA A 86 3.860 -7.347 -2.145 1.00 65.44 C ATOM 1328 O ALA A 86 3.981 -8.574 -2.171 1.00 73.22 O ATOM 1329 CB ALA A 86 4.534 -6.824 0.211 1.00 14.12 C ATOM 0 H ALA A 86 2.225 -7.888 0.292 1.00 13.12 H new ATOM 0 HA ALA A 86 3.357 -5.564 -1.080 1.00 5.43 H new ATOM 0 HB1 ALA A 86 5.493 -6.477 -0.174 1.00 14.12 H new ATOM 0 HB2 ALA A 86 4.275 -6.256 1.105 1.00 14.12 H new ATOM 0 HB3 ALA A 86 4.606 -7.882 0.462 1.00 14.12 H new ATOM 1335 N LYS A 87 4.071 -6.583 -3.218 1.00 12.53 N ATOM 1336 CA LYS A 87 4.558 -7.136 -4.489 1.00 73.21 C ATOM 1337 C LYS A 87 5.725 -6.310 -5.029 1.00 51.55 C ATOM 1338 O LYS A 87 5.898 -5.149 -4.675 1.00 65.22 O ATOM 1339 CB LYS A 87 3.437 -7.197 -5.542 1.00 51.13 C ATOM 1340 CG LYS A 87 2.228 -8.039 -5.145 1.00 21.11 C ATOM 1341 CD LYS A 87 1.314 -8.294 -6.342 1.00 12.10 C ATOM 1342 CE LYS A 87 0.003 -8.942 -5.922 1.00 32.51 C ATOM 1343 NZ LYS A 87 -0.791 -9.422 -7.086 1.00 25.12 N ATOM 0 H LYS A 87 3.912 -5.576 -3.235 1.00 12.53 H new ATOM 0 HA LYS A 87 4.901 -8.151 -4.290 1.00 73.21 H new ATOM 0 HB2 LYS A 87 3.101 -6.182 -5.753 1.00 51.13 H new ATOM 0 HB3 LYS A 87 3.850 -7.595 -6.469 1.00 51.13 H new ATOM 0 HG2 LYS A 87 2.564 -8.990 -4.732 1.00 21.11 H new ATOM 0 HG3 LYS A 87 1.669 -7.530 -4.360 1.00 21.11 H new ATOM 0 HD2 LYS A 87 1.108 -7.352 -6.849 1.00 12.10 H new ATOM 0 HD3 LYS A 87 1.824 -8.937 -7.059 1.00 12.10 H new ATOM 0 HE2 LYS A 87 0.212 -9.780 -5.257 1.00 32.51 H new ATOM 0 HE3 LYS A 87 -0.588 -8.224 -5.353 1.00 32.51 H new ATOM 0 HZ1 LYS A 87 -1.674 -9.855 -6.749 1.00 25.12 H new ATOM 0 HZ2 LYS A 87 -1.015 -8.619 -7.708 1.00 25.12 H new ATOM 0 HZ3 LYS A 87 -0.240 -10.127 -7.615 1.00 25.12 H new ATOM 1357 N LYS A 88 6.533 -6.923 -5.879 1.00 41.43 N ATOM 1358 CA LYS A 88 7.705 -6.262 -6.433 1.00 55.23 C ATOM 1359 C LYS A 88 7.392 -5.658 -7.813 1.00 61.21 C ATOM 1360 O LYS A 88 6.676 -6.267 -8.617 1.00 43.12 O ATOM 1361 CB LYS A 88 8.857 -7.264 -6.531 1.00 72.33 C ATOM 1362 CG LYS A 88 10.218 -6.601 -6.534 1.00 41.04 C ATOM 1363 CD LYS A 88 11.355 -7.614 -6.652 1.00 1.50 C ATOM 1364 CE LYS A 88 11.370 -8.600 -5.488 1.00 31.35 C ATOM 1365 NZ LYS A 88 12.487 -9.573 -5.603 1.00 23.34 N ATOM 0 H LYS A 88 6.398 -7.881 -6.202 1.00 41.43 H new ATOM 0 HA LYS A 88 7.996 -5.446 -5.772 1.00 55.23 H new ATOM 0 HB2 LYS A 88 8.799 -7.959 -5.693 1.00 72.33 H new ATOM 0 HB3 LYS A 88 8.743 -7.852 -7.442 1.00 72.33 H new ATOM 0 HG2 LYS A 88 10.275 -5.896 -7.363 1.00 41.04 H new ATOM 0 HG3 LYS A 88 10.341 -6.025 -5.617 1.00 41.04 H new ATOM 0 HD2 LYS A 88 11.256 -8.162 -7.589 1.00 1.50 H new ATOM 0 HD3 LYS A 88 12.308 -7.086 -6.691 1.00 1.50 H new ATOM 0 HE2 LYS A 88 11.460 -8.053 -4.549 1.00 31.35 H new ATOM 0 HE3 LYS A 88 10.422 -9.137 -5.454 1.00 31.35 H new ATOM 0 HZ1 LYS A 88 12.859 -9.788 -4.656 1.00 23.34 H new ATOM 0 HZ2 LYS A 88 12.141 -10.448 -6.046 1.00 23.34 H new ATOM 0 HZ3 LYS A 88 13.244 -9.165 -6.188 1.00 23.34 H new ATOM 1379 N GLY A 89 7.925 -4.463 -8.080 1.00 24.32 N ATOM 1380 CA GLY A 89 7.636 -3.775 -9.341 1.00 33.32 C ATOM 1381 C GLY A 89 8.842 -3.051 -9.936 1.00 73.51 C ATOM 1382 O GLY A 89 9.956 -3.144 -9.415 1.00 51.22 O ATOM 0 H GLY A 89 8.549 -3.958 -7.451 1.00 24.32 H new ATOM 0 HA2 GLY A 89 7.266 -4.502 -10.065 1.00 33.32 H new ATOM 0 HA3 GLY A 89 6.836 -3.054 -9.176 1.00 33.32 H new ATOM 1386 N ASP A 90 8.613 -2.313 -11.024 1.00 1.45 N ATOM 1387 CA ASP A 90 9.687 -1.599 -11.730 1.00 44.14 C ATOM 1388 C ASP A 90 9.804 -0.137 -11.257 1.00 45.22 C ATOM 1389 O ASP A 90 10.186 0.751 -12.026 1.00 10.21 O ATOM 1390 CB ASP A 90 9.433 -1.644 -13.243 1.00 31.14 C ATOM 1391 CG ASP A 90 9.368 -3.062 -13.783 1.00 41.03 C ATOM 1392 OD1 ASP A 90 10.437 -3.673 -14.009 1.00 2.23 O ATOM 1393 OD2 ASP A 90 8.249 -3.575 -13.992 1.00 4.30 O ATOM 0 H ASP A 90 7.689 -2.192 -11.440 1.00 1.45 H new ATOM 0 HA ASP A 90 10.629 -2.097 -11.502 1.00 44.14 H new ATOM 0 HB2 ASP A 90 8.497 -1.131 -13.466 1.00 31.14 H new ATOM 0 HB3 ASP A 90 10.225 -1.100 -13.757 1.00 31.14 H new ATOM 1398 N VAL A 91 9.501 0.100 -9.984 1.00 73.53 N ATOM 1399 CA VAL A 91 9.551 1.448 -9.406 1.00 4.04 C ATOM 1400 C VAL A 91 10.935 1.759 -8.804 1.00 74.42 C ATOM 1401 O VAL A 91 11.654 0.848 -8.391 1.00 63.34 O ATOM 1402 CB VAL A 91 8.464 1.622 -8.312 1.00 72.50 C ATOM 1403 CG1 VAL A 91 7.070 1.474 -8.916 1.00 75.20 C ATOM 1404 CG2 VAL A 91 8.666 0.626 -7.170 1.00 31.21 C ATOM 0 H VAL A 91 9.216 -0.626 -9.326 1.00 73.53 H new ATOM 0 HA VAL A 91 9.361 2.149 -10.219 1.00 4.04 H new ATOM 0 HB VAL A 91 8.558 2.626 -7.899 1.00 72.50 H new ATOM 0 HG11 VAL A 91 6.320 1.599 -8.135 1.00 75.20 H new ATOM 0 HG12 VAL A 91 6.924 2.233 -9.684 1.00 75.20 H new ATOM 0 HG13 VAL A 91 6.969 0.484 -9.361 1.00 75.20 H new ATOM 0 HG21 VAL A 91 7.890 0.772 -6.419 1.00 31.21 H new ATOM 0 HG22 VAL A 91 8.608 -0.390 -7.559 1.00 31.21 H new ATOM 0 HG23 VAL A 91 9.644 0.786 -6.717 1.00 31.21 H new ATOM 1414 N PRO A 92 11.331 3.050 -8.758 1.00 30.32 N ATOM 1415 CA PRO A 92 12.623 3.473 -8.177 1.00 13.42 C ATOM 1416 C PRO A 92 12.704 3.267 -6.651 1.00 64.45 C ATOM 1417 O PRO A 92 11.686 3.095 -5.979 1.00 3.42 O ATOM 1418 CB PRO A 92 12.702 4.975 -8.517 1.00 5.23 C ATOM 1419 CG PRO A 92 11.656 5.202 -9.562 1.00 25.12 C ATOM 1420 CD PRO A 92 10.573 4.199 -9.284 1.00 33.11 C ATOM 0 HA PRO A 92 13.445 2.881 -8.579 1.00 13.42 H new ATOM 0 HB2 PRO A 92 12.515 5.588 -7.635 1.00 5.23 H new ATOM 0 HB3 PRO A 92 13.692 5.242 -8.887 1.00 5.23 H new ATOM 0 HG2 PRO A 92 11.268 6.220 -9.512 1.00 25.12 H new ATOM 0 HG3 PRO A 92 12.067 5.066 -10.562 1.00 25.12 H new ATOM 0 HD2 PRO A 92 9.849 4.573 -8.560 1.00 33.11 H new ATOM 0 HD3 PRO A 92 10.018 3.941 -10.186 1.00 33.11 H new ATOM 1428 N LYS A 93 13.923 3.303 -6.110 1.00 32.22 N ATOM 1429 CA LYS A 93 14.142 3.117 -4.667 1.00 44.32 C ATOM 1430 C LYS A 93 13.549 4.285 -3.856 1.00 25.31 C ATOM 1431 O LYS A 93 13.606 5.441 -4.283 1.00 22.21 O ATOM 1432 CB LYS A 93 15.647 2.978 -4.374 1.00 22.21 C ATOM 1433 CG LYS A 93 15.968 2.648 -2.917 1.00 33.04 C ATOM 1434 CD LYS A 93 17.459 2.391 -2.700 1.00 73.34 C ATOM 1435 CE LYS A 93 17.743 1.909 -1.279 1.00 52.41 C ATOM 1436 NZ LYS A 93 19.164 1.513 -1.096 1.00 75.03 N ATOM 0 H LYS A 93 14.777 3.459 -6.646 1.00 32.22 H new ATOM 0 HA LYS A 93 13.631 2.203 -4.363 1.00 44.32 H new ATOM 0 HB2 LYS A 93 16.060 2.197 -5.012 1.00 22.21 H new ATOM 0 HB3 LYS A 93 16.147 3.908 -4.644 1.00 22.21 H new ATOM 0 HG2 LYS A 93 15.646 3.472 -2.280 1.00 33.04 H new ATOM 0 HG3 LYS A 93 15.401 1.769 -2.612 1.00 33.04 H new ATOM 0 HD2 LYS A 93 17.809 1.646 -3.415 1.00 73.34 H new ATOM 0 HD3 LYS A 93 18.019 3.306 -2.894 1.00 73.34 H new ATOM 0 HE2 LYS A 93 17.494 2.700 -0.572 1.00 52.41 H new ATOM 0 HE3 LYS A 93 17.098 1.061 -1.049 1.00 52.41 H new ATOM 0 HZ1 LYS A 93 19.357 1.372 -0.084 1.00 75.03 H new ATOM 0 HZ2 LYS A 93 19.347 0.628 -1.610 1.00 75.03 H new ATOM 0 HZ3 LYS A 93 19.784 2.262 -1.466 1.00 75.03 H new ATOM 1450 N GLY A 94 12.990 3.981 -2.684 1.00 43.24 N ATOM 1451 CA GLY A 94 12.334 5.008 -1.877 1.00 23.05 C ATOM 1452 C GLY A 94 11.031 5.516 -2.496 1.00 25.12 C ATOM 1453 O GLY A 94 10.563 6.616 -2.183 1.00 63.42 O ATOM 0 H GLY A 94 12.978 3.046 -2.277 1.00 43.24 H new ATOM 0 HA2 GLY A 94 12.125 4.605 -0.886 1.00 23.05 H new ATOM 0 HA3 GLY A 94 13.017 5.847 -1.743 1.00 23.05 H new ATOM 1457 N MET A 95 10.444 4.714 -3.380 1.00 4.30 N ATOM 1458 CA MET A 95 9.204 5.074 -4.058 1.00 2.40 C ATOM 1459 C MET A 95 8.391 3.804 -4.373 1.00 23.32 C ATOM 1460 O MET A 95 8.949 2.803 -4.815 1.00 11.32 O ATOM 1461 CB MET A 95 9.548 5.834 -5.346 1.00 31.11 C ATOM 1462 CG MET A 95 8.393 6.616 -5.934 1.00 71.34 C ATOM 1463 SD MET A 95 8.902 7.629 -7.342 1.00 10.21 S ATOM 1464 CE MET A 95 7.483 8.707 -7.539 1.00 22.32 C ATOM 0 H MET A 95 10.813 3.801 -3.645 1.00 4.30 H new ATOM 0 HA MET A 95 8.598 5.713 -3.416 1.00 2.40 H new ATOM 0 HB2 MET A 95 10.369 6.520 -5.141 1.00 31.11 H new ATOM 0 HB3 MET A 95 9.906 5.122 -6.090 1.00 31.11 H new ATOM 0 HG2 MET A 95 7.611 5.925 -6.249 1.00 71.34 H new ATOM 0 HG3 MET A 95 7.961 7.256 -5.165 1.00 71.34 H new ATOM 0 HE1 MET A 95 7.165 8.702 -8.581 1.00 22.32 H new ATOM 0 HE2 MET A 95 6.667 8.353 -6.909 1.00 22.32 H new ATOM 0 HE3 MET A 95 7.754 9.722 -7.247 1.00 22.32 H new ATOM 1474 N ILE A 96 7.079 3.839 -4.141 1.00 54.43 N ATOM 1475 CA ILE A 96 6.232 2.652 -4.357 1.00 12.23 C ATOM 1476 C ILE A 96 4.966 2.984 -5.157 1.00 64.55 C ATOM 1477 O ILE A 96 4.387 4.064 -5.023 1.00 33.11 O ATOM 1478 CB ILE A 96 5.822 1.975 -3.019 1.00 1.35 C ATOM 1479 CG1 ILE A 96 5.033 2.951 -2.125 1.00 70.40 C ATOM 1480 CG2 ILE A 96 7.051 1.440 -2.281 1.00 14.53 C ATOM 1481 CD1 ILE A 96 4.530 2.333 -0.833 1.00 51.20 C ATOM 0 H ILE A 96 6.578 4.663 -3.807 1.00 54.43 H new ATOM 0 HA ILE A 96 6.842 1.957 -4.933 1.00 12.23 H new ATOM 0 HB ILE A 96 5.172 1.133 -3.255 1.00 1.35 H new ATOM 0 HG12 ILE A 96 5.669 3.803 -1.885 1.00 70.40 H new ATOM 0 HG13 ILE A 96 4.182 3.336 -2.687 1.00 70.40 H new ATOM 0 HG21 ILE A 96 6.739 0.971 -1.348 1.00 14.53 H new ATOM 0 HG22 ILE A 96 7.559 0.705 -2.905 1.00 14.53 H new ATOM 0 HG23 ILE A 96 7.732 2.263 -2.064 1.00 14.53 H new ATOM 0 HD11 ILE A 96 3.985 3.083 -0.259 1.00 51.20 H new ATOM 0 HD12 ILE A 96 3.867 1.499 -1.063 1.00 51.20 H new ATOM 0 HD13 ILE A 96 5.376 1.973 -0.248 1.00 51.20 H new ATOM 1493 N PHE A 97 4.539 2.037 -5.985 1.00 5.14 N ATOM 1494 CA PHE A 97 3.344 2.202 -6.816 1.00 65.32 C ATOM 1495 C PHE A 97 2.152 1.437 -6.231 1.00 44.00 C ATOM 1496 O PHE A 97 2.258 0.254 -5.918 1.00 3.32 O ATOM 1497 CB PHE A 97 3.628 1.703 -8.242 1.00 41.54 C ATOM 1498 CG PHE A 97 2.438 1.776 -9.168 1.00 65.40 C ATOM 1499 CD1 PHE A 97 1.549 0.714 -9.268 1.00 61.23 C ATOM 1500 CD2 PHE A 97 2.210 2.908 -9.937 1.00 1.44 C ATOM 1501 CE1 PHE A 97 0.459 0.778 -10.111 1.00 54.31 C ATOM 1502 CE2 PHE A 97 1.122 2.975 -10.785 1.00 55.44 C ATOM 1503 CZ PHE A 97 0.246 1.909 -10.872 1.00 44.24 C ATOM 0 H PHE A 97 5.005 1.137 -6.101 1.00 5.14 H new ATOM 0 HA PHE A 97 3.092 3.262 -6.840 1.00 65.32 H new ATOM 0 HB2 PHE A 97 4.442 2.291 -8.666 1.00 41.54 H new ATOM 0 HB3 PHE A 97 3.974 0.670 -8.192 1.00 41.54 H new ATOM 0 HD1 PHE A 97 1.713 -0.175 -8.677 1.00 61.23 H new ATOM 0 HD2 PHE A 97 2.890 3.745 -9.872 1.00 1.44 H new ATOM 0 HE1 PHE A 97 -0.226 -0.055 -10.175 1.00 54.31 H new ATOM 0 HE2 PHE A 97 0.955 3.861 -11.380 1.00 55.44 H new ATOM 0 HZ PHE A 97 -0.605 1.962 -11.535 1.00 44.24 H new ATOM 1513 N ILE A 98 1.018 2.110 -6.088 1.00 52.32 N ATOM 1514 CA ILE A 98 -0.220 1.454 -5.662 1.00 63.32 C ATOM 1515 C ILE A 98 -1.356 1.738 -6.659 1.00 21.41 C ATOM 1516 O ILE A 98 -1.557 2.882 -7.071 1.00 15.55 O ATOM 1517 CB ILE A 98 -0.647 1.906 -4.238 1.00 23.52 C ATOM 1518 CG1 ILE A 98 0.464 1.580 -3.222 1.00 44.25 C ATOM 1519 CG2 ILE A 98 -1.966 1.246 -3.829 1.00 2.30 C ATOM 1520 CD1 ILE A 98 0.084 1.837 -1.779 1.00 20.34 C ATOM 0 H ILE A 98 0.926 3.111 -6.260 1.00 52.32 H new ATOM 0 HA ILE A 98 -0.025 0.382 -5.636 1.00 63.32 H new ATOM 0 HB ILE A 98 -0.802 2.985 -4.250 1.00 23.52 H new ATOM 0 HG12 ILE A 98 0.743 0.532 -3.331 1.00 44.25 H new ATOM 0 HG13 ILE A 98 1.347 2.172 -3.464 1.00 44.25 H new ATOM 0 HG21 ILE A 98 -2.244 1.578 -2.829 1.00 2.30 H new ATOM 0 HG22 ILE A 98 -2.748 1.527 -4.535 1.00 2.30 H new ATOM 0 HG23 ILE A 98 -1.847 0.163 -3.832 1.00 2.30 H new ATOM 0 HD11 ILE A 98 0.922 1.581 -1.131 1.00 20.34 H new ATOM 0 HD12 ILE A 98 -0.166 2.890 -1.651 1.00 20.34 H new ATOM 0 HD13 ILE A 98 -0.778 1.225 -1.515 1.00 20.34 H new ATOM 1532 N PRO A 99 -2.091 0.698 -7.094 1.00 62.32 N ATOM 1533 CA PRO A 99 -3.265 0.872 -7.963 1.00 51.52 C ATOM 1534 C PRO A 99 -4.289 1.854 -7.367 1.00 65.03 C ATOM 1535 O PRO A 99 -4.714 1.699 -6.221 1.00 1.22 O ATOM 1536 CB PRO A 99 -3.850 -0.545 -8.049 1.00 63.05 C ATOM 1537 CG PRO A 99 -2.690 -1.446 -7.794 1.00 21.00 C ATOM 1538 CD PRO A 99 -1.831 -0.723 -6.793 1.00 73.43 C ATOM 0 HA PRO A 99 -3.004 1.296 -8.933 1.00 51.52 H new ATOM 0 HB2 PRO A 99 -4.638 -0.694 -7.311 1.00 63.05 H new ATOM 0 HB3 PRO A 99 -4.291 -0.733 -9.028 1.00 63.05 H new ATOM 0 HG2 PRO A 99 -3.020 -2.409 -7.405 1.00 21.00 H new ATOM 0 HG3 PRO A 99 -2.139 -1.645 -8.713 1.00 21.00 H new ATOM 0 HD2 PRO A 99 -2.106 -0.975 -5.769 1.00 73.43 H new ATOM 0 HD3 PRO A 99 -0.777 -0.974 -6.911 1.00 73.43 H new ATOM 1546 N MET A 100 -4.667 2.871 -8.148 1.00 63.25 N ATOM 1547 CA MET A 100 -5.618 3.898 -7.703 1.00 73.35 C ATOM 1548 C MET A 100 -6.906 3.249 -7.169 1.00 34.44 C ATOM 1549 O MET A 100 -7.776 2.841 -7.942 1.00 73.23 O ATOM 1550 CB MET A 100 -5.940 4.850 -8.871 1.00 22.14 C ATOM 1551 CG MET A 100 -6.426 6.244 -8.465 1.00 43.34 C ATOM 1552 SD MET A 100 -7.909 6.237 -7.431 1.00 50.14 S ATOM 1553 CE MET A 100 -7.197 6.336 -5.786 1.00 74.41 C ATOM 0 H MET A 100 -4.326 3.006 -9.100 1.00 63.25 H new ATOM 0 HA MET A 100 -5.165 4.469 -6.893 1.00 73.35 H new ATOM 0 HB2 MET A 100 -5.046 4.960 -9.485 1.00 22.14 H new ATOM 0 HB3 MET A 100 -6.702 4.386 -9.497 1.00 22.14 H new ATOM 0 HG2 MET A 100 -5.625 6.754 -7.930 1.00 43.34 H new ATOM 0 HG3 MET A 100 -6.627 6.824 -9.366 1.00 43.34 H new ATOM 0 HE1 MET A 100 -7.604 5.538 -5.165 1.00 74.41 H new ATOM 0 HE2 MET A 100 -6.114 6.229 -5.851 1.00 74.41 H new ATOM 0 HE3 MET A 100 -7.440 7.301 -5.342 1.00 74.41 H new ATOM 1563 N GLY A 101 -7.013 3.147 -5.845 1.00 51.21 N ATOM 1564 CA GLY A 101 -8.161 2.478 -5.237 1.00 74.15 C ATOM 1565 C GLY A 101 -8.477 2.991 -3.836 1.00 72.21 C ATOM 1566 O GLY A 101 -7.827 3.920 -3.356 1.00 52.34 O ATOM 0 H GLY A 101 -6.330 3.513 -5.182 1.00 51.21 H new ATOM 0 HA2 GLY A 101 -9.034 2.616 -5.874 1.00 74.15 H new ATOM 0 HA3 GLY A 101 -7.967 1.406 -5.190 1.00 74.15 H new ATOM 1570 N PRO A 102 -9.456 2.382 -3.133 1.00 75.31 N ATOM 1571 CA PRO A 102 -9.874 2.851 -1.799 1.00 70.54 C ATOM 1572 C PRO A 102 -8.749 2.725 -0.759 1.00 33.12 C ATOM 1573 O PRO A 102 -8.697 3.474 0.212 1.00 73.02 O ATOM 1574 CB PRO A 102 -11.065 1.944 -1.445 1.00 32.01 C ATOM 1575 CG PRO A 102 -10.910 0.734 -2.308 1.00 14.10 C ATOM 1576 CD PRO A 102 -10.211 1.187 -3.565 1.00 63.22 C ATOM 0 HA PRO A 102 -10.132 3.910 -1.801 1.00 70.54 H new ATOM 0 HB2 PRO A 102 -11.056 1.677 -0.388 1.00 32.01 H new ATOM 0 HB3 PRO A 102 -12.013 2.446 -1.638 1.00 32.01 H new ATOM 0 HG2 PRO A 102 -10.329 -0.034 -1.797 1.00 14.10 H new ATOM 0 HG3 PRO A 102 -11.881 0.297 -2.541 1.00 14.10 H new ATOM 0 HD2 PRO A 102 -9.549 0.414 -3.956 1.00 63.22 H new ATOM 0 HD3 PRO A 102 -10.923 1.427 -4.355 1.00 63.22 H new ATOM 1584 N TYR A 103 -7.839 1.786 -1.005 1.00 32.21 N ATOM 1585 CA TYR A 103 -6.675 1.561 -0.137 1.00 74.11 C ATOM 1586 C TYR A 103 -5.700 2.735 -0.233 1.00 52.42 C ATOM 1587 O TYR A 103 -5.335 3.346 0.770 1.00 33.21 O ATOM 1588 CB TYR A 103 -5.964 0.262 -0.539 1.00 1.43 C ATOM 1589 CG TYR A 103 -6.851 -0.967 -0.453 1.00 24.44 C ATOM 1590 CD1 TYR A 103 -7.960 -1.102 -1.282 1.00 73.24 C ATOM 1591 CD2 TYR A 103 -6.590 -1.984 0.460 1.00 3.34 C ATOM 1592 CE1 TYR A 103 -8.777 -2.207 -1.207 1.00 43.11 C ATOM 1593 CE2 TYR A 103 -7.404 -3.094 0.539 1.00 4.42 C ATOM 1594 CZ TYR A 103 -8.497 -3.198 -0.296 1.00 70.11 C ATOM 1595 OH TYR A 103 -9.312 -4.305 -0.224 1.00 61.43 O ATOM 0 H TYR A 103 -7.883 1.159 -1.808 1.00 32.21 H new ATOM 0 HA TYR A 103 -7.022 1.477 0.893 1.00 74.11 H new ATOM 0 HB2 TYR A 103 -5.593 0.361 -1.559 1.00 1.43 H new ATOM 0 HB3 TYR A 103 -5.095 0.119 0.104 1.00 1.43 H new ATOM 0 HD1 TYR A 103 -8.184 -0.325 -1.998 1.00 73.24 H new ATOM 0 HD2 TYR A 103 -5.737 -1.903 1.117 1.00 3.34 H new ATOM 0 HE1 TYR A 103 -9.633 -2.295 -1.860 1.00 43.11 H new ATOM 0 HE2 TYR A 103 -7.187 -3.877 1.250 1.00 4.42 H new ATOM 0 HH TYR A 103 -8.767 -5.102 -0.057 1.00 61.43 H new ATOM 1605 N ALA A 104 -5.293 3.055 -1.460 1.00 53.14 N ATOM 1606 CA ALA A 104 -4.445 4.218 -1.708 1.00 54.14 C ATOM 1607 C ALA A 104 -5.158 5.508 -1.281 1.00 73.15 C ATOM 1608 O ALA A 104 -4.540 6.433 -0.768 1.00 35.35 O ATOM 1609 CB ALA A 104 -4.053 4.282 -3.184 1.00 43.41 C ATOM 0 H ALA A 104 -5.537 2.525 -2.297 1.00 53.14 H new ATOM 0 HA ALA A 104 -3.537 4.119 -1.112 1.00 54.14 H new ATOM 0 HB1 ALA A 104 -3.421 5.153 -3.355 1.00 43.41 H new ATOM 0 HB2 ALA A 104 -3.506 3.379 -3.455 1.00 43.41 H new ATOM 0 HB3 ALA A 104 -4.952 4.360 -3.796 1.00 43.41 H new ATOM 1615 N ASN A 105 -6.479 5.528 -1.451 1.00 72.21 N ATOM 1616 CA ASN A 105 -7.305 6.694 -1.120 1.00 31.14 C ATOM 1617 C ASN A 105 -7.199 7.058 0.377 1.00 35.54 C ATOM 1618 O ASN A 105 -7.491 8.185 0.777 1.00 33.23 O ATOM 1619 CB ASN A 105 -8.759 6.401 -1.526 1.00 4.25 C ATOM 1620 CG ASN A 105 -9.742 7.459 -1.071 1.00 31.10 C ATOM 1621 OD1 ASN A 105 -9.973 8.453 -1.753 1.00 42.41 O ATOM 1622 ND2 ASN A 105 -10.347 7.234 0.075 1.00 25.10 N ATOM 0 H ASN A 105 -7.009 4.739 -1.821 1.00 72.21 H new ATOM 0 HA ASN A 105 -6.943 7.560 -1.674 1.00 31.14 H new ATOM 0 HB2 ASN A 105 -8.813 6.310 -2.611 1.00 4.25 H new ATOM 0 HB3 ASN A 105 -9.056 5.438 -1.110 1.00 4.25 H new ATOM 0 HD21 ASN A 105 -11.037 7.898 0.427 1.00 25.10 H new ATOM 0 HD22 ASN A 105 -10.127 6.395 0.612 1.00 25.10 H new ATOM 1629 N MET A 106 -6.760 6.100 1.192 1.00 40.02 N ATOM 1630 CA MET A 106 -6.565 6.332 2.628 1.00 52.13 C ATOM 1631 C MET A 106 -5.273 7.120 2.899 1.00 31.30 C ATOM 1632 O MET A 106 -5.173 7.846 3.889 1.00 35.14 O ATOM 1633 CB MET A 106 -6.500 4.995 3.380 1.00 75.22 C ATOM 1634 CG MET A 106 -7.554 3.992 2.944 1.00 13.12 C ATOM 1635 SD MET A 106 -7.547 2.488 3.948 1.00 53.12 S ATOM 1636 CE MET A 106 -7.985 3.132 5.561 1.00 12.44 C ATOM 0 H MET A 106 -6.532 5.154 0.885 1.00 40.02 H new ATOM 0 HA MET A 106 -7.414 6.917 2.982 1.00 52.13 H new ATOM 0 HB2 MET A 106 -5.513 4.556 3.236 1.00 75.22 H new ATOM 0 HB3 MET A 106 -6.612 5.184 4.448 1.00 75.22 H new ATOM 0 HG2 MET A 106 -8.538 4.457 3.002 1.00 13.12 H new ATOM 0 HG3 MET A 106 -7.387 3.727 1.900 1.00 13.12 H new ATOM 0 HE1 MET A 106 -8.508 2.363 6.130 1.00 12.44 H new ATOM 0 HE2 MET A 106 -7.080 3.425 6.094 1.00 12.44 H new ATOM 0 HE3 MET A 106 -8.634 4.000 5.442 1.00 12.44 H new ATOM 1646 N VAL A 107 -4.290 6.978 2.010 1.00 12.50 N ATOM 1647 CA VAL A 107 -2.950 7.533 2.246 1.00 1.04 C ATOM 1648 C VAL A 107 -2.561 8.620 1.230 1.00 44.43 C ATOM 1649 O VAL A 107 -1.640 9.399 1.478 1.00 40.13 O ATOM 1650 CB VAL A 107 -1.874 6.417 2.221 1.00 54.22 C ATOM 1651 CG1 VAL A 107 -2.105 5.410 3.345 1.00 45.34 C ATOM 1652 CG2 VAL A 107 -1.838 5.714 0.863 1.00 13.11 C ATOM 0 H VAL A 107 -4.392 6.486 1.122 1.00 12.50 H new ATOM 0 HA VAL A 107 -2.991 7.994 3.233 1.00 1.04 H new ATOM 0 HB VAL A 107 -0.904 6.888 2.381 1.00 54.22 H new ATOM 0 HG11 VAL A 107 -1.337 4.638 3.305 1.00 45.34 H new ATOM 0 HG12 VAL A 107 -2.057 5.921 4.307 1.00 45.34 H new ATOM 0 HG13 VAL A 107 -3.087 4.952 3.227 1.00 45.34 H new ATOM 0 HG21 VAL A 107 -1.074 4.937 0.876 1.00 13.11 H new ATOM 0 HG22 VAL A 107 -2.810 5.264 0.660 1.00 13.11 H new ATOM 0 HG23 VAL A 107 -1.604 6.439 0.084 1.00 13.11 H new ATOM 1662 N ILE A 108 -3.252 8.674 0.095 1.00 70.53 N ATOM 1663 CA ILE A 108 -2.904 9.623 -0.968 1.00 71.43 C ATOM 1664 C ILE A 108 -3.731 10.922 -0.889 1.00 13.45 C ATOM 1665 O ILE A 108 -4.531 11.118 0.025 1.00 5.41 O ATOM 1666 CB ILE A 108 -3.075 9.010 -2.379 1.00 1.11 C ATOM 1667 CG1 ILE A 108 -4.554 8.882 -2.750 1.00 33.23 C ATOM 1668 CG2 ILE A 108 -2.382 7.647 -2.482 1.00 12.34 C ATOM 1669 CD1 ILE A 108 -4.749 8.622 -4.217 1.00 65.45 C ATOM 0 H ILE A 108 -4.052 8.077 -0.116 1.00 70.53 H new ATOM 0 HA ILE A 108 -1.853 9.861 -0.807 1.00 71.43 H new ATOM 0 HB ILE A 108 -2.600 9.689 -3.087 1.00 1.11 H new ATOM 0 HG12 ILE A 108 -5.002 8.071 -2.176 1.00 33.23 H new ATOM 0 HG13 ILE A 108 -5.077 9.797 -2.472 1.00 33.23 H new ATOM 0 HG21 ILE A 108 -2.521 7.243 -3.485 1.00 12.34 H new ATOM 0 HG22 ILE A 108 -1.317 7.764 -2.282 1.00 12.34 H new ATOM 0 HG23 ILE A 108 -2.815 6.963 -1.752 1.00 12.34 H new ATOM 0 HD11 ILE A 108 -5.814 8.539 -4.433 1.00 65.45 H new ATOM 0 HD12 ILE A 108 -4.325 9.445 -4.792 1.00 65.45 H new ATOM 0 HD13 ILE A 108 -4.249 7.693 -4.491 1.00 65.45 H new ATOM 1681 N ASP A 109 -3.523 11.797 -1.872 1.00 40.54 N ATOM 1682 CA ASP A 109 -4.226 13.078 -1.958 1.00 31.41 C ATOM 1683 C ASP A 109 -5.101 13.134 -3.226 1.00 61.35 C ATOM 1684 O ASP A 109 -4.590 13.096 -4.346 1.00 52.21 O ATOM 1685 CB ASP A 109 -3.203 14.221 -1.959 1.00 33.51 C ATOM 1686 CG ASP A 109 -3.841 15.583 -2.163 1.00 24.54 C ATOM 1687 OD1 ASP A 109 -4.707 15.966 -1.355 1.00 72.45 O ATOM 1688 OD2 ASP A 109 -3.480 16.274 -3.141 1.00 51.34 O ATOM 0 H ASP A 109 -2.862 11.638 -2.632 1.00 40.54 H new ATOM 0 HA ASP A 109 -4.881 13.184 -1.094 1.00 31.41 H new ATOM 0 HB2 ASP A 109 -2.660 14.217 -1.014 1.00 33.51 H new ATOM 0 HB3 ASP A 109 -2.471 14.046 -2.747 1.00 33.51 H new ATOM 1693 N PRO A 110 -6.436 13.225 -3.068 1.00 15.22 N ATOM 1694 CA PRO A 110 -7.371 13.243 -4.205 1.00 34.23 C ATOM 1695 C PRO A 110 -7.544 14.637 -4.838 1.00 25.14 C ATOM 1696 O PRO A 110 -8.505 14.884 -5.570 1.00 71.35 O ATOM 1697 CB PRO A 110 -8.675 12.771 -3.558 1.00 75.01 C ATOM 1698 CG PRO A 110 -8.609 13.284 -2.155 1.00 33.42 C ATOM 1699 CD PRO A 110 -7.144 13.307 -1.771 1.00 52.04 C ATOM 0 HA PRO A 110 -7.023 12.626 -5.033 1.00 34.23 H new ATOM 0 HB2 PRO A 110 -9.544 13.166 -4.084 1.00 75.01 H new ATOM 0 HB3 PRO A 110 -8.757 11.684 -3.579 1.00 75.01 H new ATOM 0 HG2 PRO A 110 -9.043 14.281 -2.086 1.00 33.42 H new ATOM 0 HG3 PRO A 110 -9.176 12.642 -1.481 1.00 33.42 H new ATOM 0 HD2 PRO A 110 -6.886 14.219 -1.232 1.00 52.04 H new ATOM 0 HD3 PRO A 110 -6.888 12.470 -1.122 1.00 52.04 H new ATOM 1707 N SER A 111 -6.607 15.544 -4.564 1.00 43.54 N ATOM 1708 CA SER A 111 -6.663 16.908 -5.116 1.00 42.40 C ATOM 1709 C SER A 111 -5.877 17.016 -6.434 1.00 32.21 C ATOM 1710 O SER A 111 -5.592 18.115 -6.911 1.00 4.23 O ATOM 1711 CB SER A 111 -6.114 17.918 -4.097 1.00 23.41 C ATOM 1712 OG SER A 111 -6.328 19.259 -4.519 1.00 14.43 O ATOM 0 H SER A 111 -5.800 15.365 -3.966 1.00 43.54 H new ATOM 0 HA SER A 111 -7.708 17.137 -5.325 1.00 42.40 H new ATOM 0 HB2 SER A 111 -6.595 17.759 -3.132 1.00 23.41 H new ATOM 0 HB3 SER A 111 -5.047 17.747 -3.954 1.00 23.41 H new ATOM 0 HG SER A 111 -6.165 19.329 -5.483 1.00 14.43 H new ATOM 1718 N THR A 112 -5.541 15.869 -7.022 1.00 25.34 N ATOM 1719 CA THR A 112 -4.771 15.822 -8.277 1.00 11.31 C ATOM 1720 C THR A 112 -5.685 15.721 -9.514 1.00 44.04 C ATOM 1721 O THR A 112 -6.908 15.871 -9.408 1.00 62.04 O ATOM 1722 CB THR A 112 -3.795 14.618 -8.280 1.00 60.02 C ATOM 1723 OG1 THR A 112 -4.531 13.384 -8.263 1.00 61.12 O ATOM 1724 CG2 THR A 112 -2.859 14.664 -7.074 1.00 12.54 C ATOM 0 H THR A 112 -5.789 14.952 -6.652 1.00 25.34 H new ATOM 0 HA THR A 112 -4.211 16.756 -8.332 1.00 11.31 H new ATOM 0 HB THR A 112 -3.196 14.677 -9.189 1.00 60.02 H new ATOM 0 HG1 THR A 112 -3.905 12.630 -8.267 1.00 61.12 H new ATOM 0 HG21 THR A 112 -2.186 13.807 -7.103 1.00 12.54 H new ATOM 0 HG22 THR A 112 -2.276 15.584 -7.101 1.00 12.54 H new ATOM 0 HG23 THR A 112 -3.446 14.633 -6.156 1.00 12.54 H new ATOM 1732 N ASP A 113 -5.072 15.491 -10.688 1.00 41.55 N ATOM 1733 CA ASP A 113 -5.803 15.303 -11.955 1.00 22.14 C ATOM 1734 C ASP A 113 -6.417 16.622 -12.474 1.00 51.51 C ATOM 1735 O ASP A 113 -6.765 17.514 -11.697 1.00 3.21 O ATOM 1736 CB ASP A 113 -6.879 14.210 -11.792 1.00 62.53 C ATOM 1737 CG ASP A 113 -7.778 14.075 -13.007 1.00 70.15 C ATOM 1738 OD1 ASP A 113 -7.253 13.850 -14.116 1.00 11.14 O ATOM 1739 OD2 ASP A 113 -9.016 14.194 -12.856 1.00 14.31 O ATOM 0 H ASP A 113 -4.059 15.430 -10.786 1.00 41.55 H new ATOM 0 HA ASP A 113 -5.085 14.977 -12.708 1.00 22.14 H new ATOM 0 HB2 ASP A 113 -6.392 13.254 -11.600 1.00 62.53 H new ATOM 0 HB3 ASP A 113 -7.490 14.437 -10.919 1.00 62.53 H new ATOM 1744 N GLY A 114 -6.533 16.753 -13.799 1.00 5.11 N ATOM 1745 CA GLY A 114 -7.099 17.967 -14.382 1.00 33.22 C ATOM 1746 C GLY A 114 -6.740 18.172 -15.854 1.00 22.14 C ATOM 1747 O GLY A 114 -7.556 17.907 -16.739 1.00 34.24 O ATOM 0 H GLY A 114 -6.247 16.045 -14.476 1.00 5.11 H new ATOM 0 HA2 GLY A 114 -8.184 17.934 -14.284 1.00 33.22 H new ATOM 0 HA3 GLY A 114 -6.753 18.828 -13.810 1.00 33.22 H new ATOM 1751 N THR A 115 -5.523 18.645 -16.117 1.00 63.02 N ATOM 1752 CA THR A 115 -5.107 19.007 -17.484 1.00 42.24 C ATOM 1753 C THR A 115 -4.734 17.781 -18.337 1.00 65.11 C ATOM 1754 O THR A 115 -5.394 17.485 -19.334 1.00 41.31 O ATOM 1755 CB THR A 115 -3.909 19.990 -17.468 1.00 25.03 C ATOM 1756 OG1 THR A 115 -2.767 19.380 -16.842 1.00 10.14 O ATOM 1757 CG2 THR A 115 -4.267 21.276 -16.729 1.00 70.14 C ATOM 0 H THR A 115 -4.804 18.789 -15.408 1.00 63.02 H new ATOM 0 HA THR A 115 -5.973 19.489 -17.937 1.00 42.24 H new ATOM 0 HB THR A 115 -3.666 20.235 -18.502 1.00 25.03 H new ATOM 0 HG1 THR A 115 -2.018 20.012 -16.841 1.00 10.14 H new ATOM 0 HG21 THR A 115 -3.409 21.948 -16.732 1.00 70.14 H new ATOM 0 HG22 THR A 115 -5.109 21.759 -17.226 1.00 70.14 H new ATOM 0 HG23 THR A 115 -4.539 21.041 -15.700 1.00 70.14 H new ATOM 1765 N GLY A 116 -3.668 17.085 -17.957 1.00 54.31 N ATOM 1766 CA GLY A 116 -3.216 15.921 -18.715 1.00 51.24 C ATOM 1767 C GLY A 116 -1.799 15.486 -18.352 1.00 71.01 C ATOM 1768 O GLY A 116 -1.223 15.989 -17.381 1.00 52.53 O ATOM 0 H GLY A 116 -3.104 17.303 -17.136 1.00 54.31 H new ATOM 0 HA2 GLY A 116 -3.901 15.092 -18.539 1.00 51.24 H new ATOM 0 HA3 GLY A 116 -3.258 16.149 -19.780 1.00 51.24 H new ATOM 1772 N MET A 117 -1.245 14.552 -19.138 1.00 40.11 N ATOM 1773 CA MET A 117 0.101 13.997 -18.901 1.00 23.44 C ATOM 1774 C MET A 117 0.124 13.101 -17.645 1.00 70.54 C ATOM 1775 O MET A 117 -0.617 13.335 -16.689 1.00 14.04 O ATOM 1776 CB MET A 117 1.164 15.111 -18.789 1.00 71.14 C ATOM 1777 CG MET A 117 1.551 15.771 -20.116 1.00 72.24 C ATOM 1778 SD MET A 117 0.171 16.574 -20.963 1.00 61.02 S ATOM 1779 CE MET A 117 -0.387 15.277 -22.075 1.00 31.21 C ATOM 0 H MET A 117 -1.713 14.159 -19.954 1.00 40.11 H new ATOM 0 HA MET A 117 0.350 13.381 -19.765 1.00 23.44 H new ATOM 0 HB2 MET A 117 0.792 15.881 -18.112 1.00 71.14 H new ATOM 0 HB3 MET A 117 2.061 14.692 -18.333 1.00 71.14 H new ATOM 0 HG2 MET A 117 2.330 16.510 -19.929 1.00 72.24 H new ATOM 0 HG3 MET A 117 1.979 15.016 -20.775 1.00 72.24 H new ATOM 0 HE1 MET A 117 -0.194 15.574 -23.106 1.00 31.21 H new ATOM 0 HE2 MET A 117 0.150 14.354 -21.856 1.00 31.21 H new ATOM 0 HE3 MET A 117 -1.456 15.115 -21.938 1.00 31.21 H new ATOM 1789 N PRO A 118 0.977 12.052 -17.633 1.00 3.01 N ATOM 1790 CA PRO A 118 1.047 11.102 -16.506 1.00 2.43 C ATOM 1791 C PRO A 118 1.381 11.783 -15.170 1.00 31.41 C ATOM 1792 O PRO A 118 0.754 11.497 -14.150 1.00 5.11 O ATOM 1793 CB PRO A 118 2.165 10.124 -16.921 1.00 44.31 C ATOM 1794 CG PRO A 118 2.930 10.835 -17.988 1.00 24.11 C ATOM 1795 CD PRO A 118 1.928 11.699 -18.705 1.00 21.13 C ATOM 0 HA PRO A 118 0.087 10.616 -16.331 1.00 2.43 H new ATOM 0 HB2 PRO A 118 2.806 9.877 -16.075 1.00 44.31 H new ATOM 0 HB3 PRO A 118 1.751 9.186 -17.292 1.00 44.31 H new ATOM 0 HG2 PRO A 118 3.730 11.438 -17.559 1.00 24.11 H new ATOM 0 HG3 PRO A 118 3.396 10.127 -18.673 1.00 24.11 H new ATOM 0 HD2 PRO A 118 2.394 12.583 -19.140 1.00 21.13 H new ATOM 0 HD3 PRO A 118 1.440 11.163 -19.519 1.00 21.13 H new ATOM 1803 N GLN A 119 2.360 12.692 -15.201 1.00 25.44 N ATOM 1804 CA GLN A 119 2.809 13.426 -14.009 1.00 51.13 C ATOM 1805 C GLN A 119 3.388 12.499 -12.924 1.00 60.25 C ATOM 1806 O GLN A 119 2.660 11.777 -12.242 1.00 20.50 O ATOM 1807 CB GLN A 119 1.665 14.273 -13.419 1.00 63.54 C ATOM 1808 CG GLN A 119 1.252 15.467 -14.279 1.00 21.14 C ATOM 1809 CD GLN A 119 2.316 16.557 -14.352 1.00 51.44 C ATOM 1810 OE1 GLN A 119 3.515 16.295 -14.295 1.00 71.11 O ATOM 1811 NE2 GLN A 119 1.881 17.790 -14.490 1.00 65.00 N ATOM 0 H GLN A 119 2.865 12.941 -16.052 1.00 25.44 H new ATOM 0 HA GLN A 119 3.612 14.085 -14.340 1.00 51.13 H new ATOM 0 HB2 GLN A 119 0.796 13.632 -13.268 1.00 63.54 H new ATOM 0 HB3 GLN A 119 1.968 14.636 -12.437 1.00 63.54 H new ATOM 0 HG2 GLN A 119 1.029 15.119 -15.288 1.00 21.14 H new ATOM 0 HG3 GLN A 119 0.332 15.893 -13.878 1.00 21.14 H new ATOM 0 HE21 GLN A 119 0.879 17.975 -14.534 1.00 65.00 H new ATOM 0 HE22 GLN A 119 2.546 18.561 -14.553 1.00 65.00 H new ATOM 1820 N PHE A 120 4.708 12.534 -12.760 1.00 24.34 N ATOM 1821 CA PHE A 120 5.372 11.759 -11.708 1.00 20.54 C ATOM 1822 C PHE A 120 5.183 12.442 -10.345 1.00 12.02 C ATOM 1823 O PHE A 120 6.119 13.017 -9.778 1.00 2.02 O ATOM 1824 CB PHE A 120 6.865 11.583 -12.025 1.00 73.43 C ATOM 1825 CG PHE A 120 7.121 10.804 -13.290 1.00 2.53 C ATOM 1826 CD1 PHE A 120 7.169 11.443 -14.521 1.00 2.43 C ATOM 1827 CD2 PHE A 120 7.302 9.428 -13.248 1.00 60.41 C ATOM 1828 CE1 PHE A 120 7.402 10.728 -15.680 1.00 71.15 C ATOM 1829 CE2 PHE A 120 7.535 8.711 -14.405 1.00 52.41 C ATOM 1830 CZ PHE A 120 7.582 9.360 -15.622 1.00 4.14 C ATOM 0 H PHE A 120 5.340 13.088 -13.338 1.00 24.34 H new ATOM 0 HA PHE A 120 4.916 10.770 -11.666 1.00 20.54 H new ATOM 0 HB2 PHE A 120 7.329 12.566 -12.112 1.00 73.43 H new ATOM 0 HB3 PHE A 120 7.349 11.075 -11.190 1.00 73.43 H new ATOM 0 HD1 PHE A 120 7.022 12.512 -14.574 1.00 2.43 H new ATOM 0 HD2 PHE A 120 7.260 8.913 -12.300 1.00 60.41 H new ATOM 0 HE1 PHE A 120 7.443 11.239 -16.631 1.00 71.15 H new ATOM 0 HE2 PHE A 120 7.681 7.642 -14.357 1.00 52.41 H new ATOM 0 HZ PHE A 120 7.759 8.799 -16.528 1.00 4.14 H new ATOM 1840 N LYS A 121 3.953 12.402 -9.843 1.00 63.41 N ATOM 1841 CA LYS A 121 3.601 13.054 -8.578 1.00 55.03 C ATOM 1842 C LYS A 121 2.892 12.074 -7.630 1.00 63.12 C ATOM 1843 O LYS A 121 1.699 11.809 -7.769 1.00 35.43 O ATOM 1844 CB LYS A 121 2.700 14.277 -8.848 1.00 1.33 C ATOM 1845 CG LYS A 121 3.136 15.552 -8.122 1.00 42.03 C ATOM 1846 CD LYS A 121 3.187 15.371 -6.607 1.00 4.21 C ATOM 1847 CE LYS A 121 3.670 16.637 -5.908 1.00 30.34 C ATOM 1848 NZ LYS A 121 3.793 16.449 -4.439 1.00 4.53 N ATOM 0 H LYS A 121 3.175 11.922 -10.294 1.00 63.41 H new ATOM 0 HA LYS A 121 4.521 13.385 -8.097 1.00 55.03 H new ATOM 0 HB2 LYS A 121 2.683 14.471 -9.920 1.00 1.33 H new ATOM 0 HB3 LYS A 121 1.680 14.035 -8.551 1.00 1.33 H new ATOM 0 HG2 LYS A 121 4.119 15.854 -8.482 1.00 42.03 H new ATOM 0 HG3 LYS A 121 2.446 16.360 -8.366 1.00 42.03 H new ATOM 0 HD2 LYS A 121 2.196 15.106 -6.238 1.00 4.21 H new ATOM 0 HD3 LYS A 121 3.851 14.542 -6.361 1.00 4.21 H new ATOM 0 HE2 LYS A 121 4.636 16.931 -6.318 1.00 30.34 H new ATOM 0 HE3 LYS A 121 2.975 17.452 -6.112 1.00 30.34 H new ATOM 0 HZ1 LYS A 121 4.124 17.333 -4.002 1.00 4.53 H new ATOM 0 HZ2 LYS A 121 2.866 16.193 -4.043 1.00 4.53 H new ATOM 0 HZ3 LYS A 121 4.475 15.689 -4.242 1.00 4.53 H new ATOM 1862 N GLY A 122 3.641 11.535 -6.675 1.00 72.41 N ATOM 1863 CA GLY A 122 3.070 10.622 -5.693 1.00 62.42 C ATOM 1864 C GLY A 122 3.009 11.232 -4.299 1.00 41.31 C ATOM 1865 O GLY A 122 3.745 12.172 -3.988 1.00 51.42 O ATOM 0 H GLY A 122 4.639 11.713 -6.560 1.00 72.41 H new ATOM 0 HA2 GLY A 122 2.065 10.338 -6.006 1.00 62.42 H new ATOM 0 HA3 GLY A 122 3.664 9.709 -5.661 1.00 62.42 H new ATOM 1869 N VAL A 123 2.130 10.707 -3.456 1.00 11.31 N ATOM 1870 CA VAL A 123 2.013 11.183 -2.074 1.00 22.11 C ATOM 1871 C VAL A 123 2.998 10.457 -1.150 1.00 15.31 C ATOM 1872 O VAL A 123 2.957 9.237 -1.020 1.00 13.20 O ATOM 1873 CB VAL A 123 0.580 10.996 -1.538 1.00 70.42 C ATOM 1874 CG1 VAL A 123 0.484 11.437 -0.078 1.00 52.32 C ATOM 1875 CG2 VAL A 123 -0.414 11.756 -2.417 1.00 51.42 C ATOM 0 H VAL A 123 1.487 9.953 -3.699 1.00 11.31 H new ATOM 0 HA VAL A 123 2.253 12.246 -2.083 1.00 22.11 H new ATOM 0 HB VAL A 123 0.327 9.937 -1.576 1.00 70.42 H new ATOM 0 HG11 VAL A 123 -0.536 11.296 0.278 1.00 52.32 H new ATOM 0 HG12 VAL A 123 1.166 10.840 0.528 1.00 52.32 H new ATOM 0 HG13 VAL A 123 0.754 12.490 0.003 1.00 52.32 H new ATOM 0 HG21 VAL A 123 -1.423 11.617 -2.029 1.00 51.42 H new ATOM 0 HG22 VAL A 123 -0.166 12.818 -2.412 1.00 51.42 H new ATOM 0 HG23 VAL A 123 -0.362 11.376 -3.437 1.00 51.42 H new ATOM 1885 N LYS A 124 3.875 11.214 -0.503 1.00 25.12 N ATOM 1886 CA LYS A 124 4.920 10.629 0.343 1.00 4.52 C ATOM 1887 C LYS A 124 4.366 9.973 1.615 1.00 14.13 C ATOM 1888 O LYS A 124 3.238 10.225 2.034 1.00 73.14 O ATOM 1889 CB LYS A 124 5.961 11.680 0.734 1.00 12.20 C ATOM 1890 CG LYS A 124 6.791 12.195 -0.433 1.00 5.44 C ATOM 1891 CD LYS A 124 7.983 13.009 0.052 1.00 50.03 C ATOM 1892 CE LYS A 124 8.963 12.163 0.860 1.00 44.53 C ATOM 1893 NZ LYS A 124 10.150 12.949 1.287 1.00 33.10 N ATOM 0 H LYS A 124 3.888 12.233 -0.544 1.00 25.12 H new ATOM 0 HA LYS A 124 5.386 9.849 -0.258 1.00 4.52 H new ATOM 0 HB2 LYS A 124 5.453 12.522 1.204 1.00 12.20 H new ATOM 0 HB3 LYS A 124 6.630 11.253 1.481 1.00 12.20 H new ATOM 0 HG2 LYS A 124 7.142 11.354 -1.032 1.00 5.44 H new ATOM 0 HG3 LYS A 124 6.168 12.810 -1.082 1.00 5.44 H new ATOM 0 HD2 LYS A 124 8.499 13.442 -0.805 1.00 50.03 H new ATOM 0 HD3 LYS A 124 7.630 13.839 0.664 1.00 50.03 H new ATOM 0 HE2 LYS A 124 8.458 11.761 1.738 1.00 44.53 H new ATOM 0 HE3 LYS A 124 9.287 11.311 0.262 1.00 44.53 H new ATOM 0 HZ1 LYS A 124 10.792 12.340 1.833 1.00 33.10 H new ATOM 0 HZ2 LYS A 124 10.647 13.311 0.448 1.00 33.10 H new ATOM 0 HZ3 LYS A 124 9.843 13.747 1.879 1.00 33.10 H new ATOM 1907 N GLY A 125 5.197 9.129 2.216 1.00 62.42 N ATOM 1908 CA GLY A 125 4.846 8.453 3.455 1.00 41.44 C ATOM 1909 C GLY A 125 5.896 7.427 3.882 1.00 1.43 C ATOM 1910 O GLY A 125 7.080 7.563 3.565 1.00 41.32 O ATOM 0 H GLY A 125 6.124 8.897 1.860 1.00 62.42 H new ATOM 0 HA2 GLY A 125 4.723 9.193 4.246 1.00 41.44 H new ATOM 0 HA3 GLY A 125 3.884 7.954 3.333 1.00 41.44 H new ATOM 1914 N THR A 126 5.460 6.396 4.597 1.00 23.13 N ATOM 1915 CA THR A 126 6.355 5.333 5.079 1.00 5.23 C ATOM 1916 C THR A 126 5.733 3.951 4.863 1.00 73.52 C ATOM 1917 O THR A 126 4.511 3.805 4.840 1.00 21.24 O ATOM 1918 CB THR A 126 6.683 5.488 6.586 1.00 23.44 C ATOM 1919 OG1 THR A 126 5.471 5.500 7.356 1.00 54.34 O ATOM 1920 CG2 THR A 126 7.477 6.763 6.861 1.00 13.21 C ATOM 0 H THR A 126 4.483 6.267 4.861 1.00 23.13 H new ATOM 0 HA THR A 126 7.275 5.425 4.502 1.00 5.23 H new ATOM 0 HB THR A 126 7.297 4.636 6.879 1.00 23.44 H new ATOM 0 HG1 THR A 126 4.746 5.881 6.818 1.00 54.34 H new ATOM 0 HG21 THR A 126 7.688 6.837 7.928 1.00 13.21 H new ATOM 0 HG22 THR A 126 8.415 6.734 6.307 1.00 13.21 H new ATOM 0 HG23 THR A 126 6.895 7.629 6.545 1.00 13.21 H new ATOM 1928 N VAL A 127 6.577 2.936 4.710 1.00 24.21 N ATOM 1929 CA VAL A 127 6.107 1.562 4.519 1.00 11.10 C ATOM 1930 C VAL A 127 6.849 0.584 5.442 1.00 40.52 C ATOM 1931 O VAL A 127 8.036 0.756 5.732 1.00 22.53 O ATOM 1932 CB VAL A 127 6.274 1.109 3.045 1.00 12.10 C ATOM 1933 CG1 VAL A 127 7.747 1.083 2.639 1.00 21.44 C ATOM 1934 CG2 VAL A 127 5.616 -0.255 2.816 1.00 50.23 C ATOM 0 H VAL A 127 7.592 3.036 4.714 1.00 24.21 H new ATOM 0 HA VAL A 127 5.047 1.551 4.774 1.00 11.10 H new ATOM 0 HB VAL A 127 5.769 1.838 2.411 1.00 12.10 H new ATOM 0 HG11 VAL A 127 7.833 0.762 1.601 1.00 21.44 H new ATOM 0 HG12 VAL A 127 8.172 2.081 2.746 1.00 21.44 H new ATOM 0 HG13 VAL A 127 8.289 0.387 3.280 1.00 21.44 H new ATOM 0 HG21 VAL A 127 5.746 -0.552 1.775 1.00 50.23 H new ATOM 0 HG22 VAL A 127 6.081 -0.997 3.466 1.00 50.23 H new ATOM 0 HG23 VAL A 127 4.552 -0.189 3.044 1.00 50.23 H new ATOM 1944 N GLU A 128 6.128 -0.428 5.910 1.00 54.20 N ATOM 1945 CA GLU A 128 6.694 -1.468 6.774 1.00 13.02 C ATOM 1946 C GLU A 128 5.845 -2.747 6.705 1.00 43.32 C ATOM 1947 O GLU A 128 4.647 -2.689 6.426 1.00 53.13 O ATOM 1948 CB GLU A 128 6.756 -0.971 8.228 1.00 12.35 C ATOM 1949 CG GLU A 128 5.396 -0.538 8.777 1.00 32.44 C ATOM 1950 CD GLU A 128 5.436 -0.155 10.249 1.00 33.40 C ATOM 1951 OE1 GLU A 128 5.440 -1.064 11.106 1.00 35.53 O ATOM 1952 OE2 GLU A 128 5.435 1.055 10.560 1.00 55.13 O ATOM 0 H GLU A 128 5.137 -0.555 5.705 1.00 54.20 H new ATOM 0 HA GLU A 128 7.702 -1.693 6.425 1.00 13.02 H new ATOM 0 HB2 GLU A 128 7.159 -1.763 8.859 1.00 12.35 H new ATOM 0 HB3 GLU A 128 7.449 -0.132 8.289 1.00 12.35 H new ATOM 0 HG2 GLU A 128 5.031 0.310 8.198 1.00 32.44 H new ATOM 0 HG3 GLU A 128 4.681 -1.349 8.639 1.00 32.44 H new ATOM 1959 N LYS A 129 6.462 -3.903 6.950 1.00 35.10 N ATOM 1960 CA LYS A 129 5.712 -5.163 7.019 1.00 21.43 C ATOM 1961 C LYS A 129 5.005 -5.313 8.374 1.00 4.22 C ATOM 1962 O LYS A 129 5.565 -4.994 9.424 1.00 63.11 O ATOM 1963 CB LYS A 129 6.620 -6.377 6.762 1.00 61.13 C ATOM 1964 CG LYS A 129 5.921 -7.716 7.018 1.00 3.23 C ATOM 1965 CD LYS A 129 6.629 -8.898 6.360 1.00 20.52 C ATOM 1966 CE LYS A 129 8.094 -9.009 6.758 1.00 32.52 C ATOM 1967 NZ LYS A 129 8.703 -10.254 6.222 1.00 23.41 N ATOM 0 H LYS A 129 7.466 -3.996 7.103 1.00 35.10 H new ATOM 0 HA LYS A 129 4.958 -5.129 6.233 1.00 21.43 H new ATOM 0 HB2 LYS A 129 6.971 -6.349 5.730 1.00 61.13 H new ATOM 0 HB3 LYS A 129 7.501 -6.306 7.400 1.00 61.13 H new ATOM 0 HG2 LYS A 129 5.862 -7.888 8.093 1.00 3.23 H new ATOM 0 HG3 LYS A 129 4.897 -7.661 6.647 1.00 3.23 H new ATOM 0 HD2 LYS A 129 6.114 -9.820 6.630 1.00 20.52 H new ATOM 0 HD3 LYS A 129 6.559 -8.800 5.277 1.00 20.52 H new ATOM 0 HE2 LYS A 129 8.642 -8.143 6.385 1.00 32.52 H new ATOM 0 HE3 LYS A 129 8.180 -8.997 7.845 1.00 32.52 H new ATOM 0 HZ1 LYS A 129 9.716 -10.097 6.045 1.00 23.41 H new ATOM 0 HZ2 LYS A 129 8.587 -11.023 6.913 1.00 23.41 H new ATOM 0 HZ3 LYS A 129 8.233 -10.515 5.332 1.00 23.41 H new ATOM 1981 N THR A 130 3.773 -5.810 8.342 1.00 34.00 N ATOM 1982 CA THR A 130 2.966 -5.961 9.556 1.00 25.21 C ATOM 1983 C THR A 130 2.255 -7.316 9.599 1.00 13.14 C ATOM 1984 O THR A 130 1.919 -7.892 8.563 1.00 71.21 O ATOM 1985 CB THR A 130 1.903 -4.840 9.678 1.00 45.21 C ATOM 1986 OG1 THR A 130 1.115 -5.037 10.861 1.00 35.45 O ATOM 1987 CG2 THR A 130 0.988 -4.807 8.456 1.00 73.21 C ATOM 0 H THR A 130 3.307 -6.117 7.488 1.00 34.00 H new ATOM 0 HA THR A 130 3.661 -5.893 10.393 1.00 25.21 H new ATOM 0 HB THR A 130 2.428 -3.887 9.740 1.00 45.21 H new ATOM 0 HG1 THR A 130 0.600 -4.225 11.050 1.00 35.45 H new ATOM 0 HG21 THR A 130 0.254 -4.010 8.573 1.00 73.21 H new ATOM 0 HG22 THR A 130 1.583 -4.624 7.561 1.00 73.21 H new ATOM 0 HG23 THR A 130 0.473 -5.763 8.361 1.00 73.21 H new ATOM 1995 N ASP A 131 2.019 -7.819 10.804 1.00 11.22 N ATOM 1996 CA ASP A 131 1.291 -9.076 10.978 1.00 34.32 C ATOM 1997 C ASP A 131 -0.226 -8.850 10.863 1.00 71.12 C ATOM 1998 O ASP A 131 -1.011 -9.800 10.931 1.00 33.42 O ATOM 1999 CB ASP A 131 1.640 -9.714 12.325 1.00 21.21 C ATOM 2000 CG ASP A 131 1.299 -8.813 13.495 1.00 61.23 C ATOM 2001 OD1 ASP A 131 2.064 -7.862 13.755 1.00 33.32 O ATOM 2002 OD2 ASP A 131 0.265 -9.055 14.158 1.00 31.12 O ATOM 0 H ASP A 131 2.319 -7.380 11.675 1.00 11.22 H new ATOM 0 HA ASP A 131 1.593 -9.758 10.183 1.00 34.32 H new ATOM 0 HB2 ASP A 131 1.103 -10.657 12.427 1.00 21.21 H new ATOM 0 HB3 ASP A 131 2.704 -9.949 12.348 1.00 21.21 H new ATOM 2007 N GLU A 132 -0.626 -7.586 10.697 1.00 44.12 N ATOM 2008 CA GLU A 132 -2.040 -7.226 10.510 1.00 1.43 C ATOM 2009 C GLU A 132 -2.602 -7.784 9.195 1.00 41.42 C ATOM 2010 O GLU A 132 -1.861 -8.029 8.242 1.00 53.21 O ATOM 2011 CB GLU A 132 -2.205 -5.700 10.523 1.00 73.04 C ATOM 2012 CG GLU A 132 -1.829 -5.052 11.848 1.00 60.51 C ATOM 2013 CD GLU A 132 -1.903 -3.536 11.799 1.00 52.21 C ATOM 2014 OE1 GLU A 132 -3.003 -2.976 12.028 1.00 0.13 O ATOM 2015 OE2 GLU A 132 -0.869 -2.894 11.523 1.00 42.24 O ATOM 0 H GLU A 132 0.011 -6.789 10.688 1.00 44.12 H new ATOM 0 HA GLU A 132 -2.598 -7.668 11.335 1.00 1.43 H new ATOM 0 HB2 GLU A 132 -1.590 -5.271 9.732 1.00 73.04 H new ATOM 0 HB3 GLU A 132 -3.241 -5.454 10.290 1.00 73.04 H new ATOM 0 HG2 GLU A 132 -2.494 -5.419 12.629 1.00 60.51 H new ATOM 0 HG3 GLU A 132 -0.818 -5.354 12.122 1.00 60.51 H new ATOM 2022 N LYS A 133 -3.917 -7.977 9.148 1.00 70.32 N ATOM 2023 CA LYS A 133 -4.581 -8.474 7.939 1.00 34.12 C ATOM 2024 C LYS A 133 -4.777 -7.357 6.901 1.00 60.23 C ATOM 2025 O LYS A 133 -4.916 -6.184 7.250 1.00 63.23 O ATOM 2026 CB LYS A 133 -5.948 -9.081 8.291 1.00 50.01 C ATOM 2027 CG LYS A 133 -6.960 -8.055 8.803 1.00 71.44 C ATOM 2028 CD LYS A 133 -8.374 -8.625 8.897 1.00 54.44 C ATOM 2029 CE LYS A 133 -9.390 -7.536 9.221 1.00 23.32 C ATOM 2030 NZ LYS A 133 -10.786 -8.045 9.208 1.00 52.42 N ATOM 0 H LYS A 133 -4.546 -7.798 9.930 1.00 70.32 H new ATOM 0 HA LYS A 133 -3.937 -9.240 7.507 1.00 34.12 H new ATOM 0 HB2 LYS A 133 -6.356 -9.572 7.408 1.00 50.01 H new ATOM 0 HB3 LYS A 133 -5.810 -9.852 9.049 1.00 50.01 H new ATOM 0 HG2 LYS A 133 -6.648 -7.701 9.786 1.00 71.44 H new ATOM 0 HG3 LYS A 133 -6.964 -7.190 8.139 1.00 71.44 H new ATOM 0 HD2 LYS A 133 -8.639 -9.103 7.954 1.00 54.44 H new ATOM 0 HD3 LYS A 133 -8.407 -9.397 9.666 1.00 54.44 H new ATOM 0 HE2 LYS A 133 -9.168 -7.115 10.202 1.00 23.32 H new ATOM 0 HE3 LYS A 133 -9.294 -6.726 8.498 1.00 23.32 H new ATOM 0 HZ1 LYS A 133 -11.438 -7.264 8.993 1.00 52.42 H new ATOM 0 HZ2 LYS A 133 -10.879 -8.784 8.482 1.00 52.42 H new ATOM 0 HZ3 LYS A 133 -11.019 -8.443 10.140 1.00 52.42 H new ATOM 2044 N VAL A 134 -4.792 -7.735 5.627 1.00 44.45 N ATOM 2045 CA VAL A 134 -5.120 -6.798 4.551 1.00 62.30 C ATOM 2046 C VAL A 134 -6.614 -6.451 4.583 1.00 40.35 C ATOM 2047 O VAL A 134 -7.467 -7.344 4.601 1.00 1.04 O ATOM 2048 CB VAL A 134 -4.757 -7.383 3.161 1.00 1.34 C ATOM 2049 CG1 VAL A 134 -5.220 -6.457 2.034 1.00 30.44 C ATOM 2050 CG2 VAL A 134 -3.254 -7.633 3.067 1.00 4.21 C ATOM 0 H VAL A 134 -4.582 -8.682 5.312 1.00 44.45 H new ATOM 0 HA VAL A 134 -4.531 -5.895 4.711 1.00 62.30 H new ATOM 0 HB VAL A 134 -5.278 -8.334 3.047 1.00 1.34 H new ATOM 0 HG11 VAL A 134 -4.952 -6.893 1.072 1.00 30.44 H new ATOM 0 HG12 VAL A 134 -6.301 -6.332 2.087 1.00 30.44 H new ATOM 0 HG13 VAL A 134 -4.737 -5.486 2.140 1.00 30.44 H new ATOM 0 HG21 VAL A 134 -3.014 -8.044 2.086 1.00 4.21 H new ATOM 0 HG22 VAL A 134 -2.719 -6.694 3.208 1.00 4.21 H new ATOM 0 HG23 VAL A 134 -2.954 -8.341 3.840 1.00 4.21 H new ATOM 2060 N LEU A 135 -6.928 -5.158 4.583 1.00 1.12 N ATOM 2061 CA LEU A 135 -8.327 -4.718 4.667 1.00 61.52 C ATOM 2062 C LEU A 135 -9.142 -5.173 3.452 1.00 34.34 C ATOM 2063 O LEU A 135 -8.702 -5.049 2.315 1.00 43.01 O ATOM 2064 CB LEU A 135 -8.415 -3.187 4.807 1.00 31.15 C ATOM 2065 CG LEU A 135 -8.460 -2.659 6.248 1.00 35.21 C ATOM 2066 CD1 LEU A 135 -8.557 -1.137 6.263 1.00 44.55 C ATOM 2067 CD2 LEU A 135 -9.638 -3.277 7.002 1.00 15.25 C ATOM 0 H LEU A 135 -6.246 -4.402 4.527 1.00 1.12 H new ATOM 0 HA LEU A 135 -8.752 -5.184 5.556 1.00 61.52 H new ATOM 0 HB2 LEU A 135 -7.557 -2.743 4.302 1.00 31.15 H new ATOM 0 HB3 LEU A 135 -9.307 -2.842 4.284 1.00 31.15 H new ATOM 0 HG LEU A 135 -7.535 -2.946 6.749 1.00 35.21 H new ATOM 0 HD11 LEU A 135 -8.588 -0.785 7.294 1.00 44.55 H new ATOM 0 HD12 LEU A 135 -7.688 -0.712 5.760 1.00 44.55 H new ATOM 0 HD13 LEU A 135 -9.464 -0.825 5.746 1.00 44.55 H new ATOM 0 HD21 LEU A 135 -9.658 -2.894 8.022 1.00 15.25 H new ATOM 0 HD22 LEU A 135 -10.569 -3.017 6.498 1.00 15.25 H new ATOM 0 HD23 LEU A 135 -9.528 -4.361 7.024 1.00 15.25 H new ATOM 2079 N SER A 136 -10.325 -5.723 3.699 1.00 73.30 N ATOM 2080 CA SER A 136 -11.267 -6.016 2.616 1.00 4.15 C ATOM 2081 C SER A 136 -11.890 -4.716 2.101 1.00 63.53 C ATOM 2082 O SER A 136 -12.188 -3.816 2.886 1.00 52.40 O ATOM 2083 CB SER A 136 -12.369 -6.975 3.084 1.00 35.24 C ATOM 2084 OG SER A 136 -13.299 -7.235 2.043 1.00 50.24 O ATOM 0 H SER A 136 -10.657 -5.975 4.630 1.00 73.30 H new ATOM 0 HA SER A 136 -10.717 -6.500 1.809 1.00 4.15 H new ATOM 0 HB2 SER A 136 -11.922 -7.911 3.418 1.00 35.24 H new ATOM 0 HB3 SER A 136 -12.889 -6.546 3.941 1.00 35.24 H new ATOM 0 HG SER A 136 -13.990 -7.850 2.367 1.00 50.24 H new ATOM 2090 N VAL A 137 -12.095 -4.627 0.787 1.00 71.22 N ATOM 2091 CA VAL A 137 -12.568 -3.390 0.142 1.00 34.15 C ATOM 2092 C VAL A 137 -13.756 -2.748 0.884 1.00 3.35 C ATOM 2093 O VAL A 137 -13.763 -1.543 1.134 1.00 60.55 O ATOM 2094 CB VAL A 137 -12.977 -3.650 -1.330 1.00 52.23 C ATOM 2095 CG1 VAL A 137 -13.428 -2.357 -2.004 1.00 52.21 C ATOM 2096 CG2 VAL A 137 -11.830 -4.287 -2.110 1.00 73.21 C ATOM 0 H VAL A 137 -11.941 -5.400 0.139 1.00 71.22 H new ATOM 0 HA VAL A 137 -11.729 -2.695 0.178 1.00 34.15 H new ATOM 0 HB VAL A 137 -13.816 -4.346 -1.327 1.00 52.23 H new ATOM 0 HG11 VAL A 137 -13.710 -2.564 -3.036 1.00 52.21 H new ATOM 0 HG12 VAL A 137 -14.285 -1.947 -1.469 1.00 52.21 H new ATOM 0 HG13 VAL A 137 -12.612 -1.635 -1.989 1.00 52.21 H new ATOM 0 HG21 VAL A 137 -12.142 -4.459 -3.140 1.00 73.21 H new ATOM 0 HG22 VAL A 137 -10.968 -3.620 -2.099 1.00 73.21 H new ATOM 0 HG23 VAL A 137 -11.560 -5.237 -1.649 1.00 73.21 H new ATOM 2106 N LYS A 138 -14.752 -3.556 1.239 1.00 21.30 N ATOM 2107 CA LYS A 138 -15.947 -3.047 1.918 1.00 10.34 C ATOM 2108 C LYS A 138 -15.657 -2.652 3.381 1.00 4.20 C ATOM 2109 O LYS A 138 -16.138 -1.623 3.856 1.00 11.13 O ATOM 2110 CB LYS A 138 -17.079 -4.080 1.858 1.00 54.34 C ATOM 2111 CG LYS A 138 -18.409 -3.563 2.401 1.00 22.21 C ATOM 2112 CD LYS A 138 -19.514 -4.607 2.288 1.00 35.14 C ATOM 2113 CE LYS A 138 -19.220 -5.841 3.133 1.00 14.34 C ATOM 2114 NZ LYS A 138 -20.267 -6.882 2.973 1.00 24.24 N ATOM 0 H LYS A 138 -14.758 -4.562 1.070 1.00 21.30 H new ATOM 0 HA LYS A 138 -16.260 -2.145 1.392 1.00 10.34 H new ATOM 0 HB2 LYS A 138 -17.217 -4.396 0.824 1.00 54.34 H new ATOM 0 HB3 LYS A 138 -16.784 -4.963 2.424 1.00 54.34 H new ATOM 0 HG2 LYS A 138 -18.287 -3.275 3.445 1.00 22.21 H new ATOM 0 HG3 LYS A 138 -18.700 -2.666 1.855 1.00 22.21 H new ATOM 0 HD2 LYS A 138 -20.461 -4.169 2.603 1.00 35.14 H new ATOM 0 HD3 LYS A 138 -19.630 -4.901 1.245 1.00 35.14 H new ATOM 0 HE2 LYS A 138 -18.252 -6.253 2.850 1.00 14.34 H new ATOM 0 HE3 LYS A 138 -19.150 -5.555 4.182 1.00 14.34 H new ATOM 0 HZ1 LYS A 138 -20.031 -7.705 3.563 1.00 24.24 H new ATOM 0 HZ2 LYS A 138 -21.187 -6.497 3.267 1.00 24.24 H new ATOM 0 HZ3 LYS A 138 -20.317 -7.174 1.976 1.00 24.24 H new ATOM 2128 N GLU A 139 -14.856 -3.457 4.088 1.00 23.33 N ATOM 2129 CA GLU A 139 -14.511 -3.153 5.486 1.00 32.32 C ATOM 2130 C GLU A 139 -13.698 -1.860 5.569 1.00 21.21 C ATOM 2131 O GLU A 139 -13.810 -1.097 6.527 1.00 43.34 O ATOM 2132 CB GLU A 139 -13.740 -4.314 6.131 1.00 60.12 C ATOM 2133 CG GLU A 139 -13.347 -4.057 7.585 1.00 52.11 C ATOM 2134 CD GLU A 139 -12.966 -5.328 8.327 1.00 51.33 C ATOM 2135 OE1 GLU A 139 -13.872 -6.134 8.629 1.00 3.51 O ATOM 2136 OE2 GLU A 139 -11.772 -5.528 8.620 1.00 20.11 O ATOM 0 H GLU A 139 -14.438 -4.313 3.724 1.00 23.33 H new ATOM 0 HA GLU A 139 -15.440 -3.017 6.039 1.00 32.32 H new ATOM 0 HB2 GLU A 139 -14.351 -5.215 6.083 1.00 60.12 H new ATOM 0 HB3 GLU A 139 -12.839 -4.508 5.549 1.00 60.12 H new ATOM 0 HG2 GLU A 139 -12.509 -3.361 7.612 1.00 52.11 H new ATOM 0 HG3 GLU A 139 -14.178 -3.576 8.101 1.00 52.11 H new ATOM 2143 N LEU A 140 -12.883 -1.621 4.548 1.00 50.32 N ATOM 2144 CA LEU A 140 -12.161 -0.367 4.402 1.00 61.33 C ATOM 2145 C LEU A 140 -13.145 0.819 4.403 1.00 3.42 C ATOM 2146 O LEU A 140 -12.893 1.853 5.029 1.00 55.23 O ATOM 2147 CB LEU A 140 -11.353 -0.410 3.101 1.00 24.33 C ATOM 2148 CG LEU A 140 -10.124 0.501 3.067 1.00 33.25 C ATOM 2149 CD1 LEU A 140 -9.161 0.049 1.984 1.00 34.15 C ATOM 2150 CD2 LEU A 140 -10.518 1.959 2.856 1.00 65.22 C ATOM 0 H LEU A 140 -12.706 -2.291 3.800 1.00 50.32 H new ATOM 0 HA LEU A 140 -11.479 -0.232 5.242 1.00 61.33 H new ATOM 0 HB2 LEU A 140 -11.030 -1.436 2.927 1.00 24.33 H new ATOM 0 HB3 LEU A 140 -12.010 -0.138 2.275 1.00 24.33 H new ATOM 0 HG LEU A 140 -9.626 0.428 4.034 1.00 33.25 H new ATOM 0 HD11 LEU A 140 -8.292 0.707 1.972 1.00 34.15 H new ATOM 0 HD12 LEU A 140 -8.840 -0.973 2.186 1.00 34.15 H new ATOM 0 HD13 LEU A 140 -9.659 0.088 1.015 1.00 34.15 H new ATOM 0 HD21 LEU A 140 -9.622 2.579 2.837 1.00 65.22 H new ATOM 0 HD22 LEU A 140 -11.049 2.059 1.909 1.00 65.22 H new ATOM 0 HD23 LEU A 140 -11.166 2.282 3.671 1.00 65.22 H new ATOM 2162 N LEU A 141 -14.279 0.644 3.716 1.00 10.01 N ATOM 2163 CA LEU A 141 -15.336 1.661 3.690 1.00 52.31 C ATOM 2164 C LEU A 141 -15.851 1.930 5.113 1.00 5.21 C ATOM 2165 O LEU A 141 -15.973 3.079 5.543 1.00 10.41 O ATOM 2166 CB LEU A 141 -16.508 1.206 2.802 1.00 32.12 C ATOM 2167 CG LEU A 141 -16.129 0.678 1.406 1.00 52.14 C ATOM 2168 CD1 LEU A 141 -17.371 0.215 0.647 1.00 71.02 C ATOM 2169 CD2 LEU A 141 -15.366 1.732 0.609 1.00 10.31 C ATOM 0 H LEU A 141 -14.488 -0.192 3.171 1.00 10.01 H new ATOM 0 HA LEU A 141 -14.913 2.577 3.277 1.00 52.31 H new ATOM 0 HB2 LEU A 141 -17.055 0.424 3.329 1.00 32.12 H new ATOM 0 HB3 LEU A 141 -17.192 2.046 2.678 1.00 32.12 H new ATOM 0 HG LEU A 141 -15.471 -0.181 1.539 1.00 52.14 H new ATOM 0 HD11 LEU A 141 -17.080 -0.154 -0.336 1.00 71.02 H new ATOM 0 HD12 LEU A 141 -17.861 -0.584 1.204 1.00 71.02 H new ATOM 0 HD13 LEU A 141 -18.060 1.052 0.531 1.00 71.02 H new ATOM 0 HD21 LEU A 141 -15.111 1.332 -0.372 1.00 10.31 H new ATOM 0 HD22 LEU A 141 -15.989 2.619 0.489 1.00 10.31 H new ATOM 0 HD23 LEU A 141 -14.453 1.999 1.140 1.00 10.31 H new ATOM 2181 N GLU A 142 -16.142 0.851 5.837 1.00 73.14 N ATOM 2182 CA GLU A 142 -16.605 0.940 7.227 1.00 2.04 C ATOM 2183 C GLU A 142 -15.557 1.630 8.115 1.00 44.33 C ATOM 2184 O GLU A 142 -15.887 2.489 8.934 1.00 44.33 O ATOM 2185 CB GLU A 142 -16.905 -0.465 7.772 1.00 14.55 C ATOM 2186 CG GLU A 142 -17.889 -1.259 6.917 1.00 1.01 C ATOM 2187 CD GLU A 142 -18.186 -2.639 7.488 1.00 55.34 C ATOM 2188 OE1 GLU A 142 -17.350 -3.552 7.328 1.00 55.11 O ATOM 2189 OE2 GLU A 142 -19.267 -2.820 8.093 1.00 33.11 O ATOM 0 H GLU A 142 -16.066 -0.103 5.484 1.00 73.14 H new ATOM 0 HA GLU A 142 -17.516 1.538 7.244 1.00 2.04 H new ATOM 0 HB2 GLU A 142 -15.971 -1.022 7.848 1.00 14.55 H new ATOM 0 HB3 GLU A 142 -17.305 -0.375 8.782 1.00 14.55 H new ATOM 0 HG2 GLU A 142 -18.820 -0.699 6.828 1.00 1.01 H new ATOM 0 HG3 GLU A 142 -17.484 -1.366 5.911 1.00 1.01 H new ATOM 2196 N ALA A 143 -14.291 1.260 7.923 1.00 4.11 N ATOM 2197 CA ALA A 143 -13.182 1.800 8.714 1.00 60.21 C ATOM 2198 C ALA A 143 -13.077 3.329 8.598 1.00 1.32 C ATOM 2199 O ALA A 143 -12.913 4.023 9.603 1.00 50.55 O ATOM 2200 CB ALA A 143 -11.867 1.148 8.292 1.00 22.01 C ATOM 0 H ALA A 143 -14.005 0.581 7.218 1.00 4.11 H new ATOM 0 HA ALA A 143 -13.384 1.566 9.759 1.00 60.21 H new ATOM 0 HB1 ALA A 143 -11.051 1.557 8.887 1.00 22.01 H new ATOM 0 HB2 ALA A 143 -11.927 0.071 8.451 1.00 22.01 H new ATOM 0 HB3 ALA A 143 -11.683 1.349 7.237 1.00 22.01 H new ATOM 2206 N ILE A 144 -13.174 3.849 7.372 1.00 23.31 N ATOM 2207 CA ILE A 144 -13.071 5.298 7.146 1.00 12.52 C ATOM 2208 C ILE A 144 -14.367 6.041 7.516 1.00 21.24 C ATOM 2209 O ILE A 144 -14.403 7.271 7.515 1.00 50.02 O ATOM 2210 CB ILE A 144 -12.650 5.626 5.682 1.00 62.24 C ATOM 2211 CG1 ILE A 144 -13.637 5.041 4.650 1.00 52.11 C ATOM 2212 CG2 ILE A 144 -11.236 5.108 5.418 1.00 42.34 C ATOM 2213 CD1 ILE A 144 -14.864 5.899 4.389 1.00 53.54 C ATOM 0 H ILE A 144 -13.322 3.298 6.527 1.00 23.31 H new ATOM 0 HA ILE A 144 -12.286 5.655 7.813 1.00 12.52 H new ATOM 0 HB ILE A 144 -12.668 6.710 5.567 1.00 62.24 H new ATOM 0 HG12 ILE A 144 -13.109 4.889 3.708 1.00 52.11 H new ATOM 0 HG13 ILE A 144 -13.963 4.060 4.995 1.00 52.11 H new ATOM 0 HG21 ILE A 144 -10.949 5.341 4.393 1.00 42.34 H new ATOM 0 HG22 ILE A 144 -10.539 5.585 6.107 1.00 42.34 H new ATOM 0 HG23 ILE A 144 -11.211 4.028 5.566 1.00 42.34 H new ATOM 0 HD11 ILE A 144 -15.500 5.410 3.651 1.00 53.54 H new ATOM 0 HD12 ILE A 144 -15.420 6.031 5.317 1.00 53.54 H new ATOM 0 HD13 ILE A 144 -14.553 6.873 4.011 1.00 53.54 H new ATOM 2225 N GLY A 145 -15.428 5.291 7.825 1.00 13.03 N ATOM 2226 CA GLY A 145 -16.691 5.903 8.251 1.00 1.35 C ATOM 2227 C GLY A 145 -17.912 5.390 7.488 1.00 62.00 C ATOM 2228 O GLY A 145 -19.018 5.343 8.031 1.00 51.41 O ATOM 0 H GLY A 145 -15.440 4.272 7.789 1.00 13.03 H new ATOM 0 HA2 GLY A 145 -16.834 5.716 9.315 1.00 1.35 H new ATOM 0 HA3 GLY A 145 -16.622 6.983 8.124 1.00 1.35 H new ATOM 2232 N SER A 146 -17.720 5.009 6.228 1.00 52.21 N ATOM 2233 CA SER A 146 -18.829 4.547 5.375 1.00 44.03 C ATOM 2234 C SER A 146 -19.173 3.080 5.647 1.00 42.50 C ATOM 2235 O SER A 146 -20.345 2.693 5.680 1.00 74.24 O ATOM 2236 CB SER A 146 -18.479 4.726 3.890 1.00 53.43 C ATOM 2237 OG SER A 146 -19.528 4.271 3.047 1.00 33.55 O ATOM 0 H SER A 146 -16.809 5.008 5.768 1.00 52.21 H new ATOM 0 HA SER A 146 -19.700 5.156 5.617 1.00 44.03 H new ATOM 0 HB2 SER A 146 -18.279 5.778 3.687 1.00 53.43 H new ATOM 0 HB3 SER A 146 -17.565 4.178 3.662 1.00 53.43 H new ATOM 0 HG SER A 146 -19.274 4.401 2.109 1.00 33.55 H new TER 2243 SER A 146