USER MOD reduce.3.24.130724 H: found=0, std=0, add=1032, rem=0, adj=55 USER MOD reduce.3.24.130724 removed 1031 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 64 LYS NZ :NH3+ -177:sc= 0.997 (180deg=0.967) USER MOD Set 1.2: A 125 SER OG : rot 36:sc= -0.109 USER MOD Set 2.1: A 57 CYS SG : rot 160:sc= 0.565 USER MOD Set 2.2: A 102 SER OG : rot 180:sc= 0 USER MOD Set 2.3: A 109 HIS : +bothHN:sc= 0.999 K(o=1.6,f=-5.2!) USER MOD Set 3.1: A 47 SER OG : rot 176:sc= 0.899 USER MOD Set 3.2: A 62 TYR OH : rot 130:sc= 0.434 USER MOD Set 4.1: A 41 THR OG1 : rot 118:sc= 0.792 USER MOD Set 4.2: A 43 SER OG : rot 43:sc= 1.38 USER MOD Set 5.1: A 37 ASN :FLIP amide:sc= 0.959 F(o=0.79,f=2.2) USER MOD Set 5.2: A 39 SER OG : rot 1:sc= 1.2 USER MOD Set 6.1: A 23 HIS : no HD1:sc= -0.497 X(o=-0.5,f=-0.53) USER MOD Set 6.2: A 25 ASN : amide:sc= 0 K(o=-0.5,f=-1.3) USER MOD Single : A 1 MET CE :methyl -164:sc= -0.0403 (180deg=-0.339) USER MOD Single : A 1 MET N :NH3+ -148:sc= 0.453 (180deg=-0.382!) USER MOD Single : A 2 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0445) USER MOD Single : A 3 LYS NZ :NH3+ 164:sc= -0.0194 (180deg=-0.206) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.201 USER MOD Single : A 8 THR OG1 : rot -40:sc= 0.796 USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 THR OG1 : rot 180:sc= -0.119 USER MOD Single : A 32 GLN : amide:sc= -0.978 K(o=-0.98,f=-5.2!) USER MOD Single : A 33 THR OG1 : rot 180:sc= -0.107 USER MOD Single : A 34 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 36 THR OG1 : rot 51:sc= 0.385 USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= -0.138 X(o=-0.14,f=-0.64) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 119:sc= 0.938 USER MOD Single : A 48 SER OG : rot -34:sc= 0.536 USER MOD Single : A 50 ASN : amide:sc= 0.0487 K(o=0.049,f=-8.5!) USER MOD Single : A 52 TYR OH : rot 180:sc= 0 USER MOD Single : A 53 THR OG1 : rot 180:sc= -0.355 USER MOD Single : A 56 GLN : amide:sc= -0.0104 K(o=-0.01,f=-0.61) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 86:sc= 0.861 USER MOD Single : A 68 ASN : amide:sc= 1.17 K(o=1.2,f=-0.0018) USER MOD Single : A 71 SER OG : rot 140:sc= -0.398 USER MOD Single : A 72 THR OG1 : rot -33:sc= 0.767 USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 ASN : amide:sc= -0.903 X(o=-0.9,f=-0.73) USER MOD Single : A 78 ASN :FLIP amide:sc= -1.21 F(o=-2.4!,f=-1.2) USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot -88:sc= 0.713 USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 88 TYR OH : rot 1:sc= 0.208 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= -0.333 X(o=-0.33,f=-0.38) USER MOD Single : A 92 ASN : amide:sc= 0.263 X(o=0.26,f=0) USER MOD Single : A 93 SER OG : rot 180:sc= -0.395 USER MOD Single : A 98 SER OG : rot -104:sc= 0.889 USER MOD Single : A 101 GLN : amide:sc= -1.09! C(o=-1.1!,f=-8.9!) USER MOD Single : A 103 THR OG1 : rot -24:sc= 1.16 USER MOD Single : A 107 TYR OH : rot 180:sc= 0 USER MOD Single : A 112 TYR OH : rot 180:sc= -0.895 USER MOD Single : A 115 ASN : amide:sc= -0.469 K(o=-0.47,f=-2.6!) USER MOD Single : A 117 ASN : amide:sc= -0.113 X(o=-0.11,f=-0.024) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 81:sc= -0.0767 USER MOD Single : A 127 MET CE :methyl -152:sc= -2.17 (180deg=-3.06!) USER MOD Single : A 128 ASN :FLIP amide:sc= -0.0202 F(o=-0.78,f=-0.02) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 130 ASN : amide:sc=-0.00599 X(o=-0.006,f=0) USER MOD Single : A 135 SER OG : rot 173:sc= 0.744 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD Single : A 140 THR OG1 : rot 180:sc= -0.254 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 147 SER OG : rot -23:sc= 0.265 USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 149 TYR OH : rot 180:sc= 0 USER MOD Single : A 150 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 151 TYR OH : rot 30:sc= -0.218 USER MOD Single : A 153 HIS : no HD1:sc= 0.552 K(o=0.55,f=-4!) USER MOD Single : A 155 ASN : amide:sc= -0.0906 K(o=-0.091,f=-2.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -72.986 16.263 -44.654 1.00 32.11 N ATOM 2 CA MET A 1 -71.523 16.510 -44.497 1.00 34.41 C ATOM 3 C MET A 1 -71.210 17.116 -43.118 1.00 33.14 C ATOM 4 O MET A 1 -72.098 17.650 -42.460 1.00 35.54 O ATOM 5 CB MET A 1 -71.010 17.437 -45.615 1.00 2.41 C ATOM 6 CG MET A 1 -71.723 18.783 -45.681 1.00 72.32 C ATOM 7 SD MET A 1 -73.477 18.626 -46.069 1.00 44.42 S ATOM 8 CE MET A 1 -73.412 18.023 -47.760 1.00 4.50 C ATOM 0 H1 MET A 1 -73.135 15.430 -45.259 1.00 32.11 H new ATOM 0 H2 MET A 1 -73.412 16.093 -43.720 1.00 32.11 H new ATOM 0 H3 MET A 1 -73.433 17.093 -45.092 1.00 32.11 H new ATOM 0 HA MET A 1 -71.010 15.551 -44.572 1.00 34.41 H new ATOM 0 HB2 MET A 1 -69.944 17.609 -45.469 1.00 2.41 H new ATOM 0 HB3 MET A 1 -71.123 16.930 -46.573 1.00 2.41 H new ATOM 0 HG2 MET A 1 -71.611 19.295 -44.725 1.00 72.32 H new ATOM 0 HG3 MET A 1 -71.243 19.407 -46.435 1.00 72.32 H new ATOM 0 HE1 MET A 1 -74.389 18.146 -48.228 1.00 4.50 H new ATOM 0 HE2 MET A 1 -72.667 18.589 -48.320 1.00 4.50 H new ATOM 0 HE3 MET A 1 -73.141 16.967 -47.760 1.00 4.50 H new ATOM 20 N LYS A 2 -69.944 17.031 -42.692 1.00 34.14 N ATOM 21 CA LYS A 2 -69.524 17.547 -41.379 1.00 44.34 C ATOM 22 C LYS A 2 -69.774 19.065 -41.253 1.00 1.44 C ATOM 23 O LYS A 2 -68.932 19.889 -41.621 1.00 3.23 O ATOM 24 CB LYS A 2 -68.041 17.207 -41.116 1.00 35.20 C ATOM 25 CG LYS A 2 -67.059 17.757 -42.157 1.00 12.10 C ATOM 26 CD LYS A 2 -65.614 17.388 -41.822 1.00 40.14 C ATOM 27 CE LYS A 2 -64.612 18.065 -42.757 1.00 13.14 C ATOM 28 NZ LYS A 2 -64.846 17.717 -44.185 1.00 24.51 N ATOM 0 H LYS A 2 -69.191 16.610 -43.236 1.00 34.14 H new ATOM 0 HA LYS A 2 -70.133 17.057 -40.619 1.00 44.34 H new ATOM 0 HB2 LYS A 2 -67.763 17.594 -40.136 1.00 35.20 H new ATOM 0 HB3 LYS A 2 -67.934 16.123 -41.073 1.00 35.20 H new ATOM 0 HG2 LYS A 2 -67.316 17.366 -43.142 1.00 12.10 H new ATOM 0 HG3 LYS A 2 -67.155 18.841 -42.210 1.00 12.10 H new ATOM 0 HD2 LYS A 2 -65.398 17.674 -40.793 1.00 40.14 H new ATOM 0 HD3 LYS A 2 -65.493 16.307 -41.885 1.00 40.14 H new ATOM 0 HE2 LYS A 2 -64.677 19.146 -42.634 1.00 13.14 H new ATOM 0 HE3 LYS A 2 -63.601 17.772 -42.475 1.00 13.14 H new ATOM 0 HZ1 LYS A 2 -64.084 18.116 -44.769 1.00 24.51 H new ATOM 0 HZ2 LYS A 2 -64.859 16.683 -44.293 1.00 24.51 H new ATOM 0 HZ3 LYS A 2 -65.759 18.109 -44.493 1.00 24.51 H new ATOM 42 N LYS A 3 -70.951 19.426 -40.750 1.00 22.05 N ATOM 43 CA LYS A 3 -71.340 20.835 -40.631 1.00 22.05 C ATOM 44 C LYS A 3 -70.595 21.530 -39.477 1.00 41.12 C ATOM 45 O LYS A 3 -69.961 22.570 -39.669 1.00 12.31 O ATOM 46 CB LYS A 3 -72.858 20.954 -40.420 1.00 54.21 C ATOM 47 CG LYS A 3 -73.406 22.342 -40.741 1.00 12.20 C ATOM 48 CD LYS A 3 -73.406 22.602 -42.246 1.00 52.02 C ATOM 49 CE LYS A 3 -73.619 24.071 -42.577 1.00 60.42 C ATOM 50 NZ LYS A 3 -72.449 24.901 -42.176 1.00 55.41 N ATOM 0 H LYS A 3 -71.654 18.766 -40.417 1.00 22.05 H new ATOM 0 HA LYS A 3 -71.065 21.333 -41.561 1.00 22.05 H new ATOM 0 HB2 LYS A 3 -73.363 20.218 -41.045 1.00 54.21 H new ATOM 0 HB3 LYS A 3 -73.094 20.708 -39.385 1.00 54.21 H new ATOM 0 HG2 LYS A 3 -74.421 22.434 -40.354 1.00 12.20 H new ATOM 0 HG3 LYS A 3 -72.803 23.099 -40.239 1.00 12.20 H new ATOM 0 HD2 LYS A 3 -72.458 22.270 -42.670 1.00 52.02 H new ATOM 0 HD3 LYS A 3 -74.191 22.008 -42.715 1.00 52.02 H new ATOM 0 HE2 LYS A 3 -73.794 24.181 -43.647 1.00 60.42 H new ATOM 0 HE3 LYS A 3 -74.513 24.433 -42.069 1.00 60.42 H new ATOM 0 HZ1 LYS A 3 -72.502 25.826 -42.648 1.00 55.41 H new ATOM 0 HZ2 LYS A 3 -72.457 25.037 -41.145 1.00 55.41 H new ATOM 0 HZ3 LYS A 3 -71.570 24.420 -42.455 1.00 55.41 H new ATOM 64 N LEU A 4 -70.684 20.956 -38.278 1.00 5.33 N ATOM 65 CA LEU A 4 -69.982 21.490 -37.103 1.00 13.42 C ATOM 66 C LEU A 4 -68.714 20.671 -36.801 1.00 11.50 C ATOM 67 O LEU A 4 -68.783 19.588 -36.215 1.00 44.15 O ATOM 68 CB LEU A 4 -70.899 21.510 -35.863 1.00 34.23 C ATOM 69 CG LEU A 4 -72.029 22.562 -35.870 1.00 60.34 C ATOM 70 CD1 LEU A 4 -73.076 22.246 -36.935 1.00 45.43 C ATOM 71 CD2 LEU A 4 -72.678 22.667 -34.489 1.00 40.11 C ATOM 0 H LEU A 4 -71.236 20.119 -38.091 1.00 5.33 H new ATOM 0 HA LEU A 4 -69.693 22.515 -37.336 1.00 13.42 H new ATOM 0 HB2 LEU A 4 -71.350 20.524 -35.754 1.00 34.23 H new ATOM 0 HB3 LEU A 4 -70.280 21.677 -34.981 1.00 34.23 H new ATOM 0 HG LEU A 4 -71.584 23.526 -36.117 1.00 60.34 H new ATOM 0 HD11 LEU A 4 -73.858 23.006 -36.914 1.00 45.43 H new ATOM 0 HD12 LEU A 4 -72.604 22.238 -37.918 1.00 45.43 H new ATOM 0 HD13 LEU A 4 -73.515 21.268 -36.735 1.00 45.43 H new ATOM 0 HD21 LEU A 4 -73.472 23.414 -34.516 1.00 40.11 H new ATOM 0 HD22 LEU A 4 -73.098 21.701 -34.210 1.00 40.11 H new ATOM 0 HD23 LEU A 4 -71.927 22.962 -33.756 1.00 40.11 H new ATOM 83 N VAL A 5 -67.562 21.195 -37.213 1.00 43.44 N ATOM 84 CA VAL A 5 -66.277 20.528 -36.978 1.00 53.14 C ATOM 85 C VAL A 5 -65.751 20.820 -35.559 1.00 74.35 C ATOM 86 O VAL A 5 -65.187 21.887 -35.294 1.00 44.31 O ATOM 87 CB VAL A 5 -65.217 20.958 -38.027 1.00 41.15 C ATOM 88 CG1 VAL A 5 -63.885 20.245 -37.787 1.00 31.03 C ATOM 89 CG2 VAL A 5 -65.729 20.698 -39.443 1.00 54.12 C ATOM 0 H VAL A 5 -67.489 22.081 -37.713 1.00 43.44 H new ATOM 0 HA VAL A 5 -66.449 19.456 -37.076 1.00 53.14 H new ATOM 0 HB VAL A 5 -65.044 22.029 -37.917 1.00 41.15 H new ATOM 0 HG11 VAL A 5 -63.161 20.565 -38.536 1.00 31.03 H new ATOM 0 HG12 VAL A 5 -63.513 20.494 -36.793 1.00 31.03 H new ATOM 0 HG13 VAL A 5 -64.031 19.167 -37.860 1.00 31.03 H new ATOM 0 HG21 VAL A 5 -64.973 21.005 -40.165 1.00 54.12 H new ATOM 0 HG22 VAL A 5 -65.937 19.635 -39.565 1.00 54.12 H new ATOM 0 HG23 VAL A 5 -66.643 21.268 -39.610 1.00 54.12 H new ATOM 99 N THR A 6 -65.954 19.867 -34.651 1.00 31.03 N ATOM 100 CA THR A 6 -65.509 20.006 -33.255 1.00 41.21 C ATOM 101 C THR A 6 -64.267 19.146 -32.975 1.00 3.44 C ATOM 102 O THR A 6 -63.891 18.295 -33.785 1.00 24.12 O ATOM 103 CB THR A 6 -66.628 19.614 -32.260 1.00 42.51 C ATOM 104 OG1 THR A 6 -66.198 19.837 -30.906 1.00 1.13 O ATOM 105 CG2 THR A 6 -67.037 18.152 -32.436 1.00 64.32 C ATOM 0 H THR A 6 -66.425 18.985 -34.853 1.00 31.03 H new ATOM 0 HA THR A 6 -65.258 21.057 -33.112 1.00 41.21 H new ATOM 0 HB THR A 6 -67.493 20.243 -32.471 1.00 42.51 H new ATOM 0 HG1 THR A 6 -66.917 19.586 -30.289 1.00 1.13 H new ATOM 0 HG21 THR A 6 -67.824 17.906 -31.724 1.00 64.32 H new ATOM 0 HG22 THR A 6 -67.404 17.996 -33.450 1.00 64.32 H new ATOM 0 HG23 THR A 6 -66.175 17.509 -32.260 1.00 64.32 H new ATOM 113 N ALA A 7 -63.646 19.361 -31.817 1.00 24.14 N ATOM 114 CA ALA A 7 -62.414 18.652 -31.452 1.00 40.42 C ATOM 115 C ALA A 7 -62.085 18.818 -29.962 1.00 13.11 C ATOM 116 O ALA A 7 -62.598 19.719 -29.297 1.00 43.32 O ATOM 117 CB ALA A 7 -61.247 19.142 -32.308 1.00 24.33 C ATOM 0 H ALA A 7 -63.974 20.021 -31.112 1.00 24.14 H new ATOM 0 HA ALA A 7 -62.575 17.591 -31.640 1.00 40.42 H new ATOM 0 HB1 ALA A 7 -60.340 18.608 -32.026 1.00 24.33 H new ATOM 0 HB2 ALA A 7 -61.465 18.958 -33.360 1.00 24.33 H new ATOM 0 HB3 ALA A 7 -61.103 20.211 -32.149 1.00 24.33 H new ATOM 123 N THR A 8 -61.220 17.945 -29.446 1.00 33.41 N ATOM 124 CA THR A 8 -60.775 18.018 -28.043 1.00 43.32 C ATOM 125 C THR A 8 -59.366 18.630 -27.944 1.00 54.04 C ATOM 126 O THR A 8 -58.658 18.453 -26.951 1.00 75.31 O ATOM 127 CB THR A 8 -60.783 16.614 -27.377 1.00 22.05 C ATOM 128 OG1 THR A 8 -60.453 16.710 -25.977 1.00 71.42 O ATOM 129 CG2 THR A 8 -59.801 15.666 -28.060 1.00 5.41 C ATOM 0 H THR A 8 -60.809 17.175 -29.975 1.00 33.41 H new ATOM 0 HA THR A 8 -61.478 18.660 -27.512 1.00 43.32 H new ATOM 0 HB THR A 8 -61.791 16.213 -27.486 1.00 22.05 H new ATOM 0 HG1 THR A 8 -59.740 17.371 -25.853 1.00 71.42 H new ATOM 0 HG21 THR A 8 -59.833 14.694 -27.569 1.00 5.41 H new ATOM 0 HG22 THR A 8 -60.075 15.552 -29.109 1.00 5.41 H new ATOM 0 HG23 THR A 8 -58.793 16.075 -27.991 1.00 5.41 H new ATOM 137 N THR A 9 -58.971 19.367 -28.984 1.00 23.10 N ATOM 138 CA THR A 9 -57.640 19.995 -29.043 1.00 52.10 C ATOM 139 C THR A 9 -57.730 21.528 -28.991 1.00 63.21 C ATOM 140 O THR A 9 -58.360 22.145 -29.850 1.00 43.21 O ATOM 141 CB THR A 9 -56.888 19.597 -30.338 1.00 2.34 C ATOM 142 OG1 THR A 9 -56.823 18.168 -30.457 1.00 74.04 O ATOM 143 CG2 THR A 9 -55.471 20.173 -30.363 1.00 14.44 C ATOM 0 H THR A 9 -59.553 19.547 -29.802 1.00 23.10 H new ATOM 0 HA THR A 9 -57.094 19.635 -28.171 1.00 52.10 H new ATOM 0 HB THR A 9 -57.444 20.011 -31.180 1.00 2.34 H new ATOM 0 HG1 THR A 9 -56.347 17.930 -31.280 1.00 74.04 H new ATOM 0 HG21 THR A 9 -54.973 19.874 -31.285 1.00 14.44 H new ATOM 0 HG22 THR A 9 -55.519 21.261 -30.313 1.00 14.44 H new ATOM 0 HG23 THR A 9 -54.910 19.795 -29.508 1.00 14.44 H new ATOM 151 N LEU A 10 -57.093 22.132 -27.980 1.00 72.51 N ATOM 152 CA LEU A 10 -57.026 23.601 -27.837 1.00 61.55 C ATOM 153 C LEU A 10 -58.412 24.244 -27.629 1.00 23.32 C ATOM 154 O LEU A 10 -58.592 25.445 -27.856 1.00 4.11 O ATOM 155 CB LEU A 10 -56.332 24.230 -29.058 1.00 43.04 C ATOM 156 CG LEU A 10 -54.871 23.799 -29.288 1.00 21.31 C ATOM 157 CD1 LEU A 10 -54.289 24.490 -30.521 1.00 72.13 C ATOM 158 CD2 LEU A 10 -54.019 24.090 -28.052 1.00 21.22 C ATOM 0 H LEU A 10 -56.610 21.624 -27.239 1.00 72.51 H new ATOM 0 HA LEU A 10 -56.440 23.801 -26.940 1.00 61.55 H new ATOM 0 HB2 LEU A 10 -56.909 23.983 -29.949 1.00 43.04 H new ATOM 0 HB3 LEU A 10 -56.360 25.314 -28.951 1.00 43.04 H new ATOM 0 HG LEU A 10 -54.859 22.723 -29.464 1.00 21.31 H new ATOM 0 HD11 LEU A 10 -53.257 24.171 -30.664 1.00 72.13 H new ATOM 0 HD12 LEU A 10 -54.876 24.222 -31.399 1.00 72.13 H new ATOM 0 HD13 LEU A 10 -54.318 25.570 -30.380 1.00 72.13 H new ATOM 0 HD21 LEU A 10 -52.991 23.778 -28.237 1.00 21.22 H new ATOM 0 HD22 LEU A 10 -54.041 25.159 -27.839 1.00 21.22 H new ATOM 0 HD23 LEU A 10 -54.417 23.541 -27.198 1.00 21.22 H new ATOM 170 N THR A 11 -59.374 23.453 -27.167 1.00 40.20 N ATOM 171 CA THR A 11 -60.743 23.937 -26.931 1.00 22.41 C ATOM 172 C THR A 11 -61.023 24.149 -25.434 1.00 25.12 C ATOM 173 O THR A 11 -60.327 23.604 -24.571 1.00 74.31 O ATOM 174 CB THR A 11 -61.799 22.960 -27.505 1.00 55.44 C ATOM 175 OG1 THR A 11 -63.126 23.473 -27.286 1.00 13.40 O ATOM 176 CG2 THR A 11 -61.669 21.576 -26.870 1.00 55.32 C ATOM 0 H THR A 11 -59.237 22.467 -26.945 1.00 40.20 H new ATOM 0 HA THR A 11 -60.821 24.894 -27.446 1.00 22.41 H new ATOM 0 HB THR A 11 -61.622 22.867 -28.576 1.00 55.44 H new ATOM 0 HG1 THR A 11 -63.784 22.847 -27.655 1.00 13.40 H new ATOM 0 HG21 THR A 11 -62.422 20.910 -27.291 1.00 55.32 H new ATOM 0 HG22 THR A 11 -60.676 21.175 -27.072 1.00 55.32 H new ATOM 0 HG23 THR A 11 -61.816 21.655 -25.793 1.00 55.32 H new ATOM 184 N ALA A 12 -62.050 24.943 -25.136 1.00 2.02 N ATOM 185 CA ALA A 12 -62.429 25.258 -23.753 1.00 52.44 C ATOM 186 C ALA A 12 -63.323 24.171 -23.128 1.00 71.31 C ATOM 187 O ALA A 12 -63.693 23.191 -23.782 1.00 10.23 O ATOM 188 CB ALA A 12 -63.131 26.613 -23.707 1.00 15.14 C ATOM 0 H ALA A 12 -62.642 25.385 -25.839 1.00 2.02 H new ATOM 0 HA ALA A 12 -61.514 25.296 -23.161 1.00 52.44 H new ATOM 0 HB1 ALA A 12 -63.411 26.843 -22.679 1.00 15.14 H new ATOM 0 HB2 ALA A 12 -62.458 27.384 -24.081 1.00 15.14 H new ATOM 0 HB3 ALA A 12 -64.026 26.580 -24.328 1.00 15.14 H new ATOM 194 N GLY A 13 -63.659 24.349 -21.850 1.00 23.34 N ATOM 195 CA GLY A 13 -64.535 23.405 -21.156 1.00 31.23 C ATOM 196 C GLY A 13 -63.783 22.257 -20.479 1.00 51.12 C ATOM 197 O GLY A 13 -64.040 21.931 -19.319 1.00 22.30 O ATOM 0 H GLY A 13 -63.341 25.132 -21.278 1.00 23.34 H new ATOM 0 HA2 GLY A 13 -65.113 23.943 -20.405 1.00 31.23 H new ATOM 0 HA3 GLY A 13 -65.247 22.991 -21.870 1.00 31.23 H new ATOM 201 N ILE A 14 -62.854 21.640 -21.207 1.00 43.55 N ATOM 202 CA ILE A 14 -62.080 20.504 -20.687 1.00 53.24 C ATOM 203 C ILE A 14 -60.692 20.955 -20.167 1.00 1.13 C ATOM 204 O ILE A 14 -59.756 20.162 -20.049 1.00 20.34 O ATOM 205 CB ILE A 14 -61.923 19.415 -21.789 1.00 72.10 C ATOM 206 CG1 ILE A 14 -61.371 18.106 -21.198 1.00 30.14 C ATOM 207 CG2 ILE A 14 -61.035 19.921 -22.929 1.00 51.05 C ATOM 208 CD1 ILE A 14 -61.252 16.979 -22.204 1.00 2.12 C ATOM 0 H ILE A 14 -62.615 21.906 -22.162 1.00 43.55 H new ATOM 0 HA ILE A 14 -62.626 20.080 -19.844 1.00 53.24 H new ATOM 0 HB ILE A 14 -62.911 19.204 -22.198 1.00 72.10 H new ATOM 0 HG12 ILE A 14 -60.389 18.300 -20.766 1.00 30.14 H new ATOM 0 HG13 ILE A 14 -62.020 17.785 -20.383 1.00 30.14 H new ATOM 0 HG21 ILE A 14 -60.939 19.144 -23.688 1.00 51.05 H new ATOM 0 HG22 ILE A 14 -61.484 20.809 -23.374 1.00 51.05 H new ATOM 0 HG23 ILE A 14 -60.048 20.171 -22.538 1.00 51.05 H new ATOM 0 HD11 ILE A 14 -60.856 16.091 -21.711 1.00 2.12 H new ATOM 0 HD12 ILE A 14 -62.235 16.756 -22.618 1.00 2.12 H new ATOM 0 HD13 ILE A 14 -60.579 17.278 -23.008 1.00 2.12 H new ATOM 220 N GLY A 15 -60.572 22.239 -19.825 1.00 63.22 N ATOM 221 CA GLY A 15 -59.299 22.774 -19.344 1.00 31.43 C ATOM 222 C GLY A 15 -58.971 22.358 -17.911 1.00 31.21 C ATOM 223 O GLY A 15 -59.096 23.156 -16.980 1.00 73.43 O ATOM 0 H GLY A 15 -61.331 22.919 -19.871 1.00 63.22 H new ATOM 0 HA2 GLY A 15 -58.499 22.439 -20.004 1.00 31.43 H new ATOM 0 HA3 GLY A 15 -59.325 23.862 -19.402 1.00 31.43 H new ATOM 227 N ALA A 16 -58.564 21.105 -17.730 1.00 45.22 N ATOM 228 CA ALA A 16 -58.179 20.596 -16.409 1.00 10.14 C ATOM 229 C ALA A 16 -56.672 20.766 -16.151 1.00 45.42 C ATOM 230 O ALA A 16 -55.844 20.125 -16.805 1.00 11.12 O ATOM 231 CB ALA A 16 -58.579 19.130 -16.279 1.00 41.12 C ATOM 0 H ALA A 16 -58.491 20.419 -18.481 1.00 45.22 H new ATOM 0 HA ALA A 16 -58.708 21.181 -15.657 1.00 10.14 H new ATOM 0 HB1 ALA A 16 -58.290 18.760 -15.295 1.00 41.12 H new ATOM 0 HB2 ALA A 16 -59.658 19.035 -16.399 1.00 41.12 H new ATOM 0 HB3 ALA A 16 -58.075 18.546 -17.049 1.00 41.12 H new ATOM 237 N ALA A 17 -56.323 21.627 -15.194 1.00 41.23 N ATOM 238 CA ALA A 17 -54.917 21.896 -14.853 1.00 15.42 C ATOM 239 C ALA A 17 -54.383 20.910 -13.800 1.00 71.41 C ATOM 240 O ALA A 17 -55.147 20.353 -13.012 1.00 11.32 O ATOM 241 CB ALA A 17 -54.772 23.330 -14.356 1.00 31.03 C ATOM 0 H ALA A 17 -56.995 22.154 -14.637 1.00 41.23 H new ATOM 0 HA ALA A 17 -54.322 21.761 -15.756 1.00 15.42 H new ATOM 0 HB1 ALA A 17 -53.729 23.524 -14.105 1.00 31.03 H new ATOM 0 HB2 ALA A 17 -55.092 24.020 -15.137 1.00 31.03 H new ATOM 0 HB3 ALA A 17 -55.391 23.472 -13.470 1.00 31.03 H new ATOM 247 N ILE A 18 -53.067 20.696 -13.792 1.00 62.22 N ATOM 248 CA ILE A 18 -52.437 19.764 -12.846 1.00 32.53 C ATOM 249 C ILE A 18 -51.901 20.496 -11.602 1.00 62.22 C ATOM 250 O ILE A 18 -50.962 21.291 -11.688 1.00 62.12 O ATOM 251 CB ILE A 18 -51.277 18.977 -13.512 1.00 14.22 C ATOM 252 CG1 ILE A 18 -51.789 18.189 -14.731 1.00 35.45 C ATOM 253 CG2 ILE A 18 -50.611 18.041 -12.500 1.00 30.42 C ATOM 254 CD1 ILE A 18 -50.721 17.361 -15.422 1.00 10.44 C ATOM 0 H ILE A 18 -52.414 21.153 -14.428 1.00 62.22 H new ATOM 0 HA ILE A 18 -53.213 19.063 -12.538 1.00 32.53 H new ATOM 0 HB ILE A 18 -50.529 19.691 -13.858 1.00 14.22 H new ATOM 0 HG12 ILE A 18 -52.596 17.529 -14.412 1.00 35.45 H new ATOM 0 HG13 ILE A 18 -52.215 18.888 -15.451 1.00 35.45 H new ATOM 0 HG21 ILE A 18 -49.800 17.498 -12.986 1.00 30.42 H new ATOM 0 HG22 ILE A 18 -50.211 18.626 -11.672 1.00 30.42 H new ATOM 0 HG23 ILE A 18 -51.347 17.332 -12.121 1.00 30.42 H new ATOM 0 HD11 ILE A 18 -51.160 16.836 -16.270 1.00 10.44 H new ATOM 0 HD12 ILE A 18 -49.924 18.016 -15.774 1.00 10.44 H new ATOM 0 HD13 ILE A 18 -50.311 16.636 -14.719 1.00 10.44 H new ATOM 266 N VAL A 19 -52.503 20.222 -10.447 1.00 64.32 N ATOM 267 CA VAL A 19 -52.078 20.831 -9.179 1.00 52.51 C ATOM 268 C VAL A 19 -51.336 19.812 -8.297 1.00 64.23 C ATOM 269 O VAL A 19 -51.852 18.728 -8.016 1.00 74.14 O ATOM 270 CB VAL A 19 -53.287 21.396 -8.393 1.00 31.35 C ATOM 271 CG1 VAL A 19 -52.830 22.093 -7.109 1.00 12.21 C ATOM 272 CG2 VAL A 19 -54.096 22.349 -9.272 1.00 55.00 C ATOM 0 H VAL A 19 -53.291 19.580 -10.358 1.00 64.32 H new ATOM 0 HA VAL A 19 -51.403 21.649 -9.429 1.00 52.51 H new ATOM 0 HB VAL A 19 -53.929 20.562 -8.108 1.00 31.35 H new ATOM 0 HG11 VAL A 19 -53.699 22.480 -6.576 1.00 12.21 H new ATOM 0 HG12 VAL A 19 -52.304 21.379 -6.475 1.00 12.21 H new ATOM 0 HG13 VAL A 19 -52.161 22.916 -7.360 1.00 12.21 H new ATOM 0 HG21 VAL A 19 -54.942 22.737 -8.705 1.00 55.00 H new ATOM 0 HG22 VAL A 19 -53.462 23.177 -9.591 1.00 55.00 H new ATOM 0 HG23 VAL A 19 -54.462 21.814 -10.148 1.00 55.00 H new ATOM 282 N GLY A 20 -50.128 20.168 -7.865 1.00 53.14 N ATOM 283 CA GLY A 20 -49.335 19.276 -7.023 1.00 23.22 C ATOM 284 C GLY A 20 -48.527 20.026 -5.971 1.00 64.23 C ATOM 285 O GLY A 20 -47.594 20.757 -6.301 1.00 54.33 O ATOM 0 H GLY A 20 -49.681 21.059 -8.081 1.00 53.14 H new ATOM 0 HA2 GLY A 20 -49.997 18.566 -6.528 1.00 23.22 H new ATOM 0 HA3 GLY A 20 -48.658 18.697 -7.651 1.00 23.22 H new ATOM 289 N LEU A 21 -48.884 19.843 -4.702 1.00 55.12 N ATOM 290 CA LEU A 21 -48.198 20.525 -3.598 1.00 3.01 C ATOM 291 C LEU A 21 -46.806 19.920 -3.339 1.00 20.30 C ATOM 292 O LEU A 21 -46.525 18.783 -3.727 1.00 64.02 O ATOM 293 CB LEU A 21 -49.048 20.467 -2.319 1.00 74.01 C ATOM 294 CG LEU A 21 -50.329 21.333 -2.324 1.00 72.24 C ATOM 295 CD1 LEU A 21 -51.345 20.824 -3.346 1.00 62.35 C ATOM 296 CD2 LEU A 21 -50.947 21.386 -0.926 1.00 52.24 C ATOM 0 H LEU A 21 -49.644 19.229 -4.409 1.00 55.12 H new ATOM 0 HA LEU A 21 -48.062 21.567 -3.887 1.00 3.01 H new ATOM 0 HB2 LEU A 21 -49.333 19.430 -2.142 1.00 74.01 H new ATOM 0 HB3 LEU A 21 -48.427 20.775 -1.478 1.00 74.01 H new ATOM 0 HG LEU A 21 -50.046 22.344 -2.617 1.00 72.24 H new ATOM 0 HD11 LEU A 21 -52.233 21.456 -3.322 1.00 62.35 H new ATOM 0 HD12 LEU A 21 -50.905 20.854 -4.343 1.00 62.35 H new ATOM 0 HD13 LEU A 21 -51.623 19.799 -3.103 1.00 62.35 H new ATOM 0 HD21 LEU A 21 -51.847 22.000 -0.949 1.00 52.24 H new ATOM 0 HD22 LEU A 21 -51.204 20.377 -0.603 1.00 52.24 H new ATOM 0 HD23 LEU A 21 -50.231 21.819 -0.228 1.00 52.24 H new ATOM 308 N ASP A 22 -45.943 20.690 -2.680 1.00 74.24 N ATOM 309 CA ASP A 22 -44.565 20.270 -2.390 1.00 23.43 C ATOM 310 C ASP A 22 -44.443 19.637 -0.987 1.00 41.44 C ATOM 311 O ASP A 22 -45.360 19.728 -0.170 1.00 61.43 O ATOM 312 CB ASP A 22 -43.636 21.488 -2.514 1.00 34.34 C ATOM 313 CG ASP A 22 -42.183 21.162 -2.215 1.00 24.41 C ATOM 314 OD1 ASP A 22 -41.537 20.499 -3.052 1.00 71.44 O ATOM 315 OD2 ASP A 22 -41.691 21.544 -1.134 1.00 74.24 O ATOM 0 H ASP A 22 -46.174 21.620 -2.331 1.00 74.24 H new ATOM 0 HA ASP A 22 -44.274 19.506 -3.111 1.00 23.43 H new ATOM 0 HB2 ASP A 22 -43.711 21.893 -3.523 1.00 34.34 H new ATOM 0 HB3 ASP A 22 -43.975 22.267 -1.831 1.00 34.34 H new ATOM 320 N HIS A 23 -43.305 18.994 -0.718 1.00 75.10 N ATOM 321 CA HIS A 23 -43.034 18.398 0.598 1.00 2.11 C ATOM 322 C HIS A 23 -41.790 19.038 1.238 1.00 71.20 C ATOM 323 O HIS A 23 -40.659 18.779 0.826 1.00 14.32 O ATOM 324 CB HIS A 23 -42.858 16.874 0.471 1.00 54.35 C ATOM 325 CG HIS A 23 -41.723 16.453 -0.422 1.00 13.12 C ATOM 326 ND1 HIS A 23 -40.540 15.927 0.058 1.00 52.30 N ATOM 327 CD2 HIS A 23 -41.590 16.489 -1.768 1.00 60.22 C ATOM 328 CE1 HIS A 23 -39.736 15.663 -0.951 1.00 43.23 C ATOM 329 NE2 HIS A 23 -40.348 15.992 -2.067 1.00 52.31 N ATOM 0 H HIS A 23 -42.552 18.871 -1.395 1.00 75.10 H new ATOM 0 HA HIS A 23 -43.888 18.593 1.247 1.00 2.11 H new ATOM 0 HB2 HIS A 23 -42.698 16.455 1.464 1.00 54.35 H new ATOM 0 HB3 HIS A 23 -43.784 16.444 0.089 1.00 54.35 H new ATOM 0 HD2 HIS A 23 -42.325 16.843 -2.475 1.00 60.22 H new ATOM 0 HE1 HIS A 23 -38.742 15.247 -0.875 1.00 43.23 H new ATOM 0 HE2 HIS A 23 -39.961 15.893 -3.005 1.00 52.31 H new ATOM 338 N GLY A 24 -42.009 19.888 2.242 1.00 14.41 N ATOM 339 CA GLY A 24 -40.910 20.609 2.881 1.00 75.41 C ATOM 340 C GLY A 24 -39.884 19.702 3.561 1.00 33.54 C ATOM 341 O GLY A 24 -40.210 18.977 4.503 1.00 34.13 O ATOM 0 H GLY A 24 -42.931 20.093 2.627 1.00 14.41 H new ATOM 0 HA2 GLY A 24 -40.403 21.216 2.131 1.00 75.41 H new ATOM 0 HA3 GLY A 24 -41.321 21.295 3.622 1.00 75.41 H new ATOM 345 N ASN A 25 -38.642 19.733 3.079 1.00 61.32 N ATOM 346 CA ASN A 25 -37.544 18.968 3.690 1.00 75.14 C ATOM 347 C ASN A 25 -36.789 19.818 4.725 1.00 1.43 C ATOM 348 O ASN A 25 -36.364 20.939 4.433 1.00 45.40 O ATOM 349 CB ASN A 25 -36.562 18.485 2.617 1.00 5.31 C ATOM 350 CG ASN A 25 -37.212 17.599 1.571 1.00 65.43 C ATOM 351 OD1 ASN A 25 -38.196 16.913 1.837 1.00 72.15 O ATOM 352 ND2 ASN A 25 -36.669 17.608 0.372 1.00 25.34 N ATOM 0 H ASN A 25 -38.366 20.281 2.264 1.00 61.32 H new ATOM 0 HA ASN A 25 -37.982 18.106 4.193 1.00 75.14 H new ATOM 0 HB2 ASN A 25 -36.116 19.350 2.126 1.00 5.31 H new ATOM 0 HB3 ASN A 25 -35.751 17.937 3.096 1.00 5.31 H new ATOM 0 HD21 ASN A 25 -37.065 17.033 -0.372 1.00 25.34 H new ATOM 0 HD22 ASN A 25 -35.852 18.190 0.186 1.00 25.34 H new ATOM 359 N GLU A 26 -36.619 19.283 5.930 1.00 31.44 N ATOM 360 CA GLU A 26 -35.941 20.011 7.010 1.00 43.32 C ATOM 361 C GLU A 26 -34.474 19.574 7.162 1.00 74.13 C ATOM 362 O GLU A 26 -34.185 18.409 7.454 1.00 44.41 O ATOM 363 CB GLU A 26 -36.689 19.807 8.335 1.00 65.03 C ATOM 364 CG GLU A 26 -38.153 20.241 8.292 1.00 52.11 C ATOM 365 CD GLU A 26 -38.334 21.696 7.883 1.00 72.01 C ATOM 366 OE1 GLU A 26 -37.900 22.593 8.643 1.00 72.24 O ATOM 367 OE2 GLU A 26 -38.915 21.951 6.807 1.00 50.05 O ATOM 0 H GLU A 26 -36.939 18.350 6.188 1.00 31.44 H new ATOM 0 HA GLU A 26 -35.946 21.069 6.748 1.00 43.32 H new ATOM 0 HB2 GLU A 26 -36.640 18.753 8.610 1.00 65.03 H new ATOM 0 HB3 GLU A 26 -36.178 20.365 9.119 1.00 65.03 H new ATOM 0 HG2 GLU A 26 -38.694 19.604 7.593 1.00 52.11 H new ATOM 0 HG3 GLU A 26 -38.600 20.088 9.274 1.00 52.11 H new ATOM 374 N ALA A 27 -33.555 20.513 6.953 1.00 25.24 N ATOM 375 CA ALA A 27 -32.123 20.260 7.127 1.00 23.33 C ATOM 376 C ALA A 27 -31.421 21.481 7.739 1.00 30.10 C ATOM 377 O ALA A 27 -31.905 22.610 7.629 1.00 72.52 O ATOM 378 CB ALA A 27 -31.487 19.890 5.789 1.00 71.13 C ATOM 0 H ALA A 27 -33.777 21.465 6.660 1.00 25.24 H new ATOM 0 HA ALA A 27 -32.003 19.423 7.815 1.00 23.33 H new ATOM 0 HB1 ALA A 27 -30.422 19.704 5.931 1.00 71.13 H new ATOM 0 HB2 ALA A 27 -31.963 18.991 5.396 1.00 71.13 H new ATOM 0 HB3 ALA A 27 -31.621 20.710 5.083 1.00 71.13 H new ATOM 384 N ASP A 28 -30.283 21.249 8.382 1.00 20.03 N ATOM 385 CA ASP A 28 -29.523 22.324 9.027 1.00 50.04 C ATOM 386 C ASP A 28 -28.091 22.417 8.475 1.00 5.32 C ATOM 387 O ASP A 28 -27.682 21.620 7.625 1.00 4.43 O ATOM 388 CB ASP A 28 -29.498 22.103 10.542 1.00 33.54 C ATOM 389 CG ASP A 28 -28.860 20.781 10.920 1.00 60.45 C ATOM 390 OD1 ASP A 28 -29.522 19.732 10.785 1.00 74.43 O ATOM 391 OD2 ASP A 28 -27.695 20.779 11.358 1.00 33.34 O ATOM 0 H ASP A 28 -29.861 20.325 8.473 1.00 20.03 H new ATOM 0 HA ASP A 28 -30.019 23.269 8.807 1.00 50.04 H new ATOM 0 HB2 ASP A 28 -28.950 22.917 11.017 1.00 33.54 H new ATOM 0 HB3 ASP A 28 -30.517 22.136 10.929 1.00 33.54 H new ATOM 396 N ALA A 29 -27.331 23.390 8.964 1.00 60.45 N ATOM 397 CA ALA A 29 -25.964 23.617 8.494 1.00 12.32 C ATOM 398 C ALA A 29 -24.956 23.622 9.651 1.00 55.51 C ATOM 399 O ALA A 29 -25.166 24.274 10.675 1.00 65.34 O ATOM 400 CB ALA A 29 -25.892 24.928 7.725 1.00 44.43 C ATOM 0 H ALA A 29 -27.638 24.039 9.689 1.00 60.45 H new ATOM 0 HA ALA A 29 -25.697 22.793 7.832 1.00 12.32 H new ATOM 0 HB1 ALA A 29 -24.872 25.091 7.378 1.00 44.43 H new ATOM 0 HB2 ALA A 29 -26.564 24.884 6.868 1.00 44.43 H new ATOM 0 HB3 ALA A 29 -26.189 25.749 8.377 1.00 44.43 H new ATOM 406 N ALA A 30 -23.862 22.887 9.479 1.00 74.21 N ATOM 407 CA ALA A 30 -22.785 22.848 10.473 1.00 11.30 C ATOM 408 C ALA A 30 -21.613 23.752 10.061 1.00 71.23 C ATOM 409 O ALA A 30 -21.651 24.399 9.011 1.00 72.34 O ATOM 410 CB ALA A 30 -22.309 21.414 10.664 1.00 23.21 C ATOM 0 H ALA A 30 -23.694 22.306 8.658 1.00 74.21 H new ATOM 0 HA ALA A 30 -23.177 23.224 11.418 1.00 11.30 H new ATOM 0 HB1 ALA A 30 -21.509 21.392 11.404 1.00 23.21 H new ATOM 0 HB2 ALA A 30 -23.139 20.798 11.009 1.00 23.21 H new ATOM 0 HB3 ALA A 30 -21.938 21.025 9.716 1.00 23.21 H new ATOM 416 N GLU A 31 -20.580 23.808 10.896 1.00 41.45 N ATOM 417 CA GLU A 31 -19.370 24.567 10.566 1.00 73.11 C ATOM 418 C GLU A 31 -18.111 23.900 11.134 1.00 15.03 C ATOM 419 O GLU A 31 -18.173 23.137 12.101 1.00 13.11 O ATOM 420 CB GLU A 31 -19.465 26.007 11.093 1.00 32.25 C ATOM 421 CG GLU A 31 -19.582 26.106 12.612 1.00 31.52 C ATOM 422 CD GLU A 31 -19.408 27.528 13.125 1.00 52.15 C ATOM 423 OE1 GLU A 31 -18.248 27.961 13.299 1.00 24.24 O ATOM 424 OE2 GLU A 31 -20.421 28.216 13.360 1.00 54.31 O ATOM 0 H GLU A 31 -20.552 23.341 11.802 1.00 41.45 H new ATOM 0 HA GLU A 31 -19.293 24.585 9.479 1.00 73.11 H new ATOM 0 HB2 GLU A 31 -18.583 26.560 10.770 1.00 32.25 H new ATOM 0 HB3 GLU A 31 -20.329 26.493 10.640 1.00 32.25 H new ATOM 0 HG2 GLU A 31 -20.557 25.729 12.922 1.00 31.52 H new ATOM 0 HG3 GLU A 31 -18.831 25.464 13.072 1.00 31.52 H new ATOM 431 N GLN A 32 -16.975 24.200 10.516 1.00 54.50 N ATOM 432 CA GLN A 32 -15.670 23.723 10.987 1.00 54.35 C ATOM 433 C GLN A 32 -14.663 24.877 11.014 1.00 60.34 C ATOM 434 O GLN A 32 -15.024 26.034 10.783 1.00 53.13 O ATOM 435 CB GLN A 32 -15.145 22.596 10.079 1.00 32.33 C ATOM 436 CG GLN A 32 -15.931 21.291 10.168 1.00 14.11 C ATOM 437 CD GLN A 32 -15.748 20.563 11.496 1.00 72.41 C ATOM 438 OE1 GLN A 32 -15.543 21.172 12.541 1.00 71.44 O ATOM 439 NE2 GLN A 32 -15.824 19.248 11.463 1.00 2.32 N ATOM 0 H GLN A 32 -16.927 24.778 9.677 1.00 54.50 H new ATOM 0 HA GLN A 32 -15.793 23.331 11.997 1.00 54.35 H new ATOM 0 HB2 GLN A 32 -15.159 22.943 9.046 1.00 32.33 H new ATOM 0 HB3 GLN A 32 -14.104 22.396 10.334 1.00 32.33 H new ATOM 0 HG2 GLN A 32 -16.990 21.503 10.021 1.00 14.11 H new ATOM 0 HG3 GLN A 32 -15.622 20.633 9.356 1.00 14.11 H new ATOM 0 HE21 GLN A 32 -15.996 18.769 10.579 1.00 2.32 H new ATOM 0 HE22 GLN A 32 -15.711 18.709 12.322 1.00 2.32 H new ATOM 448 N THR A 33 -13.405 24.566 11.305 1.00 34.15 N ATOM 449 CA THR A 33 -12.334 25.566 11.238 1.00 21.20 C ATOM 450 C THR A 33 -12.050 25.974 9.782 1.00 44.21 C ATOM 451 O THR A 33 -12.610 25.403 8.841 1.00 21.54 O ATOM 452 CB THR A 33 -11.026 25.044 11.885 1.00 22.42 C ATOM 453 OG1 THR A 33 -10.040 26.087 11.927 1.00 71.45 O ATOM 454 CG2 THR A 33 -10.471 23.844 11.120 1.00 73.12 C ATOM 0 H THR A 33 -13.098 23.636 11.589 1.00 34.15 H new ATOM 0 HA THR A 33 -12.679 26.436 11.796 1.00 21.20 H new ATOM 0 HB THR A 33 -11.261 24.727 12.901 1.00 22.42 H new ATOM 0 HG1 THR A 33 -9.219 25.745 12.339 1.00 71.45 H new ATOM 0 HG21 THR A 33 -9.554 23.501 11.598 1.00 73.12 H new ATOM 0 HG22 THR A 33 -11.206 23.039 11.124 1.00 73.12 H new ATOM 0 HG23 THR A 33 -10.257 24.135 10.092 1.00 73.12 H new ATOM 462 N GLN A 34 -11.187 26.963 9.594 1.00 11.30 N ATOM 463 CA GLN A 34 -10.846 27.443 8.251 1.00 54.02 C ATOM 464 C GLN A 34 -9.448 26.953 7.829 1.00 63.30 C ATOM 465 O GLN A 34 -8.429 27.490 8.279 1.00 5.04 O ATOM 466 CB GLN A 34 -10.920 28.977 8.205 1.00 12.42 C ATOM 467 CG GLN A 34 -10.633 29.577 6.831 1.00 52.11 C ATOM 468 CD GLN A 34 -10.849 31.083 6.793 1.00 1.31 C ATOM 469 OE1 GLN A 34 -11.684 31.620 7.510 1.00 13.11 O ATOM 470 NE2 GLN A 34 -10.105 31.775 5.956 1.00 71.14 N ATOM 0 H GLN A 34 -10.708 27.452 10.350 1.00 11.30 H new ATOM 0 HA GLN A 34 -11.569 27.036 7.545 1.00 54.02 H new ATOM 0 HB2 GLN A 34 -11.913 29.291 8.526 1.00 12.42 H new ATOM 0 HB3 GLN A 34 -10.209 29.385 8.923 1.00 12.42 H new ATOM 0 HG2 GLN A 34 -9.604 29.354 6.549 1.00 52.11 H new ATOM 0 HG3 GLN A 34 -11.276 29.103 6.090 1.00 52.11 H new ATOM 0 HE21 GLN A 34 -9.418 31.299 5.372 1.00 71.14 H new ATOM 0 HE22 GLN A 34 -10.216 32.787 5.892 1.00 71.14 H new ATOM 479 N PRO A 35 -9.378 25.915 6.967 1.00 74.33 N ATOM 480 CA PRO A 35 -8.097 25.350 6.515 1.00 31.11 C ATOM 481 C PRO A 35 -7.346 26.273 5.539 1.00 52.31 C ATOM 482 O PRO A 35 -7.523 26.198 4.319 1.00 62.44 O ATOM 483 CB PRO A 35 -8.508 24.038 5.831 1.00 25.52 C ATOM 484 CG PRO A 35 -9.905 24.280 5.361 1.00 53.10 C ATOM 485 CD PRO A 35 -10.534 25.211 6.370 1.00 21.23 C ATOM 0 HA PRO A 35 -7.401 25.211 7.342 1.00 31.11 H new ATOM 0 HB2 PRO A 35 -7.845 23.800 4.999 1.00 25.52 H new ATOM 0 HB3 PRO A 35 -8.463 23.198 6.524 1.00 25.52 H new ATOM 0 HG2 PRO A 35 -9.909 24.724 4.366 1.00 53.10 H new ATOM 0 HG3 PRO A 35 -10.461 23.345 5.295 1.00 53.10 H new ATOM 0 HD2 PRO A 35 -11.225 25.907 5.896 1.00 21.23 H new ATOM 0 HD3 PRO A 35 -11.101 24.662 7.122 1.00 21.23 H new ATOM 493 N THR A 36 -6.515 27.158 6.086 1.00 55.23 N ATOM 494 CA THR A 36 -5.752 28.113 5.273 1.00 45.43 C ATOM 495 C THR A 36 -4.525 27.456 4.630 1.00 75.43 C ATOM 496 O THR A 36 -3.384 27.709 5.021 1.00 3.31 O ATOM 497 CB THR A 36 -5.303 29.345 6.103 1.00 71.33 C ATOM 498 OG1 THR A 36 -4.507 28.931 7.228 1.00 64.31 O ATOM 499 CG2 THR A 36 -6.507 30.142 6.597 1.00 0.13 C ATOM 0 H THR A 36 -6.350 27.236 7.090 1.00 55.23 H new ATOM 0 HA THR A 36 -6.424 28.449 4.484 1.00 45.43 H new ATOM 0 HB THR A 36 -4.704 29.983 5.452 1.00 71.33 H new ATOM 0 HG1 THR A 36 -3.792 28.335 6.921 1.00 64.31 H new ATOM 0 HG21 THR A 36 -6.163 30.999 7.176 1.00 0.13 H new ATOM 0 HG22 THR A 36 -7.088 30.490 5.743 1.00 0.13 H new ATOM 0 HG23 THR A 36 -7.131 29.507 7.226 1.00 0.13 H new ATOM 507 N ASN A 37 -4.768 26.590 3.651 1.00 34.45 N ATOM 508 CA ASN A 37 -3.686 25.942 2.911 1.00 41.12 C ATOM 509 C ASN A 37 -3.130 26.887 1.837 1.00 61.23 C ATOM 510 O ASN A 37 -3.668 26.982 0.731 1.00 62.35 O ATOM 511 CB ASN A 37 -4.176 24.640 2.272 1.00 62.01 C ATOM 512 CG ASN A 37 -3.056 23.888 1.578 1.00 21.42 C ATOM 513 OD1 ASN A 37 -2.802 24.219 0.328 1.00 10.04 O flip ATOM 514 ND2 ASN A 37 -2.417 23.025 2.164 1.00 50.22 N flip ATOM 0 H ASN A 37 -5.704 26.319 3.350 1.00 34.45 H new ATOM 0 HA ASN A 37 -2.886 25.703 3.612 1.00 41.12 H new ATOM 0 HB2 ASN A 37 -4.618 24.004 3.039 1.00 62.01 H new ATOM 0 HB3 ASN A 37 -4.963 24.864 1.551 1.00 62.01 H new ATOM 0 HD21 ASN A 37 -2.641 22.794 3.132 1.00 50.22 H new ATOM 0 HD22 ASN A 37 -1.661 22.537 1.685 1.00 50.22 H new ATOM 521 N GLN A 38 -2.054 27.592 2.179 1.00 23.33 N ATOM 522 CA GLN A 38 -1.465 28.607 1.293 1.00 42.22 C ATOM 523 C GLN A 38 -0.638 27.992 0.147 1.00 55.53 C ATOM 524 O GLN A 38 -0.148 28.711 -0.726 1.00 24.44 O ATOM 525 CB GLN A 38 -0.601 29.575 2.114 1.00 44.33 C ATOM 526 CG GLN A 38 0.549 28.900 2.854 1.00 23.55 C ATOM 527 CD GLN A 38 1.284 29.851 3.784 1.00 60.52 C ATOM 528 OE1 GLN A 38 2.233 30.521 3.389 1.00 23.52 O ATOM 529 NE2 GLN A 38 0.857 29.909 5.027 1.00 20.21 N ATOM 0 H GLN A 38 -1.566 27.482 3.068 1.00 23.33 H new ATOM 0 HA GLN A 38 -2.289 29.148 0.829 1.00 42.22 H new ATOM 0 HB2 GLN A 38 -0.195 30.337 1.449 1.00 44.33 H new ATOM 0 HB3 GLN A 38 -1.235 30.088 2.838 1.00 44.33 H new ATOM 0 HG2 GLN A 38 0.162 28.060 3.431 1.00 23.55 H new ATOM 0 HG3 GLN A 38 1.252 28.491 2.129 1.00 23.55 H new ATOM 0 HE21 GLN A 38 0.065 29.338 5.321 1.00 20.21 H new ATOM 0 HE22 GLN A 38 1.318 30.525 5.696 1.00 20.21 H new ATOM 538 N SER A 39 -0.484 26.669 0.148 1.00 10.01 N ATOM 539 CA SER A 39 0.262 25.980 -0.914 1.00 53.54 C ATOM 540 C SER A 39 -0.622 25.712 -2.140 1.00 61.25 C ATOM 541 O SER A 39 -1.392 24.745 -2.179 1.00 24.44 O ATOM 542 CB SER A 39 0.857 24.663 -0.395 1.00 72.42 C ATOM 543 OG SER A 39 -0.146 23.782 0.080 1.00 61.14 O ATOM 0 H SER A 39 -0.862 26.052 0.867 1.00 10.01 H new ATOM 0 HA SER A 39 1.075 26.638 -1.220 1.00 53.54 H new ATOM 0 HB2 SER A 39 1.418 24.178 -1.194 1.00 72.42 H new ATOM 0 HB3 SER A 39 1.564 24.875 0.407 1.00 72.42 H new ATOM 0 HG SER A 39 -1.027 24.195 -0.038 1.00 61.14 H new ATOM 549 N THR A 40 -0.518 26.581 -3.139 1.00 32.25 N ATOM 550 CA THR A 40 -1.311 26.444 -4.366 1.00 73.22 C ATOM 551 C THR A 40 -0.580 25.567 -5.393 1.00 63.00 C ATOM 552 O THR A 40 0.077 26.069 -6.308 1.00 1.03 O ATOM 553 CB THR A 40 -1.640 27.824 -4.998 1.00 33.14 C ATOM 554 OG1 THR A 40 -2.294 28.671 -4.035 1.00 75.01 O ATOM 555 CG2 THR A 40 -2.536 27.674 -6.227 1.00 64.41 C ATOM 0 H THR A 40 0.105 27.388 -3.128 1.00 32.25 H new ATOM 0 HA THR A 40 -2.249 25.965 -4.087 1.00 73.22 H new ATOM 0 HB THR A 40 -0.698 28.277 -5.307 1.00 33.14 H new ATOM 0 HG1 THR A 40 -2.495 29.538 -4.445 1.00 75.01 H new ATOM 0 HG21 THR A 40 -2.747 28.658 -6.645 1.00 64.41 H new ATOM 0 HG22 THR A 40 -2.029 27.063 -6.974 1.00 64.41 H new ATOM 0 HG23 THR A 40 -3.471 27.194 -5.939 1.00 64.41 H new ATOM 563 N THR A 41 -0.670 24.250 -5.216 1.00 71.35 N ATOM 564 CA THR A 41 -0.031 23.301 -6.134 1.00 61.52 C ATOM 565 C THR A 41 -0.976 22.918 -7.280 1.00 3.24 C ATOM 566 O THR A 41 -2.178 22.733 -7.074 1.00 44.51 O ATOM 567 CB THR A 41 0.417 22.002 -5.413 1.00 10.52 C ATOM 568 OG1 THR A 41 -0.720 21.196 -5.067 1.00 54.11 O ATOM 569 CG2 THR A 41 1.216 22.323 -4.154 1.00 3.43 C ATOM 0 H THR A 41 -1.178 23.813 -4.447 1.00 71.35 H new ATOM 0 HA THR A 41 0.849 23.808 -6.530 1.00 61.52 H new ATOM 0 HB THR A 41 1.054 21.446 -6.101 1.00 10.52 H new ATOM 0 HG1 THR A 41 -0.661 20.333 -5.527 1.00 54.11 H new ATOM 0 HG21 THR A 41 1.518 21.395 -3.668 1.00 3.43 H new ATOM 0 HG22 THR A 41 2.103 22.897 -4.422 1.00 3.43 H new ATOM 0 HG23 THR A 41 0.599 22.907 -3.471 1.00 3.43 H new ATOM 577 N GLN A 42 -0.430 22.801 -8.487 1.00 61.01 N ATOM 578 CA GLN A 42 -1.213 22.392 -9.661 1.00 60.01 C ATOM 579 C GLN A 42 -1.164 20.858 -9.838 1.00 30.10 C ATOM 580 O GLN A 42 -1.403 20.326 -10.924 1.00 25.43 O ATOM 581 CB GLN A 42 -0.673 23.117 -10.911 1.00 52.41 C ATOM 582 CG GLN A 42 -1.522 22.945 -12.170 1.00 21.51 C ATOM 583 CD GLN A 42 -2.964 23.401 -11.992 1.00 41.13 C ATOM 584 OE1 GLN A 42 -3.261 24.296 -11.206 1.00 11.25 O ATOM 585 NE2 GLN A 42 -3.872 22.785 -12.721 1.00 61.32 N ATOM 0 H GLN A 42 0.554 22.983 -8.683 1.00 61.01 H new ATOM 0 HA GLN A 42 -2.257 22.671 -9.517 1.00 60.01 H new ATOM 0 HB2 GLN A 42 -0.590 24.181 -10.689 1.00 52.41 H new ATOM 0 HB3 GLN A 42 0.334 22.755 -11.117 1.00 52.41 H new ATOM 0 HG2 GLN A 42 -1.068 23.508 -12.985 1.00 21.51 H new ATOM 0 HG3 GLN A 42 -1.514 21.896 -12.465 1.00 21.51 H new ATOM 0 HE21 GLN A 42 -3.593 22.045 -13.365 1.00 61.32 H new ATOM 0 HE22 GLN A 42 -4.854 23.048 -12.641 1.00 61.32 H new ATOM 594 N SER A 43 -0.879 20.154 -8.746 1.00 72.24 N ATOM 595 CA SER A 43 -0.759 18.691 -8.761 1.00 52.52 C ATOM 596 C SER A 43 -2.131 18.009 -8.879 1.00 32.11 C ATOM 597 O SER A 43 -2.806 17.768 -7.877 1.00 21.34 O ATOM 598 CB SER A 43 -0.038 18.207 -7.492 1.00 72.41 C ATOM 599 OG SER A 43 -0.741 18.595 -6.318 1.00 52.41 O ATOM 0 H SER A 43 -0.725 20.574 -7.829 1.00 72.24 H new ATOM 0 HA SER A 43 -0.174 18.416 -9.639 1.00 52.52 H new ATOM 0 HB2 SER A 43 0.059 17.122 -7.518 1.00 72.41 H new ATOM 0 HB3 SER A 43 0.972 18.617 -7.466 1.00 72.41 H new ATOM 0 HG SER A 43 -1.701 18.446 -6.447 1.00 52.41 H new ATOM 605 N THR A 44 -2.539 17.712 -10.113 1.00 63.01 N ATOM 606 CA THR A 44 -3.838 17.069 -10.381 1.00 73.12 C ATOM 607 C THR A 44 -3.709 15.542 -10.457 1.00 3.53 C ATOM 608 O THR A 44 -2.614 15.010 -10.642 1.00 74.11 O ATOM 609 CB THR A 44 -4.448 17.566 -11.716 1.00 65.30 C ATOM 610 OG1 THR A 44 -3.619 17.168 -12.820 1.00 30.42 O ATOM 611 CG2 THR A 44 -4.601 19.084 -11.717 1.00 71.55 C ATOM 0 H THR A 44 -1.990 17.905 -10.951 1.00 63.01 H new ATOM 0 HA THR A 44 -4.489 17.340 -9.550 1.00 73.12 H new ATOM 0 HB THR A 44 -5.435 17.116 -11.821 1.00 65.30 H new ATOM 0 HG1 THR A 44 -4.015 17.486 -13.658 1.00 30.42 H new ATOM 0 HG21 THR A 44 -5.031 19.406 -12.665 1.00 71.55 H new ATOM 0 HG22 THR A 44 -5.258 19.384 -10.900 1.00 71.55 H new ATOM 0 HG23 THR A 44 -3.624 19.548 -11.586 1.00 71.55 H new ATOM 619 N SER A 45 -4.832 14.838 -10.314 1.00 45.45 N ATOM 620 CA SER A 45 -4.848 13.373 -10.463 1.00 2.35 C ATOM 621 C SER A 45 -4.843 12.969 -11.941 1.00 64.32 C ATOM 622 O SER A 45 -5.629 13.486 -12.738 1.00 13.11 O ATOM 623 CB SER A 45 -6.078 12.758 -9.781 1.00 61.11 C ATOM 624 OG SER A 45 -6.176 11.370 -10.068 1.00 70.11 O ATOM 0 H SER A 45 -5.739 15.250 -10.097 1.00 45.45 H new ATOM 0 HA SER A 45 -3.946 12.994 -9.983 1.00 2.35 H new ATOM 0 HB2 SER A 45 -6.014 12.907 -8.703 1.00 61.11 H new ATOM 0 HB3 SER A 45 -6.980 13.268 -10.120 1.00 61.11 H new ATOM 0 HG SER A 45 -6.121 10.859 -9.234 1.00 70.11 H new ATOM 630 N GLY A 46 -3.965 12.034 -12.304 1.00 13.50 N ATOM 631 CA GLY A 46 -3.874 11.587 -13.692 1.00 25.51 C ATOM 632 C GLY A 46 -4.759 10.381 -14.001 1.00 70.43 C ATOM 633 O GLY A 46 -4.654 9.790 -15.076 1.00 73.22 O ATOM 0 H GLY A 46 -3.315 11.577 -11.665 1.00 13.50 H new ATOM 0 HA2 GLY A 46 -4.152 12.410 -14.350 1.00 25.51 H new ATOM 0 HA3 GLY A 46 -2.838 11.335 -13.917 1.00 25.51 H new ATOM 637 N SER A 47 -5.631 10.010 -13.065 1.00 33.32 N ATOM 638 CA SER A 47 -6.528 8.862 -13.257 1.00 74.13 C ATOM 639 C SER A 47 -7.799 8.993 -12.408 1.00 63.14 C ATOM 640 O SER A 47 -7.761 8.824 -11.190 1.00 4.44 O ATOM 641 CB SER A 47 -5.804 7.556 -12.900 1.00 3.04 C ATOM 642 OG SER A 47 -6.610 6.416 -13.174 1.00 14.53 O ATOM 0 H SER A 47 -5.739 10.483 -12.168 1.00 33.32 H new ATOM 0 HA SER A 47 -6.818 8.844 -14.307 1.00 74.13 H new ATOM 0 HB2 SER A 47 -4.874 7.489 -13.465 1.00 3.04 H new ATOM 0 HB3 SER A 47 -5.535 7.566 -11.844 1.00 3.04 H new ATOM 0 HG SER A 47 -6.094 5.601 -13.000 1.00 14.53 H new ATOM 648 N SER A 48 -8.923 9.293 -13.055 1.00 72.52 N ATOM 649 CA SER A 48 -10.216 9.412 -12.355 1.00 51.10 C ATOM 650 C SER A 48 -11.035 8.114 -12.465 1.00 14.51 C ATOM 651 O SER A 48 -12.156 8.023 -11.962 1.00 20.13 O ATOM 652 CB SER A 48 -11.025 10.590 -12.917 1.00 42.11 C ATOM 653 OG SER A 48 -12.204 10.824 -12.157 1.00 53.45 O ATOM 0 H SER A 48 -8.973 9.459 -14.060 1.00 72.52 H new ATOM 0 HA SER A 48 -10.005 9.594 -11.301 1.00 51.10 H new ATOM 0 HB2 SER A 48 -10.408 11.488 -12.918 1.00 42.11 H new ATOM 0 HB3 SER A 48 -11.294 10.386 -13.954 1.00 42.11 H new ATOM 0 HG SER A 48 -12.552 9.971 -11.821 1.00 53.45 H new ATOM 659 N ALA A 49 -10.465 7.113 -13.131 1.00 2.20 N ATOM 660 CA ALA A 49 -11.102 5.801 -13.277 1.00 13.42 C ATOM 661 C ALA A 49 -10.127 4.673 -12.908 1.00 44.32 C ATOM 662 O ALA A 49 -8.926 4.904 -12.761 1.00 41.25 O ATOM 663 CB ALA A 49 -11.618 5.619 -14.702 1.00 31.05 C ATOM 0 H ALA A 49 -9.554 7.184 -13.583 1.00 2.20 H new ATOM 0 HA ALA A 49 -11.947 5.753 -12.591 1.00 13.42 H new ATOM 0 HB1 ALA A 49 -12.089 4.640 -14.796 1.00 31.05 H new ATOM 0 HB2 ALA A 49 -12.349 6.396 -14.926 1.00 31.05 H new ATOM 0 HB3 ALA A 49 -10.786 5.690 -15.402 1.00 31.05 H new ATOM 669 N ASN A 50 -10.647 3.459 -12.747 1.00 44.32 N ATOM 670 CA ASN A 50 -9.811 2.305 -12.398 1.00 34.14 C ATOM 671 C ASN A 50 -9.516 1.449 -13.641 1.00 2.21 C ATOM 672 O ASN A 50 -10.413 1.154 -14.429 1.00 32.01 O ATOM 673 CB ASN A 50 -10.494 1.466 -11.312 1.00 11.24 C ATOM 674 CG ASN A 50 -9.530 0.515 -10.628 1.00 11.52 C ATOM 675 OD1 ASN A 50 -8.576 0.028 -11.226 1.00 42.34 O ATOM 676 ND2 ASN A 50 -9.764 0.257 -9.361 1.00 71.25 N ATOM 0 H ASN A 50 -11.639 3.245 -12.851 1.00 44.32 H new ATOM 0 HA ASN A 50 -8.861 2.671 -12.008 1.00 34.14 H new ATOM 0 HB2 ASN A 50 -10.936 2.129 -10.568 1.00 11.24 H new ATOM 0 HB3 ASN A 50 -11.310 0.896 -11.756 1.00 11.24 H new ATOM 0 HD21 ASN A 50 -9.143 -0.365 -8.844 1.00 71.25 H new ATOM 0 HD22 ASN A 50 -10.567 0.679 -8.894 1.00 71.25 H new ATOM 683 N LEU A 51 -8.258 1.044 -13.802 1.00 43.32 N ATOM 684 CA LEU A 51 -7.812 0.369 -15.032 1.00 71.52 C ATOM 685 C LEU A 51 -7.722 -1.162 -14.882 1.00 65.01 C ATOM 686 O LEU A 51 -7.568 -1.876 -15.876 1.00 72.22 O ATOM 687 CB LEU A 51 -6.448 0.932 -15.462 1.00 71.12 C ATOM 688 CG LEU A 51 -6.409 2.456 -15.682 1.00 23.04 C ATOM 689 CD1 LEU A 51 -5.010 2.915 -16.081 1.00 71.34 C ATOM 690 CD2 LEU A 51 -7.436 2.882 -16.732 1.00 54.22 C ATOM 0 H LEU A 51 -7.527 1.168 -13.102 1.00 43.32 H new ATOM 0 HA LEU A 51 -8.564 0.566 -15.796 1.00 71.52 H new ATOM 0 HB2 LEU A 51 -5.710 0.671 -14.704 1.00 71.12 H new ATOM 0 HB3 LEU A 51 -6.144 0.439 -16.386 1.00 71.12 H new ATOM 0 HG LEU A 51 -6.667 2.936 -14.738 1.00 23.04 H new ATOM 0 HD11 LEU A 51 -5.010 3.995 -16.230 1.00 71.34 H new ATOM 0 HD12 LEU A 51 -4.304 2.658 -15.292 1.00 71.34 H new ATOM 0 HD13 LEU A 51 -4.715 2.421 -17.007 1.00 71.34 H new ATOM 0 HD21 LEU A 51 -7.389 3.962 -16.870 1.00 54.22 H new ATOM 0 HD22 LEU A 51 -7.217 2.386 -17.678 1.00 54.22 H new ATOM 0 HD23 LEU A 51 -8.435 2.602 -16.398 1.00 54.22 H new ATOM 702 N TYR A 52 -7.812 -1.673 -13.654 1.00 5.30 N ATOM 703 CA TYR A 52 -7.696 -3.119 -13.416 1.00 51.42 C ATOM 704 C TYR A 52 -9.040 -3.774 -13.061 1.00 3.53 C ATOM 705 O TYR A 52 -10.016 -3.100 -12.731 1.00 73.30 O ATOM 706 CB TYR A 52 -6.640 -3.404 -12.333 1.00 10.35 C ATOM 707 CG TYR A 52 -5.310 -3.840 -12.918 1.00 14.14 C ATOM 708 CD1 TYR A 52 -4.413 -2.915 -13.445 1.00 12.34 C ATOM 709 CD2 TYR A 52 -4.969 -5.183 -12.967 1.00 2.54 C ATOM 710 CE1 TYR A 52 -3.215 -3.323 -14.006 1.00 15.21 C ATOM 711 CE2 TYR A 52 -3.773 -5.598 -13.519 1.00 23.22 C ATOM 712 CZ TYR A 52 -2.900 -4.667 -14.038 1.00 55.21 C ATOM 713 OH TYR A 52 -1.719 -5.086 -14.607 1.00 75.22 O ATOM 0 H TYR A 52 -7.963 -1.116 -12.813 1.00 5.30 H new ATOM 0 HA TYR A 52 -7.372 -3.571 -14.353 1.00 51.42 H new ATOM 0 HB2 TYR A 52 -6.492 -2.508 -11.730 1.00 10.35 H new ATOM 0 HB3 TYR A 52 -7.011 -4.181 -11.664 1.00 10.35 H new ATOM 0 HD1 TYR A 52 -4.655 -1.863 -13.416 1.00 12.34 H new ATOM 0 HD2 TYR A 52 -5.651 -5.918 -12.566 1.00 2.54 H new ATOM 0 HE1 TYR A 52 -2.531 -2.595 -14.416 1.00 15.21 H new ATOM 0 HE2 TYR A 52 -3.523 -6.648 -13.544 1.00 23.22 H new ATOM 0 HH TYR A 52 -1.654 -6.062 -14.545 1.00 75.22 H new ATOM 723 N THR A 53 -9.074 -5.103 -13.154 1.00 44.43 N ATOM 724 CA THR A 53 -10.306 -5.879 -12.926 1.00 33.20 C ATOM 725 C THR A 53 -10.606 -6.104 -11.438 1.00 71.12 C ATOM 726 O THR A 53 -9.736 -5.955 -10.583 1.00 64.32 O ATOM 727 CB THR A 53 -10.243 -7.261 -13.616 1.00 2.14 C ATOM 728 OG1 THR A 53 -11.469 -7.976 -13.398 1.00 20.52 O ATOM 729 CG2 THR A 53 -9.072 -8.088 -13.092 1.00 34.42 C ATOM 0 H THR A 53 -8.261 -5.673 -13.387 1.00 44.43 H new ATOM 0 HA THR A 53 -11.105 -5.276 -13.358 1.00 33.20 H new ATOM 0 HB THR A 53 -10.099 -7.096 -14.684 1.00 2.14 H new ATOM 0 HG1 THR A 53 -11.421 -8.849 -13.840 1.00 20.52 H new ATOM 0 HG21 THR A 53 -9.054 -9.054 -13.596 1.00 34.42 H new ATOM 0 HG22 THR A 53 -8.138 -7.560 -13.286 1.00 34.42 H new ATOM 0 HG23 THR A 53 -9.186 -8.241 -12.019 1.00 34.42 H new ATOM 737 N ALA A 54 -11.838 -6.521 -11.149 1.00 51.21 N ATOM 738 CA ALA A 54 -12.301 -6.753 -9.773 1.00 23.53 C ATOM 739 C ALA A 54 -11.786 -8.089 -9.190 1.00 75.13 C ATOM 740 O ALA A 54 -12.489 -8.763 -8.435 1.00 72.21 O ATOM 741 CB ALA A 54 -13.826 -6.713 -9.733 1.00 63.10 C ATOM 0 H ALA A 54 -12.546 -6.709 -11.859 1.00 51.21 H new ATOM 0 HA ALA A 54 -11.890 -5.958 -9.151 1.00 23.53 H new ATOM 0 HB1 ALA A 54 -14.168 -6.885 -8.712 1.00 63.10 H new ATOM 0 HB2 ALA A 54 -14.173 -5.737 -10.072 1.00 63.10 H new ATOM 0 HB3 ALA A 54 -14.228 -7.488 -10.386 1.00 63.10 H new ATOM 747 N GLY A 55 -10.543 -8.443 -9.516 1.00 62.42 N ATOM 748 CA GLY A 55 -9.952 -9.696 -9.041 1.00 64.04 C ATOM 749 C GLY A 55 -8.456 -9.577 -8.761 1.00 34.23 C ATOM 750 O GLY A 55 -7.750 -10.581 -8.664 1.00 23.30 O ATOM 0 H GLY A 55 -9.927 -7.883 -10.105 1.00 62.42 H new ATOM 0 HA2 GLY A 55 -10.463 -10.011 -8.131 1.00 64.04 H new ATOM 0 HA3 GLY A 55 -10.117 -10.475 -9.785 1.00 64.04 H new ATOM 754 N GLN A 56 -7.975 -8.343 -8.639 1.00 73.25 N ATOM 755 CA GLN A 56 -6.559 -8.075 -8.362 1.00 65.14 C ATOM 756 C GLN A 56 -6.407 -7.209 -7.102 1.00 15.13 C ATOM 757 O GLN A 56 -7.143 -6.242 -6.916 1.00 74.03 O ATOM 758 CB GLN A 56 -5.911 -7.366 -9.565 1.00 34.41 C ATOM 759 CG GLN A 56 -5.904 -8.192 -10.851 1.00 31.41 C ATOM 760 CD GLN A 56 -5.020 -9.428 -10.765 1.00 10.43 C ATOM 761 OE1 GLN A 56 -4.008 -9.441 -10.069 1.00 21.03 O ATOM 762 NE2 GLN A 56 -5.395 -10.479 -11.469 1.00 13.03 N ATOM 0 H GLN A 56 -8.547 -7.503 -8.728 1.00 73.25 H new ATOM 0 HA GLN A 56 -6.056 -9.027 -8.192 1.00 65.14 H new ATOM 0 HB2 GLN A 56 -6.441 -6.431 -9.750 1.00 34.41 H new ATOM 0 HB3 GLN A 56 -4.884 -7.105 -9.309 1.00 34.41 H new ATOM 0 HG2 GLN A 56 -6.924 -8.498 -11.084 1.00 31.41 H new ATOM 0 HG3 GLN A 56 -5.563 -7.566 -11.675 1.00 31.41 H new ATOM 0 HE21 GLN A 56 -6.241 -10.437 -12.037 1.00 13.03 H new ATOM 0 HE22 GLN A 56 -4.839 -11.334 -11.445 1.00 13.03 H new ATOM 771 N CYS A 57 -5.441 -7.545 -6.244 1.00 13.03 N ATOM 772 CA CYS A 57 -5.202 -6.778 -5.007 1.00 53.51 C ATOM 773 C CYS A 57 -4.829 -5.314 -5.308 1.00 31.23 C ATOM 774 O CYS A 57 -4.906 -4.446 -4.442 1.00 2.53 O ATOM 775 CB CYS A 57 -4.094 -7.438 -4.174 1.00 4.50 C ATOM 776 SG CYS A 57 -4.362 -9.195 -3.842 1.00 32.43 S ATOM 0 H CYS A 57 -4.812 -8.337 -6.377 1.00 13.03 H new ATOM 0 HA CYS A 57 -6.131 -6.779 -4.437 1.00 53.51 H new ATOM 0 HB2 CYS A 57 -3.144 -7.319 -4.695 1.00 4.50 H new ATOM 0 HB3 CYS A 57 -4.005 -6.910 -3.225 1.00 4.50 H new ATOM 0 HG CYS A 57 -3.232 -9.754 -3.526 1.00 32.43 H new ATOM 782 N THR A 58 -4.422 -5.054 -6.548 1.00 32.22 N ATOM 783 CA THR A 58 -4.072 -3.696 -6.997 1.00 12.40 C ATOM 784 C THR A 58 -5.324 -2.857 -7.303 1.00 23.01 C ATOM 785 O THR A 58 -5.311 -1.628 -7.202 1.00 30.13 O ATOM 786 CB THR A 58 -3.196 -3.751 -8.272 1.00 13.20 C ATOM 787 OG1 THR A 58 -3.940 -4.324 -9.358 1.00 73.14 O ATOM 788 CG2 THR A 58 -1.938 -4.583 -8.037 1.00 43.11 C ATOM 0 H THR A 58 -4.324 -5.768 -7.270 1.00 32.22 H new ATOM 0 HA THR A 58 -3.520 -3.228 -6.182 1.00 12.40 H new ATOM 0 HB THR A 58 -2.904 -2.731 -8.520 1.00 13.20 H new ATOM 0 HG1 THR A 58 -3.378 -4.353 -10.160 1.00 73.14 H new ATOM 0 HG21 THR A 58 -1.341 -4.605 -8.949 1.00 43.11 H new ATOM 0 HG22 THR A 58 -1.354 -4.139 -7.231 1.00 43.11 H new ATOM 0 HG23 THR A 58 -2.220 -5.600 -7.763 1.00 43.11 H new ATOM 796 N TRP A 59 -6.402 -3.545 -7.666 1.00 42.24 N ATOM 797 CA TRP A 59 -7.652 -2.909 -8.099 1.00 11.24 C ATOM 798 C TRP A 59 -8.232 -1.938 -7.049 1.00 73.03 C ATOM 799 O TRP A 59 -8.269 -0.728 -7.273 1.00 51.32 O ATOM 800 CB TRP A 59 -8.674 -4.000 -8.449 1.00 51.30 C ATOM 801 CG TRP A 59 -10.067 -3.494 -8.705 1.00 65.15 C ATOM 802 CD1 TRP A 59 -10.472 -2.653 -9.701 1.00 31.44 C ATOM 803 CD2 TRP A 59 -11.242 -3.825 -7.960 1.00 61.42 C ATOM 804 NE1 TRP A 59 -11.823 -2.422 -9.605 1.00 73.44 N ATOM 805 CE2 TRP A 59 -12.320 -3.135 -8.545 1.00 24.11 C ATOM 806 CE3 TRP A 59 -11.481 -4.631 -6.850 1.00 74.42 C ATOM 807 CZ2 TRP A 59 -13.620 -3.234 -8.056 1.00 62.32 C ATOM 808 CZ3 TRP A 59 -12.771 -4.732 -6.367 1.00 32.33 C ATOM 809 CH2 TRP A 59 -13.826 -4.035 -6.966 1.00 55.22 C ATOM 0 H TRP A 59 -6.438 -4.564 -7.670 1.00 42.24 H new ATOM 0 HA TRP A 59 -7.429 -2.304 -8.978 1.00 11.24 H new ATOM 0 HB2 TRP A 59 -8.327 -4.534 -9.334 1.00 51.30 H new ATOM 0 HB3 TRP A 59 -8.708 -4.723 -7.634 1.00 51.30 H new ATOM 0 HD1 TRP A 59 -9.824 -2.231 -10.455 1.00 31.44 H new ATOM 0 HE1 TRP A 59 -12.367 -1.819 -10.222 1.00 73.44 H new ATOM 0 HE3 TRP A 59 -10.673 -5.167 -6.375 1.00 74.42 H new ATOM 0 HZ2 TRP A 59 -14.435 -2.699 -8.520 1.00 62.32 H new ATOM 0 HZ3 TRP A 59 -12.969 -5.360 -5.511 1.00 32.33 H new ATOM 0 HH2 TRP A 59 -14.822 -4.131 -6.560 1.00 55.22 H new ATOM 820 N TYR A 60 -8.680 -2.465 -5.910 1.00 31.03 N ATOM 821 CA TYR A 60 -9.365 -1.643 -4.901 1.00 12.02 C ATOM 822 C TYR A 60 -8.447 -0.543 -4.328 1.00 2.14 C ATOM 823 O TYR A 60 -8.919 0.514 -3.907 1.00 62.02 O ATOM 824 CB TYR A 60 -9.921 -2.525 -3.769 1.00 10.22 C ATOM 825 CG TYR A 60 -8.858 -3.214 -2.925 1.00 35.11 C ATOM 826 CD1 TYR A 60 -8.254 -4.395 -3.351 1.00 0.40 C ATOM 827 CD2 TYR A 60 -8.461 -2.682 -1.700 1.00 22.32 C ATOM 828 CE1 TYR A 60 -7.291 -5.021 -2.582 1.00 31.41 C ATOM 829 CE2 TYR A 60 -7.499 -3.306 -0.929 1.00 3.03 C ATOM 830 CZ TYR A 60 -6.917 -4.475 -1.373 1.00 3.32 C ATOM 831 OH TYR A 60 -5.960 -5.095 -0.605 1.00 20.34 O ATOM 0 H TYR A 60 -8.584 -3.449 -5.660 1.00 31.03 H new ATOM 0 HA TYR A 60 -10.196 -1.145 -5.401 1.00 12.02 H new ATOM 0 HB2 TYR A 60 -10.541 -1.910 -3.118 1.00 10.22 H new ATOM 0 HB3 TYR A 60 -10.571 -3.285 -4.203 1.00 10.22 H new ATOM 0 HD1 TYR A 60 -8.543 -4.828 -4.297 1.00 0.40 H new ATOM 0 HD2 TYR A 60 -8.913 -1.767 -1.347 1.00 22.32 H new ATOM 0 HE1 TYR A 60 -6.833 -5.936 -2.928 1.00 31.41 H new ATOM 0 HE2 TYR A 60 -7.204 -2.880 0.018 1.00 3.03 H new ATOM 0 HH TYR A 60 -5.070 -4.798 -0.888 1.00 20.34 H new ATOM 841 N VAL A 61 -7.138 -0.796 -4.320 1.00 61.13 N ATOM 842 CA VAL A 61 -6.160 0.181 -3.817 1.00 64.50 C ATOM 843 C VAL A 61 -6.009 1.378 -4.776 1.00 3.45 C ATOM 844 O VAL A 61 -5.842 2.521 -4.341 1.00 13.42 O ATOM 845 CB VAL A 61 -4.769 -0.473 -3.604 1.00 44.13 C ATOM 846 CG1 VAL A 61 -3.777 0.531 -3.020 1.00 22.14 C ATOM 847 CG2 VAL A 61 -4.886 -1.700 -2.705 1.00 52.02 C ATOM 0 H VAL A 61 -6.726 -1.667 -4.655 1.00 61.13 H new ATOM 0 HA VAL A 61 -6.541 0.538 -2.860 1.00 64.50 H new ATOM 0 HB VAL A 61 -4.392 -0.793 -4.576 1.00 44.13 H new ATOM 0 HG11 VAL A 61 -2.810 0.048 -2.880 1.00 22.14 H new ATOM 0 HG12 VAL A 61 -3.667 1.373 -3.703 1.00 22.14 H new ATOM 0 HG13 VAL A 61 -4.146 0.890 -2.059 1.00 22.14 H new ATOM 0 HG21 VAL A 61 -3.901 -2.145 -2.567 1.00 52.02 H new ATOM 0 HG22 VAL A 61 -5.289 -1.404 -1.737 1.00 52.02 H new ATOM 0 HG23 VAL A 61 -5.552 -2.428 -3.168 1.00 52.02 H new ATOM 857 N TYR A 62 -6.089 1.101 -6.077 1.00 12.52 N ATOM 858 CA TYR A 62 -5.919 2.125 -7.120 1.00 21.45 C ATOM 859 C TYR A 62 -6.882 3.313 -6.917 1.00 1.23 C ATOM 860 O TYR A 62 -6.527 4.466 -7.183 1.00 24.23 O ATOM 861 CB TYR A 62 -6.129 1.486 -8.502 1.00 13.21 C ATOM 862 CG TYR A 62 -5.658 2.337 -9.670 1.00 43.22 C ATOM 863 CD1 TYR A 62 -4.334 2.754 -9.759 1.00 43.20 C ATOM 864 CD2 TYR A 62 -6.531 2.712 -10.686 1.00 73.50 C ATOM 865 CE1 TYR A 62 -3.896 3.518 -10.822 1.00 32.51 C ATOM 866 CE2 TYR A 62 -6.098 3.471 -11.754 1.00 64.13 C ATOM 867 CZ TYR A 62 -4.781 3.872 -11.818 1.00 72.42 C ATOM 868 OH TYR A 62 -4.346 4.625 -12.883 1.00 72.41 O ATOM 0 H TYR A 62 -6.272 0.166 -6.442 1.00 12.52 H new ATOM 0 HA TYR A 62 -4.905 2.520 -7.052 1.00 21.45 H new ATOM 0 HB2 TYR A 62 -5.604 0.531 -8.530 1.00 13.21 H new ATOM 0 HB3 TYR A 62 -7.190 1.270 -8.631 1.00 13.21 H new ATOM 0 HD1 TYR A 62 -3.637 2.475 -8.983 1.00 43.20 H new ATOM 0 HD2 TYR A 62 -7.565 2.404 -10.638 1.00 73.50 H new ATOM 0 HE1 TYR A 62 -2.865 3.837 -10.873 1.00 32.51 H new ATOM 0 HE2 TYR A 62 -6.788 3.750 -12.536 1.00 64.13 H new ATOM 0 HH TYR A 62 -4.628 4.201 -13.720 1.00 72.41 H new ATOM 878 N ASP A 63 -8.092 3.023 -6.436 1.00 33.20 N ATOM 879 CA ASP A 63 -9.079 4.067 -6.134 1.00 62.43 C ATOM 880 C ASP A 63 -8.743 4.789 -4.814 1.00 75.22 C ATOM 881 O ASP A 63 -8.814 6.019 -4.730 1.00 70.10 O ATOM 882 CB ASP A 63 -10.489 3.462 -6.059 1.00 12.11 C ATOM 883 CG ASP A 63 -11.549 4.511 -5.758 1.00 24.42 C ATOM 884 OD1 ASP A 63 -12.003 5.196 -6.700 1.00 44.21 O ATOM 885 OD2 ASP A 63 -11.918 4.676 -4.573 1.00 24.43 O ATOM 0 H ASP A 63 -8.414 2.074 -6.246 1.00 33.20 H new ATOM 0 HA ASP A 63 -9.047 4.800 -6.940 1.00 62.43 H new ATOM 0 HB2 ASP A 63 -10.723 2.972 -7.004 1.00 12.11 H new ATOM 0 HB3 ASP A 63 -10.512 2.693 -5.287 1.00 12.11 H new ATOM 890 N LYS A 64 -8.364 4.014 -3.795 1.00 42.33 N ATOM 891 CA LYS A 64 -8.045 4.559 -2.466 1.00 50.44 C ATOM 892 C LYS A 64 -6.847 5.528 -2.509 1.00 60.31 C ATOM 893 O LYS A 64 -6.757 6.455 -1.702 1.00 5.12 O ATOM 894 CB LYS A 64 -7.756 3.416 -1.475 1.00 54.23 C ATOM 895 CG LYS A 64 -8.962 2.530 -1.169 1.00 33.52 C ATOM 896 CD LYS A 64 -10.090 3.324 -0.508 1.00 22.31 C ATOM 897 CE LYS A 64 -9.696 3.856 0.871 1.00 43.44 C ATOM 898 NZ LYS A 64 -9.536 2.768 1.875 1.00 32.43 N ATOM 0 H LYS A 64 -8.269 3.001 -3.862 1.00 42.33 H new ATOM 0 HA LYS A 64 -8.916 5.122 -2.131 1.00 50.44 H new ATOM 0 HB2 LYS A 64 -6.956 2.795 -1.878 1.00 54.23 H new ATOM 0 HB3 LYS A 64 -7.388 3.844 -0.542 1.00 54.23 H new ATOM 0 HG2 LYS A 64 -9.326 2.079 -2.092 1.00 33.52 H new ATOM 0 HG3 LYS A 64 -8.658 1.714 -0.513 1.00 33.52 H new ATOM 0 HD2 LYS A 64 -10.368 4.159 -1.151 1.00 22.31 H new ATOM 0 HD3 LYS A 64 -10.970 2.689 -0.412 1.00 22.31 H new ATOM 0 HE2 LYS A 64 -8.762 4.412 0.790 1.00 43.44 H new ATOM 0 HE3 LYS A 64 -10.455 4.557 1.217 1.00 43.44 H new ATOM 0 HZ1 LYS A 64 -9.319 3.182 2.804 1.00 32.43 H new ATOM 0 HZ2 LYS A 64 -10.418 2.221 1.937 1.00 32.43 H new ATOM 0 HZ3 LYS A 64 -8.759 2.140 1.586 1.00 32.43 H new ATOM 912 N VAL A 65 -5.926 5.303 -3.444 1.00 33.35 N ATOM 913 CA VAL A 65 -4.757 6.179 -3.609 1.00 60.44 C ATOM 914 C VAL A 65 -5.066 7.364 -4.552 1.00 50.42 C ATOM 915 O VAL A 65 -4.197 8.186 -4.854 1.00 74.42 O ATOM 916 CB VAL A 65 -3.541 5.376 -4.144 1.00 71.40 C ATOM 917 CG1 VAL A 65 -3.764 4.936 -5.590 1.00 13.50 C ATOM 918 CG2 VAL A 65 -2.245 6.174 -4.000 1.00 31.13 C ATOM 0 H VAL A 65 -5.962 4.523 -4.101 1.00 33.35 H new ATOM 0 HA VAL A 65 -4.510 6.583 -2.627 1.00 60.44 H new ATOM 0 HB VAL A 65 -3.443 4.476 -3.536 1.00 71.40 H new ATOM 0 HG11 VAL A 65 -2.896 4.376 -5.938 1.00 13.50 H new ATOM 0 HG12 VAL A 65 -4.650 4.304 -5.645 1.00 13.50 H new ATOM 0 HG13 VAL A 65 -3.905 5.814 -6.220 1.00 13.50 H new ATOM 0 HG21 VAL A 65 -1.411 5.586 -4.383 1.00 31.13 H new ATOM 0 HG22 VAL A 65 -2.325 7.102 -4.566 1.00 31.13 H new ATOM 0 HG23 VAL A 65 -2.074 6.404 -2.948 1.00 31.13 H new ATOM 928 N GLY A 66 -6.313 7.443 -5.013 1.00 25.35 N ATOM 929 CA GLY A 66 -6.735 8.533 -5.893 1.00 73.14 C ATOM 930 C GLY A 66 -6.131 8.460 -7.292 1.00 0.53 C ATOM 931 O GLY A 66 -6.031 9.473 -7.985 1.00 62.42 O ATOM 0 H GLY A 66 -7.046 6.769 -4.794 1.00 25.35 H new ATOM 0 HA2 GLY A 66 -7.822 8.522 -5.975 1.00 73.14 H new ATOM 0 HA3 GLY A 66 -6.459 9.484 -5.437 1.00 73.14 H new ATOM 935 N GLY A 67 -5.716 7.262 -7.703 1.00 32.55 N ATOM 936 CA GLY A 67 -5.151 7.063 -9.037 1.00 15.51 C ATOM 937 C GLY A 67 -3.898 7.896 -9.335 1.00 1.30 C ATOM 938 O GLY A 67 -3.563 8.115 -10.498 1.00 3.24 O ATOM 0 H GLY A 67 -5.760 6.417 -7.133 1.00 32.55 H new ATOM 0 HA2 GLY A 67 -4.906 6.008 -9.159 1.00 15.51 H new ATOM 0 HA3 GLY A 67 -5.914 7.301 -9.779 1.00 15.51 H new ATOM 942 N ASN A 68 -3.192 8.346 -8.293 1.00 34.44 N ATOM 943 CA ASN A 68 -1.975 9.161 -8.478 1.00 63.12 C ATOM 944 C ASN A 68 -0.731 8.295 -8.766 1.00 30.31 C ATOM 945 O ASN A 68 0.382 8.810 -8.876 1.00 51.11 O ATOM 946 CB ASN A 68 -1.716 10.036 -7.242 1.00 44.12 C ATOM 947 CG ASN A 68 -2.848 11.012 -6.973 1.00 11.12 C ATOM 948 OD1 ASN A 68 -2.882 12.111 -7.509 1.00 5.04 O ATOM 949 ND2 ASN A 68 -3.773 10.631 -6.118 1.00 31.41 N ATOM 0 H ASN A 68 -3.435 8.165 -7.319 1.00 34.44 H new ATOM 0 HA ASN A 68 -2.151 9.796 -9.346 1.00 63.12 H new ATOM 0 HB2 ASN A 68 -1.577 9.396 -6.370 1.00 44.12 H new ATOM 0 HB3 ASN A 68 -0.788 10.590 -7.381 1.00 44.12 H new ATOM 0 HD21 ASN A 68 -4.544 11.258 -5.887 1.00 31.41 H new ATOM 0 HD22 ASN A 68 -3.719 9.709 -5.686 1.00 31.41 H new ATOM 956 N ILE A 69 -0.926 6.979 -8.888 1.00 53.22 N ATOM 957 CA ILE A 69 0.181 6.046 -9.144 1.00 42.11 C ATOM 958 C ILE A 69 0.085 5.426 -10.545 1.00 41.23 C ATOM 959 O ILE A 69 -1.012 5.173 -11.049 1.00 23.32 O ATOM 960 CB ILE A 69 0.217 4.904 -8.095 1.00 60.10 C ATOM 961 CG1 ILE A 69 -1.087 4.089 -8.133 1.00 55.11 C ATOM 962 CG2 ILE A 69 0.465 5.470 -6.699 1.00 35.14 C ATOM 963 CD1 ILE A 69 -1.107 2.928 -7.162 1.00 20.10 C ATOM 0 H ILE A 69 -1.840 6.533 -8.814 1.00 53.22 H new ATOM 0 HA ILE A 69 1.098 6.631 -9.072 1.00 42.11 H new ATOM 0 HB ILE A 69 1.040 4.234 -8.343 1.00 60.10 H new ATOM 0 HG12 ILE A 69 -1.925 4.750 -7.912 1.00 55.11 H new ATOM 0 HG13 ILE A 69 -1.238 3.709 -9.143 1.00 55.11 H new ATOM 0 HG21 ILE A 69 0.487 4.656 -5.975 1.00 35.14 H new ATOM 0 HG22 ILE A 69 1.420 5.995 -6.684 1.00 35.14 H new ATOM 0 HG23 ILE A 69 -0.335 6.164 -6.440 1.00 35.14 H new ATOM 0 HD11 ILE A 69 -2.057 2.400 -7.245 1.00 20.10 H new ATOM 0 HD12 ILE A 69 -0.290 2.245 -7.395 1.00 20.10 H new ATOM 0 HD13 ILE A 69 -0.988 3.302 -6.145 1.00 20.10 H new ATOM 975 N GLY A 70 1.237 5.192 -11.172 1.00 52.01 N ATOM 976 CA GLY A 70 1.272 4.517 -12.468 1.00 50.52 C ATOM 977 C GLY A 70 0.913 3.030 -12.373 1.00 11.14 C ATOM 978 O GLY A 70 1.675 2.239 -11.818 1.00 74.03 O ATOM 0 H GLY A 70 2.152 5.458 -10.807 1.00 52.01 H new ATOM 0 HA2 GLY A 70 0.578 5.011 -13.149 1.00 50.52 H new ATOM 0 HA3 GLY A 70 2.268 4.619 -12.899 1.00 50.52 H new ATOM 982 N SER A 71 -0.235 2.645 -12.933 1.00 31.04 N ATOM 983 CA SER A 71 -0.717 1.251 -12.860 1.00 21.32 C ATOM 984 C SER A 71 0.156 0.282 -13.678 1.00 32.33 C ATOM 985 O SER A 71 -0.010 -0.937 -13.595 1.00 41.54 O ATOM 986 CB SER A 71 -2.167 1.168 -13.354 1.00 72.04 C ATOM 987 OG SER A 71 -2.277 1.615 -14.695 1.00 14.32 O ATOM 0 H SER A 71 -0.854 3.274 -13.444 1.00 31.04 H new ATOM 0 HA SER A 71 -0.657 0.949 -11.814 1.00 21.32 H new ATOM 0 HB2 SER A 71 -2.521 0.140 -13.280 1.00 72.04 H new ATOM 0 HB3 SER A 71 -2.808 1.773 -12.712 1.00 72.04 H new ATOM 0 HG SER A 71 -2.900 1.036 -15.183 1.00 14.32 H new ATOM 993 N THR A 72 1.102 0.824 -14.447 1.00 23.42 N ATOM 994 CA THR A 72 1.982 0.010 -15.304 1.00 2.24 C ATOM 995 C THR A 72 2.911 -0.922 -14.499 1.00 53.33 C ATOM 996 O THR A 72 3.680 -1.693 -15.079 1.00 24.15 O ATOM 997 CB THR A 72 2.856 0.898 -16.226 1.00 64.01 C ATOM 998 OG1 THR A 72 3.595 0.077 -17.145 1.00 13.52 O ATOM 999 CG2 THR A 72 3.827 1.756 -15.416 1.00 54.35 C ATOM 0 H THR A 72 1.283 1.827 -14.497 1.00 23.42 H new ATOM 0 HA THR A 72 1.311 -0.605 -15.904 1.00 2.24 H new ATOM 0 HB THR A 72 2.190 1.561 -16.778 1.00 64.01 H new ATOM 0 HG1 THR A 72 3.826 -0.771 -16.712 1.00 13.52 H new ATOM 0 HG21 THR A 72 4.425 2.367 -16.093 1.00 54.35 H new ATOM 0 HG22 THR A 72 3.266 2.404 -14.743 1.00 54.35 H new ATOM 0 HG23 THR A 72 4.484 1.110 -14.834 1.00 54.35 H new ATOM 1007 N TRP A 73 2.852 -0.839 -13.171 1.00 62.35 N ATOM 1008 CA TRP A 73 3.663 -1.697 -12.298 1.00 23.44 C ATOM 1009 C TRP A 73 3.276 -3.179 -12.433 1.00 62.34 C ATOM 1010 O TRP A 73 4.096 -4.072 -12.202 1.00 4.42 O ATOM 1011 CB TRP A 73 3.510 -1.257 -10.835 1.00 11.31 C ATOM 1012 CG TRP A 73 3.943 0.159 -10.577 1.00 61.34 C ATOM 1013 CD1 TRP A 73 4.748 0.933 -11.364 1.00 73.11 C ATOM 1014 CD2 TRP A 73 3.595 0.967 -9.448 1.00 11.41 C ATOM 1015 NE1 TRP A 73 4.922 2.168 -10.790 1.00 22.41 N ATOM 1016 CE2 TRP A 73 4.223 2.214 -9.614 1.00 3.22 C ATOM 1017 CE3 TRP A 73 2.812 0.756 -8.313 1.00 62.12 C ATOM 1018 CZ2 TRP A 73 4.092 3.242 -8.685 1.00 42.03 C ATOM 1019 CZ3 TRP A 73 2.680 1.778 -7.393 1.00 55.01 C ATOM 1020 CH2 TRP A 73 3.318 3.009 -7.583 1.00 0.52 C ATOM 0 H TRP A 73 2.250 -0.185 -12.671 1.00 62.35 H new ATOM 0 HA TRP A 73 4.702 -1.590 -12.609 1.00 23.44 H new ATOM 0 HB2 TRP A 73 2.467 -1.367 -10.540 1.00 11.31 H new ATOM 0 HB3 TRP A 73 4.093 -1.926 -10.202 1.00 11.31 H new ATOM 0 HD1 TRP A 73 5.184 0.619 -12.301 1.00 73.11 H new ATOM 0 HE1 TRP A 73 5.481 2.928 -11.177 1.00 22.41 H new ATOM 0 HE3 TRP A 73 2.317 -0.191 -8.156 1.00 62.12 H new ATOM 0 HZ2 TRP A 73 4.585 4.192 -8.830 1.00 42.03 H new ATOM 0 HZ3 TRP A 73 2.074 1.624 -6.512 1.00 55.01 H new ATOM 0 HH2 TRP A 73 3.197 3.789 -6.846 1.00 0.52 H new ATOM 1031 N GLY A 74 2.021 -3.436 -12.802 1.00 73.22 N ATOM 1032 CA GLY A 74 1.543 -4.807 -12.954 1.00 51.31 C ATOM 1033 C GLY A 74 0.904 -5.357 -11.683 1.00 25.13 C ATOM 1034 O GLY A 74 0.056 -4.703 -11.074 1.00 75.41 O ATOM 0 H GLY A 74 1.323 -2.718 -12.999 1.00 73.22 H new ATOM 0 HA2 GLY A 74 0.817 -4.845 -13.766 1.00 51.31 H new ATOM 0 HA3 GLY A 74 2.377 -5.447 -13.242 1.00 51.31 H new ATOM 1038 N ASN A 75 1.312 -6.556 -11.273 1.00 1.13 N ATOM 1039 CA ASN A 75 0.734 -7.204 -10.091 1.00 40.42 C ATOM 1040 C ASN A 75 1.376 -6.692 -8.790 1.00 63.21 C ATOM 1041 O ASN A 75 2.424 -6.041 -8.805 1.00 64.45 O ATOM 1042 CB ASN A 75 0.874 -8.725 -10.200 1.00 32.24 C ATOM 1043 CG ASN A 75 0.253 -9.262 -11.477 1.00 14.33 C ATOM 1044 OD1 ASN A 75 0.923 -9.407 -12.492 1.00 10.34 O ATOM 1045 ND2 ASN A 75 -1.034 -9.550 -11.445 1.00 53.53 N ATOM 0 H ASN A 75 2.039 -7.100 -11.738 1.00 1.13 H new ATOM 0 HA ASN A 75 -0.325 -6.948 -10.054 1.00 40.42 H new ATOM 0 HB2 ASN A 75 1.929 -8.995 -10.168 1.00 32.24 H new ATOM 0 HB3 ASN A 75 0.398 -9.196 -9.340 1.00 32.24 H new ATOM 0 HD21 ASN A 75 -1.498 -9.904 -12.281 1.00 53.53 H new ATOM 0 HD22 ASN A 75 -1.565 -9.418 -10.584 1.00 53.53 H new ATOM 1052 N ALA A 76 0.760 -7.035 -7.661 1.00 55.12 N ATOM 1053 CA ALA A 76 1.122 -6.460 -6.357 1.00 62.41 C ATOM 1054 C ALA A 76 2.460 -6.983 -5.794 1.00 51.54 C ATOM 1055 O ALA A 76 2.738 -6.835 -4.605 1.00 72.20 O ATOM 1056 CB ALA A 76 -0.005 -6.717 -5.367 1.00 25.13 C ATOM 0 H ALA A 76 0.000 -7.714 -7.618 1.00 55.12 H new ATOM 0 HA ALA A 76 1.264 -5.390 -6.510 1.00 62.41 H new ATOM 0 HB1 ALA A 76 0.258 -6.293 -4.398 1.00 25.13 H new ATOM 0 HB2 ALA A 76 -0.921 -6.252 -5.730 1.00 25.13 H new ATOM 0 HB3 ALA A 76 -0.160 -7.791 -5.263 1.00 25.13 H new ATOM 1062 N ASN A 77 3.282 -7.594 -6.642 1.00 63.22 N ATOM 1063 CA ASN A 77 4.623 -8.047 -6.243 1.00 33.01 C ATOM 1064 C ASN A 77 5.719 -7.078 -6.731 1.00 41.35 C ATOM 1065 O ASN A 77 6.775 -6.951 -6.110 1.00 41.02 O ATOM 1066 CB ASN A 77 4.887 -9.452 -6.800 1.00 41.23 C ATOM 1067 CG ASN A 77 4.835 -9.490 -8.322 1.00 51.22 C ATOM 1068 OD1 ASN A 77 5.834 -9.258 -8.995 1.00 3.23 O ATOM 1069 ND2 ASN A 77 3.674 -9.776 -8.878 1.00 62.22 N ATOM 0 H ASN A 77 3.047 -7.790 -7.615 1.00 63.22 H new ATOM 0 HA ASN A 77 4.656 -8.071 -5.154 1.00 33.01 H new ATOM 0 HB2 ASN A 77 5.865 -9.796 -6.463 1.00 41.23 H new ATOM 0 HB3 ASN A 77 4.149 -10.145 -6.396 1.00 41.23 H new ATOM 0 HD21 ASN A 77 3.589 -9.809 -9.894 1.00 62.22 H new ATOM 0 HD22 ASN A 77 2.861 -9.964 -8.292 1.00 62.22 H new ATOM 1076 N ASN A 78 5.456 -6.383 -7.834 1.00 63.31 N ATOM 1077 CA ASN A 78 6.473 -5.536 -8.478 1.00 11.31 C ATOM 1078 C ASN A 78 6.367 -4.059 -8.043 1.00 71.14 C ATOM 1079 O ASN A 78 7.194 -3.232 -8.426 1.00 13.22 O ATOM 1080 CB ASN A 78 6.344 -5.671 -10.004 1.00 42.52 C ATOM 1081 CG ASN A 78 7.473 -4.995 -10.766 1.00 41.51 C ATOM 1082 OD1 ASN A 78 7.235 -3.792 -11.248 1.00 42.14 O flip ATOM 1083 ND2 ASN A 78 8.542 -5.565 -10.945 1.00 3.14 N flip ATOM 0 H ASN A 78 4.551 -6.385 -8.305 1.00 63.31 H new ATOM 0 HA ASN A 78 7.457 -5.879 -8.159 1.00 11.31 H new ATOM 0 HB2 ASN A 78 6.320 -6.728 -10.267 1.00 42.52 H new ATOM 0 HB3 ASN A 78 5.393 -5.242 -10.321 1.00 42.52 H new ATOM 0 HD21 ASN A 78 8.694 -6.496 -10.558 1.00 3.14 H new ATOM 0 HD22 ASN A 78 9.280 -5.108 -11.481 1.00 3.14 H new ATOM 1090 N TRP A 79 5.366 -3.743 -7.221 1.00 41.41 N ATOM 1091 CA TRP A 79 5.121 -2.361 -6.773 1.00 1.31 C ATOM 1092 C TRP A 79 6.352 -1.724 -6.095 1.00 60.23 C ATOM 1093 O TRP A 79 6.825 -0.678 -6.528 1.00 41.22 O ATOM 1094 CB TRP A 79 3.910 -2.320 -5.828 1.00 52.30 C ATOM 1095 CG TRP A 79 2.591 -2.358 -6.542 1.00 75.44 C ATOM 1096 CD1 TRP A 79 2.265 -3.098 -7.644 1.00 52.54 C ATOM 1097 CD2 TRP A 79 1.418 -1.613 -6.198 1.00 4.12 C ATOM 1098 NE1 TRP A 79 0.966 -2.851 -8.011 1.00 15.13 N ATOM 1099 CE2 TRP A 79 0.424 -1.945 -7.134 1.00 62.02 C ATOM 1100 CE3 TRP A 79 1.112 -0.697 -5.185 1.00 13.14 C ATOM 1101 CZ2 TRP A 79 -0.852 -1.390 -7.094 1.00 2.42 C ATOM 1102 CZ3 TRP A 79 -0.155 -0.148 -5.146 1.00 32.34 C ATOM 1103 CH2 TRP A 79 -1.125 -0.500 -6.092 1.00 61.33 C ATOM 0 H TRP A 79 4.706 -4.425 -6.847 1.00 41.41 H new ATOM 0 HA TRP A 79 4.912 -1.769 -7.664 1.00 1.31 H new ATOM 0 HB2 TRP A 79 3.967 -3.164 -5.141 1.00 52.30 H new ATOM 0 HB3 TRP A 79 3.961 -1.414 -5.224 1.00 52.30 H new ATOM 0 HD1 TRP A 79 2.933 -3.778 -8.152 1.00 52.54 H new ATOM 0 HE1 TRP A 79 0.483 -3.271 -8.805 1.00 15.13 H new ATOM 0 HE3 TRP A 79 1.853 -0.424 -4.448 1.00 13.14 H new ATOM 0 HZ2 TRP A 79 -1.600 -1.653 -7.828 1.00 2.42 H new ATOM 0 HZ3 TRP A 79 -0.401 0.565 -4.373 1.00 32.34 H new ATOM 0 HH2 TRP A 79 -2.109 -0.060 -6.029 1.00 61.33 H new ATOM 1114 N ALA A 80 6.870 -2.362 -5.046 1.00 65.23 N ATOM 1115 CA ALA A 80 8.021 -1.835 -4.294 1.00 75.32 C ATOM 1116 C ALA A 80 9.212 -1.519 -5.211 1.00 21.52 C ATOM 1117 O ALA A 80 9.840 -0.462 -5.096 1.00 52.41 O ATOM 1118 CB ALA A 80 8.433 -2.830 -3.215 1.00 75.15 C ATOM 0 H ALA A 80 6.512 -3.249 -4.692 1.00 65.23 H new ATOM 0 HA ALA A 80 7.714 -0.898 -3.829 1.00 75.32 H new ATOM 0 HB1 ALA A 80 9.285 -2.435 -2.662 1.00 75.15 H new ATOM 0 HB2 ALA A 80 7.600 -2.991 -2.531 1.00 75.15 H new ATOM 0 HB3 ALA A 80 8.709 -3.777 -3.679 1.00 75.15 H new ATOM 1124 N SER A 81 9.509 -2.440 -6.123 1.00 53.20 N ATOM 1125 CA SER A 81 10.612 -2.265 -7.080 1.00 20.23 C ATOM 1126 C SER A 81 10.327 -1.127 -8.067 1.00 2.24 C ATOM 1127 O SER A 81 11.110 -0.183 -8.190 1.00 32.53 O ATOM 1128 CB SER A 81 10.859 -3.565 -7.859 1.00 35.12 C ATOM 1129 OG SER A 81 11.863 -3.396 -8.846 1.00 4.21 O ATOM 0 H SER A 81 9.003 -3.320 -6.225 1.00 53.20 H new ATOM 0 HA SER A 81 11.502 -2.009 -6.505 1.00 20.23 H new ATOM 0 HB2 SER A 81 11.156 -4.354 -7.168 1.00 35.12 H new ATOM 0 HB3 SER A 81 9.932 -3.888 -8.333 1.00 35.12 H new ATOM 0 HG SER A 81 11.998 -4.241 -9.323 1.00 4.21 H new ATOM 1135 N ALA A 82 9.186 -1.211 -8.749 1.00 5.24 N ATOM 1136 CA ALA A 82 8.815 -0.232 -9.777 1.00 23.41 C ATOM 1137 C ALA A 82 8.645 1.179 -9.191 1.00 41.31 C ATOM 1138 O ALA A 82 9.205 2.137 -9.709 1.00 71.02 O ATOM 1139 CB ALA A 82 7.541 -0.676 -10.481 1.00 43.50 C ATOM 0 H ALA A 82 8.497 -1.950 -8.609 1.00 5.24 H new ATOM 0 HA ALA A 82 9.628 -0.184 -10.501 1.00 23.41 H new ATOM 0 HB1 ALA A 82 7.272 0.056 -11.243 1.00 43.50 H new ATOM 0 HB2 ALA A 82 7.704 -1.646 -10.951 1.00 43.50 H new ATOM 0 HB3 ALA A 82 6.733 -0.757 -9.754 1.00 43.50 H new ATOM 1145 N ALA A 83 7.871 1.290 -8.109 1.00 21.43 N ATOM 1146 CA ALA A 83 7.662 2.569 -7.411 1.00 71.51 C ATOM 1147 C ALA A 83 8.989 3.279 -7.130 1.00 30.25 C ATOM 1148 O ALA A 83 9.207 4.406 -7.578 1.00 63.00 O ATOM 1149 CB ALA A 83 6.898 2.332 -6.112 1.00 54.11 C ATOM 0 H ALA A 83 7.373 0.504 -7.691 1.00 21.43 H new ATOM 0 HA ALA A 83 7.074 3.218 -8.060 1.00 71.51 H new ATOM 0 HB1 ALA A 83 6.747 3.282 -5.600 1.00 54.11 H new ATOM 0 HB2 ALA A 83 5.931 1.882 -6.336 1.00 54.11 H new ATOM 0 HB3 ALA A 83 7.470 1.662 -5.471 1.00 54.11 H new ATOM 1155 N SER A 84 9.888 2.601 -6.422 1.00 61.01 N ATOM 1156 CA SER A 84 11.186 3.189 -6.064 1.00 44.13 C ATOM 1157 C SER A 84 12.008 3.520 -7.317 1.00 63.43 C ATOM 1158 O SER A 84 12.667 4.559 -7.387 1.00 72.20 O ATOM 1159 CB SER A 84 11.980 2.240 -5.158 1.00 24.34 C ATOM 1160 OG SER A 84 12.237 1.005 -5.805 1.00 22.44 O ATOM 0 H SER A 84 9.748 1.649 -6.084 1.00 61.01 H new ATOM 0 HA SER A 84 10.990 4.115 -5.523 1.00 44.13 H new ATOM 0 HB2 SER A 84 12.923 2.708 -4.875 1.00 24.34 H new ATOM 0 HB3 SER A 84 11.424 2.062 -4.238 1.00 24.34 H new ATOM 0 HG SER A 84 11.490 0.391 -5.647 1.00 22.44 H new ATOM 1166 N SER A 85 11.954 2.634 -8.309 1.00 2.41 N ATOM 1167 CA SER A 85 12.665 2.841 -9.580 1.00 75.12 C ATOM 1168 C SER A 85 12.024 3.964 -10.414 1.00 33.24 C ATOM 1169 O SER A 85 12.688 4.602 -11.234 1.00 32.22 O ATOM 1170 CB SER A 85 12.683 1.542 -10.397 1.00 75.31 C ATOM 1171 OG SER A 85 13.465 1.681 -11.575 1.00 63.52 O ATOM 0 H SER A 85 11.426 1.763 -8.262 1.00 2.41 H new ATOM 0 HA SER A 85 13.686 3.137 -9.338 1.00 75.12 H new ATOM 0 HB2 SER A 85 13.083 0.732 -9.787 1.00 75.31 H new ATOM 0 HB3 SER A 85 11.664 1.265 -10.666 1.00 75.31 H new ATOM 0 HG SER A 85 13.459 0.837 -12.073 1.00 63.52 H new ATOM 1177 N ALA A 86 10.730 4.206 -10.193 1.00 5.41 N ATOM 1178 CA ALA A 86 9.972 5.214 -10.952 1.00 61.22 C ATOM 1179 C ALA A 86 9.841 6.542 -10.184 1.00 53.35 C ATOM 1180 O ALA A 86 9.007 7.386 -10.522 1.00 60.02 O ATOM 1181 CB ALA A 86 8.591 4.667 -11.303 1.00 1.40 C ATOM 0 H ALA A 86 10.178 3.715 -9.490 1.00 5.41 H new ATOM 0 HA ALA A 86 10.526 5.425 -11.867 1.00 61.22 H new ATOM 0 HB1 ALA A 86 8.034 5.417 -11.865 1.00 1.40 H new ATOM 0 HB2 ALA A 86 8.699 3.767 -11.908 1.00 1.40 H new ATOM 0 HB3 ALA A 86 8.052 4.426 -10.387 1.00 1.40 H new ATOM 1187 N GLY A 87 10.653 6.719 -9.147 1.00 4.23 N ATOM 1188 CA GLY A 87 10.668 7.980 -8.410 1.00 41.23 C ATOM 1189 C GLY A 87 9.825 7.965 -7.136 1.00 24.20 C ATOM 1190 O GLY A 87 10.040 8.783 -6.241 1.00 62.05 O ATOM 0 H GLY A 87 11.303 6.014 -8.800 1.00 4.23 H new ATOM 0 HA2 GLY A 87 11.698 8.224 -8.149 1.00 41.23 H new ATOM 0 HA3 GLY A 87 10.307 8.775 -9.063 1.00 41.23 H new ATOM 1194 N TYR A 88 8.863 7.047 -7.046 1.00 22.34 N ATOM 1195 CA TYR A 88 7.996 6.959 -5.862 1.00 64.21 C ATOM 1196 C TYR A 88 8.807 6.602 -4.605 1.00 33.33 C ATOM 1197 O TYR A 88 9.862 5.972 -4.684 1.00 53.42 O ATOM 1198 CB TYR A 88 6.878 5.930 -6.070 1.00 33.43 C ATOM 1199 CG TYR A 88 5.902 6.271 -7.186 1.00 65.44 C ATOM 1200 CD1 TYR A 88 6.228 6.052 -8.522 1.00 3.32 C ATOM 1201 CD2 TYR A 88 4.647 6.798 -6.899 1.00 60.03 C ATOM 1202 CE1 TYR A 88 5.334 6.350 -9.534 1.00 72.54 C ATOM 1203 CE2 TYR A 88 3.746 7.093 -7.905 1.00 53.33 C ATOM 1204 CZ TYR A 88 4.093 6.867 -9.220 1.00 33.33 C ATOM 1205 OH TYR A 88 3.191 7.144 -10.226 1.00 24.44 O ATOM 0 H TYR A 88 8.662 6.357 -7.770 1.00 22.34 H new ATOM 0 HA TYR A 88 7.544 7.940 -5.718 1.00 64.21 H new ATOM 0 HB2 TYR A 88 7.329 4.961 -6.284 1.00 33.43 H new ATOM 0 HB3 TYR A 88 6.322 5.824 -5.139 1.00 33.43 H new ATOM 0 HD1 TYR A 88 7.196 5.642 -8.772 1.00 3.32 H new ATOM 0 HD2 TYR A 88 4.371 6.980 -5.871 1.00 60.03 H new ATOM 0 HE1 TYR A 88 5.605 6.179 -10.565 1.00 72.54 H new ATOM 0 HE2 TYR A 88 2.775 7.499 -7.662 1.00 53.33 H new ATOM 0 HH TYR A 88 3.582 6.902 -11.092 1.00 24.44 H new ATOM 1215 N THR A 89 8.292 6.981 -3.446 1.00 72.43 N ATOM 1216 CA THR A 89 9.054 6.879 -2.192 1.00 44.41 C ATOM 1217 C THR A 89 8.675 5.633 -1.376 1.00 61.03 C ATOM 1218 O THR A 89 7.707 5.642 -0.616 1.00 25.11 O ATOM 1219 CB THR A 89 8.854 8.142 -1.320 1.00 12.24 C ATOM 1220 OG1 THR A 89 9.126 9.324 -2.091 1.00 65.40 O ATOM 1221 CG2 THR A 89 9.762 8.122 -0.095 1.00 25.33 C ATOM 0 H THR A 89 7.352 7.362 -3.338 1.00 72.43 H new ATOM 0 HA THR A 89 10.103 6.791 -2.476 1.00 44.41 H new ATOM 0 HB THR A 89 7.817 8.150 -0.984 1.00 12.24 H new ATOM 0 HG1 THR A 89 8.995 10.117 -1.531 1.00 65.40 H new ATOM 0 HG21 THR A 89 9.596 9.023 0.496 1.00 25.33 H new ATOM 0 HG22 THR A 89 9.536 7.244 0.511 1.00 25.33 H new ATOM 0 HG23 THR A 89 10.803 8.084 -0.415 1.00 25.33 H new ATOM 1229 N VAL A 90 9.446 4.559 -1.533 1.00 3.21 N ATOM 1230 CA VAL A 90 9.192 3.305 -0.809 1.00 54.11 C ATOM 1231 C VAL A 90 10.029 3.222 0.481 1.00 43.14 C ATOM 1232 O VAL A 90 11.254 3.102 0.430 1.00 72.05 O ATOM 1233 CB VAL A 90 9.499 2.071 -1.695 1.00 13.32 C ATOM 1234 CG1 VAL A 90 9.193 0.774 -0.944 1.00 13.34 C ATOM 1235 CG2 VAL A 90 8.714 2.140 -3.003 1.00 13.31 C ATOM 0 H VAL A 90 10.254 4.527 -2.155 1.00 3.21 H new ATOM 0 HA VAL A 90 8.134 3.302 -0.547 1.00 54.11 H new ATOM 0 HB VAL A 90 10.562 2.079 -1.935 1.00 13.32 H new ATOM 0 HG11 VAL A 90 9.416 -0.079 -1.585 1.00 13.34 H new ATOM 0 HG12 VAL A 90 9.806 0.721 -0.044 1.00 13.34 H new ATOM 0 HG13 VAL A 90 8.139 0.754 -0.667 1.00 13.34 H new ATOM 0 HG21 VAL A 90 8.943 1.265 -3.611 1.00 13.31 H new ATOM 0 HG22 VAL A 90 7.646 2.162 -2.786 1.00 13.31 H new ATOM 0 HG23 VAL A 90 8.992 3.043 -3.547 1.00 13.31 H new ATOM 1245 N ASN A 91 9.359 3.291 1.634 1.00 4.34 N ATOM 1246 CA ASN A 91 10.035 3.241 2.944 1.00 54.21 C ATOM 1247 C ASN A 91 9.327 2.264 3.897 1.00 21.13 C ATOM 1248 O ASN A 91 8.268 1.726 3.572 1.00 51.44 O ATOM 1249 CB ASN A 91 10.057 4.635 3.596 1.00 64.52 C ATOM 1250 CG ASN A 91 10.739 5.695 2.748 1.00 63.11 C ATOM 1251 OD1 ASN A 91 11.644 5.414 1.977 1.00 72.02 O ATOM 1252 ND2 ASN A 91 10.313 6.932 2.900 1.00 24.31 N ATOM 0 H ASN A 91 8.345 3.382 1.693 1.00 4.34 H new ATOM 0 HA ASN A 91 11.055 2.898 2.769 1.00 54.21 H new ATOM 0 HB2 ASN A 91 9.033 4.948 3.798 1.00 64.52 H new ATOM 0 HB3 ASN A 91 10.566 4.569 4.558 1.00 64.52 H new ATOM 0 HD21 ASN A 91 10.741 7.688 2.366 1.00 24.31 H new ATOM 0 HD22 ASN A 91 9.555 7.134 3.552 1.00 24.31 H new ATOM 1259 N ASN A 92 9.908 2.049 5.081 1.00 11.40 N ATOM 1260 CA ASN A 92 9.241 1.274 6.139 1.00 0.11 C ATOM 1261 C ASN A 92 8.316 2.177 6.974 1.00 2.03 C ATOM 1262 O ASN A 92 7.686 1.726 7.933 1.00 10.23 O ATOM 1263 CB ASN A 92 10.270 0.589 7.050 1.00 44.11 C ATOM 1264 CG ASN A 92 11.095 -0.451 6.315 1.00 52.31 C ATOM 1265 OD1 ASN A 92 12.166 -0.159 5.795 1.00 55.34 O ATOM 1266 ND2 ASN A 92 10.599 -1.671 6.263 1.00 62.53 N ATOM 0 H ASN A 92 10.833 2.397 5.333 1.00 11.40 H new ATOM 0 HA ASN A 92 8.638 0.504 5.658 1.00 0.11 H new ATOM 0 HB2 ASN A 92 10.934 1.342 7.473 1.00 44.11 H new ATOM 0 HB3 ASN A 92 9.753 0.115 7.884 1.00 44.11 H new ATOM 0 HD21 ASN A 92 11.110 -2.409 5.778 1.00 62.53 H new ATOM 0 HD22 ASN A 92 9.704 -1.877 6.708 1.00 62.53 H new ATOM 1273 N SER A 93 8.263 3.459 6.611 1.00 31.31 N ATOM 1274 CA SER A 93 7.360 4.425 7.258 1.00 22.03 C ATOM 1275 C SER A 93 5.890 4.128 6.939 1.00 75.25 C ATOM 1276 O SER A 93 5.470 4.228 5.785 1.00 74.11 O ATOM 1277 CB SER A 93 7.691 5.857 6.814 1.00 44.44 C ATOM 1278 OG SER A 93 6.688 6.770 7.238 1.00 31.11 O ATOM 0 H SER A 93 8.837 3.859 5.868 1.00 31.31 H new ATOM 0 HA SER A 93 7.509 4.330 8.334 1.00 22.03 H new ATOM 0 HB2 SER A 93 8.655 6.155 7.226 1.00 44.44 H new ATOM 0 HB3 SER A 93 7.783 5.892 5.728 1.00 44.44 H new ATOM 0 HG SER A 93 6.924 7.675 6.944 1.00 31.11 H new ATOM 1284 N PRO A 94 5.079 3.773 7.955 1.00 62.40 N ATOM 1285 CA PRO A 94 3.655 3.465 7.766 1.00 62.14 C ATOM 1286 C PRO A 94 2.768 4.719 7.680 1.00 24.20 C ATOM 1287 O PRO A 94 1.543 4.609 7.651 1.00 3.12 O ATOM 1288 CB PRO A 94 3.293 2.644 9.025 1.00 12.13 C ATOM 1289 CG PRO A 94 4.560 2.515 9.822 1.00 73.31 C ATOM 1290 CD PRO A 94 5.464 3.625 9.362 1.00 71.45 C ATOM 0 HA PRO A 94 3.487 2.941 6.825 1.00 62.14 H new ATOM 0 HB2 PRO A 94 2.518 3.144 9.606 1.00 12.13 H new ATOM 0 HB3 PRO A 94 2.904 1.663 8.751 1.00 12.13 H new ATOM 0 HG2 PRO A 94 4.357 2.596 10.890 1.00 73.31 H new ATOM 0 HG3 PRO A 94 5.025 1.543 9.659 1.00 73.31 H new ATOM 0 HD2 PRO A 94 5.302 4.543 9.927 1.00 71.45 H new ATOM 0 HD3 PRO A 94 6.517 3.365 9.471 1.00 71.45 H new ATOM 1298 N GLU A 95 3.395 5.900 7.635 1.00 73.22 N ATOM 1299 CA GLU A 95 2.674 7.187 7.662 1.00 53.02 C ATOM 1300 C GLU A 95 1.468 7.199 6.700 1.00 34.42 C ATOM 1301 O GLU A 95 1.561 6.727 5.562 1.00 73.53 O ATOM 1302 CB GLU A 95 3.641 8.339 7.329 1.00 74.23 C ATOM 1303 CG GLU A 95 3.497 9.569 8.231 1.00 74.44 C ATOM 1304 CD GLU A 95 2.198 10.336 8.026 1.00 32.23 C ATOM 1305 OE1 GLU A 95 1.175 9.974 8.645 1.00 23.21 O ATOM 1306 OE2 GLU A 95 2.203 11.325 7.261 1.00 21.13 O ATOM 0 H GLU A 95 4.409 5.996 7.579 1.00 73.22 H new ATOM 0 HA GLU A 95 2.281 7.324 8.669 1.00 53.02 H new ATOM 0 HB2 GLU A 95 4.664 7.970 7.400 1.00 74.23 H new ATOM 0 HB3 GLU A 95 3.482 8.642 6.294 1.00 74.23 H new ATOM 0 HG2 GLU A 95 3.560 9.253 9.272 1.00 74.44 H new ATOM 0 HG3 GLU A 95 4.336 10.240 8.050 1.00 74.44 H new ATOM 1313 N ALA A 96 0.350 7.759 7.168 1.00 15.20 N ATOM 1314 CA ALA A 96 -0.932 7.706 6.450 1.00 1.32 C ATOM 1315 C ALA A 96 -0.842 8.238 5.009 1.00 31.43 C ATOM 1316 O ALA A 96 0.036 9.040 4.674 1.00 12.31 O ATOM 1317 CB ALA A 96 -1.995 8.474 7.228 1.00 42.52 C ATOM 0 H ALA A 96 0.305 8.262 8.054 1.00 15.20 H new ATOM 0 HA ALA A 96 -1.209 6.654 6.376 1.00 1.32 H new ATOM 0 HB1 ALA A 96 -2.942 8.430 6.690 1.00 42.52 H new ATOM 0 HB2 ALA A 96 -2.117 8.027 8.215 1.00 42.52 H new ATOM 0 HB3 ALA A 96 -1.687 9.514 7.336 1.00 42.52 H new ATOM 1323 N GLY A 97 -1.777 7.799 4.166 1.00 71.42 N ATOM 1324 CA GLY A 97 -1.750 8.161 2.752 1.00 34.33 C ATOM 1325 C GLY A 97 -0.759 7.328 1.941 1.00 53.44 C ATOM 1326 O GLY A 97 -0.272 7.774 0.901 1.00 23.15 O ATOM 0 H GLY A 97 -2.555 7.198 4.436 1.00 71.42 H new ATOM 0 HA2 GLY A 97 -2.748 8.038 2.332 1.00 34.33 H new ATOM 0 HA3 GLY A 97 -1.492 9.216 2.658 1.00 34.33 H new ATOM 1330 N SER A 98 -0.470 6.113 2.410 1.00 71.41 N ATOM 1331 CA SER A 98 0.511 5.236 1.751 1.00 41.15 C ATOM 1332 C SER A 98 -0.057 3.832 1.503 1.00 62.55 C ATOM 1333 O SER A 98 -1.180 3.515 1.905 1.00 13.01 O ATOM 1334 CB SER A 98 1.789 5.131 2.596 1.00 31.14 C ATOM 1335 OG SER A 98 1.545 4.481 3.834 1.00 53.53 O ATOM 0 H SER A 98 -0.899 5.710 3.243 1.00 71.41 H new ATOM 0 HA SER A 98 0.747 5.683 0.785 1.00 41.15 H new ATOM 0 HB2 SER A 98 2.549 4.582 2.040 1.00 31.14 H new ATOM 0 HB3 SER A 98 2.187 6.129 2.781 1.00 31.14 H new ATOM 0 HG SER A 98 1.523 5.146 4.554 1.00 53.53 H new ATOM 1341 N ILE A 99 0.732 2.995 0.836 1.00 1.20 N ATOM 1342 CA ILE A 99 0.317 1.632 0.478 1.00 23.52 C ATOM 1343 C ILE A 99 1.389 0.615 0.894 1.00 30.54 C ATOM 1344 O ILE A 99 2.555 0.774 0.545 1.00 20.13 O ATOM 1345 CB ILE A 99 0.093 1.522 -1.052 1.00 25.10 C ATOM 1346 CG1 ILE A 99 -0.882 2.612 -1.536 1.00 62.41 C ATOM 1347 CG2 ILE A 99 -0.422 0.130 -1.424 1.00 22.53 C ATOM 1348 CD1 ILE A 99 -0.939 2.755 -3.040 1.00 52.21 C ATOM 0 H ILE A 99 1.674 3.236 0.527 1.00 1.20 H new ATOM 0 HA ILE A 99 -0.613 1.416 1.003 1.00 23.52 H new ATOM 0 HB ILE A 99 1.050 1.674 -1.551 1.00 25.10 H new ATOM 0 HG12 ILE A 99 -1.881 2.384 -1.164 1.00 62.41 H new ATOM 0 HG13 ILE A 99 -0.590 3.567 -1.100 1.00 62.41 H new ATOM 0 HG21 ILE A 99 -0.573 0.074 -2.502 1.00 22.53 H new ATOM 0 HG22 ILE A 99 0.307 -0.621 -1.120 1.00 22.53 H new ATOM 0 HG23 ILE A 99 -1.368 -0.056 -0.915 1.00 22.53 H new ATOM 0 HD11 ILE A 99 -1.646 3.541 -3.304 1.00 52.21 H new ATOM 0 HD12 ILE A 99 0.050 3.014 -3.419 1.00 52.21 H new ATOM 0 HD13 ILE A 99 -1.262 1.813 -3.483 1.00 52.21 H new ATOM 1360 N LEU A 100 1.009 -0.433 1.627 1.00 22.23 N ATOM 1361 CA LEU A 100 1.991 -1.437 2.070 1.00 71.20 C ATOM 1362 C LEU A 100 1.932 -2.704 1.203 1.00 0.22 C ATOM 1363 O LEU A 100 0.855 -3.176 0.839 1.00 14.45 O ATOM 1364 CB LEU A 100 1.808 -1.796 3.560 1.00 53.43 C ATOM 1365 CG LEU A 100 0.695 -2.801 3.918 1.00 52.34 C ATOM 1366 CD1 LEU A 100 0.674 -3.054 5.424 1.00 33.45 C ATOM 1367 CD2 LEU A 100 -0.669 -2.317 3.438 1.00 13.44 C ATOM 0 H LEU A 100 0.050 -0.611 1.924 1.00 22.23 H new ATOM 0 HA LEU A 100 2.977 -0.988 1.950 1.00 71.20 H new ATOM 0 HB2 LEU A 100 2.753 -2.195 3.928 1.00 53.43 H new ATOM 0 HB3 LEU A 100 1.617 -0.873 4.107 1.00 53.43 H new ATOM 0 HG LEU A 100 0.912 -3.738 3.406 1.00 52.34 H new ATOM 0 HD11 LEU A 100 -0.117 -3.765 5.662 1.00 33.45 H new ATOM 0 HD12 LEU A 100 1.635 -3.461 5.738 1.00 33.45 H new ATOM 0 HD13 LEU A 100 0.488 -2.116 5.948 1.00 33.45 H new ATOM 0 HD21 LEU A 100 -1.430 -3.049 3.707 1.00 13.44 H new ATOM 0 HD22 LEU A 100 -0.902 -1.362 3.908 1.00 13.44 H new ATOM 0 HD23 LEU A 100 -0.651 -2.193 2.355 1.00 13.44 H new ATOM 1379 N GLN A 101 3.103 -3.240 0.871 1.00 21.51 N ATOM 1380 CA GLN A 101 3.202 -4.455 0.056 1.00 61.01 C ATOM 1381 C GLN A 101 3.543 -5.679 0.922 1.00 53.55 C ATOM 1382 O GLN A 101 4.648 -5.787 1.456 1.00 73.42 O ATOM 1383 CB GLN A 101 4.259 -4.261 -1.042 1.00 52.11 C ATOM 1384 CG GLN A 101 4.426 -5.459 -1.969 1.00 61.41 C ATOM 1385 CD GLN A 101 5.327 -5.152 -3.150 1.00 71.12 C ATOM 1386 OE1 GLN A 101 5.389 -4.028 -3.613 1.00 63.33 O ATOM 1387 NE2 GLN A 101 6.039 -6.143 -3.644 1.00 62.41 N ATOM 0 H GLN A 101 4.003 -2.852 1.154 1.00 21.51 H new ATOM 0 HA GLN A 101 2.233 -4.638 -0.409 1.00 61.01 H new ATOM 0 HB2 GLN A 101 3.991 -3.389 -1.639 1.00 52.11 H new ATOM 0 HB3 GLN A 101 5.218 -4.043 -0.572 1.00 52.11 H new ATOM 0 HG2 GLN A 101 4.840 -6.296 -1.407 1.00 61.41 H new ATOM 0 HG3 GLN A 101 3.448 -5.773 -2.333 1.00 61.41 H new ATOM 0 HE21 GLN A 101 5.967 -7.075 -3.236 1.00 62.41 H new ATOM 0 HE22 GLN A 101 6.662 -5.979 -4.434 1.00 62.41 H new ATOM 1396 N SER A 102 2.579 -6.590 1.065 1.00 3.25 N ATOM 1397 CA SER A 102 2.741 -7.785 1.909 1.00 63.11 C ATOM 1398 C SER A 102 3.449 -8.940 1.183 1.00 55.04 C ATOM 1399 O SER A 102 4.091 -9.770 1.823 1.00 61.44 O ATOM 1400 CB SER A 102 1.377 -8.269 2.413 1.00 25.35 C ATOM 1401 OG SER A 102 0.732 -7.273 3.191 1.00 15.22 O ATOM 0 H SER A 102 1.671 -6.526 0.606 1.00 3.25 H new ATOM 0 HA SER A 102 3.371 -7.487 2.747 1.00 63.11 H new ATOM 0 HB2 SER A 102 0.747 -8.535 1.564 1.00 25.35 H new ATOM 0 HB3 SER A 102 1.507 -9.172 3.009 1.00 25.35 H new ATOM 0 HG SER A 102 -0.136 -7.609 3.498 1.00 15.22 H new ATOM 1407 N THR A 103 3.276 -9.009 -0.145 1.00 73.32 N ATOM 1408 CA THR A 103 3.909 -10.040 -1.019 1.00 30.21 C ATOM 1409 C THR A 103 3.392 -11.473 -0.774 1.00 33.20 C ATOM 1410 O THR A 103 3.465 -12.316 -1.669 1.00 4.44 O ATOM 1411 CB THR A 103 5.465 -10.071 -0.921 1.00 71.20 C ATOM 1412 OG1 THR A 103 5.895 -10.658 0.314 1.00 54.13 O ATOM 1413 CG2 THR A 103 6.053 -8.675 -1.049 1.00 3.34 C ATOM 0 H THR A 103 2.690 -8.351 -0.659 1.00 73.32 H new ATOM 0 HA THR A 103 3.614 -9.721 -2.018 1.00 30.21 H new ATOM 0 HB THR A 103 5.825 -10.683 -1.748 1.00 71.20 H new ATOM 0 HG1 THR A 103 5.187 -10.564 0.985 1.00 54.13 H new ATOM 0 HG21 THR A 103 7.139 -8.730 -0.977 1.00 3.34 H new ATOM 0 HG22 THR A 103 5.774 -8.250 -2.013 1.00 3.34 H new ATOM 0 HG23 THR A 103 5.667 -8.043 -0.249 1.00 3.34 H new ATOM 1421 N ALA A 104 2.871 -11.748 0.420 1.00 21.34 N ATOM 1422 CA ALA A 104 2.478 -13.109 0.809 1.00 31.11 C ATOM 1423 C ALA A 104 1.263 -13.648 0.023 1.00 62.12 C ATOM 1424 O ALA A 104 0.121 -13.539 0.476 1.00 10.14 O ATOM 1425 CB ALA A 104 2.202 -13.160 2.311 1.00 12.14 C ATOM 0 H ALA A 104 2.709 -11.045 1.141 1.00 21.34 H new ATOM 0 HA ALA A 104 3.316 -13.760 0.559 1.00 31.11 H new ATOM 0 HB1 ALA A 104 1.911 -14.172 2.593 1.00 12.14 H new ATOM 0 HB2 ALA A 104 3.102 -12.876 2.856 1.00 12.14 H new ATOM 0 HB3 ALA A 104 1.396 -12.469 2.556 1.00 12.14 H new ATOM 1431 N GLY A 105 1.525 -14.211 -1.159 1.00 44.22 N ATOM 1432 CA GLY A 105 0.498 -14.950 -1.903 1.00 10.41 C ATOM 1433 C GLY A 105 -0.480 -14.078 -2.694 1.00 60.40 C ATOM 1434 O GLY A 105 -1.010 -13.093 -2.180 1.00 74.30 O ATOM 0 H GLY A 105 2.434 -14.171 -1.621 1.00 44.22 H new ATOM 0 HA2 GLY A 105 0.992 -15.634 -2.593 1.00 10.41 H new ATOM 0 HA3 GLY A 105 -0.069 -15.561 -1.201 1.00 10.41 H new ATOM 1438 N GLY A 106 -0.744 -14.469 -3.946 1.00 73.15 N ATOM 1439 CA GLY A 106 -1.718 -13.762 -4.778 1.00 42.13 C ATOM 1440 C GLY A 106 -1.090 -12.744 -5.725 1.00 34.24 C ATOM 1441 O GLY A 106 -1.550 -11.604 -5.806 1.00 21.04 O ATOM 0 H GLY A 106 -0.299 -15.266 -4.401 1.00 73.15 H new ATOM 0 HA2 GLY A 106 -2.280 -14.490 -5.362 1.00 42.13 H new ATOM 0 HA3 GLY A 106 -2.432 -13.252 -4.132 1.00 42.13 H new ATOM 1445 N TYR A 107 -0.054 -13.163 -6.468 1.00 53.25 N ATOM 1446 CA TYR A 107 0.702 -12.248 -7.341 1.00 30.11 C ATOM 1447 C TYR A 107 1.285 -11.082 -6.529 1.00 74.44 C ATOM 1448 O TYR A 107 1.484 -9.977 -7.046 1.00 51.53 O ATOM 1449 CB TYR A 107 -0.195 -11.706 -8.469 1.00 72.12 C ATOM 1450 CG TYR A 107 -0.606 -12.743 -9.500 1.00 61.42 C ATOM 1451 CD1 TYR A 107 -1.698 -13.578 -9.284 1.00 73.40 C ATOM 1452 CD2 TYR A 107 0.092 -12.872 -10.697 1.00 13.14 C ATOM 1453 CE1 TYR A 107 -2.078 -14.512 -10.229 1.00 71.23 C ATOM 1454 CE2 TYR A 107 -0.284 -13.805 -11.644 1.00 72.11 C ATOM 1455 CZ TYR A 107 -1.369 -14.619 -11.406 1.00 44.33 C ATOM 1456 OH TYR A 107 -1.746 -15.547 -12.353 1.00 21.33 O ATOM 0 H TYR A 107 0.280 -14.127 -6.483 1.00 53.25 H new ATOM 0 HA TYR A 107 1.523 -12.810 -7.786 1.00 30.11 H new ATOM 0 HB2 TYR A 107 -1.094 -11.276 -8.027 1.00 72.12 H new ATOM 0 HB3 TYR A 107 0.330 -10.896 -8.976 1.00 72.12 H new ATOM 0 HD1 TYR A 107 -2.257 -13.495 -8.364 1.00 73.40 H new ATOM 0 HD2 TYR A 107 0.941 -12.233 -10.889 1.00 13.14 H new ATOM 0 HE1 TYR A 107 -2.926 -15.155 -10.046 1.00 71.23 H new ATOM 0 HE2 TYR A 107 0.270 -13.896 -12.566 1.00 72.11 H new ATOM 0 HH TYR A 107 -1.143 -15.492 -13.123 1.00 21.33 H new ATOM 1466 N GLY A 108 1.601 -11.354 -5.266 1.00 74.43 N ATOM 1467 CA GLY A 108 1.972 -10.304 -4.332 1.00 42.32 C ATOM 1468 C GLY A 108 0.767 -9.839 -3.524 1.00 52.13 C ATOM 1469 O GLY A 108 -0.263 -10.507 -3.511 1.00 61.14 O ATOM 0 H GLY A 108 1.607 -12.294 -4.869 1.00 74.43 H new ATOM 0 HA2 GLY A 108 2.747 -10.669 -3.658 1.00 42.32 H new ATOM 0 HA3 GLY A 108 2.396 -9.461 -4.877 1.00 42.32 H new ATOM 1473 N HIS A 109 0.879 -8.702 -2.851 1.00 44.55 N ATOM 1474 CA HIS A 109 -0.261 -8.150 -2.111 1.00 0.44 C ATOM 1475 C HIS A 109 0.006 -6.714 -1.662 1.00 24.55 C ATOM 1476 O HIS A 109 1.082 -6.408 -1.153 1.00 24.40 O ATOM 1477 CB HIS A 109 -0.601 -9.016 -0.892 1.00 22.25 C ATOM 1478 CG HIS A 109 -1.840 -8.561 -0.188 1.00 44.15 C ATOM 1479 ND1 HIS A 109 -3.013 -8.378 -0.879 1.00 43.30 N ATOM 1480 CD2 HIS A 109 -2.034 -8.233 1.114 1.00 21.11 C ATOM 1481 CE1 HIS A 109 -3.890 -7.944 0.007 1.00 1.12 C ATOM 1482 NE2 HIS A 109 -3.341 -7.840 1.226 1.00 52.10 N ATOM 0 H HIS A 109 1.733 -8.146 -2.798 1.00 44.55 H new ATOM 0 HA HIS A 109 -1.112 -8.149 -2.792 1.00 0.44 H new ATOM 0 HB2 HIS A 109 -0.728 -10.051 -1.211 1.00 22.25 H new ATOM 0 HB3 HIS A 109 0.236 -8.998 -0.194 1.00 22.25 H new ATOM 0 HD1 HIS A 109 -3.173 -8.543 -1.873 1.00 43.30 H new ATOM 0 HD2 HIS A 109 -1.301 -8.274 1.907 1.00 21.11 H new ATOM 0 HE1 HIS A 109 -4.918 -7.703 -0.221 1.00 1.12 H new ATOM 0 HE2 HIS A 109 -3.809 -7.527 2.077 1.00 52.10 H new ATOM 1490 N VAL A 110 -0.987 -5.847 -1.856 1.00 5.20 N ATOM 1491 CA VAL A 110 -0.897 -4.434 -1.459 1.00 51.44 C ATOM 1492 C VAL A 110 -2.239 -3.934 -0.901 1.00 24.11 C ATOM 1493 O VAL A 110 -3.306 -4.334 -1.373 1.00 43.41 O ATOM 1494 CB VAL A 110 -0.474 -3.523 -2.648 1.00 45.41 C ATOM 1495 CG1 VAL A 110 0.949 -3.839 -3.102 1.00 31.32 C ATOM 1496 CG2 VAL A 110 -1.458 -3.654 -3.812 1.00 52.02 C ATOM 0 H VAL A 110 -1.875 -6.098 -2.291 1.00 5.20 H new ATOM 0 HA VAL A 110 -0.132 -4.376 -0.685 1.00 51.44 H new ATOM 0 HB VAL A 110 -0.494 -2.490 -2.302 1.00 45.41 H new ATOM 0 HG11 VAL A 110 1.219 -3.188 -3.934 1.00 31.32 H new ATOM 0 HG12 VAL A 110 1.640 -3.676 -2.275 1.00 31.32 H new ATOM 0 HG13 VAL A 110 1.006 -4.879 -3.422 1.00 31.32 H new ATOM 0 HG21 VAL A 110 -1.141 -3.008 -4.631 1.00 52.02 H new ATOM 0 HG22 VAL A 110 -1.481 -4.689 -4.154 1.00 52.02 H new ATOM 0 HG23 VAL A 110 -2.454 -3.359 -3.482 1.00 52.02 H new ATOM 1506 N ALA A 111 -2.180 -3.064 0.104 1.00 22.41 N ATOM 1507 CA ALA A 111 -3.386 -2.473 0.696 1.00 1.31 C ATOM 1508 C ALA A 111 -3.149 -1.007 1.078 1.00 43.34 C ATOM 1509 O ALA A 111 -2.010 -0.589 1.296 1.00 42.43 O ATOM 1510 CB ALA A 111 -3.831 -3.277 1.913 1.00 61.22 C ATOM 0 H ALA A 111 -1.308 -2.749 0.530 1.00 22.41 H new ATOM 0 HA ALA A 111 -4.180 -2.503 -0.051 1.00 1.31 H new ATOM 0 HB1 ALA A 111 -4.726 -2.825 2.340 1.00 61.22 H new ATOM 0 HB2 ALA A 111 -4.050 -4.302 1.612 1.00 61.22 H new ATOM 0 HB3 ALA A 111 -3.035 -3.280 2.658 1.00 61.22 H new ATOM 1516 N TYR A 112 -4.224 -0.228 1.164 1.00 23.14 N ATOM 1517 CA TYR A 112 -4.110 1.201 1.477 1.00 33.01 C ATOM 1518 C TYR A 112 -4.160 1.447 2.993 1.00 33.02 C ATOM 1519 O TYR A 112 -5.065 0.968 3.683 1.00 51.34 O ATOM 1520 CB TYR A 112 -5.227 1.992 0.781 1.00 43.44 C ATOM 1521 CG TYR A 112 -5.083 3.501 0.914 1.00 61.44 C ATOM 1522 CD1 TYR A 112 -4.156 4.200 0.147 1.00 11.52 C ATOM 1523 CD2 TYR A 112 -5.877 4.226 1.801 1.00 60.41 C ATOM 1524 CE1 TYR A 112 -4.021 5.572 0.259 1.00 22.15 C ATOM 1525 CE2 TYR A 112 -5.746 5.599 1.919 1.00 62.40 C ATOM 1526 CZ TYR A 112 -4.818 6.266 1.146 1.00 61.43 C ATOM 1527 OH TYR A 112 -4.687 7.634 1.258 1.00 63.55 O ATOM 0 H TYR A 112 -5.180 -0.556 1.023 1.00 23.14 H new ATOM 0 HA TYR A 112 -3.144 1.545 1.108 1.00 33.01 H new ATOM 0 HB2 TYR A 112 -5.241 1.729 -0.277 1.00 43.44 H new ATOM 0 HB3 TYR A 112 -6.188 1.690 1.197 1.00 43.44 H new ATOM 0 HD1 TYR A 112 -3.530 3.661 -0.549 1.00 11.52 H new ATOM 0 HD2 TYR A 112 -6.606 3.708 2.406 1.00 60.41 H new ATOM 0 HE1 TYR A 112 -3.296 6.097 -0.345 1.00 22.15 H new ATOM 0 HE2 TYR A 112 -6.367 6.146 2.613 1.00 62.40 H new ATOM 0 HH TYR A 112 -5.322 7.970 1.925 1.00 63.55 H new ATOM 1537 N VAL A 113 -3.186 2.200 3.500 1.00 21.32 N ATOM 1538 CA VAL A 113 -3.112 2.527 4.927 1.00 14.13 C ATOM 1539 C VAL A 113 -4.146 3.594 5.315 1.00 51.42 C ATOM 1540 O VAL A 113 -4.099 4.727 4.836 1.00 63.43 O ATOM 1541 CB VAL A 113 -1.696 3.025 5.310 1.00 15.54 C ATOM 1542 CG1 VAL A 113 -1.625 3.407 6.789 1.00 1.10 C ATOM 1543 CG2 VAL A 113 -0.643 1.969 4.971 1.00 54.42 C ATOM 0 H VAL A 113 -2.431 2.599 2.941 1.00 21.32 H new ATOM 0 HA VAL A 113 -3.332 1.610 5.474 1.00 14.13 H new ATOM 0 HB VAL A 113 -1.486 3.920 4.725 1.00 15.54 H new ATOM 0 HG11 VAL A 113 -0.619 3.753 7.028 1.00 1.10 H new ATOM 0 HG12 VAL A 113 -2.340 4.203 6.994 1.00 1.10 H new ATOM 0 HG13 VAL A 113 -1.865 2.538 7.401 1.00 1.10 H new ATOM 0 HG21 VAL A 113 0.345 2.338 5.248 1.00 54.42 H new ATOM 0 HG22 VAL A 113 -0.856 1.053 5.522 1.00 54.42 H new ATOM 0 HG23 VAL A 113 -0.666 1.762 3.901 1.00 54.42 H new ATOM 1553 N GLU A 114 -5.078 3.218 6.185 1.00 23.40 N ATOM 1554 CA GLU A 114 -6.093 4.143 6.695 1.00 71.32 C ATOM 1555 C GLU A 114 -5.492 5.094 7.742 1.00 2.01 C ATOM 1556 O GLU A 114 -5.580 6.318 7.609 1.00 70.41 O ATOM 1557 CB GLU A 114 -7.263 3.360 7.312 1.00 14.04 C ATOM 1558 CG GLU A 114 -7.953 2.399 6.347 1.00 44.11 C ATOM 1559 CD GLU A 114 -8.647 3.107 5.189 1.00 34.34 C ATOM 1560 OE1 GLU A 114 -9.810 3.534 5.354 1.00 31.15 O ATOM 1561 OE2 GLU A 114 -8.047 3.216 4.099 1.00 21.13 O ATOM 0 H GLU A 114 -5.154 2.271 6.556 1.00 23.40 H new ATOM 0 HA GLU A 114 -6.461 4.737 5.859 1.00 71.32 H new ATOM 0 HB2 GLU A 114 -6.895 2.795 8.169 1.00 14.04 H new ATOM 0 HB3 GLU A 114 -8.000 4.068 7.690 1.00 14.04 H new ATOM 0 HG2 GLU A 114 -7.215 1.702 5.949 1.00 44.11 H new ATOM 0 HG3 GLU A 114 -8.687 1.808 6.895 1.00 44.11 H new ATOM 1568 N ASN A 115 -4.873 4.520 8.777 1.00 24.21 N ATOM 1569 CA ASN A 115 -4.255 5.309 9.852 1.00 54.15 C ATOM 1570 C ASN A 115 -3.183 4.504 10.607 1.00 71.12 C ATOM 1571 O ASN A 115 -3.105 3.281 10.493 1.00 14.35 O ATOM 1572 CB ASN A 115 -5.328 5.792 10.840 1.00 53.11 C ATOM 1573 CG ASN A 115 -4.787 6.805 11.836 1.00 51.12 C ATOM 1574 OD1 ASN A 115 -3.946 7.634 11.498 1.00 30.42 O ATOM 1575 ND2 ASN A 115 -5.225 6.723 13.072 1.00 73.34 N ATOM 0 H ASN A 115 -4.785 3.511 8.896 1.00 24.21 H new ATOM 0 HA ASN A 115 -3.769 6.168 9.389 1.00 54.15 H new ATOM 0 HB2 ASN A 115 -6.154 6.238 10.286 1.00 53.11 H new ATOM 0 HB3 ASN A 115 -5.732 4.936 11.380 1.00 53.11 H new ATOM 0 HD21 ASN A 115 -4.866 7.359 13.784 1.00 73.34 H new ATOM 0 HD22 ASN A 115 -5.924 6.023 13.320 1.00 73.34 H new ATOM 1582 N VAL A 116 -2.358 5.208 11.377 1.00 52.31 N ATOM 1583 CA VAL A 116 -1.322 4.579 12.201 1.00 61.23 C ATOM 1584 C VAL A 116 -1.585 4.828 13.693 1.00 44.11 C ATOM 1585 O VAL A 116 -1.808 5.962 14.114 1.00 62.13 O ATOM 1586 CB VAL A 116 0.082 5.127 11.846 1.00 32.32 C ATOM 1587 CG1 VAL A 116 1.170 4.398 12.635 1.00 35.10 C ATOM 1588 CG2 VAL A 116 0.337 5.027 10.344 1.00 64.32 C ATOM 0 H VAL A 116 -2.386 6.225 11.450 1.00 52.31 H new ATOM 0 HA VAL A 116 -1.354 3.509 11.997 1.00 61.23 H new ATOM 0 HB VAL A 116 0.115 6.180 12.126 1.00 32.32 H new ATOM 0 HG11 VAL A 116 2.146 4.802 12.367 1.00 35.10 H new ATOM 0 HG12 VAL A 116 1.000 4.537 13.703 1.00 35.10 H new ATOM 0 HG13 VAL A 116 1.140 3.334 12.399 1.00 35.10 H new ATOM 0 HG21 VAL A 116 1.329 5.417 10.117 1.00 64.32 H new ATOM 0 HG22 VAL A 116 0.278 3.984 10.034 1.00 64.32 H new ATOM 0 HG23 VAL A 116 -0.413 5.608 9.808 1.00 64.32 H new ATOM 1598 N ASN A 117 -1.558 3.768 14.491 1.00 4.23 N ATOM 1599 CA ASN A 117 -1.724 3.897 15.941 1.00 22.14 C ATOM 1600 C ASN A 117 -0.379 4.211 16.613 1.00 0.13 C ATOM 1601 O ASN A 117 0.663 3.729 16.172 1.00 33.34 O ATOM 1602 CB ASN A 117 -2.308 2.605 16.524 1.00 2.24 C ATOM 1603 CG ASN A 117 -3.667 2.270 15.937 1.00 15.02 C ATOM 1604 OD1 ASN A 117 -4.698 2.679 16.455 1.00 74.55 O ATOM 1605 ND2 ASN A 117 -3.682 1.525 14.851 1.00 32.31 N ATOM 0 H ASN A 117 -1.424 2.811 14.164 1.00 4.23 H new ATOM 0 HA ASN A 117 -2.412 4.719 16.136 1.00 22.14 H new ATOM 0 HB2 ASN A 117 -1.620 1.781 16.335 1.00 2.24 H new ATOM 0 HB3 ASN A 117 -2.397 2.705 17.606 1.00 2.24 H new ATOM 0 HD21 ASN A 117 -4.570 1.273 14.417 1.00 32.31 H new ATOM 0 HD22 ASN A 117 -2.805 1.200 14.443 1.00 32.31 H new ATOM 1612 N SER A 118 -0.403 5.008 17.682 1.00 33.05 N ATOM 1613 CA SER A 118 0.825 5.339 18.428 1.00 14.32 C ATOM 1614 C SER A 118 1.496 4.074 18.983 1.00 1.14 C ATOM 1615 O SER A 118 2.687 4.069 19.284 1.00 25.10 O ATOM 1616 CB SER A 118 0.523 6.316 19.574 1.00 70.34 C ATOM 1617 OG SER A 118 0.049 7.563 19.077 1.00 54.13 O ATOM 0 H SER A 118 -1.250 5.437 18.054 1.00 33.05 H new ATOM 0 HA SER A 118 1.512 5.817 17.730 1.00 14.32 H new ATOM 0 HB2 SER A 118 -0.222 5.880 20.240 1.00 70.34 H new ATOM 0 HB3 SER A 118 1.424 6.476 20.166 1.00 70.34 H new ATOM 0 HG SER A 118 -0.137 8.165 19.828 1.00 54.13 H new ATOM 1623 N ASP A 119 0.710 3.009 19.121 1.00 75.32 N ATOM 1624 CA ASP A 119 1.214 1.693 19.529 1.00 11.24 C ATOM 1625 C ASP A 119 2.220 1.125 18.507 1.00 41.21 C ATOM 1626 O ASP A 119 3.062 0.290 18.842 1.00 0.24 O ATOM 1627 CB ASP A 119 0.023 0.736 19.687 1.00 4.33 C ATOM 1628 CG ASP A 119 0.432 -0.656 20.142 1.00 2.35 C ATOM 1629 OD1 ASP A 119 0.570 -0.867 21.365 1.00 12.31 O ATOM 1630 OD2 ASP A 119 0.613 -1.544 19.278 1.00 24.13 O ATOM 0 H ASP A 119 -0.296 3.030 18.954 1.00 75.32 H new ATOM 0 HA ASP A 119 1.742 1.800 20.477 1.00 11.24 H new ATOM 0 HB2 ASP A 119 -0.679 1.155 20.407 1.00 4.33 H new ATOM 0 HB3 ASP A 119 -0.503 0.661 18.736 1.00 4.33 H new ATOM 1635 N GLY A 120 2.126 1.588 17.262 1.00 24.52 N ATOM 1636 CA GLY A 120 2.947 1.048 16.179 1.00 13.53 C ATOM 1637 C GLY A 120 2.129 0.216 15.200 1.00 12.02 C ATOM 1638 O GLY A 120 2.538 -0.013 14.061 1.00 22.24 O ATOM 0 H GLY A 120 1.491 2.334 16.978 1.00 24.52 H new ATOM 0 HA2 GLY A 120 3.426 1.868 15.645 1.00 13.53 H new ATOM 0 HA3 GLY A 120 3.743 0.433 16.600 1.00 13.53 H new ATOM 1642 N SER A 121 0.966 -0.243 15.659 1.00 42.03 N ATOM 1643 CA SER A 121 0.044 -1.027 14.825 1.00 12.44 C ATOM 1644 C SER A 121 -0.578 -0.168 13.710 1.00 14.41 C ATOM 1645 O SER A 121 -1.021 0.957 13.951 1.00 43.14 O ATOM 1646 CB SER A 121 -1.074 -1.634 15.688 1.00 40.52 C ATOM 1647 OG SER A 121 -0.556 -2.521 16.672 1.00 61.03 O ATOM 0 H SER A 121 0.634 -0.086 16.611 1.00 42.03 H new ATOM 0 HA SER A 121 0.622 -1.826 14.361 1.00 12.44 H new ATOM 0 HB2 SER A 121 -1.632 -0.835 16.176 1.00 40.52 H new ATOM 0 HB3 SER A 121 -1.777 -2.169 15.049 1.00 40.52 H new ATOM 0 HG SER A 121 -0.225 -2.005 17.436 1.00 61.03 H new ATOM 1653 N VAL A 122 -0.627 -0.717 12.499 1.00 31.13 N ATOM 1654 CA VAL A 122 -1.129 0.009 11.320 1.00 51.33 C ATOM 1655 C VAL A 122 -2.531 -0.476 10.907 1.00 41.00 C ATOM 1656 O VAL A 122 -2.800 -1.678 10.879 1.00 44.22 O ATOM 1657 CB VAL A 122 -0.161 -0.163 10.120 1.00 11.31 C ATOM 1658 CG1 VAL A 122 -0.610 0.682 8.929 1.00 24.03 C ATOM 1659 CG2 VAL A 122 1.269 0.189 10.530 1.00 54.45 C ATOM 0 H VAL A 122 -0.324 -1.670 12.301 1.00 31.13 H new ATOM 0 HA VAL A 122 -1.191 1.062 11.596 1.00 51.33 H new ATOM 0 HB VAL A 122 -0.182 -1.209 9.813 1.00 11.31 H new ATOM 0 HG11 VAL A 122 0.086 0.543 8.101 1.00 24.03 H new ATOM 0 HG12 VAL A 122 -1.608 0.373 8.619 1.00 24.03 H new ATOM 0 HG13 VAL A 122 -0.628 1.734 9.215 1.00 24.03 H new ATOM 0 HG21 VAL A 122 1.934 0.063 9.676 1.00 54.45 H new ATOM 0 HG22 VAL A 122 1.306 1.224 10.869 1.00 54.45 H new ATOM 0 HG23 VAL A 122 1.588 -0.469 11.339 1.00 54.45 H new ATOM 1669 N GLU A 123 -3.419 0.467 10.594 1.00 14.44 N ATOM 1670 CA GLU A 123 -4.770 0.147 10.118 1.00 31.14 C ATOM 1671 C GLU A 123 -4.835 0.224 8.586 1.00 51.51 C ATOM 1672 O GLU A 123 -4.608 1.286 8.004 1.00 51.15 O ATOM 1673 CB GLU A 123 -5.793 1.119 10.725 1.00 44.21 C ATOM 1674 CG GLU A 123 -5.797 1.148 12.250 1.00 2.30 C ATOM 1675 CD GLU A 123 -6.897 2.034 12.814 1.00 51.43 C ATOM 1676 OE1 GLU A 123 -6.679 3.254 12.956 1.00 72.42 O ATOM 1677 OE2 GLU A 123 -7.993 1.510 13.112 1.00 4.54 O ATOM 0 H GLU A 123 -3.228 1.467 10.661 1.00 14.44 H new ATOM 0 HA GLU A 123 -5.009 -0.869 10.432 1.00 31.14 H new ATOM 0 HB2 GLU A 123 -5.588 2.123 10.354 1.00 44.21 H new ATOM 0 HB3 GLU A 123 -6.789 0.847 10.375 1.00 44.21 H new ATOM 0 HG2 GLU A 123 -5.922 0.134 12.629 1.00 2.30 H new ATOM 0 HG3 GLU A 123 -4.830 1.504 12.606 1.00 2.30 H new ATOM 1684 N VAL A 124 -5.131 -0.899 7.938 1.00 72.54 N ATOM 1685 CA VAL A 124 -5.221 -0.947 6.472 1.00 4.13 C ATOM 1686 C VAL A 124 -6.633 -1.316 5.996 1.00 64.22 C ATOM 1687 O VAL A 124 -7.413 -1.926 6.734 1.00 73.45 O ATOM 1688 CB VAL A 124 -4.203 -1.957 5.880 1.00 64.02 C ATOM 1689 CG1 VAL A 124 -2.775 -1.550 6.241 1.00 55.32 C ATOM 1690 CG2 VAL A 124 -4.501 -3.385 6.355 1.00 71.33 C ATOM 0 H VAL A 124 -5.313 -1.790 8.400 1.00 72.54 H new ATOM 0 HA VAL A 124 -4.985 0.055 6.115 1.00 4.13 H new ATOM 0 HB VAL A 124 -4.301 -1.941 4.795 1.00 64.02 H new ATOM 0 HG11 VAL A 124 -2.074 -2.269 5.818 1.00 55.32 H new ATOM 0 HG12 VAL A 124 -2.566 -0.559 5.838 1.00 55.32 H new ATOM 0 HG13 VAL A 124 -2.665 -1.531 7.325 1.00 55.32 H new ATOM 0 HG21 VAL A 124 -3.772 -4.071 5.924 1.00 71.33 H new ATOM 0 HG22 VAL A 124 -4.441 -3.427 7.443 1.00 71.33 H new ATOM 0 HG23 VAL A 124 -5.503 -3.673 6.036 1.00 71.33 H new ATOM 1700 N SER A 125 -6.958 -0.937 4.760 1.00 4.54 N ATOM 1701 CA SER A 125 -8.261 -1.264 4.156 1.00 44.04 C ATOM 1702 C SER A 125 -8.105 -2.281 3.017 1.00 24.33 C ATOM 1703 O SER A 125 -7.363 -2.051 2.057 1.00 14.35 O ATOM 1704 CB SER A 125 -8.959 0.004 3.638 1.00 73.43 C ATOM 1705 OG SER A 125 -8.134 0.737 2.741 1.00 61.21 O ATOM 0 H SER A 125 -6.339 -0.402 4.152 1.00 4.54 H new ATOM 0 HA SER A 125 -8.880 -1.711 4.934 1.00 44.04 H new ATOM 0 HB2 SER A 125 -9.886 -0.272 3.135 1.00 73.43 H new ATOM 0 HB3 SER A 125 -9.231 0.639 4.481 1.00 73.43 H new ATOM 0 HG SER A 125 -7.609 0.114 2.197 1.00 61.21 H new ATOM 1711 N GLU A 126 -8.817 -3.401 3.126 1.00 71.45 N ATOM 1712 CA GLU A 126 -8.710 -4.497 2.155 1.00 32.22 C ATOM 1713 C GLU A 126 -10.092 -4.932 1.635 1.00 50.24 C ATOM 1714 O GLU A 126 -11.101 -4.803 2.332 1.00 2.13 O ATOM 1715 CB GLU A 126 -7.989 -5.687 2.802 1.00 21.00 C ATOM 1716 CG GLU A 126 -6.584 -5.346 3.291 1.00 43.52 C ATOM 1717 CD GLU A 126 -5.950 -6.464 4.097 1.00 43.53 C ATOM 1718 OE1 GLU A 126 -6.150 -6.505 5.325 1.00 3.21 O ATOM 1719 OE2 GLU A 126 -5.239 -7.311 3.505 1.00 31.03 O ATOM 0 H GLU A 126 -9.480 -3.577 3.881 1.00 71.45 H new ATOM 0 HA GLU A 126 -8.136 -4.140 1.300 1.00 32.22 H new ATOM 0 HB2 GLU A 126 -8.581 -6.049 3.642 1.00 21.00 H new ATOM 0 HB3 GLU A 126 -7.928 -6.502 2.081 1.00 21.00 H new ATOM 0 HG2 GLU A 126 -5.951 -5.120 2.433 1.00 43.52 H new ATOM 0 HG3 GLU A 126 -6.627 -4.444 3.902 1.00 43.52 H new ATOM 1726 N MET A 127 -10.132 -5.449 0.407 1.00 44.33 N ATOM 1727 CA MET A 127 -11.395 -5.864 -0.216 1.00 75.13 C ATOM 1728 C MET A 127 -11.920 -7.181 0.380 1.00 12.41 C ATOM 1729 O MET A 127 -11.351 -8.250 0.153 1.00 3.22 O ATOM 1730 CB MET A 127 -11.221 -6.009 -1.734 1.00 75.31 C ATOM 1731 CG MET A 127 -12.454 -6.566 -2.441 1.00 50.15 C ATOM 1732 SD MET A 127 -13.937 -5.583 -2.148 1.00 22.55 S ATOM 1733 CE MET A 127 -13.495 -4.032 -2.925 1.00 63.42 C ATOM 0 H MET A 127 -9.308 -5.591 -0.177 1.00 44.33 H new ATOM 0 HA MET A 127 -12.131 -5.087 -0.010 1.00 75.13 H new ATOM 0 HB2 MET A 127 -10.979 -5.035 -2.158 1.00 75.31 H new ATOM 0 HB3 MET A 127 -10.372 -6.663 -1.933 1.00 75.31 H new ATOM 0 HG2 MET A 127 -12.261 -6.613 -3.513 1.00 50.15 H new ATOM 0 HG3 MET A 127 -12.629 -7.588 -2.104 1.00 50.15 H new ATOM 0 HE1 MET A 127 -14.026 -3.216 -2.436 1.00 63.42 H new ATOM 0 HE2 MET A 127 -12.421 -3.872 -2.834 1.00 63.42 H new ATOM 0 HE3 MET A 127 -13.769 -4.062 -3.980 1.00 63.42 H new ATOM 1743 N ASN A 128 -13.009 -7.091 1.140 1.00 71.14 N ATOM 1744 CA ASN A 128 -13.649 -8.277 1.719 1.00 12.34 C ATOM 1745 C ASN A 128 -14.601 -8.930 0.703 1.00 71.53 C ATOM 1746 O ASN A 128 -14.757 -10.154 0.681 1.00 23.15 O ATOM 1747 CB ASN A 128 -14.415 -7.896 2.995 1.00 63.54 C ATOM 1748 CG ASN A 128 -15.044 -9.091 3.698 1.00 43.12 C ATOM 1749 OD1 ASN A 128 -14.411 -10.244 3.620 1.00 43.21 O flip ATOM 1750 ND2 ASN A 128 -16.095 -8.977 4.319 1.00 71.42 N flip ATOM 0 H ASN A 128 -13.469 -6.211 1.371 1.00 71.14 H new ATOM 0 HA ASN A 128 -12.872 -8.997 1.975 1.00 12.34 H new ATOM 0 HB2 ASN A 128 -13.734 -7.395 3.683 1.00 63.54 H new ATOM 0 HB3 ASN A 128 -15.196 -7.180 2.741 1.00 63.54 H new ATOM 0 HD21 ASN A 128 -16.565 -8.073 4.364 1.00 71.42 H new ATOM 0 HD22 ASN A 128 -16.499 -9.786 4.791 1.00 71.42 H new ATOM 1757 N TYR A 129 -15.257 -8.090 -0.106 1.00 61.13 N ATOM 1758 CA TYR A 129 -16.123 -8.541 -1.214 1.00 54.01 C ATOM 1759 C TYR A 129 -17.447 -9.172 -0.724 1.00 22.23 C ATOM 1760 O TYR A 129 -18.410 -9.280 -1.486 1.00 3.13 O ATOM 1761 CB TYR A 129 -15.357 -9.518 -2.129 1.00 12.03 C ATOM 1762 CG TYR A 129 -16.092 -9.881 -3.407 1.00 4.21 C ATOM 1763 CD1 TYR A 129 -16.144 -8.993 -4.477 1.00 61.43 C ATOM 1764 CD2 TYR A 129 -16.727 -11.113 -3.545 1.00 72.52 C ATOM 1765 CE1 TYR A 129 -16.808 -9.322 -5.645 1.00 73.10 C ATOM 1766 CE2 TYR A 129 -17.393 -11.446 -4.710 1.00 3.55 C ATOM 1767 CZ TYR A 129 -17.429 -10.548 -5.755 1.00 62.33 C ATOM 1768 OH TYR A 129 -18.089 -10.878 -6.916 1.00 22.13 O ATOM 0 H TYR A 129 -15.206 -7.075 -0.015 1.00 61.13 H new ATOM 0 HA TYR A 129 -16.396 -7.654 -1.785 1.00 54.01 H new ATOM 0 HB2 TYR A 129 -14.395 -9.076 -2.389 1.00 12.03 H new ATOM 0 HB3 TYR A 129 -15.147 -10.431 -1.572 1.00 12.03 H new ATOM 0 HD1 TYR A 129 -15.658 -8.032 -4.394 1.00 61.43 H new ATOM 0 HD2 TYR A 129 -16.699 -11.820 -2.729 1.00 72.52 H new ATOM 0 HE1 TYR A 129 -16.840 -8.622 -6.467 1.00 73.10 H new ATOM 0 HE2 TYR A 129 -17.882 -12.405 -4.801 1.00 3.55 H new ATOM 0 HH TYR A 129 -18.471 -11.777 -6.831 1.00 22.13 H new ATOM 1778 N ASN A 130 -17.503 -9.579 0.542 1.00 20.32 N ATOM 1779 CA ASN A 130 -18.714 -10.184 1.103 1.00 61.44 C ATOM 1780 C ASN A 130 -19.762 -9.109 1.445 1.00 55.25 C ATOM 1781 O ASN A 130 -19.461 -8.123 2.120 1.00 21.20 O ATOM 1782 CB ASN A 130 -18.364 -11.004 2.350 1.00 22.33 C ATOM 1783 CG ASN A 130 -19.508 -11.890 2.808 1.00 1.11 C ATOM 1784 OD1 ASN A 130 -19.619 -13.041 2.399 1.00 71.30 O ATOM 1785 ND2 ASN A 130 -20.370 -11.367 3.655 1.00 70.42 N ATOM 0 H ASN A 130 -16.727 -9.502 1.200 1.00 20.32 H new ATOM 0 HA ASN A 130 -19.144 -10.847 0.352 1.00 61.44 H new ATOM 0 HB2 ASN A 130 -17.492 -11.623 2.140 1.00 22.33 H new ATOM 0 HB3 ASN A 130 -18.087 -10.328 3.159 1.00 22.33 H new ATOM 0 HD21 ASN A 130 -21.157 -11.922 3.989 1.00 70.42 H new ATOM 0 HD22 ASN A 130 -20.250 -10.406 3.977 1.00 70.42 H new ATOM 1792 N GLY A 131 -20.990 -9.312 0.984 1.00 63.32 N ATOM 1793 CA GLY A 131 -22.045 -8.329 1.193 1.00 64.12 C ATOM 1794 C GLY A 131 -22.211 -7.386 0.003 1.00 23.21 C ATOM 1795 O GLY A 131 -22.725 -7.784 -1.045 1.00 63.42 O ATOM 0 H GLY A 131 -21.278 -10.142 0.467 1.00 63.32 H new ATOM 0 HA2 GLY A 131 -22.987 -8.846 1.377 1.00 64.12 H new ATOM 0 HA3 GLY A 131 -21.822 -7.746 2.086 1.00 64.12 H new ATOM 1799 N GLY A 132 -21.766 -6.141 0.160 1.00 75.34 N ATOM 1800 CA GLY A 132 -21.863 -5.156 -0.917 1.00 4.04 C ATOM 1801 C GLY A 132 -20.813 -5.347 -2.016 1.00 4.32 C ATOM 1802 O GLY A 132 -19.826 -6.059 -1.820 1.00 1.13 O ATOM 0 H GLY A 132 -21.337 -5.791 1.017 1.00 75.34 H new ATOM 0 HA2 GLY A 132 -22.857 -5.212 -1.361 1.00 4.04 H new ATOM 0 HA3 GLY A 132 -21.758 -4.156 -0.495 1.00 4.04 H new ATOM 1806 N PRO A 133 -20.999 -4.710 -3.192 1.00 42.32 N ATOM 1807 CA PRO A 133 -20.061 -4.842 -4.327 1.00 72.02 C ATOM 1808 C PRO A 133 -18.634 -4.377 -3.981 1.00 24.31 C ATOM 1809 O PRO A 133 -17.662 -5.114 -4.164 1.00 14.11 O ATOM 1810 CB PRO A 133 -20.681 -3.943 -5.417 1.00 31.05 C ATOM 1811 CG PRO A 133 -21.609 -3.028 -4.686 1.00 4.21 C ATOM 1812 CD PRO A 133 -22.128 -3.816 -3.513 1.00 24.04 C ATOM 0 HA PRO A 133 -19.944 -5.882 -4.632 1.00 72.02 H new ATOM 0 HB2 PRO A 133 -19.913 -3.382 -5.949 1.00 31.05 H new ATOM 0 HB3 PRO A 133 -21.215 -4.535 -6.160 1.00 31.05 H new ATOM 0 HG2 PRO A 133 -21.090 -2.129 -4.353 1.00 4.21 H new ATOM 0 HG3 PRO A 133 -22.426 -2.704 -5.331 1.00 4.21 H new ATOM 0 HD2 PRO A 133 -22.383 -3.170 -2.673 1.00 24.04 H new ATOM 0 HD3 PRO A 133 -23.027 -4.376 -3.769 1.00 24.04 H new ATOM 1820 N PHE A 134 -18.514 -3.153 -3.477 1.00 65.14 N ATOM 1821 CA PHE A 134 -17.216 -2.592 -3.086 1.00 24.22 C ATOM 1822 C PHE A 134 -16.999 -2.729 -1.571 1.00 20.34 C ATOM 1823 O PHE A 134 -16.558 -1.794 -0.902 1.00 62.42 O ATOM 1824 CB PHE A 134 -17.137 -1.118 -3.507 1.00 20.02 C ATOM 1825 CG PHE A 134 -17.390 -0.896 -4.980 1.00 42.04 C ATOM 1826 CD1 PHE A 134 -16.482 -1.347 -5.927 1.00 55.31 C ATOM 1827 CD2 PHE A 134 -18.536 -0.243 -5.417 1.00 32.04 C ATOM 1828 CE1 PHE A 134 -16.709 -1.153 -7.276 1.00 73.32 C ATOM 1829 CE2 PHE A 134 -18.767 -0.047 -6.766 1.00 50.13 C ATOM 1830 CZ PHE A 134 -17.853 -0.502 -7.697 1.00 43.43 C ATOM 0 H PHE A 134 -19.303 -2.524 -3.327 1.00 65.14 H new ATOM 0 HA PHE A 134 -16.428 -3.149 -3.593 1.00 24.22 H new ATOM 0 HB2 PHE A 134 -17.864 -0.545 -2.931 1.00 20.02 H new ATOM 0 HB3 PHE A 134 -16.151 -0.729 -3.253 1.00 20.02 H new ATOM 0 HD1 PHE A 134 -15.586 -1.857 -5.605 1.00 55.31 H new ATOM 0 HD2 PHE A 134 -19.254 0.116 -4.695 1.00 32.04 H new ATOM 0 HE1 PHE A 134 -15.993 -1.510 -8.001 1.00 73.32 H new ATOM 0 HE2 PHE A 134 -19.662 0.462 -7.092 1.00 50.13 H new ATOM 0 HZ PHE A 134 -18.032 -0.349 -8.751 1.00 43.43 H new ATOM 1840 N SER A 135 -17.303 -3.912 -1.039 1.00 64.32 N ATOM 1841 CA SER A 135 -17.194 -4.173 0.403 1.00 2.40 C ATOM 1842 C SER A 135 -15.727 -4.175 0.871 1.00 53.12 C ATOM 1843 O SER A 135 -15.076 -5.223 0.933 1.00 70.03 O ATOM 1844 CB SER A 135 -17.867 -5.509 0.762 1.00 53.23 C ATOM 1845 OG SER A 135 -17.863 -5.738 2.163 1.00 30.31 O ATOM 0 H SER A 135 -17.628 -4.710 -1.584 1.00 64.32 H new ATOM 0 HA SER A 135 -17.709 -3.365 0.922 1.00 2.40 H new ATOM 0 HB2 SER A 135 -18.894 -5.509 0.396 1.00 53.23 H new ATOM 0 HB3 SER A 135 -17.349 -6.325 0.258 1.00 53.23 H new ATOM 0 HG SER A 135 -18.395 -6.536 2.366 1.00 30.31 H new ATOM 1851 N VAL A 136 -15.200 -2.986 1.164 1.00 25.33 N ATOM 1852 CA VAL A 136 -13.831 -2.838 1.673 1.00 65.24 C ATOM 1853 C VAL A 136 -13.822 -2.755 3.209 1.00 11.24 C ATOM 1854 O VAL A 136 -14.378 -1.822 3.792 1.00 1.42 O ATOM 1855 CB VAL A 136 -13.144 -1.571 1.096 1.00 53.21 C ATOM 1856 CG1 VAL A 136 -11.695 -1.470 1.571 1.00 74.15 C ATOM 1857 CG2 VAL A 136 -13.219 -1.557 -0.430 1.00 10.32 C ATOM 0 H VAL A 136 -15.702 -2.105 1.058 1.00 25.33 H new ATOM 0 HA VAL A 136 -13.276 -3.720 1.352 1.00 65.24 H new ATOM 0 HB VAL A 136 -13.681 -0.699 1.468 1.00 53.21 H new ATOM 0 HG11 VAL A 136 -11.237 -0.574 1.153 1.00 74.15 H new ATOM 0 HG12 VAL A 136 -11.672 -1.415 2.659 1.00 74.15 H new ATOM 0 HG13 VAL A 136 -11.142 -2.349 1.240 1.00 74.15 H new ATOM 0 HG21 VAL A 136 -12.731 -0.660 -0.810 1.00 10.32 H new ATOM 0 HG22 VAL A 136 -12.717 -2.439 -0.827 1.00 10.32 H new ATOM 0 HG23 VAL A 136 -14.263 -1.562 -0.743 1.00 10.32 H new ATOM 1867 N SER A 137 -13.187 -3.725 3.860 1.00 51.34 N ATOM 1868 CA SER A 137 -13.131 -3.768 5.330 1.00 22.12 C ATOM 1869 C SER A 137 -11.756 -3.337 5.857 1.00 63.21 C ATOM 1870 O SER A 137 -10.825 -3.112 5.085 1.00 34.23 O ATOM 1871 CB SER A 137 -13.469 -5.178 5.836 1.00 71.05 C ATOM 1872 OG SER A 137 -14.811 -5.528 5.531 1.00 51.21 O ATOM 0 H SER A 137 -12.702 -4.495 3.399 1.00 51.34 H new ATOM 0 HA SER A 137 -13.871 -3.063 5.708 1.00 22.12 H new ATOM 0 HB2 SER A 137 -12.791 -5.901 5.384 1.00 71.05 H new ATOM 0 HB3 SER A 137 -13.314 -5.227 6.914 1.00 71.05 H new ATOM 0 HG SER A 137 -14.997 -6.431 5.863 1.00 51.21 H new ATOM 1878 N GLU A 138 -11.636 -3.223 7.176 1.00 64.21 N ATOM 1879 CA GLU A 138 -10.383 -2.802 7.817 1.00 5.41 C ATOM 1880 C GLU A 138 -9.678 -3.968 8.529 1.00 40.40 C ATOM 1881 O GLU A 138 -10.308 -4.957 8.916 1.00 23.32 O ATOM 1882 CB GLU A 138 -10.660 -1.692 8.840 1.00 32.45 C ATOM 1883 CG GLU A 138 -11.171 -0.387 8.237 1.00 53.13 C ATOM 1884 CD GLU A 138 -11.474 0.661 9.300 1.00 31.42 C ATOM 1885 OE1 GLU A 138 -10.518 1.232 9.868 1.00 75.04 O ATOM 1886 OE2 GLU A 138 -12.669 0.903 9.587 1.00 71.23 O ATOM 0 H GLU A 138 -12.394 -3.417 7.831 1.00 64.21 H new ATOM 0 HA GLU A 138 -9.728 -2.435 7.027 1.00 5.41 H new ATOM 0 HB2 GLU A 138 -11.392 -2.055 9.561 1.00 32.45 H new ATOM 0 HB3 GLU A 138 -9.743 -1.487 9.392 1.00 32.45 H new ATOM 0 HG2 GLU A 138 -10.427 0.006 7.544 1.00 53.13 H new ATOM 0 HG3 GLU A 138 -12.073 -0.585 7.658 1.00 53.13 H new ATOM 1893 N ARG A 139 -8.365 -3.838 8.700 1.00 70.22 N ATOM 1894 CA ARG A 139 -7.585 -4.768 9.519 1.00 73.11 C ATOM 1895 C ARG A 139 -6.378 -4.052 10.150 1.00 55.13 C ATOM 1896 O ARG A 139 -5.606 -3.385 9.463 1.00 74.11 O ATOM 1897 CB ARG A 139 -7.122 -5.985 8.696 1.00 11.34 C ATOM 1898 CG ARG A 139 -6.248 -6.957 9.491 1.00 74.21 C ATOM 1899 CD ARG A 139 -6.025 -8.279 8.761 1.00 64.33 C ATOM 1900 NE ARG A 139 -5.437 -8.098 7.436 1.00 23.21 N ATOM 1901 CZ ARG A 139 -4.662 -8.963 6.843 1.00 32.35 C ATOM 1902 NH1 ARG A 139 -4.286 -10.039 7.455 1.00 72.23 N ATOM 1903 NH2 ARG A 139 -4.262 -8.744 5.636 1.00 64.13 N ATOM 0 H ARG A 139 -7.813 -3.091 8.279 1.00 70.22 H new ATOM 0 HA ARG A 139 -8.231 -5.131 10.318 1.00 73.11 H new ATOM 0 HB2 ARG A 139 -7.997 -6.517 8.323 1.00 11.34 H new ATOM 0 HB3 ARG A 139 -6.566 -5.636 7.826 1.00 11.34 H new ATOM 0 HG2 ARG A 139 -5.284 -6.491 9.693 1.00 74.21 H new ATOM 0 HG3 ARG A 139 -6.715 -7.154 10.456 1.00 74.21 H new ATOM 0 HD2 ARG A 139 -5.373 -8.915 9.360 1.00 64.33 H new ATOM 0 HD3 ARG A 139 -6.977 -8.801 8.664 1.00 64.33 H new ATOM 0 HE ARG A 139 -5.648 -7.233 6.939 1.00 23.21 H new ATOM 0 HH11 ARG A 139 -4.596 -10.217 8.410 1.00 72.23 H new ATOM 0 HH12 ARG A 139 -3.680 -10.709 6.982 1.00 72.23 H new ATOM 0 HH21 ARG A 139 -4.552 -7.896 5.149 1.00 64.13 H new ATOM 0 HH22 ARG A 139 -3.656 -9.419 5.169 1.00 64.13 H new ATOM 1917 N THR A 140 -6.234 -4.182 11.465 1.00 35.10 N ATOM 1918 CA THR A 140 -5.125 -3.548 12.191 1.00 71.03 C ATOM 1919 C THR A 140 -4.009 -4.562 12.469 1.00 3.52 C ATOM 1920 O THR A 140 -4.201 -5.519 13.223 1.00 40.12 O ATOM 1921 CB THR A 140 -5.605 -2.935 13.531 1.00 11.35 C ATOM 1922 OG1 THR A 140 -6.706 -2.038 13.301 1.00 1.21 O ATOM 1923 CG2 THR A 140 -4.478 -2.177 14.227 1.00 20.32 C ATOM 0 H THR A 140 -6.869 -4.720 12.055 1.00 35.10 H new ATOM 0 HA THR A 140 -4.739 -2.749 11.558 1.00 71.03 H new ATOM 0 HB THR A 140 -5.925 -3.755 14.174 1.00 11.35 H new ATOM 0 HG1 THR A 140 -7.002 -1.658 14.154 1.00 1.21 H new ATOM 0 HG21 THR A 140 -4.845 -1.758 15.164 1.00 20.32 H new ATOM 0 HG22 THR A 140 -3.653 -2.860 14.433 1.00 20.32 H new ATOM 0 HG23 THR A 140 -4.129 -1.371 13.582 1.00 20.32 H new ATOM 1931 N ILE A 141 -2.853 -4.360 11.845 1.00 71.04 N ATOM 1932 CA ILE A 141 -1.715 -5.271 12.005 1.00 62.43 C ATOM 1933 C ILE A 141 -0.645 -4.669 12.933 1.00 75.43 C ATOM 1934 O ILE A 141 -0.285 -3.496 12.802 1.00 43.22 O ATOM 1935 CB ILE A 141 -1.077 -5.607 10.632 1.00 31.12 C ATOM 1936 CG1 ILE A 141 -2.147 -6.142 9.659 1.00 31.51 C ATOM 1937 CG2 ILE A 141 0.058 -6.618 10.796 1.00 22.32 C ATOM 1938 CD1 ILE A 141 -1.617 -6.451 8.273 1.00 42.31 C ATOM 0 H ILE A 141 -2.675 -3.573 11.221 1.00 71.04 H new ATOM 0 HA ILE A 141 -2.096 -6.187 12.456 1.00 62.43 H new ATOM 0 HB ILE A 141 -0.658 -4.692 10.214 1.00 31.12 H new ATOM 0 HG12 ILE A 141 -2.586 -7.047 10.079 1.00 31.51 H new ATOM 0 HG13 ILE A 141 -2.948 -5.408 9.576 1.00 31.51 H new ATOM 0 HG21 ILE A 141 0.492 -6.840 9.821 1.00 22.32 H new ATOM 0 HG22 ILE A 141 0.825 -6.201 11.448 1.00 22.32 H new ATOM 0 HG23 ILE A 141 -0.333 -7.535 11.236 1.00 22.32 H new ATOM 0 HD11 ILE A 141 -2.429 -6.822 7.647 1.00 42.31 H new ATOM 0 HD12 ILE A 141 -1.204 -5.544 7.831 1.00 42.31 H new ATOM 0 HD13 ILE A 141 -0.837 -7.209 8.342 1.00 42.31 H new ATOM 1950 N SER A 142 -0.146 -5.478 13.869 1.00 34.14 N ATOM 1951 CA SER A 142 0.879 -5.035 14.833 1.00 43.42 C ATOM 1952 C SER A 142 2.193 -4.642 14.139 1.00 51.32 C ATOM 1953 O SER A 142 2.535 -5.175 13.079 1.00 40.42 O ATOM 1954 CB SER A 142 1.151 -6.137 15.869 1.00 31.23 C ATOM 1955 OG SER A 142 -0.030 -6.478 16.581 1.00 73.40 O ATOM 0 H SER A 142 -0.433 -6.450 13.985 1.00 34.14 H new ATOM 0 HA SER A 142 0.487 -4.150 15.334 1.00 43.42 H new ATOM 0 HB2 SER A 142 1.544 -7.021 15.368 1.00 31.23 H new ATOM 0 HB3 SER A 142 1.916 -5.801 16.569 1.00 31.23 H new ATOM 0 HG SER A 142 0.172 -7.182 17.232 1.00 73.40 H new ATOM 1961 N ALA A 143 2.936 -3.723 14.765 1.00 14.42 N ATOM 1962 CA ALA A 143 4.183 -3.181 14.197 1.00 4.52 C ATOM 1963 C ALA A 143 5.165 -4.282 13.761 1.00 32.53 C ATOM 1964 O ALA A 143 5.795 -4.178 12.708 1.00 33.23 O ATOM 1965 CB ALA A 143 4.858 -2.255 15.207 1.00 43.31 C ATOM 0 H ALA A 143 2.694 -3.333 15.676 1.00 14.42 H new ATOM 0 HA ALA A 143 3.909 -2.622 13.303 1.00 4.52 H new ATOM 0 HB1 ALA A 143 5.779 -1.859 14.779 1.00 43.31 H new ATOM 0 HB2 ALA A 143 4.187 -1.431 15.450 1.00 43.31 H new ATOM 0 HB3 ALA A 143 5.090 -2.813 16.114 1.00 43.31 H new ATOM 1971 N GLY A 144 5.285 -5.338 14.569 1.00 22.51 N ATOM 1972 CA GLY A 144 6.208 -6.433 14.265 1.00 62.25 C ATOM 1973 C GLY A 144 6.018 -7.031 12.872 1.00 21.21 C ATOM 1974 O GLY A 144 6.990 -7.398 12.208 1.00 1.03 O ATOM 0 H GLY A 144 4.758 -5.458 15.434 1.00 22.51 H new ATOM 0 HA2 GLY A 144 7.231 -6.069 14.358 1.00 62.25 H new ATOM 0 HA3 GLY A 144 6.081 -7.220 15.008 1.00 62.25 H new ATOM 1978 N GLU A 145 4.768 -7.141 12.431 1.00 61.23 N ATOM 1979 CA GLU A 145 4.458 -7.664 11.093 1.00 41.23 C ATOM 1980 C GLU A 145 4.292 -6.521 10.076 1.00 42.20 C ATOM 1981 O GLU A 145 4.925 -6.518 9.020 1.00 2.11 O ATOM 1982 CB GLU A 145 3.180 -8.515 11.145 1.00 15.21 C ATOM 1983 CG GLU A 145 2.788 -9.152 9.809 1.00 11.33 C ATOM 1984 CD GLU A 145 3.781 -10.204 9.329 1.00 34.11 C ATOM 1985 OE1 GLU A 145 3.735 -11.343 9.839 1.00 4.14 O ATOM 1986 OE2 GLU A 145 4.599 -9.904 8.432 1.00 35.31 O ATOM 0 H GLU A 145 3.949 -6.876 12.977 1.00 61.23 H new ATOM 0 HA GLU A 145 5.292 -8.287 10.769 1.00 41.23 H new ATOM 0 HB2 GLU A 145 3.314 -9.305 11.884 1.00 15.21 H new ATOM 0 HB3 GLU A 145 2.356 -7.891 11.491 1.00 15.21 H new ATOM 0 HG2 GLU A 145 1.804 -9.610 9.907 1.00 11.33 H new ATOM 0 HG3 GLU A 145 2.703 -8.371 9.053 1.00 11.33 H new ATOM 1993 N ALA A 146 3.454 -5.541 10.419 1.00 35.52 N ATOM 1994 CA ALA A 146 3.136 -4.423 9.518 1.00 33.11 C ATOM 1995 C ALA A 146 4.388 -3.675 9.033 1.00 63.32 C ATOM 1996 O ALA A 146 4.575 -3.485 7.832 1.00 3.23 O ATOM 1997 CB ALA A 146 2.183 -3.454 10.208 1.00 52.24 C ATOM 0 H ALA A 146 2.978 -5.496 11.320 1.00 35.52 H new ATOM 0 HA ALA A 146 2.659 -4.849 8.636 1.00 33.11 H new ATOM 0 HB1 ALA A 146 1.952 -2.629 9.534 1.00 52.24 H new ATOM 0 HB2 ALA A 146 1.263 -3.975 10.472 1.00 52.24 H new ATOM 0 HB3 ALA A 146 2.652 -3.064 11.112 1.00 52.24 H new ATOM 2003 N SER A 147 5.252 -3.272 9.970 1.00 50.05 N ATOM 2004 CA SER A 147 6.434 -2.453 9.635 1.00 0.43 C ATOM 2005 C SER A 147 7.430 -3.196 8.729 1.00 62.34 C ATOM 2006 O SER A 147 8.338 -2.581 8.161 1.00 34.32 O ATOM 2007 CB SER A 147 7.150 -1.986 10.909 1.00 42.11 C ATOM 2008 OG SER A 147 8.260 -1.143 10.609 1.00 12.23 O ATOM 0 H SER A 147 5.161 -3.495 10.961 1.00 50.05 H new ATOM 0 HA SER A 147 6.064 -1.589 9.083 1.00 0.43 H new ATOM 0 HB2 SER A 147 6.447 -1.450 11.546 1.00 42.11 H new ATOM 0 HB3 SER A 147 7.493 -2.853 11.473 1.00 42.11 H new ATOM 0 HG SER A 147 8.571 -1.323 9.697 1.00 12.23 H new ATOM 2014 N SER A 148 7.272 -4.512 8.612 1.00 51.12 N ATOM 2015 CA SER A 148 8.115 -5.313 7.714 1.00 72.42 C ATOM 2016 C SER A 148 7.770 -5.039 6.247 1.00 42.11 C ATOM 2017 O SER A 148 8.631 -5.110 5.367 1.00 20.11 O ATOM 2018 CB SER A 148 7.949 -6.811 8.006 1.00 3.53 C ATOM 2019 OG SER A 148 8.699 -7.601 7.097 1.00 24.02 O ATOM 0 H SER A 148 6.572 -5.049 9.124 1.00 51.12 H new ATOM 0 HA SER A 148 9.151 -5.026 7.893 1.00 72.42 H new ATOM 0 HB2 SER A 148 8.271 -7.022 9.026 1.00 3.53 H new ATOM 0 HB3 SER A 148 6.895 -7.081 7.942 1.00 3.53 H new ATOM 0 HG SER A 148 8.575 -8.550 7.309 1.00 24.02 H new ATOM 2025 N TYR A 149 6.507 -4.705 6.001 1.00 53.32 N ATOM 2026 CA TYR A 149 6.006 -4.478 4.646 1.00 25.42 C ATOM 2027 C TYR A 149 6.523 -3.158 4.051 1.00 32.23 C ATOM 2028 O TYR A 149 6.833 -2.209 4.772 1.00 65.10 O ATOM 2029 CB TYR A 149 4.474 -4.501 4.654 1.00 35.35 C ATOM 2030 CG TYR A 149 3.897 -5.803 5.187 1.00 61.43 C ATOM 2031 CD1 TYR A 149 4.408 -7.028 4.773 1.00 11.40 C ATOM 2032 CD2 TYR A 149 2.841 -5.811 6.092 1.00 22.03 C ATOM 2033 CE1 TYR A 149 3.885 -8.216 5.241 1.00 23.43 C ATOM 2034 CE2 TYR A 149 2.315 -6.998 6.567 1.00 13.30 C ATOM 2035 CZ TYR A 149 2.840 -8.195 6.135 1.00 3.34 C ATOM 2036 OH TYR A 149 2.316 -9.379 6.598 1.00 32.12 O ATOM 0 H TYR A 149 5.804 -4.584 6.730 1.00 53.32 H new ATOM 0 HA TYR A 149 6.380 -5.281 4.011 1.00 25.42 H new ATOM 0 HB2 TYR A 149 4.108 -3.673 5.261 1.00 35.35 H new ATOM 0 HB3 TYR A 149 4.109 -4.338 3.640 1.00 35.35 H new ATOM 0 HD1 TYR A 149 5.229 -7.050 4.072 1.00 11.40 H new ATOM 0 HD2 TYR A 149 2.425 -4.873 6.430 1.00 22.03 H new ATOM 0 HE1 TYR A 149 4.294 -9.158 4.907 1.00 23.43 H new ATOM 0 HE2 TYR A 149 1.497 -6.986 7.273 1.00 13.30 H new ATOM 0 HH TYR A 149 1.585 -9.191 7.223 1.00 32.12 H new ATOM 2046 N ASN A 150 6.623 -3.117 2.725 1.00 43.54 N ATOM 2047 CA ASN A 150 7.126 -1.934 2.013 1.00 74.54 C ATOM 2048 C ASN A 150 6.008 -0.904 1.772 1.00 74.54 C ATOM 2049 O ASN A 150 5.036 -1.190 1.075 1.00 22.44 O ATOM 2050 CB ASN A 150 7.737 -2.359 0.673 1.00 11.13 C ATOM 2051 CG ASN A 150 8.896 -3.323 0.842 1.00 31.12 C ATOM 2052 OD1 ASN A 150 9.647 -3.254 1.808 1.00 63.44 O ATOM 2053 ND2 ASN A 150 9.044 -4.239 -0.092 1.00 61.44 N ATOM 0 H ASN A 150 6.362 -3.891 2.114 1.00 43.54 H new ATOM 0 HA ASN A 150 7.888 -1.464 2.634 1.00 74.54 H new ATOM 0 HB2 ASN A 150 6.967 -2.826 0.058 1.00 11.13 H new ATOM 0 HB3 ASN A 150 8.080 -1.474 0.137 1.00 11.13 H new ATOM 0 HD21 ASN A 150 9.801 -4.919 -0.024 1.00 61.44 H new ATOM 0 HD22 ASN A 150 8.401 -4.269 -0.883 1.00 61.44 H new ATOM 2060 N TYR A 151 6.153 0.291 2.345 1.00 20.21 N ATOM 2061 CA TYR A 151 5.147 1.350 2.193 1.00 34.41 C ATOM 2062 C TYR A 151 5.514 2.336 1.069 1.00 61.30 C ATOM 2063 O TYR A 151 6.500 3.072 1.167 1.00 2.44 O ATOM 2064 CB TYR A 151 4.973 2.120 3.512 1.00 64.33 C ATOM 2065 CG TYR A 151 4.462 1.273 4.666 1.00 32.24 C ATOM 2066 CD1 TYR A 151 5.342 0.582 5.494 1.00 64.34 C ATOM 2067 CD2 TYR A 151 3.100 1.171 4.929 1.00 25.00 C ATOM 2068 CE1 TYR A 151 4.880 -0.186 6.547 1.00 45.10 C ATOM 2069 CE2 TYR A 151 2.632 0.406 5.982 1.00 21.22 C ATOM 2070 CZ TYR A 151 3.524 -0.271 6.786 1.00 44.55 C ATOM 2071 OH TYR A 151 3.059 -1.032 7.836 1.00 72.34 O ATOM 0 H TYR A 151 6.955 0.553 2.918 1.00 20.21 H new ATOM 0 HA TYR A 151 4.209 0.864 1.925 1.00 34.41 H new ATOM 0 HB2 TYR A 151 5.931 2.557 3.793 1.00 64.33 H new ATOM 0 HB3 TYR A 151 4.281 2.946 3.349 1.00 64.33 H new ATOM 0 HD1 TYR A 151 6.404 0.647 5.311 1.00 64.34 H new ATOM 0 HD2 TYR A 151 2.397 1.698 4.301 1.00 25.00 H new ATOM 0 HE1 TYR A 151 5.577 -0.716 7.179 1.00 45.10 H new ATOM 0 HE2 TYR A 151 1.571 0.339 6.174 1.00 21.22 H new ATOM 0 HH TYR A 151 3.727 -1.042 8.553 1.00 72.34 H new ATOM 2081 N ILE A 152 4.710 2.351 0.007 1.00 52.52 N ATOM 2082 CA ILE A 152 4.875 3.313 -1.088 1.00 41.12 C ATOM 2083 C ILE A 152 4.283 4.680 -0.697 1.00 54.40 C ATOM 2084 O ILE A 152 3.146 4.762 -0.232 1.00 71.04 O ATOM 2085 CB ILE A 152 4.200 2.825 -2.407 1.00 3.23 C ATOM 2086 CG1 ILE A 152 4.794 1.478 -2.884 1.00 52.32 C ATOM 2087 CG2 ILE A 152 4.337 3.884 -3.503 1.00 31.11 C ATOM 2088 CD1 ILE A 152 4.305 0.267 -2.115 1.00 45.13 C ATOM 0 H ILE A 152 3.932 1.704 -0.121 1.00 52.52 H new ATOM 0 HA ILE A 152 5.946 3.406 -1.266 1.00 41.12 H new ATOM 0 HB ILE A 152 3.142 2.668 -2.198 1.00 3.23 H new ATOM 0 HG12 ILE A 152 4.555 1.343 -3.939 1.00 52.32 H new ATOM 0 HG13 ILE A 152 5.880 1.527 -2.807 1.00 52.32 H new ATOM 0 HG21 ILE A 152 3.861 3.527 -4.416 1.00 31.11 H new ATOM 0 HG22 ILE A 152 3.855 4.807 -3.180 1.00 31.11 H new ATOM 0 HG23 ILE A 152 5.393 4.074 -3.695 1.00 31.11 H new ATOM 0 HD11 ILE A 152 4.772 -0.632 -2.517 1.00 45.13 H new ATOM 0 HD12 ILE A 152 4.568 0.374 -1.063 1.00 45.13 H new ATOM 0 HD13 ILE A 152 3.222 0.187 -2.212 1.00 45.13 H new ATOM 2100 N HIS A 153 5.065 5.743 -0.876 1.00 41.13 N ATOM 2101 CA HIS A 153 4.627 7.110 -0.562 1.00 32.32 C ATOM 2102 C HIS A 153 4.652 7.992 -1.814 1.00 12.41 C ATOM 2103 O HIS A 153 5.446 7.767 -2.731 1.00 22.42 O ATOM 2104 CB HIS A 153 5.524 7.733 0.516 1.00 5.04 C ATOM 2105 CG HIS A 153 5.418 7.071 1.855 1.00 2.34 C ATOM 2106 ND1 HIS A 153 4.783 7.648 2.933 1.00 44.21 N ATOM 2107 CD2 HIS A 153 5.878 5.876 2.291 1.00 23.32 C ATOM 2108 CE1 HIS A 153 4.858 6.843 3.969 1.00 52.35 C ATOM 2109 NE2 HIS A 153 5.515 5.759 3.609 1.00 52.11 N ATOM 0 H HIS A 153 6.016 5.686 -1.241 1.00 41.13 H new ATOM 0 HA HIS A 153 3.605 7.051 -0.188 1.00 32.32 H new ATOM 0 HB2 HIS A 153 6.560 7.689 0.182 1.00 5.04 H new ATOM 0 HB3 HIS A 153 5.268 8.787 0.622 1.00 5.04 H new ATOM 0 HD2 HIS A 153 6.428 5.150 1.710 1.00 23.32 H new ATOM 0 HE1 HIS A 153 4.450 7.037 4.950 1.00 52.35 H new ATOM 0 HE2 HIS A 153 5.720 4.962 4.212 1.00 52.11 H new ATOM 2118 N LEU A 154 3.791 9.003 -1.837 1.00 21.21 N ATOM 2119 CA LEU A 154 3.670 9.896 -2.992 1.00 54.51 C ATOM 2120 C LEU A 154 4.371 11.239 -2.750 1.00 71.11 C ATOM 2121 O LEU A 154 5.070 11.749 -3.630 1.00 24.22 O ATOM 2122 CB LEU A 154 2.190 10.138 -3.311 1.00 63.05 C ATOM 2123 CG LEU A 154 1.347 8.872 -3.540 1.00 71.20 C ATOM 2124 CD1 LEU A 154 -0.081 9.236 -3.943 1.00 54.14 C ATOM 2125 CD2 LEU A 154 1.997 7.968 -4.588 1.00 31.15 C ATOM 0 H LEU A 154 3.162 9.228 -1.066 1.00 21.21 H new ATOM 0 HA LEU A 154 4.158 9.411 -3.837 1.00 54.51 H new ATOM 0 HB2 LEU A 154 1.748 10.705 -2.492 1.00 63.05 H new ATOM 0 HB3 LEU A 154 2.126 10.763 -4.202 1.00 63.05 H new ATOM 0 HG LEU A 154 1.302 8.320 -2.601 1.00 71.20 H new ATOM 0 HD11 LEU A 154 -0.658 8.325 -4.100 1.00 54.14 H new ATOM 0 HD12 LEU A 154 -0.543 9.827 -3.152 1.00 54.14 H new ATOM 0 HD13 LEU A 154 -0.062 9.816 -4.865 1.00 54.14 H new ATOM 0 HD21 LEU A 154 1.383 7.079 -4.733 1.00 31.15 H new ATOM 0 HD22 LEU A 154 2.083 8.508 -5.531 1.00 31.15 H new ATOM 0 HD23 LEU A 154 2.989 7.672 -4.248 1.00 31.15 H new ATOM 2137 N ASN A 155 4.173 11.805 -1.553 1.00 2.32 N ATOM 2138 CA ASN A 155 4.678 13.149 -1.217 1.00 54.13 C ATOM 2139 C ASN A 155 4.003 14.237 -2.078 1.00 30.43 C ATOM 2140 O ASN A 155 4.482 15.370 -2.165 1.00 42.14 O ATOM 2141 CB ASN A 155 6.209 13.217 -1.355 1.00 4.03 C ATOM 2142 CG ASN A 155 6.928 12.348 -0.334 1.00 40.14 C ATOM 2143 OD1 ASN A 155 6.407 11.338 0.126 1.00 73.13 O ATOM 2144 ND2 ASN A 155 8.136 12.726 0.026 1.00 71.12 N ATOM 0 H ASN A 155 3.664 11.352 -0.794 1.00 2.32 H new ATOM 0 HA ASN A 155 4.422 13.342 -0.175 1.00 54.13 H new ATOM 0 HB2 ASN A 155 6.494 12.903 -2.359 1.00 4.03 H new ATOM 0 HB3 ASN A 155 6.535 14.251 -1.240 1.00 4.03 H new ATOM 0 HD21 ASN A 155 8.662 12.174 0.703 1.00 71.12 H new ATOM 0 HD22 ASN A 155 8.546 13.571 -0.372 1.00 71.12 H new TER 2151 ASN A 155