USER MOD reduce.3.24.130724 H: found=0, std=0, add=1428, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1418 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 84 CYS SG : rot -46:sc= -3.43! USER MOD Set 1.2: B 85 HIS : no HD1:sc= -3.23! C(o=-6.7!,f=-15!) USER MOD Set 2.1: A 7 MET CE :methyl -165:sc=-0.00252 (180deg=0) USER MOD Set 2.2: B 81 THR OG1 : rot 78:sc= 0.437 USER MOD Set 3.1: A 74 MET CE :methyl -105:sc= -0.286 (180deg=-1.29) USER MOD Set 3.2: B 74 MET CE :methyl -141:sc= -0.359 (180deg=-1.31) USER MOD Set 4.1: B 25 HIS : no HD1:sc= -1.3 K(o=-1.3,f=-2.3) USER MOD Set 4.2: B 26 LYS NZ :NH3+ -158:sc= -0.0424 (180deg=-0.574) USER MOD Set 5.1: A 5 LYS NZ :NH3+ -155:sc= -0.111 (180deg=-0.634) USER MOD Set 5.2: B 5 LYS NZ :NH3+ -154:sc= -0.103 (180deg=-0.647) USER MOD Set 6.1: A 84 CYS SG : rot -50:sc= -3.58! USER MOD Set 6.2: A 85 HIS : no HD1:sc= -3! C(o=-6.6!,f=-15!) USER MOD Set 7.1: A 81 THR OG1 : rot 77:sc= 0.445 USER MOD Set 7.2: B 7 MET CE :methyl -164:sc=-0.00534 (180deg=0) USER MOD Set 8.1: A 25 HIS : no HD1:sc= -1.18 K(o=-1.2,f=-2.2) USER MOD Set 8.2: A 26 LYS NZ :NH3+ -151:sc= -0.0492 (180deg=-0.564) USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 0 MET N :NH3+ -151:sc= -0.0782 (180deg=-0.707) USER MOD Single : A 1 SER OG : rot 180:sc= -0.0066 USER MOD Single : A 15 HIS : no HD1:sc= 0 X(o=0,f=-0.0086) USER MOD Single : A 16 GLN : amide:sc= -0.618 X(o=-0.62,f=-0.2) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0.00311 USER MOD Single : A 33 LYS NZ :NH3+ -159:sc= -0.0717 (180deg=-0.563) USER MOD Single : A 37 ASN : amide:sc= -1.51 K(o=-1.5,f=-4!) USER MOD Single : A 38 ASN : amide:sc= -0.0537 K(o=-0.054,f=-1.3) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= -1.36 K(o=-1.4,f=-2.7!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 86:sc= 0.851 USER MOD Single : A 68 CYS SG : rot -86:sc= -1.12 USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 SER OG : rot -71:sc= 0.736 USER MOD Single : A 79 MET CE :methyl 160:sc= -0.101 (180deg=-0.94) USER MOD Single : A 82 THR OG1 : rot -69:sc= 0.496 USER MOD Single : A 90 HIS : no HD1:sc= -3.3! C(o=-3.3!,f=-11!) USER MOD Single : B 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 0 MET N :NH3+ -120:sc= -0.15 (180deg=-0.671) USER MOD Single : B 1 SER OG : rot 180:sc=-0.00666 USER MOD Single : B 15 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 16 GLN : amide:sc= -0.681 X(o=-0.68,f=-0.22) USER MOD Single : B 17 TYR OH : rot 180:sc= 0 USER MOD Single : B 18 SER OG : rot 180:sc= 0 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 30 SER OG : rot 180:sc= 0.00171 USER MOD Single : B 33 LYS NZ :NH3+ -157:sc= -0.0792 (180deg=-0.561) USER MOD Single : B 37 ASN : amide:sc= -1.51 K(o=-1.5,f=-4.1!) USER MOD Single : B 38 ASN : amide:sc= -0.0765 K(o=-0.077,f=-1.3) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 HIS : no HD1:sc= -1.3 K(o=-1.3,f=-2.8!) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 57 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 59 THR OG1 : rot 80:sc= 0.811 USER MOD Single : B 68 CYS SG : rot -90:sc= -1.14 USER MOD Single : B 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 78 SER OG : rot -73:sc= 0.505 USER MOD Single : B 79 MET CE :methyl 161:sc= -0.0907 (180deg=-0.88) USER MOD Single : B 82 THR OG1 : rot -69:sc= 0.59 USER MOD Single : B 90 HIS : no HD1:sc= -3.07! C(o=-3.1!,f=-11!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 -11.560 7.203 14.479 1.00 0.00 N ATOM 2 CA MET A 0 -10.230 6.632 14.132 1.00 0.00 C ATOM 3 C MET A 0 -10.287 5.106 14.248 1.00 0.00 C ATOM 4 O MET A 0 -10.263 4.555 15.331 1.00 0.00 O ATOM 5 CB MET A 0 -9.174 7.189 15.090 1.00 0.00 C ATOM 6 CG MET A 0 -8.965 8.679 14.804 1.00 0.00 C ATOM 7 SD MET A 0 -8.100 9.452 16.197 1.00 0.00 S ATOM 8 CE MET A 0 -6.415 8.951 15.758 1.00 0.00 C ATOM 0 H1 MET A 0 -11.699 8.096 13.965 1.00 0.00 H new ATOM 0 H2 MET A 0 -12.307 6.530 14.212 1.00 0.00 H new ATOM 0 H3 MET A 0 -11.605 7.382 15.503 1.00 0.00 H new ATOM 0 HA MET A 0 -9.967 6.904 13.110 1.00 0.00 H new ATOM 0 HB2 MET A 0 -9.492 7.047 16.123 1.00 0.00 H new ATOM 0 HB3 MET A 0 -8.235 6.649 14.968 1.00 0.00 H new ATOM 0 HG2 MET A 0 -8.387 8.806 13.889 1.00 0.00 H new ATOM 0 HG3 MET A 0 -9.926 9.167 14.644 1.00 0.00 H new ATOM 0 HE1 MET A 0 -5.716 9.333 16.502 1.00 0.00 H new ATOM 0 HE2 MET A 0 -6.355 7.863 15.728 1.00 0.00 H new ATOM 0 HE3 MET A 0 -6.159 9.355 14.779 1.00 0.00 H new ATOM 20 N SER A 1 -10.364 4.420 13.138 1.00 0.00 N ATOM 21 CA SER A 1 -10.423 2.930 13.178 1.00 0.00 C ATOM 22 C SER A 1 -9.003 2.371 13.277 1.00 0.00 C ATOM 23 O SER A 1 -8.034 3.100 13.210 1.00 0.00 O ATOM 24 CB SER A 1 -11.085 2.409 11.902 1.00 0.00 C ATOM 25 OG SER A 1 -10.223 2.643 10.796 1.00 0.00 O ATOM 0 H SER A 1 -10.389 4.829 12.204 1.00 0.00 H new ATOM 0 HA SER A 1 -11.004 2.612 14.043 1.00 0.00 H new ATOM 0 HB2 SER A 1 -11.294 1.343 11.996 1.00 0.00 H new ATOM 0 HB3 SER A 1 -12.041 2.908 11.745 1.00 0.00 H new ATOM 0 HG SER A 1 -10.644 2.308 9.977 1.00 0.00 H new ATOM 31 N GLU A 2 -8.869 1.083 13.438 1.00 0.00 N ATOM 32 CA GLU A 2 -7.508 0.486 13.541 1.00 0.00 C ATOM 33 C GLU A 2 -6.741 0.739 12.240 1.00 0.00 C ATOM 34 O GLU A 2 -5.538 0.911 12.241 1.00 0.00 O ATOM 35 CB GLU A 2 -7.629 -1.022 13.787 1.00 0.00 C ATOM 36 CG GLU A 2 -8.608 -1.280 14.939 1.00 0.00 C ATOM 37 CD GLU A 2 -8.166 -0.495 16.176 1.00 0.00 C ATOM 38 OE1 GLU A 2 -7.048 -0.703 16.617 1.00 0.00 O ATOM 39 OE2 GLU A 2 -8.953 0.302 16.660 1.00 0.00 O ATOM 0 H GLU A 2 -9.641 0.420 13.503 1.00 0.00 H new ATOM 0 HA GLU A 2 -6.970 0.944 14.371 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -7.977 -1.521 12.883 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -6.652 -1.441 14.027 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -9.615 -0.981 14.647 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -8.645 -2.345 15.166 1.00 0.00 H new ATOM 46 N LEU A 3 -7.429 0.756 11.129 1.00 0.00 N ATOM 47 CA LEU A 3 -6.742 0.989 9.824 1.00 0.00 C ATOM 48 C LEU A 3 -6.115 2.390 9.812 1.00 0.00 C ATOM 49 O LEU A 3 -4.940 2.551 9.548 1.00 0.00 O ATOM 50 CB LEU A 3 -7.770 0.862 8.681 1.00 0.00 C ATOM 51 CG LEU A 3 -7.083 0.394 7.391 1.00 0.00 C ATOM 52 CD1 LEU A 3 -8.123 0.271 6.275 1.00 0.00 C ATOM 53 CD2 LEU A 3 -6.010 1.406 6.975 1.00 0.00 C ATOM 0 H LEU A 3 -8.438 0.619 11.069 1.00 0.00 H new ATOM 0 HA LEU A 3 -5.954 0.249 9.687 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -8.550 0.154 8.962 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -8.257 1.823 8.513 1.00 0.00 H new ATOM 0 HG LEU A 3 -6.615 -0.575 7.566 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -7.636 -0.061 5.358 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -8.884 -0.454 6.565 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -8.591 1.241 6.106 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -5.526 1.068 6.059 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.473 2.378 6.803 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -5.266 1.494 7.767 1.00 0.00 H new ATOM 65 N GLU A 4 -6.885 3.405 10.097 1.00 0.00 N ATOM 66 CA GLU A 4 -6.324 4.786 10.096 1.00 0.00 C ATOM 67 C GLU A 4 -5.071 4.833 10.972 1.00 0.00 C ATOM 68 O GLU A 4 -4.041 5.346 10.582 1.00 0.00 O ATOM 69 CB GLU A 4 -7.371 5.758 10.644 1.00 0.00 C ATOM 70 CG GLU A 4 -8.640 5.667 9.794 1.00 0.00 C ATOM 71 CD GLU A 4 -9.709 6.601 10.361 1.00 0.00 C ATOM 72 OE1 GLU A 4 -9.358 7.700 10.757 1.00 0.00 O ATOM 73 OE2 GLU A 4 -10.862 6.202 10.389 1.00 0.00 O ATOM 0 H GLU A 4 -7.876 3.338 10.330 1.00 0.00 H new ATOM 0 HA GLU A 4 -6.060 5.071 9.078 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -7.598 5.519 11.683 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -6.982 6.776 10.629 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -8.418 5.937 8.762 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -9.009 4.641 9.783 1.00 0.00 H new ATOM 80 N LYS A 5 -5.158 4.289 12.154 1.00 0.00 N ATOM 81 CA LYS A 5 -3.984 4.281 13.070 1.00 0.00 C ATOM 82 C LYS A 5 -2.757 3.759 12.324 1.00 0.00 C ATOM 83 O LYS A 5 -1.657 4.246 12.483 1.00 0.00 O ATOM 84 CB LYS A 5 -4.279 3.342 14.241 1.00 0.00 C ATOM 85 CG LYS A 5 -3.125 3.402 15.244 1.00 0.00 C ATOM 86 CD LYS A 5 -3.454 2.528 16.455 1.00 0.00 C ATOM 87 CE LYS A 5 -2.196 2.331 17.302 1.00 0.00 C ATOM 88 NZ LYS A 5 -1.222 1.489 16.554 1.00 0.00 N ATOM 0 H LYS A 5 -5.998 3.847 12.527 1.00 0.00 H new ATOM 0 HA LYS A 5 -3.794 5.292 13.430 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -5.212 3.629 14.726 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -4.409 2.322 13.880 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -2.203 3.059 14.774 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -2.957 4.432 15.560 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -4.237 2.996 17.052 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -3.838 1.562 16.126 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -1.750 3.297 17.541 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -2.453 1.856 18.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -0.591 1.008 17.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -1.735 0.780 15.993 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -0.658 2.090 15.920 1.00 0.00 H new ATOM 102 N ALA A 6 -2.955 2.754 11.517 1.00 0.00 N ATOM 103 CA ALA A 6 -1.832 2.151 10.747 1.00 0.00 C ATOM 104 C ALA A 6 -1.459 3.029 9.546 1.00 0.00 C ATOM 105 O ALA A 6 -0.324 3.033 9.112 1.00 0.00 O ATOM 106 CB ALA A 6 -2.257 0.757 10.260 1.00 0.00 C ATOM 0 H ALA A 6 -3.863 2.318 11.356 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.958 2.073 11.394 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -1.442 0.305 9.694 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -2.495 0.129 11.118 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -3.136 0.847 9.621 1.00 0.00 H new ATOM 112 N MET A 7 -2.379 3.779 9.010 1.00 0.00 N ATOM 113 CA MET A 7 -2.020 4.646 7.852 1.00 0.00 C ATOM 114 C MET A 7 -0.967 5.662 8.311 1.00 0.00 C ATOM 115 O MET A 7 0.028 5.884 7.650 1.00 0.00 O ATOM 116 CB MET A 7 -3.270 5.379 7.344 1.00 0.00 C ATOM 117 CG MET A 7 -3.053 5.819 5.892 1.00 0.00 C ATOM 118 SD MET A 7 -3.219 4.380 4.804 1.00 0.00 S ATOM 119 CE MET A 7 -2.011 4.887 3.556 1.00 0.00 C ATOM 0 H MET A 7 -3.350 3.831 9.317 1.00 0.00 H new ATOM 0 HA MET A 7 -1.619 4.038 7.041 1.00 0.00 H new ATOM 0 HB2 MET A 7 -4.140 4.725 7.410 1.00 0.00 H new ATOM 0 HB3 MET A 7 -3.475 6.247 7.971 1.00 0.00 H new ATOM 0 HG2 MET A 7 -3.781 6.583 5.618 1.00 0.00 H new ATOM 0 HG3 MET A 7 -2.065 6.264 5.778 1.00 0.00 H new ATOM 0 HE1 MET A 7 -2.139 4.282 2.659 1.00 0.00 H new ATOM 0 HE2 MET A 7 -2.162 5.938 3.310 1.00 0.00 H new ATOM 0 HE3 MET A 7 -1.003 4.747 3.947 1.00 0.00 H new ATOM 129 N VAL A 8 -1.186 6.277 9.442 1.00 0.00 N ATOM 130 CA VAL A 8 -0.210 7.282 9.958 1.00 0.00 C ATOM 131 C VAL A 8 1.083 6.580 10.400 1.00 0.00 C ATOM 132 O VAL A 8 2.166 7.109 10.248 1.00 0.00 O ATOM 133 CB VAL A 8 -0.830 8.020 11.152 1.00 0.00 C ATOM 134 CG1 VAL A 8 -0.069 9.324 11.402 1.00 0.00 C ATOM 135 CG2 VAL A 8 -2.295 8.344 10.844 1.00 0.00 C ATOM 0 H VAL A 8 -2.003 6.126 10.034 1.00 0.00 H new ATOM 0 HA VAL A 8 0.027 7.994 9.168 1.00 0.00 H new ATOM 0 HB VAL A 8 -0.770 7.387 12.038 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -0.511 9.846 12.250 1.00 0.00 H new ATOM 0 HG12 VAL A 8 0.976 9.100 11.618 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -0.129 9.956 10.516 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -2.738 8.868 11.691 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -2.349 8.976 9.957 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -2.842 7.419 10.664 1.00 0.00 H new ATOM 145 N ALA A 9 0.981 5.398 10.945 1.00 0.00 N ATOM 146 CA ALA A 9 2.205 4.669 11.393 1.00 0.00 C ATOM 147 C ALA A 9 3.128 4.431 10.195 1.00 0.00 C ATOM 148 O ALA A 9 4.314 4.689 10.246 1.00 0.00 O ATOM 149 CB ALA A 9 1.793 3.313 11.966 1.00 0.00 C ATOM 0 H ALA A 9 0.102 4.904 11.100 1.00 0.00 H new ATOM 0 HA ALA A 9 2.724 5.260 12.148 1.00 0.00 H new ATOM 0 HB1 ALA A 9 2.680 2.773 12.296 1.00 0.00 H new ATOM 0 HB2 ALA A 9 1.124 3.464 12.813 1.00 0.00 H new ATOM 0 HB3 ALA A 9 1.280 2.734 11.198 1.00 0.00 H new ATOM 155 N LEU A 10 2.587 3.916 9.127 1.00 0.00 N ATOM 156 CA LEU A 10 3.414 3.627 7.923 1.00 0.00 C ATOM 157 C LEU A 10 4.217 4.859 7.531 1.00 0.00 C ATOM 158 O LEU A 10 5.428 4.835 7.436 1.00 0.00 O ATOM 159 CB LEU A 10 2.467 3.285 6.759 1.00 0.00 C ATOM 160 CG LEU A 10 1.944 1.839 6.901 1.00 0.00 C ATOM 161 CD1 LEU A 10 0.598 1.703 6.182 1.00 0.00 C ATOM 162 CD2 LEU A 10 2.939 0.850 6.274 1.00 0.00 C ATOM 0 H LEU A 10 1.599 3.681 9.036 1.00 0.00 H new ATOM 0 HA LEU A 10 4.093 2.802 8.140 1.00 0.00 H new ATOM 0 HB2 LEU A 10 1.629 3.982 6.746 1.00 0.00 H new ATOM 0 HB3 LEU A 10 2.991 3.398 5.810 1.00 0.00 H new ATOM 0 HG LEU A 10 1.826 1.616 7.961 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.232 0.681 6.284 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -0.122 2.392 6.624 1.00 0.00 H new ATOM 0 HD13 LEU A 10 0.724 1.939 5.125 1.00 0.00 H new ATOM 0 HD21 LEU A 10 2.558 -0.166 6.381 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.064 1.081 5.216 1.00 0.00 H new ATOM 0 HD23 LEU A 10 3.901 0.932 6.780 1.00 0.00 H new ATOM 174 N ILE A 11 3.527 5.931 7.282 1.00 0.00 N ATOM 175 CA ILE A 11 4.204 7.183 6.863 1.00 0.00 C ATOM 176 C ILE A 11 5.292 7.564 7.863 1.00 0.00 C ATOM 177 O ILE A 11 6.349 8.030 7.484 1.00 0.00 O ATOM 178 CB ILE A 11 3.174 8.312 6.789 1.00 0.00 C ATOM 179 CG1 ILE A 11 2.140 7.984 5.710 1.00 0.00 C ATOM 180 CG2 ILE A 11 3.876 9.623 6.430 1.00 0.00 C ATOM 181 CD1 ILE A 11 0.950 8.941 5.829 1.00 0.00 C ATOM 0 H ILE A 11 2.511 5.994 7.352 1.00 0.00 H new ATOM 0 HA ILE A 11 4.661 7.025 5.886 1.00 0.00 H new ATOM 0 HB ILE A 11 2.680 8.415 7.755 1.00 0.00 H new ATOM 0 HG12 ILE A 11 2.591 8.070 4.722 1.00 0.00 H new ATOM 0 HG13 ILE A 11 1.802 6.953 5.817 1.00 0.00 H new ATOM 0 HG21 ILE A 11 3.141 10.427 6.378 1.00 0.00 H new ATOM 0 HG22 ILE A 11 4.618 9.859 7.193 1.00 0.00 H new ATOM 0 HG23 ILE A 11 4.369 9.519 5.464 1.00 0.00 H new ATOM 0 HD11 ILE A 11 0.215 8.705 5.059 1.00 0.00 H new ATOM 0 HD12 ILE A 11 0.493 8.833 6.813 1.00 0.00 H new ATOM 0 HD13 ILE A 11 1.294 9.967 5.700 1.00 0.00 H new ATOM 193 N ASP A 12 5.047 7.403 9.137 1.00 0.00 N ATOM 194 CA ASP A 12 6.086 7.800 10.126 1.00 0.00 C ATOM 195 C ASP A 12 7.276 6.841 10.045 1.00 0.00 C ATOM 196 O ASP A 12 8.412 7.252 10.166 1.00 0.00 O ATOM 197 CB ASP A 12 5.501 7.807 11.540 1.00 0.00 C ATOM 198 CG ASP A 12 4.528 8.978 11.686 1.00 0.00 C ATOM 199 OD1 ASP A 12 4.562 9.860 10.843 1.00 0.00 O ATOM 200 OD2 ASP A 12 3.762 8.973 12.636 1.00 0.00 O ATOM 0 H ASP A 12 4.187 7.020 9.529 1.00 0.00 H new ATOM 0 HA ASP A 12 6.429 8.808 9.892 1.00 0.00 H new ATOM 0 HB2 ASP A 12 4.986 6.866 11.736 1.00 0.00 H new ATOM 0 HB3 ASP A 12 6.301 7.892 12.275 1.00 0.00 H new ATOM 205 N VAL A 13 7.044 5.569 9.833 1.00 0.00 N ATOM 206 CA VAL A 13 8.200 4.635 9.742 1.00 0.00 C ATOM 207 C VAL A 13 8.969 4.938 8.459 1.00 0.00 C ATOM 208 O VAL A 13 10.183 4.969 8.455 1.00 0.00 O ATOM 209 CB VAL A 13 7.724 3.180 9.752 1.00 0.00 C ATOM 210 CG1 VAL A 13 8.929 2.245 9.641 1.00 0.00 C ATOM 211 CG2 VAL A 13 6.975 2.897 11.056 1.00 0.00 C ATOM 0 H VAL A 13 6.122 5.146 9.721 1.00 0.00 H new ATOM 0 HA VAL A 13 8.851 4.774 10.605 1.00 0.00 H new ATOM 0 HB VAL A 13 7.057 3.011 8.906 1.00 0.00 H new ATOM 0 HG11 VAL A 13 8.588 1.210 9.648 1.00 0.00 H new ATOM 0 HG12 VAL A 13 9.461 2.445 8.711 1.00 0.00 H new ATOM 0 HG13 VAL A 13 9.598 2.412 10.485 1.00 0.00 H new ATOM 0 HG21 VAL A 13 6.636 1.861 11.063 1.00 0.00 H new ATOM 0 HG22 VAL A 13 7.641 3.067 11.902 1.00 0.00 H new ATOM 0 HG23 VAL A 13 6.114 3.561 11.133 1.00 0.00 H new ATOM 221 N PHE A 14 8.292 5.190 7.377 1.00 0.00 N ATOM 222 CA PHE A 14 9.027 5.516 6.128 1.00 0.00 C ATOM 223 C PHE A 14 9.854 6.782 6.370 1.00 0.00 C ATOM 224 O PHE A 14 10.944 6.941 5.850 1.00 0.00 O ATOM 225 CB PHE A 14 8.038 5.762 4.988 1.00 0.00 C ATOM 226 CG PHE A 14 8.807 6.045 3.719 1.00 0.00 C ATOM 227 CD1 PHE A 14 9.340 7.321 3.494 1.00 0.00 C ATOM 228 CD2 PHE A 14 8.994 5.032 2.771 1.00 0.00 C ATOM 229 CE1 PHE A 14 10.058 7.584 2.321 1.00 0.00 C ATOM 230 CE2 PHE A 14 9.712 5.294 1.600 1.00 0.00 C ATOM 231 CZ PHE A 14 10.245 6.569 1.374 1.00 0.00 C ATOM 0 H PHE A 14 7.275 5.185 7.303 1.00 0.00 H new ATOM 0 HA PHE A 14 9.678 4.685 5.854 1.00 0.00 H new ATOM 0 HB2 PHE A 14 7.396 4.891 4.853 1.00 0.00 H new ATOM 0 HB3 PHE A 14 7.388 6.603 5.229 1.00 0.00 H new ATOM 0 HD1 PHE A 14 9.197 8.102 4.226 1.00 0.00 H new ATOM 0 HD2 PHE A 14 8.584 4.048 2.944 1.00 0.00 H new ATOM 0 HE1 PHE A 14 10.467 8.568 2.147 1.00 0.00 H new ATOM 0 HE2 PHE A 14 9.856 4.512 0.869 1.00 0.00 H new ATOM 0 HZ PHE A 14 10.800 6.770 0.470 1.00 0.00 H new ATOM 241 N HIS A 15 9.338 7.685 7.162 1.00 0.00 N ATOM 242 CA HIS A 15 10.081 8.945 7.446 1.00 0.00 C ATOM 243 C HIS A 15 11.209 8.674 8.446 1.00 0.00 C ATOM 244 O HIS A 15 12.242 9.315 8.425 1.00 0.00 O ATOM 245 CB HIS A 15 9.119 9.982 8.032 1.00 0.00 C ATOM 246 CG HIS A 15 9.813 11.313 8.120 1.00 0.00 C ATOM 247 ND1 HIS A 15 10.180 11.878 9.332 1.00 0.00 N ATOM 248 CD2 HIS A 15 10.218 12.200 7.154 1.00 0.00 C ATOM 249 CE1 HIS A 15 10.777 13.054 9.066 1.00 0.00 C ATOM 250 NE2 HIS A 15 10.828 13.299 7.754 1.00 0.00 N ATOM 0 H HIS A 15 8.433 7.603 7.624 1.00 0.00 H new ATOM 0 HA HIS A 15 10.510 9.324 6.518 1.00 0.00 H new ATOM 0 HB2 HIS A 15 8.230 10.064 7.407 1.00 0.00 H new ATOM 0 HB3 HIS A 15 8.786 9.667 9.021 1.00 0.00 H new ATOM 0 HD2 HIS A 15 10.084 12.066 6.091 1.00 0.00 H new ATOM 0 HE1 HIS A 15 11.168 13.719 9.822 1.00 0.00 H new ATOM 0 HE2 HIS A 15 11.228 14.115 7.291 1.00 0.00 H new ATOM 258 N GLN A 16 11.007 7.733 9.330 1.00 0.00 N ATOM 259 CA GLN A 16 12.049 7.417 10.349 1.00 0.00 C ATOM 260 C GLN A 16 13.384 7.148 9.657 1.00 0.00 C ATOM 261 O GLN A 16 14.420 7.610 10.090 1.00 0.00 O ATOM 262 CB GLN A 16 11.624 6.177 11.142 1.00 0.00 C ATOM 263 CG GLN A 16 12.575 5.968 12.324 1.00 0.00 C ATOM 264 CD GLN A 16 12.372 7.080 13.355 1.00 0.00 C ATOM 265 OE1 GLN A 16 13.326 7.647 13.849 1.00 0.00 O ATOM 266 NE2 GLN A 16 11.162 7.419 13.705 1.00 0.00 N ATOM 0 H GLN A 16 10.160 7.167 9.390 1.00 0.00 H new ATOM 0 HA GLN A 16 12.161 8.264 11.026 1.00 0.00 H new ATOM 0 HB2 GLN A 16 10.602 6.297 11.502 1.00 0.00 H new ATOM 0 HB3 GLN A 16 11.634 5.299 10.496 1.00 0.00 H new ATOM 0 HG2 GLN A 16 12.392 4.996 12.783 1.00 0.00 H new ATOM 0 HG3 GLN A 16 13.608 5.966 11.976 1.00 0.00 H new ATOM 0 HE21 GLN A 16 10.360 6.944 13.291 1.00 0.00 H new ATOM 0 HE22 GLN A 16 11.018 8.159 14.392 1.00 0.00 H new ATOM 275 N TYR A 17 13.374 6.407 8.584 1.00 0.00 N ATOM 276 CA TYR A 17 14.650 6.120 7.876 1.00 0.00 C ATOM 277 C TYR A 17 15.135 7.392 7.182 1.00 0.00 C ATOM 278 O TYR A 17 16.300 7.733 7.236 1.00 0.00 O ATOM 279 CB TYR A 17 14.421 5.026 6.830 1.00 0.00 C ATOM 280 CG TYR A 17 14.284 3.686 7.519 1.00 0.00 C ATOM 281 CD1 TYR A 17 13.160 3.423 8.311 1.00 0.00 C ATOM 282 CD2 TYR A 17 15.275 2.706 7.364 1.00 0.00 C ATOM 283 CE1 TYR A 17 13.026 2.185 8.949 1.00 0.00 C ATOM 284 CE2 TYR A 17 15.140 1.467 8.003 1.00 0.00 C ATOM 285 CZ TYR A 17 14.015 1.207 8.796 1.00 0.00 C ATOM 286 OH TYR A 17 13.881 -0.013 9.426 1.00 0.00 O ATOM 0 H TYR A 17 12.541 5.990 8.169 1.00 0.00 H new ATOM 0 HA TYR A 17 15.398 5.783 8.593 1.00 0.00 H new ATOM 0 HB2 TYR A 17 13.522 5.243 6.253 1.00 0.00 H new ATOM 0 HB3 TYR A 17 15.253 5.001 6.127 1.00 0.00 H new ATOM 0 HD1 TYR A 17 12.395 4.177 8.430 1.00 0.00 H new ATOM 0 HD2 TYR A 17 16.142 2.907 6.752 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.158 1.984 9.560 1.00 0.00 H new ATOM 0 HE2 TYR A 17 15.903 0.712 7.884 1.00 0.00 H new ATOM 0 HH TYR A 17 14.654 -0.577 9.215 1.00 0.00 H new ATOM 296 N SER A 18 14.249 8.097 6.524 1.00 0.00 N ATOM 297 CA SER A 18 14.656 9.349 5.816 1.00 0.00 C ATOM 298 C SER A 18 14.352 10.572 6.689 1.00 0.00 C ATOM 299 O SER A 18 13.635 11.462 6.277 1.00 0.00 O ATOM 300 CB SER A 18 13.872 9.465 4.507 1.00 0.00 C ATOM 301 OG SER A 18 14.449 10.484 3.703 1.00 0.00 O ATOM 0 H SER A 18 13.260 7.859 6.447 1.00 0.00 H new ATOM 0 HA SER A 18 15.726 9.310 5.612 1.00 0.00 H new ATOM 0 HB2 SER A 18 13.887 8.514 3.975 1.00 0.00 H new ATOM 0 HB3 SER A 18 12.827 9.697 4.715 1.00 0.00 H new ATOM 0 HG SER A 18 13.950 10.560 2.863 1.00 0.00 H new ATOM 307 N GLY A 19 14.908 10.643 7.881 1.00 0.00 N ATOM 308 CA GLY A 19 14.671 11.830 8.772 1.00 0.00 C ATOM 309 C GLY A 19 16.018 12.517 9.016 1.00 0.00 C ATOM 310 O GLY A 19 16.083 13.652 9.446 1.00 0.00 O ATOM 0 H GLY A 19 15.518 9.927 8.276 1.00 0.00 H new ATOM 0 HA2 GLY A 19 13.970 12.522 8.306 1.00 0.00 H new ATOM 0 HA3 GLY A 19 14.228 11.515 9.717 1.00 0.00 H new ATOM 314 N ARG A 20 17.090 11.842 8.713 1.00 0.00 N ATOM 315 CA ARG A 20 18.445 12.444 8.882 1.00 0.00 C ATOM 316 C ARG A 20 18.574 13.650 7.953 1.00 0.00 C ATOM 317 O ARG A 20 19.225 14.621 8.290 1.00 0.00 O ATOM 318 CB ARG A 20 19.514 11.404 8.539 1.00 0.00 C ATOM 319 CG ARG A 20 20.867 11.847 9.092 1.00 0.00 C ATOM 320 CD ARG A 20 21.949 10.869 8.633 1.00 0.00 C ATOM 321 NE ARG A 20 23.282 11.345 9.100 1.00 0.00 N ATOM 322 CZ ARG A 20 23.443 11.713 10.341 1.00 0.00 C ATOM 323 NH1 ARG A 20 23.168 10.881 11.307 1.00 0.00 N ATOM 324 NH2 ARG A 20 23.874 12.914 10.613 1.00 0.00 N ATOM 0 H ARG A 20 17.087 10.888 8.351 1.00 0.00 H new ATOM 0 HA ARG A 20 18.582 12.765 9.915 1.00 0.00 H new ATOM 0 HB2 ARG A 20 19.240 10.436 8.958 1.00 0.00 H new ATOM 0 HB3 ARG A 20 19.577 11.277 7.458 1.00 0.00 H new ATOM 0 HG2 ARG A 20 21.101 12.854 8.746 1.00 0.00 H new ATOM 0 HG3 ARG A 20 20.833 11.884 10.181 1.00 0.00 H new ATOM 0 HD2 ARG A 20 21.747 9.874 9.030 1.00 0.00 H new ATOM 0 HD3 ARG A 20 21.941 10.786 7.546 1.00 0.00 H new ATOM 0 HE ARG A 20 24.067 11.383 8.450 1.00 0.00 H new ATOM 0 HH11 ARG A 20 22.828 9.944 11.092 1.00 0.00 H new ATOM 0 HH12 ARG A 20 23.293 11.167 12.278 1.00 0.00 H new ATOM 0 HH21 ARG A 20 24.085 13.564 9.856 1.00 0.00 H new ATOM 0 HH22 ARG A 20 24.000 13.203 11.583 1.00 0.00 H new ATOM 338 N GLU A 21 17.943 13.635 6.810 1.00 0.00 N ATOM 339 CA GLU A 21 18.025 14.826 5.910 1.00 0.00 C ATOM 340 C GLU A 21 16.711 14.964 5.147 1.00 0.00 C ATOM 341 O GLU A 21 16.165 16.043 5.032 1.00 0.00 O ATOM 342 CB GLU A 21 19.178 14.655 4.914 1.00 0.00 C ATOM 343 CG GLU A 21 20.517 14.918 5.607 1.00 0.00 C ATOM 344 CD GLU A 21 21.631 14.948 4.558 1.00 0.00 C ATOM 345 OE1 GLU A 21 21.351 15.341 3.437 1.00 0.00 O ATOM 346 OE2 GLU A 21 22.744 14.574 4.891 1.00 0.00 O ATOM 0 H GLU A 21 17.380 12.860 6.461 1.00 0.00 H new ATOM 0 HA GLU A 21 18.204 15.719 6.508 1.00 0.00 H new ATOM 0 HB2 GLU A 21 19.165 13.646 4.501 1.00 0.00 H new ATOM 0 HB3 GLU A 21 19.051 15.343 4.078 1.00 0.00 H new ATOM 0 HG2 GLU A 21 20.482 15.866 6.144 1.00 0.00 H new ATOM 0 HG3 GLU A 21 20.717 14.141 6.345 1.00 0.00 H new ATOM 353 N GLY A 22 16.196 13.879 4.627 1.00 0.00 N ATOM 354 CA GLY A 22 14.912 13.946 3.872 1.00 0.00 C ATOM 355 C GLY A 22 14.940 15.141 2.921 1.00 0.00 C ATOM 356 O GLY A 22 13.915 15.581 2.440 1.00 0.00 O ATOM 0 H GLY A 22 16.611 12.950 4.694 1.00 0.00 H new ATOM 0 HA2 GLY A 22 14.760 13.024 3.310 1.00 0.00 H new ATOM 0 HA3 GLY A 22 14.075 14.039 4.565 1.00 0.00 H new ATOM 360 N ASP A 23 16.103 15.671 2.644 1.00 0.00 N ATOM 361 CA ASP A 23 16.178 16.839 1.720 1.00 0.00 C ATOM 362 C ASP A 23 15.345 16.518 0.476 1.00 0.00 C ATOM 363 O ASP A 23 14.400 17.211 0.156 1.00 0.00 O ATOM 364 CB ASP A 23 17.637 17.090 1.330 1.00 0.00 C ATOM 365 CG ASP A 23 18.404 17.612 2.548 1.00 0.00 C ATOM 366 OD1 ASP A 23 17.777 17.813 3.576 1.00 0.00 O ATOM 367 OD2 ASP A 23 19.604 17.799 2.433 1.00 0.00 O ATOM 0 H ASP A 23 16.997 15.348 3.015 1.00 0.00 H new ATOM 0 HA ASP A 23 15.790 17.735 2.204 1.00 0.00 H new ATOM 0 HB2 ASP A 23 18.092 16.168 0.967 1.00 0.00 H new ATOM 0 HB3 ASP A 23 17.689 17.813 0.516 1.00 0.00 H new ATOM 372 N LYS A 24 15.657 15.443 -0.199 1.00 0.00 N ATOM 373 CA LYS A 24 14.847 15.045 -1.387 1.00 0.00 C ATOM 374 C LYS A 24 13.756 14.086 -0.899 1.00 0.00 C ATOM 375 O LYS A 24 13.725 13.711 0.257 1.00 0.00 O ATOM 376 CB LYS A 24 15.740 14.337 -2.410 1.00 0.00 C ATOM 377 CG LYS A 24 16.589 15.373 -3.158 1.00 0.00 C ATOM 378 CD LYS A 24 17.450 16.166 -2.158 1.00 0.00 C ATOM 379 CE LYS A 24 18.671 16.753 -2.877 1.00 0.00 C ATOM 380 NZ LYS A 24 19.394 17.684 -1.963 1.00 0.00 N ATOM 0 H LYS A 24 16.437 14.824 0.021 1.00 0.00 H new ATOM 0 HA LYS A 24 14.406 15.921 -1.863 1.00 0.00 H new ATOM 0 HB2 LYS A 24 16.386 13.617 -1.907 1.00 0.00 H new ATOM 0 HB3 LYS A 24 15.127 13.776 -3.116 1.00 0.00 H new ATOM 0 HG2 LYS A 24 17.229 14.874 -3.886 1.00 0.00 H new ATOM 0 HG3 LYS A 24 15.943 16.053 -3.714 1.00 0.00 H new ATOM 0 HD2 LYS A 24 16.860 16.966 -1.710 1.00 0.00 H new ATOM 0 HD3 LYS A 24 17.773 15.515 -1.345 1.00 0.00 H new ATOM 0 HE2 LYS A 24 19.337 15.951 -3.196 1.00 0.00 H new ATOM 0 HE3 LYS A 24 18.356 17.283 -3.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 20.221 18.080 -2.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 18.757 18.456 -1.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 19.708 17.166 -1.118 1.00 0.00 H new ATOM 394 N HIS A 25 12.882 13.664 -1.776 1.00 0.00 N ATOM 395 CA HIS A 25 11.802 12.700 -1.390 1.00 0.00 C ATOM 396 C HIS A 25 11.893 11.505 -2.338 1.00 0.00 C ATOM 397 O HIS A 25 10.918 11.091 -2.932 1.00 0.00 O ATOM 398 CB HIS A 25 10.435 13.380 -1.525 1.00 0.00 C ATOM 399 CG HIS A 25 10.130 13.643 -2.975 1.00 0.00 C ATOM 400 ND1 HIS A 25 10.817 14.590 -3.719 1.00 0.00 N ATOM 401 CD2 HIS A 25 9.218 13.083 -3.833 1.00 0.00 C ATOM 402 CE1 HIS A 25 10.311 14.571 -4.966 1.00 0.00 C ATOM 403 NE2 HIS A 25 9.334 13.670 -5.089 1.00 0.00 N ATOM 0 H HIS A 25 12.869 13.948 -2.755 1.00 0.00 H new ATOM 0 HA HIS A 25 11.921 12.374 -0.357 1.00 0.00 H new ATOM 0 HB2 HIS A 25 9.661 12.747 -1.091 1.00 0.00 H new ATOM 0 HB3 HIS A 25 10.430 14.317 -0.968 1.00 0.00 H new ATOM 0 HD2 HIS A 25 8.516 12.304 -3.573 1.00 0.00 H new ATOM 0 HE1 HIS A 25 10.654 15.207 -5.769 1.00 0.00 H new ATOM 0 HE2 HIS A 25 8.789 13.457 -5.925 1.00 0.00 H new ATOM 411 N LYS A 26 13.073 10.958 -2.482 1.00 0.00 N ATOM 412 CA LYS A 26 13.274 9.790 -3.388 1.00 0.00 C ATOM 413 C LYS A 26 14.060 8.701 -2.655 1.00 0.00 C ATOM 414 O LYS A 26 14.918 8.986 -1.844 1.00 0.00 O ATOM 415 CB LYS A 26 14.066 10.238 -4.619 1.00 0.00 C ATOM 416 CG LYS A 26 13.201 11.161 -5.479 1.00 0.00 C ATOM 417 CD LYS A 26 14.013 11.642 -6.683 1.00 0.00 C ATOM 418 CE LYS A 26 13.269 12.780 -7.381 1.00 0.00 C ATOM 419 NZ LYS A 26 11.838 12.401 -7.562 1.00 0.00 N ATOM 0 H LYS A 26 13.916 11.276 -2.003 1.00 0.00 H new ATOM 0 HA LYS A 26 12.304 9.396 -3.693 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.974 10.757 -4.311 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.377 9.369 -5.200 1.00 0.00 H new ATOM 0 HG2 LYS A 26 12.309 10.632 -5.816 1.00 0.00 H new ATOM 0 HG3 LYS A 26 12.863 12.014 -4.890 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.997 11.982 -6.359 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.174 10.818 -7.379 1.00 0.00 H new ATOM 0 HE2 LYS A 26 13.343 13.693 -6.790 1.00 0.00 H new ATOM 0 HE3 LYS A 26 13.726 12.988 -8.348 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 11.457 12.876 -8.405 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 11.764 11.371 -7.682 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 11.293 12.692 -6.725 1.00 0.00 H new ATOM 433 N LEU A 27 13.778 7.455 -2.942 1.00 0.00 N ATOM 434 CA LEU A 27 14.506 6.326 -2.278 1.00 0.00 C ATOM 435 C LEU A 27 15.147 5.464 -3.362 1.00 0.00 C ATOM 436 O LEU A 27 14.599 5.298 -4.433 1.00 0.00 O ATOM 437 CB LEU A 27 13.512 5.485 -1.473 1.00 0.00 C ATOM 438 CG LEU A 27 14.272 4.519 -0.546 1.00 0.00 C ATOM 439 CD1 LEU A 27 14.878 5.276 0.655 1.00 0.00 C ATOM 440 CD2 LEU A 27 13.301 3.451 -0.033 1.00 0.00 C ATOM 0 H LEU A 27 13.067 7.167 -3.615 1.00 0.00 H new ATOM 0 HA LEU A 27 15.272 6.712 -1.606 1.00 0.00 H new ATOM 0 HB2 LEU A 27 12.866 6.135 -0.884 1.00 0.00 H new ATOM 0 HB3 LEU A 27 12.867 4.923 -2.149 1.00 0.00 H new ATOM 0 HG LEU A 27 15.082 4.055 -1.109 1.00 0.00 H new ATOM 0 HD11 LEU A 27 15.410 4.574 1.297 1.00 0.00 H new ATOM 0 HD12 LEU A 27 15.572 6.035 0.294 1.00 0.00 H new ATOM 0 HD13 LEU A 27 14.080 5.754 1.224 1.00 0.00 H new ATOM 0 HD21 LEU A 27 13.832 2.762 0.625 1.00 0.00 H new ATOM 0 HD22 LEU A 27 12.492 3.930 0.519 1.00 0.00 H new ATOM 0 HD23 LEU A 27 12.887 2.900 -0.877 1.00 0.00 H new ATOM 452 N LYS A 28 16.314 4.925 -3.108 1.00 0.00 N ATOM 453 CA LYS A 28 16.991 4.087 -4.145 1.00 0.00 C ATOM 454 C LYS A 28 16.655 2.607 -3.925 1.00 0.00 C ATOM 455 O LYS A 28 16.398 2.175 -2.820 1.00 0.00 O ATOM 456 CB LYS A 28 18.503 4.295 -4.044 1.00 0.00 C ATOM 457 CG LYS A 28 18.839 5.736 -4.432 1.00 0.00 C ATOM 458 CD LYS A 28 20.278 6.056 -4.026 1.00 0.00 C ATOM 459 CE LYS A 28 20.563 7.537 -4.287 1.00 0.00 C ATOM 460 NZ LYS A 28 21.831 7.928 -3.605 1.00 0.00 N ATOM 0 H LYS A 28 16.825 5.028 -2.231 1.00 0.00 H new ATOM 0 HA LYS A 28 16.644 4.382 -5.135 1.00 0.00 H new ATOM 0 HB2 LYS A 28 18.843 4.090 -3.029 1.00 0.00 H new ATOM 0 HB3 LYS A 28 19.023 3.598 -4.701 1.00 0.00 H new ATOM 0 HG2 LYS A 28 18.715 5.872 -5.506 1.00 0.00 H new ATOM 0 HG3 LYS A 28 18.151 6.425 -3.942 1.00 0.00 H new ATOM 0 HD2 LYS A 28 20.430 5.826 -2.971 1.00 0.00 H new ATOM 0 HD3 LYS A 28 20.973 5.435 -4.591 1.00 0.00 H new ATOM 0 HE2 LYS A 28 20.643 7.719 -5.359 1.00 0.00 H new ATOM 0 HE3 LYS A 28 19.737 8.147 -3.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 22.025 8.934 -3.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 21.738 7.768 -2.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 22.615 7.354 -3.975 1.00 0.00 H new ATOM 474 N LYS A 29 16.668 1.828 -4.971 1.00 0.00 N ATOM 475 CA LYS A 29 16.365 0.375 -4.833 1.00 0.00 C ATOM 476 C LYS A 29 17.334 -0.277 -3.835 1.00 0.00 C ATOM 477 O LYS A 29 16.962 -1.142 -3.066 1.00 0.00 O ATOM 478 CB LYS A 29 16.491 -0.310 -6.211 1.00 0.00 C ATOM 479 CG LYS A 29 17.941 -0.311 -6.734 1.00 0.00 C ATOM 480 CD LYS A 29 18.425 1.126 -6.989 1.00 0.00 C ATOM 481 CE LYS A 29 19.624 1.110 -7.944 1.00 0.00 C ATOM 482 NZ LYS A 29 20.391 2.377 -7.787 1.00 0.00 N ATOM 0 H LYS A 29 16.877 2.137 -5.921 1.00 0.00 H new ATOM 0 HA LYS A 29 15.348 0.256 -4.460 1.00 0.00 H new ATOM 0 HB2 LYS A 29 16.133 -1.337 -6.138 1.00 0.00 H new ATOM 0 HB3 LYS A 29 15.849 0.201 -6.928 1.00 0.00 H new ATOM 0 HG2 LYS A 29 18.594 -0.797 -6.010 1.00 0.00 H new ATOM 0 HG3 LYS A 29 18.000 -0.890 -7.656 1.00 0.00 H new ATOM 0 HD2 LYS A 29 17.617 1.721 -7.415 1.00 0.00 H new ATOM 0 HD3 LYS A 29 18.705 1.597 -6.047 1.00 0.00 H new ATOM 0 HE2 LYS A 29 20.264 0.254 -7.729 1.00 0.00 H new ATOM 0 HE3 LYS A 29 19.283 1.002 -8.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 21.206 2.372 -8.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 19.776 3.185 -8.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 20.727 2.460 -6.806 1.00 0.00 H new ATOM 496 N SER A 30 18.576 0.119 -3.862 1.00 0.00 N ATOM 497 CA SER A 30 19.590 -0.478 -2.948 1.00 0.00 C ATOM 498 C SER A 30 19.207 -0.255 -1.483 1.00 0.00 C ATOM 499 O SER A 30 19.358 -1.132 -0.647 1.00 0.00 O ATOM 500 CB SER A 30 20.944 0.182 -3.213 1.00 0.00 C ATOM 501 OG SER A 30 20.783 1.593 -3.238 1.00 0.00 O ATOM 0 H SER A 30 18.936 0.840 -4.487 1.00 0.00 H new ATOM 0 HA SER A 30 19.640 -1.551 -3.135 1.00 0.00 H new ATOM 0 HB2 SER A 30 21.657 -0.100 -2.438 1.00 0.00 H new ATOM 0 HB3 SER A 30 21.351 -0.166 -4.162 1.00 0.00 H new ATOM 0 HG SER A 30 21.650 2.018 -3.406 1.00 0.00 H new ATOM 507 N GLU A 31 18.713 0.912 -1.155 1.00 0.00 N ATOM 508 CA GLU A 31 18.342 1.172 0.265 1.00 0.00 C ATOM 509 C GLU A 31 16.992 0.520 0.546 1.00 0.00 C ATOM 510 O GLU A 31 16.739 0.026 1.626 1.00 0.00 O ATOM 511 CB GLU A 31 18.282 2.679 0.527 1.00 0.00 C ATOM 512 CG GLU A 31 19.702 3.247 0.501 1.00 0.00 C ATOM 513 CD GLU A 31 19.666 4.736 0.849 1.00 0.00 C ATOM 514 OE1 GLU A 31 19.523 5.533 -0.062 1.00 0.00 O ATOM 515 OE2 GLU A 31 19.783 5.053 2.022 1.00 0.00 O ATOM 0 H GLU A 31 18.553 1.685 -1.801 1.00 0.00 H new ATOM 0 HA GLU A 31 19.094 0.746 0.930 1.00 0.00 H new ATOM 0 HB2 GLU A 31 17.667 3.168 -0.229 1.00 0.00 H new ATOM 0 HB3 GLU A 31 17.816 2.875 1.493 1.00 0.00 H new ATOM 0 HG2 GLU A 31 20.331 2.712 1.212 1.00 0.00 H new ATOM 0 HG3 GLU A 31 20.143 3.104 -0.485 1.00 0.00 H new ATOM 522 N LEU A 32 16.133 0.490 -0.436 1.00 0.00 N ATOM 523 CA LEU A 32 14.811 -0.160 -0.246 1.00 0.00 C ATOM 524 C LEU A 32 15.053 -1.632 0.078 1.00 0.00 C ATOM 525 O LEU A 32 14.407 -2.192 0.939 1.00 0.00 O ATOM 526 CB LEU A 32 13.979 -0.024 -1.528 1.00 0.00 C ATOM 527 CG LEU A 32 12.706 -0.878 -1.443 1.00 0.00 C ATOM 528 CD1 LEU A 32 11.930 -0.542 -0.165 1.00 0.00 C ATOM 529 CD2 LEU A 32 11.827 -0.585 -2.664 1.00 0.00 C ATOM 0 H LEU A 32 16.292 0.889 -1.361 1.00 0.00 H new ATOM 0 HA LEU A 32 14.263 0.314 0.568 1.00 0.00 H new ATOM 0 HB2 LEU A 32 13.712 1.021 -1.685 1.00 0.00 H new ATOM 0 HB3 LEU A 32 14.574 -0.333 -2.388 1.00 0.00 H new ATOM 0 HG LEU A 32 12.980 -1.933 -1.423 1.00 0.00 H new ATOM 0 HD11 LEU A 32 11.029 -1.153 -0.115 1.00 0.00 H new ATOM 0 HD12 LEU A 32 12.555 -0.745 0.704 1.00 0.00 H new ATOM 0 HD13 LEU A 32 11.653 0.512 -0.174 1.00 0.00 H new ATOM 0 HD21 LEU A 32 10.920 -1.187 -2.612 1.00 0.00 H new ATOM 0 HD22 LEU A 32 11.561 0.472 -2.675 1.00 0.00 H new ATOM 0 HD23 LEU A 32 12.374 -0.831 -3.574 1.00 0.00 H new ATOM 541 N LYS A 33 15.959 -2.282 -0.605 1.00 0.00 N ATOM 542 CA LYS A 33 16.185 -3.721 -0.314 1.00 0.00 C ATOM 543 C LYS A 33 16.453 -3.883 1.179 1.00 0.00 C ATOM 544 O LYS A 33 15.753 -4.591 1.876 1.00 0.00 O ATOM 545 CB LYS A 33 17.384 -4.232 -1.115 1.00 0.00 C ATOM 546 CG LYS A 33 17.488 -5.750 -0.956 1.00 0.00 C ATOM 547 CD LYS A 33 18.533 -6.301 -1.928 1.00 0.00 C ATOM 548 CE LYS A 33 18.710 -7.802 -1.692 1.00 0.00 C ATOM 549 NZ LYS A 33 19.288 -8.030 -0.337 1.00 0.00 N ATOM 0 H LYS A 33 16.542 -1.883 -1.340 1.00 0.00 H new ATOM 0 HA LYS A 33 15.304 -4.298 -0.597 1.00 0.00 H new ATOM 0 HB2 LYS A 33 17.270 -3.972 -2.167 1.00 0.00 H new ATOM 0 HB3 LYS A 33 18.300 -3.755 -0.766 1.00 0.00 H new ATOM 0 HG2 LYS A 33 17.763 -6.000 0.069 1.00 0.00 H new ATOM 0 HG3 LYS A 33 16.520 -6.212 -1.148 1.00 0.00 H new ATOM 0 HD2 LYS A 33 18.220 -6.118 -2.956 1.00 0.00 H new ATOM 0 HD3 LYS A 33 19.483 -5.786 -1.787 1.00 0.00 H new ATOM 0 HE2 LYS A 33 17.749 -8.310 -1.779 1.00 0.00 H new ATOM 0 HE3 LYS A 33 19.365 -8.226 -2.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 19.733 -8.970 -0.303 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 20.003 -7.301 -0.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 18.532 -7.978 0.376 1.00 0.00 H new ATOM 563 N GLU A 34 17.463 -3.224 1.676 1.00 0.00 N ATOM 564 CA GLU A 34 17.770 -3.337 3.132 1.00 0.00 C ATOM 565 C GLU A 34 16.497 -3.051 3.932 1.00 0.00 C ATOM 566 O GLU A 34 16.237 -3.676 4.939 1.00 0.00 O ATOM 567 CB GLU A 34 18.847 -2.320 3.514 1.00 0.00 C ATOM 568 CG GLU A 34 20.133 -2.629 2.744 1.00 0.00 C ATOM 569 CD GLU A 34 21.146 -1.505 2.969 1.00 0.00 C ATOM 570 OE1 GLU A 34 21.668 -1.415 4.068 1.00 0.00 O ATOM 571 OE2 GLU A 34 21.382 -0.752 2.038 1.00 0.00 O ATOM 0 H GLU A 34 18.085 -2.616 1.143 1.00 0.00 H new ATOM 0 HA GLU A 34 18.131 -4.342 3.352 1.00 0.00 H new ATOM 0 HB2 GLU A 34 18.507 -1.310 3.285 1.00 0.00 H new ATOM 0 HB3 GLU A 34 19.034 -2.358 4.587 1.00 0.00 H new ATOM 0 HG2 GLU A 34 20.549 -3.580 3.077 1.00 0.00 H new ATOM 0 HG3 GLU A 34 19.917 -2.731 1.680 1.00 0.00 H new ATOM 578 N LEU A 35 15.704 -2.109 3.499 1.00 0.00 N ATOM 579 CA LEU A 35 14.453 -1.791 4.247 1.00 0.00 C ATOM 580 C LEU A 35 13.467 -2.961 4.123 1.00 0.00 C ATOM 581 O LEU A 35 12.788 -3.303 5.070 1.00 0.00 O ATOM 582 CB LEU A 35 13.834 -0.503 3.691 1.00 0.00 C ATOM 583 CG LEU A 35 12.634 -0.060 4.552 1.00 0.00 C ATOM 584 CD1 LEU A 35 13.114 0.652 5.826 1.00 0.00 C ATOM 585 CD2 LEU A 35 11.763 0.905 3.742 1.00 0.00 C ATOM 0 H LEU A 35 15.867 -1.548 2.663 1.00 0.00 H new ATOM 0 HA LEU A 35 14.685 -1.640 5.301 1.00 0.00 H new ATOM 0 HB2 LEU A 35 14.584 0.287 3.670 1.00 0.00 H new ATOM 0 HB3 LEU A 35 13.511 -0.663 2.662 1.00 0.00 H new ATOM 0 HG LEU A 35 12.062 -0.944 4.835 1.00 0.00 H new ATOM 0 HD11 LEU A 35 12.252 0.956 6.419 1.00 0.00 H new ATOM 0 HD12 LEU A 35 13.735 -0.027 6.410 1.00 0.00 H new ATOM 0 HD13 LEU A 35 13.696 1.532 5.553 1.00 0.00 H new ATOM 0 HD21 LEU A 35 10.913 1.222 4.346 1.00 0.00 H new ATOM 0 HD22 LEU A 35 12.352 1.777 3.459 1.00 0.00 H new ATOM 0 HD23 LEU A 35 11.403 0.404 2.843 1.00 0.00 H new ATOM 597 N ILE A 36 13.391 -3.598 2.983 1.00 0.00 N ATOM 598 CA ILE A 36 12.461 -4.759 2.841 1.00 0.00 C ATOM 599 C ILE A 36 12.840 -5.819 3.878 1.00 0.00 C ATOM 600 O ILE A 36 12.004 -6.545 4.379 1.00 0.00 O ATOM 601 CB ILE A 36 12.604 -5.346 1.421 1.00 0.00 C ATOM 602 CG1 ILE A 36 11.970 -4.368 0.421 1.00 0.00 C ATOM 603 CG2 ILE A 36 11.889 -6.710 1.330 1.00 0.00 C ATOM 604 CD1 ILE A 36 12.177 -4.866 -1.011 1.00 0.00 C ATOM 0 H ILE A 36 13.929 -3.366 2.148 1.00 0.00 H new ATOM 0 HA ILE A 36 11.430 -4.442 2.999 1.00 0.00 H new ATOM 0 HB ILE A 36 13.660 -5.491 1.192 1.00 0.00 H new ATOM 0 HG12 ILE A 36 10.905 -4.266 0.627 1.00 0.00 H new ATOM 0 HG13 ILE A 36 12.414 -3.379 0.537 1.00 0.00 H new ATOM 0 HG21 ILE A 36 11.998 -7.112 0.323 1.00 0.00 H new ATOM 0 HG22 ILE A 36 12.332 -7.402 2.047 1.00 0.00 H new ATOM 0 HG23 ILE A 36 10.831 -6.582 1.556 1.00 0.00 H new ATOM 0 HD11 ILE A 36 11.723 -4.164 -1.710 1.00 0.00 H new ATOM 0 HD12 ILE A 36 13.244 -4.945 -1.218 1.00 0.00 H new ATOM 0 HD13 ILE A 36 11.712 -5.845 -1.127 1.00 0.00 H new ATOM 616 N ASN A 37 14.106 -5.934 4.169 1.00 0.00 N ATOM 617 CA ASN A 37 14.570 -6.970 5.133 1.00 0.00 C ATOM 618 C ASN A 37 14.023 -6.718 6.541 1.00 0.00 C ATOM 619 O ASN A 37 13.422 -7.582 7.144 1.00 0.00 O ATOM 620 CB ASN A 37 16.099 -6.953 5.187 1.00 0.00 C ATOM 621 CG ASN A 37 16.666 -7.355 3.825 1.00 0.00 C ATOM 622 OD1 ASN A 37 16.270 -6.820 2.808 1.00 0.00 O ATOM 623 ND2 ASN A 37 17.581 -8.283 3.760 1.00 0.00 N ATOM 0 H ASN A 37 14.845 -5.350 3.777 1.00 0.00 H new ATOM 0 HA ASN A 37 14.203 -7.938 4.792 1.00 0.00 H new ATOM 0 HB2 ASN A 37 16.452 -5.958 5.460 1.00 0.00 H new ATOM 0 HB3 ASN A 37 16.453 -7.639 5.956 1.00 0.00 H new ATOM 0 HD21 ASN A 37 17.964 -8.559 2.856 1.00 0.00 H new ATOM 0 HD22 ASN A 37 17.913 -8.732 4.613 1.00 0.00 H new ATOM 630 N ASN A 38 14.261 -5.557 7.091 1.00 0.00 N ATOM 631 CA ASN A 38 13.793 -5.283 8.485 1.00 0.00 C ATOM 632 C ASN A 38 12.301 -4.925 8.521 1.00 0.00 C ATOM 633 O ASN A 38 11.785 -4.561 9.559 1.00 0.00 O ATOM 634 CB ASN A 38 14.608 -4.132 9.076 1.00 0.00 C ATOM 635 CG ASN A 38 16.089 -4.517 9.111 1.00 0.00 C ATOM 636 OD1 ASN A 38 16.736 -4.588 8.085 1.00 0.00 O ATOM 637 ND2 ASN A 38 16.657 -4.767 10.258 1.00 0.00 N ATOM 0 H ASN A 38 14.757 -4.788 6.639 1.00 0.00 H new ATOM 0 HA ASN A 38 13.936 -6.189 9.074 1.00 0.00 H new ATOM 0 HB2 ASN A 38 14.470 -3.231 8.478 1.00 0.00 H new ATOM 0 HB3 ASN A 38 14.257 -3.904 10.082 1.00 0.00 H new ATOM 0 HD21 ASN A 38 17.644 -5.022 10.294 1.00 0.00 H new ATOM 0 HD22 ASN A 38 16.114 -4.708 11.120 1.00 0.00 H new ATOM 644 N GLU A 39 11.602 -5.013 7.413 1.00 0.00 N ATOM 645 CA GLU A 39 10.138 -4.665 7.409 1.00 0.00 C ATOM 646 C GLU A 39 9.307 -5.856 6.921 1.00 0.00 C ATOM 647 O GLU A 39 8.154 -5.993 7.281 1.00 0.00 O ATOM 648 CB GLU A 39 9.903 -3.476 6.468 1.00 0.00 C ATOM 649 CG GLU A 39 10.459 -2.189 7.092 1.00 0.00 C ATOM 650 CD GLU A 39 9.888 -0.977 6.352 1.00 0.00 C ATOM 651 OE1 GLU A 39 9.249 -1.179 5.332 1.00 0.00 O ATOM 652 OE2 GLU A 39 10.098 0.130 6.818 1.00 0.00 O ATOM 0 H GLU A 39 11.978 -5.310 6.512 1.00 0.00 H new ATOM 0 HA GLU A 39 9.835 -4.410 8.424 1.00 0.00 H new ATOM 0 HB2 GLU A 39 10.385 -3.661 5.508 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.837 -3.363 6.272 1.00 0.00 H new ATOM 0 HG2 GLU A 39 10.196 -2.141 8.149 1.00 0.00 H new ATOM 0 HG3 GLU A 39 11.547 -2.185 7.034 1.00 0.00 H new ATOM 659 N LEU A 40 9.873 -6.722 6.113 1.00 0.00 N ATOM 660 CA LEU A 40 9.104 -7.912 5.608 1.00 0.00 C ATOM 661 C LEU A 40 9.822 -9.207 6.012 1.00 0.00 C ATOM 662 O LEU A 40 9.663 -10.237 5.387 1.00 0.00 O ATOM 663 CB LEU A 40 8.996 -7.836 4.075 1.00 0.00 C ATOM 664 CG LEU A 40 7.879 -6.847 3.668 1.00 0.00 C ATOM 665 CD1 LEU A 40 8.163 -6.293 2.264 1.00 0.00 C ATOM 666 CD2 LEU A 40 6.515 -7.559 3.659 1.00 0.00 C ATOM 0 H LEU A 40 10.835 -6.658 5.780 1.00 0.00 H new ATOM 0 HA LEU A 40 8.105 -7.908 6.045 1.00 0.00 H new ATOM 0 HB2 LEU A 40 9.948 -7.516 3.651 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.783 -8.825 3.668 1.00 0.00 H new ATOM 0 HG LEU A 40 7.856 -6.031 4.391 1.00 0.00 H new ATOM 0 HD11 LEU A 40 7.374 -5.597 1.981 1.00 0.00 H new ATOM 0 HD12 LEU A 40 9.122 -5.774 2.265 1.00 0.00 H new ATOM 0 HD13 LEU A 40 8.196 -7.115 1.548 1.00 0.00 H new ATOM 0 HD21 LEU A 40 5.737 -6.852 3.371 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.539 -8.382 2.945 1.00 0.00 H new ATOM 0 HD23 LEU A 40 6.301 -7.948 4.655 1.00 0.00 H new ATOM 678 N SER A 41 10.608 -9.163 7.055 1.00 0.00 N ATOM 679 CA SER A 41 11.331 -10.391 7.502 1.00 0.00 C ATOM 680 C SER A 41 10.347 -11.363 8.155 1.00 0.00 C ATOM 681 O SER A 41 10.565 -12.559 8.173 1.00 0.00 O ATOM 682 CB SER A 41 12.409 -10.013 8.521 1.00 0.00 C ATOM 683 OG SER A 41 12.658 -11.125 9.372 1.00 0.00 O ATOM 0 H SER A 41 10.781 -8.330 7.617 1.00 0.00 H new ATOM 0 HA SER A 41 11.793 -10.865 6.636 1.00 0.00 H new ATOM 0 HB2 SER A 41 13.325 -9.720 8.008 1.00 0.00 H new ATOM 0 HB3 SER A 41 12.085 -9.155 9.110 1.00 0.00 H new ATOM 0 HG SER A 41 13.349 -10.889 10.026 1.00 0.00 H new ATOM 689 N HIS A 42 9.269 -10.869 8.698 1.00 0.00 N ATOM 690 CA HIS A 42 8.289 -11.779 9.350 1.00 0.00 C ATOM 691 C HIS A 42 7.522 -12.561 8.284 1.00 0.00 C ATOM 692 O HIS A 42 7.418 -13.770 8.341 1.00 0.00 O ATOM 693 CB HIS A 42 7.300 -10.958 10.176 1.00 0.00 C ATOM 694 CG HIS A 42 6.303 -11.884 10.812 1.00 0.00 C ATOM 695 ND1 HIS A 42 5.315 -12.520 10.077 1.00 0.00 N ATOM 696 CD2 HIS A 42 6.135 -12.303 12.108 1.00 0.00 C ATOM 697 CE1 HIS A 42 4.605 -13.282 10.927 1.00 0.00 C ATOM 698 NE2 HIS A 42 5.062 -13.186 12.179 1.00 0.00 N ATOM 0 H HIS A 42 9.026 -9.879 8.718 1.00 0.00 H new ATOM 0 HA HIS A 42 8.823 -12.473 9.998 1.00 0.00 H new ATOM 0 HB2 HIS A 42 7.829 -10.392 10.942 1.00 0.00 H new ATOM 0 HB3 HIS A 42 6.789 -10.234 9.541 1.00 0.00 H new ATOM 0 HD2 HIS A 42 6.743 -11.994 12.945 1.00 0.00 H new ATOM 0 HE1 HIS A 42 3.767 -13.897 10.634 1.00 0.00 H new ATOM 0 HE2 HIS A 42 4.702 -13.658 13.008 1.00 0.00 H new ATOM 706 N PHE A 43 6.980 -11.880 7.314 1.00 0.00 N ATOM 707 CA PHE A 43 6.214 -12.582 6.249 1.00 0.00 C ATOM 708 C PHE A 43 7.148 -13.528 5.493 1.00 0.00 C ATOM 709 O PHE A 43 6.711 -14.418 4.792 1.00 0.00 O ATOM 710 CB PHE A 43 5.621 -11.551 5.288 1.00 0.00 C ATOM 711 CG PHE A 43 4.504 -10.807 5.984 1.00 0.00 C ATOM 712 CD1 PHE A 43 4.792 -9.675 6.757 1.00 0.00 C ATOM 713 CD2 PHE A 43 3.181 -11.253 5.861 1.00 0.00 C ATOM 714 CE1 PHE A 43 3.758 -8.988 7.405 1.00 0.00 C ATOM 715 CE2 PHE A 43 2.147 -10.565 6.509 1.00 0.00 C ATOM 716 CZ PHE A 43 2.436 -9.433 7.281 1.00 0.00 C ATOM 0 H PHE A 43 7.035 -10.866 7.213 1.00 0.00 H new ATOM 0 HA PHE A 43 5.405 -13.160 6.695 1.00 0.00 H new ATOM 0 HB2 PHE A 43 6.392 -10.853 4.964 1.00 0.00 H new ATOM 0 HB3 PHE A 43 5.242 -12.046 4.393 1.00 0.00 H new ATOM 0 HD1 PHE A 43 5.812 -9.332 6.853 1.00 0.00 H new ATOM 0 HD2 PHE A 43 2.959 -12.127 5.267 1.00 0.00 H new ATOM 0 HE1 PHE A 43 3.980 -8.115 8.000 1.00 0.00 H new ATOM 0 HE2 PHE A 43 1.127 -10.908 6.413 1.00 0.00 H new ATOM 0 HZ PHE A 43 1.639 -8.903 7.781 1.00 0.00 H new ATOM 726 N LEU A 44 8.433 -13.333 5.626 1.00 0.00 N ATOM 727 CA LEU A 44 9.409 -14.207 4.912 1.00 0.00 C ATOM 728 C LEU A 44 9.058 -15.685 5.153 1.00 0.00 C ATOM 729 O LEU A 44 9.229 -16.521 4.289 1.00 0.00 O ATOM 730 CB LEU A 44 10.828 -13.899 5.436 1.00 0.00 C ATOM 731 CG LEU A 44 11.888 -14.113 4.335 1.00 0.00 C ATOM 732 CD1 LEU A 44 11.759 -15.527 3.754 1.00 0.00 C ATOM 733 CD2 LEU A 44 11.725 -13.064 3.209 1.00 0.00 C ATOM 0 H LEU A 44 8.851 -12.602 6.202 1.00 0.00 H new ATOM 0 HA LEU A 44 9.368 -14.014 3.840 1.00 0.00 H new ATOM 0 HB2 LEU A 44 10.872 -12.870 5.791 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.051 -14.540 6.289 1.00 0.00 H new ATOM 0 HG LEU A 44 12.877 -13.994 4.778 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.510 -15.671 2.977 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.910 -16.261 4.546 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.765 -15.655 3.325 1.00 0.00 H new ATOM 0 HD21 LEU A 44 12.482 -13.232 2.443 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.733 -13.157 2.766 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.845 -12.063 3.624 1.00 0.00 H new ATOM 745 N GLU A 45 8.573 -16.016 6.318 1.00 0.00 N ATOM 746 CA GLU A 45 8.226 -17.441 6.595 1.00 0.00 C ATOM 747 C GLU A 45 6.961 -17.830 5.825 1.00 0.00 C ATOM 748 O GLU A 45 6.841 -18.932 5.328 1.00 0.00 O ATOM 749 CB GLU A 45 7.988 -17.635 8.094 1.00 0.00 C ATOM 750 CG GLU A 45 7.879 -19.130 8.402 1.00 0.00 C ATOM 751 CD GLU A 45 7.601 -19.327 9.893 1.00 0.00 C ATOM 752 OE1 GLU A 45 8.520 -19.149 10.676 1.00 0.00 O ATOM 753 OE2 GLU A 45 6.474 -19.652 10.227 1.00 0.00 O ATOM 0 H GLU A 45 8.402 -15.367 7.086 1.00 0.00 H new ATOM 0 HA GLU A 45 9.053 -18.074 6.274 1.00 0.00 H new ATOM 0 HB2 GLU A 45 8.806 -17.194 8.663 1.00 0.00 H new ATOM 0 HB3 GLU A 45 7.075 -17.122 8.398 1.00 0.00 H new ATOM 0 HG2 GLU A 45 7.080 -19.576 7.811 1.00 0.00 H new ATOM 0 HG3 GLU A 45 8.803 -19.637 8.124 1.00 0.00 H new ATOM 760 N GLU A 46 6.015 -16.939 5.727 1.00 0.00 N ATOM 761 CA GLU A 46 4.753 -17.262 4.995 1.00 0.00 C ATOM 762 C GLU A 46 4.927 -16.994 3.496 1.00 0.00 C ATOM 763 O GLU A 46 4.208 -16.204 2.919 1.00 0.00 O ATOM 764 CB GLU A 46 3.621 -16.380 5.527 1.00 0.00 C ATOM 765 CG GLU A 46 3.220 -16.840 6.931 1.00 0.00 C ATOM 766 CD GLU A 46 1.997 -16.047 7.396 1.00 0.00 C ATOM 767 OE1 GLU A 46 1.446 -15.319 6.587 1.00 0.00 O ATOM 768 OE2 GLU A 46 1.633 -16.180 8.553 1.00 0.00 O ATOM 0 H GLU A 46 6.059 -15.999 6.122 1.00 0.00 H new ATOM 0 HA GLU A 46 4.515 -18.315 5.148 1.00 0.00 H new ATOM 0 HB2 GLU A 46 3.941 -15.338 5.553 1.00 0.00 H new ATOM 0 HB3 GLU A 46 2.762 -16.433 4.858 1.00 0.00 H new ATOM 0 HG2 GLU A 46 2.995 -17.907 6.926 1.00 0.00 H new ATOM 0 HG3 GLU A 46 4.048 -16.692 7.624 1.00 0.00 H new ATOM 775 N ILE A 47 5.871 -17.648 2.859 1.00 0.00 N ATOM 776 CA ILE A 47 6.091 -17.436 1.387 1.00 0.00 C ATOM 777 C ILE A 47 5.992 -18.779 0.663 1.00 0.00 C ATOM 778 O ILE A 47 6.858 -19.622 0.784 1.00 0.00 O ATOM 779 CB ILE A 47 7.488 -16.849 1.148 1.00 0.00 C ATOM 780 CG1 ILE A 47 7.719 -15.609 2.040 1.00 0.00 C ATOM 781 CG2 ILE A 47 7.637 -16.478 -0.330 1.00 0.00 C ATOM 782 CD1 ILE A 47 6.979 -14.375 1.499 1.00 0.00 C ATOM 0 H ILE A 47 6.501 -18.322 3.294 1.00 0.00 H new ATOM 0 HA ILE A 47 5.335 -16.748 1.009 1.00 0.00 H new ATOM 0 HB ILE A 47 8.237 -17.596 1.410 1.00 0.00 H new ATOM 0 HG12 ILE A 47 7.380 -15.822 3.054 1.00 0.00 H new ATOM 0 HG13 ILE A 47 8.786 -15.397 2.099 1.00 0.00 H new ATOM 0 HG21 ILE A 47 8.629 -16.061 -0.502 1.00 0.00 H new ATOM 0 HG22 ILE A 47 7.507 -17.369 -0.944 1.00 0.00 H new ATOM 0 HG23 ILE A 47 6.881 -15.740 -0.598 1.00 0.00 H new ATOM 0 HD11 ILE A 47 7.166 -13.523 2.153 1.00 0.00 H new ATOM 0 HD12 ILE A 47 7.337 -14.147 0.495 1.00 0.00 H new ATOM 0 HD13 ILE A 47 5.909 -14.579 1.465 1.00 0.00 H new ATOM 794 N LYS A 48 4.948 -18.985 -0.099 1.00 0.00 N ATOM 795 CA LYS A 48 4.805 -20.276 -0.835 1.00 0.00 C ATOM 796 C LYS A 48 5.462 -20.147 -2.212 1.00 0.00 C ATOM 797 O LYS A 48 6.185 -21.019 -2.650 1.00 0.00 O ATOM 798 CB LYS A 48 3.320 -20.605 -1.013 1.00 0.00 C ATOM 799 CG LYS A 48 2.617 -20.619 0.351 1.00 0.00 C ATOM 800 CD LYS A 48 3.034 -21.859 1.154 1.00 0.00 C ATOM 801 CE LYS A 48 2.038 -22.087 2.295 1.00 0.00 C ATOM 802 NZ LYS A 48 2.520 -23.200 3.159 1.00 0.00 N ATOM 0 H LYS A 48 4.191 -18.317 -0.243 1.00 0.00 H new ATOM 0 HA LYS A 48 5.287 -21.072 -0.268 1.00 0.00 H new ATOM 0 HB2 LYS A 48 2.852 -19.868 -1.665 1.00 0.00 H new ATOM 0 HB3 LYS A 48 3.210 -21.575 -1.498 1.00 0.00 H new ATOM 0 HG2 LYS A 48 2.869 -19.716 0.907 1.00 0.00 H new ATOM 0 HG3 LYS A 48 1.536 -20.615 0.210 1.00 0.00 H new ATOM 0 HD2 LYS A 48 3.065 -22.733 0.504 1.00 0.00 H new ATOM 0 HD3 LYS A 48 4.039 -21.725 1.555 1.00 0.00 H new ATOM 0 HE2 LYS A 48 1.928 -21.176 2.884 1.00 0.00 H new ATOM 0 HE3 LYS A 48 1.054 -22.326 1.891 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 1.844 -23.355 3.934 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 2.603 -24.068 2.593 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 3.450 -22.955 3.555 1.00 0.00 H new ATOM 816 N GLU A 49 5.214 -19.060 -2.898 1.00 0.00 N ATOM 817 CA GLU A 49 5.823 -18.871 -4.248 1.00 0.00 C ATOM 818 C GLU A 49 7.212 -18.245 -4.092 1.00 0.00 C ATOM 819 O GLU A 49 7.342 -17.062 -3.847 1.00 0.00 O ATOM 820 CB GLU A 49 4.935 -17.942 -5.084 1.00 0.00 C ATOM 821 CG GLU A 49 3.652 -18.675 -5.492 1.00 0.00 C ATOM 822 CD GLU A 49 2.753 -18.863 -4.269 1.00 0.00 C ATOM 823 OE1 GLU A 49 2.907 -18.108 -3.323 1.00 0.00 O ATOM 824 OE2 GLU A 49 1.923 -19.757 -4.300 1.00 0.00 O ATOM 0 H GLU A 49 4.617 -18.296 -2.581 1.00 0.00 H new ATOM 0 HA GLU A 49 5.910 -19.835 -4.748 1.00 0.00 H new ATOM 0 HB2 GLU A 49 4.687 -17.049 -4.511 1.00 0.00 H new ATOM 0 HB3 GLU A 49 5.474 -17.612 -5.972 1.00 0.00 H new ATOM 0 HG2 GLU A 49 3.125 -18.106 -6.258 1.00 0.00 H new ATOM 0 HG3 GLU A 49 3.898 -19.644 -5.927 1.00 0.00 H new ATOM 831 N GLN A 50 8.253 -19.019 -4.238 1.00 0.00 N ATOM 832 CA GLN A 50 9.624 -18.449 -4.103 1.00 0.00 C ATOM 833 C GLN A 50 10.021 -17.754 -5.411 1.00 0.00 C ATOM 834 O GLN A 50 10.861 -16.875 -5.426 1.00 0.00 O ATOM 835 CB GLN A 50 10.616 -19.578 -3.802 1.00 0.00 C ATOM 836 CG GLN A 50 10.184 -20.314 -2.531 1.00 0.00 C ATOM 837 CD GLN A 50 11.111 -21.508 -2.292 1.00 0.00 C ATOM 838 OE1 GLN A 50 12.100 -21.670 -2.978 1.00 0.00 O ATOM 839 NE2 GLN A 50 10.830 -22.356 -1.340 1.00 0.00 N ATOM 0 H GLN A 50 8.214 -20.017 -4.444 1.00 0.00 H new ATOM 0 HA GLN A 50 9.639 -17.724 -3.289 1.00 0.00 H new ATOM 0 HB2 GLN A 50 10.657 -20.273 -4.641 1.00 0.00 H new ATOM 0 HB3 GLN A 50 11.619 -19.171 -3.676 1.00 0.00 H new ATOM 0 HG2 GLN A 50 10.218 -19.637 -1.677 1.00 0.00 H new ATOM 0 HG3 GLN A 50 9.153 -20.654 -2.628 1.00 0.00 H new ATOM 0 HE21 GLN A 50 9.999 -22.219 -0.764 1.00 0.00 H new ATOM 0 HE22 GLN A 50 11.441 -23.155 -1.172 1.00 0.00 H new ATOM 848 N GLU A 51 9.429 -18.142 -6.510 1.00 0.00 N ATOM 849 CA GLU A 51 9.782 -17.506 -7.814 1.00 0.00 C ATOM 850 C GLU A 51 9.182 -16.097 -7.914 1.00 0.00 C ATOM 851 O GLU A 51 9.690 -15.260 -8.633 1.00 0.00 O ATOM 852 CB GLU A 51 9.290 -18.368 -8.978 1.00 0.00 C ATOM 853 CG GLU A 51 9.794 -19.803 -8.808 1.00 0.00 C ATOM 854 CD GLU A 51 11.324 -19.813 -8.811 1.00 0.00 C ATOM 855 OE1 GLU A 51 11.902 -18.953 -9.456 1.00 0.00 O ATOM 856 OE2 GLU A 51 11.893 -20.681 -8.169 1.00 0.00 O ATOM 0 H GLU A 51 8.717 -18.871 -6.561 1.00 0.00 H new ATOM 0 HA GLU A 51 10.868 -17.424 -7.868 1.00 0.00 H new ATOM 0 HB2 GLU A 51 8.201 -18.357 -9.016 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.646 -17.957 -9.923 1.00 0.00 H new ATOM 0 HG2 GLU A 51 9.419 -20.223 -7.874 1.00 0.00 H new ATOM 0 HG3 GLU A 51 9.415 -20.430 -9.614 1.00 0.00 H new ATOM 863 N VAL A 52 8.144 -15.797 -7.182 1.00 0.00 N ATOM 864 CA VAL A 52 7.588 -14.411 -7.240 1.00 0.00 C ATOM 865 C VAL A 52 8.562 -13.488 -6.509 1.00 0.00 C ATOM 866 O VAL A 52 8.931 -12.447 -7.013 1.00 0.00 O ATOM 867 CB VAL A 52 6.217 -14.361 -6.550 1.00 0.00 C ATOM 868 CG1 VAL A 52 5.795 -12.902 -6.340 1.00 0.00 C ATOM 869 CG2 VAL A 52 5.178 -15.059 -7.428 1.00 0.00 C ATOM 0 H VAL A 52 7.661 -16.440 -6.554 1.00 0.00 H new ATOM 0 HA VAL A 52 7.463 -14.099 -8.277 1.00 0.00 H new ATOM 0 HB VAL A 52 6.284 -14.864 -5.585 1.00 0.00 H new ATOM 0 HG11 VAL A 52 4.822 -12.872 -5.850 1.00 0.00 H new ATOM 0 HG12 VAL A 52 6.532 -12.397 -5.715 1.00 0.00 H new ATOM 0 HG13 VAL A 52 5.731 -12.399 -7.305 1.00 0.00 H new ATOM 0 HG21 VAL A 52 4.205 -15.024 -6.938 1.00 0.00 H new ATOM 0 HG22 VAL A 52 5.118 -14.554 -8.392 1.00 0.00 H new ATOM 0 HG23 VAL A 52 5.470 -16.098 -7.581 1.00 0.00 H new ATOM 879 N VAL A 53 8.994 -13.854 -5.339 1.00 0.00 N ATOM 880 CA VAL A 53 9.951 -12.981 -4.609 1.00 0.00 C ATOM 881 C VAL A 53 11.246 -12.882 -5.415 1.00 0.00 C ATOM 882 O VAL A 53 11.921 -11.871 -5.407 1.00 0.00 O ATOM 883 CB VAL A 53 10.244 -13.577 -3.230 1.00 0.00 C ATOM 884 CG1 VAL A 53 11.316 -12.741 -2.527 1.00 0.00 C ATOM 885 CG2 VAL A 53 8.963 -13.567 -2.393 1.00 0.00 C ATOM 0 H VAL A 53 8.729 -14.714 -4.858 1.00 0.00 H new ATOM 0 HA VAL A 53 9.521 -11.988 -4.481 1.00 0.00 H new ATOM 0 HB VAL A 53 10.600 -14.601 -3.344 1.00 0.00 H new ATOM 0 HG11 VAL A 53 11.524 -13.167 -1.545 1.00 0.00 H new ATOM 0 HG12 VAL A 53 12.228 -12.743 -3.124 1.00 0.00 H new ATOM 0 HG13 VAL A 53 10.961 -11.717 -2.411 1.00 0.00 H new ATOM 0 HG21 VAL A 53 9.167 -13.991 -1.410 1.00 0.00 H new ATOM 0 HG22 VAL A 53 8.610 -12.542 -2.280 1.00 0.00 H new ATOM 0 HG23 VAL A 53 8.198 -14.161 -2.892 1.00 0.00 H new ATOM 895 N ASP A 54 11.598 -13.929 -6.111 1.00 0.00 N ATOM 896 CA ASP A 54 12.848 -13.903 -6.919 1.00 0.00 C ATOM 897 C ASP A 54 12.767 -12.777 -7.950 1.00 0.00 C ATOM 898 O ASP A 54 13.702 -12.024 -8.141 1.00 0.00 O ATOM 899 CB ASP A 54 13.013 -15.238 -7.647 1.00 0.00 C ATOM 900 CG ASP A 54 13.261 -16.350 -6.627 1.00 0.00 C ATOM 901 OD1 ASP A 54 13.451 -16.029 -5.466 1.00 0.00 O ATOM 902 OD2 ASP A 54 13.258 -17.504 -7.024 1.00 0.00 O ATOM 0 H ASP A 54 11.072 -14.802 -6.154 1.00 0.00 H new ATOM 0 HA ASP A 54 13.700 -13.736 -6.260 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.119 -15.459 -8.231 1.00 0.00 H new ATOM 0 HB3 ASP A 54 13.846 -15.181 -8.348 1.00 0.00 H new ATOM 907 N LYS A 55 11.655 -12.671 -8.631 1.00 0.00 N ATOM 908 CA LYS A 55 11.513 -11.609 -9.667 1.00 0.00 C ATOM 909 C LYS A 55 11.441 -10.236 -8.998 1.00 0.00 C ATOM 910 O LYS A 55 11.837 -9.244 -9.575 1.00 0.00 O ATOM 911 CB LYS A 55 10.254 -11.861 -10.503 1.00 0.00 C ATOM 912 CG LYS A 55 10.309 -13.268 -11.119 1.00 0.00 C ATOM 913 CD LYS A 55 11.297 -13.299 -12.293 1.00 0.00 C ATOM 914 CE LYS A 55 11.100 -14.589 -13.094 1.00 0.00 C ATOM 915 NZ LYS A 55 11.949 -14.544 -14.318 1.00 0.00 N ATOM 0 H LYS A 55 10.841 -13.274 -8.513 1.00 0.00 H new ATOM 0 HA LYS A 55 12.381 -11.632 -10.326 1.00 0.00 H new ATOM 0 HB2 LYS A 55 9.366 -11.762 -9.878 1.00 0.00 H new ATOM 0 HB3 LYS A 55 10.174 -11.112 -11.291 1.00 0.00 H new ATOM 0 HG2 LYS A 55 10.611 -13.992 -10.362 1.00 0.00 H new ATOM 0 HG3 LYS A 55 9.317 -13.561 -11.462 1.00 0.00 H new ATOM 0 HD2 LYS A 55 11.142 -12.432 -12.936 1.00 0.00 H new ATOM 0 HD3 LYS A 55 12.320 -13.242 -11.922 1.00 0.00 H new ATOM 0 HE2 LYS A 55 11.366 -15.453 -12.485 1.00 0.00 H new ATOM 0 HE3 LYS A 55 10.051 -14.703 -13.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 11.817 -15.419 -14.864 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 11.675 -13.727 -14.901 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 12.948 -14.454 -14.044 1.00 0.00 H new ATOM 929 N VAL A 56 10.985 -10.160 -7.779 1.00 0.00 N ATOM 930 CA VAL A 56 10.949 -8.842 -7.086 1.00 0.00 C ATOM 931 C VAL A 56 12.387 -8.376 -6.859 1.00 0.00 C ATOM 932 O VAL A 56 12.776 -7.303 -7.276 1.00 0.00 O ATOM 933 CB VAL A 56 10.255 -9.002 -5.731 1.00 0.00 C ATOM 934 CG1 VAL A 56 10.317 -7.676 -4.969 1.00 0.00 C ATOM 935 CG2 VAL A 56 8.789 -9.395 -5.947 1.00 0.00 C ATOM 0 H VAL A 56 10.637 -10.949 -7.235 1.00 0.00 H new ATOM 0 HA VAL A 56 10.406 -8.115 -7.690 1.00 0.00 H new ATOM 0 HB VAL A 56 10.758 -9.780 -5.156 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.823 -7.788 -4.004 1.00 0.00 H new ATOM 0 HG12 VAL A 56 11.358 -7.394 -4.814 1.00 0.00 H new ATOM 0 HG13 VAL A 56 9.814 -6.901 -5.546 1.00 0.00 H new ATOM 0 HG21 VAL A 56 8.297 -9.508 -4.981 1.00 0.00 H new ATOM 0 HG22 VAL A 56 8.285 -8.618 -6.522 1.00 0.00 H new ATOM 0 HG23 VAL A 56 8.742 -10.338 -6.491 1.00 0.00 H new ATOM 945 N MET A 57 13.174 -9.171 -6.190 1.00 0.00 N ATOM 946 CA MET A 57 14.584 -8.775 -5.919 1.00 0.00 C ATOM 947 C MET A 57 15.306 -8.447 -7.229 1.00 0.00 C ATOM 948 O MET A 57 16.236 -7.666 -7.250 1.00 0.00 O ATOM 949 CB MET A 57 15.308 -9.923 -5.212 1.00 0.00 C ATOM 950 CG MET A 57 14.652 -10.185 -3.854 1.00 0.00 C ATOM 951 SD MET A 57 15.003 -8.805 -2.736 1.00 0.00 S ATOM 952 CE MET A 57 13.779 -9.219 -1.469 1.00 0.00 C ATOM 0 H MET A 57 12.901 -10.081 -5.818 1.00 0.00 H new ATOM 0 HA MET A 57 14.586 -7.889 -5.283 1.00 0.00 H new ATOM 0 HB2 MET A 57 15.270 -10.823 -5.825 1.00 0.00 H new ATOM 0 HB3 MET A 57 16.361 -9.674 -5.077 1.00 0.00 H new ATOM 0 HG2 MET A 57 13.575 -10.303 -3.975 1.00 0.00 H new ATOM 0 HG3 MET A 57 15.029 -11.115 -3.430 1.00 0.00 H new ATOM 0 HE1 MET A 57 13.823 -8.483 -0.667 1.00 0.00 H new ATOM 0 HE2 MET A 57 12.783 -9.216 -1.911 1.00 0.00 H new ATOM 0 HE3 MET A 57 13.994 -10.209 -1.065 1.00 0.00 H new ATOM 962 N GLU A 58 14.877 -9.013 -8.332 1.00 0.00 N ATOM 963 CA GLU A 58 15.532 -8.700 -9.638 1.00 0.00 C ATOM 964 C GLU A 58 14.900 -7.440 -10.232 1.00 0.00 C ATOM 965 O GLU A 58 15.573 -6.642 -10.850 1.00 0.00 O ATOM 966 CB GLU A 58 15.392 -9.879 -10.606 1.00 0.00 C ATOM 967 CG GLU A 58 16.335 -9.682 -11.800 1.00 0.00 C ATOM 968 CD GLU A 58 15.896 -10.583 -12.957 1.00 0.00 C ATOM 969 OE1 GLU A 58 14.707 -10.627 -13.227 1.00 0.00 O ATOM 970 OE2 GLU A 58 16.755 -11.211 -13.552 1.00 0.00 O ATOM 0 H GLU A 58 14.104 -9.676 -8.383 1.00 0.00 H new ATOM 0 HA GLU A 58 16.595 -8.525 -9.473 1.00 0.00 H new ATOM 0 HB2 GLU A 58 15.627 -10.812 -10.094 1.00 0.00 H new ATOM 0 HB3 GLU A 58 14.362 -9.957 -10.953 1.00 0.00 H new ATOM 0 HG2 GLU A 58 16.326 -8.639 -12.115 1.00 0.00 H new ATOM 0 HG3 GLU A 58 17.359 -9.918 -11.510 1.00 0.00 H new ATOM 977 N THR A 59 13.624 -7.233 -10.046 1.00 0.00 N ATOM 978 CA THR A 59 13.005 -5.999 -10.609 1.00 0.00 C ATOM 979 C THR A 59 13.550 -4.794 -9.838 1.00 0.00 C ATOM 980 O THR A 59 13.934 -3.803 -10.427 1.00 0.00 O ATOM 981 CB THR A 59 11.478 -6.065 -10.500 1.00 0.00 C ATOM 982 OG1 THR A 59 11.041 -7.385 -10.789 1.00 0.00 O ATOM 983 CG2 THR A 59 10.848 -5.091 -11.499 1.00 0.00 C ATOM 0 H THR A 59 12.993 -7.853 -9.538 1.00 0.00 H new ATOM 0 HA THR A 59 13.255 -5.906 -11.666 1.00 0.00 H new ATOM 0 HB THR A 59 11.176 -5.792 -9.489 1.00 0.00 H new ATOM 0 HG1 THR A 59 11.079 -7.928 -9.974 1.00 0.00 H new ATOM 0 HG21 THR A 59 9.762 -5.140 -11.419 1.00 0.00 H new ATOM 0 HG22 THR A 59 11.183 -4.077 -11.279 1.00 0.00 H new ATOM 0 HG23 THR A 59 11.150 -5.361 -12.511 1.00 0.00 H new ATOM 991 N LEU A 60 13.634 -4.873 -8.541 1.00 0.00 N ATOM 992 CA LEU A 60 14.211 -3.737 -7.773 1.00 0.00 C ATOM 993 C LEU A 60 15.653 -3.529 -8.236 1.00 0.00 C ATOM 994 O LEU A 60 16.019 -2.462 -8.687 1.00 0.00 O ATOM 995 CB LEU A 60 14.193 -4.070 -6.277 1.00 0.00 C ATOM 996 CG LEU A 60 12.750 -4.324 -5.818 1.00 0.00 C ATOM 997 CD1 LEU A 60 12.755 -4.748 -4.346 1.00 0.00 C ATOM 998 CD2 LEU A 60 11.914 -3.043 -5.983 1.00 0.00 C ATOM 0 H LEU A 60 13.330 -5.670 -7.982 1.00 0.00 H new ATOM 0 HA LEU A 60 13.628 -2.831 -7.941 1.00 0.00 H new ATOM 0 HB2 LEU A 60 14.806 -4.950 -6.084 1.00 0.00 H new ATOM 0 HB3 LEU A 60 14.626 -3.248 -5.707 1.00 0.00 H new ATOM 0 HG LEU A 60 12.312 -5.115 -6.426 1.00 0.00 H new ATOM 0 HD11 LEU A 60 11.732 -4.929 -4.016 1.00 0.00 H new ATOM 0 HD12 LEU A 60 13.340 -5.661 -4.232 1.00 0.00 H new ATOM 0 HD13 LEU A 60 13.196 -3.956 -3.741 1.00 0.00 H new ATOM 0 HD21 LEU A 60 10.892 -3.231 -5.655 1.00 0.00 H new ATOM 0 HD22 LEU A 60 12.347 -2.245 -5.380 1.00 0.00 H new ATOM 0 HD23 LEU A 60 11.910 -2.744 -7.031 1.00 0.00 H new ATOM 1010 N ASP A 61 16.476 -4.538 -8.146 1.00 0.00 N ATOM 1011 CA ASP A 61 17.884 -4.381 -8.603 1.00 0.00 C ATOM 1012 C ASP A 61 17.888 -3.793 -10.019 1.00 0.00 C ATOM 1013 O ASP A 61 18.869 -3.232 -10.466 1.00 0.00 O ATOM 1014 CB ASP A 61 18.572 -5.749 -8.620 1.00 0.00 C ATOM 1015 CG ASP A 61 20.070 -5.568 -8.869 1.00 0.00 C ATOM 1016 OD1 ASP A 61 20.440 -5.362 -10.013 1.00 0.00 O ATOM 1017 OD2 ASP A 61 20.823 -5.639 -7.911 1.00 0.00 O ATOM 0 H ASP A 61 16.236 -5.458 -7.778 1.00 0.00 H new ATOM 0 HA ASP A 61 18.418 -3.716 -7.924 1.00 0.00 H new ATOM 0 HB2 ASP A 61 18.410 -6.260 -7.671 1.00 0.00 H new ATOM 0 HB3 ASP A 61 18.137 -6.376 -9.398 1.00 0.00 H new ATOM 1022 N GLU A 62 16.790 -3.921 -10.729 1.00 0.00 N ATOM 1023 CA GLU A 62 16.709 -3.379 -12.126 1.00 0.00 C ATOM 1024 C GLU A 62 15.925 -2.071 -12.116 1.00 0.00 C ATOM 1025 O GLU A 62 15.112 -1.799 -12.975 1.00 0.00 O ATOM 1026 CB GLU A 62 15.990 -4.357 -13.006 1.00 0.00 C ATOM 1027 CG GLU A 62 16.852 -5.600 -13.236 1.00 0.00 C ATOM 1028 CD GLU A 62 15.992 -6.712 -13.839 1.00 0.00 C ATOM 1029 OE1 GLU A 62 14.906 -6.938 -13.328 1.00 0.00 O ATOM 1030 OE2 GLU A 62 16.432 -7.320 -14.801 1.00 0.00 O ATOM 0 H GLU A 62 15.941 -4.380 -10.399 1.00 0.00 H new ATOM 0 HA GLU A 62 17.718 -3.212 -12.502 1.00 0.00 H new ATOM 0 HB2 GLU A 62 15.044 -4.643 -12.546 1.00 0.00 H new ATOM 0 HB3 GLU A 62 15.752 -3.890 -13.962 1.00 0.00 H new ATOM 0 HG2 GLU A 62 17.680 -5.363 -13.904 1.00 0.00 H new ATOM 0 HG3 GLU A 62 17.288 -5.933 -12.294 1.00 0.00 H new ATOM 1037 N ASP A 63 16.185 -1.282 -11.149 1.00 0.00 N ATOM 1038 CA ASP A 63 15.498 0.038 -11.010 1.00 0.00 C ATOM 1039 C ASP A 63 15.424 0.731 -12.373 1.00 0.00 C ATOM 1040 O ASP A 63 14.475 1.421 -12.687 1.00 0.00 O ATOM 1041 CB ASP A 63 16.341 0.910 -10.066 1.00 0.00 C ATOM 1042 CG ASP A 63 15.532 2.134 -9.627 1.00 0.00 C ATOM 1043 OD1 ASP A 63 14.321 2.021 -9.535 1.00 0.00 O ATOM 1044 OD2 ASP A 63 16.140 3.165 -9.388 1.00 0.00 O ATOM 0 H ASP A 63 16.863 -1.484 -10.415 1.00 0.00 H new ATOM 0 HA ASP A 63 14.490 -0.106 -10.622 1.00 0.00 H new ATOM 0 HB2 ASP A 63 16.643 0.330 -9.194 1.00 0.00 H new ATOM 0 HB3 ASP A 63 17.254 1.228 -10.569 1.00 0.00 H new ATOM 1049 N GLY A 64 16.411 0.501 -13.191 1.00 0.00 N ATOM 1050 CA GLY A 64 16.437 1.085 -14.570 1.00 0.00 C ATOM 1051 C GLY A 64 16.214 2.608 -14.569 1.00 0.00 C ATOM 1052 O GLY A 64 16.398 3.247 -15.586 1.00 0.00 O ATOM 0 H GLY A 64 17.219 -0.078 -12.962 1.00 0.00 H new ATOM 0 HA2 GLY A 64 17.396 0.862 -15.038 1.00 0.00 H new ATOM 0 HA3 GLY A 64 15.667 0.609 -15.177 1.00 0.00 H new ATOM 1056 N ASP A 65 15.827 3.205 -13.460 1.00 0.00 N ATOM 1057 CA ASP A 65 15.605 4.704 -13.440 1.00 0.00 C ATOM 1058 C ASP A 65 16.701 5.452 -12.634 1.00 0.00 C ATOM 1059 O ASP A 65 17.020 6.575 -12.969 1.00 0.00 O ATOM 1060 CB ASP A 65 14.247 4.993 -12.802 1.00 0.00 C ATOM 1061 CG ASP A 65 14.151 4.275 -11.456 1.00 0.00 C ATOM 1062 OD1 ASP A 65 14.709 4.782 -10.497 1.00 0.00 O ATOM 1063 OD2 ASP A 65 13.520 3.233 -11.406 1.00 0.00 O ATOM 0 H ASP A 65 15.655 2.730 -12.574 1.00 0.00 H new ATOM 0 HA ASP A 65 15.646 5.059 -14.470 1.00 0.00 H new ATOM 0 HB2 ASP A 65 14.120 6.067 -12.663 1.00 0.00 H new ATOM 0 HB3 ASP A 65 13.446 4.660 -13.461 1.00 0.00 H new ATOM 1068 N GLY A 66 17.288 4.885 -11.593 1.00 0.00 N ATOM 1069 CA GLY A 66 18.347 5.622 -10.822 1.00 0.00 C ATOM 1070 C GLY A 66 17.773 6.098 -9.485 1.00 0.00 C ATOM 1071 O GLY A 66 18.492 6.266 -8.521 1.00 0.00 O ATOM 0 H GLY A 66 17.078 3.948 -11.249 1.00 0.00 H new ATOM 0 HA2 GLY A 66 19.204 4.971 -10.650 1.00 0.00 H new ATOM 0 HA3 GLY A 66 18.704 6.474 -11.400 1.00 0.00 H new ATOM 1075 N GLU A 67 16.480 6.295 -9.408 1.00 0.00 N ATOM 1076 CA GLU A 67 15.864 6.736 -8.114 1.00 0.00 C ATOM 1077 C GLU A 67 14.456 6.147 -7.991 1.00 0.00 C ATOM 1078 O GLU A 67 13.664 6.233 -8.908 1.00 0.00 O ATOM 1079 CB GLU A 67 15.784 8.264 -8.071 1.00 0.00 C ATOM 1080 CG GLU A 67 17.182 8.848 -7.860 1.00 0.00 C ATOM 1081 CD GLU A 67 17.078 10.365 -7.692 1.00 0.00 C ATOM 1082 OE1 GLU A 67 16.735 11.026 -8.659 1.00 0.00 O ATOM 1083 OE2 GLU A 67 17.340 10.839 -6.600 1.00 0.00 O ATOM 0 H GLU A 67 15.825 6.171 -10.180 1.00 0.00 H new ATOM 0 HA GLU A 67 16.480 6.385 -7.286 1.00 0.00 H new ATOM 0 HB2 GLU A 67 15.358 8.642 -9.001 1.00 0.00 H new ATOM 0 HB3 GLU A 67 15.122 8.581 -7.265 1.00 0.00 H new ATOM 0 HG2 GLU A 67 17.644 8.404 -6.978 1.00 0.00 H new ATOM 0 HG3 GLU A 67 17.821 8.608 -8.710 1.00 0.00 H new ATOM 1090 N CYS A 68 14.133 5.549 -6.867 1.00 0.00 N ATOM 1091 CA CYS A 68 12.769 4.955 -6.683 1.00 0.00 C ATOM 1092 C CYS A 68 11.945 5.861 -5.761 1.00 0.00 C ATOM 1093 O CYS A 68 12.367 6.207 -4.675 1.00 0.00 O ATOM 1094 CB CYS A 68 12.903 3.559 -6.060 1.00 0.00 C ATOM 1095 SG CYS A 68 14.341 2.722 -6.773 1.00 0.00 S ATOM 0 H CYS A 68 14.758 5.447 -6.067 1.00 0.00 H new ATOM 0 HA CYS A 68 12.268 4.870 -7.647 1.00 0.00 H new ATOM 0 HB2 CYS A 68 13.014 3.640 -4.979 1.00 0.00 H new ATOM 0 HB3 CYS A 68 12.000 2.977 -6.245 1.00 0.00 H new ATOM 0 HG CYS A 68 13.993 2.123 -7.873 1.00 0.00 H new ATOM 1101 N ASP A 69 10.776 6.255 -6.190 1.00 0.00 N ATOM 1102 CA ASP A 69 9.926 7.149 -5.349 1.00 0.00 C ATOM 1103 C ASP A 69 9.133 6.315 -4.338 1.00 0.00 C ATOM 1104 O ASP A 69 9.307 5.118 -4.234 1.00 0.00 O ATOM 1105 CB ASP A 69 8.957 7.911 -6.255 1.00 0.00 C ATOM 1106 CG ASP A 69 9.744 8.638 -7.346 1.00 0.00 C ATOM 1107 OD1 ASP A 69 10.067 8.004 -8.338 1.00 0.00 O ATOM 1108 OD2 ASP A 69 10.012 9.815 -7.172 1.00 0.00 O ATOM 0 H ASP A 69 10.371 5.996 -7.090 1.00 0.00 H new ATOM 0 HA ASP A 69 10.560 7.852 -4.809 1.00 0.00 H new ATOM 0 HB2 ASP A 69 8.244 7.220 -6.705 1.00 0.00 H new ATOM 0 HB3 ASP A 69 8.381 8.627 -5.669 1.00 0.00 H new ATOM 1113 N PHE A 70 8.252 6.938 -3.598 1.00 0.00 N ATOM 1114 CA PHE A 70 7.443 6.170 -2.607 1.00 0.00 C ATOM 1115 C PHE A 70 6.380 5.365 -3.357 1.00 0.00 C ATOM 1116 O PHE A 70 6.012 4.281 -2.950 1.00 0.00 O ATOM 1117 CB PHE A 70 6.775 7.133 -1.621 1.00 0.00 C ATOM 1118 CG PHE A 70 6.013 6.353 -0.572 1.00 0.00 C ATOM 1119 CD1 PHE A 70 4.764 5.796 -0.878 1.00 0.00 C ATOM 1120 CD2 PHE A 70 6.555 6.190 0.708 1.00 0.00 C ATOM 1121 CE1 PHE A 70 4.061 5.078 0.097 1.00 0.00 C ATOM 1122 CE2 PHE A 70 5.852 5.473 1.682 1.00 0.00 C ATOM 1123 CZ PHE A 70 4.604 4.917 1.377 1.00 0.00 C ATOM 0 H PHE A 70 8.059 7.939 -3.637 1.00 0.00 H new ATOM 0 HA PHE A 70 8.089 5.493 -2.047 1.00 0.00 H new ATOM 0 HB2 PHE A 70 7.529 7.759 -1.144 1.00 0.00 H new ATOM 0 HB3 PHE A 70 6.097 7.800 -2.154 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.344 5.920 -1.865 1.00 0.00 H new ATOM 0 HD2 PHE A 70 7.518 6.619 0.944 1.00 0.00 H new ATOM 0 HE1 PHE A 70 3.099 4.648 -0.139 1.00 0.00 H new ATOM 0 HE2 PHE A 70 6.272 5.348 2.669 1.00 0.00 H new ATOM 0 HZ PHE A 70 4.060 4.364 2.129 1.00 0.00 H new ATOM 1133 N GLN A 71 5.888 5.872 -4.449 1.00 0.00 N ATOM 1134 CA GLN A 71 4.859 5.111 -5.211 1.00 0.00 C ATOM 1135 C GLN A 71 5.432 3.744 -5.595 1.00 0.00 C ATOM 1136 O GLN A 71 4.740 2.746 -5.571 1.00 0.00 O ATOM 1137 CB GLN A 71 4.485 5.886 -6.475 1.00 0.00 C ATOM 1138 CG GLN A 71 3.661 7.116 -6.091 1.00 0.00 C ATOM 1139 CD GLN A 71 3.269 7.884 -7.354 1.00 0.00 C ATOM 1140 OE1 GLN A 71 3.882 8.878 -7.689 1.00 0.00 O ATOM 1141 NE2 GLN A 71 2.266 7.462 -8.074 1.00 0.00 N ATOM 0 H GLN A 71 6.150 6.774 -4.847 1.00 0.00 H new ATOM 0 HA GLN A 71 3.969 4.975 -4.597 1.00 0.00 H new ATOM 0 HB2 GLN A 71 5.386 6.190 -7.008 1.00 0.00 H new ATOM 0 HB3 GLN A 71 3.914 5.249 -7.150 1.00 0.00 H new ATOM 0 HG2 GLN A 71 2.767 6.812 -5.546 1.00 0.00 H new ATOM 0 HG3 GLN A 71 4.237 7.759 -5.426 1.00 0.00 H new ATOM 0 HE21 GLN A 71 1.752 6.627 -7.792 1.00 0.00 H new ATOM 0 HE22 GLN A 71 1.996 7.967 -8.918 1.00 0.00 H new ATOM 1150 N GLU A 72 6.689 3.682 -5.937 1.00 0.00 N ATOM 1151 CA GLU A 72 7.288 2.368 -6.305 1.00 0.00 C ATOM 1152 C GLU A 72 7.439 1.501 -5.047 1.00 0.00 C ATOM 1153 O GLU A 72 7.454 0.293 -5.111 1.00 0.00 O ATOM 1154 CB GLU A 72 8.656 2.574 -6.964 1.00 0.00 C ATOM 1155 CG GLU A 72 8.494 3.374 -8.259 1.00 0.00 C ATOM 1156 CD GLU A 72 7.714 2.544 -9.280 1.00 0.00 C ATOM 1157 OE1 GLU A 72 7.798 1.328 -9.215 1.00 0.00 O ATOM 1158 OE2 GLU A 72 7.047 3.137 -10.112 1.00 0.00 O ATOM 0 H GLU A 72 7.324 4.479 -5.978 1.00 0.00 H new ATOM 0 HA GLU A 72 6.631 1.865 -7.014 1.00 0.00 H new ATOM 0 HB2 GLU A 72 9.323 3.101 -6.281 1.00 0.00 H new ATOM 0 HB3 GLU A 72 9.116 1.609 -7.177 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.970 4.308 -8.058 1.00 0.00 H new ATOM 0 HG3 GLU A 72 9.472 3.637 -8.661 1.00 0.00 H new ATOM 1165 N PHE A 73 7.507 2.115 -3.898 1.00 0.00 N ATOM 1166 CA PHE A 73 7.616 1.334 -2.629 1.00 0.00 C ATOM 1167 C PHE A 73 6.262 0.677 -2.327 1.00 0.00 C ATOM 1168 O PHE A 73 6.213 -0.461 -1.908 1.00 0.00 O ATOM 1169 CB PHE A 73 8.070 2.264 -1.484 1.00 0.00 C ATOM 1170 CG PHE A 73 7.594 1.755 -0.139 1.00 0.00 C ATOM 1171 CD1 PHE A 73 6.281 2.004 0.275 1.00 0.00 C ATOM 1172 CD2 PHE A 73 8.465 1.041 0.691 1.00 0.00 C ATOM 1173 CE1 PHE A 73 5.837 1.538 1.517 1.00 0.00 C ATOM 1174 CE2 PHE A 73 8.021 0.574 1.934 1.00 0.00 C ATOM 1175 CZ PHE A 73 6.707 0.822 2.347 1.00 0.00 C ATOM 0 H PHE A 73 7.492 3.128 -3.781 1.00 0.00 H new ATOM 0 HA PHE A 73 8.363 0.546 -2.730 1.00 0.00 H new ATOM 0 HB2 PHE A 73 9.157 2.338 -1.483 1.00 0.00 H new ATOM 0 HB3 PHE A 73 7.682 3.268 -1.653 1.00 0.00 H new ATOM 0 HD1 PHE A 73 5.609 2.557 -0.365 1.00 0.00 H new ATOM 0 HD2 PHE A 73 9.479 0.850 0.373 1.00 0.00 H new ATOM 0 HE1 PHE A 73 4.823 1.731 1.835 1.00 0.00 H new ATOM 0 HE2 PHE A 73 8.693 0.022 2.575 1.00 0.00 H new ATOM 0 HZ PHE A 73 6.365 0.461 3.306 1.00 0.00 H new ATOM 1185 N MET A 74 5.170 1.344 -2.531 1.00 0.00 N ATOM 1186 CA MET A 74 3.872 0.673 -2.236 1.00 0.00 C ATOM 1187 C MET A 74 3.627 -0.441 -3.265 1.00 0.00 C ATOM 1188 O MET A 74 3.387 -1.574 -2.896 1.00 0.00 O ATOM 1189 CB MET A 74 2.727 1.688 -2.272 1.00 0.00 C ATOM 1190 CG MET A 74 1.517 1.110 -1.535 1.00 0.00 C ATOM 1191 SD MET A 74 1.861 1.068 0.248 1.00 0.00 S ATOM 1192 CE MET A 74 1.743 -0.724 0.497 1.00 0.00 C ATOM 0 H MET A 74 5.112 2.301 -2.880 1.00 0.00 H new ATOM 0 HA MET A 74 3.913 0.238 -1.237 1.00 0.00 H new ATOM 0 HB2 MET A 74 3.039 2.623 -1.806 1.00 0.00 H new ATOM 0 HB3 MET A 74 2.463 1.919 -3.304 1.00 0.00 H new ATOM 0 HG2 MET A 74 0.633 1.717 -1.732 1.00 0.00 H new ATOM 0 HG3 MET A 74 1.301 0.105 -1.899 1.00 0.00 H new ATOM 0 HE1 MET A 74 0.803 -0.961 0.995 1.00 0.00 H new ATOM 0 HE2 MET A 74 1.780 -1.229 -0.468 1.00 0.00 H new ATOM 0 HE3 MET A 74 2.575 -1.061 1.115 1.00 0.00 H new ATOM 1202 N ALA A 75 3.671 -0.162 -4.537 1.00 0.00 N ATOM 1203 CA ALA A 75 3.423 -1.243 -5.539 1.00 0.00 C ATOM 1204 C ALA A 75 4.347 -2.441 -5.302 1.00 0.00 C ATOM 1205 O ALA A 75 3.899 -3.570 -5.258 1.00 0.00 O ATOM 1206 CB ALA A 75 3.668 -0.692 -6.945 1.00 0.00 C ATOM 0 H ALA A 75 3.866 0.760 -4.927 1.00 0.00 H new ATOM 0 HA ALA A 75 2.391 -1.577 -5.435 1.00 0.00 H new ATOM 0 HB1 ALA A 75 3.488 -1.477 -7.680 1.00 0.00 H new ATOM 0 HB2 ALA A 75 2.991 0.142 -7.132 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.699 -0.348 -7.026 1.00 0.00 H new ATOM 1212 N PHE A 76 5.624 -2.228 -5.168 1.00 0.00 N ATOM 1213 CA PHE A 76 6.538 -3.393 -4.958 1.00 0.00 C ATOM 1214 C PHE A 76 6.235 -4.056 -3.607 1.00 0.00 C ATOM 1215 O PHE A 76 6.337 -5.257 -3.460 1.00 0.00 O ATOM 1216 CB PHE A 76 8.008 -2.923 -5.001 1.00 0.00 C ATOM 1217 CG PHE A 76 8.514 -2.912 -6.435 1.00 0.00 C ATOM 1218 CD1 PHE A 76 8.551 -4.102 -7.173 1.00 0.00 C ATOM 1219 CD2 PHE A 76 8.939 -1.713 -7.027 1.00 0.00 C ATOM 1220 CE1 PHE A 76 9.009 -4.093 -8.494 1.00 0.00 C ATOM 1221 CE2 PHE A 76 9.398 -1.706 -8.348 1.00 0.00 C ATOM 1222 CZ PHE A 76 9.432 -2.895 -9.083 1.00 0.00 C ATOM 0 H PHE A 76 6.074 -1.313 -5.193 1.00 0.00 H new ATOM 0 HA PHE A 76 6.378 -4.121 -5.753 1.00 0.00 H new ATOM 0 HB2 PHE A 76 8.091 -1.925 -4.571 1.00 0.00 H new ATOM 0 HB3 PHE A 76 8.627 -3.584 -4.394 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.225 -5.027 -6.721 1.00 0.00 H new ATOM 0 HD2 PHE A 76 8.912 -0.793 -6.461 1.00 0.00 H new ATOM 0 HE1 PHE A 76 9.037 -5.012 -9.061 1.00 0.00 H new ATOM 0 HE2 PHE A 76 9.726 -0.782 -8.801 1.00 0.00 H new ATOM 0 HZ PHE A 76 9.784 -2.889 -10.104 1.00 0.00 H new ATOM 1232 N VAL A 77 5.862 -3.287 -2.625 1.00 0.00 N ATOM 1233 CA VAL A 77 5.555 -3.891 -1.296 1.00 0.00 C ATOM 1234 C VAL A 77 4.295 -4.757 -1.424 1.00 0.00 C ATOM 1235 O VAL A 77 4.183 -5.797 -0.805 1.00 0.00 O ATOM 1236 CB VAL A 77 5.343 -2.773 -0.259 1.00 0.00 C ATOM 1237 CG1 VAL A 77 4.618 -3.323 0.977 1.00 0.00 C ATOM 1238 CG2 VAL A 77 6.707 -2.211 0.169 1.00 0.00 C ATOM 0 H VAL A 77 5.756 -2.274 -2.681 1.00 0.00 H new ATOM 0 HA VAL A 77 6.385 -4.515 -0.965 1.00 0.00 H new ATOM 0 HB VAL A 77 4.737 -1.986 -0.708 1.00 0.00 H new ATOM 0 HG11 VAL A 77 4.475 -2.521 1.702 1.00 0.00 H new ATOM 0 HG12 VAL A 77 3.648 -3.723 0.682 1.00 0.00 H new ATOM 0 HG13 VAL A 77 5.216 -4.116 1.426 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.560 -1.419 0.903 1.00 0.00 H new ATOM 0 HG22 VAL A 77 7.307 -3.008 0.609 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.224 -1.807 -0.702 1.00 0.00 H new ATOM 1248 N SER A 78 3.352 -4.345 -2.225 1.00 0.00 N ATOM 1249 CA SER A 78 2.114 -5.158 -2.389 1.00 0.00 C ATOM 1250 C SER A 78 2.469 -6.492 -3.054 1.00 0.00 C ATOM 1251 O SER A 78 2.082 -7.548 -2.593 1.00 0.00 O ATOM 1252 CB SER A 78 1.118 -4.402 -3.269 1.00 0.00 C ATOM 1253 OG SER A 78 1.452 -4.604 -4.636 1.00 0.00 O ATOM 0 H SER A 78 3.384 -3.484 -2.771 1.00 0.00 H new ATOM 0 HA SER A 78 1.667 -5.342 -1.412 1.00 0.00 H new ATOM 0 HB2 SER A 78 0.104 -4.752 -3.075 1.00 0.00 H new ATOM 0 HB3 SER A 78 1.139 -3.339 -3.031 1.00 0.00 H new ATOM 0 HG SER A 78 2.280 -4.123 -4.845 1.00 0.00 H new ATOM 1259 N MET A 79 3.184 -6.449 -4.144 1.00 0.00 N ATOM 1260 CA MET A 79 3.545 -7.711 -4.856 1.00 0.00 C ATOM 1261 C MET A 79 4.157 -8.723 -3.881 1.00 0.00 C ATOM 1262 O MET A 79 3.908 -9.907 -3.977 1.00 0.00 O ATOM 1263 CB MET A 79 4.558 -7.402 -5.963 1.00 0.00 C ATOM 1264 CG MET A 79 3.958 -6.405 -6.958 1.00 0.00 C ATOM 1265 SD MET A 79 5.276 -5.725 -7.999 1.00 0.00 S ATOM 1266 CE MET A 79 5.804 -7.282 -8.759 1.00 0.00 C ATOM 0 H MET A 79 3.535 -5.594 -4.575 1.00 0.00 H new ATOM 0 HA MET A 79 2.640 -8.138 -5.288 1.00 0.00 H new ATOM 0 HB2 MET A 79 5.470 -6.991 -5.529 1.00 0.00 H new ATOM 0 HB3 MET A 79 4.837 -8.321 -6.479 1.00 0.00 H new ATOM 0 HG2 MET A 79 3.209 -6.899 -7.577 1.00 0.00 H new ATOM 0 HG3 MET A 79 3.451 -5.602 -6.424 1.00 0.00 H new ATOM 0 HE1 MET A 79 6.351 -7.071 -9.678 1.00 0.00 H new ATOM 0 HE2 MET A 79 6.451 -7.823 -8.068 1.00 0.00 H new ATOM 0 HE3 MET A 79 4.929 -7.890 -8.988 1.00 0.00 H new ATOM 1276 N VAL A 80 4.956 -8.278 -2.951 1.00 0.00 N ATOM 1277 CA VAL A 80 5.576 -9.241 -1.990 1.00 0.00 C ATOM 1278 C VAL A 80 4.516 -9.753 -1.014 1.00 0.00 C ATOM 1279 O VAL A 80 4.497 -10.917 -0.668 1.00 0.00 O ATOM 1280 CB VAL A 80 6.691 -8.540 -1.203 1.00 0.00 C ATOM 1281 CG1 VAL A 80 7.301 -9.514 -0.191 1.00 0.00 C ATOM 1282 CG2 VAL A 80 7.784 -8.070 -2.165 1.00 0.00 C ATOM 0 H VAL A 80 5.207 -7.299 -2.813 1.00 0.00 H new ATOM 0 HA VAL A 80 5.993 -10.080 -2.547 1.00 0.00 H new ATOM 0 HB VAL A 80 6.270 -7.682 -0.678 1.00 0.00 H new ATOM 0 HG11 VAL A 80 8.092 -9.012 0.366 1.00 0.00 H new ATOM 0 HG12 VAL A 80 6.529 -9.851 0.500 1.00 0.00 H new ATOM 0 HG13 VAL A 80 7.717 -10.373 -0.718 1.00 0.00 H new ATOM 0 HG21 VAL A 80 8.574 -7.573 -1.603 1.00 0.00 H new ATOM 0 HG22 VAL A 80 8.199 -8.929 -2.692 1.00 0.00 H new ATOM 0 HG23 VAL A 80 7.358 -7.373 -2.887 1.00 0.00 H new ATOM 1292 N THR A 81 3.626 -8.908 -0.577 1.00 0.00 N ATOM 1293 CA THR A 81 2.570 -9.380 0.362 1.00 0.00 C ATOM 1294 C THR A 81 1.644 -10.340 -0.388 1.00 0.00 C ATOM 1295 O THR A 81 1.303 -11.400 0.097 1.00 0.00 O ATOM 1296 CB THR A 81 1.766 -8.183 0.878 1.00 0.00 C ATOM 1297 OG1 THR A 81 2.659 -7.193 1.366 1.00 0.00 O ATOM 1298 CG2 THR A 81 0.835 -8.635 2.006 1.00 0.00 C ATOM 0 H THR A 81 3.583 -7.920 -0.826 1.00 0.00 H new ATOM 0 HA THR A 81 3.026 -9.890 1.210 1.00 0.00 H new ATOM 0 HB THR A 81 1.170 -7.768 0.065 1.00 0.00 H new ATOM 0 HG1 THR A 81 3.056 -6.710 0.611 1.00 0.00 H new ATOM 0 HG21 THR A 81 0.264 -7.781 2.371 1.00 0.00 H new ATOM 0 HG22 THR A 81 0.150 -9.395 1.630 1.00 0.00 H new ATOM 0 HG23 THR A 81 1.427 -9.051 2.821 1.00 0.00 H new ATOM 1306 N THR A 82 1.243 -9.973 -1.576 1.00 0.00 N ATOM 1307 CA THR A 82 0.346 -10.852 -2.378 1.00 0.00 C ATOM 1308 C THR A 82 1.136 -12.054 -2.905 1.00 0.00 C ATOM 1309 O THR A 82 0.568 -13.053 -3.300 1.00 0.00 O ATOM 1310 CB THR A 82 -0.227 -10.063 -3.558 1.00 0.00 C ATOM 1311 OG1 THR A 82 0.816 -9.344 -4.199 1.00 0.00 O ATOM 1312 CG2 THR A 82 -1.287 -9.083 -3.052 1.00 0.00 C ATOM 0 H THR A 82 1.501 -9.095 -2.027 1.00 0.00 H new ATOM 0 HA THR A 82 -0.469 -11.204 -1.746 1.00 0.00 H new ATOM 0 HB THR A 82 -0.682 -10.753 -4.269 1.00 0.00 H new ATOM 0 HG1 THR A 82 1.125 -8.623 -3.612 1.00 0.00 H new ATOM 0 HG21 THR A 82 -1.694 -8.522 -3.893 1.00 0.00 H new ATOM 0 HG22 THR A 82 -2.089 -9.635 -2.562 1.00 0.00 H new ATOM 0 HG23 THR A 82 -0.834 -8.393 -2.340 1.00 0.00 H new ATOM 1320 N ALA A 83 2.440 -11.967 -2.917 1.00 0.00 N ATOM 1321 CA ALA A 83 3.256 -13.110 -3.423 1.00 0.00 C ATOM 1322 C ALA A 83 2.843 -14.382 -2.686 1.00 0.00 C ATOM 1323 O ALA A 83 2.890 -15.470 -3.225 1.00 0.00 O ATOM 1324 CB ALA A 83 4.742 -12.839 -3.172 1.00 0.00 C ATOM 0 H ALA A 83 2.974 -11.158 -2.600 1.00 0.00 H new ATOM 0 HA ALA A 83 3.089 -13.229 -4.494 1.00 0.00 H new ATOM 0 HB1 ALA A 83 5.332 -13.677 -3.543 1.00 0.00 H new ATOM 0 HB2 ALA A 83 5.038 -11.928 -3.691 1.00 0.00 H new ATOM 0 HB3 ALA A 83 4.914 -12.720 -2.102 1.00 0.00 H new ATOM 1330 N CYS A 84 2.430 -14.249 -1.457 1.00 0.00 N ATOM 1331 CA CYS A 84 2.003 -15.448 -0.680 1.00 0.00 C ATOM 1332 C CYS A 84 0.650 -15.932 -1.207 1.00 0.00 C ATOM 1333 O CYS A 84 -0.152 -15.152 -1.682 1.00 0.00 O ATOM 1334 CB CYS A 84 1.866 -15.074 0.798 1.00 0.00 C ATOM 1335 SG CYS A 84 1.681 -16.578 1.789 1.00 0.00 S ATOM 0 H CYS A 84 2.369 -13.363 -0.956 1.00 0.00 H new ATOM 0 HA CYS A 84 2.745 -16.239 -0.788 1.00 0.00 H new ATOM 0 HB2 CYS A 84 2.743 -14.516 1.125 1.00 0.00 H new ATOM 0 HB3 CYS A 84 1.003 -14.424 0.941 1.00 0.00 H new ATOM 0 HG CYS A 84 0.751 -17.326 1.274 1.00 0.00 H new ATOM 1341 N HIS A 85 0.386 -17.210 -1.128 1.00 0.00 N ATOM 1342 CA HIS A 85 -0.920 -17.730 -1.626 1.00 0.00 C ATOM 1343 C HIS A 85 -2.051 -16.874 -1.052 1.00 0.00 C ATOM 1344 O HIS A 85 -1.823 -15.992 -0.249 1.00 0.00 O ATOM 1345 CB HIS A 85 -1.104 -19.184 -1.179 1.00 0.00 C ATOM 1346 CG HIS A 85 -0.993 -19.269 0.318 1.00 0.00 C ATOM 1347 ND1 HIS A 85 -0.580 -18.195 1.089 1.00 0.00 N ATOM 1348 CD2 HIS A 85 -1.238 -20.293 1.201 1.00 0.00 C ATOM 1349 CE1 HIS A 85 -0.588 -18.592 2.374 1.00 0.00 C ATOM 1350 NE2 HIS A 85 -0.982 -19.862 2.499 1.00 0.00 N ATOM 0 H HIS A 85 1.016 -17.913 -0.742 1.00 0.00 H new ATOM 0 HA HIS A 85 -0.938 -17.686 -2.715 1.00 0.00 H new ATOM 0 HB2 HIS A 85 -2.076 -19.555 -1.503 1.00 0.00 H new ATOM 0 HB3 HIS A 85 -0.350 -19.817 -1.646 1.00 0.00 H new ATOM 0 HD2 HIS A 85 -1.577 -21.282 0.929 1.00 0.00 H new ATOM 0 HE1 HIS A 85 -0.309 -17.960 3.204 1.00 0.00 H new ATOM 0 HE2 HIS A 85 -1.075 -20.400 3.360 1.00 0.00 H new ATOM 1358 N GLU A 86 -3.267 -17.125 -1.458 1.00 0.00 N ATOM 1359 CA GLU A 86 -4.418 -16.325 -0.938 1.00 0.00 C ATOM 1360 C GLU A 86 -4.283 -16.141 0.576 1.00 0.00 C ATOM 1361 O GLU A 86 -4.576 -17.032 1.348 1.00 0.00 O ATOM 1362 CB GLU A 86 -5.724 -17.062 -1.246 1.00 0.00 C ATOM 1363 CG GLU A 86 -6.041 -16.941 -2.738 1.00 0.00 C ATOM 1364 CD GLU A 86 -7.117 -17.962 -3.119 1.00 0.00 C ATOM 1365 OE1 GLU A 86 -6.795 -19.137 -3.183 1.00 0.00 O ATOM 1366 OE2 GLU A 86 -8.244 -17.550 -3.341 1.00 0.00 O ATOM 0 H GLU A 86 -3.515 -17.852 -2.129 1.00 0.00 H new ATOM 0 HA GLU A 86 -4.423 -15.346 -1.418 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -5.636 -18.112 -0.966 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -6.538 -16.642 -0.655 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -6.385 -15.932 -2.966 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -5.139 -17.111 -3.327 1.00 0.00 H new ATOM 1373 N PHE A 87 -3.838 -14.991 1.009 1.00 0.00 N ATOM 1374 CA PHE A 87 -3.687 -14.760 2.471 1.00 0.00 C ATOM 1375 C PHE A 87 -5.067 -14.758 3.126 1.00 0.00 C ATOM 1376 O PHE A 87 -5.207 -15.036 4.300 1.00 0.00 O ATOM 1377 CB PHE A 87 -2.985 -13.423 2.725 1.00 0.00 C ATOM 1378 CG PHE A 87 -3.673 -12.319 1.960 1.00 0.00 C ATOM 1379 CD1 PHE A 87 -4.740 -11.628 2.544 1.00 0.00 C ATOM 1380 CD2 PHE A 87 -3.235 -11.974 0.675 1.00 0.00 C ATOM 1381 CE1 PHE A 87 -5.370 -10.591 1.846 1.00 0.00 C ATOM 1382 CE2 PHE A 87 -3.868 -10.940 -0.026 1.00 0.00 C ATOM 1383 CZ PHE A 87 -4.936 -10.247 0.560 1.00 0.00 C ATOM 0 H PHE A 87 -3.574 -14.206 0.414 1.00 0.00 H new ATOM 0 HA PHE A 87 -3.081 -15.557 2.901 1.00 0.00 H new ATOM 0 HB2 PHE A 87 -2.993 -13.196 3.791 1.00 0.00 H new ATOM 0 HB3 PHE A 87 -1.940 -13.489 2.421 1.00 0.00 H new ATOM 0 HD1 PHE A 87 -5.078 -11.895 3.534 1.00 0.00 H new ATOM 0 HD2 PHE A 87 -2.409 -12.505 0.225 1.00 0.00 H new ATOM 0 HE1 PHE A 87 -6.191 -10.056 2.300 1.00 0.00 H new ATOM 0 HE2 PHE A 87 -3.533 -10.677 -1.018 1.00 0.00 H new ATOM 0 HZ PHE A 87 -5.424 -9.449 0.020 1.00 0.00 H new ATOM 1393 N PHE A 88 -6.094 -14.457 2.376 1.00 0.00 N ATOM 1394 CA PHE A 88 -7.462 -14.453 2.966 1.00 0.00 C ATOM 1395 C PHE A 88 -7.687 -15.779 3.691 1.00 0.00 C ATOM 1396 O PHE A 88 -8.227 -15.831 4.778 1.00 0.00 O ATOM 1397 CB PHE A 88 -8.502 -14.303 1.856 1.00 0.00 C ATOM 1398 CG PHE A 88 -8.148 -13.123 0.980 1.00 0.00 C ATOM 1399 CD1 PHE A 88 -8.378 -11.818 1.435 1.00 0.00 C ATOM 1400 CD2 PHE A 88 -7.596 -13.334 -0.290 1.00 0.00 C ATOM 1401 CE1 PHE A 88 -8.054 -10.726 0.619 1.00 0.00 C ATOM 1402 CE2 PHE A 88 -7.273 -12.242 -1.104 1.00 0.00 C ATOM 1403 CZ PHE A 88 -7.503 -10.939 -0.650 1.00 0.00 C ATOM 0 H PHE A 88 -6.044 -14.215 1.386 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.560 -13.621 3.664 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.542 -15.213 1.257 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -9.492 -14.162 2.289 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -8.805 -11.654 2.414 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -7.419 -14.340 -0.641 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -8.229 -9.720 0.969 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -6.846 -12.405 -2.083 1.00 0.00 H new ATOM 0 HZ PHE A 88 -7.255 -10.097 -1.279 1.00 0.00 H new ATOM 1413 N GLU A 89 -7.261 -16.854 3.083 1.00 0.00 N ATOM 1414 CA GLU A 89 -7.423 -18.197 3.707 1.00 0.00 C ATOM 1415 C GLU A 89 -6.146 -18.533 4.474 1.00 0.00 C ATOM 1416 O GLU A 89 -5.582 -19.600 4.330 1.00 0.00 O ATOM 1417 CB GLU A 89 -7.661 -19.241 2.609 1.00 0.00 C ATOM 1418 CG GLU A 89 -8.254 -20.512 3.223 1.00 0.00 C ATOM 1419 CD GLU A 89 -8.365 -21.595 2.148 1.00 0.00 C ATOM 1420 OE1 GLU A 89 -8.497 -21.240 0.989 1.00 0.00 O ATOM 1421 OE2 GLU A 89 -8.316 -22.761 2.504 1.00 0.00 O ATOM 0 H GLU A 89 -6.803 -16.858 2.171 1.00 0.00 H new ATOM 0 HA GLU A 89 -8.274 -18.198 4.388 1.00 0.00 H new ATOM 0 HB2 GLU A 89 -8.338 -18.841 1.854 1.00 0.00 H new ATOM 0 HB3 GLU A 89 -6.723 -19.473 2.105 1.00 0.00 H new ATOM 0 HG2 GLU A 89 -7.625 -20.861 4.042 1.00 0.00 H new ATOM 0 HG3 GLU A 89 -9.237 -20.301 3.644 1.00 0.00 H new ATOM 1428 N HIS A 90 -5.684 -17.624 5.286 1.00 0.00 N ATOM 1429 CA HIS A 90 -4.442 -17.877 6.062 1.00 0.00 C ATOM 1430 C HIS A 90 -4.633 -19.114 6.939 1.00 0.00 C ATOM 1431 O HIS A 90 -4.925 -19.014 8.115 1.00 0.00 O ATOM 1432 CB HIS A 90 -4.142 -16.667 6.946 1.00 0.00 C ATOM 1433 CG HIS A 90 -2.807 -16.858 7.608 1.00 0.00 C ATOM 1434 ND1 HIS A 90 -2.686 -17.375 8.887 1.00 0.00 N ATOM 1435 CD2 HIS A 90 -1.527 -16.612 7.178 1.00 0.00 C ATOM 1436 CE1 HIS A 90 -1.374 -17.426 9.180 1.00 0.00 C ATOM 1437 NE2 HIS A 90 -0.623 -16.973 8.173 1.00 0.00 N ATOM 0 H HIS A 90 -6.116 -16.714 5.445 1.00 0.00 H new ATOM 0 HA HIS A 90 -3.611 -18.043 5.377 1.00 0.00 H new ATOM 0 HB2 HIS A 90 -4.137 -15.756 6.347 1.00 0.00 H new ATOM 0 HB3 HIS A 90 -4.921 -16.549 7.699 1.00 0.00 H new ATOM 0 HD2 HIS A 90 -1.262 -16.201 6.215 1.00 0.00 H new ATOM 0 HE1 HIS A 90 -0.976 -17.789 10.116 1.00 0.00 H new ATOM 0 HE2 HIS A 90 0.394 -16.906 8.140 1.00 0.00 H new ATOM 1445 N GLU A 91 -4.471 -20.280 6.378 1.00 0.00 N ATOM 1446 CA GLU A 91 -4.642 -21.521 7.183 1.00 0.00 C ATOM 1447 C GLU A 91 -3.787 -21.428 8.448 1.00 0.00 C ATOM 1448 O GLU A 91 -2.760 -20.771 8.399 1.00 0.00 O ATOM 1449 CB GLU A 91 -4.203 -22.731 6.355 1.00 0.00 C ATOM 1450 CG GLU A 91 -5.147 -22.908 5.162 1.00 0.00 C ATOM 1451 CD GLU A 91 -6.476 -23.496 5.641 1.00 0.00 C ATOM 1452 OE1 GLU A 91 -6.447 -24.323 6.537 1.00 0.00 O ATOM 1453 OE2 GLU A 91 -7.500 -23.111 5.100 1.00 0.00 O ATOM 1454 OXT GLU A 91 -4.175 -22.013 9.446 1.00 0.00 O ATOM 0 H GLU A 91 -4.228 -20.427 5.398 1.00 0.00 H new ATOM 0 HA GLU A 91 -5.690 -21.634 7.461 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -3.180 -22.593 6.005 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -4.210 -23.629 6.973 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -5.317 -21.948 4.675 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -4.693 -23.566 4.421 1.00 0.00 H new TER 1461 GLU A 91 ATOM 1462 N MET B 0 8.981 -7.769 16.086 1.00 0.00 N ATOM 1463 CA MET B 0 7.729 -7.189 15.529 1.00 0.00 C ATOM 1464 C MET B 0 7.764 -5.666 15.683 1.00 0.00 C ATOM 1465 O MET B 0 7.556 -5.135 16.756 1.00 0.00 O ATOM 1466 CB MET B 0 6.526 -7.761 16.284 1.00 0.00 C ATOM 1467 CG MET B 0 6.370 -9.245 15.938 1.00 0.00 C ATOM 1468 SD MET B 0 5.283 -10.042 17.149 1.00 0.00 S ATOM 1469 CE MET B 0 3.696 -9.529 16.440 1.00 0.00 C ATOM 0 H1 MET B 0 9.487 -8.285 15.338 1.00 0.00 H new ATOM 0 H2 MET B 0 9.586 -7.005 16.449 1.00 0.00 H new ATOM 0 H3 MET B 0 8.746 -8.423 16.860 1.00 0.00 H new ATOM 0 HA MET B 0 7.643 -7.442 14.472 1.00 0.00 H new ATOM 0 HB2 MET B 0 6.665 -7.639 17.358 1.00 0.00 H new ATOM 0 HB3 MET B 0 5.621 -7.216 16.015 1.00 0.00 H new ATOM 0 HG2 MET B 0 5.955 -9.353 14.936 1.00 0.00 H new ATOM 0 HG3 MET B 0 7.345 -9.732 15.934 1.00 0.00 H new ATOM 0 HE1 MET B 0 2.882 -9.923 17.048 1.00 0.00 H new ATOM 0 HE2 MET B 0 3.641 -8.441 16.421 1.00 0.00 H new ATOM 0 HE3 MET B 0 3.610 -9.914 15.424 1.00 0.00 H new ATOM 1481 N SER B 1 8.027 -4.959 14.614 1.00 0.00 N ATOM 1482 CA SER B 1 8.076 -3.469 14.693 1.00 0.00 C ATOM 1483 C SER B 1 6.660 -2.909 14.560 1.00 0.00 C ATOM 1484 O SER B 1 5.717 -3.636 14.316 1.00 0.00 O ATOM 1485 CB SER B 1 8.945 -2.927 13.557 1.00 0.00 C ATOM 1486 OG SER B 1 8.283 -3.138 12.317 1.00 0.00 O ATOM 0 H SER B 1 8.210 -5.350 13.690 1.00 0.00 H new ATOM 0 HA SER B 1 8.500 -3.168 15.651 1.00 0.00 H new ATOM 0 HB2 SER B 1 9.135 -1.864 13.705 1.00 0.00 H new ATOM 0 HB3 SER B 1 9.914 -3.427 13.555 1.00 0.00 H new ATOM 0 HG SER B 1 8.837 -2.790 11.587 1.00 0.00 H new ATOM 1492 N GLU B 2 6.499 -1.625 14.720 1.00 0.00 N ATOM 1493 CA GLU B 2 5.140 -1.027 14.603 1.00 0.00 C ATOM 1494 C GLU B 2 4.605 -1.254 13.186 1.00 0.00 C ATOM 1495 O GLU B 2 3.419 -1.422 12.980 1.00 0.00 O ATOM 1496 CB GLU B 2 5.215 0.476 14.894 1.00 0.00 C ATOM 1497 CG GLU B 2 5.985 0.710 16.199 1.00 0.00 C ATOM 1498 CD GLU B 2 5.341 -0.097 17.329 1.00 0.00 C ATOM 1499 OE1 GLU B 2 4.163 0.105 17.578 1.00 0.00 O ATOM 1500 OE2 GLU B 2 6.035 -0.904 17.924 1.00 0.00 O ATOM 0 H GLU B 2 7.249 -0.965 14.926 1.00 0.00 H new ATOM 0 HA GLU B 2 4.470 -1.499 15.322 1.00 0.00 H new ATOM 0 HB2 GLU B 2 5.710 0.992 14.071 1.00 0.00 H new ATOM 0 HB3 GLU B 2 4.211 0.892 14.973 1.00 0.00 H new ATOM 0 HG2 GLU B 2 7.027 0.414 16.076 1.00 0.00 H new ATOM 0 HG3 GLU B 2 5.982 1.771 16.449 1.00 0.00 H new ATOM 1507 N LEU B 3 5.471 -1.251 12.207 1.00 0.00 N ATOM 1508 CA LEU B 3 5.015 -1.458 10.801 1.00 0.00 C ATOM 1509 C LEU B 3 4.401 -2.857 10.656 1.00 0.00 C ATOM 1510 O LEU B 3 3.288 -3.010 10.194 1.00 0.00 O ATOM 1511 CB LEU B 3 6.223 -1.312 9.851 1.00 0.00 C ATOM 1512 CG LEU B 3 5.763 -0.818 8.472 1.00 0.00 C ATOM 1513 CD1 LEU B 3 6.977 -0.675 7.551 1.00 0.00 C ATOM 1514 CD2 LEU B 3 4.777 -1.819 7.861 1.00 0.00 C ATOM 0 H LEU B 3 6.475 -1.114 12.321 1.00 0.00 H new ATOM 0 HA LEU B 3 4.260 -0.714 10.546 1.00 0.00 H new ATOM 0 HB2 LEU B 3 6.943 -0.612 10.274 1.00 0.00 H new ATOM 0 HB3 LEU B 3 6.732 -2.271 9.750 1.00 0.00 H new ATOM 0 HG LEU B 3 5.271 0.148 8.584 1.00 0.00 H new ATOM 0 HD11 LEU B 3 6.651 -0.324 6.572 1.00 0.00 H new ATOM 0 HD12 LEU B 3 7.676 0.043 7.980 1.00 0.00 H new ATOM 0 HD13 LEU B 3 7.469 -1.642 7.445 1.00 0.00 H new ATOM 0 HD21 LEU B 3 4.455 -1.462 6.883 1.00 0.00 H new ATOM 0 HD22 LEU B 3 5.264 -2.788 7.751 1.00 0.00 H new ATOM 0 HD23 LEU B 3 3.910 -1.920 8.514 1.00 0.00 H new ATOM 1526 N GLU B 4 5.113 -3.879 11.048 1.00 0.00 N ATOM 1527 CA GLU B 4 4.562 -5.259 10.925 1.00 0.00 C ATOM 1528 C GLU B 4 3.179 -5.319 11.575 1.00 0.00 C ATOM 1529 O GLU B 4 2.230 -5.822 11.006 1.00 0.00 O ATOM 1530 CB GLU B 4 5.501 -6.243 11.624 1.00 0.00 C ATOM 1531 CG GLU B 4 6.896 -6.138 11.003 1.00 0.00 C ATOM 1532 CD GLU B 4 7.855 -7.085 11.727 1.00 0.00 C ATOM 1533 OE1 GLU B 4 7.443 -8.191 12.036 1.00 0.00 O ATOM 1534 OE2 GLU B 4 8.986 -6.689 11.957 1.00 0.00 O ATOM 0 H GLU B 4 6.050 -3.818 11.447 1.00 0.00 H new ATOM 0 HA GLU B 4 4.475 -5.524 9.871 1.00 0.00 H new ATOM 0 HB2 GLU B 4 5.548 -6.024 12.691 1.00 0.00 H new ATOM 0 HB3 GLU B 4 5.121 -7.260 11.524 1.00 0.00 H new ATOM 0 HG2 GLU B 4 6.853 -6.389 9.943 1.00 0.00 H new ATOM 0 HG3 GLU B 4 7.260 -5.113 11.073 1.00 0.00 H new ATOM 1541 N LYS B 5 3.063 -4.798 12.765 1.00 0.00 N ATOM 1542 CA LYS B 5 1.751 -4.804 13.468 1.00 0.00 C ATOM 1543 C LYS B 5 0.668 -4.266 12.535 1.00 0.00 C ATOM 1544 O LYS B 5 -0.444 -4.753 12.497 1.00 0.00 O ATOM 1545 CB LYS B 5 1.842 -3.888 14.690 1.00 0.00 C ATOM 1546 CG LYS B 5 0.534 -3.965 15.482 1.00 0.00 C ATOM 1547 CD LYS B 5 0.653 -3.115 16.747 1.00 0.00 C ATOM 1548 CE LYS B 5 -0.731 -2.931 17.372 1.00 0.00 C ATOM 1549 NZ LYS B 5 -1.565 -2.073 16.486 1.00 0.00 N ATOM 0 H LYS B 5 3.827 -4.365 13.284 1.00 0.00 H new ATOM 0 HA LYS B 5 1.504 -5.821 13.771 1.00 0.00 H new ATOM 0 HB2 LYS B 5 2.680 -4.186 15.320 1.00 0.00 H new ATOM 0 HB3 LYS B 5 2.030 -2.861 14.375 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -0.296 -3.611 14.870 1.00 0.00 H new ATOM 0 HG3 LYS B 5 0.317 -5.000 15.746 1.00 0.00 H new ATOM 0 HD2 LYS B 5 1.324 -3.596 17.459 1.00 0.00 H new ATOM 0 HD3 LYS B 5 1.087 -2.144 16.506 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -1.210 -3.900 17.513 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -0.639 -2.474 18.357 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -2.291 -1.590 17.053 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -0.962 -1.365 16.020 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -2.026 -2.664 15.765 1.00 0.00 H new ATOM 1563 N ALA B 6 0.999 -3.246 11.793 1.00 0.00 N ATOM 1564 CA ALA B 6 0.022 -2.626 10.855 1.00 0.00 C ATOM 1565 C ALA B 6 -0.141 -3.481 9.592 1.00 0.00 C ATOM 1566 O ALA B 6 -1.186 -3.473 8.972 1.00 0.00 O ATOM 1567 CB ALA B 6 0.521 -1.224 10.474 1.00 0.00 C ATOM 0 H ALA B 6 1.921 -2.809 11.797 1.00 0.00 H new ATOM 0 HA ALA B 6 -0.949 -2.558 11.345 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -0.187 -0.760 9.787 1.00 0.00 H new ATOM 0 HB2 ALA B 6 0.609 -0.613 11.372 1.00 0.00 H new ATOM 0 HB3 ALA B 6 1.495 -1.303 9.992 1.00 0.00 H new ATOM 1573 N MET B 7 0.857 -4.223 9.205 1.00 0.00 N ATOM 1574 CA MET B 7 0.700 -5.067 7.988 1.00 0.00 C ATOM 1575 C MET B 7 -0.414 -6.088 8.242 1.00 0.00 C ATOM 1576 O MET B 7 -1.283 -6.296 7.417 1.00 0.00 O ATOM 1577 CB MET B 7 2.019 -5.792 7.684 1.00 0.00 C ATOM 1578 CG MET B 7 2.052 -6.204 6.208 1.00 0.00 C ATOM 1579 SD MET B 7 2.399 -4.745 5.192 1.00 0.00 S ATOM 1580 CE MET B 7 1.420 -5.226 3.748 1.00 0.00 C ATOM 0 H MET B 7 1.763 -4.283 9.670 1.00 0.00 H new ATOM 0 HA MET B 7 0.441 -4.444 7.132 1.00 0.00 H new ATOM 0 HB2 MET B 7 2.864 -5.141 7.909 1.00 0.00 H new ATOM 0 HB3 MET B 7 2.117 -6.672 8.320 1.00 0.00 H new ATOM 0 HG2 MET B 7 2.816 -6.964 6.047 1.00 0.00 H new ATOM 0 HG3 MET B 7 1.098 -6.645 5.919 1.00 0.00 H new ATOM 0 HE1 MET B 7 1.710 -4.616 2.892 1.00 0.00 H new ATOM 0 HE2 MET B 7 1.598 -6.277 3.522 1.00 0.00 H new ATOM 0 HE3 MET B 7 0.361 -5.074 3.959 1.00 0.00 H new ATOM 1590 N VAL B 8 -0.389 -6.726 9.382 1.00 0.00 N ATOM 1591 CA VAL B 8 -1.437 -7.737 9.705 1.00 0.00 C ATOM 1592 C VAL B 8 -2.788 -7.042 9.935 1.00 0.00 C ATOM 1593 O VAL B 8 -3.829 -7.565 9.592 1.00 0.00 O ATOM 1594 CB VAL B 8 -1.029 -8.500 10.973 1.00 0.00 C ATOM 1595 CG1 VAL B 8 -1.820 -9.806 11.065 1.00 0.00 C ATOM 1596 CG2 VAL B 8 0.467 -8.820 10.912 1.00 0.00 C ATOM 0 H VAL B 8 0.316 -6.589 10.107 1.00 0.00 H new ATOM 0 HA VAL B 8 -1.535 -8.432 8.871 1.00 0.00 H new ATOM 0 HB VAL B 8 -1.240 -7.885 11.848 1.00 0.00 H new ATOM 0 HG11 VAL B 8 -1.528 -10.345 11.966 1.00 0.00 H new ATOM 0 HG12 VAL B 8 -2.886 -9.584 11.105 1.00 0.00 H new ATOM 0 HG13 VAL B 8 -1.610 -10.421 10.190 1.00 0.00 H new ATOM 0 HG21 VAL B 8 0.760 -9.362 11.811 1.00 0.00 H new ATOM 0 HG22 VAL B 8 0.672 -9.434 10.035 1.00 0.00 H new ATOM 0 HG23 VAL B 8 1.035 -7.892 10.846 1.00 0.00 H new ATOM 1606 N ALA B 9 -2.780 -5.870 10.512 1.00 0.00 N ATOM 1607 CA ALA B 9 -4.064 -5.147 10.760 1.00 0.00 C ATOM 1608 C ALA B 9 -4.771 -4.885 9.428 1.00 0.00 C ATOM 1609 O ALA B 9 -5.947 -5.140 9.272 1.00 0.00 O ATOM 1610 CB ALA B 9 -3.756 -3.803 11.420 1.00 0.00 C ATOM 0 H ALA B 9 -1.941 -5.381 10.823 1.00 0.00 H new ATOM 0 HA ALA B 9 -4.703 -5.751 11.405 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -4.687 -3.267 11.605 1.00 0.00 H new ATOM 0 HB2 ALA B 9 -3.240 -3.972 12.365 1.00 0.00 H new ATOM 0 HB3 ALA B 9 -3.121 -3.211 10.761 1.00 0.00 H new ATOM 1616 N LEU B 10 -4.057 -4.351 8.477 1.00 0.00 N ATOM 1617 CA LEU B 10 -4.668 -4.037 7.155 1.00 0.00 C ATOM 1618 C LEU B 10 -5.392 -5.259 6.609 1.00 0.00 C ATOM 1619 O LEU B 10 -6.569 -5.232 6.311 1.00 0.00 O ATOM 1620 CB LEU B 10 -3.538 -3.675 6.175 1.00 0.00 C ATOM 1621 CG LEU B 10 -3.048 -2.233 6.431 1.00 0.00 C ATOM 1622 CD1 LEU B 10 -1.600 -2.087 5.954 1.00 0.00 C ATOM 1623 CD2 LEU B 10 -3.923 -1.230 5.663 1.00 0.00 C ATOM 0 H LEU B 10 -3.068 -4.117 8.560 1.00 0.00 H new ATOM 0 HA LEU B 10 -5.374 -3.215 7.269 1.00 0.00 H new ATOM 0 HB2 LEU B 10 -2.709 -4.374 6.291 1.00 0.00 H new ATOM 0 HB3 LEU B 10 -3.893 -3.769 5.149 1.00 0.00 H new ATOM 0 HG LEU B 10 -3.112 -2.030 7.500 1.00 0.00 H new ATOM 0 HD11 LEU B 10 -1.258 -1.068 6.136 1.00 0.00 H new ATOM 0 HD12 LEU B 10 -0.965 -2.786 6.499 1.00 0.00 H new ATOM 0 HD13 LEU B 10 -1.545 -2.303 4.887 1.00 0.00 H new ATOM 0 HD21 LEU B 10 -3.567 -0.217 5.852 1.00 0.00 H new ATOM 0 HD22 LEU B 10 -3.867 -1.441 4.595 1.00 0.00 H new ATOM 0 HD23 LEU B 10 -4.957 -1.319 5.996 1.00 0.00 H new ATOM 1635 N ILE B 11 -4.669 -6.328 6.461 1.00 0.00 N ATOM 1636 CA ILE B 11 -5.263 -7.571 5.909 1.00 0.00 C ATOM 1637 C ILE B 11 -6.505 -7.968 6.703 1.00 0.00 C ATOM 1638 O ILE B 11 -7.481 -8.424 6.142 1.00 0.00 O ATOM 1639 CB ILE B 11 -4.234 -8.700 5.990 1.00 0.00 C ATOM 1640 CG1 ILE B 11 -3.033 -8.355 5.108 1.00 0.00 C ATOM 1641 CG2 ILE B 11 -4.864 -10.002 5.493 1.00 0.00 C ATOM 1642 CD1 ILE B 11 -1.879 -9.315 5.408 1.00 0.00 C ATOM 0 H ILE B 11 -3.680 -6.394 6.702 1.00 0.00 H new ATOM 0 HA ILE B 11 -5.548 -7.395 4.872 1.00 0.00 H new ATOM 0 HB ILE B 11 -3.910 -8.822 7.024 1.00 0.00 H new ATOM 0 HG12 ILE B 11 -3.311 -8.423 4.056 1.00 0.00 H new ATOM 0 HG13 ILE B 11 -2.720 -7.327 5.289 1.00 0.00 H new ATOM 0 HG21 ILE B 11 -4.131 -10.806 5.551 1.00 0.00 H new ATOM 0 HG22 ILE B 11 -5.724 -10.250 6.114 1.00 0.00 H new ATOM 0 HG23 ILE B 11 -5.187 -9.879 4.459 1.00 0.00 H new ATOM 0 HD11 ILE B 11 -1.025 -9.066 4.778 1.00 0.00 H new ATOM 0 HD12 ILE B 11 -1.594 -9.225 6.456 1.00 0.00 H new ATOM 0 HD13 ILE B 11 -2.194 -10.338 5.204 1.00 0.00 H new ATOM 1654 N ASP B 12 -6.480 -7.832 8.003 1.00 0.00 N ATOM 1655 CA ASP B 12 -7.671 -8.245 8.794 1.00 0.00 C ATOM 1656 C ASP B 12 -8.831 -7.282 8.531 1.00 0.00 C ATOM 1657 O ASP B 12 -9.970 -7.694 8.450 1.00 0.00 O ATOM 1658 CB ASP B 12 -7.334 -8.280 10.286 1.00 0.00 C ATOM 1659 CG ASP B 12 -6.398 -9.456 10.572 1.00 0.00 C ATOM 1660 OD1 ASP B 12 -6.288 -10.321 9.719 1.00 0.00 O ATOM 1661 OD2 ASP B 12 -5.805 -9.471 11.639 1.00 0.00 O ATOM 0 H ASP B 12 -5.699 -7.459 8.542 1.00 0.00 H new ATOM 0 HA ASP B 12 -7.969 -9.247 8.486 1.00 0.00 H new ATOM 0 HB2 ASP B 12 -6.861 -7.344 10.585 1.00 0.00 H new ATOM 0 HB3 ASP B 12 -8.247 -8.377 10.873 1.00 0.00 H new ATOM 1666 N VAL B 13 -8.568 -6.007 8.385 1.00 0.00 N ATOM 1667 CA VAL B 13 -9.693 -5.068 8.117 1.00 0.00 C ATOM 1668 C VAL B 13 -10.233 -5.346 6.717 1.00 0.00 C ATOM 1669 O VAL B 13 -11.428 -5.375 6.506 1.00 0.00 O ATOM 1670 CB VAL B 13 -9.227 -3.616 8.235 1.00 0.00 C ATOM 1671 CG1 VAL B 13 -10.396 -2.676 7.939 1.00 0.00 C ATOM 1672 CG2 VAL B 13 -8.710 -3.359 9.652 1.00 0.00 C ATOM 0 H VAL B 13 -7.641 -5.585 8.439 1.00 0.00 H new ATOM 0 HA VAL B 13 -10.481 -5.221 8.854 1.00 0.00 H new ATOM 0 HB VAL B 13 -8.427 -3.434 7.518 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -10.062 -1.642 8.024 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -10.762 -2.858 6.928 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -11.199 -2.857 8.654 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -8.378 -2.324 9.736 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -9.509 -3.543 10.370 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -7.874 -4.026 9.861 1.00 0.00 H new ATOM 1682 N PHE B 14 -9.382 -5.579 5.761 1.00 0.00 N ATOM 1683 CA PHE B 14 -9.894 -5.880 4.399 1.00 0.00 C ATOM 1684 C PHE B 14 -10.748 -7.148 4.474 1.00 0.00 C ATOM 1685 O PHE B 14 -11.734 -7.295 3.774 1.00 0.00 O ATOM 1686 CB PHE B 14 -8.726 -6.106 3.438 1.00 0.00 C ATOM 1687 CG PHE B 14 -9.268 -6.364 2.052 1.00 0.00 C ATOM 1688 CD1 PHE B 14 -9.753 -7.634 1.716 1.00 0.00 C ATOM 1689 CD2 PHE B 14 -9.293 -5.332 1.106 1.00 0.00 C ATOM 1690 CE1 PHE B 14 -10.262 -7.873 0.433 1.00 0.00 C ATOM 1691 CE2 PHE B 14 -9.802 -5.571 -0.175 1.00 0.00 C ATOM 1692 CZ PHE B 14 -10.287 -6.840 -0.511 1.00 0.00 C ATOM 0 H PHE B 14 -8.367 -5.574 5.861 1.00 0.00 H new ATOM 0 HA PHE B 14 -10.489 -5.043 4.034 1.00 0.00 H new ATOM 0 HB2 PHE B 14 -8.072 -5.234 3.430 1.00 0.00 H new ATOM 0 HB3 PHE B 14 -8.125 -6.952 3.770 1.00 0.00 H new ATOM 0 HD1 PHE B 14 -9.735 -8.429 2.446 1.00 0.00 H new ATOM 0 HD2 PHE B 14 -8.920 -4.352 1.365 1.00 0.00 H new ATOM 0 HE1 PHE B 14 -10.635 -8.853 0.173 1.00 0.00 H new ATOM 0 HE2 PHE B 14 -9.821 -4.776 -0.905 1.00 0.00 H new ATOM 0 HZ PHE B 14 -10.681 -7.022 -1.500 1.00 0.00 H new ATOM 1702 N HIS B 15 -10.373 -8.067 5.324 1.00 0.00 N ATOM 1703 CA HIS B 15 -11.152 -9.331 5.454 1.00 0.00 C ATOM 1704 C HIS B 15 -12.434 -9.076 6.253 1.00 0.00 C ATOM 1705 O HIS B 15 -13.447 -9.714 6.046 1.00 0.00 O ATOM 1706 CB HIS B 15 -10.303 -10.380 6.175 1.00 0.00 C ATOM 1707 CG HIS B 15 -11.000 -11.711 6.119 1.00 0.00 C ATOM 1708 ND1 HIS B 15 -11.566 -12.299 7.239 1.00 0.00 N ATOM 1709 CD2 HIS B 15 -11.234 -12.579 5.082 1.00 0.00 C ATOM 1710 CE1 HIS B 15 -12.108 -13.468 6.854 1.00 0.00 C ATOM 1711 NE2 HIS B 15 -11.935 -13.688 5.548 1.00 0.00 N ATOM 0 H HIS B 15 -9.559 -7.996 5.935 1.00 0.00 H new ATOM 0 HA HIS B 15 -11.416 -9.692 4.460 1.00 0.00 H new ATOM 0 HB2 HIS B 15 -9.320 -10.452 5.709 1.00 0.00 H new ATOM 0 HB3 HIS B 15 -10.143 -10.084 7.212 1.00 0.00 H new ATOM 0 HD2 HIS B 15 -10.922 -12.425 4.060 1.00 0.00 H new ATOM 0 HE1 HIS B 15 -12.621 -14.146 7.520 1.00 0.00 H new ATOM 0 HE2 HIS B 15 -12.249 -14.495 5.008 1.00 0.00 H new ATOM 1719 N GLN B 16 -12.385 -8.152 7.176 1.00 0.00 N ATOM 1720 CA GLN B 16 -13.586 -7.854 8.010 1.00 0.00 C ATOM 1721 C GLN B 16 -14.784 -7.568 7.107 1.00 0.00 C ATOM 1722 O GLN B 16 -15.878 -8.037 7.349 1.00 0.00 O ATOM 1723 CB GLN B 16 -13.303 -6.630 8.887 1.00 0.00 C ATOM 1724 CG GLN B 16 -14.441 -6.441 9.894 1.00 0.00 C ATOM 1725 CD GLN B 16 -14.414 -7.573 10.924 1.00 0.00 C ATOM 1726 OE1 GLN B 16 -15.437 -8.147 11.238 1.00 0.00 O ATOM 1727 NE2 GLN B 16 -13.280 -7.921 11.468 1.00 0.00 N ATOM 0 H GLN B 16 -11.562 -7.589 7.389 1.00 0.00 H new ATOM 0 HA GLN B 16 -13.810 -8.714 8.642 1.00 0.00 H new ATOM 0 HB2 GLN B 16 -12.357 -6.759 9.413 1.00 0.00 H new ATOM 0 HB3 GLN B 16 -13.204 -5.740 8.265 1.00 0.00 H new ATOM 0 HG2 GLN B 16 -14.340 -5.478 10.395 1.00 0.00 H new ATOM 0 HG3 GLN B 16 -15.400 -6.431 9.376 1.00 0.00 H new ATOM 0 HE21 GLN B 16 -12.420 -7.440 11.206 1.00 0.00 H new ATOM 0 HE22 GLN B 16 -13.254 -8.674 12.156 1.00 0.00 H new ATOM 1736 N TYR B 17 -14.594 -6.808 6.066 1.00 0.00 N ATOM 1737 CA TYR B 17 -15.730 -6.504 5.157 1.00 0.00 C ATOM 1738 C TYR B 17 -16.090 -7.762 4.367 1.00 0.00 C ATOM 1739 O TYR B 17 -17.247 -8.101 4.215 1.00 0.00 O ATOM 1740 CB TYR B 17 -15.329 -5.391 4.186 1.00 0.00 C ATOM 1741 CG TYR B 17 -15.312 -4.065 4.913 1.00 0.00 C ATOM 1742 CD1 TYR B 17 -14.340 -3.820 5.889 1.00 0.00 C ATOM 1743 CD2 TYR B 17 -16.264 -3.080 4.612 1.00 0.00 C ATOM 1744 CE1 TYR B 17 -14.317 -2.594 6.565 1.00 0.00 C ATOM 1745 CE2 TYR B 17 -16.240 -1.854 5.287 1.00 0.00 C ATOM 1746 CZ TYR B 17 -15.266 -1.611 6.264 1.00 0.00 C ATOM 1747 OH TYR B 17 -15.242 -0.403 6.931 1.00 0.00 O ATOM 0 H TYR B 17 -13.703 -6.385 5.806 1.00 0.00 H new ATOM 0 HA TYR B 17 -16.589 -6.178 5.743 1.00 0.00 H new ATOM 0 HB2 TYR B 17 -14.345 -5.599 3.765 1.00 0.00 H new ATOM 0 HB3 TYR B 17 -16.031 -5.351 3.353 1.00 0.00 H new ATOM 0 HD1 TYR B 17 -13.606 -4.578 6.121 1.00 0.00 H new ATOM 0 HD2 TYR B 17 -17.016 -3.267 3.859 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -13.567 -2.407 7.319 1.00 0.00 H new ATOM 0 HE2 TYR B 17 -16.973 -1.095 5.055 1.00 0.00 H new ATOM 0 HH TYR B 17 -15.968 0.167 6.602 1.00 0.00 H new ATOM 1757 N SER B 18 -15.105 -8.456 3.855 1.00 0.00 N ATOM 1758 CA SER B 18 -15.384 -9.694 3.065 1.00 0.00 C ATOM 1759 C SER B 18 -15.231 -10.933 3.953 1.00 0.00 C ATOM 1760 O SER B 18 -14.453 -11.818 3.652 1.00 0.00 O ATOM 1761 CB SER B 18 -14.389 -9.786 1.906 1.00 0.00 C ATOM 1762 OG SER B 18 -14.820 -10.789 0.996 1.00 0.00 O ATOM 0 H SER B 18 -14.118 -8.218 3.950 1.00 0.00 H new ATOM 0 HA SER B 18 -16.404 -9.650 2.683 1.00 0.00 H new ATOM 0 HB2 SER B 18 -14.315 -8.825 1.398 1.00 0.00 H new ATOM 0 HB3 SER B 18 -13.394 -10.024 2.283 1.00 0.00 H new ATOM 0 HG SER B 18 -14.186 -10.850 0.251 1.00 0.00 H new ATOM 1768 N GLY B 19 -15.982 -11.026 5.032 1.00 0.00 N ATOM 1769 CA GLY B 19 -15.898 -12.231 5.927 1.00 0.00 C ATOM 1770 C GLY B 19 -17.265 -12.919 5.927 1.00 0.00 C ATOM 1771 O GLY B 19 -17.402 -14.061 6.317 1.00 0.00 O ATOM 0 H GLY B 19 -16.651 -10.317 5.331 1.00 0.00 H new ATOM 0 HA2 GLY B 19 -15.127 -12.915 5.573 1.00 0.00 H new ATOM 0 HA3 GLY B 19 -15.621 -11.935 6.939 1.00 0.00 H new ATOM 1775 N ARG B 20 -18.272 -12.236 5.459 1.00 0.00 N ATOM 1776 CA ARG B 20 -19.634 -12.838 5.385 1.00 0.00 C ATOM 1777 C ARG B 20 -19.603 -14.026 4.424 1.00 0.00 C ATOM 1778 O ARG B 20 -20.301 -15.001 4.627 1.00 0.00 O ATOM 1779 CB ARG B 20 -20.631 -11.789 4.885 1.00 0.00 C ATOM 1780 CG ARG B 20 -22.058 -12.241 5.192 1.00 0.00 C ATOM 1781 CD ARG B 20 -23.048 -11.251 4.574 1.00 0.00 C ATOM 1782 NE ARG B 20 -24.439 -11.733 4.800 1.00 0.00 N ATOM 1783 CZ ARG B 20 -24.810 -12.123 5.989 1.00 0.00 C ATOM 1784 NH1 ARG B 20 -24.702 -11.310 7.004 1.00 0.00 N ATOM 1785 NH2 ARG B 20 -25.278 -13.328 6.162 1.00 0.00 N ATOM 0 H ARG B 20 -18.209 -11.276 5.121 1.00 0.00 H new ATOM 0 HA ARG B 20 -19.943 -13.178 6.374 1.00 0.00 H new ATOM 0 HB2 ARG B 20 -20.433 -10.830 5.363 1.00 0.00 H new ATOM 0 HB3 ARG B 20 -20.510 -11.642 3.812 1.00 0.00 H new ATOM 0 HG2 ARG B 20 -22.229 -13.241 4.792 1.00 0.00 H new ATOM 0 HG3 ARG B 20 -22.209 -12.299 6.270 1.00 0.00 H new ATOM 0 HD2 ARG B 20 -22.917 -10.264 5.018 1.00 0.00 H new ATOM 0 HD3 ARG B 20 -22.857 -11.148 3.506 1.00 0.00 H new ATOM 0 HE ARG B 20 -25.102 -11.758 4.025 1.00 0.00 H new ATOM 0 HH11 ARG B 20 -24.328 -10.371 6.868 1.00 0.00 H new ATOM 0 HH12 ARG B 20 -24.992 -11.614 7.934 1.00 0.00 H new ATOM 0 HH21 ARG B 20 -25.354 -13.964 5.369 1.00 0.00 H new ATOM 0 HH22 ARG B 20 -25.568 -13.634 7.091 1.00 0.00 H new ATOM 1799 N GLU B 21 -18.787 -13.990 3.406 1.00 0.00 N ATOM 1800 CA GLU B 21 -18.715 -15.164 2.483 1.00 0.00 C ATOM 1801 C GLU B 21 -17.291 -15.290 1.950 1.00 0.00 C ATOM 1802 O GLU B 21 -16.731 -16.368 1.909 1.00 0.00 O ATOM 1803 CB GLU B 21 -19.682 -14.972 1.308 1.00 0.00 C ATOM 1804 CG GLU B 21 -21.119 -15.245 1.759 1.00 0.00 C ATOM 1805 CD GLU B 21 -22.039 -15.253 0.536 1.00 0.00 C ATOM 1806 OE1 GLU B 21 -21.573 -15.625 -0.529 1.00 0.00 O ATOM 1807 OE2 GLU B 21 -23.192 -14.883 0.683 1.00 0.00 O ATOM 0 H GLU B 21 -18.173 -13.210 3.173 1.00 0.00 H new ATOM 0 HA GLU B 21 -18.993 -16.067 3.026 1.00 0.00 H new ATOM 0 HB2 GLU B 21 -19.601 -13.956 0.922 1.00 0.00 H new ATOM 0 HB3 GLU B 21 -19.414 -15.645 0.493 1.00 0.00 H new ATOM 0 HG2 GLU B 21 -21.174 -16.203 2.277 1.00 0.00 H new ATOM 0 HG3 GLU B 21 -21.442 -14.481 2.466 1.00 0.00 H new ATOM 1814 N GLY B 22 -16.695 -14.198 1.546 1.00 0.00 N ATOM 1815 CA GLY B 22 -15.301 -14.253 1.018 1.00 0.00 C ATOM 1816 C GLY B 22 -15.167 -15.430 0.054 1.00 0.00 C ATOM 1817 O GLY B 22 -14.075 -15.863 -0.254 1.00 0.00 O ATOM 0 H GLY B 22 -17.116 -13.269 1.559 1.00 0.00 H new ATOM 0 HA2 GLY B 22 -15.057 -13.321 0.507 1.00 0.00 H new ATOM 0 HA3 GLY B 22 -14.593 -14.360 1.840 1.00 0.00 H new ATOM 1821 N ASP B 23 -16.265 -15.952 -0.426 1.00 0.00 N ATOM 1822 CA ASP B 23 -16.182 -17.102 -1.372 1.00 0.00 C ATOM 1823 C ASP B 23 -15.150 -16.759 -2.450 1.00 0.00 C ATOM 1824 O ASP B 23 -14.164 -17.448 -2.618 1.00 0.00 O ATOM 1825 CB ASP B 23 -17.553 -17.342 -2.008 1.00 0.00 C ATOM 1826 CG ASP B 23 -18.515 -17.885 -0.948 1.00 0.00 C ATOM 1827 OD1 ASP B 23 -18.072 -18.108 0.167 1.00 0.00 O ATOM 1828 OD2 ASP B 23 -19.678 -18.068 -1.268 1.00 0.00 O ATOM 0 H ASP B 23 -17.209 -15.634 -0.206 1.00 0.00 H new ATOM 0 HA ASP B 23 -15.882 -18.009 -0.847 1.00 0.00 H new ATOM 0 HB2 ASP B 23 -17.941 -16.413 -2.425 1.00 0.00 H new ATOM 0 HB3 ASP B 23 -17.465 -18.050 -2.832 1.00 0.00 H new ATOM 1833 N LYS B 24 -15.344 -15.671 -3.148 1.00 0.00 N ATOM 1834 CA LYS B 24 -14.345 -15.252 -4.173 1.00 0.00 C ATOM 1835 C LYS B 24 -13.354 -14.305 -3.489 1.00 0.00 C ATOM 1836 O LYS B 24 -13.519 -13.952 -2.338 1.00 0.00 O ATOM 1837 CB LYS B 24 -15.052 -14.523 -5.320 1.00 0.00 C ATOM 1838 CG LYS B 24 -15.762 -15.542 -6.220 1.00 0.00 C ATOM 1839 CD LYS B 24 -16.778 -16.352 -5.396 1.00 0.00 C ATOM 1840 CE LYS B 24 -17.859 -16.923 -6.322 1.00 0.00 C ATOM 1841 NZ LYS B 24 -18.725 -17.870 -5.562 1.00 0.00 N ATOM 0 H LYS B 24 -16.151 -15.055 -3.052 1.00 0.00 H new ATOM 0 HA LYS B 24 -13.828 -16.119 -4.584 1.00 0.00 H new ATOM 0 HB2 LYS B 24 -15.774 -13.811 -4.921 1.00 0.00 H new ATOM 0 HB3 LYS B 24 -14.328 -13.952 -5.901 1.00 0.00 H new ATOM 0 HG2 LYS B 24 -16.270 -15.028 -7.036 1.00 0.00 H new ATOM 0 HG3 LYS B 24 -15.031 -16.212 -6.672 1.00 0.00 H new ATOM 0 HD2 LYS B 24 -16.271 -17.162 -4.871 1.00 0.00 H new ATOM 0 HD3 LYS B 24 -17.234 -15.716 -4.637 1.00 0.00 H new ATOM 0 HE2 LYS B 24 -18.463 -16.114 -6.734 1.00 0.00 H new ATOM 0 HE3 LYS B 24 -17.395 -17.436 -7.165 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 -19.456 -18.255 -6.193 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 -18.145 -18.649 -5.190 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 -19.179 -17.368 -4.772 1.00 0.00 H new ATOM 1855 N HIS B 25 -12.344 -13.869 -4.197 1.00 0.00 N ATOM 1856 CA HIS B 25 -11.347 -12.914 -3.616 1.00 0.00 C ATOM 1857 C HIS B 25 -11.276 -11.701 -4.543 1.00 0.00 C ATOM 1858 O HIS B 25 -10.215 -11.279 -4.956 1.00 0.00 O ATOM 1859 CB HIS B 25 -9.976 -13.595 -3.530 1.00 0.00 C ATOM 1860 CG HIS B 25 -9.429 -13.830 -4.913 1.00 0.00 C ATOM 1861 ND1 HIS B 25 -9.979 -14.762 -5.779 1.00 0.00 N ATOM 1862 CD2 HIS B 25 -8.386 -13.256 -5.593 1.00 0.00 C ATOM 1863 CE1 HIS B 25 -9.269 -14.720 -6.922 1.00 0.00 C ATOM 1864 NE2 HIS B 25 -8.286 -13.819 -6.861 1.00 0.00 N ATOM 0 H HIS B 25 -12.164 -14.136 -5.165 1.00 0.00 H new ATOM 0 HA HIS B 25 -11.641 -12.606 -2.613 1.00 0.00 H new ATOM 0 HB2 HIS B 25 -9.287 -12.973 -2.959 1.00 0.00 H new ATOM 0 HB3 HIS B 25 -10.064 -14.543 -2.999 1.00 0.00 H new ATOM 0 HD2 HIS B 25 -7.740 -12.484 -5.203 1.00 0.00 H new ATOM 0 HE1 HIS B 25 -9.470 -15.340 -7.783 1.00 0.00 H new ATOM 0 HE2 HIS B 25 -7.607 -13.592 -7.588 1.00 0.00 H new ATOM 1872 N LYS B 26 -12.416 -11.149 -4.873 1.00 0.00 N ATOM 1873 CA LYS B 26 -12.461 -9.963 -5.779 1.00 0.00 C ATOM 1874 C LYS B 26 -13.362 -8.887 -5.169 1.00 0.00 C ATOM 1875 O LYS B 26 -14.344 -9.186 -4.520 1.00 0.00 O ATOM 1876 CB LYS B 26 -13.032 -10.386 -7.134 1.00 0.00 C ATOM 1877 CG LYS B 26 -12.033 -11.295 -7.852 1.00 0.00 C ATOM 1878 CD LYS B 26 -12.629 -11.751 -9.186 1.00 0.00 C ATOM 1879 CE LYS B 26 -11.776 -12.878 -9.769 1.00 0.00 C ATOM 1880 NZ LYS B 26 -10.336 -12.498 -9.698 1.00 0.00 N ATOM 0 H LYS B 26 -13.327 -11.474 -4.549 1.00 0.00 H new ATOM 0 HA LYS B 26 -11.454 -9.566 -5.908 1.00 0.00 H new ATOM 0 HB2 LYS B 26 -13.978 -10.908 -6.994 1.00 0.00 H new ATOM 0 HB3 LYS B 26 -13.241 -9.506 -7.743 1.00 0.00 H new ATOM 0 HG2 LYS B 26 -11.097 -10.763 -8.022 1.00 0.00 H new ATOM 0 HG3 LYS B 26 -11.799 -12.160 -7.231 1.00 0.00 H new ATOM 0 HD2 LYS B 26 -13.653 -12.094 -9.040 1.00 0.00 H new ATOM 0 HD3 LYS B 26 -12.670 -10.914 -9.883 1.00 0.00 H new ATOM 0 HE2 LYS B 26 -11.947 -13.802 -9.216 1.00 0.00 H new ATOM 0 HE3 LYS B 26 -12.063 -13.068 -10.803 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 -9.797 -13.048 -10.397 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 -10.234 -11.483 -9.903 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 -9.971 -12.697 -8.745 1.00 0.00 H new ATOM 1894 N LEU B 27 -13.036 -7.636 -5.381 1.00 0.00 N ATOM 1895 CA LEU B 27 -13.867 -6.519 -4.828 1.00 0.00 C ATOM 1896 C LEU B 27 -14.316 -5.634 -5.987 1.00 0.00 C ATOM 1897 O LEU B 27 -13.595 -5.450 -6.947 1.00 0.00 O ATOM 1898 CB LEU B 27 -13.025 -5.695 -3.851 1.00 0.00 C ATOM 1899 CG LEU B 27 -13.932 -4.745 -3.047 1.00 0.00 C ATOM 1900 CD1 LEU B 27 -14.732 -5.524 -1.981 1.00 0.00 C ATOM 1901 CD2 LEU B 27 -13.063 -3.689 -2.357 1.00 0.00 C ATOM 0 H LEU B 27 -12.222 -7.337 -5.918 1.00 0.00 H new ATOM 0 HA LEU B 27 -14.735 -6.918 -4.303 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -12.487 -6.358 -3.173 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -12.276 -5.121 -4.397 1.00 0.00 H new ATOM 0 HG LEU B 27 -14.636 -4.268 -3.730 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -15.366 -4.833 -1.425 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -15.354 -6.274 -2.469 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -14.042 -6.015 -1.295 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -13.698 -3.012 -1.785 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -12.359 -4.180 -1.685 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -12.513 -3.123 -3.109 1.00 0.00 H new ATOM 1913 N LYS B 28 -15.510 -5.098 -5.926 1.00 0.00 N ATOM 1914 CA LYS B 28 -16.002 -4.239 -7.046 1.00 0.00 C ATOM 1915 C LYS B 28 -15.710 -2.765 -6.745 1.00 0.00 C ATOM 1916 O LYS B 28 -15.645 -2.354 -5.604 1.00 0.00 O ATOM 1917 CB LYS B 28 -17.509 -4.446 -7.207 1.00 0.00 C ATOM 1918 CG LYS B 28 -17.773 -5.878 -7.674 1.00 0.00 C ATOM 1919 CD LYS B 28 -19.260 -6.203 -7.524 1.00 0.00 C ATOM 1920 CE LYS B 28 -19.495 -7.678 -7.857 1.00 0.00 C ATOM 1921 NZ LYS B 28 -20.859 -8.079 -7.408 1.00 0.00 N ATOM 0 H LYS B 28 -16.163 -5.218 -5.152 1.00 0.00 H new ATOM 0 HA LYS B 28 -15.491 -4.515 -7.968 1.00 0.00 H new ATOM 0 HB2 LYS B 28 -18.017 -4.260 -6.261 1.00 0.00 H new ATOM 0 HB3 LYS B 28 -17.911 -3.735 -7.929 1.00 0.00 H new ATOM 0 HG2 LYS B 28 -17.469 -5.993 -8.714 1.00 0.00 H new ATOM 0 HG3 LYS B 28 -17.177 -6.578 -7.088 1.00 0.00 H new ATOM 0 HD2 LYS B 28 -19.589 -5.992 -6.506 1.00 0.00 H new ATOM 0 HD3 LYS B 28 -19.850 -5.571 -8.187 1.00 0.00 H new ATOM 0 HE2 LYS B 28 -19.392 -7.840 -8.930 1.00 0.00 H new ATOM 0 HE3 LYS B 28 -18.743 -8.297 -7.367 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 -21.018 -9.081 -7.634 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 -20.942 -7.939 -6.381 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 -21.570 -7.497 -7.895 1.00 0.00 H new ATOM 1935 N LYS B 29 -15.546 -1.966 -7.763 1.00 0.00 N ATOM 1936 CA LYS B 29 -15.273 -0.516 -7.548 1.00 0.00 C ATOM 1937 C LYS B 29 -16.397 0.119 -6.715 1.00 0.00 C ATOM 1938 O LYS B 29 -16.162 0.969 -5.879 1.00 0.00 O ATOM 1939 CB LYS B 29 -15.164 0.195 -8.914 1.00 0.00 C ATOM 1940 CG LYS B 29 -16.504 0.209 -9.675 1.00 0.00 C ATOM 1941 CD LYS B 29 -16.936 -1.221 -10.035 1.00 0.00 C ATOM 1942 CE LYS B 29 -17.957 -1.185 -11.179 1.00 0.00 C ATOM 1943 NZ LYS B 29 -18.737 -2.454 -11.179 1.00 0.00 N ATOM 0 H LYS B 29 -15.590 -2.256 -8.740 1.00 0.00 H new ATOM 0 HA LYS B 29 -14.334 -0.406 -7.006 1.00 0.00 H new ATOM 0 HB2 LYS B 29 -14.825 1.220 -8.762 1.00 0.00 H new ATOM 0 HB3 LYS B 29 -14.409 -0.304 -9.522 1.00 0.00 H new ATOM 0 HG2 LYS B 29 -17.271 0.683 -9.063 1.00 0.00 H new ATOM 0 HG3 LYS B 29 -16.407 0.805 -10.583 1.00 0.00 H new ATOM 0 HD2 LYS B 29 -16.067 -1.809 -10.330 1.00 0.00 H new ATOM 0 HD3 LYS B 29 -17.371 -1.709 -9.163 1.00 0.00 H new ATOM 0 HE2 LYS B 29 -18.626 -0.333 -11.059 1.00 0.00 H new ATOM 0 HE3 LYS B 29 -17.447 -1.058 -12.134 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 -19.431 -2.435 -11.953 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 -18.091 -3.258 -11.313 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 -19.234 -2.556 -10.271 1.00 0.00 H new ATOM 1957 N SER B 30 -17.617 -0.274 -6.961 1.00 0.00 N ATOM 1958 CA SER B 30 -18.772 0.308 -6.221 1.00 0.00 C ATOM 1959 C SER B 30 -18.642 0.057 -4.716 1.00 0.00 C ATOM 1960 O SER B 30 -18.934 0.918 -3.901 1.00 0.00 O ATOM 1961 CB SER B 30 -20.061 -0.343 -6.724 1.00 0.00 C ATOM 1962 OG SER B 30 -19.896 -1.754 -6.748 1.00 0.00 O ATOM 0 H SER B 30 -17.865 -0.982 -7.652 1.00 0.00 H new ATOM 0 HA SER B 30 -18.791 1.384 -6.394 1.00 0.00 H new ATOM 0 HB2 SER B 30 -20.895 -0.074 -6.076 1.00 0.00 H new ATOM 0 HB3 SER B 30 -20.302 0.024 -7.722 1.00 0.00 H new ATOM 0 HG SER B 30 -20.721 -2.174 -7.068 1.00 0.00 H new ATOM 1968 N GLU B 31 -18.210 -1.117 -4.332 1.00 0.00 N ATOM 1969 CA GLU B 31 -18.084 -1.406 -2.874 1.00 0.00 C ATOM 1970 C GLU B 31 -16.803 -0.762 -2.356 1.00 0.00 C ATOM 1971 O GLU B 31 -16.737 -0.289 -1.240 1.00 0.00 O ATOM 1972 CB GLU B 31 -18.068 -2.917 -2.635 1.00 0.00 C ATOM 1973 CG GLU B 31 -19.462 -3.482 -2.912 1.00 0.00 C ATOM 1974 CD GLU B 31 -19.484 -4.977 -2.591 1.00 0.00 C ATOM 1975 OE1 GLU B 31 -19.188 -5.758 -3.480 1.00 0.00 O ATOM 1976 OE2 GLU B 31 -19.798 -5.316 -1.462 1.00 0.00 O ATOM 0 H GLU B 31 -17.943 -1.878 -4.956 1.00 0.00 H new ATOM 0 HA GLU B 31 -18.938 -0.992 -2.338 1.00 0.00 H new ATOM 0 HB2 GLU B 31 -17.333 -3.393 -3.285 1.00 0.00 H new ATOM 0 HB3 GLU B 31 -17.772 -3.132 -1.608 1.00 0.00 H new ATOM 0 HG2 GLU B 31 -20.204 -2.959 -2.308 1.00 0.00 H new ATOM 0 HG3 GLU B 31 -19.730 -3.320 -3.956 1.00 0.00 H new ATOM 1983 N LEU B 32 -15.789 -0.715 -3.178 1.00 0.00 N ATOM 1984 CA LEU B 32 -14.519 -0.072 -2.754 1.00 0.00 C ATOM 1985 C LEU B 32 -14.814 1.395 -2.448 1.00 0.00 C ATOM 1986 O LEU B 32 -14.324 1.937 -1.479 1.00 0.00 O ATOM 1987 CB LEU B 32 -13.481 -0.185 -3.879 1.00 0.00 C ATOM 1988 CG LEU B 32 -12.242 0.665 -3.563 1.00 0.00 C ATOM 1989 CD1 LEU B 32 -11.694 0.303 -2.179 1.00 0.00 C ATOM 1990 CD2 LEU B 32 -11.169 0.392 -4.622 1.00 0.00 C ATOM 0 H LEU B 32 -15.789 -1.095 -4.124 1.00 0.00 H new ATOM 0 HA LEU B 32 -14.116 -0.563 -1.868 1.00 0.00 H new ATOM 0 HB2 LEU B 32 -13.190 -1.227 -4.008 1.00 0.00 H new ATOM 0 HB3 LEU B 32 -13.922 0.142 -4.821 1.00 0.00 H new ATOM 0 HG LEU B 32 -12.516 1.720 -3.570 1.00 0.00 H new ATOM 0 HD11 LEU B 32 -10.815 0.912 -1.965 1.00 0.00 H new ATOM 0 HD12 LEU B 32 -12.458 0.491 -1.425 1.00 0.00 H new ATOM 0 HD13 LEU B 32 -11.418 -0.751 -2.161 1.00 0.00 H new ATOM 0 HD21 LEU B 32 -10.284 0.991 -4.407 1.00 0.00 H new ATOM 0 HD22 LEU B 32 -10.904 -0.665 -4.607 1.00 0.00 H new ATOM 0 HD23 LEU B 32 -11.555 0.655 -5.607 1.00 0.00 H new ATOM 2002 N LYS B 33 -15.592 2.060 -3.262 1.00 0.00 N ATOM 2003 CA LYS B 33 -15.865 3.493 -2.986 1.00 0.00 C ATOM 2004 C LYS B 33 -16.383 3.627 -1.558 1.00 0.00 C ATOM 2005 O LYS B 33 -15.812 4.321 -0.739 1.00 0.00 O ATOM 2006 CB LYS B 33 -16.912 4.021 -3.969 1.00 0.00 C ATOM 2007 CG LYS B 33 -17.043 5.536 -3.801 1.00 0.00 C ATOM 2008 CD LYS B 33 -17.909 6.108 -4.926 1.00 0.00 C ATOM 2009 CE LYS B 33 -18.125 7.605 -4.694 1.00 0.00 C ATOM 2010 NZ LYS B 33 -18.925 7.808 -3.453 1.00 0.00 N ATOM 0 H LYS B 33 -16.042 1.676 -4.093 1.00 0.00 H new ATOM 0 HA LYS B 33 -14.950 4.073 -3.104 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -16.622 3.781 -4.992 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -17.873 3.539 -3.789 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -17.488 5.767 -2.833 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -16.057 6.000 -3.817 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -17.426 5.945 -5.890 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -18.869 5.592 -4.959 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -17.164 8.112 -4.606 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -18.641 8.045 -5.547 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -19.397 8.734 -3.492 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -19.641 7.057 -3.375 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -18.296 7.774 -2.625 1.00 0.00 H new ATOM 2024 N GLU B 34 -17.462 2.961 -1.252 1.00 0.00 N ATOM 2025 CA GLU B 34 -18.011 3.048 0.133 1.00 0.00 C ATOM 2026 C GLU B 34 -16.893 2.743 1.132 1.00 0.00 C ATOM 2027 O GLU B 34 -16.807 3.349 2.180 1.00 0.00 O ATOM 2028 CB GLU B 34 -19.136 2.026 0.307 1.00 0.00 C ATOM 2029 CG GLU B 34 -20.274 2.352 -0.663 1.00 0.00 C ATOM 2030 CD GLU B 34 -21.309 1.226 -0.635 1.00 0.00 C ATOM 2031 OE1 GLU B 34 -22.010 1.116 0.358 1.00 0.00 O ATOM 2032 OE2 GLU B 34 -21.383 0.492 -1.606 1.00 0.00 O ATOM 0 H GLU B 34 -17.984 2.365 -1.894 1.00 0.00 H new ATOM 0 HA GLU B 34 -18.404 4.050 0.308 1.00 0.00 H new ATOM 0 HB2 GLU B 34 -18.761 1.020 0.119 1.00 0.00 H new ATOM 0 HB3 GLU B 34 -19.502 2.043 1.333 1.00 0.00 H new ATOM 0 HG2 GLU B 34 -20.742 3.297 -0.387 1.00 0.00 H new ATOM 0 HG3 GLU B 34 -19.881 2.474 -1.673 1.00 0.00 H new ATOM 2039 N LEU B 35 -16.037 1.808 0.822 1.00 0.00 N ATOM 2040 CA LEU B 35 -14.930 1.474 1.765 1.00 0.00 C ATOM 2041 C LEU B 35 -13.938 2.643 1.832 1.00 0.00 C ATOM 2042 O LEU B 35 -13.430 2.966 2.887 1.00 0.00 O ATOM 2043 CB LEU B 35 -14.224 0.195 1.297 1.00 0.00 C ATOM 2044 CG LEU B 35 -13.187 -0.267 2.341 1.00 0.00 C ATOM 2045 CD1 LEU B 35 -13.875 -1.002 3.501 1.00 0.00 C ATOM 2046 CD2 LEU B 35 -12.191 -1.218 1.672 1.00 0.00 C ATOM 0 H LEU B 35 -16.055 1.262 -0.040 1.00 0.00 H new ATOM 0 HA LEU B 35 -15.337 1.305 2.762 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -14.959 -0.593 1.133 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -13.731 0.374 0.342 1.00 0.00 H new ATOM 0 HG LEU B 35 -12.672 0.610 2.734 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -13.126 -1.319 4.226 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -14.587 -0.333 3.984 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -14.401 -1.876 3.117 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -11.455 -1.548 2.405 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -12.723 -2.083 1.277 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -11.685 -0.700 0.857 1.00 0.00 H new ATOM 2058 N ILE B 36 -13.670 3.302 0.734 1.00 0.00 N ATOM 2059 CA ILE B 36 -12.732 4.463 0.773 1.00 0.00 C ATOM 2060 C ILE B 36 -13.282 5.504 1.751 1.00 0.00 C ATOM 2061 O ILE B 36 -12.544 6.219 2.400 1.00 0.00 O ATOM 2062 CB ILE B 36 -12.632 5.077 -0.638 1.00 0.00 C ATOM 2063 CG1 ILE B 36 -11.837 4.117 -1.535 1.00 0.00 C ATOM 2064 CG2 ILE B 36 -11.914 6.441 -0.582 1.00 0.00 C ATOM 2065 CD1 ILE B 36 -11.799 4.643 -2.972 1.00 0.00 C ATOM 0 H ILE B 36 -14.059 3.087 -0.184 1.00 0.00 H new ATOM 0 HA ILE B 36 -11.742 4.141 1.097 1.00 0.00 H new ATOM 0 HB ILE B 36 -13.634 5.229 -1.039 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -10.822 4.008 -1.153 1.00 0.00 H new ATOM 0 HG13 ILE B 36 -12.293 3.127 -1.515 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -11.852 6.861 -1.586 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -12.473 7.120 0.061 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -10.909 6.307 -0.182 1.00 0.00 H new ATOM 0 HD11 ILE B 36 -11.232 3.953 -3.597 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -12.816 4.728 -3.355 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -11.322 5.623 -2.988 1.00 0.00 H new ATOM 2077 N ASN B 37 -14.580 5.616 1.825 1.00 0.00 N ATOM 2078 CA ASN B 37 -15.201 6.635 2.716 1.00 0.00 C ATOM 2079 C ASN B 37 -14.900 6.355 4.192 1.00 0.00 C ATOM 2080 O ASN B 37 -14.412 7.207 4.904 1.00 0.00 O ATOM 2081 CB ASN B 37 -16.717 6.620 2.511 1.00 0.00 C ATOM 2082 CG ASN B 37 -17.045 7.049 1.080 1.00 0.00 C ATOM 2083 OD1 ASN B 37 -16.482 6.533 0.135 1.00 0.00 O ATOM 2084 ND2 ASN B 37 -17.937 7.981 0.878 1.00 0.00 N ATOM 0 H ASN B 37 -15.241 5.041 1.303 1.00 0.00 H new ATOM 0 HA ASN B 37 -14.782 7.608 2.460 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -17.110 5.621 2.701 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -17.197 7.292 3.222 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -18.161 8.275 -0.073 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -18.410 8.415 1.671 1.00 0.00 H new ATOM 2091 N ASN B 38 -15.227 5.185 4.671 1.00 0.00 N ATOM 2092 CA ASN B 38 -15.001 4.883 6.119 1.00 0.00 C ATOM 2093 C ASN B 38 -13.537 4.521 6.401 1.00 0.00 C ATOM 2094 O ASN B 38 -13.204 4.137 7.504 1.00 0.00 O ATOM 2095 CB ASN B 38 -15.904 3.723 6.541 1.00 0.00 C ATOM 2096 CG ASN B 38 -17.369 4.110 6.332 1.00 0.00 C ATOM 2097 OD1 ASN B 38 -17.833 4.202 5.212 1.00 0.00 O ATOM 2098 ND2 ASN B 38 -18.124 4.340 7.371 1.00 0.00 N ATOM 0 H ASN B 38 -15.639 4.427 4.127 1.00 0.00 H new ATOM 0 HA ASN B 38 -15.241 5.778 6.693 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -15.666 2.833 5.958 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -15.729 3.475 7.588 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -19.103 4.597 7.243 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -17.735 4.263 8.311 1.00 0.00 H new ATOM 2105 N GLU B 39 -12.661 4.629 5.429 1.00 0.00 N ATOM 2106 CA GLU B 39 -11.217 4.277 5.667 1.00 0.00 C ATOM 2107 C GLU B 39 -10.316 5.476 5.349 1.00 0.00 C ATOM 2108 O GLU B 39 -9.241 5.604 5.902 1.00 0.00 O ATOM 2109 CB GLU B 39 -10.824 3.107 4.756 1.00 0.00 C ATOM 2110 CG GLU B 39 -11.477 1.809 5.253 1.00 0.00 C ATOM 2111 CD GLU B 39 -10.787 0.610 4.597 1.00 0.00 C ATOM 2112 OE1 GLU B 39 -9.984 0.829 3.705 1.00 0.00 O ATOM 2113 OE2 GLU B 39 -11.072 -0.505 5.000 1.00 0.00 O ATOM 0 H GLU B 39 -12.879 4.944 4.484 1.00 0.00 H new ATOM 0 HA GLU B 39 -11.091 4.001 6.714 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -11.137 3.312 3.732 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -9.740 2.995 4.741 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -11.396 1.740 6.338 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -12.540 1.808 5.012 1.00 0.00 H new ATOM 2120 N LEU B 40 -10.738 6.358 4.473 1.00 0.00 N ATOM 2121 CA LEU B 40 -9.896 7.556 4.129 1.00 0.00 C ATOM 2122 C LEU B 40 -10.673 8.844 4.430 1.00 0.00 C ATOM 2123 O LEU B 40 -10.411 9.886 3.860 1.00 0.00 O ATOM 2124 CB LEU B 40 -9.529 7.509 2.636 1.00 0.00 C ATOM 2125 CG LEU B 40 -8.358 6.525 2.404 1.00 0.00 C ATOM 2126 CD1 LEU B 40 -8.400 5.998 0.963 1.00 0.00 C ATOM 2127 CD2 LEU B 40 -7.013 7.234 2.641 1.00 0.00 C ATOM 0 H LEU B 40 -11.629 6.302 3.980 1.00 0.00 H new ATOM 0 HA LEU B 40 -8.986 7.542 4.729 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -10.395 7.199 2.051 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -9.251 8.505 2.291 1.00 0.00 H new ATOM 0 HG LEU B 40 -8.457 5.695 3.103 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -7.573 5.305 0.805 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -9.344 5.481 0.792 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -8.312 6.833 0.268 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -6.197 6.531 2.475 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -6.917 8.072 1.950 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -6.971 7.602 3.666 1.00 0.00 H new ATOM 2139 N SER B 41 -11.624 8.782 5.324 1.00 0.00 N ATOM 2140 CA SER B 41 -12.414 10.003 5.665 1.00 0.00 C ATOM 2141 C SER B 41 -11.556 10.961 6.494 1.00 0.00 C ATOM 2142 O SER B 41 -11.775 12.156 6.497 1.00 0.00 O ATOM 2143 CB SER B 41 -13.649 9.609 6.479 1.00 0.00 C ATOM 2144 OG SER B 41 -14.040 10.705 7.296 1.00 0.00 O ATOM 0 H SER B 41 -11.889 7.939 5.833 1.00 0.00 H new ATOM 0 HA SER B 41 -12.723 10.493 4.742 1.00 0.00 H new ATOM 0 HB2 SER B 41 -14.464 9.328 5.812 1.00 0.00 H new ATOM 0 HB3 SER B 41 -13.429 8.739 7.098 1.00 0.00 H new ATOM 0 HG SER B 41 -14.832 10.458 7.818 1.00 0.00 H new ATOM 2150 N HIS B 42 -10.586 10.454 7.202 1.00 0.00 N ATOM 2151 CA HIS B 42 -9.731 11.349 8.028 1.00 0.00 C ATOM 2152 C HIS B 42 -8.795 12.150 7.122 1.00 0.00 C ATOM 2153 O HIS B 42 -8.703 13.357 7.219 1.00 0.00 O ATOM 2154 CB HIS B 42 -8.896 10.511 8.994 1.00 0.00 C ATOM 2155 CG HIS B 42 -8.022 11.423 9.807 1.00 0.00 C ATOM 2156 ND1 HIS B 42 -6.925 12.071 9.262 1.00 0.00 N ATOM 2157 CD2 HIS B 42 -8.076 11.817 11.120 1.00 0.00 C ATOM 2158 CE1 HIS B 42 -6.369 12.814 10.235 1.00 0.00 C ATOM 2159 NE2 HIS B 42 -7.032 12.696 11.389 1.00 0.00 N ATOM 0 H HIS B 42 -10.349 9.463 7.244 1.00 0.00 H new ATOM 0 HA HIS B 42 -10.368 12.032 8.590 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -9.547 9.932 9.649 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -8.284 9.798 8.441 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -8.817 11.494 11.836 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -5.493 13.431 10.100 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -6.819 13.152 12.276 1.00 0.00 H new ATOM 2167 N PHE B 43 -8.096 11.486 6.245 1.00 0.00 N ATOM 2168 CA PHE B 43 -7.162 12.207 5.340 1.00 0.00 C ATOM 2169 C PHE B 43 -7.955 13.169 4.454 1.00 0.00 C ATOM 2170 O PHE B 43 -7.406 14.071 3.854 1.00 0.00 O ATOM 2171 CB PHE B 43 -6.413 11.193 4.474 1.00 0.00 C ATOM 2172 CG PHE B 43 -5.429 10.434 5.335 1.00 0.00 C ATOM 2173 CD1 PHE B 43 -5.843 9.287 6.025 1.00 0.00 C ATOM 2174 CD2 PHE B 43 -4.105 10.878 5.446 1.00 0.00 C ATOM 2175 CE1 PHE B 43 -4.933 8.586 6.827 1.00 0.00 C ATOM 2176 CE2 PHE B 43 -3.196 10.176 6.247 1.00 0.00 C ATOM 2177 CZ PHE B 43 -3.610 9.030 6.937 1.00 0.00 C ATOM 0 H PHE B 43 -8.132 10.475 6.116 1.00 0.00 H new ATOM 0 HA PHE B 43 -6.442 12.776 5.928 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -7.117 10.502 4.011 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -5.889 11.704 3.666 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -6.863 8.943 5.939 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -3.785 11.762 4.914 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -5.252 7.703 7.360 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -2.175 10.519 6.333 1.00 0.00 H new ATOM 0 HZ PHE B 43 -2.908 8.489 7.554 1.00 0.00 H new ATOM 2187 N LEU B 44 -9.243 12.975 4.364 1.00 0.00 N ATOM 2188 CA LEU B 44 -10.085 13.864 3.511 1.00 0.00 C ATOM 2189 C LEU B 44 -9.781 15.336 3.836 1.00 0.00 C ATOM 2190 O LEU B 44 -9.804 16.189 2.972 1.00 0.00 O ATOM 2191 CB LEU B 44 -11.572 13.549 3.781 1.00 0.00 C ATOM 2192 CG LEU B 44 -12.430 13.786 2.520 1.00 0.00 C ATOM 2193 CD1 LEU B 44 -12.206 15.210 1.997 1.00 0.00 C ATOM 2194 CD2 LEU B 44 -12.078 12.758 1.418 1.00 0.00 C ATOM 0 H LEU B 44 -9.752 12.235 4.847 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.864 13.691 2.458 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -11.674 12.513 4.104 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -11.937 14.175 4.595 1.00 0.00 H new ATOM 0 HG LEU B 44 -13.479 13.661 2.787 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -12.814 15.371 1.107 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -12.490 15.929 2.766 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -11.154 15.344 1.746 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -12.694 12.943 0.538 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -11.026 12.856 1.151 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -12.266 11.750 1.787 1.00 0.00 H new ATOM 2206 N GLU B 45 -9.502 15.644 5.073 1.00 0.00 N ATOM 2207 CA GLU B 45 -9.208 17.062 5.431 1.00 0.00 C ATOM 2208 C GLU B 45 -7.831 17.464 4.894 1.00 0.00 C ATOM 2209 O GLU B 45 -7.630 18.575 4.446 1.00 0.00 O ATOM 2210 CB GLU B 45 -9.228 17.227 6.953 1.00 0.00 C ATOM 2211 CG GLU B 45 -9.174 18.717 7.303 1.00 0.00 C ATOM 2212 CD GLU B 45 -9.153 18.884 8.823 1.00 0.00 C ATOM 2213 OE1 GLU B 45 -10.191 18.694 9.435 1.00 0.00 O ATOM 2214 OE2 GLU B 45 -8.099 19.201 9.350 1.00 0.00 O ATOM 0 H GLU B 45 -9.465 14.981 5.847 1.00 0.00 H new ATOM 0 HA GLU B 45 -9.969 17.703 4.985 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -10.130 16.777 7.367 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -8.380 16.707 7.398 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -8.286 19.172 6.864 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -10.038 19.232 6.882 1.00 0.00 H new ATOM 2221 N GLU B 46 -6.881 16.572 4.941 1.00 0.00 N ATOM 2222 CA GLU B 46 -5.514 16.906 4.441 1.00 0.00 C ATOM 2223 C GLU B 46 -5.431 16.668 2.929 1.00 0.00 C ATOM 2224 O GLU B 46 -4.623 15.886 2.467 1.00 0.00 O ATOM 2225 CB GLU B 46 -4.488 16.012 5.140 1.00 0.00 C ATOM 2226 CG GLU B 46 -4.331 16.444 6.599 1.00 0.00 C ATOM 2227 CD GLU B 46 -3.203 15.640 7.250 1.00 0.00 C ATOM 2228 OE1 GLU B 46 -2.522 14.927 6.533 1.00 0.00 O ATOM 2229 OE2 GLU B 46 -3.041 15.751 8.454 1.00 0.00 O ATOM 0 H GLU B 46 -6.990 15.625 5.304 1.00 0.00 H new ATOM 0 HA GLU B 46 -5.306 17.955 4.653 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -4.807 14.971 5.092 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -3.528 16.075 4.627 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -4.110 17.510 6.652 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -5.264 16.285 7.139 1.00 0.00 H new ATOM 2236 N ILE B 47 -6.253 17.335 2.153 1.00 0.00 N ATOM 2237 CA ILE B 47 -6.221 17.151 0.662 1.00 0.00 C ATOM 2238 C ILE B 47 -6.002 18.507 -0.010 1.00 0.00 C ATOM 2239 O ILE B 47 -6.877 19.350 -0.021 1.00 0.00 O ATOM 2240 CB ILE B 47 -7.556 16.572 0.178 1.00 0.00 C ATOM 2241 CG1 ILE B 47 -7.934 15.316 0.994 1.00 0.00 C ATOM 2242 CG2 ILE B 47 -7.452 16.229 -1.311 1.00 0.00 C ATOM 2243 CD1 ILE B 47 -7.111 14.091 0.563 1.00 0.00 C ATOM 0 H ILE B 47 -6.948 18.002 2.488 1.00 0.00 H new ATOM 0 HA ILE B 47 -5.411 16.468 0.405 1.00 0.00 H new ATOM 0 HB ILE B 47 -8.339 17.316 0.323 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -7.772 15.508 2.055 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -8.996 15.105 0.867 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -8.400 15.817 -1.657 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -7.220 17.131 -1.877 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -6.661 15.494 -1.461 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -7.405 13.227 1.159 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -7.293 13.883 -0.491 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -6.051 14.293 0.715 1.00 0.00 H new ATOM 2255 N LYS B 48 -4.845 18.726 -0.579 1.00 0.00 N ATOM 2256 CA LYS B 48 -4.580 20.031 -1.256 1.00 0.00 C ATOM 2257 C LYS B 48 -4.994 19.928 -2.726 1.00 0.00 C ATOM 2258 O LYS B 48 -5.633 20.810 -3.264 1.00 0.00 O ATOM 2259 CB LYS B 48 -3.086 20.359 -1.173 1.00 0.00 C ATOM 2260 CG LYS B 48 -2.625 20.346 0.290 1.00 0.00 C ATOM 2261 CD LYS B 48 -3.173 21.571 1.035 1.00 0.00 C ATOM 2262 CE LYS B 48 -2.385 21.776 2.332 1.00 0.00 C ATOM 2263 NZ LYS B 48 -3.008 22.873 3.123 1.00 0.00 N ATOM 0 H LYS B 48 -4.073 18.059 -0.604 1.00 0.00 H new ATOM 0 HA LYS B 48 -5.152 20.819 -0.765 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -2.513 19.632 -1.749 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -2.895 21.337 -1.614 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -2.967 19.433 0.778 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -1.536 20.342 0.335 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -3.095 22.457 0.406 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -4.231 21.431 1.258 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -2.375 20.854 2.914 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -1.347 22.021 2.105 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -2.473 23.013 4.004 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -2.995 23.752 2.567 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -3.991 22.622 3.351 1.00 0.00 H new ATOM 2277 N GLU B 49 -4.632 18.855 -3.381 1.00 0.00 N ATOM 2278 CA GLU B 49 -5.003 18.692 -4.818 1.00 0.00 C ATOM 2279 C GLU B 49 -6.398 18.067 -4.911 1.00 0.00 C ATOM 2280 O GLU B 49 -6.567 16.879 -4.714 1.00 0.00 O ATOM 2281 CB GLU B 49 -3.985 17.777 -5.509 1.00 0.00 C ATOM 2282 CG GLU B 49 -2.652 18.515 -5.679 1.00 0.00 C ATOM 2283 CD GLU B 49 -1.973 18.678 -4.318 1.00 0.00 C ATOM 2284 OE1 GLU B 49 -2.285 17.906 -3.426 1.00 0.00 O ATOM 2285 OE2 GLU B 49 -1.151 19.570 -4.191 1.00 0.00 O ATOM 0 H GLU B 49 -4.095 18.085 -2.982 1.00 0.00 H new ATOM 0 HA GLU B 49 -5.005 19.666 -5.308 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -3.837 16.872 -4.919 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -4.365 17.465 -6.482 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -2.002 17.960 -6.356 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -2.822 19.492 -6.130 1.00 0.00 H new ATOM 2292 N GLN B 50 -7.399 18.845 -5.218 1.00 0.00 N ATOM 2293 CA GLN B 50 -8.773 18.276 -5.328 1.00 0.00 C ATOM 2294 C GLN B 50 -8.942 17.606 -6.697 1.00 0.00 C ATOM 2295 O GLN B 50 -9.766 16.730 -6.871 1.00 0.00 O ATOM 2296 CB GLN B 50 -9.802 19.401 -5.178 1.00 0.00 C ATOM 2297 CG GLN B 50 -9.594 20.112 -3.838 1.00 0.00 C ATOM 2298 CD GLN B 50 -10.549 21.303 -3.737 1.00 0.00 C ATOM 2299 OE1 GLN B 50 -11.408 21.480 -4.578 1.00 0.00 O ATOM 2300 NE2 GLN B 50 -10.434 22.132 -2.736 1.00 0.00 N ATOM 0 H GLN B 50 -7.326 19.847 -5.397 1.00 0.00 H new ATOM 0 HA GLN B 50 -8.925 17.536 -4.542 1.00 0.00 H new ATOM 0 HB2 GLN B 50 -9.701 20.112 -5.998 1.00 0.00 H new ATOM 0 HB3 GLN B 50 -10.812 18.994 -5.232 1.00 0.00 H new ATOM 0 HG2 GLN B 50 -9.772 19.419 -3.015 1.00 0.00 H new ATOM 0 HG3 GLN B 50 -8.562 20.452 -3.751 1.00 0.00 H new ATOM 0 HE21 GLN B 50 -9.713 21.983 -2.030 1.00 0.00 H new ATOM 0 HE22 GLN B 50 -11.065 22.929 -2.659 1.00 0.00 H new ATOM 2309 N GLU B 51 -8.173 18.014 -7.672 1.00 0.00 N ATOM 2310 CA GLU B 51 -8.299 17.404 -9.030 1.00 0.00 C ATOM 2311 C GLU B 51 -7.688 15.995 -9.053 1.00 0.00 C ATOM 2312 O GLU B 51 -8.066 15.173 -9.863 1.00 0.00 O ATOM 2313 CB GLU B 51 -7.617 18.286 -10.076 1.00 0.00 C ATOM 2314 CG GLU B 51 -8.144 19.718 -9.966 1.00 0.00 C ATOM 2315 CD GLU B 51 -9.652 19.732 -10.229 1.00 0.00 C ATOM 2316 OE1 GLU B 51 -10.111 18.886 -10.979 1.00 0.00 O ATOM 2317 OE2 GLU B 51 -10.322 20.589 -9.676 1.00 0.00 O ATOM 0 H GLU B 51 -7.464 18.742 -7.588 1.00 0.00 H new ATOM 0 HA GLU B 51 -9.359 17.326 -9.270 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -6.537 18.273 -9.928 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -7.806 17.894 -11.075 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -7.934 20.118 -8.974 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -7.634 20.360 -10.684 1.00 0.00 H new ATOM 2324 N VAL B 52 -6.789 15.679 -8.161 1.00 0.00 N ATOM 2325 CA VAL B 52 -6.231 14.294 -8.150 1.00 0.00 C ATOM 2326 C VAL B 52 -7.313 13.358 -7.612 1.00 0.00 C ATOM 2327 O VAL B 52 -7.590 12.328 -8.191 1.00 0.00 O ATOM 2328 CB VAL B 52 -4.997 14.228 -7.239 1.00 0.00 C ATOM 2329 CG1 VAL B 52 -4.614 12.764 -6.988 1.00 0.00 C ATOM 2330 CG2 VAL B 52 -3.824 14.939 -7.915 1.00 0.00 C ATOM 0 H VAL B 52 -6.420 16.309 -7.448 1.00 0.00 H new ATOM 0 HA VAL B 52 -5.933 14.002 -9.157 1.00 0.00 H new ATOM 0 HB VAL B 52 -5.229 14.713 -6.291 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -3.738 12.723 -6.341 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -5.445 12.248 -6.507 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -4.387 12.279 -7.938 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -2.948 14.892 -7.268 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -3.601 14.451 -8.864 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -4.086 15.982 -8.096 1.00 0.00 H new ATOM 2340 N VAL B 53 -7.937 13.704 -6.526 1.00 0.00 N ATOM 2341 CA VAL B 53 -9.004 12.819 -5.985 1.00 0.00 C ATOM 2342 C VAL B 53 -10.143 12.738 -7.001 1.00 0.00 C ATOM 2343 O VAL B 53 -10.809 11.729 -7.127 1.00 0.00 O ATOM 2344 CB VAL B 53 -9.527 13.390 -4.666 1.00 0.00 C ATOM 2345 CG1 VAL B 53 -10.702 12.543 -4.170 1.00 0.00 C ATOM 2346 CG2 VAL B 53 -8.407 13.361 -3.624 1.00 0.00 C ATOM 0 H VAL B 53 -7.758 14.554 -5.991 1.00 0.00 H new ATOM 0 HA VAL B 53 -8.601 11.823 -5.804 1.00 0.00 H new ATOM 0 HB VAL B 53 -9.860 14.416 -4.821 1.00 0.00 H new ATOM 0 HG11 VAL B 53 -11.074 12.951 -3.230 1.00 0.00 H new ATOM 0 HG12 VAL B 53 -11.500 12.557 -4.912 1.00 0.00 H new ATOM 0 HG13 VAL B 53 -10.370 11.517 -4.014 1.00 0.00 H new ATOM 0 HG21 VAL B 53 -8.776 13.767 -2.682 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -8.078 12.333 -3.472 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -7.568 13.962 -3.975 1.00 0.00 H new ATOM 2356 N ASP B 54 -10.373 13.799 -7.727 1.00 0.00 N ATOM 2357 CA ASP B 54 -11.468 13.791 -8.735 1.00 0.00 C ATOM 2358 C ASP B 54 -11.212 12.685 -9.759 1.00 0.00 C ATOM 2359 O ASP B 54 -12.100 11.938 -10.119 1.00 0.00 O ATOM 2360 CB ASP B 54 -11.508 15.140 -9.455 1.00 0.00 C ATOM 2361 CG ASP B 54 -11.927 16.233 -8.471 1.00 0.00 C ATOM 2362 OD1 ASP B 54 -12.311 15.891 -7.365 1.00 0.00 O ATOM 2363 OD2 ASP B 54 -11.858 17.394 -8.840 1.00 0.00 O ATOM 0 H ASP B 54 -9.848 14.671 -7.664 1.00 0.00 H new ATOM 0 HA ASP B 54 -12.419 13.613 -8.233 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -10.528 15.370 -9.874 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -12.209 15.098 -10.289 1.00 0.00 H new ATOM 2368 N LYS B 55 -10.001 12.588 -10.243 1.00 0.00 N ATOM 2369 CA LYS B 55 -9.684 11.547 -11.260 1.00 0.00 C ATOM 2370 C LYS B 55 -9.725 10.161 -10.615 1.00 0.00 C ATOM 2371 O LYS B 55 -10.016 9.181 -11.270 1.00 0.00 O ATOM 2372 CB LYS B 55 -8.302 11.812 -11.866 1.00 0.00 C ATOM 2373 CG LYS B 55 -8.253 13.230 -12.456 1.00 0.00 C ATOM 2374 CD LYS B 55 -9.028 13.286 -13.779 1.00 0.00 C ATOM 2375 CE LYS B 55 -8.699 14.590 -14.510 1.00 0.00 C ATOM 2376 NZ LYS B 55 -9.328 14.570 -15.861 1.00 0.00 N ATOM 0 H LYS B 55 -9.219 13.186 -9.976 1.00 0.00 H new ATOM 0 HA LYS B 55 -10.428 11.586 -12.056 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -7.533 11.700 -11.102 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -8.089 11.078 -12.643 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -8.679 13.940 -11.747 1.00 0.00 H new ATOM 0 HG3 LYS B 55 -7.217 13.526 -12.621 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -8.766 12.431 -14.403 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -10.099 13.224 -13.588 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -9.065 15.443 -13.938 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -7.619 14.707 -14.601 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -9.106 15.455 -16.360 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -8.958 13.764 -16.404 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -10.359 14.477 -15.763 1.00 0.00 H new ATOM 2390 N VAL B 56 -9.483 10.061 -9.338 1.00 0.00 N ATOM 2391 CA VAL B 56 -9.563 8.730 -8.674 1.00 0.00 C ATOM 2392 C VAL B 56 -11.018 8.262 -8.703 1.00 0.00 C ATOM 2393 O VAL B 56 -11.330 7.198 -9.200 1.00 0.00 O ATOM 2394 CB VAL B 56 -9.109 8.862 -7.218 1.00 0.00 C ATOM 2395 CG1 VAL B 56 -9.298 7.523 -6.503 1.00 0.00 C ATOM 2396 CG2 VAL B 56 -7.627 9.256 -7.175 1.00 0.00 C ATOM 0 H VAL B 56 -9.234 10.839 -8.727 1.00 0.00 H new ATOM 0 HA VAL B 56 -8.924 8.014 -9.191 1.00 0.00 H new ATOM 0 HB VAL B 56 -9.703 9.629 -6.722 1.00 0.00 H new ATOM 0 HG11 VAL B 56 -8.975 7.615 -5.466 1.00 0.00 H new ATOM 0 HG12 VAL B 56 -10.350 7.241 -6.532 1.00 0.00 H new ATOM 0 HG13 VAL B 56 -8.703 6.757 -7.001 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -7.305 9.350 -6.138 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -7.032 8.489 -7.672 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -7.489 10.209 -7.685 1.00 0.00 H new ATOM 2406 N MET B 57 -11.908 9.047 -8.162 1.00 0.00 N ATOM 2407 CA MET B 57 -13.343 8.649 -8.141 1.00 0.00 C ATOM 2408 C MET B 57 -13.832 8.347 -9.561 1.00 0.00 C ATOM 2409 O MET B 57 -14.744 7.569 -9.754 1.00 0.00 O ATOM 2410 CB MET B 57 -14.178 9.785 -7.546 1.00 0.00 C ATOM 2411 CG MET B 57 -13.762 10.019 -6.092 1.00 0.00 C ATOM 2412 SD MET B 57 -14.296 8.619 -5.076 1.00 0.00 S ATOM 2413 CE MET B 57 -13.305 9.006 -3.612 1.00 0.00 C ATOM 0 H MET B 57 -11.703 9.949 -7.733 1.00 0.00 H new ATOM 0 HA MET B 57 -13.452 7.752 -7.531 1.00 0.00 H new ATOM 0 HB2 MET B 57 -14.037 10.697 -8.127 1.00 0.00 H new ATOM 0 HB3 MET B 57 -15.238 9.536 -7.596 1.00 0.00 H new ATOM 0 HG2 MET B 57 -12.680 10.137 -6.027 1.00 0.00 H new ATOM 0 HG3 MET B 57 -14.206 10.942 -5.720 1.00 0.00 H new ATOM 0 HE1 MET B 57 -13.483 8.255 -2.843 1.00 0.00 H new ATOM 0 HE2 MET B 57 -12.248 9.009 -3.878 1.00 0.00 H new ATOM 0 HE3 MET B 57 -13.586 9.988 -3.232 1.00 0.00 H new ATOM 2423 N GLU B 58 -13.223 8.933 -10.564 1.00 0.00 N ATOM 2424 CA GLU B 58 -13.647 8.647 -11.968 1.00 0.00 C ATOM 2425 C GLU B 58 -12.922 7.396 -12.470 1.00 0.00 C ATOM 2426 O GLU B 58 -13.479 6.611 -13.209 1.00 0.00 O ATOM 2427 CB GLU B 58 -13.346 9.843 -12.876 1.00 0.00 C ATOM 2428 CG GLU B 58 -14.073 9.671 -14.216 1.00 0.00 C ATOM 2429 CD GLU B 58 -13.444 10.592 -15.264 1.00 0.00 C ATOM 2430 OE1 GLU B 58 -12.227 10.639 -15.329 1.00 0.00 O ATOM 2431 OE2 GLU B 58 -14.191 11.233 -15.985 1.00 0.00 O ATOM 0 H GLU B 58 -12.453 9.595 -10.470 1.00 0.00 H new ATOM 0 HA GLU B 58 -14.723 8.472 -11.989 1.00 0.00 H new ATOM 0 HB2 GLU B 58 -13.665 10.767 -12.394 1.00 0.00 H new ATOM 0 HB3 GLU B 58 -12.272 9.925 -13.042 1.00 0.00 H new ATOM 0 HG2 GLU B 58 -14.010 8.634 -14.545 1.00 0.00 H new ATOM 0 HG3 GLU B 58 -15.131 9.905 -14.100 1.00 0.00 H new ATOM 2438 N THR B 59 -11.696 7.183 -12.075 1.00 0.00 N ATOM 2439 CA THR B 59 -10.989 5.958 -12.548 1.00 0.00 C ATOM 2440 C THR B 59 -11.655 4.741 -11.904 1.00 0.00 C ATOM 2441 O THR B 59 -11.933 3.762 -12.568 1.00 0.00 O ATOM 2442 CB THR B 59 -9.503 6.019 -12.181 1.00 0.00 C ATOM 2443 OG1 THR B 59 -9.025 7.344 -12.366 1.00 0.00 O ATOM 2444 CG2 THR B 59 -8.711 5.062 -13.076 1.00 0.00 C ATOM 0 H THR B 59 -11.161 7.792 -11.456 1.00 0.00 H new ATOM 0 HA THR B 59 -11.056 5.885 -13.633 1.00 0.00 H new ATOM 0 HB THR B 59 -9.376 5.727 -11.139 1.00 0.00 H new ATOM 0 HG1 THR B 59 -9.286 7.896 -11.599 1.00 0.00 H new ATOM 0 HG21 THR B 59 -7.654 5.108 -12.812 1.00 0.00 H new ATOM 0 HG22 THR B 59 -9.077 4.045 -12.934 1.00 0.00 H new ATOM 0 HG23 THR B 59 -8.837 5.351 -14.119 1.00 0.00 H new ATOM 2452 N LEU B 60 -11.959 4.795 -10.638 1.00 0.00 N ATOM 2453 CA LEU B 60 -12.656 3.645 -10.001 1.00 0.00 C ATOM 2454 C LEU B 60 -13.999 3.449 -10.706 1.00 0.00 C ATOM 2455 O LEU B 60 -14.281 2.392 -11.233 1.00 0.00 O ATOM 2456 CB LEU B 60 -12.892 3.951 -8.518 1.00 0.00 C ATOM 2457 CG LEU B 60 -11.548 4.192 -7.816 1.00 0.00 C ATOM 2458 CD1 LEU B 60 -11.803 4.588 -6.358 1.00 0.00 C ATOM 2459 CD2 LEU B 60 -10.694 2.913 -7.861 1.00 0.00 C ATOM 0 H LEU B 60 -11.756 5.581 -10.020 1.00 0.00 H new ATOM 0 HA LEU B 60 -12.053 2.741 -10.085 1.00 0.00 H new ATOM 0 HB2 LEU B 60 -13.529 4.830 -8.415 1.00 0.00 H new ATOM 0 HB3 LEU B 60 -13.416 3.121 -8.045 1.00 0.00 H new ATOM 0 HG LEU B 60 -11.014 4.993 -8.327 1.00 0.00 H new ATOM 0 HD11 LEU B 60 -10.851 4.760 -5.856 1.00 0.00 H new ATOM 0 HD12 LEU B 60 -12.399 5.500 -6.328 1.00 0.00 H new ATOM 0 HD13 LEU B 60 -12.340 3.786 -5.852 1.00 0.00 H new ATOM 0 HD21 LEU B 60 -9.742 3.093 -7.361 1.00 0.00 H new ATOM 0 HD22 LEU B 60 -11.222 2.105 -7.356 1.00 0.00 H new ATOM 0 HD23 LEU B 60 -10.511 2.634 -8.899 1.00 0.00 H new ATOM 2471 N ASP B 61 -14.825 4.459 -10.737 1.00 0.00 N ATOM 2472 CA ASP B 61 -16.136 4.314 -11.430 1.00 0.00 C ATOM 2473 C ASP B 61 -15.898 3.752 -12.837 1.00 0.00 C ATOM 2474 O ASP B 61 -16.789 3.202 -13.454 1.00 0.00 O ATOM 2475 CB ASP B 61 -16.812 5.683 -11.537 1.00 0.00 C ATOM 2476 CG ASP B 61 -18.246 5.510 -12.039 1.00 0.00 C ATOM 2477 OD1 ASP B 61 -18.417 5.326 -13.233 1.00 0.00 O ATOM 2478 OD2 ASP B 61 -19.150 5.565 -11.222 1.00 0.00 O ATOM 0 H ASP B 61 -14.651 5.372 -10.316 1.00 0.00 H new ATOM 0 HA ASP B 61 -16.778 3.638 -10.865 1.00 0.00 H new ATOM 0 HB2 ASP B 61 -16.813 6.176 -10.565 1.00 0.00 H new ATOM 0 HB3 ASP B 61 -16.252 6.324 -12.218 1.00 0.00 H new ATOM 2483 N GLU B 62 -14.697 3.890 -13.347 1.00 0.00 N ATOM 2484 CA GLU B 62 -14.381 3.371 -14.717 1.00 0.00 C ATOM 2485 C GLU B 62 -13.609 2.064 -14.603 1.00 0.00 C ATOM 2486 O GLU B 62 -12.660 1.808 -15.316 1.00 0.00 O ATOM 2487 CB GLU B 62 -13.521 4.368 -15.445 1.00 0.00 C ATOM 2488 CG GLU B 62 -14.335 5.617 -15.795 1.00 0.00 C ATOM 2489 CD GLU B 62 -13.385 6.739 -16.223 1.00 0.00 C ATOM 2490 OE1 GLU B 62 -12.403 6.952 -15.532 1.00 0.00 O ATOM 2491 OE2 GLU B 62 -13.657 7.366 -17.234 1.00 0.00 O ATOM 0 H GLU B 62 -13.917 4.343 -12.870 1.00 0.00 H new ATOM 0 HA GLU B 62 -15.313 3.210 -15.259 1.00 0.00 H new ATOM 0 HB2 GLU B 62 -12.668 4.644 -14.825 1.00 0.00 H new ATOM 0 HB3 GLU B 62 -13.122 3.919 -16.355 1.00 0.00 H new ATOM 0 HG2 GLU B 62 -15.037 5.394 -16.598 1.00 0.00 H new ATOM 0 HG3 GLU B 62 -14.925 5.933 -14.935 1.00 0.00 H new ATOM 2498 N ASP B 63 -14.027 1.258 -13.708 1.00 0.00 N ATOM 2499 CA ASP B 63 -13.374 -0.070 -13.475 1.00 0.00 C ATOM 2500 C ASP B 63 -13.067 -0.732 -14.824 1.00 0.00 C ATOM 2501 O ASP B 63 -12.078 -1.419 -14.986 1.00 0.00 O ATOM 2502 CB ASP B 63 -14.361 -0.953 -12.708 1.00 0.00 C ATOM 2503 CG ASP B 63 -13.637 -2.186 -12.163 1.00 0.00 C ATOM 2504 OD1 ASP B 63 -12.459 -2.077 -11.866 1.00 0.00 O ATOM 2505 OD2 ASP B 63 -14.275 -3.220 -12.050 1.00 0.00 O ATOM 0 H ASP B 63 -14.820 1.450 -13.095 1.00 0.00 H new ATOM 0 HA ASP B 63 -12.448 0.058 -12.914 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -14.806 -0.389 -11.888 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -15.176 -1.259 -13.364 1.00 0.00 H new ATOM 2510 N GLY B 64 -13.901 -0.483 -15.792 1.00 0.00 N ATOM 2511 CA GLY B 64 -13.694 -1.039 -17.162 1.00 0.00 C ATOM 2512 C GLY B 64 -13.472 -2.564 -17.156 1.00 0.00 C ATOM 2513 O GLY B 64 -13.479 -3.184 -18.203 1.00 0.00 O ATOM 0 H GLY B 64 -14.736 0.094 -15.692 1.00 0.00 H new ATOM 0 HA2 GLY B 64 -14.561 -0.804 -17.780 1.00 0.00 H new ATOM 0 HA3 GLY B 64 -12.834 -0.552 -17.621 1.00 0.00 H new ATOM 2517 N ASP B 65 -13.277 -3.183 -16.011 1.00 0.00 N ATOM 2518 CA ASP B 65 -13.059 -4.681 -15.982 1.00 0.00 C ATOM 2519 C ASP B 65 -14.276 -5.443 -15.388 1.00 0.00 C ATOM 2520 O ASP B 65 -14.532 -6.560 -15.794 1.00 0.00 O ATOM 2521 CB ASP B 65 -11.829 -4.986 -15.128 1.00 0.00 C ATOM 2522 CG ASP B 65 -11.964 -4.295 -13.772 1.00 0.00 C ATOM 2523 OD1 ASP B 65 -12.676 -4.819 -12.931 1.00 0.00 O ATOM 2524 OD2 ASP B 65 -11.351 -3.255 -13.596 1.00 0.00 O ATOM 0 H ASP B 65 -13.258 -2.725 -15.100 1.00 0.00 H new ATOM 0 HA ASP B 65 -12.923 -5.015 -17.011 1.00 0.00 H new ATOM 0 HB2 ASP B 65 -11.727 -6.062 -14.991 1.00 0.00 H new ATOM 0 HB3 ASP B 65 -10.927 -4.642 -15.635 1.00 0.00 H new ATOM 2529 N GLY B 66 -15.031 -4.896 -14.451 1.00 0.00 N ATOM 2530 CA GLY B 66 -16.204 -5.644 -13.887 1.00 0.00 C ATOM 2531 C GLY B 66 -15.865 -6.146 -12.479 1.00 0.00 C ATOM 2532 O GLY B 66 -16.738 -6.331 -11.654 1.00 0.00 O ATOM 0 H GLY B 66 -14.882 -3.967 -14.057 1.00 0.00 H new ATOM 0 HA2 GLY B 66 -17.079 -4.995 -13.852 1.00 0.00 H new ATOM 0 HA3 GLY B 66 -16.457 -6.485 -14.533 1.00 0.00 H new ATOM 2536 N GLU B 67 -14.604 -6.348 -12.187 1.00 0.00 N ATOM 2537 CA GLU B 67 -14.216 -6.816 -10.816 1.00 0.00 C ATOM 2538 C GLU B 67 -12.850 -6.231 -10.445 1.00 0.00 C ATOM 2539 O GLU B 67 -11.914 -6.302 -11.217 1.00 0.00 O ATOM 2540 CB GLU B 67 -14.143 -8.344 -10.790 1.00 0.00 C ATOM 2541 CG GLU B 67 -15.556 -8.929 -10.830 1.00 0.00 C ATOM 2542 CD GLU B 67 -15.480 -10.449 -10.675 1.00 0.00 C ATOM 2543 OE1 GLU B 67 -14.978 -11.092 -11.583 1.00 0.00 O ATOM 2544 OE2 GLU B 67 -15.922 -10.943 -9.652 1.00 0.00 O ATOM 0 H GLU B 67 -13.828 -6.210 -12.834 1.00 0.00 H new ATOM 0 HA GLU B 67 -14.964 -6.481 -10.097 1.00 0.00 H new ATOM 0 HB2 GLU B 67 -13.566 -8.705 -11.641 1.00 0.00 H new ATOM 0 HB3 GLU B 67 -13.626 -8.678 -9.890 1.00 0.00 H new ATOM 0 HG2 GLU B 67 -16.162 -8.501 -10.031 1.00 0.00 H new ATOM 0 HG3 GLU B 67 -16.042 -8.672 -11.771 1.00 0.00 H new ATOM 2551 N CYS B 68 -12.723 -5.656 -9.272 1.00 0.00 N ATOM 2552 CA CYS B 68 -11.410 -5.068 -8.848 1.00 0.00 C ATOM 2553 C CYS B 68 -10.753 -5.994 -7.816 1.00 0.00 C ATOM 2554 O CYS B 68 -11.353 -6.359 -6.825 1.00 0.00 O ATOM 2555 CB CYS B 68 -11.649 -3.684 -8.231 1.00 0.00 C ATOM 2556 SG CYS B 68 -12.947 -2.830 -9.161 1.00 0.00 S ATOM 0 H CYS B 68 -13.474 -5.568 -8.588 1.00 0.00 H new ATOM 0 HA CYS B 68 -10.753 -4.966 -9.711 1.00 0.00 H new ATOM 0 HB2 CYS B 68 -11.941 -3.785 -7.186 1.00 0.00 H new ATOM 0 HB3 CYS B 68 -10.728 -3.101 -8.250 1.00 0.00 H new ATOM 0 HG CYS B 68 -12.410 -2.142 -10.124 1.00 0.00 H new ATOM 2562 N ASP B 69 -9.529 -6.382 -8.049 1.00 0.00 N ATOM 2563 CA ASP B 69 -8.832 -7.293 -7.093 1.00 0.00 C ATOM 2564 C ASP B 69 -8.223 -6.480 -5.946 1.00 0.00 C ATOM 2565 O ASP B 69 -8.413 -5.285 -5.851 1.00 0.00 O ATOM 2566 CB ASP B 69 -7.723 -8.040 -7.836 1.00 0.00 C ATOM 2567 CG ASP B 69 -8.312 -8.745 -9.059 1.00 0.00 C ATOM 2568 OD1 ASP B 69 -8.463 -8.092 -10.078 1.00 0.00 O ATOM 2569 OD2 ASP B 69 -8.605 -9.924 -8.955 1.00 0.00 O ATOM 0 H ASP B 69 -8.979 -6.107 -8.863 1.00 0.00 H new ATOM 0 HA ASP B 69 -9.547 -8.005 -6.681 1.00 0.00 H new ATOM 0 HB2 ASP B 69 -6.944 -7.343 -8.145 1.00 0.00 H new ATOM 0 HB3 ASP B 69 -7.254 -8.768 -7.174 1.00 0.00 H new ATOM 2574 N PHE B 70 -7.480 -7.119 -5.080 1.00 0.00 N ATOM 2575 CA PHE B 70 -6.851 -6.371 -3.952 1.00 0.00 C ATOM 2576 C PHE B 70 -5.677 -5.555 -4.495 1.00 0.00 C ATOM 2577 O PHE B 70 -5.384 -4.480 -4.011 1.00 0.00 O ATOM 2578 CB PHE B 70 -6.359 -7.354 -2.885 1.00 0.00 C ATOM 2579 CG PHE B 70 -5.787 -6.596 -1.708 1.00 0.00 C ATOM 2580 CD1 PHE B 70 -4.504 -6.036 -1.786 1.00 0.00 C ATOM 2581 CD2 PHE B 70 -6.538 -6.457 -0.535 1.00 0.00 C ATOM 2582 CE1 PHE B 70 -3.977 -5.338 -0.693 1.00 0.00 C ATOM 2583 CE2 PHE B 70 -6.011 -5.760 0.558 1.00 0.00 C ATOM 2584 CZ PHE B 70 -4.730 -5.201 0.479 1.00 0.00 C ATOM 0 H PHE B 70 -7.283 -8.119 -5.105 1.00 0.00 H new ATOM 0 HA PHE B 70 -7.583 -5.703 -3.498 1.00 0.00 H new ATOM 0 HB2 PHE B 70 -7.182 -7.987 -2.555 1.00 0.00 H new ATOM 0 HB3 PHE B 70 -5.600 -8.012 -3.308 1.00 0.00 H new ATOM 0 HD1 PHE B 70 -3.922 -6.143 -2.690 1.00 0.00 H new ATOM 0 HD2 PHE B 70 -7.526 -6.889 -0.473 1.00 0.00 H new ATOM 0 HE1 PHE B 70 -2.989 -4.905 -0.754 1.00 0.00 H new ATOM 0 HE2 PHE B 70 -6.592 -5.653 1.462 1.00 0.00 H new ATOM 0 HZ PHE B 70 -4.323 -4.664 1.323 1.00 0.00 H new ATOM 2594 N GLN B 71 -5.006 -6.042 -5.498 1.00 0.00 N ATOM 2595 CA GLN B 71 -3.864 -5.269 -6.060 1.00 0.00 C ATOM 2596 C GLN B 71 -4.365 -3.894 -6.509 1.00 0.00 C ATOM 2597 O GLN B 71 -3.688 -2.898 -6.349 1.00 0.00 O ATOM 2598 CB GLN B 71 -3.280 -6.021 -7.256 1.00 0.00 C ATOM 2599 CG GLN B 71 -2.532 -7.260 -6.761 1.00 0.00 C ATOM 2600 CD GLN B 71 -1.931 -8.004 -7.954 1.00 0.00 C ATOM 2601 OE1 GLN B 71 -2.477 -8.991 -8.407 1.00 0.00 O ATOM 2602 NE2 GLN B 71 -0.821 -7.571 -8.486 1.00 0.00 N ATOM 0 H GLN B 71 -5.196 -6.936 -5.952 1.00 0.00 H new ATOM 0 HA GLN B 71 -3.091 -5.147 -5.302 1.00 0.00 H new ATOM 0 HB2 GLN B 71 -4.077 -6.313 -7.940 1.00 0.00 H new ATOM 0 HB3 GLN B 71 -2.603 -5.372 -7.812 1.00 0.00 H new ATOM 0 HG2 GLN B 71 -1.744 -6.969 -6.066 1.00 0.00 H new ATOM 0 HG3 GLN B 71 -3.212 -7.915 -6.216 1.00 0.00 H new ATOM 0 HE21 GLN B 71 -0.363 -6.743 -8.106 1.00 0.00 H new ATOM 0 HE22 GLN B 71 -0.412 -8.061 -9.282 1.00 0.00 H new ATOM 2611 N GLU B 72 -5.546 -3.823 -7.058 1.00 0.00 N ATOM 2612 CA GLU B 72 -6.076 -2.501 -7.498 1.00 0.00 C ATOM 2613 C GLU B 72 -6.439 -1.658 -6.267 1.00 0.00 C ATOM 2614 O GLU B 72 -6.444 -0.448 -6.309 1.00 0.00 O ATOM 2615 CB GLU B 72 -7.312 -2.691 -8.382 1.00 0.00 C ATOM 2616 CG GLU B 72 -6.931 -3.467 -9.646 1.00 0.00 C ATOM 2617 CD GLU B 72 -5.990 -2.619 -10.504 1.00 0.00 C ATOM 2618 OE1 GLU B 72 -6.086 -1.405 -10.431 1.00 0.00 O ATOM 2619 OE2 GLU B 72 -5.192 -3.199 -11.222 1.00 0.00 O ATOM 0 H GLU B 72 -6.164 -4.618 -7.221 1.00 0.00 H new ATOM 0 HA GLU B 72 -5.309 -1.986 -8.077 1.00 0.00 H new ATOM 0 HB2 GLU B 72 -8.084 -3.229 -7.833 1.00 0.00 H new ATOM 0 HB3 GLU B 72 -7.730 -1.721 -8.652 1.00 0.00 H new ATOM 0 HG2 GLU B 72 -6.447 -4.406 -9.377 1.00 0.00 H new ATOM 0 HG3 GLU B 72 -7.827 -3.721 -10.213 1.00 0.00 H new ATOM 2626 N PHE B 73 -6.699 -2.293 -5.158 1.00 0.00 N ATOM 2627 CA PHE B 73 -7.023 -1.536 -3.911 1.00 0.00 C ATOM 2628 C PHE B 73 -5.740 -0.887 -3.371 1.00 0.00 C ATOM 2629 O PHE B 73 -5.764 0.243 -2.928 1.00 0.00 O ATOM 2630 CB PHE B 73 -7.663 -2.487 -2.877 1.00 0.00 C ATOM 2631 CG PHE B 73 -7.423 -2.004 -1.461 1.00 0.00 C ATOM 2632 CD1 PHE B 73 -6.198 -2.264 -0.836 1.00 0.00 C ATOM 2633 CD2 PHE B 73 -8.423 -1.304 -0.778 1.00 0.00 C ATOM 2634 CE1 PHE B 73 -5.972 -1.822 0.472 1.00 0.00 C ATOM 2635 CE2 PHE B 73 -8.197 -0.861 0.531 1.00 0.00 C ATOM 2636 CZ PHE B 73 -6.972 -1.120 1.156 1.00 0.00 C ATOM 0 H PHE B 73 -6.702 -3.308 -5.059 1.00 0.00 H new ATOM 0 HA PHE B 73 -7.743 -0.745 -4.122 1.00 0.00 H new ATOM 0 HB2 PHE B 73 -8.735 -2.560 -3.062 1.00 0.00 H new ATOM 0 HB3 PHE B 73 -7.250 -3.489 -2.997 1.00 0.00 H new ATOM 0 HD1 PHE B 73 -5.427 -2.806 -1.364 1.00 0.00 H new ATOM 0 HD2 PHE B 73 -9.369 -1.105 -1.260 1.00 0.00 H new ATOM 0 HE1 PHE B 73 -5.026 -2.022 0.954 1.00 0.00 H new ATOM 0 HE2 PHE B 73 -8.968 -0.319 1.058 1.00 0.00 H new ATOM 0 HZ PHE B 73 -6.798 -0.779 2.166 1.00 0.00 H new ATOM 2646 N MET B 74 -4.629 -1.553 -3.399 1.00 0.00 N ATOM 2647 CA MET B 74 -3.401 -0.890 -2.876 1.00 0.00 C ATOM 2648 C MET B 74 -2.986 0.243 -3.827 1.00 0.00 C ATOM 2649 O MET B 74 -2.813 1.367 -3.402 1.00 0.00 O ATOM 2650 CB MET B 74 -2.265 -1.907 -2.737 1.00 0.00 C ATOM 2651 CG MET B 74 -1.198 -1.346 -1.795 1.00 0.00 C ATOM 2652 SD MET B 74 -1.839 -1.337 -0.096 1.00 0.00 S ATOM 2653 CE MET B 74 -1.767 0.450 0.204 1.00 0.00 C ATOM 0 H MET B 74 -4.511 -2.503 -3.750 1.00 0.00 H new ATOM 0 HA MET B 74 -3.612 -0.474 -1.891 1.00 0.00 H new ATOM 0 HB2 MET B 74 -2.651 -2.850 -2.348 1.00 0.00 H new ATOM 0 HB3 MET B 74 -1.830 -2.119 -3.713 1.00 0.00 H new ATOM 0 HG2 MET B 74 -0.293 -1.951 -1.851 1.00 0.00 H new ATOM 0 HG3 MET B 74 -0.925 -0.335 -2.098 1.00 0.00 H new ATOM 0 HE1 MET B 74 -1.440 0.634 1.227 1.00 0.00 H new ATOM 0 HE2 MET B 74 -1.062 0.907 -0.490 1.00 0.00 H new ATOM 0 HE3 MET B 74 -2.756 0.884 0.055 1.00 0.00 H new ATOM 2663 N ALA B 75 -2.813 -0.012 -5.093 1.00 0.00 N ATOM 2664 CA ALA B 75 -2.400 1.086 -6.019 1.00 0.00 C ATOM 2665 C ALA B 75 -3.352 2.282 -5.919 1.00 0.00 C ATOM 2666 O ALA B 75 -2.920 3.409 -5.778 1.00 0.00 O ATOM 2667 CB ALA B 75 -2.402 0.563 -7.455 1.00 0.00 C ATOM 0 H ALA B 75 -2.938 -0.926 -5.528 1.00 0.00 H new ATOM 0 HA ALA B 75 -1.400 1.415 -5.736 1.00 0.00 H new ATOM 0 HB1 ALA B 75 -2.101 1.361 -8.133 1.00 0.00 H new ATOM 0 HB2 ALA B 75 -1.702 -0.269 -7.540 1.00 0.00 H new ATOM 0 HB3 ALA B 75 -3.404 0.223 -7.717 1.00 0.00 H new ATOM 2673 N PHE B 76 -4.633 2.069 -6.007 1.00 0.00 N ATOM 2674 CA PHE B 76 -5.570 3.231 -5.934 1.00 0.00 C ATOM 2675 C PHE B 76 -5.502 3.868 -4.538 1.00 0.00 C ATOM 2676 O PHE B 76 -5.629 5.067 -4.388 1.00 0.00 O ATOM 2677 CB PHE B 76 -7.012 2.766 -6.233 1.00 0.00 C ATOM 2678 CG PHE B 76 -7.267 2.783 -7.732 1.00 0.00 C ATOM 2679 CD1 PHE B 76 -7.180 3.988 -8.443 1.00 0.00 C ATOM 2680 CD2 PHE B 76 -7.584 1.597 -8.411 1.00 0.00 C ATOM 2681 CE1 PHE B 76 -7.407 4.004 -9.823 1.00 0.00 C ATOM 2682 CE2 PHE B 76 -7.813 1.616 -9.790 1.00 0.00 C ATOM 2683 CZ PHE B 76 -7.723 2.819 -10.497 1.00 0.00 C ATOM 0 H PHE B 76 -5.071 1.156 -6.125 1.00 0.00 H new ATOM 0 HA PHE B 76 -5.277 3.972 -6.678 1.00 0.00 H new ATOM 0 HB2 PHE B 76 -7.167 1.761 -5.841 1.00 0.00 H new ATOM 0 HB3 PHE B 76 -7.725 3.418 -5.728 1.00 0.00 H new ATOM 0 HD1 PHE B 76 -6.938 4.904 -7.925 1.00 0.00 H new ATOM 0 HD2 PHE B 76 -7.651 0.667 -7.867 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -7.338 4.933 -10.370 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -8.059 0.702 -10.309 1.00 0.00 H new ATOM 0 HZ PHE B 76 -7.897 2.834 -11.563 1.00 0.00 H new ATOM 2693 N VAL B 77 -5.300 3.081 -3.522 1.00 0.00 N ATOM 2694 CA VAL B 77 -5.223 3.659 -2.149 1.00 0.00 C ATOM 2695 C VAL B 77 -3.961 4.524 -2.044 1.00 0.00 C ATOM 2696 O VAL B 77 -3.956 5.552 -1.396 1.00 0.00 O ATOM 2697 CB VAL B 77 -5.189 2.521 -1.112 1.00 0.00 C ATOM 2698 CG1 VAL B 77 -4.684 3.046 0.239 1.00 0.00 C ATOM 2699 CG2 VAL B 77 -6.605 1.954 -0.932 1.00 0.00 C ATOM 0 H VAL B 77 -5.185 2.069 -3.578 1.00 0.00 H new ATOM 0 HA VAL B 77 -6.098 4.279 -1.952 1.00 0.00 H new ATOM 0 HB VAL B 77 -4.515 1.741 -1.467 1.00 0.00 H new ATOM 0 HG11 VAL B 77 -4.665 2.231 0.962 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -3.678 3.449 0.120 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -5.350 3.832 0.596 1.00 0.00 H new ATOM 0 HG21 VAL B 77 -6.584 1.148 -0.198 1.00 0.00 H new ATOM 0 HG22 VAL B 77 -7.272 2.743 -0.585 1.00 0.00 H new ATOM 0 HG23 VAL B 77 -6.966 1.567 -1.885 1.00 0.00 H new ATOM 2709 N SER B 78 -2.895 4.125 -2.682 1.00 0.00 N ATOM 2710 CA SER B 78 -1.648 4.939 -2.618 1.00 0.00 C ATOM 2711 C SER B 78 -1.886 6.286 -3.308 1.00 0.00 C ATOM 2712 O SER B 78 -1.585 7.332 -2.769 1.00 0.00 O ATOM 2713 CB SER B 78 -0.516 4.197 -3.331 1.00 0.00 C ATOM 2714 OG SER B 78 -0.614 4.426 -4.731 1.00 0.00 O ATOM 0 H SER B 78 -2.833 3.275 -3.242 1.00 0.00 H new ATOM 0 HA SER B 78 -1.374 5.104 -1.576 1.00 0.00 H new ATOM 0 HB2 SER B 78 0.450 4.541 -2.961 1.00 0.00 H new ATOM 0 HB3 SER B 78 -0.576 3.129 -3.120 1.00 0.00 H new ATOM 0 HG SER B 78 -1.375 3.925 -5.092 1.00 0.00 H new ATOM 2720 N MET B 79 -2.406 6.265 -4.504 1.00 0.00 N ATOM 2721 CA MET B 79 -2.642 7.540 -5.243 1.00 0.00 C ATOM 2722 C MET B 79 -3.412 8.535 -4.367 1.00 0.00 C ATOM 2723 O MET B 79 -3.152 9.720 -4.397 1.00 0.00 O ATOM 2724 CB MET B 79 -3.454 7.255 -6.511 1.00 0.00 C ATOM 2725 CG MET B 79 -2.692 6.275 -7.409 1.00 0.00 C ATOM 2726 SD MET B 79 -3.814 5.619 -8.671 1.00 0.00 S ATOM 2727 CE MET B 79 -4.207 7.191 -9.480 1.00 0.00 C ATOM 0 H MET B 79 -2.679 5.419 -5.004 1.00 0.00 H new ATOM 0 HA MET B 79 -1.677 7.972 -5.507 1.00 0.00 H new ATOM 0 HB2 MET B 79 -4.425 6.838 -6.245 1.00 0.00 H new ATOM 0 HB3 MET B 79 -3.642 8.184 -7.049 1.00 0.00 H new ATOM 0 HG2 MET B 79 -1.849 6.778 -7.882 1.00 0.00 H new ATOM 0 HG3 MET B 79 -2.282 5.460 -6.812 1.00 0.00 H new ATOM 0 HE1 MET B 79 -4.606 6.998 -10.476 1.00 0.00 H new ATOM 0 HE2 MET B 79 -4.949 7.729 -8.889 1.00 0.00 H new ATOM 0 HE3 MET B 79 -3.303 7.794 -9.562 1.00 0.00 H new ATOM 2737 N VAL B 80 -4.357 8.075 -3.595 1.00 0.00 N ATOM 2738 CA VAL B 80 -5.132 9.020 -2.734 1.00 0.00 C ATOM 2739 C VAL B 80 -4.253 9.512 -1.584 1.00 0.00 C ATOM 2740 O VAL B 80 -4.294 10.669 -1.217 1.00 0.00 O ATOM 2741 CB VAL B 80 -6.364 8.308 -2.161 1.00 0.00 C ATOM 2742 CG1 VAL B 80 -7.137 9.263 -1.249 1.00 0.00 C ATOM 2743 CG2 VAL B 80 -7.278 7.858 -3.303 1.00 0.00 C ATOM 0 H VAL B 80 -4.627 7.094 -3.521 1.00 0.00 H new ATOM 0 HA VAL B 80 -5.451 9.870 -3.337 1.00 0.00 H new ATOM 0 HB VAL B 80 -6.037 7.440 -1.589 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -8.011 8.752 -0.845 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -6.494 9.585 -0.430 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -7.458 10.133 -1.822 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -8.152 7.353 -2.892 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -7.598 8.728 -3.877 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -6.736 7.173 -3.955 1.00 0.00 H new ATOM 2753 N THR B 81 -3.449 8.657 -1.017 1.00 0.00 N ATOM 2754 CA THR B 81 -2.569 9.109 0.095 1.00 0.00 C ATOM 2755 C THR B 81 -1.530 10.081 -0.469 1.00 0.00 C ATOM 2756 O THR B 81 -1.277 11.130 0.088 1.00 0.00 O ATOM 2757 CB THR B 81 -1.862 7.901 0.717 1.00 0.00 C ATOM 2758 OG1 THR B 81 -2.824 6.903 1.028 1.00 0.00 O ATOM 2759 CG2 THR B 81 -1.136 8.329 1.995 1.00 0.00 C ATOM 0 H THR B 81 -3.363 7.673 -1.273 1.00 0.00 H new ATOM 0 HA THR B 81 -3.163 9.604 0.863 1.00 0.00 H new ATOM 0 HB THR B 81 -1.136 7.501 0.009 1.00 0.00 H new ATOM 0 HG1 THR B 81 -3.075 6.424 0.210 1.00 0.00 H new ATOM 0 HG21 THR B 81 -0.634 7.467 2.435 1.00 0.00 H new ATOM 0 HG22 THR B 81 -0.398 9.095 1.755 1.00 0.00 H new ATOM 0 HG23 THR B 81 -1.858 8.730 2.706 1.00 0.00 H new ATOM 2767 N THR B 82 -0.933 9.735 -1.577 1.00 0.00 N ATOM 2768 CA THR B 82 0.086 10.628 -2.199 1.00 0.00 C ATOM 2769 C THR B 82 -0.604 11.841 -2.830 1.00 0.00 C ATOM 2770 O THR B 82 0.022 12.846 -3.104 1.00 0.00 O ATOM 2771 CB THR B 82 0.852 9.860 -3.279 1.00 0.00 C ATOM 2772 OG1 THR B 82 -0.067 9.155 -4.102 1.00 0.00 O ATOM 2773 CG2 THR B 82 1.812 8.868 -2.620 1.00 0.00 C ATOM 0 H THR B 82 -1.109 8.866 -2.081 1.00 0.00 H new ATOM 0 HA THR B 82 0.781 10.967 -1.431 1.00 0.00 H new ATOM 0 HB THR B 82 1.420 10.563 -3.888 1.00 0.00 H new ATOM 0 HG1 THR B 82 -0.471 8.424 -3.590 1.00 0.00 H new ATOM 0 HG21 THR B 82 2.357 8.322 -3.390 1.00 0.00 H new ATOM 0 HG22 THR B 82 2.519 9.409 -1.991 1.00 0.00 H new ATOM 0 HG23 THR B 82 1.246 8.165 -2.009 1.00 0.00 H new ATOM 2781 N ALA B 83 -1.888 11.757 -3.064 1.00 0.00 N ATOM 2782 CA ALA B 83 -2.607 12.911 -3.679 1.00 0.00 C ATOM 2783 C ALA B 83 -2.326 14.168 -2.859 1.00 0.00 C ATOM 2784 O ALA B 83 -2.283 15.267 -3.377 1.00 0.00 O ATOM 2785 CB ALA B 83 -4.113 12.638 -3.689 1.00 0.00 C ATOM 0 H ALA B 83 -2.467 10.943 -2.857 1.00 0.00 H new ATOM 0 HA ALA B 83 -2.261 13.051 -4.703 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -4.633 13.484 -4.139 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -4.316 11.737 -4.268 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -4.464 12.498 -2.667 1.00 0.00 H new ATOM 2791 N CYS B 84 -2.127 14.011 -1.581 1.00 0.00 N ATOM 2792 CA CYS B 84 -1.839 15.194 -0.720 1.00 0.00 C ATOM 2793 C CYS B 84 -0.417 15.685 -1.000 1.00 0.00 C ATOM 2794 O CYS B 84 0.455 14.913 -1.348 1.00 0.00 O ATOM 2795 CB CYS B 84 -1.955 14.792 0.752 1.00 0.00 C ATOM 2796 SG CYS B 84 -1.942 16.277 1.789 1.00 0.00 S ATOM 0 H CYS B 84 -2.151 13.115 -1.094 1.00 0.00 H new ATOM 0 HA CYS B 84 -2.553 15.989 -0.938 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -2.875 14.230 0.915 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -1.128 14.137 1.027 1.00 0.00 H new ATOM 0 HG CYS B 84 -0.991 17.072 1.397 1.00 0.00 H new ATOM 2802 N HIS B 85 -0.172 16.961 -0.854 1.00 0.00 N ATOM 2803 CA HIS B 85 1.200 17.487 -1.112 1.00 0.00 C ATOM 2804 C HIS B 85 2.218 16.618 -0.372 1.00 0.00 C ATOM 2805 O HIS B 85 1.858 15.721 0.364 1.00 0.00 O ATOM 2806 CB HIS B 85 1.303 18.932 -0.614 1.00 0.00 C ATOM 2807 CG HIS B 85 0.940 18.989 0.844 1.00 0.00 C ATOM 2808 ND1 HIS B 85 0.403 17.902 1.513 1.00 0.00 N ATOM 2809 CD2 HIS B 85 1.031 19.995 1.775 1.00 0.00 C ATOM 2810 CE1 HIS B 85 0.193 18.274 2.789 1.00 0.00 C ATOM 2811 NE2 HIS B 85 0.558 19.541 3.002 1.00 0.00 N ATOM 0 H HIS B 85 -0.859 17.658 -0.569 1.00 0.00 H new ATOM 0 HA HIS B 85 1.404 17.462 -2.183 1.00 0.00 H new ATOM 0 HB2 HIS B 85 2.316 19.307 -0.762 1.00 0.00 H new ATOM 0 HB3 HIS B 85 0.637 19.575 -1.190 1.00 0.00 H new ATOM 0 HD2 HIS B 85 1.412 20.987 1.584 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -0.220 17.627 3.548 1.00 0.00 H new ATOM 0 HE2 HIS B 85 0.502 20.063 3.876 1.00 0.00 H new ATOM 2819 N GLU B 86 3.484 16.874 -0.561 1.00 0.00 N ATOM 2820 CA GLU B 86 4.531 16.062 0.131 1.00 0.00 C ATOM 2821 C GLU B 86 4.141 15.849 1.597 1.00 0.00 C ATOM 2822 O GLU B 86 4.299 16.725 2.424 1.00 0.00 O ATOM 2823 CB GLU B 86 5.869 16.802 0.064 1.00 0.00 C ATOM 2824 CG GLU B 86 6.435 16.709 -1.356 1.00 0.00 C ATOM 2825 CD GLU B 86 7.559 17.734 -1.529 1.00 0.00 C ATOM 2826 OE1 GLU B 86 7.251 18.910 -1.625 1.00 0.00 O ATOM 2827 OE2 GLU B 86 8.708 17.324 -1.565 1.00 0.00 O ATOM 0 H GLU B 86 3.841 17.613 -1.167 1.00 0.00 H new ATOM 0 HA GLU B 86 4.619 15.093 -0.360 1.00 0.00 H new ATOM 0 HB2 GLU B 86 5.733 17.846 0.345 1.00 0.00 H new ATOM 0 HB3 GLU B 86 6.572 16.369 0.776 1.00 0.00 H new ATOM 0 HG2 GLU B 86 6.814 15.704 -1.542 1.00 0.00 H new ATOM 0 HG3 GLU B 86 5.646 16.893 -2.086 1.00 0.00 H new ATOM 2834 N PHE B 87 3.631 14.692 1.926 1.00 0.00 N ATOM 2835 CA PHE B 87 3.234 14.435 3.337 1.00 0.00 C ATOM 2836 C PHE B 87 4.484 14.417 4.216 1.00 0.00 C ATOM 2837 O PHE B 87 4.422 14.673 5.402 1.00 0.00 O ATOM 2838 CB PHE B 87 2.501 13.094 3.443 1.00 0.00 C ATOM 2839 CG PHE B 87 3.311 12.003 2.784 1.00 0.00 C ATOM 2840 CD1 PHE B 87 4.263 11.299 3.527 1.00 0.00 C ATOM 2841 CD2 PHE B 87 3.097 11.684 1.437 1.00 0.00 C ATOM 2842 CE1 PHE B 87 5.004 10.275 2.927 1.00 0.00 C ATOM 2843 CE2 PHE B 87 3.840 10.661 0.834 1.00 0.00 C ATOM 2844 CZ PHE B 87 4.794 9.956 1.580 1.00 0.00 C ATOM 0 H PHE B 87 3.473 13.918 1.280 1.00 0.00 H new ATOM 0 HA PHE B 87 2.563 15.226 3.673 1.00 0.00 H new ATOM 0 HB2 PHE B 87 2.329 12.847 4.491 1.00 0.00 H new ATOM 0 HB3 PHE B 87 1.523 13.168 2.968 1.00 0.00 H new ATOM 0 HD1 PHE B 87 4.427 11.546 4.566 1.00 0.00 H new ATOM 0 HD2 PHE B 87 2.360 12.226 0.864 1.00 0.00 H new ATOM 0 HE1 PHE B 87 5.738 9.731 3.503 1.00 0.00 H new ATOM 0 HE2 PHE B 87 3.678 10.416 -0.205 1.00 0.00 H new ATOM 0 HZ PHE B 87 5.367 9.167 1.116 1.00 0.00 H new ATOM 2854 N PHE B 88 5.624 14.128 3.645 1.00 0.00 N ATOM 2855 CA PHE B 88 6.872 14.110 4.459 1.00 0.00 C ATOM 2856 C PHE B 88 6.968 15.421 5.236 1.00 0.00 C ATOM 2857 O PHE B 88 7.316 15.451 6.400 1.00 0.00 O ATOM 2858 CB PHE B 88 8.085 13.979 3.538 1.00 0.00 C ATOM 2859 CG PHE B 88 7.886 12.816 2.593 1.00 0.00 C ATOM 2860 CD1 PHE B 88 8.036 11.502 3.055 1.00 0.00 C ATOM 2861 CD2 PHE B 88 7.556 13.052 1.252 1.00 0.00 C ATOM 2862 CE1 PHE B 88 7.857 10.426 2.176 1.00 0.00 C ATOM 2863 CE2 PHE B 88 7.378 11.977 0.375 1.00 0.00 C ATOM 2864 CZ PHE B 88 7.528 10.664 0.836 1.00 0.00 C ATOM 0 H PHE B 88 5.743 13.905 2.657 1.00 0.00 H new ATOM 0 HA PHE B 88 6.852 13.265 5.148 1.00 0.00 H new ATOM 0 HB2 PHE B 88 8.225 14.900 2.972 1.00 0.00 H new ATOM 0 HB3 PHE B 88 8.988 13.829 4.130 1.00 0.00 H new ATOM 0 HD1 PHE B 88 8.290 11.319 4.089 1.00 0.00 H new ATOM 0 HD2 PHE B 88 7.439 14.065 0.895 1.00 0.00 H new ATOM 0 HE1 PHE B 88 7.973 9.413 2.532 1.00 0.00 H new ATOM 0 HE2 PHE B 88 7.125 12.160 -0.659 1.00 0.00 H new ATOM 0 HZ PHE B 88 7.390 9.835 0.158 1.00 0.00 H new ATOM 2874 N GLU B 89 6.651 16.509 4.586 1.00 0.00 N ATOM 2875 CA GLU B 89 6.703 17.839 5.253 1.00 0.00 C ATOM 2876 C GLU B 89 5.314 18.164 5.799 1.00 0.00 C ATOM 2877 O GLU B 89 4.782 19.234 5.581 1.00 0.00 O ATOM 2878 CB GLU B 89 7.123 18.903 4.232 1.00 0.00 C ATOM 2879 CG GLU B 89 7.602 20.161 4.961 1.00 0.00 C ATOM 2880 CD GLU B 89 7.892 21.264 3.942 1.00 0.00 C ATOM 2881 OE1 GLU B 89 8.219 20.930 2.815 1.00 0.00 O ATOM 2882 OE2 GLU B 89 7.782 22.423 4.306 1.00 0.00 O ATOM 0 H GLU B 89 6.355 16.531 3.610 1.00 0.00 H new ATOM 0 HA GLU B 89 7.426 17.825 6.069 1.00 0.00 H new ATOM 0 HB2 GLU B 89 7.918 18.515 3.596 1.00 0.00 H new ATOM 0 HB3 GLU B 89 6.284 19.146 3.581 1.00 0.00 H new ATOM 0 HG2 GLU B 89 6.843 20.495 5.668 1.00 0.00 H new ATOM 0 HG3 GLU B 89 8.500 19.940 5.538 1.00 0.00 H new ATOM 2889 N HIS B 90 4.723 17.240 6.503 1.00 0.00 N ATOM 2890 CA HIS B 90 3.367 17.481 7.062 1.00 0.00 C ATOM 2891 C HIS B 90 3.405 18.701 7.983 1.00 0.00 C ATOM 2892 O HIS B 90 3.493 18.578 9.189 1.00 0.00 O ATOM 2893 CB HIS B 90 2.922 16.256 7.859 1.00 0.00 C ATOM 2894 CG HIS B 90 1.495 16.436 8.289 1.00 0.00 C ATOM 2895 ND1 HIS B 90 1.158 16.930 9.538 1.00 0.00 N ATOM 2896 CD2 HIS B 90 0.306 16.202 7.644 1.00 0.00 C ATOM 2897 CE1 HIS B 90 -0.185 16.978 9.606 1.00 0.00 C ATOM 2898 NE2 HIS B 90 -0.754 16.545 8.477 1.00 0.00 N ATOM 0 H HIS B 90 5.123 16.326 6.715 1.00 0.00 H new ATOM 0 HA HIS B 90 2.664 17.662 6.248 1.00 0.00 H new ATOM 0 HB2 HIS B 90 3.020 15.357 7.251 1.00 0.00 H new ATOM 0 HB3 HIS B 90 3.563 16.123 8.731 1.00 0.00 H new ATOM 0 HD2 HIS B 90 0.208 15.811 6.642 1.00 0.00 H new ATOM 0 HE1 HIS B 90 -0.736 17.324 10.468 1.00 0.00 H new ATOM 0 HE2 HIS B 90 -1.751 16.480 8.271 1.00 0.00 H new ATOM 2906 N GLU B 91 3.338 19.877 7.424 1.00 0.00 N ATOM 2907 CA GLU B 91 3.370 21.102 8.270 1.00 0.00 C ATOM 2908 C GLU B 91 2.313 20.988 9.370 1.00 0.00 C ATOM 2909 O GLU B 91 1.309 20.334 9.134 1.00 0.00 O ATOM 2910 CB GLU B 91 3.076 22.329 7.403 1.00 0.00 C ATOM 2911 CG GLU B 91 4.208 22.526 6.390 1.00 0.00 C ATOM 2912 CD GLU B 91 5.436 23.103 7.098 1.00 0.00 C ATOM 2913 OE1 GLU B 91 5.255 23.913 7.993 1.00 0.00 O ATOM 2914 OE2 GLU B 91 6.538 22.726 6.733 1.00 0.00 O ATOM 2915 OXT GLU B 91 2.526 21.553 10.430 1.00 0.00 O ATOM 0 H GLU B 91 3.263 20.043 6.420 1.00 0.00 H new ATOM 0 HA GLU B 91 4.356 21.206 8.723 1.00 0.00 H new ATOM 0 HB2 GLU B 91 2.127 22.200 6.882 1.00 0.00 H new ATOM 0 HB3 GLU B 91 2.978 23.215 8.030 1.00 0.00 H new ATOM 0 HG2 GLU B 91 4.460 21.575 5.921 1.00 0.00 H new ATOM 0 HG3 GLU B 91 3.885 23.198 5.595 1.00 0.00 H new TER 2922 GLU B 91