USER MOD reduce.3.24.130724 H: found=0, std=0, add=1128, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1128 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 16 ASN : amide:sc= 0.481 K(o=-0.42,f=-3.2) USER MOD Set 1.2: A 145 THR OG1 : rot 87:sc= 0.568 USER MOD Set 1.3: A 147 SER OG : rot 153:sc= -1.47! USER MOD Set 2.1: A 71 ASN : amide:sc= -0.178 X(o=-0.2,f=-0.021) USER MOD Set 2.2: A 79 SER OG : rot 180:sc= -0.0211 USER MOD Set 3.1: A 42 SER OG : rot 69:sc= 1.48 USER MOD Set 3.2: A 77 LYS NZ :NH3+ -159:sc= 1.7 (180deg=-0.152) USER MOD Set 4.1: A 3 ASN : amide:sc= -6.38! C(o=-6.5!,f=-6.2!) USER MOD Set 4.2: A 129 ASN : amide:sc= -0.137 X(o=-6.5,f=-6.2) USER MOD Single : A 0 SER OG : rot 180:sc= -0.494 USER MOD Single : A 2 LYS NZ :NH3+ 178:sc= 1.91 (180deg=1.84) USER MOD Single : A 5 THR OG1 : rot -125:sc= 1.23 USER MOD Single : A 7 LYS NZ :NH3+ -124:sc= 0.152 (180deg=-0.147) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A -2 SER OG : rot 180:sc= 0 USER MOD Single : A -3 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= -0.145 X(o=-0.14,f=-0.21) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot -130:sc=-0.00496 USER MOD Single : A 38 CYS SG : rot -96:sc= 0.267 USER MOD Single : A 39 MET CE :methyl 163:sc= -0.0693 (180deg=-0.469) USER MOD Single : A 43 TYR OH : rot 30:sc= -0.851 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ 155:sc= 1.18 (180deg=0.678) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 153:sc= -0.0587 (180deg=-2.43!) USER MOD Single : A 56 ASN : amide:sc= -0.105 K(o=-0.11,f=-3.1!) USER MOD Single : A 57 THR OG1 : rot 180:sc= 0.111 USER MOD Single : A 61 LYS NZ :NH3+ -154:sc= 2.03 (180deg=1.52) USER MOD Single : A 63 THR OG1 : rot 180:sc= 0.0202 USER MOD Single : A 65 ASN : amide:sc= 1.16 K(o=1.2,f=-0.13) USER MOD Single : A 66 TYR OH : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 135:sc= 1.22 USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 SER OG : rot 180:sc= 0.00476 USER MOD Single : A 74 THR OG1 : rot 180:sc= 0.0698 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 THR OG1 : rot 39:sc= 0.408 USER MOD Single : A 86 THR OG1 : rot 92:sc= 0.997 USER MOD Single : A 89 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 ASN : amide:sc= -0.542 K(o=-0.54,f=-2) USER MOD Single : A 107 SER OG : rot 180:sc=0.000406 USER MOD Single : A 108 ASN : amide:sc= -0.155 K(o=-0.15,f=-0.84) USER MOD Single : A 110 THR OG1 : rot 180:sc= -0.0283 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 117 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 THR OG1 : rot 76:sc= 1.2 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 LYS NZ :NH3+ 136:sc= 0.312 (180deg=-0.419!) USER MOD Single : A 138 SER OG : rot 160:sc= -1.2 USER MOD Single : A 139 ASN :FLIP amide:sc= 0 F(o=-0.67,f=0) USER MOD Single : A 141 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 143 THR OG1 : rot -76:sc= 1.22 USER MOD Single : A 150 THR OG1 : rot 180:sc= 0.0616 USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 -1.015 33.344 10.463 1.00 0.00 N ATOM 2 CA GLY A -3 -1.312 31.920 10.455 1.00 0.00 C ATOM 3 C GLY A -3 -2.330 31.595 9.402 1.00 0.00 C ATOM 4 O GLY A -3 -3.522 31.495 9.683 1.00 0.00 O ATOM 0 H1 GLY A -3 -0.309 33.547 11.199 1.00 0.00 H new ATOM 0 H2 GLY A -3 -0.639 33.625 9.535 1.00 0.00 H new ATOM 0 H3 GLY A -3 -1.885 33.879 10.661 1.00 0.00 H new ATOM 0 HA2 GLY A -3 -0.399 31.354 10.271 1.00 0.00 H new ATOM 0 HA3 GLY A -3 -1.684 31.616 11.433 1.00 0.00 H new ATOM 10 N SER A -2 -1.882 31.483 8.186 1.00 0.00 N ATOM 11 CA SER A -2 -2.735 31.137 7.088 1.00 0.00 C ATOM 12 C SER A -2 -2.101 29.970 6.376 1.00 0.00 C ATOM 13 O SER A -2 -1.606 30.112 5.251 1.00 0.00 O ATOM 14 CB SER A -2 -2.893 32.346 6.145 1.00 0.00 C ATOM 15 OG SER A -2 -3.866 32.123 5.134 1.00 0.00 O ATOM 0 H SER A -2 -0.907 31.630 7.927 1.00 0.00 H new ATOM 0 HA SER A -2 -3.731 30.863 7.435 1.00 0.00 H new ATOM 0 HB2 SER A -2 -3.174 33.223 6.728 1.00 0.00 H new ATOM 0 HB3 SER A -2 -1.933 32.567 5.679 1.00 0.00 H new ATOM 0 HG SER A -2 -3.932 32.916 4.563 1.00 0.00 H new ATOM 21 N ALA A -1 -2.044 28.829 7.085 1.00 0.00 N ATOM 22 CA ALA A -1 -1.394 27.609 6.608 1.00 0.00 C ATOM 23 C ALA A -1 0.053 27.945 6.278 1.00 0.00 C ATOM 24 O ALA A -1 0.577 27.542 5.224 1.00 0.00 O ATOM 25 CB ALA A -1 -2.140 27.025 5.396 1.00 0.00 C ATOM 0 H ALA A -1 -2.454 28.733 8.014 1.00 0.00 H new ATOM 0 HA ALA A -1 -1.418 26.840 7.380 1.00 0.00 H new ATOM 0 HB1 ALA A -1 -1.636 26.118 5.061 1.00 0.00 H new ATOM 0 HB2 ALA A -1 -3.165 26.787 5.680 1.00 0.00 H new ATOM 0 HB3 ALA A -1 -2.148 27.756 4.587 1.00 0.00 H new ATOM 31 N SER A 0 0.673 28.701 7.218 1.00 0.00 N ATOM 32 CA SER A 0 2.018 29.260 7.119 1.00 0.00 C ATOM 33 C SER A 0 2.996 28.261 6.545 1.00 0.00 C ATOM 34 O SER A 0 3.606 28.498 5.492 1.00 0.00 O ATOM 35 CB SER A 0 2.446 29.746 8.499 1.00 0.00 C ATOM 36 OG SER A 0 1.435 30.596 9.048 1.00 0.00 O ATOM 0 H SER A 0 0.218 28.940 8.099 1.00 0.00 H new ATOM 0 HA SER A 0 2.010 30.104 6.429 1.00 0.00 H new ATOM 0 HB2 SER A 0 2.616 28.895 9.158 1.00 0.00 H new ATOM 0 HB3 SER A 0 3.390 30.287 8.428 1.00 0.00 H new ATOM 0 HG SER A 0 1.714 30.905 9.935 1.00 0.00 H new ATOM 42 N VAL A 1 3.120 27.151 7.190 1.00 0.00 N ATOM 43 CA VAL A 1 3.870 26.097 6.681 1.00 0.00 C ATOM 44 C VAL A 1 2.957 24.933 6.329 1.00 0.00 C ATOM 45 O VAL A 1 3.031 24.400 5.208 1.00 0.00 O ATOM 46 CB VAL A 1 5.028 25.682 7.617 1.00 0.00 C ATOM 47 CG1 VAL A 1 6.116 26.733 7.610 1.00 0.00 C ATOM 48 CG2 VAL A 1 4.570 25.438 9.051 1.00 0.00 C ATOM 0 H VAL A 1 2.690 26.966 8.096 1.00 0.00 H new ATOM 0 HA VAL A 1 4.353 26.438 5.765 1.00 0.00 H new ATOM 0 HB VAL A 1 5.415 24.740 7.230 1.00 0.00 H new ATOM 0 HG11 VAL A 1 6.924 26.425 8.274 1.00 0.00 H new ATOM 0 HG12 VAL A 1 6.503 26.849 6.598 1.00 0.00 H new ATOM 0 HG13 VAL A 1 5.706 27.683 7.953 1.00 0.00 H new ATOM 0 HG21 VAL A 1 5.425 25.150 9.662 1.00 0.00 H new ATOM 0 HG22 VAL A 1 4.129 26.350 9.452 1.00 0.00 H new ATOM 0 HG23 VAL A 1 3.828 24.639 9.065 1.00 0.00 H new ATOM 58 N LYS A 2 2.039 24.598 7.271 1.00 0.00 N ATOM 59 CA LYS A 2 1.090 23.485 7.182 1.00 0.00 C ATOM 60 C LYS A 2 1.895 22.188 6.886 1.00 0.00 C ATOM 61 O LYS A 2 3.109 22.155 7.139 1.00 0.00 O ATOM 62 CB LYS A 2 0.061 23.771 6.046 1.00 0.00 C ATOM 63 CG LYS A 2 -1.269 23.041 6.174 1.00 0.00 C ATOM 64 CD LYS A 2 -1.969 22.894 4.820 1.00 0.00 C ATOM 65 CE LYS A 2 -3.255 22.083 4.937 1.00 0.00 C ATOM 66 NZ LYS A 2 -3.788 21.686 3.614 1.00 0.00 N ATOM 0 H LYS A 2 1.945 25.122 8.141 1.00 0.00 H new ATOM 0 HA LYS A 2 0.540 23.367 8.116 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -0.133 24.843 6.016 1.00 0.00 H new ATOM 0 HB3 LYS A 2 0.514 23.502 5.092 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -1.102 22.054 6.606 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -1.917 23.584 6.861 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -2.196 23.881 4.418 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -1.296 22.410 4.113 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -3.067 21.190 5.534 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -4.005 22.669 5.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -4.643 21.108 3.743 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -4.025 22.537 3.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -3.071 21.133 3.103 1.00 0.00 H new ATOM 80 N ASN A 3 1.205 21.132 6.478 1.00 0.00 N ATOM 81 CA ASN A 3 1.793 19.952 5.861 1.00 0.00 C ATOM 82 C ASN A 3 2.966 19.325 6.596 1.00 0.00 C ATOM 83 O ASN A 3 4.131 19.693 6.367 1.00 0.00 O ATOM 84 CB ASN A 3 2.192 20.276 4.427 1.00 0.00 C ATOM 85 CG ASN A 3 1.019 20.446 3.505 1.00 0.00 C ATOM 86 OD1 ASN A 3 0.497 21.545 3.315 1.00 0.00 O ATOM 87 ND2 ASN A 3 0.599 19.371 2.926 1.00 0.00 N ATOM 0 H ASN A 3 0.191 21.071 6.570 1.00 0.00 H new ATOM 0 HA ASN A 3 1.011 19.194 5.903 1.00 0.00 H new ATOM 0 HB2 ASN A 3 2.785 21.191 4.421 1.00 0.00 H new ATOM 0 HB3 ASN A 3 2.831 19.479 4.047 1.00 0.00 H new ATOM 0 HD21 ASN A 3 -0.193 19.413 2.284 1.00 0.00 H new ATOM 0 HD22 ASN A 3 1.059 18.479 3.110 1.00 0.00 H new ATOM 94 N GLU A 4 2.688 18.392 7.452 1.00 0.00 N ATOM 95 CA GLU A 4 3.748 17.695 8.139 1.00 0.00 C ATOM 96 C GLU A 4 4.080 16.443 7.359 1.00 0.00 C ATOM 97 O GLU A 4 3.209 15.892 6.689 1.00 0.00 O ATOM 98 CB GLU A 4 3.433 17.389 9.631 1.00 0.00 C ATOM 99 CG GLU A 4 2.241 16.465 9.922 1.00 0.00 C ATOM 100 CD GLU A 4 0.901 17.051 9.557 1.00 0.00 C ATOM 101 OE1 GLU A 4 0.534 18.105 10.093 1.00 0.00 O ATOM 102 OE2 GLU A 4 0.183 16.465 8.743 1.00 0.00 O ATOM 0 H GLU A 4 1.744 18.091 7.696 1.00 0.00 H new ATOM 0 HA GLU A 4 4.617 18.351 8.179 1.00 0.00 H new ATOM 0 HB2 GLU A 4 4.322 16.945 10.080 1.00 0.00 H new ATOM 0 HB3 GLU A 4 3.258 18.337 10.140 1.00 0.00 H new ATOM 0 HG2 GLU A 4 2.378 15.532 9.376 1.00 0.00 H new ATOM 0 HG3 GLU A 4 2.239 16.216 10.983 1.00 0.00 H new ATOM 109 N THR A 5 5.324 16.035 7.385 1.00 0.00 N ATOM 110 CA THR A 5 5.743 14.891 6.632 1.00 0.00 C ATOM 111 C THR A 5 5.230 13.577 7.269 1.00 0.00 C ATOM 112 O THR A 5 5.655 13.154 8.367 1.00 0.00 O ATOM 113 CB THR A 5 7.290 14.914 6.329 1.00 0.00 C ATOM 114 OG1 THR A 5 7.677 13.829 5.474 1.00 0.00 O ATOM 115 CG2 THR A 5 8.142 14.910 7.585 1.00 0.00 C ATOM 0 H THR A 5 6.064 16.484 7.924 1.00 0.00 H new ATOM 0 HA THR A 5 5.272 14.938 5.650 1.00 0.00 H new ATOM 0 HB THR A 5 7.473 15.856 5.813 1.00 0.00 H new ATOM 0 HG1 THR A 5 8.393 13.315 5.902 1.00 0.00 H new ATOM 0 HG21 THR A 5 9.196 14.926 7.309 1.00 0.00 H new ATOM 0 HG22 THR A 5 7.910 15.790 8.185 1.00 0.00 H new ATOM 0 HG23 THR A 5 7.932 14.011 8.164 1.00 0.00 H new ATOM 123 N VAL A 6 4.259 13.000 6.591 1.00 0.00 N ATOM 124 CA VAL A 6 3.580 11.801 7.000 1.00 0.00 C ATOM 125 C VAL A 6 4.466 10.597 6.749 1.00 0.00 C ATOM 126 O VAL A 6 5.068 10.466 5.703 1.00 0.00 O ATOM 127 CB VAL A 6 2.253 11.646 6.209 1.00 0.00 C ATOM 128 CG1 VAL A 6 1.502 10.408 6.626 1.00 0.00 C ATOM 129 CG2 VAL A 6 1.382 12.882 6.361 1.00 0.00 C ATOM 0 H VAL A 6 3.913 13.373 5.707 1.00 0.00 H new ATOM 0 HA VAL A 6 3.356 11.868 8.065 1.00 0.00 H new ATOM 0 HB VAL A 6 2.511 11.537 5.156 1.00 0.00 H new ATOM 0 HG11 VAL A 6 0.579 10.332 6.052 1.00 0.00 H new ATOM 0 HG12 VAL A 6 2.119 9.529 6.440 1.00 0.00 H new ATOM 0 HG13 VAL A 6 1.265 10.467 7.688 1.00 0.00 H new ATOM 0 HG21 VAL A 6 0.459 12.748 5.797 1.00 0.00 H new ATOM 0 HG22 VAL A 6 1.146 13.033 7.414 1.00 0.00 H new ATOM 0 HG23 VAL A 6 1.916 13.753 5.980 1.00 0.00 H new ATOM 139 N LYS A 7 4.560 9.740 7.707 1.00 0.00 N ATOM 140 CA LYS A 7 5.401 8.591 7.581 1.00 0.00 C ATOM 141 C LYS A 7 4.641 7.439 6.956 1.00 0.00 C ATOM 142 O LYS A 7 3.579 7.048 7.452 1.00 0.00 O ATOM 143 CB LYS A 7 5.965 8.184 8.929 1.00 0.00 C ATOM 144 CG LYS A 7 6.674 9.313 9.663 1.00 0.00 C ATOM 145 CD LYS A 7 7.410 8.809 10.888 1.00 0.00 C ATOM 146 CE LYS A 7 8.625 7.982 10.497 1.00 0.00 C ATOM 147 NZ LYS A 7 9.659 8.792 9.797 1.00 0.00 N ATOM 0 H LYS A 7 4.062 9.811 8.594 1.00 0.00 H new ATOM 0 HA LYS A 7 6.233 8.852 6.927 1.00 0.00 H new ATOM 0 HB2 LYS A 7 5.154 7.809 9.554 1.00 0.00 H new ATOM 0 HB3 LYS A 7 6.664 7.360 8.786 1.00 0.00 H new ATOM 0 HG2 LYS A 7 7.379 9.799 8.989 1.00 0.00 H new ATOM 0 HG3 LYS A 7 5.946 10.068 9.961 1.00 0.00 H new ATOM 0 HD2 LYS A 7 7.724 9.654 11.501 1.00 0.00 H new ATOM 0 HD3 LYS A 7 6.737 8.206 11.498 1.00 0.00 H new ATOM 0 HE2 LYS A 7 9.060 7.535 11.391 1.00 0.00 H new ATOM 0 HE3 LYS A 7 8.311 7.162 9.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 9.869 8.363 8.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 9.305 9.760 9.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 10.526 8.820 10.371 1.00 0.00 H new ATOM 161 N LEU A 8 5.160 6.922 5.882 1.00 0.00 N ATOM 162 CA LEU A 8 4.593 5.777 5.239 1.00 0.00 C ATOM 163 C LEU A 8 5.567 4.636 5.460 1.00 0.00 C ATOM 164 O LEU A 8 6.704 4.635 4.923 1.00 0.00 O ATOM 165 CB LEU A 8 4.366 6.035 3.746 1.00 0.00 C ATOM 166 CG LEU A 8 3.557 4.973 2.990 1.00 0.00 C ATOM 167 CD1 LEU A 8 2.119 4.924 3.496 1.00 0.00 C ATOM 168 CD2 LEU A 8 3.586 5.238 1.497 1.00 0.00 C ATOM 0 H LEU A 8 5.996 7.287 5.425 1.00 0.00 H new ATOM 0 HA LEU A 8 3.614 5.539 5.656 1.00 0.00 H new ATOM 0 HB2 LEU A 8 3.859 6.994 3.637 1.00 0.00 H new ATOM 0 HB3 LEU A 8 5.339 6.132 3.263 1.00 0.00 H new ATOM 0 HG LEU A 8 4.018 4.003 3.176 1.00 0.00 H new ATOM 0 HD11 LEU A 8 1.565 4.164 2.945 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.115 4.678 4.558 1.00 0.00 H new ATOM 0 HD13 LEU A 8 1.648 5.895 3.347 1.00 0.00 H new ATOM 0 HD21 LEU A 8 3.006 4.473 0.980 1.00 0.00 H new ATOM 0 HD22 LEU A 8 3.156 6.219 1.293 1.00 0.00 H new ATOM 0 HD23 LEU A 8 4.617 5.213 1.143 1.00 0.00 H new ATOM 180 N SER A 9 5.140 3.695 6.240 1.00 0.00 N ATOM 181 CA SER A 9 5.982 2.658 6.712 1.00 0.00 C ATOM 182 C SER A 9 5.444 1.298 6.297 1.00 0.00 C ATOM 183 O SER A 9 4.234 1.083 6.191 1.00 0.00 O ATOM 184 CB SER A 9 6.090 2.781 8.246 1.00 0.00 C ATOM 185 OG SER A 9 7.024 1.869 8.811 1.00 0.00 O ATOM 0 H SER A 9 4.177 3.630 6.569 1.00 0.00 H new ATOM 0 HA SER A 9 6.975 2.752 6.273 1.00 0.00 H new ATOM 0 HB2 SER A 9 6.383 3.799 8.504 1.00 0.00 H new ATOM 0 HB3 SER A 9 5.109 2.609 8.689 1.00 0.00 H new ATOM 0 HG SER A 9 7.054 1.991 9.783 1.00 0.00 H new ATOM 191 N VAL A 10 6.342 0.410 6.042 1.00 0.00 N ATOM 192 CA VAL A 10 6.039 -0.935 5.653 1.00 0.00 C ATOM 193 C VAL A 10 6.527 -1.891 6.706 1.00 0.00 C ATOM 194 O VAL A 10 7.377 -1.532 7.545 1.00 0.00 O ATOM 195 CB VAL A 10 6.627 -1.312 4.275 1.00 0.00 C ATOM 196 CG1 VAL A 10 5.966 -0.488 3.190 1.00 0.00 C ATOM 197 CG2 VAL A 10 8.141 -1.122 4.252 1.00 0.00 C ATOM 0 H VAL A 10 7.342 0.601 6.099 1.00 0.00 H new ATOM 0 HA VAL A 10 4.955 -1.005 5.559 1.00 0.00 H new ATOM 0 HB VAL A 10 6.425 -2.367 4.090 1.00 0.00 H new ATOM 0 HG11 VAL A 10 6.385 -0.759 2.221 1.00 0.00 H new ATOM 0 HG12 VAL A 10 4.893 -0.682 3.188 1.00 0.00 H new ATOM 0 HG13 VAL A 10 6.143 0.571 3.379 1.00 0.00 H new ATOM 0 HG21 VAL A 10 8.527 -1.395 3.270 1.00 0.00 H new ATOM 0 HG22 VAL A 10 8.380 -0.079 4.459 1.00 0.00 H new ATOM 0 HG23 VAL A 10 8.599 -1.756 5.011 1.00 0.00 H new ATOM 207 N GLY A 11 6.041 -3.088 6.665 1.00 0.00 N ATOM 208 CA GLY A 11 6.411 -4.044 7.642 1.00 0.00 C ATOM 209 C GLY A 11 6.759 -5.325 6.979 1.00 0.00 C ATOM 210 O GLY A 11 6.580 -5.475 5.763 1.00 0.00 O ATOM 0 H GLY A 11 5.384 -3.423 5.960 1.00 0.00 H new ATOM 0 HA2 GLY A 11 7.261 -3.679 8.219 1.00 0.00 H new ATOM 0 HA3 GLY A 11 5.591 -4.197 8.344 1.00 0.00 H new ATOM 214 N THR A 12 7.269 -6.221 7.736 1.00 0.00 N ATOM 215 CA THR A 12 7.783 -7.436 7.224 1.00 0.00 C ATOM 216 C THR A 12 6.907 -8.608 7.641 1.00 0.00 C ATOM 217 O THR A 12 6.512 -8.729 8.809 1.00 0.00 O ATOM 218 CB THR A 12 9.213 -7.617 7.741 1.00 0.00 C ATOM 219 OG1 THR A 12 9.972 -6.431 7.417 1.00 0.00 O ATOM 220 CG2 THR A 12 9.871 -8.828 7.124 1.00 0.00 C ATOM 0 H THR A 12 7.343 -6.130 8.749 1.00 0.00 H new ATOM 0 HA THR A 12 7.789 -7.403 6.135 1.00 0.00 H new ATOM 0 HB THR A 12 9.183 -7.769 8.820 1.00 0.00 H new ATOM 0 HG1 THR A 12 10.891 -6.531 7.744 1.00 0.00 H new ATOM 0 HG21 THR A 12 10.885 -8.928 7.512 1.00 0.00 H new ATOM 0 HG22 THR A 12 9.297 -9.721 7.373 1.00 0.00 H new ATOM 0 HG23 THR A 12 9.907 -8.710 6.041 1.00 0.00 H new ATOM 228 N VAL A 13 6.589 -9.428 6.688 1.00 0.00 N ATOM 229 CA VAL A 13 5.776 -10.588 6.894 1.00 0.00 C ATOM 230 C VAL A 13 6.537 -11.808 6.427 1.00 0.00 C ATOM 231 O VAL A 13 7.548 -11.689 5.732 1.00 0.00 O ATOM 232 CB VAL A 13 4.418 -10.500 6.127 1.00 0.00 C ATOM 233 CG1 VAL A 13 3.527 -9.421 6.713 1.00 0.00 C ATOM 234 CG2 VAL A 13 4.646 -10.229 4.645 1.00 0.00 C ATOM 0 H VAL A 13 6.894 -9.307 5.722 1.00 0.00 H new ATOM 0 HA VAL A 13 5.548 -10.655 7.958 1.00 0.00 H new ATOM 0 HB VAL A 13 3.919 -11.463 6.237 1.00 0.00 H new ATOM 0 HG11 VAL A 13 2.589 -9.383 6.159 1.00 0.00 H new ATOM 0 HG12 VAL A 13 3.321 -9.647 7.759 1.00 0.00 H new ATOM 0 HG13 VAL A 13 4.029 -8.456 6.642 1.00 0.00 H new ATOM 0 HG21 VAL A 13 3.685 -10.172 4.133 1.00 0.00 H new ATOM 0 HG22 VAL A 13 5.177 -9.285 4.525 1.00 0.00 H new ATOM 0 HG23 VAL A 13 5.239 -11.036 4.215 1.00 0.00 H new ATOM 244 N SER A 14 6.090 -12.949 6.820 1.00 0.00 N ATOM 245 CA SER A 14 6.664 -14.160 6.379 1.00 0.00 C ATOM 246 C SER A 14 5.635 -14.910 5.563 1.00 0.00 C ATOM 247 O SER A 14 4.425 -14.809 5.838 1.00 0.00 O ATOM 248 CB SER A 14 7.152 -14.967 7.571 1.00 0.00 C ATOM 249 OG SER A 14 6.109 -15.206 8.522 1.00 0.00 O ATOM 0 H SER A 14 5.307 -13.063 7.464 1.00 0.00 H new ATOM 0 HA SER A 14 7.532 -13.969 5.748 1.00 0.00 H new ATOM 0 HB2 SER A 14 7.551 -15.920 7.224 1.00 0.00 H new ATOM 0 HB3 SER A 14 7.971 -14.436 8.057 1.00 0.00 H new ATOM 0 HG SER A 14 6.463 -15.729 9.271 1.00 0.00 H new ATOM 255 N GLY A 15 6.079 -15.622 4.577 1.00 0.00 N ATOM 256 CA GLY A 15 5.176 -16.329 3.741 1.00 0.00 C ATOM 257 C GLY A 15 5.719 -17.656 3.330 1.00 0.00 C ATOM 258 O GLY A 15 6.927 -17.887 3.387 1.00 0.00 O ATOM 0 H GLY A 15 7.064 -15.726 4.334 1.00 0.00 H new ATOM 0 HA2 GLY A 15 4.231 -16.470 4.266 1.00 0.00 H new ATOM 0 HA3 GLY A 15 4.962 -15.734 2.853 1.00 0.00 H new ATOM 262 N ASN A 16 4.846 -18.522 2.924 1.00 0.00 N ATOM 263 CA ASN A 16 5.207 -19.841 2.481 1.00 0.00 C ATOM 264 C ASN A 16 4.593 -20.108 1.122 1.00 0.00 C ATOM 265 O ASN A 16 3.506 -19.603 0.836 1.00 0.00 O ATOM 266 CB ASN A 16 4.737 -20.900 3.481 1.00 0.00 C ATOM 267 CG ASN A 16 5.539 -20.927 4.764 1.00 0.00 C ATOM 268 OD1 ASN A 16 6.539 -21.633 4.861 1.00 0.00 O ATOM 269 ND2 ASN A 16 5.114 -20.188 5.744 1.00 0.00 N ATOM 0 H ASN A 16 3.844 -18.334 2.888 1.00 0.00 H new ATOM 0 HA ASN A 16 6.293 -19.897 2.408 1.00 0.00 H new ATOM 0 HB2 ASN A 16 3.689 -20.719 3.722 1.00 0.00 H new ATOM 0 HB3 ASN A 16 4.791 -21.881 3.009 1.00 0.00 H new ATOM 0 HD21 ASN A 16 5.615 -20.181 6.632 1.00 0.00 H new ATOM 0 HD22 ASN A 16 4.279 -19.615 5.625 1.00 0.00 H new ATOM 276 N PRO A 17 5.283 -20.880 0.245 1.00 0.00 N ATOM 277 CA PRO A 17 4.776 -21.210 -1.099 1.00 0.00 C ATOM 278 C PRO A 17 3.446 -21.970 -1.043 1.00 0.00 C ATOM 279 O PRO A 17 3.363 -23.087 -0.501 1.00 0.00 O ATOM 280 CB PRO A 17 5.877 -22.102 -1.693 1.00 0.00 C ATOM 281 CG PRO A 17 7.094 -21.772 -0.908 1.00 0.00 C ATOM 282 CD PRO A 17 6.606 -21.479 0.477 1.00 0.00 C ATOM 0 HA PRO A 17 4.574 -20.316 -1.688 1.00 0.00 H new ATOM 0 HB2 PRO A 17 5.622 -23.158 -1.603 1.00 0.00 H new ATOM 0 HB3 PRO A 17 6.023 -21.898 -2.754 1.00 0.00 H new ATOM 0 HG2 PRO A 17 7.799 -22.603 -0.909 1.00 0.00 H new ATOM 0 HG3 PRO A 17 7.614 -20.913 -1.332 1.00 0.00 H new ATOM 0 HD2 PRO A 17 6.538 -22.384 1.080 1.00 0.00 H new ATOM 0 HD3 PRO A 17 7.272 -20.795 1.003 1.00 0.00 H new ATOM 290 N GLY A 18 2.416 -21.357 -1.568 1.00 0.00 N ATOM 291 CA GLY A 18 1.106 -21.947 -1.563 1.00 0.00 C ATOM 292 C GLY A 18 0.148 -21.142 -0.718 1.00 0.00 C ATOM 293 O GLY A 18 -1.070 -21.166 -0.940 1.00 0.00 O ATOM 0 H GLY A 18 2.463 -20.438 -2.009 1.00 0.00 H new ATOM 0 HA2 GLY A 18 0.729 -22.011 -2.584 1.00 0.00 H new ATOM 0 HA3 GLY A 18 1.165 -22.966 -1.180 1.00 0.00 H new ATOM 297 N ASP A 19 0.690 -20.438 0.252 1.00 0.00 N ATOM 298 CA ASP A 19 -0.108 -19.630 1.158 1.00 0.00 C ATOM 299 C ASP A 19 -0.257 -18.213 0.597 1.00 0.00 C ATOM 300 O ASP A 19 0.564 -17.758 -0.199 1.00 0.00 O ATOM 301 CB ASP A 19 0.529 -19.617 2.568 1.00 0.00 C ATOM 302 CG ASP A 19 -0.316 -18.917 3.626 1.00 0.00 C ATOM 303 OD1 ASP A 19 0.251 -18.407 4.614 1.00 0.00 O ATOM 304 OD2 ASP A 19 -1.558 -18.881 3.499 1.00 0.00 O ATOM 0 H ASP A 19 1.693 -20.407 0.437 1.00 0.00 H new ATOM 0 HA ASP A 19 -1.103 -20.065 1.249 1.00 0.00 H new ATOM 0 HB2 ASP A 19 0.709 -20.645 2.883 1.00 0.00 H new ATOM 0 HB3 ASP A 19 1.501 -19.127 2.511 1.00 0.00 H new ATOM 309 N THR A 20 -1.306 -17.548 0.968 1.00 0.00 N ATOM 310 CA THR A 20 -1.538 -16.196 0.551 1.00 0.00 C ATOM 311 C THR A 20 -1.113 -15.270 1.692 1.00 0.00 C ATOM 312 O THR A 20 -1.558 -15.436 2.828 1.00 0.00 O ATOM 313 CB THR A 20 -3.025 -16.007 0.204 1.00 0.00 C ATOM 314 OG1 THR A 20 -3.401 -17.050 -0.715 1.00 0.00 O ATOM 315 CG2 THR A 20 -3.269 -14.664 -0.455 1.00 0.00 C ATOM 0 H THR A 20 -2.033 -17.929 1.574 1.00 0.00 H new ATOM 0 HA THR A 20 -0.958 -15.960 -0.341 1.00 0.00 H new ATOM 0 HB THR A 20 -3.614 -16.049 1.120 1.00 0.00 H new ATOM 0 HG1 THR A 20 -4.347 -16.953 -0.951 1.00 0.00 H new ATOM 0 HG21 THR A 20 -4.329 -14.560 -0.688 1.00 0.00 H new ATOM 0 HG22 THR A 20 -2.967 -13.866 0.223 1.00 0.00 H new ATOM 0 HG23 THR A 20 -2.687 -14.599 -1.374 1.00 0.00 H new ATOM 323 N VAL A 21 -0.265 -14.324 1.401 1.00 0.00 N ATOM 324 CA VAL A 21 0.285 -13.469 2.416 1.00 0.00 C ATOM 325 C VAL A 21 -0.304 -12.061 2.259 1.00 0.00 C ATOM 326 O VAL A 21 -0.779 -11.694 1.171 1.00 0.00 O ATOM 327 CB VAL A 21 1.848 -13.447 2.331 1.00 0.00 C ATOM 328 CG1 VAL A 21 2.356 -12.698 1.104 1.00 0.00 C ATOM 329 CG2 VAL A 21 2.481 -12.927 3.612 1.00 0.00 C ATOM 0 H VAL A 21 0.064 -14.124 0.457 1.00 0.00 H new ATOM 0 HA VAL A 21 0.021 -13.853 3.401 1.00 0.00 H new ATOM 0 HB VAL A 21 2.163 -14.484 2.215 1.00 0.00 H new ATOM 0 HG11 VAL A 21 3.446 -12.713 1.094 1.00 0.00 H new ATOM 0 HG12 VAL A 21 1.978 -13.179 0.202 1.00 0.00 H new ATOM 0 HG13 VAL A 21 2.008 -11.666 1.138 1.00 0.00 H new ATOM 0 HG21 VAL A 21 3.566 -12.929 3.509 1.00 0.00 H new ATOM 0 HG22 VAL A 21 2.136 -11.910 3.801 1.00 0.00 H new ATOM 0 HG23 VAL A 21 2.195 -13.568 4.446 1.00 0.00 H new ATOM 339 N LYS A 22 -0.324 -11.314 3.332 1.00 0.00 N ATOM 340 CA LYS A 22 -0.893 -9.998 3.330 1.00 0.00 C ATOM 341 C LYS A 22 0.086 -8.998 3.948 1.00 0.00 C ATOM 342 O LYS A 22 0.479 -9.139 5.107 1.00 0.00 O ATOM 343 CB LYS A 22 -2.201 -10.049 4.102 1.00 0.00 C ATOM 344 CG LYS A 22 -3.011 -8.769 4.118 1.00 0.00 C ATOM 345 CD LYS A 22 -4.376 -9.001 4.764 1.00 0.00 C ATOM 346 CE LYS A 22 -4.257 -9.445 6.217 1.00 0.00 C ATOM 347 NZ LYS A 22 -5.559 -9.805 6.789 1.00 0.00 N ATOM 0 H LYS A 22 0.056 -11.605 4.233 1.00 0.00 H new ATOM 0 HA LYS A 22 -1.090 -9.666 2.311 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -2.819 -10.842 3.680 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -1.982 -10.330 5.132 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -2.470 -7.998 4.666 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -3.143 -8.403 3.100 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -4.961 -8.083 4.713 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -4.920 -9.757 4.198 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -3.584 -10.300 6.281 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -3.811 -8.643 6.806 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -5.434 -10.101 7.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -6.194 -8.982 6.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -5.974 -10.587 6.243 1.00 0.00 H new ATOM 361 N VAL A 23 0.485 -8.015 3.172 1.00 0.00 N ATOM 362 CA VAL A 23 1.432 -7.000 3.629 1.00 0.00 C ATOM 363 C VAL A 23 0.672 -5.717 3.978 1.00 0.00 C ATOM 364 O VAL A 23 0.014 -5.135 3.114 1.00 0.00 O ATOM 365 CB VAL A 23 2.500 -6.668 2.538 1.00 0.00 C ATOM 366 CG1 VAL A 23 3.581 -5.728 3.082 1.00 0.00 C ATOM 367 CG2 VAL A 23 3.123 -7.932 1.979 1.00 0.00 C ATOM 0 H VAL A 23 0.169 -7.889 2.210 1.00 0.00 H new ATOM 0 HA VAL A 23 1.947 -7.397 4.504 1.00 0.00 H new ATOM 0 HB VAL A 23 1.986 -6.154 1.725 1.00 0.00 H new ATOM 0 HG11 VAL A 23 4.308 -5.517 2.298 1.00 0.00 H new ATOM 0 HG12 VAL A 23 3.121 -4.796 3.410 1.00 0.00 H new ATOM 0 HG13 VAL A 23 4.084 -6.201 3.925 1.00 0.00 H new ATOM 0 HG21 VAL A 23 3.862 -7.669 1.222 1.00 0.00 H new ATOM 0 HG22 VAL A 23 3.608 -8.485 2.783 1.00 0.00 H new ATOM 0 HG23 VAL A 23 2.347 -8.552 1.529 1.00 0.00 H new ATOM 377 N PRO A 24 0.713 -5.277 5.237 1.00 0.00 N ATOM 378 CA PRO A 24 0.045 -4.058 5.650 1.00 0.00 C ATOM 379 C PRO A 24 0.915 -2.796 5.440 1.00 0.00 C ATOM 380 O PRO A 24 2.040 -2.685 5.958 1.00 0.00 O ATOM 381 CB PRO A 24 -0.219 -4.303 7.136 1.00 0.00 C ATOM 382 CG PRO A 24 0.910 -5.180 7.590 1.00 0.00 C ATOM 383 CD PRO A 24 1.391 -5.945 6.377 1.00 0.00 C ATOM 0 HA PRO A 24 -0.855 -3.862 5.067 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -0.240 -3.366 7.693 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -1.183 -4.788 7.291 1.00 0.00 H new ATOM 0 HG2 PRO A 24 1.717 -4.582 8.014 1.00 0.00 H new ATOM 0 HG3 PRO A 24 0.577 -5.864 8.370 1.00 0.00 H new ATOM 0 HD2 PRO A 24 2.476 -5.897 6.280 1.00 0.00 H new ATOM 0 HD3 PRO A 24 1.123 -7.000 6.438 1.00 0.00 H new ATOM 391 N VAL A 25 0.399 -1.860 4.674 1.00 0.00 N ATOM 392 CA VAL A 25 1.085 -0.601 4.450 1.00 0.00 C ATOM 393 C VAL A 25 0.615 0.371 5.522 1.00 0.00 C ATOM 394 O VAL A 25 -0.544 0.754 5.544 1.00 0.00 O ATOM 395 CB VAL A 25 0.775 -0.020 3.036 1.00 0.00 C ATOM 396 CG1 VAL A 25 1.528 1.283 2.805 1.00 0.00 C ATOM 397 CG2 VAL A 25 1.118 -1.030 1.944 1.00 0.00 C ATOM 0 H VAL A 25 -0.496 -1.945 4.193 1.00 0.00 H new ATOM 0 HA VAL A 25 2.162 -0.759 4.502 1.00 0.00 H new ATOM 0 HB VAL A 25 -0.294 0.188 2.990 1.00 0.00 H new ATOM 0 HG11 VAL A 25 1.294 1.667 1.812 1.00 0.00 H new ATOM 0 HG12 VAL A 25 1.229 2.014 3.556 1.00 0.00 H new ATOM 0 HG13 VAL A 25 2.600 1.102 2.881 1.00 0.00 H new ATOM 0 HG21 VAL A 25 0.893 -0.601 0.968 1.00 0.00 H new ATOM 0 HG22 VAL A 25 2.179 -1.276 1.996 1.00 0.00 H new ATOM 0 HG23 VAL A 25 0.528 -1.935 2.087 1.00 0.00 H new ATOM 407 N THR A 26 1.498 0.746 6.395 1.00 0.00 N ATOM 408 CA THR A 26 1.162 1.551 7.543 1.00 0.00 C ATOM 409 C THR A 26 1.448 3.042 7.266 1.00 0.00 C ATOM 410 O THR A 26 2.418 3.386 6.606 1.00 0.00 O ATOM 411 CB THR A 26 1.982 1.055 8.759 1.00 0.00 C ATOM 412 OG1 THR A 26 1.854 -0.380 8.834 1.00 0.00 O ATOM 413 CG2 THR A 26 1.471 1.663 10.066 1.00 0.00 C ATOM 0 H THR A 26 2.487 0.502 6.335 1.00 0.00 H new ATOM 0 HA THR A 26 0.098 1.453 7.757 1.00 0.00 H new ATOM 0 HB THR A 26 3.021 1.357 8.627 1.00 0.00 H new ATOM 0 HG1 THR A 26 2.368 -0.715 9.598 1.00 0.00 H new ATOM 0 HG21 THR A 26 2.070 1.293 10.898 1.00 0.00 H new ATOM 0 HG22 THR A 26 1.550 2.749 10.017 1.00 0.00 H new ATOM 0 HG23 THR A 26 0.429 1.381 10.215 1.00 0.00 H new ATOM 421 N ILE A 27 0.585 3.891 7.742 1.00 0.00 N ATOM 422 CA ILE A 27 0.721 5.317 7.592 1.00 0.00 C ATOM 423 C ILE A 27 0.590 5.951 8.988 1.00 0.00 C ATOM 424 O ILE A 27 -0.323 5.607 9.746 1.00 0.00 O ATOM 425 CB ILE A 27 -0.337 5.878 6.569 1.00 0.00 C ATOM 426 CG1 ILE A 27 -0.238 7.402 6.417 1.00 0.00 C ATOM 427 CG2 ILE A 27 -1.756 5.449 6.925 1.00 0.00 C ATOM 428 CD1 ILE A 27 -1.194 7.993 5.385 1.00 0.00 C ATOM 0 H ILE A 27 -0.250 3.610 8.256 1.00 0.00 H new ATOM 0 HA ILE A 27 1.696 5.571 7.177 1.00 0.00 H new ATOM 0 HB ILE A 27 -0.097 5.439 5.601 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -0.434 7.865 7.384 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.784 7.662 6.140 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -2.454 5.857 6.194 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -1.820 4.361 6.919 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -2.011 5.822 7.917 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -1.059 9.074 5.341 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -0.985 7.561 4.406 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -2.222 7.767 5.670 1.00 0.00 H new ATOM 440 N SER A 28 1.526 6.803 9.352 1.00 0.00 N ATOM 441 CA SER A 28 1.558 7.368 10.692 1.00 0.00 C ATOM 442 C SER A 28 1.978 8.852 10.673 1.00 0.00 C ATOM 443 O SER A 28 2.481 9.349 9.662 1.00 0.00 O ATOM 444 CB SER A 28 2.561 6.566 11.543 1.00 0.00 C ATOM 445 OG SER A 28 2.311 5.158 11.467 1.00 0.00 O ATOM 0 H SER A 28 2.277 7.122 8.740 1.00 0.00 H new ATOM 0 HA SER A 28 0.556 7.309 11.116 1.00 0.00 H new ATOM 0 HB2 SER A 28 3.575 6.775 11.203 1.00 0.00 H new ATOM 0 HB3 SER A 28 2.499 6.891 12.581 1.00 0.00 H new ATOM 0 HG SER A 28 2.966 4.679 12.017 1.00 0.00 H new ATOM 451 N GLN A 29 1.733 9.540 11.808 1.00 0.00 N ATOM 452 CA GLN A 29 2.144 10.950 12.076 1.00 0.00 C ATOM 453 C GLN A 29 1.389 11.988 11.237 1.00 0.00 C ATOM 454 O GLN A 29 1.752 13.164 11.200 1.00 0.00 O ATOM 455 CB GLN A 29 3.667 11.126 11.946 1.00 0.00 C ATOM 456 CG GLN A 29 4.454 10.218 12.882 1.00 0.00 C ATOM 457 CD GLN A 29 4.111 10.405 14.349 1.00 0.00 C ATOM 458 OE1 GLN A 29 3.212 9.751 14.878 1.00 0.00 O ATOM 459 NE2 GLN A 29 4.812 11.270 15.015 1.00 0.00 N ATOM 0 H GLN A 29 1.229 9.125 12.592 1.00 0.00 H new ATOM 0 HA GLN A 29 1.861 11.145 13.110 1.00 0.00 H new ATOM 0 HB2 GLN A 29 3.964 10.923 10.917 1.00 0.00 H new ATOM 0 HB3 GLN A 29 3.926 12.164 12.153 1.00 0.00 H new ATOM 0 HG2 GLN A 29 4.271 9.180 12.605 1.00 0.00 H new ATOM 0 HG3 GLN A 29 5.519 10.402 12.741 1.00 0.00 H new ATOM 0 HE21 GLN A 29 5.550 11.796 14.548 1.00 0.00 H new ATOM 0 HE22 GLN A 29 4.625 11.424 16.006 1.00 0.00 H new ATOM 468 N VAL A 30 0.302 11.562 10.651 1.00 0.00 N ATOM 469 CA VAL A 30 -0.501 12.403 9.785 1.00 0.00 C ATOM 470 C VAL A 30 -1.495 13.266 10.590 1.00 0.00 C ATOM 471 O VAL A 30 -2.079 12.802 11.581 1.00 0.00 O ATOM 472 CB VAL A 30 -1.244 11.527 8.712 1.00 0.00 C ATOM 473 CG1 VAL A 30 -2.089 10.436 9.348 1.00 0.00 C ATOM 474 CG2 VAL A 30 -2.080 12.369 7.763 1.00 0.00 C ATOM 0 H VAL A 30 -0.059 10.614 10.758 1.00 0.00 H new ATOM 0 HA VAL A 30 0.168 13.090 9.267 1.00 0.00 H new ATOM 0 HB VAL A 30 -0.464 11.042 8.125 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -2.583 9.857 8.568 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.450 9.779 9.938 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -2.841 10.888 9.995 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -2.574 11.720 7.040 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -2.831 12.919 8.330 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -1.435 13.073 7.237 1.00 0.00 H new ATOM 484 N SER A 31 -1.595 14.533 10.231 1.00 0.00 N ATOM 485 CA SER A 31 -2.555 15.427 10.781 1.00 0.00 C ATOM 486 C SER A 31 -3.269 16.191 9.663 1.00 0.00 C ATOM 487 O SER A 31 -4.470 16.461 9.745 1.00 0.00 O ATOM 488 CB SER A 31 -1.871 16.354 11.717 1.00 0.00 C ATOM 489 OG SER A 31 -1.280 15.627 12.797 1.00 0.00 O ATOM 0 H SER A 31 -0.990 14.963 9.532 1.00 0.00 H new ATOM 0 HA SER A 31 -3.312 14.867 11.331 1.00 0.00 H new ATOM 0 HB2 SER A 31 -1.103 16.916 11.186 1.00 0.00 H new ATOM 0 HB3 SER A 31 -2.585 17.080 12.107 1.00 0.00 H new ATOM 0 HG SER A 31 -0.831 16.251 13.405 1.00 0.00 H new ATOM 495 N THR A 32 -2.526 16.520 8.628 1.00 0.00 N ATOM 496 CA THR A 32 -3.062 17.152 7.456 1.00 0.00 C ATOM 497 C THR A 32 -3.772 16.065 6.639 1.00 0.00 C ATOM 498 O THR A 32 -3.185 15.014 6.403 1.00 0.00 O ATOM 499 CB THR A 32 -1.903 17.756 6.628 1.00 0.00 C ATOM 500 OG1 THR A 32 -1.092 18.586 7.475 1.00 0.00 O ATOM 501 CG2 THR A 32 -2.430 18.588 5.489 1.00 0.00 C ATOM 0 H THR A 32 -1.521 16.351 8.583 1.00 0.00 H new ATOM 0 HA THR A 32 -3.756 17.950 7.720 1.00 0.00 H new ATOM 0 HB THR A 32 -1.311 16.937 6.220 1.00 0.00 H new ATOM 0 HG1 THR A 32 -0.957 19.457 7.047 1.00 0.00 H new ATOM 0 HG21 THR A 32 -1.595 19.001 4.923 1.00 0.00 H new ATOM 0 HG22 THR A 32 -3.039 17.965 4.834 1.00 0.00 H new ATOM 0 HG23 THR A 32 -3.038 19.402 5.884 1.00 0.00 H new ATOM 509 N PRO A 33 -5.043 16.266 6.232 1.00 0.00 N ATOM 510 CA PRO A 33 -5.770 15.222 5.533 1.00 0.00 C ATOM 511 C PRO A 33 -5.196 14.912 4.156 1.00 0.00 C ATOM 512 O PRO A 33 -5.130 15.773 3.267 1.00 0.00 O ATOM 513 CB PRO A 33 -7.188 15.779 5.410 1.00 0.00 C ATOM 514 CG PRO A 33 -7.051 17.255 5.566 1.00 0.00 C ATOM 515 CD PRO A 33 -5.841 17.485 6.422 1.00 0.00 C ATOM 0 HA PRO A 33 -5.716 14.277 6.073 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -7.627 15.525 4.445 1.00 0.00 H new ATOM 0 HB3 PRO A 33 -7.841 15.362 6.177 1.00 0.00 H new ATOM 0 HG2 PRO A 33 -6.937 17.738 4.596 1.00 0.00 H new ATOM 0 HG3 PRO A 33 -7.941 17.680 6.031 1.00 0.00 H new ATOM 0 HD2 PRO A 33 -5.293 18.375 6.111 1.00 0.00 H new ATOM 0 HD3 PRO A 33 -6.112 17.627 7.468 1.00 0.00 H new ATOM 523 N VAL A 34 -4.842 13.669 3.988 1.00 0.00 N ATOM 524 CA VAL A 34 -4.304 13.177 2.768 1.00 0.00 C ATOM 525 C VAL A 34 -5.441 12.710 1.869 1.00 0.00 C ATOM 526 O VAL A 34 -6.444 12.198 2.361 1.00 0.00 O ATOM 527 CB VAL A 34 -3.233 12.053 3.015 1.00 0.00 C ATOM 528 CG1 VAL A 34 -3.807 10.831 3.714 1.00 0.00 C ATOM 529 CG2 VAL A 34 -2.532 11.662 1.730 1.00 0.00 C ATOM 0 H VAL A 34 -4.925 12.960 4.717 1.00 0.00 H new ATOM 0 HA VAL A 34 -3.774 13.983 2.261 1.00 0.00 H new ATOM 0 HB VAL A 34 -2.494 12.483 3.691 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -3.020 10.090 3.857 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -4.211 11.123 4.683 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -4.602 10.403 3.104 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -1.799 10.883 1.938 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -3.265 11.289 1.015 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -2.027 12.533 1.311 1.00 0.00 H new ATOM 539 N GLY A 35 -5.326 12.953 0.591 1.00 0.00 N ATOM 540 CA GLY A 35 -6.343 12.491 -0.323 1.00 0.00 C ATOM 541 C GLY A 35 -5.773 12.047 -1.642 1.00 0.00 C ATOM 542 O GLY A 35 -6.506 11.602 -2.521 1.00 0.00 O ATOM 0 H GLY A 35 -4.552 13.460 0.161 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -6.886 11.663 0.132 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -7.064 13.290 -0.493 1.00 0.00 H new ATOM 546 N LEU A 36 -4.461 12.168 -1.782 1.00 0.00 N ATOM 547 CA LEU A 36 -3.783 11.830 -3.006 1.00 0.00 C ATOM 548 C LEU A 36 -2.637 10.908 -2.720 1.00 0.00 C ATOM 549 O LEU A 36 -1.677 11.286 -2.071 1.00 0.00 O ATOM 550 CB LEU A 36 -3.269 13.098 -3.689 1.00 0.00 C ATOM 551 CG LEU A 36 -4.333 14.059 -4.206 1.00 0.00 C ATOM 552 CD1 LEU A 36 -3.692 15.315 -4.774 1.00 0.00 C ATOM 553 CD2 LEU A 36 -5.173 13.369 -5.260 1.00 0.00 C ATOM 0 H LEU A 36 -3.843 12.505 -1.043 1.00 0.00 H new ATOM 0 HA LEU A 36 -4.487 11.329 -3.670 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -2.635 13.635 -2.983 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -2.636 12.804 -4.526 1.00 0.00 H new ATOM 0 HG LEU A 36 -4.975 14.354 -3.376 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.469 15.988 -5.138 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -3.116 15.814 -3.995 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -3.031 15.046 -5.598 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -5.933 14.058 -5.628 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -4.535 13.057 -6.087 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -5.656 12.494 -4.825 1.00 0.00 H new ATOM 565 N ILE A 37 -2.751 9.704 -3.170 1.00 0.00 N ATOM 566 CA ILE A 37 -1.697 8.721 -2.988 1.00 0.00 C ATOM 567 C ILE A 37 -1.467 8.005 -4.315 1.00 0.00 C ATOM 568 O ILE A 37 -2.409 7.636 -4.983 1.00 0.00 O ATOM 569 CB ILE A 37 -1.995 7.626 -1.863 1.00 0.00 C ATOM 570 CG1 ILE A 37 -2.340 8.221 -0.469 1.00 0.00 C ATOM 571 CG2 ILE A 37 -0.825 6.655 -1.714 1.00 0.00 C ATOM 572 CD1 ILE A 37 -3.779 8.689 -0.296 1.00 0.00 C ATOM 0 H ILE A 37 -3.568 9.359 -3.674 1.00 0.00 H new ATOM 0 HA ILE A 37 -0.819 9.272 -2.652 1.00 0.00 H new ATOM 0 HB ILE A 37 -2.882 7.101 -2.216 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -2.127 7.469 0.291 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -1.676 9.064 -0.278 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -1.057 5.922 -0.942 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -0.654 6.143 -2.661 1.00 0.00 H new ATOM 0 HG23 ILE A 37 0.072 7.207 -1.433 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.914 9.086 0.710 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.999 9.468 -1.026 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -4.456 7.848 -0.448 1.00 0.00 H new ATOM 584 N CYS A 38 -0.243 7.861 -4.697 1.00 0.00 N ATOM 585 CA CYS A 38 0.126 7.142 -5.889 1.00 0.00 C ATOM 586 C CYS A 38 1.347 6.313 -5.560 1.00 0.00 C ATOM 587 O CYS A 38 2.176 6.753 -4.766 1.00 0.00 O ATOM 588 CB CYS A 38 0.423 8.128 -7.028 1.00 0.00 C ATOM 589 SG CYS A 38 0.949 7.365 -8.579 1.00 0.00 S ATOM 0 H CYS A 38 0.552 8.244 -4.185 1.00 0.00 H new ATOM 0 HA CYS A 38 -0.686 6.495 -6.220 1.00 0.00 H new ATOM 0 HB2 CYS A 38 -0.471 8.722 -7.217 1.00 0.00 H new ATOM 0 HB3 CYS A 38 1.200 8.818 -6.698 1.00 0.00 H new ATOM 0 HG CYS A 38 2.248 7.359 -8.641 1.00 0.00 H new ATOM 595 N MET A 39 1.419 5.100 -6.085 1.00 0.00 N ATOM 596 CA MET A 39 2.558 4.222 -5.857 1.00 0.00 C ATOM 597 C MET A 39 2.676 3.159 -6.954 1.00 0.00 C ATOM 598 O MET A 39 1.690 2.813 -7.619 1.00 0.00 O ATOM 599 CB MET A 39 2.480 3.561 -4.462 1.00 0.00 C ATOM 600 CG MET A 39 1.206 2.763 -4.208 1.00 0.00 C ATOM 601 SD MET A 39 1.176 1.965 -2.584 1.00 0.00 S ATOM 602 CE MET A 39 1.254 3.381 -1.485 1.00 0.00 C ATOM 0 H MET A 39 0.694 4.697 -6.678 1.00 0.00 H new ATOM 0 HA MET A 39 3.456 4.838 -5.893 1.00 0.00 H new ATOM 0 HB2 MET A 39 3.338 2.900 -4.339 1.00 0.00 H new ATOM 0 HB3 MET A 39 2.565 4.337 -3.701 1.00 0.00 H new ATOM 0 HG2 MET A 39 0.346 3.427 -4.295 1.00 0.00 H new ATOM 0 HG3 MET A 39 1.101 2.002 -4.981 1.00 0.00 H new ATOM 0 HE1 MET A 39 0.944 3.082 -0.484 1.00 0.00 H new ATOM 0 HE2 MET A 39 2.276 3.759 -1.451 1.00 0.00 H new ATOM 0 HE3 MET A 39 0.589 4.163 -1.852 1.00 0.00 H new ATOM 612 N ASP A 40 3.883 2.666 -7.142 1.00 0.00 N ATOM 613 CA ASP A 40 4.189 1.595 -8.105 1.00 0.00 C ATOM 614 C ASP A 40 4.811 0.448 -7.360 1.00 0.00 C ATOM 615 O ASP A 40 5.887 0.596 -6.798 1.00 0.00 O ATOM 616 CB ASP A 40 5.171 2.094 -9.181 1.00 0.00 C ATOM 617 CG ASP A 40 5.772 0.973 -10.032 1.00 0.00 C ATOM 618 OD1 ASP A 40 5.172 0.571 -11.044 1.00 0.00 O ATOM 619 OD2 ASP A 40 6.882 0.509 -9.723 1.00 0.00 O ATOM 0 H ASP A 40 4.701 2.994 -6.628 1.00 0.00 H new ATOM 0 HA ASP A 40 3.269 1.281 -8.597 1.00 0.00 H new ATOM 0 HB2 ASP A 40 4.654 2.797 -9.834 1.00 0.00 H new ATOM 0 HB3 ASP A 40 5.978 2.643 -8.697 1.00 0.00 H new ATOM 624 N ILE A 41 4.144 -0.667 -7.323 1.00 0.00 N ATOM 625 CA ILE A 41 4.654 -1.801 -6.587 1.00 0.00 C ATOM 626 C ILE A 41 5.287 -2.768 -7.561 1.00 0.00 C ATOM 627 O ILE A 41 4.596 -3.410 -8.348 1.00 0.00 O ATOM 628 CB ILE A 41 3.559 -2.576 -5.730 1.00 0.00 C ATOM 629 CG1 ILE A 41 2.839 -1.685 -4.682 1.00 0.00 C ATOM 630 CG2 ILE A 41 4.183 -3.776 -5.010 1.00 0.00 C ATOM 631 CD1 ILE A 41 1.872 -0.665 -5.238 1.00 0.00 C ATOM 0 H ILE A 41 3.250 -0.822 -7.789 1.00 0.00 H new ATOM 0 HA ILE A 41 5.376 -1.404 -5.873 1.00 0.00 H new ATOM 0 HB ILE A 41 2.810 -2.905 -6.450 1.00 0.00 H new ATOM 0 HG12 ILE A 41 2.297 -2.333 -3.993 1.00 0.00 H new ATOM 0 HG13 ILE A 41 3.595 -1.160 -4.098 1.00 0.00 H new ATOM 0 HG21 ILE A 41 3.417 -4.291 -4.430 1.00 0.00 H new ATOM 0 HG22 ILE A 41 4.605 -4.462 -5.745 1.00 0.00 H new ATOM 0 HG23 ILE A 41 4.972 -3.430 -4.342 1.00 0.00 H new ATOM 0 HD11 ILE A 41 1.428 -0.100 -4.418 1.00 0.00 H new ATOM 0 HD12 ILE A 41 2.404 0.016 -5.902 1.00 0.00 H new ATOM 0 HD13 ILE A 41 1.086 -1.175 -5.795 1.00 0.00 H new ATOM 643 N SER A 42 6.578 -2.844 -7.527 1.00 0.00 N ATOM 644 CA SER A 42 7.301 -3.770 -8.327 1.00 0.00 C ATOM 645 C SER A 42 7.720 -4.946 -7.447 1.00 0.00 C ATOM 646 O SER A 42 8.520 -4.801 -6.527 1.00 0.00 O ATOM 647 CB SER A 42 8.503 -3.069 -8.955 1.00 0.00 C ATOM 648 OG SER A 42 8.072 -1.992 -9.775 1.00 0.00 O ATOM 0 H SER A 42 7.164 -2.256 -6.935 1.00 0.00 H new ATOM 0 HA SER A 42 6.683 -4.151 -9.140 1.00 0.00 H new ATOM 0 HB2 SER A 42 9.165 -2.697 -8.173 1.00 0.00 H new ATOM 0 HB3 SER A 42 9.078 -3.780 -9.549 1.00 0.00 H new ATOM 0 HG SER A 42 7.697 -1.282 -9.213 1.00 0.00 H new ATOM 654 N TYR A 43 7.151 -6.086 -7.709 1.00 0.00 N ATOM 655 CA TYR A 43 7.387 -7.264 -6.912 1.00 0.00 C ATOM 656 C TYR A 43 7.874 -8.416 -7.788 1.00 0.00 C ATOM 657 O TYR A 43 7.970 -8.271 -9.009 1.00 0.00 O ATOM 658 CB TYR A 43 6.101 -7.646 -6.140 1.00 0.00 C ATOM 659 CG TYR A 43 4.896 -8.023 -7.002 1.00 0.00 C ATOM 660 CD1 TYR A 43 4.678 -9.333 -7.358 1.00 0.00 C ATOM 661 CD2 TYR A 43 3.980 -7.074 -7.433 1.00 0.00 C ATOM 662 CE1 TYR A 43 3.596 -9.703 -8.112 1.00 0.00 C ATOM 663 CE2 TYR A 43 2.888 -7.446 -8.201 1.00 0.00 C ATOM 664 CZ TYR A 43 2.707 -8.761 -8.534 1.00 0.00 C ATOM 665 OH TYR A 43 1.615 -9.143 -9.286 1.00 0.00 O ATOM 0 H TYR A 43 6.505 -6.230 -8.485 1.00 0.00 H new ATOM 0 HA TYR A 43 8.170 -7.051 -6.184 1.00 0.00 H new ATOM 0 HB2 TYR A 43 6.330 -8.484 -5.482 1.00 0.00 H new ATOM 0 HB3 TYR A 43 5.820 -6.808 -5.502 1.00 0.00 H new ATOM 0 HD1 TYR A 43 5.378 -10.090 -7.035 1.00 0.00 H new ATOM 0 HD2 TYR A 43 4.119 -6.036 -7.168 1.00 0.00 H new ATOM 0 HE1 TYR A 43 3.448 -10.741 -8.372 1.00 0.00 H new ATOM 0 HE2 TYR A 43 2.182 -6.700 -8.536 1.00 0.00 H new ATOM 0 HH TYR A 43 1.352 -10.055 -9.041 1.00 0.00 H new ATOM 675 N ASP A 44 8.165 -9.548 -7.172 1.00 0.00 N ATOM 676 CA ASP A 44 8.624 -10.725 -7.904 1.00 0.00 C ATOM 677 C ASP A 44 7.434 -11.373 -8.594 1.00 0.00 C ATOM 678 O ASP A 44 6.487 -11.826 -7.933 1.00 0.00 O ATOM 679 CB ASP A 44 9.282 -11.722 -6.961 1.00 0.00 C ATOM 680 CG ASP A 44 9.969 -12.861 -7.686 1.00 0.00 C ATOM 681 OD1 ASP A 44 9.294 -13.676 -8.352 1.00 0.00 O ATOM 682 OD2 ASP A 44 11.198 -12.996 -7.543 1.00 0.00 O ATOM 0 H ASP A 44 8.093 -9.682 -6.163 1.00 0.00 H new ATOM 0 HA ASP A 44 9.362 -10.419 -8.645 1.00 0.00 H new ATOM 0 HB2 ASP A 44 10.012 -11.200 -6.342 1.00 0.00 H new ATOM 0 HB3 ASP A 44 8.527 -12.130 -6.289 1.00 0.00 H new ATOM 687 N ALA A 45 7.502 -11.444 -9.900 1.00 0.00 N ATOM 688 CA ALA A 45 6.396 -11.890 -10.733 1.00 0.00 C ATOM 689 C ALA A 45 6.140 -13.391 -10.651 1.00 0.00 C ATOM 690 O ALA A 45 5.015 -13.846 -10.904 1.00 0.00 O ATOM 691 CB ALA A 45 6.643 -11.485 -12.176 1.00 0.00 C ATOM 0 H ALA A 45 8.337 -11.191 -10.429 1.00 0.00 H new ATOM 0 HA ALA A 45 5.500 -11.402 -10.349 1.00 0.00 H new ATOM 0 HB1 ALA A 45 5.812 -11.821 -12.796 1.00 0.00 H new ATOM 0 HB2 ALA A 45 6.728 -10.400 -12.240 1.00 0.00 H new ATOM 0 HB3 ALA A 45 7.567 -11.942 -12.529 1.00 0.00 H new ATOM 697 N SER A 46 7.152 -14.155 -10.315 1.00 0.00 N ATOM 698 CA SER A 46 7.012 -15.591 -10.298 1.00 0.00 C ATOM 699 C SER A 46 6.643 -16.083 -8.897 1.00 0.00 C ATOM 700 O SER A 46 5.992 -17.118 -8.741 1.00 0.00 O ATOM 701 CB SER A 46 8.296 -16.258 -10.802 1.00 0.00 C ATOM 702 OG SER A 46 8.110 -17.648 -11.048 1.00 0.00 O ATOM 0 H SER A 46 8.075 -13.810 -10.052 1.00 0.00 H new ATOM 0 HA SER A 46 6.201 -15.870 -10.970 1.00 0.00 H new ATOM 0 HB2 SER A 46 8.624 -15.768 -11.718 1.00 0.00 H new ATOM 0 HB3 SER A 46 9.089 -16.122 -10.066 1.00 0.00 H new ATOM 0 HG SER A 46 8.949 -18.039 -11.369 1.00 0.00 H new ATOM 708 N LYS A 47 7.068 -15.351 -7.882 1.00 0.00 N ATOM 709 CA LYS A 47 6.763 -15.723 -6.510 1.00 0.00 C ATOM 710 C LYS A 47 5.395 -15.248 -6.094 1.00 0.00 C ATOM 711 O LYS A 47 4.653 -15.980 -5.451 1.00 0.00 O ATOM 712 CB LYS A 47 7.783 -15.155 -5.521 1.00 0.00 C ATOM 713 CG LYS A 47 9.187 -15.679 -5.636 1.00 0.00 C ATOM 714 CD LYS A 47 10.086 -14.930 -4.679 1.00 0.00 C ATOM 715 CE LYS A 47 11.518 -15.368 -4.799 1.00 0.00 C ATOM 716 NZ LYS A 47 12.078 -15.120 -6.149 1.00 0.00 N ATOM 0 H LYS A 47 7.622 -14.500 -7.980 1.00 0.00 H new ATOM 0 HA LYS A 47 6.799 -16.812 -6.485 1.00 0.00 H new ATOM 0 HB2 LYS A 47 7.811 -14.072 -5.643 1.00 0.00 H new ATOM 0 HB3 LYS A 47 7.426 -15.353 -4.510 1.00 0.00 H new ATOM 0 HG2 LYS A 47 9.208 -16.745 -5.412 1.00 0.00 H new ATOM 0 HG3 LYS A 47 9.548 -15.561 -6.658 1.00 0.00 H new ATOM 0 HD2 LYS A 47 10.016 -13.860 -4.876 1.00 0.00 H new ATOM 0 HD3 LYS A 47 9.742 -15.089 -3.657 1.00 0.00 H new ATOM 0 HE2 LYS A 47 12.119 -14.841 -4.058 1.00 0.00 H new ATOM 0 HE3 LYS A 47 11.590 -16.431 -4.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 13.112 -15.028 -6.084 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 11.839 -15.915 -6.775 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 11.676 -14.242 -6.536 1.00 0.00 H new ATOM 730 N PHE A 48 5.051 -14.039 -6.444 1.00 0.00 N ATOM 731 CA PHE A 48 3.836 -13.472 -5.936 1.00 0.00 C ATOM 732 C PHE A 48 2.849 -13.204 -7.034 1.00 0.00 C ATOM 733 O PHE A 48 3.214 -12.846 -8.156 1.00 0.00 O ATOM 734 CB PHE A 48 4.124 -12.186 -5.152 1.00 0.00 C ATOM 735 CG PHE A 48 5.186 -12.349 -4.103 1.00 0.00 C ATOM 736 CD1 PHE A 48 6.416 -11.726 -4.241 1.00 0.00 C ATOM 737 CD2 PHE A 48 4.968 -13.155 -3.002 1.00 0.00 C ATOM 738 CE1 PHE A 48 7.404 -11.903 -3.298 1.00 0.00 C ATOM 739 CE2 PHE A 48 5.951 -13.333 -2.054 1.00 0.00 C ATOM 740 CZ PHE A 48 7.172 -12.708 -2.203 1.00 0.00 C ATOM 0 H PHE A 48 5.586 -13.437 -7.069 1.00 0.00 H new ATOM 0 HA PHE A 48 3.392 -14.203 -5.260 1.00 0.00 H new ATOM 0 HB2 PHE A 48 4.430 -11.406 -5.849 1.00 0.00 H new ATOM 0 HB3 PHE A 48 3.204 -11.846 -4.677 1.00 0.00 H new ATOM 0 HD1 PHE A 48 6.602 -11.095 -5.097 1.00 0.00 H new ATOM 0 HD2 PHE A 48 4.016 -13.651 -2.884 1.00 0.00 H new ATOM 0 HE1 PHE A 48 8.359 -11.412 -3.416 1.00 0.00 H new ATOM 0 HE2 PHE A 48 5.766 -13.961 -1.195 1.00 0.00 H new ATOM 0 HZ PHE A 48 7.945 -12.849 -1.462 1.00 0.00 H new ATOM 750 N THR A 49 1.611 -13.442 -6.734 1.00 0.00 N ATOM 751 CA THR A 49 0.536 -13.146 -7.619 1.00 0.00 C ATOM 752 C THR A 49 -0.526 -12.379 -6.830 1.00 0.00 C ATOM 753 O THR A 49 -1.147 -12.928 -5.920 1.00 0.00 O ATOM 754 CB THR A 49 -0.041 -14.457 -8.190 1.00 0.00 C ATOM 755 OG1 THR A 49 1.059 -15.241 -8.703 1.00 0.00 O ATOM 756 CG2 THR A 49 -1.027 -14.176 -9.321 1.00 0.00 C ATOM 0 H THR A 49 1.317 -13.856 -5.849 1.00 0.00 H new ATOM 0 HA THR A 49 0.878 -12.538 -8.457 1.00 0.00 H new ATOM 0 HB THR A 49 -0.573 -14.991 -7.402 1.00 0.00 H new ATOM 0 HG1 THR A 49 0.717 -16.082 -9.071 1.00 0.00 H new ATOM 0 HG21 THR A 49 -1.418 -15.118 -9.705 1.00 0.00 H new ATOM 0 HG22 THR A 49 -1.850 -13.568 -8.944 1.00 0.00 H new ATOM 0 HG23 THR A 49 -0.518 -13.641 -10.123 1.00 0.00 H new ATOM 764 N VAL A 50 -0.677 -11.110 -7.131 1.00 0.00 N ATOM 765 CA VAL A 50 -1.627 -10.273 -6.427 1.00 0.00 C ATOM 766 C VAL A 50 -3.029 -10.491 -6.982 1.00 0.00 C ATOM 767 O VAL A 50 -3.223 -10.556 -8.208 1.00 0.00 O ATOM 768 CB VAL A 50 -1.231 -8.744 -6.497 1.00 0.00 C ATOM 769 CG1 VAL A 50 -1.201 -8.212 -7.929 1.00 0.00 C ATOM 770 CG2 VAL A 50 -2.143 -7.878 -5.631 1.00 0.00 C ATOM 0 H VAL A 50 -0.152 -10.631 -7.862 1.00 0.00 H new ATOM 0 HA VAL A 50 -1.611 -10.562 -5.376 1.00 0.00 H new ATOM 0 HB VAL A 50 -0.218 -8.681 -6.099 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -0.924 -7.158 -7.920 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -0.471 -8.774 -8.511 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -2.187 -8.324 -8.379 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -1.836 -6.835 -5.709 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -3.173 -7.979 -5.973 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -2.072 -8.201 -4.592 1.00 0.00 H new ATOM 780 N LYS A 51 -3.986 -10.679 -6.105 1.00 0.00 N ATOM 781 CA LYS A 51 -5.353 -10.737 -6.548 1.00 0.00 C ATOM 782 C LYS A 51 -5.905 -9.344 -6.554 1.00 0.00 C ATOM 783 O LYS A 51 -6.321 -8.811 -7.594 1.00 0.00 O ATOM 784 CB LYS A 51 -6.249 -11.572 -5.642 1.00 0.00 C ATOM 785 CG LYS A 51 -5.960 -13.052 -5.556 1.00 0.00 C ATOM 786 CD LYS A 51 -7.119 -13.814 -4.857 1.00 0.00 C ATOM 787 CE LYS A 51 -7.254 -13.586 -3.324 1.00 0.00 C ATOM 788 NZ LYS A 51 -7.430 -12.163 -2.905 1.00 0.00 N ATOM 0 H LYS A 51 -3.846 -10.792 -5.101 1.00 0.00 H new ATOM 0 HA LYS A 51 -5.346 -11.200 -7.535 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -6.191 -11.158 -4.635 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -7.278 -11.448 -5.979 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -5.810 -13.454 -6.558 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.033 -13.212 -5.006 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -8.057 -13.525 -5.332 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -6.987 -14.881 -5.036 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -8.105 -14.163 -2.961 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -6.366 -13.985 -2.834 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -7.948 -12.128 -2.004 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -6.497 -11.718 -2.786 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -7.967 -11.651 -3.633 1.00 0.00 H new ATOM 802 N ASP A 52 -5.839 -8.739 -5.404 1.00 0.00 N ATOM 803 CA ASP A 52 -6.427 -7.467 -5.143 1.00 0.00 C ATOM 804 C ASP A 52 -5.813 -6.927 -3.889 1.00 0.00 C ATOM 805 O ASP A 52 -4.941 -7.575 -3.297 1.00 0.00 O ATOM 806 CB ASP A 52 -7.962 -7.607 -4.975 1.00 0.00 C ATOM 807 CG ASP A 52 -8.386 -8.541 -3.838 1.00 0.00 C ATOM 808 OD1 ASP A 52 -8.711 -8.052 -2.747 1.00 0.00 O ATOM 809 OD2 ASP A 52 -8.445 -9.789 -4.050 1.00 0.00 O ATOM 0 H ASP A 52 -5.357 -9.135 -4.597 1.00 0.00 H new ATOM 0 HA ASP A 52 -6.244 -6.788 -5.976 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -8.388 -6.620 -4.797 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -8.387 -7.974 -5.909 1.00 0.00 H new ATOM 814 N VAL A 53 -6.189 -5.744 -3.507 1.00 0.00 N ATOM 815 CA VAL A 53 -5.712 -5.187 -2.278 1.00 0.00 C ATOM 816 C VAL A 53 -6.904 -4.738 -1.459 1.00 0.00 C ATOM 817 O VAL A 53 -7.926 -4.289 -2.014 1.00 0.00 O ATOM 818 CB VAL A 53 -4.668 -4.024 -2.463 1.00 0.00 C ATOM 819 CG1 VAL A 53 -3.459 -4.484 -3.271 1.00 0.00 C ATOM 820 CG2 VAL A 53 -5.285 -2.804 -3.102 1.00 0.00 C ATOM 0 H VAL A 53 -6.827 -5.144 -4.031 1.00 0.00 H new ATOM 0 HA VAL A 53 -5.161 -5.967 -1.753 1.00 0.00 H new ATOM 0 HB VAL A 53 -4.334 -3.746 -1.463 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -2.758 -3.656 -3.380 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -2.969 -5.309 -2.754 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -3.785 -4.815 -4.257 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -4.528 -2.027 -3.210 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -5.678 -3.067 -4.084 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -6.096 -2.435 -2.474 1.00 0.00 H new ATOM 830 N LEU A 54 -6.798 -4.887 -0.178 1.00 0.00 N ATOM 831 CA LEU A 54 -7.871 -4.560 0.722 1.00 0.00 C ATOM 832 C LEU A 54 -7.624 -3.181 1.323 1.00 0.00 C ATOM 833 O LEU A 54 -6.668 -2.992 2.074 1.00 0.00 O ATOM 834 CB LEU A 54 -7.957 -5.621 1.826 1.00 0.00 C ATOM 835 CG LEU A 54 -8.126 -7.075 1.354 1.00 0.00 C ATOM 836 CD1 LEU A 54 -8.047 -8.027 2.526 1.00 0.00 C ATOM 837 CD2 LEU A 54 -9.446 -7.258 0.622 1.00 0.00 C ATOM 0 H LEU A 54 -5.960 -5.242 0.283 1.00 0.00 H new ATOM 0 HA LEU A 54 -8.817 -4.544 0.180 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -7.053 -5.560 2.432 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -8.795 -5.372 2.477 1.00 0.00 H new ATOM 0 HG LEU A 54 -7.314 -7.300 0.663 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -8.169 -9.051 2.172 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -7.077 -7.924 3.013 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -8.838 -7.793 3.239 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -9.542 -8.294 0.298 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -10.270 -7.009 1.290 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -9.473 -6.602 -0.248 1.00 0.00 H new ATOM 849 N PRO A 55 -8.440 -2.188 0.970 1.00 0.00 N ATOM 850 CA PRO A 55 -8.282 -0.838 1.473 1.00 0.00 C ATOM 851 C PRO A 55 -8.925 -0.666 2.844 1.00 0.00 C ATOM 852 O PRO A 55 -9.987 -1.240 3.131 1.00 0.00 O ATOM 853 CB PRO A 55 -9.012 0.005 0.433 1.00 0.00 C ATOM 854 CG PRO A 55 -10.097 -0.889 -0.079 1.00 0.00 C ATOM 855 CD PRO A 55 -9.592 -2.302 0.052 1.00 0.00 C ATOM 0 HA PRO A 55 -7.236 -0.563 1.607 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -9.422 0.913 0.875 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -8.341 0.315 -0.369 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -11.014 -0.751 0.494 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -10.332 -0.657 -1.118 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -10.359 -2.964 0.455 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -9.294 -2.710 -0.914 1.00 0.00 H new ATOM 863 N ASN A 56 -8.293 0.094 3.685 1.00 0.00 N ATOM 864 CA ASN A 56 -8.833 0.354 5.000 1.00 0.00 C ATOM 865 C ASN A 56 -9.859 1.463 4.926 1.00 0.00 C ATOM 866 O ASN A 56 -9.532 2.612 4.603 1.00 0.00 O ATOM 867 CB ASN A 56 -7.718 0.684 5.980 1.00 0.00 C ATOM 868 CG ASN A 56 -8.197 1.157 7.346 1.00 0.00 C ATOM 869 OD1 ASN A 56 -9.266 0.790 7.829 1.00 0.00 O ATOM 870 ND2 ASN A 56 -7.399 1.957 7.978 1.00 0.00 N ATOM 0 H ASN A 56 -7.401 0.549 3.491 1.00 0.00 H new ATOM 0 HA ASN A 56 -9.332 -0.543 5.366 1.00 0.00 H new ATOM 0 HB2 ASN A 56 -7.095 -0.201 6.114 1.00 0.00 H new ATOM 0 HB3 ASN A 56 -7.085 1.456 5.544 1.00 0.00 H new ATOM 0 HD21 ASN A 56 -7.651 2.301 8.905 1.00 0.00 H new ATOM 0 HD22 ASN A 56 -6.519 2.243 7.549 1.00 0.00 H new ATOM 877 N THR A 57 -11.082 1.115 5.248 1.00 0.00 N ATOM 878 CA THR A 57 -12.224 1.990 5.174 1.00 0.00 C ATOM 879 C THR A 57 -12.216 3.086 6.243 1.00 0.00 C ATOM 880 O THR A 57 -12.922 4.094 6.114 1.00 0.00 O ATOM 881 CB THR A 57 -13.496 1.149 5.257 1.00 0.00 C ATOM 882 OG1 THR A 57 -13.265 0.073 6.191 1.00 0.00 O ATOM 883 CG2 THR A 57 -13.852 0.577 3.891 1.00 0.00 C ATOM 0 H THR A 57 -11.316 0.180 5.581 1.00 0.00 H new ATOM 0 HA THR A 57 -12.182 2.515 4.220 1.00 0.00 H new ATOM 0 HB THR A 57 -14.326 1.772 5.589 1.00 0.00 H new ATOM 0 HG1 THR A 57 -14.072 -0.479 6.260 1.00 0.00 H new ATOM 0 HG21 THR A 57 -14.761 -0.019 3.972 1.00 0.00 H new ATOM 0 HG22 THR A 57 -14.014 1.392 3.186 1.00 0.00 H new ATOM 0 HG23 THR A 57 -13.036 -0.052 3.536 1.00 0.00 H new ATOM 891 N ASP A 58 -11.410 2.898 7.288 1.00 0.00 N ATOM 892 CA ASP A 58 -11.253 3.916 8.335 1.00 0.00 C ATOM 893 C ASP A 58 -10.520 5.115 7.756 1.00 0.00 C ATOM 894 O ASP A 58 -10.742 6.266 8.149 1.00 0.00 O ATOM 895 CB ASP A 58 -10.479 3.351 9.539 1.00 0.00 C ATOM 896 CG ASP A 58 -10.255 4.365 10.651 1.00 0.00 C ATOM 897 OD1 ASP A 58 -11.184 4.608 11.453 1.00 0.00 O ATOM 898 OD2 ASP A 58 -9.138 4.893 10.770 1.00 0.00 O ATOM 0 H ASP A 58 -10.856 2.054 7.435 1.00 0.00 H new ATOM 0 HA ASP A 58 -12.239 4.221 8.685 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -11.024 2.497 9.942 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -9.513 2.980 9.197 1.00 0.00 H new ATOM 903 N LEU A 59 -9.690 4.844 6.775 1.00 0.00 N ATOM 904 CA LEU A 59 -8.950 5.876 6.124 1.00 0.00 C ATOM 905 C LEU A 59 -9.609 6.276 4.832 1.00 0.00 C ATOM 906 O LEU A 59 -10.045 7.400 4.706 1.00 0.00 O ATOM 907 CB LEU A 59 -7.499 5.472 5.898 1.00 0.00 C ATOM 908 CG LEU A 59 -6.691 5.185 7.157 1.00 0.00 C ATOM 909 CD1 LEU A 59 -5.256 4.933 6.816 1.00 0.00 C ATOM 910 CD2 LEU A 59 -6.812 6.310 8.161 1.00 0.00 C ATOM 0 H LEU A 59 -9.516 3.906 6.415 1.00 0.00 H new ATOM 0 HA LEU A 59 -8.945 6.743 6.785 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -7.482 4.583 5.267 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -7.002 6.267 5.342 1.00 0.00 H new ATOM 0 HG LEU A 59 -7.101 4.286 7.617 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -4.695 4.730 7.728 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.186 4.074 6.148 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.840 5.811 6.322 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -6.223 6.072 9.047 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -6.443 7.235 7.718 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -7.857 6.435 8.443 1.00 0.00 H new ATOM 922 N VAL A 60 -9.736 5.347 3.920 1.00 0.00 N ATOM 923 CA VAL A 60 -10.290 5.619 2.602 1.00 0.00 C ATOM 924 C VAL A 60 -11.808 5.456 2.661 1.00 0.00 C ATOM 925 O VAL A 60 -12.302 4.398 3.064 1.00 0.00 O ATOM 926 CB VAL A 60 -9.702 4.631 1.539 1.00 0.00 C ATOM 927 CG1 VAL A 60 -10.150 4.995 0.131 1.00 0.00 C ATOM 928 CG2 VAL A 60 -8.175 4.568 1.620 1.00 0.00 C ATOM 0 H VAL A 60 -9.460 4.375 4.062 1.00 0.00 H new ATOM 0 HA VAL A 60 -10.029 6.636 2.310 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.094 3.640 1.770 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -9.723 4.288 -0.581 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -11.238 4.955 0.074 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -9.810 6.002 -0.110 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -7.799 3.873 0.869 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -7.760 5.559 1.438 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -7.877 4.227 2.611 1.00 0.00 H new ATOM 938 N LYS A 61 -12.543 6.487 2.285 1.00 0.00 N ATOM 939 CA LYS A 61 -13.990 6.427 2.345 1.00 0.00 C ATOM 940 C LYS A 61 -14.580 6.239 0.977 1.00 0.00 C ATOM 941 O LYS A 61 -14.174 6.890 0.030 1.00 0.00 O ATOM 942 CB LYS A 61 -14.645 7.626 3.071 1.00 0.00 C ATOM 943 CG LYS A 61 -14.416 7.683 4.585 1.00 0.00 C ATOM 944 CD LYS A 61 -13.037 8.188 4.942 1.00 0.00 C ATOM 945 CE LYS A 61 -12.810 8.179 6.439 1.00 0.00 C ATOM 946 NZ LYS A 61 -11.480 8.719 6.780 1.00 0.00 N ATOM 0 H LYS A 61 -12.165 7.368 1.938 1.00 0.00 H new ATOM 0 HA LYS A 61 -14.220 5.554 2.955 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -14.267 8.548 2.629 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -15.718 7.600 2.884 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -15.166 8.331 5.039 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -14.556 6.688 5.008 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -12.284 7.567 4.456 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -12.910 9.201 4.560 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -13.583 8.771 6.930 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -12.900 7.161 6.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -11.166 8.321 7.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -10.800 8.463 6.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -11.535 9.755 6.857 1.00 0.00 H new ATOM 960 N ASP A 62 -15.557 5.351 0.930 1.00 0.00 N ATOM 961 CA ASP A 62 -16.268 4.903 -0.272 1.00 0.00 C ATOM 962 C ASP A 62 -15.352 4.657 -1.472 1.00 0.00 C ATOM 963 O ASP A 62 -15.166 5.513 -2.351 1.00 0.00 O ATOM 964 CB ASP A 62 -17.442 5.785 -0.635 1.00 0.00 C ATOM 965 CG ASP A 62 -18.353 5.078 -1.597 1.00 0.00 C ATOM 966 OD1 ASP A 62 -19.143 4.227 -1.145 1.00 0.00 O ATOM 967 OD2 ASP A 62 -18.311 5.347 -2.794 1.00 0.00 O ATOM 0 H ASP A 62 -15.901 4.892 1.774 1.00 0.00 H new ATOM 0 HA ASP A 62 -16.679 3.931 0.002 1.00 0.00 H new ATOM 0 HB2 ASP A 62 -17.993 6.055 0.265 1.00 0.00 H new ATOM 0 HB3 ASP A 62 -17.083 6.713 -1.080 1.00 0.00 H new ATOM 972 N THR A 63 -14.794 3.485 -1.496 1.00 0.00 N ATOM 973 CA THR A 63 -13.815 3.091 -2.469 1.00 0.00 C ATOM 974 C THR A 63 -14.371 2.982 -3.902 1.00 0.00 C ATOM 975 O THR A 63 -13.673 3.331 -4.878 1.00 0.00 O ATOM 976 CB THR A 63 -13.169 1.763 -2.023 1.00 0.00 C ATOM 977 OG1 THR A 63 -14.191 0.810 -1.683 1.00 0.00 O ATOM 978 CG2 THR A 63 -12.276 1.989 -0.814 1.00 0.00 C ATOM 0 H THR A 63 -15.012 2.753 -0.820 1.00 0.00 H new ATOM 0 HA THR A 63 -13.065 3.881 -2.513 1.00 0.00 H new ATOM 0 HB THR A 63 -12.568 1.378 -2.847 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.774 -0.031 -1.402 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.827 1.043 -0.511 1.00 0.00 H new ATOM 0 HG22 THR A 63 -11.489 2.698 -1.070 1.00 0.00 H new ATOM 0 HG23 THR A 63 -12.870 2.388 0.008 1.00 0.00 H new ATOM 986 N ASP A 64 -15.636 2.577 -4.017 1.00 0.00 N ATOM 987 CA ASP A 64 -16.270 2.306 -5.320 1.00 0.00 C ATOM 988 C ASP A 64 -16.465 3.568 -6.163 1.00 0.00 C ATOM 989 O ASP A 64 -16.381 3.518 -7.393 1.00 0.00 O ATOM 990 CB ASP A 64 -17.598 1.556 -5.147 1.00 0.00 C ATOM 991 CG ASP A 64 -18.252 1.199 -6.473 1.00 0.00 C ATOM 992 OD1 ASP A 64 -19.265 1.821 -6.833 1.00 0.00 O ATOM 993 OD2 ASP A 64 -17.753 0.290 -7.177 1.00 0.00 O ATOM 0 H ASP A 64 -16.252 2.426 -3.218 1.00 0.00 H new ATOM 0 HA ASP A 64 -15.578 1.666 -5.868 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -17.423 0.644 -4.577 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -18.283 2.170 -4.563 1.00 0.00 H new ATOM 998 N ASN A 65 -16.649 4.707 -5.511 1.00 0.00 N ATOM 999 CA ASN A 65 -16.844 5.992 -6.220 1.00 0.00 C ATOM 1000 C ASN A 65 -15.567 6.631 -6.756 1.00 0.00 C ATOM 1001 O ASN A 65 -15.461 7.862 -6.828 1.00 0.00 O ATOM 1002 CB ASN A 65 -17.719 6.991 -5.465 1.00 0.00 C ATOM 1003 CG ASN A 65 -19.199 6.754 -5.732 1.00 0.00 C ATOM 1004 OD1 ASN A 65 -19.761 7.297 -6.687 1.00 0.00 O ATOM 1005 ND2 ASN A 65 -19.837 5.959 -4.916 1.00 0.00 N ATOM 0 H ASN A 65 -16.670 4.782 -4.494 1.00 0.00 H new ATOM 0 HA ASN A 65 -17.408 5.700 -7.106 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -17.524 6.910 -4.396 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -17.453 8.006 -5.762 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -20.829 5.771 -5.059 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -19.343 5.526 -4.136 1.00 0.00 H new ATOM 1012 N TYR A 66 -14.596 5.773 -7.106 1.00 0.00 N ATOM 1013 CA TYR A 66 -13.337 6.142 -7.761 1.00 0.00 C ATOM 1014 C TYR A 66 -12.340 6.726 -6.751 1.00 0.00 C ATOM 1015 O TYR A 66 -11.472 7.521 -7.080 1.00 0.00 O ATOM 1016 CB TYR A 66 -13.603 7.060 -9.012 1.00 0.00 C ATOM 1017 CG TYR A 66 -12.414 7.300 -9.922 1.00 0.00 C ATOM 1018 CD1 TYR A 66 -11.838 8.561 -10.034 1.00 0.00 C ATOM 1019 CD2 TYR A 66 -11.866 6.263 -10.660 1.00 0.00 C ATOM 1020 CE1 TYR A 66 -10.752 8.778 -10.851 1.00 0.00 C ATOM 1021 CE2 TYR A 66 -10.782 6.473 -11.482 1.00 0.00 C ATOM 1022 CZ TYR A 66 -10.229 7.732 -11.571 1.00 0.00 C ATOM 1023 OH TYR A 66 -9.139 7.939 -12.385 1.00 0.00 O ATOM 0 H TYR A 66 -14.671 4.770 -6.934 1.00 0.00 H new ATOM 0 HA TYR A 66 -12.860 5.243 -8.152 1.00 0.00 H new ATOM 0 HB2 TYR A 66 -14.403 6.614 -9.602 1.00 0.00 H new ATOM 0 HB3 TYR A 66 -13.967 8.025 -8.659 1.00 0.00 H new ATOM 0 HD1 TYR A 66 -12.250 9.384 -9.470 1.00 0.00 H new ATOM 0 HD2 TYR A 66 -12.296 5.275 -10.589 1.00 0.00 H new ATOM 0 HE1 TYR A 66 -10.315 9.763 -10.925 1.00 0.00 H new ATOM 0 HE2 TYR A 66 -10.367 5.656 -12.054 1.00 0.00 H new ATOM 0 HH TYR A 66 -8.893 7.097 -12.823 1.00 0.00 H new ATOM 1033 N SER A 67 -12.461 6.290 -5.516 1.00 0.00 N ATOM 1034 CA SER A 67 -11.492 6.646 -4.503 1.00 0.00 C ATOM 1035 C SER A 67 -10.363 5.594 -4.542 1.00 0.00 C ATOM 1036 O SER A 67 -9.175 5.895 -4.355 1.00 0.00 O ATOM 1037 CB SER A 67 -12.172 6.710 -3.112 1.00 0.00 C ATOM 1038 OG SER A 67 -11.290 7.157 -2.109 1.00 0.00 O ATOM 0 H SER A 67 -13.219 5.690 -5.190 1.00 0.00 H new ATOM 0 HA SER A 67 -11.072 7.633 -4.695 1.00 0.00 H new ATOM 0 HB2 SER A 67 -13.033 7.377 -3.160 1.00 0.00 H new ATOM 0 HB3 SER A 67 -12.549 5.722 -2.848 1.00 0.00 H new ATOM 0 HG SER A 67 -11.741 7.823 -1.549 1.00 0.00 H new ATOM 1044 N PHE A 68 -10.757 4.380 -4.894 1.00 0.00 N ATOM 1045 CA PHE A 68 -9.881 3.236 -4.960 1.00 0.00 C ATOM 1046 C PHE A 68 -9.541 2.922 -6.412 1.00 0.00 C ATOM 1047 O PHE A 68 -10.397 2.451 -7.174 1.00 0.00 O ATOM 1048 CB PHE A 68 -10.617 2.058 -4.304 1.00 0.00 C ATOM 1049 CG PHE A 68 -9.931 0.721 -4.304 1.00 0.00 C ATOM 1050 CD1 PHE A 68 -10.248 -0.242 -5.253 1.00 0.00 C ATOM 1051 CD2 PHE A 68 -9.000 0.422 -3.346 1.00 0.00 C ATOM 1052 CE1 PHE A 68 -9.641 -1.475 -5.235 1.00 0.00 C ATOM 1053 CE2 PHE A 68 -8.385 -0.808 -3.321 1.00 0.00 C ATOM 1054 CZ PHE A 68 -8.706 -1.760 -4.268 1.00 0.00 C ATOM 0 H PHE A 68 -11.721 4.165 -5.147 1.00 0.00 H new ATOM 0 HA PHE A 68 -8.944 3.431 -4.439 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -10.827 2.328 -3.269 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -11.578 1.942 -4.804 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -10.981 -0.019 -6.015 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -8.745 1.161 -2.601 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -9.897 -2.217 -5.977 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -7.651 -1.029 -2.560 1.00 0.00 H new ATOM 0 HZ PHE A 68 -8.224 -2.726 -4.249 1.00 0.00 H new ATOM 1064 N ILE A 69 -8.328 3.224 -6.812 1.00 0.00 N ATOM 1065 CA ILE A 69 -7.882 2.906 -8.148 1.00 0.00 C ATOM 1066 C ILE A 69 -6.704 1.960 -8.039 1.00 0.00 C ATOM 1067 O ILE A 69 -5.609 2.347 -7.630 1.00 0.00 O ATOM 1068 CB ILE A 69 -7.433 4.166 -8.994 1.00 0.00 C ATOM 1069 CG1 ILE A 69 -8.521 5.241 -9.113 1.00 0.00 C ATOM 1070 CG2 ILE A 69 -6.976 3.760 -10.387 1.00 0.00 C ATOM 1071 CD1 ILE A 69 -8.698 6.115 -7.894 1.00 0.00 C ATOM 0 H ILE A 69 -7.632 3.690 -6.230 1.00 0.00 H new ATOM 0 HA ILE A 69 -8.731 2.464 -8.670 1.00 0.00 H new ATOM 0 HB ILE A 69 -6.600 4.602 -8.442 1.00 0.00 H new ATOM 0 HG12 ILE A 69 -8.288 5.878 -9.966 1.00 0.00 H new ATOM 0 HG13 ILE A 69 -9.470 4.752 -9.330 1.00 0.00 H new ATOM 0 HG21 ILE A 69 -6.674 4.647 -10.944 1.00 0.00 H new ATOM 0 HG22 ILE A 69 -6.131 3.076 -10.308 1.00 0.00 H new ATOM 0 HG23 ILE A 69 -7.795 3.266 -10.909 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -9.489 6.841 -8.079 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -8.967 5.496 -7.038 1.00 0.00 H new ATOM 0 HD13 ILE A 69 -7.766 6.640 -7.684 1.00 0.00 H new ATOM 1083 N VAL A 70 -6.927 0.731 -8.363 1.00 0.00 N ATOM 1084 CA VAL A 70 -5.873 -0.236 -8.375 1.00 0.00 C ATOM 1085 C VAL A 70 -5.862 -0.891 -9.709 1.00 0.00 C ATOM 1086 O VAL A 70 -6.775 -1.630 -10.073 1.00 0.00 O ATOM 1087 CB VAL A 70 -5.987 -1.292 -7.231 1.00 0.00 C ATOM 1088 CG1 VAL A 70 -4.913 -2.377 -7.361 1.00 0.00 C ATOM 1089 CG2 VAL A 70 -5.856 -0.607 -5.890 1.00 0.00 C ATOM 0 H VAL A 70 -7.842 0.365 -8.627 1.00 0.00 H new ATOM 0 HA VAL A 70 -4.931 0.282 -8.192 1.00 0.00 H new ATOM 0 HB VAL A 70 -6.963 -1.770 -7.310 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -5.022 -3.096 -6.549 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -5.027 -2.889 -8.316 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -3.925 -1.919 -7.311 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -5.936 -1.347 -5.094 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -4.887 -0.111 -5.828 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -6.650 0.132 -5.780 1.00 0.00 H new ATOM 1099 N ASN A 71 -4.862 -0.591 -10.432 1.00 0.00 N ATOM 1100 CA ASN A 71 -4.683 -1.089 -11.739 1.00 0.00 C ATOM 1101 C ASN A 71 -3.702 -2.223 -11.693 1.00 0.00 C ATOM 1102 O ASN A 71 -2.515 -2.031 -11.368 1.00 0.00 O ATOM 1103 CB ASN A 71 -4.213 0.049 -12.658 1.00 0.00 C ATOM 1104 CG ASN A 71 -3.779 -0.394 -14.040 1.00 0.00 C ATOM 1105 OD1 ASN A 71 -4.593 -0.498 -14.950 1.00 0.00 O ATOM 1106 ND2 ASN A 71 -2.500 -0.619 -14.221 1.00 0.00 N ATOM 0 H ASN A 71 -4.115 0.031 -10.123 1.00 0.00 H new ATOM 0 HA ASN A 71 -5.621 -1.470 -12.144 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -5.021 0.773 -12.760 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -3.381 0.565 -12.179 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -2.155 -0.890 -15.142 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -1.850 -0.523 -13.441 1.00 0.00 H new ATOM 1113 N THR A 72 -4.192 -3.395 -11.947 1.00 0.00 N ATOM 1114 CA THR A 72 -3.374 -4.555 -11.977 1.00 0.00 C ATOM 1115 C THR A 72 -2.566 -4.513 -13.269 1.00 0.00 C ATOM 1116 O THR A 72 -3.100 -4.686 -14.361 1.00 0.00 O ATOM 1117 CB THR A 72 -4.232 -5.831 -11.904 1.00 0.00 C ATOM 1118 OG1 THR A 72 -5.226 -5.663 -10.861 1.00 0.00 O ATOM 1119 CG2 THR A 72 -3.359 -7.023 -11.549 1.00 0.00 C ATOM 0 H THR A 72 -5.178 -3.570 -12.140 1.00 0.00 H new ATOM 0 HA THR A 72 -2.707 -4.572 -11.115 1.00 0.00 H new ATOM 0 HB THR A 72 -4.708 -6.002 -12.869 1.00 0.00 H new ATOM 0 HG1 THR A 72 -5.781 -6.469 -10.805 1.00 0.00 H new ATOM 0 HG21 THR A 72 -3.973 -7.922 -11.499 1.00 0.00 H new ATOM 0 HG22 THR A 72 -2.590 -7.151 -12.311 1.00 0.00 H new ATOM 0 HG23 THR A 72 -2.886 -6.853 -10.582 1.00 0.00 H new ATOM 1127 N SER A 73 -1.316 -4.198 -13.125 1.00 0.00 N ATOM 1128 CA SER A 73 -0.422 -4.018 -14.217 1.00 0.00 C ATOM 1129 C SER A 73 0.176 -5.365 -14.610 1.00 0.00 C ATOM 1130 O SER A 73 -0.183 -6.409 -14.026 1.00 0.00 O ATOM 1131 CB SER A 73 0.660 -2.985 -13.841 1.00 0.00 C ATOM 1132 OG SER A 73 1.417 -2.567 -14.974 1.00 0.00 O ATOM 0 H SER A 73 -0.880 -4.056 -12.214 1.00 0.00 H new ATOM 0 HA SER A 73 -0.956 -3.627 -15.083 1.00 0.00 H new ATOM 0 HB2 SER A 73 0.188 -2.117 -13.380 1.00 0.00 H new ATOM 0 HB3 SER A 73 1.330 -3.416 -13.097 1.00 0.00 H new ATOM 0 HG SER A 73 2.090 -1.912 -14.694 1.00 0.00 H new ATOM 1138 N THR A 74 0.971 -5.349 -15.661 1.00 0.00 N ATOM 1139 CA THR A 74 1.692 -6.492 -16.169 1.00 0.00 C ATOM 1140 C THR A 74 2.418 -7.212 -14.997 1.00 0.00 C ATOM 1141 O THR A 74 2.972 -6.527 -14.123 1.00 0.00 O ATOM 1142 CB THR A 74 2.728 -5.953 -17.170 1.00 0.00 C ATOM 1143 OG1 THR A 74 2.074 -4.991 -18.027 1.00 0.00 O ATOM 1144 CG2 THR A 74 3.303 -7.067 -18.028 1.00 0.00 C ATOM 0 H THR A 74 1.137 -4.502 -16.205 1.00 0.00 H new ATOM 0 HA THR A 74 1.019 -7.205 -16.646 1.00 0.00 H new ATOM 0 HB THR A 74 3.547 -5.495 -16.615 1.00 0.00 H new ATOM 0 HG1 THR A 74 2.720 -4.635 -18.672 1.00 0.00 H new ATOM 0 HG21 THR A 74 4.031 -6.651 -18.724 1.00 0.00 H new ATOM 0 HG22 THR A 74 3.791 -7.803 -17.389 1.00 0.00 H new ATOM 0 HG23 THR A 74 2.500 -7.547 -18.587 1.00 0.00 H new ATOM 1152 N PRO A 75 2.356 -8.594 -14.943 1.00 0.00 N ATOM 1153 CA PRO A 75 2.934 -9.421 -13.866 1.00 0.00 C ATOM 1154 C PRO A 75 4.246 -8.879 -13.306 1.00 0.00 C ATOM 1155 O PRO A 75 5.223 -8.656 -14.038 1.00 0.00 O ATOM 1156 CB PRO A 75 3.149 -10.794 -14.524 1.00 0.00 C ATOM 1157 CG PRO A 75 2.541 -10.700 -15.896 1.00 0.00 C ATOM 1158 CD PRO A 75 1.697 -9.457 -15.927 1.00 0.00 C ATOM 0 HA PRO A 75 2.270 -9.446 -13.002 1.00 0.00 H new ATOM 0 HB2 PRO A 75 4.210 -11.035 -14.584 1.00 0.00 H new ATOM 0 HB3 PRO A 75 2.675 -11.584 -13.941 1.00 0.00 H new ATOM 0 HG2 PRO A 75 3.319 -10.656 -16.659 1.00 0.00 H new ATOM 0 HG3 PRO A 75 1.936 -11.581 -16.109 1.00 0.00 H new ATOM 0 HD2 PRO A 75 1.682 -9.003 -16.918 1.00 0.00 H new ATOM 0 HD3 PRO A 75 0.662 -9.664 -15.655 1.00 0.00 H new ATOM 1166 N GLY A 76 4.246 -8.652 -12.015 1.00 0.00 N ATOM 1167 CA GLY A 76 5.377 -8.069 -11.357 1.00 0.00 C ATOM 1168 C GLY A 76 5.146 -6.620 -10.957 1.00 0.00 C ATOM 1169 O GLY A 76 5.933 -6.065 -10.203 1.00 0.00 O ATOM 0 H GLY A 76 3.463 -8.867 -11.398 1.00 0.00 H new ATOM 0 HA2 GLY A 76 5.615 -8.653 -10.468 1.00 0.00 H new ATOM 0 HA3 GLY A 76 6.243 -8.125 -12.016 1.00 0.00 H new ATOM 1173 N LYS A 77 4.079 -6.004 -11.451 1.00 0.00 N ATOM 1174 CA LYS A 77 3.755 -4.621 -11.092 1.00 0.00 C ATOM 1175 C LYS A 77 2.298 -4.419 -10.698 1.00 0.00 C ATOM 1176 O LYS A 77 1.398 -5.112 -11.180 1.00 0.00 O ATOM 1177 CB LYS A 77 4.089 -3.644 -12.218 1.00 0.00 C ATOM 1178 CG LYS A 77 5.543 -3.258 -12.333 1.00 0.00 C ATOM 1179 CD LYS A 77 5.729 -2.266 -13.464 1.00 0.00 C ATOM 1180 CE LYS A 77 7.112 -1.649 -13.455 1.00 0.00 C ATOM 1181 NZ LYS A 77 7.365 -0.908 -12.205 1.00 0.00 N ATOM 0 H LYS A 77 3.422 -6.436 -12.101 1.00 0.00 H new ATOM 0 HA LYS A 77 4.377 -4.414 -10.221 1.00 0.00 H new ATOM 0 HB2 LYS A 77 3.772 -4.084 -13.163 1.00 0.00 H new ATOM 0 HB3 LYS A 77 3.501 -2.738 -12.075 1.00 0.00 H new ATOM 0 HG2 LYS A 77 5.887 -2.821 -11.395 1.00 0.00 H new ATOM 0 HG3 LYS A 77 6.150 -4.145 -12.513 1.00 0.00 H new ATOM 0 HD2 LYS A 77 5.562 -2.767 -14.417 1.00 0.00 H new ATOM 0 HD3 LYS A 77 4.980 -1.478 -13.382 1.00 0.00 H new ATOM 0 HE2 LYS A 77 7.861 -2.432 -13.573 1.00 0.00 H new ATOM 0 HE3 LYS A 77 7.217 -0.976 -14.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 8.132 -0.222 -12.357 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 6.501 -0.404 -11.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 7.641 -1.575 -11.456 1.00 0.00 H new ATOM 1195 N ILE A 78 2.088 -3.478 -9.799 1.00 0.00 N ATOM 1196 CA ILE A 78 0.764 -3.028 -9.409 1.00 0.00 C ATOM 1197 C ILE A 78 0.796 -1.518 -9.471 1.00 0.00 C ATOM 1198 O ILE A 78 1.729 -0.900 -8.939 1.00 0.00 O ATOM 1199 CB ILE A 78 0.379 -3.381 -7.941 1.00 0.00 C ATOM 1200 CG1 ILE A 78 0.789 -4.797 -7.563 1.00 0.00 C ATOM 1201 CG2 ILE A 78 -1.134 -3.228 -7.771 1.00 0.00 C ATOM 1202 CD1 ILE A 78 0.520 -5.143 -6.111 1.00 0.00 C ATOM 0 H ILE A 78 2.843 -2.996 -9.311 1.00 0.00 H new ATOM 0 HA ILE A 78 0.046 -3.512 -10.071 1.00 0.00 H new ATOM 0 HB ILE A 78 0.914 -2.697 -7.281 1.00 0.00 H new ATOM 0 HG12 ILE A 78 0.256 -5.502 -8.200 1.00 0.00 H new ATOM 0 HG13 ILE A 78 1.852 -4.924 -7.767 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -1.412 -3.473 -6.746 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -1.422 -2.200 -7.989 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -1.647 -3.902 -8.457 1.00 0.00 H new ATOM 0 HD11 ILE A 78 0.838 -6.167 -5.916 1.00 0.00 H new ATOM 0 HD12 ILE A 78 1.075 -4.462 -5.466 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -0.546 -5.049 -5.906 1.00 0.00 H new ATOM 1214 N SER A 79 -0.163 -0.927 -10.106 1.00 0.00 N ATOM 1215 CA SER A 79 -0.241 0.497 -10.162 1.00 0.00 C ATOM 1216 C SER A 79 -1.382 0.926 -9.240 1.00 0.00 C ATOM 1217 O SER A 79 -2.543 0.607 -9.497 1.00 0.00 O ATOM 1218 CB SER A 79 -0.512 0.919 -11.603 1.00 0.00 C ATOM 1219 OG SER A 79 0.368 0.244 -12.505 1.00 0.00 O ATOM 0 H SER A 79 -0.911 -1.414 -10.599 1.00 0.00 H new ATOM 0 HA SER A 79 0.688 0.968 -9.839 1.00 0.00 H new ATOM 0 HB2 SER A 79 -1.547 0.696 -11.863 1.00 0.00 H new ATOM 0 HB3 SER A 79 -0.383 1.997 -11.701 1.00 0.00 H new ATOM 0 HG SER A 79 0.176 0.528 -13.423 1.00 0.00 H new ATOM 1225 N ILE A 80 -1.059 1.570 -8.145 1.00 0.00 N ATOM 1226 CA ILE A 80 -2.077 1.961 -7.194 1.00 0.00 C ATOM 1227 C ILE A 80 -2.158 3.469 -7.072 1.00 0.00 C ATOM 1228 O ILE A 80 -1.139 4.149 -6.891 1.00 0.00 O ATOM 1229 CB ILE A 80 -1.854 1.314 -5.785 1.00 0.00 C ATOM 1230 CG1 ILE A 80 -1.879 -0.217 -5.889 1.00 0.00 C ATOM 1231 CG2 ILE A 80 -2.902 1.798 -4.783 1.00 0.00 C ATOM 1232 CD1 ILE A 80 -1.707 -0.955 -4.567 1.00 0.00 C ATOM 0 H ILE A 80 -0.108 1.834 -7.889 1.00 0.00 H new ATOM 0 HA ILE A 80 -3.025 1.588 -7.580 1.00 0.00 H new ATOM 0 HB ILE A 80 -0.874 1.625 -5.423 1.00 0.00 H new ATOM 0 HG12 ILE A 80 -2.825 -0.520 -6.337 1.00 0.00 H new ATOM 0 HG13 ILE A 80 -1.089 -0.533 -6.570 1.00 0.00 H new ATOM 0 HG21 ILE A 80 -2.722 1.332 -3.814 1.00 0.00 H new ATOM 0 HG22 ILE A 80 -2.836 2.881 -4.682 1.00 0.00 H new ATOM 0 HG23 ILE A 80 -3.897 1.526 -5.137 1.00 0.00 H new ATOM 0 HD11 ILE A 80 -1.738 -2.030 -4.744 1.00 0.00 H new ATOM 0 HD12 ILE A 80 -0.748 -0.688 -4.123 1.00 0.00 H new ATOM 0 HD13 ILE A 80 -2.512 -0.675 -3.887 1.00 0.00 H new ATOM 1244 N THR A 81 -3.358 3.974 -7.181 1.00 0.00 N ATOM 1245 CA THR A 81 -3.634 5.360 -7.028 1.00 0.00 C ATOM 1246 C THR A 81 -4.868 5.513 -6.118 1.00 0.00 C ATOM 1247 O THR A 81 -5.903 4.911 -6.356 1.00 0.00 O ATOM 1248 CB THR A 81 -3.925 6.026 -8.404 1.00 0.00 C ATOM 1249 OG1 THR A 81 -2.868 5.731 -9.336 1.00 0.00 O ATOM 1250 CG2 THR A 81 -4.039 7.534 -8.255 1.00 0.00 C ATOM 0 H THR A 81 -4.184 3.411 -7.384 1.00 0.00 H new ATOM 0 HA THR A 81 -2.765 5.850 -6.589 1.00 0.00 H new ATOM 0 HB THR A 81 -4.868 5.626 -8.777 1.00 0.00 H new ATOM 0 HG1 THR A 81 -3.064 6.154 -10.198 1.00 0.00 H new ATOM 0 HG21 THR A 81 -4.243 7.981 -9.228 1.00 0.00 H new ATOM 0 HG22 THR A 81 -4.852 7.771 -7.569 1.00 0.00 H new ATOM 0 HG23 THR A 81 -3.104 7.932 -7.861 1.00 0.00 H new ATOM 1258 N PHE A 82 -4.735 6.252 -5.069 1.00 0.00 N ATOM 1259 CA PHE A 82 -5.853 6.551 -4.230 1.00 0.00 C ATOM 1260 C PHE A 82 -6.122 8.017 -4.347 1.00 0.00 C ATOM 1261 O PHE A 82 -5.310 8.840 -3.909 1.00 0.00 O ATOM 1262 CB PHE A 82 -5.609 6.220 -2.744 1.00 0.00 C ATOM 1263 CG PHE A 82 -5.361 4.775 -2.402 1.00 0.00 C ATOM 1264 CD1 PHE A 82 -6.400 3.860 -2.406 1.00 0.00 C ATOM 1265 CD2 PHE A 82 -4.098 4.344 -2.028 1.00 0.00 C ATOM 1266 CE1 PHE A 82 -6.178 2.542 -2.051 1.00 0.00 C ATOM 1267 CE2 PHE A 82 -3.875 3.029 -1.677 1.00 0.00 C ATOM 1268 CZ PHE A 82 -4.918 2.127 -1.688 1.00 0.00 C ATOM 0 H PHE A 82 -3.853 6.666 -4.767 1.00 0.00 H new ATOM 0 HA PHE A 82 -6.691 5.937 -4.559 1.00 0.00 H new ATOM 0 HB2 PHE A 82 -4.753 6.802 -2.403 1.00 0.00 H new ATOM 0 HB3 PHE A 82 -6.473 6.561 -2.174 1.00 0.00 H new ATOM 0 HD1 PHE A 82 -7.393 4.178 -2.689 1.00 0.00 H new ATOM 0 HD2 PHE A 82 -3.278 5.047 -2.011 1.00 0.00 H new ATOM 0 HE1 PHE A 82 -6.996 1.837 -2.059 1.00 0.00 H new ATOM 0 HE2 PHE A 82 -2.884 2.706 -1.394 1.00 0.00 H new ATOM 0 HZ PHE A 82 -4.746 1.097 -1.412 1.00 0.00 H new ATOM 1278 N THR A 83 -7.182 8.356 -4.984 1.00 0.00 N ATOM 1279 CA THR A 83 -7.588 9.716 -5.031 1.00 0.00 C ATOM 1280 C THR A 83 -8.940 9.765 -4.395 1.00 0.00 C ATOM 1281 O THR A 83 -9.894 9.204 -4.937 1.00 0.00 O ATOM 1282 CB THR A 83 -7.652 10.228 -6.502 1.00 0.00 C ATOM 1283 OG1 THR A 83 -8.376 9.288 -7.323 1.00 0.00 O ATOM 1284 CG2 THR A 83 -6.262 10.434 -7.080 1.00 0.00 C ATOM 0 H THR A 83 -7.790 7.707 -5.484 1.00 0.00 H new ATOM 0 HA THR A 83 -6.878 10.358 -4.509 1.00 0.00 H new ATOM 0 HB THR A 83 -8.168 11.188 -6.495 1.00 0.00 H new ATOM 0 HG1 THR A 83 -9.134 8.928 -6.817 1.00 0.00 H new ATOM 0 HG21 THR A 83 -6.344 10.791 -8.107 1.00 0.00 H new ATOM 0 HG22 THR A 83 -5.725 11.170 -6.482 1.00 0.00 H new ATOM 0 HG23 THR A 83 -5.719 9.489 -7.067 1.00 0.00 H new ATOM 1292 N ASP A 84 -9.053 10.455 -3.308 1.00 0.00 N ATOM 1293 CA ASP A 84 -10.287 10.429 -2.574 1.00 0.00 C ATOM 1294 C ASP A 84 -11.087 11.675 -2.794 1.00 0.00 C ATOM 1295 O ASP A 84 -10.648 12.774 -2.454 1.00 0.00 O ATOM 1296 CB ASP A 84 -10.083 10.167 -1.081 1.00 0.00 C ATOM 1297 CG ASP A 84 -11.410 10.120 -0.353 1.00 0.00 C ATOM 1298 OD1 ASP A 84 -12.277 9.286 -0.721 1.00 0.00 O ATOM 1299 OD2 ASP A 84 -11.624 10.924 0.539 1.00 0.00 O ATOM 0 H ASP A 84 -8.319 11.039 -2.907 1.00 0.00 H new ATOM 0 HA ASP A 84 -10.855 9.587 -2.968 1.00 0.00 H new ATOM 0 HB2 ASP A 84 -9.554 9.224 -0.942 1.00 0.00 H new ATOM 0 HB3 ASP A 84 -9.457 10.950 -0.653 1.00 0.00 H new ATOM 1304 N PRO A 85 -12.268 11.539 -3.393 1.00 0.00 N ATOM 1305 CA PRO A 85 -13.134 12.661 -3.653 1.00 0.00 C ATOM 1306 C PRO A 85 -13.991 13.010 -2.429 1.00 0.00 C ATOM 1307 O PRO A 85 -14.718 14.014 -2.425 1.00 0.00 O ATOM 1308 CB PRO A 85 -13.999 12.156 -4.806 1.00 0.00 C ATOM 1309 CG PRO A 85 -14.125 10.686 -4.579 1.00 0.00 C ATOM 1310 CD PRO A 85 -12.871 10.258 -3.865 1.00 0.00 C ATOM 0 HA PRO A 85 -12.590 13.577 -3.885 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -14.976 12.640 -4.808 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -13.536 12.368 -5.769 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -15.008 10.459 -3.982 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -14.234 10.155 -5.525 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -13.094 9.591 -3.032 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -12.196 9.721 -4.531 1.00 0.00 H new ATOM 1318 N THR A 86 -13.866 12.210 -1.394 1.00 0.00 N ATOM 1319 CA THR A 86 -14.689 12.306 -0.230 1.00 0.00 C ATOM 1320 C THR A 86 -13.998 13.113 0.890 1.00 0.00 C ATOM 1321 O THR A 86 -14.613 13.389 1.913 1.00 0.00 O ATOM 1322 CB THR A 86 -14.970 10.881 0.286 1.00 0.00 C ATOM 1323 OG1 THR A 86 -14.983 9.968 -0.834 1.00 0.00 O ATOM 1324 CG2 THR A 86 -16.327 10.828 0.953 1.00 0.00 C ATOM 0 H THR A 86 -13.173 11.463 -1.346 1.00 0.00 H new ATOM 0 HA THR A 86 -15.612 12.820 -0.499 1.00 0.00 H new ATOM 0 HB THR A 86 -14.196 10.605 1.002 1.00 0.00 H new ATOM 0 HG1 THR A 86 -14.084 9.603 -0.969 1.00 0.00 H new ATOM 0 HG21 THR A 86 -16.516 9.817 1.314 1.00 0.00 H new ATOM 0 HG22 THR A 86 -16.347 11.523 1.793 1.00 0.00 H new ATOM 0 HG23 THR A 86 -17.097 11.106 0.234 1.00 0.00 H new ATOM 1332 N LEU A 87 -12.751 13.534 0.646 1.00 0.00 N ATOM 1333 CA LEU A 87 -11.881 14.196 1.645 1.00 0.00 C ATOM 1334 C LEU A 87 -12.481 15.410 2.380 1.00 0.00 C ATOM 1335 O LEU A 87 -12.110 15.687 3.525 1.00 0.00 O ATOM 1336 CB LEU A 87 -10.467 14.494 1.061 1.00 0.00 C ATOM 1337 CG LEU A 87 -10.353 15.325 -0.252 1.00 0.00 C ATOM 1338 CD1 LEU A 87 -10.729 16.791 -0.072 1.00 0.00 C ATOM 1339 CD2 LEU A 87 -8.956 15.209 -0.821 1.00 0.00 C ATOM 0 H LEU A 87 -12.304 13.426 -0.264 1.00 0.00 H new ATOM 0 HA LEU A 87 -11.784 13.457 2.440 1.00 0.00 H new ATOM 0 HB2 LEU A 87 -9.896 15.014 1.830 1.00 0.00 H new ATOM 0 HB3 LEU A 87 -9.973 13.537 0.889 1.00 0.00 H new ATOM 0 HG LEU A 87 -11.075 14.904 -0.952 1.00 0.00 H new ATOM 0 HD11 LEU A 87 -10.628 17.312 -1.024 1.00 0.00 H new ATOM 0 HD12 LEU A 87 -11.761 16.862 0.273 1.00 0.00 H new ATOM 0 HD13 LEU A 87 -10.068 17.248 0.664 1.00 0.00 H new ATOM 0 HD21 LEU A 87 -8.887 15.793 -1.738 1.00 0.00 H new ATOM 0 HD22 LEU A 87 -8.235 15.586 -0.096 1.00 0.00 H new ATOM 0 HD23 LEU A 87 -8.738 14.164 -1.040 1.00 0.00 H new ATOM 1351 N ALA A 88 -13.406 16.115 1.748 1.00 0.00 N ATOM 1352 CA ALA A 88 -13.995 17.287 2.367 1.00 0.00 C ATOM 1353 C ALA A 88 -15.078 16.881 3.348 1.00 0.00 C ATOM 1354 O ALA A 88 -15.320 17.564 4.339 1.00 0.00 O ATOM 1355 CB ALA A 88 -14.538 18.246 1.321 1.00 0.00 C ATOM 0 H ALA A 88 -13.761 15.898 0.817 1.00 0.00 H new ATOM 0 HA ALA A 88 -13.213 17.810 2.918 1.00 0.00 H new ATOM 0 HB1 ALA A 88 -14.973 19.115 1.815 1.00 0.00 H new ATOM 0 HB2 ALA A 88 -13.728 18.568 0.667 1.00 0.00 H new ATOM 0 HB3 ALA A 88 -15.303 17.744 0.729 1.00 0.00 H new ATOM 1361 N ASN A 89 -15.699 15.748 3.079 1.00 0.00 N ATOM 1362 CA ASN A 89 -16.752 15.217 3.934 1.00 0.00 C ATOM 1363 C ASN A 89 -16.171 14.316 4.992 1.00 0.00 C ATOM 1364 O ASN A 89 -16.587 14.356 6.140 1.00 0.00 O ATOM 1365 CB ASN A 89 -17.819 14.456 3.130 1.00 0.00 C ATOM 1366 CG ASN A 89 -18.695 15.357 2.287 1.00 0.00 C ATOM 1367 OD1 ASN A 89 -19.715 15.858 2.764 1.00 0.00 O ATOM 1368 ND2 ASN A 89 -18.339 15.551 1.042 1.00 0.00 N ATOM 0 H ASN A 89 -15.491 15.169 2.265 1.00 0.00 H new ATOM 0 HA ASN A 89 -17.237 16.069 4.410 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -17.326 13.731 2.482 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -18.448 13.892 3.819 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -18.913 16.133 0.432 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -17.488 15.120 0.682 1.00 0.00 H new ATOM 1375 N TYR A 90 -15.215 13.506 4.603 1.00 0.00 N ATOM 1376 CA TYR A 90 -14.519 12.625 5.510 1.00 0.00 C ATOM 1377 C TYR A 90 -13.036 12.710 5.182 1.00 0.00 C ATOM 1378 O TYR A 90 -12.613 12.200 4.158 1.00 0.00 O ATOM 1379 CB TYR A 90 -14.925 11.159 5.324 1.00 0.00 C ATOM 1380 CG TYR A 90 -16.391 10.799 5.390 1.00 0.00 C ATOM 1381 CD1 TYR A 90 -17.018 10.303 4.269 1.00 0.00 C ATOM 1382 CD2 TYR A 90 -17.127 10.900 6.559 1.00 0.00 C ATOM 1383 CE1 TYR A 90 -18.325 9.913 4.281 1.00 0.00 C ATOM 1384 CE2 TYR A 90 -18.459 10.518 6.587 1.00 0.00 C ATOM 1385 CZ TYR A 90 -19.050 10.023 5.437 1.00 0.00 C ATOM 1386 OH TYR A 90 -20.359 9.607 5.456 1.00 0.00 O ATOM 0 H TYR A 90 -14.895 13.440 3.637 1.00 0.00 H new ATOM 0 HA TYR A 90 -14.759 12.931 6.528 1.00 0.00 H new ATOM 0 HB2 TYR A 90 -14.547 10.832 4.355 1.00 0.00 H new ATOM 0 HB3 TYR A 90 -14.406 10.573 6.083 1.00 0.00 H new ATOM 0 HD1 TYR A 90 -16.457 10.220 3.350 1.00 0.00 H new ATOM 0 HD2 TYR A 90 -16.659 11.279 7.456 1.00 0.00 H new ATOM 0 HE1 TYR A 90 -18.784 9.521 3.386 1.00 0.00 H new ATOM 0 HE2 TYR A 90 -19.031 10.606 7.499 1.00 0.00 H new ATOM 0 HH TYR A 90 -20.735 9.750 6.350 1.00 0.00 H new ATOM 1396 N PRO A 91 -12.233 13.355 6.011 1.00 0.00 N ATOM 1397 CA PRO A 91 -10.812 13.479 5.749 1.00 0.00 C ATOM 1398 C PRO A 91 -10.025 12.228 6.153 1.00 0.00 C ATOM 1399 O PRO A 91 -10.536 11.349 6.868 1.00 0.00 O ATOM 1400 CB PRO A 91 -10.374 14.662 6.622 1.00 0.00 C ATOM 1401 CG PRO A 91 -11.501 14.954 7.568 1.00 0.00 C ATOM 1402 CD PRO A 91 -12.631 14.005 7.263 1.00 0.00 C ATOM 0 HA PRO A 91 -10.622 13.616 4.684 1.00 0.00 H new ATOM 0 HB2 PRO A 91 -9.464 14.420 7.171 1.00 0.00 H new ATOM 0 HB3 PRO A 91 -10.152 15.534 6.006 1.00 0.00 H new ATOM 0 HG2 PRO A 91 -11.172 14.833 8.600 1.00 0.00 H new ATOM 0 HG3 PRO A 91 -11.832 15.987 7.458 1.00 0.00 H new ATOM 0 HD2 PRO A 91 -12.766 13.277 8.063 1.00 0.00 H new ATOM 0 HD3 PRO A 91 -13.577 14.536 7.152 1.00 0.00 H new ATOM 1410 N ILE A 92 -8.816 12.110 5.645 1.00 0.00 N ATOM 1411 CA ILE A 92 -7.911 11.087 6.102 1.00 0.00 C ATOM 1412 C ILE A 92 -6.800 11.813 6.844 1.00 0.00 C ATOM 1413 O ILE A 92 -5.834 12.263 6.243 1.00 0.00 O ATOM 1414 CB ILE A 92 -7.277 10.287 4.929 1.00 0.00 C ATOM 1415 CG1 ILE A 92 -8.352 9.859 3.910 1.00 0.00 C ATOM 1416 CG2 ILE A 92 -6.543 9.062 5.480 1.00 0.00 C ATOM 1417 CD1 ILE A 92 -7.823 9.047 2.734 1.00 0.00 C ATOM 0 H ILE A 92 -8.440 12.714 4.914 1.00 0.00 H new ATOM 0 HA ILE A 92 -8.453 10.372 6.722 1.00 0.00 H new ATOM 0 HB ILE A 92 -6.564 10.929 4.412 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -9.111 9.273 4.427 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -8.846 10.752 3.526 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -6.099 8.503 4.656 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -5.758 9.385 6.164 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -7.248 8.425 6.013 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -8.648 8.790 2.069 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -7.086 9.636 2.187 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -7.356 8.134 3.103 1.00 0.00 H new ATOM 1429 N SER A 93 -6.976 11.990 8.117 1.00 0.00 N ATOM 1430 CA SER A 93 -6.016 12.722 8.917 1.00 0.00 C ATOM 1431 C SER A 93 -5.676 11.944 10.176 1.00 0.00 C ATOM 1432 O SER A 93 -5.094 12.475 11.137 1.00 0.00 O ATOM 1433 CB SER A 93 -6.587 14.107 9.237 1.00 0.00 C ATOM 1434 OG SER A 93 -7.874 14.015 9.841 1.00 0.00 O ATOM 0 H SER A 93 -7.780 11.638 8.637 1.00 0.00 H new ATOM 0 HA SER A 93 -5.087 12.852 8.361 1.00 0.00 H new ATOM 0 HB2 SER A 93 -5.908 14.636 9.905 1.00 0.00 H new ATOM 0 HB3 SER A 93 -6.655 14.694 8.321 1.00 0.00 H new ATOM 0 HG SER A 93 -8.210 14.915 10.034 1.00 0.00 H new ATOM 1440 N VAL A 94 -6.028 10.683 10.143 1.00 0.00 N ATOM 1441 CA VAL A 94 -5.777 9.763 11.217 1.00 0.00 C ATOM 1442 C VAL A 94 -4.875 8.660 10.690 1.00 0.00 C ATOM 1443 O VAL A 94 -4.803 8.453 9.481 1.00 0.00 O ATOM 1444 CB VAL A 94 -7.095 9.172 11.816 1.00 0.00 C ATOM 1445 CG1 VAL A 94 -7.897 10.255 12.511 1.00 0.00 C ATOM 1446 CG2 VAL A 94 -7.949 8.514 10.742 1.00 0.00 C ATOM 0 H VAL A 94 -6.508 10.261 9.348 1.00 0.00 H new ATOM 0 HA VAL A 94 -5.290 10.295 12.034 1.00 0.00 H new ATOM 0 HB VAL A 94 -6.810 8.411 12.543 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -8.810 9.825 12.921 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -7.304 10.685 13.318 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -8.154 11.035 11.794 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -8.857 8.114 11.193 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -8.215 9.252 9.985 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -7.388 7.704 10.277 1.00 0.00 H new ATOM 1456 N ASP A 95 -4.182 7.986 11.565 1.00 0.00 N ATOM 1457 CA ASP A 95 -3.207 6.975 11.151 1.00 0.00 C ATOM 1458 C ASP A 95 -3.790 5.562 11.155 1.00 0.00 C ATOM 1459 O ASP A 95 -4.958 5.346 11.556 1.00 0.00 O ATOM 1460 CB ASP A 95 -1.944 7.023 12.035 1.00 0.00 C ATOM 1461 CG ASP A 95 -2.192 6.659 13.479 1.00 0.00 C ATOM 1462 OD1 ASP A 95 -2.405 7.562 14.297 1.00 0.00 O ATOM 1463 OD2 ASP A 95 -2.170 5.471 13.829 1.00 0.00 O ATOM 0 H ASP A 95 -4.263 8.107 12.574 1.00 0.00 H new ATOM 0 HA ASP A 95 -2.934 7.218 10.124 1.00 0.00 H new ATOM 0 HB2 ASP A 95 -1.198 6.344 11.623 1.00 0.00 H new ATOM 0 HB3 ASP A 95 -1.520 8.026 11.991 1.00 0.00 H new ATOM 1468 N GLY A 96 -2.978 4.611 10.721 1.00 0.00 N ATOM 1469 CA GLY A 96 -3.356 3.222 10.686 1.00 0.00 C ATOM 1470 C GLY A 96 -2.752 2.542 9.491 1.00 0.00 C ATOM 1471 O GLY A 96 -1.656 2.899 9.065 1.00 0.00 O ATOM 0 H GLY A 96 -2.033 4.791 10.382 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -3.026 2.726 11.599 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -4.442 3.135 10.651 1.00 0.00 H new ATOM 1475 N ILE A 97 -3.436 1.570 8.950 1.00 0.00 N ATOM 1476 CA ILE A 97 -2.979 0.905 7.739 1.00 0.00 C ATOM 1477 C ILE A 97 -3.747 1.497 6.566 1.00 0.00 C ATOM 1478 O ILE A 97 -4.933 1.713 6.672 1.00 0.00 O ATOM 1479 CB ILE A 97 -3.149 -0.684 7.783 1.00 0.00 C ATOM 1480 CG1 ILE A 97 -2.155 -1.373 8.751 1.00 0.00 C ATOM 1481 CG2 ILE A 97 -2.997 -1.315 6.403 1.00 0.00 C ATOM 1482 CD1 ILE A 97 -2.357 -1.099 10.219 1.00 0.00 C ATOM 0 H ILE A 97 -4.316 1.213 9.323 1.00 0.00 H new ATOM 0 HA ILE A 97 -1.908 1.076 7.636 1.00 0.00 H new ATOM 0 HB ILE A 97 -4.162 -0.846 8.151 1.00 0.00 H new ATOM 0 HG12 ILE A 97 -2.213 -2.450 8.592 1.00 0.00 H new ATOM 0 HG13 ILE A 97 -1.145 -1.065 8.481 1.00 0.00 H new ATOM 0 HG21 ILE A 97 -3.120 -2.395 6.481 1.00 0.00 H new ATOM 0 HG22 ILE A 97 -3.756 -0.911 5.733 1.00 0.00 H new ATOM 0 HG23 ILE A 97 -2.006 -1.090 6.007 1.00 0.00 H new ATOM 0 HD11 ILE A 97 -1.603 -1.634 10.796 1.00 0.00 H new ATOM 0 HD12 ILE A 97 -2.265 -0.029 10.405 1.00 0.00 H new ATOM 0 HD13 ILE A 97 -3.350 -1.435 10.519 1.00 0.00 H new ATOM 1494 N LEU A 98 -3.060 1.802 5.493 1.00 0.00 N ATOM 1495 CA LEU A 98 -3.683 2.371 4.316 1.00 0.00 C ATOM 1496 C LEU A 98 -4.399 1.272 3.534 1.00 0.00 C ATOM 1497 O LEU A 98 -5.615 1.342 3.289 1.00 0.00 O ATOM 1498 CB LEU A 98 -2.618 3.065 3.445 1.00 0.00 C ATOM 1499 CG LEU A 98 -3.115 3.784 2.180 1.00 0.00 C ATOM 1500 CD1 LEU A 98 -4.070 4.922 2.528 1.00 0.00 C ATOM 1501 CD2 LEU A 98 -1.936 4.308 1.377 1.00 0.00 C ATOM 0 H LEU A 98 -2.053 1.664 5.407 1.00 0.00 H new ATOM 0 HA LEU A 98 -4.419 3.118 4.614 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -2.094 3.792 4.065 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -1.885 2.316 3.144 1.00 0.00 H new ATOM 0 HG LEU A 98 -3.663 3.062 1.575 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -4.403 5.410 1.612 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.933 4.523 3.061 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -3.557 5.647 3.160 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -2.301 4.815 0.484 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -1.365 5.010 1.985 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -1.296 3.476 1.086 1.00 0.00 H new ATOM 1513 N ALA A 99 -3.652 0.247 3.180 1.00 0.00 N ATOM 1514 CA ALA A 99 -4.179 -0.868 2.445 1.00 0.00 C ATOM 1515 C ALA A 99 -3.359 -2.101 2.737 1.00 0.00 C ATOM 1516 O ALA A 99 -2.180 -2.005 3.122 1.00 0.00 O ATOM 1517 CB ALA A 99 -4.197 -0.575 0.948 1.00 0.00 C ATOM 0 H ALA A 99 -2.659 0.170 3.398 1.00 0.00 H new ATOM 0 HA ALA A 99 -5.208 -1.042 2.761 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -4.600 -1.435 0.414 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -4.821 0.297 0.755 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -3.182 -0.378 0.604 1.00 0.00 H new ATOM 1523 N TYR A 100 -3.983 -3.230 2.606 1.00 0.00 N ATOM 1524 CA TYR A 100 -3.359 -4.506 2.807 1.00 0.00 C ATOM 1525 C TYR A 100 -3.141 -5.133 1.445 1.00 0.00 C ATOM 1526 O TYR A 100 -4.097 -5.308 0.680 1.00 0.00 O ATOM 1527 CB TYR A 100 -4.257 -5.418 3.655 1.00 0.00 C ATOM 1528 CG TYR A 100 -4.613 -4.882 5.032 1.00 0.00 C ATOM 1529 CD1 TYR A 100 -5.715 -4.051 5.212 1.00 0.00 C ATOM 1530 CD2 TYR A 100 -3.860 -5.219 6.149 1.00 0.00 C ATOM 1531 CE1 TYR A 100 -6.051 -3.571 6.458 1.00 0.00 C ATOM 1532 CE2 TYR A 100 -4.192 -4.739 7.404 1.00 0.00 C ATOM 1533 CZ TYR A 100 -5.287 -3.915 7.551 1.00 0.00 C ATOM 1534 OH TYR A 100 -5.631 -3.444 8.796 1.00 0.00 O ATOM 0 H TYR A 100 -4.968 -3.294 2.349 1.00 0.00 H new ATOM 0 HA TYR A 100 -2.413 -4.378 3.333 1.00 0.00 H new ATOM 0 HB2 TYR A 100 -5.180 -5.603 3.106 1.00 0.00 H new ATOM 0 HB3 TYR A 100 -3.759 -6.380 3.775 1.00 0.00 H new ATOM 0 HD1 TYR A 100 -6.318 -3.778 4.359 1.00 0.00 H new ATOM 0 HD2 TYR A 100 -3.002 -5.866 6.037 1.00 0.00 H new ATOM 0 HE1 TYR A 100 -6.910 -2.927 6.578 1.00 0.00 H new ATOM 0 HE2 TYR A 100 -3.596 -5.009 8.263 1.00 0.00 H new ATOM 0 HH TYR A 100 -4.993 -3.778 9.460 1.00 0.00 H new ATOM 1544 N LEU A 101 -1.913 -5.434 1.137 1.00 0.00 N ATOM 1545 CA LEU A 101 -1.554 -6.005 -0.144 1.00 0.00 C ATOM 1546 C LEU A 101 -1.708 -7.526 -0.081 1.00 0.00 C ATOM 1547 O LEU A 101 -1.048 -8.180 0.736 1.00 0.00 O ATOM 1548 CB LEU A 101 -0.100 -5.642 -0.486 1.00 0.00 C ATOM 1549 CG LEU A 101 0.288 -4.148 -0.433 1.00 0.00 C ATOM 1550 CD1 LEU A 101 1.767 -3.973 -0.740 1.00 0.00 C ATOM 1551 CD2 LEU A 101 -0.546 -3.320 -1.400 1.00 0.00 C ATOM 0 H LEU A 101 -1.122 -5.292 1.766 1.00 0.00 H new ATOM 0 HA LEU A 101 -2.210 -5.606 -0.917 1.00 0.00 H new ATOM 0 HB2 LEU A 101 0.553 -6.185 0.198 1.00 0.00 H new ATOM 0 HB3 LEU A 101 0.113 -6.010 -1.490 1.00 0.00 H new ATOM 0 HG LEU A 101 0.087 -3.791 0.577 1.00 0.00 H new ATOM 0 HD11 LEU A 101 2.024 -2.915 -0.699 1.00 0.00 H new ATOM 0 HD12 LEU A 101 2.358 -4.519 -0.005 1.00 0.00 H new ATOM 0 HD13 LEU A 101 1.980 -4.360 -1.737 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -0.246 -2.274 -1.336 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -0.389 -3.681 -2.417 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -1.601 -3.411 -1.141 1.00 0.00 H new ATOM 1563 N ASP A 102 -2.581 -8.070 -0.912 1.00 0.00 N ATOM 1564 CA ASP A 102 -2.850 -9.510 -0.938 1.00 0.00 C ATOM 1565 C ASP A 102 -2.034 -10.202 -2.030 1.00 0.00 C ATOM 1566 O ASP A 102 -2.218 -9.939 -3.220 1.00 0.00 O ATOM 1567 CB ASP A 102 -4.352 -9.741 -1.158 1.00 0.00 C ATOM 1568 CG ASP A 102 -4.729 -11.184 -1.344 1.00 0.00 C ATOM 1569 OD1 ASP A 102 -4.838 -11.630 -2.509 1.00 0.00 O ATOM 1570 OD2 ASP A 102 -4.984 -11.876 -0.339 1.00 0.00 O ATOM 0 H ASP A 102 -3.125 -7.534 -1.588 1.00 0.00 H new ATOM 0 HA ASP A 102 -2.553 -9.942 0.018 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -4.899 -9.340 -0.305 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -4.671 -9.177 -2.035 1.00 0.00 H new ATOM 1575 N PHE A 103 -1.119 -11.060 -1.630 1.00 0.00 N ATOM 1576 CA PHE A 103 -0.273 -11.772 -2.571 1.00 0.00 C ATOM 1577 C PHE A 103 -0.346 -13.258 -2.359 1.00 0.00 C ATOM 1578 O PHE A 103 -0.010 -13.754 -1.282 1.00 0.00 O ATOM 1579 CB PHE A 103 1.198 -11.355 -2.450 1.00 0.00 C ATOM 1580 CG PHE A 103 1.513 -9.956 -2.865 1.00 0.00 C ATOM 1581 CD1 PHE A 103 1.711 -8.967 -1.923 1.00 0.00 C ATOM 1582 CD2 PHE A 103 1.632 -9.634 -4.203 1.00 0.00 C ATOM 1583 CE1 PHE A 103 2.024 -7.685 -2.309 1.00 0.00 C ATOM 1584 CE2 PHE A 103 1.940 -8.353 -4.595 1.00 0.00 C ATOM 1585 CZ PHE A 103 2.138 -7.375 -3.646 1.00 0.00 C ATOM 0 H PHE A 103 -0.940 -11.284 -0.651 1.00 0.00 H new ATOM 0 HA PHE A 103 -0.647 -11.513 -3.562 1.00 0.00 H new ATOM 0 HB2 PHE A 103 1.509 -11.485 -1.413 1.00 0.00 H new ATOM 0 HB3 PHE A 103 1.800 -12.036 -3.051 1.00 0.00 H new ATOM 0 HD1 PHE A 103 1.619 -9.202 -0.873 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.481 -10.399 -4.951 1.00 0.00 H new ATOM 0 HE1 PHE A 103 2.181 -6.920 -1.563 1.00 0.00 H new ATOM 0 HE2 PHE A 103 2.026 -8.114 -5.645 1.00 0.00 H new ATOM 0 HZ PHE A 103 2.382 -6.368 -3.949 1.00 0.00 H new ATOM 1595 N ILE A 104 -0.765 -13.971 -3.364 1.00 0.00 N ATOM 1596 CA ILE A 104 -0.741 -15.407 -3.316 1.00 0.00 C ATOM 1597 C ILE A 104 0.671 -15.824 -3.652 1.00 0.00 C ATOM 1598 O ILE A 104 1.199 -15.448 -4.713 1.00 0.00 O ATOM 1599 CB ILE A 104 -1.713 -16.066 -4.343 1.00 0.00 C ATOM 1600 CG1 ILE A 104 -3.150 -15.576 -4.125 1.00 0.00 C ATOM 1601 CG2 ILE A 104 -1.648 -17.598 -4.231 1.00 0.00 C ATOM 1602 CD1 ILE A 104 -4.151 -16.135 -5.117 1.00 0.00 C ATOM 0 H ILE A 104 -1.130 -13.580 -4.233 1.00 0.00 H new ATOM 0 HA ILE A 104 -1.061 -15.733 -2.326 1.00 0.00 H new ATOM 0 HB ILE A 104 -1.401 -15.774 -5.346 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -3.465 -15.844 -3.117 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -3.164 -14.488 -4.184 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -2.331 -18.045 -4.953 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -0.632 -17.935 -4.436 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.935 -17.902 -3.224 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -5.143 -15.740 -4.895 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -3.863 -15.845 -6.127 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -4.168 -17.222 -5.043 1.00 0.00 H new ATOM 1614 N ILE A 105 1.307 -16.525 -2.750 1.00 0.00 N ATOM 1615 CA ILE A 105 2.640 -16.977 -2.990 1.00 0.00 C ATOM 1616 C ILE A 105 2.571 -18.270 -3.763 1.00 0.00 C ATOM 1617 O ILE A 105 1.907 -19.227 -3.345 1.00 0.00 O ATOM 1618 CB ILE A 105 3.445 -17.171 -1.680 1.00 0.00 C ATOM 1619 CG1 ILE A 105 3.396 -15.879 -0.859 1.00 0.00 C ATOM 1620 CG2 ILE A 105 4.905 -17.536 -2.000 1.00 0.00 C ATOM 1621 CD1 ILE A 105 4.114 -15.950 0.457 1.00 0.00 C ATOM 0 H ILE A 105 0.919 -16.792 -1.845 1.00 0.00 H new ATOM 0 HA ILE A 105 3.167 -16.214 -3.564 1.00 0.00 H new ATOM 0 HB ILE A 105 3.003 -17.985 -1.105 1.00 0.00 H new ATOM 0 HG12 ILE A 105 3.827 -15.071 -1.450 1.00 0.00 H new ATOM 0 HG13 ILE A 105 2.353 -15.619 -0.676 1.00 0.00 H new ATOM 0 HG21 ILE A 105 5.459 -17.669 -1.071 1.00 0.00 H new ATOM 0 HG22 ILE A 105 4.931 -18.462 -2.574 1.00 0.00 H new ATOM 0 HG23 ILE A 105 5.361 -16.735 -2.582 1.00 0.00 H new ATOM 0 HD11 ILE A 105 4.028 -14.992 0.971 1.00 0.00 H new ATOM 0 HD12 ILE A 105 3.670 -16.733 1.072 1.00 0.00 H new ATOM 0 HD13 ILE A 105 5.166 -16.176 0.286 1.00 0.00 H new ATOM 1633 N ASN A 106 3.203 -18.265 -4.892 1.00 0.00 N ATOM 1634 CA ASN A 106 3.260 -19.385 -5.794 1.00 0.00 C ATOM 1635 C ASN A 106 4.023 -20.535 -5.145 1.00 0.00 C ATOM 1636 O ASN A 106 4.974 -20.316 -4.401 1.00 0.00 O ATOM 1637 CB ASN A 106 3.945 -18.925 -7.096 1.00 0.00 C ATOM 1638 CG ASN A 106 4.092 -19.999 -8.165 1.00 0.00 C ATOM 1639 OD1 ASN A 106 3.342 -20.970 -8.216 1.00 0.00 O ATOM 1640 ND2 ASN A 106 5.036 -19.809 -9.045 1.00 0.00 N ATOM 0 H ASN A 106 3.716 -17.451 -5.230 1.00 0.00 H new ATOM 0 HA ASN A 106 2.256 -19.743 -6.024 1.00 0.00 H new ATOM 0 HB2 ASN A 106 3.376 -18.095 -7.514 1.00 0.00 H new ATOM 0 HB3 ASN A 106 4.935 -18.541 -6.851 1.00 0.00 H new ATOM 0 HD21 ASN A 106 5.168 -20.478 -9.804 1.00 0.00 H new ATOM 0 HD22 ASN A 106 5.642 -18.992 -8.974 1.00 0.00 H new ATOM 1647 N SER A 107 3.600 -21.748 -5.418 1.00 0.00 N ATOM 1648 CA SER A 107 4.209 -22.941 -4.870 1.00 0.00 C ATOM 1649 C SER A 107 5.622 -23.163 -5.457 1.00 0.00 C ATOM 1650 O SER A 107 6.423 -23.926 -4.916 1.00 0.00 O ATOM 1651 CB SER A 107 3.308 -24.123 -5.193 1.00 0.00 C ATOM 1652 OG SER A 107 1.964 -23.820 -4.844 1.00 0.00 O ATOM 0 H SER A 107 2.811 -21.938 -6.036 1.00 0.00 H new ATOM 0 HA SER A 107 4.319 -22.834 -3.791 1.00 0.00 H new ATOM 0 HB2 SER A 107 3.372 -24.360 -6.255 1.00 0.00 H new ATOM 0 HB3 SER A 107 3.643 -25.006 -4.649 1.00 0.00 H new ATOM 0 HG SER A 107 1.390 -24.585 -5.057 1.00 0.00 H new ATOM 1658 N ASN A 108 5.913 -22.479 -6.551 1.00 0.00 N ATOM 1659 CA ASN A 108 7.194 -22.590 -7.241 1.00 0.00 C ATOM 1660 C ASN A 108 8.102 -21.385 -6.879 1.00 0.00 C ATOM 1661 O ASN A 108 9.078 -21.068 -7.567 1.00 0.00 O ATOM 1662 CB ASN A 108 6.940 -22.670 -8.757 1.00 0.00 C ATOM 1663 CG ASN A 108 8.173 -23.028 -9.574 1.00 0.00 C ATOM 1664 OD1 ASN A 108 9.066 -23.728 -9.101 1.00 0.00 O ATOM 1665 ND2 ASN A 108 8.222 -22.562 -10.791 1.00 0.00 N ATOM 0 H ASN A 108 5.265 -21.826 -6.991 1.00 0.00 H new ATOM 0 HA ASN A 108 7.712 -23.496 -6.926 1.00 0.00 H new ATOM 0 HB2 ASN A 108 6.164 -23.411 -8.946 1.00 0.00 H new ATOM 0 HB3 ASN A 108 6.555 -21.710 -9.101 1.00 0.00 H new ATOM 0 HD21 ASN A 108 9.022 -22.775 -11.387 1.00 0.00 H new ATOM 0 HD22 ASN A 108 7.460 -21.984 -11.147 1.00 0.00 H new ATOM 1672 N ALA A 109 7.777 -20.731 -5.788 1.00 0.00 N ATOM 1673 CA ALA A 109 8.570 -19.625 -5.282 1.00 0.00 C ATOM 1674 C ALA A 109 9.744 -20.175 -4.494 1.00 0.00 C ATOM 1675 O ALA A 109 9.621 -21.220 -3.847 1.00 0.00 O ATOM 1676 CB ALA A 109 7.720 -18.761 -4.365 1.00 0.00 C ATOM 0 H ALA A 109 6.956 -20.948 -5.223 1.00 0.00 H new ATOM 0 HA ALA A 109 8.928 -19.025 -6.118 1.00 0.00 H new ATOM 0 HB1 ALA A 109 8.319 -17.932 -3.988 1.00 0.00 H new ATOM 0 HB2 ALA A 109 6.868 -18.369 -4.921 1.00 0.00 H new ATOM 0 HB3 ALA A 109 7.362 -19.361 -3.528 1.00 0.00 H new ATOM 1682 N THR A 110 10.873 -19.526 -4.573 1.00 0.00 N ATOM 1683 CA THR A 110 11.992 -19.936 -3.777 1.00 0.00 C ATOM 1684 C THR A 110 11.964 -19.193 -2.462 1.00 0.00 C ATOM 1685 O THR A 110 11.319 -18.132 -2.334 1.00 0.00 O ATOM 1686 CB THR A 110 13.371 -19.755 -4.499 1.00 0.00 C ATOM 1687 OG1 THR A 110 14.446 -20.305 -3.724 1.00 0.00 O ATOM 1688 CG2 THR A 110 13.679 -18.302 -4.823 1.00 0.00 C ATOM 0 H THR A 110 11.040 -18.719 -5.175 1.00 0.00 H new ATOM 0 HA THR A 110 11.895 -21.008 -3.602 1.00 0.00 H new ATOM 0 HB THR A 110 13.285 -20.300 -5.439 1.00 0.00 H new ATOM 0 HG1 THR A 110 15.292 -20.178 -4.202 1.00 0.00 H new ATOM 0 HG21 THR A 110 14.646 -18.238 -5.322 1.00 0.00 H new ATOM 0 HG22 THR A 110 12.905 -17.903 -5.479 1.00 0.00 H new ATOM 0 HG23 THR A 110 13.707 -17.722 -3.901 1.00 0.00 H new ATOM 1696 N ALA A 111 12.655 -19.735 -1.520 1.00 0.00 N ATOM 1697 CA ALA A 111 12.703 -19.195 -0.192 1.00 0.00 C ATOM 1698 C ALA A 111 13.693 -18.043 -0.116 1.00 0.00 C ATOM 1699 O ALA A 111 14.614 -17.927 -0.953 1.00 0.00 O ATOM 1700 CB ALA A 111 13.052 -20.281 0.810 1.00 0.00 C ATOM 0 H ALA A 111 13.214 -20.579 -1.645 1.00 0.00 H new ATOM 0 HA ALA A 111 11.716 -18.806 0.059 1.00 0.00 H new ATOM 0 HB1 ALA A 111 13.084 -19.854 1.813 1.00 0.00 H new ATOM 0 HB2 ALA A 111 12.296 -21.066 0.774 1.00 0.00 H new ATOM 0 HB3 ALA A 111 14.026 -20.704 0.564 1.00 0.00 H new ATOM 1706 N GLY A 112 13.504 -17.197 0.853 1.00 0.00 N ATOM 1707 CA GLY A 112 14.361 -16.075 1.030 1.00 0.00 C ATOM 1708 C GLY A 112 13.580 -14.812 1.231 1.00 0.00 C ATOM 1709 O GLY A 112 12.350 -14.783 1.028 1.00 0.00 O ATOM 0 H GLY A 112 12.752 -17.270 1.538 1.00 0.00 H new ATOM 0 HA2 GLY A 112 15.009 -16.243 1.890 1.00 0.00 H new ATOM 0 HA3 GLY A 112 15.008 -15.969 0.159 1.00 0.00 H new ATOM 1713 N ASP A 113 14.264 -13.781 1.632 1.00 0.00 N ATOM 1714 CA ASP A 113 13.663 -12.503 1.871 1.00 0.00 C ATOM 1715 C ASP A 113 13.408 -11.817 0.564 1.00 0.00 C ATOM 1716 O ASP A 113 14.340 -11.532 -0.193 1.00 0.00 O ATOM 1717 CB ASP A 113 14.567 -11.653 2.747 1.00 0.00 C ATOM 1718 CG ASP A 113 14.757 -12.232 4.125 1.00 0.00 C ATOM 1719 OD1 ASP A 113 15.671 -13.057 4.312 1.00 0.00 O ATOM 1720 OD2 ASP A 113 14.009 -11.876 5.039 1.00 0.00 O ATOM 0 H ASP A 113 15.269 -13.805 1.804 1.00 0.00 H new ATOM 0 HA ASP A 113 12.715 -12.644 2.390 1.00 0.00 H new ATOM 0 HB2 ASP A 113 15.539 -11.548 2.265 1.00 0.00 H new ATOM 0 HB3 ASP A 113 14.145 -10.652 2.834 1.00 0.00 H new ATOM 1725 N SER A 114 12.165 -11.587 0.279 1.00 0.00 N ATOM 1726 CA SER A 114 11.770 -10.980 -0.952 1.00 0.00 C ATOM 1727 C SER A 114 11.115 -9.636 -0.654 1.00 0.00 C ATOM 1728 O SER A 114 10.056 -9.579 -0.033 1.00 0.00 O ATOM 1729 CB SER A 114 10.798 -11.921 -1.653 1.00 0.00 C ATOM 1730 OG SER A 114 11.334 -13.251 -1.693 1.00 0.00 O ATOM 0 H SER A 114 11.389 -11.817 0.900 1.00 0.00 H new ATOM 0 HA SER A 114 12.629 -10.805 -1.600 1.00 0.00 H new ATOM 0 HB2 SER A 114 9.842 -11.923 -1.130 1.00 0.00 H new ATOM 0 HB3 SER A 114 10.607 -11.568 -2.666 1.00 0.00 H new ATOM 0 HG SER A 114 10.699 -13.846 -2.144 1.00 0.00 H new ATOM 1736 N ALA A 115 11.762 -8.571 -1.051 1.00 0.00 N ATOM 1737 CA ALA A 115 11.262 -7.238 -0.788 1.00 0.00 C ATOM 1738 C ALA A 115 10.422 -6.735 -1.955 1.00 0.00 C ATOM 1739 O ALA A 115 10.691 -7.066 -3.115 1.00 0.00 O ATOM 1740 CB ALA A 115 12.421 -6.283 -0.537 1.00 0.00 C ATOM 0 H ALA A 115 12.644 -8.598 -1.562 1.00 0.00 H new ATOM 0 HA ALA A 115 10.632 -7.280 0.101 1.00 0.00 H new ATOM 0 HB1 ALA A 115 12.033 -5.284 -0.340 1.00 0.00 H new ATOM 0 HB2 ALA A 115 12.995 -6.625 0.324 1.00 0.00 H new ATOM 0 HB3 ALA A 115 13.066 -6.255 -1.415 1.00 0.00 H new ATOM 1746 N LEU A 116 9.404 -5.976 -1.647 1.00 0.00 N ATOM 1747 CA LEU A 116 8.573 -5.355 -2.650 1.00 0.00 C ATOM 1748 C LEU A 116 9.143 -3.978 -2.906 1.00 0.00 C ATOM 1749 O LEU A 116 9.227 -3.157 -1.989 1.00 0.00 O ATOM 1750 CB LEU A 116 7.126 -5.216 -2.145 1.00 0.00 C ATOM 1751 CG LEU A 116 6.457 -6.482 -1.581 1.00 0.00 C ATOM 1752 CD1 LEU A 116 5.053 -6.174 -1.116 1.00 0.00 C ATOM 1753 CD2 LEU A 116 6.452 -7.619 -2.586 1.00 0.00 C ATOM 0 H LEU A 116 9.124 -5.769 -0.688 1.00 0.00 H new ATOM 0 HA LEU A 116 8.560 -5.961 -3.556 1.00 0.00 H new ATOM 0 HB2 LEU A 116 7.110 -4.451 -1.369 1.00 0.00 H new ATOM 0 HB3 LEU A 116 6.514 -4.848 -2.968 1.00 0.00 H new ATOM 0 HG LEU A 116 7.048 -6.811 -0.726 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.594 -7.080 -0.720 1.00 0.00 H new ATOM 0 HD12 LEU A 116 5.087 -5.413 -0.336 1.00 0.00 H new ATOM 0 HD13 LEU A 116 4.464 -5.806 -1.956 1.00 0.00 H new ATOM 0 HD21 LEU A 116 5.970 -8.492 -2.145 1.00 0.00 H new ATOM 0 HD22 LEU A 116 5.905 -7.314 -3.478 1.00 0.00 H new ATOM 0 HD23 LEU A 116 7.478 -7.869 -2.858 1.00 0.00 H new ATOM 1765 N THR A 117 9.556 -3.735 -4.106 1.00 0.00 N ATOM 1766 CA THR A 117 10.186 -2.498 -4.447 1.00 0.00 C ATOM 1767 C THR A 117 9.144 -1.495 -4.949 1.00 0.00 C ATOM 1768 O THR A 117 8.630 -1.622 -6.057 1.00 0.00 O ATOM 1769 CB THR A 117 11.251 -2.738 -5.536 1.00 0.00 C ATOM 1770 OG1 THR A 117 12.103 -3.840 -5.136 1.00 0.00 O ATOM 1771 CG2 THR A 117 12.103 -1.488 -5.745 1.00 0.00 C ATOM 0 H THR A 117 9.467 -4.390 -4.883 1.00 0.00 H new ATOM 0 HA THR A 117 10.667 -2.089 -3.558 1.00 0.00 H new ATOM 0 HB THR A 117 10.747 -2.975 -6.473 1.00 0.00 H new ATOM 0 HG1 THR A 117 12.780 -3.997 -5.826 1.00 0.00 H new ATOM 0 HG21 THR A 117 12.848 -1.680 -6.518 1.00 0.00 H new ATOM 0 HG22 THR A 117 11.465 -0.660 -6.054 1.00 0.00 H new ATOM 0 HG23 THR A 117 12.606 -1.230 -4.813 1.00 0.00 H new ATOM 1779 N VAL A 118 8.798 -0.546 -4.126 1.00 0.00 N ATOM 1780 CA VAL A 118 7.870 0.477 -4.532 1.00 0.00 C ATOM 1781 C VAL A 118 8.648 1.696 -4.975 1.00 0.00 C ATOM 1782 O VAL A 118 9.446 2.245 -4.197 1.00 0.00 O ATOM 1783 CB VAL A 118 6.856 0.830 -3.414 1.00 0.00 C ATOM 1784 CG1 VAL A 118 5.913 1.955 -3.838 1.00 0.00 C ATOM 1785 CG2 VAL A 118 6.056 -0.404 -3.030 1.00 0.00 C ATOM 0 H VAL A 118 9.143 -0.457 -3.170 1.00 0.00 H new ATOM 0 HA VAL A 118 7.278 0.098 -5.365 1.00 0.00 H new ATOM 0 HB VAL A 118 7.422 1.181 -2.551 1.00 0.00 H new ATOM 0 HG11 VAL A 118 5.218 2.172 -3.027 1.00 0.00 H new ATOM 0 HG12 VAL A 118 6.493 2.849 -4.068 1.00 0.00 H new ATOM 0 HG13 VAL A 118 5.354 1.648 -4.722 1.00 0.00 H new ATOM 0 HG21 VAL A 118 5.346 -0.147 -2.244 1.00 0.00 H new ATOM 0 HG22 VAL A 118 5.515 -0.773 -3.901 1.00 0.00 H new ATOM 0 HG23 VAL A 118 6.733 -1.178 -2.669 1.00 0.00 H new ATOM 1795 N ASP A 119 8.441 2.086 -6.228 1.00 0.00 N ATOM 1796 CA ASP A 119 9.156 3.209 -6.845 1.00 0.00 C ATOM 1797 C ASP A 119 8.870 4.520 -6.114 1.00 0.00 C ATOM 1798 O ASP A 119 7.718 4.960 -6.059 1.00 0.00 O ATOM 1799 CB ASP A 119 8.782 3.355 -8.319 1.00 0.00 C ATOM 1800 CG ASP A 119 9.560 4.458 -9.003 1.00 0.00 C ATOM 1801 OD1 ASP A 119 9.114 5.606 -9.004 1.00 0.00 O ATOM 1802 OD2 ASP A 119 10.624 4.184 -9.566 1.00 0.00 O ATOM 0 H ASP A 119 7.771 1.634 -6.851 1.00 0.00 H new ATOM 0 HA ASP A 119 10.221 2.991 -6.769 1.00 0.00 H new ATOM 0 HB2 ASP A 119 8.965 2.412 -8.833 1.00 0.00 H new ATOM 0 HB3 ASP A 119 7.715 3.561 -8.402 1.00 0.00 H new ATOM 1807 N PRO A 120 9.918 5.165 -5.544 1.00 0.00 N ATOM 1808 CA PRO A 120 9.776 6.408 -4.772 1.00 0.00 C ATOM 1809 C PRO A 120 9.316 7.616 -5.604 1.00 0.00 C ATOM 1810 O PRO A 120 8.631 8.494 -5.089 1.00 0.00 O ATOM 1811 CB PRO A 120 11.185 6.667 -4.216 1.00 0.00 C ATOM 1812 CG PRO A 120 11.911 5.376 -4.368 1.00 0.00 C ATOM 1813 CD PRO A 120 11.328 4.717 -5.573 1.00 0.00 C ATOM 0 HA PRO A 120 9.005 6.290 -4.011 1.00 0.00 H new ATOM 0 HB2 PRO A 120 11.684 7.466 -4.765 1.00 0.00 H new ATOM 0 HB3 PRO A 120 11.145 6.975 -3.171 1.00 0.00 H new ATOM 0 HG2 PRO A 120 12.981 5.542 -4.493 1.00 0.00 H new ATOM 0 HG3 PRO A 120 11.787 4.752 -3.483 1.00 0.00 H new ATOM 0 HD2 PRO A 120 11.832 5.028 -6.488 1.00 0.00 H new ATOM 0 HD3 PRO A 120 11.408 3.631 -5.519 1.00 0.00 H new ATOM 1821 N ALA A 121 9.649 7.640 -6.884 1.00 0.00 N ATOM 1822 CA ALA A 121 9.313 8.780 -7.737 1.00 0.00 C ATOM 1823 C ALA A 121 7.833 8.764 -8.086 1.00 0.00 C ATOM 1824 O ALA A 121 7.172 9.810 -8.121 1.00 0.00 O ATOM 1825 CB ALA A 121 10.166 8.784 -8.997 1.00 0.00 C ATOM 0 H ALA A 121 10.150 6.889 -7.359 1.00 0.00 H new ATOM 0 HA ALA A 121 9.526 9.696 -7.185 1.00 0.00 H new ATOM 0 HB1 ALA A 121 9.898 9.641 -9.615 1.00 0.00 H new ATOM 0 HB2 ALA A 121 11.219 8.849 -8.723 1.00 0.00 H new ATOM 0 HB3 ALA A 121 9.993 7.865 -9.556 1.00 0.00 H new ATOM 1831 N THR A 122 7.316 7.580 -8.290 1.00 0.00 N ATOM 1832 CA THR A 122 5.944 7.378 -8.601 1.00 0.00 C ATOM 1833 C THR A 122 5.102 7.385 -7.295 1.00 0.00 C ATOM 1834 O THR A 122 3.872 7.485 -7.327 1.00 0.00 O ATOM 1835 CB THR A 122 5.814 6.018 -9.322 1.00 0.00 C ATOM 1836 OG1 THR A 122 6.829 5.934 -10.348 1.00 0.00 O ATOM 1837 CG2 THR A 122 4.467 5.887 -9.980 1.00 0.00 C ATOM 0 H THR A 122 7.858 6.717 -8.241 1.00 0.00 H new ATOM 0 HA THR A 122 5.575 8.176 -9.245 1.00 0.00 H new ATOM 0 HB THR A 122 5.932 5.223 -8.586 1.00 0.00 H new ATOM 0 HG1 THR A 122 7.698 5.750 -9.934 1.00 0.00 H new ATOM 0 HG21 THR A 122 4.399 4.921 -10.481 1.00 0.00 H new ATOM 0 HG22 THR A 122 3.684 5.960 -9.225 1.00 0.00 H new ATOM 0 HG23 THR A 122 4.340 6.685 -10.712 1.00 0.00 H new ATOM 1845 N LEU A 123 5.789 7.314 -6.159 1.00 0.00 N ATOM 1846 CA LEU A 123 5.146 7.306 -4.872 1.00 0.00 C ATOM 1847 C LEU A 123 4.912 8.758 -4.456 1.00 0.00 C ATOM 1848 O LEU A 123 5.851 9.500 -4.151 1.00 0.00 O ATOM 1849 CB LEU A 123 6.027 6.550 -3.839 1.00 0.00 C ATOM 1850 CG LEU A 123 5.342 5.940 -2.587 1.00 0.00 C ATOM 1851 CD1 LEU A 123 6.356 5.156 -1.772 1.00 0.00 C ATOM 1852 CD2 LEU A 123 4.690 6.993 -1.706 1.00 0.00 C ATOM 0 H LEU A 123 6.807 7.261 -6.117 1.00 0.00 H new ATOM 0 HA LEU A 123 4.190 6.785 -4.919 1.00 0.00 H new ATOM 0 HB2 LEU A 123 6.535 5.742 -4.365 1.00 0.00 H new ATOM 0 HB3 LEU A 123 6.797 7.239 -3.493 1.00 0.00 H new ATOM 0 HG LEU A 123 4.553 5.279 -2.946 1.00 0.00 H new ATOM 0 HD11 LEU A 123 5.868 4.731 -0.895 1.00 0.00 H new ATOM 0 HD12 LEU A 123 6.770 4.353 -2.382 1.00 0.00 H new ATOM 0 HD13 LEU A 123 7.159 5.821 -1.454 1.00 0.00 H new ATOM 0 HD21 LEU A 123 4.226 6.511 -0.845 1.00 0.00 H new ATOM 0 HD22 LEU A 123 5.446 7.699 -1.363 1.00 0.00 H new ATOM 0 HD23 LEU A 123 3.929 7.525 -2.277 1.00 0.00 H new ATOM 1864 N ILE A 124 3.681 9.152 -4.480 1.00 0.00 N ATOM 1865 CA ILE A 124 3.274 10.494 -4.138 1.00 0.00 C ATOM 1866 C ILE A 124 2.238 10.398 -3.039 1.00 0.00 C ATOM 1867 O ILE A 124 1.320 9.584 -3.131 1.00 0.00 O ATOM 1868 CB ILE A 124 2.634 11.227 -5.371 1.00 0.00 C ATOM 1869 CG1 ILE A 124 3.608 11.242 -6.569 1.00 0.00 C ATOM 1870 CG2 ILE A 124 2.219 12.661 -4.999 1.00 0.00 C ATOM 1871 CD1 ILE A 124 3.029 11.831 -7.844 1.00 0.00 C ATOM 0 H ILE A 124 2.906 8.543 -4.743 1.00 0.00 H new ATOM 0 HA ILE A 124 4.148 11.062 -3.819 1.00 0.00 H new ATOM 0 HB ILE A 124 1.741 10.675 -5.663 1.00 0.00 H new ATOM 0 HG12 ILE A 124 4.496 11.810 -6.292 1.00 0.00 H new ATOM 0 HG13 ILE A 124 3.933 10.221 -6.770 1.00 0.00 H new ATOM 0 HG21 ILE A 124 1.778 13.149 -5.868 1.00 0.00 H new ATOM 0 HG22 ILE A 124 1.488 12.630 -4.191 1.00 0.00 H new ATOM 0 HG23 ILE A 124 3.096 13.221 -4.674 1.00 0.00 H new ATOM 0 HD11 ILE A 124 3.781 11.802 -8.633 1.00 0.00 H new ATOM 0 HD12 ILE A 124 2.159 11.251 -8.151 1.00 0.00 H new ATOM 0 HD13 ILE A 124 2.731 12.864 -7.665 1.00 0.00 H new ATOM 1883 N VAL A 125 2.411 11.162 -1.994 1.00 0.00 N ATOM 1884 CA VAL A 125 1.440 11.238 -0.915 1.00 0.00 C ATOM 1885 C VAL A 125 1.173 12.705 -0.662 1.00 0.00 C ATOM 1886 O VAL A 125 1.960 13.384 -0.014 1.00 0.00 O ATOM 1887 CB VAL A 125 1.922 10.526 0.401 1.00 0.00 C ATOM 1888 CG1 VAL A 125 0.920 10.690 1.531 1.00 0.00 C ATOM 1889 CG2 VAL A 125 2.172 9.040 0.168 1.00 0.00 C ATOM 0 H VAL A 125 3.230 11.755 -1.859 1.00 0.00 H new ATOM 0 HA VAL A 125 0.534 10.710 -1.213 1.00 0.00 H new ATOM 0 HB VAL A 125 2.857 11.008 0.688 1.00 0.00 H new ATOM 0 HG11 VAL A 125 1.291 10.184 2.422 1.00 0.00 H new ATOM 0 HG12 VAL A 125 0.784 11.750 1.746 1.00 0.00 H new ATOM 0 HG13 VAL A 125 -0.035 10.254 1.237 1.00 0.00 H new ATOM 0 HG21 VAL A 125 2.504 8.577 1.097 1.00 0.00 H new ATOM 0 HG22 VAL A 125 1.250 8.564 -0.165 1.00 0.00 H new ATOM 0 HG23 VAL A 125 2.941 8.916 -0.594 1.00 0.00 H new ATOM 1899 N ALA A 126 0.106 13.193 -1.227 1.00 0.00 N ATOM 1900 CA ALA A 126 -0.216 14.586 -1.174 1.00 0.00 C ATOM 1901 C ALA A 126 -1.559 14.822 -0.498 1.00 0.00 C ATOM 1902 O ALA A 126 -2.471 13.971 -0.552 1.00 0.00 O ATOM 1903 CB ALA A 126 -0.194 15.171 -2.577 1.00 0.00 C ATOM 0 H ALA A 126 -0.570 12.628 -1.742 1.00 0.00 H new ATOM 0 HA ALA A 126 0.536 15.094 -0.570 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -0.440 16.232 -2.533 1.00 0.00 H new ATOM 0 HB2 ALA A 126 0.800 15.046 -3.008 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -0.926 14.655 -3.198 1.00 0.00 H new ATOM 1909 N ASP A 127 -1.683 15.958 0.136 1.00 0.00 N ATOM 1910 CA ASP A 127 -2.899 16.324 0.851 1.00 0.00 C ATOM 1911 C ASP A 127 -3.856 17.085 -0.075 1.00 0.00 C ATOM 1912 O ASP A 127 -3.668 17.099 -1.291 1.00 0.00 O ATOM 1913 CB ASP A 127 -2.554 17.174 2.087 1.00 0.00 C ATOM 1914 CG ASP A 127 -2.170 18.601 1.763 1.00 0.00 C ATOM 1915 OD1 ASP A 127 -2.816 19.525 2.284 1.00 0.00 O ATOM 1916 OD2 ASP A 127 -1.256 18.824 0.958 1.00 0.00 O ATOM 0 H ASP A 127 -0.948 16.664 0.177 1.00 0.00 H new ATOM 0 HA ASP A 127 -3.396 15.413 1.184 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -3.411 17.183 2.760 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -1.732 16.700 2.624 1.00 0.00 H new ATOM 1921 N GLU A 128 -4.877 17.719 0.495 1.00 0.00 N ATOM 1922 CA GLU A 128 -5.822 18.503 -0.293 1.00 0.00 C ATOM 1923 C GLU A 128 -5.262 19.880 -0.735 1.00 0.00 C ATOM 1924 O GLU A 128 -5.927 20.650 -1.435 1.00 0.00 O ATOM 1925 CB GLU A 128 -7.230 18.556 0.355 1.00 0.00 C ATOM 1926 CG GLU A 128 -7.295 18.871 1.857 1.00 0.00 C ATOM 1927 CD GLU A 128 -6.868 20.266 2.217 1.00 0.00 C ATOM 1928 OE1 GLU A 128 -7.365 21.232 1.605 1.00 0.00 O ATOM 1929 OE2 GLU A 128 -6.072 20.426 3.149 1.00 0.00 O ATOM 0 H GLU A 128 -5.070 17.705 1.496 1.00 0.00 H new ATOM 0 HA GLU A 128 -5.963 17.967 -1.231 1.00 0.00 H new ATOM 0 HB2 GLU A 128 -7.818 19.306 -0.174 1.00 0.00 H new ATOM 0 HB3 GLU A 128 -7.716 17.594 0.189 1.00 0.00 H new ATOM 0 HG2 GLU A 128 -8.316 18.715 2.205 1.00 0.00 H new ATOM 0 HG3 GLU A 128 -6.664 18.161 2.392 1.00 0.00 H new ATOM 1936 N ASN A 129 -4.036 20.158 -0.326 1.00 0.00 N ATOM 1937 CA ASN A 129 -3.266 21.317 -0.780 1.00 0.00 C ATOM 1938 C ASN A 129 -2.176 20.797 -1.750 1.00 0.00 C ATOM 1939 O ASN A 129 -1.235 21.497 -2.102 1.00 0.00 O ATOM 1940 CB ASN A 129 -2.629 22.029 0.439 1.00 0.00 C ATOM 1941 CG ASN A 129 -1.899 23.329 0.127 1.00 0.00 C ATOM 1942 OD1 ASN A 129 -2.252 24.057 -0.804 1.00 0.00 O ATOM 1943 ND2 ASN A 129 -0.876 23.628 0.904 1.00 0.00 N ATOM 0 H ASN A 129 -3.533 19.577 0.344 1.00 0.00 H new ATOM 0 HA ASN A 129 -3.903 22.040 -1.290 1.00 0.00 H new ATOM 0 HB2 ASN A 129 -3.413 22.238 1.167 1.00 0.00 H new ATOM 0 HB3 ASN A 129 -1.928 21.343 0.914 1.00 0.00 H new ATOM 0 HD21 ASN A 129 -0.348 24.486 0.744 1.00 0.00 H new ATOM 0 HD22 ASN A 129 -0.613 23.001 1.665 1.00 0.00 H new ATOM 1950 N ASP A 130 -2.344 19.517 -2.146 1.00 0.00 N ATOM 1951 CA ASP A 130 -1.492 18.747 -3.103 1.00 0.00 C ATOM 1952 C ASP A 130 -0.003 18.735 -2.765 1.00 0.00 C ATOM 1953 O ASP A 130 0.843 18.450 -3.621 1.00 0.00 O ATOM 1954 CB ASP A 130 -1.742 19.086 -4.614 1.00 0.00 C ATOM 1955 CG ASP A 130 -1.318 20.474 -5.064 1.00 0.00 C ATOM 1956 OD1 ASP A 130 -0.140 20.679 -5.413 1.00 0.00 O ATOM 1957 OD2 ASP A 130 -2.176 21.376 -5.132 1.00 0.00 O ATOM 0 H ASP A 130 -3.118 18.954 -1.792 1.00 0.00 H new ATOM 0 HA ASP A 130 -1.840 17.724 -2.959 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -1.215 18.351 -5.223 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -2.806 18.967 -4.821 1.00 0.00 H new ATOM 1962 N LYS A 131 0.316 18.922 -1.512 1.00 0.00 N ATOM 1963 CA LYS A 131 1.691 18.927 -1.091 1.00 0.00 C ATOM 1964 C LYS A 131 2.119 17.536 -0.717 1.00 0.00 C ATOM 1965 O LYS A 131 1.475 16.886 0.112 1.00 0.00 O ATOM 1966 CB LYS A 131 1.905 19.876 0.081 1.00 0.00 C ATOM 1967 CG LYS A 131 1.633 21.334 -0.228 1.00 0.00 C ATOM 1968 CD LYS A 131 2.622 21.845 -1.235 1.00 0.00 C ATOM 1969 CE LYS A 131 2.389 23.281 -1.589 1.00 0.00 C ATOM 1970 NZ LYS A 131 3.384 23.733 -2.567 1.00 0.00 N ATOM 0 H LYS A 131 -0.360 19.073 -0.763 1.00 0.00 H new ATOM 0 HA LYS A 131 2.300 19.278 -1.924 1.00 0.00 H new ATOM 0 HB2 LYS A 131 1.261 19.567 0.904 1.00 0.00 H new ATOM 0 HB3 LYS A 131 2.934 19.778 0.427 1.00 0.00 H new ATOM 0 HG2 LYS A 131 0.620 21.449 -0.613 1.00 0.00 H new ATOM 0 HG3 LYS A 131 1.696 21.925 0.686 1.00 0.00 H new ATOM 0 HD2 LYS A 131 3.631 21.731 -0.839 1.00 0.00 H new ATOM 0 HD3 LYS A 131 2.563 21.237 -2.138 1.00 0.00 H new ATOM 0 HE2 LYS A 131 1.386 23.404 -1.998 1.00 0.00 H new ATOM 0 HE3 LYS A 131 2.445 23.897 -0.692 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 3.210 24.731 -2.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 4.337 23.634 -2.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 3.311 23.155 -3.429 1.00 0.00 H new ATOM 1984 N ASP A 132 3.175 17.068 -1.359 1.00 0.00 N ATOM 1985 CA ASP A 132 3.734 15.755 -1.078 1.00 0.00 C ATOM 1986 C ASP A 132 4.419 15.773 0.276 1.00 0.00 C ATOM 1987 O ASP A 132 5.392 16.512 0.497 1.00 0.00 O ATOM 1988 CB ASP A 132 4.696 15.308 -2.188 1.00 0.00 C ATOM 1989 CG ASP A 132 5.403 14.001 -1.878 1.00 0.00 C ATOM 1990 OD1 ASP A 132 6.565 14.042 -1.416 1.00 0.00 O ATOM 1991 OD2 ASP A 132 4.834 12.907 -2.114 1.00 0.00 O ATOM 0 H ASP A 132 3.668 17.584 -2.087 1.00 0.00 H new ATOM 0 HA ASP A 132 2.924 15.027 -1.050 1.00 0.00 H new ATOM 0 HB2 ASP A 132 4.140 15.201 -3.120 1.00 0.00 H new ATOM 0 HB3 ASP A 132 5.441 16.087 -2.349 1.00 0.00 H new ATOM 1996 N ILE A 133 3.884 15.012 1.176 1.00 0.00 N ATOM 1997 CA ILE A 133 4.327 14.961 2.541 1.00 0.00 C ATOM 1998 C ILE A 133 4.525 13.537 3.002 1.00 0.00 C ATOM 1999 O ILE A 133 3.640 12.950 3.614 1.00 0.00 O ATOM 2000 CB ILE A 133 3.333 15.690 3.494 1.00 0.00 C ATOM 2001 CG1 ILE A 133 1.849 15.344 3.145 1.00 0.00 C ATOM 2002 CG2 ILE A 133 3.568 17.176 3.485 1.00 0.00 C ATOM 2003 CD1 ILE A 133 0.810 15.945 4.077 1.00 0.00 C ATOM 0 H ILE A 133 3.102 14.387 0.980 1.00 0.00 H new ATOM 0 HA ILE A 133 5.286 15.478 2.580 1.00 0.00 H new ATOM 0 HB ILE A 133 3.520 15.331 4.506 1.00 0.00 H new ATOM 0 HG12 ILE A 133 1.643 15.682 2.130 1.00 0.00 H new ATOM 0 HG13 ILE A 133 1.734 14.260 3.149 1.00 0.00 H new ATOM 0 HG21 ILE A 133 2.861 17.660 4.158 1.00 0.00 H new ATOM 0 HG22 ILE A 133 4.585 17.385 3.815 1.00 0.00 H new ATOM 0 HG23 ILE A 133 3.428 17.560 2.475 1.00 0.00 H new ATOM 0 HD11 ILE A 133 -0.187 15.647 3.751 1.00 0.00 H new ATOM 0 HD12 ILE A 133 0.982 15.588 5.092 1.00 0.00 H new ATOM 0 HD13 ILE A 133 0.889 17.032 4.057 1.00 0.00 H new ATOM 2015 N LYS A 134 5.657 12.951 2.681 1.00 0.00 N ATOM 2016 CA LYS A 134 5.869 11.595 3.082 1.00 0.00 C ATOM 2017 C LYS A 134 7.311 11.207 3.325 1.00 0.00 C ATOM 2018 O LYS A 134 8.217 11.527 2.536 1.00 0.00 O ATOM 2019 CB LYS A 134 5.139 10.597 2.129 1.00 0.00 C ATOM 2020 CG LYS A 134 5.450 10.703 0.610 1.00 0.00 C ATOM 2021 CD LYS A 134 6.763 10.049 0.231 1.00 0.00 C ATOM 2022 CE LYS A 134 7.004 10.060 -1.265 1.00 0.00 C ATOM 2023 NZ LYS A 134 7.188 11.413 -1.808 1.00 0.00 N ATOM 0 H LYS A 134 6.419 13.383 2.159 1.00 0.00 H new ATOM 0 HA LYS A 134 5.413 11.524 4.069 1.00 0.00 H new ATOM 0 HB2 LYS A 134 5.380 9.584 2.453 1.00 0.00 H new ATOM 0 HB3 LYS A 134 4.065 10.727 2.263 1.00 0.00 H new ATOM 0 HG2 LYS A 134 4.642 10.238 0.045 1.00 0.00 H new ATOM 0 HG3 LYS A 134 5.477 11.754 0.322 1.00 0.00 H new ATOM 0 HD2 LYS A 134 7.581 10.567 0.732 1.00 0.00 H new ATOM 0 HD3 LYS A 134 6.770 9.020 0.590 1.00 0.00 H new ATOM 0 HE2 LYS A 134 7.887 9.461 -1.489 1.00 0.00 H new ATOM 0 HE3 LYS A 134 6.161 9.585 -1.767 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 7.987 11.414 -2.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 6.323 11.709 -2.304 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 7.385 12.075 -1.031 1.00 0.00 H new ATOM 2037 N ASP A 135 7.524 10.580 4.459 1.00 0.00 N ATOM 2038 CA ASP A 135 8.747 9.866 4.730 1.00 0.00 C ATOM 2039 C ASP A 135 8.386 8.474 4.354 1.00 0.00 C ATOM 2040 O ASP A 135 7.664 7.811 5.100 1.00 0.00 O ATOM 2041 CB ASP A 135 9.140 9.830 6.234 1.00 0.00 C ATOM 2042 CG ASP A 135 9.325 11.155 6.916 1.00 0.00 C ATOM 2043 OD1 ASP A 135 9.127 11.211 8.157 1.00 0.00 O ATOM 2044 OD2 ASP A 135 9.676 12.153 6.256 1.00 0.00 O ATOM 0 H ASP A 135 6.849 10.552 5.223 1.00 0.00 H new ATOM 0 HA ASP A 135 9.583 10.329 4.205 1.00 0.00 H new ATOM 0 HB2 ASP A 135 8.372 9.275 6.773 1.00 0.00 H new ATOM 0 HB3 ASP A 135 10.068 9.266 6.330 1.00 0.00 H new ATOM 2049 N ALA A 136 8.806 8.021 3.233 1.00 0.00 N ATOM 2050 CA ALA A 136 8.366 6.735 2.793 1.00 0.00 C ATOM 2051 C ALA A 136 9.485 5.899 2.324 1.00 0.00 C ATOM 2052 O ALA A 136 10.342 6.349 1.548 1.00 0.00 O ATOM 2053 CB ALA A 136 7.325 6.857 1.700 1.00 0.00 C ATOM 0 H ALA A 136 9.445 8.507 2.604 1.00 0.00 H new ATOM 0 HA ALA A 136 7.917 6.247 3.658 1.00 0.00 H new ATOM 0 HB1 ALA A 136 7.009 5.862 1.385 1.00 0.00 H new ATOM 0 HB2 ALA A 136 6.464 7.408 2.078 1.00 0.00 H new ATOM 0 HB3 ALA A 136 7.751 7.388 0.849 1.00 0.00 H new ATOM 2059 N ALA A 137 9.493 4.713 2.799 1.00 0.00 N ATOM 2060 CA ALA A 137 10.414 3.731 2.358 1.00 0.00 C ATOM 2061 C ALA A 137 9.666 2.448 2.288 1.00 0.00 C ATOM 2062 O ALA A 137 9.203 1.940 3.308 1.00 0.00 O ATOM 2063 CB ALA A 137 11.586 3.619 3.315 1.00 0.00 C ATOM 0 H ALA A 137 8.848 4.388 3.519 1.00 0.00 H new ATOM 0 HA ALA A 137 10.828 3.996 1.385 1.00 0.00 H new ATOM 0 HB1 ALA A 137 12.279 2.859 2.954 1.00 0.00 H new ATOM 0 HB2 ALA A 137 12.100 4.579 3.375 1.00 0.00 H new ATOM 0 HB3 ALA A 137 11.223 3.339 4.304 1.00 0.00 H new ATOM 2069 N SER A 138 9.496 1.936 1.115 1.00 0.00 N ATOM 2070 CA SER A 138 8.772 0.747 0.983 1.00 0.00 C ATOM 2071 C SER A 138 9.589 -0.307 0.295 1.00 0.00 C ATOM 2072 O SER A 138 9.849 -0.261 -0.919 1.00 0.00 O ATOM 2073 CB SER A 138 7.443 1.003 0.280 1.00 0.00 C ATOM 2074 OG SER A 138 6.700 -0.192 0.121 1.00 0.00 O ATOM 0 H SER A 138 9.853 2.331 0.245 1.00 0.00 H new ATOM 0 HA SER A 138 8.542 0.366 1.978 1.00 0.00 H new ATOM 0 HB2 SER A 138 6.859 1.722 0.855 1.00 0.00 H new ATOM 0 HB3 SER A 138 7.627 1.450 -0.697 1.00 0.00 H new ATOM 0 HG SER A 138 5.756 0.027 -0.026 1.00 0.00 H new ATOM 2080 N ASN A 139 10.016 -1.234 1.098 1.00 0.00 N ATOM 2081 CA ASN A 139 10.726 -2.389 0.697 1.00 0.00 C ATOM 2082 C ASN A 139 10.075 -3.546 1.407 1.00 0.00 C ATOM 2083 O ASN A 139 10.776 -4.448 1.879 1.00 0.00 O ATOM 2084 CB ASN A 139 12.186 -2.301 1.148 1.00 0.00 C ATOM 2085 CG ASN A 139 13.054 -1.276 0.442 1.00 0.00 C ATOM 2086 OD1 ASN A 139 12.753 -0.962 -0.789 1.00 0.00 O flip ATOM 2087 ND2 ASN A 139 14.008 -0.766 1.028 1.00 0.00 N flip ATOM 0 H ASN A 139 9.864 -1.193 2.106 1.00 0.00 H new ATOM 0 HA ASN A 139 10.706 -2.498 -0.387 1.00 0.00 H new ATOM 0 HB2 ASN A 139 12.200 -2.082 2.216 1.00 0.00 H new ATOM 0 HB3 ASN A 139 12.643 -3.282 1.018 1.00 0.00 H new ATOM 0 HD21 ASN A 139 14.217 -1.033 1.990 1.00 0.00 H new ATOM 0 HD22 ASN A 139 14.590 -0.077 0.552 1.00 0.00 H new ATOM 2094 N GLY A 140 8.711 -3.494 1.461 1.00 0.00 N ATOM 2095 CA GLY A 140 7.872 -4.480 2.176 1.00 0.00 C ATOM 2096 C GLY A 140 8.347 -5.876 1.959 1.00 0.00 C ATOM 2097 O GLY A 140 8.265 -6.399 0.869 1.00 0.00 O ATOM 0 H GLY A 140 8.169 -2.760 1.005 1.00 0.00 H new ATOM 0 HA2 GLY A 140 7.878 -4.256 3.243 1.00 0.00 H new ATOM 0 HA3 GLY A 140 6.840 -4.391 1.838 1.00 0.00 H new ATOM 2101 N LYS A 141 8.877 -6.456 2.977 1.00 0.00 N ATOM 2102 CA LYS A 141 9.552 -7.699 2.832 1.00 0.00 C ATOM 2103 C LYS A 141 8.682 -8.857 3.209 1.00 0.00 C ATOM 2104 O LYS A 141 8.043 -8.863 4.261 1.00 0.00 O ATOM 2105 CB LYS A 141 10.829 -7.684 3.657 1.00 0.00 C ATOM 2106 CG LYS A 141 11.671 -8.941 3.576 1.00 0.00 C ATOM 2107 CD LYS A 141 12.655 -9.046 4.739 1.00 0.00 C ATOM 2108 CE LYS A 141 13.597 -7.866 4.848 1.00 0.00 C ATOM 2109 NZ LYS A 141 14.558 -8.045 5.955 1.00 0.00 N ATOM 0 H LYS A 141 8.856 -6.087 3.928 1.00 0.00 H new ATOM 0 HA LYS A 141 9.806 -7.829 1.780 1.00 0.00 H new ATOM 0 HB2 LYS A 141 11.438 -6.838 3.337 1.00 0.00 H new ATOM 0 HB3 LYS A 141 10.565 -7.511 4.700 1.00 0.00 H new ATOM 0 HG2 LYS A 141 11.019 -9.815 3.573 1.00 0.00 H new ATOM 0 HG3 LYS A 141 12.220 -8.950 2.634 1.00 0.00 H new ATOM 0 HD2 LYS A 141 12.095 -9.140 5.670 1.00 0.00 H new ATOM 0 HD3 LYS A 141 13.241 -9.958 4.626 1.00 0.00 H new ATOM 0 HE2 LYS A 141 14.139 -7.743 3.910 1.00 0.00 H new ATOM 0 HE3 LYS A 141 13.023 -6.953 5.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 141 15.189 -7.220 6.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 141 14.041 -8.138 6.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 141 15.122 -8.903 5.790 1.00 0.00 H new ATOM 2123 N ILE A 142 8.644 -9.801 2.331 1.00 0.00 N ATOM 2124 CA ILE A 142 7.987 -11.034 2.537 1.00 0.00 C ATOM 2125 C ILE A 142 9.078 -12.085 2.619 1.00 0.00 C ATOM 2126 O ILE A 142 9.736 -12.399 1.616 1.00 0.00 O ATOM 2127 CB ILE A 142 7.028 -11.371 1.361 1.00 0.00 C ATOM 2128 CG1 ILE A 142 6.049 -10.203 1.124 1.00 0.00 C ATOM 2129 CG2 ILE A 142 6.266 -12.668 1.660 1.00 0.00 C ATOM 2130 CD1 ILE A 142 5.149 -10.365 -0.085 1.00 0.00 C ATOM 0 H ILE A 142 9.089 -9.726 1.416 1.00 0.00 H new ATOM 0 HA ILE A 142 7.381 -10.995 3.442 1.00 0.00 H new ATOM 0 HB ILE A 142 7.614 -11.517 0.453 1.00 0.00 H new ATOM 0 HG12 ILE A 142 5.426 -10.084 2.010 1.00 0.00 H new ATOM 0 HG13 ILE A 142 6.623 -9.283 1.012 1.00 0.00 H new ATOM 0 HG21 ILE A 142 5.597 -12.896 0.831 1.00 0.00 H new ATOM 0 HG22 ILE A 142 6.976 -13.485 1.789 1.00 0.00 H new ATOM 0 HG23 ILE A 142 5.684 -12.546 2.573 1.00 0.00 H new ATOM 0 HD11 ILE A 142 4.496 -9.497 -0.171 1.00 0.00 H new ATOM 0 HD12 ILE A 142 5.759 -10.451 -0.984 1.00 0.00 H new ATOM 0 HD13 ILE A 142 4.544 -11.264 0.030 1.00 0.00 H new ATOM 2142 N THR A 143 9.332 -12.552 3.789 1.00 0.00 N ATOM 2143 CA THR A 143 10.321 -13.551 3.994 1.00 0.00 C ATOM 2144 C THR A 143 9.708 -14.920 3.743 1.00 0.00 C ATOM 2145 O THR A 143 8.886 -15.401 4.528 1.00 0.00 O ATOM 2146 CB THR A 143 10.891 -13.463 5.426 1.00 0.00 C ATOM 2147 OG1 THR A 143 11.398 -12.129 5.654 1.00 0.00 O ATOM 2148 CG2 THR A 143 12.014 -14.472 5.630 1.00 0.00 C ATOM 0 H THR A 143 8.856 -12.250 4.639 1.00 0.00 H new ATOM 0 HA THR A 143 11.144 -13.393 3.297 1.00 0.00 H new ATOM 0 HB THR A 143 10.092 -13.689 6.133 1.00 0.00 H new ATOM 0 HG1 THR A 143 12.254 -12.020 5.189 1.00 0.00 H new ATOM 0 HG21 THR A 143 12.398 -14.389 6.647 1.00 0.00 H new ATOM 0 HG22 THR A 143 11.632 -15.480 5.468 1.00 0.00 H new ATOM 0 HG23 THR A 143 12.817 -14.270 4.921 1.00 0.00 H new ATOM 2156 N VAL A 144 10.055 -15.506 2.629 1.00 0.00 N ATOM 2157 CA VAL A 144 9.566 -16.806 2.288 1.00 0.00 C ATOM 2158 C VAL A 144 10.394 -17.831 3.038 1.00 0.00 C ATOM 2159 O VAL A 144 11.591 -17.959 2.801 1.00 0.00 O ATOM 2160 CB VAL A 144 9.627 -17.075 0.757 1.00 0.00 C ATOM 2161 CG1 VAL A 144 9.028 -18.437 0.419 1.00 0.00 C ATOM 2162 CG2 VAL A 144 8.907 -15.979 -0.019 1.00 0.00 C ATOM 0 H VAL A 144 10.682 -15.094 1.938 1.00 0.00 H new ATOM 0 HA VAL A 144 8.516 -16.874 2.572 1.00 0.00 H new ATOM 0 HB VAL A 144 10.677 -17.074 0.463 1.00 0.00 H new ATOM 0 HG11 VAL A 144 9.082 -18.601 -0.657 1.00 0.00 H new ATOM 0 HG12 VAL A 144 9.587 -19.218 0.934 1.00 0.00 H new ATOM 0 HG13 VAL A 144 7.986 -18.466 0.738 1.00 0.00 H new ATOM 0 HG21 VAL A 144 8.965 -16.191 -1.087 1.00 0.00 H new ATOM 0 HG22 VAL A 144 7.862 -15.943 0.288 1.00 0.00 H new ATOM 0 HG23 VAL A 144 9.379 -15.018 0.186 1.00 0.00 H new ATOM 2172 N THR A 145 9.774 -18.496 3.965 1.00 0.00 N ATOM 2173 CA THR A 145 10.431 -19.476 4.776 1.00 0.00 C ATOM 2174 C THR A 145 10.506 -20.817 4.058 1.00 0.00 C ATOM 2175 O THR A 145 11.593 -21.381 3.877 1.00 0.00 O ATOM 2176 CB THR A 145 9.700 -19.598 6.113 1.00 0.00 C ATOM 2177 OG1 THR A 145 8.284 -19.551 5.868 1.00 0.00 O ATOM 2178 CG2 THR A 145 10.089 -18.466 7.046 1.00 0.00 C ATOM 0 H THR A 145 8.785 -18.372 4.182 1.00 0.00 H new ATOM 0 HA THR A 145 11.456 -19.157 4.965 1.00 0.00 H new ATOM 0 HB THR A 145 9.975 -20.541 6.586 1.00 0.00 H new ATOM 0 HG1 THR A 145 7.957 -20.452 5.664 1.00 0.00 H new ATOM 0 HG21 THR A 145 9.556 -18.574 7.991 1.00 0.00 H new ATOM 0 HG22 THR A 145 11.163 -18.498 7.229 1.00 0.00 H new ATOM 0 HG23 THR A 145 9.827 -17.512 6.589 1.00 0.00 H new ATOM 2186 N GLY A 146 9.362 -21.318 3.648 1.00 0.00 N ATOM 2187 CA GLY A 146 9.322 -22.537 2.904 1.00 0.00 C ATOM 2188 C GLY A 146 8.632 -23.645 3.655 1.00 0.00 C ATOM 2189 O GLY A 146 8.979 -23.943 4.792 1.00 0.00 O ATOM 0 H GLY A 146 8.451 -20.893 3.822 1.00 0.00 H new ATOM 0 HA2 GLY A 146 8.806 -22.366 1.959 1.00 0.00 H new ATOM 0 HA3 GLY A 146 10.339 -22.845 2.661 1.00 0.00 H new ATOM 2193 N SER A 147 7.660 -24.259 3.015 1.00 0.00 N ATOM 2194 CA SER A 147 6.904 -25.351 3.601 1.00 0.00 C ATOM 2195 C SER A 147 7.560 -26.703 3.262 1.00 0.00 C ATOM 2196 O SER A 147 6.964 -27.768 3.449 1.00 0.00 O ATOM 2197 CB SER A 147 5.476 -25.300 3.066 1.00 0.00 C ATOM 2198 OG SER A 147 4.912 -24.014 3.275 1.00 0.00 O ATOM 0 H SER A 147 7.369 -24.015 2.068 1.00 0.00 H new ATOM 0 HA SER A 147 6.892 -25.249 4.686 1.00 0.00 H new ATOM 0 HB2 SER A 147 5.471 -25.537 2.002 1.00 0.00 H new ATOM 0 HB3 SER A 147 4.868 -26.055 3.564 1.00 0.00 H new ATOM 0 HG SER A 147 4.227 -23.843 2.595 1.00 0.00 H new ATOM 2204 N ALA A 148 8.779 -26.638 2.777 1.00 0.00 N ATOM 2205 CA ALA A 148 9.537 -27.801 2.422 1.00 0.00 C ATOM 2206 C ALA A 148 10.595 -28.034 3.500 1.00 0.00 C ATOM 2207 O ALA A 148 11.389 -27.132 3.794 1.00 0.00 O ATOM 2208 CB ALA A 148 10.173 -27.603 1.052 1.00 0.00 C ATOM 0 H ALA A 148 9.273 -25.760 2.618 1.00 0.00 H new ATOM 0 HA ALA A 148 8.892 -28.678 2.362 1.00 0.00 H new ATOM 0 HB1 ALA A 148 10.748 -28.490 0.786 1.00 0.00 H new ATOM 0 HB2 ALA A 148 9.393 -27.441 0.309 1.00 0.00 H new ATOM 0 HB3 ALA A 148 10.834 -26.737 1.079 1.00 0.00 H new ATOM 2214 N PRO A 149 10.591 -29.210 4.138 1.00 0.00 N ATOM 2215 CA PRO A 149 11.515 -29.524 5.232 1.00 0.00 C ATOM 2216 C PRO A 149 12.953 -29.793 4.764 1.00 0.00 C ATOM 2217 O PRO A 149 13.186 -30.429 3.722 1.00 0.00 O ATOM 2218 CB PRO A 149 10.917 -30.800 5.832 1.00 0.00 C ATOM 2219 CG PRO A 149 10.217 -31.455 4.693 1.00 0.00 C ATOM 2220 CD PRO A 149 9.671 -30.340 3.855 1.00 0.00 C ATOM 0 HA PRO A 149 11.604 -28.688 5.926 1.00 0.00 H new ATOM 0 HB2 PRO A 149 11.692 -31.445 6.245 1.00 0.00 H new ATOM 0 HB3 PRO A 149 10.226 -30.571 6.644 1.00 0.00 H new ATOM 0 HG2 PRO A 149 10.903 -32.077 4.118 1.00 0.00 H new ATOM 0 HG3 PRO A 149 9.418 -32.106 5.047 1.00 0.00 H new ATOM 0 HD2 PRO A 149 9.667 -30.599 2.796 1.00 0.00 H new ATOM 0 HD3 PRO A 149 8.644 -30.099 4.128 1.00 0.00 H new ATOM 2228 N THR A 150 13.903 -29.302 5.518 1.00 0.00 N ATOM 2229 CA THR A 150 15.290 -29.569 5.259 1.00 0.00 C ATOM 2230 C THR A 150 15.629 -30.953 5.833 1.00 0.00 C ATOM 2231 O THR A 150 16.256 -31.804 5.177 1.00 0.00 O ATOM 2232 CB THR A 150 16.157 -28.468 5.900 1.00 0.00 C ATOM 2233 OG1 THR A 150 15.676 -28.219 7.232 1.00 0.00 O ATOM 2234 CG2 THR A 150 16.084 -27.179 5.091 1.00 0.00 C ATOM 0 H THR A 150 13.734 -28.706 6.328 1.00 0.00 H new ATOM 0 HA THR A 150 15.492 -29.568 4.188 1.00 0.00 H new ATOM 0 HB THR A 150 17.194 -28.802 5.923 1.00 0.00 H new ATOM 0 HG1 THR A 150 16.221 -27.521 7.651 1.00 0.00 H new ATOM 0 HG21 THR A 150 16.704 -26.417 5.564 1.00 0.00 H new ATOM 0 HG22 THR A 150 16.444 -27.364 4.079 1.00 0.00 H new ATOM 0 HG23 THR A 150 15.051 -26.833 5.051 1.00 0.00 H new ATOM 2242 N SER A 151 15.188 -31.171 7.052 1.00 0.00 N ATOM 2243 CA SER A 151 15.300 -32.424 7.747 1.00 0.00 C ATOM 2244 C SER A 151 14.069 -32.529 8.644 1.00 0.00 C ATOM 2245 O SER A 151 13.124 -33.243 8.287 1.00 0.00 O ATOM 2246 CB SER A 151 16.586 -32.463 8.589 1.00 0.00 C ATOM 2247 OG SER A 151 17.722 -32.108 7.797 1.00 0.00 O ATOM 2248 OXT SER A 151 14.000 -31.765 9.637 1.00 0.00 O ATOM 0 H SER A 151 14.724 -30.449 7.603 1.00 0.00 H new ATOM 0 HA SER A 151 15.351 -33.259 7.048 1.00 0.00 H new ATOM 0 HB2 SER A 151 16.496 -31.777 9.431 1.00 0.00 H new ATOM 0 HB3 SER A 151 16.724 -33.461 9.004 1.00 0.00 H new ATOM 0 HG SER A 151 18.529 -32.137 8.352 1.00 0.00 H new TER 2254 SER A 151