USER MOD reduce.3.24.130724 H: found=0, std=0, add=987, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 987 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 78 LYS NZ :NH3+ -179:sc= 1.21 (180deg=0) USER MOD Set 1.2: A 80 ASN : amide:sc= 0.65 K(o=1.9,f=-9!) USER MOD Set 2.1: A 69 GLN : amide:sc= -0.101 X(o=-0.14,f=-0.37) USER MOD Set 2.2: A 70 TYR OH : rot 180:sc= -0.0435 USER MOD Set 3.1: A 11 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 65 LYS NZ :NH3+ 142:sc= 0.888 (180deg=0.102) USER MOD Set 4.1: A 22 MET CE :methyl -161:sc= -0.106 (180deg=-0.558) USER MOD Set 4.2: A 71 THR OG1 : rot -26:sc= 0.00412 USER MOD Set 5.1: A 15 GLN : amide:sc= 0.113 K(o=0.75,f=-5.3!) USER MOD Set 5.2: A 58 SER OG : rot -52:sc= 0.642 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 HIS : no HE2:sc= -0.816 K(o=-0.82,f=-1.8) USER MOD Single : A 4 HIS : no HD1:sc= -0.0151 X(o=-0.015,f=-0.12) USER MOD Single : A 5 HIS : no HD1:sc= -0.203 X(o=-0.2,f=-0.035) USER MOD Single : A 6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 7 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 8 HIS : no HD1:sc= -0.218 X(o=-0.22,f=0) USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 16 THR OG1 : rot 180:sc= 0.108 USER MOD Single : A 17 GLN : amide:sc= 0.514 K(o=0.51,f=-0.84) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= -0.998! C(o=-1!,f=-4!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc=-0.00105 X(o=-0.001,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 THR OG1 : rot -79:sc= 0.986 USER MOD Single : A 37 SER OG : rot -34:sc= 0.111 USER MOD Single : A 38 CYS SG : rot -93:sc= -2.84! USER MOD Single : A 39 ASN : amide:sc= -0.0212 X(o=-0.021,f=-0.35) USER MOD Single : A 41 ASN :FLIP amide:sc= -0.0834 F(o=-1.6!,f=-0.083) USER MOD Single : A 62 GLN : amide:sc= -0.73 X(o=-0.73,f=-1) USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 73 ASN :FLIP amide:sc= -1.8! C(o=-3.2!,f=-1.8!) USER MOD Single : A 75 LYS NZ :NH3+ -174:sc= 0.352 (180deg=0.338) USER MOD Single : A 77 TYR OH : rot 66:sc= 0.0125 USER MOD Single : A 84 ASN : amide:sc= -1.78 X(o=-1.8,f=-2.1!) USER MOD Single : A 85 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.119 X(o=-0.12,f=-0.26) USER MOD Single : A 91 TYR OH : rot -31:sc= 0.495 USER MOD Single : A 94 SER OG : rot -44:sc= 0.543 USER MOD Single : A 98 THR OG1 : rot 70:sc= -0.514 USER MOD Single : A 101 MET CE :methyl -173:sc= 0 (180deg=-0.156) USER MOD Single : A 103 LYS NZ :NH3+ 148:sc= 1.1 (180deg=0.859) USER MOD Single : A 104 ASN : amide:sc= -0.485 X(o=-0.49,f=-0.14) USER MOD Single : A 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 110 GLN : amide:sc= -1.03 X(o=-1,f=-0.73) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN :FLIP amide:sc= -0.536 F(o=-1.9,f=-0.54) USER MOD Single : A 125 ASN : amide:sc= 0.347 K(o=0.35,f=-0.49) USER MOD Single : A 126 ASN : amide:sc= -0.406! K(o=-0.41!,f=-2.5) USER MOD Single : A 128 ASN :FLIP amide:sc= -0.0278 F(o=-3.1!,f=-0.028) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 0.386 -0.244 -0.732 1.00 73.24 N ATOM 2 CA MET A 1 1.382 -0.500 -1.796 1.00 53.02 C ATOM 3 C MET A 1 1.196 -1.901 -2.378 1.00 61.40 C ATOM 4 O MET A 1 0.699 -2.053 -3.496 1.00 10.15 O ATOM 5 CB MET A 1 2.809 -0.338 -1.249 1.00 60.25 C ATOM 6 CG MET A 1 3.905 -0.586 -2.280 1.00 75.42 C ATOM 7 SD MET A 1 5.561 -0.393 -1.589 1.00 33.20 S ATOM 8 CE MET A 1 6.568 -0.794 -3.015 1.00 63.14 C ATOM 0 H1 MET A 1 0.527 0.712 -0.348 1.00 73.24 H new ATOM 0 H2 MET A 1 -0.573 -0.320 -1.128 1.00 73.24 H new ATOM 0 H3 MET A 1 0.503 -0.944 0.029 1.00 73.24 H new ATOM 0 HA MET A 1 1.229 0.230 -2.590 1.00 53.02 H new ATOM 0 HB2 MET A 1 2.921 0.671 -0.851 1.00 60.25 H new ATOM 0 HB3 MET A 1 2.947 -1.027 -0.415 1.00 60.25 H new ATOM 0 HG2 MET A 1 3.798 -1.593 -2.684 1.00 75.42 H new ATOM 0 HG3 MET A 1 3.779 0.106 -3.113 1.00 75.42 H new ATOM 0 HE1 MET A 1 7.622 -0.720 -2.748 1.00 63.14 H new ATOM 0 HE2 MET A 1 6.347 -1.810 -3.342 1.00 63.14 H new ATOM 0 HE3 MET A 1 6.348 -0.097 -3.823 1.00 63.14 H new ATOM 20 N ALA A 2 1.579 -2.923 -1.607 1.00 4.20 N ATOM 21 CA ALA A 2 1.501 -4.311 -2.058 1.00 23.41 C ATOM 22 C ALA A 2 1.752 -5.267 -0.894 1.00 34.04 C ATOM 23 O ALA A 2 2.797 -5.205 -0.242 1.00 4.43 O ATOM 24 CB ALA A 2 2.505 -4.569 -3.181 1.00 14.54 C ATOM 0 H ALA A 2 1.948 -2.811 -0.663 1.00 4.20 H new ATOM 0 HA ALA A 2 0.497 -4.489 -2.444 1.00 23.41 H new ATOM 0 HB1 ALA A 2 2.432 -5.608 -3.503 1.00 14.54 H new ATOM 0 HB2 ALA A 2 2.286 -3.912 -4.023 1.00 14.54 H new ATOM 0 HB3 ALA A 2 3.514 -4.372 -2.819 1.00 14.54 H new ATOM 30 N HIS A 3 0.801 -6.161 -0.643 1.00 52.43 N ATOM 31 CA HIS A 3 0.915 -7.117 0.456 1.00 23.31 C ATOM 32 C HIS A 3 1.570 -8.412 -0.029 1.00 63.32 C ATOM 33 O HIS A 3 0.970 -9.486 -0.001 1.00 44.40 O ATOM 34 CB HIS A 3 -0.459 -7.393 1.096 1.00 42.32 C ATOM 35 CG HIS A 3 -1.504 -7.898 0.142 1.00 31.34 C ATOM 36 ND1 HIS A 3 -1.711 -9.236 -0.110 1.00 43.53 N ATOM 37 CD2 HIS A 3 -2.411 -7.233 -0.616 1.00 4.31 C ATOM 38 CE1 HIS A 3 -2.693 -9.372 -0.979 1.00 23.24 C ATOM 39 NE2 HIS A 3 -3.137 -8.173 -1.303 1.00 65.04 N ATOM 0 H HIS A 3 -0.059 -6.244 -1.186 1.00 52.43 H new ATOM 0 HA HIS A 3 1.552 -6.680 1.225 1.00 23.31 H new ATOM 0 HB2 HIS A 3 -0.333 -8.123 1.895 1.00 42.32 H new ATOM 0 HB3 HIS A 3 -0.821 -6.474 1.558 1.00 42.32 H new ATOM 0 HD1 HIS A 3 -1.186 -10.003 0.310 1.00 43.53 H new ATOM 0 HD2 HIS A 3 -2.538 -6.162 -0.669 1.00 4.31 H new ATOM 0 HE1 HIS A 3 -3.071 -10.309 -1.362 1.00 23.24 H new ATOM 48 N HIS A 4 2.810 -8.292 -0.496 1.00 71.22 N ATOM 49 CA HIS A 4 3.568 -9.441 -0.990 1.00 40.44 C ATOM 50 C HIS A 4 4.538 -9.939 0.072 1.00 42.51 C ATOM 51 O HIS A 4 5.585 -9.333 0.291 1.00 15.33 O ATOM 52 CB HIS A 4 4.347 -9.082 -2.265 1.00 22.12 C ATOM 53 CG HIS A 4 3.480 -8.737 -3.437 1.00 24.11 C ATOM 54 ND1 HIS A 4 3.837 -7.808 -4.388 1.00 5.22 N ATOM 55 CD2 HIS A 4 2.279 -9.223 -3.822 1.00 70.13 C ATOM 56 CE1 HIS A 4 2.894 -7.737 -5.306 1.00 43.14 C ATOM 57 NE2 HIS A 4 1.936 -8.587 -4.988 1.00 33.43 N ATOM 0 H HIS A 4 3.314 -7.407 -0.543 1.00 71.22 H new ATOM 0 HA HIS A 4 2.854 -10.230 -1.225 1.00 40.44 H new ATOM 0 HB2 HIS A 4 5.003 -8.238 -2.051 1.00 22.12 H new ATOM 0 HB3 HIS A 4 4.987 -9.922 -2.535 1.00 22.12 H new ATOM 0 HD2 HIS A 4 1.697 -9.973 -3.307 1.00 70.13 H new ATOM 0 HE1 HIS A 4 2.904 -7.092 -6.172 1.00 43.14 H new ATOM 0 HE2 HIS A 4 1.081 -8.745 -5.521 1.00 33.43 H new ATOM 66 N HIS A 5 4.162 -11.017 0.752 1.00 33.03 N ATOM 67 CA HIS A 5 5.040 -11.679 1.715 1.00 63.31 C ATOM 68 C HIS A 5 4.445 -13.021 2.134 1.00 14.45 C ATOM 69 O HIS A 5 3.349 -13.078 2.696 1.00 33.53 O ATOM 70 CB HIS A 5 5.313 -10.790 2.947 1.00 65.22 C ATOM 71 CG HIS A 5 4.087 -10.316 3.673 1.00 2.32 C ATOM 72 ND1 HIS A 5 3.464 -9.122 3.382 1.00 51.22 N ATOM 73 CD2 HIS A 5 3.381 -10.865 4.693 1.00 52.42 C ATOM 74 CE1 HIS A 5 2.431 -8.959 4.186 1.00 32.40 C ATOM 75 NE2 HIS A 5 2.358 -10.000 4.991 1.00 53.32 N ATOM 0 H HIS A 5 3.246 -11.456 0.654 1.00 33.03 H new ATOM 0 HA HIS A 5 5.999 -11.855 1.227 1.00 63.31 H new ATOM 0 HB2 HIS A 5 5.938 -11.346 3.646 1.00 65.22 H new ATOM 0 HB3 HIS A 5 5.887 -9.920 2.628 1.00 65.22 H new ATOM 0 HD2 HIS A 5 3.586 -11.807 5.180 1.00 52.42 H new ATOM 0 HE1 HIS A 5 1.758 -8.114 4.185 1.00 32.40 H new ATOM 0 HE2 HIS A 5 1.656 -10.140 5.717 1.00 53.32 H new ATOM 84 N HIS A 6 5.160 -14.097 1.819 1.00 75.12 N ATOM 85 CA HIS A 6 4.754 -15.449 2.197 1.00 34.43 C ATOM 86 C HIS A 6 5.954 -16.386 2.105 1.00 23.31 C ATOM 87 O HIS A 6 6.816 -16.213 1.243 1.00 54.44 O ATOM 88 CB HIS A 6 3.610 -15.959 1.302 1.00 42.00 C ATOM 89 CG HIS A 6 3.973 -16.099 -0.152 1.00 13.52 C ATOM 90 ND1 HIS A 6 4.292 -17.308 -0.741 1.00 32.33 N ATOM 91 CD2 HIS A 6 4.051 -15.173 -1.140 1.00 12.01 C ATOM 92 CE1 HIS A 6 4.550 -17.116 -2.025 1.00 63.32 C ATOM 93 NE2 HIS A 6 4.409 -15.831 -2.289 1.00 73.40 N ATOM 0 H HIS A 6 6.035 -14.058 1.296 1.00 75.12 H new ATOM 0 HA HIS A 6 4.388 -15.426 3.223 1.00 34.43 H new ATOM 0 HB2 HIS A 6 3.277 -16.927 1.676 1.00 42.00 H new ATOM 0 HB3 HIS A 6 2.765 -15.276 1.389 1.00 42.00 H new ATOM 0 HD2 HIS A 6 3.866 -14.114 -1.040 1.00 12.01 H new ATOM 0 HE1 HIS A 6 4.828 -17.881 -2.735 1.00 63.32 H new ATOM 0 HE2 HIS A 6 4.545 -15.396 -3.202 1.00 73.40 H new ATOM 102 N HIS A 7 6.012 -17.374 2.990 1.00 62.42 N ATOM 103 CA HIS A 7 7.143 -18.301 3.029 1.00 65.13 C ATOM 104 C HIS A 7 6.929 -19.446 2.040 1.00 32.10 C ATOM 105 O HIS A 7 7.498 -19.452 0.949 1.00 12.14 O ATOM 106 CB HIS A 7 7.352 -18.846 4.451 1.00 65.21 C ATOM 107 CG HIS A 7 7.621 -17.780 5.472 1.00 32.15 C ATOM 108 ND1 HIS A 7 8.887 -17.328 5.781 1.00 30.24 N ATOM 109 CD2 HIS A 7 6.772 -17.068 6.252 1.00 1.33 C ATOM 110 CE1 HIS A 7 8.803 -16.387 6.703 1.00 0.14 C ATOM 111 NE2 HIS A 7 7.532 -16.210 7.007 1.00 45.42 N ATOM 0 H HIS A 7 5.292 -17.556 3.690 1.00 62.42 H new ATOM 0 HA HIS A 7 8.042 -17.757 2.738 1.00 65.13 H new ATOM 0 HB2 HIS A 7 6.466 -19.407 4.749 1.00 65.21 H new ATOM 0 HB3 HIS A 7 8.186 -19.548 4.443 1.00 65.21 H new ATOM 0 HD2 HIS A 7 5.696 -17.159 6.275 1.00 1.33 H new ATOM 0 HE1 HIS A 7 9.635 -15.852 7.136 1.00 0.14 H new ATOM 0 HE2 HIS A 7 7.173 -15.544 7.691 1.00 45.42 H new ATOM 120 N HIS A 8 6.098 -20.405 2.424 1.00 13.45 N ATOM 121 CA HIS A 8 5.747 -21.533 1.563 1.00 23.23 C ATOM 122 C HIS A 8 4.257 -21.466 1.240 1.00 74.33 C ATOM 123 O HIS A 8 3.647 -20.396 1.328 1.00 52.42 O ATOM 124 CB HIS A 8 6.092 -22.864 2.261 1.00 33.02 C ATOM 125 CG HIS A 8 7.563 -23.174 2.307 1.00 23.32 C ATOM 126 ND1 HIS A 8 8.071 -24.453 2.193 1.00 24.34 N ATOM 127 CD2 HIS A 8 8.637 -22.363 2.458 1.00 53.33 C ATOM 128 CE1 HIS A 8 9.387 -24.411 2.271 1.00 31.13 C ATOM 129 NE2 HIS A 8 9.755 -23.155 2.432 1.00 15.55 N ATOM 0 H HIS A 8 5.647 -20.426 3.339 1.00 13.45 H new ATOM 0 HA HIS A 8 6.319 -21.480 0.637 1.00 23.23 H new ATOM 0 HB2 HIS A 8 5.706 -22.837 3.280 1.00 33.02 H new ATOM 0 HB3 HIS A 8 5.577 -23.675 1.746 1.00 33.02 H new ATOM 0 HD2 HIS A 8 8.616 -21.290 2.577 1.00 53.33 H new ATOM 0 HE1 HIS A 8 10.051 -25.261 2.213 1.00 31.13 H new ATOM 0 HE2 HIS A 8 10.716 -22.826 2.523 1.00 15.55 H new ATOM 138 N MET A 9 3.678 -22.595 0.852 1.00 13.43 N ATOM 139 CA MET A 9 2.241 -22.681 0.626 1.00 15.14 C ATOM 140 C MET A 9 1.692 -23.961 1.251 1.00 73.11 C ATOM 141 O MET A 9 2.132 -25.066 0.924 1.00 44.24 O ATOM 142 CB MET A 9 1.915 -22.613 -0.877 1.00 12.04 C ATOM 143 CG MET A 9 2.534 -23.728 -1.715 1.00 32.20 C ATOM 144 SD MET A 9 2.115 -23.589 -3.466 1.00 63.45 S ATOM 145 CE MET A 9 2.937 -25.034 -4.135 1.00 61.35 C ATOM 0 H MET A 9 4.183 -23.466 0.687 1.00 13.43 H new ATOM 0 HA MET A 9 1.760 -21.828 1.104 1.00 15.14 H new ATOM 0 HB2 MET A 9 0.833 -22.642 -1.002 1.00 12.04 H new ATOM 0 HB3 MET A 9 2.255 -21.653 -1.266 1.00 12.04 H new ATOM 0 HG2 MET A 9 3.618 -23.705 -1.601 1.00 32.20 H new ATOM 0 HG3 MET A 9 2.194 -24.693 -1.339 1.00 32.20 H new ATOM 0 HE1 MET A 9 2.768 -25.083 -5.211 1.00 61.35 H new ATOM 0 HE2 MET A 9 4.007 -24.967 -3.939 1.00 61.35 H new ATOM 0 HE3 MET A 9 2.537 -25.931 -3.663 1.00 61.35 H new ATOM 155 N GLY A 10 0.762 -23.798 2.183 1.00 21.04 N ATOM 156 CA GLY A 10 0.116 -24.931 2.819 1.00 12.25 C ATOM 157 C GLY A 10 -1.377 -24.915 2.577 1.00 70.45 C ATOM 158 O GLY A 10 -1.848 -24.230 1.666 1.00 34.22 O ATOM 0 H GLY A 10 0.440 -22.888 2.514 1.00 21.04 H new ATOM 0 HA2 GLY A 10 0.540 -25.858 2.434 1.00 12.25 H new ATOM 0 HA3 GLY A 10 0.314 -24.911 3.891 1.00 12.25 H new ATOM 162 N THR A 11 -2.127 -25.656 3.386 1.00 23.34 N ATOM 163 CA THR A 11 -3.577 -25.689 3.256 1.00 5.34 C ATOM 164 C THR A 11 -4.191 -24.371 3.748 1.00 73.25 C ATOM 165 O THR A 11 -4.669 -24.260 4.880 1.00 41.22 O ATOM 166 CB THR A 11 -4.203 -26.907 3.995 1.00 3.23 C ATOM 167 OG1 THR A 11 -5.634 -26.876 3.881 1.00 31.45 O ATOM 168 CG2 THR A 11 -3.800 -26.950 5.470 1.00 54.52 C ATOM 0 H THR A 11 -1.755 -26.239 4.136 1.00 23.34 H new ATOM 0 HA THR A 11 -3.808 -25.807 2.197 1.00 5.34 H new ATOM 0 HB THR A 11 -3.819 -27.809 3.519 1.00 3.23 H new ATOM 0 HG1 THR A 11 -6.016 -27.648 4.348 1.00 31.45 H new ATOM 0 HG21 THR A 11 -4.259 -27.816 5.947 1.00 54.52 H new ATOM 0 HG22 THR A 11 -2.715 -27.025 5.549 1.00 54.52 H new ATOM 0 HG23 THR A 11 -4.138 -26.040 5.966 1.00 54.52 H new ATOM 176 N LEU A 12 -4.114 -23.353 2.898 1.00 74.23 N ATOM 177 CA LEU A 12 -4.710 -22.050 3.173 1.00 43.44 C ATOM 178 C LEU A 12 -5.692 -21.727 2.054 1.00 71.21 C ATOM 179 O LEU A 12 -5.343 -21.800 0.871 1.00 3.42 O ATOM 180 CB LEU A 12 -3.610 -20.969 3.291 1.00 12.22 C ATOM 181 CG LEU A 12 -4.034 -19.608 3.893 1.00 24.24 C ATOM 182 CD1 LEU A 12 -4.873 -18.791 2.908 1.00 50.32 C ATOM 183 CD2 LEU A 12 -4.785 -19.813 5.211 1.00 34.25 C ATOM 0 H LEU A 12 -3.636 -23.408 1.998 1.00 74.23 H new ATOM 0 HA LEU A 12 -5.243 -22.070 4.123 1.00 43.44 H new ATOM 0 HB2 LEU A 12 -2.800 -21.373 3.899 1.00 12.22 H new ATOM 0 HB3 LEU A 12 -3.202 -20.789 2.296 1.00 12.22 H new ATOM 0 HG LEU A 12 -3.127 -19.039 4.097 1.00 24.24 H new ATOM 0 HD11 LEU A 12 -5.152 -17.842 3.367 1.00 50.32 H new ATOM 0 HD12 LEU A 12 -4.292 -18.601 2.006 1.00 50.32 H new ATOM 0 HD13 LEU A 12 -5.774 -19.347 2.649 1.00 50.32 H new ATOM 0 HD21 LEU A 12 -5.075 -18.845 5.619 1.00 34.25 H new ATOM 0 HD22 LEU A 12 -5.677 -20.413 5.032 1.00 34.25 H new ATOM 0 HD23 LEU A 12 -4.138 -20.327 5.922 1.00 34.25 H new ATOM 195 N GLU A 13 -6.917 -21.392 2.425 1.00 14.14 N ATOM 196 CA GLU A 13 -7.980 -21.168 1.458 1.00 12.15 C ATOM 197 C GLU A 13 -8.895 -20.043 1.944 1.00 4.31 C ATOM 198 O GLU A 13 -8.692 -19.493 3.028 1.00 75.42 O ATOM 199 CB GLU A 13 -8.773 -22.474 1.274 1.00 73.01 C ATOM 200 CG GLU A 13 -9.723 -22.489 0.082 1.00 3.41 C ATOM 201 CD GLU A 13 -10.533 -23.769 0.018 1.00 32.20 C ATOM 202 OE1 GLU A 13 -10.024 -24.771 -0.526 1.00 74.13 O ATOM 203 OE2 GLU A 13 -11.666 -23.785 0.546 1.00 51.23 O1- ATOM 0 H GLU A 13 -7.202 -21.268 3.397 1.00 14.14 H new ATOM 0 HA GLU A 13 -7.555 -20.871 0.499 1.00 12.15 H new ATOM 0 HB2 GLU A 13 -8.067 -23.298 1.167 1.00 73.01 H new ATOM 0 HB3 GLU A 13 -9.348 -22.663 2.180 1.00 73.01 H new ATOM 0 HG2 GLU A 13 -10.398 -21.636 0.146 1.00 3.41 H new ATOM 0 HG3 GLU A 13 -9.151 -22.375 -0.839 1.00 3.41 H new ATOM 210 N ALA A 14 -9.881 -19.700 1.127 1.00 44.53 N ATOM 211 CA ALA A 14 -10.887 -18.702 1.474 1.00 21.22 C ATOM 212 C ALA A 14 -12.107 -18.882 0.576 1.00 50.53 C ATOM 213 O ALA A 14 -12.825 -17.924 0.278 1.00 52.13 O ATOM 214 CB ALA A 14 -10.311 -17.293 1.329 1.00 0.11 C ATOM 0 H ALA A 14 -10.008 -20.107 0.200 1.00 44.53 H new ATOM 0 HA ALA A 14 -11.188 -18.837 2.513 1.00 21.22 H new ATOM 0 HB1 ALA A 14 -11.073 -16.559 1.591 1.00 0.11 H new ATOM 0 HB2 ALA A 14 -9.455 -17.180 1.994 1.00 0.11 H new ATOM 0 HB3 ALA A 14 -9.994 -17.134 0.298 1.00 0.11 H new ATOM 220 N GLN A 15 -12.329 -20.133 0.157 1.00 4.44 N ATOM 221 CA GLN A 15 -13.341 -20.467 -0.850 1.00 35.21 C ATOM 222 C GLN A 15 -13.081 -19.707 -2.151 1.00 15.42 C ATOM 223 O GLN A 15 -13.962 -19.586 -3.007 1.00 13.51 O ATOM 224 CB GLN A 15 -14.762 -20.206 -0.321 1.00 23.33 C ATOM 225 CG GLN A 15 -15.272 -21.292 0.623 1.00 20.14 C ATOM 226 CD GLN A 15 -15.420 -22.646 -0.061 1.00 2.31 C ATOM 227 OE1 GLN A 15 -16.472 -22.963 -0.616 1.00 15.13 O ATOM 228 NE2 GLN A 15 -14.370 -23.453 -0.026 1.00 70.34 N ATOM 0 H GLN A 15 -11.813 -20.941 0.506 1.00 4.44 H new ATOM 0 HA GLN A 15 -13.266 -21.533 -1.064 1.00 35.21 H new ATOM 0 HB2 GLN A 15 -14.777 -19.248 0.199 1.00 23.33 H new ATOM 0 HB3 GLN A 15 -15.445 -20.121 -1.166 1.00 23.33 H new ATOM 0 HG2 GLN A 15 -14.585 -21.388 1.464 1.00 20.14 H new ATOM 0 HG3 GLN A 15 -16.236 -20.989 1.031 1.00 20.14 H new ATOM 0 HE21 GLN A 15 -13.514 -23.156 0.443 1.00 70.34 H new ATOM 0 HE22 GLN A 15 -14.417 -24.371 -0.468 1.00 70.34 H new ATOM 237 N THR A 16 -11.851 -19.223 -2.292 1.00 54.35 N ATOM 238 CA THR A 16 -11.412 -18.546 -3.498 1.00 70.15 C ATOM 239 C THR A 16 -10.977 -19.584 -4.531 1.00 32.44 C ATOM 240 O THR A 16 -11.172 -20.785 -4.326 1.00 63.23 O ATOM 241 CB THR A 16 -10.246 -17.569 -3.188 1.00 55.41 C ATOM 242 OG1 THR A 16 -9.925 -16.787 -4.350 1.00 33.34 O ATOM 243 CG2 THR A 16 -9.003 -18.315 -2.706 1.00 42.31 C ATOM 0 H THR A 16 -11.133 -19.291 -1.570 1.00 54.35 H new ATOM 0 HA THR A 16 -12.241 -17.962 -3.899 1.00 70.15 H new ATOM 0 HB THR A 16 -10.576 -16.907 -2.388 1.00 55.41 H new ATOM 0 HG1 THR A 16 -9.190 -16.175 -4.139 1.00 33.34 H new ATOM 0 HG21 THR A 16 -8.207 -17.600 -2.499 1.00 42.31 H new ATOM 0 HG22 THR A 16 -9.240 -18.868 -1.797 1.00 42.31 H new ATOM 0 HG23 THR A 16 -8.674 -19.010 -3.478 1.00 42.31 H new ATOM 251 N GLN A 17 -10.386 -19.132 -5.629 1.00 5.12 N ATOM 252 CA GLN A 17 -9.959 -20.036 -6.690 1.00 31.24 C ATOM 253 C GLN A 17 -8.685 -19.513 -7.351 1.00 21.02 C ATOM 254 O GLN A 17 -7.580 -19.951 -7.023 1.00 15.31 O ATOM 255 CB GLN A 17 -11.080 -20.193 -7.725 1.00 44.40 C ATOM 256 CG GLN A 17 -10.895 -21.370 -8.675 1.00 20.35 C ATOM 257 CD GLN A 17 -11.925 -21.373 -9.790 1.00 71.40 C ATOM 258 OE1 GLN A 17 -12.342 -20.313 -10.266 1.00 24.53 O ATOM 259 NE2 GLN A 17 -12.372 -22.552 -10.190 1.00 70.42 N ATOM 0 H GLN A 17 -10.191 -18.147 -5.809 1.00 5.12 H new ATOM 0 HA GLN A 17 -9.743 -21.013 -6.258 1.00 31.24 H new ATOM 0 HB2 GLN A 17 -12.029 -20.309 -7.201 1.00 44.40 H new ATOM 0 HB3 GLN A 17 -11.149 -19.276 -8.310 1.00 44.40 H new ATOM 0 HG2 GLN A 17 -9.895 -21.333 -9.107 1.00 20.35 H new ATOM 0 HG3 GLN A 17 -10.966 -22.302 -8.114 1.00 20.35 H new ATOM 0 HE21 GLN A 17 -12.002 -23.406 -9.772 1.00 70.42 H new ATOM 0 HE22 GLN A 17 -13.086 -22.607 -10.916 1.00 70.42 H new ATOM 268 N GLY A 18 -8.847 -18.553 -8.258 1.00 22.20 N ATOM 269 CA GLY A 18 -7.712 -17.975 -8.954 1.00 74.21 C ATOM 270 C GLY A 18 -7.342 -18.757 -10.203 1.00 24.32 C ATOM 271 O GLY A 18 -7.774 -19.899 -10.370 1.00 62.33 O ATOM 0 H GLY A 18 -9.751 -18.163 -8.524 1.00 22.20 H new ATOM 0 HA2 GLY A 18 -7.942 -16.945 -9.228 1.00 74.21 H new ATOM 0 HA3 GLY A 18 -6.855 -17.942 -8.282 1.00 74.21 H new ATOM 275 N PRO A 19 -6.546 -18.158 -11.107 1.00 54.21 N ATOM 276 CA PRO A 19 -6.089 -18.830 -12.325 1.00 75.33 C ATOM 277 C PRO A 19 -5.023 -19.883 -12.018 1.00 4.25 C ATOM 278 O PRO A 19 -3.989 -19.581 -11.410 1.00 21.34 O ATOM 279 CB PRO A 19 -5.509 -17.682 -13.160 1.00 30.43 C ATOM 280 CG PRO A 19 -5.051 -16.683 -12.152 1.00 41.32 C ATOM 281 CD PRO A 19 -6.032 -16.776 -11.010 1.00 21.44 C ATOM 0 HA PRO A 19 -6.886 -19.372 -12.835 1.00 75.33 H new ATOM 0 HB2 PRO A 19 -4.683 -18.023 -13.785 1.00 30.43 H new ATOM 0 HB3 PRO A 19 -6.259 -17.258 -13.827 1.00 30.43 H new ATOM 0 HG2 PRO A 19 -4.037 -16.902 -11.816 1.00 41.32 H new ATOM 0 HG3 PRO A 19 -5.037 -15.678 -12.575 1.00 41.32 H new ATOM 0 HD2 PRO A 19 -5.549 -16.594 -10.050 1.00 21.44 H new ATOM 0 HD3 PRO A 19 -6.832 -16.043 -11.108 1.00 21.44 H new ATOM 289 N GLY A 20 -5.289 -21.119 -12.418 1.00 0.13 N ATOM 290 CA GLY A 20 -4.350 -22.206 -12.192 1.00 11.40 C ATOM 291 C GLY A 20 -5.055 -23.526 -11.978 1.00 30.41 C ATOM 292 O GLY A 20 -4.641 -24.329 -11.135 1.00 31.00 O ATOM 0 H GLY A 20 -6.146 -21.392 -12.899 1.00 0.13 H new ATOM 0 HA2 GLY A 20 -3.678 -22.288 -13.046 1.00 11.40 H new ATOM 0 HA3 GLY A 20 -3.734 -21.978 -11.322 1.00 11.40 H new ATOM 296 N SER A 21 -6.113 -23.751 -12.751 1.00 65.42 N ATOM 297 CA SER A 21 -6.925 -24.956 -12.630 1.00 70.35 C ATOM 298 C SER A 21 -6.103 -26.211 -12.936 1.00 61.03 C ATOM 299 O SER A 21 -5.382 -26.261 -13.936 1.00 35.42 O ATOM 300 CB SER A 21 -8.130 -24.866 -13.574 1.00 2.21 C ATOM 301 OG SER A 21 -8.920 -23.721 -13.282 1.00 14.23 O ATOM 0 H SER A 21 -6.430 -23.107 -13.475 1.00 65.42 H new ATOM 0 HA SER A 21 -7.278 -25.031 -11.601 1.00 70.35 H new ATOM 0 HB2 SER A 21 -7.785 -24.821 -14.607 1.00 2.21 H new ATOM 0 HB3 SER A 21 -8.738 -25.766 -13.480 1.00 2.21 H new ATOM 0 HG SER A 21 -9.682 -23.683 -13.898 1.00 14.23 H new ATOM 307 N MET A 22 -6.207 -27.213 -12.064 1.00 71.32 N ATOM 308 CA MET A 22 -5.479 -28.471 -12.233 1.00 14.44 C ATOM 309 C MET A 22 -6.405 -29.561 -12.764 1.00 34.21 C ATOM 310 O MET A 22 -5.941 -30.556 -13.328 1.00 25.22 O ATOM 311 CB MET A 22 -4.865 -28.919 -10.899 1.00 32.01 C ATOM 312 CG MET A 22 -3.945 -27.885 -10.267 1.00 64.35 C ATOM 313 SD MET A 22 -2.438 -27.596 -11.219 1.00 62.34 S ATOM 314 CE MET A 22 -1.630 -29.190 -11.080 1.00 41.55 C ATOM 0 H MET A 22 -6.792 -27.178 -11.229 1.00 71.32 H new ATOM 0 HA MET A 22 -4.680 -28.305 -12.955 1.00 14.44 H new ATOM 0 HB2 MET A 22 -5.668 -29.152 -10.200 1.00 32.01 H new ATOM 0 HB3 MET A 22 -4.305 -29.840 -11.059 1.00 32.01 H new ATOM 0 HG2 MET A 22 -4.485 -26.944 -10.160 1.00 64.35 H new ATOM 0 HG3 MET A 22 -3.675 -28.213 -9.263 1.00 64.35 H new ATOM 0 HE1 MET A 22 -0.570 -29.082 -11.311 1.00 41.55 H new ATOM 0 HE2 MET A 22 -1.743 -29.568 -10.064 1.00 41.55 H new ATOM 0 HE3 MET A 22 -2.084 -29.891 -11.781 1.00 41.55 H new ATOM 324 N ILE A 23 -7.715 -29.379 -12.569 1.00 11.52 N ATOM 325 CA ILE A 23 -8.708 -30.348 -13.046 1.00 62.20 C ATOM 326 C ILE A 23 -8.672 -30.426 -14.575 1.00 11.52 C ATOM 327 O ILE A 23 -9.276 -29.600 -15.268 1.00 51.53 O ATOM 328 CB ILE A 23 -10.155 -29.999 -12.593 1.00 4.53 C ATOM 329 CG1 ILE A 23 -10.191 -29.526 -11.129 1.00 14.53 C ATOM 330 CG2 ILE A 23 -11.074 -31.206 -12.781 1.00 3.25 C ATOM 331 CD1 ILE A 23 -9.658 -30.528 -10.126 1.00 12.43 C ATOM 0 H ILE A 23 -8.112 -28.573 -12.086 1.00 11.52 H new ATOM 0 HA ILE A 23 -8.443 -31.309 -12.605 1.00 62.20 H new ATOM 0 HB ILE A 23 -10.510 -29.179 -13.217 1.00 4.53 H new ATOM 0 HG12 ILE A 23 -9.613 -28.606 -11.045 1.00 14.53 H new ATOM 0 HG13 ILE A 23 -11.220 -29.281 -10.866 1.00 14.53 H new ATOM 0 HG21 ILE A 23 -12.083 -30.948 -12.460 1.00 3.25 H new ATOM 0 HG22 ILE A 23 -11.089 -31.491 -13.833 1.00 3.25 H new ATOM 0 HG23 ILE A 23 -10.706 -32.040 -12.184 1.00 3.25 H new ATOM 0 HD11 ILE A 23 -9.723 -30.108 -9.122 1.00 12.43 H new ATOM 0 HD12 ILE A 23 -10.249 -31.442 -10.176 1.00 12.43 H new ATOM 0 HD13 ILE A 23 -8.617 -30.756 -10.357 1.00 12.43 H new ATOM 343 N GLU A 24 -7.942 -31.409 -15.085 1.00 63.12 N ATOM 344 CA GLU A 24 -7.754 -31.581 -16.522 1.00 10.03 C ATOM 345 C GLU A 24 -9.067 -31.966 -17.200 1.00 51.50 C ATOM 346 O GLU A 24 -9.709 -32.934 -16.806 1.00 10.23 O ATOM 347 CB GLU A 24 -6.711 -32.674 -16.779 1.00 41.42 C ATOM 348 CG GLU A 24 -6.277 -32.790 -18.236 1.00 40.21 C ATOM 349 CD GLU A 24 -5.333 -31.676 -18.648 1.00 32.25 C ATOM 350 OE1 GLU A 24 -4.127 -31.778 -18.332 1.00 35.10 O ATOM 351 OE2 GLU A 24 -5.786 -30.696 -19.278 1.00 70.14 O1- ATOM 0 H GLU A 24 -7.464 -32.109 -14.517 1.00 63.12 H new ATOM 0 HA GLU A 24 -7.410 -30.634 -16.939 1.00 10.03 H new ATOM 0 HB2 GLU A 24 -5.833 -32.475 -16.164 1.00 41.42 H new ATOM 0 HB3 GLU A 24 -7.117 -33.632 -16.455 1.00 41.42 H new ATOM 0 HG2 GLU A 24 -5.789 -33.752 -18.392 1.00 40.21 H new ATOM 0 HG3 GLU A 24 -7.158 -32.772 -18.877 1.00 40.21 H new ATOM 358 N GLN A 25 -9.459 -31.211 -18.215 1.00 3.42 N ATOM 359 CA GLN A 25 -10.650 -31.536 -18.994 1.00 70.21 C ATOM 360 C GLN A 25 -10.280 -32.522 -20.100 1.00 62.55 C ATOM 361 O GLN A 25 -9.325 -32.293 -20.852 1.00 71.41 O ATOM 362 CB GLN A 25 -11.302 -30.268 -19.589 1.00 35.52 C ATOM 363 CG GLN A 25 -10.483 -29.567 -20.679 1.00 35.52 C ATOM 364 CD GLN A 25 -9.185 -28.961 -20.169 1.00 34.41 C ATOM 365 OE1 GLN A 25 -9.089 -28.553 -19.012 1.00 41.35 O ATOM 366 NE2 GLN A 25 -8.178 -28.903 -21.026 1.00 13.53 N ATOM 0 H GLN A 25 -8.972 -30.369 -18.521 1.00 3.42 H new ATOM 0 HA GLN A 25 -11.383 -31.994 -18.330 1.00 70.21 H new ATOM 0 HB2 GLN A 25 -12.274 -30.538 -20.003 1.00 35.52 H new ATOM 0 HB3 GLN A 25 -11.485 -29.559 -18.781 1.00 35.52 H new ATOM 0 HG2 GLN A 25 -10.255 -30.284 -21.468 1.00 35.52 H new ATOM 0 HG3 GLN A 25 -11.089 -28.781 -21.129 1.00 35.52 H new ATOM 0 HE21 GLN A 25 -8.297 -29.252 -21.977 1.00 13.53 H new ATOM 0 HE22 GLN A 25 -7.283 -28.510 -20.735 1.00 13.53 H new ATOM 375 N ILE A 26 -11.011 -33.629 -20.189 1.00 73.45 N ATOM 376 CA ILE A 26 -10.733 -34.652 -21.197 1.00 30.23 C ATOM 377 C ILE A 26 -12.017 -35.115 -21.873 1.00 44.22 C ATOM 378 O ILE A 26 -13.076 -35.159 -21.248 1.00 73.54 O ATOM 379 CB ILE A 26 -10.006 -35.881 -20.587 1.00 32.02 C ATOM 380 CG1 ILE A 26 -10.855 -36.530 -19.476 1.00 24.53 C ATOM 381 CG2 ILE A 26 -8.634 -35.478 -20.051 1.00 54.44 C ATOM 382 CD1 ILE A 26 -10.251 -37.798 -18.906 1.00 35.42 C ATOM 0 H ILE A 26 -11.799 -33.842 -19.578 1.00 73.45 H new ATOM 0 HA ILE A 26 -10.078 -34.193 -21.937 1.00 30.23 H new ATOM 0 HB ILE A 26 -9.866 -36.619 -21.377 1.00 32.02 H new ATOM 0 HG12 ILE A 26 -10.993 -35.810 -18.669 1.00 24.53 H new ATOM 0 HG13 ILE A 26 -11.844 -36.757 -19.873 1.00 24.53 H new ATOM 0 HG21 ILE A 26 -8.138 -36.351 -19.627 1.00 54.44 H new ATOM 0 HG22 ILE A 26 -8.029 -35.076 -20.864 1.00 54.44 H new ATOM 0 HG23 ILE A 26 -8.754 -34.718 -19.279 1.00 54.44 H new ATOM 0 HD11 ILE A 26 -10.905 -38.196 -18.130 1.00 35.42 H new ATOM 0 HD12 ILE A 26 -10.139 -38.536 -19.700 1.00 35.42 H new ATOM 0 HD13 ILE A 26 -9.274 -37.575 -18.477 1.00 35.42 H new ATOM 394 N GLY A 27 -11.912 -35.449 -23.153 1.00 62.23 N ATOM 395 CA GLY A 27 -13.042 -35.979 -23.889 1.00 35.05 C ATOM 396 C GLY A 27 -13.097 -37.492 -23.834 1.00 75.43 C ATOM 397 O GLY A 27 -12.169 -38.133 -23.331 1.00 55.43 O ATOM 0 H GLY A 27 -11.055 -35.361 -23.699 1.00 62.23 H new ATOM 0 HA2 GLY A 27 -13.965 -35.568 -23.481 1.00 35.05 H new ATOM 0 HA3 GLY A 27 -12.981 -35.656 -24.928 1.00 35.05 H new ATOM 401 N ASP A 28 -14.174 -38.053 -24.372 1.00 55.22 N ATOM 402 CA ASP A 28 -14.409 -39.501 -24.368 1.00 30.13 C ATOM 403 C ASP A 28 -13.173 -40.290 -24.816 1.00 31.43 C ATOM 404 O ASP A 28 -12.771 -41.259 -24.167 1.00 52.43 O ATOM 405 CB ASP A 28 -15.595 -39.833 -25.289 1.00 2.44 C ATOM 406 CG ASP A 28 -15.874 -41.329 -25.388 1.00 31.34 C ATOM 407 OD1 ASP A 28 -16.708 -41.838 -24.609 1.00 33.35 O ATOM 408 OD2 ASP A 28 -15.269 -42.001 -26.252 1.00 65.03 O1- ATOM 0 H ASP A 28 -14.914 -37.518 -24.826 1.00 55.22 H new ATOM 0 HA ASP A 28 -14.633 -39.795 -23.343 1.00 30.13 H new ATOM 0 HB2 ASP A 28 -16.487 -39.327 -24.920 1.00 2.44 H new ATOM 0 HB3 ASP A 28 -15.395 -39.440 -26.286 1.00 2.44 H new ATOM 413 N SER A 29 -12.569 -39.855 -25.916 1.00 43.14 N ATOM 414 CA SER A 29 -11.471 -40.588 -26.540 1.00 21.41 C ATOM 415 C SER A 29 -10.168 -40.436 -25.743 1.00 74.42 C ATOM 416 O SER A 29 -9.259 -41.261 -25.855 1.00 31.25 O ATOM 417 CB SER A 29 -11.284 -40.097 -27.984 1.00 13.32 C ATOM 418 OG SER A 29 -10.488 -40.993 -28.741 1.00 44.32 O ATOM 0 H SER A 29 -12.823 -38.992 -26.398 1.00 43.14 H new ATOM 0 HA SER A 29 -11.723 -41.648 -26.548 1.00 21.41 H new ATOM 0 HB2 SER A 29 -12.258 -39.984 -28.460 1.00 13.32 H new ATOM 0 HB3 SER A 29 -10.817 -39.112 -27.976 1.00 13.32 H new ATOM 0 HG SER A 29 -10.390 -40.652 -29.654 1.00 44.32 H new ATOM 424 N GLU A 30 -10.091 -39.389 -24.926 1.00 44.24 N ATOM 425 CA GLU A 30 -8.882 -39.091 -24.162 1.00 41.13 C ATOM 426 C GLU A 30 -8.865 -39.841 -22.832 1.00 44.35 C ATOM 427 O GLU A 30 -7.828 -39.916 -22.181 1.00 55.03 O ATOM 428 CB GLU A 30 -8.772 -37.581 -23.896 1.00 34.32 C ATOM 429 CG GLU A 30 -8.672 -36.732 -25.157 1.00 30.32 C ATOM 430 CD GLU A 30 -8.524 -35.248 -24.852 1.00 70.04 C ATOM 431 OE1 GLU A 30 -7.378 -34.778 -24.691 1.00 75.54 O ATOM 432 OE2 GLU A 30 -9.554 -34.541 -24.771 1.00 72.31 O1- ATOM 0 H GLU A 30 -10.855 -38.730 -24.775 1.00 44.24 H new ATOM 0 HA GLU A 30 -8.030 -39.419 -24.758 1.00 41.13 H new ATOM 0 HB2 GLU A 30 -9.642 -37.260 -23.323 1.00 34.32 H new ATOM 0 HB3 GLU A 30 -7.895 -37.395 -23.276 1.00 34.32 H new ATOM 0 HG2 GLU A 30 -7.819 -37.065 -25.748 1.00 30.32 H new ATOM 0 HG3 GLU A 30 -9.562 -36.887 -25.767 1.00 30.32 H new ATOM 439 N PHE A 31 -10.008 -40.401 -22.439 1.00 52.35 N ATOM 440 CA PHE A 31 -10.152 -40.994 -21.106 1.00 4.33 C ATOM 441 C PHE A 31 -9.093 -42.070 -20.840 1.00 54.44 C ATOM 442 O PHE A 31 -8.245 -41.907 -19.959 1.00 42.52 O ATOM 443 CB PHE A 31 -11.561 -41.580 -20.936 1.00 52.22 C ATOM 444 CG PHE A 31 -11.788 -42.240 -19.597 1.00 11.55 C ATOM 445 CD1 PHE A 31 -11.965 -43.614 -19.503 1.00 31.15 C ATOM 446 CD2 PHE A 31 -11.820 -41.485 -18.432 1.00 33.32 C ATOM 447 CE1 PHE A 31 -12.167 -44.220 -18.277 1.00 3.32 C ATOM 448 CE2 PHE A 31 -12.023 -42.087 -17.204 1.00 65.25 C ATOM 449 CZ PHE A 31 -12.198 -43.456 -17.127 1.00 11.43 C ATOM 0 H PHE A 31 -10.845 -40.458 -23.019 1.00 52.35 H new ATOM 0 HA PHE A 31 -10.002 -40.200 -20.375 1.00 4.33 H new ATOM 0 HB2 PHE A 31 -12.294 -40.784 -21.067 1.00 52.22 H new ATOM 0 HB3 PHE A 31 -11.739 -42.310 -21.726 1.00 52.22 H new ATOM 0 HD1 PHE A 31 -11.945 -44.217 -20.399 1.00 31.15 H new ATOM 0 HD2 PHE A 31 -11.685 -40.415 -18.486 1.00 33.32 H new ATOM 0 HE1 PHE A 31 -12.300 -45.290 -18.219 1.00 3.32 H new ATOM 0 HE2 PHE A 31 -12.045 -41.488 -16.306 1.00 65.25 H new ATOM 0 HZ PHE A 31 -12.359 -43.928 -16.169 1.00 11.43 H new ATOM 459 N ASP A 32 -9.109 -43.137 -21.633 1.00 24.45 N ATOM 460 CA ASP A 32 -8.178 -44.251 -21.436 1.00 14.44 C ATOM 461 C ASP A 32 -6.742 -43.776 -21.635 1.00 54.45 C ATOM 462 O ASP A 32 -5.833 -44.162 -20.894 1.00 73.42 O ATOM 463 CB ASP A 32 -8.500 -45.397 -22.404 1.00 2.53 C ATOM 464 CG ASP A 32 -7.534 -46.571 -22.269 1.00 22.33 C ATOM 465 OD1 ASP A 32 -7.722 -47.407 -21.364 1.00 54.10 O ATOM 466 OD2 ASP A 32 -6.591 -46.671 -23.083 1.00 35.01 O1- ATOM 0 H ASP A 32 -9.752 -43.257 -22.416 1.00 24.45 H new ATOM 0 HA ASP A 32 -8.287 -44.621 -20.416 1.00 14.44 H new ATOM 0 HB2 ASP A 32 -9.517 -45.746 -22.222 1.00 2.53 H new ATOM 0 HB3 ASP A 32 -8.469 -45.022 -23.427 1.00 2.53 H new ATOM 471 N ASN A 33 -6.560 -42.909 -22.626 1.00 43.22 N ATOM 472 CA ASN A 33 -5.248 -42.346 -22.937 1.00 4.32 C ATOM 473 C ASN A 33 -4.651 -41.671 -21.701 1.00 12.24 C ATOM 474 O ASN A 33 -3.544 -41.992 -21.264 1.00 43.20 O ATOM 475 CB ASN A 33 -5.362 -41.325 -24.081 1.00 4.00 C ATOM 476 CG ASN A 33 -4.000 -40.851 -24.568 1.00 1.45 C ATOM 477 OD1 ASN A 33 -3.378 -41.487 -25.421 1.00 34.52 O ATOM 478 ND2 ASN A 33 -3.526 -39.732 -24.038 1.00 23.04 N ATOM 0 H ASN A 33 -7.310 -42.578 -23.233 1.00 43.22 H new ATOM 0 HA ASN A 33 -4.592 -43.158 -23.249 1.00 4.32 H new ATOM 0 HB2 ASN A 33 -5.907 -41.773 -24.912 1.00 4.00 H new ATOM 0 HB3 ASN A 33 -5.944 -40.467 -23.743 1.00 4.00 H new ATOM 0 HD21 ASN A 33 -2.619 -39.372 -24.334 1.00 23.04 H new ATOM 0 HD22 ASN A 33 -4.068 -39.231 -23.334 1.00 23.04 H new ATOM 485 N LYS A 34 -5.422 -40.762 -21.120 1.00 32.10 N ATOM 486 CA LYS A 34 -4.973 -39.963 -19.986 1.00 63.34 C ATOM 487 C LYS A 34 -4.813 -40.819 -18.730 1.00 13.43 C ATOM 488 O LYS A 34 -3.933 -40.559 -17.908 1.00 20.22 O ATOM 489 CB LYS A 34 -5.955 -38.809 -19.742 1.00 42.13 C ATOM 490 CG LYS A 34 -5.962 -37.776 -20.866 1.00 54.23 C ATOM 491 CD LYS A 34 -4.632 -37.028 -20.956 1.00 2.25 C ATOM 492 CE LYS A 34 -4.631 -36.001 -22.080 1.00 10.31 C ATOM 493 NZ LYS A 34 -3.326 -35.295 -22.189 1.00 61.25 N1+ ATOM 0 H LYS A 34 -6.375 -40.557 -21.420 1.00 32.10 H new ATOM 0 HA LYS A 34 -3.993 -39.549 -20.222 1.00 63.34 H new ATOM 0 HB2 LYS A 34 -6.960 -39.215 -19.624 1.00 42.13 H new ATOM 0 HB3 LYS A 34 -5.699 -38.315 -18.805 1.00 42.13 H new ATOM 0 HG2 LYS A 34 -6.165 -38.272 -21.815 1.00 54.23 H new ATOM 0 HG3 LYS A 34 -6.770 -37.063 -20.700 1.00 54.23 H new ATOM 0 HD2 LYS A 34 -4.432 -36.528 -20.008 1.00 2.25 H new ATOM 0 HD3 LYS A 34 -3.824 -37.742 -21.117 1.00 2.25 H new ATOM 0 HE2 LYS A 34 -4.855 -36.497 -23.024 1.00 10.31 H new ATOM 0 HE3 LYS A 34 -5.424 -35.273 -21.907 1.00 10.31 H new ATOM 0 HZ1 LYS A 34 -3.368 -34.605 -22.966 1.00 61.25 H new ATOM 0 HZ2 LYS A 34 -3.124 -34.800 -21.297 1.00 61.25 H new ATOM 0 HZ3 LYS A 34 -2.572 -35.986 -22.380 1.00 61.25 H new ATOM 507 N VAL A 35 -5.655 -41.842 -18.592 1.00 1.14 N ATOM 508 CA VAL A 35 -5.549 -42.775 -17.471 1.00 22.00 C ATOM 509 C VAL A 35 -4.258 -43.596 -17.571 1.00 74.14 C ATOM 510 O VAL A 35 -3.622 -43.902 -16.562 1.00 12.35 O ATOM 511 CB VAL A 35 -6.780 -43.720 -17.398 1.00 71.34 C ATOM 512 CG1 VAL A 35 -6.581 -44.806 -16.340 1.00 55.41 C ATOM 513 CG2 VAL A 35 -8.050 -42.921 -17.100 1.00 4.12 C ATOM 0 H VAL A 35 -6.416 -42.046 -19.240 1.00 1.14 H new ATOM 0 HA VAL A 35 -5.522 -42.185 -16.555 1.00 22.00 H new ATOM 0 HB VAL A 35 -6.887 -44.206 -18.368 1.00 71.34 H new ATOM 0 HG11 VAL A 35 -7.459 -45.452 -16.312 1.00 55.41 H new ATOM 0 HG12 VAL A 35 -5.701 -45.400 -16.589 1.00 55.41 H new ATOM 0 HG13 VAL A 35 -6.441 -44.342 -15.364 1.00 55.41 H new ATOM 0 HG21 VAL A 35 -8.903 -43.598 -17.052 1.00 4.12 H new ATOM 0 HG22 VAL A 35 -7.941 -42.407 -16.145 1.00 4.12 H new ATOM 0 HG23 VAL A 35 -8.212 -42.188 -17.890 1.00 4.12 H new ATOM 523 N THR A 36 -3.870 -43.939 -18.794 1.00 14.23 N ATOM 524 CA THR A 36 -2.650 -44.711 -19.025 1.00 5.43 C ATOM 525 C THR A 36 -1.417 -43.801 -19.120 1.00 53.41 C ATOM 526 O THR A 36 -0.284 -44.253 -18.937 1.00 51.32 O ATOM 527 CB THR A 36 -2.774 -45.569 -20.306 1.00 11.34 C ATOM 528 OG1 THR A 36 -3.134 -44.743 -21.425 1.00 35.24 O ATOM 529 CG2 THR A 36 -3.820 -46.664 -20.133 1.00 31.14 C ATOM 0 H THR A 36 -4.381 -43.696 -19.642 1.00 14.23 H new ATOM 0 HA THR A 36 -2.520 -45.373 -18.169 1.00 5.43 H new ATOM 0 HB THR A 36 -1.805 -46.034 -20.490 1.00 11.34 H new ATOM 0 HG1 THR A 36 -4.095 -44.555 -21.397 1.00 35.24 H new ATOM 0 HG21 THR A 36 -3.886 -47.252 -21.049 1.00 31.14 H new ATOM 0 HG22 THR A 36 -3.534 -47.313 -19.305 1.00 31.14 H new ATOM 0 HG23 THR A 36 -4.789 -46.212 -19.921 1.00 31.14 H new ATOM 537 N SER A 37 -1.653 -42.514 -19.390 1.00 74.54 N ATOM 538 CA SER A 37 -0.579 -41.524 -19.550 1.00 42.32 C ATOM 539 C SER A 37 0.234 -41.337 -18.256 1.00 73.45 C ATOM 540 O SER A 37 1.293 -40.703 -18.269 1.00 65.42 O ATOM 541 CB SER A 37 -1.188 -40.181 -19.998 1.00 1.24 C ATOM 542 OG SER A 37 -0.194 -39.220 -20.335 1.00 11.40 O ATOM 0 H SER A 37 -2.590 -42.128 -19.504 1.00 74.54 H new ATOM 0 HA SER A 37 0.111 -41.892 -20.310 1.00 42.32 H new ATOM 0 HB2 SER A 37 -1.835 -40.348 -20.859 1.00 1.24 H new ATOM 0 HB3 SER A 37 -1.816 -39.786 -19.200 1.00 1.24 H new ATOM 0 HG SER A 37 0.588 -39.342 -19.757 1.00 11.40 H new ATOM 548 N CYS A 38 -0.263 -41.888 -17.151 1.00 31.04 N ATOM 549 CA CYS A 38 0.410 -41.782 -15.855 1.00 10.42 C ATOM 550 C CYS A 38 1.804 -42.425 -15.891 1.00 51.55 C ATOM 551 O CYS A 38 1.991 -43.481 -16.501 1.00 23.12 O ATOM 552 CB CYS A 38 -0.445 -42.452 -14.776 1.00 55.23 C ATOM 553 SG CYS A 38 -0.863 -44.173 -15.137 1.00 22.33 S ATOM 0 H CYS A 38 -1.135 -42.416 -17.126 1.00 31.04 H new ATOM 0 HA CYS A 38 0.536 -40.724 -15.623 1.00 10.42 H new ATOM 0 HB2 CYS A 38 0.087 -42.409 -13.826 1.00 55.23 H new ATOM 0 HB3 CYS A 38 -1.366 -41.883 -14.651 1.00 55.23 H new ATOM 0 HG CYS A 38 -2.013 -44.223 -15.742 1.00 22.33 H new ATOM 559 N ASN A 39 2.776 -41.780 -15.241 1.00 72.42 N ATOM 560 CA ASN A 39 4.147 -42.298 -15.172 1.00 15.33 C ATOM 561 C ASN A 39 4.221 -43.519 -14.242 1.00 11.44 C ATOM 562 O ASN A 39 4.056 -44.655 -14.690 1.00 34.54 O ATOM 563 CB ASN A 39 5.105 -41.195 -14.696 1.00 42.12 C ATOM 564 CG ASN A 39 6.557 -41.644 -14.638 1.00 14.24 C ATOM 565 OD1 ASN A 39 7.008 -42.455 -15.449 1.00 23.53 O ATOM 566 ND2 ASN A 39 7.294 -41.130 -13.668 1.00 10.15 N ATOM 0 H ASN A 39 2.639 -40.895 -14.753 1.00 72.42 H new ATOM 0 HA ASN A 39 4.449 -42.616 -16.170 1.00 15.33 H new ATOM 0 HB2 ASN A 39 5.023 -40.338 -15.365 1.00 42.12 H new ATOM 0 HB3 ASN A 39 4.796 -40.857 -13.707 1.00 42.12 H new ATOM 0 HD21 ASN A 39 8.272 -41.402 -13.572 1.00 10.15 H new ATOM 0 HD22 ASN A 39 6.884 -40.461 -13.016 1.00 10.15 H new ATOM 573 N ASP A 40 4.450 -43.283 -12.945 1.00 2.41 N ATOM 574 CA ASP A 40 4.439 -44.360 -11.950 1.00 42.21 C ATOM 575 C ASP A 40 3.884 -43.844 -10.625 1.00 11.11 C ATOM 576 O ASP A 40 4.215 -42.736 -10.194 1.00 52.12 O ATOM 577 CB ASP A 40 5.839 -44.974 -11.739 1.00 54.20 C ATOM 578 CG ASP A 40 6.825 -44.050 -11.031 1.00 63.42 C ATOM 579 OD1 ASP A 40 7.549 -43.302 -11.721 1.00 24.22 O ATOM 580 OD2 ASP A 40 6.899 -44.083 -9.779 1.00 1.42 O1- ATOM 0 H ASP A 40 4.645 -42.358 -12.561 1.00 2.41 H new ATOM 0 HA ASP A 40 3.793 -45.151 -12.332 1.00 42.21 H new ATOM 0 HB2 ASP A 40 5.738 -45.892 -11.160 1.00 54.20 H new ATOM 0 HB3 ASP A 40 6.251 -45.253 -12.709 1.00 54.20 H new ATOM 585 N ASN A 41 3.011 -44.648 -10.012 1.00 20.22 N ATOM 586 CA ASN A 41 2.360 -44.312 -8.737 1.00 43.41 C ATOM 587 C ASN A 41 1.570 -43.007 -8.827 1.00 72.45 C ATOM 588 O ASN A 41 1.196 -42.427 -7.807 1.00 25.45 O ATOM 589 CB ASN A 41 3.379 -44.247 -7.583 1.00 53.22 C ATOM 590 CG ASN A 41 3.899 -45.615 -7.157 1.00 43.00 C ATOM 591 OD1 ASN A 41 3.077 -46.648 -7.302 1.00 12.13 O flip ATOM 592 ND2 ASN A 41 5.028 -45.741 -6.680 1.00 51.54 N flip ATOM 0 H ASN A 41 2.733 -45.555 -10.386 1.00 20.22 H new ATOM 0 HA ASN A 41 1.654 -45.115 -8.524 1.00 43.41 H new ATOM 0 HB2 ASN A 41 4.221 -43.625 -7.886 1.00 53.22 H new ATOM 0 HB3 ASN A 41 2.915 -43.760 -6.725 1.00 53.22 H new ATOM 0 HD21 ASN A 41 5.634 -44.927 -6.583 1.00 51.54 H new ATOM 0 HD22 ASN A 41 5.356 -46.660 -6.383 1.00 51.54 H new ATOM 599 N ILE A 42 1.298 -42.563 -10.051 1.00 4.44 N ATOM 600 CA ILE A 42 0.496 -41.371 -10.271 1.00 53.42 C ATOM 601 C ILE A 42 -0.975 -41.696 -10.037 1.00 61.41 C ATOM 602 O ILE A 42 -1.604 -42.388 -10.843 1.00 70.51 O ATOM 603 CB ILE A 42 0.682 -40.806 -11.705 1.00 60.24 C ATOM 604 CG1 ILE A 42 2.151 -40.407 -11.950 1.00 24.42 C ATOM 605 CG2 ILE A 42 -0.247 -39.612 -11.939 1.00 31.35 C ATOM 606 CD1 ILE A 42 2.636 -39.268 -11.075 1.00 11.11 C ATOM 0 H ILE A 42 1.624 -43.015 -10.906 1.00 4.44 H new ATOM 0 HA ILE A 42 0.830 -40.609 -9.567 1.00 53.42 H new ATOM 0 HB ILE A 42 0.419 -41.590 -12.416 1.00 60.24 H new ATOM 0 HG12 ILE A 42 2.786 -41.277 -11.781 1.00 24.42 H new ATOM 0 HG13 ILE A 42 2.270 -40.124 -12.996 1.00 24.42 H new ATOM 0 HG21 ILE A 42 -0.101 -39.230 -12.950 1.00 31.35 H new ATOM 0 HG22 ILE A 42 -1.283 -39.928 -11.816 1.00 31.35 H new ATOM 0 HG23 ILE A 42 -0.019 -38.827 -11.218 1.00 31.35 H new ATOM 0 HD11 ILE A 42 3.678 -39.048 -11.308 1.00 11.11 H new ATOM 0 HD12 ILE A 42 2.028 -38.383 -11.260 1.00 11.11 H new ATOM 0 HD13 ILE A 42 2.552 -39.553 -10.026 1.00 11.11 H new ATOM 618 N LEU A 43 -1.498 -41.242 -8.906 1.00 61.41 N ATOM 619 CA LEU A 43 -2.903 -41.425 -8.584 1.00 72.33 C ATOM 620 C LEU A 43 -3.759 -40.493 -9.437 1.00 70.42 C ATOM 621 O LEU A 43 -3.638 -39.263 -9.373 1.00 24.44 O ATOM 622 CB LEU A 43 -3.164 -41.178 -7.089 1.00 53.01 C ATOM 623 CG LEU A 43 -4.626 -41.350 -6.642 1.00 15.11 C ATOM 624 CD1 LEU A 43 -5.136 -42.755 -6.962 1.00 20.34 C ATOM 625 CD2 LEU A 43 -4.768 -41.045 -5.153 1.00 60.11 C ATOM 0 H LEU A 43 -0.965 -40.742 -8.194 1.00 61.41 H new ATOM 0 HA LEU A 43 -3.175 -42.457 -8.805 1.00 72.33 H new ATOM 0 HB2 LEU A 43 -2.541 -41.860 -6.510 1.00 53.01 H new ATOM 0 HB3 LEU A 43 -2.842 -40.166 -6.843 1.00 53.01 H new ATOM 0 HG LEU A 43 -5.238 -40.640 -7.198 1.00 15.11 H new ATOM 0 HD11 LEU A 43 -6.172 -42.849 -6.636 1.00 20.34 H new ATOM 0 HD12 LEU A 43 -5.077 -42.927 -8.037 1.00 20.34 H new ATOM 0 HD13 LEU A 43 -4.523 -43.492 -6.442 1.00 20.34 H new ATOM 0 HD21 LEU A 43 -5.808 -41.171 -4.853 1.00 60.11 H new ATOM 0 HD22 LEU A 43 -4.140 -41.727 -4.580 1.00 60.11 H new ATOM 0 HD23 LEU A 43 -4.457 -40.018 -4.961 1.00 60.11 H new ATOM 637 N ILE A 44 -4.605 -41.098 -10.251 1.00 53.43 N ATOM 638 CA ILE A 44 -5.482 -40.371 -11.149 1.00 3.43 C ATOM 639 C ILE A 44 -6.900 -40.318 -10.591 1.00 52.32 C ATOM 640 O ILE A 44 -7.571 -41.346 -10.476 1.00 63.21 O ATOM 641 CB ILE A 44 -5.487 -41.027 -12.553 1.00 54.14 C ATOM 642 CG1 ILE A 44 -4.125 -40.814 -13.233 1.00 72.45 C ATOM 643 CG2 ILE A 44 -6.625 -40.484 -13.411 1.00 35.25 C ATOM 644 CD1 ILE A 44 -4.027 -41.414 -14.616 1.00 52.24 C ATOM 0 H ILE A 44 -4.703 -42.112 -10.308 1.00 53.43 H new ATOM 0 HA ILE A 44 -5.106 -39.352 -11.240 1.00 3.43 H new ATOM 0 HB ILE A 44 -5.654 -42.098 -12.438 1.00 54.14 H new ATOM 0 HG12 ILE A 44 -3.926 -39.744 -13.298 1.00 72.45 H new ATOM 0 HG13 ILE A 44 -3.346 -41.246 -12.605 1.00 72.45 H new ATOM 0 HG21 ILE A 44 -6.603 -40.963 -14.390 1.00 35.25 H new ATOM 0 HG22 ILE A 44 -7.578 -40.694 -12.926 1.00 35.25 H new ATOM 0 HG23 ILE A 44 -6.508 -39.407 -13.531 1.00 35.25 H new ATOM 0 HD11 ILE A 44 -3.036 -41.221 -15.027 1.00 52.24 H new ATOM 0 HD12 ILE A 44 -4.192 -42.490 -14.558 1.00 52.24 H new ATOM 0 HD13 ILE A 44 -4.782 -40.965 -15.262 1.00 52.24 H new ATOM 656 N LEU A 45 -7.340 -39.120 -10.228 1.00 65.44 N ATOM 657 CA LEU A 45 -8.704 -38.912 -9.755 1.00 1.02 C ATOM 658 C LEU A 45 -9.566 -38.414 -10.907 1.00 41.11 C ATOM 659 O LEU A 45 -9.288 -37.364 -11.484 1.00 73.21 O ATOM 660 CB LEU A 45 -8.758 -37.899 -8.597 1.00 45.12 C ATOM 661 CG LEU A 45 -8.126 -38.352 -7.267 1.00 11.25 C ATOM 662 CD1 LEU A 45 -6.611 -38.465 -7.385 1.00 71.43 C ATOM 663 CD2 LEU A 45 -8.514 -37.397 -6.139 1.00 43.24 C ATOM 0 H LEU A 45 -6.770 -38.274 -10.252 1.00 65.44 H new ATOM 0 HA LEU A 45 -9.082 -39.865 -9.383 1.00 1.02 H new ATOM 0 HB2 LEU A 45 -8.260 -36.984 -8.919 1.00 45.12 H new ATOM 0 HB3 LEU A 45 -9.802 -37.646 -8.412 1.00 45.12 H new ATOM 0 HG LEU A 45 -8.513 -39.343 -7.029 1.00 11.25 H new ATOM 0 HD11 LEU A 45 -6.195 -38.786 -6.430 1.00 71.43 H new ATOM 0 HD12 LEU A 45 -6.359 -39.195 -8.155 1.00 71.43 H new ATOM 0 HD13 LEU A 45 -6.194 -37.495 -7.654 1.00 71.43 H new ATOM 0 HD21 LEU A 45 -8.059 -37.731 -5.207 1.00 43.24 H new ATOM 0 HD22 LEU A 45 -8.161 -36.393 -6.375 1.00 43.24 H new ATOM 0 HD23 LEU A 45 -9.598 -37.384 -6.030 1.00 43.24 H new ATOM 675 N VAL A 46 -10.587 -39.176 -11.258 1.00 52.30 N ATOM 676 CA VAL A 46 -11.509 -38.782 -12.313 1.00 52.42 C ATOM 677 C VAL A 46 -12.799 -38.243 -11.702 1.00 21.23 C ATOM 678 O VAL A 46 -13.582 -39.003 -11.116 1.00 14.33 O ATOM 679 CB VAL A 46 -11.835 -39.965 -13.260 1.00 13.25 C ATOM 680 CG1 VAL A 46 -12.731 -39.511 -14.415 1.00 25.32 C ATOM 681 CG2 VAL A 46 -10.549 -40.603 -13.788 1.00 72.45 C ATOM 0 H VAL A 46 -10.800 -40.075 -10.827 1.00 52.30 H new ATOM 0 HA VAL A 46 -11.025 -38.003 -12.902 1.00 52.42 H new ATOM 0 HB VAL A 46 -12.380 -40.717 -12.688 1.00 13.25 H new ATOM 0 HG11 VAL A 46 -12.945 -40.360 -15.065 1.00 25.32 H new ATOM 0 HG12 VAL A 46 -13.665 -39.114 -14.017 1.00 25.32 H new ATOM 0 HG13 VAL A 46 -12.222 -38.735 -14.987 1.00 25.32 H new ATOM 0 HG21 VAL A 46 -10.799 -41.431 -14.451 1.00 72.45 H new ATOM 0 HG22 VAL A 46 -9.973 -39.859 -14.338 1.00 72.45 H new ATOM 0 HG23 VAL A 46 -9.957 -40.974 -12.951 1.00 72.45 H new ATOM 691 N ASP A 47 -12.986 -36.929 -11.800 1.00 11.12 N ATOM 692 CA ASP A 47 -14.205 -36.276 -11.327 1.00 51.13 C ATOM 693 C ASP A 47 -15.343 -36.432 -12.334 1.00 54.22 C ATOM 694 O ASP A 47 -15.142 -36.299 -13.548 1.00 62.13 O ATOM 695 CB ASP A 47 -13.957 -34.782 -11.055 1.00 0.54 C ATOM 696 CG ASP A 47 -15.254 -34.007 -10.829 1.00 13.50 C ATOM 697 OD1 ASP A 47 -15.582 -33.134 -11.663 1.00 30.41 O ATOM 698 OD2 ASP A 47 -15.955 -34.289 -9.830 1.00 0.25 O1- ATOM 0 H ASP A 47 -12.302 -36.290 -12.206 1.00 11.12 H new ATOM 0 HA ASP A 47 -14.494 -36.763 -10.396 1.00 51.13 H new ATOM 0 HB2 ASP A 47 -13.317 -34.677 -10.179 1.00 0.54 H new ATOM 0 HB3 ASP A 47 -13.419 -34.347 -11.897 1.00 0.54 H new ATOM 703 N PHE A 48 -16.533 -36.736 -11.823 1.00 33.43 N ATOM 704 CA PHE A 48 -17.744 -36.773 -12.635 1.00 51.34 C ATOM 705 C PHE A 48 -18.666 -35.624 -12.241 1.00 61.52 C ATOM 706 O PHE A 48 -19.589 -35.785 -11.430 1.00 13.11 O ATOM 707 CB PHE A 48 -18.457 -38.127 -12.500 1.00 65.22 C ATOM 708 CG PHE A 48 -17.729 -39.253 -13.195 1.00 13.55 C ATOM 709 CD1 PHE A 48 -16.543 -39.758 -12.678 1.00 62.52 C ATOM 710 CD2 PHE A 48 -18.224 -39.798 -14.371 1.00 12.32 C ATOM 711 CE1 PHE A 48 -15.874 -40.785 -13.317 1.00 14.23 C ATOM 712 CE2 PHE A 48 -17.556 -40.825 -15.011 1.00 3.03 C ATOM 713 CZ PHE A 48 -16.380 -41.317 -14.485 1.00 0.02 C ATOM 0 H PHE A 48 -16.684 -36.962 -10.840 1.00 33.43 H new ATOM 0 HA PHE A 48 -17.467 -36.654 -13.683 1.00 51.34 H new ATOM 0 HB2 PHE A 48 -18.565 -38.370 -11.443 1.00 65.22 H new ATOM 0 HB3 PHE A 48 -19.463 -38.044 -12.912 1.00 65.22 H new ATOM 0 HD1 PHE A 48 -16.139 -39.344 -11.766 1.00 62.52 H new ATOM 0 HD2 PHE A 48 -19.142 -39.415 -14.791 1.00 12.32 H new ATOM 0 HE1 PHE A 48 -14.955 -41.171 -12.902 1.00 14.23 H new ATOM 0 HE2 PHE A 48 -17.955 -41.242 -15.924 1.00 3.03 H new ATOM 0 HZ PHE A 48 -15.856 -42.117 -14.986 1.00 0.02 H new ATOM 723 N TRP A 49 -18.369 -34.453 -12.792 1.00 62.40 N ATOM 724 CA TRP A 49 -19.137 -33.244 -12.531 1.00 3.51 C ATOM 725 C TRP A 49 -20.536 -33.356 -13.140 1.00 41.31 C ATOM 726 O TRP A 49 -20.737 -33.063 -14.321 1.00 63.54 O ATOM 727 CB TRP A 49 -18.397 -32.025 -13.109 1.00 40.21 C ATOM 728 CG TRP A 49 -18.959 -30.697 -12.688 1.00 42.53 C ATOM 729 CD1 TRP A 49 -20.063 -30.066 -13.193 1.00 65.23 C ATOM 730 CD2 TRP A 49 -18.426 -29.828 -11.680 1.00 72.13 C ATOM 731 NE1 TRP A 49 -20.249 -28.863 -12.558 1.00 33.30 N ATOM 732 CE2 TRP A 49 -19.257 -28.694 -11.625 1.00 34.35 C ATOM 733 CE3 TRP A 49 -17.326 -29.902 -10.818 1.00 22.14 C ATOM 734 CZ2 TRP A 49 -19.023 -27.643 -10.741 1.00 54.21 C ATOM 735 CZ3 TRP A 49 -17.096 -28.859 -9.943 1.00 74.34 C ATOM 736 CH2 TRP A 49 -17.941 -27.742 -9.910 1.00 43.42 C ATOM 0 H TRP A 49 -17.588 -34.316 -13.433 1.00 62.40 H new ATOM 0 HA TRP A 49 -19.243 -33.118 -11.454 1.00 3.51 H new ATOM 0 HB2 TRP A 49 -17.351 -32.074 -12.807 1.00 40.21 H new ATOM 0 HB3 TRP A 49 -18.418 -32.086 -14.197 1.00 40.21 H new ATOM 0 HD1 TRP A 49 -20.695 -30.457 -13.976 1.00 65.23 H new ATOM 0 HE1 TRP A 49 -21.002 -28.202 -12.749 1.00 33.30 H new ATOM 0 HE3 TRP A 49 -16.669 -30.759 -10.837 1.00 22.14 H new ATOM 0 HZ2 TRP A 49 -19.673 -26.781 -10.713 1.00 54.21 H new ATOM 0 HZ3 TRP A 49 -16.250 -28.905 -9.273 1.00 74.34 H new ATOM 0 HH2 TRP A 49 -17.734 -26.943 -9.214 1.00 43.42 H new ATOM 747 N ALA A 50 -21.489 -33.821 -12.343 1.00 41.34 N ATOM 748 CA ALA A 50 -22.880 -33.889 -12.772 1.00 51.22 C ATOM 749 C ALA A 50 -23.516 -32.497 -12.716 1.00 20.23 C ATOM 750 O ALA A 50 -23.317 -31.760 -11.746 1.00 33.32 O ATOM 751 CB ALA A 50 -23.654 -34.877 -11.908 1.00 54.33 C ATOM 0 H ALA A 50 -21.324 -34.157 -11.394 1.00 41.34 H new ATOM 0 HA ALA A 50 -22.916 -34.242 -13.803 1.00 51.22 H new ATOM 0 HB1 ALA A 50 -24.691 -34.917 -12.241 1.00 54.33 H new ATOM 0 HB2 ALA A 50 -23.206 -35.867 -11.997 1.00 54.33 H new ATOM 0 HB3 ALA A 50 -23.619 -34.555 -10.867 1.00 54.33 H new ATOM 757 N PRO A 51 -24.317 -32.135 -13.742 1.00 55.40 N ATOM 758 CA PRO A 51 -24.850 -30.767 -13.914 1.00 12.22 C ATOM 759 C PRO A 51 -25.725 -30.294 -12.748 1.00 34.03 C ATOM 760 O PRO A 51 -26.113 -29.127 -12.696 1.00 2.20 O ATOM 761 CB PRO A 51 -25.676 -30.860 -15.211 1.00 62.34 C ATOM 762 CG PRO A 51 -25.973 -32.313 -15.372 1.00 64.33 C ATOM 763 CD PRO A 51 -24.773 -33.032 -14.822 1.00 24.12 C ATOM 0 HA PRO A 51 -24.043 -30.035 -13.952 1.00 12.22 H new ATOM 0 HB2 PRO A 51 -26.593 -30.275 -15.139 1.00 62.34 H new ATOM 0 HB3 PRO A 51 -25.118 -30.474 -16.064 1.00 62.34 H new ATOM 0 HG2 PRO A 51 -26.878 -32.591 -14.832 1.00 64.33 H new ATOM 0 HG3 PRO A 51 -26.136 -32.566 -16.419 1.00 64.33 H new ATOM 0 HD2 PRO A 51 -25.033 -34.021 -14.443 1.00 24.12 H new ATOM 0 HD3 PRO A 51 -24.004 -33.174 -15.581 1.00 24.12 H new ATOM 771 N TRP A 52 -26.044 -31.198 -11.825 1.00 52.31 N ATOM 772 CA TRP A 52 -26.825 -30.840 -10.643 1.00 61.04 C ATOM 773 C TRP A 52 -26.020 -29.878 -9.767 1.00 61.45 C ATOM 774 O TRP A 52 -26.503 -28.808 -9.398 1.00 73.15 O ATOM 775 CB TRP A 52 -27.209 -32.095 -9.850 1.00 34.34 C ATOM 776 CG TRP A 52 -28.168 -31.817 -8.730 1.00 2.33 C ATOM 777 CD1 TRP A 52 -27.866 -31.642 -7.410 1.00 55.55 C ATOM 778 CD2 TRP A 52 -29.589 -31.673 -8.840 1.00 2.31 C ATOM 779 NE1 TRP A 52 -29.011 -31.403 -6.693 1.00 21.24 N ATOM 780 CE2 TRP A 52 -30.083 -31.417 -7.549 1.00 34.23 C ATOM 781 CE3 TRP A 52 -30.491 -31.739 -9.907 1.00 4.45 C ATOM 782 CZ2 TRP A 52 -31.439 -31.223 -7.297 1.00 10.31 C ATOM 783 CZ3 TRP A 52 -31.835 -31.546 -9.657 1.00 4.30 C ATOM 784 CH2 TRP A 52 -32.298 -31.292 -8.361 1.00 60.21 C ATOM 0 H TRP A 52 -25.775 -32.181 -11.872 1.00 52.31 H new ATOM 0 HA TRP A 52 -27.744 -30.347 -10.961 1.00 61.04 H new ATOM 0 HB2 TRP A 52 -27.654 -32.823 -10.528 1.00 34.34 H new ATOM 0 HB3 TRP A 52 -26.306 -32.549 -9.442 1.00 34.34 H new ATOM 0 HD1 TRP A 52 -26.871 -31.685 -6.992 1.00 55.55 H new ATOM 0 HE1 TRP A 52 -29.058 -31.241 -5.687 1.00 21.24 H new ATOM 0 HE3 TRP A 52 -30.142 -31.938 -10.910 1.00 4.45 H new ATOM 0 HZ2 TRP A 52 -31.800 -31.025 -6.298 1.00 10.31 H new ATOM 0 HZ3 TRP A 52 -32.540 -31.592 -10.474 1.00 4.30 H new ATOM 0 HH2 TRP A 52 -33.356 -31.147 -8.197 1.00 60.21 H new ATOM 795 N CYS A 53 -24.791 -30.288 -9.450 1.00 50.22 N ATOM 796 CA CYS A 53 -23.823 -29.452 -8.732 1.00 20.35 C ATOM 797 C CYS A 53 -24.387 -28.924 -7.398 1.00 44.23 C ATOM 798 O CYS A 53 -25.015 -27.863 -7.349 1.00 40.01 O ATOM 799 CB CYS A 53 -23.371 -28.288 -9.633 1.00 43.12 C ATOM 800 SG CYS A 53 -21.755 -27.563 -9.192 1.00 63.30 S ATOM 0 H CYS A 53 -24.435 -31.215 -9.685 1.00 50.22 H new ATOM 0 HA CYS A 53 -22.962 -30.073 -8.486 1.00 20.35 H new ATOM 0 HB2 CYS A 53 -23.326 -28.641 -10.663 1.00 43.12 H new ATOM 0 HB3 CYS A 53 -24.127 -27.504 -9.597 1.00 43.12 H new ATOM 805 N GLY A 54 -24.171 -29.682 -6.319 1.00 43.40 N ATOM 806 CA GLY A 54 -24.599 -29.247 -4.993 1.00 13.40 C ATOM 807 C GLY A 54 -23.456 -28.622 -4.202 1.00 4.44 C ATOM 808 O GLY A 54 -23.095 -27.469 -4.443 1.00 31.03 O ATOM 0 H GLY A 54 -23.707 -30.590 -6.340 1.00 43.40 H new ATOM 0 HA2 GLY A 54 -25.409 -28.525 -5.092 1.00 13.40 H new ATOM 0 HA3 GLY A 54 -24.998 -30.099 -4.443 1.00 13.40 H new ATOM 812 N PRO A 55 -22.839 -29.373 -3.263 1.00 11.55 N ATOM 813 CA PRO A 55 -21.688 -28.888 -2.472 1.00 25.30 C ATOM 814 C PRO A 55 -20.417 -28.742 -3.322 1.00 32.04 C ATOM 815 O PRO A 55 -19.334 -28.447 -2.807 1.00 53.41 O ATOM 816 CB PRO A 55 -21.512 -29.975 -1.401 1.00 54.22 C ATOM 817 CG PRO A 55 -22.089 -31.207 -2.014 1.00 31.01 C ATOM 818 CD PRO A 55 -23.225 -30.748 -2.886 1.00 51.53 C ATOM 0 HA PRO A 55 -21.861 -27.894 -2.059 1.00 25.30 H new ATOM 0 HB2 PRO A 55 -20.461 -30.114 -1.147 1.00 54.22 H new ATOM 0 HB3 PRO A 55 -22.031 -29.711 -0.479 1.00 54.22 H new ATOM 0 HG2 PRO A 55 -21.339 -31.739 -2.599 1.00 31.01 H new ATOM 0 HG3 PRO A 55 -22.441 -31.896 -1.246 1.00 31.01 H new ATOM 0 HD2 PRO A 55 -23.341 -31.386 -3.762 1.00 51.53 H new ATOM 0 HD3 PRO A 55 -24.174 -30.766 -2.350 1.00 51.53 H new ATOM 826 N CYS A 56 -20.575 -28.940 -4.628 1.00 70.12 N ATOM 827 CA CYS A 56 -19.495 -28.793 -5.602 1.00 20.13 C ATOM 828 C CYS A 56 -18.776 -27.452 -5.442 1.00 71.35 C ATOM 829 O CYS A 56 -17.581 -27.347 -5.716 1.00 52.03 O ATOM 830 CB CYS A 56 -20.091 -28.891 -7.008 1.00 24.21 C ATOM 831 SG CYS A 56 -21.592 -27.874 -7.197 1.00 62.21 S ATOM 0 H CYS A 56 -21.466 -29.210 -5.045 1.00 70.12 H new ATOM 0 HA CYS A 56 -18.763 -29.584 -5.438 1.00 20.13 H new ATOM 0 HB2 CYS A 56 -19.346 -28.575 -7.738 1.00 24.21 H new ATOM 0 HB3 CYS A 56 -20.330 -29.932 -7.227 1.00 24.21 H new ATOM 836 N ARG A 57 -19.511 -26.442 -4.977 1.00 42.14 N ATOM 837 CA ARG A 57 -18.974 -25.091 -4.823 1.00 30.24 C ATOM 838 C ARG A 57 -17.699 -25.114 -3.975 1.00 54.23 C ATOM 839 O ARG A 57 -16.677 -24.553 -4.364 1.00 53.21 O ATOM 840 CB ARG A 57 -20.043 -24.174 -4.189 1.00 42.45 C ATOM 841 CG ARG A 57 -19.706 -22.676 -4.192 1.00 14.45 C ATOM 842 CD ARG A 57 -18.690 -22.292 -3.115 1.00 71.53 C ATOM 843 NE ARG A 57 -18.347 -20.869 -3.157 1.00 20.02 N ATOM 844 CZ ARG A 57 -17.109 -20.399 -3.321 1.00 74.44 C ATOM 845 NH1 ARG A 57 -16.092 -21.234 -3.500 1.00 35.42 N1+ ATOM 846 NH2 ARG A 57 -16.890 -19.094 -3.304 1.00 33.01 N ATOM 0 H ARG A 57 -20.488 -26.536 -4.699 1.00 42.14 H new ATOM 0 HA ARG A 57 -18.715 -24.696 -5.805 1.00 30.24 H new ATOM 0 HB2 ARG A 57 -20.984 -24.319 -4.720 1.00 42.45 H new ATOM 0 HB3 ARG A 57 -20.206 -24.491 -3.159 1.00 42.45 H new ATOM 0 HG2 ARG A 57 -19.313 -22.399 -5.170 1.00 14.45 H new ATOM 0 HG3 ARG A 57 -20.621 -22.103 -4.042 1.00 14.45 H new ATOM 0 HD2 ARG A 57 -19.095 -22.537 -2.133 1.00 71.53 H new ATOM 0 HD3 ARG A 57 -17.785 -22.886 -3.244 1.00 71.53 H new ATOM 0 HE ARG A 57 -19.104 -20.193 -3.054 1.00 20.02 H new ATOM 0 HH11 ARG A 57 -16.255 -22.241 -3.513 1.00 35.42 H new ATOM 0 HH12 ARG A 57 -15.148 -20.869 -3.625 1.00 35.42 H new ATOM 0 HH21 ARG A 57 -17.667 -18.448 -3.166 1.00 33.01 H new ATOM 0 HH22 ARG A 57 -15.944 -18.734 -3.429 1.00 33.01 H new ATOM 860 N SER A 58 -17.780 -25.738 -2.807 1.00 22.42 N ATOM 861 CA SER A 58 -16.630 -25.869 -1.916 1.00 70.35 C ATOM 862 C SER A 58 -15.646 -26.932 -2.428 1.00 50.02 C ATOM 863 O SER A 58 -14.424 -26.722 -2.455 1.00 63.20 O ATOM 864 CB SER A 58 -17.115 -26.225 -0.506 1.00 12.11 C ATOM 865 OG SER A 58 -18.089 -25.295 -0.055 1.00 40.31 O ATOM 0 H SER A 58 -18.635 -26.165 -2.451 1.00 22.42 H new ATOM 0 HA SER A 58 -16.101 -24.916 -1.889 1.00 70.35 H new ATOM 0 HB2 SER A 58 -17.538 -27.230 -0.505 1.00 12.11 H new ATOM 0 HB3 SER A 58 -16.270 -26.235 0.182 1.00 12.11 H new ATOM 0 HG SER A 58 -17.742 -24.384 -0.154 1.00 40.31 H new ATOM 871 N LEU A 59 -16.187 -28.073 -2.840 1.00 35.33 N ATOM 872 CA LEU A 59 -15.366 -29.227 -3.194 1.00 33.30 C ATOM 873 C LEU A 59 -14.460 -28.956 -4.392 1.00 51.22 C ATOM 874 O LEU A 59 -13.368 -29.506 -4.462 1.00 44.13 O ATOM 875 CB LEU A 59 -16.241 -30.464 -3.453 1.00 34.51 C ATOM 876 CG LEU A 59 -16.618 -31.281 -2.202 1.00 64.10 C ATOM 877 CD1 LEU A 59 -15.369 -31.846 -1.530 1.00 21.22 C ATOM 878 CD2 LEU A 59 -17.429 -30.441 -1.216 1.00 63.33 C ATOM 0 H LEU A 59 -17.191 -28.225 -2.937 1.00 35.33 H new ATOM 0 HA LEU A 59 -14.719 -29.423 -2.339 1.00 33.30 H new ATOM 0 HB2 LEU A 59 -17.158 -30.142 -3.946 1.00 34.51 H new ATOM 0 HB3 LEU A 59 -15.718 -31.119 -4.150 1.00 34.51 H new ATOM 0 HG LEU A 59 -17.243 -32.114 -2.523 1.00 64.10 H new ATOM 0 HD11 LEU A 59 -15.658 -32.419 -0.649 1.00 21.22 H new ATOM 0 HD12 LEU A 59 -14.842 -32.495 -2.229 1.00 21.22 H new ATOM 0 HD13 LEU A 59 -14.714 -31.027 -1.232 1.00 21.22 H new ATOM 0 HD21 LEU A 59 -17.680 -31.045 -0.344 1.00 63.33 H new ATOM 0 HD22 LEU A 59 -16.841 -29.578 -0.903 1.00 63.33 H new ATOM 0 HD23 LEU A 59 -18.346 -30.100 -1.697 1.00 63.33 H new ATOM 890 N GLU A 60 -14.896 -28.112 -5.325 1.00 25.40 N ATOM 891 CA GLU A 60 -14.098 -27.839 -6.521 1.00 51.24 C ATOM 892 C GLU A 60 -12.745 -27.209 -6.133 1.00 31.13 C ATOM 893 O GLU A 60 -11.697 -27.787 -6.428 1.00 60.23 O ATOM 894 CB GLU A 60 -14.886 -26.971 -7.523 1.00 44.05 C ATOM 895 CG GLU A 60 -14.196 -26.771 -8.878 1.00 51.15 C ATOM 896 CD GLU A 60 -13.615 -25.376 -9.056 1.00 40.34 C ATOM 897 OE1 GLU A 60 -14.403 -24.426 -9.248 1.00 65.12 O ATOM 898 OE2 GLU A 60 -12.379 -25.225 -9.026 1.00 25.24 O1- ATOM 0 H GLU A 60 -15.784 -27.611 -5.279 1.00 25.40 H new ATOM 0 HA GLU A 60 -13.883 -28.782 -7.024 1.00 51.24 H new ATOM 0 HB2 GLU A 60 -15.861 -27.428 -7.691 1.00 44.05 H new ATOM 0 HB3 GLU A 60 -15.065 -25.994 -7.074 1.00 44.05 H new ATOM 0 HG2 GLU A 60 -13.398 -27.506 -8.984 1.00 51.15 H new ATOM 0 HG3 GLU A 60 -14.914 -26.963 -9.676 1.00 51.15 H new ATOM 905 N PRO A 61 -12.727 -26.048 -5.426 1.00 40.44 N ATOM 906 CA PRO A 61 -11.471 -25.461 -4.948 1.00 20.54 C ATOM 907 C PRO A 61 -10.759 -26.369 -3.940 1.00 64.23 C ATOM 908 O PRO A 61 -9.527 -26.338 -3.833 1.00 41.33 O ATOM 909 CB PRO A 61 -11.895 -24.135 -4.294 1.00 61.44 C ATOM 910 CG PRO A 61 -13.346 -24.296 -3.999 1.00 3.54 C ATOM 911 CD PRO A 61 -13.887 -25.207 -5.069 1.00 61.33 C ATOM 0 HA PRO A 61 -10.756 -25.321 -5.759 1.00 20.54 H new ATOM 0 HB2 PRO A 61 -11.326 -23.944 -3.384 1.00 61.44 H new ATOM 0 HB3 PRO A 61 -11.719 -23.292 -4.962 1.00 61.44 H new ATOM 0 HG2 PRO A 61 -13.498 -24.724 -3.008 1.00 3.54 H new ATOM 0 HG3 PRO A 61 -13.856 -23.333 -4.012 1.00 3.54 H new ATOM 0 HD2 PRO A 61 -14.720 -25.807 -4.702 1.00 61.33 H new ATOM 0 HD3 PRO A 61 -14.254 -24.644 -5.927 1.00 61.33 H new ATOM 919 N GLN A 62 -11.522 -27.185 -3.200 1.00 1.31 N ATOM 920 CA GLN A 62 -10.907 -28.133 -2.262 1.00 64.23 C ATOM 921 C GLN A 62 -10.171 -29.252 -3.014 1.00 72.30 C ATOM 922 O GLN A 62 -9.121 -29.730 -2.570 1.00 45.13 O ATOM 923 CB GLN A 62 -11.944 -28.726 -1.298 1.00 52.44 C ATOM 924 CG GLN A 62 -12.558 -27.697 -0.351 1.00 75.21 C ATOM 925 CD GLN A 62 -13.404 -28.324 0.744 1.00 5.22 C ATOM 926 OE1 GLN A 62 -12.914 -28.616 1.835 1.00 5.12 O ATOM 927 NE2 GLN A 62 -14.674 -28.545 0.457 1.00 34.41 N ATOM 0 H GLN A 62 -12.541 -27.209 -3.230 1.00 1.31 H new ATOM 0 HA GLN A 62 -10.179 -27.578 -1.670 1.00 64.23 H new ATOM 0 HB2 GLN A 62 -12.740 -29.195 -1.877 1.00 52.44 H new ATOM 0 HB3 GLN A 62 -11.472 -29.513 -0.709 1.00 52.44 H new ATOM 0 HG2 GLN A 62 -11.760 -27.111 0.105 1.00 75.21 H new ATOM 0 HG3 GLN A 62 -13.173 -27.005 -0.926 1.00 75.21 H new ATOM 0 HE21 GLN A 62 -15.042 -28.288 -0.459 1.00 34.41 H new ATOM 0 HE22 GLN A 62 -15.287 -28.972 1.151 1.00 34.41 H new ATOM 936 N LEU A 63 -10.710 -29.656 -4.159 1.00 4.32 N ATOM 937 CA LEU A 63 -10.060 -30.661 -4.996 1.00 24.11 C ATOM 938 C LEU A 63 -8.791 -30.077 -5.596 1.00 34.30 C ATOM 939 O LEU A 63 -7.746 -30.725 -5.609 1.00 14.04 O ATOM 940 CB LEU A 63 -11.002 -31.154 -6.105 1.00 72.32 C ATOM 941 CG LEU A 63 -12.160 -32.047 -5.629 1.00 45.24 C ATOM 942 CD1 LEU A 63 -13.106 -32.371 -6.785 1.00 73.33 C ATOM 943 CD2 LEU A 63 -11.620 -33.328 -4.992 1.00 74.14 C ATOM 0 H LEU A 63 -11.593 -29.305 -4.529 1.00 4.32 H new ATOM 0 HA LEU A 63 -9.805 -31.520 -4.375 1.00 24.11 H new ATOM 0 HB2 LEU A 63 -11.419 -30.287 -6.618 1.00 72.32 H new ATOM 0 HB3 LEU A 63 -10.416 -31.707 -6.839 1.00 72.32 H new ATOM 0 HG LEU A 63 -12.726 -31.502 -4.874 1.00 45.24 H new ATOM 0 HD11 LEU A 63 -13.917 -33.004 -6.425 1.00 73.33 H new ATOM 0 HD12 LEU A 63 -13.519 -31.446 -7.188 1.00 73.33 H new ATOM 0 HD13 LEU A 63 -12.558 -32.895 -7.568 1.00 73.33 H new ATOM 0 HD21 LEU A 63 -12.453 -33.949 -4.661 1.00 74.14 H new ATOM 0 HD22 LEU A 63 -11.027 -33.877 -5.724 1.00 74.14 H new ATOM 0 HD23 LEU A 63 -10.994 -33.073 -4.137 1.00 74.14 H new ATOM 955 N GLU A 64 -8.892 -28.838 -6.070 1.00 4.53 N ATOM 956 CA GLU A 64 -7.740 -28.113 -6.595 1.00 14.32 C ATOM 957 C GLU A 64 -6.668 -27.978 -5.520 1.00 63.35 C ATOM 958 O GLU A 64 -5.474 -28.045 -5.808 1.00 10.34 O ATOM 959 CB GLU A 64 -8.172 -26.734 -7.110 1.00 61.33 C ATOM 960 CG GLU A 64 -9.144 -26.810 -8.285 1.00 42.54 C ATOM 961 CD GLU A 64 -8.453 -27.092 -9.612 1.00 13.44 C ATOM 962 OE1 GLU A 64 -7.678 -28.063 -9.700 1.00 52.13 O ATOM 963 OE2 GLU A 64 -8.693 -26.348 -10.584 1.00 65.51 O1- ATOM 0 H GLU A 64 -9.766 -28.313 -6.101 1.00 4.53 H new ATOM 0 HA GLU A 64 -7.319 -28.674 -7.429 1.00 14.32 H new ATOM 0 HB2 GLU A 64 -8.638 -26.179 -6.296 1.00 61.33 H new ATOM 0 HB3 GLU A 64 -7.288 -26.173 -7.413 1.00 61.33 H new ATOM 0 HG2 GLU A 64 -9.879 -27.591 -8.091 1.00 42.54 H new ATOM 0 HG3 GLU A 64 -9.690 -25.870 -8.359 1.00 42.54 H new ATOM 970 N LYS A 65 -7.110 -27.804 -4.273 1.00 0.43 N ATOM 971 CA LYS A 65 -6.204 -27.785 -3.127 1.00 4.21 C ATOM 972 C LYS A 65 -5.357 -29.049 -3.105 1.00 63.22 C ATOM 973 O LYS A 65 -4.121 -28.998 -3.158 1.00 64.34 O ATOM 974 CB LYS A 65 -7.008 -27.704 -1.817 1.00 2.10 C ATOM 975 CG LYS A 65 -6.183 -27.977 -0.556 1.00 73.25 C ATOM 976 CD LYS A 65 -7.061 -28.250 0.672 1.00 53.43 C ATOM 977 CE LYS A 65 -8.266 -27.316 0.770 1.00 74.54 C ATOM 978 NZ LYS A 65 -7.880 -25.894 0.947 1.00 62.51 N1+ ATOM 0 H LYS A 65 -8.093 -27.674 -4.033 1.00 0.43 H new ATOM 0 HA LYS A 65 -5.557 -26.912 -3.217 1.00 4.21 H new ATOM 0 HB2 LYS A 65 -7.454 -26.712 -1.738 1.00 2.10 H new ATOM 0 HB3 LYS A 65 -7.829 -28.420 -1.863 1.00 2.10 H new ATOM 0 HG2 LYS A 65 -5.531 -28.833 -0.730 1.00 73.25 H new ATOM 0 HG3 LYS A 65 -5.538 -27.121 -0.355 1.00 73.25 H new ATOM 0 HD2 LYS A 65 -7.411 -29.282 0.638 1.00 53.43 H new ATOM 0 HD3 LYS A 65 -6.456 -28.148 1.573 1.00 53.43 H new ATOM 0 HE2 LYS A 65 -8.870 -27.414 -0.132 1.00 74.54 H new ATOM 0 HE3 LYS A 65 -8.892 -27.625 1.607 1.00 74.54 H new ATOM 0 HZ1 LYS A 65 -8.528 -25.288 0.404 1.00 62.51 H new ATOM 0 HZ2 LYS A 65 -7.933 -25.643 1.955 1.00 62.51 H new ATOM 0 HZ3 LYS A 65 -6.908 -25.753 0.606 1.00 62.51 H new ATOM 992 N LEU A 66 -6.037 -30.190 -3.065 1.00 12.42 N ATOM 993 CA LEU A 66 -5.354 -31.465 -2.948 1.00 2.43 C ATOM 994 C LEU A 66 -4.596 -31.777 -4.237 1.00 60.12 C ATOM 995 O LEU A 66 -3.564 -32.448 -4.219 1.00 51.14 O ATOM 996 CB LEU A 66 -6.352 -32.592 -2.629 1.00 45.35 C ATOM 997 CG LEU A 66 -7.301 -32.312 -1.450 1.00 74.51 C ATOM 998 CD1 LEU A 66 -8.244 -33.489 -1.221 1.00 61.45 C ATOM 999 CD2 LEU A 66 -6.511 -32.000 -0.180 1.00 41.11 C ATOM 0 H LEU A 66 -7.054 -30.254 -3.112 1.00 12.42 H new ATOM 0 HA LEU A 66 -4.640 -31.399 -2.127 1.00 2.43 H new ATOM 0 HB2 LEU A 66 -6.951 -32.788 -3.518 1.00 45.35 H new ATOM 0 HB3 LEU A 66 -5.792 -33.502 -2.415 1.00 45.35 H new ATOM 0 HG LEU A 66 -7.902 -31.438 -1.701 1.00 74.51 H new ATOM 0 HD11 LEU A 66 -8.905 -33.268 -0.383 1.00 61.45 H new ATOM 0 HD12 LEU A 66 -8.840 -33.658 -2.118 1.00 61.45 H new ATOM 0 HD13 LEU A 66 -7.662 -34.383 -0.998 1.00 61.45 H new ATOM 0 HD21 LEU A 66 -7.202 -31.805 0.640 1.00 41.11 H new ATOM 0 HD22 LEU A 66 -5.878 -32.851 0.073 1.00 41.11 H new ATOM 0 HD23 LEU A 66 -5.888 -31.121 -0.346 1.00 41.11 H new ATOM 1011 N ALA A 67 -5.110 -31.259 -5.347 1.00 43.32 N ATOM 1012 CA ALA A 67 -4.509 -31.474 -6.655 1.00 1.23 C ATOM 1013 C ALA A 67 -3.158 -30.782 -6.734 1.00 3.40 C ATOM 1014 O ALA A 67 -2.183 -31.358 -7.202 1.00 21.23 O ATOM 1015 CB ALA A 67 -5.433 -30.967 -7.758 1.00 34.31 C ATOM 0 H ALA A 67 -5.951 -30.681 -5.364 1.00 43.32 H new ATOM 0 HA ALA A 67 -4.360 -32.545 -6.797 1.00 1.23 H new ATOM 0 HB1 ALA A 67 -4.967 -31.136 -8.729 1.00 34.31 H new ATOM 0 HB2 ALA A 67 -6.382 -31.502 -7.712 1.00 34.31 H new ATOM 0 HB3 ALA A 67 -5.611 -29.900 -7.622 1.00 34.31 H new ATOM 1021 N GLN A 68 -3.105 -29.547 -6.253 1.00 30.24 N ATOM 1022 CA GLN A 68 -1.877 -28.763 -6.288 1.00 34.53 C ATOM 1023 C GLN A 68 -0.881 -29.272 -5.248 1.00 14.40 C ATOM 1024 O GLN A 68 0.325 -29.303 -5.499 1.00 34.01 O ATOM 1025 CB GLN A 68 -2.181 -27.274 -6.069 1.00 73.12 C ATOM 1026 CG GLN A 68 -3.046 -26.663 -7.168 1.00 63.23 C ATOM 1027 CD GLN A 68 -3.182 -25.151 -7.068 1.00 72.52 C ATOM 1028 OE1 GLN A 68 -3.107 -24.574 -5.984 1.00 74.13 O ATOM 1029 NE2 GLN A 68 -3.399 -24.499 -8.202 1.00 35.24 N ATOM 0 H GLN A 68 -3.900 -29.065 -5.833 1.00 30.24 H new ATOM 0 HA GLN A 68 -1.425 -28.878 -7.273 1.00 34.53 H new ATOM 0 HB2 GLN A 68 -2.685 -27.151 -5.110 1.00 73.12 H new ATOM 0 HB3 GLN A 68 -1.242 -26.724 -6.009 1.00 73.12 H new ATOM 0 HG2 GLN A 68 -2.619 -26.917 -8.138 1.00 63.23 H new ATOM 0 HG3 GLN A 68 -4.039 -27.112 -7.129 1.00 63.23 H new ATOM 0 HE21 GLN A 68 -3.455 -25.011 -9.082 1.00 35.24 H new ATOM 0 HE22 GLN A 68 -3.510 -23.485 -8.194 1.00 35.24 H new ATOM 1038 N GLN A 69 -1.387 -29.680 -4.085 1.00 23.22 N ATOM 1039 CA GLN A 69 -0.529 -30.229 -3.032 1.00 22.40 C ATOM 1040 C GLN A 69 0.095 -31.559 -3.468 1.00 3.21 C ATOM 1041 O GLN A 69 1.292 -31.789 -3.286 1.00 75.41 O ATOM 1042 CB GLN A 69 -1.325 -30.440 -1.733 1.00 11.52 C ATOM 1043 CG GLN A 69 -0.484 -31.016 -0.593 1.00 32.44 C ATOM 1044 CD GLN A 69 -1.294 -31.343 0.651 1.00 50.30 C ATOM 1045 OE1 GLN A 69 -2.308 -30.705 0.941 1.00 65.51 O ATOM 1046 NE2 GLN A 69 -0.845 -32.338 1.401 1.00 31.30 N ATOM 0 H GLN A 69 -2.378 -29.642 -3.848 1.00 23.22 H new ATOM 0 HA GLN A 69 0.268 -29.508 -2.850 1.00 22.40 H new ATOM 0 HB2 GLN A 69 -1.749 -29.487 -1.416 1.00 11.52 H new ATOM 0 HB3 GLN A 69 -2.161 -31.110 -1.933 1.00 11.52 H new ATOM 0 HG2 GLN A 69 0.015 -31.921 -0.941 1.00 32.44 H new ATOM 0 HG3 GLN A 69 0.297 -30.302 -0.331 1.00 32.44 H new ATOM 0 HE21 GLN A 69 -0.002 -32.842 1.128 1.00 31.30 H new ATOM 0 HE22 GLN A 69 -1.343 -32.600 2.252 1.00 31.30 H new ATOM 1055 N TYR A 70 -0.726 -32.424 -4.049 1.00 14.41 N ATOM 1056 CA TYR A 70 -0.327 -33.796 -4.371 1.00 60.14 C ATOM 1057 C TYR A 70 0.048 -33.970 -5.849 1.00 40.42 C ATOM 1058 O TYR A 70 0.309 -35.086 -6.285 1.00 75.22 O ATOM 1059 CB TYR A 70 -1.443 -34.781 -3.989 1.00 23.30 C ATOM 1060 CG TYR A 70 -1.729 -34.847 -2.496 1.00 14.04 C ATOM 1061 CD1 TYR A 70 -2.982 -34.517 -1.987 1.00 64.52 C ATOM 1062 CD2 TYR A 70 -0.742 -35.243 -1.597 1.00 13.23 C ATOM 1063 CE1 TYR A 70 -3.242 -34.581 -0.632 1.00 62.24 C ATOM 1064 CE2 TYR A 70 -0.996 -35.309 -0.239 1.00 4.24 C ATOM 1065 CZ TYR A 70 -2.248 -34.977 0.238 1.00 51.45 C ATOM 1066 OH TYR A 70 -2.509 -35.045 1.587 1.00 12.52 O ATOM 0 H TYR A 70 -1.686 -32.199 -4.311 1.00 14.41 H new ATOM 0 HA TYR A 70 0.566 -34.012 -3.785 1.00 60.14 H new ATOM 0 HB2 TYR A 70 -2.357 -34.498 -4.511 1.00 23.30 H new ATOM 0 HB3 TYR A 70 -1.170 -35.776 -4.340 1.00 23.30 H new ATOM 0 HD1 TYR A 70 -3.764 -34.206 -2.663 1.00 64.52 H new ATOM 0 HD2 TYR A 70 0.239 -35.503 -1.967 1.00 13.23 H new ATOM 0 HE1 TYR A 70 -4.220 -34.322 -0.255 1.00 62.24 H new ATOM 0 HE2 TYR A 70 -0.219 -35.619 0.444 1.00 4.24 H new ATOM 0 HH TYR A 70 -1.704 -35.342 2.061 1.00 12.52 H new ATOM 1076 N THR A 71 0.070 -32.877 -6.614 1.00 61.35 N ATOM 1077 CA THR A 71 0.276 -32.943 -8.074 1.00 51.44 C ATOM 1078 C THR A 71 1.543 -33.720 -8.462 1.00 2.11 C ATOM 1079 O THR A 71 1.669 -34.175 -9.601 1.00 63.31 O ATOM 1080 CB THR A 71 0.350 -31.525 -8.702 1.00 32.42 C ATOM 1081 OG1 THR A 71 0.486 -31.617 -10.132 1.00 20.15 O ATOM 1082 CG2 THR A 71 1.517 -30.724 -8.132 1.00 4.22 C ATOM 0 H THR A 71 -0.052 -31.931 -6.252 1.00 61.35 H new ATOM 0 HA THR A 71 -0.590 -33.477 -8.466 1.00 51.44 H new ATOM 0 HB THR A 71 -0.578 -31.008 -8.456 1.00 32.42 H new ATOM 0 HG1 THR A 71 0.909 -32.470 -10.366 1.00 20.15 H new ATOM 0 HG21 THR A 71 1.540 -29.736 -8.593 1.00 4.22 H new ATOM 0 HG22 THR A 71 1.394 -30.619 -7.054 1.00 4.22 H new ATOM 0 HG23 THR A 71 2.452 -31.244 -8.341 1.00 4.22 H new ATOM 1090 N GLU A 72 2.472 -33.872 -7.524 1.00 51.24 N ATOM 1091 CA GLU A 72 3.698 -34.627 -7.770 1.00 74.02 C ATOM 1092 C GLU A 72 3.398 -36.117 -7.975 1.00 60.10 C ATOM 1093 O GLU A 72 4.137 -36.817 -8.671 1.00 53.34 O ATOM 1094 CB GLU A 72 4.676 -34.433 -6.608 1.00 21.44 C ATOM 1095 CG GLU A 72 4.079 -34.760 -5.246 1.00 35.12 C ATOM 1096 CD GLU A 72 5.055 -34.527 -4.108 1.00 32.11 C ATOM 1097 OE1 GLU A 72 5.582 -35.516 -3.557 1.00 53.51 O ATOM 1098 OE2 GLU A 72 5.306 -33.350 -3.763 1.00 0.13 O1- ATOM 0 H GLU A 72 2.400 -33.482 -6.584 1.00 51.24 H new ATOM 0 HA GLU A 72 4.155 -34.249 -8.685 1.00 74.02 H new ATOM 0 HB2 GLU A 72 5.551 -35.062 -6.772 1.00 21.44 H new ATOM 0 HB3 GLU A 72 5.022 -33.400 -6.605 1.00 21.44 H new ATOM 0 HG2 GLU A 72 3.190 -34.150 -5.087 1.00 35.12 H new ATOM 0 HG3 GLU A 72 3.757 -35.801 -5.236 1.00 35.12 H new ATOM 1105 N ASN A 73 2.315 -36.597 -7.361 1.00 54.34 N ATOM 1106 CA ASN A 73 1.905 -37.999 -7.488 1.00 53.33 C ATOM 1107 C ASN A 73 0.422 -38.112 -7.833 1.00 50.23 C ATOM 1108 O ASN A 73 -0.136 -39.206 -7.808 1.00 40.15 O ATOM 1109 CB ASN A 73 2.172 -38.779 -6.186 1.00 52.25 C ATOM 1110 CG ASN A 73 3.627 -38.748 -5.749 1.00 60.25 C ATOM 1111 OD1 ASN A 73 3.946 -37.861 -4.821 1.00 52.33 O flip ATOM 1112 ND2 ASN A 73 4.449 -39.540 -6.214 1.00 3.30 N flip ATOM 0 H ASN A 73 1.704 -36.035 -6.769 1.00 54.34 H new ATOM 0 HA ASN A 73 2.498 -38.429 -8.295 1.00 53.33 H new ATOM 0 HB2 ASN A 73 1.553 -38.365 -5.390 1.00 52.25 H new ATOM 0 HB3 ASN A 73 1.864 -39.816 -6.323 1.00 52.25 H new ATOM 0 HD21 ASN A 73 4.164 -40.210 -6.929 1.00 3.30 H new ATOM 0 HD22 ASN A 73 5.414 -39.526 -5.884 1.00 3.30 H new ATOM 1119 N VAL A 74 -0.217 -36.989 -8.155 1.00 42.24 N ATOM 1120 CA VAL A 74 -1.659 -36.969 -8.428 1.00 72.51 C ATOM 1121 C VAL A 74 -1.987 -36.119 -9.656 1.00 33.41 C ATOM 1122 O VAL A 74 -1.383 -35.067 -9.880 1.00 74.22 O ATOM 1123 CB VAL A 74 -2.457 -36.438 -7.199 1.00 15.53 C ATOM 1124 CG1 VAL A 74 -3.900 -36.093 -7.564 1.00 23.10 C ATOM 1125 CG2 VAL A 74 -2.427 -37.457 -6.062 1.00 50.05 C ATOM 0 H VAL A 74 0.238 -36.079 -8.234 1.00 42.24 H new ATOM 0 HA VAL A 74 -1.957 -37.998 -8.628 1.00 72.51 H new ATOM 0 HB VAL A 74 -1.972 -35.520 -6.867 1.00 15.53 H new ATOM 0 HG11 VAL A 74 -4.421 -35.727 -6.680 1.00 23.10 H new ATOM 0 HG12 VAL A 74 -3.906 -35.322 -8.334 1.00 23.10 H new ATOM 0 HG13 VAL A 74 -4.403 -36.984 -7.939 1.00 23.10 H new ATOM 0 HG21 VAL A 74 -2.989 -37.070 -5.212 1.00 50.05 H new ATOM 0 HG22 VAL A 74 -2.876 -38.391 -6.399 1.00 50.05 H new ATOM 0 HG23 VAL A 74 -1.395 -37.638 -5.763 1.00 50.05 H new ATOM 1135 N LYS A 75 -2.946 -36.595 -10.451 1.00 71.33 N ATOM 1136 CA LYS A 75 -3.449 -35.855 -11.608 1.00 20.41 C ATOM 1137 C LYS A 75 -4.958 -36.074 -11.716 1.00 63.15 C ATOM 1138 O LYS A 75 -5.416 -37.210 -11.843 1.00 32.02 O ATOM 1139 CB LYS A 75 -2.744 -36.331 -12.891 1.00 33.32 C ATOM 1140 CG LYS A 75 -2.941 -35.427 -14.115 1.00 15.44 C ATOM 1141 CD LYS A 75 -2.290 -34.055 -13.925 1.00 32.33 C ATOM 1142 CE LYS A 75 -2.081 -33.317 -15.251 1.00 62.53 C ATOM 1143 NZ LYS A 75 -3.360 -33.001 -15.949 1.00 41.05 N1+ ATOM 0 H LYS A 75 -3.394 -37.501 -10.312 1.00 71.33 H new ATOM 0 HA LYS A 75 -3.243 -34.792 -11.483 1.00 20.41 H new ATOM 0 HB2 LYS A 75 -1.676 -36.417 -12.690 1.00 33.32 H new ATOM 0 HB3 LYS A 75 -3.104 -37.331 -13.135 1.00 33.32 H new ATOM 0 HG2 LYS A 75 -2.517 -35.911 -14.995 1.00 15.44 H new ATOM 0 HG3 LYS A 75 -4.007 -35.300 -14.304 1.00 15.44 H new ATOM 0 HD2 LYS A 75 -2.914 -33.448 -13.269 1.00 32.33 H new ATOM 0 HD3 LYS A 75 -1.329 -34.178 -13.426 1.00 32.33 H new ATOM 0 HE2 LYS A 75 -1.537 -32.391 -15.063 1.00 62.53 H new ATOM 0 HE3 LYS A 75 -1.457 -33.926 -15.905 1.00 62.53 H new ATOM 0 HZ1 LYS A 75 -3.154 -32.595 -16.884 1.00 41.05 H new ATOM 0 HZ2 LYS A 75 -3.917 -33.872 -16.065 1.00 41.05 H new ATOM 0 HZ3 LYS A 75 -3.903 -32.316 -15.386 1.00 41.05 H new ATOM 1157 N ILE A 76 -5.730 -34.993 -11.640 1.00 10.31 N ATOM 1158 CA ILE A 76 -7.189 -35.087 -11.695 1.00 43.12 C ATOM 1159 C ILE A 76 -7.690 -34.754 -13.095 1.00 51.15 C ATOM 1160 O ILE A 76 -7.188 -33.831 -13.742 1.00 60.02 O ATOM 1161 CB ILE A 76 -7.870 -34.141 -10.666 1.00 3.10 C ATOM 1162 CG1 ILE A 76 -7.317 -34.400 -9.252 1.00 3.44 C ATOM 1163 CG2 ILE A 76 -9.389 -34.319 -10.690 1.00 13.44 C ATOM 1164 CD1 ILE A 76 -7.958 -33.553 -8.169 1.00 73.14 C ATOM 0 H ILE A 76 -5.372 -34.043 -11.540 1.00 10.31 H new ATOM 0 HA ILE A 76 -7.454 -36.114 -11.442 1.00 43.12 H new ATOM 0 HB ILE A 76 -7.644 -33.111 -10.943 1.00 3.10 H new ATOM 0 HG12 ILE A 76 -7.458 -35.452 -9.006 1.00 3.44 H new ATOM 0 HG13 ILE A 76 -6.243 -34.215 -9.255 1.00 3.44 H new ATOM 0 HG21 ILE A 76 -9.846 -33.648 -9.963 1.00 13.44 H new ATOM 0 HG22 ILE A 76 -9.767 -34.086 -11.686 1.00 13.44 H new ATOM 0 HG23 ILE A 76 -9.639 -35.350 -10.439 1.00 13.44 H new ATOM 0 HD11 ILE A 76 -7.512 -33.797 -7.205 1.00 73.14 H new ATOM 0 HD12 ILE A 76 -7.794 -32.498 -8.388 1.00 73.14 H new ATOM 0 HD13 ILE A 76 -9.029 -33.755 -8.135 1.00 73.14 H new ATOM 1176 N TYR A 77 -8.671 -35.519 -13.556 1.00 3.34 N ATOM 1177 CA TYR A 77 -9.303 -35.295 -14.848 1.00 12.22 C ATOM 1178 C TYR A 77 -10.807 -35.145 -14.658 1.00 34.33 C ATOM 1179 O TYR A 77 -11.354 -35.566 -13.639 1.00 1.44 O ATOM 1180 CB TYR A 77 -9.025 -36.461 -15.806 1.00 23.15 C ATOM 1181 CG TYR A 77 -7.555 -36.731 -16.061 1.00 51.23 C ATOM 1182 CD1 TYR A 77 -6.869 -37.674 -15.315 1.00 62.14 C ATOM 1183 CD2 TYR A 77 -6.856 -36.047 -17.047 1.00 61.02 C ATOM 1184 CE1 TYR A 77 -5.533 -37.937 -15.546 1.00 25.40 C ATOM 1185 CE2 TYR A 77 -5.518 -36.301 -17.284 1.00 34.01 C ATOM 1186 CZ TYR A 77 -4.861 -37.245 -16.529 1.00 2.40 C ATOM 1187 OH TYR A 77 -3.531 -37.507 -16.764 1.00 22.34 O ATOM 0 H TYR A 77 -9.051 -36.314 -13.043 1.00 3.34 H new ATOM 0 HA TYR A 77 -8.888 -34.385 -15.281 1.00 12.22 H new ATOM 0 HB2 TYR A 77 -9.482 -37.364 -15.401 1.00 23.15 H new ATOM 0 HB3 TYR A 77 -9.514 -36.256 -16.758 1.00 23.15 H new ATOM 0 HD1 TYR A 77 -7.388 -38.214 -14.537 1.00 62.14 H new ATOM 0 HD2 TYR A 77 -7.367 -35.303 -17.640 1.00 61.02 H new ATOM 0 HE1 TYR A 77 -5.017 -38.682 -14.958 1.00 25.40 H new ATOM 0 HE2 TYR A 77 -4.991 -35.762 -18.057 1.00 34.01 H new ATOM 0 HH TYR A 77 -3.433 -38.419 -17.109 1.00 22.34 H new ATOM 1197 N LYS A 78 -11.460 -34.548 -15.642 1.00 10.01 N ATOM 1198 CA LYS A 78 -12.906 -34.389 -15.640 1.00 3.41 C ATOM 1199 C LYS A 78 -13.423 -34.703 -17.040 1.00 25.15 C ATOM 1200 O LYS A 78 -13.017 -34.069 -18.024 1.00 45.21 O ATOM 1201 CB LYS A 78 -13.285 -32.965 -15.191 1.00 53.32 C ATOM 1202 CG LYS A 78 -14.786 -32.740 -14.973 1.00 32.43 C ATOM 1203 CD LYS A 78 -15.503 -32.261 -16.234 1.00 31.14 C ATOM 1204 CE LYS A 78 -14.971 -30.912 -16.699 1.00 3.31 C ATOM 1205 NZ LYS A 78 -15.737 -30.376 -17.852 1.00 62.33 N1+ ATOM 0 H LYS A 78 -11.002 -34.159 -16.466 1.00 10.01 H new ATOM 0 HA LYS A 78 -13.368 -35.077 -14.931 1.00 3.41 H new ATOM 0 HB2 LYS A 78 -12.759 -32.739 -14.263 1.00 53.32 H new ATOM 0 HB3 LYS A 78 -12.930 -32.256 -15.939 1.00 53.32 H new ATOM 0 HG2 LYS A 78 -15.242 -33.669 -14.632 1.00 32.43 H new ATOM 0 HG3 LYS A 78 -14.927 -32.006 -14.180 1.00 32.43 H new ATOM 0 HD2 LYS A 78 -15.376 -32.997 -17.028 1.00 31.14 H new ATOM 0 HD3 LYS A 78 -16.573 -32.184 -16.039 1.00 31.14 H new ATOM 0 HE2 LYS A 78 -15.015 -30.202 -15.874 1.00 3.31 H new ATOM 0 HE3 LYS A 78 -13.922 -31.013 -16.977 1.00 3.31 H new ATOM 0 HZ1 LYS A 78 -15.330 -29.465 -18.146 1.00 62.33 H new ATOM 0 HZ2 LYS A 78 -15.689 -31.049 -18.644 1.00 62.33 H new ATOM 0 HZ3 LYS A 78 -16.730 -30.238 -17.575 1.00 62.33 H new ATOM 1219 N ILE A 79 -14.297 -35.699 -17.122 1.00 35.25 N ATOM 1220 CA ILE A 79 -14.747 -36.239 -18.401 1.00 51.22 C ATOM 1221 C ILE A 79 -15.825 -35.357 -19.036 1.00 13.33 C ATOM 1222 O ILE A 79 -16.784 -34.947 -18.378 1.00 3.23 O ATOM 1223 CB ILE A 79 -15.274 -37.692 -18.237 1.00 11.23 C ATOM 1224 CG1 ILE A 79 -15.678 -38.292 -19.597 1.00 75.13 C ATOM 1225 CG2 ILE A 79 -16.443 -37.744 -17.253 1.00 32.21 C ATOM 1226 CD1 ILE A 79 -14.524 -38.437 -20.570 1.00 50.20 C ATOM 0 H ILE A 79 -14.712 -36.154 -16.309 1.00 35.25 H new ATOM 0 HA ILE A 79 -13.884 -36.252 -19.067 1.00 51.22 H new ATOM 0 HB ILE A 79 -14.462 -38.295 -17.830 1.00 11.23 H new ATOM 0 HG12 ILE A 79 -16.127 -39.271 -19.432 1.00 75.13 H new ATOM 0 HG13 ILE A 79 -16.444 -37.662 -20.048 1.00 75.13 H new ATOM 0 HG21 ILE A 79 -16.792 -38.772 -17.157 1.00 32.21 H new ATOM 0 HG22 ILE A 79 -16.115 -37.380 -16.279 1.00 32.21 H new ATOM 0 HG23 ILE A 79 -17.256 -37.117 -17.620 1.00 32.21 H new ATOM 0 HD11 ILE A 79 -14.887 -38.866 -21.504 1.00 50.20 H new ATOM 0 HD12 ILE A 79 -14.088 -37.457 -20.766 1.00 50.20 H new ATOM 0 HD13 ILE A 79 -13.766 -39.092 -20.140 1.00 50.20 H new ATOM 1238 N ASN A 80 -15.643 -35.061 -20.317 1.00 52.33 N ATOM 1239 CA ASN A 80 -16.613 -34.295 -21.094 1.00 2.04 C ATOM 1240 C ASN A 80 -17.473 -35.250 -21.918 1.00 60.11 C ATOM 1241 O ASN A 80 -17.069 -35.704 -22.991 1.00 23.20 O ATOM 1242 CB ASN A 80 -15.907 -33.284 -22.017 1.00 23.44 C ATOM 1243 CG ASN A 80 -15.161 -32.195 -21.256 1.00 12.41 C ATOM 1244 OD1 ASN A 80 -15.547 -31.812 -20.148 1.00 32.04 O ATOM 1245 ND2 ASN A 80 -14.088 -31.687 -21.844 1.00 24.31 N ATOM 0 H ASN A 80 -14.819 -35.345 -20.848 1.00 52.33 H new ATOM 0 HA ASN A 80 -17.247 -33.735 -20.406 1.00 2.04 H new ATOM 0 HB2 ASN A 80 -15.204 -33.816 -22.658 1.00 23.44 H new ATOM 0 HB3 ASN A 80 -16.646 -32.820 -22.670 1.00 23.44 H new ATOM 0 HD21 ASN A 80 -13.551 -30.954 -21.380 1.00 24.31 H new ATOM 0 HD22 ASN A 80 -13.799 -32.029 -22.761 1.00 24.31 H new ATOM 1252 N ILE A 81 -18.641 -35.582 -21.381 1.00 22.21 N ATOM 1253 CA ILE A 81 -19.568 -36.504 -22.028 1.00 54.13 C ATOM 1254 C ILE A 81 -20.991 -36.195 -21.550 1.00 65.23 C ATOM 1255 O ILE A 81 -21.847 -37.072 -21.437 1.00 21.40 O ATOM 1256 CB ILE A 81 -19.175 -37.977 -21.710 1.00 63.43 C ATOM 1257 CG1 ILE A 81 -19.956 -38.963 -22.600 1.00 0.10 C ATOM 1258 CG2 ILE A 81 -19.382 -38.293 -20.224 1.00 45.20 C ATOM 1259 CD1 ILE A 81 -19.711 -38.783 -24.087 1.00 64.23 C ATOM 0 H ILE A 81 -18.972 -35.221 -20.486 1.00 22.21 H new ATOM 0 HA ILE A 81 -19.522 -36.378 -23.110 1.00 54.13 H new ATOM 0 HB ILE A 81 -18.114 -38.095 -21.932 1.00 63.43 H new ATOM 0 HG12 ILE A 81 -19.687 -39.981 -22.319 1.00 0.10 H new ATOM 0 HG13 ILE A 81 -21.022 -38.849 -22.402 1.00 0.10 H new ATOM 0 HG21 ILE A 81 -19.100 -39.328 -20.029 1.00 45.20 H new ATOM 0 HG22 ILE A 81 -18.763 -37.629 -19.621 1.00 45.20 H new ATOM 0 HG23 ILE A 81 -20.430 -38.148 -19.964 1.00 45.20 H new ATOM 0 HD11 ILE A 81 -20.297 -39.515 -24.643 1.00 64.23 H new ATOM 0 HD12 ILE A 81 -20.008 -37.778 -24.386 1.00 64.23 H new ATOM 0 HD13 ILE A 81 -18.652 -38.927 -24.301 1.00 64.23 H new ATOM 1271 N GLU A 82 -21.228 -34.905 -21.321 1.00 34.03 N ATOM 1272 CA GLU A 82 -22.467 -34.406 -20.713 1.00 12.21 C ATOM 1273 C GLU A 82 -23.744 -34.908 -21.408 1.00 64.13 C ATOM 1274 O GLU A 82 -24.832 -34.843 -20.828 1.00 42.22 O ATOM 1275 CB GLU A 82 -22.444 -32.862 -20.680 1.00 14.33 C ATOM 1276 CG GLU A 82 -21.844 -32.204 -21.929 1.00 12.32 C ATOM 1277 CD GLU A 82 -22.561 -32.573 -23.221 1.00 44.14 C ATOM 1278 OE1 GLU A 82 -23.647 -32.017 -23.486 1.00 64.21 O ATOM 1279 OE2 GLU A 82 -22.046 -33.429 -23.974 1.00 51.21 O1- ATOM 0 H GLU A 82 -20.562 -34.168 -21.553 1.00 34.03 H new ATOM 0 HA GLU A 82 -22.502 -34.806 -19.700 1.00 12.21 H new ATOM 0 HB2 GLU A 82 -23.464 -32.500 -20.549 1.00 14.33 H new ATOM 0 HB3 GLU A 82 -21.876 -32.539 -19.807 1.00 14.33 H new ATOM 0 HG2 GLU A 82 -21.870 -31.121 -21.806 1.00 12.32 H new ATOM 0 HG3 GLU A 82 -20.796 -32.490 -22.011 1.00 12.32 H new ATOM 1286 N ASP A 83 -23.621 -35.381 -22.644 1.00 63.52 N ATOM 1287 CA ASP A 83 -24.778 -35.869 -23.401 1.00 11.04 C ATOM 1288 C ASP A 83 -25.159 -37.288 -22.974 1.00 33.50 C ATOM 1289 O ASP A 83 -26.343 -37.635 -22.913 1.00 21.21 O ATOM 1290 CB ASP A 83 -24.485 -35.837 -24.907 1.00 23.45 C ATOM 1291 CG ASP A 83 -25.678 -36.271 -25.751 1.00 52.42 C ATOM 1292 OD1 ASP A 83 -26.492 -35.399 -26.138 1.00 43.25 O ATOM 1293 OD2 ASP A 83 -25.811 -37.479 -26.032 1.00 25.20 O1- ATOM 0 H ASP A 83 -22.735 -35.438 -23.146 1.00 63.52 H new ATOM 0 HA ASP A 83 -25.619 -35.209 -23.187 1.00 11.04 H new ATOM 0 HB2 ASP A 83 -24.191 -34.827 -25.194 1.00 23.45 H new ATOM 0 HB3 ASP A 83 -23.638 -36.489 -25.121 1.00 23.45 H new ATOM 1298 N ASN A 84 -24.153 -38.100 -22.661 1.00 32.21 N ATOM 1299 CA ASN A 84 -24.373 -39.505 -22.326 1.00 13.34 C ATOM 1300 C ASN A 84 -24.453 -39.696 -20.813 1.00 61.05 C ATOM 1301 O ASN A 84 -23.435 -39.685 -20.122 1.00 23.22 O ATOM 1302 CB ASN A 84 -23.253 -40.384 -22.904 1.00 61.11 C ATOM 1303 CG ASN A 84 -23.547 -41.872 -22.770 1.00 73.53 C ATOM 1304 OD1 ASN A 84 -22.651 -42.676 -22.512 1.00 44.50 O ATOM 1305 ND2 ASN A 84 -24.797 -42.253 -22.985 1.00 3.45 N ATOM 0 H ASN A 84 -23.176 -37.809 -22.632 1.00 32.21 H new ATOM 0 HA ASN A 84 -25.322 -39.809 -22.768 1.00 13.34 H new ATOM 0 HB2 ASN A 84 -23.111 -40.139 -23.957 1.00 61.11 H new ATOM 0 HB3 ASN A 84 -22.317 -40.155 -22.394 1.00 61.11 H new ATOM 0 HD21 ASN A 84 -25.044 -43.242 -22.939 1.00 3.45 H new ATOM 0 HD22 ASN A 84 -25.513 -41.558 -23.196 1.00 3.45 H new ATOM 1312 N GLN A 85 -25.668 -39.867 -20.303 1.00 14.34 N ATOM 1313 CA GLN A 85 -25.883 -40.062 -18.872 1.00 73.43 C ATOM 1314 C GLN A 85 -25.501 -41.486 -18.465 1.00 30.44 C ATOM 1315 O GLN A 85 -25.192 -41.749 -17.299 1.00 11.40 O ATOM 1316 CB GLN A 85 -27.349 -39.767 -18.512 1.00 62.01 C ATOM 1317 CG GLN A 85 -27.670 -39.916 -17.026 1.00 14.43 C ATOM 1318 CD GLN A 85 -29.103 -39.527 -16.684 1.00 52.52 C ATOM 1319 OE1 GLN A 85 -29.700 -38.660 -17.325 1.00 30.11 O ATOM 1320 NE2 GLN A 85 -29.670 -40.166 -15.672 1.00 22.33 N ATOM 0 H GLN A 85 -26.522 -39.875 -20.861 1.00 14.34 H new ATOM 0 HA GLN A 85 -25.246 -39.369 -18.323 1.00 73.43 H new ATOM 0 HB2 GLN A 85 -27.591 -38.751 -18.825 1.00 62.01 H new ATOM 0 HB3 GLN A 85 -27.993 -40.438 -19.081 1.00 62.01 H new ATOM 0 HG2 GLN A 85 -27.498 -40.949 -16.725 1.00 14.43 H new ATOM 0 HG3 GLN A 85 -26.984 -39.297 -16.448 1.00 14.43 H new ATOM 0 HE21 GLN A 85 -29.148 -40.879 -15.162 1.00 22.33 H new ATOM 0 HE22 GLN A 85 -30.629 -39.946 -15.403 1.00 22.33 H new ATOM 1329 N ASP A 86 -25.506 -42.396 -19.442 1.00 11.41 N ATOM 1330 CA ASP A 86 -25.158 -43.803 -19.203 1.00 44.11 C ATOM 1331 C ASP A 86 -23.824 -43.922 -18.481 1.00 63.32 C ATOM 1332 O ASP A 86 -23.648 -44.792 -17.629 1.00 33.14 O ATOM 1333 CB ASP A 86 -25.093 -44.590 -20.521 1.00 54.34 C ATOM 1334 CG ASP A 86 -26.445 -44.714 -21.199 1.00 51.54 C ATOM 1335 OD1 ASP A 86 -26.866 -43.751 -21.867 1.00 24.41 O ATOM 1336 OD2 ASP A 86 -27.090 -45.776 -21.074 1.00 5.23 O1- ATOM 0 H ASP A 86 -25.748 -42.185 -20.410 1.00 11.41 H new ATOM 0 HA ASP A 86 -25.942 -44.225 -18.575 1.00 44.11 H new ATOM 0 HB2 ASP A 86 -24.396 -44.098 -21.199 1.00 54.34 H new ATOM 0 HB3 ASP A 86 -24.697 -45.586 -20.325 1.00 54.34 H new ATOM 1341 N VAL A 87 -22.896 -43.028 -18.815 1.00 53.31 N ATOM 1342 CA VAL A 87 -21.566 -43.020 -18.208 1.00 43.31 C ATOM 1343 C VAL A 87 -21.668 -43.002 -16.681 1.00 71.01 C ATOM 1344 O VAL A 87 -20.892 -43.664 -15.989 1.00 44.23 O ATOM 1345 CB VAL A 87 -20.741 -41.798 -18.688 1.00 24.23 C ATOM 1346 CG1 VAL A 87 -19.359 -41.768 -18.036 1.00 42.44 C ATOM 1347 CG2 VAL A 87 -20.618 -41.805 -20.211 1.00 22.14 C ATOM 0 H VAL A 87 -23.042 -42.294 -19.508 1.00 53.31 H new ATOM 0 HA VAL A 87 -21.056 -43.931 -18.521 1.00 43.31 H new ATOM 0 HB VAL A 87 -21.270 -40.895 -18.384 1.00 24.23 H new ATOM 0 HG11 VAL A 87 -18.807 -40.899 -18.394 1.00 42.44 H new ATOM 0 HG12 VAL A 87 -19.469 -41.707 -16.953 1.00 42.44 H new ATOM 0 HG13 VAL A 87 -18.815 -42.676 -18.295 1.00 42.44 H new ATOM 0 HG21 VAL A 87 -20.036 -40.941 -20.533 1.00 22.14 H new ATOM 0 HG22 VAL A 87 -20.118 -42.719 -20.531 1.00 22.14 H new ATOM 0 HG23 VAL A 87 -21.612 -41.760 -20.656 1.00 22.14 H new ATOM 1357 N ALA A 88 -22.655 -42.275 -16.164 1.00 74.24 N ATOM 1358 CA ALA A 88 -22.880 -42.205 -14.726 1.00 11.24 C ATOM 1359 C ALA A 88 -23.276 -43.579 -14.192 1.00 40.14 C ATOM 1360 O ALA A 88 -22.675 -44.091 -13.244 1.00 31.23 O ATOM 1361 CB ALA A 88 -23.956 -41.171 -14.406 1.00 44.41 C ATOM 0 H ALA A 88 -23.311 -41.727 -16.721 1.00 74.24 H new ATOM 0 HA ALA A 88 -21.955 -41.896 -14.238 1.00 11.24 H new ATOM 0 HB1 ALA A 88 -24.113 -41.131 -13.328 1.00 44.41 H new ATOM 0 HB2 ALA A 88 -23.637 -40.192 -14.763 1.00 44.41 H new ATOM 0 HB3 ALA A 88 -24.888 -41.451 -14.898 1.00 44.41 H new ATOM 1367 N THR A 89 -24.268 -44.182 -14.837 1.00 43.13 N ATOM 1368 CA THR A 89 -24.783 -45.487 -14.436 1.00 3.03 C ATOM 1369 C THR A 89 -23.703 -46.568 -14.553 1.00 72.34 C ATOM 1370 O THR A 89 -23.661 -47.509 -13.758 1.00 54.24 O ATOM 1371 CB THR A 89 -26.003 -45.872 -15.308 1.00 23.32 C ATOM 1372 OG1 THR A 89 -26.925 -44.772 -15.359 1.00 72.42 O ATOM 1373 CG2 THR A 89 -26.713 -47.107 -14.760 1.00 3.52 C ATOM 0 H THR A 89 -24.737 -43.782 -15.650 1.00 43.13 H new ATOM 0 HA THR A 89 -25.091 -45.419 -13.393 1.00 3.03 H new ATOM 0 HB THR A 89 -25.642 -46.104 -16.310 1.00 23.32 H new ATOM 0 HG1 THR A 89 -27.696 -45.017 -15.913 1.00 72.42 H new ATOM 0 HG21 THR A 89 -27.564 -47.349 -15.396 1.00 3.52 H new ATOM 0 HG22 THR A 89 -26.020 -47.948 -14.745 1.00 3.52 H new ATOM 0 HG23 THR A 89 -27.062 -46.906 -13.747 1.00 3.52 H new ATOM 1381 N GLN A 90 -22.822 -46.410 -15.538 1.00 45.13 N ATOM 1382 CA GLN A 90 -21.766 -47.383 -15.802 1.00 11.14 C ATOM 1383 C GLN A 90 -20.656 -47.291 -14.758 1.00 24.42 C ATOM 1384 O GLN A 90 -20.218 -48.307 -14.215 1.00 33.43 O ATOM 1385 CB GLN A 90 -21.186 -47.167 -17.209 1.00 21.33 C ATOM 1386 CG GLN A 90 -22.188 -47.414 -18.332 1.00 23.40 C ATOM 1387 CD GLN A 90 -22.763 -48.822 -18.310 1.00 32.12 C ATOM 1388 OE1 GLN A 90 -23.784 -49.080 -17.672 1.00 31.51 O ATOM 1389 NE2 GLN A 90 -22.110 -49.741 -19.002 1.00 52.44 N ATOM 0 H GLN A 90 -22.820 -45.610 -16.171 1.00 45.13 H new ATOM 0 HA GLN A 90 -22.204 -48.379 -15.744 1.00 11.14 H new ATOM 0 HB2 GLN A 90 -20.813 -46.146 -17.285 1.00 21.33 H new ATOM 0 HB3 GLN A 90 -20.331 -47.829 -17.345 1.00 21.33 H new ATOM 0 HG2 GLN A 90 -23.002 -46.693 -18.252 1.00 23.40 H new ATOM 0 HG3 GLN A 90 -21.701 -47.240 -19.292 1.00 23.40 H new ATOM 0 HE21 GLN A 90 -21.267 -49.488 -19.518 1.00 52.44 H new ATOM 0 HE22 GLN A 90 -22.449 -50.703 -19.020 1.00 52.44 H new ATOM 1398 N TYR A 91 -20.209 -46.071 -14.478 1.00 23.00 N ATOM 1399 CA TYR A 91 -19.095 -45.855 -13.554 1.00 63.04 C ATOM 1400 C TYR A 91 -19.576 -45.757 -12.106 1.00 53.41 C ATOM 1401 O TYR A 91 -18.767 -45.719 -11.179 1.00 53.15 O ATOM 1402 CB TYR A 91 -18.300 -44.608 -13.965 1.00 50.03 C ATOM 1403 CG TYR A 91 -17.489 -44.812 -15.238 1.00 40.41 C ATOM 1404 CD1 TYR A 91 -16.117 -45.047 -15.186 1.00 1.24 C ATOM 1405 CD2 TYR A 91 -18.098 -44.787 -16.488 1.00 62.23 C ATOM 1406 CE1 TYR A 91 -15.382 -45.247 -16.339 1.00 31.01 C ATOM 1407 CE2 TYR A 91 -17.367 -44.985 -17.644 1.00 43.30 C ATOM 1408 CZ TYR A 91 -16.012 -45.215 -17.564 1.00 51.11 C ATOM 1409 OH TYR A 91 -15.282 -45.416 -18.714 1.00 21.33 O ATOM 0 H TYR A 91 -20.599 -45.216 -14.876 1.00 23.00 H new ATOM 0 HA TYR A 91 -18.433 -46.719 -13.611 1.00 63.04 H new ATOM 0 HB2 TYR A 91 -18.989 -43.776 -14.109 1.00 50.03 H new ATOM 0 HB3 TYR A 91 -17.628 -44.328 -13.154 1.00 50.03 H new ATOM 0 HD1 TYR A 91 -15.619 -45.073 -14.228 1.00 1.24 H new ATOM 0 HD2 TYR A 91 -19.161 -44.610 -16.557 1.00 62.23 H new ATOM 0 HE1 TYR A 91 -14.319 -45.428 -16.280 1.00 31.01 H new ATOM 0 HE2 TYR A 91 -17.857 -44.959 -18.606 1.00 43.30 H new ATOM 0 HH TYR A 91 -14.370 -45.082 -18.585 1.00 21.33 H new ATOM 1419 N GLY A 92 -20.893 -45.715 -11.915 1.00 22.12 N ATOM 1420 CA GLY A 92 -21.455 -45.796 -10.576 1.00 65.55 C ATOM 1421 C GLY A 92 -21.523 -44.451 -9.878 1.00 41.00 C ATOM 1422 O GLY A 92 -21.171 -44.334 -8.701 1.00 12.12 O ATOM 0 H GLY A 92 -21.581 -45.626 -12.663 1.00 22.12 H new ATOM 0 HA2 GLY A 92 -22.458 -46.220 -10.634 1.00 65.55 H new ATOM 0 HA3 GLY A 92 -20.854 -46.480 -9.977 1.00 65.55 H new ATOM 1426 N VAL A 93 -21.967 -43.435 -10.604 1.00 13.51 N ATOM 1427 CA VAL A 93 -22.174 -42.111 -10.036 1.00 13.34 C ATOM 1428 C VAL A 93 -23.549 -42.052 -9.376 1.00 30.02 C ATOM 1429 O VAL A 93 -24.567 -42.328 -10.019 1.00 73.22 O ATOM 1430 CB VAL A 93 -22.059 -41.005 -11.113 1.00 53.43 C ATOM 1431 CG1 VAL A 93 -22.245 -39.620 -10.494 1.00 75.31 C ATOM 1432 CG2 VAL A 93 -20.716 -41.102 -11.834 1.00 13.21 C ATOM 0 H VAL A 93 -22.192 -43.504 -11.596 1.00 13.51 H new ATOM 0 HA VAL A 93 -21.396 -41.933 -9.293 1.00 13.34 H new ATOM 0 HB VAL A 93 -22.854 -41.154 -11.844 1.00 53.43 H new ATOM 0 HG11 VAL A 93 -22.160 -38.860 -11.271 1.00 75.31 H new ATOM 0 HG12 VAL A 93 -23.230 -39.557 -10.032 1.00 75.31 H new ATOM 0 HG13 VAL A 93 -21.478 -39.453 -9.738 1.00 75.31 H new ATOM 0 HG21 VAL A 93 -20.650 -40.318 -12.588 1.00 13.21 H new ATOM 0 HG22 VAL A 93 -19.907 -40.981 -11.114 1.00 13.21 H new ATOM 0 HG23 VAL A 93 -20.631 -42.076 -12.315 1.00 13.21 H new ATOM 1442 N SER A 94 -23.575 -41.709 -8.092 1.00 15.51 N ATOM 1443 CA SER A 94 -24.817 -41.705 -7.319 1.00 63.12 C ATOM 1444 C SER A 94 -24.921 -40.448 -6.453 1.00 52.01 C ATOM 1445 O SER A 94 -25.848 -40.311 -5.650 1.00 33.01 O ATOM 1446 CB SER A 94 -24.881 -42.971 -6.446 1.00 45.35 C ATOM 1447 OG SER A 94 -26.125 -43.089 -5.770 1.00 22.42 O ATOM 0 H SER A 94 -22.750 -41.429 -7.562 1.00 15.51 H new ATOM 0 HA SER A 94 -25.661 -41.701 -8.009 1.00 63.12 H new ATOM 0 HB2 SER A 94 -24.723 -43.850 -7.070 1.00 45.35 H new ATOM 0 HB3 SER A 94 -24.072 -42.949 -5.716 1.00 45.35 H new ATOM 0 HG SER A 94 -26.378 -42.219 -5.396 1.00 22.42 H new ATOM 1453 N ALA A 95 -23.984 -39.522 -6.629 1.00 12.01 N ATOM 1454 CA ALA A 95 -23.958 -38.297 -5.836 1.00 52.44 C ATOM 1455 C ALA A 95 -23.344 -37.154 -6.634 1.00 22.24 C ATOM 1456 O ALA A 95 -22.891 -37.349 -7.766 1.00 22.21 O ATOM 1457 CB ALA A 95 -23.196 -38.522 -4.535 1.00 0.24 C ATOM 0 H ALA A 95 -23.232 -39.596 -7.314 1.00 12.01 H new ATOM 0 HA ALA A 95 -24.983 -38.023 -5.588 1.00 52.44 H new ATOM 0 HB1 ALA A 95 -23.186 -37.599 -3.955 1.00 0.24 H new ATOM 0 HB2 ALA A 95 -23.685 -39.307 -3.958 1.00 0.24 H new ATOM 0 HB3 ALA A 95 -22.172 -38.821 -4.760 1.00 0.24 H new ATOM 1463 N ILE A 96 -23.336 -35.963 -6.042 1.00 40.13 N ATOM 1464 CA ILE A 96 -22.776 -34.775 -6.681 1.00 41.53 C ATOM 1465 C ILE A 96 -21.767 -34.077 -5.757 1.00 24.21 C ATOM 1466 O ILE A 96 -22.145 -33.477 -4.750 1.00 22.54 O ATOM 1467 CB ILE A 96 -23.890 -33.777 -7.146 1.00 44.03 C ATOM 1468 CG1 ILE A 96 -25.141 -33.833 -6.240 1.00 70.20 C ATOM 1469 CG2 ILE A 96 -24.282 -34.055 -8.593 1.00 72.40 C ATOM 1470 CD1 ILE A 96 -25.026 -33.051 -4.952 1.00 75.51 C ATOM 0 H ILE A 96 -23.715 -35.794 -5.110 1.00 40.13 H new ATOM 0 HA ILE A 96 -22.249 -35.110 -7.574 1.00 41.53 H new ATOM 0 HB ILE A 96 -23.473 -32.773 -7.069 1.00 44.03 H new ATOM 0 HG12 ILE A 96 -25.996 -33.457 -6.802 1.00 70.20 H new ATOM 0 HG13 ILE A 96 -25.351 -34.875 -5.999 1.00 70.20 H new ATOM 0 HG21 ILE A 96 -25.057 -33.353 -8.901 1.00 72.40 H new ATOM 0 HG22 ILE A 96 -23.409 -33.937 -9.235 1.00 72.40 H new ATOM 0 HG23 ILE A 96 -24.660 -35.074 -8.678 1.00 72.40 H new ATOM 0 HD11 ILE A 96 -25.950 -33.149 -4.383 1.00 75.51 H new ATOM 0 HD12 ILE A 96 -24.195 -33.439 -4.364 1.00 75.51 H new ATOM 0 HD13 ILE A 96 -24.850 -32.000 -5.179 1.00 75.51 H new ATOM 1482 N PRO A 97 -20.457 -34.158 -6.073 1.00 41.14 N ATOM 1483 CA PRO A 97 -19.937 -34.884 -7.238 1.00 50.44 C ATOM 1484 C PRO A 97 -19.625 -36.351 -6.924 1.00 2.04 C ATOM 1485 O PRO A 97 -20.111 -36.907 -5.935 1.00 63.12 O ATOM 1486 CB PRO A 97 -18.656 -34.108 -7.546 1.00 4.13 C ATOM 1487 CG PRO A 97 -18.148 -33.683 -6.205 1.00 64.14 C ATOM 1488 CD PRO A 97 -19.361 -33.530 -5.307 1.00 35.15 C ATOM 0 HA PRO A 97 -20.648 -34.930 -8.063 1.00 50.44 H new ATOM 0 HB2 PRO A 97 -17.929 -34.731 -8.067 1.00 4.13 H new ATOM 0 HB3 PRO A 97 -18.856 -33.249 -8.186 1.00 4.13 H new ATOM 0 HG2 PRO A 97 -17.458 -34.423 -5.800 1.00 64.14 H new ATOM 0 HG3 PRO A 97 -17.600 -32.744 -6.279 1.00 64.14 H new ATOM 0 HD2 PRO A 97 -19.211 -34.024 -4.347 1.00 35.15 H new ATOM 0 HD3 PRO A 97 -19.572 -32.481 -5.096 1.00 35.15 H new ATOM 1496 N THR A 98 -18.832 -36.978 -7.784 1.00 51.24 N ATOM 1497 CA THR A 98 -18.402 -38.356 -7.588 1.00 74.00 C ATOM 1498 C THR A 98 -16.995 -38.538 -8.152 1.00 5.01 C ATOM 1499 O THR A 98 -16.734 -38.205 -9.313 1.00 43.51 O ATOM 1500 CB THR A 98 -19.378 -39.360 -8.253 1.00 21.00 C ATOM 1501 OG1 THR A 98 -20.685 -39.251 -7.655 1.00 33.40 O ATOM 1502 CG2 THR A 98 -18.879 -40.797 -8.116 1.00 73.42 C ATOM 0 H THR A 98 -18.470 -36.547 -8.634 1.00 51.24 H new ATOM 0 HA THR A 98 -18.398 -38.561 -6.518 1.00 74.00 H new ATOM 0 HB THR A 98 -19.434 -39.113 -9.313 1.00 21.00 H new ATOM 0 HG1 THR A 98 -21.094 -38.399 -7.915 1.00 33.40 H new ATOM 0 HG21 THR A 98 -19.587 -41.475 -8.593 1.00 73.42 H new ATOM 0 HG22 THR A 98 -17.905 -40.892 -8.597 1.00 73.42 H new ATOM 0 HG23 THR A 98 -18.788 -41.051 -7.060 1.00 73.42 H new ATOM 1510 N ILE A 99 -16.093 -39.051 -7.314 1.00 33.32 N ATOM 1511 CA ILE A 99 -14.682 -39.179 -7.665 1.00 62.41 C ATOM 1512 C ILE A 99 -14.271 -40.647 -7.778 1.00 30.42 C ATOM 1513 O ILE A 99 -14.372 -41.404 -6.809 1.00 23.12 O ATOM 1514 CB ILE A 99 -13.788 -38.501 -6.594 1.00 11.51 C ATOM 1515 CG1 ILE A 99 -14.174 -37.021 -6.411 1.00 44.42 C ATOM 1516 CG2 ILE A 99 -12.305 -38.635 -6.956 1.00 43.23 C ATOM 1517 CD1 ILE A 99 -13.984 -36.173 -7.653 1.00 13.43 C ATOM 0 H ILE A 99 -16.320 -39.387 -6.378 1.00 33.32 H new ATOM 0 HA ILE A 99 -14.545 -38.689 -8.629 1.00 62.41 H new ATOM 0 HB ILE A 99 -13.953 -39.013 -5.646 1.00 11.51 H new ATOM 0 HG12 ILE A 99 -15.218 -36.965 -6.102 1.00 44.42 H new ATOM 0 HG13 ILE A 99 -13.579 -36.599 -5.601 1.00 44.42 H new ATOM 0 HG21 ILE A 99 -11.698 -38.152 -6.190 1.00 43.23 H new ATOM 0 HG22 ILE A 99 -12.039 -39.690 -7.017 1.00 43.23 H new ATOM 0 HG23 ILE A 99 -12.121 -38.158 -7.919 1.00 43.23 H new ATOM 0 HD11 ILE A 99 -14.278 -35.145 -7.440 1.00 13.43 H new ATOM 0 HD12 ILE A 99 -12.936 -36.196 -7.952 1.00 13.43 H new ATOM 0 HD13 ILE A 99 -14.601 -36.567 -8.461 1.00 13.43 H new ATOM 1529 N LEU A 100 -13.814 -41.044 -8.960 1.00 43.14 N ATOM 1530 CA LEU A 100 -13.231 -42.373 -9.160 1.00 54.31 C ATOM 1531 C LEU A 100 -11.710 -42.261 -9.168 1.00 72.51 C ATOM 1532 O LEU A 100 -11.170 -41.223 -9.545 1.00 11.02 O ATOM 1533 CB LEU A 100 -13.715 -43.000 -10.481 1.00 62.44 C ATOM 1534 CG LEU A 100 -15.154 -43.547 -10.481 1.00 2.41 C ATOM 1535 CD1 LEU A 100 -16.182 -42.430 -10.280 1.00 3.04 C ATOM 1536 CD2 LEU A 100 -15.431 -44.316 -11.770 1.00 53.13 C ATOM 0 H LEU A 100 -13.834 -40.465 -9.799 1.00 43.14 H new ATOM 0 HA LEU A 100 -13.552 -43.019 -8.342 1.00 54.31 H new ATOM 0 HB2 LEU A 100 -13.633 -42.250 -11.268 1.00 62.44 H new ATOM 0 HB3 LEU A 100 -13.038 -43.813 -10.744 1.00 62.44 H new ATOM 0 HG LEU A 100 -15.251 -44.233 -9.639 1.00 2.41 H new ATOM 0 HD11 LEU A 100 -17.186 -42.854 -10.286 1.00 3.04 H new ATOM 0 HD12 LEU A 100 -16.002 -41.937 -9.325 1.00 3.04 H new ATOM 0 HD13 LEU A 100 -16.091 -41.702 -11.086 1.00 3.04 H new ATOM 0 HD21 LEU A 100 -16.452 -44.696 -11.754 1.00 53.13 H new ATOM 0 HD22 LEU A 100 -15.304 -43.651 -12.625 1.00 53.13 H new ATOM 0 HD23 LEU A 100 -14.734 -45.150 -11.853 1.00 53.13 H new ATOM 1548 N MET A 101 -11.014 -43.306 -8.731 1.00 11.43 N ATOM 1549 CA MET A 101 -9.554 -43.311 -8.777 1.00 4.10 C ATOM 1550 C MET A 101 -9.049 -44.399 -9.723 1.00 43.12 C ATOM 1551 O MET A 101 -9.667 -45.455 -9.860 1.00 65.12 O ATOM 1552 CB MET A 101 -8.956 -43.524 -7.374 1.00 31.24 C ATOM 1553 CG MET A 101 -9.519 -42.590 -6.310 1.00 63.31 C ATOM 1554 SD MET A 101 -8.487 -42.499 -4.835 1.00 12.02 S ATOM 1555 CE MET A 101 -9.233 -41.097 -4.007 1.00 54.53 C ATOM 0 H MET A 101 -11.431 -44.153 -8.345 1.00 11.43 H new ATOM 0 HA MET A 101 -9.232 -42.338 -9.148 1.00 4.10 H new ATOM 0 HB2 MET A 101 -9.133 -44.555 -7.068 1.00 31.24 H new ATOM 0 HB3 MET A 101 -7.876 -43.388 -7.427 1.00 31.24 H new ATOM 0 HG2 MET A 101 -9.628 -41.591 -6.732 1.00 63.31 H new ATOM 0 HG3 MET A 101 -10.516 -42.928 -6.029 1.00 63.31 H new ATOM 0 HE1 MET A 101 -8.635 -40.828 -3.136 1.00 54.53 H new ATOM 0 HE2 MET A 101 -9.277 -40.251 -4.692 1.00 54.53 H new ATOM 0 HE3 MET A 101 -10.242 -41.358 -3.688 1.00 54.53 H new ATOM 1565 N PHE A 102 -7.930 -44.119 -10.380 1.00 13.11 N ATOM 1566 CA PHE A 102 -7.224 -45.092 -11.214 1.00 71.35 C ATOM 1567 C PHE A 102 -5.726 -44.850 -11.066 1.00 34.00 C ATOM 1568 O PHE A 102 -5.310 -43.722 -10.802 1.00 61.02 O ATOM 1569 CB PHE A 102 -7.634 -44.966 -12.694 1.00 21.10 C ATOM 1570 CG PHE A 102 -9.085 -45.286 -12.963 1.00 2.32 C ATOM 1571 CD1 PHE A 102 -10.015 -44.271 -13.147 1.00 2.42 C ATOM 1572 CD2 PHE A 102 -9.519 -46.604 -13.030 1.00 24.22 C ATOM 1573 CE1 PHE A 102 -11.344 -44.563 -13.391 1.00 61.40 C ATOM 1574 CE2 PHE A 102 -10.847 -46.900 -13.273 1.00 73.14 C ATOM 1575 CZ PHE A 102 -11.760 -45.879 -13.454 1.00 3.41 C ATOM 0 H PHE A 102 -7.481 -43.204 -10.351 1.00 13.11 H new ATOM 0 HA PHE A 102 -7.484 -46.099 -10.888 1.00 71.35 H new ATOM 0 HB2 PHE A 102 -7.429 -43.950 -13.031 1.00 21.10 H new ATOM 0 HB3 PHE A 102 -7.010 -45.632 -13.290 1.00 21.10 H new ATOM 0 HD1 PHE A 102 -9.696 -43.240 -13.099 1.00 2.42 H new ATOM 0 HD2 PHE A 102 -8.810 -47.407 -12.891 1.00 24.22 H new ATOM 0 HE1 PHE A 102 -12.056 -43.763 -13.532 1.00 61.40 H new ATOM 0 HE2 PHE A 102 -11.171 -47.929 -13.321 1.00 73.14 H new ATOM 0 HZ PHE A 102 -12.798 -46.109 -13.645 1.00 3.41 H new ATOM 1585 N LYS A 103 -4.909 -45.890 -11.212 1.00 14.01 N ATOM 1586 CA LYS A 103 -3.459 -45.724 -11.081 1.00 2.12 C ATOM 1587 C LYS A 103 -2.716 -46.716 -11.964 1.00 22.12 C ATOM 1588 O LYS A 103 -2.885 -47.925 -11.821 1.00 72.21 O ATOM 1589 CB LYS A 103 -3.035 -45.889 -9.615 1.00 74.24 C ATOM 1590 CG LYS A 103 -1.551 -45.629 -9.360 1.00 43.03 C ATOM 1591 CD LYS A 103 -1.228 -45.554 -7.867 1.00 41.12 C ATOM 1592 CE LYS A 103 -1.544 -46.856 -7.142 1.00 53.33 C ATOM 1593 NZ LYS A 103 -1.234 -46.770 -5.691 1.00 71.52 N1+ ATOM 0 H LYS A 103 -5.216 -46.841 -11.417 1.00 14.01 H new ATOM 0 HA LYS A 103 -3.199 -44.718 -11.410 1.00 2.12 H new ATOM 0 HB2 LYS A 103 -3.623 -45.208 -8.999 1.00 74.24 H new ATOM 0 HB3 LYS A 103 -3.276 -46.901 -9.290 1.00 74.24 H new ATOM 0 HG2 LYS A 103 -0.960 -46.422 -9.819 1.00 43.03 H new ATOM 0 HG3 LYS A 103 -1.259 -44.695 -9.841 1.00 43.03 H new ATOM 0 HD2 LYS A 103 -0.172 -45.315 -7.737 1.00 41.12 H new ATOM 0 HD3 LYS A 103 -1.797 -44.741 -7.415 1.00 41.12 H new ATOM 0 HE2 LYS A 103 -2.598 -47.099 -7.274 1.00 53.33 H new ATOM 0 HE3 LYS A 103 -0.971 -47.669 -7.588 1.00 53.33 H new ATOM 0 HZ1 LYS A 103 -1.899 -47.366 -5.158 1.00 71.52 H new ATOM 0 HZ2 LYS A 103 -0.262 -47.101 -5.523 1.00 71.52 H new ATOM 0 HZ3 LYS A 103 -1.323 -45.783 -5.375 1.00 71.52 H new ATOM 1607 N ASN A 104 -1.904 -46.189 -12.884 1.00 41.43 N ATOM 1608 CA ASN A 104 -1.111 -47.010 -13.805 1.00 72.22 C ATOM 1609 C ASN A 104 -2.039 -47.850 -14.685 1.00 0.14 C ATOM 1610 O ASN A 104 -1.671 -48.922 -15.169 1.00 72.20 O ATOM 1611 CB ASN A 104 -0.128 -47.902 -13.020 1.00 20.21 C ATOM 1612 CG ASN A 104 1.007 -48.438 -13.883 1.00 24.30 C ATOM 1613 OD1 ASN A 104 2.035 -47.781 -14.047 1.00 10.43 O ATOM 1614 ND2 ASN A 104 0.842 -49.636 -14.418 1.00 31.24 N ATOM 0 H ASN A 104 -1.777 -45.185 -13.012 1.00 41.43 H new ATOM 0 HA ASN A 104 -0.525 -46.357 -14.451 1.00 72.22 H new ATOM 0 HB2 ASN A 104 0.291 -47.330 -12.192 1.00 20.21 H new ATOM 0 HB3 ASN A 104 -0.674 -48.740 -12.585 1.00 20.21 H new ATOM 0 HD21 ASN A 104 1.581 -50.046 -14.989 1.00 31.24 H new ATOM 0 HD22 ASN A 104 -0.024 -50.150 -14.260 1.00 31.24 H new ATOM 1621 N GLY A 105 -3.252 -47.336 -14.893 1.00 32.31 N ATOM 1622 CA GLY A 105 -4.255 -48.049 -15.669 1.00 42.31 C ATOM 1623 C GLY A 105 -4.949 -49.127 -14.859 1.00 34.43 C ATOM 1624 O GLY A 105 -5.876 -49.779 -15.346 1.00 43.11 O ATOM 0 H GLY A 105 -3.558 -46.432 -14.534 1.00 32.31 H new ATOM 0 HA2 GLY A 105 -4.997 -47.341 -16.038 1.00 42.31 H new ATOM 0 HA3 GLY A 105 -3.783 -48.500 -16.542 1.00 42.31 H new ATOM 1628 N LYS A 106 -4.504 -49.307 -13.617 1.00 12.22 N ATOM 1629 CA LYS A 106 -5.047 -50.333 -12.735 1.00 63.04 C ATOM 1630 C LYS A 106 -6.206 -49.759 -11.922 1.00 35.11 C ATOM 1631 O LYS A 106 -6.206 -48.564 -11.585 1.00 44.30 O ATOM 1632 CB LYS A 106 -3.938 -50.868 -11.816 1.00 13.01 C ATOM 1633 CG LYS A 106 -4.384 -51.971 -10.862 1.00 24.15 C ATOM 1634 CD LYS A 106 -3.198 -52.594 -10.128 1.00 53.23 C ATOM 1635 CE LYS A 106 -2.416 -51.567 -9.314 1.00 13.04 C ATOM 1636 NZ LYS A 106 -1.250 -52.181 -8.623 1.00 41.10 N1+ ATOM 0 H LYS A 106 -3.761 -48.748 -13.197 1.00 12.22 H new ATOM 0 HA LYS A 106 -5.428 -51.163 -13.331 1.00 63.04 H new ATOM 0 HB2 LYS A 106 -3.123 -51.247 -12.433 1.00 13.01 H new ATOM 0 HB3 LYS A 106 -3.537 -50.040 -11.232 1.00 13.01 H new ATOM 0 HG2 LYS A 106 -5.088 -51.563 -10.137 1.00 24.15 H new ATOM 0 HG3 LYS A 106 -4.914 -52.743 -11.420 1.00 24.15 H new ATOM 0 HD2 LYS A 106 -3.557 -53.382 -9.466 1.00 53.23 H new ATOM 0 HD3 LYS A 106 -2.532 -53.064 -10.852 1.00 53.23 H new ATOM 0 HE2 LYS A 106 -2.070 -50.769 -9.971 1.00 13.04 H new ATOM 0 HE3 LYS A 106 -3.076 -51.109 -8.577 1.00 13.04 H new ATOM 0 HZ1 LYS A 106 -0.744 -51.452 -8.081 1.00 41.10 H new ATOM 0 HZ2 LYS A 106 -1.582 -52.925 -7.977 1.00 41.10 H new ATOM 0 HZ3 LYS A 106 -0.608 -52.596 -9.328 1.00 41.10 H new ATOM 1650 N LYS A 107 -7.187 -50.612 -11.619 1.00 44.23 N ATOM 1651 CA LYS A 107 -8.414 -50.182 -10.957 1.00 71.41 C ATOM 1652 C LYS A 107 -8.133 -49.752 -9.515 1.00 52.45 C ATOM 1653 O LYS A 107 -7.416 -50.425 -8.770 1.00 11.33 O ATOM 1654 CB LYS A 107 -9.472 -51.301 -11.014 1.00 63.10 C ATOM 1655 CG LYS A 107 -10.903 -50.833 -10.717 1.00 42.24 C ATOM 1656 CD LYS A 107 -11.273 -50.951 -9.236 1.00 71.43 C ATOM 1657 CE LYS A 107 -11.381 -52.408 -8.792 1.00 14.53 C ATOM 1658 NZ LYS A 107 -11.850 -52.529 -7.385 1.00 70.01 N1+ ATOM 0 H LYS A 107 -7.152 -51.610 -11.825 1.00 44.23 H new ATOM 0 HA LYS A 107 -8.810 -49.315 -11.486 1.00 71.41 H new ATOM 0 HB2 LYS A 107 -9.449 -51.756 -12.004 1.00 63.10 H new ATOM 0 HB3 LYS A 107 -9.201 -52.078 -10.299 1.00 63.10 H new ATOM 0 HG2 LYS A 107 -11.013 -49.795 -11.032 1.00 42.24 H new ATOM 0 HG3 LYS A 107 -11.603 -51.422 -11.309 1.00 42.24 H new ATOM 0 HD2 LYS A 107 -10.522 -50.442 -8.632 1.00 71.43 H new ATOM 0 HD3 LYS A 107 -12.222 -50.445 -9.057 1.00 71.43 H new ATOM 0 HE2 LYS A 107 -12.070 -52.937 -9.450 1.00 14.53 H new ATOM 0 HE3 LYS A 107 -10.409 -52.891 -8.893 1.00 14.53 H new ATOM 0 HZ1 LYS A 107 -11.909 -53.534 -7.124 1.00 70.01 H new ATOM 0 HZ2 LYS A 107 -11.180 -52.046 -6.753 1.00 70.01 H new ATOM 0 HZ3 LYS A 107 -12.789 -52.092 -7.293 1.00 70.01 H new ATOM 1672 N LEU A 108 -8.727 -48.629 -9.147 1.00 60.01 N ATOM 1673 CA LEU A 108 -8.485 -47.943 -7.882 1.00 60.42 C ATOM 1674 C LEU A 108 -9.825 -47.510 -7.288 1.00 41.03 C ATOM 1675 O LEU A 108 -10.857 -47.583 -7.958 1.00 12.22 O ATOM 1676 CB LEU A 108 -7.521 -46.750 -8.054 1.00 52.31 C ATOM 1677 CG LEU A 108 -6.132 -46.909 -7.404 1.00 61.41 C ATOM 1678 CD1 LEU A 108 -6.260 -47.080 -5.891 1.00 21.14 C ATOM 1679 CD2 LEU A 108 -5.369 -48.081 -8.021 1.00 11.12 C ATOM 0 H LEU A 108 -9.411 -48.153 -9.735 1.00 60.01 H new ATOM 0 HA LEU A 108 -7.995 -48.630 -7.191 1.00 60.42 H new ATOM 0 HB2 LEU A 108 -7.384 -46.569 -9.120 1.00 52.31 H new ATOM 0 HB3 LEU A 108 -7.996 -45.861 -7.639 1.00 52.31 H new ATOM 0 HG LEU A 108 -5.563 -46.000 -7.597 1.00 61.41 H new ATOM 0 HD11 LEU A 108 -5.268 -47.191 -5.452 1.00 21.14 H new ATOM 0 HD12 LEU A 108 -6.749 -46.204 -5.466 1.00 21.14 H new ATOM 0 HD13 LEU A 108 -6.854 -47.968 -5.674 1.00 21.14 H new ATOM 0 HD21 LEU A 108 -4.393 -48.171 -7.545 1.00 11.12 H new ATOM 0 HD22 LEU A 108 -5.933 -49.002 -7.870 1.00 11.12 H new ATOM 0 HD23 LEU A 108 -5.237 -47.907 -9.089 1.00 11.12 H new ATOM 1691 N SER A 109 -9.812 -47.089 -6.031 1.00 60.43 N ATOM 1692 CA SER A 109 -11.030 -46.932 -5.242 1.00 11.20 C ATOM 1693 C SER A 109 -11.881 -45.756 -5.730 1.00 20.34 C ATOM 1694 O SER A 109 -11.444 -44.933 -6.535 1.00 72.41 O ATOM 1695 CB SER A 109 -10.631 -46.682 -3.774 1.00 32.42 C ATOM 1696 OG SER A 109 -10.997 -47.770 -2.938 1.00 42.25 O ATOM 0 H SER A 109 -8.958 -46.846 -5.528 1.00 60.43 H new ATOM 0 HA SER A 109 -11.624 -47.840 -5.345 1.00 11.20 H new ATOM 0 HB2 SER A 109 -9.555 -46.521 -3.712 1.00 32.42 H new ATOM 0 HB3 SER A 109 -11.111 -45.771 -3.417 1.00 32.42 H new ATOM 0 HG SER A 109 -10.728 -47.579 -2.015 1.00 42.25 H new ATOM 1702 N GLN A 110 -13.119 -45.714 -5.247 1.00 61.23 N ATOM 1703 CA GLN A 110 -14.082 -44.698 -5.649 1.00 74.54 C ATOM 1704 C GLN A 110 -14.710 -44.055 -4.415 1.00 60.21 C ATOM 1705 O GLN A 110 -15.192 -44.755 -3.520 1.00 10.33 O ATOM 1706 CB GLN A 110 -15.176 -45.333 -6.524 1.00 11.44 C ATOM 1707 CG GLN A 110 -16.140 -44.328 -7.146 1.00 71.21 C ATOM 1708 CD GLN A 110 -17.247 -44.987 -7.957 1.00 13.41 C ATOM 1709 OE1 GLN A 110 -17.092 -46.103 -8.457 1.00 25.31 O ATOM 1710 NE2 GLN A 110 -18.358 -44.282 -8.132 1.00 4.42 N ATOM 0 H GLN A 110 -13.481 -46.383 -4.567 1.00 61.23 H new ATOM 0 HA GLN A 110 -13.567 -43.929 -6.224 1.00 74.54 H new ATOM 0 HB2 GLN A 110 -14.702 -45.906 -7.321 1.00 11.44 H new ATOM 0 HB3 GLN A 110 -15.745 -46.039 -5.919 1.00 11.44 H new ATOM 0 HG2 GLN A 110 -16.587 -43.725 -6.356 1.00 71.21 H new ATOM 0 HG3 GLN A 110 -15.582 -43.648 -7.789 1.00 71.21 H new ATOM 0 HE21 GLN A 110 -18.451 -43.361 -7.703 1.00 4.42 H new ATOM 0 HE22 GLN A 110 -19.119 -44.661 -8.696 1.00 4.42 H new ATOM 1719 N VAL A 111 -14.686 -42.726 -4.362 1.00 70.11 N ATOM 1720 CA VAL A 111 -15.340 -41.981 -3.292 1.00 60.35 C ATOM 1721 C VAL A 111 -16.515 -41.182 -3.862 1.00 22.32 C ATOM 1722 O VAL A 111 -16.339 -40.223 -4.622 1.00 33.31 O ATOM 1723 CB VAL A 111 -14.351 -41.052 -2.532 1.00 32.14 C ATOM 1724 CG1 VAL A 111 -13.370 -41.880 -1.697 1.00 22.02 C ATOM 1725 CG2 VAL A 111 -13.594 -40.142 -3.495 1.00 44.03 C ATOM 0 H VAL A 111 -14.217 -42.140 -5.053 1.00 70.11 H new ATOM 0 HA VAL A 111 -15.714 -42.700 -2.563 1.00 60.35 H new ATOM 0 HB VAL A 111 -14.935 -40.421 -1.862 1.00 32.14 H new ATOM 0 HG11 VAL A 111 -12.686 -41.213 -1.172 1.00 22.02 H new ATOM 0 HG12 VAL A 111 -13.923 -42.477 -0.971 1.00 22.02 H new ATOM 0 HG13 VAL A 111 -12.802 -42.541 -2.352 1.00 22.02 H new ATOM 0 HG21 VAL A 111 -12.911 -39.505 -2.933 1.00 44.03 H new ATOM 0 HG22 VAL A 111 -13.026 -40.750 -4.200 1.00 44.03 H new ATOM 0 HG23 VAL A 111 -14.303 -39.520 -4.041 1.00 44.03 H new ATOM 1735 N ILE A 112 -17.717 -41.622 -3.519 1.00 51.33 N ATOM 1736 CA ILE A 112 -18.947 -41.035 -4.037 1.00 62.14 C ATOM 1737 C ILE A 112 -19.511 -40.027 -3.039 1.00 15.21 C ATOM 1738 O ILE A 112 -19.768 -40.372 -1.883 1.00 22.02 O ATOM 1739 CB ILE A 112 -20.014 -42.131 -4.312 1.00 32.24 C ATOM 1740 CG1 ILE A 112 -19.426 -43.245 -5.194 1.00 3.11 C ATOM 1741 CG2 ILE A 112 -21.257 -41.526 -4.965 1.00 52.53 C ATOM 1742 CD1 ILE A 112 -20.380 -44.396 -5.455 1.00 61.34 C ATOM 0 H ILE A 112 -17.868 -42.397 -2.873 1.00 51.33 H new ATOM 0 HA ILE A 112 -18.708 -40.531 -4.974 1.00 62.14 H new ATOM 0 HB ILE A 112 -20.310 -42.567 -3.358 1.00 32.24 H new ATOM 0 HG12 ILE A 112 -19.122 -42.816 -6.149 1.00 3.11 H new ATOM 0 HG13 ILE A 112 -18.526 -43.634 -4.718 1.00 3.11 H new ATOM 0 HG21 ILE A 112 -21.990 -42.311 -5.148 1.00 52.53 H new ATOM 0 HG22 ILE A 112 -21.687 -40.775 -4.302 1.00 52.53 H new ATOM 0 HG23 ILE A 112 -20.981 -41.060 -5.911 1.00 52.53 H new ATOM 0 HD11 ILE A 112 -19.890 -45.139 -6.084 1.00 61.34 H new ATOM 0 HD12 ILE A 112 -20.666 -44.854 -4.508 1.00 61.34 H new ATOM 0 HD13 ILE A 112 -21.271 -44.023 -5.961 1.00 61.34 H new ATOM 1754 N GLY A 113 -19.695 -38.789 -3.482 1.00 41.41 N ATOM 1755 CA GLY A 113 -20.234 -37.755 -2.619 1.00 14.45 C ATOM 1756 C GLY A 113 -19.279 -36.590 -2.474 1.00 3.03 C ATOM 1757 O GLY A 113 -18.338 -36.452 -3.258 1.00 60.32 O ATOM 0 H GLY A 113 -19.479 -38.481 -4.430 1.00 41.41 H new ATOM 0 HA2 GLY A 113 -21.181 -37.400 -3.025 1.00 14.45 H new ATOM 0 HA3 GLY A 113 -20.446 -38.176 -1.636 1.00 14.45 H new ATOM 1761 N ALA A 114 -19.509 -35.757 -1.467 1.00 12.52 N ATOM 1762 CA ALA A 114 -18.693 -34.575 -1.238 1.00 24.52 C ATOM 1763 C ALA A 114 -18.117 -34.583 0.174 1.00 0.33 C ATOM 1764 O ALA A 114 -18.563 -33.831 1.048 1.00 33.13 O ATOM 1765 CB ALA A 114 -19.516 -33.319 -1.483 1.00 15.11 C ATOM 0 H ALA A 114 -20.262 -35.882 -0.791 1.00 12.52 H new ATOM 0 HA ALA A 114 -17.858 -34.584 -1.938 1.00 24.52 H new ATOM 0 HB1 ALA A 114 -18.897 -32.439 -1.309 1.00 15.11 H new ATOM 0 HB2 ALA A 114 -19.874 -33.313 -2.513 1.00 15.11 H new ATOM 0 HB3 ALA A 114 -20.368 -33.304 -0.803 1.00 15.11 H new ATOM 1771 N ASP A 115 -17.144 -35.459 0.395 1.00 64.24 N ATOM 1772 CA ASP A 115 -16.464 -35.554 1.683 1.00 1.22 C ATOM 1773 C ASP A 115 -14.961 -35.405 1.473 1.00 22.24 C ATOM 1774 O ASP A 115 -14.257 -36.383 1.198 1.00 33.32 O ATOM 1775 CB ASP A 115 -16.787 -36.889 2.369 1.00 64.14 C ATOM 1776 CG ASP A 115 -16.414 -36.895 3.843 1.00 52.23 C ATOM 1777 OD1 ASP A 115 -15.243 -37.170 4.169 1.00 51.14 O ATOM 1778 OD2 ASP A 115 -17.303 -36.634 4.684 1.00 30.13 O1- ATOM 0 H ASP A 115 -16.806 -36.118 -0.306 1.00 64.24 H new ATOM 0 HA ASP A 115 -16.815 -34.753 2.333 1.00 1.22 H new ATOM 0 HB2 ASP A 115 -17.852 -37.097 2.267 1.00 64.14 H new ATOM 0 HB3 ASP A 115 -16.255 -37.693 1.860 1.00 64.14 H new ATOM 1783 N ILE A 116 -14.481 -34.170 1.581 1.00 10.14 N ATOM 1784 CA ILE A 116 -13.092 -33.848 1.265 1.00 23.23 C ATOM 1785 C ILE A 116 -12.138 -34.605 2.186 1.00 50.32 C ATOM 1786 O ILE A 116 -11.012 -34.922 1.803 1.00 24.53 O ATOM 1787 CB ILE A 116 -12.820 -32.321 1.364 1.00 35.22 C ATOM 1788 CG1 ILE A 116 -11.480 -31.967 0.697 1.00 23.43 C ATOM 1789 CG2 ILE A 116 -12.838 -31.851 2.819 1.00 34.43 C ATOM 1790 CD1 ILE A 116 -11.449 -32.254 -0.790 1.00 62.15 C ATOM 0 H ILE A 116 -15.037 -33.371 1.887 1.00 10.14 H new ATOM 0 HA ILE A 116 -12.916 -34.158 0.235 1.00 23.23 H new ATOM 0 HB ILE A 116 -13.619 -31.802 0.834 1.00 35.22 H new ATOM 0 HG12 ILE A 116 -11.271 -30.910 0.859 1.00 23.43 H new ATOM 0 HG13 ILE A 116 -10.682 -32.528 1.184 1.00 23.43 H new ATOM 0 HG21 ILE A 116 -12.645 -30.779 2.857 1.00 34.43 H new ATOM 0 HG22 ILE A 116 -13.814 -32.060 3.257 1.00 34.43 H new ATOM 0 HG23 ILE A 116 -12.068 -32.379 3.381 1.00 34.43 H new ATOM 0 HD11 ILE A 116 -10.474 -31.980 -1.193 1.00 62.15 H new ATOM 0 HD12 ILE A 116 -11.626 -33.316 -0.959 1.00 62.15 H new ATOM 0 HD13 ILE A 116 -12.224 -31.673 -1.289 1.00 62.15 H new ATOM 1802 N SER A 117 -12.609 -34.910 3.390 1.00 64.32 N ATOM 1803 CA SER A 117 -11.819 -35.651 4.362 1.00 24.52 C ATOM 1804 C SER A 117 -11.543 -37.063 3.842 1.00 72.20 C ATOM 1805 O SER A 117 -10.405 -37.548 3.884 1.00 63.13 O ATOM 1806 CB SER A 117 -12.557 -35.702 5.707 1.00 2.24 C ATOM 1807 OG SER A 117 -11.729 -36.228 6.731 1.00 54.32 O ATOM 0 H SER A 117 -13.541 -34.653 3.716 1.00 64.32 H new ATOM 0 HA SER A 117 -10.865 -35.145 4.511 1.00 24.52 H new ATOM 0 HB2 SER A 117 -12.886 -34.700 5.982 1.00 2.24 H new ATOM 0 HB3 SER A 117 -13.452 -36.316 5.610 1.00 2.24 H new ATOM 0 HG SER A 117 -12.225 -36.247 7.576 1.00 54.32 H new ATOM 1813 N LYS A 118 -12.587 -37.705 3.322 1.00 24.02 N ATOM 1814 CA LYS A 118 -12.471 -39.048 2.765 1.00 23.25 C ATOM 1815 C LYS A 118 -11.631 -39.013 1.495 1.00 51.14 C ATOM 1816 O LYS A 118 -10.825 -39.912 1.245 1.00 44.54 O ATOM 1817 CB LYS A 118 -13.864 -39.631 2.470 1.00 55.14 C ATOM 1818 CG LYS A 118 -13.841 -41.078 1.977 1.00 21.34 C ATOM 1819 CD LYS A 118 -13.196 -42.013 2.999 1.00 32.24 C ATOM 1820 CE LYS A 118 -13.985 -42.069 4.304 1.00 45.55 C ATOM 1821 NZ LYS A 118 -13.279 -42.857 5.348 1.00 20.35 N1+ ATOM 0 H LYS A 118 -13.527 -37.313 3.276 1.00 24.02 H new ATOM 0 HA LYS A 118 -11.979 -39.689 3.496 1.00 23.25 H new ATOM 0 HB2 LYS A 118 -14.469 -39.576 3.375 1.00 55.14 H new ATOM 0 HB3 LYS A 118 -14.355 -39.010 1.720 1.00 55.14 H new ATOM 0 HG2 LYS A 118 -14.859 -41.409 1.773 1.00 21.34 H new ATOM 0 HG3 LYS A 118 -13.293 -41.133 1.036 1.00 21.34 H new ATOM 0 HD2 LYS A 118 -13.123 -43.015 2.577 1.00 32.24 H new ATOM 0 HD3 LYS A 118 -12.179 -41.678 3.205 1.00 32.24 H new ATOM 0 HE2 LYS A 118 -14.156 -41.056 4.668 1.00 45.55 H new ATOM 0 HE3 LYS A 118 -14.964 -42.510 4.117 1.00 45.55 H new ATOM 0 HZ1 LYS A 118 -13.849 -42.870 6.218 1.00 20.35 H new ATOM 0 HZ2 LYS A 118 -13.138 -43.831 5.012 1.00 20.35 H new ATOM 0 HZ3 LYS A 118 -12.355 -42.422 5.546 1.00 20.35 H new ATOM 1835 N ILE A 119 -11.819 -37.958 0.703 1.00 22.14 N ATOM 1836 CA ILE A 119 -11.068 -37.786 -0.535 1.00 2.21 C ATOM 1837 C ILE A 119 -9.569 -37.710 -0.246 1.00 62.22 C ATOM 1838 O ILE A 119 -8.793 -38.511 -0.766 1.00 24.10 O ATOM 1839 CB ILE A 119 -11.518 -36.519 -1.313 1.00 43.35 C ATOM 1840 CG1 ILE A 119 -13.007 -36.628 -1.687 1.00 44.33 C ATOM 1841 CG2 ILE A 119 -10.660 -36.320 -2.565 1.00 11.44 C ATOM 1842 CD1 ILE A 119 -13.553 -35.413 -2.409 1.00 40.14 C ATOM 0 H ILE A 119 -12.485 -37.211 0.899 1.00 22.14 H new ATOM 0 HA ILE A 119 -11.273 -38.655 -1.160 1.00 2.21 H new ATOM 0 HB ILE A 119 -11.383 -35.650 -0.669 1.00 43.35 H new ATOM 0 HG12 ILE A 119 -13.149 -37.506 -2.317 1.00 44.33 H new ATOM 0 HG13 ILE A 119 -13.588 -36.790 -0.779 1.00 44.33 H new ATOM 0 HG21 ILE A 119 -10.992 -35.427 -3.095 1.00 11.44 H new ATOM 0 HG22 ILE A 119 -9.616 -36.203 -2.276 1.00 11.44 H new ATOM 0 HG23 ILE A 119 -10.761 -37.188 -3.217 1.00 11.44 H new ATOM 0 HD11 ILE A 119 -14.607 -35.569 -2.637 1.00 40.14 H new ATOM 0 HD12 ILE A 119 -13.445 -34.534 -1.774 1.00 40.14 H new ATOM 0 HD13 ILE A 119 -13.000 -35.261 -3.336 1.00 40.14 H new ATOM 1854 N ILE A 120 -9.170 -36.766 0.612 1.00 71.14 N ATOM 1855 CA ILE A 120 -7.755 -36.586 0.954 1.00 1.52 C ATOM 1856 C ILE A 120 -7.206 -37.854 1.614 1.00 44.53 C ATOM 1857 O ILE A 120 -6.068 -38.274 1.337 1.00 2.32 O ATOM 1858 CB ILE A 120 -7.536 -35.336 1.871 1.00 41.41 C ATOM 1859 CG1 ILE A 120 -6.031 -35.026 2.091 1.00 72.14 C ATOM 1860 CG2 ILE A 120 -8.249 -35.503 3.210 1.00 5.22 C ATOM 1861 CD1 ILE A 120 -5.355 -35.835 3.188 1.00 43.13 C ATOM 0 H ILE A 120 -9.803 -36.118 1.080 1.00 71.14 H new ATOM 0 HA ILE A 120 -7.205 -36.406 0.030 1.00 1.52 H new ATOM 0 HB ILE A 120 -7.972 -34.484 1.350 1.00 41.41 H new ATOM 0 HG12 ILE A 120 -5.500 -35.199 1.155 1.00 72.14 H new ATOM 0 HG13 ILE A 120 -5.925 -33.967 2.326 1.00 72.14 H new ATOM 0 HG21 ILE A 120 -8.079 -34.620 3.825 1.00 5.22 H new ATOM 0 HG22 ILE A 120 -9.319 -35.626 3.040 1.00 5.22 H new ATOM 0 HG23 ILE A 120 -7.859 -36.383 3.722 1.00 5.22 H new ATOM 0 HD11 ILE A 120 -4.307 -35.544 3.262 1.00 43.13 H new ATOM 0 HD12 ILE A 120 -5.852 -35.645 4.139 1.00 43.13 H new ATOM 0 HD13 ILE A 120 -5.421 -36.897 2.950 1.00 43.13 H new ATOM 1873 N SER A 121 -8.028 -38.471 2.468 1.00 33.33 N ATOM 1874 CA SER A 121 -7.656 -39.710 3.133 1.00 32.12 C ATOM 1875 C SER A 121 -7.242 -40.757 2.105 1.00 12.31 C ATOM 1876 O SER A 121 -6.158 -41.330 2.195 1.00 23.30 O ATOM 1877 CB SER A 121 -8.818 -40.237 3.987 1.00 43.12 C ATOM 1878 OG SER A 121 -8.478 -41.462 4.620 1.00 42.33 O ATOM 0 H SER A 121 -8.957 -38.126 2.711 1.00 33.33 H new ATOM 0 HA SER A 121 -6.810 -39.507 3.790 1.00 32.12 H new ATOM 0 HB2 SER A 121 -9.083 -39.496 4.742 1.00 43.12 H new ATOM 0 HB3 SER A 121 -9.697 -40.381 3.359 1.00 43.12 H new ATOM 0 HG SER A 121 -9.236 -41.773 5.158 1.00 42.33 H new ATOM 1884 N GLU A 122 -8.097 -40.981 1.115 1.00 14.44 N ATOM 1885 CA GLU A 122 -7.832 -41.986 0.098 1.00 72.13 C ATOM 1886 C GLU A 122 -6.686 -41.561 -0.815 1.00 73.04 C ATOM 1887 O GLU A 122 -5.924 -42.405 -1.283 1.00 20.21 O ATOM 1888 CB GLU A 122 -9.098 -42.285 -0.710 1.00 32.23 C ATOM 1889 CG GLU A 122 -10.123 -43.108 0.061 1.00 71.24 C ATOM 1890 CD GLU A 122 -9.574 -44.465 0.484 1.00 22.22 C ATOM 1891 OE1 GLU A 122 -9.208 -44.631 1.669 1.00 61.24 O ATOM 1892 OE2 GLU A 122 -9.497 -45.373 -0.368 1.00 70.43 O1- ATOM 0 H GLU A 122 -8.978 -40.480 0.996 1.00 14.44 H new ATOM 0 HA GLU A 122 -7.527 -42.903 0.603 1.00 72.13 H new ATOM 0 HB2 GLU A 122 -9.555 -41.345 -1.018 1.00 32.23 H new ATOM 0 HB3 GLU A 122 -8.823 -42.819 -1.619 1.00 32.23 H new ATOM 0 HG2 GLU A 122 -10.439 -42.555 0.945 1.00 71.24 H new ATOM 0 HG3 GLU A 122 -11.009 -43.253 -0.558 1.00 71.24 H new ATOM 1899 N ILE A 123 -6.542 -40.256 -1.056 1.00 11.43 N ATOM 1900 CA ILE A 123 -5.432 -39.769 -1.868 1.00 32.41 C ATOM 1901 C ILE A 123 -4.103 -40.205 -1.256 1.00 5.24 C ATOM 1902 O ILE A 123 -3.310 -40.898 -1.899 1.00 71.51 O ATOM 1903 CB ILE A 123 -5.447 -38.225 -2.023 1.00 73.41 C ATOM 1904 CG1 ILE A 123 -6.680 -37.767 -2.819 1.00 51.34 C ATOM 1905 CG2 ILE A 123 -4.166 -37.742 -2.704 1.00 71.34 C ATOM 1906 CD1 ILE A 123 -6.873 -36.267 -2.835 1.00 15.35 C ATOM 0 H ILE A 123 -7.169 -39.531 -0.707 1.00 11.43 H new ATOM 0 HA ILE A 123 -5.548 -40.204 -2.861 1.00 32.41 H new ATOM 0 HB ILE A 123 -5.499 -37.785 -1.027 1.00 73.41 H new ATOM 0 HG12 ILE A 123 -6.592 -38.124 -3.845 1.00 51.34 H new ATOM 0 HG13 ILE A 123 -7.569 -38.234 -2.395 1.00 51.34 H new ATOM 0 HG21 ILE A 123 -4.194 -36.657 -2.804 1.00 71.34 H new ATOM 0 HG22 ILE A 123 -3.304 -38.029 -2.102 1.00 71.34 H new ATOM 0 HG23 ILE A 123 -4.086 -38.196 -3.692 1.00 71.34 H new ATOM 0 HD11 ILE A 123 -7.762 -36.021 -3.415 1.00 15.35 H new ATOM 0 HD12 ILE A 123 -6.994 -35.905 -1.814 1.00 15.35 H new ATOM 0 HD13 ILE A 123 -6.002 -35.793 -3.287 1.00 15.35 H new ATOM 1918 N ASN A 124 -3.882 -39.848 0.010 1.00 61.24 N ATOM 1919 CA ASN A 124 -2.622 -40.195 0.671 1.00 42.31 C ATOM 1920 C ASN A 124 -2.541 -41.708 0.884 1.00 20.40 C ATOM 1921 O ASN A 124 -1.464 -42.302 0.804 1.00 70.22 O ATOM 1922 CB ASN A 124 -2.450 -39.446 2.008 1.00 5.10 C ATOM 1923 CG ASN A 124 -3.306 -39.999 3.141 1.00 40.22 C ATOM 1924 OD1 ASN A 124 -4.474 -39.414 3.351 1.00 31.24 O flip ATOM 1925 ND2 ASN A 124 -2.904 -40.931 3.838 1.00 15.41 N flip ATOM 0 H ASN A 124 -4.543 -39.330 0.589 1.00 61.24 H new ATOM 0 HA ASN A 124 -1.806 -39.883 0.020 1.00 42.31 H new ATOM 0 HB2 ASN A 124 -1.402 -39.488 2.304 1.00 5.10 H new ATOM 0 HB3 ASN A 124 -2.697 -38.395 1.859 1.00 5.10 H new ATOM 0 HD21 ASN A 124 -1.998 -41.357 3.646 1.00 15.41 H new ATOM 0 HD22 ASN A 124 -3.477 -41.277 4.607 1.00 15.41 H new ATOM 1932 N ASN A 125 -3.701 -42.322 1.114 1.00 31.14 N ATOM 1933 CA ASN A 125 -3.803 -43.764 1.347 1.00 72.20 C ATOM 1934 C ASN A 125 -3.433 -44.550 0.088 1.00 71.23 C ATOM 1935 O ASN A 125 -2.939 -45.675 0.172 1.00 34.51 O ATOM 1936 CB ASN A 125 -5.235 -44.123 1.783 1.00 65.54 C ATOM 1937 CG ASN A 125 -5.401 -45.579 2.192 1.00 44.14 C ATOM 1938 OD1 ASN A 125 -4.471 -46.213 2.690 1.00 32.44 O ATOM 1939 ND2 ASN A 125 -6.600 -46.111 2.013 1.00 44.23 N ATOM 0 H ASN A 125 -4.597 -41.835 1.144 1.00 31.14 H new ATOM 0 HA ASN A 125 -3.103 -44.033 2.138 1.00 72.20 H new ATOM 0 HB2 ASN A 125 -5.522 -43.485 2.619 1.00 65.54 H new ATOM 0 HB3 ASN A 125 -5.921 -43.904 0.964 1.00 65.54 H new ATOM 0 HD21 ASN A 125 -6.776 -47.076 2.291 1.00 44.23 H new ATOM 0 HD22 ASN A 125 -7.347 -45.555 1.597 1.00 44.23 H new ATOM 1946 N ASN A 126 -3.673 -43.949 -1.080 1.00 24.21 N ATOM 1947 CA ASN A 126 -3.434 -44.619 -2.362 1.00 34.20 C ATOM 1948 C ASN A 126 -2.091 -44.219 -2.970 1.00 61.32 C ATOM 1949 O ASN A 126 -1.564 -44.929 -3.830 1.00 63.21 O ATOM 1950 CB ASN A 126 -4.581 -44.335 -3.348 1.00 71.20 C ATOM 1951 CG ASN A 126 -5.896 -44.954 -2.894 1.00 53.32 C ATOM 1952 OD1 ASN A 126 -5.911 -46.012 -2.259 1.00 60.30 O ATOM 1953 ND2 ASN A 126 -7.007 -44.305 -3.218 1.00 41.12 N ATOM 0 H ASN A 126 -4.033 -42.998 -1.165 1.00 24.21 H new ATOM 0 HA ASN A 126 -3.399 -45.691 -2.167 1.00 34.20 H new ATOM 0 HB2 ASN A 126 -4.707 -43.258 -3.456 1.00 71.20 H new ATOM 0 HB3 ASN A 126 -4.318 -44.725 -4.331 1.00 71.20 H new ATOM 0 HD21 ASN A 126 -7.915 -44.678 -2.941 1.00 41.12 H new ATOM 0 HD22 ASN A 126 -6.953 -43.433 -3.744 1.00 41.12 H new ATOM 1960 N ILE A 127 -1.544 -43.077 -2.548 1.00 24.11 N ATOM 1961 CA ILE A 127 -0.189 -42.696 -2.947 1.00 45.52 C ATOM 1962 C ILE A 127 0.831 -43.540 -2.184 1.00 24.03 C ATOM 1963 O ILE A 127 1.771 -44.085 -2.771 1.00 24.55 O ATOM 1964 CB ILE A 127 0.101 -41.193 -2.695 1.00 23.43 C ATOM 1965 CG1 ILE A 127 -0.821 -40.311 -3.550 1.00 53.10 C ATOM 1966 CG2 ILE A 127 1.573 -40.870 -2.978 1.00 51.22 C ATOM 1967 CD1 ILE A 127 -0.651 -38.828 -3.290 1.00 54.51 C ATOM 0 H ILE A 127 -2.012 -42.408 -1.937 1.00 24.11 H new ATOM 0 HA ILE A 127 -0.107 -42.875 -4.019 1.00 45.52 H new ATOM 0 HB ILE A 127 -0.100 -40.979 -1.645 1.00 23.43 H new ATOM 0 HG12 ILE A 127 -0.627 -40.511 -4.604 1.00 53.10 H new ATOM 0 HG13 ILE A 127 -1.857 -40.589 -3.358 1.00 53.10 H new ATOM 0 HG21 ILE A 127 1.755 -39.811 -2.795 1.00 51.22 H new ATOM 0 HG22 ILE A 127 2.209 -41.466 -2.323 1.00 51.22 H new ATOM 0 HG23 ILE A 127 1.803 -41.103 -4.017 1.00 51.22 H new ATOM 0 HD11 ILE A 127 -1.333 -38.266 -3.928 1.00 54.51 H new ATOM 0 HD12 ILE A 127 -0.873 -38.614 -2.245 1.00 54.51 H new ATOM 0 HD13 ILE A 127 0.376 -38.535 -3.510 1.00 54.51 H new ATOM 1979 N ASN A 128 0.634 -43.636 -0.870 1.00 64.33 N ATOM 1980 CA ASN A 128 1.492 -44.443 -0.005 1.00 71.43 C ATOM 1981 C ASN A 128 0.852 -45.815 0.216 1.00 23.15 C ATOM 1982 O ASN A 128 1.121 -46.736 -0.580 1.00 65.33 O ATOM 1983 CB ASN A 128 1.723 -43.735 1.348 1.00 24.12 C ATOM 1984 CG ASN A 128 2.667 -42.541 1.272 1.00 23.51 C ATOM 1985 OD1 ASN A 128 2.719 -41.875 0.127 1.00 5.34 O flip ATOM 1986 ND2 ASN A 128 3.347 -42.216 2.250 1.00 22.35 N flip ATOM 1987 OXT ASN A 128 0.062 -45.964 1.173 1.00 0.00 O1- ATOM 0 H ASN A 128 -0.121 -43.159 -0.377 1.00 64.33 H new ATOM 0 HA ASN A 128 2.460 -44.572 -0.490 1.00 71.43 H new ATOM 0 HB2 ASN A 128 0.762 -43.401 1.740 1.00 24.12 H new ATOM 0 HB3 ASN A 128 2.124 -44.457 2.060 1.00 24.12 H new ATOM 0 HD21 ASN A 128 3.283 -42.751 3.116 1.00 22.35 H new ATOM 0 HD22 ASN A 128 3.973 -41.413 2.192 1.00 22.35 H new TER 1994 ASN A 128