USER MOD reduce.3.24.130724 H: found=0, std=0, add=1087, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 1084 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 Single : A 5 TYR OH : rot -64:sc= 0.038 USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.214 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 HIS : no HD1:sc= -0.183 X(o=-0.18,f=-0.033) USER MOD Single : A 13 TYR OH : rot 110:sc= 0 USER MOD Single : A 15 SER OG : rot 54:sc= 1.24 USER MOD Single : A 20 THR OG1 : rot 180:sc= -0.437 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.106 USER MOD Single : A 33 ASN : amide:sc= -0.138 X(o=-0.14,f=-0.14) USER MOD Single : A 41 ASN : amide:sc= -0.035 X(o=-0.035,f=-0.049) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 147:sc= -1.14 (180deg=-2.64!) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 LYS NZ :NH3+ -145:sc= 0 (180deg=-1.42) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 HIS : no HD1:sc= -0.415 K(o=-0.41,f=-1.7) USER MOD Single : A 86 LYS NZ :NH3+ -135:sc= -0.229 (180deg=-1.18) USER MOD Single : A 93 THR OG1 : rot 180:sc= -0.0522 USER MOD Single : A 94 SER OG : rot 180:sc= 0.0651 USER MOD Single : A 99 HIS : no HD1:sc= -0.108 K(o=-0.11,f=-0.94) USER MOD Single : A 106 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 ASN : amide:sc= -0.871 K(o=-0.87,f=-6.9!) USER MOD Single : A 124 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 125 GLN : amide:sc= -1.37 K(o=-1.4,f=-4.2!) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -1.37 K(o=-1.4,f=-2.5!) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 136 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASP A 3 0.168 -9.903 -5.641 1.00 63.21 N ATOM 2 CA ASP A 3 -0.969 -9.464 -4.839 1.00 1.10 C ATOM 3 C ASP A 3 -1.272 -7.990 -5.087 1.00 54.11 C ATOM 4 O ASP A 3 -0.380 -7.210 -5.419 1.00 24.32 O ATOM 5 CB ASP A 3 -0.693 -9.698 -3.354 1.00 23.13 C ATOM 6 CG ASP A 3 0.706 -9.276 -2.951 1.00 5.44 C ATOM 7 OD1 ASP A 3 0.891 -8.091 -2.603 1.00 40.21 O ATOM 8 OD2 ASP A 3 1.616 -10.131 -2.984 1.00 10.33 O1- ATOM 0 HA ASP A 3 -1.839 -10.050 -5.135 1.00 1.10 H new ATOM 0 HB2 ASP A 3 -1.421 -9.145 -2.761 1.00 23.13 H new ATOM 0 HB3 ASP A 3 -0.831 -10.754 -3.124 1.00 23.13 H new ATOM 13 N VAL A 4 -2.538 -7.616 -4.925 1.00 1.21 N ATOM 14 CA VAL A 4 -2.958 -6.235 -5.132 1.00 45.01 C ATOM 15 C VAL A 4 -3.826 -5.746 -3.977 1.00 4.33 C ATOM 16 O VAL A 4 -4.601 -6.511 -3.404 1.00 12.14 O ATOM 17 CB VAL A 4 -3.740 -6.077 -6.450 1.00 11.04 C ATOM 18 CG1 VAL A 4 -4.154 -4.628 -6.655 1.00 11.12 C ATOM 19 CG2 VAL A 4 -2.910 -6.576 -7.623 1.00 24.21 C ATOM 0 H VAL A 4 -3.289 -8.249 -4.651 1.00 1.21 H new ATOM 0 HA VAL A 4 -2.051 -5.632 -5.182 1.00 45.01 H new ATOM 0 HB VAL A 4 -4.645 -6.682 -6.392 1.00 11.04 H new ATOM 0 HG11 VAL A 4 -4.705 -4.536 -7.591 1.00 11.12 H new ATOM 0 HG12 VAL A 4 -4.788 -4.310 -5.828 1.00 11.12 H new ATOM 0 HG13 VAL A 4 -3.266 -3.998 -6.694 1.00 11.12 H new ATOM 0 HG21 VAL A 4 -3.477 -6.457 -8.546 1.00 24.21 H new ATOM 0 HG22 VAL A 4 -1.987 -5.999 -7.687 1.00 24.21 H new ATOM 0 HG23 VAL A 4 -2.670 -7.629 -7.477 1.00 24.21 H new ATOM 29 N TYR A 5 -3.690 -4.468 -3.642 1.00 14.41 N ATOM 30 CA TYR A 5 -4.460 -3.877 -2.554 1.00 14.11 C ATOM 31 C TYR A 5 -5.528 -2.931 -3.095 1.00 34.31 C ATOM 32 O TYR A 5 -5.261 -1.757 -3.356 1.00 3.50 O ATOM 33 CB TYR A 5 -3.535 -3.126 -1.596 1.00 22.13 C ATOM 34 CG TYR A 5 -2.311 -3.916 -1.191 1.00 23.14 C ATOM 35 CD1 TYR A 5 -1.173 -3.928 -1.987 1.00 4.24 C ATOM 36 CD2 TYR A 5 -2.292 -4.650 -0.011 1.00 11.34 C ATOM 37 CE1 TYR A 5 -0.052 -4.650 -1.622 1.00 42.42 C ATOM 38 CE2 TYR A 5 -1.177 -5.373 0.363 1.00 71.45 C ATOM 39 CZ TYR A 5 -0.060 -5.370 -0.445 1.00 3.24 C ATOM 40 OH TYR A 5 1.055 -6.089 -0.077 1.00 3.20 O ATOM 0 H TYR A 5 -3.054 -3.821 -4.108 1.00 14.41 H new ATOM 0 HA TYR A 5 -4.955 -4.683 -2.012 1.00 14.11 H new ATOM 0 HB2 TYR A 5 -3.217 -2.195 -2.066 1.00 22.13 H new ATOM 0 HB3 TYR A 5 -4.095 -2.856 -0.701 1.00 22.13 H new ATOM 0 HD1 TYR A 5 -1.164 -3.363 -2.908 1.00 4.24 H new ATOM 0 HD2 TYR A 5 -3.165 -4.655 0.625 1.00 11.34 H new ATOM 0 HE1 TYR A 5 0.824 -4.650 -2.254 1.00 42.42 H new ATOM 0 HE2 TYR A 5 -1.180 -5.938 1.284 1.00 71.45 H new ATOM 0 HH TYR A 5 1.217 -6.799 -0.732 1.00 3.20 H new ATOM 50 N THR A 6 -6.741 -3.451 -3.259 1.00 71.00 N ATOM 51 CA THR A 6 -7.850 -2.655 -3.767 1.00 14.31 C ATOM 52 C THR A 6 -8.126 -1.456 -2.867 1.00 73.50 C ATOM 53 O THR A 6 -7.745 -1.446 -1.697 1.00 43.33 O ATOM 54 CB THR A 6 -9.136 -3.496 -3.890 1.00 51.52 C ATOM 55 OG1 THR A 6 -10.247 -2.649 -4.202 1.00 70.22 O ATOM 56 CG2 THR A 6 -9.413 -4.252 -2.600 1.00 71.11 C ATOM 0 H THR A 6 -6.979 -4.420 -3.047 1.00 71.00 H new ATOM 0 HA THR A 6 -7.558 -2.303 -4.756 1.00 14.31 H new ATOM 0 HB THR A 6 -8.996 -4.220 -4.693 1.00 51.52 H new ATOM 0 HG1 THR A 6 -11.060 -3.191 -4.280 1.00 70.22 H new ATOM 0 HG21 THR A 6 -10.325 -4.838 -2.711 1.00 71.11 H new ATOM 0 HG22 THR A 6 -8.578 -4.918 -2.382 1.00 71.11 H new ATOM 0 HG23 THR A 6 -9.535 -3.543 -1.781 1.00 71.11 H new ATOM 64 N SER A 7 -8.791 -0.446 -3.420 1.00 24.13 N ATOM 65 CA SER A 7 -9.114 0.760 -2.667 1.00 4.43 C ATOM 66 C SER A 7 -10.575 0.751 -2.230 1.00 34.24 C ATOM 67 O SER A 7 -11.292 -0.228 -2.441 1.00 13.42 O ATOM 68 CB SER A 7 -8.829 2.005 -3.510 1.00 10.54 C ATOM 69 OG SER A 7 -7.685 1.817 -4.325 1.00 74.54 O ATOM 0 H SER A 7 -9.116 -0.439 -4.387 1.00 24.13 H new ATOM 0 HA SER A 7 -8.486 0.782 -1.776 1.00 4.43 H new ATOM 0 HB2 SER A 7 -9.693 2.230 -4.136 1.00 10.54 H new ATOM 0 HB3 SER A 7 -8.677 2.864 -2.856 1.00 10.54 H new ATOM 0 HG SER A 7 -7.525 2.625 -4.855 1.00 74.54 H new ATOM 75 N ILE A 8 -11.011 1.850 -1.622 1.00 55.43 N ATOM 76 CA ILE A 8 -12.387 1.970 -1.156 1.00 25.01 C ATOM 77 C ILE A 8 -13.299 2.488 -2.263 1.00 21.43 C ATOM 78 O ILE A 8 -12.994 3.488 -2.916 1.00 13.54 O ATOM 79 CB ILE A 8 -12.490 2.910 0.059 1.00 54.34 C ATOM 80 CG1 ILE A 8 -11.610 2.398 1.202 1.00 4.33 C ATOM 81 CG2 ILE A 8 -13.937 3.034 0.512 1.00 52.02 C ATOM 82 CD1 ILE A 8 -10.184 2.897 1.137 1.00 12.02 C ATOM 0 H ILE A 8 -10.431 2.669 -1.441 1.00 55.43 H new ATOM 0 HA ILE A 8 -12.708 0.971 -0.861 1.00 25.01 H new ATOM 0 HB ILE A 8 -12.136 3.899 -0.233 1.00 54.34 H new ATOM 0 HG12 ILE A 8 -12.050 2.702 2.152 1.00 4.33 H new ATOM 0 HG13 ILE A 8 -11.606 1.308 1.186 1.00 4.33 H new ATOM 0 HG21 ILE A 8 -13.993 3.702 1.372 1.00 52.02 H new ATOM 0 HG22 ILE A 8 -14.540 3.438 -0.301 1.00 52.02 H new ATOM 0 HG23 ILE A 8 -14.316 2.051 0.791 1.00 52.02 H new ATOM 0 HD11 ILE A 8 -9.619 2.494 1.978 1.00 12.02 H new ATOM 0 HD12 ILE A 8 -9.727 2.571 0.203 1.00 12.02 H new ATOM 0 HD13 ILE A 8 -10.177 3.986 1.184 1.00 12.02 H new ATOM 94 N HIS A 9 -14.420 1.805 -2.469 1.00 22.41 N ATOM 95 CA HIS A 9 -15.378 2.198 -3.497 1.00 40.14 C ATOM 96 C HIS A 9 -16.621 2.819 -2.869 1.00 0.44 C ATOM 97 O HIS A 9 -16.907 2.606 -1.691 1.00 31.34 O ATOM 98 CB HIS A 9 -15.771 0.989 -4.346 1.00 13.31 C ATOM 99 CG HIS A 9 -14.934 0.824 -5.577 1.00 14.24 C ATOM 100 ND1 HIS A 9 -15.280 -0.014 -6.616 1.00 60.14 N ATOM 101 CD2 HIS A 9 -13.761 1.398 -5.934 1.00 65.44 C ATOM 102 CE1 HIS A 9 -14.355 0.050 -7.557 1.00 42.51 C ATOM 103 NE2 HIS A 9 -13.423 0.900 -7.167 1.00 14.34 N ATOM 0 H HIS A 9 -14.688 0.976 -1.938 1.00 22.41 H new ATOM 0 HA HIS A 9 -14.904 2.942 -4.137 1.00 40.14 H new ATOM 0 HB2 HIS A 9 -15.691 0.087 -3.739 1.00 13.31 H new ATOM 0 HB3 HIS A 9 -16.817 1.085 -4.638 1.00 13.31 H new ATOM 0 HD2 HIS A 9 -13.196 2.115 -5.356 1.00 65.44 H new ATOM 0 HE1 HIS A 9 -14.360 -0.499 -8.487 1.00 42.51 H new ATOM 0 HE2 HIS A 9 -12.587 1.147 -7.697 1.00 14.34 H new ATOM 111 N ILE A 10 -17.357 3.590 -3.664 1.00 62.41 N ATOM 112 CA ILE A 10 -18.570 4.242 -3.186 1.00 5.23 C ATOM 113 C ILE A 10 -19.802 3.709 -3.909 1.00 41.15 C ATOM 114 O ILE A 10 -19.923 3.839 -5.128 1.00 13.04 O ATOM 115 CB ILE A 10 -18.499 5.769 -3.373 1.00 51.44 C ATOM 116 CG1 ILE A 10 -17.350 6.352 -2.548 1.00 72.52 C ATOM 117 CG2 ILE A 10 -19.820 6.412 -2.981 1.00 54.40 C ATOM 118 CD1 ILE A 10 -17.554 6.226 -1.055 1.00 33.02 C ATOM 0 H ILE A 10 -17.134 3.778 -4.641 1.00 62.41 H new ATOM 0 HA ILE A 10 -18.651 4.018 -2.122 1.00 5.23 H new ATOM 0 HB ILE A 10 -18.311 5.984 -4.425 1.00 51.44 H new ATOM 0 HG12 ILE A 10 -16.423 5.848 -2.824 1.00 72.52 H new ATOM 0 HG13 ILE A 10 -17.228 7.405 -2.802 1.00 72.52 H new ATOM 0 HG21 ILE A 10 -19.754 7.491 -3.119 1.00 54.40 H new ATOM 0 HG22 ILE A 10 -20.618 6.014 -3.608 1.00 54.40 H new ATOM 0 HG23 ILE A 10 -20.036 6.192 -1.935 1.00 54.40 H new ATOM 0 HD11 ILE A 10 -16.701 6.660 -0.533 1.00 33.02 H new ATOM 0 HD12 ILE A 10 -18.463 6.754 -0.766 1.00 33.02 H new ATOM 0 HD13 ILE A 10 -17.645 5.173 -0.788 1.00 33.02 H new ATOM 130 N GLU A 11 -20.715 3.111 -3.151 1.00 14.33 N ATOM 131 CA GLU A 11 -21.939 2.560 -3.721 1.00 21.25 C ATOM 132 C GLU A 11 -23.037 3.617 -3.776 1.00 42.40 C ATOM 133 O GLU A 11 -22.973 4.631 -3.081 1.00 51.11 O ATOM 134 CB GLU A 11 -22.413 1.358 -2.901 1.00 50.43 C ATOM 135 CG GLU A 11 -21.626 0.086 -3.172 1.00 44.11 C ATOM 136 CD GLU A 11 -22.208 -0.728 -4.312 1.00 11.42 C ATOM 137 OE1 GLU A 11 -22.559 -0.130 -5.350 1.00 55.02 O ATOM 138 OE2 GLU A 11 -22.313 -1.963 -4.164 1.00 31.51 O1- ATOM 0 H GLU A 11 -20.631 2.996 -2.141 1.00 14.33 H new ATOM 0 HA GLU A 11 -21.722 2.234 -4.738 1.00 21.25 H new ATOM 0 HB2 GLU A 11 -22.340 1.601 -1.841 1.00 50.43 H new ATOM 0 HB3 GLU A 11 -23.466 1.176 -3.115 1.00 50.43 H new ATOM 0 HG2 GLU A 11 -20.593 0.345 -3.405 1.00 44.11 H new ATOM 0 HG3 GLU A 11 -21.605 -0.524 -2.269 1.00 44.11 H new ATOM 145 N GLU A 12 -24.044 3.373 -4.609 1.00 22.22 N ATOM 146 CA GLU A 12 -25.156 4.304 -4.756 1.00 35.34 C ATOM 147 C GLU A 12 -26.474 3.555 -4.938 1.00 30.44 C ATOM 148 O GLU A 12 -26.699 2.916 -5.966 1.00 41.32 O ATOM 149 CB GLU A 12 -24.917 5.234 -5.946 1.00 64.20 C ATOM 150 CG GLU A 12 -26.120 6.094 -6.299 1.00 75.35 C ATOM 151 CD GLU A 12 -25.802 7.139 -7.352 1.00 25.02 C ATOM 152 OE1 GLU A 12 -24.844 7.914 -7.147 1.00 51.50 O ATOM 153 OE2 GLU A 12 -26.510 7.181 -8.379 1.00 22.11 O1- ATOM 0 H GLU A 12 -24.112 2.539 -5.192 1.00 22.22 H new ATOM 0 HA GLU A 12 -25.220 4.900 -3.845 1.00 35.34 H new ATOM 0 HB2 GLU A 12 -24.070 5.883 -5.725 1.00 64.20 H new ATOM 0 HB3 GLU A 12 -24.642 4.635 -6.814 1.00 64.20 H new ATOM 0 HG2 GLU A 12 -26.926 5.454 -6.659 1.00 75.35 H new ATOM 0 HG3 GLU A 12 -26.484 6.590 -5.399 1.00 75.35 H new ATOM 160 N TYR A 13 -27.339 3.639 -3.933 1.00 22.50 N ATOM 161 CA TYR A 13 -28.632 2.967 -3.980 1.00 61.54 C ATOM 162 C TYR A 13 -29.761 3.973 -4.180 1.00 2.15 C ATOM 163 O TYR A 13 -29.667 5.122 -3.748 1.00 12.31 O ATOM 164 CB TYR A 13 -28.864 2.171 -2.696 1.00 3.33 C ATOM 165 CG TYR A 13 -28.104 0.865 -2.646 1.00 52.40 C ATOM 166 CD1 TYR A 13 -26.715 0.846 -2.690 1.00 2.40 C ATOM 167 CD2 TYR A 13 -28.774 -0.349 -2.558 1.00 44.14 C ATOM 168 CE1 TYR A 13 -26.016 -0.346 -2.646 1.00 40.42 C ATOM 169 CE2 TYR A 13 -28.083 -1.544 -2.511 1.00 2.10 C ATOM 170 CZ TYR A 13 -26.704 -1.537 -2.556 1.00 52.02 C ATOM 171 OH TYR A 13 -26.012 -2.726 -2.512 1.00 41.41 O ATOM 0 H TYR A 13 -27.168 4.166 -3.076 1.00 22.50 H new ATOM 0 HA TYR A 13 -28.626 2.281 -4.827 1.00 61.54 H new ATOM 0 HB2 TYR A 13 -28.574 2.783 -1.842 1.00 3.33 H new ATOM 0 HB3 TYR A 13 -29.930 1.965 -2.594 1.00 3.33 H new ATOM 0 HD1 TYR A 13 -26.173 1.777 -2.760 1.00 2.40 H new ATOM 0 HD2 TYR A 13 -29.853 -0.358 -2.526 1.00 44.14 H new ATOM 0 HE1 TYR A 13 -24.937 -0.344 -2.682 1.00 40.42 H new ATOM 0 HE2 TYR A 13 -28.619 -2.479 -2.439 1.00 2.10 H new ATOM 0 HH TYR A 13 -26.091 -3.117 -1.617 1.00 41.41 H new ATOM 181 N GLU A 14 -30.829 3.532 -4.838 1.00 51.13 N ATOM 182 CA GLU A 14 -31.977 4.393 -5.095 1.00 44.05 C ATOM 183 C GLU A 14 -33.219 3.876 -4.373 1.00 34.43 C ATOM 184 O GLU A 14 -33.369 2.673 -4.160 1.00 43.23 O ATOM 185 CB GLU A 14 -32.249 4.484 -6.598 1.00 41.01 C ATOM 186 CG GLU A 14 -32.855 5.808 -7.028 1.00 63.43 C ATOM 187 CD GLU A 14 -32.976 5.932 -8.534 1.00 53.14 C ATOM 188 OE1 GLU A 14 -31.929 6.041 -9.208 1.00 2.11 O ATOM 189 OE2 GLU A 14 -34.117 5.922 -9.041 1.00 40.11 O1- ATOM 0 H GLU A 14 -30.923 2.584 -5.202 1.00 51.13 H new ATOM 0 HA GLU A 14 -31.744 5.387 -4.714 1.00 44.05 H new ATOM 0 HB2 GLU A 14 -31.315 4.330 -7.138 1.00 41.01 H new ATOM 0 HB3 GLU A 14 -32.921 3.676 -6.887 1.00 41.01 H new ATOM 0 HG2 GLU A 14 -33.842 5.915 -6.578 1.00 63.43 H new ATOM 0 HG3 GLU A 14 -32.241 6.625 -6.648 1.00 63.43 H new ATOM 196 N SER A 15 -34.103 4.794 -3.998 1.00 45.22 N ATOM 197 CA SER A 15 -35.329 4.432 -3.296 1.00 21.12 C ATOM 198 C SER A 15 -36.332 5.581 -3.328 1.00 40.40 C ATOM 199 O SER A 15 -36.152 6.594 -2.652 1.00 61.11 O ATOM 200 CB SER A 15 -35.018 4.051 -1.848 1.00 50.55 C ATOM 201 OG SER A 15 -33.753 4.549 -1.449 1.00 60.35 O ATOM 0 H SER A 15 -33.994 5.794 -4.168 1.00 45.22 H new ATOM 0 HA SER A 15 -35.770 3.574 -3.803 1.00 21.12 H new ATOM 0 HB2 SER A 15 -35.792 4.447 -1.190 1.00 50.55 H new ATOM 0 HB3 SER A 15 -35.035 2.966 -1.743 1.00 50.55 H new ATOM 0 HG SER A 15 -33.714 5.514 -1.615 1.00 60.35 H new ATOM 207 N GLU A 16 -37.389 5.414 -4.116 1.00 11.34 N ATOM 208 CA GLU A 16 -38.421 6.438 -4.237 1.00 40.23 C ATOM 209 C GLU A 16 -39.806 5.845 -3.995 1.00 3.23 C ATOM 210 O GLU A 16 -40.114 4.749 -4.462 1.00 64.35 O ATOM 211 CB GLU A 16 -38.366 7.088 -5.621 1.00 4.30 C ATOM 212 CG GLU A 16 -38.959 6.226 -6.722 1.00 43.20 C ATOM 213 CD GLU A 16 -38.408 6.569 -8.092 1.00 63.23 C ATOM 214 OE1 GLU A 16 -37.920 7.705 -8.267 1.00 62.45 O ATOM 215 OE2 GLU A 16 -38.464 5.701 -8.989 1.00 71.20 O1- ATOM 0 H GLU A 16 -37.554 4.580 -4.680 1.00 11.34 H new ATOM 0 HA GLU A 16 -38.233 7.199 -3.479 1.00 40.23 H new ATOM 0 HB2 GLU A 16 -38.899 8.038 -5.588 1.00 4.30 H new ATOM 0 HB3 GLU A 16 -37.328 7.313 -5.866 1.00 4.30 H new ATOM 0 HG2 GLU A 16 -38.757 5.177 -6.506 1.00 43.20 H new ATOM 0 HG3 GLU A 16 -40.042 6.347 -6.729 1.00 43.20 H new ATOM 222 N ALA A 17 -40.637 6.578 -3.261 1.00 45.31 N ATOM 223 CA ALA A 17 -41.989 6.127 -2.959 1.00 31.31 C ATOM 224 C ALA A 17 -42.889 6.225 -4.186 1.00 53.14 C ATOM 225 O ALA A 17 -43.394 7.299 -4.512 1.00 52.54 O ATOM 226 CB ALA A 17 -42.571 6.937 -1.809 1.00 33.40 C ATOM 0 H ALA A 17 -40.397 7.487 -2.865 1.00 45.31 H new ATOM 0 HA ALA A 17 -41.937 5.079 -2.662 1.00 31.31 H new ATOM 0 HB1 ALA A 17 -43.581 6.589 -1.594 1.00 33.40 H new ATOM 0 HB2 ALA A 17 -41.948 6.811 -0.924 1.00 33.40 H new ATOM 0 HB3 ALA A 17 -42.601 7.991 -2.085 1.00 33.40 H new ATOM 232 N ARG A 18 -43.084 5.099 -4.863 1.00 33.11 N ATOM 233 CA ARG A 18 -43.921 5.059 -6.056 1.00 74.51 C ATOM 234 C ARG A 18 -45.394 4.931 -5.681 1.00 1.22 C ATOM 235 O ARG A 18 -45.742 4.263 -4.707 1.00 0.43 O ATOM 236 CB ARG A 18 -43.508 3.893 -6.955 1.00 24.01 C ATOM 237 CG ARG A 18 -42.114 4.040 -7.542 1.00 71.34 C ATOM 238 CD ARG A 18 -42.129 4.874 -8.813 1.00 21.32 C ATOM 239 NE ARG A 18 -42.824 4.197 -9.905 1.00 34.15 N ATOM 240 CZ ARG A 18 -42.316 3.165 -10.571 1.00 3.12 C ATOM 241 NH1 ARG A 18 -41.117 2.695 -10.257 1.00 25.32 N1+ ATOM 242 NH2 ARG A 18 -43.010 2.601 -11.552 1.00 33.24 N ATOM 0 H ARG A 18 -42.674 4.201 -4.606 1.00 33.11 H new ATOM 0 HA ARG A 18 -43.782 5.994 -6.599 1.00 74.51 H new ATOM 0 HB2 ARG A 18 -43.555 2.968 -6.380 1.00 24.01 H new ATOM 0 HB3 ARG A 18 -44.228 3.800 -7.768 1.00 24.01 H new ATOM 0 HG2 ARG A 18 -41.456 4.506 -6.808 1.00 71.34 H new ATOM 0 HG3 ARG A 18 -41.703 3.054 -7.758 1.00 71.34 H new ATOM 0 HD2 ARG A 18 -42.613 5.830 -8.613 1.00 21.32 H new ATOM 0 HD3 ARG A 18 -41.105 5.092 -9.115 1.00 21.32 H new ATOM 0 HE ARG A 18 -43.749 4.534 -10.171 1.00 34.15 H new ATOM 0 HH11 ARG A 18 -40.582 3.125 -9.503 1.00 25.32 H new ATOM 0 HH12 ARG A 18 -40.729 1.903 -10.770 1.00 25.32 H new ATOM 0 HH21 ARG A 18 -43.933 2.960 -11.795 1.00 33.24 H new ATOM 0 HH22 ARG A 18 -42.620 1.809 -12.063 1.00 33.24 H new ATOM 256 N ASP A 19 -46.255 5.574 -6.461 1.00 32.20 N ATOM 257 CA ASP A 19 -47.692 5.532 -6.213 1.00 41.34 C ATOM 258 C ASP A 19 -48.288 4.211 -6.690 1.00 44.41 C ATOM 259 O ASP A 19 -47.982 3.740 -7.786 1.00 5.35 O ATOM 260 CB ASP A 19 -48.387 6.701 -6.912 1.00 22.55 C ATOM 261 CG ASP A 19 -48.256 6.634 -8.421 1.00 73.34 C ATOM 262 OD1 ASP A 19 -47.115 6.504 -8.912 1.00 3.01 O ATOM 263 OD2 ASP A 19 -49.294 6.712 -9.111 1.00 24.34 O1- ATOM 0 H ASP A 19 -45.983 6.131 -7.271 1.00 32.20 H new ATOM 0 HA ASP A 19 -47.852 5.615 -5.138 1.00 41.34 H new ATOM 0 HB2 ASP A 19 -49.443 6.706 -6.642 1.00 22.55 H new ATOM 0 HB3 ASP A 19 -47.962 7.639 -6.555 1.00 22.55 H new ATOM 268 N THR A 20 -49.138 3.617 -5.860 1.00 61.12 N ATOM 269 CA THR A 20 -49.775 2.350 -6.195 1.00 12.12 C ATOM 270 C THR A 20 -51.009 2.567 -7.063 1.00 54.32 C ATOM 271 O THR A 20 -51.490 3.691 -7.208 1.00 54.42 O ATOM 272 CB THR A 20 -50.182 1.573 -4.929 1.00 40.23 C ATOM 273 OG1 THR A 20 -50.730 0.300 -5.290 1.00 70.42 O ATOM 274 CG2 THR A 20 -51.202 2.357 -4.117 1.00 72.02 C ATOM 0 H THR A 20 -49.402 3.993 -4.949 1.00 61.12 H new ATOM 0 HA THR A 20 -49.042 1.766 -6.751 1.00 12.12 H new ATOM 0 HB THR A 20 -49.291 1.425 -4.319 1.00 40.23 H new ATOM 0 HG1 THR A 20 -50.985 -0.188 -4.479 1.00 70.42 H new ATOM 0 HG21 THR A 20 -51.474 1.788 -3.228 1.00 72.02 H new ATOM 0 HG22 THR A 20 -50.772 3.313 -3.819 1.00 72.02 H new ATOM 0 HG23 THR A 20 -52.092 2.532 -4.722 1.00 72.02 H new ATOM 282 N LYS A 21 -51.520 1.484 -7.639 1.00 3.44 N ATOM 283 CA LYS A 21 -52.700 1.555 -8.492 1.00 22.44 C ATOM 284 C LYS A 21 -53.975 1.399 -7.670 1.00 14.33 C ATOM 285 O LYS A 21 -55.075 1.316 -8.220 1.00 74.45 O ATOM 286 CB LYS A 21 -52.640 0.471 -9.571 1.00 24.43 C ATOM 287 CG LYS A 21 -52.689 -0.942 -9.017 1.00 51.34 C ATOM 288 CD LYS A 21 -51.294 -1.524 -8.851 1.00 33.02 C ATOM 289 CE LYS A 21 -51.032 -1.938 -7.411 1.00 63.52 C ATOM 290 NZ LYS A 21 -51.260 -3.395 -7.203 1.00 64.01 N1+ ATOM 0 H LYS A 21 -51.135 0.546 -7.530 1.00 3.44 H new ATOM 0 HA LYS A 21 -52.714 2.535 -8.970 1.00 22.44 H new ATOM 0 HB2 LYS A 21 -53.472 0.611 -10.261 1.00 24.43 H new ATOM 0 HB3 LYS A 21 -51.723 0.595 -10.148 1.00 24.43 H new ATOM 0 HG2 LYS A 21 -53.200 -0.939 -8.054 1.00 51.34 H new ATOM 0 HG3 LYS A 21 -53.272 -1.576 -9.685 1.00 51.34 H new ATOM 0 HD2 LYS A 21 -51.178 -2.388 -9.506 1.00 33.02 H new ATOM 0 HD3 LYS A 21 -50.552 -0.788 -9.160 1.00 33.02 H new ATOM 0 HE2 LYS A 21 -50.005 -1.689 -7.143 1.00 63.52 H new ATOM 0 HE3 LYS A 21 -51.682 -1.370 -6.746 1.00 63.52 H new ATOM 0 HZ1 LYS A 21 -51.071 -3.638 -6.209 1.00 64.01 H new ATOM 0 HZ2 LYS A 21 -52.247 -3.629 -7.435 1.00 64.01 H new ATOM 0 HZ3 LYS A 21 -50.622 -3.938 -7.819 1.00 64.01 H new ATOM 304 N LEU A 22 -53.823 1.361 -6.351 1.00 11.11 N ATOM 305 CA LEU A 22 -54.963 1.217 -5.453 1.00 62.04 C ATOM 306 C LEU A 22 -55.343 2.560 -4.835 1.00 2.31 C ATOM 307 O LEU A 22 -56.276 2.646 -4.039 1.00 51.15 O ATOM 308 CB LEU A 22 -54.643 0.207 -4.349 1.00 32.22 C ATOM 309 CG LEU A 22 -55.715 -0.849 -4.076 1.00 53.13 C ATOM 310 CD1 LEU A 22 -57.062 -0.191 -3.823 1.00 24.41 C ATOM 311 CD2 LEU A 22 -55.807 -1.828 -5.237 1.00 34.53 C ATOM 0 H LEU A 22 -52.921 1.428 -5.880 1.00 11.11 H new ATOM 0 HA LEU A 22 -55.810 0.854 -6.036 1.00 62.04 H new ATOM 0 HB2 LEU A 22 -53.716 -0.304 -4.609 1.00 32.22 H new ATOM 0 HB3 LEU A 22 -54.457 0.755 -3.425 1.00 32.22 H new ATOM 0 HG LEU A 22 -55.432 -1.403 -3.181 1.00 53.13 H new ATOM 0 HD11 LEU A 22 -57.812 -0.959 -3.631 1.00 24.41 H new ATOM 0 HD12 LEU A 22 -56.988 0.469 -2.958 1.00 24.41 H new ATOM 0 HD13 LEU A 22 -57.353 0.390 -4.698 1.00 24.41 H new ATOM 0 HD21 LEU A 22 -56.575 -2.572 -5.025 1.00 34.53 H new ATOM 0 HD22 LEU A 22 -56.066 -1.289 -6.148 1.00 34.53 H new ATOM 0 HD23 LEU A 22 -54.846 -2.326 -5.370 1.00 34.53 H new ATOM 323 N GLY A 23 -54.612 3.606 -5.210 1.00 52.15 N ATOM 324 CA GLY A 23 -54.890 4.930 -4.685 1.00 43.34 C ATOM 325 C GLY A 23 -54.161 5.202 -3.384 1.00 14.33 C ATOM 326 O GLY A 23 -54.738 5.133 -2.299 1.00 42.31 O ATOM 0 H GLY A 23 -53.833 3.560 -5.867 1.00 52.15 H new ATOM 0 HA2 GLY A 23 -54.601 5.678 -5.423 1.00 43.34 H new ATOM 0 HA3 GLY A 23 -55.963 5.037 -4.526 1.00 43.34 H new ATOM 330 N PRO A 24 -52.862 5.518 -3.483 1.00 42.45 N ATOM 331 CA PRO A 24 -52.025 5.806 -2.314 1.00 55.11 C ATOM 332 C PRO A 24 -52.395 7.125 -1.648 1.00 31.25 C ATOM 333 O PRO A 24 -53.191 7.897 -2.180 1.00 23.44 O ATOM 334 CB PRO A 24 -50.612 5.879 -2.899 1.00 4.11 C ATOM 335 CG PRO A 24 -50.812 6.256 -4.327 1.00 61.03 C ATOM 336 CD PRO A 24 -52.108 5.618 -4.745 1.00 45.53 C ATOM 0 HA PRO A 24 -52.140 5.053 -1.535 1.00 55.11 H new ATOM 0 HB2 PRO A 24 -50.005 6.618 -2.376 1.00 4.11 H new ATOM 0 HB3 PRO A 24 -50.097 4.922 -2.810 1.00 4.11 H new ATOM 0 HG2 PRO A 24 -50.855 7.339 -4.443 1.00 61.03 H new ATOM 0 HG3 PRO A 24 -49.986 5.902 -4.944 1.00 61.03 H new ATOM 0 HD2 PRO A 24 -52.635 6.225 -5.481 1.00 45.53 H new ATOM 0 HD3 PRO A 24 -51.947 4.639 -5.195 1.00 45.53 H new ATOM 344 N GLU A 25 -51.812 7.378 -0.480 1.00 30.43 N ATOM 345 CA GLU A 25 -52.082 8.606 0.258 1.00 61.13 C ATOM 346 C GLU A 25 -50.790 9.209 0.802 1.00 2.52 C ATOM 347 O GLU A 25 -50.596 10.424 0.763 1.00 75.32 O ATOM 348 CB GLU A 25 -53.054 8.332 1.409 1.00 32.13 C ATOM 349 CG GLU A 25 -54.514 8.500 1.024 1.00 54.54 C ATOM 350 CD GLU A 25 -55.426 8.610 2.231 1.00 55.02 C ATOM 351 OE1 GLU A 25 -54.983 9.162 3.260 1.00 54.21 O ATOM 352 OE2 GLU A 25 -56.581 8.143 2.147 1.00 12.11 O1- ATOM 0 H GLU A 25 -51.150 6.749 -0.025 1.00 30.43 H new ATOM 0 HA GLU A 25 -52.535 9.321 -0.429 1.00 61.13 H new ATOM 0 HB2 GLU A 25 -52.897 7.316 1.772 1.00 32.13 H new ATOM 0 HB3 GLU A 25 -52.825 9.005 2.235 1.00 32.13 H new ATOM 0 HG2 GLU A 25 -54.623 9.393 0.408 1.00 54.54 H new ATOM 0 HG3 GLU A 25 -54.825 7.652 0.414 1.00 54.54 H new ATOM 359 N GLU A 26 -49.911 8.352 1.310 1.00 43.40 N ATOM 360 CA GLU A 26 -48.638 8.800 1.863 1.00 42.11 C ATOM 361 C GLU A 26 -47.706 7.618 2.112 1.00 25.51 C ATOM 362 O GLU A 26 -48.155 6.482 2.266 1.00 40.12 O ATOM 363 CB GLU A 26 -48.866 9.567 3.168 1.00 74.23 C ATOM 364 CG GLU A 26 -49.249 8.677 4.338 1.00 70.14 C ATOM 365 CD GLU A 26 -50.133 9.387 5.346 1.00 31.34 C ATOM 366 OE1 GLU A 26 -49.872 10.574 5.632 1.00 24.24 O ATOM 367 OE2 GLU A 26 -51.086 8.754 5.847 1.00 61.41 O1- ATOM 0 H GLU A 26 -50.057 7.343 1.350 1.00 43.40 H new ATOM 0 HA GLU A 26 -48.169 9.463 1.136 1.00 42.11 H new ATOM 0 HB2 GLU A 26 -47.958 10.115 3.421 1.00 74.23 H new ATOM 0 HB3 GLU A 26 -49.652 10.306 3.012 1.00 74.23 H new ATOM 0 HG2 GLU A 26 -49.767 7.794 3.964 1.00 70.14 H new ATOM 0 HG3 GLU A 26 -48.344 8.328 4.836 1.00 70.14 H new ATOM 374 N ILE A 27 -46.407 7.894 2.149 1.00 34.23 N ATOM 375 CA ILE A 27 -45.412 6.854 2.378 1.00 51.54 C ATOM 376 C ILE A 27 -45.392 6.427 3.842 1.00 3.43 C ATOM 377 O ILE A 27 -45.620 7.237 4.741 1.00 75.14 O ATOM 378 CB ILE A 27 -44.003 7.324 1.973 1.00 31.11 C ATOM 379 CG1 ILE A 27 -43.047 6.132 1.893 1.00 64.55 C ATOM 380 CG2 ILE A 27 -43.485 8.360 2.960 1.00 22.12 C ATOM 381 CD1 ILE A 27 -41.637 6.512 1.495 1.00 33.44 C ATOM 0 H ILE A 27 -46.019 8.829 2.023 1.00 34.23 H new ATOM 0 HA ILE A 27 -45.695 6.004 1.757 1.00 51.54 H new ATOM 0 HB ILE A 27 -44.060 7.787 0.988 1.00 31.11 H new ATOM 0 HG12 ILE A 27 -43.020 5.633 2.862 1.00 64.55 H new ATOM 0 HG13 ILE A 27 -43.437 5.412 1.174 1.00 64.55 H new ATOM 0 HG21 ILE A 27 -42.488 8.682 2.660 1.00 22.12 H new ATOM 0 HG22 ILE A 27 -44.156 9.219 2.971 1.00 22.12 H new ATOM 0 HG23 ILE A 27 -43.440 7.922 3.957 1.00 22.12 H new ATOM 0 HD11 ILE A 27 -41.016 5.617 1.459 1.00 33.44 H new ATOM 0 HD12 ILE A 27 -41.651 6.984 0.513 1.00 33.44 H new ATOM 0 HD13 ILE A 27 -41.228 7.209 2.227 1.00 33.44 H new ATOM 393 N THR A 28 -45.114 5.147 4.076 1.00 23.51 N ATOM 394 CA THR A 28 -45.063 4.612 5.430 1.00 45.35 C ATOM 395 C THR A 28 -44.121 3.417 5.514 1.00 32.33 C ATOM 396 O THR A 28 -43.551 2.992 4.508 1.00 33.43 O ATOM 397 CB THR A 28 -46.460 4.184 5.919 1.00 53.03 C ATOM 398 OG1 THR A 28 -46.423 3.903 7.322 1.00 4.11 O ATOM 399 CG2 THR A 28 -46.945 2.957 5.163 1.00 21.31 C ATOM 0 H THR A 28 -44.921 4.463 3.345 1.00 23.51 H new ATOM 0 HA THR A 28 -44.691 5.411 6.071 1.00 45.35 H new ATOM 0 HB THR A 28 -47.153 5.004 5.732 1.00 53.03 H new ATOM 0 HG1 THR A 28 -47.315 3.633 7.625 1.00 4.11 H new ATOM 0 HG21 THR A 28 -47.933 2.673 5.525 1.00 21.31 H new ATOM 0 HG22 THR A 28 -47.000 3.184 4.098 1.00 21.31 H new ATOM 0 HG23 THR A 28 -46.250 2.133 5.323 1.00 21.31 H new ATOM 407 N ARG A 29 -43.960 2.879 6.718 1.00 14.42 N ATOM 408 CA ARG A 29 -43.085 1.732 6.931 1.00 74.04 C ATOM 409 C ARG A 29 -43.874 0.537 7.459 1.00 61.04 C ATOM 410 O ARG A 29 -44.495 0.610 8.519 1.00 23.41 O ATOM 411 CB ARG A 29 -41.968 2.092 7.913 1.00 13.44 C ATOM 412 CG ARG A 29 -42.463 2.789 9.170 1.00 21.03 C ATOM 413 CD ARG A 29 -41.607 2.435 10.376 1.00 15.43 C ATOM 414 NE ARG A 29 -42.067 3.107 11.588 1.00 11.32 N ATOM 415 CZ ARG A 29 -43.123 2.714 12.292 1.00 74.13 C ATOM 416 NH1 ARG A 29 -43.825 1.657 11.904 1.00 53.55 N1+ ATOM 417 NH2 ARG A 29 -43.479 3.377 13.385 1.00 74.03 N ATOM 0 H ARG A 29 -44.424 3.218 7.561 1.00 14.42 H new ATOM 0 HA ARG A 29 -42.644 1.460 5.972 1.00 74.04 H new ATOM 0 HB2 ARG A 29 -41.438 1.183 8.197 1.00 13.44 H new ATOM 0 HB3 ARG A 29 -41.247 2.737 7.410 1.00 13.44 H new ATOM 0 HG2 ARG A 29 -42.451 3.868 9.018 1.00 21.03 H new ATOM 0 HG3 ARG A 29 -43.498 2.506 9.361 1.00 21.03 H new ATOM 0 HD2 ARG A 29 -41.626 1.356 10.530 1.00 15.43 H new ATOM 0 HD3 ARG A 29 -40.571 2.711 10.179 1.00 15.43 H new ATOM 0 HE ARG A 29 -41.549 3.924 11.912 1.00 11.32 H new ATOM 0 HH11 ARG A 29 -43.554 1.145 11.064 1.00 53.55 H new ATOM 0 HH12 ARG A 29 -44.635 1.356 12.445 1.00 53.55 H new ATOM 0 HH21 ARG A 29 -42.942 4.190 13.686 1.00 74.03 H new ATOM 0 HH22 ARG A 29 -44.290 3.074 13.924 1.00 74.03 H new ATOM 431 N ASP A 30 -43.845 -0.561 6.711 1.00 64.35 N ATOM 432 CA ASP A 30 -44.557 -1.771 7.103 1.00 0.23 C ATOM 433 C ASP A 30 -43.821 -3.016 6.615 1.00 34.02 C ATOM 434 O ASP A 30 -44.103 -3.530 5.532 1.00 14.01 O ATOM 435 CB ASP A 30 -45.981 -1.755 6.545 1.00 31.35 C ATOM 436 CG ASP A 30 -46.709 -3.065 6.775 1.00 31.41 C ATOM 437 OD1 ASP A 30 -46.933 -3.421 7.950 1.00 64.23 O ATOM 438 OD2 ASP A 30 -47.052 -3.735 5.778 1.00 50.33 O1- ATOM 0 H ASP A 30 -43.336 -0.637 5.830 1.00 64.35 H new ATOM 0 HA ASP A 30 -44.602 -1.799 8.192 1.00 0.23 H new ATOM 0 HB2 ASP A 30 -46.541 -0.945 7.011 1.00 31.35 H new ATOM 0 HB3 ASP A 30 -45.947 -1.545 5.476 1.00 31.35 H new ATOM 443 N ILE A 31 -42.879 -3.494 7.421 1.00 63.23 N ATOM 444 CA ILE A 31 -42.105 -4.678 7.071 1.00 25.31 C ATOM 445 C ILE A 31 -42.470 -5.858 7.965 1.00 64.24 C ATOM 446 O ILE A 31 -41.795 -6.154 8.951 1.00 20.01 O ATOM 447 CB ILE A 31 -40.591 -4.413 7.182 1.00 73.13 C ATOM 448 CG1 ILE A 31 -40.258 -3.009 6.672 1.00 24.14 C ATOM 449 CG2 ILE A 31 -39.812 -5.463 6.406 1.00 43.12 C ATOM 450 CD1 ILE A 31 -40.723 -2.755 5.256 1.00 71.21 C ATOM 0 H ILE A 31 -42.634 -3.080 8.320 1.00 63.23 H new ATOM 0 HA ILE A 31 -42.349 -4.920 6.037 1.00 25.31 H new ATOM 0 HB ILE A 31 -40.302 -4.476 8.231 1.00 73.13 H new ATOM 0 HG12 ILE A 31 -40.715 -2.273 7.333 1.00 24.14 H new ATOM 0 HG13 ILE A 31 -39.180 -2.858 6.724 1.00 24.14 H new ATOM 0 HG21 ILE A 31 -38.744 -5.263 6.494 1.00 43.12 H new ATOM 0 HG22 ILE A 31 -40.030 -6.451 6.811 1.00 43.12 H new ATOM 0 HG23 ILE A 31 -40.102 -5.429 5.356 1.00 43.12 H new ATOM 0 HD11 ILE A 31 -40.453 -1.741 4.961 1.00 71.21 H new ATOM 0 HD12 ILE A 31 -40.246 -3.468 4.583 1.00 71.21 H new ATOM 0 HD13 ILE A 31 -41.805 -2.873 5.202 1.00 71.21 H new ATOM 462 N PRO A 32 -43.562 -6.552 7.612 1.00 34.15 N ATOM 463 CA PRO A 32 -44.041 -7.713 8.367 1.00 63.53 C ATOM 464 C PRO A 32 -43.114 -8.916 8.231 1.00 74.13 C ATOM 465 O PRO A 32 -42.512 -9.131 7.180 1.00 52.54 O ATOM 466 CB PRO A 32 -45.402 -8.012 7.734 1.00 61.33 C ATOM 467 CG PRO A 32 -45.305 -7.462 6.353 1.00 72.25 C ATOM 468 CD PRO A 32 -44.415 -6.256 6.448 1.00 11.40 C ATOM 0 HA PRO A 32 -44.089 -7.511 9.437 1.00 63.53 H new ATOM 0 HB2 PRO A 32 -45.606 -9.083 7.721 1.00 61.33 H new ATOM 0 HB3 PRO A 32 -46.211 -7.540 8.292 1.00 61.33 H new ATOM 0 HG2 PRO A 32 -44.889 -8.200 5.667 1.00 72.25 H new ATOM 0 HG3 PRO A 32 -46.289 -7.191 5.971 1.00 72.25 H new ATOM 0 HD2 PRO A 32 -43.825 -6.120 5.542 1.00 11.40 H new ATOM 0 HD3 PRO A 32 -44.991 -5.342 6.594 1.00 11.40 H new ATOM 476 N ASN A 33 -43.004 -9.696 9.301 1.00 71.22 N ATOM 477 CA ASN A 33 -42.150 -10.879 9.299 1.00 2.45 C ATOM 478 C ASN A 33 -40.684 -10.490 9.133 1.00 2.05 C ATOM 479 O ASN A 33 -39.905 -11.213 8.512 1.00 32.14 O ATOM 480 CB ASN A 33 -42.565 -11.833 8.178 1.00 52.30 C ATOM 481 CG ASN A 33 -44.071 -11.971 8.064 1.00 14.10 C ATOM 482 OD1 ASN A 33 -44.756 -12.256 9.047 1.00 31.13 O ATOM 483 ND2 ASN A 33 -44.596 -11.766 6.861 1.00 31.33 N ATOM 0 H ASN A 33 -43.495 -9.531 10.180 1.00 71.22 H new ATOM 0 HA ASN A 33 -42.269 -11.383 10.258 1.00 2.45 H new ATOM 0 HB2 ASN A 33 -42.163 -11.473 7.231 1.00 52.30 H new ATOM 0 HB3 ASN A 33 -42.126 -12.814 8.358 1.00 52.30 H new ATOM 0 HD21 ASN A 33 -45.604 -11.843 6.725 1.00 31.33 H new ATOM 0 HD22 ASN A 33 -43.991 -11.532 6.074 1.00 31.33 H new ATOM 490 N VAL A 34 -40.314 -9.343 9.695 1.00 34.42 N ATOM 491 CA VAL A 34 -38.941 -8.858 9.611 1.00 3.55 C ATOM 492 C VAL A 34 -38.198 -9.083 10.924 1.00 63.25 C ATOM 493 O VAL A 34 -38.812 -9.211 11.982 1.00 72.34 O ATOM 494 CB VAL A 34 -38.896 -7.359 9.258 1.00 61.54 C ATOM 495 CG1 VAL A 34 -39.349 -6.518 10.442 1.00 74.44 C ATOM 496 CG2 VAL A 34 -37.497 -6.960 8.814 1.00 63.24 C ATOM 0 H VAL A 34 -40.946 -8.733 10.213 1.00 34.42 H new ATOM 0 HA VAL A 34 -38.452 -9.425 8.818 1.00 3.55 H new ATOM 0 HB VAL A 34 -39.582 -7.176 8.430 1.00 61.54 H new ATOM 0 HG11 VAL A 34 -39.311 -5.462 10.174 1.00 74.44 H new ATOM 0 HG12 VAL A 34 -40.371 -6.787 10.710 1.00 74.44 H new ATOM 0 HG13 VAL A 34 -38.691 -6.701 11.291 1.00 74.44 H new ATOM 0 HG21 VAL A 34 -37.482 -5.898 8.568 1.00 63.24 H new ATOM 0 HG22 VAL A 34 -36.790 -7.156 9.620 1.00 63.24 H new ATOM 0 HG23 VAL A 34 -37.215 -7.540 7.935 1.00 63.24 H new ATOM 506 N GLY A 35 -36.872 -9.130 10.846 1.00 71.54 N ATOM 507 CA GLY A 35 -36.067 -9.340 12.034 1.00 61.21 C ATOM 508 C GLY A 35 -35.960 -8.092 12.889 1.00 63.23 C ATOM 509 O GLY A 35 -35.804 -6.988 12.370 1.00 50.52 O ATOM 0 H GLY A 35 -36.341 -9.026 9.981 1.00 71.54 H new ATOM 0 HA2 GLY A 35 -36.501 -10.146 12.626 1.00 61.21 H new ATOM 0 HA3 GLY A 35 -35.068 -9.662 11.740 1.00 61.21 H new ATOM 513 N GLU A 36 -36.045 -8.268 14.204 1.00 25.34 N ATOM 514 CA GLU A 36 -35.960 -7.147 15.132 1.00 23.30 C ATOM 515 C GLU A 36 -34.669 -6.363 14.920 1.00 75.14 C ATOM 516 O GLU A 36 -34.613 -5.158 15.169 1.00 34.31 O ATOM 517 CB GLU A 36 -36.035 -7.645 16.577 1.00 11.14 C ATOM 518 CG GLU A 36 -34.958 -8.656 16.929 1.00 41.24 C ATOM 519 CD GLU A 36 -35.178 -9.293 18.288 1.00 1.32 C ATOM 520 OE1 GLU A 36 -36.350 -9.501 18.664 1.00 11.12 O ATOM 521 OE2 GLU A 36 -34.175 -9.585 18.974 1.00 24.50 O1- ATOM 0 H GLU A 36 -36.173 -9.176 14.650 1.00 25.34 H new ATOM 0 HA GLU A 36 -36.804 -6.484 14.939 1.00 23.30 H new ATOM 0 HB2 GLU A 36 -35.955 -6.792 17.251 1.00 11.14 H new ATOM 0 HB3 GLU A 36 -37.013 -8.095 16.747 1.00 11.14 H new ATOM 0 HG2 GLU A 36 -34.933 -9.435 16.167 1.00 41.24 H new ATOM 0 HG3 GLU A 36 -33.985 -8.165 16.915 1.00 41.24 H new ATOM 528 N ASP A 37 -33.633 -7.054 14.458 1.00 22.02 N ATOM 529 CA ASP A 37 -32.342 -6.422 14.211 1.00 32.15 C ATOM 530 C ASP A 37 -32.416 -5.481 13.013 1.00 14.55 C ATOM 531 O ASP A 37 -31.746 -4.450 12.978 1.00 61.42 O ATOM 532 CB ASP A 37 -31.268 -7.486 13.973 1.00 75.52 C ATOM 533 CG ASP A 37 -30.854 -8.187 15.252 1.00 61.23 C ATOM 534 OD1 ASP A 37 -31.579 -8.059 16.261 1.00 2.44 O ATOM 535 OD2 ASP A 37 -29.804 -8.864 15.245 1.00 44.23 O1- ATOM 0 H ASP A 37 -33.662 -8.052 14.247 1.00 22.02 H new ATOM 0 HA ASP A 37 -32.077 -5.838 15.092 1.00 32.15 H new ATOM 0 HB2 ASP A 37 -31.642 -8.223 13.263 1.00 75.52 H new ATOM 0 HB3 ASP A 37 -30.394 -7.020 13.518 1.00 75.52 H new ATOM 540 N ALA A 38 -33.236 -5.845 12.032 1.00 41.12 N ATOM 541 CA ALA A 38 -33.399 -5.032 10.833 1.00 33.22 C ATOM 542 C ALA A 38 -34.038 -3.688 11.164 1.00 61.11 C ATOM 543 O ALA A 38 -33.903 -2.722 10.410 1.00 73.30 O ATOM 544 CB ALA A 38 -34.235 -5.776 9.802 1.00 54.45 C ATOM 0 H ALA A 38 -33.797 -6.697 12.044 1.00 41.12 H new ATOM 0 HA ALA A 38 -32.410 -4.842 10.415 1.00 33.22 H new ATOM 0 HB1 ALA A 38 -34.349 -5.158 8.912 1.00 54.45 H new ATOM 0 HB2 ALA A 38 -33.738 -6.709 9.535 1.00 54.45 H new ATOM 0 HB3 ALA A 38 -35.218 -5.995 10.220 1.00 54.45 H new ATOM 550 N LEU A 39 -34.735 -3.630 12.293 1.00 44.35 N ATOM 551 CA LEU A 39 -35.396 -2.404 12.724 1.00 51.12 C ATOM 552 C LEU A 39 -34.796 -1.891 14.030 1.00 25.44 C ATOM 553 O LEU A 39 -35.380 -1.040 14.701 1.00 75.32 O ATOM 554 CB LEU A 39 -36.897 -2.643 12.898 1.00 75.42 C ATOM 555 CG LEU A 39 -37.291 -3.764 13.858 1.00 63.45 C ATOM 556 CD1 LEU A 39 -37.323 -3.254 15.291 1.00 3.12 C ATOM 557 CD2 LEU A 39 -38.639 -4.352 13.469 1.00 33.13 C ATOM 0 H LEU A 39 -34.857 -4.419 12.927 1.00 44.35 H new ATOM 0 HA LEU A 39 -35.242 -1.648 11.954 1.00 51.12 H new ATOM 0 HB2 LEU A 39 -37.354 -1.717 13.246 1.00 75.42 H new ATOM 0 HB3 LEU A 39 -37.325 -2.862 11.920 1.00 75.42 H new ATOM 0 HG LEU A 39 -36.541 -4.552 13.791 1.00 63.45 H new ATOM 0 HD11 LEU A 39 -37.606 -4.067 15.960 1.00 3.12 H new ATOM 0 HD12 LEU A 39 -36.336 -2.883 15.567 1.00 3.12 H new ATOM 0 HD13 LEU A 39 -38.050 -2.446 15.374 1.00 3.12 H new ATOM 0 HD21 LEU A 39 -38.903 -5.149 14.164 1.00 33.13 H new ATOM 0 HD22 LEU A 39 -39.400 -3.572 13.505 1.00 33.13 H new ATOM 0 HD23 LEU A 39 -38.582 -4.756 12.458 1.00 33.13 H new ATOM 569 N ARG A 40 -33.627 -2.414 14.383 1.00 20.52 N ATOM 570 CA ARG A 40 -32.947 -2.010 15.608 1.00 43.52 C ATOM 571 C ARG A 40 -32.413 -0.585 15.488 1.00 33.33 C ATOM 572 O ARG A 40 -32.352 0.149 16.472 1.00 61.33 O ATOM 573 CB ARG A 40 -31.800 -2.971 15.922 1.00 31.43 C ATOM 574 CG ARG A 40 -30.580 -2.774 15.036 1.00 41.24 C ATOM 575 CD ARG A 40 -29.686 -4.004 15.039 1.00 43.45 C ATOM 576 NE ARG A 40 -28.783 -4.021 16.187 1.00 63.04 N ATOM 577 CZ ARG A 40 -28.066 -5.081 16.542 1.00 32.22 C ATOM 578 NH1 ARG A 40 -28.146 -6.205 15.841 1.00 22.50 N1+ ATOM 579 NH2 ARG A 40 -27.266 -5.019 17.599 1.00 20.05 N ATOM 0 H ARG A 40 -33.130 -3.119 13.838 1.00 20.52 H new ATOM 0 HA ARG A 40 -33.671 -2.042 16.423 1.00 43.52 H new ATOM 0 HB2 ARG A 40 -31.506 -2.844 16.964 1.00 31.43 H new ATOM 0 HB3 ARG A 40 -32.156 -3.996 15.813 1.00 31.43 H new ATOM 0 HG2 ARG A 40 -30.900 -2.558 14.017 1.00 41.24 H new ATOM 0 HG3 ARG A 40 -30.013 -1.910 15.382 1.00 41.24 H new ATOM 0 HD2 ARG A 40 -30.304 -4.902 15.051 1.00 43.45 H new ATOM 0 HD3 ARG A 40 -29.103 -4.031 14.119 1.00 43.45 H new ATOM 0 HE ARG A 40 -28.699 -3.172 16.747 1.00 63.04 H new ATOM 0 HH11 ARG A 40 -28.759 -6.256 15.027 1.00 22.50 H new ATOM 0 HH12 ARG A 40 -27.594 -7.018 16.116 1.00 22.50 H new ATOM 0 HH21 ARG A 40 -27.201 -4.157 18.140 1.00 20.05 H new ATOM 0 HH22 ARG A 40 -26.716 -5.834 17.871 1.00 20.05 H new ATOM 593 N ASN A 41 -32.028 -0.203 14.274 1.00 55.32 N ATOM 594 CA ASN A 41 -31.499 1.133 14.026 1.00 71.13 C ATOM 595 C ASN A 41 -32.556 2.027 13.387 1.00 35.30 C ATOM 596 O ASN A 41 -32.495 3.253 13.493 1.00 31.23 O ATOM 597 CB ASN A 41 -30.266 1.055 13.122 1.00 34.41 C ATOM 598 CG ASN A 41 -29.173 0.181 13.707 1.00 10.32 C ATOM 599 OD1 ASN A 41 -28.744 0.382 14.844 1.00 32.53 O ATOM 600 ND2 ASN A 41 -28.718 -0.796 12.932 1.00 61.32 N ATOM 0 H ASN A 41 -32.073 -0.799 13.448 1.00 55.32 H new ATOM 0 HA ASN A 41 -31.213 1.568 14.984 1.00 71.13 H new ATOM 0 HB2 ASN A 41 -30.558 0.663 12.148 1.00 34.41 H new ATOM 0 HB3 ASN A 41 -29.875 2.059 12.958 1.00 34.41 H new ATOM 0 HD21 ASN A 41 -27.984 -1.417 13.272 1.00 61.32 H new ATOM 0 HD22 ASN A 41 -29.103 -0.926 11.996 1.00 61.32 H new ATOM 607 N LEU A 42 -33.526 1.407 12.724 1.00 5.31 N ATOM 608 CA LEU A 42 -34.599 2.146 12.068 1.00 1.45 C ATOM 609 C LEU A 42 -35.256 3.126 13.035 1.00 41.30 C ATOM 610 O LEU A 42 -35.520 2.791 14.190 1.00 64.12 O ATOM 611 CB LEU A 42 -35.646 1.180 11.514 1.00 35.41 C ATOM 612 CG LEU A 42 -36.377 1.635 10.250 1.00 32.44 C ATOM 613 CD1 LEU A 42 -35.634 1.172 9.007 1.00 21.05 C ATOM 614 CD2 LEU A 42 -37.807 1.113 10.244 1.00 43.22 C ATOM 0 H LEU A 42 -33.591 0.394 12.626 1.00 5.31 H new ATOM 0 HA LEU A 42 -34.165 2.713 11.244 1.00 1.45 H new ATOM 0 HB2 LEU A 42 -35.158 0.228 11.305 1.00 35.41 H new ATOM 0 HB3 LEU A 42 -36.387 0.994 12.291 1.00 35.41 H new ATOM 0 HG LEU A 42 -36.408 2.725 10.244 1.00 32.44 H new ATOM 0 HD11 LEU A 42 -36.169 1.505 8.118 1.00 21.05 H new ATOM 0 HD12 LEU A 42 -34.629 1.594 9.005 1.00 21.05 H new ATOM 0 HD13 LEU A 42 -35.570 0.084 9.006 1.00 21.05 H new ATOM 0 HD21 LEU A 42 -38.312 1.446 9.337 1.00 43.22 H new ATOM 0 HD22 LEU A 42 -37.797 0.023 10.274 1.00 43.22 H new ATOM 0 HD23 LEU A 42 -38.337 1.495 11.116 1.00 43.22 H new ATOM 626 N ASP A 43 -35.517 4.337 12.556 1.00 10.14 N ATOM 627 CA ASP A 43 -36.147 5.364 13.376 1.00 31.33 C ATOM 628 C ASP A 43 -37.617 5.533 13.004 1.00 31.33 C ATOM 629 O ASP A 43 -38.162 4.756 12.219 1.00 2.34 O ATOM 630 CB ASP A 43 -35.412 6.696 13.217 1.00 44.20 C ATOM 631 CG ASP A 43 -33.937 6.588 13.554 1.00 54.04 C ATOM 632 OD1 ASP A 43 -33.587 5.761 14.421 1.00 1.31 O ATOM 633 OD2 ASP A 43 -33.135 7.331 12.951 1.00 30.34 O1- ATOM 0 H ASP A 43 -35.302 4.631 11.603 1.00 10.14 H new ATOM 0 HA ASP A 43 -36.089 5.047 14.417 1.00 31.33 H new ATOM 0 HB2 ASP A 43 -35.522 7.048 12.191 1.00 44.20 H new ATOM 0 HB3 ASP A 43 -35.875 7.442 13.862 1.00 44.20 H new ATOM 638 N ASP A 44 -38.253 6.552 13.573 1.00 73.33 N ATOM 639 CA ASP A 44 -39.659 6.822 13.301 1.00 11.43 C ATOM 640 C ASP A 44 -39.865 7.221 11.843 1.00 44.41 C ATOM 641 O ASP A 44 -40.984 7.189 11.332 1.00 0.12 O ATOM 642 CB ASP A 44 -40.176 7.928 14.223 1.00 63.23 C ATOM 643 CG ASP A 44 -40.209 7.500 15.677 1.00 31.34 C ATOM 644 OD1 ASP A 44 -41.218 6.891 16.093 1.00 40.13 O ATOM 645 OD2 ASP A 44 -39.229 7.775 16.400 1.00 13.32 O1- ATOM 0 H ASP A 44 -37.817 7.204 14.225 1.00 73.33 H new ATOM 0 HA ASP A 44 -40.222 5.908 13.491 1.00 11.43 H new ATOM 0 HB2 ASP A 44 -39.542 8.809 14.121 1.00 63.23 H new ATOM 0 HB3 ASP A 44 -41.179 8.219 13.910 1.00 63.23 H new ATOM 650 N ARG A 45 -38.776 7.598 11.180 1.00 71.11 N ATOM 651 CA ARG A 45 -38.837 8.006 9.782 1.00 52.13 C ATOM 652 C ARG A 45 -38.963 6.792 8.866 1.00 35.45 C ATOM 653 O ARG A 45 -39.422 6.903 7.730 1.00 3.22 O ATOM 654 CB ARG A 45 -37.591 8.813 9.409 1.00 65.04 C ATOM 655 CG ARG A 45 -37.611 10.239 9.932 1.00 43.34 C ATOM 656 CD ARG A 45 -36.222 10.859 9.913 1.00 43.42 C ATOM 657 NE ARG A 45 -36.243 12.260 10.324 1.00 64.23 N ATOM 658 CZ ARG A 45 -35.151 13.010 10.432 1.00 23.12 C ATOM 659 NH1 ARG A 45 -33.960 12.496 10.161 1.00 63.01 N1+ ATOM 660 NH2 ARG A 45 -35.250 14.278 10.812 1.00 3.01 N ATOM 0 H ARG A 45 -37.842 7.629 11.589 1.00 71.11 H new ATOM 0 HA ARG A 45 -39.720 8.632 9.651 1.00 52.13 H new ATOM 0 HB2 ARG A 45 -36.709 8.304 9.798 1.00 65.04 H new ATOM 0 HB3 ARG A 45 -37.494 8.834 8.324 1.00 65.04 H new ATOM 0 HG2 ARG A 45 -38.288 10.841 9.325 1.00 43.34 H new ATOM 0 HG3 ARG A 45 -38.001 10.249 10.950 1.00 43.34 H new ATOM 0 HD2 ARG A 45 -35.565 10.296 10.576 1.00 43.42 H new ATOM 0 HD3 ARG A 45 -35.804 10.782 8.909 1.00 43.42 H new ATOM 0 HE ARG A 45 -37.144 12.686 10.540 1.00 64.23 H new ATOM 0 HH11 ARG A 45 -33.879 11.522 9.869 1.00 63.01 H new ATOM 0 HH12 ARG A 45 -33.124 13.074 10.245 1.00 63.01 H new ATOM 0 HH21 ARG A 45 -36.165 14.678 11.021 1.00 3.01 H new ATOM 0 HH22 ARG A 45 -34.411 14.853 10.895 1.00 3.01 H new ATOM 674 N GLY A 46 -38.549 5.632 9.369 1.00 63.25 N ATOM 675 CA GLY A 46 -38.623 4.414 8.583 1.00 13.20 C ATOM 676 C GLY A 46 -37.336 4.129 7.834 1.00 41.41 C ATOM 677 O GLY A 46 -37.325 3.356 6.876 1.00 11.40 O ATOM 0 H GLY A 46 -38.164 5.515 10.306 1.00 63.25 H new ATOM 0 HA2 GLY A 46 -38.851 3.575 9.240 1.00 13.20 H new ATOM 0 HA3 GLY A 46 -39.444 4.494 7.871 1.00 13.20 H new ATOM 681 N VAL A 47 -36.248 4.757 8.268 1.00 30.53 N ATOM 682 CA VAL A 47 -34.950 4.568 7.632 1.00 42.32 C ATOM 683 C VAL A 47 -33.860 4.322 8.668 1.00 35.22 C ATOM 684 O VAL A 47 -33.852 4.941 9.734 1.00 74.45 O ATOM 685 CB VAL A 47 -34.563 5.786 6.773 1.00 33.24 C ATOM 686 CG1 VAL A 47 -34.494 7.041 7.629 1.00 62.32 C ATOM 687 CG2 VAL A 47 -33.239 5.539 6.065 1.00 11.24 C ATOM 0 H VAL A 47 -36.240 5.402 9.058 1.00 30.53 H new ATOM 0 HA VAL A 47 -35.038 3.693 6.988 1.00 42.32 H new ATOM 0 HB VAL A 47 -35.332 5.934 6.014 1.00 33.24 H new ATOM 0 HG11 VAL A 47 -34.219 7.892 7.006 1.00 62.32 H new ATOM 0 HG12 VAL A 47 -35.467 7.224 8.085 1.00 62.32 H new ATOM 0 HG13 VAL A 47 -33.746 6.908 8.411 1.00 62.32 H new ATOM 0 HG21 VAL A 47 -32.981 6.410 5.462 1.00 11.24 H new ATOM 0 HG22 VAL A 47 -32.458 5.365 6.805 1.00 11.24 H new ATOM 0 HG23 VAL A 47 -33.329 4.665 5.420 1.00 11.24 H new ATOM 697 N ILE A 48 -32.941 3.418 8.350 1.00 4.11 N ATOM 698 CA ILE A 48 -31.845 3.092 9.255 1.00 23.31 C ATOM 699 C ILE A 48 -30.883 4.266 9.397 1.00 42.35 C ATOM 700 O ILE A 48 -30.428 4.834 8.404 1.00 21.41 O ATOM 701 CB ILE A 48 -31.062 1.858 8.768 1.00 74.51 C ATOM 702 CG1 ILE A 48 -31.972 0.629 8.735 1.00 2.21 C ATOM 703 CG2 ILE A 48 -29.857 1.608 9.664 1.00 61.43 C ATOM 704 CD1 ILE A 48 -32.435 0.183 10.104 1.00 11.41 C ATOM 0 H ILE A 48 -32.933 2.898 7.473 1.00 4.11 H new ATOM 0 HA ILE A 48 -32.291 2.871 10.225 1.00 23.31 H new ATOM 0 HB ILE A 48 -30.705 2.049 7.756 1.00 74.51 H new ATOM 0 HG12 ILE A 48 -32.844 0.849 8.119 1.00 2.21 H new ATOM 0 HG13 ILE A 48 -31.442 -0.193 8.254 1.00 2.21 H new ATOM 0 HG21 ILE A 48 -29.314 0.733 9.307 1.00 61.43 H new ATOM 0 HG22 ILE A 48 -29.200 2.477 9.641 1.00 61.43 H new ATOM 0 HG23 ILE A 48 -30.193 1.434 10.686 1.00 61.43 H new ATOM 0 HD11 ILE A 48 -33.076 -0.693 10.004 1.00 11.41 H new ATOM 0 HD12 ILE A 48 -31.569 -0.069 10.717 1.00 11.41 H new ATOM 0 HD13 ILE A 48 -32.994 0.989 10.580 1.00 11.41 H new ATOM 716 N ARG A 49 -30.577 4.626 10.639 1.00 61.21 N ATOM 717 CA ARG A 49 -29.668 5.733 10.912 1.00 55.21 C ATOM 718 C ARG A 49 -28.279 5.447 10.351 1.00 4.43 C ATOM 719 O ARG A 49 -27.949 4.303 10.036 1.00 74.42 O ATOM 720 CB ARG A 49 -29.579 5.987 12.418 1.00 75.12 C ATOM 721 CG ARG A 49 -28.924 7.312 12.774 1.00 63.14 C ATOM 722 CD ARG A 49 -29.072 7.627 14.255 1.00 21.00 C ATOM 723 NE ARG A 49 -28.523 8.938 14.593 1.00 40.53 N ATOM 724 CZ ARG A 49 -28.596 9.474 15.806 1.00 35.01 C ATOM 725 NH1 ARG A 49 -29.192 8.815 16.791 1.00 2.42 N1+ ATOM 726 NH2 ARG A 49 -28.072 10.671 16.036 1.00 44.41 N ATOM 0 H ARG A 49 -30.945 4.167 11.472 1.00 61.21 H new ATOM 0 HA ARG A 49 -30.062 6.623 10.422 1.00 55.21 H new ATOM 0 HB2 ARG A 49 -30.583 5.962 12.842 1.00 75.12 H new ATOM 0 HB3 ARG A 49 -29.016 5.177 12.882 1.00 75.12 H new ATOM 0 HG2 ARG A 49 -27.866 7.278 12.512 1.00 63.14 H new ATOM 0 HG3 ARG A 49 -29.373 8.111 12.184 1.00 63.14 H new ATOM 0 HD2 ARG A 49 -30.126 7.594 14.529 1.00 21.00 H new ATOM 0 HD3 ARG A 49 -28.566 6.860 14.841 1.00 21.00 H new ATOM 0 HE ARG A 49 -28.058 9.471 13.858 1.00 40.53 H new ATOM 0 HH11 ARG A 49 -29.596 7.894 16.618 1.00 2.42 H new ATOM 0 HH12 ARG A 49 -29.247 9.229 17.722 1.00 2.42 H new ATOM 0 HH21 ARG A 49 -27.613 11.180 15.281 1.00 44.41 H new ATOM 0 HH22 ARG A 49 -28.128 11.082 16.968 1.00 44.41 H new ATOM 740 N ILE A 50 -27.470 6.494 10.227 1.00 42.34 N ATOM 741 CA ILE A 50 -26.117 6.354 9.704 1.00 64.41 C ATOM 742 C ILE A 50 -25.226 5.592 10.679 1.00 25.51 C ATOM 743 O ILE A 50 -25.448 5.618 11.888 1.00 50.31 O ATOM 744 CB ILE A 50 -25.482 7.727 9.413 1.00 4.21 C ATOM 745 CG1 ILE A 50 -26.462 8.614 8.642 1.00 31.11 C ATOM 746 CG2 ILE A 50 -24.187 7.557 8.630 1.00 54.25 C ATOM 747 CD1 ILE A 50 -26.943 8.000 7.346 1.00 54.33 C ATOM 0 H ILE A 50 -27.728 7.447 10.481 1.00 42.34 H new ATOM 0 HA ILE A 50 -26.195 5.793 8.773 1.00 64.41 H new ATOM 0 HB ILE A 50 -25.251 8.211 10.362 1.00 4.21 H new ATOM 0 HG12 ILE A 50 -27.323 8.826 9.276 1.00 31.11 H new ATOM 0 HG13 ILE A 50 -25.982 9.569 8.426 1.00 31.11 H new ATOM 0 HG21 ILE A 50 -23.750 8.536 8.432 1.00 54.25 H new ATOM 0 HG22 ILE A 50 -23.486 6.958 9.211 1.00 54.25 H new ATOM 0 HG23 ILE A 50 -24.396 7.055 7.685 1.00 54.25 H new ATOM 0 HD11 ILE A 50 -27.634 8.684 6.854 1.00 54.33 H new ATOM 0 HD12 ILE A 50 -26.090 7.814 6.693 1.00 54.33 H new ATOM 0 HD13 ILE A 50 -27.452 7.059 7.556 1.00 54.33 H new ATOM 759 N GLY A 51 -24.215 4.914 10.142 1.00 2.14 N ATOM 760 CA GLY A 51 -23.305 4.155 10.979 1.00 43.44 C ATOM 761 C GLY A 51 -23.788 2.740 11.229 1.00 53.24 C ATOM 762 O GLY A 51 -23.279 2.048 12.109 1.00 63.33 O ATOM 0 H GLY A 51 -24.011 4.877 9.143 1.00 2.14 H new ATOM 0 HA2 GLY A 51 -22.324 4.122 10.506 1.00 43.44 H new ATOM 0 HA3 GLY A 51 -23.182 4.667 11.933 1.00 43.44 H new ATOM 766 N ALA A 52 -24.777 2.309 10.451 1.00 53.13 N ATOM 767 CA ALA A 52 -25.329 0.968 10.591 1.00 25.41 C ATOM 768 C ALA A 52 -24.837 0.053 9.476 1.00 3.24 C ATOM 769 O ALA A 52 -24.877 0.413 8.300 1.00 33.21 O ATOM 770 CB ALA A 52 -26.850 1.022 10.599 1.00 4.44 C ATOM 0 H ALA A 52 -25.211 2.870 9.718 1.00 53.13 H new ATOM 0 HA ALA A 52 -24.985 0.558 11.541 1.00 25.41 H new ATOM 0 HB1 ALA A 52 -27.249 0.013 10.704 1.00 4.44 H new ATOM 0 HB2 ALA A 52 -27.188 1.635 11.435 1.00 4.44 H new ATOM 0 HB3 ALA A 52 -27.204 1.457 9.664 1.00 4.44 H new ATOM 776 N GLU A 53 -24.370 -1.134 9.852 1.00 24.44 N ATOM 777 CA GLU A 53 -23.868 -2.100 8.883 1.00 12.23 C ATOM 778 C GLU A 53 -25.009 -2.682 8.055 1.00 61.23 C ATOM 779 O GLU A 53 -26.074 -3.003 8.583 1.00 62.55 O ATOM 780 CB GLU A 53 -23.114 -3.225 9.594 1.00 5.05 C ATOM 781 CG GLU A 53 -21.791 -2.785 10.198 1.00 63.31 C ATOM 782 CD GLU A 53 -21.949 -2.208 11.592 1.00 65.35 C ATOM 783 OE1 GLU A 53 -22.554 -2.887 12.449 1.00 22.21 O ATOM 784 OE2 GLU A 53 -21.470 -1.079 11.826 1.00 42.20 O1- ATOM 0 H GLU A 53 -24.329 -1.449 10.821 1.00 24.44 H new ATOM 0 HA GLU A 53 -23.183 -1.581 8.213 1.00 12.23 H new ATOM 0 HB2 GLU A 53 -23.746 -3.632 10.383 1.00 5.05 H new ATOM 0 HB3 GLU A 53 -22.929 -4.032 8.885 1.00 5.05 H new ATOM 0 HG2 GLU A 53 -21.112 -3.637 10.236 1.00 63.31 H new ATOM 0 HG3 GLU A 53 -21.330 -2.039 9.550 1.00 63.31 H new ATOM 791 N VAL A 54 -24.779 -2.817 6.752 1.00 22.21 N ATOM 792 CA VAL A 54 -25.786 -3.361 5.850 1.00 62.55 C ATOM 793 C VAL A 54 -25.635 -4.871 5.704 1.00 25.30 C ATOM 794 O VAL A 54 -24.524 -5.400 5.729 1.00 72.42 O ATOM 795 CB VAL A 54 -25.700 -2.710 4.456 1.00 34.21 C ATOM 796 CG1 VAL A 54 -24.300 -2.859 3.882 1.00 11.11 C ATOM 797 CG2 VAL A 54 -26.736 -3.317 3.521 1.00 22.21 C ATOM 0 H VAL A 54 -23.903 -2.557 6.298 1.00 22.21 H new ATOM 0 HA VAL A 54 -26.758 -3.137 6.289 1.00 62.55 H new ATOM 0 HB VAL A 54 -25.913 -1.646 4.557 1.00 34.21 H new ATOM 0 HG11 VAL A 54 -24.259 -2.393 2.897 1.00 11.11 H new ATOM 0 HG12 VAL A 54 -23.582 -2.374 4.543 1.00 11.11 H new ATOM 0 HG13 VAL A 54 -24.054 -3.917 3.793 1.00 11.11 H new ATOM 0 HG21 VAL A 54 -26.662 -2.846 2.541 1.00 22.21 H new ATOM 0 HG22 VAL A 54 -26.556 -4.388 3.424 1.00 22.21 H new ATOM 0 HG23 VAL A 54 -27.734 -3.153 3.928 1.00 22.21 H new ATOM 807 N LYS A 55 -26.761 -5.559 5.550 1.00 32.13 N ATOM 808 CA LYS A 55 -26.755 -7.010 5.398 1.00 11.44 C ATOM 809 C LYS A 55 -28.067 -7.497 4.790 1.00 24.20 C ATOM 810 O LYS A 55 -28.987 -6.712 4.565 1.00 53.12 O ATOM 811 CB LYS A 55 -26.527 -7.685 6.752 1.00 13.34 C ATOM 812 CG LYS A 55 -27.733 -7.625 7.673 1.00 34.42 C ATOM 813 CD LYS A 55 -27.407 -8.159 9.057 1.00 72.33 C ATOM 814 CE LYS A 55 -27.057 -9.639 9.016 1.00 54.12 C ATOM 815 NZ LYS A 55 -26.879 -10.206 10.381 1.00 75.44 N1+ ATOM 0 H LYS A 55 -27.689 -5.136 5.527 1.00 32.13 H new ATOM 0 HA LYS A 55 -25.940 -7.277 4.725 1.00 11.44 H new ATOM 0 HB2 LYS A 55 -26.258 -8.728 6.587 1.00 13.34 H new ATOM 0 HB3 LYS A 55 -25.679 -7.211 7.246 1.00 13.34 H new ATOM 0 HG2 LYS A 55 -28.080 -6.595 7.752 1.00 34.42 H new ATOM 0 HG3 LYS A 55 -28.550 -8.204 7.242 1.00 34.42 H new ATOM 0 HD2 LYS A 55 -26.572 -7.598 9.477 1.00 72.33 H new ATOM 0 HD3 LYS A 55 -28.260 -8.004 9.718 1.00 72.33 H new ATOM 0 HE2 LYS A 55 -27.845 -10.184 8.497 1.00 54.12 H new ATOM 0 HE3 LYS A 55 -26.141 -9.780 8.442 1.00 54.12 H new ATOM 0 HZ1 LYS A 55 -26.642 -11.216 10.309 1.00 75.44 H new ATOM 0 HZ2 LYS A 55 -26.110 -9.703 10.868 1.00 75.44 H new ATOM 0 HZ3 LYS A 55 -27.761 -10.095 10.921 1.00 75.44 H new ATOM 829 N ASP A 56 -28.144 -8.798 4.528 1.00 1.11 N ATOM 830 CA ASP A 56 -29.345 -9.391 3.949 1.00 50.12 C ATOM 831 C ASP A 56 -30.540 -9.217 4.880 1.00 51.21 C ATOM 832 O ASP A 56 -30.406 -9.292 6.101 1.00 22.43 O ATOM 833 CB ASP A 56 -29.117 -10.876 3.661 1.00 24.03 C ATOM 834 CG ASP A 56 -29.318 -11.740 4.890 1.00 74.11 C ATOM 835 OD1 ASP A 56 -28.369 -11.859 5.694 1.00 70.55 O ATOM 836 OD2 ASP A 56 -30.423 -12.299 5.048 1.00 42.54 O1- ATOM 0 H ASP A 56 -27.390 -9.461 4.707 1.00 1.11 H new ATOM 0 HA ASP A 56 -29.560 -8.876 3.013 1.00 50.12 H new ATOM 0 HB2 ASP A 56 -29.801 -11.200 2.876 1.00 24.03 H new ATOM 0 HB3 ASP A 56 -28.105 -11.019 3.281 1.00 24.03 H new ATOM 841 N GLY A 57 -31.712 -8.985 4.295 1.00 23.23 N ATOM 842 CA GLY A 57 -32.914 -8.803 5.088 1.00 2.42 C ATOM 843 C GLY A 57 -33.055 -7.388 5.609 1.00 30.44 C ATOM 844 O GLY A 57 -34.000 -7.079 6.337 1.00 50.43 O ATOM 0 H GLY A 57 -31.850 -8.920 3.286 1.00 23.23 H new ATOM 0 HA2 GLY A 57 -33.786 -9.053 4.483 1.00 2.42 H new ATOM 0 HA3 GLY A 57 -32.900 -9.497 5.929 1.00 2.42 H new ATOM 848 N ASP A 58 -32.116 -6.525 5.238 1.00 1.23 N ATOM 849 CA ASP A 58 -32.141 -5.133 5.674 1.00 24.33 C ATOM 850 C ASP A 58 -32.220 -4.190 4.477 1.00 44.22 C ATOM 851 O ASP A 58 -31.219 -3.935 3.806 1.00 4.32 O ATOM 852 CB ASP A 58 -30.898 -4.815 6.507 1.00 74.23 C ATOM 853 CG ASP A 58 -31.038 -5.261 7.949 1.00 42.34 C ATOM 854 OD1 ASP A 58 -31.825 -6.196 8.208 1.00 52.45 O ATOM 855 OD2 ASP A 58 -30.361 -4.675 8.820 1.00 60.24 O1- ATOM 0 H ASP A 58 -31.328 -6.764 4.636 1.00 1.23 H new ATOM 0 HA ASP A 58 -33.029 -4.987 6.289 1.00 24.33 H new ATOM 0 HB2 ASP A 58 -30.031 -5.303 6.061 1.00 74.23 H new ATOM 0 HB3 ASP A 58 -30.710 -3.742 6.478 1.00 74.23 H new ATOM 860 N LEU A 59 -33.417 -3.677 4.215 1.00 1.10 N ATOM 861 CA LEU A 59 -33.628 -2.762 3.098 1.00 32.31 C ATOM 862 C LEU A 59 -33.105 -1.368 3.429 1.00 22.24 C ATOM 863 O LEU A 59 -32.750 -0.598 2.535 1.00 63.34 O ATOM 864 CB LEU A 59 -35.115 -2.691 2.746 1.00 63.13 C ATOM 865 CG LEU A 59 -35.815 -4.031 2.512 1.00 21.11 C ATOM 866 CD1 LEU A 59 -34.849 -5.040 1.909 1.00 3.32 C ATOM 867 CD2 LEU A 59 -36.398 -4.561 3.813 1.00 13.30 C ATOM 0 H LEU A 59 -34.255 -3.879 4.760 1.00 1.10 H new ATOM 0 HA LEU A 59 -33.075 -3.142 2.239 1.00 32.31 H new ATOM 0 HB2 LEU A 59 -35.634 -2.169 3.550 1.00 63.13 H new ATOM 0 HB3 LEU A 59 -35.226 -2.084 1.848 1.00 63.13 H new ATOM 0 HG LEU A 59 -36.632 -3.875 1.807 1.00 21.11 H new ATOM 0 HD11 LEU A 59 -35.365 -5.987 1.750 1.00 3.32 H new ATOM 0 HD12 LEU A 59 -34.478 -4.664 0.956 1.00 3.32 H new ATOM 0 HD13 LEU A 59 -34.011 -5.193 2.589 1.00 3.32 H new ATOM 0 HD21 LEU A 59 -36.892 -5.515 3.628 1.00 13.30 H new ATOM 0 HD22 LEU A 59 -35.598 -4.702 4.540 1.00 13.30 H new ATOM 0 HD23 LEU A 59 -37.122 -3.847 4.205 1.00 13.30 H new ATOM 879 N LEU A 60 -33.058 -1.051 4.718 1.00 4.23 N ATOM 880 CA LEU A 60 -32.576 0.251 5.168 1.00 33.23 C ATOM 881 C LEU A 60 -33.487 1.370 4.674 1.00 4.21 C ATOM 882 O LEU A 60 -33.118 2.544 4.702 1.00 64.02 O ATOM 883 CB LEU A 60 -31.147 0.486 4.674 1.00 0.12 C ATOM 884 CG LEU A 60 -30.164 -0.666 4.891 1.00 74.51 C ATOM 885 CD1 LEU A 60 -29.074 -0.642 3.832 1.00 63.21 C ATOM 886 CD2 LEU A 60 -29.558 -0.593 6.285 1.00 1.41 C ATOM 0 H LEU A 60 -33.347 -1.677 5.470 1.00 4.23 H new ATOM 0 HA LEU A 60 -32.583 0.257 6.258 1.00 33.23 H new ATOM 0 HB2 LEU A 60 -31.185 0.709 3.608 1.00 0.12 H new ATOM 0 HB3 LEU A 60 -30.753 1.372 5.172 1.00 0.12 H new ATOM 0 HG LEU A 60 -30.708 -1.606 4.802 1.00 74.51 H new ATOM 0 HD11 LEU A 60 -28.384 -1.468 4.002 1.00 63.21 H new ATOM 0 HD12 LEU A 60 -29.524 -0.742 2.844 1.00 63.21 H new ATOM 0 HD13 LEU A 60 -28.532 0.302 3.890 1.00 63.21 H new ATOM 0 HD21 LEU A 60 -28.861 -1.420 6.423 1.00 1.41 H new ATOM 0 HD22 LEU A 60 -29.028 0.352 6.402 1.00 1.41 H new ATOM 0 HD23 LEU A 60 -30.351 -0.659 7.030 1.00 1.41 H new ATOM 898 N VAL A 61 -34.681 0.999 4.223 1.00 0.20 N ATOM 899 CA VAL A 61 -35.647 1.971 3.727 1.00 71.21 C ATOM 900 C VAL A 61 -37.076 1.485 3.943 1.00 70.32 C ATOM 901 O VAL A 61 -37.385 0.315 3.725 1.00 31.11 O ATOM 902 CB VAL A 61 -35.436 2.258 2.229 1.00 31.34 C ATOM 903 CG1 VAL A 61 -34.056 2.853 1.989 1.00 4.22 C ATOM 904 CG2 VAL A 61 -35.627 0.989 1.411 1.00 2.31 C ATOM 0 H VAL A 61 -35.002 0.031 4.191 1.00 0.20 H new ATOM 0 HA VAL A 61 -35.489 2.890 4.291 1.00 71.21 H new ATOM 0 HB VAL A 61 -36.181 2.986 1.908 1.00 31.34 H new ATOM 0 HG11 VAL A 61 -33.924 3.049 0.925 1.00 4.22 H new ATOM 0 HG12 VAL A 61 -33.960 3.786 2.545 1.00 4.22 H new ATOM 0 HG13 VAL A 61 -33.293 2.151 2.325 1.00 4.22 H new ATOM 0 HG21 VAL A 61 -35.474 1.211 0.355 1.00 2.31 H new ATOM 0 HG22 VAL A 61 -34.906 0.237 1.732 1.00 2.31 H new ATOM 0 HG23 VAL A 61 -36.638 0.609 1.559 1.00 2.31 H new ATOM 914 N GLY A 62 -37.947 2.394 4.373 1.00 71.04 N ATOM 915 CA GLY A 62 -39.333 2.041 4.611 1.00 31.12 C ATOM 916 C GLY A 62 -40.245 2.480 3.483 1.00 34.53 C ATOM 917 O GLY A 62 -40.616 3.650 3.394 1.00 41.31 O ATOM 0 H GLY A 62 -37.716 3.370 4.561 1.00 71.04 H new ATOM 0 HA2 GLY A 62 -39.413 0.962 4.739 1.00 31.12 H new ATOM 0 HA3 GLY A 62 -39.666 2.498 5.543 1.00 31.12 H new ATOM 921 N LYS A 63 -40.608 1.539 2.618 1.00 64.14 N ATOM 922 CA LYS A 63 -41.482 1.833 1.489 1.00 33.22 C ATOM 923 C LYS A 63 -42.601 0.801 1.384 1.00 20.52 C ATOM 924 O LYS A 63 -42.351 -0.377 1.131 1.00 13.53 O ATOM 925 CB LYS A 63 -40.677 1.861 0.188 1.00 74.02 C ATOM 926 CG LYS A 63 -41.162 2.904 -0.805 1.00 20.40 C ATOM 927 CD LYS A 63 -40.484 2.746 -2.156 1.00 71.32 C ATOM 928 CE LYS A 63 -39.033 3.198 -2.107 1.00 42.40 C ATOM 929 NZ LYS A 63 -38.124 2.098 -1.681 1.00 61.51 N1+ ATOM 0 H LYS A 63 -40.310 0.565 2.678 1.00 64.14 H new ATOM 0 HA LYS A 63 -41.929 2.813 1.654 1.00 33.22 H new ATOM 0 HB2 LYS A 63 -39.630 2.054 0.422 1.00 74.02 H new ATOM 0 HB3 LYS A 63 -40.723 0.877 -0.279 1.00 74.02 H new ATOM 0 HG2 LYS A 63 -42.242 2.818 -0.927 1.00 20.40 H new ATOM 0 HG3 LYS A 63 -40.964 3.901 -0.412 1.00 20.40 H new ATOM 0 HD2 LYS A 63 -40.531 1.703 -2.468 1.00 71.32 H new ATOM 0 HD3 LYS A 63 -41.022 3.327 -2.905 1.00 71.32 H new ATOM 0 HE2 LYS A 63 -38.731 3.558 -3.091 1.00 42.40 H new ATOM 0 HE3 LYS A 63 -38.937 4.036 -1.417 1.00 42.40 H new ATOM 0 HZ1 LYS A 63 -37.205 2.203 -2.157 1.00 61.51 H new ATOM 0 HZ2 LYS A 63 -37.987 2.140 -0.651 1.00 61.51 H new ATOM 0 HZ3 LYS A 63 -38.544 1.182 -1.937 1.00 61.51 H new ATOM 943 N VAL A 64 -43.836 1.253 1.578 1.00 71.05 N ATOM 944 CA VAL A 64 -44.994 0.369 1.503 1.00 72.21 C ATOM 945 C VAL A 64 -46.258 1.148 1.156 1.00 72.14 C ATOM 946 O VAL A 64 -46.352 2.349 1.414 1.00 61.31 O ATOM 947 CB VAL A 64 -45.215 -0.381 2.830 1.00 41.14 C ATOM 948 CG1 VAL A 64 -44.279 -1.576 2.930 1.00 41.34 C ATOM 949 CG2 VAL A 64 -45.021 0.558 4.011 1.00 71.41 C ATOM 0 H VAL A 64 -44.061 2.226 1.788 1.00 71.05 H new ATOM 0 HA VAL A 64 -44.789 -0.355 0.715 1.00 72.21 H new ATOM 0 HB VAL A 64 -46.240 -0.750 2.853 1.00 41.14 H new ATOM 0 HG11 VAL A 64 -44.449 -2.094 3.874 1.00 41.34 H new ATOM 0 HG12 VAL A 64 -44.471 -2.259 2.102 1.00 41.34 H new ATOM 0 HG13 VAL A 64 -43.245 -1.233 2.886 1.00 41.34 H new ATOM 0 HG21 VAL A 64 -45.181 0.012 4.940 1.00 71.41 H new ATOM 0 HG22 VAL A 64 -44.007 0.958 3.995 1.00 71.41 H new ATOM 0 HG23 VAL A 64 -45.736 1.378 3.945 1.00 71.41 H new ATOM 959 N THR A 65 -47.229 0.457 0.569 1.00 75.31 N ATOM 960 CA THR A 65 -48.489 1.083 0.185 1.00 21.11 C ATOM 961 C THR A 65 -49.677 0.202 0.555 1.00 50.33 C ATOM 962 O THR A 65 -49.564 -1.019 0.663 1.00 22.30 O ATOM 963 CB THR A 65 -48.532 1.377 -1.326 1.00 51.22 C ATOM 964 OG1 THR A 65 -47.522 0.620 -2.002 1.00 52.43 O ATOM 965 CG2 THR A 65 -48.328 2.860 -1.595 1.00 65.41 C ATOM 0 H THR A 65 -47.168 -0.537 0.349 1.00 75.31 H new ATOM 0 HA THR A 65 -48.554 2.023 0.732 1.00 21.11 H new ATOM 0 HB THR A 65 -49.513 1.088 -1.702 1.00 51.22 H new ATOM 0 HG1 THR A 65 -47.557 0.812 -2.962 1.00 52.43 H new ATOM 0 HG21 THR A 65 -48.362 3.043 -2.669 1.00 65.41 H new ATOM 0 HG22 THR A 65 -49.116 3.431 -1.104 1.00 65.41 H new ATOM 0 HG23 THR A 65 -47.359 3.171 -1.205 1.00 65.41 H new ATOM 973 N PRO A 66 -50.843 0.832 0.753 1.00 71.34 N ATOM 974 CA PRO A 66 -52.075 0.124 1.114 1.00 72.00 C ATOM 975 C PRO A 66 -52.615 -0.719 -0.037 1.00 31.14 C ATOM 976 O PRO A 66 -52.569 -0.310 -1.196 1.00 4.01 O ATOM 977 CB PRO A 66 -53.050 1.255 1.450 1.00 54.11 C ATOM 978 CG PRO A 66 -52.546 2.430 0.684 1.00 72.32 C ATOM 979 CD PRO A 66 -51.050 2.286 0.643 1.00 51.54 C ATOM 0 HA PRO A 66 -51.917 -0.578 1.933 1.00 72.00 H new ATOM 0 HB2 PRO A 66 -54.069 0.999 1.158 1.00 54.11 H new ATOM 0 HB3 PRO A 66 -53.067 1.458 2.521 1.00 54.11 H new ATOM 0 HG2 PRO A 66 -52.964 2.448 -0.322 1.00 72.32 H new ATOM 0 HG3 PRO A 66 -52.835 3.364 1.166 1.00 72.32 H new ATOM 0 HD2 PRO A 66 -50.634 2.682 -0.283 1.00 51.54 H new ATOM 0 HD3 PRO A 66 -50.572 2.823 1.462 1.00 51.54 H new ATOM 987 N LYS A 67 -53.127 -1.901 0.292 1.00 13.34 N ATOM 988 CA LYS A 67 -53.679 -2.802 -0.712 1.00 22.03 C ATOM 989 C LYS A 67 -55.172 -3.018 -0.489 1.00 61.40 C ATOM 990 O LYS A 67 -55.649 -3.002 0.645 1.00 45.12 O ATOM 991 CB LYS A 67 -52.948 -4.147 -0.676 1.00 13.12 C ATOM 992 CG LYS A 67 -51.764 -4.221 -1.625 1.00 24.12 C ATOM 993 CD LYS A 67 -51.222 -5.636 -1.730 1.00 43.33 C ATOM 994 CE LYS A 67 -52.141 -6.525 -2.555 1.00 51.24 C ATOM 995 NZ LYS A 67 -51.666 -7.937 -2.586 1.00 22.33 N1+ ATOM 0 H LYS A 67 -53.171 -2.257 1.247 1.00 13.34 H new ATOM 0 HA LYS A 67 -53.539 -2.344 -1.691 1.00 22.03 H new ATOM 0 HB2 LYS A 67 -52.601 -4.335 0.340 1.00 13.12 H new ATOM 0 HB3 LYS A 67 -53.652 -4.941 -0.925 1.00 13.12 H new ATOM 0 HG2 LYS A 67 -52.066 -3.872 -2.612 1.00 24.12 H new ATOM 0 HG3 LYS A 67 -50.976 -3.553 -1.278 1.00 24.12 H new ATOM 0 HD2 LYS A 67 -50.231 -5.615 -2.184 1.00 43.33 H new ATOM 0 HD3 LYS A 67 -51.106 -6.058 -0.731 1.00 43.33 H new ATOM 0 HE2 LYS A 67 -53.149 -6.490 -2.141 1.00 51.24 H new ATOM 0 HE3 LYS A 67 -52.201 -6.140 -3.573 1.00 51.24 H new ATOM 0 HZ1 LYS A 67 -51.877 -8.354 -3.515 1.00 22.33 H new ATOM 0 HZ2 LYS A 67 -50.640 -7.962 -2.420 1.00 22.33 H new ATOM 0 HZ3 LYS A 67 -52.150 -8.482 -1.844 1.00 22.33 H new ATOM 1009 N GLY A 68 -55.906 -3.221 -1.580 1.00 41.33 N ATOM 1010 CA GLY A 68 -57.337 -3.438 -1.481 1.00 62.55 C ATOM 1011 C GLY A 68 -57.706 -4.907 -1.529 1.00 22.32 C ATOM 1012 O GLY A 68 -56.845 -5.764 -1.729 1.00 24.52 O ATOM 0 H GLY A 68 -55.534 -3.239 -2.530 1.00 41.33 H new ATOM 0 HA2 GLY A 68 -57.703 -3.005 -0.550 1.00 62.55 H new ATOM 0 HA3 GLY A 68 -57.838 -2.914 -2.295 1.00 62.55 H new ATOM 1016 N VAL A 69 -58.989 -5.200 -1.345 1.00 13.52 N ATOM 1017 CA VAL A 69 -59.469 -6.577 -1.368 1.00 23.11 C ATOM 1018 C VAL A 69 -59.842 -7.005 -2.783 1.00 22.23 C ATOM 1019 O VAL A 69 -59.836 -8.193 -3.107 1.00 32.21 O ATOM 1020 CB VAL A 69 -60.692 -6.761 -0.449 1.00 70.31 C ATOM 1021 CG1 VAL A 69 -60.293 -6.601 1.010 1.00 51.03 C ATOM 1022 CG2 VAL A 69 -61.790 -5.775 -0.821 1.00 34.25 C ATOM 0 H VAL A 69 -59.715 -4.503 -1.178 1.00 13.52 H new ATOM 0 HA VAL A 69 -58.654 -7.202 -1.005 1.00 23.11 H new ATOM 0 HB VAL A 69 -61.079 -7.771 -0.586 1.00 70.31 H new ATOM 0 HG11 VAL A 69 -61.170 -6.734 1.644 1.00 51.03 H new ATOM 0 HG12 VAL A 69 -59.543 -7.349 1.266 1.00 51.03 H new ATOM 0 HG13 VAL A 69 -59.880 -5.605 1.167 1.00 51.03 H new ATOM 0 HG21 VAL A 69 -62.646 -5.919 -0.162 1.00 34.25 H new ATOM 0 HG22 VAL A 69 -61.416 -4.757 -0.714 1.00 34.25 H new ATOM 0 HG23 VAL A 69 -62.095 -5.943 -1.854 1.00 34.25 H new ATOM 1032 N THR A 70 -60.167 -6.028 -3.625 1.00 55.35 N ATOM 1033 CA THR A 70 -60.544 -6.303 -5.005 1.00 0.23 C ATOM 1034 C THR A 70 -59.479 -7.136 -5.711 1.00 24.22 C ATOM 1035 O THR A 70 -59.780 -7.893 -6.633 1.00 33.12 O ATOM 1036 CB THR A 70 -60.768 -5.001 -5.797 1.00 23.51 C ATOM 1037 OG1 THR A 70 -59.628 -4.145 -5.665 1.00 74.35 O ATOM 1038 CG2 THR A 70 -62.012 -4.277 -5.305 1.00 3.05 C ATOM 0 H THR A 70 -60.176 -5.039 -3.374 1.00 55.35 H new ATOM 0 HA THR A 70 -61.478 -6.864 -4.971 1.00 0.23 H new ATOM 0 HB THR A 70 -60.908 -5.259 -6.847 1.00 23.51 H new ATOM 0 HG1 THR A 70 -59.778 -3.320 -6.173 1.00 74.35 H new ATOM 0 HG21 THR A 70 -62.150 -3.360 -5.879 1.00 3.05 H new ATOM 0 HG22 THR A 70 -62.882 -4.920 -5.434 1.00 3.05 H new ATOM 0 HG23 THR A 70 -61.896 -4.030 -4.250 1.00 3.05 H new ATOM 1046 N GLU A 71 -58.233 -6.992 -5.269 1.00 11.11 N ATOM 1047 CA GLU A 71 -57.124 -7.732 -5.859 1.00 34.23 C ATOM 1048 C GLU A 71 -56.383 -8.541 -4.797 1.00 23.33 C ATOM 1049 O GLU A 71 -55.201 -8.311 -4.538 1.00 53.31 O ATOM 1050 CB GLU A 71 -56.155 -6.774 -6.554 1.00 54.35 C ATOM 1051 CG GLU A 71 -55.326 -7.431 -7.645 1.00 72.01 C ATOM 1052 CD GLU A 71 -56.152 -7.800 -8.863 1.00 25.40 C ATOM 1053 OE1 GLU A 71 -56.408 -6.907 -9.698 1.00 5.12 O ATOM 1054 OE2 GLU A 71 -56.543 -8.980 -8.979 1.00 23.50 O1- ATOM 0 H GLU A 71 -57.967 -6.370 -4.505 1.00 11.11 H new ATOM 0 HA GLU A 71 -57.533 -8.422 -6.597 1.00 34.23 H new ATOM 0 HB2 GLU A 71 -56.721 -5.949 -6.987 1.00 54.35 H new ATOM 0 HB3 GLU A 71 -55.485 -6.345 -5.809 1.00 54.35 H new ATOM 0 HG2 GLU A 71 -54.525 -6.755 -7.945 1.00 72.01 H new ATOM 0 HG3 GLU A 71 -54.853 -8.328 -7.246 1.00 72.01 H new ATOM 1061 N LEU A 72 -57.087 -9.488 -4.186 1.00 12.50 N ATOM 1062 CA LEU A 72 -56.497 -10.331 -3.152 1.00 60.42 C ATOM 1063 C LEU A 72 -56.283 -11.751 -3.664 1.00 51.14 C ATOM 1064 O LEU A 72 -56.792 -12.126 -4.721 1.00 34.14 O ATOM 1065 CB LEU A 72 -57.393 -10.352 -1.912 1.00 44.10 C ATOM 1066 CG LEU A 72 -56.674 -10.455 -0.566 1.00 41.21 C ATOM 1067 CD1 LEU A 72 -55.739 -9.273 -0.370 1.00 14.22 C ATOM 1068 CD2 LEU A 72 -57.681 -10.535 0.572 1.00 4.04 C ATOM 0 H LEU A 72 -58.066 -9.691 -4.388 1.00 12.50 H new ATOM 0 HA LEU A 72 -55.527 -9.912 -2.885 1.00 60.42 H new ATOM 0 HB2 LEU A 72 -57.998 -9.445 -1.910 1.00 44.10 H new ATOM 0 HB3 LEU A 72 -58.081 -11.193 -1.999 1.00 44.10 H new ATOM 0 HG LEU A 72 -56.079 -11.368 -0.562 1.00 41.21 H new ATOM 0 HD11 LEU A 72 -55.236 -9.363 0.593 1.00 14.22 H new ATOM 0 HD12 LEU A 72 -54.996 -9.260 -1.168 1.00 14.22 H new ATOM 0 HD13 LEU A 72 -56.313 -8.347 -0.394 1.00 14.22 H new ATOM 0 HD21 LEU A 72 -57.151 -10.608 1.522 1.00 4.04 H new ATOM 0 HD22 LEU A 72 -58.303 -9.640 0.571 1.00 4.04 H new ATOM 0 HD23 LEU A 72 -58.311 -11.415 0.439 1.00 4.04 H new ATOM 1080 N THR A 73 -55.528 -12.541 -2.906 1.00 73.31 N ATOM 1081 CA THR A 73 -55.249 -13.921 -3.282 1.00 33.52 C ATOM 1082 C THR A 73 -56.247 -14.879 -2.643 1.00 24.20 C ATOM 1083 O THR A 73 -56.901 -14.541 -1.657 1.00 22.42 O ATOM 1084 CB THR A 73 -53.822 -14.336 -2.874 1.00 30.40 C ATOM 1085 OG1 THR A 73 -53.616 -14.076 -1.481 1.00 65.52 O ATOM 1086 CG2 THR A 73 -52.785 -13.586 -3.694 1.00 71.53 C ATOM 0 H THR A 73 -55.099 -12.248 -2.028 1.00 73.31 H new ATOM 0 HA THR A 73 -55.341 -13.977 -4.367 1.00 33.52 H new ATOM 0 HB THR A 73 -53.709 -15.403 -3.065 1.00 30.40 H new ATOM 0 HG1 THR A 73 -52.708 -14.344 -1.229 1.00 65.52 H new ATOM 0 HG21 THR A 73 -51.786 -13.896 -3.388 1.00 71.53 H new ATOM 0 HG22 THR A 73 -52.926 -13.809 -4.751 1.00 71.53 H new ATOM 0 HG23 THR A 73 -52.898 -12.514 -3.531 1.00 71.53 H new ATOM 1094 N ALA A 74 -56.359 -16.075 -3.211 1.00 25.51 N ATOM 1095 CA ALA A 74 -57.277 -17.083 -2.693 1.00 22.05 C ATOM 1096 C ALA A 74 -56.949 -17.433 -1.246 1.00 64.11 C ATOM 1097 O ALA A 74 -57.843 -17.534 -0.406 1.00 22.20 O ATOM 1098 CB ALA A 74 -57.235 -18.332 -3.563 1.00 52.43 C ATOM 0 H ALA A 74 -55.826 -16.370 -4.029 1.00 25.51 H new ATOM 0 HA ALA A 74 -58.285 -16.669 -2.719 1.00 22.05 H new ATOM 0 HB1 ALA A 74 -57.925 -19.076 -3.165 1.00 52.43 H new ATOM 0 HB2 ALA A 74 -57.526 -18.076 -4.582 1.00 52.43 H new ATOM 0 HB3 ALA A 74 -56.224 -18.739 -3.566 1.00 52.43 H new ATOM 1104 N GLU A 75 -55.664 -17.617 -0.963 1.00 71.15 N ATOM 1105 CA GLU A 75 -55.220 -17.958 0.383 1.00 23.11 C ATOM 1106 C GLU A 75 -55.657 -16.893 1.385 1.00 12.34 C ATOM 1107 O GLU A 75 -55.979 -17.202 2.533 1.00 50.21 O ATOM 1108 CB GLU A 75 -53.698 -18.112 0.418 1.00 42.41 C ATOM 1109 CG GLU A 75 -53.165 -19.119 -0.586 1.00 25.54 C ATOM 1110 CD GLU A 75 -51.653 -19.226 -0.559 1.00 73.13 C ATOM 1111 OE1 GLU A 75 -51.112 -19.757 0.433 1.00 41.51 O ATOM 1112 OE2 GLU A 75 -51.010 -18.778 -1.532 1.00 65.41 O1- ATOM 0 H GLU A 75 -54.912 -17.536 -1.647 1.00 71.15 H new ATOM 0 HA GLU A 75 -55.681 -18.906 0.661 1.00 23.11 H new ATOM 0 HB2 GLU A 75 -53.239 -17.142 0.226 1.00 42.41 H new ATOM 0 HB3 GLU A 75 -53.395 -18.415 1.420 1.00 42.41 H new ATOM 0 HG2 GLU A 75 -53.598 -20.097 -0.378 1.00 25.54 H new ATOM 0 HG3 GLU A 75 -53.487 -18.833 -1.587 1.00 25.54 H new ATOM 1119 N GLU A 76 -55.666 -15.639 0.942 1.00 50.31 N ATOM 1120 CA GLU A 76 -56.063 -14.530 1.801 1.00 72.21 C ATOM 1121 C GLU A 76 -57.579 -14.481 1.962 1.00 22.24 C ATOM 1122 O GLU A 76 -58.091 -14.051 2.995 1.00 10.21 O ATOM 1123 CB GLU A 76 -55.556 -13.206 1.227 1.00 62.24 C ATOM 1124 CG GLU A 76 -54.120 -12.887 1.606 1.00 64.30 C ATOM 1125 CD GLU A 76 -54.007 -12.248 2.977 1.00 33.44 C ATOM 1126 OE1 GLU A 76 -54.997 -11.637 3.431 1.00 31.41 O ATOM 1127 OE2 GLU A 76 -52.926 -12.358 3.594 1.00 3.21 O1- ATOM 0 H GLU A 76 -55.403 -15.367 -0.005 1.00 50.31 H new ATOM 0 HA GLU A 76 -55.617 -14.687 2.783 1.00 72.21 H new ATOM 0 HB2 GLU A 76 -55.638 -13.236 0.140 1.00 62.24 H new ATOM 0 HB3 GLU A 76 -56.202 -12.399 1.573 1.00 62.24 H new ATOM 0 HG2 GLU A 76 -53.531 -13.804 1.587 1.00 64.30 H new ATOM 0 HG3 GLU A 76 -53.692 -12.217 0.861 1.00 64.30 H new ATOM 1134 N ARG A 77 -58.292 -14.922 0.930 1.00 60.41 N ATOM 1135 CA ARG A 77 -59.749 -14.927 0.955 1.00 75.45 C ATOM 1136 C ARG A 77 -60.272 -15.841 2.060 1.00 5.25 C ATOM 1137 O ARG A 77 -61.133 -15.450 2.849 1.00 54.11 O ATOM 1138 CB ARG A 77 -60.302 -15.379 -0.398 1.00 61.41 C ATOM 1139 CG ARG A 77 -60.253 -14.298 -1.466 1.00 55.33 C ATOM 1140 CD ARG A 77 -60.515 -14.872 -2.851 1.00 52.34 C ATOM 1141 NE ARG A 77 -61.096 -13.881 -3.753 1.00 62.33 N ATOM 1142 CZ ARG A 77 -62.371 -13.509 -3.712 1.00 34.33 C ATOM 1143 NH1 ARG A 77 -63.193 -14.042 -2.818 1.00 23.02 N1+ ATOM 1144 NH2 ARG A 77 -62.826 -12.601 -4.566 1.00 22.33 N ATOM 0 H ARG A 77 -57.884 -15.280 0.067 1.00 60.41 H new ATOM 0 HA ARG A 77 -60.086 -13.911 1.158 1.00 75.45 H new ATOM 0 HB2 ARG A 77 -59.736 -16.244 -0.742 1.00 61.41 H new ATOM 0 HB3 ARG A 77 -61.334 -15.705 -0.269 1.00 61.41 H new ATOM 0 HG2 ARG A 77 -60.994 -13.530 -1.243 1.00 55.33 H new ATOM 0 HG3 ARG A 77 -59.277 -13.813 -1.450 1.00 55.33 H new ATOM 0 HD2 ARG A 77 -59.581 -15.242 -3.273 1.00 52.34 H new ATOM 0 HD3 ARG A 77 -61.188 -15.726 -2.768 1.00 52.34 H new ATOM 0 HE ARG A 77 -60.490 -13.451 -4.452 1.00 62.33 H new ATOM 0 HH11 ARG A 77 -62.847 -14.740 -2.159 1.00 23.02 H new ATOM 0 HH12 ARG A 77 -64.171 -13.754 -2.789 1.00 23.02 H new ATOM 0 HH21 ARG A 77 -62.197 -12.188 -5.255 1.00 22.33 H new ATOM 0 HH22 ARG A 77 -63.805 -12.316 -4.534 1.00 22.33 H new ATOM 1158 N LEU A 78 -59.745 -17.060 2.111 1.00 4.11 N ATOM 1159 CA LEU A 78 -60.157 -18.030 3.119 1.00 63.30 C ATOM 1160 C LEU A 78 -59.671 -17.617 4.504 1.00 1.51 C ATOM 1161 O LEU A 78 -60.285 -17.956 5.517 1.00 72.43 O ATOM 1162 CB LEU A 78 -59.619 -19.418 2.770 1.00 62.25 C ATOM 1163 CG LEU A 78 -58.105 -19.521 2.577 1.00 4.10 C ATOM 1164 CD1 LEU A 78 -57.404 -19.670 3.918 1.00 71.01 C ATOM 1165 CD2 LEU A 78 -57.763 -20.688 1.661 1.00 24.05 C ATOM 0 H LEU A 78 -59.032 -17.400 1.466 1.00 4.11 H new ATOM 0 HA LEU A 78 -61.246 -18.062 3.132 1.00 63.30 H new ATOM 0 HB2 LEU A 78 -59.912 -20.109 3.560 1.00 62.25 H new ATOM 0 HB3 LEU A 78 -60.106 -19.755 1.855 1.00 62.25 H new ATOM 0 HG LEU A 78 -57.754 -18.602 2.108 1.00 4.10 H new ATOM 0 HD11 LEU A 78 -56.328 -19.742 3.760 1.00 71.01 H new ATOM 0 HD12 LEU A 78 -57.622 -18.803 4.541 1.00 71.01 H new ATOM 0 HD13 LEU A 78 -57.759 -20.573 4.416 1.00 71.01 H new ATOM 0 HD21 LEU A 78 -56.682 -20.747 1.535 1.00 24.05 H new ATOM 0 HD22 LEU A 78 -58.128 -21.616 2.102 1.00 24.05 H new ATOM 0 HD23 LEU A 78 -58.234 -20.538 0.690 1.00 24.05 H new ATOM 1177 N LEU A 79 -58.566 -16.880 4.542 1.00 73.12 N ATOM 1178 CA LEU A 79 -57.997 -16.417 5.804 1.00 25.52 C ATOM 1179 C LEU A 79 -59.003 -15.570 6.575 1.00 13.43 C ATOM 1180 O LEU A 79 -58.927 -15.458 7.800 1.00 45.51 O ATOM 1181 CB LEU A 79 -56.723 -15.610 5.546 1.00 42.42 C ATOM 1182 CG LEU A 79 -55.697 -15.595 6.679 1.00 44.11 C ATOM 1183 CD1 LEU A 79 -54.740 -16.769 6.549 1.00 40.45 C ATOM 1184 CD2 LEU A 79 -54.934 -14.279 6.689 1.00 24.32 C ATOM 0 H LEU A 79 -58.046 -16.590 3.714 1.00 73.12 H new ATOM 0 HA LEU A 79 -57.749 -17.291 6.406 1.00 25.52 H new ATOM 0 HB2 LEU A 79 -56.241 -16.005 4.652 1.00 42.42 H new ATOM 0 HB3 LEU A 79 -57.007 -14.581 5.326 1.00 42.42 H new ATOM 0 HG LEU A 79 -56.228 -15.691 7.626 1.00 44.11 H new ATOM 0 HD11 LEU A 79 -54.017 -16.741 7.364 1.00 40.45 H new ATOM 0 HD12 LEU A 79 -55.301 -17.702 6.593 1.00 40.45 H new ATOM 0 HD13 LEU A 79 -54.215 -16.706 5.596 1.00 40.45 H new ATOM 0 HD21 LEU A 79 -54.208 -14.286 7.502 1.00 24.32 H new ATOM 0 HD22 LEU A 79 -54.414 -14.152 5.739 1.00 24.32 H new ATOM 0 HD23 LEU A 79 -55.632 -13.455 6.833 1.00 24.32 H new ATOM 1196 N HIS A 80 -59.947 -14.976 5.853 1.00 75.01 N ATOM 1197 CA HIS A 80 -60.971 -14.140 6.471 1.00 1.10 C ATOM 1198 C HIS A 80 -61.735 -14.917 7.539 1.00 41.42 C ATOM 1199 O HIS A 80 -61.947 -14.424 8.646 1.00 43.25 O ATOM 1200 CB HIS A 80 -61.941 -13.619 5.410 1.00 42.21 C ATOM 1201 CG HIS A 80 -63.040 -12.769 5.971 1.00 54.33 C ATOM 1202 ND1 HIS A 80 -62.953 -12.135 7.192 1.00 50.24 N ATOM 1203 CD2 HIS A 80 -64.255 -12.447 5.468 1.00 45.33 C ATOM 1204 CE1 HIS A 80 -64.066 -11.462 7.418 1.00 33.42 C ATOM 1205 NE2 HIS A 80 -64.873 -11.635 6.386 1.00 55.02 N ATOM 0 H HIS A 80 -60.025 -15.058 4.839 1.00 75.01 H new ATOM 0 HA HIS A 80 -60.476 -13.294 6.948 1.00 1.10 H new ATOM 0 HB2 HIS A 80 -61.384 -13.040 4.673 1.00 42.21 H new ATOM 0 HB3 HIS A 80 -62.380 -14.466 4.883 1.00 42.21 H new ATOM 0 HD2 HIS A 80 -64.662 -12.769 4.521 1.00 45.33 H new ATOM 0 HE1 HIS A 80 -64.280 -10.871 8.296 1.00 33.42 H new ATOM 0 HE2 HIS A 80 -65.804 -11.231 6.288 1.00 55.02 H new ATOM 1213 N ALA A 81 -62.146 -16.135 7.198 1.00 63.15 N ATOM 1214 CA ALA A 81 -62.884 -16.979 8.128 1.00 52.51 C ATOM 1215 C ALA A 81 -62.018 -17.372 9.320 1.00 71.02 C ATOM 1216 O ALA A 81 -62.530 -17.676 10.397 1.00 50.32 O ATOM 1217 CB ALA A 81 -63.400 -18.222 7.416 1.00 34.12 C ATOM 0 H ALA A 81 -61.980 -16.558 6.285 1.00 63.15 H new ATOM 0 HA ALA A 81 -63.733 -16.408 8.503 1.00 52.51 H new ATOM 0 HB1 ALA A 81 -63.950 -18.844 8.122 1.00 34.12 H new ATOM 0 HB2 ALA A 81 -64.061 -17.927 6.602 1.00 34.12 H new ATOM 0 HB3 ALA A 81 -62.559 -18.786 7.014 1.00 34.12 H new ATOM 1223 N ILE A 82 -60.705 -17.362 9.119 1.00 14.21 N ATOM 1224 CA ILE A 82 -59.769 -17.717 10.180 1.00 11.44 C ATOM 1225 C ILE A 82 -59.735 -16.646 11.265 1.00 25.11 C ATOM 1226 O ILE A 82 -59.956 -16.932 12.441 1.00 24.25 O ATOM 1227 CB ILE A 82 -58.344 -17.918 9.628 1.00 54.10 C ATOM 1228 CG1 ILE A 82 -58.375 -18.822 8.394 1.00 55.43 C ATOM 1229 CG2 ILE A 82 -57.439 -18.506 10.700 1.00 73.32 C ATOM 1230 CD1 ILE A 82 -58.993 -20.179 8.654 1.00 45.00 C ATOM 0 H ILE A 82 -60.265 -17.113 8.233 1.00 14.21 H new ATOM 0 HA ILE A 82 -60.120 -18.655 10.610 1.00 11.44 H new ATOM 0 HB ILE A 82 -57.943 -16.948 9.334 1.00 54.10 H new ATOM 0 HG12 ILE A 82 -58.934 -18.323 7.602 1.00 55.43 H new ATOM 0 HG13 ILE A 82 -57.357 -18.959 8.028 1.00 55.43 H new ATOM 0 HG21 ILE A 82 -56.436 -18.642 10.295 1.00 73.32 H new ATOM 0 HG22 ILE A 82 -57.397 -17.828 11.553 1.00 73.32 H new ATOM 0 HG23 ILE A 82 -57.834 -19.470 11.022 1.00 73.32 H new ATOM 0 HD11 ILE A 82 -58.981 -20.766 7.736 1.00 45.00 H new ATOM 0 HD12 ILE A 82 -58.421 -20.698 9.423 1.00 45.00 H new ATOM 0 HD13 ILE A 82 -60.022 -20.052 8.990 1.00 45.00 H new ATOM 1242 N PHE A 83 -59.457 -15.411 10.860 1.00 72.31 N ATOM 1243 CA PHE A 83 -59.395 -14.296 11.798 1.00 63.53 C ATOM 1244 C PHE A 83 -60.796 -13.871 12.231 1.00 3.44 C ATOM 1245 O PHE A 83 -60.980 -13.315 13.313 1.00 52.42 O ATOM 1246 CB PHE A 83 -58.663 -13.111 11.165 1.00 53.14 C ATOM 1247 CG PHE A 83 -57.191 -13.087 11.465 1.00 4.12 C ATOM 1248 CD1 PHE A 83 -56.308 -13.851 10.720 1.00 53.02 C ATOM 1249 CD2 PHE A 83 -56.691 -12.300 12.490 1.00 44.11 C ATOM 1250 CE1 PHE A 83 -54.952 -13.831 10.992 1.00 32.53 C ATOM 1251 CE2 PHE A 83 -55.337 -12.276 12.766 1.00 2.50 C ATOM 1252 CZ PHE A 83 -54.467 -13.043 12.017 1.00 24.31 C ATOM 0 H PHE A 83 -59.271 -15.157 9.890 1.00 72.31 H new ATOM 0 HA PHE A 83 -58.846 -14.625 12.680 1.00 63.53 H new ATOM 0 HB2 PHE A 83 -58.805 -13.141 10.085 1.00 53.14 H new ATOM 0 HB3 PHE A 83 -59.113 -12.184 11.520 1.00 53.14 H new ATOM 0 HD1 PHE A 83 -56.683 -14.469 9.918 1.00 53.02 H new ATOM 0 HD2 PHE A 83 -57.367 -11.699 13.080 1.00 44.11 H new ATOM 0 HE1 PHE A 83 -54.274 -14.431 10.404 1.00 32.53 H new ATOM 0 HE2 PHE A 83 -54.960 -11.658 13.567 1.00 2.50 H new ATOM 0 HZ PHE A 83 -53.409 -13.027 12.232 1.00 24.31 H new ATOM 1262 N GLY A 84 -61.779 -14.136 11.376 1.00 11.45 N ATOM 1263 CA GLY A 84 -63.149 -13.774 11.687 1.00 21.23 C ATOM 1264 C GLY A 84 -63.380 -12.278 11.634 1.00 34.15 C ATOM 1265 O GLY A 84 -64.223 -11.748 12.357 1.00 1.13 O ATOM 0 H GLY A 84 -61.651 -14.595 10.474 1.00 11.45 H new ATOM 0 HA2 GLY A 84 -63.820 -14.267 10.984 1.00 21.23 H new ATOM 0 HA3 GLY A 84 -63.402 -14.142 12.681 1.00 21.23 H new ATOM 1269 N GLU A 85 -62.629 -11.595 10.776 1.00 71.23 N ATOM 1270 CA GLU A 85 -62.755 -10.148 10.633 1.00 3.24 C ATOM 1271 C GLU A 85 -61.865 -9.633 9.506 1.00 45.31 C ATOM 1272 O GLU A 85 -60.808 -10.200 9.225 1.00 43.43 O ATOM 1273 CB GLU A 85 -62.390 -9.451 11.946 1.00 62.14 C ATOM 1274 CG GLU A 85 -60.999 -9.793 12.450 1.00 3.03 C ATOM 1275 CD GLU A 85 -60.789 -9.392 13.897 1.00 22.13 C ATOM 1276 OE1 GLU A 85 -61.493 -9.936 14.773 1.00 62.10 O ATOM 1277 OE2 GLU A 85 -59.918 -8.533 14.154 1.00 0.10 O1- ATOM 0 H GLU A 85 -61.927 -12.019 10.170 1.00 71.23 H new ATOM 0 HA GLU A 85 -63.792 -9.921 10.385 1.00 3.24 H new ATOM 0 HB2 GLU A 85 -62.462 -8.372 11.807 1.00 62.14 H new ATOM 0 HB3 GLU A 85 -63.120 -9.724 12.708 1.00 62.14 H new ATOM 0 HG2 GLU A 85 -60.832 -10.865 12.346 1.00 3.03 H new ATOM 0 HG3 GLU A 85 -60.258 -9.293 11.827 1.00 3.03 H new ATOM 1284 N LYS A 86 -62.299 -8.555 8.863 1.00 0.31 N ATOM 1285 CA LYS A 86 -61.544 -7.961 7.767 1.00 50.23 C ATOM 1286 C LYS A 86 -60.346 -7.177 8.294 1.00 62.42 C ATOM 1287 O LYS A 86 -60.413 -6.564 9.359 1.00 1.22 O ATOM 1288 CB LYS A 86 -62.444 -7.042 6.939 1.00 52.31 C ATOM 1289 CG LYS A 86 -63.360 -7.786 5.983 1.00 22.44 C ATOM 1290 CD LYS A 86 -64.669 -8.171 6.652 1.00 14.40 C ATOM 1291 CE LYS A 86 -65.698 -7.055 6.547 1.00 71.34 C ATOM 1292 NZ LYS A 86 -65.593 -6.097 7.682 1.00 0.31 N1+ ATOM 0 H LYS A 86 -63.171 -8.074 9.083 1.00 0.31 H new ATOM 0 HA LYS A 86 -61.178 -8.768 7.132 1.00 50.23 H new ATOM 0 HB2 LYS A 86 -63.051 -6.438 7.614 1.00 52.31 H new ATOM 0 HB3 LYS A 86 -61.820 -6.354 6.369 1.00 52.31 H new ATOM 0 HG2 LYS A 86 -63.565 -7.162 5.113 1.00 22.44 H new ATOM 0 HG3 LYS A 86 -62.858 -8.683 5.620 1.00 22.44 H new ATOM 0 HD2 LYS A 86 -65.063 -9.076 6.189 1.00 14.40 H new ATOM 0 HD3 LYS A 86 -64.488 -8.403 7.702 1.00 14.40 H new ATOM 0 HE2 LYS A 86 -65.560 -6.521 5.607 1.00 71.34 H new ATOM 0 HE3 LYS A 86 -66.699 -7.485 6.526 1.00 71.34 H new ATOM 0 HZ1 LYS A 86 -66.544 -5.886 8.047 1.00 0.31 H new ATOM 0 HZ2 LYS A 86 -65.017 -6.517 8.439 1.00 0.31 H new ATOM 0 HZ3 LYS A 86 -65.145 -5.218 7.354 1.00 0.31 H new ATOM 1306 N ALA A 87 -59.251 -7.201 7.540 1.00 21.22 N ATOM 1307 CA ALA A 87 -58.040 -6.489 7.931 1.00 63.11 C ATOM 1308 C ALA A 87 -57.446 -5.729 6.749 1.00 4.23 C ATOM 1309 O ALA A 87 -57.689 -6.072 5.592 1.00 21.02 O ATOM 1310 CB ALA A 87 -57.018 -7.461 8.503 1.00 2.10 C ATOM 0 H ALA A 87 -59.178 -7.705 6.656 1.00 21.22 H new ATOM 0 HA ALA A 87 -58.306 -5.764 8.700 1.00 63.11 H new ATOM 0 HB1 ALA A 87 -56.119 -6.916 8.791 1.00 2.10 H new ATOM 0 HB2 ALA A 87 -57.438 -7.957 9.378 1.00 2.10 H new ATOM 0 HB3 ALA A 87 -56.765 -8.207 7.750 1.00 2.10 H new ATOM 1316 N ARG A 88 -56.667 -4.694 7.049 1.00 51.52 N ATOM 1317 CA ARG A 88 -56.040 -3.885 6.012 1.00 72.01 C ATOM 1318 C ARG A 88 -54.895 -4.644 5.348 1.00 43.43 C ATOM 1319 O ARG A 88 -54.244 -5.478 5.976 1.00 52.35 O ATOM 1320 CB ARG A 88 -55.520 -2.573 6.604 1.00 64.15 C ATOM 1321 CG ARG A 88 -56.563 -1.467 6.638 1.00 10.34 C ATOM 1322 CD ARG A 88 -57.782 -1.874 7.451 1.00 52.23 C ATOM 1323 NE ARG A 88 -58.787 -2.543 6.629 1.00 54.25 N ATOM 1324 CZ ARG A 88 -60.002 -2.859 7.066 1.00 53.44 C ATOM 1325 NH1 ARG A 88 -60.358 -2.567 8.310 1.00 14.44 N1+ ATOM 1326 NH2 ARG A 88 -60.861 -3.467 6.259 1.00 23.21 N ATOM 0 H ARG A 88 -56.456 -4.397 8.002 1.00 51.52 H new ATOM 0 HA ARG A 88 -56.792 -3.662 5.256 1.00 72.01 H new ATOM 0 HB2 ARG A 88 -55.164 -2.757 7.618 1.00 64.15 H new ATOM 0 HB3 ARG A 88 -54.663 -2.235 6.021 1.00 64.15 H new ATOM 0 HG2 ARG A 88 -56.124 -0.565 7.065 1.00 10.34 H new ATOM 0 HG3 ARG A 88 -56.868 -1.222 5.621 1.00 10.34 H new ATOM 0 HD2 ARG A 88 -57.474 -2.537 8.259 1.00 52.23 H new ATOM 0 HD3 ARG A 88 -58.221 -0.990 7.914 1.00 52.23 H new ATOM 0 HE ARG A 88 -58.543 -2.781 5.667 1.00 54.25 H new ATOM 0 HH11 ARG A 88 -59.699 -2.099 8.933 1.00 14.44 H new ATOM 0 HH12 ARG A 88 -61.291 -2.810 8.644 1.00 14.44 H new ATOM 0 HH21 ARG A 88 -60.590 -3.693 5.302 1.00 23.21 H new ATOM 0 HH22 ARG A 88 -61.793 -3.709 6.595 1.00 23.21 H new ATOM 1340 N GLU A 89 -54.654 -4.347 4.074 1.00 51.11 N ATOM 1341 CA GLU A 89 -53.589 -5.003 3.326 1.00 3.21 C ATOM 1342 C GLU A 89 -52.486 -4.010 2.966 1.00 11.30 C ATOM 1343 O GLU A 89 -52.728 -2.807 2.862 1.00 53.52 O ATOM 1344 CB GLU A 89 -54.149 -5.643 2.053 1.00 74.52 C ATOM 1345 CG GLU A 89 -54.897 -6.941 2.303 1.00 45.43 C ATOM 1346 CD GLU A 89 -53.972 -8.139 2.389 1.00 12.21 C ATOM 1347 OE1 GLU A 89 -53.413 -8.533 1.344 1.00 23.33 O ATOM 1348 OE2 GLU A 89 -53.808 -8.685 3.500 1.00 4.44 O1- ATOM 0 H GLU A 89 -55.182 -3.657 3.540 1.00 51.11 H new ATOM 0 HA GLU A 89 -53.162 -5.782 3.958 1.00 3.21 H new ATOM 0 HB2 GLU A 89 -54.819 -4.935 1.565 1.00 74.52 H new ATOM 0 HB3 GLU A 89 -53.329 -5.834 1.361 1.00 74.52 H new ATOM 0 HG2 GLU A 89 -55.464 -6.857 3.230 1.00 45.43 H new ATOM 0 HG3 GLU A 89 -55.619 -7.100 1.502 1.00 45.43 H new ATOM 1355 N VAL A 90 -51.274 -4.524 2.779 1.00 14.00 N ATOM 1356 CA VAL A 90 -50.135 -3.685 2.432 1.00 43.15 C ATOM 1357 C VAL A 90 -49.194 -4.404 1.470 1.00 34.22 C ATOM 1358 O VAL A 90 -49.154 -5.634 1.431 1.00 14.45 O ATOM 1359 CB VAL A 90 -49.345 -3.263 3.685 1.00 61.31 C ATOM 1360 CG1 VAL A 90 -48.323 -2.191 3.338 1.00 61.42 C ATOM 1361 CG2 VAL A 90 -50.291 -2.778 4.772 1.00 63.51 C ATOM 0 H VAL A 90 -51.057 -5.517 2.862 1.00 14.00 H new ATOM 0 HA VAL A 90 -50.535 -2.795 1.947 1.00 43.15 H new ATOM 0 HB VAL A 90 -48.808 -4.132 4.064 1.00 61.31 H new ATOM 0 HG11 VAL A 90 -47.775 -1.906 4.236 1.00 61.42 H new ATOM 0 HG12 VAL A 90 -47.626 -2.580 2.596 1.00 61.42 H new ATOM 0 HG13 VAL A 90 -48.835 -1.318 2.933 1.00 61.42 H new ATOM 0 HG21 VAL A 90 -49.716 -2.484 5.650 1.00 63.51 H new ATOM 0 HG22 VAL A 90 -50.858 -1.922 4.406 1.00 63.51 H new ATOM 0 HG23 VAL A 90 -50.978 -3.580 5.041 1.00 63.51 H new ATOM 1371 N ARG A 91 -48.440 -3.630 0.698 1.00 25.45 N ATOM 1372 CA ARG A 91 -47.501 -4.194 -0.264 1.00 3.45 C ATOM 1373 C ARG A 91 -46.087 -3.686 -0.004 1.00 15.52 C ATOM 1374 O ARG A 91 -45.889 -2.526 0.360 1.00 10.53 O ATOM 1375 CB ARG A 91 -47.927 -3.842 -1.691 1.00 35.24 C ATOM 1376 CG ARG A 91 -47.100 -4.535 -2.762 1.00 1.41 C ATOM 1377 CD ARG A 91 -47.575 -5.960 -2.998 1.00 62.05 C ATOM 1378 NE ARG A 91 -48.629 -6.025 -4.007 1.00 32.31 N ATOM 1379 CZ ARG A 91 -49.115 -7.163 -4.488 1.00 62.40 C ATOM 1380 NH1 ARG A 91 -48.645 -8.325 -4.056 1.00 60.23 N1+ ATOM 1381 NH2 ARG A 91 -50.074 -7.141 -5.405 1.00 63.42 N ATOM 0 H ARG A 91 -48.461 -2.610 0.720 1.00 25.45 H new ATOM 0 HA ARG A 91 -47.507 -5.278 -0.148 1.00 3.45 H new ATOM 0 HB2 ARG A 91 -48.975 -4.109 -1.824 1.00 35.24 H new ATOM 0 HB3 ARG A 91 -47.853 -2.763 -1.828 1.00 35.24 H new ATOM 0 HG2 ARG A 91 -47.162 -3.971 -3.693 1.00 1.41 H new ATOM 0 HG3 ARG A 91 -46.052 -4.545 -2.464 1.00 1.41 H new ATOM 0 HD2 ARG A 91 -46.733 -6.575 -3.314 1.00 62.05 H new ATOM 0 HD3 ARG A 91 -47.943 -6.379 -2.062 1.00 62.05 H new ATOM 0 HE ARG A 91 -49.012 -5.149 -4.361 1.00 32.31 H new ATOM 0 HH11 ARG A 91 -47.908 -8.347 -3.352 1.00 60.23 H new ATOM 0 HH12 ARG A 91 -49.021 -9.197 -4.428 1.00 60.23 H new ATOM 0 HH21 ARG A 91 -50.438 -6.249 -5.741 1.00 63.42 H new ATOM 0 HH22 ARG A 91 -50.447 -8.016 -5.774 1.00 63.42 H new ATOM 1395 N ASP A 92 -45.105 -4.561 -0.193 1.00 43.34 N ATOM 1396 CA ASP A 92 -43.708 -4.201 0.020 1.00 22.20 C ATOM 1397 C ASP A 92 -43.095 -3.625 -1.253 1.00 4.24 C ATOM 1398 O ASP A 92 -42.915 -4.333 -2.244 1.00 43.15 O ATOM 1399 CB ASP A 92 -42.909 -5.422 0.479 1.00 42.30 C ATOM 1400 CG ASP A 92 -43.020 -6.584 -0.488 1.00 10.14 C ATOM 1401 OD1 ASP A 92 -44.118 -7.171 -0.587 1.00 24.00 O ATOM 1402 OD2 ASP A 92 -42.009 -6.907 -1.147 1.00 53.42 O1- ATOM 0 H ASP A 92 -45.251 -5.525 -0.493 1.00 43.34 H new ATOM 0 HA ASP A 92 -43.669 -3.438 0.798 1.00 22.20 H new ATOM 0 HB2 ASP A 92 -41.861 -5.145 0.591 1.00 42.30 H new ATOM 0 HB3 ASP A 92 -43.263 -5.736 1.461 1.00 42.30 H new ATOM 1407 N THR A 93 -42.776 -2.336 -1.218 1.00 3.24 N ATOM 1408 CA THR A 93 -42.184 -1.664 -2.368 1.00 15.11 C ATOM 1409 C THR A 93 -40.780 -1.163 -2.051 1.00 15.23 C ATOM 1410 O THR A 93 -40.136 -0.524 -2.883 1.00 31.43 O ATOM 1411 CB THR A 93 -43.049 -0.475 -2.830 1.00 51.14 C ATOM 1412 OG1 THR A 93 -42.910 0.617 -1.912 1.00 20.55 O ATOM 1413 CG2 THR A 93 -44.512 -0.876 -2.931 1.00 32.22 C ATOM 0 H THR A 93 -42.918 -1.736 -0.406 1.00 3.24 H new ATOM 0 HA THR A 93 -42.131 -2.400 -3.171 1.00 15.11 H new ATOM 0 HB THR A 93 -42.705 -0.166 -3.817 1.00 51.14 H new ATOM 0 HG1 THR A 93 -43.461 1.369 -2.213 1.00 20.55 H new ATOM 0 HG21 THR A 93 -45.102 -0.020 -3.259 1.00 32.22 H new ATOM 0 HG22 THR A 93 -44.618 -1.687 -3.651 1.00 32.22 H new ATOM 0 HG23 THR A 93 -44.866 -1.209 -1.955 1.00 32.22 H new ATOM 1421 N SER A 94 -40.309 -1.460 -0.845 1.00 41.23 N ATOM 1422 CA SER A 94 -38.981 -1.037 -0.417 1.00 71.52 C ATOM 1423 C SER A 94 -37.907 -1.605 -1.340 1.00 43.33 C ATOM 1424 O SER A 94 -38.180 -2.477 -2.167 1.00 3.02 O ATOM 1425 CB SER A 94 -38.720 -1.483 1.023 1.00 20.52 C ATOM 1426 OG SER A 94 -39.348 -2.725 1.294 1.00 2.23 O ATOM 0 H SER A 94 -40.827 -1.992 -0.146 1.00 41.23 H new ATOM 0 HA SER A 94 -38.940 0.051 -0.466 1.00 71.52 H new ATOM 0 HB2 SER A 94 -37.647 -1.570 1.191 1.00 20.52 H new ATOM 0 HB3 SER A 94 -39.090 -0.726 1.714 1.00 20.52 H new ATOM 0 HG SER A 94 -39.165 -2.989 2.220 1.00 2.23 H new ATOM 1432 N LEU A 95 -36.685 -1.106 -1.193 1.00 11.13 N ATOM 1433 CA LEU A 95 -35.568 -1.562 -2.012 1.00 34.44 C ATOM 1434 C LEU A 95 -35.023 -2.891 -1.499 1.00 62.22 C ATOM 1435 O LEU A 95 -35.099 -3.185 -0.306 1.00 61.44 O ATOM 1436 CB LEU A 95 -34.456 -0.512 -2.022 1.00 53.31 C ATOM 1437 CG LEU A 95 -33.556 -0.474 -0.786 1.00 14.14 C ATOM 1438 CD1 LEU A 95 -32.372 -1.412 -0.960 1.00 71.33 C ATOM 1439 CD2 LEU A 95 -33.080 0.945 -0.516 1.00 61.44 C ATOM 0 H LEU A 95 -36.442 -0.385 -0.514 1.00 11.13 H new ATOM 0 HA LEU A 95 -35.931 -1.708 -3.029 1.00 34.44 H new ATOM 0 HB2 LEU A 95 -33.830 -0.684 -2.897 1.00 53.31 H new ATOM 0 HB3 LEU A 95 -34.913 0.470 -2.144 1.00 53.31 H new ATOM 0 HG LEU A 95 -34.136 -0.810 0.073 1.00 14.14 H new ATOM 0 HD11 LEU A 95 -31.742 -1.372 -0.071 1.00 71.33 H new ATOM 0 HD12 LEU A 95 -32.733 -2.430 -1.104 1.00 71.33 H new ATOM 0 HD13 LEU A 95 -31.791 -1.107 -1.830 1.00 71.33 H new ATOM 0 HD21 LEU A 95 -32.441 0.953 0.367 1.00 61.44 H new ATOM 0 HD22 LEU A 95 -32.516 1.309 -1.375 1.00 61.44 H new ATOM 0 HD23 LEU A 95 -33.941 1.591 -0.346 1.00 61.44 H new ATOM 1451 N ARG A 96 -34.474 -3.690 -2.408 1.00 22.20 N ATOM 1452 CA ARG A 96 -33.915 -4.988 -2.047 1.00 2.41 C ATOM 1453 C ARG A 96 -32.405 -4.894 -1.851 1.00 14.45 C ATOM 1454 O ARG A 96 -31.663 -4.607 -2.791 1.00 63.30 O ATOM 1455 CB ARG A 96 -34.238 -6.023 -3.127 1.00 44.25 C ATOM 1456 CG ARG A 96 -33.998 -7.458 -2.685 1.00 63.41 C ATOM 1457 CD ARG A 96 -32.594 -7.922 -3.038 1.00 52.41 C ATOM 1458 NE ARG A 96 -32.542 -8.558 -4.352 1.00 50.34 N ATOM 1459 CZ ARG A 96 -32.980 -9.790 -4.589 1.00 2.41 C ATOM 1460 NH1 ARG A 96 -33.499 -10.513 -3.607 1.00 13.23 N1+ ATOM 1461 NH2 ARG A 96 -32.898 -10.300 -5.812 1.00 2.33 N ATOM 0 H ARG A 96 -34.404 -3.462 -3.400 1.00 22.20 H new ATOM 0 HA ARG A 96 -34.366 -5.302 -1.106 1.00 2.41 H new ATOM 0 HB2 ARG A 96 -35.281 -5.913 -3.424 1.00 44.25 H new ATOM 0 HB3 ARG A 96 -33.632 -5.817 -4.009 1.00 44.25 H new ATOM 0 HG2 ARG A 96 -34.149 -7.538 -1.609 1.00 63.41 H new ATOM 0 HG3 ARG A 96 -34.729 -8.113 -3.159 1.00 63.41 H new ATOM 0 HD2 ARG A 96 -31.915 -7.069 -3.021 1.00 52.41 H new ATOM 0 HD3 ARG A 96 -32.243 -8.624 -2.281 1.00 52.41 H new ATOM 0 HE ARG A 96 -32.148 -8.028 -5.129 1.00 50.34 H new ATOM 0 HH11 ARG A 96 -33.563 -10.124 -2.666 1.00 13.23 H new ATOM 0 HH12 ARG A 96 -33.834 -11.458 -3.792 1.00 13.23 H new ATOM 0 HH21 ARG A 96 -32.499 -9.746 -6.570 1.00 2.33 H new ATOM 0 HH22 ARG A 96 -33.234 -11.246 -5.994 1.00 2.33 H new ATOM 1475 N VAL A 97 -31.957 -5.139 -0.624 1.00 32.32 N ATOM 1476 CA VAL A 97 -30.536 -5.083 -0.304 1.00 32.11 C ATOM 1477 C VAL A 97 -29.878 -6.447 -0.482 1.00 2.42 C ATOM 1478 O VAL A 97 -30.401 -7.477 -0.055 1.00 4.01 O ATOM 1479 CB VAL A 97 -30.304 -4.598 1.140 1.00 24.41 C ATOM 1480 CG1 VAL A 97 -29.001 -5.159 1.688 1.00 40.42 C ATOM 1481 CG2 VAL A 97 -30.307 -3.078 1.198 1.00 52.15 C ATOM 0 H VAL A 97 -32.558 -5.378 0.165 1.00 32.32 H new ATOM 0 HA VAL A 97 -30.084 -4.372 -0.995 1.00 32.11 H new ATOM 0 HB VAL A 97 -31.120 -4.964 1.764 1.00 24.41 H new ATOM 0 HG11 VAL A 97 -28.854 -4.806 2.709 1.00 40.42 H new ATOM 0 HG12 VAL A 97 -29.043 -6.248 1.683 1.00 40.42 H new ATOM 0 HG13 VAL A 97 -28.171 -4.825 1.065 1.00 40.42 H new ATOM 0 HG21 VAL A 97 -30.142 -2.753 2.225 1.00 52.15 H new ATOM 0 HG22 VAL A 97 -29.513 -2.688 0.562 1.00 52.15 H new ATOM 0 HG23 VAL A 97 -31.269 -2.702 0.849 1.00 52.15 H new ATOM 1491 N PRO A 98 -28.703 -6.458 -1.128 1.00 12.13 N ATOM 1492 CA PRO A 98 -27.947 -7.689 -1.376 1.00 3.14 C ATOM 1493 C PRO A 98 -27.362 -8.279 -0.097 1.00 31.21 C ATOM 1494 O PRO A 98 -27.236 -7.589 0.915 1.00 54.31 O ATOM 1495 CB PRO A 98 -26.828 -7.235 -2.317 1.00 5.32 C ATOM 1496 CG PRO A 98 -26.655 -5.784 -2.026 1.00 31.15 C ATOM 1497 CD PRO A 98 -28.020 -5.268 -1.663 1.00 23.22 C ATOM 0 HA PRO A 98 -28.576 -8.477 -1.789 1.00 3.14 H new ATOM 0 HB2 PRO A 98 -25.907 -7.788 -2.133 1.00 5.32 H new ATOM 0 HB3 PRO A 98 -27.096 -7.400 -3.360 1.00 5.32 H new ATOM 0 HG2 PRO A 98 -25.950 -5.631 -1.209 1.00 31.15 H new ATOM 0 HG3 PRO A 98 -26.257 -5.257 -2.893 1.00 31.15 H new ATOM 0 HD2 PRO A 98 -27.964 -4.470 -0.923 1.00 23.22 H new ATOM 0 HD3 PRO A 98 -28.540 -4.862 -2.531 1.00 23.22 H new ATOM 1505 N HIS A 99 -27.004 -9.558 -0.150 1.00 2.03 N ATOM 1506 CA HIS A 99 -26.431 -10.239 1.005 1.00 40.20 C ATOM 1507 C HIS A 99 -25.071 -9.647 1.366 1.00 23.32 C ATOM 1508 O HIS A 99 -24.179 -9.559 0.524 1.00 3.54 O ATOM 1509 CB HIS A 99 -26.289 -11.736 0.722 1.00 10.22 C ATOM 1510 CG HIS A 99 -25.394 -12.044 -0.438 1.00 63.35 C ATOM 1511 ND1 HIS A 99 -25.820 -12.008 -1.749 1.00 22.30 N ATOM 1512 CD2 HIS A 99 -24.087 -12.394 -0.479 1.00 12.11 C ATOM 1513 CE1 HIS A 99 -24.815 -12.324 -2.546 1.00 51.45 C ATOM 1514 NE2 HIS A 99 -23.752 -12.562 -1.799 1.00 54.33 N ATOM 0 H HIS A 99 -27.101 -10.143 -0.980 1.00 2.03 H new ATOM 0 HA HIS A 99 -27.105 -10.098 1.850 1.00 40.20 H new ATOM 0 HB2 HIS A 99 -25.900 -12.230 1.612 1.00 10.22 H new ATOM 0 HB3 HIS A 99 -27.276 -12.156 0.530 1.00 10.22 H new ATOM 0 HD2 HIS A 99 -23.430 -12.518 0.369 1.00 12.11 H new ATOM 0 HE1 HIS A 99 -24.856 -12.378 -3.624 1.00 51.45 H new ATOM 0 HE2 HIS A 99 -22.831 -12.828 -2.147 1.00 54.33 H new ATOM 1522 N GLY A 100 -24.923 -9.242 2.623 1.00 52.11 N ATOM 1523 CA GLY A 100 -23.670 -8.663 3.072 1.00 34.40 C ATOM 1524 C GLY A 100 -23.602 -7.168 2.827 1.00 32.53 C ATOM 1525 O GLY A 100 -23.265 -6.400 3.726 1.00 13.43 O ATOM 0 H GLY A 100 -25.647 -9.304 3.338 1.00 52.11 H new ATOM 0 HA2 GLY A 100 -23.543 -8.860 4.137 1.00 34.40 H new ATOM 0 HA3 GLY A 100 -22.843 -9.151 2.557 1.00 34.40 H new ATOM 1529 N GLY A 101 -23.923 -6.756 1.605 1.00 3.44 N ATOM 1530 CA GLY A 101 -23.887 -5.345 1.265 1.00 63.32 C ATOM 1531 C GLY A 101 -22.537 -4.911 0.730 1.00 13.11 C ATOM 1532 O GLY A 101 -22.456 -4.061 -0.157 1.00 41.12 O ATOM 0 H GLY A 101 -24.207 -7.373 0.844 1.00 3.44 H new ATOM 0 HA2 GLY A 101 -24.654 -5.134 0.520 1.00 63.32 H new ATOM 0 HA3 GLY A 101 -24.131 -4.755 2.149 1.00 63.32 H new ATOM 1536 N GLY A 102 -21.472 -5.495 1.271 1.00 35.30 N ATOM 1537 CA GLY A 102 -20.133 -5.150 0.831 1.00 42.33 C ATOM 1538 C GLY A 102 -19.526 -4.027 1.649 1.00 11.11 C ATOM 1539 O GLY A 102 -18.331 -4.042 1.944 1.00 65.03 O ATOM 0 H GLY A 102 -21.513 -6.201 2.006 1.00 35.30 H new ATOM 0 HA2 GLY A 102 -19.494 -6.030 0.897 1.00 42.33 H new ATOM 0 HA3 GLY A 102 -20.163 -4.856 -0.218 1.00 42.33 H new ATOM 1543 N GLY A 103 -20.350 -3.052 2.017 1.00 42.51 N ATOM 1544 CA GLY A 103 -19.868 -1.930 2.802 1.00 70.24 C ATOM 1545 C GLY A 103 -20.765 -1.622 3.985 1.00 14.31 C ATOM 1546 O GLY A 103 -21.509 -2.487 4.449 1.00 75.45 O ATOM 0 H GLY A 103 -21.343 -3.018 1.786 1.00 42.51 H new ATOM 0 HA2 GLY A 103 -18.861 -2.147 3.160 1.00 70.24 H new ATOM 0 HA3 GLY A 103 -19.797 -1.049 2.165 1.00 70.24 H new ATOM 1550 N ILE A 104 -20.692 -0.390 4.475 1.00 10.42 N ATOM 1551 CA ILE A 104 -21.504 0.029 5.611 1.00 73.30 C ATOM 1552 C ILE A 104 -22.135 1.395 5.364 1.00 61.32 C ATOM 1553 O ILE A 104 -21.547 2.249 4.698 1.00 74.25 O ATOM 1554 CB ILE A 104 -20.671 0.087 6.906 1.00 31.42 C ATOM 1555 CG1 ILE A 104 -19.996 -1.261 7.165 1.00 73.31 C ATOM 1556 CG2 ILE A 104 -21.551 0.481 8.084 1.00 75.13 C ATOM 1557 CD1 ILE A 104 -19.005 -1.230 8.307 1.00 42.35 C ATOM 0 H ILE A 104 -20.079 0.336 4.104 1.00 10.42 H new ATOM 0 HA ILE A 104 -22.292 -0.715 5.727 1.00 73.30 H new ATOM 0 HB ILE A 104 -19.895 0.843 6.788 1.00 31.42 H new ATOM 0 HG12 ILE A 104 -20.762 -2.007 7.379 1.00 73.31 H new ATOM 0 HG13 ILE A 104 -19.483 -1.582 6.258 1.00 73.31 H new ATOM 0 HG21 ILE A 104 -20.949 0.518 8.992 1.00 75.13 H new ATOM 0 HG22 ILE A 104 -21.989 1.462 7.899 1.00 75.13 H new ATOM 0 HG23 ILE A 104 -22.346 -0.254 8.206 1.00 75.13 H new ATOM 0 HD11 ILE A 104 -18.565 -2.219 8.434 1.00 42.35 H new ATOM 0 HD12 ILE A 104 -18.218 -0.509 8.087 1.00 42.35 H new ATOM 0 HD13 ILE A 104 -19.516 -0.940 9.225 1.00 42.35 H new ATOM 1569 N ILE A 105 -23.331 1.595 5.904 1.00 72.41 N ATOM 1570 CA ILE A 105 -24.040 2.858 5.744 1.00 11.13 C ATOM 1571 C ILE A 105 -23.293 3.999 6.429 1.00 43.31 C ATOM 1572 O ILE A 105 -23.360 4.154 7.648 1.00 71.54 O ATOM 1573 CB ILE A 105 -25.468 2.779 6.315 1.00 21.24 C ATOM 1574 CG1 ILE A 105 -26.198 1.558 5.752 1.00 33.43 C ATOM 1575 CG2 ILE A 105 -26.236 4.054 6.000 1.00 13.51 C ATOM 1576 CD1 ILE A 105 -26.430 1.627 4.259 1.00 11.11 C ATOM 0 H ILE A 105 -23.830 0.898 6.457 1.00 72.41 H new ATOM 0 HA ILE A 105 -24.096 3.054 4.673 1.00 11.13 H new ATOM 0 HB ILE A 105 -25.405 2.674 7.398 1.00 21.24 H new ATOM 0 HG12 ILE A 105 -25.620 0.662 5.981 1.00 33.43 H new ATOM 0 HG13 ILE A 105 -27.159 1.455 6.256 1.00 33.43 H new ATOM 0 HG21 ILE A 105 -27.243 3.983 6.410 1.00 13.51 H new ATOM 0 HG22 ILE A 105 -25.723 4.907 6.444 1.00 13.51 H new ATOM 0 HG23 ILE A 105 -26.293 4.187 4.920 1.00 13.51 H new ATOM 0 HD11 ILE A 105 -26.952 0.728 3.930 1.00 11.11 H new ATOM 0 HD12 ILE A 105 -27.034 2.504 4.025 1.00 11.11 H new ATOM 0 HD13 ILE A 105 -25.472 1.699 3.745 1.00 11.11 H new ATOM 1588 N HIS A 106 -22.583 4.794 5.635 1.00 44.11 N ATOM 1589 CA HIS A 106 -21.826 5.923 6.166 1.00 34.34 C ATOM 1590 C HIS A 106 -22.524 7.242 5.851 1.00 52.02 C ATOM 1591 O HIS A 106 -22.279 8.256 6.504 1.00 2.51 O ATOM 1592 CB HIS A 106 -20.410 5.931 5.586 1.00 22.33 C ATOM 1593 CG HIS A 106 -19.465 6.824 6.328 1.00 1.11 C ATOM 1594 ND1 HIS A 106 -19.016 6.550 7.603 1.00 2.12 N ATOM 1595 CD2 HIS A 106 -18.880 7.989 5.966 1.00 44.21 C ATOM 1596 CE1 HIS A 106 -18.198 7.511 7.995 1.00 70.15 C ATOM 1597 NE2 HIS A 106 -18.099 8.397 7.020 1.00 4.01 N ATOM 0 H HIS A 106 -22.516 4.678 4.624 1.00 44.11 H new ATOM 0 HA HIS A 106 -21.768 5.813 7.249 1.00 34.34 H new ATOM 0 HB2 HIS A 106 -20.017 4.914 5.593 1.00 22.33 H new ATOM 0 HB3 HIS A 106 -20.455 6.248 4.544 1.00 22.33 H new ATOM 0 HD2 HIS A 106 -19.004 8.503 5.024 1.00 44.21 H new ATOM 0 HE1 HIS A 106 -17.696 7.563 8.950 1.00 70.15 H new ATOM 0 HE2 HIS A 106 -17.534 9.246 7.046 1.00 4.01 H new ATOM 1605 N ASP A 107 -23.394 7.220 4.846 1.00 2.53 N ATOM 1606 CA ASP A 107 -24.128 8.414 4.445 1.00 2.33 C ATOM 1607 C ASP A 107 -25.451 8.043 3.784 1.00 53.53 C ATOM 1608 O ASP A 107 -25.571 6.985 3.164 1.00 42.21 O ATOM 1609 CB ASP A 107 -23.286 9.261 3.489 1.00 13.01 C ATOM 1610 CG ASP A 107 -22.404 10.255 4.220 1.00 51.05 C ATOM 1611 OD1 ASP A 107 -22.899 10.906 5.164 1.00 40.31 O ATOM 1612 OD2 ASP A 107 -21.219 10.381 3.848 1.00 71.12 O1- ATOM 0 H ASP A 107 -23.607 6.389 4.295 1.00 2.53 H new ATOM 0 HA ASP A 107 -24.341 8.996 5.342 1.00 2.33 H new ATOM 0 HB2 ASP A 107 -22.663 8.606 2.880 1.00 13.01 H new ATOM 0 HB3 ASP A 107 -23.945 9.798 2.807 1.00 13.01 H new ATOM 1617 N VAL A 108 -26.442 8.917 3.920 1.00 40.23 N ATOM 1618 CA VAL A 108 -27.757 8.681 3.336 1.00 11.03 C ATOM 1619 C VAL A 108 -28.445 9.995 2.981 1.00 62.13 C ATOM 1620 O VAL A 108 -28.619 10.867 3.832 1.00 23.34 O ATOM 1621 CB VAL A 108 -28.661 7.882 4.293 1.00 20.20 C ATOM 1622 CG1 VAL A 108 -30.047 7.702 3.692 1.00 12.41 C ATOM 1623 CG2 VAL A 108 -28.033 6.535 4.619 1.00 33.40 C ATOM 0 H VAL A 108 -26.359 9.796 4.430 1.00 40.23 H new ATOM 0 HA VAL A 108 -27.600 8.100 2.427 1.00 11.03 H new ATOM 0 HB VAL A 108 -28.764 8.443 5.222 1.00 20.20 H new ATOM 0 HG11 VAL A 108 -30.672 7.135 4.382 1.00 12.41 H new ATOM 0 HG12 VAL A 108 -30.496 8.679 3.514 1.00 12.41 H new ATOM 0 HG13 VAL A 108 -29.967 7.163 2.748 1.00 12.41 H new ATOM 0 HG21 VAL A 108 -28.685 5.984 5.296 1.00 33.40 H new ATOM 0 HG22 VAL A 108 -27.899 5.964 3.700 1.00 33.40 H new ATOM 0 HG23 VAL A 108 -27.065 6.691 5.094 1.00 33.40 H new ATOM 1633 N LYS A 109 -28.835 10.129 1.718 1.00 73.05 N ATOM 1634 CA LYS A 109 -29.506 11.335 1.249 1.00 64.22 C ATOM 1635 C LYS A 109 -31.011 11.113 1.139 1.00 55.52 C ATOM 1636 O LYS A 109 -31.463 10.075 0.655 1.00 53.24 O ATOM 1637 CB LYS A 109 -28.944 11.762 -0.109 1.00 5.12 C ATOM 1638 CG LYS A 109 -27.749 12.694 -0.006 1.00 4.01 C ATOM 1639 CD LYS A 109 -28.175 14.152 -0.044 1.00 43.23 C ATOM 1640 CE LYS A 109 -27.150 15.050 0.631 1.00 25.43 C ATOM 1641 NZ LYS A 109 -27.692 16.412 0.891 1.00 11.23 N1+ ATOM 0 H LYS A 109 -28.698 9.417 1.001 1.00 73.05 H new ATOM 0 HA LYS A 109 -29.324 12.126 1.976 1.00 64.22 H new ATOM 0 HB2 LYS A 109 -28.654 10.873 -0.669 1.00 5.12 H new ATOM 0 HB3 LYS A 109 -29.731 12.255 -0.680 1.00 5.12 H new ATOM 0 HG2 LYS A 109 -27.210 12.495 0.920 1.00 4.01 H new ATOM 0 HG3 LYS A 109 -27.059 12.494 -0.825 1.00 4.01 H new ATOM 0 HD2 LYS A 109 -28.310 14.466 -1.079 1.00 43.23 H new ATOM 0 HD3 LYS A 109 -29.140 14.263 0.451 1.00 43.23 H new ATOM 0 HE2 LYS A 109 -26.835 14.599 1.572 1.00 25.43 H new ATOM 0 HE3 LYS A 109 -26.263 15.126 0.002 1.00 25.43 H new ATOM 0 HZ1 LYS A 109 -26.963 16.994 1.352 1.00 11.23 H new ATOM 0 HZ2 LYS A 109 -27.969 16.853 -0.009 1.00 11.23 H new ATOM 0 HZ3 LYS A 109 -28.523 16.342 1.512 1.00 11.23 H new ATOM 1655 N VAL A 110 -31.785 12.094 1.594 1.00 33.40 N ATOM 1656 CA VAL A 110 -33.240 12.007 1.544 1.00 62.24 C ATOM 1657 C VAL A 110 -33.857 13.345 1.155 1.00 62.33 C ATOM 1658 O VAL A 110 -33.663 14.353 1.835 1.00 72.31 O ATOM 1659 CB VAL A 110 -33.820 11.560 2.899 1.00 4.52 C ATOM 1660 CG1 VAL A 110 -33.338 12.474 4.015 1.00 44.34 C ATOM 1661 CG2 VAL A 110 -35.340 11.531 2.843 1.00 54.34 C ATOM 0 H VAL A 110 -31.428 12.958 2.001 1.00 33.40 H new ATOM 0 HA VAL A 110 -33.488 11.263 0.787 1.00 62.24 H new ATOM 0 HB VAL A 110 -33.466 10.551 3.111 1.00 4.52 H new ATOM 0 HG11 VAL A 110 -33.758 12.142 4.964 1.00 44.34 H new ATOM 0 HG12 VAL A 110 -32.250 12.440 4.068 1.00 44.34 H new ATOM 0 HG13 VAL A 110 -33.660 13.496 3.813 1.00 44.34 H new ATOM 0 HG21 VAL A 110 -35.734 11.213 3.808 1.00 54.34 H new ATOM 0 HG22 VAL A 110 -35.715 12.527 2.609 1.00 54.34 H new ATOM 0 HG23 VAL A 110 -35.662 10.832 2.072 1.00 54.34 H new ATOM 1671 N PHE A 111 -34.604 13.348 0.055 1.00 31.14 N ATOM 1672 CA PHE A 111 -35.252 14.562 -0.425 1.00 61.30 C ATOM 1673 C PHE A 111 -36.758 14.506 -0.191 1.00 14.04 C ATOM 1674 O PHE A 111 -37.369 13.441 -0.268 1.00 54.20 O ATOM 1675 CB PHE A 111 -34.964 14.764 -1.915 1.00 25.34 C ATOM 1676 CG PHE A 111 -33.520 14.567 -2.278 1.00 21.54 C ATOM 1677 CD1 PHE A 111 -32.524 15.255 -1.606 1.00 61.01 C ATOM 1678 CD2 PHE A 111 -33.160 13.696 -3.294 1.00 34.24 C ATOM 1679 CE1 PHE A 111 -31.193 15.076 -1.937 1.00 62.23 C ATOM 1680 CE2 PHE A 111 -31.832 13.513 -3.630 1.00 44.30 C ATOM 1681 CZ PHE A 111 -30.847 14.205 -2.951 1.00 45.00 C ATOM 0 H PHE A 111 -34.775 12.523 -0.520 1.00 31.14 H new ATOM 0 HA PHE A 111 -34.847 15.405 0.135 1.00 61.30 H new ATOM 0 HB2 PHE A 111 -35.574 14.069 -2.492 1.00 25.34 H new ATOM 0 HB3 PHE A 111 -35.269 15.770 -2.203 1.00 25.34 H new ATOM 0 HD1 PHE A 111 -32.789 15.940 -0.814 1.00 61.01 H new ATOM 0 HD2 PHE A 111 -33.926 13.154 -3.829 1.00 34.24 H new ATOM 0 HE1 PHE A 111 -30.426 15.617 -1.403 1.00 62.23 H new ATOM 0 HE2 PHE A 111 -31.564 12.830 -4.422 1.00 44.30 H new ATOM 0 HZ PHE A 111 -29.809 14.065 -3.213 1.00 45.00 H new ATOM 1691 N ASN A 112 -37.350 15.660 0.098 1.00 50.25 N ATOM 1692 CA ASN A 112 -38.785 15.743 0.346 1.00 72.43 C ATOM 1693 C ASN A 112 -39.435 16.784 -0.560 1.00 13.34 C ATOM 1694 O ASN A 112 -38.887 17.867 -0.769 1.00 60.11 O ATOM 1695 CB ASN A 112 -39.051 16.088 1.813 1.00 64.11 C ATOM 1696 CG ASN A 112 -40.422 15.635 2.275 1.00 42.02 C ATOM 1697 OD1 ASN A 112 -41.376 15.613 1.496 1.00 74.51 O ATOM 1698 ND2 ASN A 112 -40.526 15.269 3.547 1.00 45.40 N ATOM 0 H ASN A 112 -36.858 16.551 0.166 1.00 50.25 H new ATOM 0 HA ASN A 112 -39.224 14.770 0.123 1.00 72.43 H new ATOM 0 HB2 ASN A 112 -38.288 15.622 2.437 1.00 64.11 H new ATOM 0 HB3 ASN A 112 -38.962 17.165 1.952 1.00 64.11 H new ATOM 0 HD21 ASN A 112 -41.423 14.953 3.915 1.00 45.40 H new ATOM 0 HD22 ASN A 112 -39.709 15.303 4.156 1.00 45.40 H new ATOM 1705 N ARG A 113 -40.605 16.449 -1.093 1.00 20.34 N ATOM 1706 CA ARG A 113 -41.330 17.355 -1.976 1.00 53.42 C ATOM 1707 C ARG A 113 -41.797 18.595 -1.219 1.00 54.43 C ATOM 1708 O ARG A 113 -41.907 19.678 -1.792 1.00 33.44 O ATOM 1709 CB ARG A 113 -42.531 16.642 -2.598 1.00 52.52 C ATOM 1710 CG ARG A 113 -43.515 16.097 -1.575 1.00 1.01 C ATOM 1711 CD ARG A 113 -44.731 15.479 -2.244 1.00 10.22 C ATOM 1712 NE ARG A 113 -45.383 14.490 -1.390 1.00 43.12 N ATOM 1713 CZ ARG A 113 -46.580 13.973 -1.645 1.00 21.52 C ATOM 1714 NH1 ARG A 113 -47.251 14.348 -2.724 1.00 31.21 N1+ ATOM 1715 NH2 ARG A 113 -47.106 13.078 -0.820 1.00 54.41 N ATOM 0 H ARG A 113 -41.071 15.557 -0.929 1.00 20.34 H new ATOM 0 HA ARG A 113 -40.652 17.669 -2.769 1.00 53.42 H new ATOM 0 HB2 ARG A 113 -43.053 17.336 -3.257 1.00 52.52 H new ATOM 0 HB3 ARG A 113 -42.173 15.820 -3.219 1.00 52.52 H new ATOM 0 HG2 ARG A 113 -43.020 15.349 -0.956 1.00 1.01 H new ATOM 0 HG3 ARG A 113 -43.833 16.901 -0.911 1.00 1.01 H new ATOM 0 HD2 ARG A 113 -45.443 16.264 -2.498 1.00 10.22 H new ATOM 0 HD3 ARG A 113 -44.429 15.008 -3.179 1.00 10.22 H new ATOM 0 HE ARG A 113 -44.892 14.179 -0.552 1.00 43.12 H new ATOM 0 HH11 ARG A 113 -46.849 15.035 -3.361 1.00 31.21 H new ATOM 0 HH12 ARG A 113 -48.170 13.949 -2.917 1.00 31.21 H new ATOM 0 HH21 ARG A 113 -46.592 12.786 0.011 1.00 54.41 H new ATOM 0 HH22 ARG A 113 -48.025 12.682 -1.016 1.00 54.41 H new ATOM 1729 N GLU A 114 -42.069 18.426 0.071 1.00 1.14 N ATOM 1730 CA GLU A 114 -42.525 19.533 0.905 1.00 4.11 C ATOM 1731 C GLU A 114 -41.500 20.664 0.919 1.00 41.23 C ATOM 1732 O GLU A 114 -41.857 21.836 1.025 1.00 33.03 O ATOM 1733 CB GLU A 114 -42.787 19.049 2.333 1.00 54.33 C ATOM 1734 CG GLU A 114 -41.519 18.777 3.124 1.00 44.41 C ATOM 1735 CD GLU A 114 -41.785 18.023 4.413 1.00 52.21 C ATOM 1736 OE1 GLU A 114 -42.971 17.781 4.724 1.00 71.42 O ATOM 1737 OE2 GLU A 114 -40.810 17.675 5.112 1.00 73.01 O1- ATOM 0 H GLU A 114 -41.982 17.536 0.561 1.00 1.14 H new ATOM 0 HA GLU A 114 -43.454 19.915 0.481 1.00 4.11 H new ATOM 0 HB2 GLU A 114 -43.380 19.798 2.859 1.00 54.33 H new ATOM 0 HB3 GLU A 114 -43.384 18.138 2.295 1.00 54.33 H new ATOM 0 HG2 GLU A 114 -40.827 18.203 2.508 1.00 44.41 H new ATOM 0 HG3 GLU A 114 -41.030 19.723 3.355 1.00 44.41 H new ATOM 1744 N ASP A 115 -40.227 20.300 0.809 1.00 61.31 N ATOM 1745 CA ASP A 115 -39.150 21.283 0.808 1.00 32.24 C ATOM 1746 C ASP A 115 -39.102 22.035 -0.519 1.00 43.43 C ATOM 1747 O ASP A 115 -38.494 23.100 -0.618 1.00 43.12 O ATOM 1748 CB ASP A 115 -37.807 20.599 1.071 1.00 53.53 C ATOM 1749 CG ASP A 115 -37.534 20.409 2.550 1.00 13.43 C ATOM 1750 OD1 ASP A 115 -37.443 21.424 3.271 1.00 74.43 O ATOM 1751 OD2 ASP A 115 -37.410 19.244 2.985 1.00 32.32 O1- ATOM 0 H ASP A 115 -39.916 19.333 0.719 1.00 61.31 H new ATOM 0 HA ASP A 115 -39.345 22.001 1.604 1.00 32.24 H new ATOM 0 HB2 ASP A 115 -37.793 19.629 0.574 1.00 53.53 H new ATOM 0 HB3 ASP A 115 -37.007 21.194 0.630 1.00 53.53 H new ATOM 1756 N GLY A 116 -39.746 21.472 -1.536 1.00 54.51 N ATOM 1757 CA GLY A 116 -39.764 22.102 -2.844 1.00 23.20 C ATOM 1758 C GLY A 116 -38.906 21.364 -3.854 1.00 2.22 C ATOM 1759 O GLY A 116 -38.479 21.940 -4.853 1.00 55.14 O ATOM 0 H GLY A 116 -40.256 20.591 -1.478 1.00 54.51 H new ATOM 0 HA2 GLY A 116 -40.790 22.148 -3.208 1.00 23.20 H new ATOM 0 HA3 GLY A 116 -39.412 23.130 -2.754 1.00 23.20 H new ATOM 1763 N ASP A 117 -38.654 20.086 -3.591 1.00 71.14 N ATOM 1764 CA ASP A 117 -37.841 19.268 -4.486 1.00 22.33 C ATOM 1765 C ASP A 117 -38.688 18.697 -5.618 1.00 23.13 C ATOM 1766 O ASP A 117 -39.663 17.986 -5.379 1.00 55.15 O ATOM 1767 CB ASP A 117 -37.175 18.133 -3.707 1.00 15.40 C ATOM 1768 CG ASP A 117 -35.928 17.614 -4.396 1.00 11.35 C ATOM 1769 OD1 ASP A 117 -34.839 18.172 -4.150 1.00 73.13 O ATOM 1770 OD2 ASP A 117 -36.042 16.650 -5.182 1.00 42.23 O1- ATOM 0 H ASP A 117 -39.000 19.594 -2.767 1.00 71.14 H new ATOM 0 HA ASP A 117 -37.068 19.903 -4.920 1.00 22.33 H new ATOM 0 HB2 ASP A 117 -36.916 18.485 -2.708 1.00 15.40 H new ATOM 0 HB3 ASP A 117 -37.885 17.316 -3.583 1.00 15.40 H new ATOM 1775 N GLU A 118 -38.309 19.015 -6.852 1.00 12.24 N ATOM 1776 CA GLU A 118 -39.035 18.534 -8.021 1.00 23.12 C ATOM 1777 C GLU A 118 -38.758 17.053 -8.263 1.00 62.43 C ATOM 1778 O GLU A 118 -37.606 16.618 -8.269 1.00 43.24 O ATOM 1779 CB GLU A 118 -38.646 19.346 -9.260 1.00 34.24 C ATOM 1780 CG GLU A 118 -39.231 18.801 -10.552 1.00 62.21 C ATOM 1781 CD GLU A 118 -38.955 19.700 -11.742 1.00 42.54 C ATOM 1782 OE1 GLU A 118 -38.145 20.640 -11.599 1.00 52.30 O ATOM 1783 OE2 GLU A 118 -39.548 19.464 -12.815 1.00 0.43 O1- ATOM 0 H GLU A 118 -37.504 19.603 -7.068 1.00 12.24 H new ATOM 0 HA GLU A 118 -40.101 18.660 -7.832 1.00 23.12 H new ATOM 0 HB2 GLU A 118 -38.976 20.376 -9.127 1.00 34.24 H new ATOM 0 HB3 GLU A 118 -37.559 19.368 -9.344 1.00 34.24 H new ATOM 0 HG2 GLU A 118 -38.817 17.811 -10.745 1.00 62.21 H new ATOM 0 HG3 GLU A 118 -40.308 18.679 -10.436 1.00 62.21 H new ATOM 1790 N LEU A 119 -39.823 16.284 -8.461 1.00 53.45 N ATOM 1791 CA LEU A 119 -39.697 14.851 -8.702 1.00 44.14 C ATOM 1792 C LEU A 119 -40.499 14.432 -9.930 1.00 13.41 C ATOM 1793 O LEU A 119 -41.417 15.126 -10.368 1.00 3.34 O ATOM 1794 CB LEU A 119 -40.169 14.063 -7.478 1.00 54.15 C ATOM 1795 CG LEU A 119 -39.128 13.842 -6.380 1.00 4.14 C ATOM 1796 CD1 LEU A 119 -39.025 15.067 -5.485 1.00 75.22 C ATOM 1797 CD2 LEU A 119 -39.474 12.608 -5.559 1.00 64.10 C ATOM 0 H LEU A 119 -40.783 16.629 -8.459 1.00 53.45 H new ATOM 0 HA LEU A 119 -38.645 14.631 -8.885 1.00 44.14 H new ATOM 0 HB2 LEU A 119 -41.022 14.583 -7.043 1.00 54.15 H new ATOM 0 HB3 LEU A 119 -40.527 13.089 -7.813 1.00 54.15 H new ATOM 0 HG LEU A 119 -38.159 13.681 -6.853 1.00 4.14 H new ATOM 0 HD11 LEU A 119 -38.279 14.890 -4.710 1.00 75.22 H new ATOM 0 HD12 LEU A 119 -38.730 15.930 -6.082 1.00 75.22 H new ATOM 0 HD13 LEU A 119 -39.992 15.261 -5.020 1.00 75.22 H new ATOM 0 HD21 LEU A 119 -38.723 12.465 -4.782 1.00 64.10 H new ATOM 0 HD22 LEU A 119 -40.453 12.741 -5.098 1.00 64.10 H new ATOM 0 HD23 LEU A 119 -39.495 11.733 -6.209 1.00 64.10 H new ATOM 1809 N PRO A 120 -40.148 13.269 -10.498 1.00 20.10 N ATOM 1810 CA PRO A 120 -40.825 12.731 -11.683 1.00 0.40 C ATOM 1811 C PRO A 120 -42.244 12.265 -11.377 1.00 11.03 C ATOM 1812 O PRO A 120 -42.643 12.128 -10.220 1.00 42.43 O ATOM 1813 CB PRO A 120 -39.947 11.542 -12.082 1.00 45.01 C ATOM 1814 CG PRO A 120 -39.271 11.129 -10.821 1.00 75.10 C ATOM 1815 CD PRO A 120 -39.064 12.390 -10.029 1.00 64.30 C ATOM 0 HA PRO A 120 -40.934 13.481 -12.467 1.00 0.40 H new ATOM 0 HB2 PRO A 120 -40.545 10.730 -12.495 1.00 45.01 H new ATOM 0 HB3 PRO A 120 -39.222 11.824 -12.846 1.00 45.01 H new ATOM 0 HG2 PRO A 120 -39.881 10.416 -10.267 1.00 75.10 H new ATOM 0 HG3 PRO A 120 -38.320 10.639 -11.031 1.00 75.10 H new ATOM 0 HD2 PRO A 120 -39.131 12.207 -8.957 1.00 64.30 H new ATOM 0 HD3 PRO A 120 -38.083 12.826 -10.217 1.00 64.30 H new ATOM 1823 N PRO A 121 -43.027 12.016 -12.437 1.00 13.45 N ATOM 1824 CA PRO A 121 -44.415 11.561 -12.307 1.00 63.41 C ATOM 1825 C PRO A 121 -44.510 10.134 -11.779 1.00 74.12 C ATOM 1826 O PRO A 121 -43.927 9.212 -12.345 1.00 70.11 O ATOM 1827 CB PRO A 121 -44.948 11.637 -13.740 1.00 51.31 C ATOM 1828 CG PRO A 121 -43.740 11.505 -14.602 1.00 10.41 C ATOM 1829 CD PRO A 121 -42.617 12.158 -13.845 1.00 53.13 C ATOM 0 HA PRO A 121 -44.977 12.165 -11.595 1.00 63.41 H new ATOM 0 HB2 PRO A 121 -45.665 10.840 -13.938 1.00 51.31 H new ATOM 0 HB3 PRO A 121 -45.462 12.581 -13.921 1.00 51.31 H new ATOM 0 HG2 PRO A 121 -43.517 10.457 -14.804 1.00 10.41 H new ATOM 0 HG3 PRO A 121 -43.894 11.989 -15.566 1.00 10.41 H new ATOM 0 HD2 PRO A 121 -41.663 11.666 -14.037 1.00 53.13 H new ATOM 0 HD3 PRO A 121 -42.498 13.205 -14.125 1.00 53.13 H new ATOM 1837 N GLY A 122 -45.249 9.961 -10.686 1.00 43.21 N ATOM 1838 CA GLY A 122 -45.407 8.644 -10.100 1.00 45.50 C ATOM 1839 C GLY A 122 -44.551 8.453 -8.863 1.00 61.31 C ATOM 1840 O GLY A 122 -44.512 7.365 -8.287 1.00 64.21 O ATOM 0 H GLY A 122 -45.740 10.710 -10.197 1.00 43.21 H new ATOM 0 HA2 GLY A 122 -46.454 8.488 -9.841 1.00 45.50 H new ATOM 0 HA3 GLY A 122 -45.146 7.887 -10.839 1.00 45.50 H new ATOM 1844 N VAL A 123 -43.862 9.513 -8.454 1.00 20.12 N ATOM 1845 CA VAL A 123 -43.001 9.459 -7.278 1.00 30.11 C ATOM 1846 C VAL A 123 -43.462 10.448 -6.213 1.00 42.43 C ATOM 1847 O VAL A 123 -43.851 11.572 -6.524 1.00 35.02 O ATOM 1848 CB VAL A 123 -41.534 9.757 -7.641 1.00 72.33 C ATOM 1849 CG1 VAL A 123 -40.665 9.760 -6.393 1.00 14.23 C ATOM 1850 CG2 VAL A 123 -41.021 8.748 -8.656 1.00 34.10 C ATOM 0 H VAL A 123 -43.883 10.420 -8.920 1.00 20.12 H new ATOM 0 HA VAL A 123 -43.070 8.446 -6.882 1.00 30.11 H new ATOM 0 HB VAL A 123 -41.484 10.748 -8.092 1.00 72.33 H new ATOM 0 HG11 VAL A 123 -39.632 9.972 -6.669 1.00 14.23 H new ATOM 0 HG12 VAL A 123 -41.021 10.526 -5.704 1.00 14.23 H new ATOM 0 HG13 VAL A 123 -40.718 8.784 -5.910 1.00 14.23 H new ATOM 0 HG21 VAL A 123 -39.983 8.974 -8.901 1.00 34.10 H new ATOM 0 HG22 VAL A 123 -41.085 7.744 -8.235 1.00 34.10 H new ATOM 0 HG23 VAL A 123 -41.627 8.801 -9.560 1.00 34.10 H new ATOM 1860 N ASN A 124 -43.413 10.020 -4.955 1.00 33.12 N ATOM 1861 CA ASN A 124 -43.826 10.868 -3.844 1.00 53.53 C ATOM 1862 C ASN A 124 -42.614 11.383 -3.072 1.00 53.12 C ATOM 1863 O ASN A 124 -42.625 12.497 -2.551 1.00 73.13 O ATOM 1864 CB ASN A 124 -44.753 10.097 -2.903 1.00 43.21 C ATOM 1865 CG ASN A 124 -46.043 9.675 -3.580 1.00 42.43 C ATOM 1866 OD1 ASN A 124 -46.431 10.234 -4.605 1.00 73.31 O ATOM 1867 ND2 ASN A 124 -46.714 8.682 -3.007 1.00 3.04 N ATOM 0 H ASN A 124 -43.092 9.092 -4.681 1.00 33.12 H new ATOM 0 HA ASN A 124 -44.364 11.723 -4.254 1.00 53.53 H new ATOM 0 HB2 ASN A 124 -44.235 9.213 -2.531 1.00 43.21 H new ATOM 0 HB3 ASN A 124 -44.986 10.718 -2.038 1.00 43.21 H new ATOM 0 HD21 ASN A 124 -47.589 8.354 -3.417 1.00 3.04 H new ATOM 0 HD22 ASN A 124 -46.355 8.247 -2.157 1.00 3.04 H new ATOM 1874 N GLN A 125 -41.570 10.562 -3.006 1.00 42.31 N ATOM 1875 CA GLN A 125 -40.351 10.934 -2.300 1.00 61.22 C ATOM 1876 C GLN A 125 -39.123 10.331 -2.975 1.00 32.52 C ATOM 1877 O GLN A 125 -39.242 9.455 -3.834 1.00 3.53 O ATOM 1878 CB GLN A 125 -40.420 10.476 -0.842 1.00 74.32 C ATOM 1879 CG GLN A 125 -41.140 11.456 0.071 1.00 12.52 C ATOM 1880 CD GLN A 125 -42.276 10.811 0.840 1.00 12.21 C ATOM 1881 OE1 GLN A 125 -42.363 10.937 2.062 1.00 35.21 O ATOM 1882 NE2 GLN A 125 -43.155 10.118 0.127 1.00 13.11 N ATOM 0 H GLN A 125 -41.545 9.636 -3.433 1.00 42.31 H new ATOM 0 HA GLN A 125 -40.263 12.020 -2.330 1.00 61.22 H new ATOM 0 HB2 GLN A 125 -40.926 9.511 -0.797 1.00 74.32 H new ATOM 0 HB3 GLN A 125 -39.407 10.323 -0.470 1.00 74.32 H new ATOM 0 HG2 GLN A 125 -40.426 11.882 0.775 1.00 12.52 H new ATOM 0 HG3 GLN A 125 -41.532 12.281 -0.524 1.00 12.52 H new ATOM 0 HE21 GLN A 125 -43.044 10.040 -0.884 1.00 13.11 H new ATOM 0 HE22 GLN A 125 -43.942 9.663 0.590 1.00 13.11 H new ATOM 1891 N LEU A 126 -37.946 10.806 -2.586 1.00 13.13 N ATOM 1892 CA LEU A 126 -36.696 10.314 -3.154 1.00 42.24 C ATOM 1893 C LEU A 126 -35.626 10.169 -2.076 1.00 22.01 C ATOM 1894 O LEU A 126 -35.417 11.074 -1.269 1.00 4.43 O ATOM 1895 CB LEU A 126 -36.205 11.260 -4.252 1.00 14.10 C ATOM 1896 CG LEU A 126 -35.189 10.677 -5.235 1.00 62.41 C ATOM 1897 CD1 LEU A 126 -33.853 10.443 -4.546 1.00 34.22 C ATOM 1898 CD2 LEU A 126 -35.713 9.383 -5.840 1.00 54.24 C ATOM 0 H LEU A 126 -37.831 11.532 -1.879 1.00 13.13 H new ATOM 0 HA LEU A 126 -36.885 9.331 -3.586 1.00 42.24 H new ATOM 0 HB2 LEU A 126 -37.069 11.608 -4.818 1.00 14.10 H new ATOM 0 HB3 LEU A 126 -35.761 12.135 -3.778 1.00 14.10 H new ATOM 0 HG LEU A 126 -35.038 11.396 -6.040 1.00 62.41 H new ATOM 0 HD11 LEU A 126 -33.143 10.028 -5.261 1.00 34.22 H new ATOM 0 HD12 LEU A 126 -33.471 11.389 -4.162 1.00 34.22 H new ATOM 0 HD13 LEU A 126 -33.987 9.744 -3.720 1.00 34.22 H new ATOM 0 HD21 LEU A 126 -34.977 8.983 -6.537 1.00 54.24 H new ATOM 0 HD22 LEU A 126 -35.894 8.658 -5.047 1.00 54.24 H new ATOM 0 HD23 LEU A 126 -36.645 9.580 -6.370 1.00 54.24 H new ATOM 1910 N VAL A 127 -34.950 9.025 -2.070 1.00 20.53 N ATOM 1911 CA VAL A 127 -33.900 8.762 -1.094 1.00 45.13 C ATOM 1912 C VAL A 127 -32.799 7.892 -1.691 1.00 1.10 C ATOM 1913 O VAL A 127 -33.075 6.923 -2.398 1.00 14.25 O ATOM 1914 CB VAL A 127 -34.462 8.070 0.162 1.00 20.41 C ATOM 1915 CG1 VAL A 127 -33.375 7.910 1.214 1.00 10.03 C ATOM 1916 CG2 VAL A 127 -35.642 8.853 0.719 1.00 54.52 C ATOM 0 H VAL A 127 -35.111 8.265 -2.731 1.00 20.53 H new ATOM 0 HA VAL A 127 -33.482 9.728 -0.811 1.00 45.13 H new ATOM 0 HB VAL A 127 -34.814 7.077 -0.118 1.00 20.41 H new ATOM 0 HG11 VAL A 127 -33.790 7.419 2.094 1.00 10.03 H new ATOM 0 HG12 VAL A 127 -32.564 7.305 0.810 1.00 10.03 H new ATOM 0 HG13 VAL A 127 -32.991 8.891 1.493 1.00 10.03 H new ATOM 0 HG21 VAL A 127 -36.026 8.350 1.606 1.00 54.52 H new ATOM 0 HG22 VAL A 127 -35.318 9.859 0.985 1.00 54.52 H new ATOM 0 HG23 VAL A 127 -36.428 8.912 -0.034 1.00 54.52 H new ATOM 1926 N ARG A 128 -31.551 8.244 -1.402 1.00 4.20 N ATOM 1927 CA ARG A 128 -30.408 7.496 -1.910 1.00 61.44 C ATOM 1928 C ARG A 128 -29.465 7.107 -0.776 1.00 20.05 C ATOM 1929 O ARG A 128 -29.036 7.954 0.007 1.00 44.24 O ATOM 1930 CB ARG A 128 -29.655 8.322 -2.954 1.00 53.24 C ATOM 1931 CG ARG A 128 -30.529 8.793 -4.106 1.00 2.30 C ATOM 1932 CD ARG A 128 -29.868 9.920 -4.883 1.00 44.25 C ATOM 1933 NE ARG A 128 -28.483 9.608 -5.227 1.00 42.20 N ATOM 1934 CZ ARG A 128 -27.621 10.507 -5.690 1.00 12.20 C ATOM 1935 NH1 ARG A 128 -27.998 11.765 -5.862 1.00 23.30 N1+ ATOM 1936 NH2 ARG A 128 -26.377 10.147 -5.979 1.00 64.11 N ATOM 0 H ARG A 128 -31.306 9.043 -0.818 1.00 4.20 H new ATOM 0 HA ARG A 128 -30.781 6.585 -2.377 1.00 61.44 H new ATOM 0 HB2 ARG A 128 -29.212 9.191 -2.467 1.00 53.24 H new ATOM 0 HB3 ARG A 128 -28.834 7.726 -3.352 1.00 53.24 H new ATOM 0 HG2 ARG A 128 -30.731 7.957 -4.776 1.00 2.30 H new ATOM 0 HG3 ARG A 128 -31.491 9.131 -3.720 1.00 2.30 H new ATOM 0 HD2 ARG A 128 -30.434 10.112 -5.795 1.00 44.25 H new ATOM 0 HD3 ARG A 128 -29.897 10.835 -4.291 1.00 44.25 H new ATOM 0 HE ARG A 128 -28.160 8.648 -5.105 1.00 42.20 H new ATOM 0 HH11 ARG A 128 -28.953 12.046 -5.639 1.00 23.30 H new ATOM 0 HH12 ARG A 128 -27.334 12.452 -6.218 1.00 23.30 H new ATOM 0 HH21 ARG A 128 -26.082 9.180 -5.846 1.00 64.11 H new ATOM 0 HH22 ARG A 128 -25.716 10.838 -6.334 1.00 64.11 H new ATOM 1950 N VAL A 129 -29.145 5.819 -0.694 1.00 61.44 N ATOM 1951 CA VAL A 129 -28.253 5.317 0.343 1.00 71.52 C ATOM 1952 C VAL A 129 -26.824 5.193 -0.174 1.00 13.23 C ATOM 1953 O VAL A 129 -26.601 4.835 -1.331 1.00 34.03 O ATOM 1954 CB VAL A 129 -28.718 3.947 0.870 1.00 44.32 C ATOM 1955 CG1 VAL A 129 -27.697 3.373 1.841 1.00 3.32 C ATOM 1956 CG2 VAL A 129 -30.085 4.064 1.527 1.00 62.34 C ATOM 0 H VAL A 129 -29.491 5.104 -1.334 1.00 61.44 H new ATOM 0 HA VAL A 129 -28.280 6.039 1.159 1.00 71.52 H new ATOM 0 HB VAL A 129 -28.804 3.263 0.026 1.00 44.32 H new ATOM 0 HG11 VAL A 129 -28.043 2.405 2.203 1.00 3.32 H new ATOM 0 HG12 VAL A 129 -26.741 3.250 1.333 1.00 3.32 H new ATOM 0 HG13 VAL A 129 -27.575 4.053 2.684 1.00 3.32 H new ATOM 0 HG21 VAL A 129 -30.397 3.086 1.893 1.00 62.34 H new ATOM 0 HG22 VAL A 129 -30.029 4.763 2.361 1.00 62.34 H new ATOM 0 HG23 VAL A 129 -30.809 4.427 0.798 1.00 62.34 H new ATOM 1966 N TYR A 130 -25.860 5.490 0.689 1.00 2.33 N ATOM 1967 CA TYR A 130 -24.452 5.414 0.319 1.00 2.11 C ATOM 1968 C TYR A 130 -23.729 4.353 1.144 1.00 50.21 C ATOM 1969 O TYR A 130 -23.780 4.367 2.375 1.00 35.14 O ATOM 1970 CB TYR A 130 -23.777 6.773 0.512 1.00 54.22 C ATOM 1971 CG TYR A 130 -24.246 7.825 -0.468 1.00 50.10 C ATOM 1972 CD1 TYR A 130 -25.548 8.309 -0.428 1.00 41.25 C ATOM 1973 CD2 TYR A 130 -23.387 8.336 -1.432 1.00 64.34 C ATOM 1974 CE1 TYR A 130 -25.980 9.270 -1.320 1.00 42.45 C ATOM 1975 CE2 TYR A 130 -23.810 9.297 -2.330 1.00 13.34 C ATOM 1976 CZ TYR A 130 -25.108 9.761 -2.269 1.00 23.14 C ATOM 1977 OH TYR A 130 -25.535 10.719 -3.160 1.00 43.15 O ATOM 0 H TYR A 130 -26.028 5.786 1.651 1.00 2.33 H new ATOM 0 HA TYR A 130 -24.394 5.134 -0.733 1.00 2.11 H new ATOM 0 HB2 TYR A 130 -23.967 7.123 1.527 1.00 54.22 H new ATOM 0 HB3 TYR A 130 -22.698 6.651 0.413 1.00 54.22 H new ATOM 0 HD1 TYR A 130 -26.234 7.927 0.314 1.00 41.25 H new ATOM 0 HD2 TYR A 130 -22.370 7.976 -1.481 1.00 64.34 H new ATOM 0 HE1 TYR A 130 -26.995 9.635 -1.275 1.00 42.45 H new ATOM 0 HE2 TYR A 130 -23.129 9.682 -3.075 1.00 13.34 H new ATOM 0 HH TYR A 130 -24.799 10.958 -3.761 1.00 43.15 H new ATOM 1987 N ILE A 131 -23.055 3.437 0.458 1.00 62.14 N ATOM 1988 CA ILE A 131 -22.320 2.370 1.126 1.00 14.52 C ATOM 1989 C ILE A 131 -20.861 2.346 0.681 1.00 32.22 C ATOM 1990 O ILE A 131 -20.563 2.154 -0.498 1.00 50.11 O ATOM 1991 CB ILE A 131 -22.951 0.993 0.850 1.00 53.44 C ATOM 1992 CG1 ILE A 131 -24.207 0.804 1.705 1.00 75.34 C ATOM 1993 CG2 ILE A 131 -21.946 -0.116 1.125 1.00 74.22 C ATOM 1994 CD1 ILE A 131 -25.495 0.948 0.925 1.00 41.20 C ATOM 0 H ILE A 131 -23.002 3.412 -0.560 1.00 62.14 H new ATOM 0 HA ILE A 131 -22.369 2.575 2.195 1.00 14.52 H new ATOM 0 HB ILE A 131 -23.237 0.945 -0.201 1.00 53.44 H new ATOM 0 HG12 ILE A 131 -24.179 -0.184 2.165 1.00 75.34 H new ATOM 0 HG13 ILE A 131 -24.199 1.533 2.515 1.00 75.34 H new ATOM 0 HG21 ILE A 131 -22.408 -1.083 0.925 1.00 74.22 H new ATOM 0 HG22 ILE A 131 -21.077 0.012 0.479 1.00 74.22 H new ATOM 0 HG23 ILE A 131 -21.632 -0.072 2.168 1.00 74.22 H new ATOM 0 HD11 ILE A 131 -26.343 0.802 1.593 1.00 41.20 H new ATOM 0 HD12 ILE A 131 -25.546 1.945 0.487 1.00 41.20 H new ATOM 0 HD13 ILE A 131 -25.525 0.201 0.132 1.00 41.20 H new ATOM 2006 N VAL A 132 -19.954 2.540 1.634 1.00 41.23 N ATOM 2007 CA VAL A 132 -18.526 2.538 1.341 1.00 34.34 C ATOM 2008 C VAL A 132 -17.887 1.210 1.733 1.00 0.01 C ATOM 2009 O VAL A 132 -18.280 0.589 2.720 1.00 51.31 O ATOM 2010 CB VAL A 132 -17.801 3.680 2.077 1.00 61.21 C ATOM 2011 CG1 VAL A 132 -18.455 5.017 1.763 1.00 1.22 C ATOM 2012 CG2 VAL A 132 -17.786 3.423 3.576 1.00 73.24 C ATOM 0 H VAL A 132 -20.183 2.700 2.615 1.00 41.23 H new ATOM 0 HA VAL A 132 -18.423 2.685 0.266 1.00 34.34 H new ATOM 0 HB VAL A 132 -16.769 3.717 1.728 1.00 61.21 H new ATOM 0 HG11 VAL A 132 -17.929 5.812 2.292 1.00 1.22 H new ATOM 0 HG12 VAL A 132 -18.408 5.202 0.690 1.00 1.22 H new ATOM 0 HG13 VAL A 132 -19.497 4.996 2.082 1.00 1.22 H new ATOM 0 HG21 VAL A 132 -17.270 4.240 4.080 1.00 73.24 H new ATOM 0 HG22 VAL A 132 -18.810 3.359 3.944 1.00 73.24 H new ATOM 0 HG23 VAL A 132 -17.268 2.486 3.779 1.00 73.24 H new ATOM 2022 N GLN A 133 -16.900 0.781 0.952 1.00 42.41 N ATOM 2023 CA GLN A 133 -16.208 -0.474 1.217 1.00 12.41 C ATOM 2024 C GLN A 133 -15.009 -0.251 2.134 1.00 54.20 C ATOM 2025 O GLN A 133 -14.040 0.408 1.757 1.00 2.20 O ATOM 2026 CB GLN A 133 -15.750 -1.116 -0.094 1.00 71.20 C ATOM 2027 CG GLN A 133 -16.850 -1.880 -0.814 1.00 14.21 C ATOM 2028 CD GLN A 133 -17.756 -0.973 -1.623 1.00 65.31 C ATOM 2029 OE1 GLN A 133 -17.572 -0.811 -2.830 1.00 73.53 O ATOM 2030 NE2 GLN A 133 -18.741 -0.378 -0.962 1.00 12.32 N ATOM 0 H GLN A 133 -16.562 1.284 0.131 1.00 42.41 H new ATOM 0 HA GLN A 133 -16.906 -1.146 1.717 1.00 12.41 H new ATOM 0 HB2 GLN A 133 -15.366 -0.339 -0.755 1.00 71.20 H new ATOM 0 HB3 GLN A 133 -14.923 -1.795 0.113 1.00 71.20 H new ATOM 0 HG2 GLN A 133 -16.400 -2.621 -1.475 1.00 14.21 H new ATOM 0 HG3 GLN A 133 -17.447 -2.425 -0.083 1.00 14.21 H new ATOM 0 HE21 GLN A 133 -18.856 -0.542 0.038 1.00 12.32 H new ATOM 0 HE22 GLN A 133 -19.383 0.243 -1.454 1.00 12.32 H new ATOM 2039 N LYS A 134 -15.081 -0.804 3.340 1.00 12.52 N ATOM 2040 CA LYS A 134 -14.002 -0.667 4.311 1.00 43.01 C ATOM 2041 C LYS A 134 -12.972 -1.778 4.140 1.00 3.21 C ATOM 2042 O LYS A 134 -13.324 -2.928 3.881 1.00 43.24 O ATOM 2043 CB LYS A 134 -14.564 -0.692 5.734 1.00 4.32 C ATOM 2044 CG LYS A 134 -13.494 -0.634 6.811 1.00 31.52 C ATOM 2045 CD LYS A 134 -14.105 -0.606 8.203 1.00 15.52 C ATOM 2046 CE LYS A 134 -14.830 -1.904 8.519 1.00 55.02 C ATOM 2047 NZ LYS A 134 -15.477 -1.865 9.860 1.00 1.44 N1+ ATOM 0 H LYS A 134 -15.876 -1.352 3.669 1.00 12.52 H new ATOM 0 HA LYS A 134 -13.510 0.290 4.138 1.00 43.01 H new ATOM 0 HB2 LYS A 134 -15.243 0.151 5.862 1.00 4.32 H new ATOM 0 HB3 LYS A 134 -15.153 -1.599 5.867 1.00 4.32 H new ATOM 0 HG2 LYS A 134 -12.836 -1.498 6.719 1.00 31.52 H new ATOM 0 HG3 LYS A 134 -12.877 0.253 6.665 1.00 31.52 H new ATOM 0 HD2 LYS A 134 -13.322 -0.436 8.942 1.00 15.52 H new ATOM 0 HD3 LYS A 134 -14.802 0.229 8.279 1.00 15.52 H new ATOM 0 HE2 LYS A 134 -15.586 -2.093 7.756 1.00 55.02 H new ATOM 0 HE3 LYS A 134 -14.124 -2.733 8.480 1.00 55.02 H new ATOM 0 HZ1 LYS A 134 -15.961 -2.768 10.038 1.00 1.44 H new ATOM 0 HZ2 LYS A 134 -14.753 -1.710 10.590 1.00 1.44 H new ATOM 0 HZ3 LYS A 134 -16.170 -1.090 9.889 1.00 1.44 H new ATOM 2061 N ARG A 135 -11.699 -1.427 4.288 1.00 73.21 N ATOM 2062 CA ARG A 135 -10.618 -2.395 4.151 1.00 2.23 C ATOM 2063 C ARG A 135 -10.788 -3.543 5.141 1.00 4.34 C ATOM 2064 O ARG A 135 -11.528 -3.431 6.119 1.00 70.31 O ATOM 2065 CB ARG A 135 -9.265 -1.714 4.368 1.00 24.23 C ATOM 2066 CG ARG A 135 -9.123 -1.065 5.735 1.00 61.24 C ATOM 2067 CD ARG A 135 -7.677 -0.693 6.027 1.00 61.52 C ATOM 2068 NE ARG A 135 -7.507 -0.185 7.386 1.00 65.45 N ATOM 2069 CZ ARG A 135 -7.464 -0.963 8.462 1.00 44.11 C ATOM 2070 NH1 ARG A 135 -7.578 -2.278 8.337 1.00 2.13 N1+ ATOM 2071 NH2 ARG A 135 -7.307 -0.426 9.664 1.00 1.42 N ATOM 0 H ARG A 135 -11.391 -0.479 4.503 1.00 73.21 H new ATOM 0 HA ARG A 135 -10.654 -2.802 3.141 1.00 2.23 H new ATOM 0 HB2 ARG A 135 -8.472 -2.451 4.241 1.00 24.23 H new ATOM 0 HB3 ARG A 135 -9.122 -0.956 3.598 1.00 24.23 H new ATOM 0 HG2 ARG A 135 -9.746 -0.172 5.782 1.00 61.24 H new ATOM 0 HG3 ARG A 135 -9.486 -1.748 6.503 1.00 61.24 H new ATOM 0 HD2 ARG A 135 -7.042 -1.567 5.885 1.00 61.52 H new ATOM 0 HD3 ARG A 135 -7.345 0.062 5.314 1.00 61.52 H new ATOM 0 HE ARG A 135 -7.416 0.823 7.516 1.00 65.45 H new ATOM 0 HH11 ARG A 135 -7.699 -2.694 7.414 1.00 2.13 H new ATOM 0 HH12 ARG A 135 -7.545 -2.874 9.164 1.00 2.13 H new ATOM 0 HH21 ARG A 135 -7.219 0.585 9.763 1.00 1.42 H new ATOM 0 HH22 ARG A 135 -7.274 -1.024 10.489 1.00 1.42 H new ATOM 2085 N LYS A 136 -10.095 -4.648 4.882 1.00 75.34 N ATOM 2086 CA LYS A 136 -10.167 -5.817 5.750 1.00 14.01 C ATOM 2087 C LYS A 136 -8.810 -6.113 6.378 1.00 71.32 C ATOM 2088 O LYS A 136 -7.768 -5.893 5.759 1.00 71.05 O ATOM 2089 CB LYS A 136 -10.653 -7.034 4.960 1.00 52.34 C ATOM 2090 CG LYS A 136 -9.983 -7.187 3.606 1.00 44.13 C ATOM 2091 CD LYS A 136 -10.109 -8.607 3.077 1.00 43.40 C ATOM 2092 CE LYS A 136 -9.577 -8.722 1.658 1.00 63.11 C ATOM 2093 NZ LYS A 136 -9.113 -10.103 1.350 1.00 55.42 N1+ ATOM 0 H LYS A 136 -9.477 -4.758 4.078 1.00 75.34 H new ATOM 0 HA LYS A 136 -10.877 -5.603 6.549 1.00 14.01 H new ATOM 0 HB2 LYS A 136 -10.474 -7.934 5.548 1.00 52.34 H new ATOM 0 HB3 LYS A 136 -11.731 -6.957 4.816 1.00 52.34 H new ATOM 0 HG2 LYS A 136 -10.432 -6.492 2.896 1.00 44.13 H new ATOM 0 HG3 LYS A 136 -8.929 -6.921 3.689 1.00 44.13 H new ATOM 0 HD2 LYS A 136 -9.562 -9.289 3.728 1.00 43.40 H new ATOM 0 HD3 LYS A 136 -11.155 -8.914 3.101 1.00 43.40 H new ATOM 0 HE2 LYS A 136 -10.358 -8.435 0.953 1.00 63.11 H new ATOM 0 HE3 LYS A 136 -8.752 -8.023 1.522 1.00 63.11 H new ATOM 0 HZ1 LYS A 136 -8.758 -10.140 0.373 1.00 55.42 H new ATOM 0 HZ2 LYS A 136 -8.351 -10.368 2.006 1.00 55.42 H new ATOM 0 HZ3 LYS A 136 -9.906 -10.767 1.455 1.00 55.42 H new ATOM 2107 N ILE A 137 -8.828 -6.615 7.608 1.00 30.52 N ATOM 2108 CA ILE A 137 -7.598 -6.944 8.317 1.00 4.50 C ATOM 2109 C ILE A 137 -6.691 -7.827 7.466 1.00 42.20 C ATOM 2110 O ILE A 137 -7.164 -8.581 6.616 1.00 34.34 O ATOM 2111 CB ILE A 137 -7.889 -7.659 9.649 1.00 24.31 C ATOM 2112 CG1 ILE A 137 -8.731 -8.914 9.405 1.00 34.43 C ATOM 2113 CG2 ILE A 137 -8.598 -6.719 10.612 1.00 52.43 C ATOM 2114 CD1 ILE A 137 -7.907 -10.142 9.085 1.00 4.14 C ATOM 0 H ILE A 137 -9.681 -6.803 8.134 1.00 30.52 H new ATOM 0 HA ILE A 137 -7.092 -6.001 8.524 1.00 4.50 H new ATOM 0 HB ILE A 137 -6.942 -7.960 10.097 1.00 24.31 H new ATOM 0 HG12 ILE A 137 -9.336 -9.113 10.289 1.00 34.43 H new ATOM 0 HG13 ILE A 137 -9.421 -8.725 8.582 1.00 34.43 H new ATOM 0 HG21 ILE A 137 -8.797 -7.240 11.549 1.00 52.43 H new ATOM 0 HG22 ILE A 137 -7.966 -5.852 10.806 1.00 52.43 H new ATOM 0 HG23 ILE A 137 -9.540 -6.391 10.173 1.00 52.43 H new ATOM 0 HD11 ILE A 137 -8.569 -10.993 8.924 1.00 4.14 H new ATOM 0 HD12 ILE A 137 -7.321 -9.962 8.183 1.00 4.14 H new ATOM 0 HD13 ILE A 137 -7.236 -10.357 9.917 1.00 4.14 H new ATOM 2126 N SER A 138 -5.387 -7.728 7.702 1.00 33.30 N ATOM 2127 CA SER A 138 -4.414 -8.517 6.955 1.00 12.12 C ATOM 2128 C SER A 138 -4.668 -10.009 7.139 1.00 23.35 C ATOM 2129 O SER A 138 -4.796 -10.494 8.264 1.00 14.03 O ATOM 2130 CB SER A 138 -2.993 -8.170 7.406 1.00 33.30 C ATOM 2131 OG SER A 138 -2.046 -8.502 6.404 1.00 33.15 O ATOM 0 H SER A 138 -4.980 -7.110 8.404 1.00 33.30 H new ATOM 0 HA SER A 138 -4.522 -8.276 5.897 1.00 12.12 H new ATOM 0 HB2 SER A 138 -2.929 -7.106 7.633 1.00 33.30 H new ATOM 0 HB3 SER A 138 -2.758 -8.707 8.325 1.00 33.30 H new ATOM 0 HG SER A 138 -1.146 -8.270 6.715 1.00 33.15 H new ATOM 2137 N GLU A 139 -4.741 -10.733 6.026 1.00 73.41 N ATOM 2138 CA GLU A 139 -4.981 -12.170 6.064 1.00 32.15 C ATOM 2139 C GLU A 139 -3.703 -12.927 6.416 1.00 5.54 C ATOM 2140 O GLU A 139 -3.743 -13.959 7.085 1.00 63.51 O ATOM 2141 CB GLU A 139 -5.519 -12.656 4.717 1.00 31.35 C ATOM 2142 CG GLU A 139 -6.968 -12.275 4.467 1.00 73.33 C ATOM 2143 CD GLU A 139 -7.934 -13.053 5.341 1.00 40.35 C ATOM 2144 OE1 GLU A 139 -8.045 -12.725 6.540 1.00 55.44 O ATOM 2145 OE2 GLU A 139 -8.580 -13.989 4.824 1.00 25.42 O1- ATOM 0 H GLU A 139 -4.637 -10.347 5.087 1.00 73.41 H new ATOM 0 HA GLU A 139 -5.724 -12.367 6.837 1.00 32.15 H new ATOM 0 HB2 GLU A 139 -4.901 -12.245 3.919 1.00 31.35 H new ATOM 0 HB3 GLU A 139 -5.424 -13.741 4.667 1.00 31.35 H new ATOM 0 HG2 GLU A 139 -7.096 -11.208 4.650 1.00 73.33 H new ATOM 0 HG3 GLU A 139 -7.210 -12.450 3.419 1.00 73.33 H new ATOM 2152 N GLY A 140 -2.568 -12.404 5.960 1.00 65.11 N ATOM 2153 CA GLY A 140 -1.294 -13.041 6.236 1.00 41.24 C ATOM 2154 C GLY A 140 -0.732 -13.760 5.026 1.00 43.02 C ATOM 2155 O GLY A 140 0.467 -14.031 4.957 1.00 23.34 O ATOM 0 H GLY A 140 -2.509 -11.551 5.404 1.00 65.11 H new ATOM 0 HA2 GLY A 140 -0.580 -12.289 6.572 1.00 41.24 H new ATOM 0 HA3 GLY A 140 -1.416 -13.752 7.053 1.00 41.24 H new ATOM 2159 N ASP A 141 -1.599 -14.071 4.069 1.00 63.32 N ATOM 2160 CA ASP A 141 -1.183 -14.764 2.856 1.00 33.42 C ATOM 2161 C ASP A 141 -0.603 -16.136 3.184 1.00 14.14 C ATOM 2162 O ASP A 141 0.555 -16.422 2.875 1.00 20.30 O ATOM 2163 CB ASP A 141 -0.150 -13.929 2.095 1.00 74.13 C ATOM 2164 CG ASP A 141 -0.164 -14.209 0.606 1.00 34.21 C ATOM 2165 OD1 ASP A 141 -1.093 -13.732 -0.078 1.00 41.30 O ATOM 2166 OD2 ASP A 141 0.755 -14.905 0.123 1.00 23.22 O1- ATOM 0 H ASP A 141 -2.595 -13.854 4.110 1.00 63.32 H new ATOM 0 HA ASP A 141 -2.063 -14.903 2.227 1.00 33.42 H new ATOM 0 HB2 ASP A 141 -0.346 -12.870 2.265 1.00 74.13 H new ATOM 0 HB3 ASP A 141 0.844 -14.136 2.492 1.00 74.13 H new TER 2171 ASP A 141