USER MOD reduce.3.24.130724 H: found=0, std=0, add=1087, rem=0, adj=15 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 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 SER OG : rot 180:sc= 0.087 USER MOD Single : A 9 HIS : no HD1:sc= -0.283 X(o=-0.28,f=-0.048) USER MOD Single : A 13 TYR OH : rot 30:sc= -0.353 USER MOD Single : A 15 SER OG : rot 74:sc= 1.01 USER MOD Single : A 20 THR OG1 : rot 180:sc= -0.271 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.162 USER MOD Single : A 33 ASN : amide:sc= -0.134 X(o=-0.13,f=-0.13) USER MOD Single : A 41 ASN : amide:sc= -0.395 X(o=-0.39,f=-0.15) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 LYS NZ :NH3+ 136:sc= -0.748 (180deg=-1.5) USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.0201 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0.0454 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 80 HIS : no HD1:sc= 0 X(o=0,f=-0.033) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 THR OG1 : rot -32:sc= 0.013 USER MOD Single : A 94 SER OG : rot 70:sc= -0.898! USER MOD Single : A 99 HIS : no HD1:sc= -0.45 X(o=-0.45,f=-0.74) 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= -1.1 K(o=-1.1,f=-2.1!) USER MOD Single : A 124 ASN : amide:sc= -0.24 K(o=-0.24,f=-3!) USER MOD Single : A 125 GLN : amide:sc= -2.77 K(o=-2.8,f=-5.5!) USER MOD Single : A 130 TYR OH : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -1.96 K(o=-2,f=-5.4!) 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 -16.237 -12.511 0.914 1.00 63.21 N ATOM 2 CA ASP A 3 -15.449 -11.305 1.138 1.00 1.10 C ATOM 3 C ASP A 3 -14.802 -10.830 -0.159 1.00 54.11 C ATOM 4 O ASP A 3 -14.813 -11.538 -1.166 1.00 24.32 O ATOM 5 CB ASP A 3 -14.374 -11.560 2.195 1.00 23.13 C ATOM 6 CG ASP A 3 -13.172 -12.294 1.634 1.00 5.44 C ATOM 7 OD1 ASP A 3 -13.348 -13.426 1.136 1.00 40.21 O ATOM 8 OD2 ASP A 3 -12.056 -11.737 1.692 1.00 10.33 O1- ATOM 0 HA ASP A 3 -16.120 -10.524 1.496 1.00 1.10 H new ATOM 0 HB2 ASP A 3 -14.050 -10.608 2.617 1.00 23.13 H new ATOM 0 HB3 ASP A 3 -14.802 -12.141 3.012 1.00 23.13 H new ATOM 13 N VAL A 4 -14.238 -9.627 -0.128 1.00 1.21 N ATOM 14 CA VAL A 4 -13.585 -9.057 -1.301 1.00 45.01 C ATOM 15 C VAL A 4 -12.300 -8.331 -0.917 1.00 4.33 C ATOM 16 O VAL A 4 -12.209 -7.735 0.157 1.00 12.14 O ATOM 17 CB VAL A 4 -14.514 -8.075 -2.039 1.00 11.04 C ATOM 18 CG1 VAL A 4 -14.916 -6.929 -1.123 1.00 11.12 C ATOM 19 CG2 VAL A 4 -13.843 -7.551 -3.299 1.00 24.21 C ATOM 0 H VAL A 4 -14.220 -9.028 0.697 1.00 1.21 H new ATOM 0 HA VAL A 4 -13.345 -9.888 -1.964 1.00 45.01 H new ATOM 0 HB VAL A 4 -15.418 -8.609 -2.332 1.00 11.04 H new ATOM 0 HG11 VAL A 4 -15.572 -6.246 -1.662 1.00 11.12 H new ATOM 0 HG12 VAL A 4 -15.440 -7.325 -0.253 1.00 11.12 H new ATOM 0 HG13 VAL A 4 -14.024 -6.394 -0.797 1.00 11.12 H new ATOM 0 HG21 VAL A 4 -14.514 -6.859 -3.808 1.00 24.21 H new ATOM 0 HG22 VAL A 4 -12.922 -7.033 -3.032 1.00 24.21 H new ATOM 0 HG23 VAL A 4 -13.612 -8.385 -3.962 1.00 24.21 H new ATOM 29 N TYR A 5 -11.310 -8.387 -1.800 1.00 14.41 N ATOM 30 CA TYR A 5 -10.029 -7.738 -1.553 1.00 14.11 C ATOM 31 C TYR A 5 -9.672 -6.786 -2.692 1.00 34.31 C ATOM 32 O TYR A 5 -8.891 -7.128 -3.581 1.00 3.50 O ATOM 33 CB TYR A 5 -8.926 -8.784 -1.384 1.00 22.13 C ATOM 34 CG TYR A 5 -9.045 -9.949 -2.340 1.00 23.14 C ATOM 35 CD1 TYR A 5 -9.853 -11.039 -2.040 1.00 4.24 C ATOM 36 CD2 TYR A 5 -8.352 -9.960 -3.544 1.00 11.34 C ATOM 37 CE1 TYR A 5 -9.965 -12.107 -2.910 1.00 42.42 C ATOM 38 CE2 TYR A 5 -8.459 -11.021 -4.421 1.00 71.45 C ATOM 39 CZ TYR A 5 -9.265 -12.093 -4.099 1.00 3.24 C ATOM 40 OH TYR A 5 -9.375 -13.153 -4.970 1.00 3.20 O ATOM 0 H TYR A 5 -11.370 -8.875 -2.693 1.00 14.41 H new ATOM 0 HA TYR A 5 -10.116 -7.160 -0.633 1.00 14.11 H new ATOM 0 HB2 TYR A 5 -7.957 -8.305 -1.527 1.00 22.13 H new ATOM 0 HB3 TYR A 5 -8.947 -9.160 -0.361 1.00 22.13 H new ATOM 0 HD1 TYR A 5 -10.403 -11.052 -1.111 1.00 4.24 H new ATOM 0 HD2 TYR A 5 -7.718 -9.123 -3.799 1.00 11.34 H new ATOM 0 HE1 TYR A 5 -10.596 -12.947 -2.661 1.00 42.42 H new ATOM 0 HE2 TYR A 5 -7.915 -11.012 -5.354 1.00 71.45 H new ATOM 0 HH TYR A 5 -8.820 -12.986 -5.760 1.00 3.20 H new ATOM 50 N THR A 6 -10.249 -5.589 -2.657 1.00 71.00 N ATOM 51 CA THR A 6 -9.994 -4.588 -3.685 1.00 14.31 C ATOM 52 C THR A 6 -9.890 -3.192 -3.079 1.00 73.50 C ATOM 53 O THR A 6 -9.983 -3.025 -1.864 1.00 43.33 O ATOM 54 CB THR A 6 -11.100 -4.589 -4.757 1.00 51.52 C ATOM 55 OG1 THR A 6 -12.387 -4.534 -4.132 1.00 70.22 O ATOM 56 CG2 THR A 6 -11.007 -5.830 -5.630 1.00 71.11 C ATOM 0 H THR A 6 -10.896 -5.289 -1.928 1.00 71.00 H new ATOM 0 HA THR A 6 -9.045 -4.850 -4.153 1.00 14.31 H new ATOM 0 HB THR A 6 -10.965 -3.710 -5.388 1.00 51.52 H new ATOM 0 HG1 THR A 6 -13.085 -4.533 -4.820 1.00 70.22 H new ATOM 0 HG21 THR A 6 -11.798 -5.808 -6.379 1.00 71.11 H new ATOM 0 HG22 THR A 6 -10.037 -5.853 -6.127 1.00 71.11 H new ATOM 0 HG23 THR A 6 -11.119 -6.720 -5.010 1.00 71.11 H new ATOM 64 N SER A 7 -9.697 -2.194 -3.935 1.00 24.13 N ATOM 65 CA SER A 7 -9.577 -0.813 -3.483 1.00 4.43 C ATOM 66 C SER A 7 -10.913 -0.296 -2.956 1.00 34.24 C ATOM 67 O SER A 7 -11.878 -1.050 -2.831 1.00 13.42 O ATOM 68 CB SER A 7 -9.086 0.079 -4.625 1.00 10.54 C ATOM 69 OG SER A 7 -8.614 -0.698 -5.712 1.00 74.54 O ATOM 0 H SER A 7 -9.620 -2.316 -4.945 1.00 24.13 H new ATOM 0 HA SER A 7 -8.850 -0.784 -2.671 1.00 4.43 H new ATOM 0 HB2 SER A 7 -9.897 0.725 -4.961 1.00 10.54 H new ATOM 0 HB3 SER A 7 -8.289 0.730 -4.266 1.00 10.54 H new ATOM 0 HG SER A 7 -8.308 -0.105 -6.429 1.00 74.54 H new ATOM 75 N ILE A 8 -10.960 0.996 -2.648 1.00 55.43 N ATOM 76 CA ILE A 8 -12.176 1.615 -2.137 1.00 25.01 C ATOM 77 C ILE A 8 -13.229 1.746 -3.231 1.00 21.43 C ATOM 78 O ILE A 8 -12.905 1.773 -4.419 1.00 13.54 O ATOM 79 CB ILE A 8 -11.892 3.008 -1.544 1.00 54.34 C ATOM 80 CG1 ILE A 8 -10.605 2.982 -0.718 1.00 4.33 C ATOM 81 CG2 ILE A 8 -13.065 3.470 -0.693 1.00 52.02 C ATOM 82 CD1 ILE A 8 -10.534 1.826 0.255 1.00 12.02 C ATOM 0 H ILE A 8 -10.170 1.634 -2.744 1.00 55.43 H new ATOM 0 HA ILE A 8 -12.554 0.963 -1.349 1.00 25.01 H new ATOM 0 HB ILE A 8 -11.761 3.716 -2.363 1.00 54.34 H new ATOM 0 HG12 ILE A 8 -9.751 2.931 -1.393 1.00 4.33 H new ATOM 0 HG13 ILE A 8 -10.519 3.917 -0.165 1.00 4.33 H new ATOM 0 HG21 ILE A 8 -12.850 4.456 -0.281 1.00 52.02 H new ATOM 0 HG22 ILE A 8 -13.963 3.523 -1.309 1.00 52.02 H new ATOM 0 HG23 ILE A 8 -13.224 2.763 0.121 1.00 52.02 H new ATOM 0 HD11 ILE A 8 -9.595 1.871 0.806 1.00 12.02 H new ATOM 0 HD12 ILE A 8 -11.368 1.887 0.954 1.00 12.02 H new ATOM 0 HD13 ILE A 8 -10.588 0.885 -0.293 1.00 12.02 H new ATOM 94 N HIS A 9 -14.492 1.826 -2.824 1.00 22.41 N ATOM 95 CA HIS A 9 -15.594 1.957 -3.770 1.00 40.14 C ATOM 96 C HIS A 9 -16.790 2.644 -3.119 1.00 0.44 C ATOM 97 O HIS A 9 -16.911 2.671 -1.894 1.00 31.34 O ATOM 98 CB HIS A 9 -16.006 0.582 -4.298 1.00 13.31 C ATOM 99 CG HIS A 9 -15.309 0.194 -5.566 1.00 14.24 C ATOM 100 ND1 HIS A 9 -14.955 -1.106 -5.862 1.00 60.14 N ATOM 101 CD2 HIS A 9 -14.901 0.942 -6.617 1.00 65.44 C ATOM 102 CE1 HIS A 9 -14.358 -1.140 -7.040 1.00 42.51 C ATOM 103 NE2 HIS A 9 -14.314 0.090 -7.519 1.00 14.34 N ATOM 0 H HIS A 9 -14.777 1.802 -1.845 1.00 22.41 H new ATOM 0 HA HIS A 9 -15.254 2.572 -4.604 1.00 40.14 H new ATOM 0 HB2 HIS A 9 -15.799 -0.168 -3.535 1.00 13.31 H new ATOM 0 HB3 HIS A 9 -17.083 0.575 -4.468 1.00 13.31 H new ATOM 0 HD2 HIS A 9 -15.016 2.010 -6.726 1.00 65.44 H new ATOM 0 HE1 HIS A 9 -13.972 -2.023 -7.528 1.00 42.51 H new ATOM 0 HE2 HIS A 9 -13.909 0.363 -8.415 1.00 14.34 H new ATOM 111 N ILE A 10 -17.671 3.198 -3.947 1.00 62.41 N ATOM 112 CA ILE A 10 -18.857 3.885 -3.451 1.00 5.23 C ATOM 113 C ILE A 10 -20.125 3.310 -4.073 1.00 41.15 C ATOM 114 O ILE A 10 -20.305 3.353 -5.290 1.00 13.04 O ATOM 115 CB ILE A 10 -18.795 5.396 -3.741 1.00 51.44 C ATOM 116 CG1 ILE A 10 -17.595 6.026 -3.030 1.00 72.52 C ATOM 117 CG2 ILE A 10 -20.087 6.072 -3.310 1.00 54.40 C ATOM 118 CD1 ILE A 10 -17.690 5.971 -1.522 1.00 33.02 C ATOM 0 H ILE A 10 -17.585 3.184 -4.963 1.00 62.41 H new ATOM 0 HA ILE A 10 -18.883 3.732 -2.372 1.00 5.23 H new ATOM 0 HB ILE A 10 -18.674 5.539 -4.815 1.00 51.44 H new ATOM 0 HG12 ILE A 10 -16.686 5.516 -3.348 1.00 72.52 H new ATOM 0 HG13 ILE A 10 -17.503 7.066 -3.343 1.00 72.52 H new ATOM 0 HG21 ILE A 10 -20.027 7.140 -3.522 1.00 54.40 H new ATOM 0 HG22 ILE A 10 -20.924 5.640 -3.858 1.00 54.40 H new ATOM 0 HG23 ILE A 10 -20.237 5.922 -2.241 1.00 54.40 H new ATOM 0 HD11 ILE A 10 -16.806 6.435 -1.085 1.00 33.02 H new ATOM 0 HD12 ILE A 10 -18.581 6.506 -1.194 1.00 33.02 H new ATOM 0 HD13 ILE A 10 -17.751 4.932 -1.199 1.00 33.02 H new ATOM 130 N GLU A 11 -21.001 2.775 -3.229 1.00 14.33 N ATOM 131 CA GLU A 11 -22.254 2.193 -3.697 1.00 21.25 C ATOM 132 C GLU A 11 -23.318 3.270 -3.885 1.00 42.40 C ATOM 133 O GLU A 11 -23.215 4.362 -3.326 1.00 51.11 O ATOM 134 CB GLU A 11 -22.751 1.137 -2.709 1.00 50.43 C ATOM 135 CG GLU A 11 -23.012 -0.219 -3.346 1.00 44.11 C ATOM 136 CD GLU A 11 -21.825 -0.729 -4.139 1.00 11.42 C ATOM 137 OE1 GLU A 11 -20.915 -1.324 -3.525 1.00 55.02 O ATOM 138 OE2 GLU A 11 -21.805 -0.533 -5.372 1.00 31.51 O1- ATOM 0 H GLU A 11 -20.867 2.732 -2.219 1.00 14.33 H new ATOM 0 HA GLU A 11 -22.067 1.720 -4.661 1.00 21.25 H new ATOM 0 HB2 GLU A 11 -22.014 1.020 -1.914 1.00 50.43 H new ATOM 0 HB3 GLU A 11 -23.670 1.492 -2.242 1.00 50.43 H new ATOM 0 HG2 GLU A 11 -23.261 -0.940 -2.567 1.00 44.11 H new ATOM 0 HG3 GLU A 11 -23.879 -0.147 -4.003 1.00 44.11 H new ATOM 145 N GLU A 12 -24.337 2.955 -4.677 1.00 22.22 N ATOM 146 CA GLU A 12 -25.420 3.896 -4.940 1.00 35.34 C ATOM 147 C GLU A 12 -26.764 3.176 -5.007 1.00 30.44 C ATOM 148 O GLU A 12 -27.020 2.403 -5.931 1.00 41.32 O ATOM 149 CB GLU A 12 -25.165 4.648 -6.248 1.00 64.20 C ATOM 150 CG GLU A 12 -23.744 5.167 -6.386 1.00 75.35 C ATOM 151 CD GLU A 12 -23.537 5.974 -7.652 1.00 25.02 C ATOM 152 OE1 GLU A 12 -24.268 6.969 -7.847 1.00 51.50 O ATOM 153 OE2 GLU A 12 -22.647 5.612 -8.449 1.00 22.11 O1- ATOM 0 H GLU A 12 -24.436 2.056 -5.148 1.00 22.22 H new ATOM 0 HA GLU A 12 -25.453 4.611 -4.118 1.00 35.34 H new ATOM 0 HB2 GLU A 12 -25.384 3.986 -7.086 1.00 64.20 H new ATOM 0 HB3 GLU A 12 -25.857 5.487 -6.315 1.00 64.20 H new ATOM 0 HG2 GLU A 12 -23.502 5.786 -5.522 1.00 75.35 H new ATOM 0 HG3 GLU A 12 -23.052 4.325 -6.379 1.00 75.35 H new ATOM 160 N TYR A 13 -27.616 3.435 -4.023 1.00 22.50 N ATOM 161 CA TYR A 13 -28.933 2.809 -3.967 1.00 61.54 C ATOM 162 C TYR A 13 -30.036 3.846 -4.157 1.00 2.15 C ATOM 163 O TYR A 13 -29.925 4.978 -3.689 1.00 12.31 O ATOM 164 CB TYR A 13 -29.121 2.086 -2.633 1.00 3.33 C ATOM 165 CG TYR A 13 -28.380 0.770 -2.548 1.00 52.40 C ATOM 166 CD1 TYR A 13 -27.018 0.734 -2.272 1.00 2.40 C ATOM 167 CD2 TYR A 13 -29.041 -0.436 -2.743 1.00 44.14 C ATOM 168 CE1 TYR A 13 -26.336 -0.465 -2.195 1.00 40.42 C ATOM 169 CE2 TYR A 13 -28.367 -1.640 -2.665 1.00 2.10 C ATOM 170 CZ TYR A 13 -27.016 -1.649 -2.391 1.00 52.02 C ATOM 171 OH TYR A 13 -26.342 -2.846 -2.314 1.00 41.41 O ATOM 0 H TYR A 13 -27.420 4.074 -3.253 1.00 22.50 H new ATOM 0 HA TYR A 13 -28.998 2.083 -4.777 1.00 61.54 H new ATOM 0 HB2 TYR A 13 -28.783 2.736 -1.826 1.00 3.33 H new ATOM 0 HB3 TYR A 13 -30.184 1.906 -2.474 1.00 3.33 H new ATOM 0 HD1 TYR A 13 -26.484 1.659 -2.115 1.00 2.40 H new ATOM 0 HD2 TYR A 13 -30.099 -0.433 -2.959 1.00 44.14 H new ATOM 0 HE1 TYR A 13 -25.277 -0.475 -1.983 1.00 40.42 H new ATOM 0 HE2 TYR A 13 -28.896 -2.569 -2.818 1.00 2.10 H new ATOM 0 HH TYR A 13 -25.593 -2.760 -1.688 1.00 41.41 H new ATOM 181 N GLU A 14 -31.100 3.447 -4.846 1.00 51.13 N ATOM 182 CA GLU A 14 -32.225 4.341 -5.098 1.00 44.05 C ATOM 183 C GLU A 14 -33.490 3.828 -4.417 1.00 34.43 C ATOM 184 O GLU A 14 -33.684 2.622 -4.270 1.00 43.23 O ATOM 185 CB GLU A 14 -32.464 4.483 -6.603 1.00 41.01 C ATOM 186 CG GLU A 14 -32.839 5.893 -7.028 1.00 63.43 C ATOM 187 CD GLU A 14 -32.718 6.103 -8.524 1.00 53.14 C ATOM 188 OE1 GLU A 14 -32.827 5.109 -9.273 1.00 2.11 O ATOM 189 OE2 GLU A 14 -32.514 7.260 -8.948 1.00 40.11 O1- ATOM 0 H GLU A 14 -31.207 2.512 -5.239 1.00 51.13 H new ATOM 0 HA GLU A 14 -31.980 5.318 -4.682 1.00 44.05 H new ATOM 0 HB2 GLU A 14 -31.563 4.179 -7.136 1.00 41.01 H new ATOM 0 HB3 GLU A 14 -33.258 3.799 -6.903 1.00 41.01 H new ATOM 0 HG2 GLU A 14 -33.863 6.102 -6.717 1.00 63.43 H new ATOM 0 HG3 GLU A 14 -32.197 6.607 -6.512 1.00 63.43 H new ATOM 196 N SER A 15 -34.349 4.754 -4.002 1.00 45.22 N ATOM 197 CA SER A 15 -35.594 4.398 -3.333 1.00 21.12 C ATOM 198 C SER A 15 -36.597 5.545 -3.403 1.00 40.40 C ATOM 199 O SER A 15 -36.436 6.565 -2.732 1.00 61.11 O ATOM 200 CB SER A 15 -35.326 4.028 -1.873 1.00 50.55 C ATOM 201 OG SER A 15 -33.937 4.043 -1.591 1.00 60.35 O ATOM 0 H SER A 15 -34.205 5.757 -4.118 1.00 45.22 H new ATOM 0 HA SER A 15 -36.019 3.536 -3.847 1.00 21.12 H new ATOM 0 HB2 SER A 15 -35.841 4.729 -1.216 1.00 50.55 H new ATOM 0 HB3 SER A 15 -35.732 3.038 -1.665 1.00 50.55 H new ATOM 0 HG SER A 15 -33.623 4.970 -1.544 1.00 60.35 H new ATOM 207 N GLU A 16 -37.631 5.371 -4.219 1.00 11.34 N ATOM 208 CA GLU A 16 -38.659 6.392 -4.377 1.00 40.23 C ATOM 209 C GLU A 16 -40.053 5.791 -4.216 1.00 3.23 C ATOM 210 O GLU A 16 -40.350 4.731 -4.766 1.00 64.35 O ATOM 211 CB GLU A 16 -38.537 7.064 -5.748 1.00 4.30 C ATOM 212 CG GLU A 16 -39.070 6.216 -6.890 1.00 43.20 C ATOM 213 CD GLU A 16 -38.403 6.535 -8.214 1.00 63.23 C ATOM 214 OE1 GLU A 16 -37.633 7.516 -8.269 1.00 62.45 O ATOM 215 OE2 GLU A 16 -38.654 5.804 -9.196 1.00 71.20 O1- ATOM 0 H GLU A 16 -37.779 4.533 -4.781 1.00 11.34 H new ATOM 0 HA GLU A 16 -38.513 7.141 -3.599 1.00 40.23 H new ATOM 0 HB2 GLU A 16 -39.075 8.012 -5.728 1.00 4.30 H new ATOM 0 HB3 GLU A 16 -37.489 7.297 -5.937 1.00 4.30 H new ATOM 0 HG2 GLU A 16 -38.919 5.162 -6.656 1.00 43.20 H new ATOM 0 HG3 GLU A 16 -40.145 6.371 -6.982 1.00 43.20 H new ATOM 222 N ALA A 17 -40.903 6.477 -3.459 1.00 45.31 N ATOM 223 CA ALA A 17 -42.265 6.012 -3.226 1.00 31.31 C ATOM 224 C ALA A 17 -43.148 6.269 -4.442 1.00 53.14 C ATOM 225 O ALA A 17 -43.655 7.376 -4.630 1.00 52.54 O ATOM 226 CB ALA A 17 -42.850 6.689 -1.995 1.00 33.40 C ATOM 0 H ALA A 17 -40.673 7.357 -2.997 1.00 45.31 H new ATOM 0 HA ALA A 17 -42.231 4.936 -3.055 1.00 31.31 H new ATOM 0 HB1 ALA A 17 -43.867 6.333 -1.833 1.00 33.40 H new ATOM 0 HB2 ALA A 17 -42.239 6.451 -1.124 1.00 33.40 H new ATOM 0 HB3 ALA A 17 -42.863 7.769 -2.145 1.00 33.40 H new ATOM 232 N ARG A 18 -43.327 5.242 -5.266 1.00 33.11 N ATOM 233 CA ARG A 18 -44.148 5.358 -6.465 1.00 74.51 C ATOM 234 C ARG A 18 -45.626 5.174 -6.133 1.00 1.22 C ATOM 235 O ARG A 18 -45.986 4.344 -5.298 1.00 0.43 O ATOM 236 CB ARG A 18 -43.717 4.324 -7.506 1.00 24.01 C ATOM 237 CG ARG A 18 -42.246 4.414 -7.881 1.00 71.34 C ATOM 238 CD ARG A 18 -41.971 3.751 -9.222 1.00 21.32 C ATOM 239 NE ARG A 18 -42.132 4.681 -10.336 1.00 34.15 N ATOM 240 CZ ARG A 18 -41.618 4.477 -11.543 1.00 3.12 C ATOM 241 NH1 ARG A 18 -40.913 3.382 -11.791 1.00 25.32 N1+ ATOM 242 NH2 ARG A 18 -41.807 5.371 -12.506 1.00 33.24 N ATOM 0 H ARG A 18 -42.914 4.320 -5.125 1.00 33.11 H new ATOM 0 HA ARG A 18 -44.007 6.358 -6.875 1.00 74.51 H new ATOM 0 HB2 ARG A 18 -43.925 3.325 -7.122 1.00 24.01 H new ATOM 0 HB3 ARG A 18 -44.321 4.452 -8.404 1.00 24.01 H new ATOM 0 HG2 ARG A 18 -41.943 5.460 -7.922 1.00 71.34 H new ATOM 0 HG3 ARG A 18 -41.643 3.938 -7.108 1.00 71.34 H new ATOM 0 HD2 ARG A 18 -40.957 3.351 -9.227 1.00 21.32 H new ATOM 0 HD3 ARG A 18 -42.647 2.907 -9.354 1.00 21.32 H new ATOM 0 HE ARG A 18 -42.669 5.534 -10.178 1.00 34.15 H new ATOM 0 HH11 ARG A 18 -40.764 2.693 -11.053 1.00 25.32 H new ATOM 0 HH12 ARG A 18 -40.519 3.228 -12.719 1.00 25.32 H new ATOM 0 HH21 ARG A 18 -42.347 6.216 -12.319 1.00 33.24 H new ATOM 0 HH22 ARG A 18 -41.412 5.213 -13.433 1.00 33.24 H new ATOM 256 N ASP A 19 -46.476 5.955 -6.790 1.00 32.20 N ATOM 257 CA ASP A 19 -47.915 5.879 -6.565 1.00 41.34 C ATOM 258 C ASP A 19 -48.479 4.565 -7.097 1.00 44.41 C ATOM 259 O ASP A 19 -48.196 4.167 -8.228 1.00 5.35 O ATOM 260 CB ASP A 19 -48.621 7.059 -7.233 1.00 22.55 C ATOM 261 CG ASP A 19 -48.561 6.987 -8.747 1.00 73.34 C ATOM 262 OD1 ASP A 19 -47.472 6.698 -9.285 1.00 3.01 O ATOM 263 OD2 ASP A 19 -49.605 7.218 -9.393 1.00 24.34 O1- ATOM 0 H ASP A 19 -46.194 6.648 -7.483 1.00 32.20 H new ATOM 0 HA ASP A 19 -48.092 5.922 -5.490 1.00 41.34 H new ATOM 0 HB2 ASP A 19 -49.663 7.083 -6.914 1.00 22.55 H new ATOM 0 HB3 ASP A 19 -48.163 7.990 -6.898 1.00 22.55 H new ATOM 268 N THR A 20 -49.278 3.892 -6.274 1.00 61.12 N ATOM 269 CA THR A 20 -49.880 2.623 -6.659 1.00 12.12 C ATOM 270 C THR A 20 -51.143 2.841 -7.483 1.00 54.32 C ATOM 271 O THR A 20 -51.660 3.956 -7.563 1.00 54.42 O ATOM 272 CB THR A 20 -50.227 1.768 -5.427 1.00 40.23 C ATOM 273 OG1 THR A 20 -50.733 0.493 -5.840 1.00 70.42 O ATOM 274 CG2 THR A 20 -51.256 2.469 -4.554 1.00 72.02 C ATOM 0 H THR A 20 -49.523 4.206 -5.335 1.00 61.12 H new ATOM 0 HA THR A 20 -49.142 2.095 -7.262 1.00 12.12 H new ATOM 0 HB THR A 20 -49.317 1.625 -4.845 1.00 40.23 H new ATOM 0 HG1 THR A 20 -50.949 -0.045 -5.050 1.00 70.42 H new ATOM 0 HG21 THR A 20 -51.485 1.846 -3.690 1.00 72.02 H new ATOM 0 HG22 THR A 20 -50.856 3.425 -4.216 1.00 72.02 H new ATOM 0 HG23 THR A 20 -52.166 2.640 -5.130 1.00 72.02 H new ATOM 282 N LYS A 21 -51.637 1.770 -8.095 1.00 3.44 N ATOM 283 CA LYS A 21 -52.842 1.843 -8.914 1.00 22.44 C ATOM 284 C LYS A 21 -54.089 1.598 -8.068 1.00 14.33 C ATOM 285 O LYS A 21 -55.199 1.504 -8.594 1.00 74.45 O ATOM 286 CB LYS A 21 -52.775 0.822 -10.051 1.00 24.43 C ATOM 287 CG LYS A 21 -52.680 -0.616 -9.572 1.00 51.34 C ATOM 288 CD LYS A 21 -54.040 -1.294 -9.567 1.00 33.02 C ATOM 289 CE LYS A 21 -54.556 -1.498 -8.150 1.00 63.52 C ATOM 290 NZ LYS A 21 -55.250 -2.807 -7.997 1.00 64.01 N1+ ATOM 0 H LYS A 21 -51.221 0.840 -8.039 1.00 3.44 H new ATOM 0 HA LYS A 21 -52.903 2.845 -9.339 1.00 22.44 H new ATOM 0 HB2 LYS A 21 -53.660 0.930 -10.677 1.00 24.43 H new ATOM 0 HB3 LYS A 21 -51.912 1.045 -10.678 1.00 24.43 H new ATOM 0 HG2 LYS A 21 -51.998 -1.171 -10.217 1.00 51.34 H new ATOM 0 HG3 LYS A 21 -52.258 -0.639 -8.567 1.00 51.34 H new ATOM 0 HD2 LYS A 21 -54.751 -0.690 -10.131 1.00 33.02 H new ATOM 0 HD3 LYS A 21 -53.969 -2.257 -10.072 1.00 33.02 H new ATOM 0 HE2 LYS A 21 -53.723 -1.444 -7.449 1.00 63.52 H new ATOM 0 HE3 LYS A 21 -55.242 -0.691 -7.893 1.00 63.52 H new ATOM 0 HZ1 LYS A 21 -55.587 -2.909 -7.018 1.00 64.01 H new ATOM 0 HZ2 LYS A 21 -56.060 -2.849 -8.648 1.00 64.01 H new ATOM 0 HZ3 LYS A 21 -54.588 -3.579 -8.217 1.00 64.01 H new ATOM 304 N LEU A 22 -53.899 1.497 -6.757 1.00 11.11 N ATOM 305 CA LEU A 22 -55.008 1.265 -5.840 1.00 62.04 C ATOM 306 C LEU A 22 -55.428 2.560 -5.153 1.00 2.31 C ATOM 307 O LEU A 22 -56.400 2.589 -4.399 1.00 51.15 O ATOM 308 CB LEU A 22 -54.618 0.221 -4.790 1.00 32.22 C ATOM 309 CG LEU A 22 -55.574 -0.961 -4.632 1.00 53.13 C ATOM 310 CD1 LEU A 22 -54.801 -2.237 -4.333 1.00 24.41 C ATOM 311 CD2 LEU A 22 -56.590 -0.682 -3.534 1.00 34.53 C ATOM 0 H LEU A 22 -52.987 1.572 -6.306 1.00 11.11 H new ATOM 0 HA LEU A 22 -55.853 0.892 -6.419 1.00 62.04 H new ATOM 0 HB2 LEU A 22 -53.631 -0.167 -5.042 1.00 32.22 H new ATOM 0 HB3 LEU A 22 -54.528 0.721 -3.826 1.00 32.22 H new ATOM 0 HG LEU A 22 -56.111 -1.097 -5.571 1.00 53.13 H new ATOM 0 HD11 LEU A 22 -55.498 -3.068 -4.224 1.00 24.41 H new ATOM 0 HD12 LEU A 22 -54.113 -2.446 -5.152 1.00 24.41 H new ATOM 0 HD13 LEU A 22 -54.237 -2.113 -3.408 1.00 24.41 H new ATOM 0 HD21 LEU A 22 -57.262 -1.534 -3.435 1.00 34.53 H new ATOM 0 HD22 LEU A 22 -56.070 -0.519 -2.590 1.00 34.53 H new ATOM 0 HD23 LEU A 22 -57.166 0.207 -3.789 1.00 34.53 H new ATOM 323 N GLY A 23 -54.689 3.633 -5.421 1.00 52.15 N ATOM 324 CA GLY A 23 -55.002 4.917 -4.824 1.00 43.34 C ATOM 325 C GLY A 23 -54.217 5.171 -3.551 1.00 14.33 C ATOM 326 O GLY A 23 -54.733 5.038 -2.442 1.00 42.31 O ATOM 0 H GLY A 23 -53.879 3.635 -6.041 1.00 52.15 H new ATOM 0 HA2 GLY A 23 -54.790 5.709 -5.542 1.00 43.34 H new ATOM 0 HA3 GLY A 23 -56.069 4.962 -4.605 1.00 43.34 H new ATOM 330 N PRO A 24 -52.938 5.544 -3.705 1.00 42.45 N ATOM 331 CA PRO A 24 -52.053 5.823 -2.569 1.00 55.11 C ATOM 332 C PRO A 24 -52.440 7.102 -1.834 1.00 31.25 C ATOM 333 O PRO A 24 -53.276 7.871 -2.306 1.00 23.44 O ATOM 334 CB PRO A 24 -50.677 5.979 -3.222 1.00 4.11 C ATOM 335 CG PRO A 24 -50.967 6.398 -4.622 1.00 61.03 C ATOM 336 CD PRO A 24 -52.257 5.724 -4.998 1.00 45.53 C ATOM 0 HA PRO A 24 -52.097 5.037 -1.815 1.00 55.11 H new ATOM 0 HB2 PRO A 24 -50.075 6.724 -2.703 1.00 4.11 H new ATOM 0 HB3 PRO A 24 -50.118 5.043 -3.196 1.00 4.11 H new ATOM 0 HG2 PRO A 24 -51.058 7.482 -4.694 1.00 61.03 H new ATOM 0 HG3 PRO A 24 -50.161 6.100 -5.293 1.00 61.03 H new ATOM 0 HD2 PRO A 24 -52.846 6.336 -5.681 1.00 45.53 H new ATOM 0 HD3 PRO A 24 -52.082 4.770 -5.496 1.00 45.53 H new ATOM 344 N GLU A 25 -51.827 7.321 -0.675 1.00 30.43 N ATOM 345 CA GLU A 25 -52.109 8.506 0.126 1.00 61.13 C ATOM 346 C GLU A 25 -50.829 9.066 0.740 1.00 2.52 C ATOM 347 O GLU A 25 -50.603 10.276 0.732 1.00 75.32 O ATOM 348 CB GLU A 25 -53.115 8.176 1.230 1.00 32.13 C ATOM 349 CG GLU A 25 -54.563 8.387 0.818 1.00 54.54 C ATOM 350 CD GLU A 25 -55.537 8.120 1.949 1.00 55.02 C ATOM 351 OE1 GLU A 25 -55.222 7.274 2.815 1.00 54.21 O ATOM 352 OE2 GLU A 25 -56.611 8.754 1.971 1.00 12.11 O1- ATOM 0 H GLU A 25 -51.132 6.694 -0.270 1.00 30.43 H new ATOM 0 HA GLU A 25 -52.537 9.263 -0.531 1.00 61.13 H new ATOM 0 HB2 GLU A 25 -52.980 7.138 1.534 1.00 32.13 H new ATOM 0 HB3 GLU A 25 -52.900 8.794 2.102 1.00 32.13 H new ATOM 0 HG2 GLU A 25 -54.691 9.411 0.467 1.00 54.54 H new ATOM 0 HG3 GLU A 25 -54.797 7.731 -0.021 1.00 54.54 H new ATOM 359 N GLU A 26 -49.996 8.176 1.270 1.00 43.40 N ATOM 360 CA GLU A 26 -48.739 8.581 1.889 1.00 42.11 C ATOM 361 C GLU A 26 -47.826 7.378 2.105 1.00 25.51 C ATOM 362 O GLU A 26 -48.294 6.243 2.214 1.00 40.12 O ATOM 363 CB GLU A 26 -49.005 9.279 3.224 1.00 74.23 C ATOM 364 CG GLU A 26 -49.420 8.331 4.336 1.00 70.14 C ATOM 365 CD GLU A 26 -50.339 8.985 5.349 1.00 31.34 C ATOM 366 OE1 GLU A 26 -51.518 9.225 5.012 1.00 24.24 O ATOM 367 OE2 GLU A 26 -49.880 9.258 6.477 1.00 61.41 O1- ATOM 0 H GLU A 26 -50.168 7.171 1.283 1.00 43.40 H new ATOM 0 HA GLU A 26 -48.240 9.277 1.215 1.00 42.11 H new ATOM 0 HB2 GLU A 26 -48.105 9.813 3.530 1.00 74.23 H new ATOM 0 HB3 GLU A 26 -49.787 10.026 3.084 1.00 74.23 H new ATOM 0 HG2 GLU A 26 -49.921 7.466 3.902 1.00 70.14 H new ATOM 0 HG3 GLU A 26 -48.529 7.962 4.845 1.00 70.14 H new ATOM 374 N ILE A 27 -46.524 7.633 2.166 1.00 34.23 N ATOM 375 CA ILE A 27 -45.546 6.572 2.370 1.00 51.54 C ATOM 376 C ILE A 27 -45.524 6.117 3.825 1.00 3.43 C ATOM 377 O ILE A 27 -45.653 6.927 4.743 1.00 75.14 O ATOM 378 CB ILE A 27 -44.132 7.025 1.963 1.00 31.11 C ATOM 379 CG1 ILE A 27 -43.205 5.815 1.826 1.00 64.55 C ATOM 380 CG2 ILE A 27 -43.578 8.010 2.981 1.00 22.12 C ATOM 381 CD1 ILE A 27 -41.787 6.179 1.446 1.00 33.44 C ATOM 0 H ILE A 27 -46.121 8.566 2.077 1.00 34.23 H new ATOM 0 HA ILE A 27 -45.848 5.738 1.736 1.00 51.54 H new ATOM 0 HB ILE A 27 -44.191 7.526 0.997 1.00 31.11 H new ATOM 0 HG12 ILE A 27 -43.191 5.270 2.770 1.00 64.55 H new ATOM 0 HG13 ILE A 27 -43.612 5.139 1.074 1.00 64.55 H new ATOM 0 HG21 ILE A 27 -42.578 8.321 2.679 1.00 22.12 H new ATOM 0 HG22 ILE A 27 -44.229 8.883 3.034 1.00 22.12 H new ATOM 0 HG23 ILE A 27 -43.530 7.533 3.960 1.00 22.12 H new ATOM 0 HD11 ILE A 27 -41.187 5.272 1.367 1.00 33.44 H new ATOM 0 HD12 ILE A 27 -41.789 6.698 0.487 1.00 33.44 H new ATOM 0 HD13 ILE A 27 -41.361 6.830 2.210 1.00 33.44 H new ATOM 393 N THR A 28 -45.357 4.814 4.029 1.00 23.51 N ATOM 394 CA THR A 28 -45.317 4.250 5.372 1.00 45.35 C ATOM 395 C THR A 28 -44.363 3.062 5.441 1.00 32.33 C ATOM 396 O THR A 28 -43.803 2.645 4.428 1.00 33.43 O ATOM 397 CB THR A 28 -46.715 3.799 5.835 1.00 53.03 C ATOM 398 OG1 THR A 28 -46.687 3.468 7.228 1.00 4.11 O ATOM 399 CG2 THR A 28 -47.188 2.596 5.033 1.00 21.31 C ATOM 0 H THR A 28 -45.247 4.130 3.281 1.00 23.51 H new ATOM 0 HA THR A 28 -44.960 5.038 6.035 1.00 45.35 H new ATOM 0 HB THR A 28 -47.411 4.622 5.671 1.00 53.03 H new ATOM 0 HG1 THR A 28 -47.580 3.184 7.515 1.00 4.11 H new ATOM 0 HG21 THR A 28 -48.177 2.295 5.378 1.00 21.31 H new ATOM 0 HG22 THR A 28 -47.236 2.859 3.976 1.00 21.31 H new ATOM 0 HG23 THR A 28 -46.490 1.770 5.170 1.00 21.31 H new ATOM 407 N ARG A 29 -44.184 2.523 6.643 1.00 14.42 N ATOM 408 CA ARG A 29 -43.297 1.383 6.844 1.00 74.04 C ATOM 409 C ARG A 29 -44.042 0.224 7.501 1.00 61.04 C ATOM 410 O ARG A 29 -44.575 0.362 8.603 1.00 23.41 O ATOM 411 CB ARG A 29 -42.100 1.787 7.704 1.00 13.44 C ATOM 412 CG ARG A 29 -42.476 2.615 8.922 1.00 21.03 C ATOM 413 CD ARG A 29 -41.623 2.253 10.128 1.00 15.43 C ATOM 414 NE ARG A 29 -42.288 2.578 11.386 1.00 11.32 N ATOM 415 CZ ARG A 29 -43.218 1.811 11.946 1.00 74.13 C ATOM 416 NH1 ARG A 29 -43.589 0.680 11.362 1.00 53.55 N1+ ATOM 417 NH2 ARG A 29 -43.777 2.176 13.093 1.00 74.03 N ATOM 0 H ARG A 29 -44.641 2.857 7.492 1.00 14.42 H new ATOM 0 HA ARG A 29 -42.940 1.056 5.868 1.00 74.04 H new ATOM 0 HB2 ARG A 29 -41.580 0.887 8.033 1.00 13.44 H new ATOM 0 HB3 ARG A 29 -41.399 2.354 7.092 1.00 13.44 H new ATOM 0 HG2 ARG A 29 -42.355 3.674 8.694 1.00 21.03 H new ATOM 0 HG3 ARG A 29 -43.528 2.458 9.159 1.00 21.03 H new ATOM 0 HD2 ARG A 29 -41.394 1.188 10.104 1.00 15.43 H new ATOM 0 HD3 ARG A 29 -40.673 2.784 10.072 1.00 15.43 H new ATOM 0 HE ARG A 29 -42.025 3.441 11.862 1.00 11.32 H new ATOM 0 HH11 ARG A 29 -43.161 0.397 10.481 1.00 53.55 H new ATOM 0 HH12 ARG A 29 -44.303 0.093 11.794 1.00 53.55 H new ATOM 0 HH21 ARG A 29 -43.493 3.045 13.545 1.00 74.03 H new ATOM 0 HH22 ARG A 29 -44.491 1.587 13.523 1.00 74.03 H new ATOM 431 N ASP A 30 -44.074 -0.915 6.819 1.00 64.35 N ATOM 432 CA ASP A 30 -44.753 -2.098 7.337 1.00 0.23 C ATOM 433 C ASP A 30 -44.059 -3.372 6.865 1.00 34.02 C ATOM 434 O ASP A 30 -44.542 -4.055 5.961 1.00 14.01 O ATOM 435 CB ASP A 30 -46.217 -2.106 6.896 1.00 31.35 C ATOM 436 CG ASP A 30 -46.948 -3.357 7.340 1.00 31.41 C ATOM 437 OD1 ASP A 30 -47.406 -3.394 8.502 1.00 64.23 O ATOM 438 OD2 ASP A 30 -47.064 -4.298 6.528 1.00 50.33 O1- ATOM 0 H ASP A 30 -43.638 -1.045 5.906 1.00 64.35 H new ATOM 0 HA ASP A 30 -44.710 -2.064 8.426 1.00 0.23 H new ATOM 0 HB2 ASP A 30 -46.721 -1.230 7.304 1.00 31.35 H new ATOM 0 HB3 ASP A 30 -46.267 -2.026 5.810 1.00 31.35 H new ATOM 443 N ILE A 31 -42.924 -3.685 7.482 1.00 63.23 N ATOM 444 CA ILE A 31 -42.166 -4.876 7.125 1.00 25.31 C ATOM 445 C ILE A 31 -42.212 -5.913 8.242 1.00 64.24 C ATOM 446 O ILE A 31 -41.295 -6.028 9.054 1.00 20.01 O ATOM 447 CB ILE A 31 -40.695 -4.536 6.816 1.00 73.13 C ATOM 448 CG1 ILE A 31 -40.615 -3.375 5.823 1.00 24.14 C ATOM 449 CG2 ILE A 31 -39.971 -5.758 6.271 1.00 43.12 C ATOM 450 CD1 ILE A 31 -40.583 -2.016 6.484 1.00 71.21 C ATOM 0 H ILE A 31 -42.510 -3.130 8.231 1.00 63.23 H new ATOM 0 HA ILE A 31 -42.631 -5.289 6.230 1.00 25.31 H new ATOM 0 HB ILE A 31 -40.206 -4.232 7.742 1.00 73.13 H new ATOM 0 HG12 ILE A 31 -39.722 -3.493 5.210 1.00 24.14 H new ATOM 0 HG13 ILE A 31 -41.472 -3.423 5.151 1.00 24.14 H new ATOM 0 HG21 ILE A 31 -38.933 -5.501 6.058 1.00 43.12 H new ATOM 0 HG22 ILE A 31 -40.002 -6.559 7.010 1.00 43.12 H new ATOM 0 HG23 ILE A 31 -40.458 -6.091 5.354 1.00 43.12 H new ATOM 0 HD11 ILE A 31 -40.526 -1.241 5.720 1.00 71.21 H new ATOM 0 HD12 ILE A 31 -41.488 -1.877 7.075 1.00 71.21 H new ATOM 0 HD13 ILE A 31 -39.711 -1.948 7.135 1.00 71.21 H new ATOM 462 N PRO A 32 -43.306 -6.689 8.285 1.00 34.15 N ATOM 463 CA PRO A 32 -43.498 -7.732 9.296 1.00 63.53 C ATOM 464 C PRO A 32 -42.550 -8.911 9.101 1.00 74.13 C ATOM 465 O PRO A 32 -42.008 -9.109 8.015 1.00 52.54 O ATOM 466 CB PRO A 32 -44.949 -8.170 9.083 1.00 61.33 C ATOM 467 CG PRO A 32 -45.237 -7.842 7.658 1.00 72.25 C ATOM 468 CD PRO A 32 -44.439 -6.607 7.348 1.00 11.40 C ATOM 0 HA PRO A 32 -43.292 -7.367 10.302 1.00 63.53 H new ATOM 0 HB2 PRO A 32 -45.074 -9.235 9.277 1.00 61.33 H new ATOM 0 HB3 PRO A 32 -45.625 -7.642 9.756 1.00 61.33 H new ATOM 0 HG2 PRO A 32 -44.952 -8.665 7.003 1.00 72.25 H new ATOM 0 HG3 PRO A 32 -46.302 -7.667 7.505 1.00 72.25 H new ATOM 0 HD2 PRO A 32 -44.103 -6.595 6.311 1.00 11.40 H new ATOM 0 HD3 PRO A 32 -45.024 -5.701 7.504 1.00 11.40 H new ATOM 476 N ASN A 33 -42.357 -9.691 10.159 1.00 71.22 N ATOM 477 CA ASN A 33 -41.475 -10.851 10.102 1.00 2.45 C ATOM 478 C ASN A 33 -40.034 -10.426 9.831 1.00 2.05 C ATOM 479 O ASN A 33 -39.202 -11.237 9.426 1.00 32.14 O ATOM 480 CB ASN A 33 -41.944 -11.823 9.019 1.00 52.30 C ATOM 481 CG ASN A 33 -43.451 -11.994 9.010 1.00 14.10 C ATOM 482 OD1 ASN A 33 -44.040 -12.465 9.982 1.00 31.13 O ATOM 483 ND2 ASN A 33 -44.082 -11.611 7.907 1.00 31.33 N ATOM 0 H ASN A 33 -42.799 -9.541 11.066 1.00 71.22 H new ATOM 0 HA ASN A 33 -41.512 -11.352 11.070 1.00 2.45 H new ATOM 0 HB2 ASN A 33 -41.616 -11.462 8.044 1.00 52.30 H new ATOM 0 HB3 ASN A 33 -41.472 -12.793 9.176 1.00 52.30 H new ATOM 0 HD21 ASN A 33 -45.096 -11.702 7.842 1.00 31.33 H new ATOM 0 HD22 ASN A 33 -43.553 -11.225 7.125 1.00 31.33 H new ATOM 490 N VAL A 34 -39.748 -9.147 10.059 1.00 34.42 N ATOM 491 CA VAL A 34 -38.408 -8.615 9.841 1.00 3.55 C ATOM 492 C VAL A 34 -37.549 -8.759 11.091 1.00 63.25 C ATOM 493 O VAL A 34 -38.063 -8.835 12.206 1.00 72.34 O ATOM 494 CB VAL A 34 -38.454 -7.131 9.432 1.00 61.54 C ATOM 495 CG1 VAL A 34 -38.867 -6.264 10.611 1.00 74.44 C ATOM 496 CG2 VAL A 34 -37.107 -6.687 8.880 1.00 63.24 C ATOM 0 H VAL A 34 -40.425 -8.462 10.394 1.00 34.42 H new ATOM 0 HA VAL A 34 -37.965 -9.195 9.031 1.00 3.55 H new ATOM 0 HB VAL A 34 -39.200 -7.013 8.646 1.00 61.54 H new ATOM 0 HG11 VAL A 34 -38.894 -5.219 10.302 1.00 74.44 H new ATOM 0 HG12 VAL A 34 -39.856 -6.566 10.956 1.00 74.44 H new ATOM 0 HG13 VAL A 34 -38.148 -6.385 11.421 1.00 74.44 H new ATOM 0 HG21 VAL A 34 -37.159 -5.636 8.596 1.00 63.24 H new ATOM 0 HG22 VAL A 34 -36.340 -6.820 9.643 1.00 63.24 H new ATOM 0 HG23 VAL A 34 -36.857 -7.287 8.005 1.00 63.24 H new ATOM 506 N GLY A 35 -36.233 -8.795 10.899 1.00 71.54 N ATOM 507 CA GLY A 35 -35.322 -8.930 12.021 1.00 61.21 C ATOM 508 C GLY A 35 -35.291 -7.692 12.894 1.00 63.23 C ATOM 509 O GLY A 35 -35.610 -6.595 12.437 1.00 50.52 O ATOM 0 H GLY A 35 -35.782 -8.733 9.986 1.00 71.54 H new ATOM 0 HA2 GLY A 35 -35.618 -9.789 12.624 1.00 61.21 H new ATOM 0 HA3 GLY A 35 -34.318 -9.133 11.648 1.00 61.21 H new ATOM 513 N GLU A 36 -34.905 -7.868 14.154 1.00 25.34 N ATOM 514 CA GLU A 36 -34.836 -6.754 15.093 1.00 23.30 C ATOM 515 C GLU A 36 -33.659 -5.839 14.767 1.00 75.14 C ATOM 516 O GLU A 36 -33.689 -4.643 15.059 1.00 34.31 O ATOM 517 CB GLU A 36 -34.710 -7.274 16.527 1.00 11.14 C ATOM 518 CG GLU A 36 -36.042 -7.414 17.242 1.00 41.24 C ATOM 519 CD GLU A 36 -35.888 -7.530 18.747 1.00 1.32 C ATOM 520 OE1 GLU A 36 -35.257 -6.636 19.348 1.00 11.12 O ATOM 521 OE2 GLU A 36 -36.396 -8.514 19.322 1.00 24.50 O1- ATOM 0 H GLU A 36 -34.636 -8.770 14.548 1.00 25.34 H new ATOM 0 HA GLU A 36 -35.757 -6.178 15.002 1.00 23.30 H new ATOM 0 HB2 GLU A 36 -34.212 -8.244 16.511 1.00 11.14 H new ATOM 0 HB3 GLU A 36 -34.071 -6.598 17.095 1.00 11.14 H new ATOM 0 HG2 GLU A 36 -36.667 -6.552 17.010 1.00 41.24 H new ATOM 0 HG3 GLU A 36 -36.562 -8.295 16.865 1.00 41.24 H new ATOM 528 N ASP A 37 -32.624 -6.411 14.161 1.00 22.02 N ATOM 529 CA ASP A 37 -31.436 -5.649 13.794 1.00 32.15 C ATOM 530 C ASP A 37 -31.740 -4.686 12.652 1.00 14.55 C ATOM 531 O ASP A 37 -31.227 -3.568 12.615 1.00 61.42 O ATOM 532 CB ASP A 37 -30.301 -6.592 13.395 1.00 75.52 C ATOM 533 CG ASP A 37 -30.721 -7.582 12.325 1.00 61.23 C ATOM 534 OD1 ASP A 37 -31.527 -8.484 12.637 1.00 2.44 O ATOM 535 OD2 ASP A 37 -30.244 -7.455 11.178 1.00 44.23 O1- ATOM 0 H ASP A 37 -32.584 -7.400 13.914 1.00 22.02 H new ATOM 0 HA ASP A 37 -31.125 -5.068 14.662 1.00 32.15 H new ATOM 0 HB2 ASP A 37 -29.456 -6.006 13.033 1.00 75.52 H new ATOM 0 HB3 ASP A 37 -29.958 -7.136 14.275 1.00 75.52 H new ATOM 540 N ALA A 38 -32.578 -5.127 11.718 1.00 41.12 N ATOM 541 CA ALA A 38 -32.951 -4.304 10.575 1.00 33.22 C ATOM 542 C ALA A 38 -33.813 -3.123 11.007 1.00 61.11 C ATOM 543 O ALA A 38 -33.973 -2.154 10.264 1.00 73.30 O ATOM 544 CB ALA A 38 -33.682 -5.143 9.537 1.00 54.45 C ATOM 0 H ALA A 38 -33.011 -6.050 11.732 1.00 41.12 H new ATOM 0 HA ALA A 38 -32.038 -3.909 10.129 1.00 33.22 H new ATOM 0 HB1 ALA A 38 -33.955 -4.516 8.689 1.00 54.45 H new ATOM 0 HB2 ALA A 38 -33.032 -5.950 9.198 1.00 54.45 H new ATOM 0 HB3 ALA A 38 -34.584 -5.566 9.980 1.00 54.45 H new ATOM 550 N LEU A 39 -34.369 -3.212 12.210 1.00 44.35 N ATOM 551 CA LEU A 39 -35.217 -2.150 12.740 1.00 51.12 C ATOM 552 C LEU A 39 -34.654 -1.606 14.050 1.00 25.44 C ATOM 553 O LEU A 39 -35.346 -0.911 14.794 1.00 75.32 O ATOM 554 CB LEU A 39 -36.639 -2.667 12.960 1.00 75.42 C ATOM 555 CG LEU A 39 -36.771 -3.919 13.828 1.00 63.45 C ATOM 556 CD1 LEU A 39 -36.805 -3.545 15.302 1.00 3.12 C ATOM 557 CD2 LEU A 39 -38.018 -4.704 13.447 1.00 33.13 C ATOM 0 H LEU A 39 -34.248 -4.008 12.836 1.00 44.35 H new ATOM 0 HA LEU A 39 -35.240 -1.340 12.011 1.00 51.12 H new ATOM 0 HB2 LEU A 39 -37.228 -1.870 13.415 1.00 75.42 H new ATOM 0 HB3 LEU A 39 -37.083 -2.876 11.987 1.00 75.42 H new ATOM 0 HG LEU A 39 -35.901 -4.551 13.654 1.00 63.45 H new ATOM 0 HD11 LEU A 39 -36.899 -4.448 15.905 1.00 3.12 H new ATOM 0 HD12 LEU A 39 -35.884 -3.026 15.567 1.00 3.12 H new ATOM 0 HD13 LEU A 39 -37.657 -2.892 15.492 1.00 3.12 H new ATOM 0 HD21 LEU A 39 -38.095 -5.591 14.075 1.00 33.13 H new ATOM 0 HD22 LEU A 39 -38.899 -4.079 13.591 1.00 33.13 H new ATOM 0 HD23 LEU A 39 -37.954 -5.004 12.401 1.00 33.13 H new ATOM 569 N ARG A 40 -33.393 -1.925 14.324 1.00 20.52 N ATOM 570 CA ARG A 40 -32.736 -1.468 15.543 1.00 43.52 C ATOM 571 C ARG A 40 -32.373 0.011 15.442 1.00 33.33 C ATOM 572 O ARG A 40 -32.262 0.703 16.454 1.00 61.33 O ATOM 573 CB ARG A 40 -31.479 -2.296 15.811 1.00 31.43 C ATOM 574 CG ARG A 40 -30.294 -1.903 14.943 1.00 41.24 C ATOM 575 CD ARG A 40 -29.203 -2.962 14.979 1.00 43.45 C ATOM 576 NE ARG A 40 -28.132 -2.614 15.909 1.00 63.04 N ATOM 577 CZ ARG A 40 -27.016 -3.322 16.044 1.00 32.22 C ATOM 578 NH1 ARG A 40 -26.826 -4.410 15.312 1.00 22.50 N1+ ATOM 579 NH2 ARG A 40 -26.089 -2.941 16.912 1.00 20.05 N ATOM 0 H ARG A 40 -32.806 -2.498 13.718 1.00 20.52 H new ATOM 0 HA ARG A 40 -33.431 -1.598 16.372 1.00 43.52 H new ATOM 0 HB2 ARG A 40 -31.201 -2.190 16.860 1.00 31.43 H new ATOM 0 HB3 ARG A 40 -31.706 -3.349 15.646 1.00 31.43 H new ATOM 0 HG2 ARG A 40 -30.627 -1.756 13.915 1.00 41.24 H new ATOM 0 HG3 ARG A 40 -29.890 -0.951 15.286 1.00 41.24 H new ATOM 0 HD2 ARG A 40 -29.637 -3.919 15.268 1.00 43.45 H new ATOM 0 HD3 ARG A 40 -28.788 -3.089 13.979 1.00 43.45 H new ATOM 0 HE ARG A 40 -28.247 -1.781 16.487 1.00 63.04 H new ATOM 0 HH11 ARG A 40 -27.537 -4.705 14.643 1.00 22.50 H new ATOM 0 HH12 ARG A 40 -25.968 -4.952 15.417 1.00 22.50 H new ATOM 0 HH21 ARG A 40 -26.232 -2.104 17.477 1.00 20.05 H new ATOM 0 HH22 ARG A 40 -25.232 -3.485 17.015 1.00 20.05 H new ATOM 593 N ASN A 41 -32.190 0.487 14.215 1.00 55.32 N ATOM 594 CA ASN A 41 -31.838 1.884 13.983 1.00 71.13 C ATOM 595 C ASN A 41 -32.959 2.612 13.248 1.00 35.30 C ATOM 596 O ASN A 41 -33.044 3.841 13.283 1.00 31.23 O ATOM 597 CB ASN A 41 -30.540 1.978 13.178 1.00 34.41 C ATOM 598 CG ASN A 41 -29.361 1.367 13.911 1.00 10.32 C ATOM 599 OD1 ASN A 41 -28.982 1.823 14.990 1.00 32.53 O ATOM 600 ND2 ASN A 41 -28.773 0.329 13.326 1.00 61.32 N ATOM 0 H ASN A 41 -32.279 -0.073 13.367 1.00 55.32 H new ATOM 0 HA ASN A 41 -31.692 2.362 14.952 1.00 71.13 H new ATOM 0 HB2 ASN A 41 -30.671 1.473 12.221 1.00 34.41 H new ATOM 0 HB3 ASN A 41 -30.326 3.024 12.959 1.00 34.41 H new ATOM 0 HD21 ASN A 41 -27.974 -0.123 13.772 1.00 61.32 H new ATOM 0 HD22 ASN A 41 -29.120 -0.016 12.431 1.00 61.32 H new ATOM 607 N LEU A 42 -33.816 1.848 12.582 1.00 5.31 N ATOM 608 CA LEU A 42 -34.934 2.419 11.838 1.00 1.45 C ATOM 609 C LEU A 42 -35.741 3.372 12.714 1.00 41.30 C ATOM 610 O LEU A 42 -36.238 2.988 13.772 1.00 64.12 O ATOM 611 CB LEU A 42 -35.840 1.307 11.306 1.00 35.41 C ATOM 612 CG LEU A 42 -36.606 1.624 10.021 1.00 32.44 C ATOM 613 CD1 LEU A 42 -35.827 1.151 8.804 1.00 21.05 C ATOM 614 CD2 LEU A 42 -37.987 0.985 10.053 1.00 43.22 C ATOM 0 H LEU A 42 -33.759 0.830 12.541 1.00 5.31 H new ATOM 0 HA LEU A 42 -34.529 2.982 10.997 1.00 1.45 H new ATOM 0 HB2 LEU A 42 -35.230 0.420 11.133 1.00 35.41 H new ATOM 0 HB3 LEU A 42 -36.562 1.051 12.082 1.00 35.41 H new ATOM 0 HG LEU A 42 -36.728 2.705 9.951 1.00 32.44 H new ATOM 0 HD11 LEU A 42 -36.388 1.385 7.899 1.00 21.05 H new ATOM 0 HD12 LEU A 42 -34.861 1.654 8.772 1.00 21.05 H new ATOM 0 HD13 LEU A 42 -35.673 0.074 8.867 1.00 21.05 H new ATOM 0 HD21 LEU A 42 -38.518 1.221 9.131 1.00 43.22 H new ATOM 0 HD22 LEU A 42 -37.886 -0.096 10.147 1.00 43.22 H new ATOM 0 HD23 LEU A 42 -38.547 1.372 10.904 1.00 43.22 H new ATOM 626 N ASP A 43 -35.867 4.616 12.263 1.00 10.14 N ATOM 627 CA ASP A 43 -36.616 5.625 13.004 1.00 31.33 C ATOM 628 C ASP A 43 -38.094 5.590 12.627 1.00 31.33 C ATOM 629 O ASP A 43 -38.532 4.717 11.877 1.00 2.34 O ATOM 630 CB ASP A 43 -36.041 7.016 12.738 1.00 44.20 C ATOM 631 CG ASP A 43 -34.588 7.132 13.155 1.00 54.04 C ATOM 632 OD1 ASP A 43 -34.073 6.182 13.782 1.00 1.31 O ATOM 633 OD2 ASP A 43 -33.966 8.172 12.855 1.00 30.34 O1- ATOM 0 H ASP A 43 -35.461 4.949 11.389 1.00 10.14 H new ATOM 0 HA ASP A 43 -36.525 5.401 14.067 1.00 31.33 H new ATOM 0 HB2 ASP A 43 -36.131 7.246 11.676 1.00 44.20 H new ATOM 0 HB3 ASP A 43 -36.631 7.758 13.276 1.00 44.20 H new ATOM 638 N ASP A 44 -38.856 6.543 13.152 1.00 73.33 N ATOM 639 CA ASP A 44 -40.284 6.622 12.870 1.00 11.43 C ATOM 640 C ASP A 44 -40.532 6.869 11.385 1.00 44.41 C ATOM 641 O ASP A 44 -41.625 6.619 10.878 1.00 0.12 O ATOM 642 CB ASP A 44 -40.929 7.733 13.700 1.00 63.23 C ATOM 643 CG ASP A 44 -41.338 7.261 15.081 1.00 31.34 C ATOM 644 OD1 ASP A 44 -40.533 6.564 15.732 1.00 40.13 O ATOM 645 OD2 ASP A 44 -42.465 7.588 15.510 1.00 13.32 O1- ATOM 0 H ASP A 44 -38.508 7.272 13.775 1.00 73.33 H new ATOM 0 HA ASP A 44 -40.736 5.668 13.141 1.00 11.43 H new ATOM 0 HB2 ASP A 44 -40.230 8.564 13.796 1.00 63.23 H new ATOM 0 HB3 ASP A 44 -41.805 8.113 13.175 1.00 63.23 H new ATOM 650 N ARG A 45 -39.510 7.365 10.694 1.00 71.11 N ATOM 651 CA ARG A 45 -39.618 7.648 9.268 1.00 52.13 C ATOM 652 C ARG A 45 -39.537 6.363 8.450 1.00 35.45 C ATOM 653 O ARG A 45 -39.995 6.311 7.310 1.00 3.22 O ATOM 654 CB ARG A 45 -38.513 8.613 8.834 1.00 65.04 C ATOM 655 CG ARG A 45 -38.632 9.996 9.455 1.00 43.34 C ATOM 656 CD ARG A 45 -37.328 10.769 9.347 1.00 43.42 C ATOM 657 NE ARG A 45 -37.356 12.001 10.131 1.00 64.23 N ATOM 658 CZ ARG A 45 -36.382 12.905 10.114 1.00 23.12 C ATOM 659 NH1 ARG A 45 -35.311 12.715 9.356 1.00 63.01 N1+ ATOM 660 NH2 ARG A 45 -36.481 14.001 10.855 1.00 3.01 N ATOM 0 H ARG A 45 -38.599 7.579 11.099 1.00 71.11 H new ATOM 0 HA ARG A 45 -40.588 8.111 9.087 1.00 52.13 H new ATOM 0 HB2 ARG A 45 -37.546 8.187 9.100 1.00 65.04 H new ATOM 0 HB3 ARG A 45 -38.532 8.709 7.748 1.00 65.04 H new ATOM 0 HG2 ARG A 45 -39.428 10.552 8.959 1.00 43.34 H new ATOM 0 HG3 ARG A 45 -38.915 9.902 10.503 1.00 43.34 H new ATOM 0 HD2 ARG A 45 -36.505 10.141 9.688 1.00 43.42 H new ATOM 0 HD3 ARG A 45 -37.134 11.009 8.302 1.00 43.42 H new ATOM 0 HE ARG A 45 -38.167 12.177 10.724 1.00 64.23 H new ATOM 0 HH11 ARG A 45 -35.233 11.874 8.784 1.00 63.01 H new ATOM 0 HH12 ARG A 45 -34.565 13.410 9.344 1.00 63.01 H new ATOM 0 HH21 ARG A 45 -37.305 14.150 11.438 1.00 3.01 H new ATOM 0 HH22 ARG A 45 -35.733 14.695 10.842 1.00 3.01 H new ATOM 674 N GLY A 46 -38.948 5.327 9.041 1.00 63.25 N ATOM 675 CA GLY A 46 -38.815 4.057 8.352 1.00 13.20 C ATOM 676 C GLY A 46 -37.486 3.920 7.638 1.00 41.41 C ATOM 677 O GLY A 46 -37.339 3.096 6.736 1.00 11.40 O ATOM 0 H GLY A 46 -38.561 5.345 9.984 1.00 63.25 H new ATOM 0 HA2 GLY A 46 -38.923 3.245 9.071 1.00 13.20 H new ATOM 0 HA3 GLY A 46 -39.624 3.953 7.629 1.00 13.20 H new ATOM 681 N VAL A 47 -36.514 4.732 8.040 1.00 30.53 N ATOM 682 CA VAL A 47 -35.189 4.699 7.431 1.00 42.32 C ATOM 683 C VAL A 47 -34.108 4.471 8.482 1.00 35.22 C ATOM 684 O VAL A 47 -34.131 5.078 9.553 1.00 74.45 O ATOM 685 CB VAL A 47 -34.886 6.005 6.673 1.00 33.24 C ATOM 686 CG1 VAL A 47 -34.849 7.184 7.634 1.00 62.32 C ATOM 687 CG2 VAL A 47 -33.575 5.886 5.910 1.00 11.24 C ATOM 0 H VAL A 47 -36.619 5.421 8.785 1.00 30.53 H new ATOM 0 HA VAL A 47 -35.186 3.869 6.724 1.00 42.32 H new ATOM 0 HB VAL A 47 -35.684 6.180 5.952 1.00 33.24 H new ATOM 0 HG11 VAL A 47 -34.634 8.098 7.080 1.00 62.32 H new ATOM 0 HG12 VAL A 47 -35.815 7.279 8.130 1.00 62.32 H new ATOM 0 HG13 VAL A 47 -34.072 7.020 8.381 1.00 62.32 H new ATOM 0 HG21 VAL A 47 -33.377 6.818 5.380 1.00 11.24 H new ATOM 0 HG22 VAL A 47 -32.764 5.687 6.610 1.00 11.24 H new ATOM 0 HG23 VAL A 47 -33.645 5.068 5.193 1.00 11.24 H new ATOM 697 N ILE A 48 -33.161 3.593 8.166 1.00 4.11 N ATOM 698 CA ILE A 48 -32.069 3.287 9.083 1.00 23.31 C ATOM 699 C ILE A 48 -31.138 4.483 9.249 1.00 42.35 C ATOM 700 O ILE A 48 -30.827 5.179 8.281 1.00 21.41 O ATOM 701 CB ILE A 48 -31.250 2.076 8.597 1.00 74.51 C ATOM 702 CG1 ILE A 48 -32.126 0.823 8.560 1.00 2.21 C ATOM 703 CG2 ILE A 48 -30.043 1.858 9.498 1.00 61.43 C ATOM 704 CD1 ILE A 48 -32.601 0.375 9.924 1.00 11.41 C ATOM 0 H ILE A 48 -33.128 3.082 7.284 1.00 4.11 H new ATOM 0 HA ILE A 48 -32.522 3.047 10.045 1.00 23.31 H new ATOM 0 HB ILE A 48 -30.894 2.278 7.587 1.00 74.51 H new ATOM 0 HG12 ILE A 48 -32.993 1.015 7.928 1.00 2.21 H new ATOM 0 HG13 ILE A 48 -31.566 0.012 8.095 1.00 2.21 H new ATOM 0 HG21 ILE A 48 -29.474 0.999 9.142 1.00 61.43 H new ATOM 0 HG22 ILE A 48 -29.410 2.745 9.480 1.00 61.43 H new ATOM 0 HG23 ILE A 48 -30.379 1.673 10.518 1.00 61.43 H new ATOM 0 HD11 ILE A 48 -33.217 -0.518 9.820 1.00 11.41 H new ATOM 0 HD12 ILE A 48 -31.740 0.151 10.554 1.00 11.41 H new ATOM 0 HD13 ILE A 48 -33.189 1.169 10.383 1.00 11.41 H new ATOM 716 N ARG A 49 -30.695 4.715 10.479 1.00 61.21 N ATOM 717 CA ARG A 49 -29.798 5.827 10.772 1.00 55.21 C ATOM 718 C ARG A 49 -28.382 5.524 10.292 1.00 4.43 C ATOM 719 O ARG A 49 -28.038 4.371 10.030 1.00 74.42 O ATOM 720 CB ARG A 49 -29.788 6.121 12.272 1.00 75.12 C ATOM 721 CG ARG A 49 -29.133 7.445 12.630 1.00 63.14 C ATOM 722 CD ARG A 49 -29.377 7.813 14.085 1.00 21.00 C ATOM 723 NE ARG A 49 -28.384 8.760 14.584 1.00 40.53 N ATOM 724 CZ ARG A 49 -28.343 9.189 15.841 1.00 35.01 C ATOM 725 NH1 ARG A 49 -29.234 8.755 16.722 1.00 2.42 N1+ ATOM 726 NH2 ARG A 49 -27.409 10.052 16.219 1.00 44.41 N ATOM 0 H ARG A 49 -30.942 4.148 11.290 1.00 61.21 H new ATOM 0 HA ARG A 49 -30.163 6.705 10.240 1.00 55.21 H new ATOM 0 HB2 ARG A 49 -30.814 6.122 12.640 1.00 75.12 H new ATOM 0 HB3 ARG A 49 -29.265 5.316 12.788 1.00 75.12 H new ATOM 0 HG2 ARG A 49 -28.061 7.383 12.444 1.00 63.14 H new ATOM 0 HG3 ARG A 49 -29.524 8.232 11.984 1.00 63.14 H new ATOM 0 HD2 ARG A 49 -30.373 8.244 14.188 1.00 21.00 H new ATOM 0 HD3 ARG A 49 -29.356 6.910 14.696 1.00 21.00 H new ATOM 0 HE ARG A 49 -27.683 9.112 13.932 1.00 40.53 H new ATOM 0 HH11 ARG A 49 -29.953 8.090 16.435 1.00 2.42 H new ATOM 0 HH12 ARG A 49 -29.201 9.086 17.686 1.00 2.42 H new ATOM 0 HH21 ARG A 49 -26.721 10.387 15.544 1.00 44.41 H new ATOM 0 HH22 ARG A 49 -27.379 10.380 17.184 1.00 44.41 H new ATOM 740 N ILE A 50 -27.565 6.566 10.180 1.00 42.34 N ATOM 741 CA ILE A 50 -26.186 6.411 9.733 1.00 64.41 C ATOM 742 C ILE A 50 -25.366 5.618 10.745 1.00 25.51 C ATOM 743 O ILE A 50 -25.642 5.648 11.943 1.00 50.31 O ATOM 744 CB ILE A 50 -25.513 7.776 9.499 1.00 4.21 C ATOM 745 CG1 ILE A 50 -26.419 8.679 8.659 1.00 31.11 C ATOM 746 CG2 ILE A 50 -24.164 7.592 8.819 1.00 54.25 C ATOM 747 CD1 ILE A 50 -26.801 8.078 7.325 1.00 54.33 C ATOM 0 H ILE A 50 -27.834 7.527 10.393 1.00 42.34 H new ATOM 0 HA ILE A 50 -26.219 5.866 8.790 1.00 64.41 H new ATOM 0 HB ILE A 50 -25.350 8.254 10.465 1.00 4.21 H new ATOM 0 HG12 ILE A 50 -27.326 8.896 9.223 1.00 31.11 H new ATOM 0 HG13 ILE A 50 -25.914 9.630 8.489 1.00 31.11 H new ATOM 0 HG21 ILE A 50 -23.701 8.566 8.660 1.00 54.25 H new ATOM 0 HG22 ILE A 50 -23.518 6.982 9.450 1.00 54.25 H new ATOM 0 HG23 ILE A 50 -24.305 7.097 7.858 1.00 54.25 H new ATOM 0 HD11 ILE A 50 -27.443 8.773 6.784 1.00 54.33 H new ATOM 0 HD12 ILE A 50 -25.901 7.886 6.741 1.00 54.33 H new ATOM 0 HD13 ILE A 50 -27.335 7.142 7.487 1.00 54.33 H new ATOM 759 N GLY A 51 -24.352 4.911 10.254 1.00 2.14 N ATOM 760 CA GLY A 51 -23.506 4.122 11.130 1.00 43.44 C ATOM 761 C GLY A 51 -24.047 2.723 11.353 1.00 53.24 C ATOM 762 O GLY A 51 -23.616 2.023 12.268 1.00 63.33 O ATOM 0 H GLY A 51 -24.102 4.871 9.266 1.00 2.14 H new ATOM 0 HA2 GLY A 51 -22.505 4.057 10.702 1.00 43.44 H new ATOM 0 HA3 GLY A 51 -23.410 4.629 12.090 1.00 43.44 H new ATOM 766 N ALA A 52 -24.994 2.316 10.515 1.00 53.13 N ATOM 767 CA ALA A 52 -25.594 0.992 10.625 1.00 25.41 C ATOM 768 C ALA A 52 -25.058 0.055 9.549 1.00 3.24 C ATOM 769 O ALA A 52 -25.073 0.384 8.363 1.00 33.21 O ATOM 770 CB ALA A 52 -27.110 1.091 10.536 1.00 4.44 C ATOM 0 H ALA A 52 -25.363 2.884 9.752 1.00 53.13 H new ATOM 0 HA ALA A 52 -25.325 0.577 11.596 1.00 25.41 H new ATOM 0 HB1 ALA A 52 -27.545 0.095 10.620 1.00 4.44 H new ATOM 0 HB2 ALA A 52 -27.482 1.719 11.346 1.00 4.44 H new ATOM 0 HB3 ALA A 52 -27.390 1.530 9.579 1.00 4.44 H new ATOM 776 N GLU A 53 -24.584 -1.114 9.970 1.00 24.44 N ATOM 777 CA GLU A 53 -24.042 -2.097 9.040 1.00 12.23 C ATOM 778 C GLU A 53 -25.146 -2.685 8.166 1.00 61.23 C ATOM 779 O GLU A 53 -26.233 -3.003 8.648 1.00 62.55 O ATOM 780 CB GLU A 53 -23.330 -3.216 9.805 1.00 5.05 C ATOM 781 CG GLU A 53 -22.036 -2.773 10.467 1.00 63.31 C ATOM 782 CD GLU A 53 -21.478 -3.818 11.413 1.00 65.35 C ATOM 783 OE1 GLU A 53 -22.249 -4.337 12.248 1.00 22.21 O ATOM 784 OE2 GLU A 53 -20.269 -4.119 11.318 1.00 42.20 O1- ATOM 0 H GLU A 53 -24.565 -1.403 10.948 1.00 24.44 H new ATOM 0 HA GLU A 53 -23.322 -1.593 8.395 1.00 12.23 H new ATOM 0 HB2 GLU A 53 -24.003 -3.608 10.568 1.00 5.05 H new ATOM 0 HB3 GLU A 53 -23.115 -4.035 9.118 1.00 5.05 H new ATOM 0 HG2 GLU A 53 -21.296 -2.552 9.698 1.00 63.31 H new ATOM 0 HG3 GLU A 53 -22.211 -1.848 11.016 1.00 63.31 H new ATOM 791 N VAL A 54 -24.858 -2.827 6.876 1.00 22.21 N ATOM 792 CA VAL A 54 -25.825 -3.378 5.933 1.00 62.55 C ATOM 793 C VAL A 54 -25.665 -4.887 5.802 1.00 25.30 C ATOM 794 O VAL A 54 -24.553 -5.413 5.857 1.00 72.42 O ATOM 795 CB VAL A 54 -25.680 -2.734 4.541 1.00 34.21 C ATOM 796 CG1 VAL A 54 -24.247 -2.854 4.043 1.00 11.11 C ATOM 797 CG2 VAL A 54 -26.650 -3.369 3.558 1.00 22.21 C ATOM 0 H VAL A 54 -23.963 -2.568 6.460 1.00 22.21 H new ATOM 0 HA VAL A 54 -26.816 -3.154 6.327 1.00 62.55 H new ATOM 0 HB VAL A 54 -25.923 -1.674 4.623 1.00 34.21 H new ATOM 0 HG11 VAL A 54 -24.164 -2.394 3.059 1.00 11.11 H new ATOM 0 HG12 VAL A 54 -23.577 -2.348 4.738 1.00 11.11 H new ATOM 0 HG13 VAL A 54 -23.972 -3.907 3.975 1.00 11.11 H new ATOM 0 HG21 VAL A 54 -26.534 -2.902 2.580 1.00 22.21 H new ATOM 0 HG22 VAL A 54 -26.441 -4.436 3.478 1.00 22.21 H new ATOM 0 HG23 VAL A 54 -27.671 -3.225 3.910 1.00 22.21 H new ATOM 807 N LYS A 55 -26.784 -5.582 5.627 1.00 32.13 N ATOM 808 CA LYS A 55 -26.770 -7.033 5.484 1.00 11.44 C ATOM 809 C LYS A 55 -28.064 -7.530 4.845 1.00 24.20 C ATOM 810 O LYS A 55 -28.978 -6.748 4.585 1.00 53.12 O ATOM 811 CB LYS A 55 -26.576 -7.698 6.850 1.00 13.34 C ATOM 812 CG LYS A 55 -27.675 -7.375 7.846 1.00 34.42 C ATOM 813 CD LYS A 55 -27.896 -8.517 8.823 1.00 72.33 C ATOM 814 CE LYS A 55 -26.717 -8.675 9.771 1.00 54.12 C ATOM 815 NZ LYS A 55 -26.729 -7.647 10.848 1.00 75.44 N1+ ATOM 0 H LYS A 55 -27.713 -5.163 5.581 1.00 32.13 H new ATOM 0 HA LYS A 55 -25.938 -7.301 4.833 1.00 11.44 H new ATOM 0 HB2 LYS A 55 -26.526 -8.778 6.715 1.00 13.34 H new ATOM 0 HB3 LYS A 55 -25.618 -7.384 7.265 1.00 13.34 H new ATOM 0 HG2 LYS A 55 -27.415 -6.470 8.395 1.00 34.42 H new ATOM 0 HG3 LYS A 55 -28.602 -7.168 7.312 1.00 34.42 H new ATOM 0 HD2 LYS A 55 -28.804 -8.335 9.397 1.00 72.33 H new ATOM 0 HD3 LYS A 55 -28.048 -9.445 8.272 1.00 72.33 H new ATOM 0 HE2 LYS A 55 -26.741 -9.669 10.218 1.00 54.12 H new ATOM 0 HE3 LYS A 55 -25.786 -8.601 9.208 1.00 54.12 H new ATOM 0 HZ1 LYS A 55 -25.910 -7.789 11.473 1.00 75.44 H new ATOM 0 HZ2 LYS A 55 -26.680 -6.699 10.423 1.00 75.44 H new ATOM 0 HZ3 LYS A 55 -27.605 -7.734 11.401 1.00 75.44 H new ATOM 829 N ASP A 56 -28.134 -8.833 4.598 1.00 1.11 N ATOM 830 CA ASP A 56 -29.316 -9.433 3.991 1.00 50.12 C ATOM 831 C ASP A 56 -30.534 -9.263 4.894 1.00 51.21 C ATOM 832 O ASP A 56 -30.427 -9.318 6.118 1.00 22.43 O ATOM 833 CB ASP A 56 -29.074 -10.918 3.715 1.00 24.03 C ATOM 834 CG ASP A 56 -29.355 -11.786 4.925 1.00 74.11 C ATOM 835 OD1 ASP A 56 -30.523 -12.192 5.106 1.00 70.55 O ATOM 836 OD2 ASP A 56 -28.408 -12.062 5.690 1.00 42.54 O1- ATOM 0 H ASP A 56 -27.386 -9.494 4.809 1.00 1.11 H new ATOM 0 HA ASP A 56 -29.510 -8.923 3.048 1.00 50.12 H new ATOM 0 HB2 ASP A 56 -29.707 -11.238 2.887 1.00 24.03 H new ATOM 0 HB3 ASP A 56 -28.040 -11.062 3.400 1.00 24.03 H new ATOM 841 N GLY A 57 -31.695 -9.056 4.278 1.00 23.23 N ATOM 842 CA GLY A 57 -32.918 -8.879 5.041 1.00 2.42 C ATOM 843 C GLY A 57 -33.084 -7.461 5.550 1.00 30.44 C ATOM 844 O GLY A 57 -34.098 -7.129 6.165 1.00 50.43 O ATOM 0 H GLY A 57 -31.810 -9.008 3.266 1.00 23.23 H new ATOM 0 HA2 GLY A 57 -33.773 -9.140 4.417 1.00 2.42 H new ATOM 0 HA3 GLY A 57 -32.918 -9.567 5.886 1.00 2.42 H new ATOM 848 N ASP A 58 -32.085 -6.622 5.296 1.00 1.23 N ATOM 849 CA ASP A 58 -32.125 -5.231 5.733 1.00 24.33 C ATOM 850 C ASP A 58 -32.323 -4.294 4.546 1.00 44.22 C ATOM 851 O ASP A 58 -31.362 -3.907 3.879 1.00 4.32 O ATOM 852 CB ASP A 58 -30.837 -4.870 6.474 1.00 74.23 C ATOM 853 CG ASP A 58 -30.710 -5.594 7.801 1.00 42.34 C ATOM 854 OD1 ASP A 58 -31.511 -6.520 8.050 1.00 52.45 O ATOM 855 OD2 ASP A 58 -29.812 -5.235 8.590 1.00 60.24 O1- ATOM 0 H ASP A 58 -31.238 -6.881 4.790 1.00 1.23 H new ATOM 0 HA ASP A 58 -32.970 -5.113 6.411 1.00 24.33 H new ATOM 0 HB2 ASP A 58 -29.980 -5.114 5.847 1.00 74.23 H new ATOM 0 HB3 ASP A 58 -30.810 -3.794 6.646 1.00 74.23 H new ATOM 860 N LEU A 59 -33.575 -3.933 4.285 1.00 1.10 N ATOM 861 CA LEU A 59 -33.899 -3.042 3.178 1.00 32.31 C ATOM 862 C LEU A 59 -33.366 -1.636 3.435 1.00 22.24 C ATOM 863 O LEU A 59 -33.009 -0.916 2.503 1.00 63.34 O ATOM 864 CB LEU A 59 -35.413 -2.994 2.961 1.00 63.13 C ATOM 865 CG LEU A 59 -36.159 -4.317 3.140 1.00 21.11 C ATOM 866 CD1 LEU A 59 -36.844 -4.364 4.497 1.00 3.32 C ATOM 867 CD2 LEU A 59 -37.171 -4.514 2.022 1.00 13.30 C ATOM 0 H LEU A 59 -34.382 -4.244 4.826 1.00 1.10 H new ATOM 0 HA LEU A 59 -33.422 -3.433 2.279 1.00 32.31 H new ATOM 0 HB2 LEU A 59 -35.836 -2.265 3.652 1.00 63.13 H new ATOM 0 HB3 LEU A 59 -35.604 -2.626 1.953 1.00 63.13 H new ATOM 0 HG LEU A 59 -35.434 -5.130 3.094 1.00 21.11 H new ATOM 0 HD11 LEU A 59 -37.370 -5.313 4.607 1.00 3.32 H new ATOM 0 HD12 LEU A 59 -36.097 -4.270 5.285 1.00 3.32 H new ATOM 0 HD13 LEU A 59 -37.557 -3.543 4.573 1.00 3.32 H new ATOM 0 HD21 LEU A 59 -37.692 -5.460 2.166 1.00 13.30 H new ATOM 0 HD22 LEU A 59 -37.892 -3.697 2.036 1.00 13.30 H new ATOM 0 HD23 LEU A 59 -36.655 -4.526 1.062 1.00 13.30 H new ATOM 879 N LEU A 60 -33.315 -1.253 4.706 1.00 4.23 N ATOM 880 CA LEU A 60 -32.823 0.067 5.088 1.00 33.23 C ATOM 881 C LEU A 60 -33.725 1.165 4.536 1.00 4.21 C ATOM 882 O LEU A 60 -33.347 2.336 4.505 1.00 64.02 O ATOM 883 CB LEU A 60 -31.392 0.264 4.584 1.00 0.12 C ATOM 884 CG LEU A 60 -30.418 -0.881 4.862 1.00 74.51 C ATOM 885 CD1 LEU A 60 -29.267 -0.856 3.868 1.00 63.21 C ATOM 886 CD2 LEU A 60 -29.894 -0.804 6.288 1.00 1.41 C ATOM 0 H LEU A 60 -33.608 -1.837 5.489 1.00 4.23 H new ATOM 0 HA LEU A 60 -32.831 0.130 6.176 1.00 33.23 H new ATOM 0 HB2 LEU A 60 -31.427 0.431 3.507 1.00 0.12 H new ATOM 0 HB3 LEU A 60 -30.992 1.172 5.034 1.00 0.12 H new ATOM 0 HG LEU A 60 -30.954 -1.823 4.744 1.00 74.51 H new ATOM 0 HD11 LEU A 60 -28.584 -1.678 4.081 1.00 63.21 H new ATOM 0 HD12 LEU A 60 -29.658 -0.962 2.856 1.00 63.21 H new ATOM 0 HD13 LEU A 60 -28.733 0.091 3.953 1.00 63.21 H new ATOM 0 HD21 LEU A 60 -29.202 -1.627 6.466 1.00 1.41 H new ATOM 0 HD22 LEU A 60 -29.376 0.144 6.434 1.00 1.41 H new ATOM 0 HD23 LEU A 60 -30.728 -0.873 6.986 1.00 1.41 H new ATOM 898 N VAL A 61 -34.921 0.779 4.102 1.00 0.20 N ATOM 899 CA VAL A 61 -35.879 1.731 3.553 1.00 71.21 C ATOM 900 C VAL A 61 -37.311 1.263 3.783 1.00 70.32 C ATOM 901 O VAL A 61 -37.632 0.092 3.585 1.00 31.11 O ATOM 902 CB VAL A 61 -35.656 1.946 2.045 1.00 31.34 C ATOM 903 CG1 VAL A 61 -34.290 2.565 1.789 1.00 4.22 C ATOM 904 CG2 VAL A 61 -35.805 0.632 1.293 1.00 2.31 C ATOM 0 H VAL A 61 -35.249 -0.187 4.120 1.00 0.20 H new ATOM 0 HA VAL A 61 -35.721 2.676 4.073 1.00 71.21 H new ATOM 0 HB VAL A 61 -36.415 2.637 1.678 1.00 31.34 H new ATOM 0 HG11 VAL A 61 -34.151 2.709 0.718 1.00 4.22 H new ATOM 0 HG12 VAL A 61 -34.226 3.528 2.296 1.00 4.22 H new ATOM 0 HG13 VAL A 61 -33.513 1.902 2.170 1.00 4.22 H new ATOM 0 HG21 VAL A 61 -35.644 0.802 0.228 1.00 2.31 H new ATOM 0 HG22 VAL A 61 -35.070 -0.083 1.661 1.00 2.31 H new ATOM 0 HG23 VAL A 61 -36.808 0.235 1.450 1.00 2.31 H new ATOM 914 N GLY A 62 -38.171 2.188 4.202 1.00 71.04 N ATOM 915 CA GLY A 62 -39.560 1.851 4.451 1.00 31.12 C ATOM 916 C GLY A 62 -40.473 2.285 3.322 1.00 34.53 C ATOM 917 O GLY A 62 -40.834 3.457 3.220 1.00 41.31 O ATOM 0 H GLY A 62 -37.930 3.164 4.373 1.00 71.04 H new ATOM 0 HA2 GLY A 62 -39.650 0.774 4.593 1.00 31.12 H new ATOM 0 HA3 GLY A 62 -39.885 2.323 5.378 1.00 31.12 H new ATOM 921 N LYS A 63 -40.848 1.337 2.470 1.00 64.14 N ATOM 922 CA LYS A 63 -41.725 1.626 1.341 1.00 33.22 C ATOM 923 C LYS A 63 -42.804 0.556 1.203 1.00 20.52 C ATOM 924 O LYS A 63 -42.551 -0.533 0.686 1.00 13.53 O ATOM 925 CB LYS A 63 -40.913 1.715 0.047 1.00 74.02 C ATOM 926 CG LYS A 63 -39.610 2.482 0.199 1.00 20.40 C ATOM 927 CD LYS A 63 -38.892 2.631 -1.131 1.00 71.32 C ATOM 928 CE LYS A 63 -39.415 3.824 -1.916 1.00 42.40 C ATOM 929 NZ LYS A 63 -39.076 5.115 -1.256 1.00 61.51 N1+ ATOM 0 H LYS A 63 -40.558 0.361 2.540 1.00 64.14 H new ATOM 0 HA LYS A 63 -42.209 2.585 1.526 1.00 33.22 H new ATOM 0 HB2 LYS A 63 -40.693 0.707 -0.304 1.00 74.02 H new ATOM 0 HB3 LYS A 63 -41.520 2.195 -0.721 1.00 74.02 H new ATOM 0 HG2 LYS A 63 -39.814 3.468 0.616 1.00 20.40 H new ATOM 0 HG3 LYS A 63 -38.963 1.964 0.907 1.00 20.40 H new ATOM 0 HD2 LYS A 63 -37.822 2.749 -0.957 1.00 71.32 H new ATOM 0 HD3 LYS A 63 -39.021 1.722 -1.719 1.00 71.32 H new ATOM 0 HE2 LYS A 63 -38.995 3.809 -2.922 1.00 42.40 H new ATOM 0 HE3 LYS A 63 -40.497 3.743 -2.021 1.00 42.40 H new ATOM 0 HZ1 LYS A 63 -38.739 5.792 -1.970 1.00 61.51 H new ATOM 0 HZ2 LYS A 63 -39.922 5.498 -0.787 1.00 61.51 H new ATOM 0 HZ3 LYS A 63 -38.330 4.958 -0.549 1.00 61.51 H new ATOM 943 N VAL A 64 -44.009 0.874 1.666 1.00 71.05 N ATOM 944 CA VAL A 64 -45.128 -0.058 1.591 1.00 72.21 C ATOM 945 C VAL A 64 -46.427 0.667 1.261 1.00 72.14 C ATOM 946 O VAL A 64 -46.788 1.646 1.914 1.00 61.31 O ATOM 947 CB VAL A 64 -45.304 -0.830 2.914 1.00 41.14 C ATOM 948 CG1 VAL A 64 -44.310 -1.978 2.999 1.00 41.34 C ATOM 949 CG2 VAL A 64 -45.151 0.109 4.101 1.00 71.41 C ATOM 0 H VAL A 64 -44.235 1.770 2.097 1.00 71.05 H new ATOM 0 HA VAL A 64 -44.899 -0.765 0.794 1.00 72.21 H new ATOM 0 HB VAL A 64 -46.309 -1.250 2.939 1.00 41.14 H new ATOM 0 HG11 VAL A 64 -44.449 -2.511 3.939 1.00 41.34 H new ATOM 0 HG12 VAL A 64 -44.473 -2.662 2.166 1.00 41.34 H new ATOM 0 HG13 VAL A 64 -43.295 -1.584 2.952 1.00 41.34 H new ATOM 0 HG21 VAL A 64 -45.278 -0.452 5.027 1.00 71.41 H new ATOM 0 HG22 VAL A 64 -44.159 0.560 4.083 1.00 71.41 H new ATOM 0 HG23 VAL A 64 -45.906 0.893 4.045 1.00 71.41 H new ATOM 959 N THR A 65 -47.127 0.179 0.242 1.00 75.31 N ATOM 960 CA THR A 65 -48.388 0.781 -0.176 1.00 21.11 C ATOM 961 C THR A 65 -49.577 -0.022 0.337 1.00 50.33 C ATOM 962 O THR A 65 -49.464 -1.201 0.673 1.00 22.30 O ATOM 963 CB THR A 65 -48.477 0.886 -1.710 1.00 51.22 C ATOM 964 OG1 THR A 65 -47.645 -0.107 -2.319 1.00 52.43 O ATOM 965 CG2 THR A 65 -48.055 2.269 -2.183 1.00 65.41 C ATOM 0 H THR A 65 -46.843 -0.631 -0.309 1.00 75.31 H new ATOM 0 HA THR A 65 -48.418 1.783 0.252 1.00 21.11 H new ATOM 0 HB THR A 65 -49.513 0.720 -2.004 1.00 51.22 H new ATOM 0 HG1 THR A 65 -47.709 -0.034 -3.294 1.00 52.43 H new ATOM 0 HG21 THR A 65 -48.126 2.319 -3.270 1.00 65.41 H new ATOM 0 HG22 THR A 65 -48.710 3.020 -1.741 1.00 65.41 H new ATOM 0 HG23 THR A 65 -47.026 2.460 -1.877 1.00 65.41 H new ATOM 973 N PRO A 66 -50.748 0.629 0.400 1.00 71.34 N ATOM 974 CA PRO A 66 -51.983 -0.005 0.872 1.00 72.00 C ATOM 975 C PRO A 66 -52.506 -1.051 -0.107 1.00 31.14 C ATOM 976 O PRO A 66 -52.084 -1.102 -1.263 1.00 4.01 O ATOM 977 CB PRO A 66 -52.964 1.164 0.979 1.00 54.11 C ATOM 978 CG PRO A 66 -52.454 2.177 0.012 1.00 72.32 C ATOM 979 CD PRO A 66 -50.957 2.036 0.017 1.00 51.54 C ATOM 0 HA PRO A 66 -51.834 -0.541 1.810 1.00 72.00 H new ATOM 0 HB2 PRO A 66 -53.978 0.854 0.729 1.00 54.11 H new ATOM 0 HB3 PRO A 66 -52.994 1.564 1.992 1.00 54.11 H new ATOM 0 HG2 PRO A 66 -52.859 2.004 -0.985 1.00 72.32 H new ATOM 0 HG3 PRO A 66 -52.752 3.183 0.307 1.00 72.32 H new ATOM 0 HD2 PRO A 66 -50.530 2.254 -0.962 1.00 51.54 H new ATOM 0 HD3 PRO A 66 -50.491 2.719 0.727 1.00 51.54 H new ATOM 987 N LYS A 67 -53.427 -1.887 0.363 1.00 13.34 N ATOM 988 CA LYS A 67 -54.010 -2.932 -0.470 1.00 22.03 C ATOM 989 C LYS A 67 -55.526 -2.973 -0.309 1.00 61.40 C ATOM 990 O LYS A 67 -56.049 -2.783 0.787 1.00 45.12 O ATOM 991 CB LYS A 67 -53.411 -4.293 -0.111 1.00 13.12 C ATOM 992 CG LYS A 67 -51.963 -4.453 -0.542 1.00 24.12 C ATOM 993 CD LYS A 67 -51.443 -5.848 -0.240 1.00 43.33 C ATOM 994 CE LYS A 67 -52.169 -6.903 -1.060 1.00 51.24 C ATOM 995 NZ LYS A 67 -51.352 -8.138 -1.223 1.00 22.33 N1+ ATOM 0 H LYS A 67 -53.786 -1.860 1.318 1.00 13.34 H new ATOM 0 HA LYS A 67 -53.779 -2.704 -1.510 1.00 22.03 H new ATOM 0 HB2 LYS A 67 -53.478 -4.437 0.967 1.00 13.12 H new ATOM 0 HB3 LYS A 67 -54.008 -5.077 -0.576 1.00 13.12 H new ATOM 0 HG2 LYS A 67 -51.876 -4.255 -1.610 1.00 24.12 H new ATOM 0 HG3 LYS A 67 -51.346 -3.715 -0.030 1.00 24.12 H new ATOM 0 HD2 LYS A 67 -50.375 -5.893 -0.451 1.00 43.33 H new ATOM 0 HD3 LYS A 67 -51.567 -6.062 0.822 1.00 43.33 H new ATOM 0 HE2 LYS A 67 -53.113 -7.153 -0.576 1.00 51.24 H new ATOM 0 HE3 LYS A 67 -52.412 -6.496 -2.042 1.00 51.24 H new ATOM 0 HZ1 LYS A 67 -51.882 -8.833 -1.788 1.00 22.33 H new ATOM 0 HZ2 LYS A 67 -50.462 -7.904 -1.708 1.00 22.33 H new ATOM 0 HZ3 LYS A 67 -51.141 -8.541 -0.288 1.00 22.33 H new ATOM 1009 N GLY A 68 -56.227 -3.224 -1.412 1.00 41.33 N ATOM 1010 CA GLY A 68 -57.676 -3.287 -1.370 1.00 62.55 C ATOM 1011 C GLY A 68 -58.183 -4.565 -0.731 1.00 22.32 C ATOM 1012 O GLY A 68 -57.455 -5.230 0.006 1.00 24.52 O ATOM 0 H GLY A 68 -55.817 -3.384 -2.332 1.00 41.33 H new ATOM 0 HA2 GLY A 68 -58.058 -2.430 -0.814 1.00 62.55 H new ATOM 0 HA3 GLY A 68 -58.069 -3.210 -2.384 1.00 62.55 H new ATOM 1016 N VAL A 69 -59.435 -4.910 -1.013 1.00 13.52 N ATOM 1017 CA VAL A 69 -60.040 -6.116 -0.459 1.00 23.11 C ATOM 1018 C VAL A 69 -59.847 -7.305 -1.394 1.00 22.23 C ATOM 1019 O VAL A 69 -59.562 -8.418 -0.950 1.00 32.21 O ATOM 1020 CB VAL A 69 -61.545 -5.921 -0.198 1.00 70.31 C ATOM 1021 CG1 VAL A 69 -62.125 -7.135 0.512 1.00 51.03 C ATOM 1022 CG2 VAL A 69 -61.785 -4.655 0.609 1.00 34.25 C ATOM 0 H VAL A 69 -60.051 -4.371 -1.622 1.00 13.52 H new ATOM 0 HA VAL A 69 -59.539 -6.316 0.488 1.00 23.11 H new ATOM 0 HB VAL A 69 -62.052 -5.815 -1.157 1.00 70.31 H new ATOM 0 HG11 VAL A 69 -63.189 -6.979 0.688 1.00 51.03 H new ATOM 0 HG12 VAL A 69 -61.986 -8.020 -0.108 1.00 51.03 H new ATOM 0 HG13 VAL A 69 -61.616 -7.276 1.466 1.00 51.03 H new ATOM 0 HG21 VAL A 69 -62.854 -4.532 0.784 1.00 34.25 H new ATOM 0 HG22 VAL A 69 -61.267 -4.729 1.565 1.00 34.25 H new ATOM 0 HG23 VAL A 69 -61.407 -3.794 0.057 1.00 34.25 H new ATOM 1032 N THR A 70 -60.004 -7.062 -2.691 1.00 55.35 N ATOM 1033 CA THR A 70 -59.848 -8.113 -3.690 1.00 0.23 C ATOM 1034 C THR A 70 -58.467 -8.752 -3.605 1.00 24.22 C ATOM 1035 O THR A 70 -58.282 -9.905 -3.993 1.00 33.12 O ATOM 1036 CB THR A 70 -60.064 -7.570 -5.115 1.00 23.51 C ATOM 1037 OG1 THR A 70 -61.033 -6.516 -5.096 1.00 74.35 O ATOM 1038 CG2 THR A 70 -60.527 -8.676 -6.051 1.00 3.05 C ATOM 0 H THR A 70 -60.239 -6.147 -3.075 1.00 55.35 H new ATOM 0 HA THR A 70 -60.607 -8.866 -3.478 1.00 0.23 H new ATOM 0 HB THR A 70 -59.113 -7.182 -5.480 1.00 23.51 H new ATOM 0 HG1 THR A 70 -61.163 -6.175 -6.005 1.00 74.35 H new ATOM 0 HG21 THR A 70 -60.673 -8.269 -7.051 1.00 3.05 H new ATOM 0 HG22 THR A 70 -59.773 -9.462 -6.086 1.00 3.05 H new ATOM 0 HG23 THR A 70 -61.467 -9.091 -5.687 1.00 3.05 H new ATOM 1046 N GLU A 71 -57.500 -7.995 -3.095 1.00 11.11 N ATOM 1047 CA GLU A 71 -56.135 -8.489 -2.959 1.00 34.23 C ATOM 1048 C GLU A 71 -56.051 -9.570 -1.886 1.00 23.33 C ATOM 1049 O GLU A 71 -55.249 -10.499 -1.984 1.00 53.31 O ATOM 1050 CB GLU A 71 -55.184 -7.340 -2.617 1.00 54.35 C ATOM 1051 CG GLU A 71 -55.214 -6.204 -3.626 1.00 72.01 C ATOM 1052 CD GLU A 71 -54.281 -6.441 -4.798 1.00 25.40 C ATOM 1053 OE1 GLU A 71 -53.051 -6.458 -4.582 1.00 5.12 O ATOM 1054 OE2 GLU A 71 -54.780 -6.610 -5.930 1.00 23.50 O1- ATOM 0 H GLU A 71 -57.637 -7.038 -2.770 1.00 11.11 H new ATOM 0 HA GLU A 71 -55.838 -8.925 -3.913 1.00 34.23 H new ATOM 0 HB2 GLU A 71 -55.441 -6.948 -1.633 1.00 54.35 H new ATOM 0 HB3 GLU A 71 -54.168 -7.728 -2.550 1.00 54.35 H new ATOM 0 HG2 GLU A 71 -56.232 -6.078 -3.996 1.00 72.01 H new ATOM 0 HG3 GLU A 71 -54.938 -5.274 -3.129 1.00 72.01 H new ATOM 1061 N LEU A 72 -56.886 -9.442 -0.859 1.00 12.50 N ATOM 1062 CA LEU A 72 -56.908 -10.407 0.234 1.00 60.42 C ATOM 1063 C LEU A 72 -57.057 -11.829 -0.296 1.00 51.14 C ATOM 1064 O LEU A 72 -57.334 -12.036 -1.478 1.00 34.14 O ATOM 1065 CB LEU A 72 -58.051 -10.088 1.199 1.00 44.10 C ATOM 1066 CG LEU A 72 -58.031 -8.692 1.825 1.00 41.21 C ATOM 1067 CD1 LEU A 72 -59.147 -8.551 2.849 1.00 14.22 C ATOM 1068 CD2 LEU A 72 -56.679 -8.413 2.464 1.00 4.04 C ATOM 0 H LEU A 72 -57.556 -8.679 -0.761 1.00 12.50 H new ATOM 0 HA LEU A 72 -55.960 -10.336 0.767 1.00 60.42 H new ATOM 0 HB2 LEU A 72 -58.994 -10.212 0.667 1.00 44.10 H new ATOM 0 HB3 LEU A 72 -58.038 -10.825 2.002 1.00 44.10 H new ATOM 0 HG LEU A 72 -58.195 -7.958 1.036 1.00 41.21 H new ATOM 0 HD11 LEU A 72 -59.118 -7.552 3.284 1.00 14.22 H new ATOM 0 HD12 LEU A 72 -60.110 -8.706 2.362 1.00 14.22 H new ATOM 0 HD13 LEU A 72 -59.015 -9.293 3.636 1.00 14.22 H new ATOM 0 HD21 LEU A 72 -56.683 -7.416 2.904 1.00 4.04 H new ATOM 0 HD22 LEU A 72 -56.485 -9.152 3.241 1.00 4.04 H new ATOM 0 HD23 LEU A 72 -55.899 -8.471 1.705 1.00 4.04 H new ATOM 1080 N THR A 73 -56.874 -12.807 0.586 1.00 73.31 N ATOM 1081 CA THR A 73 -56.989 -14.209 0.206 1.00 33.52 C ATOM 1082 C THR A 73 -58.092 -14.904 0.997 1.00 24.20 C ATOM 1083 O THR A 73 -58.602 -14.361 1.976 1.00 22.42 O ATOM 1084 CB THR A 73 -55.663 -14.962 0.426 1.00 30.40 C ATOM 1085 OG1 THR A 73 -55.444 -15.169 1.825 1.00 65.52 O ATOM 1086 CG2 THR A 73 -54.496 -14.185 -0.165 1.00 71.53 C ATOM 0 H THR A 73 -56.646 -12.653 1.568 1.00 73.31 H new ATOM 0 HA THR A 73 -57.238 -14.229 -0.855 1.00 33.52 H new ATOM 0 HB THR A 73 -55.730 -15.926 -0.078 1.00 30.40 H new ATOM 0 HG1 THR A 73 -54.600 -15.650 1.956 1.00 65.52 H new ATOM 0 HG21 THR A 73 -53.570 -14.736 0.002 1.00 71.53 H new ATOM 0 HG22 THR A 73 -54.652 -14.053 -1.236 1.00 71.53 H new ATOM 0 HG23 THR A 73 -54.429 -13.208 0.315 1.00 71.53 H new ATOM 1094 N ALA A 74 -58.453 -16.108 0.567 1.00 25.51 N ATOM 1095 CA ALA A 74 -59.493 -16.878 1.237 1.00 22.05 C ATOM 1096 C ALA A 74 -59.049 -17.301 2.634 1.00 64.11 C ATOM 1097 O ALA A 74 -59.866 -17.410 3.548 1.00 22.20 O ATOM 1098 CB ALA A 74 -59.865 -18.098 0.408 1.00 52.43 C ATOM 0 H ALA A 74 -58.040 -16.571 -0.243 1.00 25.51 H new ATOM 0 HA ALA A 74 -60.372 -16.241 1.340 1.00 22.05 H new ATOM 0 HB1 ALA A 74 -60.643 -18.663 0.921 1.00 52.43 H new ATOM 0 HB2 ALA A 74 -60.233 -17.777 -0.567 1.00 52.43 H new ATOM 0 HB3 ALA A 74 -58.986 -18.729 0.275 1.00 52.43 H new ATOM 1104 N GLU A 75 -57.751 -17.538 2.791 1.00 71.15 N ATOM 1105 CA GLU A 75 -57.201 -17.950 4.077 1.00 23.11 C ATOM 1106 C GLU A 75 -57.508 -16.918 5.157 1.00 12.34 C ATOM 1107 O GLU A 75 -57.775 -17.268 6.306 1.00 50.21 O ATOM 1108 CB GLU A 75 -55.688 -18.155 3.967 1.00 42.41 C ATOM 1109 CG GLU A 75 -55.281 -19.107 2.856 1.00 25.54 C ATOM 1110 CD GLU A 75 -53.981 -19.829 3.152 1.00 73.13 C ATOM 1111 OE1 GLU A 75 -54.027 -20.898 3.795 1.00 41.51 O ATOM 1112 OE2 GLU A 75 -52.916 -19.322 2.741 1.00 65.41 O1- ATOM 0 H GLU A 75 -57.061 -17.452 2.045 1.00 71.15 H new ATOM 0 HA GLU A 75 -57.669 -18.893 4.358 1.00 23.11 H new ATOM 0 HB2 GLU A 75 -55.211 -17.190 3.799 1.00 42.41 H new ATOM 0 HB3 GLU A 75 -55.312 -18.536 4.916 1.00 42.41 H new ATOM 0 HG2 GLU A 75 -56.073 -19.840 2.703 1.00 25.54 H new ATOM 0 HG3 GLU A 75 -55.179 -18.550 1.925 1.00 25.54 H new ATOM 1119 N GLU A 76 -57.468 -15.644 4.778 1.00 50.31 N ATOM 1120 CA GLU A 76 -57.741 -14.561 5.715 1.00 72.21 C ATOM 1121 C GLU A 76 -59.187 -14.614 6.203 1.00 22.24 C ATOM 1122 O GLU A 76 -59.490 -14.205 7.323 1.00 10.21 O ATOM 1123 CB GLU A 76 -57.463 -13.206 5.059 1.00 62.24 C ATOM 1124 CG GLU A 76 -55.992 -12.965 4.762 1.00 64.30 C ATOM 1125 CD GLU A 76 -55.728 -11.574 4.218 1.00 33.44 C ATOM 1126 OE1 GLU A 76 -56.291 -10.605 4.769 1.00 31.41 O ATOM 1127 OE2 GLU A 76 -54.960 -11.456 3.241 1.00 3.21 O1- ATOM 0 H GLU A 76 -57.249 -15.337 3.830 1.00 50.31 H new ATOM 0 HA GLU A 76 -57.081 -14.684 6.574 1.00 72.21 H new ATOM 0 HB2 GLU A 76 -58.029 -13.139 4.130 1.00 62.24 H new ATOM 0 HB3 GLU A 76 -57.828 -12.414 5.712 1.00 62.24 H new ATOM 0 HG2 GLU A 76 -55.412 -13.111 5.673 1.00 64.30 H new ATOM 0 HG3 GLU A 76 -55.644 -13.705 4.041 1.00 64.30 H new ATOM 1134 N ARG A 77 -60.074 -15.120 5.352 1.00 60.41 N ATOM 1135 CA ARG A 77 -61.486 -15.225 5.695 1.00 75.45 C ATOM 1136 C ARG A 77 -61.683 -16.105 6.926 1.00 5.25 C ATOM 1137 O ARG A 77 -62.385 -15.727 7.865 1.00 54.11 O ATOM 1138 CB ARG A 77 -62.277 -15.797 4.516 1.00 61.41 C ATOM 1139 CG ARG A 77 -62.049 -15.052 3.211 1.00 55.33 C ATOM 1140 CD ARG A 77 -62.922 -15.604 2.095 1.00 52.34 C ATOM 1141 NE ARG A 77 -62.780 -17.050 1.953 1.00 62.33 N ATOM 1142 CZ ARG A 77 -63.502 -17.780 1.111 1.00 34.33 C ATOM 1143 NH1 ARG A 77 -64.412 -17.202 0.339 1.00 23.02 N1+ ATOM 1144 NH2 ARG A 77 -63.314 -19.092 1.039 1.00 22.33 N ATOM 0 H ARG A 77 -59.839 -15.463 4.421 1.00 60.41 H new ATOM 0 HA ARG A 77 -61.854 -14.224 5.922 1.00 75.45 H new ATOM 0 HB2 ARG A 77 -62.004 -16.843 4.380 1.00 61.41 H new ATOM 0 HB3 ARG A 77 -63.340 -15.774 4.757 1.00 61.41 H new ATOM 0 HG2 ARG A 77 -62.264 -13.993 3.353 1.00 55.33 H new ATOM 0 HG3 ARG A 77 -61.000 -15.129 2.925 1.00 55.33 H new ATOM 0 HD2 ARG A 77 -63.965 -15.360 2.297 1.00 52.34 H new ATOM 0 HD3 ARG A 77 -62.658 -15.120 1.155 1.00 52.34 H new ATOM 0 HE ARG A 77 -62.088 -17.526 2.532 1.00 62.33 H new ATOM 0 HH11 ARG A 77 -64.559 -16.194 0.391 1.00 23.02 H new ATOM 0 HH12 ARG A 77 -64.965 -17.765 -0.307 1.00 23.02 H new ATOM 0 HH21 ARG A 77 -62.614 -19.540 1.631 1.00 22.33 H new ATOM 0 HH22 ARG A 77 -63.869 -19.652 0.392 1.00 22.33 H new ATOM 1158 N LEU A 78 -61.059 -17.277 6.915 1.00 4.11 N ATOM 1159 CA LEU A 78 -61.165 -18.211 8.032 1.00 63.30 C ATOM 1160 C LEU A 78 -60.182 -17.849 9.139 1.00 1.51 C ATOM 1161 O LEU A 78 -60.414 -18.143 10.312 1.00 72.43 O ATOM 1162 CB LEU A 78 -60.909 -19.640 7.552 1.00 62.25 C ATOM 1163 CG LEU A 78 -59.558 -19.893 6.885 1.00 4.10 C ATOM 1164 CD1 LEU A 78 -58.484 -20.144 7.932 1.00 71.01 C ATOM 1165 CD2 LEU A 78 -59.650 -21.065 5.919 1.00 24.05 C ATOM 0 H LEU A 78 -60.474 -17.604 6.146 1.00 4.11 H new ATOM 0 HA LEU A 78 -62.176 -18.146 8.435 1.00 63.30 H new ATOM 0 HB2 LEU A 78 -61.001 -20.311 8.406 1.00 62.25 H new ATOM 0 HB3 LEU A 78 -61.695 -19.912 6.848 1.00 62.25 H new ATOM 0 HG LEU A 78 -59.282 -19.003 6.319 1.00 4.10 H new ATOM 0 HD11 LEU A 78 -57.529 -20.322 7.438 1.00 71.01 H new ATOM 0 HD12 LEU A 78 -58.399 -19.273 8.582 1.00 71.01 H new ATOM 0 HD13 LEU A 78 -58.753 -21.017 8.527 1.00 71.01 H new ATOM 0 HD21 LEU A 78 -58.678 -21.230 5.454 1.00 24.05 H new ATOM 0 HD22 LEU A 78 -59.949 -21.961 6.462 1.00 24.05 H new ATOM 0 HD23 LEU A 78 -60.389 -20.844 5.148 1.00 24.05 H new ATOM 1177 N LEU A 79 -59.081 -17.208 8.759 1.00 73.12 N ATOM 1178 CA LEU A 79 -58.061 -16.804 9.722 1.00 25.52 C ATOM 1179 C LEU A 79 -58.655 -15.902 10.798 1.00 13.43 C ATOM 1180 O LEU A 79 -58.142 -15.830 11.915 1.00 45.51 O ATOM 1181 CB LEU A 79 -56.918 -16.081 9.008 1.00 42.42 C ATOM 1182 CG LEU A 79 -55.807 -15.532 9.904 1.00 44.11 C ATOM 1183 CD1 LEU A 79 -54.940 -16.663 10.434 1.00 40.45 C ATOM 1184 CD2 LEU A 79 -54.960 -14.520 9.146 1.00 24.32 C ATOM 0 H LEU A 79 -58.872 -16.957 7.793 1.00 73.12 H new ATOM 0 HA LEU A 79 -57.672 -17.702 10.202 1.00 25.52 H new ATOM 0 HB2 LEU A 79 -56.472 -16.769 8.290 1.00 42.42 H new ATOM 0 HB3 LEU A 79 -57.339 -15.254 8.437 1.00 42.42 H new ATOM 0 HG LEU A 79 -56.269 -15.027 10.752 1.00 44.11 H new ATOM 0 HD11 LEU A 79 -54.155 -16.253 11.069 1.00 40.45 H new ATOM 0 HD12 LEU A 79 -55.554 -17.351 11.015 1.00 40.45 H new ATOM 0 HD13 LEU A 79 -54.488 -17.197 9.598 1.00 40.45 H new ATOM 0 HD21 LEU A 79 -54.175 -14.140 9.800 1.00 24.32 H new ATOM 0 HD22 LEU A 79 -54.509 -15.001 8.278 1.00 24.32 H new ATOM 0 HD23 LEU A 79 -55.589 -13.693 8.817 1.00 24.32 H new ATOM 1196 N HIS A 80 -59.740 -15.214 10.454 1.00 75.01 N ATOM 1197 CA HIS A 80 -60.406 -14.317 11.393 1.00 1.10 C ATOM 1198 C HIS A 80 -60.775 -15.052 12.678 1.00 41.42 C ATOM 1199 O HIS A 80 -60.751 -14.474 13.764 1.00 43.25 O ATOM 1200 CB HIS A 80 -61.660 -13.719 10.756 1.00 42.21 C ATOM 1201 CG HIS A 80 -62.414 -12.799 11.667 1.00 54.33 C ATOM 1202 ND1 HIS A 80 -63.507 -13.200 12.404 1.00 50.24 N ATOM 1203 CD2 HIS A 80 -62.223 -11.490 11.959 1.00 45.33 C ATOM 1204 CE1 HIS A 80 -63.959 -12.177 13.109 1.00 33.42 C ATOM 1205 NE2 HIS A 80 -63.196 -11.128 12.856 1.00 55.02 N ATOM 0 H HIS A 80 -60.176 -15.260 9.533 1.00 75.01 H new ATOM 0 HA HIS A 80 -59.714 -13.512 11.642 1.00 1.10 H new ATOM 0 HB2 HIS A 80 -61.376 -13.173 9.856 1.00 42.21 H new ATOM 0 HB3 HIS A 80 -62.320 -14.528 10.443 1.00 42.21 H new ATOM 0 HD2 HIS A 80 -61.449 -10.851 11.560 1.00 45.33 H new ATOM 0 HE1 HIS A 80 -64.807 -12.195 13.778 1.00 33.42 H new ATOM 0 HE2 HIS A 80 -63.312 -10.199 13.262 1.00 55.02 H new ATOM 1213 N ALA A 81 -61.116 -16.331 12.546 1.00 63.15 N ATOM 1214 CA ALA A 81 -61.489 -17.144 13.696 1.00 52.51 C ATOM 1215 C ALA A 81 -60.261 -17.535 14.513 1.00 71.02 C ATOM 1216 O ALA A 81 -60.364 -17.831 15.704 1.00 50.32 O ATOM 1217 CB ALA A 81 -62.240 -18.387 13.243 1.00 34.12 C ATOM 0 H ALA A 81 -61.141 -16.825 11.654 1.00 63.15 H new ATOM 0 HA ALA A 81 -62.144 -16.549 14.333 1.00 52.51 H new ATOM 0 HB1 ALA A 81 -62.512 -18.985 14.113 1.00 34.12 H new ATOM 0 HB2 ALA A 81 -63.143 -18.092 12.708 1.00 34.12 H new ATOM 0 HB3 ALA A 81 -61.604 -18.976 12.583 1.00 34.12 H new ATOM 1223 N ILE A 82 -59.100 -17.534 13.866 1.00 14.21 N ATOM 1224 CA ILE A 82 -57.854 -17.888 14.533 1.00 11.44 C ATOM 1225 C ILE A 82 -57.344 -16.736 15.391 1.00 25.11 C ATOM 1226 O ILE A 82 -57.208 -16.866 16.608 1.00 24.25 O ATOM 1227 CB ILE A 82 -56.764 -18.279 13.518 1.00 54.10 C ATOM 1228 CG1 ILE A 82 -57.322 -19.270 12.494 1.00 55.43 C ATOM 1229 CG2 ILE A 82 -55.560 -18.872 14.236 1.00 73.32 C ATOM 1230 CD1 ILE A 82 -56.311 -19.696 11.452 1.00 45.00 C ATOM 0 H ILE A 82 -58.997 -17.292 12.881 1.00 14.21 H new ATOM 0 HA ILE A 82 -58.070 -18.745 15.171 1.00 11.44 H new ATOM 0 HB ILE A 82 -56.442 -17.382 12.989 1.00 54.10 H new ATOM 0 HG12 ILE A 82 -57.687 -20.154 13.017 1.00 55.43 H new ATOM 0 HG13 ILE A 82 -58.179 -18.819 11.994 1.00 55.43 H new ATOM 0 HG21 ILE A 82 -54.798 -19.144 13.505 1.00 73.32 H new ATOM 0 HG22 ILE A 82 -55.152 -18.137 14.930 1.00 73.32 H new ATOM 0 HG23 ILE A 82 -55.867 -19.761 14.788 1.00 73.32 H new ATOM 0 HD11 ILE A 82 -56.776 -20.398 10.760 1.00 45.00 H new ATOM 0 HD12 ILE A 82 -55.964 -18.821 10.903 1.00 45.00 H new ATOM 0 HD13 ILE A 82 -55.464 -20.176 11.942 1.00 45.00 H new ATOM 1242 N PHE A 83 -57.062 -15.607 14.750 1.00 72.31 N ATOM 1243 CA PHE A 83 -56.567 -14.430 15.454 1.00 63.53 C ATOM 1244 C PHE A 83 -57.694 -13.738 16.216 1.00 3.44 C ATOM 1245 O PHE A 83 -57.457 -13.053 17.210 1.00 52.42 O ATOM 1246 CB PHE A 83 -55.927 -13.450 14.468 1.00 53.14 C ATOM 1247 CG PHE A 83 -54.427 -13.417 14.545 1.00 4.12 C ATOM 1248 CD1 PHE A 83 -53.666 -14.391 13.920 1.00 53.02 C ATOM 1249 CD2 PHE A 83 -53.778 -12.412 15.243 1.00 44.11 C ATOM 1250 CE1 PHE A 83 -52.286 -14.364 13.989 1.00 32.53 C ATOM 1251 CE2 PHE A 83 -52.398 -12.378 15.315 1.00 2.50 C ATOM 1252 CZ PHE A 83 -51.652 -13.356 14.687 1.00 24.31 C ATOM 0 H PHE A 83 -57.168 -15.482 13.743 1.00 72.31 H new ATOM 0 HA PHE A 83 -55.814 -14.757 16.171 1.00 63.53 H new ATOM 0 HB2 PHE A 83 -56.225 -13.720 13.455 1.00 53.14 H new ATOM 0 HB3 PHE A 83 -56.315 -12.449 14.659 1.00 53.14 H new ATOM 0 HD1 PHE A 83 -54.157 -15.181 13.372 1.00 53.02 H new ATOM 0 HD2 PHE A 83 -54.357 -11.646 15.737 1.00 44.11 H new ATOM 0 HE1 PHE A 83 -51.705 -15.130 13.498 1.00 32.53 H new ATOM 0 HE2 PHE A 83 -51.904 -11.588 15.861 1.00 2.50 H new ATOM 0 HZ PHE A 83 -50.574 -13.332 14.742 1.00 24.31 H new ATOM 1262 N GLY A 84 -58.922 -13.924 15.742 1.00 11.45 N ATOM 1263 CA GLY A 84 -60.067 -13.311 16.389 1.00 21.23 C ATOM 1264 C GLY A 84 -60.160 -11.822 16.117 1.00 34.15 C ATOM 1265 O GLY A 84 -60.737 -11.076 16.907 1.00 1.13 O ATOM 0 H GLY A 84 -59.144 -14.488 14.922 1.00 11.45 H new ATOM 0 HA2 GLY A 84 -60.979 -13.798 16.044 1.00 21.23 H new ATOM 0 HA3 GLY A 84 -60.005 -13.477 17.464 1.00 21.23 H new ATOM 1269 N GLU A 85 -59.589 -11.391 14.997 1.00 71.23 N ATOM 1270 CA GLU A 85 -59.608 -9.981 14.625 1.00 3.24 C ATOM 1271 C GLU A 85 -59.065 -9.784 13.212 1.00 45.31 C ATOM 1272 O GLU A 85 -58.362 -10.642 12.679 1.00 43.43 O ATOM 1273 CB GLU A 85 -58.786 -9.157 15.618 1.00 62.14 C ATOM 1274 CG GLU A 85 -57.295 -9.444 15.559 1.00 3.03 C ATOM 1275 CD GLU A 85 -56.562 -8.980 16.803 1.00 22.13 C ATOM 1276 OE1 GLU A 85 -56.187 -7.790 16.864 1.00 62.10 O ATOM 1277 OE2 GLU A 85 -56.364 -9.808 17.718 1.00 0.10 O1- ATOM 0 H GLU A 85 -59.108 -11.997 14.332 1.00 71.23 H new ATOM 0 HA GLU A 85 -60.643 -9.639 14.650 1.00 3.24 H new ATOM 0 HB2 GLU A 85 -58.952 -8.097 15.423 1.00 62.14 H new ATOM 0 HB3 GLU A 85 -59.146 -9.355 16.628 1.00 62.14 H new ATOM 0 HG2 GLU A 85 -57.140 -10.515 15.429 1.00 3.03 H new ATOM 0 HG3 GLU A 85 -56.868 -8.951 14.685 1.00 3.03 H new ATOM 1284 N LYS A 86 -59.399 -8.647 12.610 1.00 0.31 N ATOM 1285 CA LYS A 86 -58.946 -8.334 11.260 1.00 50.23 C ATOM 1286 C LYS A 86 -57.581 -7.655 11.287 1.00 62.42 C ATOM 1287 O LYS A 86 -57.345 -6.744 12.080 1.00 1.22 O ATOM 1288 CB LYS A 86 -59.961 -7.430 10.557 1.00 52.31 C ATOM 1289 CG LYS A 86 -61.258 -8.135 10.199 1.00 22.44 C ATOM 1290 CD LYS A 86 -62.208 -7.213 9.453 1.00 14.40 C ATOM 1291 CE LYS A 86 -62.990 -6.326 10.411 1.00 71.34 C ATOM 1292 NZ LYS A 86 -64.227 -6.996 10.901 1.00 0.31 N1+ ATOM 0 H LYS A 86 -59.982 -7.927 13.036 1.00 0.31 H new ATOM 0 HA LYS A 86 -58.856 -9.270 10.708 1.00 50.23 H new ATOM 0 HB2 LYS A 86 -60.185 -6.580 11.201 1.00 52.31 H new ATOM 0 HB3 LYS A 86 -59.511 -7.031 9.648 1.00 52.31 H new ATOM 0 HG2 LYS A 86 -61.040 -9.009 9.585 1.00 22.44 H new ATOM 0 HG3 LYS A 86 -61.739 -8.496 11.108 1.00 22.44 H new ATOM 0 HD2 LYS A 86 -61.643 -6.591 8.758 1.00 14.40 H new ATOM 0 HD3 LYS A 86 -62.901 -7.807 8.857 1.00 14.40 H new ATOM 0 HE2 LYS A 86 -62.359 -6.063 11.260 1.00 71.34 H new ATOM 0 HE3 LYS A 86 -63.255 -5.395 9.910 1.00 71.34 H new ATOM 0 HZ1 LYS A 86 -64.732 -6.360 11.551 1.00 0.31 H new ATOM 0 HZ2 LYS A 86 -64.841 -7.225 10.093 1.00 0.31 H new ATOM 0 HZ3 LYS A 86 -63.973 -7.872 11.401 1.00 0.31 H new ATOM 1306 N ALA A 87 -56.684 -8.106 10.416 1.00 21.22 N ATOM 1307 CA ALA A 87 -55.342 -7.542 10.339 1.00 63.11 C ATOM 1308 C ALA A 87 -55.136 -6.796 9.025 1.00 4.23 C ATOM 1309 O ALA A 87 -55.377 -7.340 7.947 1.00 21.02 O ATOM 1310 CB ALA A 87 -54.298 -8.637 10.497 1.00 2.10 C ATOM 0 H ALA A 87 -56.863 -8.861 9.754 1.00 21.22 H new ATOM 0 HA ALA A 87 -55.227 -6.828 11.154 1.00 63.11 H new ATOM 0 HB1 ALA A 87 -53.301 -8.201 10.437 1.00 2.10 H new ATOM 0 HB2 ALA A 87 -54.424 -9.123 11.464 1.00 2.10 H new ATOM 0 HB3 ALA A 87 -54.420 -9.373 9.703 1.00 2.10 H new ATOM 1316 N ARG A 88 -54.687 -5.549 9.122 1.00 51.52 N ATOM 1317 CA ARG A 88 -54.450 -4.729 7.940 1.00 72.01 C ATOM 1318 C ARG A 88 -53.422 -5.383 7.021 1.00 43.43 C ATOM 1319 O ARG A 88 -52.383 -5.860 7.478 1.00 52.35 O ATOM 1320 CB ARG A 88 -53.971 -3.335 8.348 1.00 64.15 C ATOM 1321 CG ARG A 88 -55.100 -2.384 8.710 1.00 10.34 C ATOM 1322 CD ARG A 88 -55.969 -2.066 7.503 1.00 52.23 C ATOM 1323 NE ARG A 88 -56.648 -0.780 7.640 1.00 54.25 N ATOM 1324 CZ ARG A 88 -57.698 -0.584 8.430 1.00 53.44 C ATOM 1325 NH1 ARG A 88 -58.187 -1.585 9.150 1.00 14.44 N1+ ATOM 1326 NH2 ARG A 88 -58.261 0.615 8.501 1.00 23.21 N ATOM 0 H ARG A 88 -54.480 -5.085 10.006 1.00 51.52 H new ATOM 0 HA ARG A 88 -55.391 -4.638 7.397 1.00 72.01 H new ATOM 0 HB2 ARG A 88 -53.297 -3.427 9.200 1.00 64.15 H new ATOM 0 HB3 ARG A 88 -53.393 -2.905 7.530 1.00 64.15 H new ATOM 0 HG2 ARG A 88 -55.713 -2.827 9.495 1.00 10.34 H new ATOM 0 HG3 ARG A 88 -54.684 -1.461 9.114 1.00 10.34 H new ATOM 0 HD2 ARG A 88 -55.352 -2.056 6.605 1.00 52.23 H new ATOM 0 HD3 ARG A 88 -56.710 -2.855 7.372 1.00 52.23 H new ATOM 0 HE ARG A 88 -56.297 0.011 7.100 1.00 54.25 H new ATOM 0 HH11 ARG A 88 -57.757 -2.508 9.098 1.00 14.44 H new ATOM 0 HH12 ARG A 88 -58.993 -1.431 9.756 1.00 14.44 H new ATOM 0 HH21 ARG A 88 -57.888 1.387 7.949 1.00 23.21 H new ATOM 0 HH22 ARG A 88 -59.067 0.765 9.108 1.00 23.21 H new ATOM 1340 N GLU A 89 -53.720 -5.401 5.726 1.00 51.11 N ATOM 1341 CA GLU A 89 -52.822 -5.998 4.744 1.00 3.21 C ATOM 1342 C GLU A 89 -52.322 -4.949 3.756 1.00 11.30 C ATOM 1343 O GLU A 89 -53.105 -4.169 3.212 1.00 53.52 O ATOM 1344 CB GLU A 89 -53.530 -7.128 3.993 1.00 74.52 C ATOM 1345 CG GLU A 89 -53.375 -8.488 4.651 1.00 45.43 C ATOM 1346 CD GLU A 89 -52.090 -9.186 4.251 1.00 12.21 C ATOM 1347 OE1 GLU A 89 -51.595 -8.927 3.134 1.00 23.33 O ATOM 1348 OE2 GLU A 89 -51.577 -9.992 5.055 1.00 4.44 O1- ATOM 0 H GLU A 89 -54.576 -5.009 5.332 1.00 51.11 H new ATOM 0 HA GLU A 89 -51.964 -6.408 5.276 1.00 3.21 H new ATOM 0 HB2 GLU A 89 -54.591 -6.891 3.914 1.00 74.52 H new ATOM 0 HB3 GLU A 89 -53.138 -7.179 2.977 1.00 74.52 H new ATOM 0 HG2 GLU A 89 -53.397 -8.368 5.734 1.00 45.43 H new ATOM 0 HG3 GLU A 89 -54.224 -9.116 4.383 1.00 45.43 H new ATOM 1355 N VAL A 90 -51.013 -4.936 3.527 1.00 14.00 N ATOM 1356 CA VAL A 90 -50.408 -3.984 2.604 1.00 43.15 C ATOM 1357 C VAL A 90 -49.361 -4.660 1.724 1.00 34.22 C ATOM 1358 O VAL A 90 -49.096 -5.854 1.866 1.00 14.45 O ATOM 1359 CB VAL A 90 -49.749 -2.813 3.357 1.00 61.31 C ATOM 1360 CG1 VAL A 90 -50.805 -1.842 3.864 1.00 61.42 C ATOM 1361 CG2 VAL A 90 -48.895 -3.331 4.504 1.00 63.51 C ATOM 0 H VAL A 90 -50.351 -5.574 3.968 1.00 14.00 H new ATOM 0 HA VAL A 90 -51.212 -3.598 1.977 1.00 43.15 H new ATOM 0 HB VAL A 90 -49.100 -2.277 2.664 1.00 61.31 H new ATOM 0 HG11 VAL A 90 -50.321 -1.021 4.393 1.00 61.42 H new ATOM 0 HG12 VAL A 90 -51.370 -1.446 3.020 1.00 61.42 H new ATOM 0 HG13 VAL A 90 -51.482 -2.362 4.542 1.00 61.42 H new ATOM 0 HG21 VAL A 90 -48.437 -2.490 5.025 1.00 63.51 H new ATOM 0 HG22 VAL A 90 -49.520 -3.892 5.199 1.00 63.51 H new ATOM 0 HG23 VAL A 90 -48.115 -3.983 4.111 1.00 63.51 H new ATOM 1371 N ARG A 91 -48.772 -3.889 0.817 1.00 25.45 N ATOM 1372 CA ARG A 91 -47.754 -4.414 -0.087 1.00 3.45 C ATOM 1373 C ARG A 91 -46.379 -3.855 0.260 1.00 15.52 C ATOM 1374 O ARG A 91 -46.264 -2.784 0.858 1.00 10.53 O ATOM 1375 CB ARG A 91 -48.105 -4.073 -1.536 1.00 35.24 C ATOM 1376 CG ARG A 91 -47.177 -4.714 -2.555 1.00 1.41 C ATOM 1377 CD ARG A 91 -47.612 -4.405 -3.978 1.00 62.05 C ATOM 1378 NE ARG A 91 -48.421 -5.479 -4.548 1.00 32.31 N ATOM 1379 CZ ARG A 91 -48.880 -5.472 -5.794 1.00 62.40 C ATOM 1380 NH1 ARG A 91 -48.609 -4.452 -6.597 1.00 60.23 N1+ ATOM 1381 NH2 ARG A 91 -49.610 -6.486 -6.241 1.00 63.42 N ATOM 0 H ARG A 91 -48.981 -2.899 0.688 1.00 25.45 H new ATOM 0 HA ARG A 91 -47.725 -5.498 0.027 1.00 3.45 H new ATOM 0 HB2 ARG A 91 -49.128 -4.392 -1.738 1.00 35.24 H new ATOM 0 HB3 ARG A 91 -48.077 -2.991 -1.662 1.00 35.24 H new ATOM 0 HG2 ARG A 91 -46.160 -4.355 -2.399 1.00 1.41 H new ATOM 0 HG3 ARG A 91 -47.161 -5.793 -2.405 1.00 1.41 H new ATOM 0 HD2 ARG A 91 -48.183 -3.476 -3.989 1.00 62.05 H new ATOM 0 HD3 ARG A 91 -46.731 -4.245 -4.600 1.00 62.05 H new ATOM 0 HE ARG A 91 -48.646 -6.279 -3.956 1.00 32.31 H new ATOM 0 HH11 ARG A 91 -48.047 -3.671 -6.258 1.00 60.23 H new ATOM 0 HH12 ARG A 91 -48.962 -4.448 -7.554 1.00 60.23 H new ATOM 0 HH21 ARG A 91 -49.820 -7.273 -5.627 1.00 63.42 H new ATOM 0 HH22 ARG A 91 -49.961 -6.478 -7.199 1.00 63.42 H new ATOM 1395 N ASP A 92 -45.336 -4.585 -0.118 1.00 43.34 N ATOM 1396 CA ASP A 92 -43.966 -4.162 0.152 1.00 22.20 C ATOM 1397 C ASP A 92 -43.239 -3.817 -1.143 1.00 4.24 C ATOM 1398 O ASP A 92 -42.939 -4.693 -1.954 1.00 43.15 O ATOM 1399 CB ASP A 92 -43.208 -5.261 0.899 1.00 42.30 C ATOM 1400 CG ASP A 92 -43.616 -6.651 0.453 1.00 10.14 C ATOM 1401 OD1 ASP A 92 -43.069 -7.135 -0.560 1.00 24.00 O ATOM 1402 OD2 ASP A 92 -44.483 -7.257 1.118 1.00 53.42 O1- ATOM 0 H ASP A 92 -45.413 -5.474 -0.613 1.00 43.34 H new ATOM 0 HA ASP A 92 -44.004 -3.269 0.776 1.00 22.20 H new ATOM 0 HB2 ASP A 92 -42.137 -5.132 0.741 1.00 42.30 H new ATOM 0 HB3 ASP A 92 -43.387 -5.159 1.969 1.00 42.30 H new ATOM 1407 N THR A 93 -42.959 -2.531 -1.334 1.00 3.24 N ATOM 1408 CA THR A 93 -42.269 -2.067 -2.531 1.00 15.11 C ATOM 1409 C THR A 93 -40.874 -1.553 -2.197 1.00 15.23 C ATOM 1410 O THR A 93 -40.242 -0.874 -3.007 1.00 31.43 O ATOM 1411 CB THR A 93 -43.060 -0.952 -3.239 1.00 51.14 C ATOM 1412 OG1 THR A 93 -42.952 0.270 -2.500 1.00 20.55 O ATOM 1413 CG2 THR A 93 -44.526 -1.334 -3.383 1.00 32.22 C ATOM 0 H THR A 93 -43.200 -1.792 -0.674 1.00 3.24 H new ATOM 0 HA THR A 93 -42.186 -2.923 -3.200 1.00 15.11 H new ATOM 0 HB THR A 93 -42.637 -0.814 -4.234 1.00 51.14 H new ATOM 0 HG1 THR A 93 -42.881 0.069 -1.543 1.00 20.55 H new ATOM 0 HG21 THR A 93 -45.064 -0.530 -3.886 1.00 32.22 H new ATOM 0 HG22 THR A 93 -44.608 -2.249 -3.970 1.00 32.22 H new ATOM 0 HG23 THR A 93 -44.958 -1.497 -2.396 1.00 32.22 H new ATOM 1421 N SER A 94 -40.398 -1.880 -1.001 1.00 41.23 N ATOM 1422 CA SER A 94 -39.077 -1.448 -0.558 1.00 71.52 C ATOM 1423 C SER A 94 -37.986 -2.035 -1.450 1.00 43.33 C ATOM 1424 O SER A 94 -38.246 -2.919 -2.268 1.00 3.02 O ATOM 1425 CB SER A 94 -38.841 -1.862 0.895 1.00 20.52 C ATOM 1426 OG SER A 94 -39.731 -2.895 1.282 1.00 2.23 O ATOM 0 H SER A 94 -40.907 -2.443 -0.320 1.00 41.23 H new ATOM 0 HA SER A 94 -39.035 -0.361 -0.629 1.00 71.52 H new ATOM 0 HB2 SER A 94 -37.812 -2.199 1.018 1.00 20.52 H new ATOM 0 HB3 SER A 94 -38.974 -1.000 1.548 1.00 20.52 H new ATOM 0 HG SER A 94 -39.491 -3.724 0.819 1.00 2.23 H new ATOM 1432 N LEU A 95 -36.766 -1.538 -1.284 1.00 11.13 N ATOM 1433 CA LEU A 95 -35.634 -2.013 -2.074 1.00 34.44 C ATOM 1434 C LEU A 95 -35.045 -3.283 -1.471 1.00 62.22 C ATOM 1435 O LEU A 95 -35.105 -3.494 -0.259 1.00 61.44 O ATOM 1436 CB LEU A 95 -34.558 -0.929 -2.160 1.00 53.31 C ATOM 1437 CG LEU A 95 -33.700 -0.733 -0.909 1.00 14.14 C ATOM 1438 CD1 LEU A 95 -32.479 -1.639 -0.953 1.00 71.33 C ATOM 1439 CD2 LEU A 95 -33.281 0.723 -0.772 1.00 61.44 C ATOM 0 H LEU A 95 -36.534 -0.807 -0.611 1.00 11.13 H new ATOM 0 HA LEU A 95 -35.992 -2.242 -3.078 1.00 34.44 H new ATOM 0 HB2 LEU A 95 -33.898 -1.166 -2.995 1.00 53.31 H new ATOM 0 HB3 LEU A 95 -35.043 0.018 -2.395 1.00 53.31 H new ATOM 0 HG LEU A 95 -34.296 -1.002 -0.037 1.00 14.14 H new ATOM 0 HD11 LEU A 95 -31.880 -1.486 -0.055 1.00 71.33 H new ATOM 0 HD12 LEU A 95 -32.800 -2.680 -1.003 1.00 71.33 H new ATOM 0 HD13 LEU A 95 -31.881 -1.401 -1.833 1.00 71.33 H new ATOM 0 HD21 LEU A 95 -32.671 0.843 0.123 1.00 61.44 H new ATOM 0 HD22 LEU A 95 -32.703 1.019 -1.647 1.00 61.44 H new ATOM 0 HD23 LEU A 95 -34.168 1.351 -0.694 1.00 61.44 H new ATOM 1451 N ARG A 96 -34.473 -4.128 -2.324 1.00 22.20 N ATOM 1452 CA ARG A 96 -33.872 -5.378 -1.876 1.00 2.41 C ATOM 1453 C ARG A 96 -32.365 -5.222 -1.697 1.00 14.45 C ATOM 1454 O ARG A 96 -31.634 -4.996 -2.661 1.00 63.30 O ATOM 1455 CB ARG A 96 -34.165 -6.497 -2.877 1.00 44.25 C ATOM 1456 CG ARG A 96 -33.895 -7.889 -2.329 1.00 63.41 C ATOM 1457 CD ARG A 96 -32.480 -8.348 -2.646 1.00 52.41 C ATOM 1458 NE ARG A 96 -32.416 -9.097 -3.899 1.00 50.34 N ATOM 1459 CZ ARG A 96 -31.278 -9.480 -4.468 1.00 2.41 C ATOM 1460 NH1 ARG A 96 -30.117 -9.186 -3.900 1.00 13.23 N1+ ATOM 1461 NH2 ARG A 96 -31.301 -10.158 -5.607 1.00 2.33 N ATOM 0 H ARG A 96 -34.414 -3.969 -3.330 1.00 22.20 H new ATOM 0 HA ARG A 96 -34.310 -5.639 -0.913 1.00 2.41 H new ATOM 0 HB2 ARG A 96 -35.208 -6.433 -3.186 1.00 44.25 H new ATOM 0 HB3 ARG A 96 -33.559 -6.343 -3.770 1.00 44.25 H new ATOM 0 HG2 ARG A 96 -34.046 -7.892 -1.250 1.00 63.41 H new ATOM 0 HG3 ARG A 96 -34.611 -8.593 -2.753 1.00 63.41 H new ATOM 0 HD2 ARG A 96 -31.823 -7.481 -2.708 1.00 52.41 H new ATOM 0 HD3 ARG A 96 -32.110 -8.971 -1.832 1.00 52.41 H new ATOM 0 HE ARG A 96 -33.292 -9.339 -4.362 1.00 50.34 H new ATOM 0 HH11 ARG A 96 -30.096 -8.664 -3.024 1.00 13.23 H new ATOM 0 HH12 ARG A 96 -29.245 -9.481 -4.339 1.00 13.23 H new ATOM 0 HH21 ARG A 96 -32.193 -10.386 -6.047 1.00 2.33 H new ATOM 0 HH22 ARG A 96 -30.427 -10.452 -6.043 1.00 2.33 H new ATOM 1475 N VAL A 97 -31.906 -5.346 -0.455 1.00 32.32 N ATOM 1476 CA VAL A 97 -30.485 -5.220 -0.149 1.00 32.11 C ATOM 1477 C VAL A 97 -29.770 -6.556 -0.303 1.00 2.42 C ATOM 1478 O VAL A 97 -30.257 -7.603 0.124 1.00 4.01 O ATOM 1479 CB VAL A 97 -30.265 -4.693 1.282 1.00 24.41 C ATOM 1480 CG1 VAL A 97 -28.957 -5.225 1.851 1.00 40.42 C ATOM 1481 CG2 VAL A 97 -30.283 -3.172 1.297 1.00 52.15 C ATOM 0 H VAL A 97 -32.497 -5.533 0.355 1.00 32.32 H new ATOM 0 HA VAL A 97 -30.069 -4.506 -0.859 1.00 32.11 H new ATOM 0 HB VAL A 97 -31.080 -5.050 1.912 1.00 24.41 H new ATOM 0 HG11 VAL A 97 -28.818 -4.843 2.862 1.00 40.42 H new ATOM 0 HG12 VAL A 97 -28.987 -6.314 1.876 1.00 40.42 H new ATOM 0 HG13 VAL A 97 -28.128 -4.899 1.223 1.00 40.42 H new ATOM 0 HG21 VAL A 97 -30.126 -2.816 2.315 1.00 52.15 H new ATOM 0 HG22 VAL A 97 -29.489 -2.792 0.654 1.00 52.15 H new ATOM 0 HG23 VAL A 97 -31.247 -2.816 0.933 1.00 52.15 H new ATOM 1491 N PRO A 98 -28.584 -6.524 -0.928 1.00 12.13 N ATOM 1492 CA PRO A 98 -27.774 -7.725 -1.153 1.00 3.14 C ATOM 1493 C PRO A 98 -27.187 -8.278 0.141 1.00 31.21 C ATOM 1494 O PRO A 98 -27.059 -7.560 1.134 1.00 54.31 O ATOM 1495 CB PRO A 98 -26.657 -7.232 -2.078 1.00 5.32 C ATOM 1496 CG PRO A 98 -26.549 -5.773 -1.797 1.00 31.15 C ATOM 1497 CD PRO A 98 -27.941 -5.312 -1.463 1.00 23.22 C ATOM 0 HA PRO A 98 -28.363 -8.541 -1.571 1.00 3.14 H new ATOM 0 HB2 PRO A 98 -25.718 -7.745 -1.873 1.00 5.32 H new ATOM 0 HB3 PRO A 98 -26.899 -7.417 -3.125 1.00 5.32 H new ATOM 0 HG2 PRO A 98 -25.866 -5.585 -0.969 1.00 31.15 H new ATOM 0 HG3 PRO A 98 -26.157 -5.237 -2.661 1.00 31.15 H new ATOM 0 HD2 PRO A 98 -27.932 -4.505 -0.730 1.00 23.22 H new ATOM 0 HD3 PRO A 98 -28.462 -4.936 -2.344 1.00 23.22 H new ATOM 1505 N HIS A 99 -26.831 -9.559 0.124 1.00 2.03 N ATOM 1506 CA HIS A 99 -26.255 -10.209 1.297 1.00 40.20 C ATOM 1507 C HIS A 99 -24.898 -9.605 1.641 1.00 23.32 C ATOM 1508 O HIS A 99 -24.019 -9.500 0.787 1.00 3.54 O ATOM 1509 CB HIS A 99 -26.112 -11.711 1.055 1.00 10.22 C ATOM 1510 CG HIS A 99 -25.390 -12.047 -0.213 1.00 63.35 C ATOM 1511 ND1 HIS A 99 -24.019 -12.169 -0.289 1.00 22.30 N ATOM 1512 CD2 HIS A 99 -25.857 -12.289 -1.461 1.00 12.11 C ATOM 1513 CE1 HIS A 99 -23.673 -12.470 -1.528 1.00 51.45 C ATOM 1514 NE2 HIS A 99 -24.770 -12.549 -2.259 1.00 54.33 N ATOM 0 H HIS A 99 -26.931 -10.167 -0.689 1.00 2.03 H new ATOM 0 HA HIS A 99 -26.928 -10.047 2.139 1.00 40.20 H new ATOM 0 HB2 HIS A 99 -25.580 -12.157 1.895 1.00 10.22 H new ATOM 0 HB3 HIS A 99 -27.104 -12.163 1.029 1.00 10.22 H new ATOM 0 HD2 HIS A 99 -26.892 -12.279 -1.771 1.00 12.11 H new ATOM 0 HE1 HIS A 99 -22.665 -12.625 -1.883 1.00 51.45 H new ATOM 0 HE2 HIS A 99 -24.804 -12.768 -3.255 1.00 54.33 H new ATOM 1522 N GLY A 100 -24.733 -9.208 2.900 1.00 52.11 N ATOM 1523 CA GLY A 100 -23.480 -8.618 3.335 1.00 34.40 C ATOM 1524 C GLY A 100 -23.414 -7.130 3.061 1.00 32.53 C ATOM 1525 O GLY A 100 -23.092 -6.342 3.949 1.00 13.43 O ATOM 0 H GLY A 100 -25.445 -9.285 3.626 1.00 52.11 H new ATOM 0 HA2 GLY A 100 -23.351 -8.794 4.403 1.00 34.40 H new ATOM 0 HA3 GLY A 100 -22.653 -9.115 2.828 1.00 34.40 H new ATOM 1529 N GLY A 101 -23.719 -6.742 1.827 1.00 3.44 N ATOM 1530 CA GLY A 101 -23.685 -5.338 1.459 1.00 63.32 C ATOM 1531 C GLY A 101 -22.317 -4.898 0.977 1.00 13.11 C ATOM 1532 O GLY A 101 -22.206 -4.063 0.080 1.00 41.12 O ATOM 0 H GLY A 101 -23.989 -7.375 1.074 1.00 3.44 H new ATOM 0 HA2 GLY A 101 -24.420 -5.153 0.675 1.00 63.32 H new ATOM 0 HA3 GLY A 101 -23.976 -4.733 2.318 1.00 63.32 H new ATOM 1536 N GLY A 102 -21.271 -5.461 1.574 1.00 35.30 N ATOM 1537 CA GLY A 102 -19.917 -5.108 1.188 1.00 42.33 C ATOM 1538 C GLY A 102 -19.355 -3.972 2.019 1.00 11.11 C ATOM 1539 O GLY A 102 -18.174 -3.971 2.363 1.00 65.03 O ATOM 0 H GLY A 102 -21.337 -6.155 2.318 1.00 35.30 H new ATOM 0 HA2 GLY A 102 -19.274 -5.982 1.291 1.00 42.33 H new ATOM 0 HA3 GLY A 102 -19.905 -4.825 0.135 1.00 42.33 H new ATOM 1543 N GLY A 103 -20.203 -3.000 2.341 1.00 42.51 N ATOM 1544 CA GLY A 103 -19.764 -1.866 3.133 1.00 70.24 C ATOM 1545 C GLY A 103 -20.716 -1.550 4.270 1.00 14.31 C ATOM 1546 O GLY A 103 -21.479 -2.411 4.707 1.00 75.45 O ATOM 0 H GLY A 103 -21.185 -2.978 2.068 1.00 42.51 H new ATOM 0 HA2 GLY A 103 -18.774 -2.072 3.539 1.00 70.24 H new ATOM 0 HA3 GLY A 103 -19.669 -0.992 2.489 1.00 70.24 H new ATOM 1550 N ILE A 104 -20.671 -0.312 4.751 1.00 10.42 N ATOM 1551 CA ILE A 104 -21.535 0.115 5.843 1.00 73.30 C ATOM 1552 C ILE A 104 -22.158 1.477 5.552 1.00 61.32 C ATOM 1553 O ILE A 104 -21.556 2.314 4.880 1.00 74.25 O ATOM 1554 CB ILE A 104 -20.764 0.190 7.174 1.00 31.42 C ATOM 1555 CG1 ILE A 104 -20.037 -1.129 7.443 1.00 73.31 C ATOM 1556 CG2 ILE A 104 -21.713 0.519 8.318 1.00 75.13 C ATOM 1557 CD1 ILE A 104 -19.110 -1.077 8.637 1.00 42.35 C ATOM 0 H ILE A 104 -20.045 0.413 4.401 1.00 10.42 H new ATOM 0 HA ILE A 104 -22.324 -0.631 5.931 1.00 73.30 H new ATOM 0 HB ILE A 104 -20.022 0.985 7.102 1.00 31.42 H new ATOM 0 HG12 ILE A 104 -20.775 -1.915 7.601 1.00 73.31 H new ATOM 0 HG13 ILE A 104 -19.462 -1.404 6.559 1.00 73.31 H new ATOM 0 HG21 ILE A 104 -21.153 0.569 9.252 1.00 75.13 H new ATOM 0 HG22 ILE A 104 -22.190 1.481 8.130 1.00 75.13 H new ATOM 0 HG23 ILE A 104 -22.476 -0.256 8.393 1.00 75.13 H new ATOM 0 HD11 ILE A 104 -18.629 -2.047 8.767 1.00 42.35 H new ATOM 0 HD12 ILE A 104 -18.349 -0.314 8.474 1.00 42.35 H new ATOM 0 HD13 ILE A 104 -19.683 -0.833 9.532 1.00 42.35 H new ATOM 1569 N ILE A 105 -23.365 1.691 6.065 1.00 72.41 N ATOM 1570 CA ILE A 105 -24.068 2.952 5.862 1.00 11.13 C ATOM 1571 C ILE A 105 -23.334 4.104 6.540 1.00 43.31 C ATOM 1572 O ILE A 105 -23.420 4.281 7.755 1.00 71.54 O ATOM 1573 CB ILE A 105 -25.508 2.886 6.403 1.00 21.24 C ATOM 1574 CG1 ILE A 105 -26.226 1.650 5.856 1.00 33.43 C ATOM 1575 CG2 ILE A 105 -26.269 4.153 6.037 1.00 13.51 C ATOM 1576 CD1 ILE A 105 -26.413 1.675 4.357 1.00 11.11 C ATOM 0 H ILE A 105 -23.876 1.008 6.624 1.00 72.41 H new ATOM 0 HA ILE A 105 -24.100 3.127 4.787 1.00 11.13 H new ATOM 0 HB ILE A 105 -25.469 2.809 7.490 1.00 21.24 H new ATOM 0 HG12 ILE A 105 -25.659 0.760 6.128 1.00 33.43 H new ATOM 0 HG13 ILE A 105 -27.202 1.565 6.334 1.00 33.43 H new ATOM 0 HG21 ILE A 105 -27.285 4.092 6.426 1.00 13.51 H new ATOM 0 HG22 ILE A 105 -25.766 5.018 6.470 1.00 13.51 H new ATOM 0 HG23 ILE A 105 -26.301 4.258 4.953 1.00 13.51 H new ATOM 0 HD11 ILE A 105 -26.928 0.769 4.039 1.00 11.11 H new ATOM 0 HD12 ILE A 105 -27.006 2.546 4.079 1.00 11.11 H new ATOM 0 HD13 ILE A 105 -25.439 1.728 3.870 1.00 11.11 H new ATOM 1588 N HIS A 106 -22.613 4.888 5.744 1.00 44.11 N ATOM 1589 CA HIS A 106 -21.866 6.027 6.266 1.00 34.34 C ATOM 1590 C HIS A 106 -22.562 7.340 5.918 1.00 52.02 C ATOM 1591 O HIS A 106 -22.363 8.355 6.585 1.00 2.51 O ATOM 1592 CB HIS A 106 -20.442 6.028 5.709 1.00 22.33 C ATOM 1593 CG HIS A 106 -19.463 6.765 6.569 1.00 1.11 C ATOM 1594 ND1 HIS A 106 -18.937 7.994 6.228 1.00 2.12 N ATOM 1595 CD2 HIS A 106 -18.915 6.442 7.763 1.00 44.21 C ATOM 1596 CE1 HIS A 106 -18.107 8.394 7.175 1.00 70.15 C ATOM 1597 NE2 HIS A 106 -18.075 7.470 8.118 1.00 4.01 N ATOM 0 H HIS A 106 -22.530 4.755 4.736 1.00 44.11 H new ATOM 0 HA HIS A 106 -21.824 5.936 7.351 1.00 34.34 H new ATOM 0 HB2 HIS A 106 -20.106 4.998 5.591 1.00 22.33 H new ATOM 0 HB3 HIS A 106 -20.450 6.476 4.715 1.00 22.33 H new ATOM 0 HD2 HIS A 106 -19.103 5.543 8.332 1.00 44.21 H new ATOM 0 HE1 HIS A 106 -17.550 9.319 7.177 1.00 70.15 H new ATOM 0 HE2 HIS A 106 -17.517 7.512 8.971 1.00 4.01 H new ATOM 1605 N ASP A 107 -23.378 7.311 4.871 1.00 2.53 N ATOM 1606 CA ASP A 107 -24.104 8.498 4.434 1.00 2.33 C ATOM 1607 C ASP A 107 -25.415 8.114 3.754 1.00 53.53 C ATOM 1608 O ASP A 107 -25.529 7.038 3.166 1.00 42.21 O ATOM 1609 CB ASP A 107 -23.244 9.326 3.480 1.00 13.01 C ATOM 1610 CG ASP A 107 -23.300 10.810 3.789 1.00 51.05 C ATOM 1611 OD1 ASP A 107 -22.555 11.258 4.685 1.00 40.31 O ATOM 1612 OD2 ASP A 107 -24.090 11.522 3.134 1.00 71.12 O1- ATOM 0 H ASP A 107 -23.554 6.478 4.309 1.00 2.53 H new ATOM 0 HA ASP A 107 -24.334 9.097 5.315 1.00 2.33 H new ATOM 0 HB2 ASP A 107 -22.210 8.985 3.538 1.00 13.01 H new ATOM 0 HB3 ASP A 107 -23.578 9.158 2.456 1.00 13.01 H new ATOM 1617 N VAL A 108 -26.402 9.000 3.840 1.00 40.23 N ATOM 1618 CA VAL A 108 -27.705 8.755 3.233 1.00 11.03 C ATOM 1619 C VAL A 108 -28.374 10.061 2.819 1.00 62.13 C ATOM 1620 O VAL A 108 -28.544 10.968 3.634 1.00 23.34 O ATOM 1621 CB VAL A 108 -28.637 7.993 4.194 1.00 20.20 C ATOM 1622 CG1 VAL A 108 -30.012 7.807 3.568 1.00 12.41 C ATOM 1623 CG2 VAL A 108 -28.029 6.652 4.574 1.00 33.40 C ATOM 0 H VAL A 108 -26.324 9.894 4.324 1.00 40.23 H new ATOM 0 HA VAL A 108 -27.532 8.144 2.347 1.00 11.03 H new ATOM 0 HB VAL A 108 -28.755 8.583 5.103 1.00 20.20 H new ATOM 0 HG11 VAL A 108 -30.657 7.267 4.261 1.00 12.41 H new ATOM 0 HG12 VAL A 108 -30.448 8.782 3.351 1.00 12.41 H new ATOM 0 HG13 VAL A 108 -29.917 7.239 2.643 1.00 12.41 H new ATOM 0 HG21 VAL A 108 -28.701 6.127 5.253 1.00 33.40 H new ATOM 0 HG22 VAL A 108 -27.880 6.052 3.676 1.00 33.40 H new ATOM 0 HG23 VAL A 108 -27.070 6.814 5.066 1.00 33.40 H new ATOM 1633 N LYS A 109 -28.754 10.148 1.549 1.00 73.05 N ATOM 1634 CA LYS A 109 -29.406 11.343 1.027 1.00 64.22 C ATOM 1635 C LYS A 109 -30.914 11.138 0.923 1.00 55.52 C ATOM 1636 O LYS A 109 -31.378 10.113 0.423 1.00 53.24 O ATOM 1637 CB LYS A 109 -28.835 11.702 -0.346 1.00 5.12 C ATOM 1638 CG LYS A 109 -27.709 12.720 -0.289 1.00 4.01 C ATOM 1639 CD LYS A 109 -28.220 14.132 -0.520 1.00 43.23 C ATOM 1640 CE LYS A 109 -27.272 15.171 0.058 1.00 25.43 C ATOM 1641 NZ LYS A 109 -26.069 15.361 -0.799 1.00 11.23 N1+ ATOM 0 H LYS A 109 -28.622 9.405 0.862 1.00 73.05 H new ATOM 0 HA LYS A 109 -29.214 12.163 1.719 1.00 64.22 H new ATOM 0 HB2 LYS A 109 -28.469 10.795 -0.827 1.00 5.12 H new ATOM 0 HB3 LYS A 109 -29.636 12.094 -0.972 1.00 5.12 H new ATOM 0 HG2 LYS A 109 -27.217 12.665 0.682 1.00 4.01 H new ATOM 0 HG3 LYS A 109 -26.959 12.476 -1.041 1.00 4.01 H new ATOM 0 HD2 LYS A 109 -28.343 14.305 -1.589 1.00 43.23 H new ATOM 0 HD3 LYS A 109 -29.204 14.243 -0.064 1.00 43.23 H new ATOM 0 HE2 LYS A 109 -27.796 16.121 0.165 1.00 25.43 H new ATOM 0 HE3 LYS A 109 -26.962 14.864 1.057 1.00 25.43 H new ATOM 0 HZ1 LYS A 109 -25.448 16.077 -0.371 1.00 11.23 H new ATOM 0 HZ2 LYS A 109 -25.555 14.461 -0.881 1.00 11.23 H new ATOM 0 HZ3 LYS A 109 -26.363 15.679 -1.745 1.00 11.23 H new ATOM 1655 N VAL A 110 -31.675 12.119 1.399 1.00 33.40 N ATOM 1656 CA VAL A 110 -33.130 12.047 1.358 1.00 62.24 C ATOM 1657 C VAL A 110 -33.736 13.387 0.958 1.00 62.33 C ATOM 1658 O VAL A 110 -33.523 14.400 1.624 1.00 72.31 O ATOM 1659 CB VAL A 110 -33.710 11.619 2.719 1.00 4.52 C ATOM 1660 CG1 VAL A 110 -33.219 12.545 3.823 1.00 44.34 C ATOM 1661 CG2 VAL A 110 -35.230 11.598 2.668 1.00 54.34 C ATOM 0 H VAL A 110 -31.307 12.973 1.818 1.00 33.40 H new ATOM 0 HA VAL A 110 -33.388 11.297 0.610 1.00 62.24 H new ATOM 0 HB VAL A 110 -33.363 10.610 2.941 1.00 4.52 H new ATOM 0 HG11 VAL A 110 -33.639 12.228 4.778 1.00 44.34 H new ATOM 0 HG12 VAL A 110 -32.131 12.505 3.874 1.00 44.34 H new ATOM 0 HG13 VAL A 110 -33.535 13.566 3.609 1.00 44.34 H new ATOM 0 HG21 VAL A 110 -35.622 11.293 3.638 1.00 54.34 H new ATOM 0 HG22 VAL A 110 -35.600 12.594 2.423 1.00 54.34 H new ATOM 0 HG23 VAL A 110 -35.559 10.892 1.906 1.00 54.34 H new ATOM 1671 N PHE A 111 -34.494 13.385 -0.134 1.00 31.14 N ATOM 1672 CA PHE A 111 -35.130 14.603 -0.624 1.00 61.30 C ATOM 1673 C PHE A 111 -36.636 14.565 -0.378 1.00 14.04 C ATOM 1674 O PHE A 111 -37.296 13.565 -0.656 1.00 54.20 O ATOM 1675 CB PHE A 111 -34.851 14.785 -2.117 1.00 25.34 C ATOM 1676 CG PHE A 111 -33.416 14.548 -2.491 1.00 21.54 C ATOM 1677 CD1 PHE A 111 -32.408 15.342 -1.967 1.00 61.01 C ATOM 1678 CD2 PHE A 111 -33.073 13.530 -3.367 1.00 34.24 C ATOM 1679 CE1 PHE A 111 -31.087 15.127 -2.311 1.00 62.23 C ATOM 1680 CE2 PHE A 111 -31.753 13.309 -3.714 1.00 44.30 C ATOM 1681 CZ PHE A 111 -30.759 14.108 -3.184 1.00 45.00 C ATOM 0 H PHE A 111 -34.683 12.555 -0.696 1.00 31.14 H new ATOM 0 HA PHE A 111 -34.710 15.448 -0.078 1.00 61.30 H new ATOM 0 HB2 PHE A 111 -35.483 14.101 -2.683 1.00 25.34 H new ATOM 0 HB3 PHE A 111 -35.133 15.796 -2.411 1.00 25.34 H new ATOM 0 HD1 PHE A 111 -32.658 16.138 -1.282 1.00 61.01 H new ATOM 0 HD2 PHE A 111 -33.846 12.902 -3.784 1.00 34.24 H new ATOM 0 HE1 PHE A 111 -30.312 15.755 -1.898 1.00 62.23 H new ATOM 0 HE2 PHE A 111 -31.500 12.513 -4.398 1.00 44.30 H new ATOM 0 HZ PHE A 111 -29.727 13.936 -3.452 1.00 45.00 H new ATOM 1691 N ASN A 112 -37.172 15.662 0.147 1.00 50.25 N ATOM 1692 CA ASN A 112 -38.598 15.755 0.432 1.00 72.43 C ATOM 1693 C ASN A 112 -39.266 16.793 -0.467 1.00 13.34 C ATOM 1694 O ASN A 112 -38.687 17.838 -0.762 1.00 60.11 O ATOM 1695 CB ASN A 112 -38.824 16.117 1.901 1.00 64.11 C ATOM 1696 CG ASN A 112 -40.284 16.024 2.302 1.00 42.02 C ATOM 1697 OD1 ASN A 112 -40.833 16.945 2.906 1.00 74.51 O ATOM 1698 ND2 ASN A 112 -40.919 14.906 1.966 1.00 45.40 N ATOM 0 H ASN A 112 -36.639 16.499 0.384 1.00 50.25 H new ATOM 0 HA ASN A 112 -39.047 14.782 0.231 1.00 72.43 H new ATOM 0 HB2 ASN A 112 -38.234 15.452 2.531 1.00 64.11 H new ATOM 0 HB3 ASN A 112 -38.464 17.130 2.082 1.00 64.11 H new ATOM 0 HD21 ASN A 112 -41.902 14.785 2.209 1.00 45.40 H new ATOM 0 HD22 ASN A 112 -40.423 14.169 1.465 1.00 45.40 H new ATOM 1705 N ARG A 113 -40.489 16.495 -0.897 1.00 20.34 N ATOM 1706 CA ARG A 113 -41.235 17.402 -1.763 1.00 53.42 C ATOM 1707 C ARG A 113 -41.561 18.703 -1.035 1.00 54.43 C ATOM 1708 O ARG A 113 -41.498 19.783 -1.619 1.00 33.44 O ATOM 1709 CB ARG A 113 -42.526 16.736 -2.241 1.00 52.52 C ATOM 1710 CG ARG A 113 -43.445 16.305 -1.110 1.00 1.01 C ATOM 1711 CD ARG A 113 -44.634 15.513 -1.628 1.00 10.22 C ATOM 1712 NE ARG A 113 -45.607 15.233 -0.576 1.00 43.12 N ATOM 1713 CZ ARG A 113 -46.658 14.437 -0.739 1.00 21.52 C ATOM 1714 NH1 ARG A 113 -46.870 13.844 -1.906 1.00 31.21 N1+ ATOM 1715 NH2 ARG A 113 -47.499 14.231 0.267 1.00 54.41 N ATOM 0 H ARG A 113 -40.983 15.635 -0.660 1.00 20.34 H new ATOM 0 HA ARG A 113 -40.612 17.635 -2.627 1.00 53.42 H new ATOM 0 HB2 ARG A 113 -43.063 17.428 -2.890 1.00 52.52 H new ATOM 0 HB3 ARG A 113 -42.273 15.864 -2.844 1.00 52.52 H new ATOM 0 HG2 ARG A 113 -42.886 15.699 -0.397 1.00 1.01 H new ATOM 0 HG3 ARG A 113 -43.799 17.185 -0.572 1.00 1.01 H new ATOM 0 HD2 ARG A 113 -45.118 16.070 -2.430 1.00 10.22 H new ATOM 0 HD3 ARG A 113 -44.284 14.574 -2.057 1.00 10.22 H new ATOM 0 HE ARG A 113 -45.472 15.673 0.334 1.00 43.12 H new ATOM 0 HH11 ARG A 113 -46.225 13.999 -2.681 1.00 31.21 H new ATOM 0 HH12 ARG A 113 -47.678 13.233 -2.028 1.00 31.21 H new ATOM 0 HH21 ARG A 113 -47.339 14.684 1.167 1.00 54.41 H new ATOM 0 HH22 ARG A 113 -48.306 13.620 0.140 1.00 54.41 H new ATOM 1729 N GLU A 114 -41.908 18.589 0.244 1.00 1.14 N ATOM 1730 CA GLU A 114 -42.246 19.757 1.050 1.00 4.11 C ATOM 1731 C GLU A 114 -40.995 20.561 1.390 1.00 41.23 C ATOM 1732 O GLU A 114 -41.078 21.735 1.751 1.00 33.03 O ATOM 1733 CB GLU A 114 -42.956 19.329 2.335 1.00 54.33 C ATOM 1734 CG GLU A 114 -44.471 19.331 2.223 1.00 44.41 C ATOM 1735 CD GLU A 114 -45.156 19.430 3.573 1.00 52.21 C ATOM 1736 OE1 GLU A 114 -44.450 19.370 4.601 1.00 71.42 O ATOM 1737 OE2 GLU A 114 -46.397 19.566 3.600 1.00 73.01 O1- ATOM 0 H GLU A 114 -41.962 17.701 0.743 1.00 1.14 H new ATOM 0 HA GLU A 114 -42.916 20.389 0.467 1.00 4.11 H new ATOM 0 HB2 GLU A 114 -42.622 18.328 2.609 1.00 54.33 H new ATOM 0 HB3 GLU A 114 -42.659 19.997 3.144 1.00 54.33 H new ATOM 0 HG2 GLU A 114 -44.784 20.168 1.599 1.00 44.41 H new ATOM 0 HG3 GLU A 114 -44.796 18.420 1.721 1.00 44.41 H new ATOM 1744 N ASP A 115 -39.837 19.922 1.274 1.00 61.31 N ATOM 1745 CA ASP A 115 -38.568 20.577 1.569 1.00 32.24 C ATOM 1746 C ASP A 115 -38.195 21.561 0.464 1.00 43.43 C ATOM 1747 O ASP A 115 -37.342 22.428 0.654 1.00 43.12 O ATOM 1748 CB ASP A 115 -37.459 19.536 1.737 1.00 53.53 C ATOM 1749 CG ASP A 115 -36.100 20.170 1.966 1.00 13.43 C ATOM 1750 OD1 ASP A 115 -35.908 20.792 3.031 1.00 74.43 O ATOM 1751 OD2 ASP A 115 -35.230 20.042 1.079 1.00 32.32 O1- ATOM 0 H ASP A 115 -39.750 18.950 0.977 1.00 61.31 H new ATOM 0 HA ASP A 115 -38.681 21.130 2.501 1.00 32.24 H new ATOM 0 HB2 ASP A 115 -37.700 18.885 2.578 1.00 53.53 H new ATOM 0 HB3 ASP A 115 -37.418 18.906 0.848 1.00 53.53 H new ATOM 1756 N GLY A 116 -38.840 21.421 -0.690 1.00 54.51 N ATOM 1757 CA GLY A 116 -38.561 22.303 -1.807 1.00 23.20 C ATOM 1758 C GLY A 116 -37.801 21.609 -2.919 1.00 2.22 C ATOM 1759 O GLY A 116 -37.141 22.259 -3.730 1.00 55.14 O ATOM 0 H GLY A 116 -39.551 20.712 -0.871 1.00 54.51 H new ATOM 0 HA2 GLY A 116 -39.500 22.693 -2.201 1.00 23.20 H new ATOM 0 HA3 GLY A 116 -37.983 23.158 -1.455 1.00 23.20 H new ATOM 1763 N ASP A 117 -37.891 20.284 -2.957 1.00 71.14 N ATOM 1764 CA ASP A 117 -37.206 19.500 -3.979 1.00 22.33 C ATOM 1765 C ASP A 117 -38.205 18.889 -4.956 1.00 23.13 C ATOM 1766 O ASP A 117 -38.931 17.957 -4.613 1.00 55.15 O ATOM 1767 CB ASP A 117 -36.369 18.397 -3.329 1.00 15.40 C ATOM 1768 CG ASP A 117 -35.111 18.934 -2.675 1.00 11.35 C ATOM 1769 OD1 ASP A 117 -35.228 19.794 -1.777 1.00 73.13 O ATOM 1770 OD2 ASP A 117 -34.008 18.493 -3.061 1.00 42.23 O1- ATOM 0 H ASP A 117 -38.431 19.730 -2.292 1.00 71.14 H new ATOM 0 HA ASP A 117 -36.546 20.168 -4.533 1.00 22.33 H new ATOM 0 HB2 ASP A 117 -36.971 17.881 -2.582 1.00 15.40 H new ATOM 0 HB3 ASP A 117 -36.096 17.659 -4.084 1.00 15.40 H new ATOM 1775 N GLU A 118 -38.234 19.421 -6.173 1.00 12.24 N ATOM 1776 CA GLU A 118 -39.147 18.929 -7.199 1.00 23.12 C ATOM 1777 C GLU A 118 -38.878 17.457 -7.505 1.00 62.43 C ATOM 1778 O GLU A 118 -37.740 16.993 -7.428 1.00 43.24 O ATOM 1779 CB GLU A 118 -39.008 19.758 -8.478 1.00 34.24 C ATOM 1780 CG GLU A 118 -40.259 19.763 -9.339 1.00 62.21 C ATOM 1781 CD GLU A 118 -39.952 19.943 -10.813 1.00 42.54 C ATOM 1782 OE1 GLU A 118 -39.199 19.117 -11.369 1.00 52.30 O ATOM 1783 OE2 GLU A 118 -40.465 20.912 -11.411 1.00 0.43 O1- ATOM 0 H GLU A 118 -37.637 20.192 -6.473 1.00 12.24 H new ATOM 0 HA GLU A 118 -40.164 19.026 -6.820 1.00 23.12 H new ATOM 0 HB2 GLU A 118 -38.757 20.784 -8.210 1.00 34.24 H new ATOM 0 HB3 GLU A 118 -38.175 19.369 -9.064 1.00 34.24 H new ATOM 0 HG2 GLU A 118 -40.798 18.826 -9.196 1.00 62.21 H new ATOM 0 HG3 GLU A 118 -40.920 20.565 -9.009 1.00 62.21 H new ATOM 1790 N LEU A 119 -39.935 16.729 -7.849 1.00 53.45 N ATOM 1791 CA LEU A 119 -39.815 15.309 -8.164 1.00 44.14 C ATOM 1792 C LEU A 119 -40.537 14.979 -9.467 1.00 13.41 C ATOM 1793 O LEU A 119 -41.436 15.695 -9.906 1.00 3.34 O ATOM 1794 CB LEU A 119 -40.385 14.464 -7.025 1.00 54.15 C ATOM 1795 CG LEU A 119 -39.488 14.301 -5.797 1.00 4.14 C ATOM 1796 CD1 LEU A 119 -40.271 13.698 -4.640 1.00 75.22 C ATOM 1797 CD2 LEU A 119 -38.278 13.441 -6.130 1.00 64.10 C ATOM 0 H LEU A 119 -40.884 17.098 -7.917 1.00 53.45 H new ATOM 0 HA LEU A 119 -38.757 15.077 -8.286 1.00 44.14 H new ATOM 0 HB2 LEU A 119 -41.327 14.909 -6.705 1.00 54.15 H new ATOM 0 HB3 LEU A 119 -40.617 13.473 -7.415 1.00 54.15 H new ATOM 0 HG LEU A 119 -39.135 15.287 -5.495 1.00 4.14 H new ATOM 0 HD11 LEU A 119 -39.617 13.589 -3.775 1.00 75.22 H new ATOM 0 HD12 LEU A 119 -41.104 14.352 -4.385 1.00 75.22 H new ATOM 0 HD13 LEU A 119 -40.654 12.720 -4.930 1.00 75.22 H new ATOM 0 HD21 LEU A 119 -37.651 13.336 -5.244 1.00 64.10 H new ATOM 0 HD22 LEU A 119 -38.611 12.456 -6.458 1.00 64.10 H new ATOM 0 HD23 LEU A 119 -37.704 13.914 -6.927 1.00 64.10 H new ATOM 1809 N PRO A 120 -40.135 13.867 -10.100 1.00 20.10 N ATOM 1810 CA PRO A 120 -40.732 13.415 -11.361 1.00 0.40 C ATOM 1811 C PRO A 120 -42.160 12.912 -11.179 1.00 11.03 C ATOM 1812 O PRO A 120 -42.630 12.696 -10.062 1.00 42.43 O ATOM 1813 CB PRO A 120 -39.814 12.269 -11.796 1.00 45.01 C ATOM 1814 CG PRO A 120 -39.209 11.766 -10.532 1.00 75.10 C ATOM 1815 CD PRO A 120 -39.068 12.965 -9.634 1.00 64.30 C ATOM 0 HA PRO A 120 -40.805 14.222 -12.090 1.00 0.40 H new ATOM 0 HB2 PRO A 120 -40.374 11.485 -12.306 1.00 45.01 H new ATOM 0 HB3 PRO A 120 -39.049 12.617 -12.490 1.00 45.01 H new ATOM 0 HG2 PRO A 120 -39.841 11.006 -10.072 1.00 75.10 H new ATOM 0 HG3 PRO A 120 -38.240 11.303 -10.720 1.00 75.10 H new ATOM 0 HD2 PRO A 120 -39.197 12.699 -8.585 1.00 64.30 H new ATOM 0 HD3 PRO A 120 -38.084 13.424 -9.728 1.00 64.30 H new ATOM 1823 N PRO A 121 -42.869 12.723 -12.301 1.00 13.45 N ATOM 1824 CA PRO A 121 -44.255 12.244 -12.291 1.00 63.41 C ATOM 1825 C PRO A 121 -44.360 10.785 -11.861 1.00 74.12 C ATOM 1826 O PRO A 121 -43.702 9.912 -12.428 1.00 70.11 O ATOM 1827 CB PRO A 121 -44.696 12.406 -13.747 1.00 51.31 C ATOM 1828 CG PRO A 121 -43.434 12.345 -14.536 1.00 10.41 C ATOM 1829 CD PRO A 121 -42.373 12.962 -13.668 1.00 53.13 C ATOM 0 HA PRO A 121 -44.872 12.794 -11.581 1.00 63.41 H new ATOM 0 HB2 PRO A 121 -45.385 11.615 -14.042 1.00 51.31 H new ATOM 0 HB3 PRO A 121 -45.213 13.353 -13.901 1.00 51.31 H new ATOM 0 HG2 PRO A 121 -43.181 11.315 -14.789 1.00 10.41 H new ATOM 0 HG3 PRO A 121 -43.534 12.889 -15.475 1.00 10.41 H new ATOM 0 HD2 PRO A 121 -41.401 12.497 -13.830 1.00 53.13 H new ATOM 0 HD3 PRO A 121 -42.255 14.026 -13.872 1.00 53.13 H new ATOM 1837 N GLY A 122 -45.191 10.527 -10.858 1.00 43.21 N ATOM 1838 CA GLY A 122 -45.368 9.171 -10.370 1.00 45.50 C ATOM 1839 C GLY A 122 -44.594 8.909 -9.093 1.00 61.31 C ATOM 1840 O GLY A 122 -44.779 7.878 -8.447 1.00 64.21 O ATOM 0 H GLY A 122 -45.746 11.232 -10.373 1.00 43.21 H new ATOM 0 HA2 GLY A 122 -46.428 8.987 -10.193 1.00 45.50 H new ATOM 0 HA3 GLY A 122 -45.046 8.467 -11.137 1.00 45.50 H new ATOM 1844 N VAL A 123 -43.723 9.845 -8.728 1.00 20.12 N ATOM 1845 CA VAL A 123 -42.916 9.710 -7.521 1.00 30.11 C ATOM 1846 C VAL A 123 -43.400 10.658 -6.429 1.00 42.43 C ATOM 1847 O VAL A 123 -43.820 11.779 -6.708 1.00 35.02 O ATOM 1848 CB VAL A 123 -41.428 9.988 -7.804 1.00 72.33 C ATOM 1849 CG1 VAL A 123 -40.619 9.930 -6.518 1.00 14.23 C ATOM 1850 CG2 VAL A 123 -40.889 9.002 -8.829 1.00 34.10 C ATOM 0 H VAL A 123 -43.558 10.705 -9.251 1.00 20.12 H new ATOM 0 HA VAL A 123 -43.026 8.680 -7.181 1.00 30.11 H new ATOM 0 HB VAL A 123 -41.336 10.993 -8.216 1.00 72.33 H new ATOM 0 HG11 VAL A 123 -39.570 10.129 -6.739 1.00 14.23 H new ATOM 0 HG12 VAL A 123 -40.991 10.680 -5.820 1.00 14.23 H new ATOM 0 HG13 VAL A 123 -40.714 8.940 -6.072 1.00 14.23 H new ATOM 0 HG21 VAL A 123 -39.836 9.212 -9.018 1.00 34.10 H new ATOM 0 HG22 VAL A 123 -40.993 7.987 -8.447 1.00 34.10 H new ATOM 0 HG23 VAL A 123 -41.451 9.100 -9.758 1.00 34.10 H new ATOM 1860 N ASN A 124 -43.339 10.198 -5.183 1.00 33.12 N ATOM 1861 CA ASN A 124 -43.771 11.004 -4.048 1.00 53.53 C ATOM 1862 C ASN A 124 -42.578 11.424 -3.194 1.00 53.12 C ATOM 1863 O ASN A 124 -42.593 12.483 -2.568 1.00 73.13 O ATOM 1864 CB ASN A 124 -44.775 10.226 -3.195 1.00 43.21 C ATOM 1865 CG ASN A 124 -45.894 9.626 -4.024 1.00 42.43 C ATOM 1866 OD1 ASN A 124 -46.080 9.981 -5.187 1.00 73.31 O ATOM 1867 ND2 ASN A 124 -46.647 8.709 -3.425 1.00 3.04 N ATOM 0 H ASN A 124 -42.994 9.271 -4.934 1.00 33.12 H new ATOM 0 HA ASN A 124 -44.253 11.902 -4.435 1.00 53.53 H new ATOM 0 HB2 ASN A 124 -44.255 9.430 -2.661 1.00 43.21 H new ATOM 0 HB3 ASN A 124 -45.200 10.890 -2.442 1.00 43.21 H new ATOM 0 HD21 ASN A 124 -47.415 8.269 -3.932 1.00 3.04 H new ATOM 0 HD22 ASN A 124 -46.457 8.445 -2.458 1.00 3.04 H new ATOM 1874 N GLN A 125 -41.546 10.586 -3.175 1.00 42.31 N ATOM 1875 CA GLN A 125 -40.347 10.871 -2.397 1.00 61.22 C ATOM 1876 C GLN A 125 -39.111 10.276 -3.066 1.00 32.52 C ATOM 1877 O GLN A 125 -39.220 9.447 -3.972 1.00 3.53 O ATOM 1878 CB GLN A 125 -40.489 10.317 -0.979 1.00 74.32 C ATOM 1879 CG GLN A 125 -41.431 11.125 -0.102 1.00 12.52 C ATOM 1880 CD GLN A 125 -42.808 10.499 0.006 1.00 12.21 C ATOM 1881 OE1 GLN A 125 -42.959 9.389 0.518 1.00 35.21 O ATOM 1882 NE2 GLN A 125 -43.820 11.210 -0.474 1.00 13.11 N ATOM 0 H GLN A 125 -41.517 9.705 -3.689 1.00 42.31 H new ATOM 0 HA GLN A 125 -40.226 11.953 -2.346 1.00 61.22 H new ATOM 0 HB2 GLN A 125 -40.848 9.289 -1.034 1.00 74.32 H new ATOM 0 HB3 GLN A 125 -39.506 10.286 -0.510 1.00 74.32 H new ATOM 0 HG2 GLN A 125 -41.001 11.221 0.895 1.00 12.52 H new ATOM 0 HG3 GLN A 125 -41.525 12.132 -0.508 1.00 12.52 H new ATOM 0 HE21 GLN A 125 -43.648 12.125 -0.890 1.00 13.11 H new ATOM 0 HE22 GLN A 125 -44.770 10.841 -0.427 1.00 13.11 H new ATOM 1891 N LEU A 126 -37.937 10.704 -2.616 1.00 13.13 N ATOM 1892 CA LEU A 126 -36.680 10.214 -3.172 1.00 42.24 C ATOM 1893 C LEU A 126 -35.609 10.114 -2.090 1.00 22.01 C ATOM 1894 O LEU A 126 -35.321 11.088 -1.394 1.00 4.43 O ATOM 1895 CB LEU A 126 -36.201 11.137 -4.294 1.00 14.10 C ATOM 1896 CG LEU A 126 -35.214 10.527 -5.289 1.00 62.41 C ATOM 1897 CD1 LEU A 126 -33.878 10.252 -4.615 1.00 34.22 C ATOM 1898 CD2 LEU A 126 -35.782 9.250 -5.891 1.00 54.24 C ATOM 0 H LEU A 126 -37.829 11.389 -1.868 1.00 13.13 H new ATOM 0 HA LEU A 126 -36.855 9.218 -3.579 1.00 42.24 H new ATOM 0 HB2 LEU A 126 -37.073 11.487 -4.846 1.00 14.10 H new ATOM 0 HB3 LEU A 126 -35.736 12.014 -3.843 1.00 14.10 H new ATOM 0 HG LEU A 126 -35.052 11.243 -6.095 1.00 62.41 H new ATOM 0 HD11 LEU A 126 -33.188 9.818 -5.339 1.00 34.22 H new ATOM 0 HD12 LEU A 126 -33.464 11.185 -4.233 1.00 34.22 H new ATOM 0 HD13 LEU A 126 -34.024 9.555 -3.789 1.00 34.22 H new ATOM 0 HD21 LEU A 126 -35.065 8.830 -6.597 1.00 54.24 H new ATOM 0 HD22 LEU A 126 -35.975 8.528 -5.097 1.00 54.24 H new ATOM 0 HD23 LEU A 126 -36.713 9.476 -6.411 1.00 54.24 H new ATOM 1910 N VAL A 127 -35.021 8.930 -1.954 1.00 20.53 N ATOM 1911 CA VAL A 127 -33.980 8.702 -0.959 1.00 45.13 C ATOM 1912 C VAL A 127 -32.959 7.684 -1.455 1.00 1.10 C ATOM 1913 O VAL A 127 -33.322 6.604 -1.923 1.00 14.25 O ATOM 1914 CB VAL A 127 -34.574 8.211 0.374 1.00 20.41 C ATOM 1915 CG1 VAL A 127 -35.447 6.985 0.149 1.00 10.03 C ATOM 1916 CG2 VAL A 127 -33.466 7.910 1.372 1.00 54.52 C ATOM 0 H VAL A 127 -35.248 8.113 -2.521 1.00 20.53 H new ATOM 0 HA VAL A 127 -33.484 9.659 -0.795 1.00 45.13 H new ATOM 0 HB VAL A 127 -35.199 9.003 0.787 1.00 20.41 H new ATOM 0 HG11 VAL A 127 -35.859 6.652 1.102 1.00 10.03 H new ATOM 0 HG12 VAL A 127 -36.262 7.238 -0.530 1.00 10.03 H new ATOM 0 HG13 VAL A 127 -34.847 6.186 -0.287 1.00 10.03 H new ATOM 0 HG21 VAL A 127 -33.904 7.564 2.308 1.00 54.52 H new ATOM 0 HG22 VAL A 127 -32.814 7.136 0.969 1.00 54.52 H new ATOM 0 HG23 VAL A 127 -32.886 8.814 1.555 1.00 54.52 H new ATOM 1926 N ARG A 128 -31.682 8.034 -1.348 1.00 4.20 N ATOM 1927 CA ARG A 128 -30.608 7.150 -1.786 1.00 61.44 C ATOM 1928 C ARG A 128 -29.678 6.808 -0.625 1.00 20.05 C ATOM 1929 O ARG A 128 -29.620 7.529 0.371 1.00 44.24 O ATOM 1930 CB ARG A 128 -29.811 7.802 -2.918 1.00 53.24 C ATOM 1931 CG ARG A 128 -30.659 8.176 -4.122 1.00 2.30 C ATOM 1932 CD ARG A 128 -29.990 9.254 -4.961 1.00 44.25 C ATOM 1933 NE ARG A 128 -29.696 8.790 -6.314 1.00 42.20 N ATOM 1934 CZ ARG A 128 -28.654 8.023 -6.619 1.00 12.20 C ATOM 1935 NH1 ARG A 128 -27.812 7.636 -5.670 1.00 23.30 N1+ ATOM 1936 NH2 ARG A 128 -28.454 7.642 -7.873 1.00 64.11 N ATOM 0 H ARG A 128 -31.365 8.923 -0.962 1.00 4.20 H new ATOM 0 HA ARG A 128 -31.057 6.227 -2.153 1.00 61.44 H new ATOM 0 HB2 ARG A 128 -29.321 8.698 -2.537 1.00 53.24 H new ATOM 0 HB3 ARG A 128 -29.023 7.119 -3.237 1.00 53.24 H new ATOM 0 HG2 ARG A 128 -30.833 7.292 -4.735 1.00 2.30 H new ATOM 0 HG3 ARG A 128 -31.635 8.528 -3.786 1.00 2.30 H new ATOM 0 HD2 ARG A 128 -30.638 10.129 -5.011 1.00 44.25 H new ATOM 0 HD3 ARG A 128 -29.066 9.569 -4.477 1.00 44.25 H new ATOM 0 HE ARG A 128 -30.325 9.070 -7.067 1.00 42.20 H new ATOM 0 HH11 ARG A 128 -27.963 7.927 -4.704 1.00 23.30 H new ATOM 0 HH12 ARG A 128 -27.013 7.047 -5.906 1.00 23.30 H new ATOM 0 HH21 ARG A 128 -29.100 7.937 -8.605 1.00 64.11 H new ATOM 0 HH22 ARG A 128 -27.654 7.053 -8.106 1.00 64.11 H new ATOM 1950 N VAL A 129 -28.952 5.704 -0.763 1.00 61.44 N ATOM 1951 CA VAL A 129 -28.024 5.266 0.274 1.00 71.52 C ATOM 1952 C VAL A 129 -26.586 5.282 -0.233 1.00 13.23 C ATOM 1953 O VAL A 129 -26.338 5.150 -1.432 1.00 34.03 O ATOM 1954 CB VAL A 129 -28.365 3.848 0.771 1.00 44.32 C ATOM 1955 CG1 VAL A 129 -27.562 3.511 2.018 1.00 3.32 C ATOM 1956 CG2 VAL A 129 -29.857 3.723 1.039 1.00 62.34 C ATOM 0 H VAL A 129 -28.988 5.096 -1.582 1.00 61.44 H new ATOM 0 HA VAL A 129 -28.122 5.967 1.103 1.00 71.52 H new ATOM 0 HB VAL A 129 -28.097 3.135 -0.008 1.00 44.32 H new ATOM 0 HG11 VAL A 129 -27.817 2.506 2.354 1.00 3.32 H new ATOM 0 HG12 VAL A 129 -26.497 3.558 1.789 1.00 3.32 H new ATOM 0 HG13 VAL A 129 -27.796 4.227 2.806 1.00 3.32 H new ATOM 0 HG21 VAL A 129 -30.081 2.715 1.389 1.00 62.34 H new ATOM 0 HG22 VAL A 129 -30.152 4.445 1.800 1.00 62.34 H new ATOM 0 HG23 VAL A 129 -30.409 3.919 0.120 1.00 62.34 H new ATOM 1966 N TYR A 130 -25.642 5.444 0.687 1.00 2.33 N ATOM 1967 CA TYR A 130 -24.229 5.479 0.334 1.00 2.11 C ATOM 1968 C TYR A 130 -23.435 4.472 1.159 1.00 50.21 C ATOM 1969 O TYR A 130 -23.297 4.620 2.375 1.00 35.14 O ATOM 1970 CB TYR A 130 -23.663 6.886 0.543 1.00 54.22 C ATOM 1971 CG TYR A 130 -24.187 7.902 -0.446 1.00 50.10 C ATOM 1972 CD1 TYR A 130 -25.532 8.252 -0.466 1.00 41.25 C ATOM 1973 CD2 TYR A 130 -23.339 8.512 -1.362 1.00 64.34 C ATOM 1974 CE1 TYR A 130 -26.015 9.180 -1.368 1.00 42.45 C ATOM 1975 CE2 TYR A 130 -23.812 9.441 -2.267 1.00 13.34 C ATOM 1976 CZ TYR A 130 -25.152 9.772 -2.266 1.00 23.14 C ATOM 1977 OH TYR A 130 -25.628 10.697 -3.167 1.00 43.15 O ATOM 0 H TYR A 130 -25.830 5.553 1.683 1.00 2.33 H new ATOM 0 HA TYR A 130 -24.138 5.211 -0.719 1.00 2.11 H new ATOM 0 HB2 TYR A 130 -23.902 7.218 1.553 1.00 54.22 H new ATOM 0 HB3 TYR A 130 -22.576 6.846 0.469 1.00 54.22 H new ATOM 0 HD1 TYR A 130 -26.211 7.791 0.236 1.00 41.25 H new ATOM 0 HD2 TYR A 130 -22.290 8.255 -1.366 1.00 64.34 H new ATOM 0 HE1 TYR A 130 -27.063 9.441 -1.370 1.00 42.45 H new ATOM 0 HE2 TYR A 130 -23.138 9.906 -2.971 1.00 13.34 H new ATOM 0 HH TYR A 130 -24.890 11.018 -3.727 1.00 43.15 H new ATOM 1987 N ILE A 131 -22.913 3.449 0.491 1.00 62.14 N ATOM 1988 CA ILE A 131 -22.132 2.417 1.162 1.00 14.52 C ATOM 1989 C ILE A 131 -20.695 2.397 0.650 1.00 32.22 C ATOM 1990 O ILE A 131 -20.454 2.379 -0.557 1.00 50.11 O ATOM 1991 CB ILE A 131 -22.754 1.023 0.967 1.00 53.44 C ATOM 1992 CG1 ILE A 131 -24.021 0.883 1.813 1.00 75.34 C ATOM 1993 CG2 ILE A 131 -21.749 -0.061 1.326 1.00 74.22 C ATOM 1994 CD1 ILE A 131 -25.298 1.083 1.028 1.00 41.20 C ATOM 0 H ILE A 131 -23.017 3.313 -0.514 1.00 62.14 H new ATOM 0 HA ILE A 131 -22.134 2.660 2.225 1.00 14.52 H new ATOM 0 HB ILE A 131 -23.025 0.906 -0.082 1.00 53.44 H new ATOM 0 HG12 ILE A 131 -24.036 -0.107 2.269 1.00 75.34 H new ATOM 0 HG13 ILE A 131 -23.987 1.608 2.626 1.00 75.34 H new ATOM 0 HG21 ILE A 131 -22.204 -1.041 1.183 1.00 74.22 H new ATOM 0 HG22 ILE A 131 -20.872 0.029 0.685 1.00 74.22 H new ATOM 0 HG23 ILE A 131 -21.450 0.051 2.368 1.00 74.22 H new ATOM 0 HD11 ILE A 131 -26.155 0.969 1.692 1.00 41.20 H new ATOM 0 HD12 ILE A 131 -25.306 2.083 0.594 1.00 41.20 H new ATOM 0 HD13 ILE A 131 -25.355 0.341 0.231 1.00 41.20 H new ATOM 2006 N VAL A 132 -19.743 2.397 1.577 1.00 41.23 N ATOM 2007 CA VAL A 132 -18.329 2.374 1.221 1.00 34.34 C ATOM 2008 C VAL A 132 -17.731 0.987 1.428 1.00 0.01 C ATOM 2009 O VAL A 132 -17.821 0.418 2.516 1.00 51.31 O ATOM 2010 CB VAL A 132 -17.525 3.396 2.049 1.00 61.21 C ATOM 2011 CG1 VAL A 132 -17.848 4.814 1.605 1.00 1.22 C ATOM 2012 CG2 VAL A 132 -17.804 3.215 3.533 1.00 73.24 C ATOM 0 H VAL A 132 -19.925 2.413 2.581 1.00 41.23 H new ATOM 0 HA VAL A 132 -18.265 2.640 0.166 1.00 34.34 H new ATOM 0 HB VAL A 132 -16.463 3.222 1.879 1.00 61.21 H new ATOM 0 HG11 VAL A 132 -17.271 5.522 2.200 1.00 1.22 H new ATOM 0 HG12 VAL A 132 -17.592 4.933 0.552 1.00 1.22 H new ATOM 0 HG13 VAL A 132 -18.912 5.005 1.744 1.00 1.22 H new ATOM 0 HG21 VAL A 132 -17.228 3.944 4.103 1.00 73.24 H new ATOM 0 HG22 VAL A 132 -18.867 3.362 3.724 1.00 73.24 H new ATOM 0 HG23 VAL A 132 -17.517 2.208 3.837 1.00 73.24 H new ATOM 2022 N GLN A 133 -17.122 0.448 0.376 1.00 42.41 N ATOM 2023 CA GLN A 133 -16.510 -0.873 0.444 1.00 12.41 C ATOM 2024 C GLN A 133 -15.239 -0.842 1.286 1.00 54.20 C ATOM 2025 O GLN A 133 -14.402 0.048 1.134 1.00 2.20 O ATOM 2026 CB GLN A 133 -16.191 -1.383 -0.964 1.00 71.20 C ATOM 2027 CG GLN A 133 -17.343 -2.132 -1.615 1.00 14.21 C ATOM 2028 CD GLN A 133 -18.498 -1.220 -1.982 1.00 65.31 C ATOM 2029 OE1 GLN A 133 -18.480 -0.567 -3.026 1.00 73.53 O ATOM 2030 NE2 GLN A 133 -19.510 -1.173 -1.125 1.00 12.32 N ATOM 0 H GLN A 133 -17.040 0.906 -0.532 1.00 42.41 H new ATOM 0 HA GLN A 133 -17.220 -1.551 0.917 1.00 12.41 H new ATOM 0 HB2 GLN A 133 -15.916 -0.537 -1.594 1.00 71.20 H new ATOM 0 HB3 GLN A 133 -15.323 -2.040 -0.915 1.00 71.20 H new ATOM 0 HG2 GLN A 133 -16.983 -2.636 -2.512 1.00 14.21 H new ATOM 0 HG3 GLN A 133 -17.698 -2.907 -0.935 1.00 14.21 H new ATOM 0 HE21 GLN A 133 -19.482 -1.731 -0.272 1.00 12.32 H new ATOM 0 HE22 GLN A 133 -20.316 -0.578 -1.319 1.00 12.32 H new ATOM 2039 N LYS A 134 -15.100 -1.820 2.174 1.00 12.52 N ATOM 2040 CA LYS A 134 -13.931 -1.908 3.041 1.00 43.01 C ATOM 2041 C LYS A 134 -12.673 -2.197 2.230 1.00 3.21 C ATOM 2042 O LYS A 134 -12.747 -2.715 1.115 1.00 43.24 O ATOM 2043 CB LYS A 134 -14.133 -2.997 4.096 1.00 4.32 C ATOM 2044 CG LYS A 134 -15.414 -2.840 4.897 1.00 31.52 C ATOM 2045 CD LYS A 134 -15.702 -4.073 5.736 1.00 15.52 C ATOM 2046 CE LYS A 134 -14.639 -4.281 6.803 1.00 55.02 C ATOM 2047 NZ LYS A 134 -15.179 -4.994 7.994 1.00 1.44 N1+ ATOM 0 H LYS A 134 -15.784 -2.564 2.312 1.00 12.52 H new ATOM 0 HA LYS A 134 -13.807 -0.947 3.540 1.00 43.01 H new ATOM 0 HB2 LYS A 134 -14.139 -3.970 3.605 1.00 4.32 H new ATOM 0 HB3 LYS A 134 -13.284 -2.990 4.780 1.00 4.32 H new ATOM 0 HG2 LYS A 134 -15.334 -1.968 5.546 1.00 31.52 H new ATOM 0 HG3 LYS A 134 -16.248 -2.657 4.219 1.00 31.52 H new ATOM 0 HD2 LYS A 134 -16.679 -3.973 6.209 1.00 15.52 H new ATOM 0 HD3 LYS A 134 -15.749 -4.951 5.091 1.00 15.52 H new ATOM 0 HE2 LYS A 134 -13.810 -4.851 6.383 1.00 55.02 H new ATOM 0 HE3 LYS A 134 -14.238 -3.315 7.109 1.00 55.02 H new ATOM 0 HZ1 LYS A 134 -14.423 -5.116 8.698 1.00 1.44 H new ATOM 0 HZ2 LYS A 134 -15.953 -4.438 8.410 1.00 1.44 H new ATOM 0 HZ3 LYS A 134 -15.538 -5.927 7.707 1.00 1.44 H new ATOM 2061 N ARG A 135 -11.518 -1.861 2.797 1.00 73.21 N ATOM 2062 CA ARG A 135 -10.243 -2.086 2.125 1.00 2.23 C ATOM 2063 C ARG A 135 -9.640 -3.425 2.538 1.00 4.34 C ATOM 2064 O ARG A 135 -9.677 -3.799 3.711 1.00 70.31 O ATOM 2065 CB ARG A 135 -9.267 -0.953 2.447 1.00 24.23 C ATOM 2066 CG ARG A 135 -7.811 -1.388 2.454 1.00 61.24 C ATOM 2067 CD ARG A 135 -6.877 -0.214 2.202 1.00 61.52 C ATOM 2068 NE ARG A 135 -7.076 0.368 0.877 1.00 65.45 N ATOM 2069 CZ ARG A 135 -6.567 -0.146 -0.236 1.00 44.11 C ATOM 2070 NH1 ARG A 135 -5.831 -1.248 -0.185 1.00 2.13 N1+ ATOM 2071 NH2 ARG A 135 -6.793 0.442 -1.404 1.00 1.42 N ATOM 0 H ARG A 135 -11.439 -1.432 3.719 1.00 73.21 H new ATOM 0 HA ARG A 135 -10.425 -2.106 1.050 1.00 2.23 H new ATOM 0 HB2 ARG A 135 -9.396 -0.155 1.716 1.00 24.23 H new ATOM 0 HB3 ARG A 135 -9.517 -0.535 3.422 1.00 24.23 H new ATOM 0 HG2 ARG A 135 -7.571 -1.845 3.414 1.00 61.24 H new ATOM 0 HG3 ARG A 135 -7.654 -2.150 1.690 1.00 61.24 H new ATOM 0 HD2 ARG A 135 -7.041 0.550 2.962 1.00 61.52 H new ATOM 0 HD3 ARG A 135 -5.843 -0.545 2.301 1.00 61.52 H new ATOM 0 HE ARG A 135 -7.637 1.216 0.803 1.00 65.45 H new ATOM 0 HH11 ARG A 135 -5.655 -1.703 0.711 1.00 2.13 H new ATOM 0 HH12 ARG A 135 -5.441 -1.641 -1.042 1.00 2.13 H new ATOM 0 HH21 ARG A 135 -7.358 1.290 -1.447 1.00 1.42 H new ATOM 0 HH22 ARG A 135 -6.401 0.046 -2.259 1.00 1.42 H new ATOM 2085 N LYS A 136 -9.086 -4.142 1.568 1.00 75.34 N ATOM 2086 CA LYS A 136 -8.473 -5.440 1.829 1.00 14.01 C ATOM 2087 C LYS A 136 -7.456 -5.343 2.961 1.00 71.32 C ATOM 2088 O LYS A 136 -6.925 -4.268 3.241 1.00 71.05 O ATOM 2089 CB LYS A 136 -7.796 -5.971 0.563 1.00 52.34 C ATOM 2090 CG LYS A 136 -6.496 -5.262 0.227 1.00 44.13 C ATOM 2091 CD LYS A 136 -5.950 -5.708 -1.120 1.00 43.40 C ATOM 2092 CE LYS A 136 -4.825 -4.801 -1.593 1.00 63.11 C ATOM 2093 NZ LYS A 136 -3.609 -4.938 -0.744 1.00 55.42 N1+ ATOM 0 H LYS A 136 -9.048 -3.847 0.592 1.00 75.34 H new ATOM 0 HA LYS A 136 -9.260 -6.132 2.130 1.00 14.01 H new ATOM 0 HB2 LYS A 136 -7.598 -7.036 0.686 1.00 52.34 H new ATOM 0 HB3 LYS A 136 -8.483 -5.869 -0.277 1.00 52.34 H new ATOM 0 HG2 LYS A 136 -6.660 -4.185 0.215 1.00 44.13 H new ATOM 0 HG3 LYS A 136 -5.759 -5.464 1.004 1.00 44.13 H new ATOM 0 HD2 LYS A 136 -5.586 -6.733 -1.045 1.00 43.40 H new ATOM 0 HD3 LYS A 136 -6.753 -5.708 -1.857 1.00 43.40 H new ATOM 0 HE2 LYS A 136 -4.575 -5.041 -2.627 1.00 63.11 H new ATOM 0 HE3 LYS A 136 -5.163 -3.765 -1.579 1.00 63.11 H new ATOM 0 HZ1 LYS A 136 -2.865 -4.304 -1.099 1.00 55.42 H new ATOM 0 HZ2 LYS A 136 -3.841 -4.685 0.238 1.00 55.42 H new ATOM 0 HZ3 LYS A 136 -3.271 -5.921 -0.778 1.00 55.42 H new ATOM 2107 N ILE A 137 -7.187 -6.473 3.607 1.00 30.52 N ATOM 2108 CA ILE A 137 -6.231 -6.514 4.706 1.00 4.50 C ATOM 2109 C ILE A 137 -5.166 -7.580 4.469 1.00 42.20 C ATOM 2110 O ILE A 137 -5.295 -8.410 3.570 1.00 34.34 O ATOM 2111 CB ILE A 137 -6.929 -6.793 6.050 1.00 24.31 C ATOM 2112 CG1 ILE A 137 -8.103 -7.755 5.849 1.00 34.43 C ATOM 2113 CG2 ILE A 137 -7.404 -5.493 6.681 1.00 52.43 C ATOM 2114 CD1 ILE A 137 -7.700 -9.084 5.253 1.00 4.14 C ATOM 0 H ILE A 137 -7.618 -7.371 3.388 1.00 30.52 H new ATOM 0 HA ILE A 137 -5.758 -5.533 4.748 1.00 4.50 H new ATOM 0 HB ILE A 137 -6.212 -7.260 6.725 1.00 24.31 H new ATOM 0 HG12 ILE A 137 -8.588 -7.929 6.810 1.00 34.43 H new ATOM 0 HG13 ILE A 137 -8.841 -7.284 5.200 1.00 34.43 H new ATOM 0 HG21 ILE A 137 -7.895 -5.707 7.630 1.00 52.43 H new ATOM 0 HG22 ILE A 137 -6.549 -4.839 6.854 1.00 52.43 H new ATOM 0 HG23 ILE A 137 -8.108 -5.000 6.011 1.00 52.43 H new ATOM 0 HD11 ILE A 137 -8.582 -9.714 5.139 1.00 4.14 H new ATOM 0 HD12 ILE A 137 -7.242 -8.921 4.277 1.00 4.14 H new ATOM 0 HD13 ILE A 137 -6.985 -9.576 5.912 1.00 4.14 H new ATOM 2126 N SER A 138 -4.115 -7.550 5.281 1.00 33.30 N ATOM 2127 CA SER A 138 -3.026 -8.511 5.159 1.00 12.12 C ATOM 2128 C SER A 138 -3.561 -9.941 5.156 1.00 23.35 C ATOM 2129 O SER A 138 -3.923 -10.480 6.202 1.00 14.03 O ATOM 2130 CB SER A 138 -2.026 -8.331 6.302 1.00 33.30 C ATOM 2131 OG SER A 138 -0.752 -8.841 5.952 1.00 33.15 O ATOM 0 H SER A 138 -3.994 -6.870 6.031 1.00 33.30 H new ATOM 0 HA SER A 138 -2.519 -8.329 4.211 1.00 12.12 H new ATOM 0 HB2 SER A 138 -1.941 -7.273 6.552 1.00 33.30 H new ATOM 0 HB3 SER A 138 -2.392 -8.841 7.193 1.00 33.30 H new ATOM 0 HG SER A 138 -0.131 -8.712 6.699 1.00 33.15 H new ATOM 2137 N GLU A 139 -3.607 -10.547 3.974 1.00 73.41 N ATOM 2138 CA GLU A 139 -4.099 -11.912 3.836 1.00 32.15 C ATOM 2139 C GLU A 139 -3.072 -12.915 4.352 1.00 5.54 C ATOM 2140 O GLU A 139 -3.236 -13.490 5.428 1.00 63.51 O ATOM 2141 CB GLU A 139 -4.429 -12.213 2.372 1.00 31.35 C ATOM 2142 CG GLU A 139 -5.536 -11.338 1.806 1.00 73.33 C ATOM 2143 CD GLU A 139 -5.020 -10.009 1.288 1.00 40.35 C ATOM 2144 OE1 GLU A 139 -3.789 -9.874 1.122 1.00 55.44 O ATOM 2145 OE2 GLU A 139 -5.845 -9.104 1.048 1.00 25.42 O1- ATOM 0 H GLU A 139 -3.310 -10.115 3.099 1.00 73.41 H new ATOM 0 HA GLU A 139 -5.006 -12.006 4.433 1.00 32.15 H new ATOM 0 HB2 GLU A 139 -3.529 -12.081 1.771 1.00 31.35 H new ATOM 0 HB3 GLU A 139 -4.722 -13.259 2.282 1.00 31.35 H new ATOM 0 HG2 GLU A 139 -6.037 -11.870 0.997 1.00 73.33 H new ATOM 0 HG3 GLU A 139 -6.283 -11.157 2.579 1.00 73.33 H new ATOM 2152 N GLY A 140 -2.012 -13.122 3.577 1.00 65.11 N ATOM 2153 CA GLY A 140 -0.974 -14.055 3.971 1.00 41.24 C ATOM 2154 C GLY A 140 -1.184 -15.438 3.386 1.00 43.02 C ATOM 2155 O GLY A 140 -0.517 -16.394 3.780 1.00 23.34 O ATOM 0 H GLY A 140 -1.854 -12.659 2.682 1.00 65.11 H new ATOM 0 HA2 GLY A 140 -0.005 -13.672 3.651 1.00 41.24 H new ATOM 0 HA3 GLY A 140 -0.946 -14.124 5.058 1.00 41.24 H new ATOM 2159 N ASP A 141 -2.114 -15.544 2.444 1.00 63.32 N ATOM 2160 CA ASP A 141 -2.411 -16.820 1.802 1.00 33.42 C ATOM 2161 C ASP A 141 -1.636 -16.965 0.497 1.00 14.14 C ATOM 2162 O ASP A 141 -1.220 -15.972 -0.103 1.00 20.30 O ATOM 2163 CB ASP A 141 -3.912 -16.943 1.536 1.00 74.13 C ATOM 2164 CG ASP A 141 -4.377 -16.038 0.412 1.00 34.21 C ATOM 2165 OD1 ASP A 141 -4.260 -14.803 0.558 1.00 41.30 O ATOM 2166 OD2 ASP A 141 -4.857 -16.564 -0.613 1.00 23.22 O1- ATOM 0 H ASP A 141 -2.676 -14.762 2.107 1.00 63.32 H new ATOM 0 HA ASP A 141 -2.103 -17.619 2.476 1.00 33.42 H new ATOM 0 HB2 ASP A 141 -4.150 -17.977 1.288 1.00 74.13 H new ATOM 0 HB3 ASP A 141 -4.460 -16.699 2.446 1.00 74.13 H new TER 2171 ASP A 141