USER MOD reduce.3.24.130724 H: found=0, std=0, add=1222, rem=0, adj=43 USER MOD reduce.3.24.130724 removed 1218 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 10 MET CE :methyl -116:sc= -0.749 (180deg=-2.24) USER MOD Set 1.2: A 51 HIS :FLIP no HD1:sc= -0.21 F(o=-1.9,f=-0.96) USER MOD Set 2.1: A 22 SER OG : rot 180:sc=-0.00591 USER MOD Set 2.2: A 34 LYS NZ :NH3+ 157:sc= -8.19! (180deg=-9.21!) USER MOD Set 3.1: A 17 ASN :FLIP amide:sc= -0.0838 F(o=-0.86,f=-0.096) USER MOD Set 3.2: A 55 SER OG : rot 171:sc= -0.0123 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot -86:sc= 1.14 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -0.21 X(o=-0.21,f=-0.46) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot 77:sc= 0.853 USER MOD Single : A 18 SER OG : rot 72:sc= 0.0206 USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc= -0.152 K(o=-0.15,f=-1.2) USER MOD Single : A 26 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 MET CE :methyl 177:sc= -3.92! (180deg=-3.98!) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 GLN :FLIP amide:sc=-0.00699 F(o=-0.51,f=-0.007) USER MOD Single : A 39 THR OG1 : rot 83:sc= -1.21 USER MOD Single : A 40 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00281) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -0.647 K(o=-0.65,f=-3.3!) USER MOD Single : A 62 LYS NZ :NH3+ 152:sc= 0 (180deg=-0.653) USER MOD Single : A 63 CYS SG : rot -53:sc= -0.0334 USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 TYR OH : rot -66:sc= 0.148 USER MOD Single : A 68 LYS NZ :NH3+ 174:sc= 2.02 (180deg=1.79) USER MOD Single : A 73 TYR OH : rot 180:sc= -0.0588 USER MOD Single : A 77 SER OG : rot 79:sc= 1.12 USER MOD Single : A 81 GLN :FLIP amide:sc= -0.862 F(o=-2.2,f=-0.86) USER MOD Single : A 82 SER OG : rot 76:sc= 0.232 USER MOD Single : A 84 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 85 GLN :FLIP amide:sc= -1.63! C(o=-3!,f=-1.6!) USER MOD Single : A 88 GLN : amide:sc= -4.86! C(o=-4.9!,f=-6.3!) USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot -65:sc= 0.137 USER MOD Single : A 99 ASN : amide:sc= -1.67 X(o=-1.7,f=-1.7) USER MOD Single : A 100 ASN : amide:sc= 0 X(o=0,f=-0.016) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 150:sc= -1.7 USER MOD Single : A 106 GLN : amide:sc= -0.813 K(o=-0.81,f=-1.6) USER MOD Single : A 107 ASN : amide:sc= -0.594 K(o=-0.59,f=-1.3) USER MOD Single : A 109 TYR OH : rot -162:sc= 0.623 USER MOD Single : A 111 CYS SG : rot 180:sc= -1.4 USER MOD Single : A 116 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 LYS NZ :NH3+ -162:sc= 0.336 (180deg=0.236) USER MOD Single : A 124 ASN : amide:sc= 0.413 X(o=0.41,f=0) USER MOD Single : A 127 GLN : amide:sc=-5.61e-05 X(o=-5.6e-05,f=-0.017) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 ASN :FLIP amide:sc= 0.13 F(o=-1.2,f=0.13) USER MOD Single : A 130 ASN : amide:sc= -0.232 K(o=-0.23,f=-2.2) USER MOD Single : A 133 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 134 SER OG : rot 180:sc= 0 USER MOD Single : A 138 GLN : amide:sc= 0.192 K(o=0.19,f=-0.41) USER MOD Single : A 143 MET CE :methyl -163:sc= -0.913 (180deg=-2.72) USER MOD Single : A 147 SER OG : rot 180:sc= 0 USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -36.986 8.694 -2.325 1.00 0.00 N ATOM 2 CA GLY A 1 -36.540 10.074 -2.393 1.00 0.00 C ATOM 3 C GLY A 1 -35.713 10.476 -1.188 1.00 0.00 C ATOM 4 O GLY A 1 -36.213 11.133 -0.275 1.00 0.00 O ATOM 0 H1 GLY A 1 -37.547 8.468 -3.171 1.00 0.00 H new ATOM 0 H2 GLY A 1 -36.160 8.064 -2.279 1.00 0.00 H new ATOM 0 H3 GLY A 1 -37.571 8.560 -1.476 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -35.951 10.218 -3.299 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -37.407 10.730 -2.470 1.00 0.00 H new ATOM 8 N SER A 2 -34.444 10.080 -1.185 1.00 0.00 N ATOM 9 CA SER A 2 -33.547 10.399 -0.080 1.00 0.00 C ATOM 10 C SER A 2 -33.833 11.794 0.466 1.00 0.00 C ATOM 11 O SER A 2 -34.026 11.975 1.668 1.00 0.00 O ATOM 12 CB SER A 2 -32.090 10.305 -0.536 1.00 0.00 C ATOM 13 OG SER A 2 -31.239 9.963 0.544 1.00 0.00 O ATOM 0 H SER A 2 -34.014 9.538 -1.935 1.00 0.00 H new ATOM 0 HA SER A 2 -33.718 9.675 0.716 1.00 0.00 H new ATOM 0 HB2 SER A 2 -32.000 9.558 -1.325 1.00 0.00 H new ATOM 0 HB3 SER A 2 -31.777 11.258 -0.962 1.00 0.00 H new ATOM 0 HG SER A 2 -30.314 9.907 0.226 1.00 0.00 H new ATOM 19 N SER A 3 -33.857 12.779 -0.427 1.00 0.00 N ATOM 20 CA SER A 3 -34.115 14.160 -0.035 1.00 0.00 C ATOM 21 C SER A 3 -33.474 14.470 1.314 1.00 0.00 C ATOM 22 O SER A 3 -34.069 15.139 2.158 1.00 0.00 O ATOM 23 CB SER A 3 -35.621 14.421 0.031 1.00 0.00 C ATOM 24 OG SER A 3 -36.268 13.467 0.855 1.00 0.00 O ATOM 0 H SER A 3 -33.701 12.646 -1.426 1.00 0.00 H new ATOM 0 HA SER A 3 -33.673 14.814 -0.787 1.00 0.00 H new ATOM 0 HB2 SER A 3 -35.803 15.424 0.418 1.00 0.00 H new ATOM 0 HB3 SER A 3 -36.044 14.385 -0.973 1.00 0.00 H new ATOM 0 HG SER A 3 -36.486 12.672 0.326 1.00 0.00 H new ATOM 30 N GLY A 4 -32.254 13.978 1.511 1.00 0.00 N ATOM 31 CA GLY A 4 -31.552 14.213 2.759 1.00 0.00 C ATOM 32 C GLY A 4 -30.871 15.567 2.795 1.00 0.00 C ATOM 33 O GLY A 4 -31.175 16.444 1.986 1.00 0.00 O ATOM 0 H GLY A 4 -31.740 13.421 0.828 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -32.257 14.142 3.588 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -30.807 13.431 2.906 1.00 0.00 H new ATOM 37 N SER A 5 -29.949 15.739 3.737 1.00 0.00 N ATOM 38 CA SER A 5 -29.227 16.998 3.879 1.00 0.00 C ATOM 39 C SER A 5 -28.000 17.026 2.973 1.00 0.00 C ATOM 40 O SER A 5 -27.633 16.015 2.374 1.00 0.00 O ATOM 41 CB SER A 5 -28.806 17.207 5.335 1.00 0.00 C ATOM 42 OG SER A 5 -29.913 17.079 6.210 1.00 0.00 O ATOM 0 H SER A 5 -29.684 15.022 4.413 1.00 0.00 H new ATOM 0 HA SER A 5 -29.894 17.807 3.582 1.00 0.00 H new ATOM 0 HB2 SER A 5 -28.040 16.479 5.603 1.00 0.00 H new ATOM 0 HB3 SER A 5 -28.360 18.195 5.450 1.00 0.00 H new ATOM 0 HG SER A 5 -29.617 17.215 7.134 1.00 0.00 H new ATOM 48 N SER A 6 -27.368 18.192 2.879 1.00 0.00 N ATOM 49 CA SER A 6 -26.184 18.354 2.043 1.00 0.00 C ATOM 50 C SER A 6 -24.943 18.585 2.900 1.00 0.00 C ATOM 51 O SER A 6 -25.039 19.017 4.048 1.00 0.00 O ATOM 52 CB SER A 6 -26.374 19.523 1.075 1.00 0.00 C ATOM 53 OG SER A 6 -26.751 20.702 1.765 1.00 0.00 O ATOM 0 H SER A 6 -27.656 19.038 3.371 1.00 0.00 H new ATOM 0 HA SER A 6 -26.044 17.437 1.471 1.00 0.00 H new ATOM 0 HB2 SER A 6 -25.448 19.699 0.527 1.00 0.00 H new ATOM 0 HB3 SER A 6 -27.137 19.269 0.339 1.00 0.00 H new ATOM 0 HG SER A 6 -26.864 21.434 1.124 1.00 0.00 H new ATOM 59 N GLY A 7 -23.777 18.294 2.331 1.00 0.00 N ATOM 60 CA GLY A 7 -22.532 18.476 3.056 1.00 0.00 C ATOM 61 C GLY A 7 -21.401 17.645 2.483 1.00 0.00 C ATOM 62 O GLY A 7 -21.562 16.994 1.450 1.00 0.00 O ATOM 0 H GLY A 7 -23.672 17.936 1.382 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -22.253 19.529 3.033 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -22.682 18.208 4.102 1.00 0.00 H new ATOM 66 N ASP A 8 -20.255 17.668 3.153 1.00 0.00 N ATOM 67 CA ASP A 8 -19.092 16.911 2.704 1.00 0.00 C ATOM 68 C ASP A 8 -19.289 15.418 2.945 1.00 0.00 C ATOM 69 O ASP A 8 -19.899 15.015 3.934 1.00 0.00 O ATOM 70 CB ASP A 8 -17.832 17.395 3.425 1.00 0.00 C ATOM 71 CG ASP A 8 -16.562 16.852 2.800 1.00 0.00 C ATOM 72 OD1 ASP A 8 -16.389 17.012 1.574 1.00 0.00 O ATOM 73 OD2 ASP A 8 -15.743 16.265 3.537 1.00 0.00 O ATOM 0 H ASP A 8 -20.106 18.202 4.009 1.00 0.00 H new ATOM 0 HA ASP A 8 -18.974 17.075 1.633 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -17.804 18.485 3.409 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -17.877 17.092 4.471 1.00 0.00 H new ATOM 78 N ASN A 9 -18.768 14.603 2.034 1.00 0.00 N ATOM 79 CA ASN A 9 -18.888 13.154 2.147 1.00 0.00 C ATOM 80 C ASN A 9 -17.640 12.461 1.609 1.00 0.00 C ATOM 81 O ASN A 9 -17.233 12.688 0.470 1.00 0.00 O ATOM 82 CB ASN A 9 -20.124 12.663 1.390 1.00 0.00 C ATOM 83 CG ASN A 9 -21.416 13.146 2.019 1.00 0.00 C ATOM 84 OD1 ASN A 9 -21.900 14.235 1.711 1.00 0.00 O ATOM 85 ND2 ASN A 9 -21.982 12.334 2.905 1.00 0.00 N ATOM 0 H ASN A 9 -18.259 14.921 1.209 1.00 0.00 H new ATOM 0 HA ASN A 9 -18.994 12.905 3.203 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -20.075 13.008 0.357 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -20.121 11.573 1.363 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -22.854 12.604 3.361 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -21.545 11.440 3.130 1.00 0.00 H new ATOM 92 N MET A 10 -17.036 11.614 2.437 1.00 0.00 N ATOM 93 CA MET A 10 -15.835 10.886 2.043 1.00 0.00 C ATOM 94 C MET A 10 -16.195 9.629 1.258 1.00 0.00 C ATOM 95 O MET A 10 -15.647 8.555 1.505 1.00 0.00 O ATOM 96 CB MET A 10 -15.012 10.513 3.278 1.00 0.00 C ATOM 97 CG MET A 10 -14.527 11.715 4.071 1.00 0.00 C ATOM 98 SD MET A 10 -13.493 11.251 5.473 1.00 0.00 S ATOM 99 CE MET A 10 -11.962 10.838 4.642 1.00 0.00 C ATOM 0 H MET A 10 -17.358 11.415 3.384 1.00 0.00 H new ATOM 0 HA MET A 10 -15.240 11.535 1.401 1.00 0.00 H new ATOM 0 HB2 MET A 10 -15.615 9.879 3.928 1.00 0.00 H new ATOM 0 HB3 MET A 10 -14.151 9.923 2.966 1.00 0.00 H new ATOM 0 HG2 MET A 10 -13.964 12.377 3.413 1.00 0.00 H new ATOM 0 HG3 MET A 10 -15.387 12.280 4.430 1.00 0.00 H new ATOM 0 HE1 MET A 10 -11.743 9.780 4.787 1.00 0.00 H new ATOM 0 HE2 MET A 10 -12.059 11.045 3.576 1.00 0.00 H new ATOM 0 HE3 MET A 10 -11.151 11.437 5.056 1.00 0.00 H new ATOM 109 N GLU A 11 -17.118 9.771 0.312 1.00 0.00 N ATOM 110 CA GLU A 11 -17.549 8.645 -0.508 1.00 0.00 C ATOM 111 C GLU A 11 -16.418 8.164 -1.412 1.00 0.00 C ATOM 112 O GLU A 11 -16.306 6.974 -1.705 1.00 0.00 O ATOM 113 CB GLU A 11 -18.761 9.038 -1.356 1.00 0.00 C ATOM 114 CG GLU A 11 -19.131 8.003 -2.405 1.00 0.00 C ATOM 115 CD GLU A 11 -20.002 8.575 -3.507 1.00 0.00 C ATOM 116 OE1 GLU A 11 -19.451 9.217 -4.425 1.00 0.00 O ATOM 117 OE2 GLU A 11 -21.234 8.381 -3.451 1.00 0.00 O ATOM 0 H GLU A 11 -17.581 10.653 0.095 1.00 0.00 H new ATOM 0 HA GLU A 11 -17.829 7.830 0.159 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -19.616 9.200 -0.700 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -18.555 9.987 -1.851 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -18.221 7.593 -2.842 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -19.655 7.176 -1.925 1.00 0.00 H new ATOM 124 N ALA A 12 -15.580 9.098 -1.849 1.00 0.00 N ATOM 125 CA ALA A 12 -14.456 8.771 -2.718 1.00 0.00 C ATOM 126 C ALA A 12 -13.491 7.813 -2.028 1.00 0.00 C ATOM 127 O ALA A 12 -12.981 6.877 -2.645 1.00 0.00 O ATOM 128 CB ALA A 12 -13.731 10.039 -3.143 1.00 0.00 C ATOM 0 H ALA A 12 -15.658 10.088 -1.615 1.00 0.00 H new ATOM 0 HA ALA A 12 -14.847 8.275 -3.606 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -12.894 9.780 -3.791 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -14.420 10.689 -3.682 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -13.358 10.558 -2.260 1.00 0.00 H new ATOM 134 N VAL A 13 -13.242 8.053 -0.744 1.00 0.00 N ATOM 135 CA VAL A 13 -12.337 7.211 0.030 1.00 0.00 C ATOM 136 C VAL A 13 -12.895 5.800 0.182 1.00 0.00 C ATOM 137 O VAL A 13 -12.351 4.843 -0.369 1.00 0.00 O ATOM 138 CB VAL A 13 -12.079 7.803 1.428 1.00 0.00 C ATOM 139 CG1 VAL A 13 -11.320 6.810 2.296 1.00 0.00 C ATOM 140 CG2 VAL A 13 -11.320 9.117 1.318 1.00 0.00 C ATOM 0 H VAL A 13 -13.654 8.824 -0.218 1.00 0.00 H new ATOM 0 HA VAL A 13 -11.396 7.169 -0.518 1.00 0.00 H new ATOM 0 HB VAL A 13 -13.040 8.004 1.902 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -11.147 7.245 3.280 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -11.906 5.897 2.401 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -10.363 6.576 1.829 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -11.146 9.521 2.315 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -10.363 8.944 0.825 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -11.906 9.828 0.735 1.00 0.00 H new ATOM 150 N LYS A 14 -13.983 5.678 0.934 1.00 0.00 N ATOM 151 CA LYS A 14 -14.617 4.384 1.158 1.00 0.00 C ATOM 152 C LYS A 14 -14.493 3.496 -0.075 1.00 0.00 C ATOM 153 O LYS A 14 -14.239 2.296 0.034 1.00 0.00 O ATOM 154 CB LYS A 14 -16.093 4.572 1.517 1.00 0.00 C ATOM 155 CG LYS A 14 -16.314 5.426 2.754 1.00 0.00 C ATOM 156 CD LYS A 14 -17.650 6.149 2.700 1.00 0.00 C ATOM 157 CE LYS A 14 -17.615 7.442 3.501 1.00 0.00 C ATOM 158 NZ LYS A 14 -17.894 7.208 4.945 1.00 0.00 N ATOM 0 H LYS A 14 -14.445 6.460 1.399 1.00 0.00 H new ATOM 0 HA LYS A 14 -14.106 3.896 1.988 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -16.608 5.030 0.673 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -16.547 3.594 1.675 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -16.275 4.797 3.643 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -15.508 6.154 2.843 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -17.905 6.368 1.663 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -18.433 5.499 3.090 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -16.637 7.911 3.391 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -18.349 8.139 3.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -17.861 8.113 5.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -18.838 6.784 5.052 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -17.178 6.563 5.337 1.00 0.00 H new ATOM 172 N THR A 15 -14.670 4.093 -1.250 1.00 0.00 N ATOM 173 CA THR A 15 -14.577 3.356 -2.504 1.00 0.00 C ATOM 174 C THR A 15 -13.190 2.751 -2.684 1.00 0.00 C ATOM 175 O THR A 15 -13.053 1.565 -2.985 1.00 0.00 O ATOM 176 CB THR A 15 -14.892 4.259 -3.711 1.00 0.00 C ATOM 177 OG1 THR A 15 -16.209 4.807 -3.583 1.00 0.00 O ATOM 178 CG2 THR A 15 -14.786 3.479 -5.013 1.00 0.00 C ATOM 0 H THR A 15 -14.879 5.085 -1.359 1.00 0.00 H new ATOM 0 HA THR A 15 -15.316 2.556 -2.456 1.00 0.00 H new ATOM 0 HB THR A 15 -14.163 5.069 -3.731 1.00 0.00 H new ATOM 0 HG1 THR A 15 -16.196 5.540 -2.933 1.00 0.00 H new ATOM 0 HG21 THR A 15 -15.013 4.138 -5.851 1.00 0.00 H new ATOM 0 HG22 THR A 15 -13.774 3.088 -5.122 1.00 0.00 H new ATOM 0 HG23 THR A 15 -15.495 2.651 -5.000 1.00 0.00 H new ATOM 186 N PHE A 16 -12.162 3.573 -2.498 1.00 0.00 N ATOM 187 CA PHE A 16 -10.784 3.119 -2.641 1.00 0.00 C ATOM 188 C PHE A 16 -10.426 2.117 -1.547 1.00 0.00 C ATOM 189 O PHE A 16 -9.695 1.156 -1.786 1.00 0.00 O ATOM 190 CB PHE A 16 -9.824 4.309 -2.591 1.00 0.00 C ATOM 191 CG PHE A 16 -8.380 3.911 -2.488 1.00 0.00 C ATOM 192 CD1 PHE A 16 -7.801 3.669 -1.252 1.00 0.00 C ATOM 193 CD2 PHE A 16 -7.600 3.780 -3.626 1.00 0.00 C ATOM 194 CE1 PHE A 16 -6.472 3.302 -1.153 1.00 0.00 C ATOM 195 CE2 PHE A 16 -6.271 3.413 -3.533 1.00 0.00 C ATOM 196 CZ PHE A 16 -5.706 3.175 -2.295 1.00 0.00 C ATOM 0 H PHE A 16 -12.258 4.557 -2.248 1.00 0.00 H new ATOM 0 HA PHE A 16 -10.689 2.625 -3.608 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -9.962 4.915 -3.486 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -10.081 4.937 -1.738 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -8.395 3.768 -0.356 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -8.036 3.967 -4.596 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -6.033 3.115 -0.184 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -5.674 3.312 -4.428 1.00 0.00 H new ATOM 0 HZ PHE A 16 -4.667 2.890 -2.220 1.00 0.00 H new ATOM 206 N ASN A 17 -10.945 2.349 -0.346 1.00 0.00 N ATOM 207 CA ASN A 17 -10.680 1.469 0.786 1.00 0.00 C ATOM 208 C ASN A 17 -11.066 0.030 0.457 1.00 0.00 C ATOM 209 O ASN A 17 -10.575 -0.913 1.079 1.00 0.00 O ATOM 210 CB ASN A 17 -11.447 1.945 2.021 1.00 0.00 C ATOM 211 CG ASN A 17 -10.639 2.909 2.868 1.00 0.00 C ATOM 212 OD1 ASN A 17 -10.198 4.004 2.260 1.00 0.00 O flip ATOM 213 ND2 ASN A 17 -10.413 2.671 4.054 1.00 0.00 N flip ATOM 0 H ASN A 17 -11.552 3.140 -0.131 1.00 0.00 H new ATOM 0 HA ASN A 17 -9.611 1.501 0.997 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -12.372 2.429 1.707 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -11.728 1.083 2.625 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -10.772 1.817 4.480 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -9.867 3.328 4.611 1.00 0.00 H new ATOM 220 N SER A 18 -11.948 -0.131 -0.524 1.00 0.00 N ATOM 221 CA SER A 18 -12.402 -1.455 -0.934 1.00 0.00 C ATOM 222 C SER A 18 -11.467 -2.051 -1.982 1.00 0.00 C ATOM 223 O SER A 18 -11.095 -3.221 -1.903 1.00 0.00 O ATOM 224 CB SER A 18 -13.826 -1.379 -1.489 1.00 0.00 C ATOM 225 OG SER A 18 -14.736 -0.932 -0.499 1.00 0.00 O ATOM 0 H SER A 18 -12.362 0.639 -1.050 1.00 0.00 H new ATOM 0 HA SER A 18 -12.395 -2.102 -0.057 1.00 0.00 H new ATOM 0 HB2 SER A 18 -13.851 -0.702 -2.343 1.00 0.00 H new ATOM 0 HB3 SER A 18 -14.131 -2.361 -1.851 1.00 0.00 H new ATOM 0 HG SER A 18 -14.595 0.024 -0.333 1.00 0.00 H new ATOM 231 N GLU A 19 -11.091 -1.235 -2.962 1.00 0.00 N ATOM 232 CA GLU A 19 -10.200 -1.682 -4.026 1.00 0.00 C ATOM 233 C GLU A 19 -8.806 -1.979 -3.480 1.00 0.00 C ATOM 234 O GLU A 19 -8.147 -2.927 -3.911 1.00 0.00 O ATOM 235 CB GLU A 19 -10.112 -0.622 -5.126 1.00 0.00 C ATOM 236 CG GLU A 19 -11.465 -0.090 -5.568 1.00 0.00 C ATOM 237 CD GLU A 19 -12.267 -1.112 -6.349 1.00 0.00 C ATOM 238 OE1 GLU A 19 -11.801 -1.531 -7.430 1.00 0.00 O ATOM 239 OE2 GLU A 19 -13.361 -1.492 -5.882 1.00 0.00 O ATOM 0 H GLU A 19 -11.389 -0.263 -3.041 1.00 0.00 H new ATOM 0 HA GLU A 19 -10.610 -2.600 -4.447 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -9.503 0.209 -4.770 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -9.599 -1.047 -5.988 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -12.034 0.219 -4.691 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -11.319 0.798 -6.183 1.00 0.00 H new ATOM 246 N LEU A 20 -8.363 -1.164 -2.529 1.00 0.00 N ATOM 247 CA LEU A 20 -7.048 -1.339 -1.923 1.00 0.00 C ATOM 248 C LEU A 20 -6.914 -2.726 -1.303 1.00 0.00 C ATOM 249 O LEU A 20 -6.039 -3.505 -1.683 1.00 0.00 O ATOM 250 CB LEU A 20 -6.809 -0.266 -0.859 1.00 0.00 C ATOM 251 CG LEU A 20 -5.362 -0.089 -0.398 1.00 0.00 C ATOM 252 CD1 LEU A 20 -4.995 -1.148 0.630 1.00 0.00 C ATOM 253 CD2 LEU A 20 -4.413 -0.146 -1.586 1.00 0.00 C ATOM 0 H LEU A 20 -8.895 -0.376 -2.161 1.00 0.00 H new ATOM 0 HA LEU A 20 -6.297 -1.238 -2.707 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -7.165 0.688 -1.248 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -7.420 -0.504 0.012 1.00 0.00 H new ATOM 0 HG LEU A 20 -5.268 0.891 0.071 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -3.962 -1.006 0.946 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -5.654 -1.060 1.494 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -5.106 -2.138 0.188 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -3.388 -0.018 -1.239 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -4.510 -1.111 -2.083 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -4.660 0.650 -2.288 1.00 0.00 H new ATOM 265 N TYR A 21 -7.787 -3.029 -0.349 1.00 0.00 N ATOM 266 CA TYR A 21 -7.766 -4.322 0.323 1.00 0.00 C ATOM 267 C TYR A 21 -8.315 -5.418 -0.585 1.00 0.00 C ATOM 268 O TYR A 21 -8.046 -6.601 -0.382 1.00 0.00 O ATOM 269 CB TYR A 21 -8.580 -4.261 1.617 1.00 0.00 C ATOM 270 CG TYR A 21 -7.898 -3.494 2.727 1.00 0.00 C ATOM 271 CD1 TYR A 21 -7.810 -2.107 2.687 1.00 0.00 C ATOM 272 CD2 TYR A 21 -7.340 -4.155 3.814 1.00 0.00 C ATOM 273 CE1 TYR A 21 -7.187 -1.402 3.699 1.00 0.00 C ATOM 274 CE2 TYR A 21 -6.716 -3.458 4.830 1.00 0.00 C ATOM 275 CZ TYR A 21 -6.642 -2.082 4.768 1.00 0.00 C ATOM 276 OH TYR A 21 -6.020 -1.384 5.778 1.00 0.00 O ATOM 0 H TYR A 21 -8.518 -2.396 -0.024 1.00 0.00 H new ATOM 0 HA TYR A 21 -6.730 -4.560 0.564 1.00 0.00 H new ATOM 0 HB2 TYR A 21 -9.545 -3.799 1.408 1.00 0.00 H new ATOM 0 HB3 TYR A 21 -8.780 -5.277 1.959 1.00 0.00 H new ATOM 0 HD1 TYR A 21 -8.236 -1.572 1.851 1.00 0.00 H new ATOM 0 HD2 TYR A 21 -7.395 -5.232 3.865 1.00 0.00 H new ATOM 0 HE1 TYR A 21 -7.127 -0.325 3.653 1.00 0.00 H new ATOM 0 HE2 TYR A 21 -6.288 -3.987 5.669 1.00 0.00 H new ATOM 0 HH TYR A 21 -5.692 -2.012 6.455 1.00 0.00 H new ATOM 286 N SER A 22 -9.086 -5.013 -1.589 1.00 0.00 N ATOM 287 CA SER A 22 -9.677 -5.959 -2.529 1.00 0.00 C ATOM 288 C SER A 22 -8.609 -6.872 -3.124 1.00 0.00 C ATOM 289 O SER A 22 -8.917 -7.926 -3.682 1.00 0.00 O ATOM 290 CB SER A 22 -10.407 -5.213 -3.647 1.00 0.00 C ATOM 291 OG SER A 22 -10.585 -6.042 -4.782 1.00 0.00 O ATOM 0 H SER A 22 -9.316 -4.036 -1.773 1.00 0.00 H new ATOM 0 HA SER A 22 -10.394 -6.573 -1.985 1.00 0.00 H new ATOM 0 HB2 SER A 22 -11.377 -4.871 -3.287 1.00 0.00 H new ATOM 0 HB3 SER A 22 -9.840 -4.325 -3.927 1.00 0.00 H new ATOM 0 HG SER A 22 -11.055 -5.542 -5.482 1.00 0.00 H new ATOM 297 N LEU A 23 -7.352 -6.460 -3.001 1.00 0.00 N ATOM 298 CA LEU A 23 -6.237 -7.239 -3.526 1.00 0.00 C ATOM 299 C LEU A 23 -6.266 -8.665 -2.985 1.00 0.00 C ATOM 300 O LEU A 23 -5.834 -9.602 -3.655 1.00 0.00 O ATOM 301 CB LEU A 23 -4.908 -6.572 -3.166 1.00 0.00 C ATOM 302 CG LEU A 23 -4.463 -5.428 -4.078 1.00 0.00 C ATOM 303 CD1 LEU A 23 -3.162 -4.821 -3.575 1.00 0.00 C ATOM 304 CD2 LEU A 23 -4.307 -5.917 -5.510 1.00 0.00 C ATOM 0 H LEU A 23 -7.080 -5.591 -2.542 1.00 0.00 H new ATOM 0 HA LEU A 23 -6.334 -7.279 -4.611 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -4.980 -6.191 -2.147 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -4.129 -7.335 -3.167 1.00 0.00 H new ATOM 0 HG LEU A 23 -5.232 -4.655 -4.062 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -2.860 -4.008 -4.236 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -3.307 -4.434 -2.567 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -2.385 -5.585 -3.562 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -3.990 -5.089 -6.145 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -3.558 -6.708 -5.545 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -5.261 -6.304 -5.868 1.00 0.00 H new ATOM 316 N ASN A 24 -6.780 -8.821 -1.770 1.00 0.00 N ATOM 317 CA ASN A 24 -6.868 -10.133 -1.139 1.00 0.00 C ATOM 318 C ASN A 24 -7.588 -11.126 -2.047 1.00 0.00 C ATOM 319 O ASN A 24 -7.296 -12.321 -2.031 1.00 0.00 O ATOM 320 CB ASN A 24 -7.596 -10.029 0.202 1.00 0.00 C ATOM 321 CG ASN A 24 -6.656 -9.700 1.346 1.00 0.00 C ATOM 322 OD1 ASN A 24 -6.495 -10.488 2.278 1.00 0.00 O ATOM 323 ND2 ASN A 24 -6.031 -8.530 1.280 1.00 0.00 N ATOM 0 H ASN A 24 -7.142 -8.055 -1.202 1.00 0.00 H new ATOM 0 HA ASN A 24 -5.854 -10.495 -0.967 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -8.366 -9.260 0.136 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -8.103 -10.971 0.411 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -5.387 -8.253 2.021 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -6.195 -7.908 0.488 1.00 0.00 H new ATOM 330 N ASP A 25 -8.530 -10.621 -2.836 1.00 0.00 N ATOM 331 CA ASP A 25 -9.291 -11.463 -3.752 1.00 0.00 C ATOM 332 C ASP A 25 -8.377 -12.094 -4.797 1.00 0.00 C ATOM 333 O ASP A 25 -8.562 -13.248 -5.182 1.00 0.00 O ATOM 334 CB ASP A 25 -10.386 -10.644 -4.439 1.00 0.00 C ATOM 335 CG ASP A 25 -11.484 -10.227 -3.482 1.00 0.00 C ATOM 336 OD1 ASP A 25 -11.639 -10.886 -2.433 1.00 0.00 O ATOM 337 OD2 ASP A 25 -12.190 -9.241 -3.782 1.00 0.00 O ATOM 0 H ASP A 25 -8.785 -9.634 -2.860 1.00 0.00 H new ATOM 0 HA ASP A 25 -9.755 -12.262 -3.173 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -9.943 -9.755 -4.888 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -10.818 -11.229 -5.250 1.00 0.00 H new ATOM 342 N TYR A 26 -7.392 -11.328 -5.253 1.00 0.00 N ATOM 343 CA TYR A 26 -6.451 -11.811 -6.257 1.00 0.00 C ATOM 344 C TYR A 26 -5.086 -12.088 -5.636 1.00 0.00 C ATOM 345 O TYR A 26 -4.594 -11.311 -4.816 1.00 0.00 O ATOM 346 CB TYR A 26 -6.312 -10.791 -7.388 1.00 0.00 C ATOM 347 CG TYR A 26 -7.587 -10.032 -7.680 1.00 0.00 C ATOM 348 CD1 TYR A 26 -8.029 -9.025 -6.830 1.00 0.00 C ATOM 349 CD2 TYR A 26 -8.348 -10.321 -8.805 1.00 0.00 C ATOM 350 CE1 TYR A 26 -9.194 -8.330 -7.092 1.00 0.00 C ATOM 351 CE2 TYR A 26 -9.514 -9.630 -9.076 1.00 0.00 C ATOM 352 CZ TYR A 26 -9.932 -8.636 -8.217 1.00 0.00 C ATOM 353 OH TYR A 26 -11.092 -7.945 -8.482 1.00 0.00 O ATOM 0 H TYR A 26 -7.224 -10.371 -4.944 1.00 0.00 H new ATOM 0 HA TYR A 26 -6.840 -12.744 -6.664 1.00 0.00 H new ATOM 0 HB2 TYR A 26 -5.527 -10.080 -7.130 1.00 0.00 H new ATOM 0 HB3 TYR A 26 -5.991 -11.306 -8.293 1.00 0.00 H new ATOM 0 HD1 TYR A 26 -7.452 -8.782 -5.950 1.00 0.00 H new ATOM 0 HD2 TYR A 26 -8.023 -11.099 -9.480 1.00 0.00 H new ATOM 0 HE1 TYR A 26 -9.525 -7.552 -6.420 1.00 0.00 H new ATOM 0 HE2 TYR A 26 -10.094 -9.867 -9.955 1.00 0.00 H new ATOM 0 HH TYR A 26 -11.491 -8.281 -9.312 1.00 0.00 H new ATOM 363 N LYS A 27 -4.477 -13.200 -6.032 1.00 0.00 N ATOM 364 CA LYS A 27 -3.167 -13.581 -5.518 1.00 0.00 C ATOM 365 C LYS A 27 -2.060 -13.149 -6.474 1.00 0.00 C ATOM 366 O LYS A 27 -2.142 -13.347 -7.686 1.00 0.00 O ATOM 367 CB LYS A 27 -3.104 -15.094 -5.297 1.00 0.00 C ATOM 368 CG LYS A 27 -4.290 -15.647 -4.526 1.00 0.00 C ATOM 369 CD LYS A 27 -4.571 -17.094 -4.896 1.00 0.00 C ATOM 370 CE LYS A 27 -3.527 -18.032 -4.309 1.00 0.00 C ATOM 371 NZ LYS A 27 -3.880 -18.458 -2.927 1.00 0.00 N ATOM 0 H LYS A 27 -4.870 -13.854 -6.708 1.00 0.00 H new ATOM 0 HA LYS A 27 -3.017 -13.074 -4.565 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -3.047 -15.592 -6.265 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -2.187 -15.336 -4.759 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -4.095 -15.576 -3.456 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -5.172 -15.041 -4.730 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -5.560 -17.377 -4.536 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -4.585 -17.197 -5.981 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -3.429 -18.911 -4.946 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -2.557 -17.535 -4.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -3.144 -19.096 -2.562 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -3.949 -17.622 -2.313 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -4.794 -18.954 -2.939 1.00 0.00 H new ATOM 385 N PRO A 28 -0.999 -12.547 -5.918 1.00 0.00 N ATOM 386 CA PRO A 28 0.146 -12.076 -6.704 1.00 0.00 C ATOM 387 C PRO A 28 0.649 -13.131 -7.683 1.00 0.00 C ATOM 388 O PRO A 28 0.778 -14.310 -7.352 1.00 0.00 O ATOM 389 CB PRO A 28 1.209 -11.783 -5.642 1.00 0.00 C ATOM 390 CG PRO A 28 0.435 -11.486 -4.403 1.00 0.00 C ATOM 391 CD PRO A 28 -0.834 -12.278 -4.479 1.00 0.00 C ATOM 0 HA PRO A 28 -0.109 -11.214 -7.320 1.00 0.00 H new ATOM 0 HB2 PRO A 28 1.872 -12.636 -5.500 1.00 0.00 H new ATOM 0 HB3 PRO A 28 1.834 -10.938 -5.930 1.00 0.00 H new ATOM 0 HG2 PRO A 28 1.007 -11.759 -3.516 1.00 0.00 H new ATOM 0 HG3 PRO A 28 0.220 -10.420 -4.329 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.763 -13.202 -3.906 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -1.679 -11.718 -4.078 1.00 0.00 H new ATOM 399 N PRO A 29 0.942 -12.700 -8.919 1.00 0.00 N ATOM 400 CA PRO A 29 0.793 -11.299 -9.325 1.00 0.00 C ATOM 401 C PRO A 29 -0.669 -10.875 -9.418 1.00 0.00 C ATOM 402 O PRO A 29 -1.569 -11.715 -9.420 1.00 0.00 O ATOM 403 CB PRO A 29 1.450 -11.258 -10.707 1.00 0.00 C ATOM 404 CG PRO A 29 1.340 -12.652 -11.220 1.00 0.00 C ATOM 405 CD PRO A 29 1.441 -13.546 -10.016 1.00 0.00 C ATOM 0 HA PRO A 29 1.242 -10.616 -8.604 1.00 0.00 H new ATOM 0 HB2 PRO A 29 0.943 -10.553 -11.366 1.00 0.00 H new ATOM 0 HB3 PRO A 29 2.491 -10.941 -10.641 1.00 0.00 H new ATOM 0 HG2 PRO A 29 0.394 -12.803 -11.740 1.00 0.00 H new ATOM 0 HG3 PRO A 29 2.134 -12.869 -11.934 1.00 0.00 H new ATOM 0 HD2 PRO A 29 0.840 -14.447 -10.133 1.00 0.00 H new ATOM 0 HD3 PRO A 29 2.467 -13.868 -9.840 1.00 0.00 H new ATOM 413 N ILE A 30 -0.897 -9.568 -9.494 1.00 0.00 N ATOM 414 CA ILE A 30 -2.250 -9.034 -9.588 1.00 0.00 C ATOM 415 C ILE A 30 -2.576 -8.613 -11.017 1.00 0.00 C ATOM 416 O ILE A 30 -1.742 -8.031 -11.710 1.00 0.00 O ATOM 417 CB ILE A 30 -2.445 -7.826 -8.652 1.00 0.00 C ATOM 418 CG1 ILE A 30 -2.163 -8.226 -7.203 1.00 0.00 C ATOM 419 CG2 ILE A 30 -3.855 -7.271 -8.790 1.00 0.00 C ATOM 420 CD1 ILE A 30 -3.173 -9.200 -6.637 1.00 0.00 C ATOM 0 H ILE A 30 -0.163 -8.860 -9.492 1.00 0.00 H new ATOM 0 HA ILE A 30 -2.926 -9.832 -9.283 1.00 0.00 H new ATOM 0 HB ILE A 30 -1.739 -7.046 -8.938 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -1.169 -8.670 -7.144 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -2.148 -7.329 -6.583 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -3.977 -6.418 -8.122 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -4.022 -6.953 -9.819 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -4.577 -8.044 -8.527 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -2.910 -9.439 -5.607 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -4.166 -8.751 -6.663 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -3.172 -10.113 -7.233 1.00 0.00 H new ATOM 432 N SER A 31 -3.797 -8.911 -11.452 1.00 0.00 N ATOM 433 CA SER A 31 -4.234 -8.566 -12.799 1.00 0.00 C ATOM 434 C SER A 31 -3.948 -7.099 -13.104 1.00 0.00 C ATOM 435 O SER A 31 -4.274 -6.213 -12.314 1.00 0.00 O ATOM 436 CB SER A 31 -5.728 -8.851 -12.962 1.00 0.00 C ATOM 437 OG SER A 31 -5.986 -10.244 -12.950 1.00 0.00 O ATOM 0 H SER A 31 -4.501 -9.391 -10.890 1.00 0.00 H new ATOM 0 HA SER A 31 -3.675 -9.181 -13.504 1.00 0.00 H new ATOM 0 HB2 SER A 31 -6.283 -8.368 -12.158 1.00 0.00 H new ATOM 0 HB3 SER A 31 -6.084 -8.420 -13.898 1.00 0.00 H new ATOM 0 HG SER A 31 -6.948 -10.399 -13.054 1.00 0.00 H new ATOM 443 N LYS A 32 -3.335 -6.849 -14.256 1.00 0.00 N ATOM 444 CA LYS A 32 -3.005 -5.490 -14.669 1.00 0.00 C ATOM 445 C LYS A 32 -4.214 -4.570 -14.530 1.00 0.00 C ATOM 446 O LYS A 32 -4.099 -3.446 -14.042 1.00 0.00 O ATOM 447 CB LYS A 32 -2.508 -5.481 -16.116 1.00 0.00 C ATOM 448 CG LYS A 32 -1.060 -5.917 -16.264 1.00 0.00 C ATOM 449 CD LYS A 32 -0.678 -6.093 -17.724 1.00 0.00 C ATOM 450 CE LYS A 32 0.426 -7.127 -17.890 1.00 0.00 C ATOM 451 NZ LYS A 32 0.607 -7.520 -19.315 1.00 0.00 N ATOM 0 H LYS A 32 -3.056 -7.571 -14.921 1.00 0.00 H new ATOM 0 HA LYS A 32 -2.213 -5.121 -14.017 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -3.140 -6.139 -16.713 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -2.620 -4.476 -16.524 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -0.407 -5.176 -15.803 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -0.905 -6.855 -15.731 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -1.554 -6.399 -18.296 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -0.348 -5.138 -18.133 1.00 0.00 H new ATOM 0 HE2 LYS A 32 1.362 -6.725 -17.502 1.00 0.00 H new ATOM 0 HE3 LYS A 32 0.189 -8.010 -17.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 1.368 -8.226 -19.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -0.278 -7.927 -19.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 0.858 -6.682 -19.877 1.00 0.00 H new ATOM 465 N ALA A 33 -5.374 -5.055 -14.962 1.00 0.00 N ATOM 466 CA ALA A 33 -6.604 -4.278 -14.882 1.00 0.00 C ATOM 467 C ALA A 33 -6.901 -3.866 -13.444 1.00 0.00 C ATOM 468 O ALA A 33 -7.314 -2.735 -13.184 1.00 0.00 O ATOM 469 CB ALA A 33 -7.768 -5.072 -15.456 1.00 0.00 C ATOM 0 H ALA A 33 -5.487 -5.983 -15.371 1.00 0.00 H new ATOM 0 HA ALA A 33 -6.470 -3.371 -15.472 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -8.680 -4.479 -15.390 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -7.566 -5.311 -16.500 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -7.893 -5.995 -14.890 1.00 0.00 H new ATOM 475 N LYS A 34 -6.690 -4.790 -12.513 1.00 0.00 N ATOM 476 CA LYS A 34 -6.934 -4.523 -11.100 1.00 0.00 C ATOM 477 C LYS A 34 -6.142 -3.306 -10.632 1.00 0.00 C ATOM 478 O LYS A 34 -6.719 -2.302 -10.215 1.00 0.00 O ATOM 479 CB LYS A 34 -6.559 -5.744 -10.257 1.00 0.00 C ATOM 480 CG LYS A 34 -6.522 -5.465 -8.765 1.00 0.00 C ATOM 481 CD LYS A 34 -7.922 -5.380 -8.179 1.00 0.00 C ATOM 482 CE LYS A 34 -7.917 -4.693 -6.822 1.00 0.00 C ATOM 483 NZ LYS A 34 -7.290 -5.543 -5.772 1.00 0.00 N ATOM 0 H LYS A 34 -6.350 -5.731 -12.711 1.00 0.00 H new ATOM 0 HA LYS A 34 -7.996 -4.314 -10.973 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -7.275 -6.543 -10.451 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -5.582 -6.108 -10.574 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -5.962 -6.253 -8.260 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -5.992 -4.530 -8.582 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.571 -4.833 -8.863 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.337 -6.383 -8.079 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -7.377 -3.749 -6.895 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -8.940 -4.454 -6.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -6.952 -4.941 -4.994 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -7.992 -6.218 -5.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -6.488 -6.064 -6.180 1.00 0.00 H new ATOM 497 N MET A 35 -4.819 -3.403 -10.705 1.00 0.00 N ATOM 498 CA MET A 35 -3.949 -2.309 -10.290 1.00 0.00 C ATOM 499 C MET A 35 -4.518 -0.964 -10.732 1.00 0.00 C ATOM 500 O MET A 35 -4.355 0.047 -10.047 1.00 0.00 O ATOM 501 CB MET A 35 -2.545 -2.496 -10.870 1.00 0.00 C ATOM 502 CG MET A 35 -1.612 -3.279 -9.961 1.00 0.00 C ATOM 503 SD MET A 35 -1.296 -2.437 -8.398 1.00 0.00 S ATOM 504 CE MET A 35 -0.890 -3.826 -7.342 1.00 0.00 C ATOM 0 H MET A 35 -4.326 -4.228 -11.048 1.00 0.00 H new ATOM 0 HA MET A 35 -3.889 -2.319 -9.202 1.00 0.00 H new ATOM 0 HB2 MET A 35 -2.622 -3.010 -11.828 1.00 0.00 H new ATOM 0 HB3 MET A 35 -2.109 -1.517 -11.068 1.00 0.00 H new ATOM 0 HG2 MET A 35 -2.045 -4.259 -9.760 1.00 0.00 H new ATOM 0 HG3 MET A 35 -0.666 -3.448 -10.476 1.00 0.00 H new ATOM 0 HE1 MET A 35 -0.617 -3.462 -6.351 1.00 0.00 H new ATOM 0 HE2 MET A 35 -1.754 -4.486 -7.261 1.00 0.00 H new ATOM 0 HE3 MET A 35 -0.052 -4.376 -7.770 1.00 0.00 H new ATOM 514 N THR A 36 -5.188 -0.959 -11.880 1.00 0.00 N ATOM 515 CA THR A 36 -5.781 0.261 -12.413 1.00 0.00 C ATOM 516 C THR A 36 -7.056 0.627 -11.663 1.00 0.00 C ATOM 517 O THR A 36 -7.274 1.789 -11.322 1.00 0.00 O ATOM 518 CB THR A 36 -6.104 0.120 -13.913 1.00 0.00 C ATOM 519 OG1 THR A 36 -4.891 0.065 -14.672 1.00 0.00 O ATOM 520 CG2 THR A 36 -6.957 1.284 -14.395 1.00 0.00 C ATOM 0 H THR A 36 -5.333 -1.786 -12.459 1.00 0.00 H new ATOM 0 HA THR A 36 -5.045 1.054 -12.280 1.00 0.00 H new ATOM 0 HB THR A 36 -6.664 -0.804 -14.056 1.00 0.00 H new ATOM 0 HG1 THR A 36 -5.105 -0.026 -15.624 1.00 0.00 H new ATOM 0 HG21 THR A 36 -7.172 1.162 -15.457 1.00 0.00 H new ATOM 0 HG22 THR A 36 -7.892 1.306 -13.836 1.00 0.00 H new ATOM 0 HG23 THR A 36 -6.419 2.219 -14.239 1.00 0.00 H new ATOM 528 N GLN A 37 -7.895 -0.372 -11.409 1.00 0.00 N ATOM 529 CA GLN A 37 -9.149 -0.154 -10.698 1.00 0.00 C ATOM 530 C GLN A 37 -8.911 0.593 -9.390 1.00 0.00 C ATOM 531 O GLN A 37 -9.692 1.467 -9.013 1.00 0.00 O ATOM 532 CB GLN A 37 -9.839 -1.490 -10.417 1.00 0.00 C ATOM 533 CG GLN A 37 -10.206 -2.262 -11.674 1.00 0.00 C ATOM 534 CD GLN A 37 -11.493 -1.771 -12.306 1.00 0.00 C ATOM 535 OE1 GLN A 37 -11.430 -0.616 -12.959 1.00 0.00 O flip ATOM 536 NE2 GLN A 37 -12.534 -2.423 -12.209 1.00 0.00 N flip ATOM 0 H GLN A 37 -7.729 -1.340 -11.685 1.00 0.00 H new ATOM 0 HA GLN A 37 -9.795 0.455 -11.331 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -9.183 -2.106 -9.801 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -10.743 -1.307 -9.836 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -9.395 -2.177 -12.397 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -10.306 -3.320 -11.430 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -12.537 -3.306 -11.698 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -13.393 -2.080 -12.640 1.00 0.00 H new ATOM 545 N ILE A 38 -7.828 0.244 -8.704 1.00 0.00 N ATOM 546 CA ILE A 38 -7.487 0.883 -7.439 1.00 0.00 C ATOM 547 C ILE A 38 -6.989 2.308 -7.659 1.00 0.00 C ATOM 548 O ILE A 38 -7.529 3.261 -7.097 1.00 0.00 O ATOM 549 CB ILE A 38 -6.411 0.087 -6.677 1.00 0.00 C ATOM 550 CG1 ILE A 38 -6.679 -1.415 -6.795 1.00 0.00 C ATOM 551 CG2 ILE A 38 -6.373 0.510 -5.217 1.00 0.00 C ATOM 552 CD1 ILE A 38 -5.775 -2.260 -5.925 1.00 0.00 C ATOM 0 H ILE A 38 -7.172 -0.477 -9.003 1.00 0.00 H new ATOM 0 HA ILE A 38 -8.399 0.907 -6.843 1.00 0.00 H new ATOM 0 HB ILE A 38 -5.439 0.301 -7.122 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.717 -1.613 -6.527 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.555 -1.717 -7.835 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.608 -0.062 -4.692 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.140 1.573 -5.152 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -7.344 0.323 -4.758 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -6.021 -3.313 -6.059 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -4.736 -2.091 -6.208 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -5.915 -1.985 -4.880 1.00 0.00 H new ATOM 564 N THR A 39 -5.955 2.446 -8.483 1.00 0.00 N ATOM 565 CA THR A 39 -5.383 3.754 -8.779 1.00 0.00 C ATOM 566 C THR A 39 -6.470 4.760 -9.138 1.00 0.00 C ATOM 567 O THR A 39 -6.431 5.913 -8.705 1.00 0.00 O ATOM 568 CB THR A 39 -4.370 3.675 -9.937 1.00 0.00 C ATOM 569 OG1 THR A 39 -3.222 2.920 -9.533 1.00 0.00 O ATOM 570 CG2 THR A 39 -3.940 5.067 -10.375 1.00 0.00 C ATOM 0 H THR A 39 -5.496 1.668 -8.957 1.00 0.00 H new ATOM 0 HA THR A 39 -4.868 4.085 -7.877 1.00 0.00 H new ATOM 0 HB THR A 39 -4.852 3.179 -10.779 1.00 0.00 H new ATOM 0 HG1 THR A 39 -3.409 1.963 -9.631 1.00 0.00 H new ATOM 0 HG21 THR A 39 -3.225 4.986 -11.194 1.00 0.00 H new ATOM 0 HG22 THR A 39 -4.812 5.629 -10.709 1.00 0.00 H new ATOM 0 HG23 THR A 39 -3.475 5.585 -9.536 1.00 0.00 H new ATOM 578 N LYS A 40 -7.441 4.319 -9.930 1.00 0.00 N ATOM 579 CA LYS A 40 -8.541 5.181 -10.346 1.00 0.00 C ATOM 580 C LYS A 40 -9.292 5.726 -9.136 1.00 0.00 C ATOM 581 O LYS A 40 -9.546 6.927 -9.041 1.00 0.00 O ATOM 582 CB LYS A 40 -9.504 4.411 -11.253 1.00 0.00 C ATOM 583 CG LYS A 40 -8.950 4.145 -12.642 1.00 0.00 C ATOM 584 CD LYS A 40 -9.557 2.894 -13.254 1.00 0.00 C ATOM 585 CE LYS A 40 -11.074 2.984 -13.318 1.00 0.00 C ATOM 586 NZ LYS A 40 -11.529 3.993 -14.314 1.00 0.00 N ATOM 0 H LYS A 40 -7.489 3.369 -10.297 1.00 0.00 H new ATOM 0 HA LYS A 40 -8.122 6.021 -10.900 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -9.752 3.460 -10.782 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -10.433 4.974 -11.343 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -9.153 5.001 -13.286 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -7.867 4.036 -12.588 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -9.158 2.748 -14.258 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.268 2.023 -12.666 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -11.485 2.008 -13.576 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -11.464 3.244 -12.334 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.568 4.000 -14.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.187 4.935 -14.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -11.150 3.750 -15.252 1.00 0.00 H new ATOM 600 N ALA A 41 -9.644 4.837 -8.213 1.00 0.00 N ATOM 601 CA ALA A 41 -10.362 5.231 -7.007 1.00 0.00 C ATOM 602 C ALA A 41 -9.551 6.225 -6.185 1.00 0.00 C ATOM 603 O ALA A 41 -10.076 7.238 -5.722 1.00 0.00 O ATOM 604 CB ALA A 41 -10.702 4.005 -6.172 1.00 0.00 C ATOM 0 H ALA A 41 -9.444 3.839 -8.277 1.00 0.00 H new ATOM 0 HA ALA A 41 -11.288 5.720 -7.309 1.00 0.00 H new ATOM 0 HB1 ALA A 41 -11.238 4.313 -5.274 1.00 0.00 H new ATOM 0 HB2 ALA A 41 -11.329 3.330 -6.755 1.00 0.00 H new ATOM 0 HB3 ALA A 41 -9.783 3.492 -5.888 1.00 0.00 H new ATOM 610 N ALA A 42 -8.268 5.930 -6.005 1.00 0.00 N ATOM 611 CA ALA A 42 -7.383 6.800 -5.239 1.00 0.00 C ATOM 612 C ALA A 42 -7.377 8.214 -5.808 1.00 0.00 C ATOM 613 O ALA A 42 -7.836 9.156 -5.160 1.00 0.00 O ATOM 614 CB ALA A 42 -5.972 6.231 -5.218 1.00 0.00 C ATOM 0 H ALA A 42 -7.818 5.095 -6.379 1.00 0.00 H new ATOM 0 HA ALA A 42 -7.758 6.849 -4.217 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -5.322 6.891 -4.643 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -5.985 5.243 -4.758 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -5.597 6.151 -6.238 1.00 0.00 H new ATOM 620 N ILE A 43 -6.854 8.357 -7.021 1.00 0.00 N ATOM 621 CA ILE A 43 -6.789 9.658 -7.675 1.00 0.00 C ATOM 622 C ILE A 43 -8.111 10.407 -7.543 1.00 0.00 C ATOM 623 O ILE A 43 -8.137 11.636 -7.470 1.00 0.00 O ATOM 624 CB ILE A 43 -6.437 9.520 -9.168 1.00 0.00 C ATOM 625 CG1 ILE A 43 -5.080 8.833 -9.334 1.00 0.00 C ATOM 626 CG2 ILE A 43 -6.432 10.885 -9.840 1.00 0.00 C ATOM 627 CD1 ILE A 43 -3.905 9.741 -9.046 1.00 0.00 C ATOM 0 H ILE A 43 -6.469 7.589 -7.570 1.00 0.00 H new ATOM 0 HA ILE A 43 -6.003 10.224 -7.175 1.00 0.00 H new ATOM 0 HB ILE A 43 -7.196 8.903 -9.649 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -5.034 7.971 -8.669 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -4.995 8.454 -10.353 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -6.181 10.770 -10.895 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -7.419 11.339 -9.749 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -5.692 11.525 -9.359 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -2.976 9.188 -9.183 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -3.926 10.591 -9.728 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -3.965 10.099 -8.018 1.00 0.00 H new ATOM 639 N LYS A 44 -9.208 9.658 -7.512 1.00 0.00 N ATOM 640 CA LYS A 44 -10.535 10.249 -7.385 1.00 0.00 C ATOM 641 C LYS A 44 -10.753 10.799 -5.979 1.00 0.00 C ATOM 642 O LYS A 44 -11.333 11.871 -5.806 1.00 0.00 O ATOM 643 CB LYS A 44 -11.611 9.211 -7.711 1.00 0.00 C ATOM 644 CG LYS A 44 -11.859 9.038 -9.199 1.00 0.00 C ATOM 645 CD LYS A 44 -13.301 8.655 -9.484 1.00 0.00 C ATOM 646 CE LYS A 44 -13.711 7.411 -8.711 1.00 0.00 C ATOM 647 NZ LYS A 44 -15.183 7.190 -8.754 1.00 0.00 N ATOM 0 H LYS A 44 -9.204 8.640 -7.573 1.00 0.00 H new ATOM 0 HA LYS A 44 -10.608 11.074 -8.094 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -11.318 8.251 -7.286 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -12.543 9.502 -7.227 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -11.619 9.965 -9.719 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -11.193 8.270 -9.593 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -13.958 9.483 -9.218 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -13.427 8.479 -10.552 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -13.201 6.541 -9.126 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -13.388 7.505 -7.674 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -15.421 6.333 -8.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -15.669 8.008 -8.335 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -15.488 7.074 -9.742 1.00 0.00 H new ATOM 661 N ALA A 45 -10.284 10.060 -4.980 1.00 0.00 N ATOM 662 CA ALA A 45 -10.425 10.476 -3.590 1.00 0.00 C ATOM 663 C ALA A 45 -9.279 11.391 -3.172 1.00 0.00 C ATOM 664 O ALA A 45 -8.995 11.542 -1.983 1.00 0.00 O ATOM 665 CB ALA A 45 -10.492 9.260 -2.679 1.00 0.00 C ATOM 0 H ALA A 45 -9.803 9.170 -5.107 1.00 0.00 H new ATOM 0 HA ALA A 45 -11.355 11.037 -3.497 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -10.597 9.586 -1.644 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -11.349 8.646 -2.955 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -9.578 8.676 -2.784 1.00 0.00 H new ATOM 671 N ILE A 46 -8.623 11.998 -4.155 1.00 0.00 N ATOM 672 CA ILE A 46 -7.508 12.897 -3.888 1.00 0.00 C ATOM 673 C ILE A 46 -7.879 13.935 -2.834 1.00 0.00 C ATOM 674 O ILE A 46 -7.116 14.189 -1.901 1.00 0.00 O ATOM 675 CB ILE A 46 -7.051 13.623 -5.167 1.00 0.00 C ATOM 676 CG1 ILE A 46 -5.585 14.045 -5.044 1.00 0.00 C ATOM 677 CG2 ILE A 46 -7.935 14.831 -5.436 1.00 0.00 C ATOM 678 CD1 ILE A 46 -4.894 14.224 -6.378 1.00 0.00 C ATOM 0 H ILE A 46 -8.845 11.883 -5.144 1.00 0.00 H new ATOM 0 HA ILE A 46 -6.689 12.281 -3.517 1.00 0.00 H new ATOM 0 HB ILE A 46 -7.143 12.937 -6.009 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -5.530 14.980 -4.487 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -5.047 13.296 -4.463 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -7.599 15.333 -6.343 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -8.967 14.505 -5.563 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -7.873 15.522 -4.595 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -3.859 14.523 -6.214 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -4.917 13.284 -6.929 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -5.408 14.994 -6.953 1.00 0.00 H new ATOM 690 N LYS A 47 -9.057 14.531 -2.987 1.00 0.00 N ATOM 691 CA LYS A 47 -9.532 15.539 -2.047 1.00 0.00 C ATOM 692 C LYS A 47 -9.384 15.055 -0.608 1.00 0.00 C ATOM 693 O LYS A 47 -9.082 15.838 0.292 1.00 0.00 O ATOM 694 CB LYS A 47 -10.996 15.881 -2.333 1.00 0.00 C ATOM 695 CG LYS A 47 -11.905 14.665 -2.394 1.00 0.00 C ATOM 696 CD LYS A 47 -13.123 14.923 -3.265 1.00 0.00 C ATOM 697 CE LYS A 47 -13.943 13.657 -3.463 1.00 0.00 C ATOM 698 NZ LYS A 47 -15.155 13.906 -4.294 1.00 0.00 N ATOM 0 H LYS A 47 -9.700 14.333 -3.753 1.00 0.00 H new ATOM 0 HA LYS A 47 -8.923 16.434 -2.174 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -11.360 16.558 -1.560 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -11.057 16.417 -3.280 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -11.349 13.813 -2.787 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -12.226 14.399 -1.387 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -13.744 15.692 -2.806 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -12.804 15.307 -4.234 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -13.326 12.895 -3.940 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -14.243 13.263 -2.492 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -15.687 13.020 -4.406 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -15.757 14.614 -3.827 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -14.868 14.258 -5.230 1.00 0.00 H new ATOM 712 N PHE A 48 -9.595 13.760 -0.400 1.00 0.00 N ATOM 713 CA PHE A 48 -9.484 13.172 0.930 1.00 0.00 C ATOM 714 C PHE A 48 -8.338 12.166 0.986 1.00 0.00 C ATOM 715 O PHE A 48 -8.254 11.355 1.908 1.00 0.00 O ATOM 716 CB PHE A 48 -10.797 12.488 1.320 1.00 0.00 C ATOM 717 CG PHE A 48 -12.019 13.254 0.901 1.00 0.00 C ATOM 718 CD1 PHE A 48 -12.032 14.639 0.942 1.00 0.00 C ATOM 719 CD2 PHE A 48 -13.154 12.589 0.466 1.00 0.00 C ATOM 720 CE1 PHE A 48 -13.156 15.346 0.558 1.00 0.00 C ATOM 721 CE2 PHE A 48 -14.281 13.291 0.080 1.00 0.00 C ATOM 722 CZ PHE A 48 -14.281 14.672 0.125 1.00 0.00 C ATOM 0 H PHE A 48 -9.844 13.098 -1.135 1.00 0.00 H new ATOM 0 HA PHE A 48 -9.276 13.974 1.638 1.00 0.00 H new ATOM 0 HB2 PHE A 48 -10.828 11.496 0.870 1.00 0.00 H new ATOM 0 HB3 PHE A 48 -10.818 12.349 2.401 1.00 0.00 H new ATOM 0 HD1 PHE A 48 -11.155 15.172 1.278 1.00 0.00 H new ATOM 0 HD2 PHE A 48 -13.159 11.510 0.428 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -13.154 16.425 0.597 1.00 0.00 H new ATOM 0 HE2 PHE A 48 -15.160 12.761 -0.256 1.00 0.00 H new ATOM 0 HZ PHE A 48 -15.159 15.223 -0.178 1.00 0.00 H new ATOM 732 N TYR A 49 -7.458 12.226 -0.008 1.00 0.00 N ATOM 733 CA TYR A 49 -6.318 11.319 -0.074 1.00 0.00 C ATOM 734 C TYR A 49 -5.753 11.051 1.317 1.00 0.00 C ATOM 735 O TYR A 49 -5.301 9.945 1.615 1.00 0.00 O ATOM 736 CB TYR A 49 -5.228 11.902 -0.976 1.00 0.00 C ATOM 737 CG TYR A 49 -4.251 12.794 -0.244 1.00 0.00 C ATOM 738 CD1 TYR A 49 -4.567 14.116 0.043 1.00 0.00 C ATOM 739 CD2 TYR A 49 -3.010 12.315 0.158 1.00 0.00 C ATOM 740 CE1 TYR A 49 -3.677 14.935 0.710 1.00 0.00 C ATOM 741 CE2 TYR A 49 -2.114 13.126 0.827 1.00 0.00 C ATOM 742 CZ TYR A 49 -2.452 14.435 1.101 1.00 0.00 C ATOM 743 OH TYR A 49 -1.561 15.247 1.766 1.00 0.00 O ATOM 0 H TYR A 49 -7.512 12.893 -0.778 1.00 0.00 H new ATOM 0 HA TYR A 49 -6.662 10.374 -0.494 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -4.680 11.085 -1.445 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -5.698 12.472 -1.778 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -5.525 14.510 -0.261 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -2.741 11.291 -0.056 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -3.938 15.961 0.924 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -1.154 12.737 1.134 1.00 0.00 H new ATOM 0 HH TYR A 49 -0.747 14.741 1.971 1.00 0.00 H new ATOM 753 N LYS A 50 -5.783 12.071 2.167 1.00 0.00 N ATOM 754 CA LYS A 50 -5.277 11.949 3.529 1.00 0.00 C ATOM 755 C LYS A 50 -5.545 10.554 4.086 1.00 0.00 C ATOM 756 O LYS A 50 -4.737 10.009 4.839 1.00 0.00 O ATOM 757 CB LYS A 50 -5.922 13.002 4.432 1.00 0.00 C ATOM 758 CG LYS A 50 -5.466 14.420 4.134 1.00 0.00 C ATOM 759 CD LYS A 50 -6.425 15.447 4.713 1.00 0.00 C ATOM 760 CE LYS A 50 -7.560 15.756 3.749 1.00 0.00 C ATOM 761 NZ LYS A 50 -8.756 16.293 4.455 1.00 0.00 N ATOM 0 H LYS A 50 -6.153 12.993 1.936 1.00 0.00 H new ATOM 0 HA LYS A 50 -4.199 12.111 3.505 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -7.005 12.947 4.324 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -5.693 12.767 5.471 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -4.470 14.577 4.547 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -5.389 14.560 3.056 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -6.835 15.075 5.652 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -5.882 16.364 4.943 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -7.220 16.480 3.008 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -7.834 14.850 3.208 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -9.507 16.491 3.764 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -9.096 15.592 5.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -8.501 17.171 4.951 1.00 0.00 H new ATOM 775 N HIS A 51 -6.683 9.980 3.709 1.00 0.00 N ATOM 776 CA HIS A 51 -7.057 8.647 4.169 1.00 0.00 C ATOM 777 C HIS A 51 -6.435 7.572 3.282 1.00 0.00 C ATOM 778 O HIS A 51 -5.733 6.684 3.765 1.00 0.00 O ATOM 779 CB HIS A 51 -8.578 8.497 4.182 1.00 0.00 C ATOM 780 CG HIS A 51 -9.210 8.916 5.474 1.00 0.00 C ATOM 781 ND1 HIS A 51 -9.162 10.092 6.142 1.00 0.00 N flip ATOM 782 CD2 HIS A 51 -10.002 8.079 6.231 1.00 0.00 C flip ATOM 783 CE1 HIS A 51 -9.919 9.946 7.279 1.00 0.00 C flip ATOM 784 NE2 HIS A 51 -10.415 8.722 7.308 1.00 0.00 N flip ATOM 0 H HIS A 51 -7.362 10.417 3.086 1.00 0.00 H new ATOM 0 HA HIS A 51 -6.679 8.520 5.183 1.00 0.00 H new ATOM 0 HB2 HIS A 51 -9.000 9.090 3.371 1.00 0.00 H new ATOM 0 HB3 HIS A 51 -8.834 7.456 3.982 1.00 0.00 H new ATOM 0 HD2 HIS A 51 -10.247 7.057 5.982 1.00 0.00 H new ATOM 0 HE1 HIS A 51 -10.082 10.708 8.027 1.00 0.00 H new ATOM 0 HE2 HIS A 51 -11.015 8.339 8.038 1.00 0.00 H new ATOM 792 N VAL A 52 -6.699 7.659 1.982 1.00 0.00 N ATOM 793 CA VAL A 52 -6.166 6.694 1.028 1.00 0.00 C ATOM 794 C VAL A 52 -4.722 6.334 1.359 1.00 0.00 C ATOM 795 O VAL A 52 -4.428 5.209 1.762 1.00 0.00 O ATOM 796 CB VAL A 52 -6.231 7.235 -0.413 1.00 0.00 C ATOM 797 CG1 VAL A 52 -5.274 6.471 -1.314 1.00 0.00 C ATOM 798 CG2 VAL A 52 -7.654 7.159 -0.946 1.00 0.00 C ATOM 0 H VAL A 52 -7.279 8.388 1.566 1.00 0.00 H new ATOM 0 HA VAL A 52 -6.786 5.801 1.101 1.00 0.00 H new ATOM 0 HB VAL A 52 -5.926 8.281 -0.404 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -5.334 6.867 -2.328 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.256 6.582 -0.941 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -5.545 5.415 -1.321 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -7.682 7.545 -1.965 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -7.989 6.122 -0.942 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -8.312 7.756 -0.314 1.00 0.00 H new ATOM 808 N VAL A 53 -3.823 7.298 1.186 1.00 0.00 N ATOM 809 CA VAL A 53 -2.409 7.084 1.468 1.00 0.00 C ATOM 810 C VAL A 53 -2.221 6.208 2.702 1.00 0.00 C ATOM 811 O VAL A 53 -1.514 5.202 2.659 1.00 0.00 O ATOM 812 CB VAL A 53 -1.671 8.419 1.682 1.00 0.00 C ATOM 813 CG1 VAL A 53 -0.316 8.182 2.333 1.00 0.00 C ATOM 814 CG2 VAL A 53 -1.515 9.159 0.362 1.00 0.00 C ATOM 0 H VAL A 53 -4.049 8.235 0.852 1.00 0.00 H new ATOM 0 HA VAL A 53 -1.986 6.579 0.600 1.00 0.00 H new ATOM 0 HB VAL A 53 -2.266 9.040 2.352 1.00 0.00 H new ATOM 0 HG11 VAL A 53 0.191 9.136 2.476 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -0.456 7.697 3.299 1.00 0.00 H new ATOM 0 HG13 VAL A 53 0.289 7.543 1.691 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -0.992 10.100 0.532 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -0.942 8.546 -0.334 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -2.499 9.363 -0.060 1.00 0.00 H new ATOM 824 N GLN A 54 -2.860 6.599 3.801 1.00 0.00 N ATOM 825 CA GLN A 54 -2.762 5.849 5.047 1.00 0.00 C ATOM 826 C GLN A 54 -3.141 4.387 4.834 1.00 0.00 C ATOM 827 O GLN A 54 -2.378 3.482 5.172 1.00 0.00 O ATOM 828 CB GLN A 54 -3.665 6.471 6.114 1.00 0.00 C ATOM 829 CG GLN A 54 -3.724 5.671 7.404 1.00 0.00 C ATOM 830 CD GLN A 54 -4.559 6.348 8.474 1.00 0.00 C ATOM 831 OE1 GLN A 54 -4.026 6.997 9.375 1.00 0.00 O ATOM 832 NE2 GLN A 54 -5.875 6.200 8.380 1.00 0.00 N ATOM 0 H GLN A 54 -3.450 7.429 3.853 1.00 0.00 H new ATOM 0 HA GLN A 54 -1.727 5.892 5.386 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -3.310 7.477 6.337 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -4.673 6.570 5.712 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -4.138 4.684 7.196 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -2.712 5.520 7.780 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -6.274 5.653 7.617 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -6.488 6.633 9.071 1.00 0.00 H new ATOM 841 N SER A 55 -4.324 4.163 4.272 1.00 0.00 N ATOM 842 CA SER A 55 -4.806 2.811 4.017 1.00 0.00 C ATOM 843 C SER A 55 -3.787 2.014 3.209 1.00 0.00 C ATOM 844 O SER A 55 -3.548 0.836 3.477 1.00 0.00 O ATOM 845 CB SER A 55 -6.142 2.854 3.273 1.00 0.00 C ATOM 846 OG SER A 55 -7.208 3.155 4.157 1.00 0.00 O ATOM 0 H SER A 55 -4.967 4.901 3.984 1.00 0.00 H new ATOM 0 HA SER A 55 -4.949 2.316 4.978 1.00 0.00 H new ATOM 0 HB2 SER A 55 -6.098 3.603 2.483 1.00 0.00 H new ATOM 0 HB3 SER A 55 -6.325 1.893 2.791 1.00 0.00 H new ATOM 0 HG SER A 55 -8.024 3.320 3.641 1.00 0.00 H new ATOM 852 N VAL A 56 -3.188 2.665 2.217 1.00 0.00 N ATOM 853 CA VAL A 56 -2.193 2.020 1.369 1.00 0.00 C ATOM 854 C VAL A 56 -0.988 1.563 2.184 1.00 0.00 C ATOM 855 O VAL A 56 -0.384 0.532 1.893 1.00 0.00 O ATOM 856 CB VAL A 56 -1.713 2.962 0.249 1.00 0.00 C ATOM 857 CG1 VAL A 56 -0.694 2.263 -0.637 1.00 0.00 C ATOM 858 CG2 VAL A 56 -2.894 3.458 -0.572 1.00 0.00 C ATOM 0 H VAL A 56 -3.375 3.640 1.981 1.00 0.00 H new ATOM 0 HA VAL A 56 -2.676 1.151 0.921 1.00 0.00 H new ATOM 0 HB VAL A 56 -1.229 3.825 0.707 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -0.367 2.944 -1.422 1.00 0.00 H new ATOM 0 HG12 VAL A 56 0.164 1.962 -0.037 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -1.148 1.381 -1.088 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -2.537 4.122 -1.359 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -3.408 2.608 -1.021 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -3.585 4.000 0.074 1.00 0.00 H new ATOM 868 N GLU A 57 -0.646 2.339 3.208 1.00 0.00 N ATOM 869 CA GLU A 57 0.488 2.013 4.066 1.00 0.00 C ATOM 870 C GLU A 57 0.109 0.941 5.084 1.00 0.00 C ATOM 871 O GLU A 57 0.899 0.045 5.381 1.00 0.00 O ATOM 872 CB GLU A 57 0.984 3.267 4.790 1.00 0.00 C ATOM 873 CG GLU A 57 1.736 4.232 3.890 1.00 0.00 C ATOM 874 CD GLU A 57 2.573 5.226 4.671 1.00 0.00 C ATOM 875 OE1 GLU A 57 2.295 5.421 5.873 1.00 0.00 O ATOM 876 OE2 GLU A 57 3.506 5.810 4.081 1.00 0.00 O ATOM 0 H GLU A 57 -1.137 3.196 3.463 1.00 0.00 H new ATOM 0 HA GLU A 57 1.288 1.625 3.436 1.00 0.00 H new ATOM 0 HB2 GLU A 57 0.131 3.784 5.230 1.00 0.00 H new ATOM 0 HB3 GLU A 57 1.634 2.968 5.612 1.00 0.00 H new ATOM 0 HG2 GLU A 57 2.382 3.667 3.218 1.00 0.00 H new ATOM 0 HG3 GLU A 57 1.023 4.773 3.267 1.00 0.00 H new ATOM 883 N LYS A 58 -1.104 1.040 5.615 1.00 0.00 N ATOM 884 CA LYS A 58 -1.590 0.079 6.599 1.00 0.00 C ATOM 885 C LYS A 58 -1.841 -1.280 5.954 1.00 0.00 C ATOM 886 O LYS A 58 -1.235 -2.281 6.337 1.00 0.00 O ATOM 887 CB LYS A 58 -2.876 0.592 7.250 1.00 0.00 C ATOM 888 CG LYS A 58 -2.772 2.017 7.764 1.00 0.00 C ATOM 889 CD LYS A 58 -2.285 2.058 9.202 1.00 0.00 C ATOM 890 CE LYS A 58 -0.767 2.112 9.276 1.00 0.00 C ATOM 891 NZ LYS A 58 -0.286 2.295 10.673 1.00 0.00 N ATOM 0 H LYS A 58 -1.770 1.776 5.381 1.00 0.00 H new ATOM 0 HA LYS A 58 -0.824 -0.038 7.365 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -3.688 0.535 6.525 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.141 -0.065 8.078 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -2.089 2.584 7.131 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.746 2.501 7.695 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -2.706 2.929 9.705 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -2.645 1.178 9.734 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -0.350 1.192 8.866 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -0.402 2.931 8.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 0.753 2.327 10.681 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -0.663 3.186 11.056 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -0.612 1.501 11.259 1.00 0.00 H new ATOM 905 N PHE A 59 -2.736 -1.309 4.973 1.00 0.00 N ATOM 906 CA PHE A 59 -3.067 -2.546 4.275 1.00 0.00 C ATOM 907 C PHE A 59 -1.817 -3.392 4.047 1.00 0.00 C ATOM 908 O PHE A 59 -1.876 -4.621 4.062 1.00 0.00 O ATOM 909 CB PHE A 59 -3.738 -2.236 2.935 1.00 0.00 C ATOM 910 CG PHE A 59 -3.597 -3.339 1.925 1.00 0.00 C ATOM 911 CD1 PHE A 59 -2.509 -3.376 1.068 1.00 0.00 C ATOM 912 CD2 PHE A 59 -4.553 -4.338 1.832 1.00 0.00 C ATOM 913 CE1 PHE A 59 -2.376 -4.390 0.138 1.00 0.00 C ATOM 914 CE2 PHE A 59 -4.425 -5.354 0.904 1.00 0.00 C ATOM 915 CZ PHE A 59 -3.336 -5.379 0.055 1.00 0.00 C ATOM 0 H PHE A 59 -3.246 -0.490 4.643 1.00 0.00 H new ATOM 0 HA PHE A 59 -3.759 -3.112 4.898 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -4.797 -2.042 3.104 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -3.308 -1.322 2.525 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -1.756 -2.604 1.127 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -5.408 -4.322 2.492 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -1.522 -4.409 -0.523 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -5.176 -6.128 0.843 1.00 0.00 H new ATOM 0 HZ PHE A 59 -3.235 -6.171 -0.673 1.00 0.00 H new ATOM 925 N ILE A 60 -0.688 -2.723 3.834 1.00 0.00 N ATOM 926 CA ILE A 60 0.575 -3.413 3.603 1.00 0.00 C ATOM 927 C ILE A 60 1.006 -4.199 4.837 1.00 0.00 C ATOM 928 O ILE A 60 1.470 -5.333 4.731 1.00 0.00 O ATOM 929 CB ILE A 60 1.693 -2.426 3.221 1.00 0.00 C ATOM 930 CG1 ILE A 60 1.494 -1.926 1.788 1.00 0.00 C ATOM 931 CG2 ILE A 60 3.056 -3.084 3.373 1.00 0.00 C ATOM 932 CD1 ILE A 60 2.468 -0.840 1.387 1.00 0.00 C ATOM 0 H ILE A 60 -0.623 -1.705 3.817 1.00 0.00 H new ATOM 0 HA ILE A 60 0.411 -4.103 2.775 1.00 0.00 H new ATOM 0 HB ILE A 60 1.647 -1.570 3.895 1.00 0.00 H new ATOM 0 HG12 ILE A 60 1.596 -2.766 1.101 1.00 0.00 H new ATOM 0 HG13 ILE A 60 0.477 -1.548 1.681 1.00 0.00 H new ATOM 0 HG21 ILE A 60 3.836 -2.373 3.099 1.00 0.00 H new ATOM 0 HG22 ILE A 60 3.196 -3.396 4.408 1.00 0.00 H new ATOM 0 HG23 ILE A 60 3.114 -3.955 2.721 1.00 0.00 H new ATOM 0 HD11 ILE A 60 2.269 -0.534 0.360 1.00 0.00 H new ATOM 0 HD12 ILE A 60 2.351 0.017 2.050 1.00 0.00 H new ATOM 0 HD13 ILE A 60 3.487 -1.220 1.461 1.00 0.00 H new ATOM 944 N GLN A 61 0.847 -3.587 6.007 1.00 0.00 N ATOM 945 CA GLN A 61 1.219 -4.231 7.261 1.00 0.00 C ATOM 946 C GLN A 61 0.203 -5.301 7.646 1.00 0.00 C ATOM 947 O GLN A 61 0.545 -6.297 8.284 1.00 0.00 O ATOM 948 CB GLN A 61 1.330 -3.192 8.378 1.00 0.00 C ATOM 949 CG GLN A 61 -0.007 -2.603 8.797 1.00 0.00 C ATOM 950 CD GLN A 61 -0.035 -2.200 10.258 1.00 0.00 C ATOM 951 OE1 GLN A 61 -0.785 -2.765 11.055 1.00 0.00 O ATOM 952 NE2 GLN A 61 0.783 -1.218 10.618 1.00 0.00 N ATOM 0 H GLN A 61 0.464 -2.648 6.112 1.00 0.00 H new ATOM 0 HA GLN A 61 2.188 -4.710 7.121 1.00 0.00 H new ATOM 0 HB2 GLN A 61 1.802 -3.653 9.246 1.00 0.00 H new ATOM 0 HB3 GLN A 61 1.985 -2.386 8.049 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -0.225 -1.732 8.179 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -0.795 -3.332 8.610 1.00 0.00 H new ATOM 0 HE21 GLN A 61 1.388 -0.778 9.924 1.00 0.00 H new ATOM 0 HE22 GLN A 61 0.807 -0.904 11.588 1.00 0.00 H new ATOM 961 N LYS A 62 -1.049 -5.090 7.254 1.00 0.00 N ATOM 962 CA LYS A 62 -2.116 -6.036 7.557 1.00 0.00 C ATOM 963 C LYS A 62 -2.078 -7.223 6.599 1.00 0.00 C ATOM 964 O LYS A 62 -2.376 -8.354 6.985 1.00 0.00 O ATOM 965 CB LYS A 62 -3.478 -5.344 7.474 1.00 0.00 C ATOM 966 CG LYS A 62 -3.479 -3.934 8.038 1.00 0.00 C ATOM 967 CD LYS A 62 -3.259 -3.934 9.541 1.00 0.00 C ATOM 968 CE LYS A 62 -4.577 -3.999 10.297 1.00 0.00 C ATOM 969 NZ LYS A 62 -4.998 -5.403 10.558 1.00 0.00 N ATOM 0 H LYS A 62 -1.350 -4.271 6.725 1.00 0.00 H new ATOM 0 HA LYS A 62 -1.964 -6.405 8.571 1.00 0.00 H new ATOM 0 HB2 LYS A 62 -3.796 -5.310 6.432 1.00 0.00 H new ATOM 0 HB3 LYS A 62 -4.213 -5.942 8.012 1.00 0.00 H new ATOM 0 HG2 LYS A 62 -2.697 -3.348 7.555 1.00 0.00 H new ATOM 0 HG3 LYS A 62 -4.428 -3.450 7.808 1.00 0.00 H new ATOM 0 HD2 LYS A 62 -2.637 -4.785 9.819 1.00 0.00 H new ATOM 0 HD3 LYS A 62 -2.716 -3.034 9.830 1.00 0.00 H new ATOM 0 HE2 LYS A 62 -4.479 -3.467 11.243 1.00 0.00 H new ATOM 0 HE3 LYS A 62 -5.350 -3.489 9.723 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 -5.577 -5.437 11.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 -5.555 -5.754 9.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 -4.156 -6.000 10.683 1.00 0.00 H new ATOM 983 N CYS A 63 -1.709 -6.959 5.351 1.00 0.00 N ATOM 984 CA CYS A 63 -1.632 -8.006 4.338 1.00 0.00 C ATOM 985 C CYS A 63 -0.668 -9.107 4.768 1.00 0.00 C ATOM 986 O CYS A 63 -0.121 -9.073 5.870 1.00 0.00 O ATOM 987 CB CYS A 63 -1.188 -7.416 2.998 1.00 0.00 C ATOM 988 SG CYS A 63 0.601 -7.203 2.842 1.00 0.00 S ATOM 0 H CYS A 63 -1.458 -6.029 5.016 1.00 0.00 H new ATOM 0 HA CYS A 63 -2.625 -8.441 4.223 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -1.537 -8.064 2.194 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -1.672 -6.449 2.861 1.00 0.00 H new ATOM 0 HG CYS A 63 1.047 -6.521 3.855 1.00 0.00 H new ATOM 994 N LYS A 64 -0.466 -10.084 3.890 1.00 0.00 N ATOM 995 CA LYS A 64 0.432 -11.197 4.177 1.00 0.00 C ATOM 996 C LYS A 64 1.784 -10.994 3.501 1.00 0.00 C ATOM 997 O LYS A 64 1.913 -10.251 2.527 1.00 0.00 O ATOM 998 CB LYS A 64 -0.191 -12.514 3.710 1.00 0.00 C ATOM 999 CG LYS A 64 -1.583 -12.761 4.267 1.00 0.00 C ATOM 1000 CD LYS A 64 -2.658 -12.219 3.341 1.00 0.00 C ATOM 1001 CE LYS A 64 -4.037 -12.307 3.977 1.00 0.00 C ATOM 1002 NZ LYS A 64 -4.668 -13.637 3.752 1.00 0.00 N ATOM 0 H LYS A 64 -0.912 -10.128 2.974 1.00 0.00 H new ATOM 0 HA LYS A 64 0.588 -11.237 5.255 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -0.239 -12.517 2.621 1.00 0.00 H new ATOM 0 HB3 LYS A 64 0.460 -13.338 4.003 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -1.733 -13.831 4.413 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -1.673 -12.290 5.246 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -2.436 -11.181 3.092 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -2.651 -12.779 2.406 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -3.956 -12.120 5.048 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -4.677 -11.527 3.565 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -5.606 -13.657 4.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -4.769 -13.805 2.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -4.070 -14.380 4.167 1.00 0.00 H new ATOM 1016 N PRO A 65 2.816 -11.669 4.026 1.00 0.00 N ATOM 1017 CA PRO A 65 4.177 -11.581 3.488 1.00 0.00 C ATOM 1018 C PRO A 65 4.213 -11.749 1.973 1.00 0.00 C ATOM 1019 O PRO A 65 5.185 -11.371 1.320 1.00 0.00 O ATOM 1020 CB PRO A 65 4.906 -12.740 4.172 1.00 0.00 C ATOM 1021 CG PRO A 65 4.160 -12.959 5.442 1.00 0.00 C ATOM 1022 CD PRO A 65 2.735 -12.573 5.187 1.00 0.00 C ATOM 0 HA PRO A 65 4.627 -10.606 3.677 1.00 0.00 H new ATOM 0 HB2 PRO A 65 4.899 -13.635 3.549 1.00 0.00 H new ATOM 0 HB3 PRO A 65 5.950 -12.493 4.364 1.00 0.00 H new ATOM 0 HG2 PRO A 65 4.227 -14.001 5.753 1.00 0.00 H new ATOM 0 HG3 PRO A 65 4.584 -12.358 6.247 1.00 0.00 H new ATOM 0 HD2 PRO A 65 2.117 -13.445 4.972 1.00 0.00 H new ATOM 0 HD3 PRO A 65 2.295 -12.075 6.051 1.00 0.00 H new ATOM 1030 N GLU A 66 3.146 -12.317 1.419 1.00 0.00 N ATOM 1031 CA GLU A 66 3.057 -12.535 -0.020 1.00 0.00 C ATOM 1032 C GLU A 66 2.504 -11.299 -0.724 1.00 0.00 C ATOM 1033 O GLU A 66 2.831 -11.032 -1.881 1.00 0.00 O ATOM 1034 CB GLU A 66 2.170 -13.745 -0.321 1.00 0.00 C ATOM 1035 CG GLU A 66 0.685 -13.468 -0.160 1.00 0.00 C ATOM 1036 CD GLU A 66 -0.128 -14.734 0.025 1.00 0.00 C ATOM 1037 OE1 GLU A 66 -0.156 -15.262 1.155 1.00 0.00 O ATOM 1038 OE2 GLU A 66 -0.737 -15.196 -0.963 1.00 0.00 O ATOM 0 H GLU A 66 2.332 -12.634 1.945 1.00 0.00 H new ATOM 0 HA GLU A 66 4.062 -12.727 -0.395 1.00 0.00 H new ATOM 0 HB2 GLU A 66 2.360 -14.079 -1.341 1.00 0.00 H new ATOM 0 HB3 GLU A 66 2.452 -14.564 0.340 1.00 0.00 H new ATOM 0 HG2 GLU A 66 0.532 -12.814 0.699 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.322 -12.933 -1.037 1.00 0.00 H new ATOM 1045 N TYR A 67 1.666 -10.548 -0.018 1.00 0.00 N ATOM 1046 CA TYR A 67 1.065 -9.342 -0.575 1.00 0.00 C ATOM 1047 C TYR A 67 1.953 -8.127 -0.327 1.00 0.00 C ATOM 1048 O TYR A 67 1.472 -6.997 -0.244 1.00 0.00 O ATOM 1049 CB TYR A 67 -0.319 -9.109 0.032 1.00 0.00 C ATOM 1050 CG TYR A 67 -1.378 -10.051 -0.494 1.00 0.00 C ATOM 1051 CD1 TYR A 67 -1.999 -9.818 -1.714 1.00 0.00 C ATOM 1052 CD2 TYR A 67 -1.756 -11.175 0.230 1.00 0.00 C ATOM 1053 CE1 TYR A 67 -2.968 -10.676 -2.198 1.00 0.00 C ATOM 1054 CE2 TYR A 67 -2.723 -12.040 -0.247 1.00 0.00 C ATOM 1055 CZ TYR A 67 -3.326 -11.785 -1.461 1.00 0.00 C ATOM 1056 OH TYR A 67 -4.289 -12.643 -1.941 1.00 0.00 O ATOM 0 H TYR A 67 1.387 -10.753 0.942 1.00 0.00 H new ATOM 0 HA TYR A 67 0.963 -9.481 -1.651 1.00 0.00 H new ATOM 0 HB2 TYR A 67 -0.254 -9.217 1.115 1.00 0.00 H new ATOM 0 HB3 TYR A 67 -0.626 -8.083 -0.168 1.00 0.00 H new ATOM 0 HD1 TYR A 67 -1.720 -8.951 -2.295 1.00 0.00 H new ATOM 0 HD2 TYR A 67 -1.286 -11.376 1.182 1.00 0.00 H new ATOM 0 HE1 TYR A 67 -3.442 -10.479 -3.148 1.00 0.00 H new ATOM 0 HE2 TYR A 67 -3.005 -12.910 0.327 1.00 0.00 H new ATOM 0 HH TYR A 67 -5.153 -12.182 -1.970 1.00 0.00 H new ATOM 1066 N LYS A 68 3.255 -8.368 -0.210 1.00 0.00 N ATOM 1067 CA LYS A 68 4.214 -7.295 0.027 1.00 0.00 C ATOM 1068 C LYS A 68 4.611 -6.622 -1.283 1.00 0.00 C ATOM 1069 O LYS A 68 5.054 -5.473 -1.293 1.00 0.00 O ATOM 1070 CB LYS A 68 5.458 -7.841 0.730 1.00 0.00 C ATOM 1071 CG LYS A 68 5.178 -8.400 2.115 1.00 0.00 C ATOM 1072 CD LYS A 68 4.287 -7.470 2.921 1.00 0.00 C ATOM 1073 CE LYS A 68 4.372 -7.770 4.410 1.00 0.00 C ATOM 1074 NZ LYS A 68 3.828 -6.654 5.232 1.00 0.00 N ATOM 0 H LYS A 68 3.670 -9.297 -0.276 1.00 0.00 H new ATOM 0 HA LYS A 68 3.739 -6.552 0.668 1.00 0.00 H new ATOM 0 HB2 LYS A 68 5.899 -8.624 0.114 1.00 0.00 H new ATOM 0 HB3 LYS A 68 6.198 -7.045 0.811 1.00 0.00 H new ATOM 0 HG2 LYS A 68 4.700 -9.376 2.025 1.00 0.00 H new ATOM 0 HG3 LYS A 68 6.119 -8.553 2.644 1.00 0.00 H new ATOM 0 HD2 LYS A 68 4.580 -6.436 2.740 1.00 0.00 H new ATOM 0 HD3 LYS A 68 3.255 -7.572 2.586 1.00 0.00 H new ATOM 0 HE2 LYS A 68 3.820 -8.684 4.628 1.00 0.00 H new ATOM 0 HE3 LYS A 68 5.411 -7.951 4.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 3.810 -6.937 6.233 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 4.432 -5.814 5.120 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 2.862 -6.430 4.918 1.00 0.00 H new ATOM 1088 N VAL A 69 4.449 -7.344 -2.387 1.00 0.00 N ATOM 1089 CA VAL A 69 4.789 -6.815 -3.703 1.00 0.00 C ATOM 1090 C VAL A 69 3.664 -5.945 -4.253 1.00 0.00 C ATOM 1091 O VAL A 69 3.883 -4.826 -4.718 1.00 0.00 O ATOM 1092 CB VAL A 69 5.083 -7.948 -4.704 1.00 0.00 C ATOM 1093 CG1 VAL A 69 4.675 -7.537 -6.111 1.00 0.00 C ATOM 1094 CG2 VAL A 69 6.554 -8.332 -4.657 1.00 0.00 C ATOM 0 H VAL A 69 4.085 -8.297 -2.397 1.00 0.00 H new ATOM 0 HA VAL A 69 5.686 -6.208 -3.578 1.00 0.00 H new ATOM 0 HB VAL A 69 4.494 -8.821 -4.421 1.00 0.00 H new ATOM 0 HG11 VAL A 69 4.890 -8.350 -6.804 1.00 0.00 H new ATOM 0 HG12 VAL A 69 3.608 -7.316 -6.131 1.00 0.00 H new ATOM 0 HG13 VAL A 69 5.234 -6.650 -6.407 1.00 0.00 H new ATOM 0 HG21 VAL A 69 6.744 -9.134 -5.371 1.00 0.00 H new ATOM 0 HG22 VAL A 69 7.164 -7.466 -4.913 1.00 0.00 H new ATOM 0 HG23 VAL A 69 6.809 -8.672 -3.653 1.00 0.00 H new ATOM 1104 N PRO A 70 2.431 -6.469 -4.199 1.00 0.00 N ATOM 1105 CA PRO A 70 1.246 -5.756 -4.686 1.00 0.00 C ATOM 1106 C PRO A 70 1.183 -4.320 -4.176 1.00 0.00 C ATOM 1107 O PRO A 70 1.154 -3.373 -4.960 1.00 0.00 O ATOM 1108 CB PRO A 70 0.082 -6.575 -4.122 1.00 0.00 C ATOM 1109 CG PRO A 70 0.635 -7.947 -3.947 1.00 0.00 C ATOM 1110 CD PRO A 70 2.097 -7.797 -3.657 1.00 0.00 C ATOM 0 HA PRO A 70 1.239 -5.672 -5.773 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -0.268 -6.165 -3.175 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -0.769 -6.575 -4.803 1.00 0.00 H new ATOM 0 HG2 PRO A 70 0.131 -8.464 -3.131 1.00 0.00 H new ATOM 0 HG3 PRO A 70 0.480 -8.543 -4.846 1.00 0.00 H new ATOM 0 HD2 PRO A 70 2.300 -7.855 -2.588 1.00 0.00 H new ATOM 0 HD3 PRO A 70 2.682 -8.583 -4.135 1.00 0.00 H new ATOM 1118 N GLY A 71 1.162 -4.166 -2.855 1.00 0.00 N ATOM 1119 CA GLY A 71 1.103 -2.842 -2.263 1.00 0.00 C ATOM 1120 C GLY A 71 1.972 -1.840 -2.996 1.00 0.00 C ATOM 1121 O GLY A 71 1.480 -0.829 -3.498 1.00 0.00 O ATOM 0 H GLY A 71 1.185 -4.934 -2.185 1.00 0.00 H new ATOM 0 HA2 GLY A 71 0.071 -2.492 -2.264 1.00 0.00 H new ATOM 0 HA3 GLY A 71 1.419 -2.899 -1.221 1.00 0.00 H new ATOM 1125 N LEU A 72 3.270 -2.119 -3.058 1.00 0.00 N ATOM 1126 CA LEU A 72 4.211 -1.233 -3.734 1.00 0.00 C ATOM 1127 C LEU A 72 3.639 -0.739 -5.058 1.00 0.00 C ATOM 1128 O LEU A 72 3.670 0.457 -5.352 1.00 0.00 O ATOM 1129 CB LEU A 72 5.538 -1.956 -3.976 1.00 0.00 C ATOM 1130 CG LEU A 72 6.781 -1.069 -4.055 1.00 0.00 C ATOM 1131 CD1 LEU A 72 6.622 -0.023 -5.147 1.00 0.00 C ATOM 1132 CD2 LEU A 72 7.047 -0.404 -2.712 1.00 0.00 C ATOM 0 H LEU A 72 3.694 -2.951 -2.648 1.00 0.00 H new ATOM 0 HA LEU A 72 4.386 -0.370 -3.091 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.684 -2.682 -3.176 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.458 -2.519 -4.906 1.00 0.00 H new ATOM 0 HG LEU A 72 7.637 -1.697 -4.304 1.00 0.00 H new ATOM 0 HD11 LEU A 72 7.516 0.599 -5.188 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.480 -0.518 -6.107 1.00 0.00 H new ATOM 0 HD13 LEU A 72 5.756 0.602 -4.929 1.00 0.00 H new ATOM 0 HD21 LEU A 72 7.935 0.224 -2.786 1.00 0.00 H new ATOM 0 HD22 LEU A 72 6.191 0.211 -2.434 1.00 0.00 H new ATOM 0 HD23 LEU A 72 7.206 -1.169 -1.952 1.00 0.00 H new ATOM 1144 N TYR A 73 3.117 -1.666 -5.854 1.00 0.00 N ATOM 1145 CA TYR A 73 2.537 -1.324 -7.147 1.00 0.00 C ATOM 1146 C TYR A 73 1.402 -0.318 -6.987 1.00 0.00 C ATOM 1147 O TYR A 73 1.223 0.572 -7.819 1.00 0.00 O ATOM 1148 CB TYR A 73 2.024 -2.583 -7.848 1.00 0.00 C ATOM 1149 CG TYR A 73 3.125 -3.499 -8.332 1.00 0.00 C ATOM 1150 CD1 TYR A 73 4.444 -3.298 -7.943 1.00 0.00 C ATOM 1151 CD2 TYR A 73 2.848 -4.564 -9.180 1.00 0.00 C ATOM 1152 CE1 TYR A 73 5.454 -4.131 -8.384 1.00 0.00 C ATOM 1153 CE2 TYR A 73 3.851 -5.404 -9.624 1.00 0.00 C ATOM 1154 CZ TYR A 73 5.152 -5.183 -9.223 1.00 0.00 C ATOM 1155 OH TYR A 73 6.155 -6.016 -9.665 1.00 0.00 O ATOM 0 H TYR A 73 3.084 -2.660 -5.626 1.00 0.00 H new ATOM 0 HA TYR A 73 3.317 -0.869 -7.757 1.00 0.00 H new ATOM 0 HB2 TYR A 73 1.380 -3.134 -7.162 1.00 0.00 H new ATOM 0 HB3 TYR A 73 1.407 -2.290 -8.698 1.00 0.00 H new ATOM 0 HD1 TYR A 73 4.684 -2.476 -7.284 1.00 0.00 H new ATOM 0 HD2 TYR A 73 1.831 -4.738 -9.498 1.00 0.00 H new ATOM 0 HE1 TYR A 73 6.474 -3.959 -8.074 1.00 0.00 H new ATOM 0 HE2 TYR A 73 3.618 -6.229 -10.281 1.00 0.00 H new ATOM 0 HH TYR A 73 5.774 -6.706 -10.247 1.00 0.00 H new ATOM 1165 N VAL A 74 0.635 -0.467 -5.911 1.00 0.00 N ATOM 1166 CA VAL A 74 -0.483 0.428 -5.639 1.00 0.00 C ATOM 1167 C VAL A 74 0.000 1.856 -5.411 1.00 0.00 C ATOM 1168 O VAL A 74 -0.585 2.810 -5.926 1.00 0.00 O ATOM 1169 CB VAL A 74 -1.285 -0.034 -4.409 1.00 0.00 C ATOM 1170 CG1 VAL A 74 -2.345 0.995 -4.045 1.00 0.00 C ATOM 1171 CG2 VAL A 74 -1.916 -1.394 -4.665 1.00 0.00 C ATOM 0 H VAL A 74 0.768 -1.199 -5.214 1.00 0.00 H new ATOM 0 HA VAL A 74 -1.130 0.402 -6.516 1.00 0.00 H new ATOM 0 HB VAL A 74 -0.601 -0.129 -3.566 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -2.902 0.651 -3.173 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -1.865 1.947 -3.817 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -3.029 1.125 -4.884 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -2.479 -1.705 -3.785 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -2.588 -1.328 -5.521 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -1.134 -2.125 -4.873 1.00 0.00 H new ATOM 1181 N ILE A 75 1.070 1.996 -4.636 1.00 0.00 N ATOM 1182 CA ILE A 75 1.633 3.308 -4.341 1.00 0.00 C ATOM 1183 C ILE A 75 2.219 3.950 -5.594 1.00 0.00 C ATOM 1184 O ILE A 75 2.037 5.143 -5.836 1.00 0.00 O ATOM 1185 CB ILE A 75 2.728 3.221 -3.262 1.00 0.00 C ATOM 1186 CG1 ILE A 75 2.142 2.690 -1.952 1.00 0.00 C ATOM 1187 CG2 ILE A 75 3.369 4.584 -3.047 1.00 0.00 C ATOM 1188 CD1 ILE A 75 3.172 2.052 -1.045 1.00 0.00 C ATOM 0 H ILE A 75 1.565 1.217 -4.201 1.00 0.00 H new ATOM 0 HA ILE A 75 0.815 3.925 -3.968 1.00 0.00 H new ATOM 0 HB ILE A 75 3.498 2.528 -3.602 1.00 0.00 H new ATOM 0 HG12 ILE A 75 1.659 3.510 -1.420 1.00 0.00 H new ATOM 0 HG13 ILE A 75 1.367 1.958 -2.180 1.00 0.00 H new ATOM 0 HG21 ILE A 75 4.141 4.506 -2.281 1.00 0.00 H new ATOM 0 HG22 ILE A 75 3.816 4.927 -3.980 1.00 0.00 H new ATOM 0 HG23 ILE A 75 2.609 5.297 -2.725 1.00 0.00 H new ATOM 0 HD11 ILE A 75 2.687 1.698 -0.135 1.00 0.00 H new ATOM 0 HD12 ILE A 75 3.638 1.211 -1.558 1.00 0.00 H new ATOM 0 HD13 ILE A 75 3.935 2.787 -0.787 1.00 0.00 H new ATOM 1200 N ASP A 76 2.922 3.149 -6.388 1.00 0.00 N ATOM 1201 CA ASP A 76 3.533 3.638 -7.619 1.00 0.00 C ATOM 1202 C ASP A 76 2.466 4.018 -8.641 1.00 0.00 C ATOM 1203 O ASP A 76 2.461 5.134 -9.161 1.00 0.00 O ATOM 1204 CB ASP A 76 4.465 2.577 -8.206 1.00 0.00 C ATOM 1205 CG ASP A 76 4.623 2.712 -9.708 1.00 0.00 C ATOM 1206 OD1 ASP A 76 3.826 2.095 -10.445 1.00 0.00 O ATOM 1207 OD2 ASP A 76 5.543 3.435 -10.146 1.00 0.00 O ATOM 0 H ASP A 76 3.083 2.159 -6.201 1.00 0.00 H new ATOM 0 HA ASP A 76 4.114 4.529 -7.379 1.00 0.00 H new ATOM 0 HB2 ASP A 76 5.444 2.655 -7.732 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.076 1.586 -7.972 1.00 0.00 H new ATOM 1212 N SER A 77 1.566 3.083 -8.925 1.00 0.00 N ATOM 1213 CA SER A 77 0.498 3.318 -9.889 1.00 0.00 C ATOM 1214 C SER A 77 -0.236 4.620 -9.581 1.00 0.00 C ATOM 1215 O SER A 77 -0.636 5.349 -10.488 1.00 0.00 O ATOM 1216 CB SER A 77 -0.490 2.149 -9.884 1.00 0.00 C ATOM 1217 OG SER A 77 0.141 0.947 -10.289 1.00 0.00 O ATOM 0 H SER A 77 1.555 2.155 -8.501 1.00 0.00 H new ATOM 0 HA SER A 77 0.948 3.400 -10.878 1.00 0.00 H new ATOM 0 HB2 SER A 77 -0.907 2.026 -8.885 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.323 2.369 -10.552 1.00 0.00 H new ATOM 0 HG SER A 77 0.654 0.578 -9.540 1.00 0.00 H new ATOM 1223 N ILE A 78 -0.408 4.904 -8.294 1.00 0.00 N ATOM 1224 CA ILE A 78 -1.092 6.117 -7.865 1.00 0.00 C ATOM 1225 C ILE A 78 -0.219 7.348 -8.088 1.00 0.00 C ATOM 1226 O ILE A 78 -0.518 8.190 -8.934 1.00 0.00 O ATOM 1227 CB ILE A 78 -1.488 6.045 -6.379 1.00 0.00 C ATOM 1228 CG1 ILE A 78 -2.690 5.117 -6.194 1.00 0.00 C ATOM 1229 CG2 ILE A 78 -1.798 7.435 -5.845 1.00 0.00 C ATOM 1230 CD1 ILE A 78 -2.822 4.570 -4.790 1.00 0.00 C ATOM 0 H ILE A 78 -0.083 4.310 -7.531 1.00 0.00 H new ATOM 0 HA ILE A 78 -1.995 6.200 -8.469 1.00 0.00 H new ATOM 0 HB ILE A 78 -0.649 5.639 -5.814 1.00 0.00 H new ATOM 0 HG12 ILE A 78 -3.600 5.659 -6.451 1.00 0.00 H new ATOM 0 HG13 ILE A 78 -2.607 4.285 -6.893 1.00 0.00 H new ATOM 0 HG21 ILE A 78 -2.076 7.367 -4.793 1.00 0.00 H new ATOM 0 HG22 ILE A 78 -0.917 8.069 -5.947 1.00 0.00 H new ATOM 0 HG23 ILE A 78 -2.623 7.867 -6.411 1.00 0.00 H new ATOM 0 HD11 ILE A 78 -3.696 3.921 -4.733 1.00 0.00 H new ATOM 0 HD12 ILE A 78 -1.929 3.999 -4.536 1.00 0.00 H new ATOM 0 HD13 ILE A 78 -2.937 5.395 -4.087 1.00 0.00 H new ATOM 1242 N VAL A 79 0.864 7.445 -7.323 1.00 0.00 N ATOM 1243 CA VAL A 79 1.783 8.571 -7.437 1.00 0.00 C ATOM 1244 C VAL A 79 2.051 8.915 -8.898 1.00 0.00 C ATOM 1245 O VAL A 79 2.183 10.085 -9.257 1.00 0.00 O ATOM 1246 CB VAL A 79 3.122 8.276 -6.737 1.00 0.00 C ATOM 1247 CG1 VAL A 79 4.046 9.481 -6.821 1.00 0.00 C ATOM 1248 CG2 VAL A 79 2.888 7.874 -5.288 1.00 0.00 C ATOM 0 H VAL A 79 1.126 6.757 -6.617 1.00 0.00 H new ATOM 0 HA VAL A 79 1.306 9.420 -6.948 1.00 0.00 H new ATOM 0 HB VAL A 79 3.604 7.443 -7.249 1.00 0.00 H new ATOM 0 HG11 VAL A 79 4.987 9.253 -6.321 1.00 0.00 H new ATOM 0 HG12 VAL A 79 4.239 9.719 -7.867 1.00 0.00 H new ATOM 0 HG13 VAL A 79 3.575 10.336 -6.336 1.00 0.00 H new ATOM 0 HG21 VAL A 79 3.845 7.669 -4.808 1.00 0.00 H new ATOM 0 HG22 VAL A 79 2.385 8.685 -4.762 1.00 0.00 H new ATOM 0 HG23 VAL A 79 2.266 6.979 -5.254 1.00 0.00 H new ATOM 1258 N ARG A 80 2.130 7.887 -9.737 1.00 0.00 N ATOM 1259 CA ARG A 80 2.383 8.080 -11.160 1.00 0.00 C ATOM 1260 C ARG A 80 1.276 8.910 -11.802 1.00 0.00 C ATOM 1261 O ARG A 80 1.545 9.832 -12.571 1.00 0.00 O ATOM 1262 CB ARG A 80 2.497 6.728 -11.867 1.00 0.00 C ATOM 1263 CG ARG A 80 3.882 6.108 -11.778 1.00 0.00 C ATOM 1264 CD ARG A 80 3.992 4.863 -12.644 1.00 0.00 C ATOM 1265 NE ARG A 80 5.354 4.648 -13.123 1.00 0.00 N ATOM 1266 CZ ARG A 80 5.675 3.751 -14.049 1.00 0.00 C ATOM 1267 NH1 ARG A 80 4.736 2.990 -14.592 1.00 0.00 N ATOM 1268 NH2 ARG A 80 6.938 3.614 -14.433 1.00 0.00 N ATOM 0 H ARG A 80 2.022 6.912 -9.456 1.00 0.00 H new ATOM 0 HA ARG A 80 3.325 8.619 -11.266 1.00 0.00 H new ATOM 0 HB2 ARG A 80 1.772 6.039 -11.434 1.00 0.00 H new ATOM 0 HB3 ARG A 80 2.231 6.853 -12.917 1.00 0.00 H new ATOM 0 HG2 ARG A 80 4.629 6.837 -12.091 1.00 0.00 H new ATOM 0 HG3 ARG A 80 4.101 5.852 -10.741 1.00 0.00 H new ATOM 0 HD2 ARG A 80 3.668 3.994 -12.072 1.00 0.00 H new ATOM 0 HD3 ARG A 80 3.318 4.953 -13.496 1.00 0.00 H new ATOM 0 HE ARG A 80 6.100 5.218 -12.725 1.00 0.00 H new ATOM 0 HH11 ARG A 80 3.764 3.092 -14.299 1.00 0.00 H new ATOM 0 HH12 ARG A 80 4.985 2.302 -15.303 1.00 0.00 H new ATOM 0 HH21 ARG A 80 7.664 4.198 -14.017 1.00 0.00 H new ATOM 0 HH22 ARG A 80 7.183 2.925 -15.144 1.00 0.00 H new ATOM 1282 N GLN A 81 0.030 8.576 -11.479 1.00 0.00 N ATOM 1283 CA GLN A 81 -1.117 9.291 -12.025 1.00 0.00 C ATOM 1284 C GLN A 81 -1.196 10.706 -11.462 1.00 0.00 C ATOM 1285 O GLN A 81 -1.023 11.684 -12.189 1.00 0.00 O ATOM 1286 CB GLN A 81 -2.410 8.533 -11.717 1.00 0.00 C ATOM 1287 CG GLN A 81 -2.800 7.532 -12.792 1.00 0.00 C ATOM 1288 CD GLN A 81 -2.732 8.118 -14.188 1.00 0.00 C ATOM 1289 OE1 GLN A 81 -3.114 9.383 -14.319 1.00 0.00 O flip ATOM 1290 NE2 GLN A 81 -2.341 7.442 -15.140 1.00 0.00 N flip ATOM 0 H GLN A 81 -0.210 7.816 -10.843 1.00 0.00 H new ATOM 0 HA GLN A 81 -0.991 9.357 -13.106 1.00 0.00 H new ATOM 0 HB2 GLN A 81 -2.297 8.009 -10.768 1.00 0.00 H new ATOM 0 HB3 GLN A 81 -3.220 9.251 -11.590 1.00 0.00 H new ATOM 0 HG2 GLN A 81 -2.140 6.666 -12.733 1.00 0.00 H new ATOM 0 HG3 GLN A 81 -3.812 7.175 -12.601 1.00 0.00 H new ATOM 0 HE21 GLN A 81 -2.057 6.473 -14.995 1.00 0.00 H new ATOM 0 HE22 GLN A 81 -2.301 7.851 -16.074 1.00 0.00 H new ATOM 1299 N SER A 82 -1.459 10.806 -10.163 1.00 0.00 N ATOM 1300 CA SER A 82 -1.565 12.102 -9.503 1.00 0.00 C ATOM 1301 C SER A 82 -0.417 13.018 -9.917 1.00 0.00 C ATOM 1302 O SER A 82 -0.628 14.186 -10.246 1.00 0.00 O ATOM 1303 CB SER A 82 -1.568 11.925 -7.983 1.00 0.00 C ATOM 1304 OG SER A 82 -0.490 11.108 -7.563 1.00 0.00 O ATOM 0 H SER A 82 -1.603 10.006 -9.547 1.00 0.00 H new ATOM 0 HA SER A 82 -2.504 12.563 -9.810 1.00 0.00 H new ATOM 0 HB2 SER A 82 -1.499 12.900 -7.500 1.00 0.00 H new ATOM 0 HB3 SER A 82 -2.511 11.479 -7.668 1.00 0.00 H new ATOM 0 HG SER A 82 0.342 11.626 -7.587 1.00 0.00 H new ATOM 1310 N ARG A 83 0.797 12.480 -9.898 1.00 0.00 N ATOM 1311 CA ARG A 83 1.980 13.248 -10.270 1.00 0.00 C ATOM 1312 C ARG A 83 1.851 13.789 -11.691 1.00 0.00 C ATOM 1313 O ARG A 83 2.415 14.832 -12.023 1.00 0.00 O ATOM 1314 CB ARG A 83 3.235 12.381 -10.154 1.00 0.00 C ATOM 1315 CG ARG A 83 4.509 13.096 -10.574 1.00 0.00 C ATOM 1316 CD ARG A 83 5.552 12.117 -11.091 1.00 0.00 C ATOM 1317 NE ARG A 83 6.758 12.797 -11.554 1.00 0.00 N ATOM 1318 CZ ARG A 83 6.859 13.392 -12.737 1.00 0.00 C ATOM 1319 NH1 ARG A 83 5.829 13.392 -13.573 1.00 0.00 N ATOM 1320 NH2 ARG A 83 7.990 13.990 -13.087 1.00 0.00 N ATOM 0 H ARG A 83 0.988 11.515 -9.629 1.00 0.00 H new ATOM 0 HA ARG A 83 2.066 14.091 -9.585 1.00 0.00 H new ATOM 0 HB2 ARG A 83 3.340 12.045 -9.123 1.00 0.00 H new ATOM 0 HB3 ARG A 83 3.109 11.490 -10.769 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.279 13.827 -11.349 1.00 0.00 H new ATOM 0 HG3 ARG A 83 4.915 13.648 -9.726 1.00 0.00 H new ATOM 0 HD2 ARG A 83 5.813 11.414 -10.300 1.00 0.00 H new ATOM 0 HD3 ARG A 83 5.128 11.534 -11.908 1.00 0.00 H new ATOM 0 HE ARG A 83 7.568 12.816 -10.934 1.00 0.00 H new ATOM 0 HH11 ARG A 83 4.957 12.934 -13.308 1.00 0.00 H new ATOM 0 HH12 ARG A 83 5.909 13.850 -14.481 1.00 0.00 H new ATOM 0 HH21 ARG A 83 8.784 13.993 -12.447 1.00 0.00 H new ATOM 0 HH22 ARG A 83 8.065 14.446 -13.996 1.00 0.00 H new ATOM 1334 N HIS A 84 1.107 13.072 -12.527 1.00 0.00 N ATOM 1335 CA HIS A 84 0.904 13.480 -13.913 1.00 0.00 C ATOM 1336 C HIS A 84 -0.374 14.301 -14.056 1.00 0.00 C ATOM 1337 O HIS A 84 -0.326 15.490 -14.371 1.00 0.00 O ATOM 1338 CB HIS A 84 0.841 12.254 -14.823 1.00 0.00 C ATOM 1339 CG HIS A 84 0.307 12.550 -16.191 1.00 0.00 C ATOM 1340 ND1 HIS A 84 1.066 13.129 -17.186 1.00 0.00 N ATOM 1341 CD2 HIS A 84 -0.918 12.342 -16.727 1.00 0.00 C ATOM 1342 CE1 HIS A 84 0.330 13.267 -18.274 1.00 0.00 C ATOM 1343 NE2 HIS A 84 -0.878 12.796 -18.022 1.00 0.00 N ATOM 0 H HIS A 84 0.635 12.206 -12.269 1.00 0.00 H new ATOM 0 HA HIS A 84 1.749 14.101 -14.211 1.00 0.00 H new ATOM 0 HB2 HIS A 84 1.840 11.829 -14.916 1.00 0.00 H new ATOM 0 HB3 HIS A 84 0.215 11.495 -14.354 1.00 0.00 H new ATOM 0 HD2 HIS A 84 -1.769 11.901 -16.229 1.00 0.00 H new ATOM 0 HE1 HIS A 84 0.660 13.693 -19.210 1.00 0.00 H new ATOM 0 HE2 HIS A 84 -1.655 12.773 -18.682 1.00 0.00 H new ATOM 1351 N GLN A 85 -1.513 13.659 -13.823 1.00 0.00 N ATOM 1352 CA GLN A 85 -2.803 14.330 -13.928 1.00 0.00 C ATOM 1353 C GLN A 85 -2.743 15.725 -13.315 1.00 0.00 C ATOM 1354 O GLN A 85 -2.987 16.724 -13.992 1.00 0.00 O ATOM 1355 CB GLN A 85 -3.890 13.504 -13.239 1.00 0.00 C ATOM 1356 CG GLN A 85 -4.591 12.525 -14.167 1.00 0.00 C ATOM 1357 CD GLN A 85 -6.037 12.285 -13.778 1.00 0.00 C ATOM 1358 OE1 GLN A 85 -6.270 11.259 -12.968 1.00 0.00 O flip ATOM 1359 NE2 GLN A 85 -6.935 13.014 -14.201 1.00 0.00 N flip ATOM 0 H GLN A 85 -1.569 12.675 -13.560 1.00 0.00 H new ATOM 0 HA GLN A 85 -3.047 14.428 -14.986 1.00 0.00 H new ATOM 0 HB2 GLN A 85 -3.445 12.952 -12.411 1.00 0.00 H new ATOM 0 HB3 GLN A 85 -4.631 14.179 -12.810 1.00 0.00 H new ATOM 0 HG2 GLN A 85 -4.552 12.906 -15.187 1.00 0.00 H new ATOM 0 HG3 GLN A 85 -4.055 11.576 -14.160 1.00 0.00 H new ATOM 0 HE21 GLN A 85 -6.711 13.792 -14.822 1.00 0.00 H new ATOM 0 HE22 GLN A 85 -7.903 12.840 -13.931 1.00 0.00 H new ATOM 1368 N PHE A 86 -2.416 15.786 -12.028 1.00 0.00 N ATOM 1369 CA PHE A 86 -2.325 17.059 -11.322 1.00 0.00 C ATOM 1370 C PHE A 86 -0.935 17.669 -11.478 1.00 0.00 C ATOM 1371 O PHE A 86 -0.781 18.889 -11.519 1.00 0.00 O ATOM 1372 CB PHE A 86 -2.648 16.868 -9.839 1.00 0.00 C ATOM 1373 CG PHE A 86 -4.038 16.359 -9.589 1.00 0.00 C ATOM 1374 CD1 PHE A 86 -4.394 15.071 -9.955 1.00 0.00 C ATOM 1375 CD2 PHE A 86 -4.989 17.167 -8.986 1.00 0.00 C ATOM 1376 CE1 PHE A 86 -5.673 14.600 -9.726 1.00 0.00 C ATOM 1377 CE2 PHE A 86 -6.269 16.701 -8.755 1.00 0.00 C ATOM 1378 CZ PHE A 86 -6.612 15.416 -9.125 1.00 0.00 C ATOM 0 H PHE A 86 -2.210 14.969 -11.453 1.00 0.00 H new ATOM 0 HA PHE A 86 -3.053 17.742 -11.760 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -1.931 16.170 -9.406 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -2.519 17.819 -9.322 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -3.664 14.428 -10.424 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -4.726 18.173 -8.693 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -5.938 13.594 -10.017 1.00 0.00 H new ATOM 0 HE2 PHE A 86 -7.001 17.342 -8.285 1.00 0.00 H new ATOM 0 HZ PHE A 86 -7.612 15.050 -8.945 1.00 0.00 H new ATOM 1388 N GLY A 87 0.076 16.809 -11.563 1.00 0.00 N ATOM 1389 CA GLY A 87 1.440 17.280 -11.712 1.00 0.00 C ATOM 1390 C GLY A 87 2.323 16.880 -10.546 1.00 0.00 C ATOM 1391 O GLY A 87 1.826 16.475 -9.495 1.00 0.00 O ATOM 0 H GLY A 87 -0.026 15.795 -11.531 1.00 0.00 H new ATOM 0 HA2 GLY A 87 1.860 16.881 -12.635 1.00 0.00 H new ATOM 0 HA3 GLY A 87 1.438 18.366 -11.806 1.00 0.00 H new ATOM 1395 N GLN A 88 3.634 16.992 -10.732 1.00 0.00 N ATOM 1396 CA GLN A 88 4.586 16.637 -9.687 1.00 0.00 C ATOM 1397 C GLN A 88 4.480 17.594 -8.505 1.00 0.00 C ATOM 1398 O GLN A 88 4.466 17.169 -7.350 1.00 0.00 O ATOM 1399 CB GLN A 88 6.012 16.649 -10.242 1.00 0.00 C ATOM 1400 CG GLN A 88 6.407 17.974 -10.875 1.00 0.00 C ATOM 1401 CD GLN A 88 6.956 18.962 -9.866 1.00 0.00 C ATOM 1402 OE1 GLN A 88 7.306 18.593 -8.745 1.00 0.00 O ATOM 1403 NE2 GLN A 88 7.036 20.228 -10.260 1.00 0.00 N ATOM 0 H GLN A 88 4.061 17.326 -11.596 1.00 0.00 H new ATOM 0 HA GLN A 88 4.347 15.632 -9.339 1.00 0.00 H new ATOM 0 HB2 GLN A 88 6.709 16.419 -9.436 1.00 0.00 H new ATOM 0 HB3 GLN A 88 6.111 15.857 -10.985 1.00 0.00 H new ATOM 0 HG2 GLN A 88 7.156 17.795 -11.647 1.00 0.00 H new ATOM 0 HG3 GLN A 88 5.538 18.410 -11.369 1.00 0.00 H new ATOM 0 HE21 GLN A 88 6.735 20.490 -11.199 1.00 0.00 H new ATOM 0 HE22 GLN A 88 7.399 20.938 -9.624 1.00 0.00 H new ATOM 1412 N GLU A 89 4.405 18.887 -8.802 1.00 0.00 N ATOM 1413 CA GLU A 89 4.300 19.904 -7.762 1.00 0.00 C ATOM 1414 C GLU A 89 2.906 19.908 -7.143 1.00 0.00 C ATOM 1415 O GLU A 89 2.718 20.352 -6.010 1.00 0.00 O ATOM 1416 CB GLU A 89 4.620 21.287 -8.335 1.00 0.00 C ATOM 1417 CG GLU A 89 3.570 21.801 -9.305 1.00 0.00 C ATOM 1418 CD GLU A 89 3.986 23.090 -9.986 1.00 0.00 C ATOM 1419 OE1 GLU A 89 5.186 23.235 -10.298 1.00 0.00 O ATOM 1420 OE2 GLU A 89 3.112 23.954 -10.206 1.00 0.00 O ATOM 0 H GLU A 89 4.415 19.255 -9.753 1.00 0.00 H new ATOM 0 HA GLU A 89 5.024 19.665 -6.983 1.00 0.00 H new ATOM 0 HB2 GLU A 89 4.722 21.996 -7.514 1.00 0.00 H new ATOM 0 HB3 GLU A 89 5.583 21.247 -8.843 1.00 0.00 H new ATOM 0 HG2 GLU A 89 3.377 21.041 -10.062 1.00 0.00 H new ATOM 0 HG3 GLU A 89 2.634 21.963 -8.770 1.00 0.00 H new ATOM 1427 N LYS A 90 1.930 19.411 -7.894 1.00 0.00 N ATOM 1428 CA LYS A 90 0.551 19.355 -7.422 1.00 0.00 C ATOM 1429 C LYS A 90 0.280 18.045 -6.690 1.00 0.00 C ATOM 1430 O LYS A 90 -0.543 17.993 -5.775 1.00 0.00 O ATOM 1431 CB LYS A 90 -0.419 19.507 -8.596 1.00 0.00 C ATOM 1432 CG LYS A 90 -0.310 20.845 -9.305 1.00 0.00 C ATOM 1433 CD LYS A 90 -1.155 21.908 -8.623 1.00 0.00 C ATOM 1434 CE LYS A 90 -0.377 22.620 -7.527 1.00 0.00 C ATOM 1435 NZ LYS A 90 -0.895 23.994 -7.282 1.00 0.00 N ATOM 0 H LYS A 90 2.068 19.040 -8.834 1.00 0.00 H new ATOM 0 HA LYS A 90 0.398 20.179 -6.725 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -0.235 18.708 -9.315 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -1.439 19.380 -8.233 1.00 0.00 H new ATOM 0 HG2 LYS A 90 0.732 21.164 -9.324 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -0.629 20.735 -10.342 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -1.493 22.635 -9.362 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -2.047 21.448 -8.197 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -0.435 22.041 -6.606 1.00 0.00 H new ATOM 0 HE3 LYS A 90 0.676 22.673 -7.805 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -0.338 24.446 -6.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -0.817 24.555 -8.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -1.892 23.942 -6.992 1.00 0.00 H new ATOM 1449 N ASP A 91 0.976 16.990 -7.098 1.00 0.00 N ATOM 1450 CA ASP A 91 0.811 15.679 -6.479 1.00 0.00 C ATOM 1451 C ASP A 91 0.602 15.812 -4.973 1.00 0.00 C ATOM 1452 O ASP A 91 1.034 16.788 -4.360 1.00 0.00 O ATOM 1453 CB ASP A 91 2.031 14.801 -6.762 1.00 0.00 C ATOM 1454 CG ASP A 91 1.758 13.332 -6.505 1.00 0.00 C ATOM 1455 OD1 ASP A 91 1.189 13.012 -5.441 1.00 0.00 O ATOM 1456 OD2 ASP A 91 2.115 12.502 -7.368 1.00 0.00 O ATOM 0 H ASP A 91 1.660 17.016 -7.854 1.00 0.00 H new ATOM 0 HA ASP A 91 -0.073 15.209 -6.910 1.00 0.00 H new ATOM 0 HB2 ASP A 91 2.339 14.935 -7.799 1.00 0.00 H new ATOM 0 HB3 ASP A 91 2.863 15.128 -6.138 1.00 0.00 H new ATOM 1461 N VAL A 92 -0.064 14.824 -4.384 1.00 0.00 N ATOM 1462 CA VAL A 92 -0.330 14.830 -2.950 1.00 0.00 C ATOM 1463 C VAL A 92 0.138 13.533 -2.299 1.00 0.00 C ATOM 1464 O VAL A 92 0.558 13.524 -1.142 1.00 0.00 O ATOM 1465 CB VAL A 92 -1.829 15.026 -2.659 1.00 0.00 C ATOM 1466 CG1 VAL A 92 -2.266 16.435 -3.030 1.00 0.00 C ATOM 1467 CG2 VAL A 92 -2.657 13.989 -3.404 1.00 0.00 C ATOM 0 H VAL A 92 -0.429 14.009 -4.877 1.00 0.00 H new ATOM 0 HA VAL A 92 0.227 15.666 -2.528 1.00 0.00 H new ATOM 0 HB VAL A 92 -1.994 14.890 -1.590 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -3.328 16.554 -2.817 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -1.696 17.158 -2.447 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -2.088 16.604 -4.092 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -3.714 14.143 -3.187 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -2.489 14.091 -4.476 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -2.362 12.990 -3.084 1.00 0.00 H new ATOM 1477 N PHE A 93 0.063 12.440 -3.050 1.00 0.00 N ATOM 1478 CA PHE A 93 0.479 11.136 -2.546 1.00 0.00 C ATOM 1479 C PHE A 93 2.000 11.020 -2.527 1.00 0.00 C ATOM 1480 O PHE A 93 2.572 10.362 -1.658 1.00 0.00 O ATOM 1481 CB PHE A 93 -0.118 10.020 -3.406 1.00 0.00 C ATOM 1482 CG PHE A 93 -1.616 10.075 -3.505 1.00 0.00 C ATOM 1483 CD1 PHE A 93 -2.233 10.932 -4.403 1.00 0.00 C ATOM 1484 CD2 PHE A 93 -2.407 9.271 -2.701 1.00 0.00 C ATOM 1485 CE1 PHE A 93 -3.611 10.985 -4.496 1.00 0.00 C ATOM 1486 CE2 PHE A 93 -3.786 9.320 -2.790 1.00 0.00 C ATOM 1487 CZ PHE A 93 -4.388 10.177 -3.689 1.00 0.00 C ATOM 0 H PHE A 93 -0.282 12.431 -4.010 1.00 0.00 H new ATOM 0 HA PHE A 93 0.112 11.035 -1.525 1.00 0.00 H new ATOM 0 HB2 PHE A 93 0.307 10.078 -4.408 1.00 0.00 H new ATOM 0 HB3 PHE A 93 0.175 9.056 -2.991 1.00 0.00 H new ATOM 0 HD1 PHE A 93 -1.630 11.565 -5.037 1.00 0.00 H new ATOM 0 HD2 PHE A 93 -1.941 8.598 -1.996 1.00 0.00 H new ATOM 0 HE1 PHE A 93 -4.080 11.658 -5.199 1.00 0.00 H new ATOM 0 HE2 PHE A 93 -4.391 8.688 -2.157 1.00 0.00 H new ATOM 0 HZ PHE A 93 -5.465 10.216 -3.761 1.00 0.00 H new ATOM 1497 N ALA A 94 2.649 11.664 -3.492 1.00 0.00 N ATOM 1498 CA ALA A 94 4.103 11.635 -3.585 1.00 0.00 C ATOM 1499 C ALA A 94 4.746 12.162 -2.307 1.00 0.00 C ATOM 1500 O ALA A 94 5.570 11.498 -1.678 1.00 0.00 O ATOM 1501 CB ALA A 94 4.571 12.443 -4.786 1.00 0.00 C ATOM 0 H ALA A 94 2.190 12.212 -4.220 1.00 0.00 H new ATOM 0 HA ALA A 94 4.413 10.598 -3.715 1.00 0.00 H new ATOM 0 HB1 ALA A 94 5.659 12.413 -4.843 1.00 0.00 H new ATOM 0 HB2 ALA A 94 4.148 12.019 -5.697 1.00 0.00 H new ATOM 0 HB3 ALA A 94 4.242 13.477 -4.680 1.00 0.00 H new ATOM 1507 N PRO A 95 4.364 13.386 -1.913 1.00 0.00 N ATOM 1508 CA PRO A 95 4.891 14.029 -0.706 1.00 0.00 C ATOM 1509 C PRO A 95 4.400 13.357 0.572 1.00 0.00 C ATOM 1510 O PRO A 95 5.053 13.429 1.613 1.00 0.00 O ATOM 1511 CB PRO A 95 4.350 15.458 -0.800 1.00 0.00 C ATOM 1512 CG PRO A 95 3.120 15.343 -1.633 1.00 0.00 C ATOM 1513 CD PRO A 95 3.386 14.235 -2.614 1.00 0.00 C ATOM 0 HA PRO A 95 5.978 13.972 -0.657 1.00 0.00 H new ATOM 0 HB2 PRO A 95 4.123 15.861 0.187 1.00 0.00 H new ATOM 0 HB3 PRO A 95 5.078 16.128 -1.259 1.00 0.00 H new ATOM 0 HG2 PRO A 95 2.250 15.117 -1.016 1.00 0.00 H new ATOM 0 HG3 PRO A 95 2.910 16.279 -2.150 1.00 0.00 H new ATOM 0 HD2 PRO A 95 2.476 13.685 -2.855 1.00 0.00 H new ATOM 0 HD3 PRO A 95 3.786 14.617 -3.553 1.00 0.00 H new ATOM 1521 N ARG A 96 3.247 12.703 0.485 1.00 0.00 N ATOM 1522 CA ARG A 96 2.668 12.018 1.634 1.00 0.00 C ATOM 1523 C ARG A 96 3.372 10.688 1.886 1.00 0.00 C ATOM 1524 O ARG A 96 3.653 10.328 3.029 1.00 0.00 O ATOM 1525 CB ARG A 96 1.173 11.782 1.415 1.00 0.00 C ATOM 1526 CG ARG A 96 0.358 11.802 2.698 1.00 0.00 C ATOM 1527 CD ARG A 96 1.091 11.106 3.834 1.00 0.00 C ATOM 1528 NE ARG A 96 0.205 10.808 4.956 1.00 0.00 N ATOM 1529 CZ ARG A 96 0.630 10.639 6.203 1.00 0.00 C ATOM 1530 NH1 ARG A 96 1.921 10.740 6.487 1.00 0.00 N ATOM 1531 NH2 ARG A 96 -0.238 10.370 7.170 1.00 0.00 N ATOM 0 H ARG A 96 2.695 12.633 -0.370 1.00 0.00 H new ATOM 0 HA ARG A 96 2.804 12.653 2.509 1.00 0.00 H new ATOM 0 HB2 ARG A 96 0.789 12.546 0.739 1.00 0.00 H new ATOM 0 HB3 ARG A 96 1.034 10.820 0.922 1.00 0.00 H new ATOM 0 HG2 ARG A 96 0.145 12.833 2.979 1.00 0.00 H new ATOM 0 HG3 ARG A 96 -0.601 11.313 2.529 1.00 0.00 H new ATOM 0 HD2 ARG A 96 1.534 10.180 3.466 1.00 0.00 H new ATOM 0 HD3 ARG A 96 1.911 11.737 4.177 1.00 0.00 H new ATOM 0 HE ARG A 96 -0.795 10.725 4.772 1.00 0.00 H new ATOM 0 HH11 ARG A 96 2.591 10.948 5.747 1.00 0.00 H new ATOM 0 HH12 ARG A 96 2.244 10.610 7.446 1.00 0.00 H new ATOM 0 HH21 ARG A 96 -1.232 10.293 6.956 1.00 0.00 H new ATOM 0 HH22 ARG A 96 0.089 10.240 8.127 1.00 0.00 H new ATOM 1545 N PHE A 97 3.655 9.961 0.809 1.00 0.00 N ATOM 1546 CA PHE A 97 4.324 8.670 0.913 1.00 0.00 C ATOM 1547 C PHE A 97 5.787 8.846 1.312 1.00 0.00 C ATOM 1548 O PHE A 97 6.318 8.083 2.118 1.00 0.00 O ATOM 1549 CB PHE A 97 4.233 7.916 -0.415 1.00 0.00 C ATOM 1550 CG PHE A 97 2.894 7.278 -0.652 1.00 0.00 C ATOM 1551 CD1 PHE A 97 2.321 6.462 0.310 1.00 0.00 C ATOM 1552 CD2 PHE A 97 2.209 7.495 -1.836 1.00 0.00 C ATOM 1553 CE1 PHE A 97 1.090 5.873 0.094 1.00 0.00 C ATOM 1554 CE2 PHE A 97 0.976 6.910 -2.058 1.00 0.00 C ATOM 1555 CZ PHE A 97 0.416 6.099 -1.091 1.00 0.00 C ATOM 0 H PHE A 97 3.431 10.245 -0.145 1.00 0.00 H new ATOM 0 HA PHE A 97 3.822 8.090 1.687 1.00 0.00 H new ATOM 0 HB2 PHE A 97 4.447 8.606 -1.231 1.00 0.00 H new ATOM 0 HB3 PHE A 97 5.003 7.145 -0.439 1.00 0.00 H new ATOM 0 HD1 PHE A 97 2.842 6.284 1.239 1.00 0.00 H new ATOM 0 HD2 PHE A 97 2.643 8.129 -2.595 1.00 0.00 H new ATOM 0 HE1 PHE A 97 0.655 5.237 0.850 1.00 0.00 H new ATOM 0 HE2 PHE A 97 0.452 7.087 -2.986 1.00 0.00 H new ATOM 0 HZ PHE A 97 -0.548 5.642 -1.261 1.00 0.00 H new ATOM 1565 N SER A 98 6.432 9.858 0.739 1.00 0.00 N ATOM 1566 CA SER A 98 7.834 10.132 1.031 1.00 0.00 C ATOM 1567 C SER A 98 8.049 10.330 2.528 1.00 0.00 C ATOM 1568 O SER A 98 9.097 9.977 3.067 1.00 0.00 O ATOM 1569 CB SER A 98 8.301 11.374 0.269 1.00 0.00 C ATOM 1570 OG SER A 98 8.017 12.556 0.997 1.00 0.00 O ATOM 0 H SER A 98 6.006 10.501 0.071 1.00 0.00 H new ATOM 0 HA SER A 98 8.422 9.273 0.708 1.00 0.00 H new ATOM 0 HB2 SER A 98 9.373 11.308 0.081 1.00 0.00 H new ATOM 0 HB3 SER A 98 7.809 11.415 -0.703 1.00 0.00 H new ATOM 0 HG SER A 98 7.046 12.668 1.072 1.00 0.00 H new ATOM 1576 N ASN A 99 7.048 10.897 3.194 1.00 0.00 N ATOM 1577 CA ASN A 99 7.127 11.142 4.629 1.00 0.00 C ATOM 1578 C ASN A 99 7.629 9.904 5.366 1.00 0.00 C ATOM 1579 O ASN A 99 8.729 9.900 5.915 1.00 0.00 O ATOM 1580 CB ASN A 99 5.757 11.554 5.173 1.00 0.00 C ATOM 1581 CG ASN A 99 5.288 12.883 4.614 1.00 0.00 C ATOM 1582 OD1 ASN A 99 6.090 13.682 4.130 1.00 0.00 O ATOM 1583 ND2 ASN A 99 3.984 13.126 4.680 1.00 0.00 N ATOM 0 H ASN A 99 6.173 11.195 2.763 1.00 0.00 H new ATOM 0 HA ASN A 99 7.836 11.953 4.796 1.00 0.00 H new ATOM 0 HB2 ASN A 99 5.026 10.783 4.930 1.00 0.00 H new ATOM 0 HB3 ASN A 99 5.805 11.617 6.260 1.00 0.00 H new ATOM 0 HD21 ASN A 99 3.610 14.004 4.321 1.00 0.00 H new ATOM 0 HD22 ASN A 99 3.356 12.434 5.090 1.00 0.00 H new ATOM 1590 N ASN A 100 6.813 8.855 5.373 1.00 0.00 N ATOM 1591 CA ASN A 100 7.173 7.611 6.042 1.00 0.00 C ATOM 1592 C ASN A 100 7.444 6.505 5.026 1.00 0.00 C ATOM 1593 O ASN A 100 7.434 5.321 5.364 1.00 0.00 O ATOM 1594 CB ASN A 100 6.058 7.179 6.997 1.00 0.00 C ATOM 1595 CG ASN A 100 5.392 8.359 7.678 1.00 0.00 C ATOM 1596 OD1 ASN A 100 4.283 8.753 7.317 1.00 0.00 O ATOM 1597 ND2 ASN A 100 6.067 8.928 8.670 1.00 0.00 N ATOM 0 H ASN A 100 5.898 8.842 4.923 1.00 0.00 H new ATOM 0 HA ASN A 100 8.084 7.786 6.614 1.00 0.00 H new ATOM 0 HB2 ASN A 100 5.309 6.612 6.444 1.00 0.00 H new ATOM 0 HB3 ASN A 100 6.470 6.511 7.754 1.00 0.00 H new ATOM 0 HD21 ASN A 100 5.669 9.725 9.166 1.00 0.00 H new ATOM 0 HD22 ASN A 100 6.984 8.568 8.936 1.00 0.00 H new ATOM 1604 N ILE A 101 7.687 6.900 3.781 1.00 0.00 N ATOM 1605 CA ILE A 101 7.962 5.943 2.716 1.00 0.00 C ATOM 1606 C ILE A 101 8.752 4.749 3.241 1.00 0.00 C ATOM 1607 O ILE A 101 8.475 3.604 2.884 1.00 0.00 O ATOM 1608 CB ILE A 101 8.746 6.595 1.562 1.00 0.00 C ATOM 1609 CG1 ILE A 101 9.049 5.562 0.475 1.00 0.00 C ATOM 1610 CG2 ILE A 101 10.032 7.219 2.081 1.00 0.00 C ATOM 1611 CD1 ILE A 101 7.980 5.478 -0.593 1.00 0.00 C ATOM 0 H ILE A 101 7.699 7.876 3.485 1.00 0.00 H new ATOM 0 HA ILE A 101 6.997 5.601 2.342 1.00 0.00 H new ATOM 0 HB ILE A 101 8.133 7.384 1.126 1.00 0.00 H new ATOM 0 HG12 ILE A 101 10.001 5.809 0.006 1.00 0.00 H new ATOM 0 HG13 ILE A 101 9.166 4.582 0.938 1.00 0.00 H new ATOM 0 HG21 ILE A 101 10.575 7.676 1.253 1.00 0.00 H new ATOM 0 HG22 ILE A 101 9.793 7.981 2.823 1.00 0.00 H new ATOM 0 HG23 ILE A 101 10.651 6.448 2.540 1.00 0.00 H new ATOM 0 HD11 ILE A 101 8.261 4.726 -1.330 1.00 0.00 H new ATOM 0 HD12 ILE A 101 7.030 5.201 -0.136 1.00 0.00 H new ATOM 0 HD13 ILE A 101 7.878 6.446 -1.083 1.00 0.00 H new ATOM 1623 N ILE A 102 9.734 5.025 4.092 1.00 0.00 N ATOM 1624 CA ILE A 102 10.562 3.973 4.668 1.00 0.00 C ATOM 1625 C ILE A 102 9.712 2.950 5.414 1.00 0.00 C ATOM 1626 O ILE A 102 9.713 1.765 5.081 1.00 0.00 O ATOM 1627 CB ILE A 102 11.615 4.550 5.634 1.00 0.00 C ATOM 1628 CG1 ILE A 102 12.460 5.611 4.926 1.00 0.00 C ATOM 1629 CG2 ILE A 102 12.498 3.438 6.180 1.00 0.00 C ATOM 1630 CD1 ILE A 102 13.312 5.056 3.806 1.00 0.00 C ATOM 0 H ILE A 102 9.976 5.968 4.398 1.00 0.00 H new ATOM 0 HA ILE A 102 11.071 3.483 3.838 1.00 0.00 H new ATOM 0 HB ILE A 102 11.100 5.022 6.471 1.00 0.00 H new ATOM 0 HG12 ILE A 102 11.801 6.380 4.523 1.00 0.00 H new ATOM 0 HG13 ILE A 102 13.106 6.096 5.657 1.00 0.00 H new ATOM 0 HG21 ILE A 102 13.237 3.861 6.861 1.00 0.00 H new ATOM 0 HG22 ILE A 102 11.883 2.715 6.716 1.00 0.00 H new ATOM 0 HG23 ILE A 102 13.008 2.940 5.355 1.00 0.00 H new ATOM 0 HD11 ILE A 102 13.884 5.864 3.349 1.00 0.00 H new ATOM 0 HD12 ILE A 102 13.996 4.308 4.206 1.00 0.00 H new ATOM 0 HD13 ILE A 102 12.670 4.596 3.055 1.00 0.00 H new ATOM 1642 N SER A 103 8.984 3.417 6.424 1.00 0.00 N ATOM 1643 CA SER A 103 8.129 2.543 7.218 1.00 0.00 C ATOM 1644 C SER A 103 7.187 1.744 6.323 1.00 0.00 C ATOM 1645 O SER A 103 6.731 0.661 6.690 1.00 0.00 O ATOM 1646 CB SER A 103 7.321 3.363 8.226 1.00 0.00 C ATOM 1647 OG SER A 103 7.036 2.605 9.389 1.00 0.00 O ATOM 0 H SER A 103 8.970 4.396 6.711 1.00 0.00 H new ATOM 0 HA SER A 103 8.768 1.844 7.758 1.00 0.00 H new ATOM 0 HB2 SER A 103 7.878 4.259 8.500 1.00 0.00 H new ATOM 0 HB3 SER A 103 6.390 3.694 7.767 1.00 0.00 H new ATOM 0 HG SER A 103 6.520 3.152 10.018 1.00 0.00 H new ATOM 1653 N THR A 104 6.898 2.288 5.145 1.00 0.00 N ATOM 1654 CA THR A 104 6.009 1.628 4.196 1.00 0.00 C ATOM 1655 C THR A 104 6.719 0.483 3.483 1.00 0.00 C ATOM 1656 O THR A 104 6.168 -0.609 3.342 1.00 0.00 O ATOM 1657 CB THR A 104 5.475 2.619 3.145 1.00 0.00 C ATOM 1658 OG1 THR A 104 4.574 3.547 3.760 1.00 0.00 O ATOM 1659 CG2 THR A 104 4.762 1.883 2.020 1.00 0.00 C ATOM 0 H THR A 104 7.266 3.184 4.825 1.00 0.00 H new ATOM 0 HA THR A 104 5.171 1.232 4.770 1.00 0.00 H new ATOM 0 HB THR A 104 6.323 3.160 2.724 1.00 0.00 H new ATOM 0 HG1 THR A 104 4.609 4.402 3.283 1.00 0.00 H new ATOM 0 HG21 THR A 104 4.394 2.604 1.290 1.00 0.00 H new ATOM 0 HG22 THR A 104 5.458 1.198 1.535 1.00 0.00 H new ATOM 0 HG23 THR A 104 3.923 1.319 2.428 1.00 0.00 H new ATOM 1667 N PHE A 105 7.944 0.738 3.036 1.00 0.00 N ATOM 1668 CA PHE A 105 8.729 -0.272 2.337 1.00 0.00 C ATOM 1669 C PHE A 105 9.150 -1.388 3.289 1.00 0.00 C ATOM 1670 O PHE A 105 9.156 -2.562 2.921 1.00 0.00 O ATOM 1671 CB PHE A 105 9.965 0.363 1.698 1.00 0.00 C ATOM 1672 CG PHE A 105 9.721 0.889 0.313 1.00 0.00 C ATOM 1673 CD1 PHE A 105 8.664 1.747 0.059 1.00 0.00 C ATOM 1674 CD2 PHE A 105 10.550 0.524 -0.737 1.00 0.00 C ATOM 1675 CE1 PHE A 105 8.437 2.233 -1.215 1.00 0.00 C ATOM 1676 CE2 PHE A 105 10.328 1.007 -2.013 1.00 0.00 C ATOM 1677 CZ PHE A 105 9.269 1.861 -2.252 1.00 0.00 C ATOM 0 H PHE A 105 8.415 1.636 3.146 1.00 0.00 H new ATOM 0 HA PHE A 105 8.106 -0.703 1.553 1.00 0.00 H new ATOM 0 HB2 PHE A 105 10.313 1.179 2.332 1.00 0.00 H new ATOM 0 HB3 PHE A 105 10.765 -0.376 1.661 1.00 0.00 H new ATOM 0 HD1 PHE A 105 8.009 2.040 0.866 1.00 0.00 H new ATOM 0 HD2 PHE A 105 11.378 -0.145 -0.556 1.00 0.00 H new ATOM 0 HE1 PHE A 105 7.610 2.903 -1.399 1.00 0.00 H new ATOM 0 HE2 PHE A 105 10.982 0.717 -2.822 1.00 0.00 H new ATOM 0 HZ PHE A 105 9.092 2.237 -3.249 1.00 0.00 H new ATOM 1687 N GLN A 106 9.503 -1.011 4.513 1.00 0.00 N ATOM 1688 CA GLN A 106 9.928 -1.979 5.518 1.00 0.00 C ATOM 1689 C GLN A 106 8.945 -3.142 5.602 1.00 0.00 C ATOM 1690 O GLN A 106 9.347 -4.301 5.691 1.00 0.00 O ATOM 1691 CB GLN A 106 10.057 -1.304 6.884 1.00 0.00 C ATOM 1692 CG GLN A 106 11.254 -0.373 6.993 1.00 0.00 C ATOM 1693 CD GLN A 106 12.576 -1.111 6.912 1.00 0.00 C ATOM 1694 OE1 GLN A 106 12.627 -2.334 7.046 1.00 0.00 O ATOM 1695 NE2 GLN A 106 13.656 -0.370 6.692 1.00 0.00 N ATOM 0 H GLN A 106 9.503 -0.043 4.833 1.00 0.00 H new ATOM 0 HA GLN A 106 10.901 -2.370 5.222 1.00 0.00 H new ATOM 0 HB2 GLN A 106 9.148 -0.738 7.088 1.00 0.00 H new ATOM 0 HB3 GLN A 106 10.134 -2.072 7.654 1.00 0.00 H new ATOM 0 HG2 GLN A 106 11.207 0.369 6.196 1.00 0.00 H new ATOM 0 HG3 GLN A 106 11.202 0.170 7.937 1.00 0.00 H new ATOM 0 HE21 GLN A 106 13.568 0.641 6.587 1.00 0.00 H new ATOM 0 HE22 GLN A 106 14.573 -0.812 6.628 1.00 0.00 H new ATOM 1704 N ASN A 107 7.655 -2.823 5.575 1.00 0.00 N ATOM 1705 CA ASN A 107 6.615 -3.842 5.649 1.00 0.00 C ATOM 1706 C ASN A 107 6.530 -4.630 4.346 1.00 0.00 C ATOM 1707 O ASN A 107 5.974 -5.729 4.306 1.00 0.00 O ATOM 1708 CB ASN A 107 5.262 -3.198 5.957 1.00 0.00 C ATOM 1709 CG ASN A 107 5.291 -2.369 7.226 1.00 0.00 C ATOM 1710 OD1 ASN A 107 6.240 -2.443 8.007 1.00 0.00 O ATOM 1711 ND2 ASN A 107 4.249 -1.573 7.438 1.00 0.00 N ATOM 0 H ASN A 107 7.305 -1.868 5.502 1.00 0.00 H new ATOM 0 HA ASN A 107 6.874 -4.531 6.453 1.00 0.00 H new ATOM 0 HB2 ASN A 107 4.965 -2.566 5.120 1.00 0.00 H new ATOM 0 HB3 ASN A 107 4.505 -3.977 6.052 1.00 0.00 H new ATOM 0 HD21 ASN A 107 4.214 -0.991 8.275 1.00 0.00 H new ATOM 0 HD22 ASN A 107 3.484 -1.543 6.764 1.00 0.00 H new ATOM 1718 N LEU A 108 7.086 -4.063 3.281 1.00 0.00 N ATOM 1719 CA LEU A 108 7.075 -4.712 1.975 1.00 0.00 C ATOM 1720 C LEU A 108 8.339 -5.542 1.768 1.00 0.00 C ATOM 1721 O LEU A 108 8.332 -6.528 1.031 1.00 0.00 O ATOM 1722 CB LEU A 108 6.951 -3.667 0.865 1.00 0.00 C ATOM 1723 CG LEU A 108 5.738 -2.739 0.949 1.00 0.00 C ATOM 1724 CD1 LEU A 108 5.920 -1.538 0.034 1.00 0.00 C ATOM 1725 CD2 LEU A 108 4.465 -3.494 0.595 1.00 0.00 C ATOM 0 H LEU A 108 7.550 -3.155 3.296 1.00 0.00 H new ATOM 0 HA LEU A 108 6.214 -5.379 1.936 1.00 0.00 H new ATOM 0 HB2 LEU A 108 7.853 -3.055 0.868 1.00 0.00 H new ATOM 0 HB3 LEU A 108 6.921 -4.186 -0.093 1.00 0.00 H new ATOM 0 HG LEU A 108 5.650 -2.378 1.974 1.00 0.00 H new ATOM 0 HD11 LEU A 108 5.047 -0.889 0.107 1.00 0.00 H new ATOM 0 HD12 LEU A 108 6.810 -0.984 0.333 1.00 0.00 H new ATOM 0 HD13 LEU A 108 6.034 -1.879 -0.995 1.00 0.00 H new ATOM 0 HD21 LEU A 108 3.612 -2.819 0.660 1.00 0.00 H new ATOM 0 HD22 LEU A 108 4.543 -3.884 -0.420 1.00 0.00 H new ATOM 0 HD23 LEU A 108 4.327 -4.321 1.291 1.00 0.00 H new ATOM 1737 N TYR A 109 9.420 -5.137 2.425 1.00 0.00 N ATOM 1738 CA TYR A 109 10.691 -5.842 2.313 1.00 0.00 C ATOM 1739 C TYR A 109 10.710 -7.075 3.212 1.00 0.00 C ATOM 1740 O TYR A 109 11.653 -7.867 3.178 1.00 0.00 O ATOM 1741 CB TYR A 109 11.849 -4.912 2.680 1.00 0.00 C ATOM 1742 CG TYR A 109 12.206 -3.930 1.587 1.00 0.00 C ATOM 1743 CD1 TYR A 109 12.322 -4.343 0.265 1.00 0.00 C ATOM 1744 CD2 TYR A 109 12.427 -2.589 1.876 1.00 0.00 C ATOM 1745 CE1 TYR A 109 12.649 -3.450 -0.736 1.00 0.00 C ATOM 1746 CE2 TYR A 109 12.753 -1.688 0.880 1.00 0.00 C ATOM 1747 CZ TYR A 109 12.863 -2.124 -0.424 1.00 0.00 C ATOM 1748 OH TYR A 109 13.188 -1.230 -1.419 1.00 0.00 O ATOM 0 H TYR A 109 9.441 -4.324 3.041 1.00 0.00 H new ATOM 0 HA TYR A 109 10.808 -6.166 1.279 1.00 0.00 H new ATOM 0 HB2 TYR A 109 11.588 -4.359 3.583 1.00 0.00 H new ATOM 0 HB3 TYR A 109 12.726 -5.514 2.917 1.00 0.00 H new ATOM 0 HD1 TYR A 109 12.153 -5.380 0.016 1.00 0.00 H new ATOM 0 HD2 TYR A 109 12.343 -2.245 2.896 1.00 0.00 H new ATOM 0 HE1 TYR A 109 12.737 -3.788 -1.758 1.00 0.00 H new ATOM 0 HE2 TYR A 109 12.921 -0.649 1.121 1.00 0.00 H new ATOM 0 HH TYR A 109 13.582 -0.426 -1.021 1.00 0.00 H new ATOM 1758 N ARG A 110 9.662 -7.231 4.014 1.00 0.00 N ATOM 1759 CA ARG A 110 9.558 -8.366 4.922 1.00 0.00 C ATOM 1760 C ARG A 110 9.395 -9.670 4.147 1.00 0.00 C ATOM 1761 O ARG A 110 9.544 -10.758 4.704 1.00 0.00 O ATOM 1762 CB ARG A 110 8.376 -8.177 5.876 1.00 0.00 C ATOM 1763 CG ARG A 110 8.240 -6.758 6.402 1.00 0.00 C ATOM 1764 CD ARG A 110 7.499 -6.725 7.730 1.00 0.00 C ATOM 1765 NE ARG A 110 8.149 -7.555 8.740 1.00 0.00 N ATOM 1766 CZ ARG A 110 7.808 -7.552 10.024 1.00 0.00 C ATOM 1767 NH1 ARG A 110 6.828 -6.767 10.451 1.00 0.00 N ATOM 1768 NH2 ARG A 110 8.446 -8.336 10.883 1.00 0.00 N ATOM 0 H ARG A 110 8.873 -6.586 4.053 1.00 0.00 H new ATOM 0 HA ARG A 110 10.480 -8.420 5.501 1.00 0.00 H new ATOM 0 HB2 ARG A 110 7.456 -8.454 5.361 1.00 0.00 H new ATOM 0 HB3 ARG A 110 8.488 -8.859 6.719 1.00 0.00 H new ATOM 0 HG2 ARG A 110 9.230 -6.318 6.525 1.00 0.00 H new ATOM 0 HG3 ARG A 110 7.708 -6.148 5.672 1.00 0.00 H new ATOM 0 HD2 ARG A 110 7.442 -5.697 8.088 1.00 0.00 H new ATOM 0 HD3 ARG A 110 6.475 -7.069 7.582 1.00 0.00 H new ATOM 0 HE ARG A 110 8.906 -8.171 8.444 1.00 0.00 H new ATOM 0 HH11 ARG A 110 6.334 -6.164 9.793 1.00 0.00 H new ATOM 0 HH12 ARG A 110 6.568 -6.766 11.437 1.00 0.00 H new ATOM 0 HH21 ARG A 110 9.199 -8.942 10.558 1.00 0.00 H new ATOM 0 HH22 ARG A 110 8.183 -8.333 11.869 1.00 0.00 H new ATOM 1782 N CYS A 111 9.088 -9.552 2.860 1.00 0.00 N ATOM 1783 CA CYS A 111 8.904 -10.722 2.007 1.00 0.00 C ATOM 1784 C CYS A 111 10.083 -11.680 2.137 1.00 0.00 C ATOM 1785 O CYS A 111 11.187 -11.296 2.524 1.00 0.00 O ATOM 1786 CB CYS A 111 8.736 -10.294 0.549 1.00 0.00 C ATOM 1787 SG CYS A 111 10.144 -9.376 -0.118 1.00 0.00 S ATOM 0 H CYS A 111 8.961 -8.659 2.384 1.00 0.00 H new ATOM 0 HA CYS A 111 8.002 -11.240 2.332 1.00 0.00 H new ATOM 0 HB2 CYS A 111 8.572 -11.181 -0.062 1.00 0.00 H new ATOM 0 HB3 CYS A 111 7.841 -9.678 0.463 1.00 0.00 H new ATOM 0 HG CYS A 111 9.908 -9.060 -1.357 1.00 0.00 H new ATOM 1793 N PRO A 112 9.846 -12.958 1.807 1.00 0.00 N ATOM 1794 CA PRO A 112 10.876 -13.999 1.879 1.00 0.00 C ATOM 1795 C PRO A 112 12.183 -13.567 1.224 1.00 0.00 C ATOM 1796 O PRO A 112 13.236 -14.154 1.469 1.00 0.00 O ATOM 1797 CB PRO A 112 10.254 -15.168 1.113 1.00 0.00 C ATOM 1798 CG PRO A 112 8.783 -14.963 1.237 1.00 0.00 C ATOM 1799 CD PRO A 112 8.554 -13.487 1.338 1.00 0.00 C ATOM 0 HA PRO A 112 11.141 -14.240 2.909 1.00 0.00 H new ATOM 0 HB2 PRO A 112 10.567 -15.168 0.069 1.00 0.00 H new ATOM 0 HB3 PRO A 112 10.557 -16.125 1.537 1.00 0.00 H new ATOM 0 HG2 PRO A 112 8.262 -15.376 0.373 1.00 0.00 H new ATOM 0 HG3 PRO A 112 8.395 -15.475 2.118 1.00 0.00 H new ATOM 0 HD2 PRO A 112 8.273 -13.060 0.375 1.00 0.00 H new ATOM 0 HD3 PRO A 112 7.750 -13.255 2.036 1.00 0.00 H new ATOM 1807 N GLY A 113 12.108 -12.536 0.388 1.00 0.00 N ATOM 1808 CA GLY A 113 13.293 -12.043 -0.290 1.00 0.00 C ATOM 1809 C GLY A 113 13.243 -12.275 -1.787 1.00 0.00 C ATOM 1810 O GLY A 113 13.695 -11.437 -2.568 1.00 0.00 O ATOM 0 H GLY A 113 11.248 -12.033 0.168 1.00 0.00 H new ATOM 0 HA2 GLY A 113 13.403 -10.976 -0.094 1.00 0.00 H new ATOM 0 HA3 GLY A 113 14.174 -12.535 0.122 1.00 0.00 H new ATOM 1814 N ASP A 114 12.693 -13.415 -2.190 1.00 0.00 N ATOM 1815 CA ASP A 114 12.586 -13.756 -3.604 1.00 0.00 C ATOM 1816 C ASP A 114 11.580 -12.849 -4.306 1.00 0.00 C ATOM 1817 O ASP A 114 11.363 -12.964 -5.513 1.00 0.00 O ATOM 1818 CB ASP A 114 12.174 -15.220 -3.768 1.00 0.00 C ATOM 1819 CG ASP A 114 13.367 -16.152 -3.840 1.00 0.00 C ATOM 1820 OD1 ASP A 114 13.934 -16.306 -4.942 1.00 0.00 O ATOM 1821 OD2 ASP A 114 13.734 -16.727 -2.794 1.00 0.00 O ATOM 0 H ASP A 114 12.314 -14.119 -1.557 1.00 0.00 H new ATOM 0 HA ASP A 114 13.563 -13.609 -4.064 1.00 0.00 H new ATOM 0 HB2 ASP A 114 11.539 -15.512 -2.932 1.00 0.00 H new ATOM 0 HB3 ASP A 114 11.577 -15.327 -4.674 1.00 0.00 H new ATOM 1826 N ASP A 115 10.968 -11.951 -3.543 1.00 0.00 N ATOM 1827 CA ASP A 115 9.984 -11.024 -4.092 1.00 0.00 C ATOM 1828 C ASP A 115 10.526 -9.598 -4.099 1.00 0.00 C ATOM 1829 O ASP A 115 10.002 -8.727 -4.794 1.00 0.00 O ATOM 1830 CB ASP A 115 8.687 -11.087 -3.285 1.00 0.00 C ATOM 1831 CG ASP A 115 7.716 -12.117 -3.828 1.00 0.00 C ATOM 1832 OD1 ASP A 115 7.206 -11.918 -4.951 1.00 0.00 O ATOM 1833 OD2 ASP A 115 7.467 -13.123 -3.131 1.00 0.00 O ATOM 0 H ASP A 115 11.135 -11.845 -2.542 1.00 0.00 H new ATOM 0 HA ASP A 115 9.777 -11.319 -5.121 1.00 0.00 H new ATOM 0 HB2 ASP A 115 8.920 -11.323 -2.247 1.00 0.00 H new ATOM 0 HB3 ASP A 115 8.212 -10.106 -3.290 1.00 0.00 H new ATOM 1838 N LYS A 116 11.576 -9.366 -3.319 1.00 0.00 N ATOM 1839 CA LYS A 116 12.189 -8.046 -3.235 1.00 0.00 C ATOM 1840 C LYS A 116 12.403 -7.455 -4.625 1.00 0.00 C ATOM 1841 O LYS A 116 12.287 -6.245 -4.820 1.00 0.00 O ATOM 1842 CB LYS A 116 13.525 -8.128 -2.493 1.00 0.00 C ATOM 1843 CG LYS A 116 13.401 -7.929 -0.992 1.00 0.00 C ATOM 1844 CD LYS A 116 14.581 -8.534 -0.249 1.00 0.00 C ATOM 1845 CE LYS A 116 14.359 -8.519 1.255 1.00 0.00 C ATOM 1846 NZ LYS A 116 15.195 -9.537 1.949 1.00 0.00 N ATOM 0 H LYS A 116 12.020 -10.075 -2.736 1.00 0.00 H new ATOM 0 HA LYS A 116 11.513 -7.394 -2.683 1.00 0.00 H new ATOM 0 HB2 LYS A 116 13.979 -9.100 -2.686 1.00 0.00 H new ATOM 0 HB3 LYS A 116 14.202 -7.375 -2.896 1.00 0.00 H new ATOM 0 HG2 LYS A 116 13.337 -6.864 -0.769 1.00 0.00 H new ATOM 0 HG3 LYS A 116 12.476 -8.384 -0.639 1.00 0.00 H new ATOM 0 HD2 LYS A 116 14.737 -9.559 -0.585 1.00 0.00 H new ATOM 0 HD3 LYS A 116 15.487 -7.979 -0.490 1.00 0.00 H new ATOM 0 HE2 LYS A 116 14.593 -7.529 1.647 1.00 0.00 H new ATOM 0 HE3 LYS A 116 13.307 -8.706 1.469 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 15.015 -9.495 2.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 14.955 -10.484 1.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 16.200 -9.344 1.766 1.00 0.00 H new ATOM 1860 N SER A 117 12.716 -8.316 -5.587 1.00 0.00 N ATOM 1861 CA SER A 117 12.949 -7.879 -6.959 1.00 0.00 C ATOM 1862 C SER A 117 11.804 -6.999 -7.449 1.00 0.00 C ATOM 1863 O SER A 117 12.025 -5.977 -8.100 1.00 0.00 O ATOM 1864 CB SER A 117 13.109 -9.088 -7.882 1.00 0.00 C ATOM 1865 OG SER A 117 13.765 -8.728 -9.085 1.00 0.00 O ATOM 0 H SER A 117 12.814 -9.321 -5.442 1.00 0.00 H new ATOM 0 HA SER A 117 13.868 -7.294 -6.977 1.00 0.00 H new ATOM 0 HB2 SER A 117 13.678 -9.866 -7.372 1.00 0.00 H new ATOM 0 HB3 SER A 117 12.129 -9.508 -8.110 1.00 0.00 H new ATOM 0 HG SER A 117 13.857 -9.519 -9.657 1.00 0.00 H new ATOM 1871 N LYS A 118 10.578 -7.402 -7.133 1.00 0.00 N ATOM 1872 CA LYS A 118 9.396 -6.651 -7.539 1.00 0.00 C ATOM 1873 C LYS A 118 9.324 -5.313 -6.811 1.00 0.00 C ATOM 1874 O LYS A 118 8.649 -4.387 -7.261 1.00 0.00 O ATOM 1875 CB LYS A 118 8.129 -7.464 -7.261 1.00 0.00 C ATOM 1876 CG LYS A 118 7.800 -8.470 -8.350 1.00 0.00 C ATOM 1877 CD LYS A 118 8.434 -9.823 -8.070 1.00 0.00 C ATOM 1878 CE LYS A 118 7.695 -10.943 -8.787 1.00 0.00 C ATOM 1879 NZ LYS A 118 6.573 -11.480 -7.968 1.00 0.00 N ATOM 0 H LYS A 118 10.377 -8.246 -6.596 1.00 0.00 H new ATOM 0 HA LYS A 118 9.469 -6.458 -8.609 1.00 0.00 H new ATOM 0 HB2 LYS A 118 8.246 -7.991 -6.314 1.00 0.00 H new ATOM 0 HB3 LYS A 118 7.288 -6.781 -7.143 1.00 0.00 H new ATOM 0 HG2 LYS A 118 6.719 -8.583 -8.427 1.00 0.00 H new ATOM 0 HG3 LYS A 118 8.151 -8.095 -9.311 1.00 0.00 H new ATOM 0 HD2 LYS A 118 9.476 -9.811 -8.389 1.00 0.00 H new ATOM 0 HD3 LYS A 118 8.431 -10.012 -6.997 1.00 0.00 H new ATOM 0 HE2 LYS A 118 7.307 -10.573 -9.736 1.00 0.00 H new ATOM 0 HE3 LYS A 118 8.392 -11.748 -9.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 118 6.293 -12.413 -8.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 118 6.879 -11.572 -6.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 118 5.763 -10.830 -8.021 1.00 0.00 H new ATOM 1893 N ILE A 119 10.025 -5.219 -5.686 1.00 0.00 N ATOM 1894 CA ILE A 119 10.042 -3.993 -4.898 1.00 0.00 C ATOM 1895 C ILE A 119 11.168 -3.067 -5.346 1.00 0.00 C ATOM 1896 O ILE A 119 11.000 -1.849 -5.401 1.00 0.00 O ATOM 1897 CB ILE A 119 10.205 -4.292 -3.396 1.00 0.00 C ATOM 1898 CG1 ILE A 119 9.202 -5.359 -2.954 1.00 0.00 C ATOM 1899 CG2 ILE A 119 10.027 -3.020 -2.580 1.00 0.00 C ATOM 1900 CD1 ILE A 119 9.433 -5.860 -1.545 1.00 0.00 C ATOM 0 H ILE A 119 10.588 -5.977 -5.300 1.00 0.00 H new ATOM 0 HA ILE A 119 9.083 -3.500 -5.060 1.00 0.00 H new ATOM 0 HB ILE A 119 11.212 -4.673 -3.224 1.00 0.00 H new ATOM 0 HG12 ILE A 119 8.194 -4.950 -3.025 1.00 0.00 H new ATOM 0 HG13 ILE A 119 9.253 -6.202 -3.643 1.00 0.00 H new ATOM 0 HG21 ILE A 119 10.145 -3.248 -1.521 1.00 0.00 H new ATOM 0 HG22 ILE A 119 10.777 -2.288 -2.879 1.00 0.00 H new ATOM 0 HG23 ILE A 119 9.031 -2.612 -2.755 1.00 0.00 H new ATOM 0 HD11 ILE A 119 8.685 -6.614 -1.300 1.00 0.00 H new ATOM 0 HD12 ILE A 119 10.428 -6.299 -1.474 1.00 0.00 H new ATOM 0 HD13 ILE A 119 9.353 -5.028 -0.845 1.00 0.00 H new ATOM 1912 N VAL A 120 12.317 -3.654 -5.667 1.00 0.00 N ATOM 1913 CA VAL A 120 13.471 -2.883 -6.113 1.00 0.00 C ATOM 1914 C VAL A 120 13.281 -2.387 -7.542 1.00 0.00 C ATOM 1915 O VAL A 120 13.821 -1.351 -7.928 1.00 0.00 O ATOM 1916 CB VAL A 120 14.765 -3.714 -6.037 1.00 0.00 C ATOM 1917 CG1 VAL A 120 14.874 -4.411 -4.689 1.00 0.00 C ATOM 1918 CG2 VAL A 120 14.817 -4.723 -7.174 1.00 0.00 C ATOM 0 H VAL A 120 12.473 -4.661 -5.626 1.00 0.00 H new ATOM 0 HA VAL A 120 13.558 -2.028 -5.443 1.00 0.00 H new ATOM 0 HB VAL A 120 15.616 -3.040 -6.140 1.00 0.00 H new ATOM 0 HG11 VAL A 120 15.795 -4.993 -4.654 1.00 0.00 H new ATOM 0 HG12 VAL A 120 14.886 -3.666 -3.894 1.00 0.00 H new ATOM 0 HG13 VAL A 120 14.020 -5.074 -4.552 1.00 0.00 H new ATOM 0 HG21 VAL A 120 15.738 -5.302 -7.105 1.00 0.00 H new ATOM 0 HG22 VAL A 120 13.961 -5.394 -7.104 1.00 0.00 H new ATOM 0 HG23 VAL A 120 14.789 -4.197 -8.128 1.00 0.00 H new ATOM 1928 N ARG A 121 12.509 -3.135 -8.324 1.00 0.00 N ATOM 1929 CA ARG A 121 12.248 -2.773 -9.712 1.00 0.00 C ATOM 1930 C ARG A 121 11.458 -1.470 -9.794 1.00 0.00 C ATOM 1931 O ARG A 121 11.598 -0.706 -10.750 1.00 0.00 O ATOM 1932 CB ARG A 121 11.481 -3.892 -10.418 1.00 0.00 C ATOM 1933 CG ARG A 121 10.005 -3.939 -10.059 1.00 0.00 C ATOM 1934 CD ARG A 121 9.209 -4.738 -11.079 1.00 0.00 C ATOM 1935 NE ARG A 121 7.835 -4.258 -11.199 1.00 0.00 N ATOM 1936 CZ ARG A 121 7.069 -4.479 -12.261 1.00 0.00 C ATOM 1937 NH1 ARG A 121 7.541 -5.169 -13.291 1.00 0.00 N ATOM 1938 NH2 ARG A 121 5.828 -4.009 -12.296 1.00 0.00 N ATOM 0 H ARG A 121 12.053 -3.995 -8.020 1.00 0.00 H new ATOM 0 HA ARG A 121 13.207 -2.629 -10.210 1.00 0.00 H new ATOM 0 HB2 ARG A 121 11.580 -3.765 -11.496 1.00 0.00 H new ATOM 0 HB3 ARG A 121 11.938 -4.849 -10.167 1.00 0.00 H new ATOM 0 HG2 ARG A 121 9.884 -4.384 -9.071 1.00 0.00 H new ATOM 0 HG3 ARG A 121 9.611 -2.924 -10.002 1.00 0.00 H new ATOM 0 HD2 ARG A 121 9.700 -4.677 -12.050 1.00 0.00 H new ATOM 0 HD3 ARG A 121 9.202 -5.789 -10.790 1.00 0.00 H new ATOM 0 HE ARG A 121 7.442 -3.723 -10.424 1.00 0.00 H new ATOM 0 HH11 ARG A 121 8.494 -5.531 -13.268 1.00 0.00 H new ATOM 0 HH12 ARG A 121 6.951 -5.337 -14.106 1.00 0.00 H new ATOM 0 HH21 ARG A 121 5.462 -3.477 -11.506 1.00 0.00 H new ATOM 0 HH22 ARG A 121 5.241 -4.180 -13.112 1.00 0.00 H new ATOM 1952 N VAL A 122 10.628 -1.222 -8.786 1.00 0.00 N ATOM 1953 CA VAL A 122 9.816 -0.012 -8.744 1.00 0.00 C ATOM 1954 C VAL A 122 10.677 1.218 -8.482 1.00 0.00 C ATOM 1955 O VAL A 122 10.519 2.251 -9.136 1.00 0.00 O ATOM 1956 CB VAL A 122 8.728 -0.104 -7.657 1.00 0.00 C ATOM 1957 CG1 VAL A 122 7.735 1.040 -7.797 1.00 0.00 C ATOM 1958 CG2 VAL A 122 8.019 -1.448 -7.726 1.00 0.00 C ATOM 0 H VAL A 122 10.500 -1.843 -7.987 1.00 0.00 H new ATOM 0 HA VAL A 122 9.338 0.083 -9.719 1.00 0.00 H new ATOM 0 HB VAL A 122 9.206 -0.021 -6.681 1.00 0.00 H new ATOM 0 HG11 VAL A 122 6.974 0.958 -7.021 1.00 0.00 H new ATOM 0 HG12 VAL A 122 8.258 1.991 -7.694 1.00 0.00 H new ATOM 0 HG13 VAL A 122 7.260 0.992 -8.777 1.00 0.00 H new ATOM 0 HG21 VAL A 122 7.254 -1.496 -6.951 1.00 0.00 H new ATOM 0 HG22 VAL A 122 7.553 -1.564 -8.704 1.00 0.00 H new ATOM 0 HG23 VAL A 122 8.742 -2.249 -7.572 1.00 0.00 H new ATOM 1968 N LEU A 123 11.589 1.103 -7.524 1.00 0.00 N ATOM 1969 CA LEU A 123 12.478 2.206 -7.176 1.00 0.00 C ATOM 1970 C LEU A 123 13.252 2.688 -8.398 1.00 0.00 C ATOM 1971 O LEU A 123 13.330 3.887 -8.663 1.00 0.00 O ATOM 1972 CB LEU A 123 13.452 1.775 -6.078 1.00 0.00 C ATOM 1973 CG LEU A 123 12.826 1.394 -4.736 1.00 0.00 C ATOM 1974 CD1 LEU A 123 13.896 0.928 -3.761 1.00 0.00 C ATOM 1975 CD2 LEU A 123 12.049 2.568 -4.158 1.00 0.00 C ATOM 0 H LEU A 123 11.733 0.256 -6.974 1.00 0.00 H new ATOM 0 HA LEU A 123 11.867 3.030 -6.808 1.00 0.00 H new ATOM 0 HB2 LEU A 123 14.026 0.923 -6.443 1.00 0.00 H new ATOM 0 HB3 LEU A 123 14.159 2.587 -5.909 1.00 0.00 H new ATOM 0 HG LEU A 123 12.131 0.570 -4.901 1.00 0.00 H new ATOM 0 HD11 LEU A 123 13.432 0.661 -2.812 1.00 0.00 H new ATOM 0 HD12 LEU A 123 14.408 0.058 -4.172 1.00 0.00 H new ATOM 0 HD13 LEU A 123 14.616 1.730 -3.600 1.00 0.00 H new ATOM 0 HD21 LEU A 123 11.610 2.279 -3.203 1.00 0.00 H new ATOM 0 HD22 LEU A 123 12.723 3.411 -4.007 1.00 0.00 H new ATOM 0 HD23 LEU A 123 11.257 2.856 -4.849 1.00 0.00 H new ATOM 1987 N ASN A 124 13.821 1.745 -9.142 1.00 0.00 N ATOM 1988 CA ASN A 124 14.588 2.074 -10.338 1.00 0.00 C ATOM 1989 C ASN A 124 13.749 2.891 -11.315 1.00 0.00 C ATOM 1990 O ASN A 124 14.266 3.756 -12.023 1.00 0.00 O ATOM 1991 CB ASN A 124 15.083 0.796 -11.019 1.00 0.00 C ATOM 1992 CG ASN A 124 16.382 0.289 -10.422 1.00 0.00 C ATOM 1993 OD1 ASN A 124 17.465 0.751 -10.782 1.00 0.00 O ATOM 1994 ND2 ASN A 124 16.279 -0.666 -9.505 1.00 0.00 N ATOM 0 H ASN A 124 13.765 0.747 -8.938 1.00 0.00 H new ATOM 0 HA ASN A 124 15.447 2.673 -10.035 1.00 0.00 H new ATOM 0 HB2 ASN A 124 14.320 0.022 -10.932 1.00 0.00 H new ATOM 0 HB3 ASN A 124 15.225 0.986 -12.083 1.00 0.00 H new ATOM 0 HD21 ASN A 124 17.119 -1.046 -9.068 1.00 0.00 H new ATOM 0 HD22 ASN A 124 15.360 -1.019 -9.237 1.00 0.00 H new ATOM 2001 N LEU A 125 12.450 2.612 -11.348 1.00 0.00 N ATOM 2002 CA LEU A 125 11.537 3.321 -12.238 1.00 0.00 C ATOM 2003 C LEU A 125 11.180 4.692 -11.671 1.00 0.00 C ATOM 2004 O LEU A 125 11.039 5.663 -12.413 1.00 0.00 O ATOM 2005 CB LEU A 125 10.266 2.500 -12.456 1.00 0.00 C ATOM 2006 CG LEU A 125 10.379 1.336 -13.442 1.00 0.00 C ATOM 2007 CD1 LEU A 125 9.268 0.325 -13.205 1.00 0.00 C ATOM 2008 CD2 LEU A 125 10.342 1.846 -14.875 1.00 0.00 C ATOM 0 H LEU A 125 12.006 1.900 -10.769 1.00 0.00 H new ATOM 0 HA LEU A 125 12.038 3.463 -13.195 1.00 0.00 H new ATOM 0 HB2 LEU A 125 9.944 2.104 -11.493 1.00 0.00 H new ATOM 0 HB3 LEU A 125 9.480 3.170 -12.804 1.00 0.00 H new ATOM 0 HG LEU A 125 11.335 0.838 -13.279 1.00 0.00 H new ATOM 0 HD11 LEU A 125 9.365 -0.496 -13.916 1.00 0.00 H new ATOM 0 HD12 LEU A 125 9.341 -0.064 -12.189 1.00 0.00 H new ATOM 0 HD13 LEU A 125 8.301 0.809 -13.340 1.00 0.00 H new ATOM 0 HD21 LEU A 125 10.424 1.004 -15.563 1.00 0.00 H new ATOM 0 HD22 LEU A 125 9.402 2.369 -15.051 1.00 0.00 H new ATOM 0 HD23 LEU A 125 11.174 2.531 -15.039 1.00 0.00 H new ATOM 2020 N TRP A 126 11.038 4.762 -10.353 1.00 0.00 N ATOM 2021 CA TRP A 126 10.700 6.014 -9.686 1.00 0.00 C ATOM 2022 C TRP A 126 11.786 7.061 -9.910 1.00 0.00 C ATOM 2023 O TRP A 126 11.505 8.172 -10.359 1.00 0.00 O ATOM 2024 CB TRP A 126 10.501 5.781 -8.188 1.00 0.00 C ATOM 2025 CG TRP A 126 9.140 5.257 -7.843 1.00 0.00 C ATOM 2026 CD1 TRP A 126 8.087 5.088 -8.697 1.00 0.00 C ATOM 2027 CD2 TRP A 126 8.685 4.836 -6.553 1.00 0.00 C ATOM 2028 NE1 TRP A 126 7.005 4.587 -8.014 1.00 0.00 N ATOM 2029 CE2 TRP A 126 7.346 4.423 -6.698 1.00 0.00 C ATOM 2030 CE3 TRP A 126 9.278 4.766 -5.290 1.00 0.00 C ATOM 2031 CZ2 TRP A 126 6.593 3.949 -5.626 1.00 0.00 C ATOM 2032 CZ3 TRP A 126 8.530 4.296 -4.227 1.00 0.00 C ATOM 2033 CH2 TRP A 126 7.199 3.891 -4.401 1.00 0.00 C ATOM 0 H TRP A 126 11.152 3.967 -9.725 1.00 0.00 H new ATOM 0 HA TRP A 126 9.769 6.385 -10.115 1.00 0.00 H new ATOM 0 HB2 TRP A 126 11.254 5.077 -7.834 1.00 0.00 H new ATOM 0 HB3 TRP A 126 10.667 6.718 -7.657 1.00 0.00 H new ATOM 0 HD1 TRP A 126 8.103 5.315 -9.753 1.00 0.00 H new ATOM 0 HE1 TRP A 126 6.095 4.372 -8.421 1.00 0.00 H new ATOM 0 HE3 TRP A 126 10.303 5.074 -5.147 1.00 0.00 H new ATOM 0 HZ2 TRP A 126 5.567 3.638 -5.757 1.00 0.00 H new ATOM 0 HZ3 TRP A 126 8.978 4.240 -3.246 1.00 0.00 H new ATOM 0 HH2 TRP A 126 6.641 3.526 -3.551 1.00 0.00 H new ATOM 2044 N GLN A 127 13.025 6.699 -9.596 1.00 0.00 N ATOM 2045 CA GLN A 127 14.152 7.608 -9.764 1.00 0.00 C ATOM 2046 C GLN A 127 14.275 8.061 -11.215 1.00 0.00 C ATOM 2047 O GLN A 127 14.804 9.136 -11.499 1.00 0.00 O ATOM 2048 CB GLN A 127 15.450 6.934 -9.316 1.00 0.00 C ATOM 2049 CG GLN A 127 16.484 7.906 -8.770 1.00 0.00 C ATOM 2050 CD GLN A 127 17.855 7.277 -8.622 1.00 0.00 C ATOM 2051 OE1 GLN A 127 18.448 6.815 -9.598 1.00 0.00 O ATOM 2052 NE2 GLN A 127 18.368 7.255 -7.397 1.00 0.00 N ATOM 0 H GLN A 127 13.274 5.783 -9.224 1.00 0.00 H new ATOM 0 HA GLN A 127 13.974 8.486 -9.143 1.00 0.00 H new ATOM 0 HB2 GLN A 127 15.219 6.194 -8.550 1.00 0.00 H new ATOM 0 HB3 GLN A 127 15.880 6.396 -10.160 1.00 0.00 H new ATOM 0 HG2 GLN A 127 16.553 8.768 -9.434 1.00 0.00 H new ATOM 0 HG3 GLN A 127 16.152 8.277 -7.800 1.00 0.00 H new ATOM 0 HE21 GLN A 127 17.842 7.649 -6.617 1.00 0.00 H new ATOM 0 HE22 GLN A 127 19.288 6.844 -7.237 1.00 0.00 H new ATOM 2061 N LYS A 128 13.784 7.234 -12.131 1.00 0.00 N ATOM 2062 CA LYS A 128 13.837 7.549 -13.554 1.00 0.00 C ATOM 2063 C LYS A 128 12.736 8.533 -13.935 1.00 0.00 C ATOM 2064 O LYS A 128 13.003 9.582 -14.520 1.00 0.00 O ATOM 2065 CB LYS A 128 13.703 6.271 -14.385 1.00 0.00 C ATOM 2066 CG LYS A 128 13.110 6.502 -15.765 1.00 0.00 C ATOM 2067 CD LYS A 128 13.080 5.220 -16.580 1.00 0.00 C ATOM 2068 CE LYS A 128 12.105 5.322 -17.743 1.00 0.00 C ATOM 2069 NZ LYS A 128 11.571 3.989 -18.138 1.00 0.00 N ATOM 0 H LYS A 128 13.344 6.340 -11.914 1.00 0.00 H new ATOM 0 HA LYS A 128 14.802 8.012 -13.763 1.00 0.00 H new ATOM 0 HB2 LYS A 128 14.686 5.813 -14.493 1.00 0.00 H new ATOM 0 HB3 LYS A 128 13.078 5.560 -13.845 1.00 0.00 H new ATOM 0 HG2 LYS A 128 12.098 6.895 -15.666 1.00 0.00 H new ATOM 0 HG3 LYS A 128 13.695 7.256 -16.292 1.00 0.00 H new ATOM 0 HD2 LYS A 128 14.079 5.005 -16.959 1.00 0.00 H new ATOM 0 HD3 LYS A 128 12.796 4.386 -15.938 1.00 0.00 H new ATOM 0 HE2 LYS A 128 11.279 5.977 -17.468 1.00 0.00 H new ATOM 0 HE3 LYS A 128 12.604 5.781 -18.596 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 10.910 4.101 -18.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 12.357 3.371 -18.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 11.072 3.562 -17.332 1.00 0.00 H new ATOM 2083 N ASN A 129 11.497 8.189 -13.598 1.00 0.00 N ATOM 2084 CA ASN A 129 10.356 9.043 -13.904 1.00 0.00 C ATOM 2085 C ASN A 129 10.373 10.303 -13.043 1.00 0.00 C ATOM 2086 O ASN A 129 9.567 11.211 -13.239 1.00 0.00 O ATOM 2087 CB ASN A 129 9.048 8.280 -13.686 1.00 0.00 C ATOM 2088 CG ASN A 129 8.705 7.375 -14.853 1.00 0.00 C ATOM 2089 OD1 ASN A 129 8.582 6.081 -14.582 1.00 0.00 O flip ATOM 2090 ND2 ASN A 129 8.554 7.833 -15.986 1.00 0.00 N flip ATOM 0 H ASN A 129 11.258 7.324 -13.113 1.00 0.00 H new ATOM 0 HA ASN A 129 10.426 9.339 -14.951 1.00 0.00 H new ATOM 0 HB2 ASN A 129 9.126 7.683 -12.777 1.00 0.00 H new ATOM 0 HB3 ASN A 129 8.237 8.992 -13.531 1.00 0.00 H new ATOM 0 HD21 ASN A 129 8.658 8.834 -16.149 1.00 0.00 H new ATOM 0 HD22 ASN A 129 8.325 7.211 -16.761 1.00 0.00 H new ATOM 2097 N ASN A 130 11.297 10.348 -12.089 1.00 0.00 N ATOM 2098 CA ASN A 130 11.419 11.496 -11.197 1.00 0.00 C ATOM 2099 C ASN A 130 10.288 11.513 -10.174 1.00 0.00 C ATOM 2100 O ASN A 130 9.889 12.573 -9.691 1.00 0.00 O ATOM 2101 CB ASN A 130 11.413 12.797 -12.003 1.00 0.00 C ATOM 2102 CG ASN A 130 11.981 13.965 -11.219 1.00 0.00 C ATOM 2103 OD1 ASN A 130 12.269 13.846 -10.028 1.00 0.00 O ATOM 2104 ND2 ASN A 130 12.143 15.101 -11.886 1.00 0.00 N ATOM 0 H ASN A 130 11.972 9.604 -11.914 1.00 0.00 H new ATOM 0 HA ASN A 130 12.366 11.411 -10.663 1.00 0.00 H new ATOM 0 HB2 ASN A 130 11.993 12.659 -12.915 1.00 0.00 H new ATOM 0 HB3 ASN A 130 10.392 13.029 -12.306 1.00 0.00 H new ATOM 0 HD21 ASN A 130 12.520 15.922 -11.412 1.00 0.00 H new ATOM 0 HD22 ASN A 130 11.890 15.153 -12.873 1.00 0.00 H new ATOM 2111 N VAL A 131 9.774 10.331 -9.849 1.00 0.00 N ATOM 2112 CA VAL A 131 8.689 10.209 -8.882 1.00 0.00 C ATOM 2113 C VAL A 131 9.158 10.586 -7.481 1.00 0.00 C ATOM 2114 O VAL A 131 8.389 11.120 -6.681 1.00 0.00 O ATOM 2115 CB VAL A 131 8.121 8.778 -8.854 1.00 0.00 C ATOM 2116 CG1 VAL A 131 6.813 8.738 -8.078 1.00 0.00 C ATOM 2117 CG2 VAL A 131 7.927 8.254 -10.269 1.00 0.00 C ATOM 0 H VAL A 131 10.091 9.444 -10.241 1.00 0.00 H new ATOM 0 HA VAL A 131 7.904 10.897 -9.197 1.00 0.00 H new ATOM 0 HB VAL A 131 8.837 8.131 -8.347 1.00 0.00 H new ATOM 0 HG11 VAL A 131 6.426 7.719 -8.069 1.00 0.00 H new ATOM 0 HG12 VAL A 131 6.987 9.069 -7.054 1.00 0.00 H new ATOM 0 HG13 VAL A 131 6.087 9.397 -8.554 1.00 0.00 H new ATOM 0 HG21 VAL A 131 7.525 7.242 -10.230 1.00 0.00 H new ATOM 0 HG22 VAL A 131 7.231 8.900 -10.804 1.00 0.00 H new ATOM 0 HG23 VAL A 131 8.885 8.244 -10.788 1.00 0.00 H new ATOM 2127 N PHE A 132 10.423 10.303 -7.190 1.00 0.00 N ATOM 2128 CA PHE A 132 10.995 10.612 -5.884 1.00 0.00 C ATOM 2129 C PHE A 132 12.452 11.045 -6.017 1.00 0.00 C ATOM 2130 O PHE A 132 13.140 10.668 -6.966 1.00 0.00 O ATOM 2131 CB PHE A 132 10.894 9.397 -4.959 1.00 0.00 C ATOM 2132 CG PHE A 132 9.482 9.040 -4.590 1.00 0.00 C ATOM 2133 CD1 PHE A 132 8.824 9.721 -3.578 1.00 0.00 C ATOM 2134 CD2 PHE A 132 8.814 8.024 -5.254 1.00 0.00 C ATOM 2135 CE1 PHE A 132 7.525 9.395 -3.236 1.00 0.00 C ATOM 2136 CE2 PHE A 132 7.515 7.695 -4.917 1.00 0.00 C ATOM 2137 CZ PHE A 132 6.870 8.380 -3.906 1.00 0.00 C ATOM 0 H PHE A 132 11.072 9.860 -7.841 1.00 0.00 H new ATOM 0 HA PHE A 132 10.428 11.437 -5.452 1.00 0.00 H new ATOM 0 HB2 PHE A 132 11.362 8.541 -5.445 1.00 0.00 H new ATOM 0 HB3 PHE A 132 11.460 9.595 -4.049 1.00 0.00 H new ATOM 0 HD1 PHE A 132 9.332 10.515 -3.051 1.00 0.00 H new ATOM 0 HD2 PHE A 132 9.314 7.483 -6.044 1.00 0.00 H new ATOM 0 HE1 PHE A 132 7.023 9.933 -2.446 1.00 0.00 H new ATOM 0 HE2 PHE A 132 7.004 6.903 -5.444 1.00 0.00 H new ATOM 0 HZ PHE A 132 5.855 8.123 -3.640 1.00 0.00 H new ATOM 2147 N LYS A 133 12.916 11.839 -5.058 1.00 0.00 N ATOM 2148 CA LYS A 133 14.291 12.324 -5.065 1.00 0.00 C ATOM 2149 C LYS A 133 15.266 11.200 -4.733 1.00 0.00 C ATOM 2150 O LYS A 133 14.943 10.291 -3.968 1.00 0.00 O ATOM 2151 CB LYS A 133 14.455 13.469 -4.063 1.00 0.00 C ATOM 2152 CG LYS A 133 14.615 13.001 -2.627 1.00 0.00 C ATOM 2153 CD LYS A 133 14.720 14.175 -1.667 1.00 0.00 C ATOM 2154 CE LYS A 133 13.679 15.241 -1.974 1.00 0.00 C ATOM 2155 NZ LYS A 133 13.424 16.121 -0.800 1.00 0.00 N ATOM 0 H LYS A 133 12.360 12.160 -4.266 1.00 0.00 H new ATOM 0 HA LYS A 133 14.515 12.691 -6.067 1.00 0.00 H new ATOM 0 HB2 LYS A 133 15.325 14.063 -4.342 1.00 0.00 H new ATOM 0 HB3 LYS A 133 13.587 14.125 -4.128 1.00 0.00 H new ATOM 0 HG2 LYS A 133 13.765 12.378 -2.350 1.00 0.00 H new ATOM 0 HG3 LYS A 133 15.507 12.380 -2.543 1.00 0.00 H new ATOM 0 HD2 LYS A 133 14.590 13.822 -0.644 1.00 0.00 H new ATOM 0 HD3 LYS A 133 15.717 14.610 -1.730 1.00 0.00 H new ATOM 0 HE2 LYS A 133 14.016 15.846 -2.815 1.00 0.00 H new ATOM 0 HE3 LYS A 133 12.748 14.763 -2.278 1.00 0.00 H new ATOM 0 HZ1 LYS A 133 12.709 16.834 -1.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 133 13.078 15.547 -0.005 1.00 0.00 H new ATOM 0 HZ3 LYS A 133 14.307 16.597 -0.525 1.00 0.00 H new ATOM 2169 N SER A 134 16.461 11.268 -5.312 1.00 0.00 N ATOM 2170 CA SER A 134 17.483 10.254 -5.078 1.00 0.00 C ATOM 2171 C SER A 134 17.800 10.135 -3.591 1.00 0.00 C ATOM 2172 O SER A 134 18.214 9.078 -3.117 1.00 0.00 O ATOM 2173 CB SER A 134 18.755 10.593 -5.857 1.00 0.00 C ATOM 2174 OG SER A 134 19.355 11.778 -5.363 1.00 0.00 O ATOM 0 H SER A 134 16.745 12.015 -5.946 1.00 0.00 H new ATOM 0 HA SER A 134 17.096 9.296 -5.427 1.00 0.00 H new ATOM 0 HB2 SER A 134 19.461 9.766 -5.784 1.00 0.00 H new ATOM 0 HB3 SER A 134 18.516 10.716 -6.913 1.00 0.00 H new ATOM 0 HG SER A 134 20.167 11.972 -5.876 1.00 0.00 H new ATOM 2180 N GLU A 135 17.603 11.228 -2.860 1.00 0.00 N ATOM 2181 CA GLU A 135 17.868 11.247 -1.427 1.00 0.00 C ATOM 2182 C GLU A 135 16.827 10.428 -0.670 1.00 0.00 C ATOM 2183 O GLU A 135 17.027 10.071 0.492 1.00 0.00 O ATOM 2184 CB GLU A 135 17.879 12.686 -0.906 1.00 0.00 C ATOM 2185 CG GLU A 135 17.434 12.813 0.541 1.00 0.00 C ATOM 2186 CD GLU A 135 17.774 14.164 1.140 1.00 0.00 C ATOM 2187 OE1 GLU A 135 18.955 14.564 1.070 1.00 0.00 O ATOM 2188 OE2 GLU A 135 16.859 14.821 1.678 1.00 0.00 O ATOM 0 H GLU A 135 17.261 12.112 -3.237 1.00 0.00 H new ATOM 0 HA GLU A 135 18.848 10.801 -1.259 1.00 0.00 H new ATOM 0 HB2 GLU A 135 18.886 13.091 -1.004 1.00 0.00 H new ATOM 0 HB3 GLU A 135 17.227 13.295 -1.532 1.00 0.00 H new ATOM 0 HG2 GLU A 135 16.357 12.654 0.601 1.00 0.00 H new ATOM 0 HG3 GLU A 135 17.906 12.028 1.132 1.00 0.00 H new ATOM 2195 N ILE A 136 15.715 10.135 -1.336 1.00 0.00 N ATOM 2196 CA ILE A 136 14.642 9.359 -0.726 1.00 0.00 C ATOM 2197 C ILE A 136 14.683 7.907 -1.190 1.00 0.00 C ATOM 2198 O ILE A 136 14.435 6.988 -0.409 1.00 0.00 O ATOM 2199 CB ILE A 136 13.260 9.953 -1.056 1.00 0.00 C ATOM 2200 CG1 ILE A 136 13.028 11.236 -0.255 1.00 0.00 C ATOM 2201 CG2 ILE A 136 12.165 8.937 -0.768 1.00 0.00 C ATOM 2202 CD1 ILE A 136 11.935 12.113 -0.823 1.00 0.00 C ATOM 0 H ILE A 136 15.534 10.423 -2.298 1.00 0.00 H new ATOM 0 HA ILE A 136 14.797 9.398 0.352 1.00 0.00 H new ATOM 0 HB ILE A 136 13.230 10.199 -2.117 1.00 0.00 H new ATOM 0 HG12 ILE A 136 12.775 10.973 0.772 1.00 0.00 H new ATOM 0 HG13 ILE A 136 13.957 11.805 -0.218 1.00 0.00 H new ATOM 0 HG21 ILE A 136 11.194 9.371 -1.006 1.00 0.00 H new ATOM 0 HG22 ILE A 136 12.324 8.048 -1.378 1.00 0.00 H new ATOM 0 HG23 ILE A 136 12.191 8.663 0.287 1.00 0.00 H new ATOM 0 HD11 ILE A 136 11.825 13.004 -0.205 1.00 0.00 H new ATOM 0 HD12 ILE A 136 12.196 12.406 -1.840 1.00 0.00 H new ATOM 0 HD13 ILE A 136 10.995 11.561 -0.834 1.00 0.00 H new ATOM 2214 N ILE A 137 14.998 7.708 -2.466 1.00 0.00 N ATOM 2215 CA ILE A 137 15.074 6.367 -3.033 1.00 0.00 C ATOM 2216 C ILE A 137 16.413 5.710 -2.713 1.00 0.00 C ATOM 2217 O ILE A 137 16.481 4.506 -2.469 1.00 0.00 O ATOM 2218 CB ILE A 137 14.878 6.390 -4.560 1.00 0.00 C ATOM 2219 CG1 ILE A 137 13.546 7.055 -4.915 1.00 0.00 C ATOM 2220 CG2 ILE A 137 14.938 4.978 -5.123 1.00 0.00 C ATOM 2221 CD1 ILE A 137 13.061 6.729 -6.311 1.00 0.00 C ATOM 0 H ILE A 137 15.204 8.458 -3.126 1.00 0.00 H new ATOM 0 HA ILE A 137 14.270 5.787 -2.580 1.00 0.00 H new ATOM 0 HB ILE A 137 15.684 6.973 -5.006 1.00 0.00 H new ATOM 0 HG12 ILE A 137 12.790 6.743 -4.194 1.00 0.00 H new ATOM 0 HG13 ILE A 137 13.652 8.136 -4.819 1.00 0.00 H new ATOM 0 HG21 ILE A 137 14.798 5.011 -6.203 1.00 0.00 H new ATOM 0 HG22 ILE A 137 15.909 4.537 -4.896 1.00 0.00 H new ATOM 0 HG23 ILE A 137 14.151 4.373 -4.673 1.00 0.00 H new ATOM 0 HD11 ILE A 137 12.112 7.234 -6.494 1.00 0.00 H new ATOM 0 HD12 ILE A 137 13.798 7.066 -7.040 1.00 0.00 H new ATOM 0 HD13 ILE A 137 12.923 5.652 -6.406 1.00 0.00 H new ATOM 2233 N GLN A 138 17.474 6.510 -2.716 1.00 0.00 N ATOM 2234 CA GLN A 138 18.811 6.006 -2.425 1.00 0.00 C ATOM 2235 C GLN A 138 18.766 4.941 -1.335 1.00 0.00 C ATOM 2236 O GLN A 138 19.265 3.827 -1.500 1.00 0.00 O ATOM 2237 CB GLN A 138 19.729 7.152 -1.998 1.00 0.00 C ATOM 2238 CG GLN A 138 20.880 6.710 -1.108 1.00 0.00 C ATOM 2239 CD GLN A 138 21.906 5.877 -1.852 1.00 0.00 C ATOM 2240 OE1 GLN A 138 22.828 6.412 -2.468 1.00 0.00 O ATOM 2241 NE2 GLN A 138 21.751 4.560 -1.798 1.00 0.00 N ATOM 0 H GLN A 138 17.434 7.509 -2.917 1.00 0.00 H new ATOM 0 HA GLN A 138 19.207 5.553 -3.334 1.00 0.00 H new ATOM 0 HB2 GLN A 138 20.133 7.634 -2.888 1.00 0.00 H new ATOM 0 HB3 GLN A 138 19.139 7.901 -1.470 1.00 0.00 H new ATOM 0 HG2 GLN A 138 21.368 7.589 -0.687 1.00 0.00 H new ATOM 0 HG3 GLN A 138 20.486 6.133 -0.271 1.00 0.00 H new ATOM 0 HE21 GLN A 138 20.972 4.159 -1.275 1.00 0.00 H new ATOM 0 HE22 GLN A 138 22.411 3.949 -2.279 1.00 0.00 H new ATOM 2250 N PRO A 139 18.154 5.288 -0.193 1.00 0.00 N ATOM 2251 CA PRO A 139 18.029 4.375 0.947 1.00 0.00 C ATOM 2252 C PRO A 139 17.067 3.225 0.667 1.00 0.00 C ATOM 2253 O PRO A 139 17.331 2.078 1.030 1.00 0.00 O ATOM 2254 CB PRO A 139 17.481 5.271 2.061 1.00 0.00 C ATOM 2255 CG PRO A 139 16.772 6.370 1.348 1.00 0.00 C ATOM 2256 CD PRO A 139 17.536 6.598 0.073 1.00 0.00 C ATOM 0 HA PRO A 139 18.978 3.898 1.192 1.00 0.00 H new ATOM 0 HB2 PRO A 139 16.804 4.721 2.714 1.00 0.00 H new ATOM 0 HB3 PRO A 139 18.284 5.659 2.688 1.00 0.00 H new ATOM 0 HG2 PRO A 139 15.738 6.096 1.139 1.00 0.00 H new ATOM 0 HG3 PRO A 139 16.746 7.275 1.954 1.00 0.00 H new ATOM 0 HD2 PRO A 139 16.878 6.905 -0.740 1.00 0.00 H new ATOM 0 HD3 PRO A 139 18.286 7.380 0.188 1.00 0.00 H new ATOM 2264 N LEU A 140 15.951 3.539 0.018 1.00 0.00 N ATOM 2265 CA LEU A 140 14.949 2.531 -0.312 1.00 0.00 C ATOM 2266 C LEU A 140 15.556 1.417 -1.160 1.00 0.00 C ATOM 2267 O LEU A 140 15.096 0.275 -1.124 1.00 0.00 O ATOM 2268 CB LEU A 140 13.778 3.173 -1.057 1.00 0.00 C ATOM 2269 CG LEU A 140 12.976 4.215 -0.277 1.00 0.00 C ATOM 2270 CD1 LEU A 140 11.919 4.852 -1.166 1.00 0.00 C ATOM 2271 CD2 LEU A 140 12.334 3.585 0.951 1.00 0.00 C ATOM 0 H LEU A 140 15.717 4.483 -0.290 1.00 0.00 H new ATOM 0 HA LEU A 140 14.585 2.097 0.619 1.00 0.00 H new ATOM 0 HB2 LEU A 140 14.163 3.643 -1.962 1.00 0.00 H new ATOM 0 HB3 LEU A 140 13.098 2.382 -1.373 1.00 0.00 H new ATOM 0 HG LEU A 140 13.660 4.996 0.055 1.00 0.00 H new ATOM 0 HD11 LEU A 140 11.359 5.591 -0.593 1.00 0.00 H new ATOM 0 HD12 LEU A 140 12.402 5.340 -2.013 1.00 0.00 H new ATOM 0 HD13 LEU A 140 11.238 4.083 -1.530 1.00 0.00 H new ATOM 0 HD21 LEU A 140 11.767 4.341 1.494 1.00 0.00 H new ATOM 0 HD22 LEU A 140 11.664 2.783 0.640 1.00 0.00 H new ATOM 0 HD23 LEU A 140 13.110 3.179 1.599 1.00 0.00 H new ATOM 2283 N LEU A 141 16.592 1.756 -1.919 1.00 0.00 N ATOM 2284 CA LEU A 141 17.265 0.784 -2.774 1.00 0.00 C ATOM 2285 C LEU A 141 18.098 -0.187 -1.944 1.00 0.00 C ATOM 2286 O LEU A 141 18.282 -1.344 -2.322 1.00 0.00 O ATOM 2287 CB LEU A 141 18.156 1.500 -3.790 1.00 0.00 C ATOM 2288 CG LEU A 141 17.454 2.040 -5.036 1.00 0.00 C ATOM 2289 CD1 LEU A 141 18.335 3.055 -5.747 1.00 0.00 C ATOM 2290 CD2 LEU A 141 17.083 0.901 -5.975 1.00 0.00 C ATOM 0 H LEU A 141 16.984 2.697 -1.960 1.00 0.00 H new ATOM 0 HA LEU A 141 16.502 0.215 -3.306 1.00 0.00 H new ATOM 0 HB2 LEU A 141 18.651 2.331 -3.287 1.00 0.00 H new ATOM 0 HB3 LEU A 141 18.937 0.810 -4.108 1.00 0.00 H new ATOM 0 HG LEU A 141 16.537 2.541 -4.725 1.00 0.00 H new ATOM 0 HD11 LEU A 141 17.819 3.428 -6.631 1.00 0.00 H new ATOM 0 HD12 LEU A 141 18.549 3.885 -5.074 1.00 0.00 H new ATOM 0 HD13 LEU A 141 19.269 2.580 -6.046 1.00 0.00 H new ATOM 0 HD21 LEU A 141 16.584 1.304 -6.856 1.00 0.00 H new ATOM 0 HD22 LEU A 141 17.986 0.371 -6.279 1.00 0.00 H new ATOM 0 HD23 LEU A 141 16.413 0.211 -5.463 1.00 0.00 H new ATOM 2302 N ASP A 142 18.599 0.291 -0.810 1.00 0.00 N ATOM 2303 CA ASP A 142 19.410 -0.535 0.076 1.00 0.00 C ATOM 2304 C ASP A 142 18.528 -1.386 0.985 1.00 0.00 C ATOM 2305 O ASP A 142 18.705 -2.600 1.079 1.00 0.00 O ATOM 2306 CB ASP A 142 20.337 0.342 0.920 1.00 0.00 C ATOM 2307 CG ASP A 142 20.599 -0.246 2.293 1.00 0.00 C ATOM 2308 OD1 ASP A 142 19.752 -0.058 3.190 1.00 0.00 O ATOM 2309 OD2 ASP A 142 21.652 -0.894 2.469 1.00 0.00 O ATOM 0 H ASP A 142 18.457 1.247 -0.483 1.00 0.00 H new ATOM 0 HA ASP A 142 20.014 -1.200 -0.541 1.00 0.00 H new ATOM 0 HB2 ASP A 142 21.284 0.473 0.397 1.00 0.00 H new ATOM 0 HB3 ASP A 142 19.895 1.332 1.030 1.00 0.00 H new ATOM 2314 N MET A 143 17.579 -0.739 1.654 1.00 0.00 N ATOM 2315 CA MET A 143 16.670 -1.436 2.556 1.00 0.00 C ATOM 2316 C MET A 143 16.339 -2.828 2.026 1.00 0.00 C ATOM 2317 O MET A 143 16.173 -3.773 2.796 1.00 0.00 O ATOM 2318 CB MET A 143 15.383 -0.630 2.741 1.00 0.00 C ATOM 2319 CG MET A 143 15.620 0.788 3.234 1.00 0.00 C ATOM 2320 SD MET A 143 14.273 1.400 4.265 1.00 0.00 S ATOM 2321 CE MET A 143 12.851 0.889 3.303 1.00 0.00 C ATOM 0 H MET A 143 17.420 0.266 1.588 1.00 0.00 H new ATOM 0 HA MET A 143 17.166 -1.542 3.521 1.00 0.00 H new ATOM 0 HB2 MET A 143 14.849 -0.591 1.792 1.00 0.00 H new ATOM 0 HB3 MET A 143 14.737 -1.149 3.449 1.00 0.00 H new ATOM 0 HG2 MET A 143 16.550 0.820 3.801 1.00 0.00 H new ATOM 0 HG3 MET A 143 15.746 1.450 2.377 1.00 0.00 H new ATOM 0 HE1 MET A 143 11.971 1.440 3.634 1.00 0.00 H new ATOM 0 HE2 MET A 143 13.033 1.094 2.248 1.00 0.00 H new ATOM 0 HE3 MET A 143 12.683 -0.179 3.441 1.00 0.00 H new ATOM 2331 N ALA A 144 16.246 -2.946 0.705 1.00 0.00 N ATOM 2332 CA ALA A 144 15.937 -4.223 0.073 1.00 0.00 C ATOM 2333 C ALA A 144 17.053 -5.235 0.306 1.00 0.00 C ATOM 2334 O ALA A 144 16.798 -6.380 0.680 1.00 0.00 O ATOM 2335 CB ALA A 144 15.701 -4.030 -1.418 1.00 0.00 C ATOM 0 H ALA A 144 16.380 -2.173 0.053 1.00 0.00 H new ATOM 0 HA ALA A 144 15.026 -4.614 0.527 1.00 0.00 H new ATOM 0 HB1 ALA A 144 15.471 -4.991 -1.877 1.00 0.00 H new ATOM 0 HB2 ALA A 144 14.865 -3.347 -1.569 1.00 0.00 H new ATOM 0 HB3 ALA A 144 16.597 -3.613 -1.877 1.00 0.00 H new ATOM 2341 N ALA A 145 18.291 -4.806 0.083 1.00 0.00 N ATOM 2342 CA ALA A 145 19.446 -5.676 0.271 1.00 0.00 C ATOM 2343 C ALA A 145 19.569 -6.119 1.725 1.00 0.00 C ATOM 2344 O ALA A 145 19.905 -7.268 2.007 1.00 0.00 O ATOM 2345 CB ALA A 145 20.717 -4.968 -0.176 1.00 0.00 C ATOM 0 H ALA A 145 18.520 -3.862 -0.228 1.00 0.00 H new ATOM 0 HA ALA A 145 19.303 -6.566 -0.342 1.00 0.00 H new ATOM 0 HB1 ALA A 145 21.572 -5.628 -0.030 1.00 0.00 H new ATOM 0 HB2 ALA A 145 20.636 -4.707 -1.231 1.00 0.00 H new ATOM 0 HB3 ALA A 145 20.855 -4.061 0.413 1.00 0.00 H new ATOM 2351 N GLY A 146 19.295 -5.199 2.645 1.00 0.00 N ATOM 2352 CA GLY A 146 19.382 -5.514 4.059 1.00 0.00 C ATOM 2353 C GLY A 146 18.290 -6.465 4.509 1.00 0.00 C ATOM 2354 O GLY A 146 17.914 -7.380 3.777 1.00 0.00 O ATOM 0 H GLY A 146 19.014 -4.241 2.436 1.00 0.00 H new ATOM 0 HA2 GLY A 146 20.355 -5.957 4.270 1.00 0.00 H new ATOM 0 HA3 GLY A 146 19.319 -4.593 4.638 1.00 0.00 H new ATOM 2358 N SER A 147 17.780 -6.249 5.717 1.00 0.00 N ATOM 2359 CA SER A 147 16.729 -7.097 6.266 1.00 0.00 C ATOM 2360 C SER A 147 17.082 -8.572 6.105 1.00 0.00 C ATOM 2361 O SER A 147 16.217 -9.403 5.832 1.00 0.00 O ATOM 2362 CB SER A 147 15.395 -6.802 5.578 1.00 0.00 C ATOM 2363 OG SER A 147 14.303 -7.163 6.406 1.00 0.00 O ATOM 0 H SER A 147 18.078 -5.494 6.334 1.00 0.00 H new ATOM 0 HA SER A 147 16.637 -6.877 7.330 1.00 0.00 H new ATOM 0 HB2 SER A 147 15.335 -5.741 5.334 1.00 0.00 H new ATOM 0 HB3 SER A 147 15.339 -7.350 4.637 1.00 0.00 H new ATOM 0 HG SER A 147 13.462 -6.963 5.944 1.00 0.00 H new ATOM 2369 N GLY A 148 18.361 -8.891 6.277 1.00 0.00 N ATOM 2370 CA GLY A 148 18.808 -10.265 6.147 1.00 0.00 C ATOM 2371 C GLY A 148 19.506 -10.526 4.827 1.00 0.00 C ATOM 2372 O GLY A 148 18.883 -10.904 3.835 1.00 0.00 O ATOM 0 H GLY A 148 19.096 -8.221 6.504 1.00 0.00 H new ATOM 0 HA2 GLY A 148 19.487 -10.502 6.966 1.00 0.00 H new ATOM 0 HA3 GLY A 148 17.951 -10.933 6.240 1.00 0.00 H new ATOM 2376 N PRO A 149 20.831 -10.320 4.803 1.00 0.00 N ATOM 2377 CA PRO A 149 21.643 -10.528 3.600 1.00 0.00 C ATOM 2378 C PRO A 149 21.767 -12.002 3.232 1.00 0.00 C ATOM 2379 O PRO A 149 22.328 -12.347 2.193 1.00 0.00 O ATOM 2380 CB PRO A 149 23.009 -9.958 3.992 1.00 0.00 C ATOM 2381 CG PRO A 149 23.053 -10.066 5.477 1.00 0.00 C ATOM 2382 CD PRO A 149 21.639 -9.869 5.949 1.00 0.00 C ATOM 0 HA PRO A 149 21.203 -10.053 2.724 1.00 0.00 H new ATOM 0 HB2 PRO A 149 23.820 -10.521 3.530 1.00 0.00 H new ATOM 0 HB3 PRO A 149 23.114 -8.923 3.667 1.00 0.00 H new ATOM 0 HG2 PRO A 149 23.436 -11.039 5.786 1.00 0.00 H new ATOM 0 HG3 PRO A 149 23.715 -9.313 5.904 1.00 0.00 H new ATOM 0 HD2 PRO A 149 21.429 -10.454 6.844 1.00 0.00 H new ATOM 0 HD3 PRO A 149 21.439 -8.826 6.196 1.00 0.00 H new ATOM 2390 N SER A 150 21.239 -12.868 4.091 1.00 0.00 N ATOM 2391 CA SER A 150 21.294 -14.307 3.857 1.00 0.00 C ATOM 2392 C SER A 150 22.739 -14.793 3.799 1.00 0.00 C ATOM 2393 O SER A 150 23.127 -15.511 2.877 1.00 0.00 O ATOM 2394 CB SER A 150 20.571 -14.661 2.556 1.00 0.00 C ATOM 2395 OG SER A 150 19.205 -14.289 2.614 1.00 0.00 O ATOM 0 H SER A 150 20.768 -12.599 4.955 1.00 0.00 H new ATOM 0 HA SER A 150 20.795 -14.805 4.688 1.00 0.00 H new ATOM 0 HB2 SER A 150 21.053 -14.156 1.719 1.00 0.00 H new ATOM 0 HB3 SER A 150 20.652 -15.732 2.371 1.00 0.00 H new ATOM 0 HG SER A 150 18.766 -14.524 1.770 1.00 0.00 H new ATOM 2401 N SER A 151 23.531 -14.396 4.789 1.00 0.00 N ATOM 2402 CA SER A 151 24.934 -14.787 4.850 1.00 0.00 C ATOM 2403 C SER A 151 25.158 -15.844 5.927 1.00 0.00 C ATOM 2404 O SER A 151 24.618 -15.747 7.029 1.00 0.00 O ATOM 2405 CB SER A 151 25.815 -13.567 5.125 1.00 0.00 C ATOM 2406 OG SER A 151 25.549 -13.026 6.408 1.00 0.00 O ATOM 0 H SER A 151 23.225 -13.803 5.561 1.00 0.00 H new ATOM 0 HA SER A 151 25.208 -15.213 3.885 1.00 0.00 H new ATOM 0 HB2 SER A 151 26.865 -13.850 5.057 1.00 0.00 H new ATOM 0 HB3 SER A 151 25.639 -12.808 4.363 1.00 0.00 H new ATOM 0 HG SER A 151 26.126 -12.248 6.561 1.00 0.00 H new ATOM 2412 N GLY A 152 25.959 -16.854 5.600 1.00 0.00 N ATOM 2413 CA GLY A 152 26.240 -17.914 6.550 1.00 0.00 C ATOM 2414 C GLY A 152 27.706 -18.299 6.571 1.00 0.00 C ATOM 2415 O GLY A 152 28.442 -17.916 7.480 1.00 0.00 O ATOM 0 H GLY A 152 26.418 -16.957 4.695 1.00 0.00 H new ATOM 0 HA2 GLY A 152 25.937 -17.594 7.547 1.00 0.00 H new ATOM 0 HA3 GLY A 152 25.641 -18.790 6.301 1.00 0.00 H new TER 2419 GLY A 152