USER MOD reduce.3.24.130724 H: found=0, std=0, add=935, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 933 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 47 CYS SG : rot -135:sc= -1.46 USER MOD Set 1.2: A 49 HIS : no HE2:sc= -3.33! C(o=-6.6!,f=-13!) USER MOD Set 1.3: A 50 CYS SG : rot 140:sc= -1.82 USER MOD Set 2.1: A 28 ASN : amide:sc= -2.04 K(o=-3,f=-4.9!) USER MOD Set 2.2: A 33 GLN :FLIP amide:sc= -1 F(o=-5.7,f=-3) USER MOD Set 3.1: A 23 THR OG1 : rot -92:sc= 1.16 USER MOD Set 3.2: A 26 ASN : amide:sc= -1.56! C(o=-0.4!,f=-3.3!) 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 180:sc= 0 USER MOD Single : A 5 SER OG : rot -57:sc= 0.156 USER MOD Single : A 6 SER OG : rot 22:sc= 0.455 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 13 TYR OH : rot 100:sc= -0.131 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= -0.214 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 34 SER OG : rot -139:sc= 0.8 USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= -1.94 X(o=-1.9,f=-1.5) USER MOD Single : A 54 THR OG1 : rot 86:sc= 0.498 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ -169:sc= 0.0661 (180deg=0.027) USER MOD Single : A 62 THR OG1 : rot 63:sc= 0.00915 USER MOD Single : A 65 LYS NZ :NH3+ -109:sc= 0.0553 (180deg=0) USER MOD Single : A 69 LYS NZ :NH3+ 173:sc= 0 (180deg=-0.0434) USER MOD Single : A 74 ASN : amide:sc= -7.73! C(o=-7.7!,f=-18!) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 78 HIS :FLIP no HD1:sc= -7.36! C(o=-9!,f=-7.4!) USER MOD Single : A 79 GLN : amide:sc= 0 K(o=0,f=-0.89) USER MOD Single : A 80 SER OG : rot 180:sc= 0 USER MOD Single : A 84 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 85 TYR OH : rot 77:sc= 0.808 USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 THR OG1 : rot 51:sc= 0.147 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 ASN :FLIP amide:sc= -4.49 F(o=-5!,f=-4.5) USER MOD Single : A 100 LYS NZ :NH3+ -154:sc= 1.05 (180deg=0.872) USER MOD Single : A 101 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 TYR OH : rot 8:sc= 1.15 USER MOD Single : A 107 GLN : amide:sc= -0.624 X(o=-0.62,f=-0.3) USER MOD Single : A 111 THR OG1 : rot 180:sc= 0.0322 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot -57:sc= 0.119 USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -23.652 0.893 -22.769 1.00 0.00 N ATOM 2 CA GLY A 1 -24.170 1.616 -21.622 1.00 0.00 C ATOM 3 C GLY A 1 -23.323 1.419 -20.381 1.00 0.00 C ATOM 4 O GLY A 1 -23.822 0.982 -19.344 1.00 0.00 O ATOM 0 H1 GLY A 1 -24.266 1.060 -23.591 1.00 0.00 H new ATOM 0 H2 GLY A 1 -22.690 1.224 -22.983 1.00 0.00 H new ATOM 0 H3 GLY A 1 -23.628 -0.125 -22.556 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -24.220 2.679 -21.859 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -25.189 1.286 -21.419 1.00 0.00 H new ATOM 8 N SER A 2 -22.038 1.741 -20.486 1.00 0.00 N ATOM 9 CA SER A 2 -21.118 1.591 -19.365 1.00 0.00 C ATOM 10 C SER A 2 -20.542 2.942 -18.951 1.00 0.00 C ATOM 11 O SER A 2 -20.625 3.919 -19.695 1.00 0.00 O ATOM 12 CB SER A 2 -19.984 0.631 -19.732 1.00 0.00 C ATOM 13 OG SER A 2 -19.158 1.181 -20.744 1.00 0.00 O ATOM 0 H SER A 2 -21.610 2.108 -21.336 1.00 0.00 H new ATOM 0 HA SER A 2 -21.674 1.179 -18.523 1.00 0.00 H new ATOM 0 HB2 SER A 2 -19.385 0.415 -18.847 1.00 0.00 H new ATOM 0 HB3 SER A 2 -20.401 -0.316 -20.074 1.00 0.00 H new ATOM 0 HG SER A 2 -18.440 0.550 -20.960 1.00 0.00 H new ATOM 19 N SER A 3 -19.957 2.988 -17.758 1.00 0.00 N ATOM 20 CA SER A 3 -19.370 4.219 -17.242 1.00 0.00 C ATOM 21 C SER A 3 -17.950 3.974 -16.740 1.00 0.00 C ATOM 22 O SER A 3 -17.746 3.557 -15.601 1.00 0.00 O ATOM 23 CB SER A 3 -20.232 4.785 -16.112 1.00 0.00 C ATOM 24 OG SER A 3 -19.845 6.110 -15.790 1.00 0.00 O ATOM 0 H SER A 3 -19.877 2.187 -17.131 1.00 0.00 H new ATOM 0 HA SER A 3 -19.330 4.943 -18.056 1.00 0.00 H new ATOM 0 HB2 SER A 3 -21.281 4.771 -16.408 1.00 0.00 H new ATOM 0 HB3 SER A 3 -20.142 4.152 -15.229 1.00 0.00 H new ATOM 0 HG SER A 3 -20.412 6.450 -15.066 1.00 0.00 H new ATOM 30 N GLY A 4 -16.971 4.238 -17.600 1.00 0.00 N ATOM 31 CA GLY A 4 -15.583 4.041 -17.227 1.00 0.00 C ATOM 32 C GLY A 4 -14.691 5.178 -17.688 1.00 0.00 C ATOM 33 O GLY A 4 -15.024 6.349 -17.507 1.00 0.00 O ATOM 0 H GLY A 4 -17.115 4.585 -18.548 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -15.511 3.944 -16.144 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -15.224 3.105 -17.656 1.00 0.00 H new ATOM 37 N SER A 5 -13.555 4.832 -18.285 1.00 0.00 N ATOM 38 CA SER A 5 -12.611 5.832 -18.769 1.00 0.00 C ATOM 39 C SER A 5 -12.196 6.776 -17.644 1.00 0.00 C ATOM 40 O SER A 5 -12.116 7.989 -17.835 1.00 0.00 O ATOM 41 CB SER A 5 -13.225 6.630 -19.920 1.00 0.00 C ATOM 42 OG SER A 5 -12.234 7.365 -20.617 1.00 0.00 O ATOM 0 H SER A 5 -13.266 3.867 -18.445 1.00 0.00 H new ATOM 0 HA SER A 5 -11.723 5.313 -19.131 1.00 0.00 H new ATOM 0 HB2 SER A 5 -13.730 5.952 -20.608 1.00 0.00 H new ATOM 0 HB3 SER A 5 -13.981 7.312 -19.531 1.00 0.00 H new ATOM 0 HG SER A 5 -11.766 7.957 -19.992 1.00 0.00 H new ATOM 48 N SER A 6 -11.933 6.209 -16.471 1.00 0.00 N ATOM 49 CA SER A 6 -11.530 7.000 -15.314 1.00 0.00 C ATOM 50 C SER A 6 -10.245 7.770 -15.603 1.00 0.00 C ATOM 51 O SER A 6 -9.217 7.183 -15.937 1.00 0.00 O ATOM 52 CB SER A 6 -11.332 6.095 -14.096 1.00 0.00 C ATOM 53 OG SER A 6 -10.266 5.186 -14.303 1.00 0.00 O ATOM 0 H SER A 6 -11.992 5.206 -16.297 1.00 0.00 H new ATOM 0 HA SER A 6 -12.323 7.717 -15.101 1.00 0.00 H new ATOM 0 HB2 SER A 6 -11.128 6.705 -13.216 1.00 0.00 H new ATOM 0 HB3 SER A 6 -12.251 5.543 -13.896 1.00 0.00 H new ATOM 0 HG SER A 6 -9.665 5.538 -14.993 1.00 0.00 H new ATOM 59 N GLY A 7 -10.313 9.092 -15.471 1.00 0.00 N ATOM 60 CA GLY A 7 -9.149 9.923 -15.721 1.00 0.00 C ATOM 61 C GLY A 7 -8.828 10.836 -14.555 1.00 0.00 C ATOM 62 O GLY A 7 -9.640 11.679 -14.176 1.00 0.00 O ATOM 0 H GLY A 7 -11.153 9.602 -15.196 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -8.289 9.286 -15.927 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -9.321 10.525 -16.613 1.00 0.00 H new ATOM 66 N ALA A 8 -7.639 10.669 -13.984 1.00 0.00 N ATOM 67 CA ALA A 8 -7.212 11.486 -12.855 1.00 0.00 C ATOM 68 C ALA A 8 -5.752 11.902 -13.000 1.00 0.00 C ATOM 69 O ALA A 8 -4.868 11.058 -13.151 1.00 0.00 O ATOM 70 CB ALA A 8 -7.422 10.732 -11.550 1.00 0.00 C ATOM 0 H ALA A 8 -6.955 9.975 -14.285 1.00 0.00 H new ATOM 0 HA ALA A 8 -7.820 12.391 -12.841 1.00 0.00 H new ATOM 0 HB1 ALA A 8 -7.099 11.353 -10.715 1.00 0.00 H new ATOM 0 HB2 ALA A 8 -8.479 10.491 -11.435 1.00 0.00 H new ATOM 0 HB3 ALA A 8 -6.839 9.811 -11.564 1.00 0.00 H new ATOM 76 N VAL A 9 -5.506 13.207 -12.952 1.00 0.00 N ATOM 77 CA VAL A 9 -4.153 13.735 -13.078 1.00 0.00 C ATOM 78 C VAL A 9 -3.404 13.649 -11.752 1.00 0.00 C ATOM 79 O VAL A 9 -2.278 13.156 -11.694 1.00 0.00 O ATOM 80 CB VAL A 9 -4.163 15.199 -13.555 1.00 0.00 C ATOM 81 CG1 VAL A 9 -2.746 15.748 -13.628 1.00 0.00 C ATOM 82 CG2 VAL A 9 -4.859 15.315 -14.903 1.00 0.00 C ATOM 0 H VAL A 9 -6.226 13.918 -12.827 1.00 0.00 H new ATOM 0 HA VAL A 9 -3.643 13.123 -13.821 1.00 0.00 H new ATOM 0 HB VAL A 9 -4.720 15.794 -12.832 1.00 0.00 H new ATOM 0 HG11 VAL A 9 -2.774 16.784 -13.967 1.00 0.00 H new ATOM 0 HG12 VAL A 9 -2.287 15.702 -12.641 1.00 0.00 H new ATOM 0 HG13 VAL A 9 -2.161 15.153 -14.329 1.00 0.00 H new ATOM 0 HG21 VAL A 9 -4.857 16.356 -15.225 1.00 0.00 H new ATOM 0 HG22 VAL A 9 -4.332 14.707 -15.638 1.00 0.00 H new ATOM 0 HG23 VAL A 9 -5.887 14.965 -14.813 1.00 0.00 H new ATOM 92 N SER A 10 -4.039 14.132 -10.689 1.00 0.00 N ATOM 93 CA SER A 10 -3.432 14.114 -9.363 1.00 0.00 C ATOM 94 C SER A 10 -2.772 12.766 -9.086 1.00 0.00 C ATOM 95 O SER A 10 -3.324 11.714 -9.408 1.00 0.00 O ATOM 96 CB SER A 10 -4.485 14.408 -8.293 1.00 0.00 C ATOM 97 OG SER A 10 -4.918 15.756 -8.361 1.00 0.00 O ATOM 0 H SER A 10 -4.973 14.540 -10.720 1.00 0.00 H new ATOM 0 HA SER A 10 -2.665 14.888 -9.331 1.00 0.00 H new ATOM 0 HB2 SER A 10 -5.338 13.742 -8.424 1.00 0.00 H new ATOM 0 HB3 SER A 10 -4.071 14.205 -7.305 1.00 0.00 H new ATOM 0 HG SER A 10 -5.592 15.918 -7.668 1.00 0.00 H new ATOM 103 N GLY A 11 -1.586 12.806 -8.487 1.00 0.00 N ATOM 104 CA GLY A 11 -0.870 11.583 -8.177 1.00 0.00 C ATOM 105 C GLY A 11 0.631 11.791 -8.111 1.00 0.00 C ATOM 106 O GLY A 11 1.305 11.831 -9.141 1.00 0.00 O ATOM 0 H GLY A 11 -1.108 13.664 -8.211 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -1.222 11.192 -7.223 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -1.097 10.831 -8.933 1.00 0.00 H new ATOM 110 N LEU A 12 1.155 11.925 -6.898 1.00 0.00 N ATOM 111 CA LEU A 12 2.585 12.131 -6.701 1.00 0.00 C ATOM 112 C LEU A 12 3.398 11.236 -7.631 1.00 0.00 C ATOM 113 O LEU A 12 4.347 11.687 -8.271 1.00 0.00 O ATOM 114 CB LEU A 12 2.966 11.852 -5.246 1.00 0.00 C ATOM 115 CG LEU A 12 2.141 12.583 -4.185 1.00 0.00 C ATOM 116 CD1 LEU A 12 2.484 12.070 -2.795 1.00 0.00 C ATOM 117 CD2 LEU A 12 2.371 14.085 -4.272 1.00 0.00 C ATOM 0 H LEU A 12 0.611 11.895 -6.036 1.00 0.00 H new ATOM 0 HA LEU A 12 2.812 13.171 -6.937 1.00 0.00 H new ATOM 0 HB2 LEU A 12 2.882 10.780 -5.068 1.00 0.00 H new ATOM 0 HB3 LEU A 12 4.014 12.117 -5.109 1.00 0.00 H new ATOM 0 HG LEU A 12 1.086 12.385 -4.373 1.00 0.00 H new ATOM 0 HD11 LEU A 12 1.887 12.602 -2.054 1.00 0.00 H new ATOM 0 HD12 LEU A 12 2.268 11.003 -2.737 1.00 0.00 H new ATOM 0 HD13 LEU A 12 3.543 12.237 -2.596 1.00 0.00 H new ATOM 0 HD21 LEU A 12 1.776 14.589 -3.510 1.00 0.00 H new ATOM 0 HD22 LEU A 12 3.427 14.301 -4.110 1.00 0.00 H new ATOM 0 HD23 LEU A 12 2.075 14.442 -5.258 1.00 0.00 H new ATOM 129 N TYR A 13 3.017 9.965 -7.702 1.00 0.00 N ATOM 130 CA TYR A 13 3.710 9.006 -8.553 1.00 0.00 C ATOM 131 C TYR A 13 3.251 9.133 -10.003 1.00 0.00 C ATOM 132 O TYR A 13 2.130 9.561 -10.275 1.00 0.00 O ATOM 133 CB TYR A 13 3.469 7.580 -8.053 1.00 0.00 C ATOM 134 CG TYR A 13 3.892 7.362 -6.618 1.00 0.00 C ATOM 135 CD1 TYR A 13 3.065 7.733 -5.565 1.00 0.00 C ATOM 136 CD2 TYR A 13 5.119 6.785 -6.316 1.00 0.00 C ATOM 137 CE1 TYR A 13 3.448 7.536 -4.253 1.00 0.00 C ATOM 138 CE2 TYR A 13 5.510 6.583 -5.006 1.00 0.00 C ATOM 139 CZ TYR A 13 4.671 6.960 -3.978 1.00 0.00 C ATOM 140 OH TYR A 13 5.056 6.761 -2.672 1.00 0.00 O ATOM 0 H TYR A 13 2.232 9.576 -7.180 1.00 0.00 H new ATOM 0 HA TYR A 13 4.777 9.224 -8.508 1.00 0.00 H new ATOM 0 HB2 TYR A 13 2.409 7.344 -8.150 1.00 0.00 H new ATOM 0 HB3 TYR A 13 4.011 6.883 -8.693 1.00 0.00 H new ATOM 0 HD1 TYR A 13 2.106 8.183 -5.776 1.00 0.00 H new ATOM 0 HD2 TYR A 13 5.779 6.489 -7.119 1.00 0.00 H new ATOM 0 HE1 TYR A 13 2.793 7.831 -3.446 1.00 0.00 H new ATOM 0 HE2 TYR A 13 6.467 6.132 -4.788 1.00 0.00 H new ATOM 0 HH TYR A 13 4.899 5.826 -2.424 1.00 0.00 H new ATOM 150 N SER A 14 4.127 8.757 -10.929 1.00 0.00 N ATOM 151 CA SER A 14 3.814 8.831 -12.351 1.00 0.00 C ATOM 152 C SER A 14 3.928 7.457 -13.005 1.00 0.00 C ATOM 153 O SER A 14 4.155 6.453 -12.330 1.00 0.00 O ATOM 154 CB SER A 14 4.750 9.820 -13.050 1.00 0.00 C ATOM 155 OG SER A 14 4.553 11.137 -12.566 1.00 0.00 O ATOM 0 H SER A 14 5.059 8.398 -10.720 1.00 0.00 H new ATOM 0 HA SER A 14 2.786 9.179 -12.454 1.00 0.00 H new ATOM 0 HB2 SER A 14 5.786 9.521 -12.889 1.00 0.00 H new ATOM 0 HB3 SER A 14 4.574 9.794 -14.125 1.00 0.00 H new ATOM 0 HG SER A 14 5.164 11.750 -13.027 1.00 0.00 H new ATOM 161 N SER A 15 3.769 7.421 -14.324 1.00 0.00 N ATOM 162 CA SER A 15 3.850 6.171 -15.070 1.00 0.00 C ATOM 163 C SER A 15 5.300 5.721 -15.221 1.00 0.00 C ATOM 164 O SER A 15 5.652 4.595 -14.869 1.00 0.00 O ATOM 165 CB SER A 15 3.208 6.333 -16.450 1.00 0.00 C ATOM 166 OG SER A 15 3.887 7.313 -17.216 1.00 0.00 O ATOM 0 H SER A 15 3.583 8.243 -14.898 1.00 0.00 H new ATOM 0 HA SER A 15 3.307 5.408 -14.512 1.00 0.00 H new ATOM 0 HB2 SER A 15 3.225 5.379 -16.977 1.00 0.00 H new ATOM 0 HB3 SER A 15 2.161 6.616 -16.337 1.00 0.00 H new ATOM 0 HG SER A 15 3.459 7.397 -18.094 1.00 0.00 H new ATOM 172 N SER A 16 6.137 6.610 -15.747 1.00 0.00 N ATOM 173 CA SER A 16 7.549 6.304 -15.949 1.00 0.00 C ATOM 174 C SER A 16 8.073 5.399 -14.838 1.00 0.00 C ATOM 175 O SER A 16 8.771 4.419 -15.098 1.00 0.00 O ATOM 176 CB SER A 16 8.369 7.594 -16.001 1.00 0.00 C ATOM 177 OG SER A 16 9.758 7.317 -15.971 1.00 0.00 O ATOM 0 H SER A 16 5.862 7.547 -16.041 1.00 0.00 H new ATOM 0 HA SER A 16 7.650 5.779 -16.899 1.00 0.00 H new ATOM 0 HB2 SER A 16 8.125 8.147 -16.908 1.00 0.00 H new ATOM 0 HB3 SER A 16 8.104 8.231 -15.157 1.00 0.00 H new ATOM 0 HG SER A 16 10.260 8.158 -16.007 1.00 0.00 H new ATOM 183 N ASP A 17 7.730 5.735 -13.599 1.00 0.00 N ATOM 184 CA ASP A 17 8.164 4.953 -12.447 1.00 0.00 C ATOM 185 C ASP A 17 7.719 3.500 -12.578 1.00 0.00 C ATOM 186 O ASP A 17 7.157 3.102 -13.598 1.00 0.00 O ATOM 187 CB ASP A 17 7.608 5.556 -11.156 1.00 0.00 C ATOM 188 CG ASP A 17 7.555 7.070 -11.200 1.00 0.00 C ATOM 189 OD1 ASP A 17 8.438 7.676 -11.842 1.00 0.00 O ATOM 190 OD2 ASP A 17 6.630 7.650 -10.592 1.00 0.00 O ATOM 0 H ASP A 17 7.153 6.543 -13.367 1.00 0.00 H new ATOM 0 HA ASP A 17 9.253 4.978 -12.411 1.00 0.00 H new ATOM 0 HB2 ASP A 17 6.606 5.165 -10.978 1.00 0.00 H new ATOM 0 HB3 ASP A 17 8.227 5.241 -10.316 1.00 0.00 H new ATOM 195 N ASP A 18 7.975 2.713 -11.538 1.00 0.00 N ATOM 196 CA ASP A 18 7.601 1.303 -11.537 1.00 0.00 C ATOM 197 C ASP A 18 6.496 1.035 -10.519 1.00 0.00 C ATOM 198 O ASP A 18 6.364 -0.077 -10.009 1.00 0.00 O ATOM 199 CB ASP A 18 8.818 0.431 -11.228 1.00 0.00 C ATOM 200 CG ASP A 18 9.990 0.728 -12.143 1.00 0.00 C ATOM 201 OD1 ASP A 18 10.277 1.922 -12.369 1.00 0.00 O ATOM 202 OD2 ASP A 18 10.620 -0.233 -12.633 1.00 0.00 O ATOM 0 H ASP A 18 8.439 3.027 -10.686 1.00 0.00 H new ATOM 0 HA ASP A 18 7.226 1.051 -12.529 1.00 0.00 H new ATOM 0 HB2 ASP A 18 9.120 0.588 -10.193 1.00 0.00 H new ATOM 0 HB3 ASP A 18 8.543 -0.619 -11.324 1.00 0.00 H new ATOM 207 N VAL A 19 5.706 2.063 -10.226 1.00 0.00 N ATOM 208 CA VAL A 19 4.613 1.939 -9.269 1.00 0.00 C ATOM 209 C VAL A 19 3.266 1.877 -9.979 1.00 0.00 C ATOM 210 O VAL A 19 3.000 2.653 -10.897 1.00 0.00 O ATOM 211 CB VAL A 19 4.603 3.115 -8.273 1.00 0.00 C ATOM 212 CG1 VAL A 19 3.394 3.026 -7.355 1.00 0.00 C ATOM 213 CG2 VAL A 19 5.894 3.142 -7.469 1.00 0.00 C ATOM 0 H VAL A 19 5.803 2.991 -10.638 1.00 0.00 H new ATOM 0 HA VAL A 19 4.775 1.010 -8.722 1.00 0.00 H new ATOM 0 HB VAL A 19 4.533 4.046 -8.836 1.00 0.00 H new ATOM 0 HG11 VAL A 19 3.403 3.864 -6.659 1.00 0.00 H new ATOM 0 HG12 VAL A 19 2.482 3.059 -7.951 1.00 0.00 H new ATOM 0 HG13 VAL A 19 3.429 2.090 -6.797 1.00 0.00 H new ATOM 0 HG21 VAL A 19 5.870 3.979 -6.771 1.00 0.00 H new ATOM 0 HG22 VAL A 19 5.997 2.209 -6.915 1.00 0.00 H new ATOM 0 HG23 VAL A 19 6.741 3.258 -8.145 1.00 0.00 H new ATOM 223 N ILE A 20 2.418 0.949 -9.547 1.00 0.00 N ATOM 224 CA ILE A 20 1.097 0.787 -10.140 1.00 0.00 C ATOM 225 C ILE A 20 0.057 1.627 -9.406 1.00 0.00 C ATOM 226 O ILE A 20 -0.177 1.437 -8.213 1.00 0.00 O ATOM 227 CB ILE A 20 0.651 -0.687 -10.128 1.00 0.00 C ATOM 228 CG1 ILE A 20 1.579 -1.531 -11.005 1.00 0.00 C ATOM 229 CG2 ILE A 20 -0.790 -0.809 -10.601 1.00 0.00 C ATOM 230 CD1 ILE A 20 1.452 -3.018 -10.763 1.00 0.00 C ATOM 0 H ILE A 20 2.623 0.298 -8.789 1.00 0.00 H new ATOM 0 HA ILE A 20 1.172 1.127 -11.173 1.00 0.00 H new ATOM 0 HB ILE A 20 0.710 -1.060 -9.106 1.00 0.00 H new ATOM 0 HG12 ILE A 20 1.364 -1.322 -12.053 1.00 0.00 H new ATOM 0 HG13 ILE A 20 2.611 -1.229 -10.824 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -1.090 -1.857 -10.587 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -1.440 -0.236 -9.939 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -0.874 -0.421 -11.616 1.00 0.00 H new ATOM 0 HD11 ILE A 20 2.139 -3.553 -11.419 1.00 0.00 H new ATOM 0 HD12 ILE A 20 1.696 -3.240 -9.724 1.00 0.00 H new ATOM 0 HD13 ILE A 20 0.430 -3.335 -10.972 1.00 0.00 H new ATOM 242 N GLU A 21 -0.564 2.554 -10.128 1.00 0.00 N ATOM 243 CA GLU A 21 -1.580 3.422 -9.544 1.00 0.00 C ATOM 244 C GLU A 21 -2.817 2.622 -9.148 1.00 0.00 C ATOM 245 O GLU A 21 -3.672 2.325 -9.983 1.00 0.00 O ATOM 246 CB GLU A 21 -1.967 4.526 -10.530 1.00 0.00 C ATOM 247 CG GLU A 21 -2.956 5.530 -9.962 1.00 0.00 C ATOM 248 CD GLU A 21 -2.627 5.931 -8.537 1.00 0.00 C ATOM 249 OE1 GLU A 21 -1.695 6.740 -8.349 1.00 0.00 O ATOM 250 OE2 GLU A 21 -3.302 5.436 -7.610 1.00 0.00 O ATOM 0 H GLU A 21 -0.382 2.723 -11.117 1.00 0.00 H new ATOM 0 HA GLU A 21 -1.160 3.877 -8.647 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -1.066 5.054 -10.844 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -2.397 4.070 -11.422 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -2.968 6.419 -10.592 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -3.959 5.104 -9.993 1.00 0.00 H new ATOM 257 N LEU A 22 -2.906 2.275 -7.869 1.00 0.00 N ATOM 258 CA LEU A 22 -4.038 1.508 -7.360 1.00 0.00 C ATOM 259 C LEU A 22 -5.229 2.418 -7.079 1.00 0.00 C ATOM 260 O LEU A 22 -5.086 3.475 -6.462 1.00 0.00 O ATOM 261 CB LEU A 22 -3.641 0.759 -6.087 1.00 0.00 C ATOM 262 CG LEU A 22 -2.766 -0.479 -6.281 1.00 0.00 C ATOM 263 CD1 LEU A 22 -2.431 -1.112 -4.940 1.00 0.00 C ATOM 264 CD2 LEU A 22 -3.458 -1.484 -7.190 1.00 0.00 C ATOM 0 H LEU A 22 -2.207 2.513 -7.165 1.00 0.00 H new ATOM 0 HA LEU A 22 -4.329 0.785 -8.123 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -3.114 1.452 -5.431 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -4.551 0.458 -5.568 1.00 0.00 H new ATOM 0 HG LEU A 22 -1.835 -0.171 -6.756 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -1.808 -1.992 -5.099 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -1.893 -0.393 -4.322 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -3.352 -1.406 -4.436 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -2.821 -2.359 -7.317 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -4.405 -1.787 -6.743 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -3.645 -1.027 -8.162 1.00 0.00 H new ATOM 276 N THR A 23 -6.407 2.000 -7.533 1.00 0.00 N ATOM 277 CA THR A 23 -7.624 2.776 -7.329 1.00 0.00 C ATOM 278 C THR A 23 -8.765 1.892 -6.840 1.00 0.00 C ATOM 279 O THR A 23 -8.734 0.668 -6.972 1.00 0.00 O ATOM 280 CB THR A 23 -8.060 3.488 -8.624 1.00 0.00 C ATOM 281 OG1 THR A 23 -9.047 2.705 -9.304 1.00 0.00 O ATOM 282 CG2 THR A 23 -6.868 3.719 -9.541 1.00 0.00 C ATOM 0 H THR A 23 -6.544 1.128 -8.044 1.00 0.00 H new ATOM 0 HA THR A 23 -7.397 3.525 -6.570 1.00 0.00 H new ATOM 0 HB THR A 23 -8.485 4.455 -8.356 1.00 0.00 H new ATOM 0 HG1 THR A 23 -8.607 2.109 -9.946 1.00 0.00 H new ATOM 0 HG21 THR A 23 -7.200 4.223 -10.449 1.00 0.00 H new ATOM 0 HG22 THR A 23 -6.131 4.339 -9.031 1.00 0.00 H new ATOM 0 HG23 THR A 23 -6.418 2.761 -9.801 1.00 0.00 H new ATOM 290 N PRO A 24 -9.797 2.523 -6.261 1.00 0.00 N ATOM 291 CA PRO A 24 -10.969 1.811 -5.742 1.00 0.00 C ATOM 292 C PRO A 24 -11.827 1.218 -6.854 1.00 0.00 C ATOM 293 O PRO A 24 -12.995 0.889 -6.642 1.00 0.00 O ATOM 294 CB PRO A 24 -11.742 2.900 -4.993 1.00 0.00 C ATOM 295 CG PRO A 24 -11.330 4.174 -5.646 1.00 0.00 C ATOM 296 CD PRO A 24 -9.901 3.979 -6.071 1.00 0.00 C ATOM 0 HA PRO A 24 -10.687 0.963 -5.118 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -12.818 2.746 -5.070 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -11.495 2.901 -3.931 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -11.965 4.396 -6.504 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -11.421 5.013 -4.956 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -9.678 4.521 -6.990 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -9.204 4.336 -5.313 1.00 0.00 H new ATOM 304 N SER A 25 -11.242 1.083 -8.040 1.00 0.00 N ATOM 305 CA SER A 25 -11.954 0.533 -9.186 1.00 0.00 C ATOM 306 C SER A 25 -11.222 -0.682 -9.748 1.00 0.00 C ATOM 307 O SER A 25 -11.817 -1.520 -10.426 1.00 0.00 O ATOM 308 CB SER A 25 -12.111 1.596 -10.275 1.00 0.00 C ATOM 309 OG SER A 25 -13.261 2.393 -10.048 1.00 0.00 O ATOM 0 H SER A 25 -10.276 1.348 -8.232 1.00 0.00 H new ATOM 0 HA SER A 25 -12.942 0.218 -8.851 1.00 0.00 H new ATOM 0 HB2 SER A 25 -11.225 2.230 -10.299 1.00 0.00 H new ATOM 0 HB3 SER A 25 -12.185 1.114 -11.250 1.00 0.00 H new ATOM 0 HG SER A 25 -13.338 3.066 -10.757 1.00 0.00 H new ATOM 315 N ASN A 26 -9.928 -0.770 -9.461 1.00 0.00 N ATOM 316 CA ASN A 26 -9.113 -1.882 -9.938 1.00 0.00 C ATOM 317 C ASN A 26 -8.392 -2.564 -8.779 1.00 0.00 C ATOM 318 O ASN A 26 -7.907 -3.688 -8.911 1.00 0.00 O ATOM 319 CB ASN A 26 -8.095 -1.390 -10.969 1.00 0.00 C ATOM 320 CG ASN A 26 -7.660 0.040 -10.715 1.00 0.00 C ATOM 321 OD1 ASN A 26 -8.379 0.986 -11.036 1.00 0.00 O ATOM 322 ND2 ASN A 26 -6.476 0.204 -10.135 1.00 0.00 N ATOM 0 H ASN A 26 -9.421 -0.085 -8.901 1.00 0.00 H new ATOM 0 HA ASN A 26 -9.774 -2.609 -10.409 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -7.221 -2.041 -10.952 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -8.528 -1.463 -11.967 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -6.130 1.143 -9.939 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -5.913 -0.609 -9.886 1.00 0.00 H new ATOM 329 N PHE A 27 -8.325 -1.876 -7.644 1.00 0.00 N ATOM 330 CA PHE A 27 -7.663 -2.415 -6.462 1.00 0.00 C ATOM 331 C PHE A 27 -7.952 -3.905 -6.308 1.00 0.00 C ATOM 332 O PHE A 27 -7.140 -4.653 -5.765 1.00 0.00 O ATOM 333 CB PHE A 27 -8.118 -1.663 -5.209 1.00 0.00 C ATOM 334 CG PHE A 27 -7.345 -2.031 -3.975 1.00 0.00 C ATOM 335 CD1 PHE A 27 -7.454 -3.298 -3.426 1.00 0.00 C ATOM 336 CD2 PHE A 27 -6.510 -1.109 -3.365 1.00 0.00 C ATOM 337 CE1 PHE A 27 -6.743 -3.640 -2.290 1.00 0.00 C ATOM 338 CE2 PHE A 27 -5.797 -1.445 -2.229 1.00 0.00 C ATOM 339 CZ PHE A 27 -5.915 -2.712 -1.691 1.00 0.00 C ATOM 0 H PHE A 27 -8.721 -0.944 -7.518 1.00 0.00 H new ATOM 0 HA PHE A 27 -6.588 -2.283 -6.586 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -8.021 -0.591 -5.383 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -9.176 -1.864 -5.039 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -8.102 -4.027 -3.890 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -6.415 -0.117 -3.781 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -6.835 -4.632 -1.872 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -5.149 -0.718 -1.763 1.00 0.00 H new ATOM 0 HZ PHE A 27 -5.360 -2.976 -0.803 1.00 0.00 H new ATOM 349 N ASN A 28 -9.116 -4.329 -6.790 1.00 0.00 N ATOM 350 CA ASN A 28 -9.514 -5.729 -6.706 1.00 0.00 C ATOM 351 C ASN A 28 -8.971 -6.522 -7.891 1.00 0.00 C ATOM 352 O ASN A 28 -8.438 -7.619 -7.726 1.00 0.00 O ATOM 353 CB ASN A 28 -11.038 -5.846 -6.655 1.00 0.00 C ATOM 354 CG ASN A 28 -11.499 -7.227 -6.230 1.00 0.00 C ATOM 355 OD1 ASN A 28 -11.816 -7.455 -5.062 1.00 0.00 O ATOM 356 ND2 ASN A 28 -11.538 -8.155 -7.178 1.00 0.00 N ATOM 0 H ASN A 28 -9.800 -3.723 -7.243 1.00 0.00 H new ATOM 0 HA ASN A 28 -9.094 -6.145 -5.790 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -11.433 -5.105 -5.961 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -11.450 -5.615 -7.637 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -11.840 -9.103 -6.952 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -11.266 -7.921 -8.133 1.00 0.00 H new ATOM 363 N ARG A 29 -9.111 -5.957 -9.087 1.00 0.00 N ATOM 364 CA ARG A 29 -8.636 -6.611 -10.300 1.00 0.00 C ATOM 365 C ARG A 29 -7.121 -6.482 -10.430 1.00 0.00 C ATOM 366 O ARG A 29 -6.515 -7.057 -11.333 1.00 0.00 O ATOM 367 CB ARG A 29 -9.317 -6.008 -11.530 1.00 0.00 C ATOM 368 CG ARG A 29 -10.651 -6.654 -11.865 1.00 0.00 C ATOM 369 CD ARG A 29 -11.694 -6.366 -10.797 1.00 0.00 C ATOM 370 NE ARG A 29 -12.844 -7.260 -10.900 1.00 0.00 N ATOM 371 CZ ARG A 29 -13.800 -7.125 -11.813 1.00 0.00 C ATOM 372 NH1 ARG A 29 -13.742 -6.139 -12.697 1.00 0.00 N ATOM 373 NH2 ARG A 29 -14.815 -7.979 -11.843 1.00 0.00 N ATOM 0 H ARG A 29 -9.549 -5.049 -9.241 1.00 0.00 H new ATOM 0 HA ARG A 29 -8.889 -7.669 -10.235 1.00 0.00 H new ATOM 0 HB2 ARG A 29 -9.471 -4.942 -11.364 1.00 0.00 H new ATOM 0 HB3 ARG A 29 -8.651 -6.104 -12.387 1.00 0.00 H new ATOM 0 HG2 ARG A 29 -11.003 -6.285 -12.828 1.00 0.00 H new ATOM 0 HG3 ARG A 29 -10.520 -7.731 -11.965 1.00 0.00 H new ATOM 0 HD2 ARG A 29 -11.241 -6.470 -9.811 1.00 0.00 H new ATOM 0 HD3 ARG A 29 -12.029 -5.333 -10.887 1.00 0.00 H new ATOM 0 HE ARG A 29 -12.917 -8.030 -10.235 1.00 0.00 H new ATOM 0 HH11 ARG A 29 -12.962 -5.482 -12.677 1.00 0.00 H new ATOM 0 HH12 ARG A 29 -14.477 -6.038 -13.397 1.00 0.00 H new ATOM 0 HH21 ARG A 29 -14.862 -8.740 -11.165 1.00 0.00 H new ATOM 0 HH22 ARG A 29 -15.549 -7.875 -12.544 1.00 0.00 H new ATOM 387 N GLU A 30 -6.517 -5.722 -9.521 1.00 0.00 N ATOM 388 CA GLU A 30 -5.073 -5.516 -9.536 1.00 0.00 C ATOM 389 C GLU A 30 -4.403 -6.285 -8.401 1.00 0.00 C ATOM 390 O GLU A 30 -3.425 -7.002 -8.615 1.00 0.00 O ATOM 391 CB GLU A 30 -4.747 -4.026 -9.419 1.00 0.00 C ATOM 392 CG GLU A 30 -4.642 -3.319 -10.760 1.00 0.00 C ATOM 393 CD GLU A 30 -3.408 -3.728 -11.541 1.00 0.00 C ATOM 394 OE1 GLU A 30 -2.376 -4.026 -10.904 1.00 0.00 O ATOM 395 OE2 GLU A 30 -3.475 -3.749 -12.787 1.00 0.00 O ATOM 0 H GLU A 30 -7.005 -5.239 -8.766 1.00 0.00 H new ATOM 0 HA GLU A 30 -4.688 -5.891 -10.484 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -5.518 -3.540 -8.821 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -3.806 -3.910 -8.882 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -5.531 -3.537 -11.352 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -4.624 -2.241 -10.598 1.00 0.00 H new ATOM 402 N VAL A 31 -4.936 -6.131 -7.193 1.00 0.00 N ATOM 403 CA VAL A 31 -4.390 -6.810 -6.024 1.00 0.00 C ATOM 404 C VAL A 31 -5.204 -8.053 -5.682 1.00 0.00 C ATOM 405 O VAL A 31 -4.701 -9.175 -5.753 1.00 0.00 O ATOM 406 CB VAL A 31 -4.357 -5.879 -4.798 1.00 0.00 C ATOM 407 CG1 VAL A 31 -3.736 -6.589 -3.605 1.00 0.00 C ATOM 408 CG2 VAL A 31 -3.598 -4.600 -5.122 1.00 0.00 C ATOM 0 H VAL A 31 -5.746 -5.542 -6.998 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.371 -7.103 -6.275 1.00 0.00 H new ATOM 0 HB VAL A 31 -5.381 -5.612 -4.538 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.721 -5.916 -2.748 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -4.324 -7.474 -3.361 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.717 -6.888 -3.849 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -3.584 -3.953 -4.245 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -2.575 -4.846 -5.408 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.090 -4.084 -5.946 1.00 0.00 H new ATOM 418 N ILE A 32 -6.463 -7.846 -5.311 1.00 0.00 N ATOM 419 CA ILE A 32 -7.347 -8.951 -4.960 1.00 0.00 C ATOM 420 C ILE A 32 -7.318 -10.039 -6.027 1.00 0.00 C ATOM 421 O ILE A 32 -7.465 -11.223 -5.724 1.00 0.00 O ATOM 422 CB ILE A 32 -8.798 -8.471 -4.770 1.00 0.00 C ATOM 423 CG1 ILE A 32 -8.853 -7.333 -3.749 1.00 0.00 C ATOM 424 CG2 ILE A 32 -9.684 -9.627 -4.330 1.00 0.00 C ATOM 425 CD1 ILE A 32 -8.422 -7.746 -2.359 1.00 0.00 C ATOM 0 H ILE A 32 -6.894 -6.924 -5.246 1.00 0.00 H new ATOM 0 HA ILE A 32 -6.982 -9.361 -4.018 1.00 0.00 H new ATOM 0 HB ILE A 32 -9.169 -8.096 -5.724 1.00 0.00 H new ATOM 0 HG12 ILE A 32 -8.215 -6.518 -4.091 1.00 0.00 H new ATOM 0 HG13 ILE A 32 -9.870 -6.945 -3.705 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -10.707 -9.273 -4.200 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -9.665 -10.409 -5.089 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -9.316 -10.028 -3.386 1.00 0.00 H new ATOM 0 HD11 ILE A 32 -8.486 -6.889 -1.688 1.00 0.00 H new ATOM 0 HD12 ILE A 32 -9.075 -8.540 -1.997 1.00 0.00 H new ATOM 0 HD13 ILE A 32 -7.394 -8.107 -2.389 1.00 0.00 H new ATOM 437 N GLN A 33 -7.127 -9.629 -7.277 1.00 0.00 N ATOM 438 CA GLN A 33 -7.078 -10.571 -8.390 1.00 0.00 C ATOM 439 C GLN A 33 -5.636 -10.901 -8.760 1.00 0.00 C ATOM 440 O GLN A 33 -5.333 -11.190 -9.918 1.00 0.00 O ATOM 441 CB GLN A 33 -7.811 -9.996 -9.604 1.00 0.00 C ATOM 442 CG GLN A 33 -9.324 -9.989 -9.454 1.00 0.00 C ATOM 443 CD GLN A 33 -9.828 -11.116 -8.573 1.00 0.00 C ATOM 444 OE1 GLN A 33 -10.141 -10.795 -7.323 1.00 0.00 O flip ATOM 445 NE2 GLN A 33 -9.936 -12.261 -9.012 1.00 0.00 N flip ATOM 0 H GLN A 33 -7.004 -8.652 -7.544 1.00 0.00 H new ATOM 0 HA GLN A 33 -7.573 -11.491 -8.078 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -7.467 -8.976 -9.777 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -7.544 -10.576 -10.487 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -9.639 -9.035 -9.032 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -9.783 -10.070 -10.439 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -9.684 -12.462 -9.980 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -10.278 -13.009 -8.408 1.00 0.00 H new ATOM 454 N SER A 34 -4.750 -10.855 -7.770 1.00 0.00 N ATOM 455 CA SER A 34 -3.339 -11.145 -7.994 1.00 0.00 C ATOM 456 C SER A 34 -2.822 -12.150 -6.969 1.00 0.00 C ATOM 457 O SER A 34 -2.597 -11.809 -5.808 1.00 0.00 O ATOM 458 CB SER A 34 -2.515 -9.858 -7.923 1.00 0.00 C ATOM 459 OG SER A 34 -1.141 -10.119 -8.153 1.00 0.00 O ATOM 0 H SER A 34 -4.985 -10.620 -6.806 1.00 0.00 H new ATOM 0 HA SER A 34 -3.236 -11.580 -8.988 1.00 0.00 H new ATOM 0 HB2 SER A 34 -2.882 -9.146 -8.662 1.00 0.00 H new ATOM 0 HB3 SER A 34 -2.642 -9.395 -6.944 1.00 0.00 H new ATOM 0 HG SER A 34 -0.599 -9.584 -7.536 1.00 0.00 H new ATOM 465 N ASP A 35 -2.637 -13.390 -7.407 1.00 0.00 N ATOM 466 CA ASP A 35 -2.146 -14.446 -6.530 1.00 0.00 C ATOM 467 C ASP A 35 -0.827 -14.042 -5.879 1.00 0.00 C ATOM 468 O ASP A 35 -0.538 -14.429 -4.747 1.00 0.00 O ATOM 469 CB ASP A 35 -1.965 -15.747 -7.314 1.00 0.00 C ATOM 470 CG ASP A 35 -1.741 -16.942 -6.409 1.00 0.00 C ATOM 471 OD1 ASP A 35 -0.634 -17.058 -5.843 1.00 0.00 O ATOM 472 OD2 ASP A 35 -2.672 -17.762 -6.267 1.00 0.00 O ATOM 0 H ASP A 35 -2.820 -13.689 -8.365 1.00 0.00 H new ATOM 0 HA ASP A 35 -2.885 -14.605 -5.744 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -2.847 -15.922 -7.930 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -1.118 -15.644 -7.992 1.00 0.00 H new ATOM 477 N GLY A 36 -0.030 -13.262 -6.602 1.00 0.00 N ATOM 478 CA GLY A 36 1.249 -12.819 -6.079 1.00 0.00 C ATOM 479 C GLY A 36 1.099 -11.842 -4.930 1.00 0.00 C ATOM 480 O GLY A 36 -0.017 -11.541 -4.503 1.00 0.00 O ATOM 0 H GLY A 36 -0.247 -12.929 -7.541 1.00 0.00 H new ATOM 0 HA2 GLY A 36 1.820 -13.685 -5.743 1.00 0.00 H new ATOM 0 HA3 GLY A 36 1.822 -12.349 -6.879 1.00 0.00 H new ATOM 484 N LEU A 37 2.224 -11.348 -4.425 1.00 0.00 N ATOM 485 CA LEU A 37 2.213 -10.400 -3.316 1.00 0.00 C ATOM 486 C LEU A 37 1.988 -8.977 -3.818 1.00 0.00 C ATOM 487 O LEU A 37 2.458 -8.606 -4.893 1.00 0.00 O ATOM 488 CB LEU A 37 3.530 -10.477 -2.541 1.00 0.00 C ATOM 489 CG LEU A 37 3.451 -10.147 -1.050 1.00 0.00 C ATOM 490 CD1 LEU A 37 2.893 -11.329 -0.271 1.00 0.00 C ATOM 491 CD2 LEU A 37 4.821 -9.754 -0.517 1.00 0.00 C ATOM 0 H LEU A 37 3.155 -11.588 -4.766 1.00 0.00 H new ATOM 0 HA LEU A 37 1.391 -10.665 -2.651 1.00 0.00 H new ATOM 0 HB2 LEU A 37 3.934 -11.484 -2.649 1.00 0.00 H new ATOM 0 HB3 LEU A 37 4.243 -9.796 -3.006 1.00 0.00 H new ATOM 0 HG LEU A 37 2.776 -9.301 -0.920 1.00 0.00 H new ATOM 0 HD11 LEU A 37 2.844 -11.076 0.788 1.00 0.00 H new ATOM 0 HD12 LEU A 37 1.893 -11.565 -0.635 1.00 0.00 H new ATOM 0 HD13 LEU A 37 3.542 -12.194 -0.408 1.00 0.00 H new ATOM 0 HD21 LEU A 37 4.745 -9.523 0.545 1.00 0.00 H new ATOM 0 HD22 LEU A 37 5.518 -10.580 -0.660 1.00 0.00 H new ATOM 0 HD23 LEU A 37 5.183 -8.877 -1.054 1.00 0.00 H new ATOM 503 N TRP A 38 1.268 -8.186 -3.031 1.00 0.00 N ATOM 504 CA TRP A 38 0.982 -6.802 -3.395 1.00 0.00 C ATOM 505 C TRP A 38 1.287 -5.860 -2.235 1.00 0.00 C ATOM 506 O TRP A 38 0.842 -6.082 -1.108 1.00 0.00 O ATOM 507 CB TRP A 38 -0.481 -6.656 -3.815 1.00 0.00 C ATOM 508 CG TRP A 38 -0.676 -6.669 -5.301 1.00 0.00 C ATOM 509 CD1 TRP A 38 -0.933 -7.758 -6.084 1.00 0.00 C ATOM 510 CD2 TRP A 38 -0.627 -5.542 -6.182 1.00 0.00 C ATOM 511 NE1 TRP A 38 -1.047 -7.376 -7.399 1.00 0.00 N ATOM 512 CE2 TRP A 38 -0.864 -6.021 -7.486 1.00 0.00 C ATOM 513 CE3 TRP A 38 -0.408 -4.174 -5.997 1.00 0.00 C ATOM 514 CZ2 TRP A 38 -0.887 -5.180 -8.595 1.00 0.00 C ATOM 515 CZ3 TRP A 38 -0.431 -3.341 -7.099 1.00 0.00 C ATOM 516 CH2 TRP A 38 -0.670 -3.845 -8.384 1.00 0.00 C ATOM 0 H TRP A 38 0.872 -8.478 -2.138 1.00 0.00 H new ATOM 0 HA TRP A 38 1.623 -6.533 -4.235 1.00 0.00 H new ATOM 0 HB2 TRP A 38 -1.061 -7.466 -3.372 1.00 0.00 H new ATOM 0 HB3 TRP A 38 -0.876 -5.723 -3.412 1.00 0.00 H new ATOM 0 HD1 TRP A 38 -1.032 -8.771 -5.723 1.00 0.00 H new ATOM 0 HE1 TRP A 38 -1.237 -8.000 -8.183 1.00 0.00 H new ATOM 0 HE3 TRP A 38 -0.224 -3.775 -5.010 1.00 0.00 H new ATOM 0 HZ2 TRP A 38 -1.070 -5.567 -9.587 1.00 0.00 H new ATOM 0 HZ3 TRP A 38 -0.262 -2.282 -6.967 1.00 0.00 H new ATOM 0 HH2 TRP A 38 -0.683 -3.167 -9.225 1.00 0.00 H new ATOM 527 N LEU A 39 2.049 -4.809 -2.517 1.00 0.00 N ATOM 528 CA LEU A 39 2.413 -3.832 -1.496 1.00 0.00 C ATOM 529 C LEU A 39 1.727 -2.495 -1.753 1.00 0.00 C ATOM 530 O LEU A 39 2.163 -1.713 -2.598 1.00 0.00 O ATOM 531 CB LEU A 39 3.930 -3.642 -1.463 1.00 0.00 C ATOM 532 CG LEU A 39 4.694 -4.513 -0.466 1.00 0.00 C ATOM 533 CD1 LEU A 39 6.190 -4.447 -0.735 1.00 0.00 C ATOM 534 CD2 LEU A 39 4.389 -4.083 0.962 1.00 0.00 C ATOM 0 H LEU A 39 2.427 -4.611 -3.444 1.00 0.00 H new ATOM 0 HA LEU A 39 2.079 -4.211 -0.530 1.00 0.00 H new ATOM 0 HB2 LEU A 39 4.322 -3.838 -2.461 1.00 0.00 H new ATOM 0 HB3 LEU A 39 4.140 -2.597 -1.237 1.00 0.00 H new ATOM 0 HG LEU A 39 4.368 -5.545 -0.592 1.00 0.00 H new ATOM 0 HD11 LEU A 39 6.717 -5.073 -0.015 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.394 -4.804 -1.745 1.00 0.00 H new ATOM 0 HD13 LEU A 39 6.532 -3.417 -0.638 1.00 0.00 H new ATOM 0 HD21 LEU A 39 4.942 -4.714 1.658 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.686 -3.043 1.100 1.00 0.00 H new ATOM 0 HD23 LEU A 39 3.320 -4.183 1.152 1.00 0.00 H new ATOM 546 N VAL A 40 0.650 -2.236 -1.017 1.00 0.00 N ATOM 547 CA VAL A 40 -0.095 -0.992 -1.162 1.00 0.00 C ATOM 548 C VAL A 40 0.238 -0.017 -0.038 1.00 0.00 C ATOM 549 O VAL A 40 0.020 -0.312 1.136 1.00 0.00 O ATOM 550 CB VAL A 40 -1.614 -1.245 -1.174 1.00 0.00 C ATOM 551 CG1 VAL A 40 -2.365 0.025 -1.543 1.00 0.00 C ATOM 552 CG2 VAL A 40 -1.958 -2.375 -2.133 1.00 0.00 C ATOM 0 H VAL A 40 0.274 -2.872 -0.314 1.00 0.00 H new ATOM 0 HA VAL A 40 0.201 -0.556 -2.116 1.00 0.00 H new ATOM 0 HB VAL A 40 -1.923 -1.542 -0.172 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -3.437 -0.174 -1.546 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -2.143 0.804 -0.814 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -2.055 0.356 -2.534 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -3.035 -2.540 -2.129 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -1.636 -2.109 -3.140 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -1.450 -3.287 -1.818 1.00 0.00 H new ATOM 562 N GLU A 41 0.767 1.145 -0.407 1.00 0.00 N ATOM 563 CA GLU A 41 1.131 2.163 0.571 1.00 0.00 C ATOM 564 C GLU A 41 0.217 3.380 0.456 1.00 0.00 C ATOM 565 O GLU A 41 0.259 4.110 -0.534 1.00 0.00 O ATOM 566 CB GLU A 41 2.589 2.587 0.381 1.00 0.00 C ATOM 567 CG GLU A 41 2.914 3.939 0.995 1.00 0.00 C ATOM 568 CD GLU A 41 4.353 4.035 1.463 1.00 0.00 C ATOM 569 OE1 GLU A 41 5.256 4.071 0.601 1.00 0.00 O ATOM 570 OE2 GLU A 41 4.577 4.075 2.691 1.00 0.00 O ATOM 0 H GLU A 41 0.953 1.405 -1.376 1.00 0.00 H new ATOM 0 HA GLU A 41 1.012 1.733 1.566 1.00 0.00 H new ATOM 0 HB2 GLU A 41 3.239 1.831 0.822 1.00 0.00 H new ATOM 0 HB3 GLU A 41 2.814 2.618 -0.685 1.00 0.00 H new ATOM 0 HG2 GLU A 41 2.721 4.723 0.262 1.00 0.00 H new ATOM 0 HG3 GLU A 41 2.248 4.120 1.839 1.00 0.00 H new ATOM 577 N PHE A 42 -0.609 3.590 1.475 1.00 0.00 N ATOM 578 CA PHE A 42 -1.535 4.717 1.488 1.00 0.00 C ATOM 579 C PHE A 42 -0.803 6.019 1.799 1.00 0.00 C ATOM 580 O PHE A 42 -0.436 6.279 2.945 1.00 0.00 O ATOM 581 CB PHE A 42 -2.642 4.482 2.518 1.00 0.00 C ATOM 582 CG PHE A 42 -3.437 3.232 2.270 1.00 0.00 C ATOM 583 CD1 PHE A 42 -2.942 1.995 2.649 1.00 0.00 C ATOM 584 CD2 PHE A 42 -4.678 3.294 1.658 1.00 0.00 C ATOM 585 CE1 PHE A 42 -3.670 0.842 2.422 1.00 0.00 C ATOM 586 CE2 PHE A 42 -5.411 2.145 1.429 1.00 0.00 C ATOM 587 CZ PHE A 42 -4.906 0.918 1.811 1.00 0.00 C ATOM 0 H PHE A 42 -0.656 2.995 2.302 1.00 0.00 H new ATOM 0 HA PHE A 42 -1.982 4.800 0.497 1.00 0.00 H new ATOM 0 HB2 PHE A 42 -2.197 4.429 3.512 1.00 0.00 H new ATOM 0 HB3 PHE A 42 -3.317 5.338 2.516 1.00 0.00 H new ATOM 0 HD1 PHE A 42 -1.976 1.931 3.127 1.00 0.00 H new ATOM 0 HD2 PHE A 42 -5.077 4.251 1.356 1.00 0.00 H new ATOM 0 HE1 PHE A 42 -3.273 -0.116 2.722 1.00 0.00 H new ATOM 0 HE2 PHE A 42 -6.378 2.207 0.952 1.00 0.00 H new ATOM 0 HZ PHE A 42 -5.477 0.019 1.632 1.00 0.00 H new ATOM 597 N TYR A 43 -0.594 6.833 0.771 1.00 0.00 N ATOM 598 CA TYR A 43 0.096 8.107 0.933 1.00 0.00 C ATOM 599 C TYR A 43 -0.873 9.276 0.781 1.00 0.00 C ATOM 600 O TYR A 43 -2.041 9.088 0.443 1.00 0.00 O ATOM 601 CB TYR A 43 1.227 8.232 -0.090 1.00 0.00 C ATOM 602 CG TYR A 43 0.745 8.531 -1.492 1.00 0.00 C ATOM 603 CD1 TYR A 43 0.350 9.814 -1.852 1.00 0.00 C ATOM 604 CD2 TYR A 43 0.685 7.532 -2.455 1.00 0.00 C ATOM 605 CE1 TYR A 43 -0.092 10.092 -3.131 1.00 0.00 C ATOM 606 CE2 TYR A 43 0.247 7.802 -3.737 1.00 0.00 C ATOM 607 CZ TYR A 43 -0.141 9.083 -4.070 1.00 0.00 C ATOM 608 OH TYR A 43 -0.580 9.355 -5.346 1.00 0.00 O ATOM 0 H TYR A 43 -0.893 6.633 -0.184 1.00 0.00 H new ATOM 0 HA TYR A 43 0.518 8.137 1.938 1.00 0.00 H new ATOM 0 HB2 TYR A 43 1.907 9.022 0.228 1.00 0.00 H new ATOM 0 HB3 TYR A 43 1.799 7.304 -0.102 1.00 0.00 H new ATOM 0 HD1 TYR A 43 0.389 10.607 -1.120 1.00 0.00 H new ATOM 0 HD2 TYR A 43 0.986 6.527 -2.197 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -0.397 11.094 -3.394 1.00 0.00 H new ATOM 0 HE2 TYR A 43 0.209 7.014 -4.475 1.00 0.00 H new ATOM 0 HH TYR A 43 -0.552 8.536 -5.883 1.00 0.00 H new ATOM 618 N ALA A 44 -0.378 10.483 1.032 1.00 0.00 N ATOM 619 CA ALA A 44 -1.198 11.683 0.921 1.00 0.00 C ATOM 620 C ALA A 44 -0.447 12.795 0.197 1.00 0.00 C ATOM 621 O ALA A 44 0.626 13.228 0.616 1.00 0.00 O ATOM 622 CB ALA A 44 -1.637 12.152 2.301 1.00 0.00 C ATOM 0 H ALA A 44 0.587 10.656 1.314 1.00 0.00 H new ATOM 0 HA ALA A 44 -2.083 11.436 0.335 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -2.249 13.049 2.203 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -2.219 11.367 2.784 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -0.758 12.376 2.906 1.00 0.00 H new ATOM 628 N PRO A 45 -1.024 13.270 -0.918 1.00 0.00 N ATOM 629 CA PRO A 45 -0.426 14.339 -1.724 1.00 0.00 C ATOM 630 C PRO A 45 -0.458 15.688 -1.015 1.00 0.00 C ATOM 631 O PRO A 45 -0.071 16.708 -1.584 1.00 0.00 O ATOM 632 CB PRO A 45 -1.305 14.371 -2.977 1.00 0.00 C ATOM 633 CG PRO A 45 -2.618 13.824 -2.533 1.00 0.00 C ATOM 634 CD PRO A 45 -2.303 12.801 -1.475 1.00 0.00 C ATOM 0 HA PRO A 45 0.628 14.153 -1.930 1.00 0.00 H new ATOM 0 HB2 PRO A 45 -1.409 15.385 -3.362 1.00 0.00 H new ATOM 0 HB3 PRO A 45 -0.875 13.769 -3.777 1.00 0.00 H new ATOM 0 HG2 PRO A 45 -3.256 14.614 -2.135 1.00 0.00 H new ATOM 0 HG3 PRO A 45 -3.154 13.371 -3.367 1.00 0.00 H new ATOM 0 HD2 PRO A 45 -3.081 12.758 -0.713 1.00 0.00 H new ATOM 0 HD3 PRO A 45 -2.215 11.800 -1.897 1.00 0.00 H new ATOM 642 N TRP A 46 -0.922 15.686 0.229 1.00 0.00 N ATOM 643 CA TRP A 46 -1.004 16.911 1.017 1.00 0.00 C ATOM 644 C TRP A 46 -0.048 16.861 2.203 1.00 0.00 C ATOM 645 O TRP A 46 0.341 17.897 2.743 1.00 0.00 O ATOM 646 CB TRP A 46 -2.435 17.131 1.508 1.00 0.00 C ATOM 647 CG TRP A 46 -2.969 15.985 2.314 1.00 0.00 C ATOM 648 CD1 TRP A 46 -3.928 15.091 1.933 1.00 0.00 C ATOM 649 CD2 TRP A 46 -2.575 15.613 3.640 1.00 0.00 C ATOM 650 NE1 TRP A 46 -4.154 14.185 2.941 1.00 0.00 N ATOM 651 CE2 TRP A 46 -3.336 14.483 3.998 1.00 0.00 C ATOM 652 CE3 TRP A 46 -1.653 16.123 4.557 1.00 0.00 C ATOM 653 CZ2 TRP A 46 -3.202 13.858 5.235 1.00 0.00 C ATOM 654 CZ3 TRP A 46 -1.521 15.501 5.784 1.00 0.00 C ATOM 655 CH2 TRP A 46 -2.291 14.378 6.114 1.00 0.00 C ATOM 0 H TRP A 46 -1.247 14.850 0.714 1.00 0.00 H new ATOM 0 HA TRP A 46 -0.715 17.745 0.377 1.00 0.00 H new ATOM 0 HB2 TRP A 46 -2.469 18.038 2.112 1.00 0.00 H new ATOM 0 HB3 TRP A 46 -3.085 17.296 0.649 1.00 0.00 H new ATOM 0 HD1 TRP A 46 -4.435 15.095 0.979 1.00 0.00 H new ATOM 0 HE1 TRP A 46 -4.823 13.415 2.907 1.00 0.00 H new ATOM 0 HE3 TRP A 46 -1.054 16.988 4.312 1.00 0.00 H new ATOM 0 HZ2 TRP A 46 -3.796 12.993 5.492 1.00 0.00 H new ATOM 0 HZ3 TRP A 46 -0.812 15.887 6.501 1.00 0.00 H new ATOM 0 HH2 TRP A 46 -2.163 13.914 7.081 1.00 0.00 H new ATOM 666 N CYS A 47 0.327 15.651 2.604 1.00 0.00 N ATOM 667 CA CYS A 47 1.239 15.467 3.728 1.00 0.00 C ATOM 668 C CYS A 47 2.684 15.703 3.301 1.00 0.00 C ATOM 669 O CYS A 47 2.972 15.875 2.118 1.00 0.00 O ATOM 670 CB CYS A 47 1.089 14.059 4.308 1.00 0.00 C ATOM 671 SG CYS A 47 1.217 13.985 6.110 1.00 0.00 S ATOM 0 H CYS A 47 0.014 14.784 2.168 1.00 0.00 H new ATOM 0 HA CYS A 47 0.983 16.198 4.495 1.00 0.00 H new ATOM 0 HB2 CYS A 47 0.123 13.654 4.006 1.00 0.00 H new ATOM 0 HB3 CYS A 47 1.854 13.415 3.873 1.00 0.00 H new ATOM 0 HG CYS A 47 1.981 12.990 6.450 1.00 0.00 H new ATOM 677 N GLY A 48 3.589 15.711 4.275 1.00 0.00 N ATOM 678 CA GLY A 48 4.994 15.929 3.980 1.00 0.00 C ATOM 679 C GLY A 48 5.765 14.631 3.844 1.00 0.00 C ATOM 680 O GLY A 48 6.170 14.253 2.745 1.00 0.00 O ATOM 0 H GLY A 48 3.375 15.571 5.262 1.00 0.00 H new ATOM 0 HA2 GLY A 48 5.084 16.500 3.056 1.00 0.00 H new ATOM 0 HA3 GLY A 48 5.439 16.531 4.772 1.00 0.00 H new ATOM 684 N HIS A 49 5.972 13.947 4.966 1.00 0.00 N ATOM 685 CA HIS A 49 6.702 12.685 4.968 1.00 0.00 C ATOM 686 C HIS A 49 6.239 11.788 3.824 1.00 0.00 C ATOM 687 O HIS A 49 6.991 10.938 3.345 1.00 0.00 O ATOM 688 CB HIS A 49 6.514 11.965 6.303 1.00 0.00 C ATOM 689 CG HIS A 49 5.108 12.013 6.817 1.00 0.00 C ATOM 690 ND1 HIS A 49 4.784 12.455 8.082 1.00 0.00 N ATOM 691 CD2 HIS A 49 3.938 11.672 6.228 1.00 0.00 C ATOM 692 CE1 HIS A 49 3.476 12.383 8.250 1.00 0.00 C ATOM 693 NE2 HIS A 49 2.939 11.911 7.139 1.00 0.00 N ATOM 0 H HIS A 49 5.644 14.246 5.884 1.00 0.00 H new ATOM 0 HA HIS A 49 7.760 12.906 4.828 1.00 0.00 H new ATOM 0 HB2 HIS A 49 6.815 10.924 6.190 1.00 0.00 H new ATOM 0 HB3 HIS A 49 7.178 12.411 7.043 1.00 0.00 H new ATOM 0 HD1 HIS A 49 5.451 12.786 8.779 1.00 0.00 H new ATOM 0 HD2 HIS A 49 3.813 11.284 5.228 1.00 0.00 H new ATOM 0 HE1 HIS A 49 2.937 12.662 9.143 1.00 0.00 H new ATOM 702 N CYS A 50 4.998 11.982 3.391 1.00 0.00 N ATOM 703 CA CYS A 50 4.434 11.189 2.304 1.00 0.00 C ATOM 704 C CYS A 50 5.033 11.602 0.963 1.00 0.00 C ATOM 705 O CYS A 50 5.497 10.760 0.195 1.00 0.00 O ATOM 706 CB CYS A 50 2.913 11.345 2.267 1.00 0.00 C ATOM 707 SG CYS A 50 2.044 10.408 3.546 1.00 0.00 S ATOM 0 H CYS A 50 4.363 12.681 3.776 1.00 0.00 H new ATOM 0 HA CYS A 50 4.680 10.143 2.485 1.00 0.00 H new ATOM 0 HB2 CYS A 50 2.664 12.401 2.373 1.00 0.00 H new ATOM 0 HB3 CYS A 50 2.550 11.028 1.289 1.00 0.00 H new ATOM 0 HG CYS A 50 1.067 11.123 4.020 1.00 0.00 H new ATOM 713 N GLN A 51 5.017 12.902 0.689 1.00 0.00 N ATOM 714 CA GLN A 51 5.556 13.426 -0.561 1.00 0.00 C ATOM 715 C GLN A 51 7.048 13.132 -0.675 1.00 0.00 C ATOM 716 O GLN A 51 7.628 13.229 -1.756 1.00 0.00 O ATOM 717 CB GLN A 51 5.312 14.933 -0.654 1.00 0.00 C ATOM 718 CG GLN A 51 3.839 15.311 -0.667 1.00 0.00 C ATOM 719 CD GLN A 51 3.617 16.799 -0.478 1.00 0.00 C ATOM 720 OE1 GLN A 51 4.560 17.590 -0.526 1.00 0.00 O ATOM 721 NE2 GLN A 51 2.366 17.188 -0.263 1.00 0.00 N ATOM 0 H GLN A 51 4.637 13.612 1.315 1.00 0.00 H new ATOM 0 HA GLN A 51 5.043 12.931 -1.385 1.00 0.00 H new ATOM 0 HB2 GLN A 51 5.797 15.424 0.190 1.00 0.00 H new ATOM 0 HB3 GLN A 51 5.784 15.314 -1.559 1.00 0.00 H new ATOM 0 HG2 GLN A 51 3.396 14.999 -1.613 1.00 0.00 H new ATOM 0 HG3 GLN A 51 3.321 14.767 0.123 1.00 0.00 H new ATOM 0 HE21 GLN A 51 1.616 16.498 -0.231 1.00 0.00 H new ATOM 0 HE22 GLN A 51 2.155 18.177 -0.130 1.00 0.00 H new ATOM 730 N ARG A 52 7.663 12.774 0.447 1.00 0.00 N ATOM 731 CA ARG A 52 9.089 12.469 0.473 1.00 0.00 C ATOM 732 C ARG A 52 9.324 10.964 0.381 1.00 0.00 C ATOM 733 O ARG A 52 10.463 10.508 0.273 1.00 0.00 O ATOM 734 CB ARG A 52 9.727 13.018 1.751 1.00 0.00 C ATOM 735 CG ARG A 52 9.384 14.473 2.026 1.00 0.00 C ATOM 736 CD ARG A 52 10.487 15.167 2.808 1.00 0.00 C ATOM 737 NE ARG A 52 10.349 16.621 2.777 1.00 0.00 N ATOM 738 CZ ARG A 52 11.357 17.459 2.989 1.00 0.00 C ATOM 739 NH1 ARG A 52 12.571 16.991 3.247 1.00 0.00 N ATOM 740 NH2 ARG A 52 11.153 18.769 2.944 1.00 0.00 N ATOM 0 H ARG A 52 7.197 12.688 1.350 1.00 0.00 H new ATOM 0 HA ARG A 52 9.553 12.946 -0.390 1.00 0.00 H new ATOM 0 HB2 ARG A 52 9.405 12.411 2.597 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.810 12.916 1.679 1.00 0.00 H new ATOM 0 HG2 ARG A 52 9.222 14.994 1.083 1.00 0.00 H new ATOM 0 HG3 ARG A 52 8.450 14.528 2.585 1.00 0.00 H new ATOM 0 HD2 ARG A 52 10.469 14.823 3.842 1.00 0.00 H new ATOM 0 HD3 ARG A 52 11.456 14.886 2.395 1.00 0.00 H new ATOM 0 HE ARG A 52 9.428 17.014 2.582 1.00 0.00 H new ATOM 0 HH11 ARG A 52 12.733 15.985 3.283 1.00 0.00 H new ATOM 0 HH12 ARG A 52 13.343 17.638 3.409 1.00 0.00 H new ATOM 0 HH21 ARG A 52 10.221 19.134 2.746 1.00 0.00 H new ATOM 0 HH22 ARG A 52 11.928 19.412 3.107 1.00 0.00 H new ATOM 754 N LEU A 53 8.239 10.197 0.424 1.00 0.00 N ATOM 755 CA LEU A 53 8.327 8.743 0.345 1.00 0.00 C ATOM 756 C LEU A 53 8.059 8.258 -1.076 1.00 0.00 C ATOM 757 O LEU A 53 7.954 7.056 -1.323 1.00 0.00 O ATOM 758 CB LEU A 53 7.331 8.100 1.313 1.00 0.00 C ATOM 759 CG LEU A 53 7.462 6.588 1.503 1.00 0.00 C ATOM 760 CD1 LEU A 53 8.831 6.237 2.063 1.00 0.00 C ATOM 761 CD2 LEU A 53 6.360 6.069 2.415 1.00 0.00 C ATOM 0 H LEU A 53 7.289 10.558 0.513 1.00 0.00 H new ATOM 0 HA LEU A 53 9.338 8.448 0.624 1.00 0.00 H new ATOM 0 HB2 LEU A 53 7.439 8.579 2.286 1.00 0.00 H new ATOM 0 HB3 LEU A 53 6.322 8.316 0.962 1.00 0.00 H new ATOM 0 HG LEU A 53 7.357 6.108 0.530 1.00 0.00 H new ATOM 0 HD11 LEU A 53 8.906 5.157 2.191 1.00 0.00 H new ATOM 0 HD12 LEU A 53 9.604 6.575 1.373 1.00 0.00 H new ATOM 0 HD13 LEU A 53 8.966 6.727 3.027 1.00 0.00 H new ATOM 0 HD21 LEU A 53 6.468 4.992 2.539 1.00 0.00 H new ATOM 0 HD22 LEU A 53 6.433 6.556 3.388 1.00 0.00 H new ATOM 0 HD23 LEU A 53 5.388 6.287 1.972 1.00 0.00 H new ATOM 773 N THR A 54 7.952 9.200 -2.007 1.00 0.00 N ATOM 774 CA THR A 54 7.698 8.868 -3.404 1.00 0.00 C ATOM 775 C THR A 54 8.863 8.090 -4.005 1.00 0.00 C ATOM 776 O THR A 54 8.690 7.022 -4.593 1.00 0.00 O ATOM 777 CB THR A 54 7.453 10.135 -4.246 1.00 0.00 C ATOM 778 OG1 THR A 54 7.001 11.202 -3.405 1.00 0.00 O ATOM 779 CG2 THR A 54 6.423 9.869 -5.334 1.00 0.00 C ATOM 0 H THR A 54 8.037 10.199 -1.820 1.00 0.00 H new ATOM 0 HA THR A 54 6.802 8.248 -3.424 1.00 0.00 H new ATOM 0 HB THR A 54 8.393 10.419 -4.718 1.00 0.00 H new ATOM 0 HG1 THR A 54 7.774 11.667 -3.023 1.00 0.00 H new ATOM 0 HG21 THR A 54 6.266 10.777 -5.916 1.00 0.00 H new ATOM 0 HG22 THR A 54 6.783 9.076 -5.989 1.00 0.00 H new ATOM 0 HG23 THR A 54 5.482 9.563 -4.877 1.00 0.00 H new ATOM 787 N PRO A 55 10.080 8.634 -3.855 1.00 0.00 N ATOM 788 CA PRO A 55 11.297 8.006 -4.375 1.00 0.00 C ATOM 789 C PRO A 55 11.664 6.736 -3.616 1.00 0.00 C ATOM 790 O PRO A 55 12.130 5.762 -4.207 1.00 0.00 O ATOM 791 CB PRO A 55 12.367 9.081 -4.168 1.00 0.00 C ATOM 792 CG PRO A 55 11.858 9.909 -3.039 1.00 0.00 C ATOM 793 CD PRO A 55 10.360 9.905 -3.164 1.00 0.00 C ATOM 0 HA PRO A 55 11.183 7.693 -5.413 1.00 0.00 H new ATOM 0 HB2 PRO A 55 13.333 8.637 -3.929 1.00 0.00 H new ATOM 0 HB3 PRO A 55 12.505 9.680 -5.068 1.00 0.00 H new ATOM 0 HG2 PRO A 55 12.171 9.495 -2.080 1.00 0.00 H new ATOM 0 HG3 PRO A 55 12.251 10.924 -3.092 1.00 0.00 H new ATOM 0 HD2 PRO A 55 9.875 9.948 -2.189 1.00 0.00 H new ATOM 0 HD3 PRO A 55 10.002 10.761 -3.736 1.00 0.00 H new ATOM 801 N GLU A 56 11.451 6.753 -2.304 1.00 0.00 N ATOM 802 CA GLU A 56 11.760 5.601 -1.465 1.00 0.00 C ATOM 803 C GLU A 56 10.840 4.428 -1.790 1.00 0.00 C ATOM 804 O GLU A 56 11.247 3.269 -1.720 1.00 0.00 O ATOM 805 CB GLU A 56 11.631 5.970 0.015 1.00 0.00 C ATOM 806 CG GLU A 56 12.658 6.988 0.480 1.00 0.00 C ATOM 807 CD GLU A 56 14.083 6.537 0.225 1.00 0.00 C ATOM 808 OE1 GLU A 56 14.321 5.312 0.190 1.00 0.00 O ATOM 809 OE2 GLU A 56 14.961 7.410 0.059 1.00 0.00 O ATOM 0 H GLU A 56 11.066 7.551 -1.799 1.00 0.00 H new ATOM 0 HA GLU A 56 12.788 5.301 -1.669 1.00 0.00 H new ATOM 0 HB2 GLU A 56 10.632 6.366 0.196 1.00 0.00 H new ATOM 0 HB3 GLU A 56 11.730 5.066 0.616 1.00 0.00 H new ATOM 0 HG2 GLU A 56 12.483 7.934 -0.032 1.00 0.00 H new ATOM 0 HG3 GLU A 56 12.524 7.172 1.546 1.00 0.00 H new ATOM 816 N TRP A 57 9.598 4.739 -2.145 1.00 0.00 N ATOM 817 CA TRP A 57 8.620 3.711 -2.481 1.00 0.00 C ATOM 818 C TRP A 57 8.821 3.213 -3.907 1.00 0.00 C ATOM 819 O TRP A 57 8.711 2.017 -4.179 1.00 0.00 O ATOM 820 CB TRP A 57 7.200 4.256 -2.314 1.00 0.00 C ATOM 821 CG TRP A 57 6.149 3.188 -2.325 1.00 0.00 C ATOM 822 CD1 TRP A 57 5.084 3.095 -3.175 1.00 0.00 C ATOM 823 CD2 TRP A 57 6.061 2.063 -1.444 1.00 0.00 C ATOM 824 NE1 TRP A 57 4.340 1.979 -2.875 1.00 0.00 N ATOM 825 CE2 TRP A 57 4.918 1.329 -1.818 1.00 0.00 C ATOM 826 CE3 TRP A 57 6.838 1.603 -0.377 1.00 0.00 C ATOM 827 CZ2 TRP A 57 4.535 0.163 -1.161 1.00 0.00 C ATOM 828 CZ3 TRP A 57 6.456 0.445 0.274 1.00 0.00 C ATOM 829 CH2 TRP A 57 5.314 -0.265 -0.120 1.00 0.00 C ATOM 0 H TRP A 57 9.245 5.694 -2.207 1.00 0.00 H new ATOM 0 HA TRP A 57 8.763 2.872 -1.800 1.00 0.00 H new ATOM 0 HB2 TRP A 57 7.138 4.807 -1.376 1.00 0.00 H new ATOM 0 HB3 TRP A 57 6.995 4.966 -3.115 1.00 0.00 H new ATOM 0 HD1 TRP A 57 4.860 3.795 -3.966 1.00 0.00 H new ATOM 0 HE1 TRP A 57 3.494 1.683 -3.361 1.00 0.00 H new ATOM 0 HE3 TRP A 57 7.721 2.143 -0.067 1.00 0.00 H new ATOM 0 HZ2 TRP A 57 3.654 -0.385 -1.462 1.00 0.00 H new ATOM 0 HZ3 TRP A 57 7.048 0.081 1.101 1.00 0.00 H new ATOM 0 HH2 TRP A 57 5.043 -1.167 0.408 1.00 0.00 H new ATOM 840 N LYS A 58 9.118 4.136 -4.816 1.00 0.00 N ATOM 841 CA LYS A 58 9.337 3.790 -6.215 1.00 0.00 C ATOM 842 C LYS A 58 10.471 2.779 -6.355 1.00 0.00 C ATOM 843 O LYS A 58 10.317 1.744 -7.003 1.00 0.00 O ATOM 844 CB LYS A 58 9.657 5.046 -7.029 1.00 0.00 C ATOM 845 CG LYS A 58 8.423 5.774 -7.534 1.00 0.00 C ATOM 846 CD LYS A 58 8.778 7.126 -8.130 1.00 0.00 C ATOM 847 CE LYS A 58 8.700 8.232 -7.089 1.00 0.00 C ATOM 848 NZ LYS A 58 8.882 9.579 -7.697 1.00 0.00 N ATOM 0 H LYS A 58 9.213 5.130 -4.608 1.00 0.00 H new ATOM 0 HA LYS A 58 8.422 3.339 -6.599 1.00 0.00 H new ATOM 0 HB2 LYS A 58 10.244 5.728 -6.414 1.00 0.00 H new ATOM 0 HB3 LYS A 58 10.279 4.769 -7.880 1.00 0.00 H new ATOM 0 HG2 LYS A 58 7.922 5.164 -8.286 1.00 0.00 H new ATOM 0 HG3 LYS A 58 7.719 5.911 -6.713 1.00 0.00 H new ATOM 0 HD2 LYS A 58 9.784 7.088 -8.547 1.00 0.00 H new ATOM 0 HD3 LYS A 58 8.100 7.351 -8.953 1.00 0.00 H new ATOM 0 HE2 LYS A 58 7.735 8.189 -6.585 1.00 0.00 H new ATOM 0 HE3 LYS A 58 9.464 8.070 -6.329 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 8.822 10.306 -6.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 9.813 9.629 -8.157 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 8.138 9.744 -8.404 1.00 0.00 H new ATOM 862 N LYS A 59 11.609 3.085 -5.741 1.00 0.00 N ATOM 863 CA LYS A 59 12.769 2.203 -5.794 1.00 0.00 C ATOM 864 C LYS A 59 12.361 0.754 -5.548 1.00 0.00 C ATOM 865 O LYS A 59 12.651 -0.128 -6.356 1.00 0.00 O ATOM 866 CB LYS A 59 13.811 2.634 -4.760 1.00 0.00 C ATOM 867 CG LYS A 59 14.782 3.682 -5.275 1.00 0.00 C ATOM 868 CD LYS A 59 15.776 4.096 -4.202 1.00 0.00 C ATOM 869 CE LYS A 59 15.174 5.119 -3.251 1.00 0.00 C ATOM 870 NZ LYS A 59 16.221 5.957 -2.604 1.00 0.00 N ATOM 0 H LYS A 59 11.753 3.938 -5.200 1.00 0.00 H new ATOM 0 HA LYS A 59 13.205 2.275 -6.791 1.00 0.00 H new ATOM 0 HB2 LYS A 59 13.298 3.026 -3.882 1.00 0.00 H new ATOM 0 HB3 LYS A 59 14.373 1.758 -4.436 1.00 0.00 H new ATOM 0 HG2 LYS A 59 15.319 3.289 -6.138 1.00 0.00 H new ATOM 0 HG3 LYS A 59 14.228 4.557 -5.616 1.00 0.00 H new ATOM 0 HD2 LYS A 59 16.094 3.218 -3.640 1.00 0.00 H new ATOM 0 HD3 LYS A 59 16.667 4.514 -4.671 1.00 0.00 H new ATOM 0 HE2 LYS A 59 14.482 5.760 -3.797 1.00 0.00 H new ATOM 0 HE3 LYS A 59 14.595 4.605 -2.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 15.796 6.509 -1.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 16.968 5.344 -2.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 16.631 6.604 -3.307 1.00 0.00 H new ATOM 884 N ALA A 60 11.686 0.515 -4.428 1.00 0.00 N ATOM 885 CA ALA A 60 11.236 -0.826 -4.078 1.00 0.00 C ATOM 886 C ALA A 60 10.350 -1.411 -5.173 1.00 0.00 C ATOM 887 O ALA A 60 10.437 -2.597 -5.488 1.00 0.00 O ATOM 888 CB ALA A 60 10.494 -0.804 -2.750 1.00 0.00 C ATOM 0 H ALA A 60 11.439 1.234 -3.748 1.00 0.00 H new ATOM 0 HA ALA A 60 12.115 -1.463 -3.979 1.00 0.00 H new ATOM 0 HB1 ALA A 60 10.164 -1.812 -2.501 1.00 0.00 H new ATOM 0 HB2 ALA A 60 11.158 -0.436 -1.968 1.00 0.00 H new ATOM 0 HB3 ALA A 60 9.628 -0.147 -2.828 1.00 0.00 H new ATOM 894 N ALA A 61 9.496 -0.570 -5.748 1.00 0.00 N ATOM 895 CA ALA A 61 8.594 -1.004 -6.808 1.00 0.00 C ATOM 896 C ALA A 61 9.371 -1.452 -8.040 1.00 0.00 C ATOM 897 O ALA A 61 8.979 -2.398 -8.725 1.00 0.00 O ATOM 898 CB ALA A 61 7.627 0.115 -7.168 1.00 0.00 C ATOM 0 H ALA A 61 9.410 0.415 -5.498 1.00 0.00 H new ATOM 0 HA ALA A 61 8.024 -1.858 -6.441 1.00 0.00 H new ATOM 0 HB1 ALA A 61 6.959 -0.222 -7.961 1.00 0.00 H new ATOM 0 HB2 ALA A 61 7.041 0.386 -6.290 1.00 0.00 H new ATOM 0 HB3 ALA A 61 8.188 0.984 -7.512 1.00 0.00 H new ATOM 904 N THR A 62 10.476 -0.767 -8.320 1.00 0.00 N ATOM 905 CA THR A 62 11.307 -1.094 -9.471 1.00 0.00 C ATOM 906 C THR A 62 11.907 -2.489 -9.339 1.00 0.00 C ATOM 907 O THR A 62 11.824 -3.300 -10.260 1.00 0.00 O ATOM 908 CB THR A 62 12.447 -0.073 -9.649 1.00 0.00 C ATOM 909 OG1 THR A 62 11.905 1.242 -9.818 1.00 0.00 O ATOM 910 CG2 THR A 62 13.310 -0.429 -10.850 1.00 0.00 C ATOM 0 H THR A 62 10.816 0.018 -7.764 1.00 0.00 H new ATOM 0 HA THR A 62 10.659 -1.062 -10.347 1.00 0.00 H new ATOM 0 HB THR A 62 13.069 -0.097 -8.754 1.00 0.00 H new ATOM 0 HG1 THR A 62 11.413 1.499 -9.010 1.00 0.00 H new ATOM 0 HG21 THR A 62 14.108 0.306 -10.955 1.00 0.00 H new ATOM 0 HG22 THR A 62 13.745 -1.418 -10.705 1.00 0.00 H new ATOM 0 HG23 THR A 62 12.697 -0.430 -11.751 1.00 0.00 H new ATOM 918 N ALA A 63 12.510 -2.762 -8.186 1.00 0.00 N ATOM 919 CA ALA A 63 13.121 -4.061 -7.932 1.00 0.00 C ATOM 920 C ALA A 63 12.061 -5.147 -7.787 1.00 0.00 C ATOM 921 O ALA A 63 12.180 -6.227 -8.367 1.00 0.00 O ATOM 922 CB ALA A 63 13.991 -4.000 -6.686 1.00 0.00 C ATOM 0 H ALA A 63 12.588 -2.101 -7.413 1.00 0.00 H new ATOM 0 HA ALA A 63 13.748 -4.314 -8.787 1.00 0.00 H new ATOM 0 HB1 ALA A 63 14.441 -4.977 -6.508 1.00 0.00 H new ATOM 0 HB2 ALA A 63 14.777 -3.259 -6.827 1.00 0.00 H new ATOM 0 HB3 ALA A 63 13.379 -3.721 -5.828 1.00 0.00 H new ATOM 928 N LEU A 64 11.024 -4.855 -7.010 1.00 0.00 N ATOM 929 CA LEU A 64 9.942 -5.808 -6.788 1.00 0.00 C ATOM 930 C LEU A 64 8.920 -5.745 -7.919 1.00 0.00 C ATOM 931 O LEU A 64 7.850 -6.348 -7.838 1.00 0.00 O ATOM 932 CB LEU A 64 9.256 -5.528 -5.449 1.00 0.00 C ATOM 933 CG LEU A 64 10.183 -5.265 -4.262 1.00 0.00 C ATOM 934 CD1 LEU A 64 9.510 -4.348 -3.252 1.00 0.00 C ATOM 935 CD2 LEU A 64 10.593 -6.575 -3.606 1.00 0.00 C ATOM 0 H LEU A 64 10.909 -3.966 -6.523 1.00 0.00 H new ATOM 0 HA LEU A 64 10.372 -6.810 -6.767 1.00 0.00 H new ATOM 0 HB2 LEU A 64 8.602 -4.665 -5.572 1.00 0.00 H new ATOM 0 HB3 LEU A 64 8.619 -6.378 -5.205 1.00 0.00 H new ATOM 0 HG LEU A 64 11.081 -4.769 -4.629 1.00 0.00 H new ATOM 0 HD11 LEU A 64 10.185 -4.172 -2.414 1.00 0.00 H new ATOM 0 HD12 LEU A 64 9.267 -3.398 -3.728 1.00 0.00 H new ATOM 0 HD13 LEU A 64 8.595 -4.816 -2.889 1.00 0.00 H new ATOM 0 HD21 LEU A 64 11.253 -6.369 -2.763 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.705 -7.098 -3.252 1.00 0.00 H new ATOM 0 HD23 LEU A 64 11.116 -7.198 -4.332 1.00 0.00 H new ATOM 947 N LYS A 65 9.258 -5.013 -8.974 1.00 0.00 N ATOM 948 CA LYS A 65 8.373 -4.873 -10.125 1.00 0.00 C ATOM 949 C LYS A 65 7.849 -6.233 -10.576 1.00 0.00 C ATOM 950 O LYS A 65 6.646 -6.414 -10.764 1.00 0.00 O ATOM 951 CB LYS A 65 9.108 -4.189 -11.280 1.00 0.00 C ATOM 952 CG LYS A 65 8.481 -4.449 -12.639 1.00 0.00 C ATOM 953 CD LYS A 65 9.207 -3.696 -13.741 1.00 0.00 C ATOM 954 CE LYS A 65 8.702 -2.267 -13.865 1.00 0.00 C ATOM 955 NZ LYS A 65 9.292 -1.570 -15.042 1.00 0.00 N ATOM 0 H LYS A 65 10.140 -4.507 -9.057 1.00 0.00 H new ATOM 0 HA LYS A 65 7.525 -4.257 -9.827 1.00 0.00 H new ATOM 0 HB2 LYS A 65 9.131 -3.114 -11.099 1.00 0.00 H new ATOM 0 HB3 LYS A 65 10.143 -4.532 -11.295 1.00 0.00 H new ATOM 0 HG2 LYS A 65 8.502 -5.518 -12.852 1.00 0.00 H new ATOM 0 HG3 LYS A 65 7.433 -4.149 -12.621 1.00 0.00 H new ATOM 0 HD2 LYS A 65 10.277 -3.688 -13.534 1.00 0.00 H new ATOM 0 HD3 LYS A 65 9.070 -4.215 -14.689 1.00 0.00 H new ATOM 0 HE2 LYS A 65 7.616 -2.272 -13.953 1.00 0.00 H new ATOM 0 HE3 LYS A 65 8.946 -1.716 -12.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 9.968 -0.850 -14.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 9.785 -2.261 -15.643 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 8.536 -1.112 -15.589 1.00 0.00 H new ATOM 969 N ASP A 66 8.760 -7.185 -10.747 1.00 0.00 N ATOM 970 CA ASP A 66 8.389 -8.530 -11.174 1.00 0.00 C ATOM 971 C ASP A 66 8.258 -9.464 -9.975 1.00 0.00 C ATOM 972 O ASP A 66 7.658 -10.534 -10.072 1.00 0.00 O ATOM 973 CB ASP A 66 9.425 -9.080 -12.155 1.00 0.00 C ATOM 974 CG ASP A 66 9.201 -8.588 -13.571 1.00 0.00 C ATOM 975 OD1 ASP A 66 8.252 -9.071 -14.224 1.00 0.00 O ATOM 976 OD2 ASP A 66 9.974 -7.720 -14.028 1.00 0.00 O ATOM 0 H ASP A 66 9.760 -7.051 -10.597 1.00 0.00 H new ATOM 0 HA ASP A 66 7.422 -8.473 -11.674 1.00 0.00 H new ATOM 0 HB2 ASP A 66 10.423 -8.789 -11.826 1.00 0.00 H new ATOM 0 HB3 ASP A 66 9.390 -10.169 -12.142 1.00 0.00 H new ATOM 981 N VAL A 67 8.826 -9.052 -8.846 1.00 0.00 N ATOM 982 CA VAL A 67 8.773 -9.852 -7.628 1.00 0.00 C ATOM 983 C VAL A 67 7.470 -9.616 -6.872 1.00 0.00 C ATOM 984 O VAL A 67 6.666 -10.532 -6.700 1.00 0.00 O ATOM 985 CB VAL A 67 9.959 -9.535 -6.697 1.00 0.00 C ATOM 986 CG1 VAL A 67 10.255 -10.719 -5.789 1.00 0.00 C ATOM 987 CG2 VAL A 67 11.187 -9.156 -7.510 1.00 0.00 C ATOM 0 H VAL A 67 9.328 -8.169 -8.750 1.00 0.00 H new ATOM 0 HA VAL A 67 8.829 -10.897 -7.932 1.00 0.00 H new ATOM 0 HB VAL A 67 9.690 -8.685 -6.070 1.00 0.00 H new ATOM 0 HG11 VAL A 67 11.095 -10.477 -5.138 1.00 0.00 H new ATOM 0 HG12 VAL A 67 9.377 -10.940 -5.181 1.00 0.00 H new ATOM 0 HG13 VAL A 67 10.504 -11.589 -6.396 1.00 0.00 H new ATOM 0 HG21 VAL A 67 12.015 -8.935 -6.837 1.00 0.00 H new ATOM 0 HG22 VAL A 67 11.461 -9.985 -8.163 1.00 0.00 H new ATOM 0 HG23 VAL A 67 10.966 -8.276 -8.114 1.00 0.00 H new ATOM 997 N VAL A 68 7.268 -8.382 -6.422 1.00 0.00 N ATOM 998 CA VAL A 68 6.062 -8.024 -5.685 1.00 0.00 C ATOM 999 C VAL A 68 5.424 -6.762 -6.255 1.00 0.00 C ATOM 1000 O VAL A 68 6.052 -5.705 -6.307 1.00 0.00 O ATOM 1001 CB VAL A 68 6.362 -7.805 -4.191 1.00 0.00 C ATOM 1002 CG1 VAL A 68 5.115 -7.332 -3.460 1.00 0.00 C ATOM 1003 CG2 VAL A 68 6.905 -9.081 -3.564 1.00 0.00 C ATOM 0 H VAL A 68 7.924 -7.613 -6.555 1.00 0.00 H new ATOM 0 HA VAL A 68 5.368 -8.858 -5.790 1.00 0.00 H new ATOM 0 HB VAL A 68 7.123 -7.030 -4.101 1.00 0.00 H new ATOM 0 HG11 VAL A 68 5.346 -7.183 -2.405 1.00 0.00 H new ATOM 0 HG12 VAL A 68 4.774 -6.392 -3.893 1.00 0.00 H new ATOM 0 HG13 VAL A 68 4.330 -8.082 -3.557 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.112 -8.908 -2.508 1.00 0.00 H new ATOM 0 HG22 VAL A 68 6.168 -9.878 -3.664 1.00 0.00 H new ATOM 0 HG23 VAL A 68 7.825 -9.372 -4.071 1.00 0.00 H new ATOM 1013 N LYS A 69 4.171 -6.880 -6.681 1.00 0.00 N ATOM 1014 CA LYS A 69 3.445 -5.749 -7.245 1.00 0.00 C ATOM 1015 C LYS A 69 3.312 -4.623 -6.224 1.00 0.00 C ATOM 1016 O LYS A 69 2.468 -4.680 -5.330 1.00 0.00 O ATOM 1017 CB LYS A 69 2.058 -6.191 -7.717 1.00 0.00 C ATOM 1018 CG LYS A 69 2.087 -7.068 -8.956 1.00 0.00 C ATOM 1019 CD LYS A 69 2.009 -6.240 -10.228 1.00 0.00 C ATOM 1020 CE LYS A 69 2.399 -7.057 -11.450 1.00 0.00 C ATOM 1021 NZ LYS A 69 1.511 -8.238 -11.633 1.00 0.00 N ATOM 0 H LYS A 69 3.637 -7.748 -6.646 1.00 0.00 H new ATOM 0 HA LYS A 69 4.011 -5.376 -8.099 1.00 0.00 H new ATOM 0 HB2 LYS A 69 1.565 -6.733 -6.910 1.00 0.00 H new ATOM 0 HB3 LYS A 69 1.455 -5.307 -7.922 1.00 0.00 H new ATOM 0 HG2 LYS A 69 3.002 -7.660 -8.962 1.00 0.00 H new ATOM 0 HG3 LYS A 69 1.253 -7.769 -8.926 1.00 0.00 H new ATOM 0 HD2 LYS A 69 0.996 -5.858 -10.353 1.00 0.00 H new ATOM 0 HD3 LYS A 69 2.667 -5.376 -10.142 1.00 0.00 H new ATOM 0 HE2 LYS A 69 2.353 -6.427 -12.338 1.00 0.00 H new ATOM 0 HE3 LYS A 69 3.432 -7.391 -11.349 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 1.732 -8.702 -12.537 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 1.662 -8.910 -10.854 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 0.518 -7.929 -11.636 1.00 0.00 H new ATOM 1035 N VAL A 70 4.149 -3.601 -6.365 1.00 0.00 N ATOM 1036 CA VAL A 70 4.123 -2.461 -5.456 1.00 0.00 C ATOM 1037 C VAL A 70 3.244 -1.342 -6.003 1.00 0.00 C ATOM 1038 O VAL A 70 3.656 -0.587 -6.883 1.00 0.00 O ATOM 1039 CB VAL A 70 5.540 -1.909 -5.207 1.00 0.00 C ATOM 1040 CG1 VAL A 70 5.488 -0.701 -4.285 1.00 0.00 C ATOM 1041 CG2 VAL A 70 6.438 -2.993 -4.629 1.00 0.00 C ATOM 0 H VAL A 70 4.854 -3.539 -7.100 1.00 0.00 H new ATOM 0 HA VAL A 70 3.708 -2.818 -4.513 1.00 0.00 H new ATOM 0 HB VAL A 70 5.960 -1.590 -6.161 1.00 0.00 H new ATOM 0 HG11 VAL A 70 6.498 -0.325 -4.121 1.00 0.00 H new ATOM 0 HG12 VAL A 70 4.880 0.080 -4.742 1.00 0.00 H new ATOM 0 HG13 VAL A 70 5.049 -0.991 -3.330 1.00 0.00 H new ATOM 0 HG21 VAL A 70 7.435 -2.587 -4.459 1.00 0.00 H new ATOM 0 HG22 VAL A 70 6.023 -3.344 -3.684 1.00 0.00 H new ATOM 0 HG23 VAL A 70 6.500 -3.826 -5.329 1.00 0.00 H new ATOM 1051 N GLY A 71 2.027 -1.241 -5.475 1.00 0.00 N ATOM 1052 CA GLY A 71 1.108 -0.211 -5.923 1.00 0.00 C ATOM 1053 C GLY A 71 1.135 1.016 -5.034 1.00 0.00 C ATOM 1054 O GLY A 71 2.067 1.204 -4.252 1.00 0.00 O ATOM 0 H GLY A 71 1.662 -1.854 -4.746 1.00 0.00 H new ATOM 0 HA2 GLY A 71 1.360 0.078 -6.943 1.00 0.00 H new ATOM 0 HA3 GLY A 71 0.096 -0.616 -5.947 1.00 0.00 H new ATOM 1058 N ALA A 72 0.113 1.856 -5.155 1.00 0.00 N ATOM 1059 CA ALA A 72 0.023 3.072 -4.356 1.00 0.00 C ATOM 1060 C ALA A 72 -1.389 3.647 -4.388 1.00 0.00 C ATOM 1061 O ALA A 72 -1.964 3.849 -5.457 1.00 0.00 O ATOM 1062 CB ALA A 72 1.026 4.103 -4.851 1.00 0.00 C ATOM 0 H ALA A 72 -0.665 1.717 -5.799 1.00 0.00 H new ATOM 0 HA ALA A 72 0.260 2.817 -3.323 1.00 0.00 H new ATOM 0 HB1 ALA A 72 0.948 5.006 -4.246 1.00 0.00 H new ATOM 0 HB2 ALA A 72 2.035 3.698 -4.770 1.00 0.00 H new ATOM 0 HB3 ALA A 72 0.815 4.345 -5.893 1.00 0.00 H new ATOM 1068 N VAL A 73 -1.943 3.909 -3.208 1.00 0.00 N ATOM 1069 CA VAL A 73 -3.288 4.461 -3.101 1.00 0.00 C ATOM 1070 C VAL A 73 -3.275 5.800 -2.372 1.00 0.00 C ATOM 1071 O VAL A 73 -2.783 5.903 -1.250 1.00 0.00 O ATOM 1072 CB VAL A 73 -4.234 3.496 -2.362 1.00 0.00 C ATOM 1073 CG1 VAL A 73 -5.389 4.259 -1.732 1.00 0.00 C ATOM 1074 CG2 VAL A 73 -4.747 2.423 -3.311 1.00 0.00 C ATOM 0 H VAL A 73 -1.481 3.748 -2.313 1.00 0.00 H new ATOM 0 HA VAL A 73 -3.652 4.607 -4.118 1.00 0.00 H new ATOM 0 HB VAL A 73 -3.676 3.006 -1.564 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -6.047 3.561 -1.214 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -4.999 4.986 -1.020 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -5.950 4.777 -2.510 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -5.414 1.750 -2.773 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -5.290 2.892 -4.131 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -3.905 1.857 -3.710 1.00 0.00 H new ATOM 1084 N ASN A 74 -3.821 6.825 -3.019 1.00 0.00 N ATOM 1085 CA ASN A 74 -3.873 8.159 -2.433 1.00 0.00 C ATOM 1086 C ASN A 74 -4.945 8.236 -1.350 1.00 0.00 C ATOM 1087 O ASN A 74 -6.097 8.570 -1.624 1.00 0.00 O ATOM 1088 CB ASN A 74 -4.151 9.204 -3.515 1.00 0.00 C ATOM 1089 CG ASN A 74 -4.363 10.591 -2.939 1.00 0.00 C ATOM 1090 OD1 ASN A 74 -4.132 10.824 -1.753 1.00 0.00 O ATOM 1091 ND2 ASN A 74 -4.805 11.519 -3.780 1.00 0.00 N ATOM 0 H ASN A 74 -4.234 6.757 -3.949 1.00 0.00 H new ATOM 0 HA ASN A 74 -2.905 8.366 -1.977 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -3.316 9.228 -4.216 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -5.034 8.910 -4.082 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -4.966 12.471 -3.450 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -4.983 11.280 -4.756 1.00 0.00 H new ATOM 1098 N ALA A 75 -4.556 7.925 -0.117 1.00 0.00 N ATOM 1099 CA ALA A 75 -5.482 7.961 1.008 1.00 0.00 C ATOM 1100 C ALA A 75 -6.372 9.198 0.947 1.00 0.00 C ATOM 1101 O ALA A 75 -7.563 9.132 1.249 1.00 0.00 O ATOM 1102 CB ALA A 75 -4.716 7.923 2.322 1.00 0.00 C ATOM 0 H ALA A 75 -3.606 7.645 0.127 1.00 0.00 H new ATOM 0 HA ALA A 75 -6.123 7.082 0.948 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -5.419 7.950 3.154 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -4.128 7.007 2.374 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -4.051 8.785 2.381 1.00 0.00 H new ATOM 1108 N ASP A 76 -5.786 10.324 0.556 1.00 0.00 N ATOM 1109 CA ASP A 76 -6.526 11.576 0.455 1.00 0.00 C ATOM 1110 C ASP A 76 -7.653 11.461 -0.566 1.00 0.00 C ATOM 1111 O ASP A 76 -8.776 11.903 -0.321 1.00 0.00 O ATOM 1112 CB ASP A 76 -5.586 12.719 0.069 1.00 0.00 C ATOM 1113 CG ASP A 76 -6.293 14.060 0.022 1.00 0.00 C ATOM 1114 OD1 ASP A 76 -7.038 14.371 0.974 1.00 0.00 O ATOM 1115 OD2 ASP A 76 -6.103 14.796 -0.969 1.00 0.00 O ATOM 0 H ASP A 76 -4.800 10.395 0.304 1.00 0.00 H new ATOM 0 HA ASP A 76 -6.964 11.790 1.430 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -4.766 12.769 0.785 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -5.145 12.510 -0.906 1.00 0.00 H new ATOM 1120 N LYS A 77 -7.346 10.864 -1.713 1.00 0.00 N ATOM 1121 CA LYS A 77 -8.332 10.690 -2.773 1.00 0.00 C ATOM 1122 C LYS A 77 -9.177 9.443 -2.530 1.00 0.00 C ATOM 1123 O LYS A 77 -10.400 9.523 -2.416 1.00 0.00 O ATOM 1124 CB LYS A 77 -7.637 10.591 -4.133 1.00 0.00 C ATOM 1125 CG LYS A 77 -8.559 10.149 -5.257 1.00 0.00 C ATOM 1126 CD LYS A 77 -7.781 9.524 -6.403 1.00 0.00 C ATOM 1127 CE LYS A 77 -7.062 10.579 -7.230 1.00 0.00 C ATOM 1128 NZ LYS A 77 -5.928 10.001 -8.002 1.00 0.00 N ATOM 0 H LYS A 77 -6.422 10.492 -1.932 1.00 0.00 H new ATOM 0 HA LYS A 77 -8.989 11.560 -2.770 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -7.210 11.562 -4.385 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -6.807 9.888 -4.057 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -9.283 9.431 -4.873 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -9.124 11.006 -5.624 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -7.055 8.814 -6.007 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -8.462 8.961 -7.042 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -7.768 11.046 -7.917 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -6.690 11.365 -6.572 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -5.464 10.752 -8.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -5.241 9.578 -7.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -6.285 9.269 -8.648 1.00 0.00 H new ATOM 1142 N HIS A 78 -8.516 8.292 -2.451 1.00 0.00 N ATOM 1143 CA HIS A 78 -9.207 7.029 -2.219 1.00 0.00 C ATOM 1144 C HIS A 78 -9.476 6.821 -0.732 1.00 0.00 C ATOM 1145 O HIS A 78 -9.313 5.718 -0.211 1.00 0.00 O ATOM 1146 CB HIS A 78 -8.383 5.864 -2.768 1.00 0.00 C ATOM 1147 CG HIS A 78 -7.960 6.048 -4.193 1.00 0.00 C ATOM 1148 ND1 HIS A 78 -6.782 5.789 -4.807 1.00 0.00 N flip ATOM 1149 CD2 HIS A 78 -8.794 6.559 -5.165 1.00 0.00 C flip ATOM 1150 CE1 HIS A 78 -6.925 6.142 -6.127 1.00 0.00 C flip ATOM 1151 NE2 HIS A 78 -8.148 6.603 -6.317 1.00 0.00 N flip ATOM 0 H HIS A 78 -7.504 8.208 -2.544 1.00 0.00 H new ATOM 0 HA HIS A 78 -10.163 7.066 -2.741 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -7.496 5.734 -2.148 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -8.966 4.947 -2.686 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -9.815 6.874 -5.009 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -6.161 6.056 -6.886 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -8.529 6.936 -7.202 1.00 0.00 H new ATOM 1160 N GLN A 79 -9.887 7.889 -0.055 1.00 0.00 N ATOM 1161 CA GLN A 79 -10.176 7.823 1.373 1.00 0.00 C ATOM 1162 C GLN A 79 -10.922 6.538 1.718 1.00 0.00 C ATOM 1163 O GLN A 79 -10.649 5.906 2.739 1.00 0.00 O ATOM 1164 CB GLN A 79 -11.001 9.037 1.804 1.00 0.00 C ATOM 1165 CG GLN A 79 -10.168 10.288 2.033 1.00 0.00 C ATOM 1166 CD GLN A 79 -11.016 11.502 2.357 1.00 0.00 C ATOM 1167 OE1 GLN A 79 -12.244 11.423 2.400 1.00 0.00 O ATOM 1168 NE2 GLN A 79 -10.363 12.636 2.587 1.00 0.00 N ATOM 0 H GLN A 79 -10.027 8.809 -0.472 1.00 0.00 H new ATOM 0 HA GLN A 79 -9.228 7.827 1.911 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -11.752 9.245 1.042 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -11.537 8.794 2.722 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -9.468 10.110 2.850 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -9.573 10.492 1.143 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -9.344 12.656 2.541 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -10.880 13.486 2.810 1.00 0.00 H new ATOM 1177 N SER A 80 -11.865 6.158 0.862 1.00 0.00 N ATOM 1178 CA SER A 80 -12.653 4.951 1.079 1.00 0.00 C ATOM 1179 C SER A 80 -11.748 3.733 1.242 1.00 0.00 C ATOM 1180 O SER A 80 -11.909 2.947 2.176 1.00 0.00 O ATOM 1181 CB SER A 80 -13.618 4.730 -0.087 1.00 0.00 C ATOM 1182 OG SER A 80 -14.422 5.876 -0.308 1.00 0.00 O ATOM 0 H SER A 80 -12.102 6.669 0.012 1.00 0.00 H new ATOM 0 HA SER A 80 -13.226 5.082 1.997 1.00 0.00 H new ATOM 0 HB2 SER A 80 -13.054 4.498 -0.991 1.00 0.00 H new ATOM 0 HB3 SER A 80 -14.255 3.870 0.122 1.00 0.00 H new ATOM 0 HG SER A 80 -15.029 5.710 -1.059 1.00 0.00 H new ATOM 1188 N LEU A 81 -10.796 3.585 0.327 1.00 0.00 N ATOM 1189 CA LEU A 81 -9.864 2.463 0.368 1.00 0.00 C ATOM 1190 C LEU A 81 -9.128 2.415 1.703 1.00 0.00 C ATOM 1191 O LEU A 81 -9.239 1.444 2.450 1.00 0.00 O ATOM 1192 CB LEU A 81 -8.858 2.569 -0.778 1.00 0.00 C ATOM 1193 CG LEU A 81 -9.396 2.257 -2.175 1.00 0.00 C ATOM 1194 CD1 LEU A 81 -8.301 2.419 -3.218 1.00 0.00 C ATOM 1195 CD2 LEU A 81 -9.974 0.850 -2.221 1.00 0.00 C ATOM 0 H LEU A 81 -10.649 4.227 -0.452 1.00 0.00 H new ATOM 0 HA LEU A 81 -10.437 1.542 0.257 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -8.451 3.580 -0.785 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -8.029 1.893 -0.571 1.00 0.00 H new ATOM 0 HG LEU A 81 -10.193 2.965 -2.403 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -8.703 2.193 -4.206 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -7.933 3.445 -3.202 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -7.482 1.736 -2.994 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -10.352 0.645 -3.222 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -9.196 0.129 -1.972 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -10.789 0.768 -1.501 1.00 0.00 H new ATOM 1207 N GLY A 82 -8.378 3.473 1.998 1.00 0.00 N ATOM 1208 CA GLY A 82 -7.636 3.532 3.244 1.00 0.00 C ATOM 1209 C GLY A 82 -8.500 3.215 4.449 1.00 0.00 C ATOM 1210 O GLY A 82 -8.247 2.248 5.166 1.00 0.00 O ATOM 0 H GLY A 82 -8.271 4.290 1.396 1.00 0.00 H new ATOM 0 HA2 GLY A 82 -6.805 2.828 3.202 1.00 0.00 H new ATOM 0 HA3 GLY A 82 -7.206 4.527 3.361 1.00 0.00 H new ATOM 1214 N GLY A 83 -9.525 4.033 4.673 1.00 0.00 N ATOM 1215 CA GLY A 83 -10.412 3.818 5.801 1.00 0.00 C ATOM 1216 C GLY A 83 -11.003 2.422 5.816 1.00 0.00 C ATOM 1217 O GLY A 83 -11.115 1.801 6.872 1.00 0.00 O ATOM 0 H GLY A 83 -9.756 4.840 4.094 1.00 0.00 H new ATOM 0 HA2 GLY A 83 -9.864 3.987 6.728 1.00 0.00 H new ATOM 0 HA3 GLY A 83 -11.219 4.550 5.770 1.00 0.00 H new ATOM 1221 N GLN A 84 -11.384 1.930 4.642 1.00 0.00 N ATOM 1222 CA GLN A 84 -11.970 0.600 4.526 1.00 0.00 C ATOM 1223 C GLN A 84 -11.078 -0.447 5.185 1.00 0.00 C ATOM 1224 O GLN A 84 -11.520 -1.560 5.475 1.00 0.00 O ATOM 1225 CB GLN A 84 -12.192 0.244 3.055 1.00 0.00 C ATOM 1226 CG GLN A 84 -12.842 -1.115 2.849 1.00 0.00 C ATOM 1227 CD GLN A 84 -13.639 -1.191 1.561 1.00 0.00 C ATOM 1228 OE1 GLN A 84 -14.867 -1.286 1.582 1.00 0.00 O ATOM 1229 NE2 GLN A 84 -12.944 -1.150 0.431 1.00 0.00 N ATOM 0 H GLN A 84 -11.298 2.432 3.758 1.00 0.00 H new ATOM 0 HA GLN A 84 -12.931 0.608 5.040 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -12.817 1.010 2.595 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -11.233 0.261 2.537 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -12.071 -1.885 2.841 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -13.499 -1.331 3.692 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -11.927 -1.071 0.460 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -13.426 -1.198 -0.466 1.00 0.00 H new ATOM 1238 N TYR A 85 -9.822 -0.084 5.420 1.00 0.00 N ATOM 1239 CA TYR A 85 -8.868 -0.993 6.043 1.00 0.00 C ATOM 1240 C TYR A 85 -8.545 -0.551 7.468 1.00 0.00 C ATOM 1241 O TYR A 85 -8.359 -1.378 8.359 1.00 0.00 O ATOM 1242 CB TYR A 85 -7.583 -1.063 5.216 1.00 0.00 C ATOM 1243 CG TYR A 85 -7.704 -1.928 3.982 1.00 0.00 C ATOM 1244 CD1 TYR A 85 -8.563 -1.579 2.946 1.00 0.00 C ATOM 1245 CD2 TYR A 85 -6.961 -3.095 3.851 1.00 0.00 C ATOM 1246 CE1 TYR A 85 -8.678 -2.367 1.817 1.00 0.00 C ATOM 1247 CE2 TYR A 85 -7.068 -3.888 2.725 1.00 0.00 C ATOM 1248 CZ TYR A 85 -7.928 -3.520 1.711 1.00 0.00 C ATOM 1249 OH TYR A 85 -8.039 -4.308 0.589 1.00 0.00 O ATOM 0 H TYR A 85 -9.441 0.833 5.188 1.00 0.00 H new ATOM 0 HA TYR A 85 -9.321 -1.983 6.082 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -7.298 -0.054 4.916 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -6.778 -1.448 5.842 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -9.151 -0.676 3.025 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -6.288 -3.387 4.644 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -9.351 -2.082 1.022 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -6.482 -4.791 2.639 1.00 0.00 H new ATOM 0 HH TYR A 85 -7.546 -3.895 -0.151 1.00 0.00 H new ATOM 1259 N GLY A 86 -8.481 0.761 7.673 1.00 0.00 N ATOM 1260 CA GLY A 86 -8.181 1.292 8.990 1.00 0.00 C ATOM 1261 C GLY A 86 -7.068 2.320 8.962 1.00 0.00 C ATOM 1262 O GLY A 86 -6.436 2.591 9.983 1.00 0.00 O ATOM 0 H GLY A 86 -8.631 1.465 6.951 1.00 0.00 H new ATOM 0 HA2 GLY A 86 -9.079 1.745 9.409 1.00 0.00 H new ATOM 0 HA3 GLY A 86 -7.899 0.474 9.652 1.00 0.00 H new ATOM 1266 N VAL A 87 -6.824 2.893 7.787 1.00 0.00 N ATOM 1267 CA VAL A 87 -5.778 3.897 7.629 1.00 0.00 C ATOM 1268 C VAL A 87 -6.166 5.207 8.307 1.00 0.00 C ATOM 1269 O VAL A 87 -7.111 5.876 7.890 1.00 0.00 O ATOM 1270 CB VAL A 87 -5.482 4.169 6.142 1.00 0.00 C ATOM 1271 CG1 VAL A 87 -4.407 5.236 5.999 1.00 0.00 C ATOM 1272 CG2 VAL A 87 -5.068 2.886 5.438 1.00 0.00 C ATOM 0 H VAL A 87 -7.336 2.679 6.931 1.00 0.00 H new ATOM 0 HA VAL A 87 -4.882 3.498 8.103 1.00 0.00 H new ATOM 0 HB VAL A 87 -6.392 4.538 5.669 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -4.211 5.415 4.942 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -4.747 6.160 6.467 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -3.492 4.898 6.486 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -4.863 3.097 4.388 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -4.171 2.485 5.910 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -5.873 2.155 5.510 1.00 0.00 H new ATOM 1282 N GLN A 88 -5.430 5.566 9.353 1.00 0.00 N ATOM 1283 CA GLN A 88 -5.698 6.796 10.089 1.00 0.00 C ATOM 1284 C GLN A 88 -4.532 7.771 9.963 1.00 0.00 C ATOM 1285 O GLN A 88 -4.718 8.986 10.004 1.00 0.00 O ATOM 1286 CB GLN A 88 -5.962 6.486 11.564 1.00 0.00 C ATOM 1287 CG GLN A 88 -4.794 5.808 12.261 1.00 0.00 C ATOM 1288 CD GLN A 88 -4.843 5.966 13.768 1.00 0.00 C ATOM 1289 OE1 GLN A 88 -5.732 5.432 14.431 1.00 0.00 O ATOM 1290 NE2 GLN A 88 -3.884 6.702 14.318 1.00 0.00 N ATOM 0 H GLN A 88 -4.644 5.023 9.710 1.00 0.00 H new ATOM 0 HA GLN A 88 -6.585 7.261 9.658 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -6.197 7.414 12.085 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -6.841 5.846 11.641 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -4.792 4.747 12.010 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -3.860 6.226 11.886 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -3.166 7.126 13.730 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -3.865 6.843 15.328 1.00 0.00 H new ATOM 1299 N GLY A 89 -3.327 7.228 9.809 1.00 0.00 N ATOM 1300 CA GLY A 89 -2.149 8.065 9.679 1.00 0.00 C ATOM 1301 C GLY A 89 -1.190 7.555 8.621 1.00 0.00 C ATOM 1302 O GLY A 89 -0.780 6.395 8.652 1.00 0.00 O ATOM 0 H GLY A 89 -3.147 6.225 9.772 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -2.455 9.081 9.429 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -1.634 8.114 10.638 1.00 0.00 H new ATOM 1306 N PHE A 90 -0.832 8.424 7.682 1.00 0.00 N ATOM 1307 CA PHE A 90 0.083 8.055 6.608 1.00 0.00 C ATOM 1308 C PHE A 90 1.482 8.604 6.872 1.00 0.00 C ATOM 1309 O PHE A 90 1.678 9.514 7.678 1.00 0.00 O ATOM 1310 CB PHE A 90 -0.436 8.576 5.266 1.00 0.00 C ATOM 1311 CG PHE A 90 -1.898 8.918 5.280 1.00 0.00 C ATOM 1312 CD1 PHE A 90 -2.823 8.038 5.817 1.00 0.00 C ATOM 1313 CD2 PHE A 90 -2.347 10.120 4.758 1.00 0.00 C ATOM 1314 CE1 PHE A 90 -4.170 8.350 5.831 1.00 0.00 C ATOM 1315 CE2 PHE A 90 -3.692 10.438 4.770 1.00 0.00 C ATOM 1316 CZ PHE A 90 -4.605 9.552 5.308 1.00 0.00 C ATOM 0 H PHE A 90 -1.161 9.389 7.643 1.00 0.00 H new ATOM 0 HA PHE A 90 0.140 6.967 6.571 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.133 9.462 4.985 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.255 7.823 4.499 1.00 0.00 H new ATOM 0 HD1 PHE A 90 -2.488 7.098 6.229 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -1.638 10.817 4.337 1.00 0.00 H new ATOM 0 HE1 PHE A 90 -4.881 7.654 6.251 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -4.029 11.378 4.359 1.00 0.00 H new ATOM 0 HZ PHE A 90 -5.656 9.799 5.320 1.00 0.00 H new ATOM 1326 N PRO A 91 2.480 8.037 6.179 1.00 0.00 N ATOM 1327 CA PRO A 91 2.260 6.952 5.218 1.00 0.00 C ATOM 1328 C PRO A 91 1.860 5.647 5.898 1.00 0.00 C ATOM 1329 O PRO A 91 2.253 5.381 7.034 1.00 0.00 O ATOM 1330 CB PRO A 91 3.621 6.803 4.533 1.00 0.00 C ATOM 1331 CG PRO A 91 4.604 7.314 5.529 1.00 0.00 C ATOM 1332 CD PRO A 91 3.901 8.410 6.280 1.00 0.00 C ATOM 0 HA PRO A 91 1.444 7.176 4.531 1.00 0.00 H new ATOM 0 HB2 PRO A 91 3.823 5.763 4.275 1.00 0.00 H new ATOM 0 HB3 PRO A 91 3.663 7.375 3.606 1.00 0.00 H new ATOM 0 HG2 PRO A 91 4.923 6.521 6.205 1.00 0.00 H new ATOM 0 HG3 PRO A 91 5.499 7.692 5.035 1.00 0.00 H new ATOM 0 HD2 PRO A 91 4.230 8.461 7.318 1.00 0.00 H new ATOM 0 HD3 PRO A 91 4.092 9.387 5.837 1.00 0.00 H new ATOM 1340 N THR A 92 1.077 4.834 5.195 1.00 0.00 N ATOM 1341 CA THR A 92 0.624 3.557 5.731 1.00 0.00 C ATOM 1342 C THR A 92 0.836 2.432 4.725 1.00 0.00 C ATOM 1343 O THR A 92 0.092 2.309 3.751 1.00 0.00 O ATOM 1344 CB THR A 92 -0.865 3.608 6.121 1.00 0.00 C ATOM 1345 OG1 THR A 92 -1.031 4.361 7.328 1.00 0.00 O ATOM 1346 CG2 THR A 92 -1.424 2.206 6.311 1.00 0.00 C ATOM 0 H THR A 92 0.744 5.038 4.253 1.00 0.00 H new ATOM 0 HA THR A 92 1.219 3.360 6.623 1.00 0.00 H new ATOM 0 HB THR A 92 -1.412 4.093 5.313 1.00 0.00 H new ATOM 0 HG1 THR A 92 -0.578 5.226 7.239 1.00 0.00 H new ATOM 0 HG21 THR A 92 -2.477 2.268 6.586 1.00 0.00 H new ATOM 0 HG22 THR A 92 -1.324 1.645 5.382 1.00 0.00 H new ATOM 0 HG23 THR A 92 -0.872 1.698 7.102 1.00 0.00 H new ATOM 1354 N ILE A 93 1.854 1.613 4.966 1.00 0.00 N ATOM 1355 CA ILE A 93 2.161 0.496 4.081 1.00 0.00 C ATOM 1356 C ILE A 93 1.451 -0.775 4.533 1.00 0.00 C ATOM 1357 O ILE A 93 1.398 -1.081 5.724 1.00 0.00 O ATOM 1358 CB ILE A 93 3.677 0.229 4.018 1.00 0.00 C ATOM 1359 CG1 ILE A 93 4.416 1.474 3.523 1.00 0.00 C ATOM 1360 CG2 ILE A 93 3.968 -0.960 3.115 1.00 0.00 C ATOM 1361 CD1 ILE A 93 5.852 1.550 3.991 1.00 0.00 C ATOM 0 H ILE A 93 2.480 1.702 5.766 1.00 0.00 H new ATOM 0 HA ILE A 93 1.807 0.773 3.088 1.00 0.00 H new ATOM 0 HB ILE A 93 4.032 -0.006 5.021 1.00 0.00 H new ATOM 0 HG12 ILE A 93 4.396 1.489 2.433 1.00 0.00 H new ATOM 0 HG13 ILE A 93 3.884 2.362 3.864 1.00 0.00 H new ATOM 0 HG21 ILE A 93 5.043 -1.136 3.081 1.00 0.00 H new ATOM 0 HG22 ILE A 93 3.468 -1.846 3.507 1.00 0.00 H new ATOM 0 HG23 ILE A 93 3.602 -0.751 2.110 1.00 0.00 H new ATOM 0 HD11 ILE A 93 6.314 2.458 3.602 1.00 0.00 H new ATOM 0 HD12 ILE A 93 5.879 1.567 5.081 1.00 0.00 H new ATOM 0 HD13 ILE A 93 6.400 0.680 3.628 1.00 0.00 H new ATOM 1373 N LYS A 94 0.906 -1.515 3.572 1.00 0.00 N ATOM 1374 CA LYS A 94 0.201 -2.756 3.869 1.00 0.00 C ATOM 1375 C LYS A 94 0.652 -3.874 2.935 1.00 0.00 C ATOM 1376 O LYS A 94 0.825 -3.661 1.735 1.00 0.00 O ATOM 1377 CB LYS A 94 -1.310 -2.550 3.743 1.00 0.00 C ATOM 1378 CG LYS A 94 -1.924 -1.811 4.920 1.00 0.00 C ATOM 1379 CD LYS A 94 -2.250 -2.757 6.064 1.00 0.00 C ATOM 1380 CE LYS A 94 -3.272 -2.152 7.014 1.00 0.00 C ATOM 1381 NZ LYS A 94 -3.547 -3.043 8.174 1.00 0.00 N ATOM 0 H LYS A 94 0.939 -1.276 2.581 1.00 0.00 H new ATOM 0 HA LYS A 94 0.438 -3.044 4.893 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.517 -1.995 2.828 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -1.794 -3.522 3.643 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -1.234 -1.042 5.268 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -2.832 -1.302 4.597 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -2.635 -3.695 5.663 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -1.338 -2.995 6.612 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -2.908 -1.190 7.374 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -4.200 -1.961 6.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -4.248 -2.595 8.797 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -3.918 -3.953 7.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -2.667 -3.205 8.703 1.00 0.00 H new ATOM 1395 N ILE A 95 0.838 -5.066 3.493 1.00 0.00 N ATOM 1396 CA ILE A 95 1.266 -6.218 2.709 1.00 0.00 C ATOM 1397 C ILE A 95 0.082 -7.112 2.354 1.00 0.00 C ATOM 1398 O ILE A 95 -0.722 -7.467 3.217 1.00 0.00 O ATOM 1399 CB ILE A 95 2.318 -7.052 3.462 1.00 0.00 C ATOM 1400 CG1 ILE A 95 3.560 -6.207 3.752 1.00 0.00 C ATOM 1401 CG2 ILE A 95 2.688 -8.289 2.657 1.00 0.00 C ATOM 1402 CD1 ILE A 95 4.305 -6.634 4.997 1.00 0.00 C ATOM 0 H ILE A 95 0.699 -5.259 4.485 1.00 0.00 H new ATOM 0 HA ILE A 95 1.711 -5.829 1.793 1.00 0.00 H new ATOM 0 HB ILE A 95 1.892 -7.374 4.412 1.00 0.00 H new ATOM 0 HG12 ILE A 95 4.235 -6.263 2.898 1.00 0.00 H new ATOM 0 HG13 ILE A 95 3.263 -5.163 3.856 1.00 0.00 H new ATOM 0 HG21 ILE A 95 3.433 -8.869 3.202 1.00 0.00 H new ATOM 0 HG22 ILE A 95 1.799 -8.899 2.498 1.00 0.00 H new ATOM 0 HG23 ILE A 95 3.098 -7.987 1.693 1.00 0.00 H new ATOM 0 HD11 ILE A 95 5.173 -5.991 5.140 1.00 0.00 H new ATOM 0 HD12 ILE A 95 3.646 -6.552 5.861 1.00 0.00 H new ATOM 0 HD13 ILE A 95 4.633 -7.668 4.888 1.00 0.00 H new ATOM 1414 N PHE A 96 -0.018 -7.474 1.080 1.00 0.00 N ATOM 1415 CA PHE A 96 -1.103 -8.328 0.611 1.00 0.00 C ATOM 1416 C PHE A 96 -0.568 -9.679 0.144 1.00 0.00 C ATOM 1417 O PHE A 96 0.308 -9.748 -0.716 1.00 0.00 O ATOM 1418 CB PHE A 96 -1.861 -7.645 -0.529 1.00 0.00 C ATOM 1419 CG PHE A 96 -2.834 -6.601 -0.061 1.00 0.00 C ATOM 1420 CD1 PHE A 96 -2.384 -5.389 0.436 1.00 0.00 C ATOM 1421 CD2 PHE A 96 -4.199 -6.833 -0.117 1.00 0.00 C ATOM 1422 CE1 PHE A 96 -3.277 -4.426 0.867 1.00 0.00 C ATOM 1423 CE2 PHE A 96 -5.097 -5.874 0.312 1.00 0.00 C ATOM 1424 CZ PHE A 96 -4.635 -4.669 0.806 1.00 0.00 C ATOM 0 H PHE A 96 0.639 -7.189 0.353 1.00 0.00 H new ATOM 0 HA PHE A 96 -1.787 -8.496 1.443 1.00 0.00 H new ATOM 0 HB2 PHE A 96 -1.143 -7.183 -1.207 1.00 0.00 H new ATOM 0 HB3 PHE A 96 -2.399 -8.401 -1.101 1.00 0.00 H new ATOM 0 HD1 PHE A 96 -1.323 -5.194 0.487 1.00 0.00 H new ATOM 0 HD2 PHE A 96 -4.565 -7.774 -0.500 1.00 0.00 H new ATOM 0 HE1 PHE A 96 -2.913 -3.484 1.251 1.00 0.00 H new ATOM 0 HE2 PHE A 96 -6.159 -6.066 0.261 1.00 0.00 H new ATOM 0 HZ PHE A 96 -5.335 -3.919 1.144 1.00 0.00 H new ATOM 1434 N GLY A 97 -1.104 -10.752 0.719 1.00 0.00 N ATOM 1435 CA GLY A 97 -0.669 -12.086 0.350 1.00 0.00 C ATOM 1436 C GLY A 97 -1.601 -13.164 0.869 1.00 0.00 C ATOM 1437 O GLY A 97 -2.602 -13.488 0.232 1.00 0.00 O ATOM 0 H GLY A 97 -1.831 -10.721 1.433 1.00 0.00 H new ATOM 0 HA2 GLY A 97 -0.605 -12.157 -0.736 1.00 0.00 H new ATOM 0 HA3 GLY A 97 0.334 -12.259 0.740 1.00 0.00 H new ATOM 1441 N ALA A 98 -1.270 -13.721 2.030 1.00 0.00 N ATOM 1442 CA ALA A 98 -2.084 -14.768 2.634 1.00 0.00 C ATOM 1443 C ALA A 98 -3.569 -14.513 2.399 1.00 0.00 C ATOM 1444 O ALA A 98 -4.226 -15.250 1.665 1.00 0.00 O ATOM 1445 CB ALA A 98 -1.793 -14.868 4.124 1.00 0.00 C ATOM 0 H ALA A 98 -0.444 -13.464 2.570 1.00 0.00 H new ATOM 0 HA ALA A 98 -1.825 -15.715 2.160 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -2.408 -15.654 4.563 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -0.740 -15.105 4.274 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -2.023 -13.917 4.604 1.00 0.00 H new ATOM 1451 N ASN A 99 -4.092 -13.464 3.027 1.00 0.00 N ATOM 1452 CA ASN A 99 -5.500 -13.113 2.887 1.00 0.00 C ATOM 1453 C ASN A 99 -5.657 -11.747 2.226 1.00 0.00 C ATOM 1454 O ASN A 99 -5.571 -10.711 2.887 1.00 0.00 O ATOM 1455 CB ASN A 99 -6.186 -13.112 4.255 1.00 0.00 C ATOM 1456 CG ASN A 99 -7.690 -12.949 4.148 1.00 0.00 C ATOM 1457 OD1 ASN A 99 -8.313 -12.490 5.227 1.00 0.00 O flip ATOM 1458 ND2 ASN A 99 -8.283 -13.231 3.107 1.00 0.00 N flip ATOM 0 H ASN A 99 -3.561 -12.843 3.638 1.00 0.00 H new ATOM 0 HA ASN A 99 -5.973 -13.861 2.251 1.00 0.00 H new ATOM 0 HB2 ASN A 99 -5.960 -14.045 4.772 1.00 0.00 H new ATOM 0 HB3 ASN A 99 -5.778 -12.304 4.862 1.00 0.00 H new ATOM 0 HD21 ASN A 99 -7.763 -13.581 2.302 1.00 0.00 H new ATOM 0 HD22 ASN A 99 -9.295 -13.115 3.049 1.00 0.00 H new ATOM 1465 N LYS A 100 -5.888 -11.751 0.918 1.00 0.00 N ATOM 1466 CA LYS A 100 -6.059 -10.514 0.166 1.00 0.00 C ATOM 1467 C LYS A 100 -7.126 -9.631 0.807 1.00 0.00 C ATOM 1468 O LYS A 100 -7.167 -8.424 0.575 1.00 0.00 O ATOM 1469 CB LYS A 100 -6.441 -10.822 -1.283 1.00 0.00 C ATOM 1470 CG LYS A 100 -5.255 -11.186 -2.160 1.00 0.00 C ATOM 1471 CD LYS A 100 -4.265 -10.038 -2.264 1.00 0.00 C ATOM 1472 CE LYS A 100 -3.214 -10.303 -3.331 1.00 0.00 C ATOM 1473 NZ LYS A 100 -2.387 -11.499 -3.010 1.00 0.00 N ATOM 0 H LYS A 100 -5.961 -12.599 0.356 1.00 0.00 H new ATOM 0 HA LYS A 100 -5.111 -9.977 0.179 1.00 0.00 H new ATOM 0 HB2 LYS A 100 -7.157 -11.644 -1.294 1.00 0.00 H new ATOM 0 HB3 LYS A 100 -6.945 -9.955 -1.709 1.00 0.00 H new ATOM 0 HG2 LYS A 100 -4.754 -12.063 -1.751 1.00 0.00 H new ATOM 0 HG3 LYS A 100 -5.607 -11.456 -3.156 1.00 0.00 H new ATOM 0 HD2 LYS A 100 -4.798 -9.117 -2.498 1.00 0.00 H new ATOM 0 HD3 LYS A 100 -3.777 -9.888 -1.301 1.00 0.00 H new ATOM 0 HE2 LYS A 100 -3.703 -10.448 -4.294 1.00 0.00 H new ATOM 0 HE3 LYS A 100 -2.568 -9.431 -3.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 -1.456 -11.410 -3.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 -2.263 -11.569 -1.980 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 -2.863 -12.355 -3.361 1.00 0.00 H new ATOM 1487 N ASN A 101 -7.986 -10.242 1.616 1.00 0.00 N ATOM 1488 CA ASN A 101 -9.052 -9.511 2.291 1.00 0.00 C ATOM 1489 C ASN A 101 -8.525 -8.813 3.541 1.00 0.00 C ATOM 1490 O ASN A 101 -9.044 -7.774 3.951 1.00 0.00 O ATOM 1491 CB ASN A 101 -10.192 -10.460 2.665 1.00 0.00 C ATOM 1492 CG ASN A 101 -11.056 -10.824 1.473 1.00 0.00 C ATOM 1493 OD1 ASN A 101 -12.100 -10.215 1.241 1.00 0.00 O ATOM 1494 ND2 ASN A 101 -10.624 -11.823 0.712 1.00 0.00 N ATOM 0 H ASN A 101 -7.965 -11.241 1.820 1.00 0.00 H new ATOM 0 HA ASN A 101 -9.430 -8.753 1.605 1.00 0.00 H new ATOM 0 HB2 ASN A 101 -9.776 -11.369 3.100 1.00 0.00 H new ATOM 0 HB3 ASN A 101 -10.812 -9.994 3.431 1.00 0.00 H new ATOM 0 HD21 ASN A 101 -11.164 -12.114 -0.103 1.00 0.00 H new ATOM 0 HD22 ASN A 101 -9.752 -12.300 0.943 1.00 0.00 H new ATOM 1501 N LYS A 102 -7.491 -9.389 4.143 1.00 0.00 N ATOM 1502 CA LYS A 102 -6.891 -8.823 5.345 1.00 0.00 C ATOM 1503 C LYS A 102 -5.369 -8.827 5.248 1.00 0.00 C ATOM 1504 O LYS A 102 -4.708 -9.825 5.535 1.00 0.00 O ATOM 1505 CB LYS A 102 -7.336 -9.609 6.580 1.00 0.00 C ATOM 1506 CG LYS A 102 -8.840 -9.801 6.670 1.00 0.00 C ATOM 1507 CD LYS A 102 -9.251 -10.367 8.019 1.00 0.00 C ATOM 1508 CE LYS A 102 -9.244 -11.888 8.010 1.00 0.00 C ATOM 1509 NZ LYS A 102 -10.113 -12.453 9.079 1.00 0.00 N ATOM 0 H LYS A 102 -7.050 -10.249 3.818 1.00 0.00 H new ATOM 0 HA LYS A 102 -7.228 -7.791 5.437 1.00 0.00 H new ATOM 0 HB2 LYS A 102 -6.853 -10.586 6.572 1.00 0.00 H new ATOM 0 HB3 LYS A 102 -6.990 -9.090 7.474 1.00 0.00 H new ATOM 0 HG2 LYS A 102 -9.340 -8.846 6.508 1.00 0.00 H new ATOM 0 HG3 LYS A 102 -9.170 -10.472 5.877 1.00 0.00 H new ATOM 0 HD2 LYS A 102 -8.571 -10.003 8.790 1.00 0.00 H new ATOM 0 HD3 LYS A 102 -10.247 -10.008 8.277 1.00 0.00 H new ATOM 0 HE2 LYS A 102 -9.584 -12.247 7.038 1.00 0.00 H new ATOM 0 HE3 LYS A 102 -8.224 -12.247 8.144 1.00 0.00 H new ATOM 0 HZ1 LYS A 102 -10.081 -13.492 9.039 1.00 0.00 H new ATOM 0 HZ2 LYS A 102 -9.774 -12.131 10.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 102 -11.092 -12.131 8.937 1.00 0.00 H new ATOM 1523 N PRO A 103 -4.798 -7.686 4.835 1.00 0.00 N ATOM 1524 CA PRO A 103 -3.347 -7.533 4.692 1.00 0.00 C ATOM 1525 C PRO A 103 -2.631 -7.519 6.039 1.00 0.00 C ATOM 1526 O PRO A 103 -3.269 -7.477 7.090 1.00 0.00 O ATOM 1527 CB PRO A 103 -3.200 -6.179 3.994 1.00 0.00 C ATOM 1528 CG PRO A 103 -4.434 -5.428 4.359 1.00 0.00 C ATOM 1529 CD PRO A 103 -5.525 -6.457 4.475 1.00 0.00 C ATOM 0 HA PRO A 103 -2.902 -8.362 4.142 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -2.305 -5.656 4.330 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -3.114 -6.298 2.914 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -4.301 -4.892 5.299 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -4.678 -4.685 3.600 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -6.255 -6.184 5.237 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -6.070 -6.572 3.538 1.00 0.00 H new ATOM 1537 N GLU A 104 -1.303 -7.553 5.998 1.00 0.00 N ATOM 1538 CA GLU A 104 -0.501 -7.544 7.216 1.00 0.00 C ATOM 1539 C GLU A 104 0.153 -6.182 7.427 1.00 0.00 C ATOM 1540 O GLU A 104 0.619 -5.551 6.477 1.00 0.00 O ATOM 1541 CB GLU A 104 0.572 -8.633 7.154 1.00 0.00 C ATOM 1542 CG GLU A 104 0.025 -10.007 6.805 1.00 0.00 C ATOM 1543 CD GLU A 104 1.121 -11.027 6.565 1.00 0.00 C ATOM 1544 OE1 GLU A 104 1.886 -11.311 7.511 1.00 0.00 O ATOM 1545 OE2 GLU A 104 1.214 -11.543 5.431 1.00 0.00 O ATOM 0 H GLU A 104 -0.760 -7.587 5.135 1.00 0.00 H new ATOM 0 HA GLU A 104 -1.163 -7.744 8.058 1.00 0.00 H new ATOM 0 HB2 GLU A 104 1.322 -8.351 6.415 1.00 0.00 H new ATOM 0 HB3 GLU A 104 1.079 -8.687 8.117 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -0.618 -10.354 7.614 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -0.597 -9.931 5.913 1.00 0.00 H new ATOM 1552 N ASP A 105 0.183 -5.734 8.677 1.00 0.00 N ATOM 1553 CA ASP A 105 0.780 -4.447 9.014 1.00 0.00 C ATOM 1554 C ASP A 105 2.254 -4.413 8.624 1.00 0.00 C ATOM 1555 O ASP A 105 3.025 -5.299 8.992 1.00 0.00 O ATOM 1556 CB ASP A 105 0.629 -4.167 10.510 1.00 0.00 C ATOM 1557 CG ASP A 105 1.768 -3.332 11.061 1.00 0.00 C ATOM 1558 OD1 ASP A 105 1.665 -2.089 11.022 1.00 0.00 O ATOM 1559 OD2 ASP A 105 2.764 -3.923 11.530 1.00 0.00 O ATOM 0 H ASP A 105 -0.199 -6.243 9.474 1.00 0.00 H new ATOM 0 HA ASP A 105 0.256 -3.673 8.453 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -0.315 -3.651 10.686 1.00 0.00 H new ATOM 0 HB3 ASP A 105 0.581 -5.112 11.050 1.00 0.00 H new ATOM 1564 N TYR A 106 2.639 -3.384 7.876 1.00 0.00 N ATOM 1565 CA TYR A 106 4.020 -3.237 7.433 1.00 0.00 C ATOM 1566 C TYR A 106 4.872 -2.580 8.515 1.00 0.00 C ATOM 1567 O TYR A 106 4.798 -1.370 8.728 1.00 0.00 O ATOM 1568 CB TYR A 106 4.079 -2.408 6.148 1.00 0.00 C ATOM 1569 CG TYR A 106 5.484 -2.194 5.630 1.00 0.00 C ATOM 1570 CD1 TYR A 106 6.311 -1.228 6.189 1.00 0.00 C ATOM 1571 CD2 TYR A 106 5.983 -2.957 4.582 1.00 0.00 C ATOM 1572 CE1 TYR A 106 7.595 -1.028 5.719 1.00 0.00 C ATOM 1573 CE2 TYR A 106 7.265 -2.765 4.106 1.00 0.00 C ATOM 1574 CZ TYR A 106 8.067 -1.799 4.677 1.00 0.00 C ATOM 1575 OH TYR A 106 9.345 -1.604 4.205 1.00 0.00 O ATOM 0 H TYR A 106 2.014 -2.640 7.564 1.00 0.00 H new ATOM 0 HA TYR A 106 4.420 -4.232 7.235 1.00 0.00 H new ATOM 0 HB2 TYR A 106 3.488 -2.904 5.378 1.00 0.00 H new ATOM 0 HB3 TYR A 106 3.616 -1.438 6.330 1.00 0.00 H new ATOM 0 HD1 TYR A 106 5.944 -0.623 7.005 1.00 0.00 H new ATOM 0 HD2 TYR A 106 5.357 -3.714 4.132 1.00 0.00 H new ATOM 0 HE1 TYR A 106 8.225 -0.273 6.165 1.00 0.00 H new ATOM 0 HE2 TYR A 106 7.638 -3.368 3.291 1.00 0.00 H new ATOM 0 HH TYR A 106 9.819 -0.980 4.793 1.00 0.00 H new ATOM 1585 N GLN A 107 5.681 -3.387 9.193 1.00 0.00 N ATOM 1586 CA GLN A 107 6.548 -2.885 10.253 1.00 0.00 C ATOM 1587 C GLN A 107 8.012 -2.943 9.832 1.00 0.00 C ATOM 1588 O GLN A 107 8.877 -3.346 10.609 1.00 0.00 O ATOM 1589 CB GLN A 107 6.341 -3.693 11.535 1.00 0.00 C ATOM 1590 CG GLN A 107 6.574 -2.890 12.804 1.00 0.00 C ATOM 1591 CD GLN A 107 5.438 -1.934 13.107 1.00 0.00 C ATOM 1592 OE1 GLN A 107 5.651 -0.733 13.282 1.00 0.00 O ATOM 1593 NE2 GLN A 107 4.221 -2.461 13.171 1.00 0.00 N ATOM 0 H GLN A 107 5.755 -4.391 9.028 1.00 0.00 H new ATOM 0 HA GLN A 107 6.284 -1.844 10.441 1.00 0.00 H new ATOM 0 HB2 GLN A 107 5.325 -4.087 11.546 1.00 0.00 H new ATOM 0 HB3 GLN A 107 7.015 -4.549 11.528 1.00 0.00 H new ATOM 0 HG2 GLN A 107 6.702 -3.573 13.643 1.00 0.00 H new ATOM 0 HG3 GLN A 107 7.502 -2.326 12.707 1.00 0.00 H new ATOM 0 HE21 GLN A 107 4.090 -3.461 13.019 1.00 0.00 H new ATOM 0 HE22 GLN A 107 3.417 -1.866 13.372 1.00 0.00 H new ATOM 1602 N GLY A 108 8.284 -2.539 8.594 1.00 0.00 N ATOM 1603 CA GLY A 108 9.645 -2.554 8.091 1.00 0.00 C ATOM 1604 C GLY A 108 10.217 -1.160 7.926 1.00 0.00 C ATOM 1605 O GLY A 108 9.769 -0.216 8.576 1.00 0.00 O ATOM 0 H GLY A 108 7.586 -2.202 7.931 1.00 0.00 H new ATOM 0 HA2 GLY A 108 10.275 -3.124 8.774 1.00 0.00 H new ATOM 0 HA3 GLY A 108 9.669 -3.069 7.131 1.00 0.00 H new ATOM 1609 N GLY A 109 11.213 -1.030 7.055 1.00 0.00 N ATOM 1610 CA GLY A 109 11.833 0.262 6.824 1.00 0.00 C ATOM 1611 C GLY A 109 11.232 0.989 5.637 1.00 0.00 C ATOM 1612 O GLY A 109 10.947 0.379 4.606 1.00 0.00 O ATOM 0 H GLY A 109 11.602 -1.796 6.505 1.00 0.00 H new ATOM 0 HA2 GLY A 109 11.725 0.878 7.717 1.00 0.00 H new ATOM 0 HA3 GLY A 109 12.902 0.125 6.659 1.00 0.00 H new ATOM 1616 N ARG A 110 11.037 2.296 5.782 1.00 0.00 N ATOM 1617 CA ARG A 110 10.464 3.106 4.714 1.00 0.00 C ATOM 1618 C ARG A 110 11.543 3.556 3.734 1.00 0.00 C ATOM 1619 O ARG A 110 11.589 4.721 3.335 1.00 0.00 O ATOM 1620 CB ARG A 110 9.749 4.326 5.298 1.00 0.00 C ATOM 1621 CG ARG A 110 8.286 4.076 5.625 1.00 0.00 C ATOM 1622 CD ARG A 110 7.734 5.140 6.560 1.00 0.00 C ATOM 1623 NE ARG A 110 8.053 6.490 6.102 1.00 0.00 N ATOM 1624 CZ ARG A 110 8.112 7.545 6.907 1.00 0.00 C ATOM 1625 NH1 ARG A 110 7.874 7.407 8.204 1.00 0.00 N ATOM 1626 NH2 ARG A 110 8.409 8.741 6.415 1.00 0.00 N ATOM 0 H ARG A 110 11.267 2.816 6.629 1.00 0.00 H new ATOM 0 HA ARG A 110 9.741 2.493 4.175 1.00 0.00 H new ATOM 0 HB2 ARG A 110 10.266 4.640 6.204 1.00 0.00 H new ATOM 0 HB3 ARG A 110 9.818 5.151 4.589 1.00 0.00 H new ATOM 0 HG2 ARG A 110 7.704 4.062 4.704 1.00 0.00 H new ATOM 0 HG3 ARG A 110 8.178 3.094 6.085 1.00 0.00 H new ATOM 0 HD2 ARG A 110 6.652 5.029 6.637 1.00 0.00 H new ATOM 0 HD3 ARG A 110 8.141 4.991 7.560 1.00 0.00 H new ATOM 0 HE ARG A 110 8.241 6.630 5.109 1.00 0.00 H new ATOM 0 HH11 ARG A 110 7.645 6.489 8.586 1.00 0.00 H new ATOM 0 HH12 ARG A 110 7.920 8.219 8.820 1.00 0.00 H new ATOM 0 HH21 ARG A 110 8.592 8.851 5.418 1.00 0.00 H new ATOM 0 HH22 ARG A 110 8.454 9.550 7.034 1.00 0.00 H new ATOM 1640 N THR A 111 12.411 2.626 3.349 1.00 0.00 N ATOM 1641 CA THR A 111 13.491 2.927 2.417 1.00 0.00 C ATOM 1642 C THR A 111 13.502 1.944 1.253 1.00 0.00 C ATOM 1643 O THR A 111 13.400 0.734 1.448 1.00 0.00 O ATOM 1644 CB THR A 111 14.863 2.892 3.117 1.00 0.00 C ATOM 1645 OG1 THR A 111 15.024 1.653 3.817 1.00 0.00 O ATOM 1646 CG2 THR A 111 15.003 4.052 4.091 1.00 0.00 C ATOM 0 H THR A 111 12.387 1.658 3.668 1.00 0.00 H new ATOM 0 HA THR A 111 13.310 3.933 2.038 1.00 0.00 H new ATOM 0 HB THR A 111 15.637 2.982 2.355 1.00 0.00 H new ATOM 0 HG1 THR A 111 15.899 1.638 4.258 1.00 0.00 H new ATOM 0 HG21 THR A 111 15.979 4.006 4.573 1.00 0.00 H new ATOM 0 HG22 THR A 111 14.909 4.994 3.551 1.00 0.00 H new ATOM 0 HG23 THR A 111 14.221 3.988 4.848 1.00 0.00 H new ATOM 1654 N GLY A 112 13.628 2.472 0.039 1.00 0.00 N ATOM 1655 CA GLY A 112 13.651 1.626 -1.140 1.00 0.00 C ATOM 1656 C GLY A 112 14.324 0.293 -0.883 1.00 0.00 C ATOM 1657 O GLY A 112 13.948 -0.722 -1.469 1.00 0.00 O ATOM 0 H GLY A 112 13.715 3.471 -0.149 1.00 0.00 H new ATOM 0 HA2 GLY A 112 12.630 1.454 -1.480 1.00 0.00 H new ATOM 0 HA3 GLY A 112 14.173 2.144 -1.945 1.00 0.00 H new ATOM 1661 N GLU A 113 15.324 0.295 -0.008 1.00 0.00 N ATOM 1662 CA GLU A 113 16.053 -0.924 0.322 1.00 0.00 C ATOM 1663 C GLU A 113 15.224 -1.824 1.234 1.00 0.00 C ATOM 1664 O GLU A 113 14.922 -2.966 0.888 1.00 0.00 O ATOM 1665 CB GLU A 113 17.383 -0.582 0.997 1.00 0.00 C ATOM 1666 CG GLU A 113 17.939 0.774 0.596 1.00 0.00 C ATOM 1667 CD GLU A 113 19.453 0.828 0.667 1.00 0.00 C ATOM 1668 OE1 GLU A 113 19.994 0.873 1.791 1.00 0.00 O ATOM 1669 OE2 GLU A 113 20.097 0.825 -0.403 1.00 0.00 O ATOM 0 H GLU A 113 15.648 1.127 0.485 1.00 0.00 H new ATOM 0 HA GLU A 113 16.252 -1.460 -0.606 1.00 0.00 H new ATOM 0 HB2 GLU A 113 17.248 -0.604 2.078 1.00 0.00 H new ATOM 0 HB3 GLU A 113 18.114 -1.352 0.751 1.00 0.00 H new ATOM 0 HG2 GLU A 113 17.618 1.008 -0.419 1.00 0.00 H new ATOM 0 HG3 GLU A 113 17.521 1.541 1.248 1.00 0.00 H new ATOM 1676 N ALA A 114 14.860 -1.301 2.400 1.00 0.00 N ATOM 1677 CA ALA A 114 14.065 -2.055 3.360 1.00 0.00 C ATOM 1678 C ALA A 114 12.842 -2.676 2.694 1.00 0.00 C ATOM 1679 O ALA A 114 12.606 -3.880 2.807 1.00 0.00 O ATOM 1680 CB ALA A 114 13.641 -1.159 4.514 1.00 0.00 C ATOM 0 H ALA A 114 15.103 -0.358 2.702 1.00 0.00 H new ATOM 0 HA ALA A 114 14.684 -2.863 3.750 1.00 0.00 H new ATOM 0 HB1 ALA A 114 13.048 -1.736 5.223 1.00 0.00 H new ATOM 0 HB2 ALA A 114 14.526 -0.768 5.015 1.00 0.00 H new ATOM 0 HB3 ALA A 114 13.045 -0.331 4.131 1.00 0.00 H new ATOM 1686 N ILE A 115 12.068 -1.849 2.000 1.00 0.00 N ATOM 1687 CA ILE A 115 10.870 -2.318 1.315 1.00 0.00 C ATOM 1688 C ILE A 115 11.164 -3.563 0.484 1.00 0.00 C ATOM 1689 O ILE A 115 10.433 -4.552 0.548 1.00 0.00 O ATOM 1690 CB ILE A 115 10.283 -1.229 0.398 1.00 0.00 C ATOM 1691 CG1 ILE A 115 9.994 0.042 1.199 1.00 0.00 C ATOM 1692 CG2 ILE A 115 9.018 -1.733 -0.280 1.00 0.00 C ATOM 1693 CD1 ILE A 115 10.143 1.312 0.391 1.00 0.00 C ATOM 0 H ILE A 115 12.249 -0.850 1.897 1.00 0.00 H new ATOM 0 HA ILE A 115 10.140 -2.563 2.087 1.00 0.00 H new ATOM 0 HB ILE A 115 11.015 -0.991 -0.373 1.00 0.00 H new ATOM 0 HG12 ILE A 115 8.980 -0.010 1.595 1.00 0.00 H new ATOM 0 HG13 ILE A 115 10.668 0.084 2.054 1.00 0.00 H new ATOM 0 HG21 ILE A 115 8.615 -0.952 -0.925 1.00 0.00 H new ATOM 0 HG22 ILE A 115 9.252 -2.613 -0.879 1.00 0.00 H new ATOM 0 HG23 ILE A 115 8.279 -1.996 0.477 1.00 0.00 H new ATOM 0 HD11 ILE A 115 9.923 2.173 1.022 1.00 0.00 H new ATOM 0 HD12 ILE A 115 11.164 1.388 0.017 1.00 0.00 H new ATOM 0 HD13 ILE A 115 9.449 1.292 -0.450 1.00 0.00 H new ATOM 1705 N VAL A 116 12.240 -3.508 -0.294 1.00 0.00 N ATOM 1706 CA VAL A 116 12.633 -4.632 -1.135 1.00 0.00 C ATOM 1707 C VAL A 116 12.793 -5.905 -0.312 1.00 0.00 C ATOM 1708 O VAL A 116 12.387 -6.987 -0.738 1.00 0.00 O ATOM 1709 CB VAL A 116 13.952 -4.343 -1.877 1.00 0.00 C ATOM 1710 CG1 VAL A 116 14.440 -5.588 -2.602 1.00 0.00 C ATOM 1711 CG2 VAL A 116 13.774 -3.186 -2.848 1.00 0.00 C ATOM 0 H VAL A 116 12.855 -2.697 -0.359 1.00 0.00 H new ATOM 0 HA VAL A 116 11.837 -4.774 -1.866 1.00 0.00 H new ATOM 0 HB VAL A 116 14.707 -4.059 -1.144 1.00 0.00 H new ATOM 0 HG11 VAL A 116 15.373 -5.365 -3.120 1.00 0.00 H new ATOM 0 HG12 VAL A 116 14.608 -6.387 -1.880 1.00 0.00 H new ATOM 0 HG13 VAL A 116 13.689 -5.905 -3.326 1.00 0.00 H new ATOM 0 HG21 VAL A 116 14.715 -2.995 -3.363 1.00 0.00 H new ATOM 0 HG22 VAL A 116 13.005 -3.439 -3.578 1.00 0.00 H new ATOM 0 HG23 VAL A 116 13.474 -2.293 -2.299 1.00 0.00 H new ATOM 1721 N ASP A 117 13.388 -5.769 0.868 1.00 0.00 N ATOM 1722 CA ASP A 117 13.601 -6.909 1.752 1.00 0.00 C ATOM 1723 C ASP A 117 12.285 -7.368 2.373 1.00 0.00 C ATOM 1724 O ASP A 117 12.072 -8.561 2.586 1.00 0.00 O ATOM 1725 CB ASP A 117 14.600 -6.547 2.853 1.00 0.00 C ATOM 1726 CG ASP A 117 15.283 -7.767 3.438 1.00 0.00 C ATOM 1727 OD1 ASP A 117 16.248 -8.261 2.818 1.00 0.00 O ATOM 1728 OD2 ASP A 117 14.853 -8.229 4.516 1.00 0.00 O ATOM 0 H ASP A 117 13.731 -4.881 1.234 1.00 0.00 H new ATOM 0 HA ASP A 117 14.007 -7.728 1.158 1.00 0.00 H new ATOM 0 HB2 ASP A 117 15.354 -5.871 2.448 1.00 0.00 H new ATOM 0 HB3 ASP A 117 14.082 -6.008 3.647 1.00 0.00 H new ATOM 1733 N ALA A 118 11.407 -6.413 2.660 1.00 0.00 N ATOM 1734 CA ALA A 118 10.112 -6.720 3.255 1.00 0.00 C ATOM 1735 C ALA A 118 9.243 -7.523 2.294 1.00 0.00 C ATOM 1736 O ALA A 118 8.648 -8.531 2.674 1.00 0.00 O ATOM 1737 CB ALA A 118 9.403 -5.438 3.666 1.00 0.00 C ATOM 0 H ALA A 118 11.569 -5.420 2.490 1.00 0.00 H new ATOM 0 HA ALA A 118 10.283 -7.328 4.143 1.00 0.00 H new ATOM 0 HB1 ALA A 118 8.437 -5.682 4.109 1.00 0.00 H new ATOM 0 HB2 ALA A 118 10.012 -4.903 4.395 1.00 0.00 H new ATOM 0 HB3 ALA A 118 9.251 -4.809 2.789 1.00 0.00 H new ATOM 1743 N ALA A 119 9.173 -7.069 1.047 1.00 0.00 N ATOM 1744 CA ALA A 119 8.377 -7.746 0.031 1.00 0.00 C ATOM 1745 C ALA A 119 8.829 -9.191 -0.148 1.00 0.00 C ATOM 1746 O ALA A 119 8.006 -10.105 -0.225 1.00 0.00 O ATOM 1747 CB ALA A 119 8.461 -6.997 -1.291 1.00 0.00 C ATOM 0 H ALA A 119 9.658 -6.235 0.716 1.00 0.00 H new ATOM 0 HA ALA A 119 7.339 -7.756 0.365 1.00 0.00 H new ATOM 0 HB1 ALA A 119 7.862 -7.514 -2.041 1.00 0.00 H new ATOM 0 HB2 ALA A 119 8.082 -5.983 -1.160 1.00 0.00 H new ATOM 0 HB3 ALA A 119 9.499 -6.957 -1.621 1.00 0.00 H new ATOM 1753 N LEU A 120 10.140 -9.392 -0.213 1.00 0.00 N ATOM 1754 CA LEU A 120 10.702 -10.728 -0.383 1.00 0.00 C ATOM 1755 C LEU A 120 10.386 -11.609 0.821 1.00 0.00 C ATOM 1756 O LEU A 120 9.811 -12.688 0.680 1.00 0.00 O ATOM 1757 CB LEU A 120 12.216 -10.643 -0.585 1.00 0.00 C ATOM 1758 CG LEU A 120 12.685 -9.909 -1.842 1.00 0.00 C ATOM 1759 CD1 LEU A 120 14.089 -9.358 -1.645 1.00 0.00 C ATOM 1760 CD2 LEU A 120 12.639 -10.835 -3.049 1.00 0.00 C ATOM 0 H LEU A 120 10.834 -8.647 -0.151 1.00 0.00 H new ATOM 0 HA LEU A 120 10.248 -11.177 -1.267 1.00 0.00 H new ATOM 0 HB2 LEU A 120 12.651 -10.149 0.284 1.00 0.00 H new ATOM 0 HB3 LEU A 120 12.617 -11.656 -0.609 1.00 0.00 H new ATOM 0 HG LEU A 120 12.010 -9.073 -2.024 1.00 0.00 H new ATOM 0 HD11 LEU A 120 14.406 -8.839 -2.549 1.00 0.00 H new ATOM 0 HD12 LEU A 120 14.092 -8.661 -0.807 1.00 0.00 H new ATOM 0 HD13 LEU A 120 14.776 -10.178 -1.437 1.00 0.00 H new ATOM 0 HD21 LEU A 120 12.976 -10.296 -3.934 1.00 0.00 H new ATOM 0 HD22 LEU A 120 13.291 -11.691 -2.876 1.00 0.00 H new ATOM 0 HD23 LEU A 120 11.617 -11.182 -3.203 1.00 0.00 H new ATOM 1772 N SER A 121 10.765 -11.140 2.006 1.00 0.00 N ATOM 1773 CA SER A 121 10.524 -11.886 3.235 1.00 0.00 C ATOM 1774 C SER A 121 9.124 -12.492 3.238 1.00 0.00 C ATOM 1775 O SER A 121 8.935 -13.643 3.629 1.00 0.00 O ATOM 1776 CB SER A 121 10.700 -10.976 4.452 1.00 0.00 C ATOM 1777 OG SER A 121 10.966 -11.732 5.621 1.00 0.00 O ATOM 0 H SER A 121 11.240 -10.247 2.140 1.00 0.00 H new ATOM 0 HA SER A 121 11.252 -12.696 3.287 1.00 0.00 H new ATOM 0 HB2 SER A 121 11.518 -10.278 4.273 1.00 0.00 H new ATOM 0 HB3 SER A 121 9.799 -10.380 4.598 1.00 0.00 H new ATOM 0 HG SER A 121 11.076 -11.127 6.384 1.00 0.00 H new ATOM 1783 N ALA A 122 8.146 -11.707 2.798 1.00 0.00 N ATOM 1784 CA ALA A 122 6.763 -12.166 2.746 1.00 0.00 C ATOM 1785 C ALA A 122 6.542 -13.113 1.572 1.00 0.00 C ATOM 1786 O ALA A 122 5.933 -14.173 1.723 1.00 0.00 O ATOM 1787 CB ALA A 122 5.817 -10.978 2.654 1.00 0.00 C ATOM 0 H ALA A 122 8.286 -10.750 2.472 1.00 0.00 H new ATOM 0 HA ALA A 122 6.553 -12.714 3.664 1.00 0.00 H new ATOM 0 HB1 ALA A 122 4.788 -11.335 2.616 1.00 0.00 H new ATOM 0 HB2 ALA A 122 5.948 -10.340 3.528 1.00 0.00 H new ATOM 0 HB3 ALA A 122 6.037 -10.407 1.752 1.00 0.00 H new ATOM 1793 N LEU A 123 7.040 -12.725 0.403 1.00 0.00 N ATOM 1794 CA LEU A 123 6.896 -13.541 -0.798 1.00 0.00 C ATOM 1795 C LEU A 123 7.322 -14.981 -0.533 1.00 0.00 C ATOM 1796 O LEU A 123 6.557 -15.918 -0.764 1.00 0.00 O ATOM 1797 CB LEU A 123 7.727 -12.953 -1.940 1.00 0.00 C ATOM 1798 CG LEU A 123 7.420 -13.489 -3.338 1.00 0.00 C ATOM 1799 CD1 LEU A 123 7.318 -15.006 -3.318 1.00 0.00 C ATOM 1800 CD2 LEU A 123 6.136 -12.874 -3.875 1.00 0.00 C ATOM 0 H LEU A 123 7.547 -11.851 0.261 1.00 0.00 H new ATOM 0 HA LEU A 123 5.844 -13.540 -1.084 1.00 0.00 H new ATOM 0 HB2 LEU A 123 7.584 -11.872 -1.948 1.00 0.00 H new ATOM 0 HB3 LEU A 123 8.780 -13.134 -1.727 1.00 0.00 H new ATOM 0 HG LEU A 123 8.239 -13.209 -4.001 1.00 0.00 H new ATOM 0 HD11 LEU A 123 7.099 -15.369 -4.322 1.00 0.00 H new ATOM 0 HD12 LEU A 123 8.263 -15.430 -2.977 1.00 0.00 H new ATOM 0 HD13 LEU A 123 6.519 -15.308 -2.641 1.00 0.00 H new ATOM 0 HD21 LEU A 123 5.933 -13.267 -4.871 1.00 0.00 H new ATOM 0 HD22 LEU A 123 5.308 -13.123 -3.211 1.00 0.00 H new ATOM 0 HD23 LEU A 123 6.246 -11.791 -3.928 1.00 0.00 H new ATOM 1812 N ARG A 124 8.546 -15.150 -0.044 1.00 0.00 N ATOM 1813 CA ARG A 124 9.074 -16.476 0.254 1.00 0.00 C ATOM 1814 C ARG A 124 8.172 -17.211 1.241 1.00 0.00 C ATOM 1815 O ARG A 124 8.061 -18.436 1.203 1.00 0.00 O ATOM 1816 CB ARG A 124 10.490 -16.369 0.822 1.00 0.00 C ATOM 1817 CG ARG A 124 10.538 -15.815 2.237 1.00 0.00 C ATOM 1818 CD ARG A 124 11.843 -16.173 2.931 1.00 0.00 C ATOM 1819 NE ARG A 124 12.949 -15.328 2.488 1.00 0.00 N ATOM 1820 CZ ARG A 124 14.077 -15.176 3.172 1.00 0.00 C ATOM 1821 NH1 ARG A 124 14.249 -15.809 4.324 1.00 0.00 N ATOM 1822 NH2 ARG A 124 15.038 -14.389 2.703 1.00 0.00 N ATOM 0 H ARG A 124 9.191 -14.385 0.154 1.00 0.00 H new ATOM 0 HA ARG A 124 9.105 -17.044 -0.676 1.00 0.00 H new ATOM 0 HB2 ARG A 124 10.952 -17.356 0.811 1.00 0.00 H new ATOM 0 HB3 ARG A 124 11.087 -15.731 0.170 1.00 0.00 H new ATOM 0 HG2 ARG A 124 10.425 -14.731 2.209 1.00 0.00 H new ATOM 0 HG3 ARG A 124 9.699 -16.208 2.812 1.00 0.00 H new ATOM 0 HD2 ARG A 124 11.719 -16.072 4.009 1.00 0.00 H new ATOM 0 HD3 ARG A 124 12.084 -17.218 2.734 1.00 0.00 H new ATOM 0 HE ARG A 124 12.849 -14.827 1.605 1.00 0.00 H new ATOM 0 HH11 ARG A 124 13.514 -16.415 4.688 1.00 0.00 H new ATOM 0 HH12 ARG A 124 15.117 -15.690 4.847 1.00 0.00 H new ATOM 0 HH21 ARG A 124 14.910 -13.901 1.817 1.00 0.00 H new ATOM 0 HH22 ARG A 124 15.904 -14.273 3.229 1.00 0.00 H new ATOM 1836 N SER A 125 7.530 -16.453 2.125 1.00 0.00 N ATOM 1837 CA SER A 125 6.642 -17.032 3.126 1.00 0.00 C ATOM 1838 C SER A 125 5.478 -17.761 2.462 1.00 0.00 C ATOM 1839 O SER A 125 5.233 -18.937 2.729 1.00 0.00 O ATOM 1840 CB SER A 125 6.110 -15.942 4.058 1.00 0.00 C ATOM 1841 OG SER A 125 5.618 -16.499 5.265 1.00 0.00 O ATOM 0 H SER A 125 7.608 -15.437 2.168 1.00 0.00 H new ATOM 0 HA SER A 125 7.214 -17.753 3.710 1.00 0.00 H new ATOM 0 HB2 SER A 125 6.904 -15.229 4.280 1.00 0.00 H new ATOM 0 HB3 SER A 125 5.315 -15.388 3.559 1.00 0.00 H new ATOM 0 HG SER A 125 5.285 -15.782 5.844 1.00 0.00 H new ATOM 1847 N GLY A 126 4.762 -17.053 1.593 1.00 0.00 N ATOM 1848 CA GLY A 126 3.632 -17.648 0.904 1.00 0.00 C ATOM 1849 C GLY A 126 2.592 -18.195 1.860 1.00 0.00 C ATOM 1850 O GLY A 126 2.885 -18.520 3.011 1.00 0.00 O ATOM 0 H GLY A 126 4.945 -16.078 1.354 1.00 0.00 H new ATOM 0 HA2 GLY A 126 3.170 -16.901 0.258 1.00 0.00 H new ATOM 0 HA3 GLY A 126 3.986 -18.452 0.259 1.00 0.00 H new ATOM 1854 N PRO A 127 1.342 -18.302 1.384 1.00 0.00 N ATOM 1855 CA PRO A 127 0.229 -18.812 2.190 1.00 0.00 C ATOM 1856 C PRO A 127 0.354 -20.306 2.472 1.00 0.00 C ATOM 1857 O PRO A 127 -0.359 -20.850 3.315 1.00 0.00 O ATOM 1858 CB PRO A 127 -0.997 -18.534 1.317 1.00 0.00 C ATOM 1859 CG PRO A 127 -0.470 -18.497 -0.076 1.00 0.00 C ATOM 1860 CD PRO A 127 0.920 -17.934 0.022 1.00 0.00 C ATOM 0 HA PRO A 127 0.187 -18.340 3.172 1.00 0.00 H new ATOM 0 HB2 PRO A 127 -1.751 -19.312 1.434 1.00 0.00 H new ATOM 0 HB3 PRO A 127 -1.469 -17.589 1.587 1.00 0.00 H new ATOM 0 HG2 PRO A 127 -0.457 -19.495 -0.515 1.00 0.00 H new ATOM 0 HG3 PRO A 127 -1.098 -17.876 -0.715 1.00 0.00 H new ATOM 0 HD2 PRO A 127 1.581 -18.361 -0.733 1.00 0.00 H new ATOM 0 HD3 PRO A 127 0.927 -16.854 -0.123 1.00 0.00 H new ATOM 1868 N SER A 128 1.265 -20.963 1.762 1.00 0.00 N ATOM 1869 CA SER A 128 1.482 -22.395 1.934 1.00 0.00 C ATOM 1870 C SER A 128 0.273 -23.189 1.447 1.00 0.00 C ATOM 1871 O SER A 128 -0.145 -24.156 2.084 1.00 0.00 O ATOM 1872 CB SER A 128 1.760 -22.717 3.403 1.00 0.00 C ATOM 1873 OG SER A 128 2.324 -24.010 3.544 1.00 0.00 O ATOM 0 H SER A 128 1.865 -20.527 1.062 1.00 0.00 H new ATOM 0 HA SER A 128 2.348 -22.681 1.337 1.00 0.00 H new ATOM 0 HB2 SER A 128 2.439 -21.973 3.819 1.00 0.00 H new ATOM 0 HB3 SER A 128 0.833 -22.657 3.973 1.00 0.00 H new ATOM 0 HG SER A 128 1.719 -24.675 3.153 1.00 0.00 H new ATOM 1879 N SER A 129 -0.284 -22.773 0.315 1.00 0.00 N ATOM 1880 CA SER A 129 -1.447 -23.442 -0.256 1.00 0.00 C ATOM 1881 C SER A 129 -1.099 -24.090 -1.593 1.00 0.00 C ATOM 1882 O SER A 129 -0.008 -23.894 -2.125 1.00 0.00 O ATOM 1883 CB SER A 129 -2.594 -22.446 -0.443 1.00 0.00 C ATOM 1884 OG SER A 129 -2.351 -21.589 -1.544 1.00 0.00 O ATOM 0 H SER A 129 0.051 -21.975 -0.225 1.00 0.00 H new ATOM 0 HA SER A 129 -1.762 -24.223 0.436 1.00 0.00 H new ATOM 0 HB2 SER A 129 -3.528 -22.987 -0.598 1.00 0.00 H new ATOM 0 HB3 SER A 129 -2.716 -21.853 0.463 1.00 0.00 H new ATOM 0 HG SER A 129 -3.099 -20.964 -1.643 1.00 0.00 H new ATOM 1890 N GLY A 130 -2.037 -24.865 -2.130 1.00 0.00 N ATOM 1891 CA GLY A 130 -1.811 -25.531 -3.399 1.00 0.00 C ATOM 1892 C GLY A 130 -2.243 -24.687 -4.582 1.00 0.00 C ATOM 1893 O GLY A 130 -1.646 -24.761 -5.656 1.00 0.00 O ATOM 0 H GLY A 130 -2.949 -25.043 -1.709 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -0.752 -25.772 -3.496 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -2.355 -26.475 -3.412 1.00 0.00 H new TER 1897 GLY A 130