USER MOD reduce.3.24.130724 H: found=0, std=0, add=913, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 911 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 58 ASN : amide:sc= -1.82 K(o=-4.2,f=-2.3) USER MOD Set 1.2: A 108 ASN : amide:sc= -2.35! K(o=-4.2!,f=-2.3) USER MOD Set 2.1: A 99 SER OG : rot 2:sc= 1.13 USER MOD Set 2.2: A 118 THR OG1 : rot -48:sc= 0.0573 USER MOD Set 3.1: A 70 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00865) USER MOD Set 3.2: A 96 SER OG : rot 180:sc= 0 USER MOD Set 4.1: A 65 LYS NZ :NH3+ -124:sc= -1.33 (180deg=-2.09!) USER MOD Set 4.2: A 105 MET CE :methyl 145:sc= -0.505 (180deg=-2.49!) USER MOD Set 4.3: A 110 THR OG1 : rot -77:sc= 0.899 USER MOD Single : A 1 GLY N :NH3+ -112:sc= 0.0392 (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 180:sc= 0.00304 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.231 K(o=-0.23,f=-2.6!) USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 THR OG1 : rot 180:sc= -0.0529 USER MOD Single : A 20 THR OG1 : rot 34:sc= 0.358 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot -47:sc= 0.013 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 ASN : amide:sc= -0.0957 X(o=-0.096,f=-0.39) USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= -0.439 X(o=-0.44,f=-0.38) USER MOD Single : A 42 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 46 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0199) USER MOD Single : A 48 SER OG : rot 180:sc= -0.172 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot -68:sc= 0.318 USER MOD Single : A 57 GLN : amide:sc= -0.0532 K(o=-0.053,f=-0.83) USER MOD Single : A 62 THR OG1 : rot 180:sc= -0.0252 USER MOD Single : A 64 TYR OH : rot 150:sc= 0 USER MOD Single : A 68 HIS : no HD1:sc= -0.0794 X(o=-0.079,f=-0.079) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 THR OG1 : rot 180:sc= -0.0737 USER MOD Single : A 77 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot -21:sc= 0.63 USER MOD Single : A 83 ASN : amide:sc= -0.255 K(o=-0.25,f=-3.1!) USER MOD Single : A 84 ASN : amide:sc=-0.000759 X(o=-0.00076,f=-0.00076) USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 98 TYR OH : rot 30:sc= 0.112 USER MOD Single : A 101 GLN : amide:sc= -8.72! C(o=-8.7!,f=-9.1!) USER MOD Single : A 103 SER OG : rot 180:sc= -0.306 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot -120:sc= -0.0481 USER MOD Single : A 115 ASN : amide:sc= -0.303 K(o=-0.3,f=-1.8) USER MOD Single : A 117 TYR OH : rot 180:sc= 0 USER MOD Single : A 121 THR OG1 : rot 170:sc= 0.948 USER MOD Single : A 124 ASN : amide:sc= 0.0731 K(o=0.073,f=-1.4!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 44.899 -33.728 53.454 1.00 0.00 N ATOM 2 CA GLY A 1 43.752 -32.923 53.077 1.00 0.00 C ATOM 3 C GLY A 1 44.145 -31.536 52.610 1.00 0.00 C ATOM 4 O GLY A 1 45.213 -31.035 52.961 1.00 0.00 O ATOM 0 H1 GLY A 1 45.016 -34.506 52.774 1.00 0.00 H new ATOM 0 H2 GLY A 1 45.754 -33.136 53.453 1.00 0.00 H new ATOM 0 H3 GLY A 1 44.750 -34.120 54.406 1.00 0.00 H new ATOM 0 HA2 GLY A 1 43.203 -33.428 52.283 1.00 0.00 H new ATOM 0 HA3 GLY A 1 43.076 -32.838 53.928 1.00 0.00 H new ATOM 8 N SER A 2 43.280 -30.914 51.815 1.00 0.00 N ATOM 9 CA SER A 2 43.545 -29.578 51.294 1.00 0.00 C ATOM 10 C SER A 2 42.306 -29.005 50.612 1.00 0.00 C ATOM 11 O SER A 2 41.899 -29.472 49.548 1.00 0.00 O ATOM 12 CB SER A 2 44.714 -29.614 50.308 1.00 0.00 C ATOM 13 OG SER A 2 45.238 -28.316 50.090 1.00 0.00 O ATOM 0 H SER A 2 42.390 -31.314 51.518 1.00 0.00 H new ATOM 0 HA SER A 2 43.807 -28.933 52.133 1.00 0.00 H new ATOM 0 HB2 SER A 2 45.498 -30.266 50.693 1.00 0.00 H new ATOM 0 HB3 SER A 2 44.382 -30.039 49.361 1.00 0.00 H new ATOM 0 HG SER A 2 45.985 -28.367 49.458 1.00 0.00 H new ATOM 19 N SER A 3 41.712 -27.991 51.232 1.00 0.00 N ATOM 20 CA SER A 3 40.518 -27.356 50.687 1.00 0.00 C ATOM 21 C SER A 3 40.761 -25.873 50.428 1.00 0.00 C ATOM 22 O SER A 3 41.736 -25.298 50.912 1.00 0.00 O ATOM 23 CB SER A 3 39.339 -27.531 51.647 1.00 0.00 C ATOM 24 OG SER A 3 39.597 -26.902 52.891 1.00 0.00 O ATOM 0 H SER A 3 42.038 -27.591 52.112 1.00 0.00 H new ATOM 0 HA SER A 3 40.281 -27.838 49.739 1.00 0.00 H new ATOM 0 HB2 SER A 3 38.438 -27.109 51.202 1.00 0.00 H new ATOM 0 HB3 SER A 3 39.149 -28.593 51.805 1.00 0.00 H new ATOM 0 HG SER A 3 38.828 -27.026 53.486 1.00 0.00 H new ATOM 30 N GLY A 4 39.867 -25.258 49.659 1.00 0.00 N ATOM 31 CA GLY A 4 40.002 -23.847 49.347 1.00 0.00 C ATOM 32 C GLY A 4 38.662 -23.151 49.220 1.00 0.00 C ATOM 33 O GLY A 4 37.648 -23.648 49.710 1.00 0.00 O ATOM 0 H GLY A 4 39.052 -25.712 49.247 1.00 0.00 H new ATOM 0 HA2 GLY A 4 40.588 -23.360 50.126 1.00 0.00 H new ATOM 0 HA3 GLY A 4 40.556 -23.735 48.415 1.00 0.00 H new ATOM 37 N SER A 5 38.656 -21.996 48.563 1.00 0.00 N ATOM 38 CA SER A 5 37.431 -21.227 48.378 1.00 0.00 C ATOM 39 C SER A 5 37.680 -20.014 47.487 1.00 0.00 C ATOM 40 O SER A 5 38.812 -19.748 47.084 1.00 0.00 O ATOM 41 CB SER A 5 36.879 -20.774 49.732 1.00 0.00 C ATOM 42 OG SER A 5 35.521 -20.386 49.625 1.00 0.00 O ATOM 0 H SER A 5 39.486 -21.572 48.150 1.00 0.00 H new ATOM 0 HA SER A 5 36.698 -21.870 47.891 1.00 0.00 H new ATOM 0 HB2 SER A 5 36.973 -21.583 50.456 1.00 0.00 H new ATOM 0 HB3 SER A 5 37.470 -19.939 50.108 1.00 0.00 H new ATOM 0 HG SER A 5 35.192 -20.103 50.503 1.00 0.00 H new ATOM 48 N SER A 6 36.613 -19.282 47.182 1.00 0.00 N ATOM 49 CA SER A 6 36.713 -18.100 46.335 1.00 0.00 C ATOM 50 C SER A 6 35.388 -17.346 46.295 1.00 0.00 C ATOM 51 O SER A 6 34.399 -17.774 46.890 1.00 0.00 O ATOM 52 CB SER A 6 37.130 -18.496 44.917 1.00 0.00 C ATOM 53 OG SER A 6 36.053 -19.094 44.217 1.00 0.00 O ATOM 0 H SER A 6 35.669 -19.487 47.509 1.00 0.00 H new ATOM 0 HA SER A 6 37.472 -17.443 46.760 1.00 0.00 H new ATOM 0 HB2 SER A 6 37.474 -17.614 44.376 1.00 0.00 H new ATOM 0 HB3 SER A 6 37.969 -19.190 44.962 1.00 0.00 H new ATOM 0 HG SER A 6 36.345 -19.336 43.313 1.00 0.00 H new ATOM 59 N GLY A 7 35.376 -16.219 45.590 1.00 0.00 N ATOM 60 CA GLY A 7 34.167 -15.422 45.485 1.00 0.00 C ATOM 61 C GLY A 7 34.289 -14.317 44.454 1.00 0.00 C ATOM 62 O GLY A 7 35.317 -14.188 43.792 1.00 0.00 O ATOM 0 H GLY A 7 36.182 -15.843 45.090 1.00 0.00 H new ATOM 0 HA2 GLY A 7 33.330 -16.069 45.222 1.00 0.00 H new ATOM 0 HA3 GLY A 7 33.938 -14.984 46.457 1.00 0.00 H new ATOM 66 N ASN A 8 33.235 -13.519 44.318 1.00 0.00 N ATOM 67 CA ASN A 8 33.228 -12.420 43.359 1.00 0.00 C ATOM 68 C ASN A 8 32.016 -11.518 43.574 1.00 0.00 C ATOM 69 O ASN A 8 31.208 -11.751 44.473 1.00 0.00 O ATOM 70 CB ASN A 8 33.225 -12.964 41.929 1.00 0.00 C ATOM 71 CG ASN A 8 32.193 -14.057 41.727 1.00 0.00 C ATOM 72 OD1 ASN A 8 31.261 -14.199 42.519 1.00 0.00 O ATOM 73 ND2 ASN A 8 32.355 -14.835 40.664 1.00 0.00 N ATOM 0 H ASN A 8 32.375 -13.613 44.859 1.00 0.00 H new ATOM 0 HA ASN A 8 34.131 -11.829 43.514 1.00 0.00 H new ATOM 0 HB2 ASN A 8 33.027 -12.148 41.234 1.00 0.00 H new ATOM 0 HB3 ASN A 8 34.214 -13.354 41.690 1.00 0.00 H new ATOM 0 HD21 ASN A 8 31.692 -15.587 40.477 1.00 0.00 H new ATOM 0 HD22 ASN A 8 33.142 -14.681 40.034 1.00 0.00 H new ATOM 80 N ARG A 9 31.896 -10.489 42.742 1.00 0.00 N ATOM 81 CA ARG A 9 30.784 -9.552 42.841 1.00 0.00 C ATOM 82 C ARG A 9 30.786 -8.579 41.665 1.00 0.00 C ATOM 83 O ARG A 9 31.824 -8.016 41.314 1.00 0.00 O ATOM 84 CB ARG A 9 30.858 -8.777 44.158 1.00 0.00 C ATOM 85 CG ARG A 9 29.505 -8.297 44.659 1.00 0.00 C ATOM 86 CD ARG A 9 29.134 -6.951 44.057 1.00 0.00 C ATOM 87 NE ARG A 9 27.875 -6.440 44.593 1.00 0.00 N ATOM 88 CZ ARG A 9 27.772 -5.826 45.766 1.00 0.00 C ATOM 89 NH1 ARG A 9 28.847 -5.647 46.522 1.00 0.00 N ATOM 90 NH2 ARG A 9 26.592 -5.389 46.186 1.00 0.00 N ATOM 0 H ARG A 9 32.555 -10.283 41.992 1.00 0.00 H new ATOM 0 HA ARG A 9 29.857 -10.124 42.815 1.00 0.00 H new ATOM 0 HB2 ARG A 9 31.313 -9.412 44.918 1.00 0.00 H new ATOM 0 HB3 ARG A 9 31.514 -7.916 44.027 1.00 0.00 H new ATOM 0 HG2 ARG A 9 28.741 -9.032 44.407 1.00 0.00 H new ATOM 0 HG3 ARG A 9 29.525 -8.218 45.746 1.00 0.00 H new ATOM 0 HD2 ARG A 9 29.930 -6.233 44.255 1.00 0.00 H new ATOM 0 HD3 ARG A 9 29.054 -7.048 42.974 1.00 0.00 H new ATOM 0 HE ARG A 9 27.029 -6.561 44.036 1.00 0.00 H new ATOM 0 HH11 ARG A 9 29.756 -5.981 46.203 1.00 0.00 H new ATOM 0 HH12 ARG A 9 28.764 -5.175 47.422 1.00 0.00 H new ATOM 0 HH21 ARG A 9 25.763 -5.524 45.608 1.00 0.00 H new ATOM 0 HH22 ARG A 9 26.514 -4.918 47.087 1.00 0.00 H new ATOM 104 N TYR A 10 29.619 -8.386 41.061 1.00 0.00 N ATOM 105 CA TYR A 10 29.487 -7.484 39.924 1.00 0.00 C ATOM 106 C TYR A 10 28.151 -6.748 39.964 1.00 0.00 C ATOM 107 O TYR A 10 27.252 -7.111 40.721 1.00 0.00 O ATOM 108 CB TYR A 10 29.614 -8.261 38.612 1.00 0.00 C ATOM 109 CG TYR A 10 28.588 -9.361 38.458 1.00 0.00 C ATOM 110 CD1 TYR A 10 28.646 -10.508 39.241 1.00 0.00 C ATOM 111 CD2 TYR A 10 27.559 -9.253 37.531 1.00 0.00 C ATOM 112 CE1 TYR A 10 27.711 -11.515 39.103 1.00 0.00 C ATOM 113 CE2 TYR A 10 26.618 -10.255 37.387 1.00 0.00 C ATOM 114 CZ TYR A 10 26.699 -11.384 38.175 1.00 0.00 C ATOM 115 OH TYR A 10 25.765 -12.385 38.035 1.00 0.00 O ATOM 0 H TYR A 10 28.751 -8.842 41.340 1.00 0.00 H new ATOM 0 HA TYR A 10 30.289 -6.748 39.982 1.00 0.00 H new ATOM 0 HB2 TYR A 10 29.518 -7.567 37.777 1.00 0.00 H new ATOM 0 HB3 TYR A 10 30.612 -8.695 38.552 1.00 0.00 H new ATOM 0 HD1 TYR A 10 29.436 -10.614 39.970 1.00 0.00 H new ATOM 0 HD2 TYR A 10 27.493 -8.370 36.912 1.00 0.00 H new ATOM 0 HE1 TYR A 10 27.772 -12.400 39.718 1.00 0.00 H new ATOM 0 HE2 TYR A 10 25.824 -10.154 36.662 1.00 0.00 H new ATOM 0 HH TYR A 10 25.120 -12.136 37.340 1.00 0.00 H new ATOM 125 N GLY A 11 28.030 -5.710 39.142 1.00 0.00 N ATOM 126 CA GLY A 11 26.801 -4.939 39.099 1.00 0.00 C ATOM 127 C GLY A 11 26.840 -3.846 38.048 1.00 0.00 C ATOM 128 O GLY A 11 27.150 -2.690 38.335 1.00 0.00 O ATOM 0 H GLY A 11 28.760 -5.390 38.506 1.00 0.00 H new ATOM 0 HA2 GLY A 11 25.964 -5.606 38.894 1.00 0.00 H new ATOM 0 HA3 GLY A 11 26.621 -4.493 40.077 1.00 0.00 H new ATOM 132 N PRO A 12 26.520 -4.211 36.797 1.00 0.00 N ATOM 133 CA PRO A 12 26.513 -3.268 35.675 1.00 0.00 C ATOM 134 C PRO A 12 25.377 -2.257 35.775 1.00 0.00 C ATOM 135 O PRO A 12 24.610 -2.263 36.736 1.00 0.00 O ATOM 136 CB PRO A 12 26.320 -4.171 34.454 1.00 0.00 C ATOM 137 CG PRO A 12 25.627 -5.380 34.983 1.00 0.00 C ATOM 138 CD PRO A 12 26.141 -5.572 36.383 1.00 0.00 C ATOM 0 HA PRO A 12 27.423 -2.669 35.640 1.00 0.00 H new ATOM 0 HB2 PRO A 12 25.724 -3.677 33.687 1.00 0.00 H new ATOM 0 HB3 PRO A 12 27.276 -4.430 33.998 1.00 0.00 H new ATOM 0 HG2 PRO A 12 24.546 -5.243 34.980 1.00 0.00 H new ATOM 0 HG3 PRO A 12 25.840 -6.253 34.366 1.00 0.00 H new ATOM 0 HD2 PRO A 12 25.377 -5.993 37.037 1.00 0.00 H new ATOM 0 HD3 PRO A 12 26.993 -6.252 36.409 1.00 0.00 H new ATOM 146 N GLY A 13 25.275 -1.387 34.774 1.00 0.00 N ATOM 147 CA GLY A 13 24.228 -0.382 34.768 1.00 0.00 C ATOM 148 C GLY A 13 23.480 -0.330 33.451 1.00 0.00 C ATOM 149 O GLY A 13 24.067 -0.530 32.387 1.00 0.00 O ATOM 0 H GLY A 13 25.899 -1.361 33.967 1.00 0.00 H new ATOM 0 HA2 GLY A 13 23.524 -0.591 35.574 1.00 0.00 H new ATOM 0 HA3 GLY A 13 24.666 0.595 34.972 1.00 0.00 H new ATOM 153 N VAL A 14 22.180 -0.062 33.520 1.00 0.00 N ATOM 154 CA VAL A 14 21.351 0.014 32.324 1.00 0.00 C ATOM 155 C VAL A 14 20.390 1.196 32.396 1.00 0.00 C ATOM 156 O VAL A 14 19.804 1.470 33.443 1.00 0.00 O ATOM 157 CB VAL A 14 20.541 -1.279 32.118 1.00 0.00 C ATOM 158 CG1 VAL A 14 19.635 -1.155 30.903 1.00 0.00 C ATOM 159 CG2 VAL A 14 21.472 -2.474 31.979 1.00 0.00 C ATOM 0 H VAL A 14 21.678 0.106 34.392 1.00 0.00 H new ATOM 0 HA VAL A 14 22.027 0.149 31.479 1.00 0.00 H new ATOM 0 HB VAL A 14 19.913 -1.436 32.995 1.00 0.00 H new ATOM 0 HG11 VAL A 14 19.071 -2.079 30.774 1.00 0.00 H new ATOM 0 HG12 VAL A 14 18.944 -0.325 31.048 1.00 0.00 H new ATOM 0 HG13 VAL A 14 20.240 -0.972 30.015 1.00 0.00 H new ATOM 0 HG21 VAL A 14 20.883 -3.379 31.834 1.00 0.00 H new ATOM 0 HG22 VAL A 14 22.128 -2.327 31.121 1.00 0.00 H new ATOM 0 HG23 VAL A 14 22.074 -2.573 32.882 1.00 0.00 H new ATOM 169 N SER A 15 20.234 1.894 31.275 1.00 0.00 N ATOM 170 CA SER A 15 19.346 3.049 31.212 1.00 0.00 C ATOM 171 C SER A 15 18.773 3.217 29.808 1.00 0.00 C ATOM 172 O SER A 15 19.266 2.625 28.847 1.00 0.00 O ATOM 173 CB SER A 15 20.095 4.317 31.625 1.00 0.00 C ATOM 174 OG SER A 15 21.287 4.473 30.874 1.00 0.00 O ATOM 0 H SER A 15 20.711 1.680 30.399 1.00 0.00 H new ATOM 0 HA SER A 15 18.521 2.881 31.904 1.00 0.00 H new ATOM 0 HB2 SER A 15 19.453 5.186 31.479 1.00 0.00 H new ATOM 0 HB3 SER A 15 20.334 4.272 32.687 1.00 0.00 H new ATOM 0 HG SER A 15 21.746 5.292 31.156 1.00 0.00 H new ATOM 180 N THR A 16 17.727 4.031 29.696 1.00 0.00 N ATOM 181 CA THR A 16 17.085 4.277 28.411 1.00 0.00 C ATOM 182 C THR A 16 17.587 5.574 27.785 1.00 0.00 C ATOM 183 O THR A 16 17.958 5.605 26.612 1.00 0.00 O ATOM 184 CB THR A 16 15.553 4.349 28.553 1.00 0.00 C ATOM 185 OG1 THR A 16 15.196 5.368 29.493 1.00 0.00 O ATOM 186 CG2 THR A 16 14.989 3.012 29.008 1.00 0.00 C ATOM 0 H THR A 16 17.307 4.531 30.480 1.00 0.00 H new ATOM 0 HA THR A 16 17.344 3.440 27.763 1.00 0.00 H new ATOM 0 HB THR A 16 15.130 4.591 27.578 1.00 0.00 H new ATOM 0 HG1 THR A 16 14.220 5.409 29.576 1.00 0.00 H new ATOM 0 HG21 THR A 16 13.906 3.087 29.101 1.00 0.00 H new ATOM 0 HG22 THR A 16 15.238 2.244 28.276 1.00 0.00 H new ATOM 0 HG23 THR A 16 15.419 2.745 29.974 1.00 0.00 H new ATOM 194 N ASP A 17 17.598 6.641 28.576 1.00 0.00 N ATOM 195 CA ASP A 17 18.057 7.941 28.099 1.00 0.00 C ATOM 196 C ASP A 17 17.433 8.275 26.748 1.00 0.00 C ATOM 197 O ASP A 17 18.094 8.827 25.868 1.00 0.00 O ATOM 198 CB ASP A 17 19.582 7.958 27.989 1.00 0.00 C ATOM 199 CG ASP A 17 20.159 9.351 28.150 1.00 0.00 C ATOM 200 OD1 ASP A 17 20.268 10.069 27.134 1.00 0.00 O ATOM 201 OD2 ASP A 17 20.500 9.723 29.292 1.00 0.00 O ATOM 0 H ASP A 17 17.295 6.632 29.550 1.00 0.00 H new ATOM 0 HA ASP A 17 17.744 8.696 28.820 1.00 0.00 H new ATOM 0 HB2 ASP A 17 20.006 7.302 28.750 1.00 0.00 H new ATOM 0 HB3 ASP A 17 19.878 7.555 27.020 1.00 0.00 H new ATOM 206 N ASP A 18 16.158 7.937 26.591 1.00 0.00 N ATOM 207 CA ASP A 18 15.445 8.201 25.346 1.00 0.00 C ATOM 208 C ASP A 18 14.478 9.370 25.512 1.00 0.00 C ATOM 209 O ASP A 18 13.525 9.294 26.288 1.00 0.00 O ATOM 210 CB ASP A 18 14.684 6.954 24.895 1.00 0.00 C ATOM 211 CG ASP A 18 15.610 5.850 24.422 1.00 0.00 C ATOM 212 OD1 ASP A 18 16.395 6.097 23.483 1.00 0.00 O ATOM 213 OD2 ASP A 18 15.550 4.740 24.991 1.00 0.00 O ATOM 0 H ASP A 18 15.597 7.480 27.310 1.00 0.00 H new ATOM 0 HA ASP A 18 16.179 8.464 24.584 1.00 0.00 H new ATOM 0 HB2 ASP A 18 14.075 6.585 25.721 1.00 0.00 H new ATOM 0 HB3 ASP A 18 14.000 7.221 24.089 1.00 0.00 H new ATOM 218 N ILE A 19 14.731 10.449 24.779 1.00 0.00 N ATOM 219 CA ILE A 19 13.883 11.632 24.845 1.00 0.00 C ATOM 220 C ILE A 19 13.396 12.038 23.458 1.00 0.00 C ATOM 221 O ILE A 19 14.088 11.834 22.460 1.00 0.00 O ATOM 222 CB ILE A 19 14.624 12.821 25.484 1.00 0.00 C ATOM 223 CG1 ILE A 19 15.644 13.402 24.502 1.00 0.00 C ATOM 224 CG2 ILE A 19 15.309 12.388 26.772 1.00 0.00 C ATOM 225 CD1 ILE A 19 16.685 12.403 24.050 1.00 0.00 C ATOM 0 H ILE A 19 15.516 10.528 24.133 1.00 0.00 H new ATOM 0 HA ILE A 19 13.026 11.371 25.467 1.00 0.00 H new ATOM 0 HB ILE A 19 13.897 13.596 25.725 1.00 0.00 H new ATOM 0 HG12 ILE A 19 15.117 13.786 23.628 1.00 0.00 H new ATOM 0 HG13 ILE A 19 16.145 14.250 24.970 1.00 0.00 H new ATOM 0 HG21 ILE A 19 15.828 13.239 27.212 1.00 0.00 H new ATOM 0 HG22 ILE A 19 14.563 12.016 27.474 1.00 0.00 H new ATOM 0 HG23 ILE A 19 16.027 11.598 26.554 1.00 0.00 H new ATOM 0 HD11 ILE A 19 17.374 12.884 23.356 1.00 0.00 H new ATOM 0 HD12 ILE A 19 17.238 12.037 24.915 1.00 0.00 H new ATOM 0 HD13 ILE A 19 16.195 11.566 23.553 1.00 0.00 H new ATOM 237 N THR A 20 12.199 12.615 23.401 1.00 0.00 N ATOM 238 CA THR A 20 11.619 13.050 22.137 1.00 0.00 C ATOM 239 C THR A 20 11.012 14.443 22.262 1.00 0.00 C ATOM 240 O THR A 20 10.161 14.686 23.118 1.00 0.00 O ATOM 241 CB THR A 20 10.535 12.071 21.650 1.00 0.00 C ATOM 242 OG1 THR A 20 9.461 12.019 22.597 1.00 0.00 O ATOM 243 CG2 THR A 20 11.112 10.677 21.454 1.00 0.00 C ATOM 0 H THR A 20 11.613 12.792 24.217 1.00 0.00 H new ATOM 0 HA THR A 20 12.429 13.074 21.408 1.00 0.00 H new ATOM 0 HB THR A 20 10.158 12.429 20.692 1.00 0.00 H new ATOM 0 HG1 THR A 20 9.349 12.899 23.013 1.00 0.00 H new ATOM 0 HG21 THR A 20 10.327 10.003 21.110 1.00 0.00 H new ATOM 0 HG22 THR A 20 11.909 10.714 20.712 1.00 0.00 H new ATOM 0 HG23 THR A 20 11.513 10.313 22.400 1.00 0.00 H new ATOM 251 N VAL A 21 11.453 15.355 21.401 1.00 0.00 N ATOM 252 CA VAL A 21 10.952 16.724 21.414 1.00 0.00 C ATOM 253 C VAL A 21 9.444 16.758 21.192 1.00 0.00 C ATOM 254 O VAL A 21 8.843 15.766 20.780 1.00 0.00 O ATOM 255 CB VAL A 21 11.638 17.583 20.335 1.00 0.00 C ATOM 256 CG1 VAL A 21 13.151 17.493 20.464 1.00 0.00 C ATOM 257 CG2 VAL A 21 11.186 17.155 18.947 1.00 0.00 C ATOM 0 H VAL A 21 12.156 15.170 20.686 1.00 0.00 H new ATOM 0 HA VAL A 21 11.182 17.137 22.396 1.00 0.00 H new ATOM 0 HB VAL A 21 11.346 18.623 20.482 1.00 0.00 H new ATOM 0 HG11 VAL A 21 13.619 18.106 19.694 1.00 0.00 H new ATOM 0 HG12 VAL A 21 13.454 17.852 21.447 1.00 0.00 H new ATOM 0 HG13 VAL A 21 13.465 16.456 20.343 1.00 0.00 H new ATOM 0 HG21 VAL A 21 11.680 17.772 18.197 1.00 0.00 H new ATOM 0 HG22 VAL A 21 11.447 16.109 18.786 1.00 0.00 H new ATOM 0 HG23 VAL A 21 10.106 17.277 18.862 1.00 0.00 H new ATOM 267 N VAL A 22 8.836 17.908 21.469 1.00 0.00 N ATOM 268 CA VAL A 22 7.398 18.073 21.298 1.00 0.00 C ATOM 269 C VAL A 22 7.086 19.026 20.150 1.00 0.00 C ATOM 270 O VAL A 22 6.976 20.237 20.345 1.00 0.00 O ATOM 271 CB VAL A 22 6.738 18.604 22.585 1.00 0.00 C ATOM 272 CG1 VAL A 22 5.245 18.805 22.375 1.00 0.00 C ATOM 273 CG2 VAL A 22 6.998 17.657 23.746 1.00 0.00 C ATOM 0 H VAL A 22 9.318 18.739 21.813 1.00 0.00 H new ATOM 0 HA VAL A 22 6.991 17.088 21.069 1.00 0.00 H new ATOM 0 HB VAL A 22 7.180 19.570 22.828 1.00 0.00 H new ATOM 0 HG11 VAL A 22 4.796 19.180 23.294 1.00 0.00 H new ATOM 0 HG12 VAL A 22 5.084 19.525 21.572 1.00 0.00 H new ATOM 0 HG13 VAL A 22 4.784 17.854 22.108 1.00 0.00 H new ATOM 0 HG21 VAL A 22 6.525 18.047 24.647 1.00 0.00 H new ATOM 0 HG22 VAL A 22 6.584 16.676 23.515 1.00 0.00 H new ATOM 0 HG23 VAL A 22 8.072 17.568 23.910 1.00 0.00 H new ATOM 283 N THR A 23 6.945 18.472 18.950 1.00 0.00 N ATOM 284 CA THR A 23 6.646 19.272 17.769 1.00 0.00 C ATOM 285 C THR A 23 5.592 18.597 16.899 1.00 0.00 C ATOM 286 O THR A 23 5.526 17.369 16.826 1.00 0.00 O ATOM 287 CB THR A 23 7.910 19.519 16.924 1.00 0.00 C ATOM 288 OG1 THR A 23 7.618 20.435 15.862 1.00 0.00 O ATOM 289 CG2 THR A 23 8.438 18.215 16.345 1.00 0.00 C ATOM 0 H THR A 23 7.033 17.472 18.770 1.00 0.00 H new ATOM 0 HA THR A 23 6.262 20.228 18.124 1.00 0.00 H new ATOM 0 HB THR A 23 8.675 19.946 17.572 1.00 0.00 H new ATOM 0 HG1 THR A 23 8.427 20.588 15.330 1.00 0.00 H new ATOM 0 HG21 THR A 23 9.331 18.415 15.752 1.00 0.00 H new ATOM 0 HG22 THR A 23 8.687 17.531 17.156 1.00 0.00 H new ATOM 0 HG23 THR A 23 7.675 17.763 15.711 1.00 0.00 H new ATOM 297 N LEU A 24 4.769 19.406 16.241 1.00 0.00 N ATOM 298 CA LEU A 24 3.716 18.886 15.375 1.00 0.00 C ATOM 299 C LEU A 24 3.716 19.603 14.028 1.00 0.00 C ATOM 300 O LEU A 24 3.820 20.828 13.966 1.00 0.00 O ATOM 301 CB LEU A 24 2.352 19.041 16.048 1.00 0.00 C ATOM 302 CG LEU A 24 2.163 18.286 17.364 1.00 0.00 C ATOM 303 CD1 LEU A 24 2.756 19.074 18.521 1.00 0.00 C ATOM 304 CD2 LEU A 24 0.688 18.003 17.609 1.00 0.00 C ATOM 0 H LEU A 24 4.810 20.424 16.290 1.00 0.00 H new ATOM 0 HA LEU A 24 3.911 17.827 15.203 1.00 0.00 H new ATOM 0 HB2 LEU A 24 2.179 20.101 16.232 1.00 0.00 H new ATOM 0 HB3 LEU A 24 1.584 18.709 15.349 1.00 0.00 H new ATOM 0 HG LEU A 24 2.688 17.334 17.293 1.00 0.00 H new ATOM 0 HD11 LEU A 24 2.612 18.521 19.449 1.00 0.00 H new ATOM 0 HD12 LEU A 24 3.822 19.225 18.350 1.00 0.00 H new ATOM 0 HD13 LEU A 24 2.260 20.042 18.594 1.00 0.00 H new ATOM 0 HD21 LEU A 24 0.572 17.465 18.550 1.00 0.00 H new ATOM 0 HD22 LEU A 24 0.140 18.944 17.659 1.00 0.00 H new ATOM 0 HD23 LEU A 24 0.293 17.397 16.794 1.00 0.00 H new ATOM 316 N SER A 25 3.597 18.831 12.953 1.00 0.00 N ATOM 317 CA SER A 25 3.585 19.391 11.607 1.00 0.00 C ATOM 318 C SER A 25 2.231 19.171 10.939 1.00 0.00 C ATOM 319 O SER A 25 1.294 18.668 11.560 1.00 0.00 O ATOM 320 CB SER A 25 4.693 18.763 10.759 1.00 0.00 C ATOM 321 OG SER A 25 5.972 19.062 11.290 1.00 0.00 O ATOM 0 H SER A 25 3.507 17.816 12.988 1.00 0.00 H new ATOM 0 HA SER A 25 3.762 20.464 11.686 1.00 0.00 H new ATOM 0 HB2 SER A 25 4.556 17.682 10.718 1.00 0.00 H new ATOM 0 HB3 SER A 25 4.625 19.132 9.735 1.00 0.00 H new ATOM 0 HG SER A 25 6.663 18.648 10.732 1.00 0.00 H new ATOM 327 N ASP A 26 2.136 19.550 9.669 1.00 0.00 N ATOM 328 CA ASP A 26 0.898 19.394 8.915 1.00 0.00 C ATOM 329 C ASP A 26 0.326 17.991 9.094 1.00 0.00 C ATOM 330 O ASP A 26 -0.880 17.819 9.270 1.00 0.00 O ATOM 331 CB ASP A 26 1.141 19.673 7.431 1.00 0.00 C ATOM 332 CG ASP A 26 1.858 20.988 7.199 1.00 0.00 C ATOM 333 OD1 ASP A 26 1.318 22.037 7.607 1.00 0.00 O ATOM 334 OD2 ASP A 26 2.958 20.969 6.608 1.00 0.00 O ATOM 0 H ASP A 26 2.902 19.967 9.140 1.00 0.00 H new ATOM 0 HA ASP A 26 0.175 20.114 9.299 1.00 0.00 H new ATOM 0 HB2 ASP A 26 1.730 18.861 7.003 1.00 0.00 H new ATOM 0 HB3 ASP A 26 0.186 19.686 6.906 1.00 0.00 H new ATOM 339 N VAL A 27 1.200 16.990 9.048 1.00 0.00 N ATOM 340 CA VAL A 27 0.782 15.602 9.205 1.00 0.00 C ATOM 341 C VAL A 27 -0.171 15.446 10.385 1.00 0.00 C ATOM 342 O VAL A 27 -0.136 16.211 11.349 1.00 0.00 O ATOM 343 CB VAL A 27 1.993 14.672 9.410 1.00 0.00 C ATOM 344 CG1 VAL A 27 2.946 14.768 8.229 1.00 0.00 C ATOM 345 CG2 VAL A 27 2.707 15.006 10.711 1.00 0.00 C ATOM 0 H VAL A 27 2.202 17.115 8.903 1.00 0.00 H new ATOM 0 HA VAL A 27 0.268 15.319 8.287 1.00 0.00 H new ATOM 0 HB VAL A 27 1.634 13.645 9.473 1.00 0.00 H new ATOM 0 HG11 VAL A 27 3.795 14.104 8.392 1.00 0.00 H new ATOM 0 HG12 VAL A 27 2.426 14.475 7.317 1.00 0.00 H new ATOM 0 HG13 VAL A 27 3.301 15.794 8.130 1.00 0.00 H new ATOM 0 HG21 VAL A 27 3.560 14.339 10.840 1.00 0.00 H new ATOM 0 HG22 VAL A 27 3.055 16.039 10.680 1.00 0.00 H new ATOM 0 HG23 VAL A 27 2.019 14.880 11.547 1.00 0.00 H new ATOM 355 N PRO A 28 -1.043 14.430 10.310 1.00 0.00 N ATOM 356 CA PRO A 28 -2.022 14.148 11.363 1.00 0.00 C ATOM 357 C PRO A 28 -1.369 13.621 12.636 1.00 0.00 C ATOM 358 O PRO A 28 -0.262 13.082 12.600 1.00 0.00 O ATOM 359 CB PRO A 28 -2.917 13.074 10.738 1.00 0.00 C ATOM 360 CG PRO A 28 -2.056 12.409 9.720 1.00 0.00 C ATOM 361 CD PRO A 28 -1.140 13.478 9.190 1.00 0.00 C ATOM 0 HA PRO A 28 -2.560 15.045 11.669 1.00 0.00 H new ATOM 0 HB2 PRO A 28 -3.265 12.363 11.488 1.00 0.00 H new ATOM 0 HB3 PRO A 28 -3.803 13.514 10.281 1.00 0.00 H new ATOM 0 HG2 PRO A 28 -1.487 11.592 10.164 1.00 0.00 H new ATOM 0 HG3 PRO A 28 -2.659 11.980 8.920 1.00 0.00 H new ATOM 0 HD2 PRO A 28 -0.164 13.074 8.920 1.00 0.00 H new ATOM 0 HD3 PRO A 28 -1.548 13.950 8.296 1.00 0.00 H new ATOM 369 N SER A 29 -2.060 13.779 13.760 1.00 0.00 N ATOM 370 CA SER A 29 -1.545 13.322 15.045 1.00 0.00 C ATOM 371 C SER A 29 -2.471 12.278 15.662 1.00 0.00 C ATOM 372 O SER A 29 -2.301 11.886 16.816 1.00 0.00 O ATOM 373 CB SER A 29 -1.381 14.504 16.003 1.00 0.00 C ATOM 374 OG SER A 29 -0.398 14.231 16.986 1.00 0.00 O ATOM 0 H SER A 29 -2.978 14.220 13.807 1.00 0.00 H new ATOM 0 HA SER A 29 -0.571 12.863 14.875 1.00 0.00 H new ATOM 0 HB2 SER A 29 -1.101 15.395 15.441 1.00 0.00 H new ATOM 0 HB3 SER A 29 -2.334 14.719 16.487 1.00 0.00 H new ATOM 0 HG SER A 29 -0.547 13.336 17.358 1.00 0.00 H new ATOM 380 N ALA A 30 -3.452 11.833 14.884 1.00 0.00 N ATOM 381 CA ALA A 30 -4.405 10.834 15.351 1.00 0.00 C ATOM 382 C ALA A 30 -4.393 9.601 14.453 1.00 0.00 C ATOM 383 O ALA A 30 -4.438 9.697 13.227 1.00 0.00 O ATOM 384 CB ALA A 30 -5.804 11.428 15.416 1.00 0.00 C ATOM 0 H ALA A 30 -3.608 12.149 13.927 1.00 0.00 H new ATOM 0 HA ALA A 30 -4.107 10.525 16.353 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -6.505 10.670 15.766 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -5.809 12.273 16.105 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -6.102 11.767 14.424 1.00 0.00 H new ATOM 390 N PRO A 31 -4.329 8.415 15.076 1.00 0.00 N ATOM 391 CA PRO A 31 -4.310 7.141 14.352 1.00 0.00 C ATOM 392 C PRO A 31 -5.647 6.831 13.687 1.00 0.00 C ATOM 393 O PRO A 31 -6.660 7.482 13.943 1.00 0.00 O ATOM 394 CB PRO A 31 -4.007 6.115 15.447 1.00 0.00 C ATOM 395 CG PRO A 31 -4.493 6.748 16.704 1.00 0.00 C ATOM 396 CD PRO A 31 -4.273 8.226 16.535 1.00 0.00 C ATOM 0 HA PRO A 31 -3.583 7.145 13.540 1.00 0.00 H new ATOM 0 HB2 PRO A 31 -4.517 5.171 15.257 1.00 0.00 H new ATOM 0 HB3 PRO A 31 -2.940 5.896 15.501 1.00 0.00 H new ATOM 0 HG2 PRO A 31 -5.547 6.527 16.870 1.00 0.00 H new ATOM 0 HG3 PRO A 31 -3.948 6.369 17.568 1.00 0.00 H new ATOM 0 HD2 PRO A 31 -5.041 8.807 17.045 1.00 0.00 H new ATOM 0 HD3 PRO A 31 -3.312 8.539 16.944 1.00 0.00 H new ATOM 404 N PRO A 32 -5.653 5.813 12.814 1.00 0.00 N ATOM 405 CA PRO A 32 -6.860 5.393 12.095 1.00 0.00 C ATOM 406 C PRO A 32 -7.884 4.738 13.016 1.00 0.00 C ATOM 407 O PRO A 32 -7.643 4.579 14.212 1.00 0.00 O ATOM 408 CB PRO A 32 -6.332 4.381 11.076 1.00 0.00 C ATOM 409 CG PRO A 32 -5.077 3.853 11.681 1.00 0.00 C ATOM 410 CD PRO A 32 -4.482 4.993 12.460 1.00 0.00 C ATOM 0 HA PRO A 32 -7.382 6.238 11.645 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -7.053 3.583 10.901 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -6.139 4.853 10.113 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -5.285 3.003 12.331 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -4.389 3.505 10.911 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -3.955 4.642 13.347 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -3.763 5.555 11.864 1.00 0.00 H new ATOM 418 N GLN A 33 -9.025 4.360 12.449 1.00 0.00 N ATOM 419 CA GLN A 33 -10.085 3.722 13.220 1.00 0.00 C ATOM 420 C GLN A 33 -10.490 2.392 12.593 1.00 0.00 C ATOM 421 O GLN A 33 -10.042 2.049 11.500 1.00 0.00 O ATOM 422 CB GLN A 33 -11.301 4.645 13.316 1.00 0.00 C ATOM 423 CG GLN A 33 -11.176 5.706 14.398 1.00 0.00 C ATOM 424 CD GLN A 33 -12.522 6.223 14.866 1.00 0.00 C ATOM 425 OE1 GLN A 33 -12.979 5.896 15.961 1.00 0.00 O ATOM 426 NE2 GLN A 33 -13.165 7.036 14.036 1.00 0.00 N ATOM 0 H GLN A 33 -9.239 4.484 11.459 1.00 0.00 H new ATOM 0 HA GLN A 33 -9.704 3.529 14.223 1.00 0.00 H new ATOM 0 HB2 GLN A 33 -11.452 5.135 12.354 1.00 0.00 H new ATOM 0 HB3 GLN A 33 -12.189 4.043 13.510 1.00 0.00 H new ATOM 0 HG2 GLN A 33 -10.635 5.291 15.248 1.00 0.00 H new ATOM 0 HG3 GLN A 33 -10.583 6.538 14.019 1.00 0.00 H new ATOM 0 HE21 GLN A 33 -12.749 7.281 13.138 1.00 0.00 H new ATOM 0 HE22 GLN A 33 -14.075 7.416 14.297 1.00 0.00 H new ATOM 435 N ASN A 34 -11.339 1.647 13.294 1.00 0.00 N ATOM 436 CA ASN A 34 -11.803 0.353 12.806 1.00 0.00 C ATOM 437 C ASN A 34 -10.628 -0.520 12.376 1.00 0.00 C ATOM 438 O ASN A 34 -10.715 -1.259 11.396 1.00 0.00 O ATOM 439 CB ASN A 34 -12.767 0.543 11.633 1.00 0.00 C ATOM 440 CG ASN A 34 -13.651 -0.668 11.409 1.00 0.00 C ATOM 441 OD1 ASN A 34 -14.257 -1.190 12.345 1.00 0.00 O ATOM 442 ND2 ASN A 34 -13.729 -1.122 10.164 1.00 0.00 N ATOM 0 H ASN A 34 -11.719 1.917 14.201 1.00 0.00 H new ATOM 0 HA ASN A 34 -12.326 -0.148 13.621 1.00 0.00 H new ATOM 0 HB2 ASN A 34 -13.392 1.416 11.818 1.00 0.00 H new ATOM 0 HB3 ASN A 34 -12.196 0.746 10.727 1.00 0.00 H new ATOM 0 HD21 ASN A 34 -14.308 -1.934 9.953 1.00 0.00 H new ATOM 0 HD22 ASN A 34 -13.210 -0.658 9.419 1.00 0.00 H new ATOM 449 N VAL A 35 -9.528 -0.429 13.117 1.00 0.00 N ATOM 450 CA VAL A 35 -8.335 -1.211 12.815 1.00 0.00 C ATOM 451 C VAL A 35 -8.430 -2.610 13.413 1.00 0.00 C ATOM 452 O VAL A 35 -8.027 -2.838 14.553 1.00 0.00 O ATOM 453 CB VAL A 35 -7.063 -0.523 13.346 1.00 0.00 C ATOM 454 CG1 VAL A 35 -5.842 -1.396 13.099 1.00 0.00 C ATOM 455 CG2 VAL A 35 -6.890 0.845 12.703 1.00 0.00 C ATOM 0 H VAL A 35 -9.438 0.179 13.931 1.00 0.00 H new ATOM 0 HA VAL A 35 -8.272 -1.286 11.729 1.00 0.00 H new ATOM 0 HB VAL A 35 -7.168 -0.383 14.422 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -4.953 -0.894 13.480 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.968 -2.350 13.610 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.730 -1.570 12.029 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -5.987 1.317 13.089 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -6.806 0.731 11.622 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -7.753 1.468 12.936 1.00 0.00 H new ATOM 465 N SER A 36 -8.965 -3.546 12.634 1.00 0.00 N ATOM 466 CA SER A 36 -9.115 -4.923 13.087 1.00 0.00 C ATOM 467 C SER A 36 -8.692 -5.903 11.997 1.00 0.00 C ATOM 468 O SER A 36 -8.498 -5.520 10.842 1.00 0.00 O ATOM 469 CB SER A 36 -10.565 -5.192 13.495 1.00 0.00 C ATOM 470 OG SER A 36 -10.779 -4.868 14.858 1.00 0.00 O ATOM 0 H SER A 36 -9.301 -3.375 11.686 1.00 0.00 H new ATOM 0 HA SER A 36 -8.468 -5.067 13.952 1.00 0.00 H new ATOM 0 HB2 SER A 36 -11.237 -4.606 12.869 1.00 0.00 H new ATOM 0 HB3 SER A 36 -10.805 -6.242 13.325 1.00 0.00 H new ATOM 0 HG SER A 36 -11.713 -5.047 15.094 1.00 0.00 H new ATOM 476 N LEU A 37 -8.550 -7.170 12.372 1.00 0.00 N ATOM 477 CA LEU A 37 -8.150 -8.207 11.427 1.00 0.00 C ATOM 478 C LEU A 37 -9.172 -9.339 11.395 1.00 0.00 C ATOM 479 O LEU A 37 -9.795 -9.653 12.409 1.00 0.00 O ATOM 480 CB LEU A 37 -6.772 -8.758 11.798 1.00 0.00 C ATOM 481 CG LEU A 37 -5.626 -7.747 11.812 1.00 0.00 C ATOM 482 CD1 LEU A 37 -4.473 -8.257 12.663 1.00 0.00 C ATOM 483 CD2 LEU A 37 -5.156 -7.454 10.395 1.00 0.00 C ATOM 0 H LEU A 37 -8.706 -7.504 13.323 1.00 0.00 H new ATOM 0 HA LEU A 37 -8.100 -7.760 10.434 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -6.839 -9.214 12.786 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -6.520 -9.553 11.096 1.00 0.00 H new ATOM 0 HG LEU A 37 -5.992 -6.819 12.252 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -3.667 -7.523 12.661 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -4.817 -8.415 13.685 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -4.108 -9.199 12.254 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -4.340 -6.732 10.424 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -4.809 -8.376 9.929 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -5.983 -7.044 9.815 1.00 0.00 H new ATOM 495 N GLU A 38 -9.336 -9.948 10.225 1.00 0.00 N ATOM 496 CA GLU A 38 -10.282 -11.046 10.063 1.00 0.00 C ATOM 497 C GLU A 38 -9.632 -12.222 9.339 1.00 0.00 C ATOM 498 O GLU A 38 -9.395 -12.167 8.132 1.00 0.00 O ATOM 499 CB GLU A 38 -11.516 -10.576 9.291 1.00 0.00 C ATOM 500 CG GLU A 38 -12.768 -11.381 9.596 1.00 0.00 C ATOM 501 CD GLU A 38 -14.032 -10.702 9.105 1.00 0.00 C ATOM 502 OE1 GLU A 38 -13.964 -9.995 8.078 1.00 0.00 O ATOM 503 OE2 GLU A 38 -15.088 -10.877 9.747 1.00 0.00 O ATOM 0 H GLU A 38 -8.827 -9.700 9.377 1.00 0.00 H new ATOM 0 HA GLU A 38 -10.588 -11.377 11.055 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -11.703 -9.528 9.524 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -11.309 -10.633 8.222 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -12.685 -12.364 9.133 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -12.840 -11.540 10.672 1.00 0.00 H new ATOM 510 N VAL A 39 -9.345 -13.284 10.085 1.00 0.00 N ATOM 511 CA VAL A 39 -8.722 -14.473 9.515 1.00 0.00 C ATOM 512 C VAL A 39 -9.669 -15.181 8.553 1.00 0.00 C ATOM 513 O VAL A 39 -10.667 -15.771 8.968 1.00 0.00 O ATOM 514 CB VAL A 39 -8.291 -15.462 10.614 1.00 0.00 C ATOM 515 CG1 VAL A 39 -7.544 -16.641 10.008 1.00 0.00 C ATOM 516 CG2 VAL A 39 -7.436 -14.758 11.657 1.00 0.00 C ATOM 0 H VAL A 39 -9.534 -13.345 11.085 1.00 0.00 H new ATOM 0 HA VAL A 39 -7.839 -14.138 8.971 1.00 0.00 H new ATOM 0 HB VAL A 39 -9.185 -15.844 11.107 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.247 -17.329 10.799 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -8.193 -17.158 9.301 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -6.656 -16.281 9.488 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.140 -15.471 12.426 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -6.546 -14.348 11.181 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -8.009 -13.950 12.112 1.00 0.00 H new ATOM 526 N VAL A 40 -9.350 -15.119 7.264 1.00 0.00 N ATOM 527 CA VAL A 40 -10.171 -15.756 6.241 1.00 0.00 C ATOM 528 C VAL A 40 -9.738 -17.199 6.008 1.00 0.00 C ATOM 529 O VAL A 40 -10.568 -18.104 5.938 1.00 0.00 O ATOM 530 CB VAL A 40 -10.101 -14.989 4.907 1.00 0.00 C ATOM 531 CG1 VAL A 40 -11.230 -15.421 3.983 1.00 0.00 C ATOM 532 CG2 VAL A 40 -10.147 -13.489 5.153 1.00 0.00 C ATOM 0 H VAL A 40 -8.528 -14.634 6.903 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.198 -15.742 6.606 1.00 0.00 H new ATOM 0 HB VAL A 40 -9.155 -15.226 4.420 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -11.165 -14.869 3.046 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -11.147 -16.489 3.781 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -12.189 -15.215 4.459 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -10.097 -12.962 4.200 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -11.077 -13.232 5.661 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -9.301 -13.196 5.775 1.00 0.00 H new ATOM 542 N ASN A 41 -8.430 -17.407 5.890 1.00 0.00 N ATOM 543 CA ASN A 41 -7.885 -18.741 5.664 1.00 0.00 C ATOM 544 C ASN A 41 -6.515 -18.886 6.318 1.00 0.00 C ATOM 545 O ASN A 41 -6.016 -17.956 6.953 1.00 0.00 O ATOM 546 CB ASN A 41 -7.780 -19.025 4.165 1.00 0.00 C ATOM 547 CG ASN A 41 -9.139 -19.136 3.501 1.00 0.00 C ATOM 548 OD1 ASN A 41 -9.941 -20.004 3.845 1.00 0.00 O ATOM 549 ND2 ASN A 41 -9.404 -18.255 2.543 1.00 0.00 N ATOM 0 H ASN A 41 -7.728 -16.669 5.947 1.00 0.00 H new ATOM 0 HA ASN A 41 -8.563 -19.465 6.117 1.00 0.00 H new ATOM 0 HB2 ASN A 41 -7.209 -18.230 3.686 1.00 0.00 H new ATOM 0 HB3 ASN A 41 -7.227 -19.952 4.011 1.00 0.00 H new ATOM 0 HD21 ASN A 41 -10.302 -18.281 2.060 1.00 0.00 H new ATOM 0 HD22 ASN A 41 -8.709 -17.552 2.290 1.00 0.00 H new ATOM 556 N SER A 42 -5.910 -20.059 6.158 1.00 0.00 N ATOM 557 CA SER A 42 -4.598 -20.328 6.735 1.00 0.00 C ATOM 558 C SER A 42 -3.494 -19.695 5.893 1.00 0.00 C ATOM 559 O SER A 42 -2.348 -19.591 6.330 1.00 0.00 O ATOM 560 CB SER A 42 -4.367 -21.836 6.849 1.00 0.00 C ATOM 561 OG SER A 42 -4.370 -22.450 5.573 1.00 0.00 O ATOM 0 H SER A 42 -6.308 -20.838 5.633 1.00 0.00 H new ATOM 0 HA SER A 42 -4.569 -19.887 7.731 1.00 0.00 H new ATOM 0 HB2 SER A 42 -3.415 -22.025 7.345 1.00 0.00 H new ATOM 0 HB3 SER A 42 -5.144 -22.280 7.472 1.00 0.00 H new ATOM 0 HG SER A 42 -4.219 -23.413 5.673 1.00 0.00 H new ATOM 567 N ARG A 43 -3.849 -19.274 4.683 1.00 0.00 N ATOM 568 CA ARG A 43 -2.889 -18.653 3.779 1.00 0.00 C ATOM 569 C ARG A 43 -3.426 -17.328 3.244 1.00 0.00 C ATOM 570 O ARG A 43 -2.798 -16.689 2.400 1.00 0.00 O ATOM 571 CB ARG A 43 -2.570 -19.594 2.615 1.00 0.00 C ATOM 572 CG ARG A 43 -3.612 -19.569 1.508 1.00 0.00 C ATOM 573 CD ARG A 43 -3.357 -20.658 0.479 1.00 0.00 C ATOM 574 NE ARG A 43 -4.391 -20.690 -0.552 1.00 0.00 N ATOM 575 CZ ARG A 43 -4.475 -19.803 -1.537 1.00 0.00 C ATOM 576 NH1 ARG A 43 -3.590 -18.819 -1.624 1.00 0.00 N ATOM 577 NH2 ARG A 43 -5.445 -19.898 -2.437 1.00 0.00 N ATOM 0 H ARG A 43 -4.794 -19.352 4.307 1.00 0.00 H new ATOM 0 HA ARG A 43 -1.975 -18.456 4.339 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -1.601 -19.324 2.196 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -2.481 -20.612 2.995 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -4.605 -19.699 1.938 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -3.602 -18.595 1.019 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -2.385 -20.496 0.013 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -3.313 -21.626 0.979 1.00 0.00 H new ATOM 0 HE ARG A 43 -5.087 -21.435 -0.513 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -2.843 -18.742 -0.934 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -3.656 -18.139 -2.381 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -6.128 -20.653 -2.373 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -5.508 -19.216 -3.193 1.00 0.00 H new ATOM 591 N SER A 44 -4.590 -16.923 3.740 1.00 0.00 N ATOM 592 CA SER A 44 -5.213 -15.677 3.309 1.00 0.00 C ATOM 593 C SER A 44 -5.825 -14.937 4.495 1.00 0.00 C ATOM 594 O SER A 44 -6.524 -15.530 5.316 1.00 0.00 O ATOM 595 CB SER A 44 -6.289 -15.958 2.258 1.00 0.00 C ATOM 596 OG SER A 44 -5.919 -17.043 1.426 1.00 0.00 O ATOM 0 H SER A 44 -5.121 -17.440 4.441 1.00 0.00 H new ATOM 0 HA SER A 44 -4.441 -15.046 2.869 1.00 0.00 H new ATOM 0 HB2 SER A 44 -7.235 -16.181 2.752 1.00 0.00 H new ATOM 0 HB3 SER A 44 -6.449 -15.068 1.650 1.00 0.00 H new ATOM 0 HG SER A 44 -6.624 -17.203 0.764 1.00 0.00 H new ATOM 602 N ILE A 45 -5.556 -13.639 4.576 1.00 0.00 N ATOM 603 CA ILE A 45 -6.080 -12.817 5.660 1.00 0.00 C ATOM 604 C ILE A 45 -6.575 -11.472 5.139 1.00 0.00 C ATOM 605 O ILE A 45 -5.919 -10.831 4.318 1.00 0.00 O ATOM 606 CB ILE A 45 -5.017 -12.574 6.747 1.00 0.00 C ATOM 607 CG1 ILE A 45 -4.468 -13.906 7.261 1.00 0.00 C ATOM 608 CG2 ILE A 45 -5.604 -11.761 7.890 1.00 0.00 C ATOM 609 CD1 ILE A 45 -3.679 -13.780 8.545 1.00 0.00 C ATOM 0 H ILE A 45 -4.978 -13.133 3.904 1.00 0.00 H new ATOM 0 HA ILE A 45 -6.915 -13.365 6.097 1.00 0.00 H new ATOM 0 HB ILE A 45 -4.195 -12.008 6.310 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -5.298 -14.594 7.420 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -3.831 -14.347 6.494 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -4.840 -11.598 8.650 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -5.951 -10.799 7.512 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -6.442 -12.302 8.328 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -3.321 -14.763 8.850 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -2.828 -13.117 8.386 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -4.318 -13.369 9.326 1.00 0.00 H new ATOM 621 N LYS A 46 -7.737 -11.047 5.624 1.00 0.00 N ATOM 622 CA LYS A 46 -8.321 -9.776 5.212 1.00 0.00 C ATOM 623 C LYS A 46 -8.011 -8.680 6.226 1.00 0.00 C ATOM 624 O LYS A 46 -8.106 -8.894 7.435 1.00 0.00 O ATOM 625 CB LYS A 46 -9.835 -9.918 5.044 1.00 0.00 C ATOM 626 CG LYS A 46 -10.542 -8.602 4.766 1.00 0.00 C ATOM 627 CD LYS A 46 -10.551 -8.277 3.282 1.00 0.00 C ATOM 628 CE LYS A 46 -11.619 -7.248 2.943 1.00 0.00 C ATOM 629 NZ LYS A 46 -12.980 -7.851 2.912 1.00 0.00 N ATOM 0 H LYS A 46 -8.293 -11.565 6.304 1.00 0.00 H new ATOM 0 HA LYS A 46 -7.880 -9.495 4.255 1.00 0.00 H new ATOM 0 HB2 LYS A 46 -10.038 -10.610 4.227 1.00 0.00 H new ATOM 0 HB3 LYS A 46 -10.253 -10.361 5.948 1.00 0.00 H new ATOM 0 HG2 LYS A 46 -11.567 -8.653 5.134 1.00 0.00 H new ATOM 0 HG3 LYS A 46 -10.047 -7.799 5.312 1.00 0.00 H new ATOM 0 HD2 LYS A 46 -9.573 -7.899 2.985 1.00 0.00 H new ATOM 0 HD3 LYS A 46 -10.727 -9.188 2.710 1.00 0.00 H new ATOM 0 HE2 LYS A 46 -11.595 -6.444 3.678 1.00 0.00 H new ATOM 0 HE3 LYS A 46 -11.398 -6.801 1.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 -13.663 -7.149 2.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 -12.979 -8.677 2.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 -13.250 -8.149 3.871 1.00 0.00 H new ATOM 643 N VAL A 47 -7.640 -7.505 5.727 1.00 0.00 N ATOM 644 CA VAL A 47 -7.319 -6.375 6.590 1.00 0.00 C ATOM 645 C VAL A 47 -8.053 -5.116 6.142 1.00 0.00 C ATOM 646 O VAL A 47 -7.857 -4.635 5.027 1.00 0.00 O ATOM 647 CB VAL A 47 -5.805 -6.095 6.607 1.00 0.00 C ATOM 648 CG1 VAL A 47 -5.513 -4.778 7.312 1.00 0.00 C ATOM 649 CG2 VAL A 47 -5.058 -7.241 7.272 1.00 0.00 C ATOM 0 H VAL A 47 -7.554 -7.311 4.729 1.00 0.00 H new ATOM 0 HA VAL A 47 -7.643 -6.642 7.596 1.00 0.00 H new ATOM 0 HB VAL A 47 -5.457 -6.014 5.577 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -4.438 -4.597 7.314 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -6.017 -3.966 6.788 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -5.875 -4.827 8.339 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -3.989 -7.026 7.275 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -5.408 -7.357 8.298 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -5.241 -8.163 6.720 1.00 0.00 H new ATOM 659 N SER A 48 -8.898 -4.587 7.021 1.00 0.00 N ATOM 660 CA SER A 48 -9.665 -3.384 6.715 1.00 0.00 C ATOM 661 C SER A 48 -9.346 -2.270 7.708 1.00 0.00 C ATOM 662 O SER A 48 -8.783 -2.517 8.774 1.00 0.00 O ATOM 663 CB SER A 48 -11.164 -3.690 6.738 1.00 0.00 C ATOM 664 OG SER A 48 -11.558 -4.396 5.574 1.00 0.00 O ATOM 0 H SER A 48 -9.069 -4.972 7.950 1.00 0.00 H new ATOM 0 HA SER A 48 -9.386 -3.048 5.716 1.00 0.00 H new ATOM 0 HB2 SER A 48 -11.405 -4.279 7.623 1.00 0.00 H new ATOM 0 HB3 SER A 48 -11.727 -2.760 6.811 1.00 0.00 H new ATOM 0 HG SER A 48 -12.520 -4.581 5.613 1.00 0.00 H new ATOM 670 N TRP A 49 -9.711 -1.045 7.348 1.00 0.00 N ATOM 671 CA TRP A 49 -9.465 0.108 8.207 1.00 0.00 C ATOM 672 C TRP A 49 -10.422 1.248 7.875 1.00 0.00 C ATOM 673 O TRP A 49 -11.276 1.119 6.997 1.00 0.00 O ATOM 674 CB TRP A 49 -8.018 0.581 8.057 1.00 0.00 C ATOM 675 CG TRP A 49 -7.657 0.956 6.652 1.00 0.00 C ATOM 676 CD1 TRP A 49 -7.823 2.177 6.061 1.00 0.00 C ATOM 677 CD2 TRP A 49 -7.072 0.105 5.661 1.00 0.00 C ATOM 678 NE1 TRP A 49 -7.377 2.135 4.763 1.00 0.00 N ATOM 679 CE2 TRP A 49 -6.910 0.876 4.493 1.00 0.00 C ATOM 680 CE3 TRP A 49 -6.667 -1.232 5.647 1.00 0.00 C ATOM 681 CZ2 TRP A 49 -6.362 0.351 3.325 1.00 0.00 C ATOM 682 CZ3 TRP A 49 -6.124 -1.752 4.487 1.00 0.00 C ATOM 683 CH2 TRP A 49 -5.974 -0.961 3.340 1.00 0.00 C ATOM 0 H TRP A 49 -10.178 -0.824 6.468 1.00 0.00 H new ATOM 0 HA TRP A 49 -9.636 -0.196 9.240 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -7.855 1.440 8.708 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -7.348 -0.209 8.398 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -8.243 3.047 6.544 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -7.391 2.915 4.106 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -6.776 -1.848 6.527 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -6.247 0.958 2.439 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -5.810 -2.785 4.464 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -5.543 -1.396 2.450 1.00 0.00 H new ATOM 694 N LEU A 50 -10.274 2.363 8.582 1.00 0.00 N ATOM 695 CA LEU A 50 -11.126 3.527 8.362 1.00 0.00 C ATOM 696 C LEU A 50 -10.374 4.818 8.670 1.00 0.00 C ATOM 697 O LEU A 50 -9.394 4.832 9.414 1.00 0.00 O ATOM 698 CB LEU A 50 -12.382 3.435 9.229 1.00 0.00 C ATOM 699 CG LEU A 50 -13.488 2.513 8.713 1.00 0.00 C ATOM 700 CD1 LEU A 50 -14.551 2.305 9.781 1.00 0.00 C ATOM 701 CD2 LEU A 50 -14.108 3.081 7.445 1.00 0.00 C ATOM 0 H LEU A 50 -9.572 2.486 9.312 1.00 0.00 H new ATOM 0 HA LEU A 50 -11.418 3.540 7.312 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -12.089 3.097 10.223 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -12.795 4.437 9.342 1.00 0.00 H new ATOM 0 HG LEU A 50 -13.046 1.545 8.475 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -15.330 1.647 9.396 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -14.097 1.853 10.663 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -14.989 3.266 10.050 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -14.893 2.412 7.092 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -14.535 4.061 7.656 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -13.341 3.177 6.677 1.00 0.00 H new ATOM 713 N PRO A 51 -10.845 5.931 8.088 1.00 0.00 N ATOM 714 CA PRO A 51 -10.234 7.248 8.288 1.00 0.00 C ATOM 715 C PRO A 51 -10.451 7.779 9.701 1.00 0.00 C ATOM 716 O PRO A 51 -11.341 7.336 10.427 1.00 0.00 O ATOM 717 CB PRO A 51 -10.956 8.132 7.268 1.00 0.00 C ATOM 718 CG PRO A 51 -12.269 7.463 7.048 1.00 0.00 C ATOM 719 CD PRO A 51 -12.010 5.988 7.189 1.00 0.00 C ATOM 0 HA PRO A 51 -9.152 7.220 8.158 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -11.087 9.146 7.646 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -10.390 8.208 6.340 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -13.006 7.801 7.776 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -12.666 7.697 6.060 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -12.870 5.468 7.612 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -11.798 5.523 6.226 1.00 0.00 H new ATOM 727 N PRO A 52 -9.619 8.751 10.102 1.00 0.00 N ATOM 728 CA PRO A 52 -9.701 9.364 11.432 1.00 0.00 C ATOM 729 C PRO A 52 -10.947 10.228 11.596 1.00 0.00 C ATOM 730 O PRO A 52 -11.635 10.558 10.630 1.00 0.00 O ATOM 731 CB PRO A 52 -8.439 10.228 11.502 1.00 0.00 C ATOM 732 CG PRO A 52 -8.108 10.533 10.082 1.00 0.00 C ATOM 733 CD PRO A 52 -8.535 9.328 9.290 1.00 0.00 C ATOM 0 HA PRO A 52 -9.767 8.616 12.222 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -8.615 11.140 12.072 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -7.623 9.698 11.993 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -8.630 11.428 9.743 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -7.041 10.721 9.962 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -8.882 9.604 8.294 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -7.714 8.623 9.157 1.00 0.00 H new ATOM 741 N PRO A 53 -11.246 10.604 12.848 1.00 0.00 N ATOM 742 CA PRO A 53 -12.410 11.435 13.169 1.00 0.00 C ATOM 743 C PRO A 53 -12.254 12.867 12.671 1.00 0.00 C ATOM 744 O PRO A 53 -11.144 13.320 12.390 1.00 0.00 O ATOM 745 CB PRO A 53 -12.460 11.402 14.698 1.00 0.00 C ATOM 746 CG PRO A 53 -11.056 11.128 15.117 1.00 0.00 C ATOM 747 CD PRO A 53 -10.470 10.247 14.048 1.00 0.00 C ATOM 0 HA PRO A 53 -13.318 11.066 12.692 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -12.816 12.349 15.103 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -13.138 10.627 15.055 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -10.490 12.054 15.213 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -11.028 10.635 16.088 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -9.406 10.437 13.909 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -10.576 9.191 14.295 1.00 0.00 H new ATOM 755 N SER A 54 -13.373 13.577 12.565 1.00 0.00 N ATOM 756 CA SER A 54 -13.360 14.959 12.098 1.00 0.00 C ATOM 757 C SER A 54 -12.387 15.801 12.918 1.00 0.00 C ATOM 758 O SER A 54 -11.935 15.385 13.984 1.00 0.00 O ATOM 759 CB SER A 54 -14.765 15.559 12.178 1.00 0.00 C ATOM 760 OG SER A 54 -15.686 14.805 11.410 1.00 0.00 O ATOM 0 H SER A 54 -14.300 13.218 12.796 1.00 0.00 H new ATOM 0 HA SER A 54 -13.029 14.963 11.059 1.00 0.00 H new ATOM 0 HB2 SER A 54 -15.092 15.589 13.217 1.00 0.00 H new ATOM 0 HB3 SER A 54 -14.745 16.588 11.820 1.00 0.00 H new ATOM 0 HG SER A 54 -16.577 15.208 11.479 1.00 0.00 H new ATOM 766 N GLY A 55 -12.070 16.989 12.412 1.00 0.00 N ATOM 767 CA GLY A 55 -11.153 17.871 13.109 1.00 0.00 C ATOM 768 C GLY A 55 -9.706 17.447 12.951 1.00 0.00 C ATOM 769 O GLY A 55 -8.977 17.994 12.124 1.00 0.00 O ATOM 0 H GLY A 55 -12.432 17.356 11.532 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -11.274 18.887 12.732 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -11.409 17.892 14.168 1.00 0.00 H new ATOM 773 N THR A 56 -9.288 16.468 13.748 1.00 0.00 N ATOM 774 CA THR A 56 -7.918 15.972 13.695 1.00 0.00 C ATOM 775 C THR A 56 -7.386 15.979 12.266 1.00 0.00 C ATOM 776 O THR A 56 -6.210 16.257 12.034 1.00 0.00 O ATOM 777 CB THR A 56 -7.816 14.544 14.262 1.00 0.00 C ATOM 778 OG1 THR A 56 -8.293 13.598 13.298 1.00 0.00 O ATOM 779 CG2 THR A 56 -8.618 14.413 15.548 1.00 0.00 C ATOM 0 H THR A 56 -9.879 16.003 14.438 1.00 0.00 H new ATOM 0 HA THR A 56 -7.315 16.642 14.308 1.00 0.00 H new ATOM 0 HB THR A 56 -6.768 14.340 14.483 1.00 0.00 H new ATOM 0 HG1 THR A 56 -9.259 13.711 13.179 1.00 0.00 H new ATOM 0 HG21 THR A 56 -8.530 13.396 15.929 1.00 0.00 H new ATOM 0 HG22 THR A 56 -8.233 15.113 16.290 1.00 0.00 H new ATOM 0 HG23 THR A 56 -9.666 14.636 15.348 1.00 0.00 H new ATOM 787 N GLN A 57 -8.260 15.671 11.313 1.00 0.00 N ATOM 788 CA GLN A 57 -7.876 15.643 9.906 1.00 0.00 C ATOM 789 C GLN A 57 -7.312 16.990 9.468 1.00 0.00 C ATOM 790 O GLN A 57 -8.022 17.995 9.450 1.00 0.00 O ATOM 791 CB GLN A 57 -9.078 15.272 9.035 1.00 0.00 C ATOM 792 CG GLN A 57 -9.354 13.778 8.983 1.00 0.00 C ATOM 793 CD GLN A 57 -10.597 13.442 8.184 1.00 0.00 C ATOM 794 OE1 GLN A 57 -11.208 14.315 7.567 1.00 0.00 O ATOM 795 NE2 GLN A 57 -10.980 12.170 8.191 1.00 0.00 N ATOM 0 H GLN A 57 -9.237 15.438 11.489 1.00 0.00 H new ATOM 0 HA GLN A 57 -7.100 14.888 9.783 1.00 0.00 H new ATOM 0 HB2 GLN A 57 -9.963 15.783 9.414 1.00 0.00 H new ATOM 0 HB3 GLN A 57 -8.909 15.637 8.022 1.00 0.00 H new ATOM 0 HG2 GLN A 57 -8.496 13.269 8.544 1.00 0.00 H new ATOM 0 HG3 GLN A 57 -9.465 13.397 9.998 1.00 0.00 H new ATOM 0 HE21 GLN A 57 -10.444 11.479 8.716 1.00 0.00 H new ATOM 0 HE22 GLN A 57 -11.810 11.884 7.671 1.00 0.00 H new ATOM 804 N ASN A 58 -6.030 17.003 9.116 1.00 0.00 N ATOM 805 CA ASN A 58 -5.370 18.228 8.679 1.00 0.00 C ATOM 806 C ASN A 58 -5.365 18.329 7.157 1.00 0.00 C ATOM 807 O ASN A 58 -5.745 19.353 6.591 1.00 0.00 O ATOM 808 CB ASN A 58 -3.936 18.277 9.210 1.00 0.00 C ATOM 809 CG ASN A 58 -3.268 19.613 8.949 1.00 0.00 C ATOM 810 OD1 ASN A 58 -3.024 20.389 9.873 1.00 0.00 O ATOM 811 ND2 ASN A 58 -2.969 19.888 7.684 1.00 0.00 N ATOM 0 H ASN A 58 -5.428 16.180 9.125 1.00 0.00 H new ATOM 0 HA ASN A 58 -5.927 19.075 9.080 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -3.942 18.080 10.282 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -3.351 17.484 8.743 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -2.519 20.772 7.447 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -3.190 19.215 6.950 1.00 0.00 H new ATOM 818 N GLY A 59 -4.931 17.258 6.499 1.00 0.00 N ATOM 819 CA GLY A 59 -4.884 17.246 5.049 1.00 0.00 C ATOM 820 C GLY A 59 -5.918 16.318 4.443 1.00 0.00 C ATOM 821 O GLY A 59 -6.579 15.563 5.156 1.00 0.00 O ATOM 0 H GLY A 59 -4.611 16.398 6.945 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -5.044 18.257 4.675 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -3.890 16.940 4.723 1.00 0.00 H new ATOM 825 N PHE A 60 -6.060 16.374 3.123 1.00 0.00 N ATOM 826 CA PHE A 60 -7.022 15.533 2.421 1.00 0.00 C ATOM 827 C PHE A 60 -6.466 14.128 2.210 1.00 0.00 C ATOM 828 O PHE A 60 -5.568 13.921 1.394 1.00 0.00 O ATOM 829 CB PHE A 60 -7.388 16.156 1.072 1.00 0.00 C ATOM 830 CG PHE A 60 -8.408 15.365 0.303 1.00 0.00 C ATOM 831 CD1 PHE A 60 -9.744 15.393 0.668 1.00 0.00 C ATOM 832 CD2 PHE A 60 -8.030 14.594 -0.784 1.00 0.00 C ATOM 833 CE1 PHE A 60 -10.685 14.667 -0.038 1.00 0.00 C ATOM 834 CE2 PHE A 60 -8.966 13.867 -1.494 1.00 0.00 C ATOM 835 CZ PHE A 60 -10.295 13.902 -1.119 1.00 0.00 C ATOM 0 H PHE A 60 -5.521 16.993 2.518 1.00 0.00 H new ATOM 0 HA PHE A 60 -7.919 15.461 3.036 1.00 0.00 H new ATOM 0 HB2 PHE A 60 -7.771 17.163 1.238 1.00 0.00 H new ATOM 0 HB3 PHE A 60 -6.485 16.253 0.469 1.00 0.00 H new ATOM 0 HD1 PHE A 60 -10.054 15.989 1.514 1.00 0.00 H new ATOM 0 HD2 PHE A 60 -6.992 14.561 -1.080 1.00 0.00 H new ATOM 0 HE1 PHE A 60 -11.724 14.698 0.256 1.00 0.00 H new ATOM 0 HE2 PHE A 60 -8.659 13.272 -2.341 1.00 0.00 H new ATOM 0 HZ PHE A 60 -11.028 13.332 -1.671 1.00 0.00 H new ATOM 845 N ILE A 61 -7.005 13.167 2.953 1.00 0.00 N ATOM 846 CA ILE A 61 -6.563 11.782 2.847 1.00 0.00 C ATOM 847 C ILE A 61 -6.701 11.268 1.418 1.00 0.00 C ATOM 848 O ILE A 61 -7.763 11.379 0.806 1.00 0.00 O ATOM 849 CB ILE A 61 -7.362 10.863 3.790 1.00 0.00 C ATOM 850 CG1 ILE A 61 -7.206 11.324 5.241 1.00 0.00 C ATOM 851 CG2 ILE A 61 -6.906 9.420 3.635 1.00 0.00 C ATOM 852 CD1 ILE A 61 -8.065 10.551 6.216 1.00 0.00 C ATOM 0 H ILE A 61 -7.748 13.322 3.634 1.00 0.00 H new ATOM 0 HA ILE A 61 -5.513 11.763 3.137 1.00 0.00 H new ATOM 0 HB ILE A 61 -8.417 10.921 3.522 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -6.161 11.227 5.534 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -7.459 12.382 5.307 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -7.480 8.783 4.308 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -7.064 9.097 2.606 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -5.847 9.345 3.880 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -7.903 10.931 7.225 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -9.115 10.668 5.948 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -7.797 9.495 6.179 1.00 0.00 H new ATOM 864 N THR A 62 -5.618 10.704 0.891 1.00 0.00 N ATOM 865 CA THR A 62 -5.618 10.172 -0.466 1.00 0.00 C ATOM 866 C THR A 62 -5.621 8.647 -0.459 1.00 0.00 C ATOM 867 O THR A 62 -6.350 8.015 -1.222 1.00 0.00 O ATOM 868 CB THR A 62 -4.396 10.667 -1.263 1.00 0.00 C ATOM 869 OG1 THR A 62 -3.188 10.226 -0.632 1.00 0.00 O ATOM 870 CG2 THR A 62 -4.396 12.185 -1.364 1.00 0.00 C ATOM 0 H THR A 62 -4.730 10.604 1.383 1.00 0.00 H new ATOM 0 HA THR A 62 -6.527 10.533 -0.947 1.00 0.00 H new ATOM 0 HB THR A 62 -4.453 10.251 -2.269 1.00 0.00 H new ATOM 0 HG1 THR A 62 -2.416 10.543 -1.146 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.524 12.512 -1.931 1.00 0.00 H new ATOM 0 HG22 THR A 62 -5.303 12.516 -1.870 1.00 0.00 H new ATOM 0 HG23 THR A 62 -4.361 12.616 -0.364 1.00 0.00 H new ATOM 878 N GLY A 63 -4.802 8.062 0.410 1.00 0.00 N ATOM 879 CA GLY A 63 -4.727 6.616 0.500 1.00 0.00 C ATOM 880 C GLY A 63 -4.350 6.140 1.889 1.00 0.00 C ATOM 881 O GLY A 63 -4.681 6.784 2.885 1.00 0.00 O ATOM 0 H GLY A 63 -4.189 8.564 1.053 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.690 6.187 0.221 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.994 6.248 -0.218 1.00 0.00 H new ATOM 885 N TYR A 64 -3.656 5.009 1.957 1.00 0.00 N ATOM 886 CA TYR A 64 -3.237 4.446 3.235 1.00 0.00 C ATOM 887 C TYR A 64 -1.985 3.590 3.068 1.00 0.00 C ATOM 888 O TYR A 64 -1.609 3.227 1.953 1.00 0.00 O ATOM 889 CB TYR A 64 -4.364 3.608 3.841 1.00 0.00 C ATOM 890 CG TYR A 64 -5.646 4.381 4.055 1.00 0.00 C ATOM 891 CD1 TYR A 64 -6.509 4.639 2.997 1.00 0.00 C ATOM 892 CD2 TYR A 64 -5.993 4.854 5.314 1.00 0.00 C ATOM 893 CE1 TYR A 64 -7.681 5.346 3.188 1.00 0.00 C ATOM 894 CE2 TYR A 64 -7.163 5.560 5.514 1.00 0.00 C ATOM 895 CZ TYR A 64 -8.004 5.804 4.448 1.00 0.00 C ATOM 896 OH TYR A 64 -9.170 6.507 4.642 1.00 0.00 O ATOM 0 H TYR A 64 -3.372 4.465 1.143 1.00 0.00 H new ATOM 0 HA TYR A 64 -3.005 5.271 3.908 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -4.566 2.759 3.187 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -4.030 3.202 4.796 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -6.260 4.281 2.009 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -5.337 4.666 6.151 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -8.341 5.539 2.355 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -7.418 5.919 6.500 1.00 0.00 H new ATOM 0 HH TYR A 64 -9.499 6.350 5.552 1.00 0.00 H new ATOM 906 N LYS A 65 -1.343 3.269 4.186 1.00 0.00 N ATOM 907 CA LYS A 65 -0.134 2.454 4.168 1.00 0.00 C ATOM 908 C LYS A 65 -0.282 1.239 5.079 1.00 0.00 C ATOM 909 O LYS A 65 -0.679 1.366 6.238 1.00 0.00 O ATOM 910 CB LYS A 65 1.074 3.286 4.603 1.00 0.00 C ATOM 911 CG LYS A 65 2.395 2.543 4.499 1.00 0.00 C ATOM 912 CD LYS A 65 3.578 3.489 4.623 1.00 0.00 C ATOM 913 CE LYS A 65 3.954 4.090 3.278 1.00 0.00 C ATOM 914 NZ LYS A 65 3.212 5.353 3.008 1.00 0.00 N ATOM 0 H LYS A 65 -1.640 3.561 5.117 1.00 0.00 H new ATOM 0 HA LYS A 65 0.022 2.104 3.148 1.00 0.00 H new ATOM 0 HB2 LYS A 65 1.124 4.186 3.990 1.00 0.00 H new ATOM 0 HB3 LYS A 65 0.929 3.610 5.634 1.00 0.00 H new ATOM 0 HG2 LYS A 65 2.450 1.786 5.281 1.00 0.00 H new ATOM 0 HG3 LYS A 65 2.445 2.020 3.544 1.00 0.00 H new ATOM 0 HD2 LYS A 65 3.335 4.287 5.324 1.00 0.00 H new ATOM 0 HD3 LYS A 65 4.433 2.952 5.035 1.00 0.00 H new ATOM 0 HE2 LYS A 65 5.026 4.286 3.255 1.00 0.00 H new ATOM 0 HE3 LYS A 65 3.745 3.370 2.487 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 2.700 5.269 2.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 2.533 5.528 3.776 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 3.884 6.145 2.953 1.00 0.00 H new ATOM 928 N ILE A 66 0.039 0.065 4.548 1.00 0.00 N ATOM 929 CA ILE A 66 -0.056 -1.171 5.315 1.00 0.00 C ATOM 930 C ILE A 66 1.324 -1.767 5.572 1.00 0.00 C ATOM 931 O ILE A 66 1.999 -2.218 4.646 1.00 0.00 O ATOM 932 CB ILE A 66 -0.927 -2.216 4.592 1.00 0.00 C ATOM 933 CG1 ILE A 66 -2.219 -1.572 4.086 1.00 0.00 C ATOM 934 CG2 ILE A 66 -1.239 -3.380 5.522 1.00 0.00 C ATOM 935 CD1 ILE A 66 -2.777 -2.232 2.844 1.00 0.00 C ATOM 0 H ILE A 66 0.367 -0.057 3.590 1.00 0.00 H new ATOM 0 HA ILE A 66 -0.522 -0.916 6.267 1.00 0.00 H new ATOM 0 HB ILE A 66 -0.373 -2.599 3.735 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -2.969 -1.611 4.876 1.00 0.00 H new ATOM 0 HG13 ILE A 66 -2.032 -0.519 3.875 1.00 0.00 H new ATOM 0 HG21 ILE A 66 -1.855 -4.110 4.997 1.00 0.00 H new ATOM 0 HG22 ILE A 66 -0.309 -3.851 5.840 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -1.777 -3.013 6.396 1.00 0.00 H new ATOM 0 HD11 ILE A 66 -3.693 -1.724 2.542 1.00 0.00 H new ATOM 0 HD12 ILE A 66 -2.045 -2.170 2.039 1.00 0.00 H new ATOM 0 HD13 ILE A 66 -2.996 -3.279 3.055 1.00 0.00 H new ATOM 947 N ARG A 67 1.736 -1.767 6.835 1.00 0.00 N ATOM 948 CA ARG A 67 3.036 -2.308 7.214 1.00 0.00 C ATOM 949 C ARG A 67 2.889 -3.701 7.818 1.00 0.00 C ATOM 950 O ARG A 67 2.336 -3.863 8.907 1.00 0.00 O ATOM 951 CB ARG A 67 3.728 -1.378 8.213 1.00 0.00 C ATOM 952 CG ARG A 67 4.599 -0.319 7.556 1.00 0.00 C ATOM 953 CD ARG A 67 6.016 -0.823 7.335 1.00 0.00 C ATOM 954 NE ARG A 67 6.950 0.268 7.069 1.00 0.00 N ATOM 955 CZ ARG A 67 7.342 1.141 7.990 1.00 0.00 C ATOM 956 NH1 ARG A 67 6.884 1.051 9.231 1.00 0.00 N ATOM 957 NH2 ARG A 67 8.194 2.107 7.671 1.00 0.00 N ATOM 0 H ARG A 67 1.189 -1.399 7.613 1.00 0.00 H new ATOM 0 HA ARG A 67 3.647 -2.383 6.314 1.00 0.00 H new ATOM 0 HB2 ARG A 67 2.971 -0.886 8.823 1.00 0.00 H new ATOM 0 HB3 ARG A 67 4.342 -1.975 8.887 1.00 0.00 H new ATOM 0 HG2 ARG A 67 4.162 -0.028 6.601 1.00 0.00 H new ATOM 0 HG3 ARG A 67 4.622 0.574 8.181 1.00 0.00 H new ATOM 0 HD2 ARG A 67 6.345 -1.376 8.215 1.00 0.00 H new ATOM 0 HD3 ARG A 67 6.026 -1.521 6.498 1.00 0.00 H new ATOM 0 HE ARG A 67 7.322 0.365 6.124 1.00 0.00 H new ATOM 0 HH11 ARG A 67 6.229 0.310 9.480 1.00 0.00 H new ATOM 0 HH12 ARG A 67 7.187 1.723 9.936 1.00 0.00 H new ATOM 0 HH21 ARG A 67 8.549 2.180 6.717 1.00 0.00 H new ATOM 0 HH22 ARG A 67 8.494 2.777 8.379 1.00 0.00 H new ATOM 971 N HIS A 68 3.388 -4.706 7.105 1.00 0.00 N ATOM 972 CA HIS A 68 3.313 -6.086 7.570 1.00 0.00 C ATOM 973 C HIS A 68 4.702 -6.714 7.634 1.00 0.00 C ATOM 974 O HIS A 68 5.514 -6.543 6.724 1.00 0.00 O ATOM 975 CB HIS A 68 2.410 -6.908 6.650 1.00 0.00 C ATOM 976 CG HIS A 68 3.094 -7.378 5.404 1.00 0.00 C ATOM 977 ND1 HIS A 68 3.439 -6.533 4.370 1.00 0.00 N ATOM 978 CD2 HIS A 68 3.499 -8.614 5.028 1.00 0.00 C ATOM 979 CE1 HIS A 68 4.025 -7.229 3.412 1.00 0.00 C ATOM 980 NE2 HIS A 68 4.074 -8.495 3.787 1.00 0.00 N ATOM 0 H HIS A 68 3.849 -4.590 6.202 1.00 0.00 H new ATOM 0 HA HIS A 68 2.889 -6.083 8.574 1.00 0.00 H new ATOM 0 HB2 HIS A 68 2.037 -7.773 7.198 1.00 0.00 H new ATOM 0 HB3 HIS A 68 1.543 -6.308 6.374 1.00 0.00 H new ATOM 0 HD2 HIS A 68 3.390 -9.525 5.598 1.00 0.00 H new ATOM 0 HE1 HIS A 68 4.400 -6.831 2.481 1.00 0.00 H new ATOM 0 HE2 HIS A 68 4.474 -9.260 3.243 1.00 0.00 H new ATOM 989 N ARG A 69 4.969 -7.441 8.714 1.00 0.00 N ATOM 990 CA ARG A 69 6.260 -8.093 8.896 1.00 0.00 C ATOM 991 C ARG A 69 6.100 -9.418 9.637 1.00 0.00 C ATOM 992 O ARG A 69 5.216 -9.567 10.481 1.00 0.00 O ATOM 993 CB ARG A 69 7.213 -7.178 9.667 1.00 0.00 C ATOM 994 CG ARG A 69 7.055 -7.265 11.176 1.00 0.00 C ATOM 995 CD ARG A 69 7.955 -8.338 11.769 1.00 0.00 C ATOM 996 NE ARG A 69 7.974 -8.290 13.228 1.00 0.00 N ATOM 997 CZ ARG A 69 7.053 -8.863 13.995 1.00 0.00 C ATOM 998 NH1 ARG A 69 6.044 -9.524 13.443 1.00 0.00 N ATOM 999 NH2 ARG A 69 7.139 -8.776 15.316 1.00 0.00 N ATOM 0 H ARG A 69 4.308 -7.593 9.476 1.00 0.00 H new ATOM 0 HA ARG A 69 6.679 -8.295 7.910 1.00 0.00 H new ATOM 0 HB2 ARG A 69 8.240 -7.432 9.403 1.00 0.00 H new ATOM 0 HB3 ARG A 69 7.048 -6.148 9.352 1.00 0.00 H new ATOM 0 HG2 ARG A 69 7.293 -6.300 11.624 1.00 0.00 H new ATOM 0 HG3 ARG A 69 6.016 -7.483 11.422 1.00 0.00 H new ATOM 0 HD2 ARG A 69 7.612 -9.320 11.443 1.00 0.00 H new ATOM 0 HD3 ARG A 69 8.969 -8.212 11.389 1.00 0.00 H new ATOM 0 HE ARG A 69 8.737 -7.789 13.684 1.00 0.00 H new ATOM 0 HH11 ARG A 69 5.974 -9.593 12.428 1.00 0.00 H new ATOM 0 HH12 ARG A 69 5.338 -9.963 14.034 1.00 0.00 H new ATOM 0 HH21 ARG A 69 7.913 -8.269 15.744 1.00 0.00 H new ATOM 0 HH22 ARG A 69 6.431 -9.217 15.903 1.00 0.00 H new ATOM 1013 N LYS A 70 6.961 -10.377 9.315 1.00 0.00 N ATOM 1014 CA LYS A 70 6.917 -11.689 9.950 1.00 0.00 C ATOM 1015 C LYS A 70 7.793 -11.720 11.198 1.00 0.00 C ATOM 1016 O LYS A 70 8.940 -11.273 11.176 1.00 0.00 O ATOM 1017 CB LYS A 70 7.375 -12.769 8.967 1.00 0.00 C ATOM 1018 CG LYS A 70 7.374 -14.169 9.557 1.00 0.00 C ATOM 1019 CD LYS A 70 6.028 -14.849 9.376 1.00 0.00 C ATOM 1020 CE LYS A 70 6.164 -16.364 9.377 1.00 0.00 C ATOM 1021 NZ LYS A 70 6.674 -16.874 10.680 1.00 0.00 N ATOM 0 H LYS A 70 7.698 -10.270 8.618 1.00 0.00 H new ATOM 0 HA LYS A 70 5.887 -11.887 10.246 1.00 0.00 H new ATOM 0 HB2 LYS A 70 6.724 -12.752 8.093 1.00 0.00 H new ATOM 0 HB3 LYS A 70 8.381 -12.530 8.621 1.00 0.00 H new ATOM 0 HG2 LYS A 70 8.151 -14.766 9.080 1.00 0.00 H new ATOM 0 HG3 LYS A 70 7.617 -14.118 10.618 1.00 0.00 H new ATOM 0 HD2 LYS A 70 5.354 -14.543 10.176 1.00 0.00 H new ATOM 0 HD3 LYS A 70 5.578 -14.524 8.438 1.00 0.00 H new ATOM 0 HE2 LYS A 70 5.195 -16.816 9.164 1.00 0.00 H new ATOM 0 HE3 LYS A 70 6.840 -16.669 8.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 6.689 -17.914 10.664 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 7.638 -16.517 10.840 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 6.052 -16.548 11.448 1.00 0.00 H new ATOM 1035 N THR A 71 7.245 -12.250 12.287 1.00 0.00 N ATOM 1036 CA THR A 71 7.976 -12.339 13.545 1.00 0.00 C ATOM 1037 C THR A 71 9.412 -12.796 13.315 1.00 0.00 C ATOM 1038 O THR A 71 9.695 -13.994 13.278 1.00 0.00 O ATOM 1039 CB THR A 71 7.291 -13.309 14.526 1.00 0.00 C ATOM 1040 OG1 THR A 71 8.101 -13.479 15.694 1.00 0.00 O ATOM 1041 CG2 THR A 71 7.049 -14.661 13.870 1.00 0.00 C ATOM 0 H THR A 71 6.297 -12.624 12.323 1.00 0.00 H new ATOM 0 HA THR A 71 7.981 -11.339 13.979 1.00 0.00 H new ATOM 0 HB THR A 71 6.329 -12.883 14.811 1.00 0.00 H new ATOM 0 HG1 THR A 71 7.657 -14.096 16.313 1.00 0.00 H new ATOM 0 HG21 THR A 71 6.564 -15.329 14.582 1.00 0.00 H new ATOM 0 HG22 THR A 71 6.408 -14.533 12.998 1.00 0.00 H new ATOM 0 HG23 THR A 71 8.002 -15.091 13.560 1.00 0.00 H new ATOM 1049 N THR A 72 10.317 -11.834 13.162 1.00 0.00 N ATOM 1050 CA THR A 72 11.724 -12.138 12.935 1.00 0.00 C ATOM 1051 C THR A 72 12.605 -10.936 13.257 1.00 0.00 C ATOM 1052 O THR A 72 12.133 -9.799 13.288 1.00 0.00 O ATOM 1053 CB THR A 72 11.978 -12.571 11.479 1.00 0.00 C ATOM 1054 OG1 THR A 72 13.355 -12.924 11.306 1.00 0.00 O ATOM 1055 CG2 THR A 72 11.609 -11.457 10.511 1.00 0.00 C ATOM 0 H THR A 72 10.100 -10.838 13.191 1.00 0.00 H new ATOM 0 HA THR A 72 11.980 -12.962 13.601 1.00 0.00 H new ATOM 0 HB THR A 72 11.352 -13.438 11.266 1.00 0.00 H new ATOM 0 HG1 THR A 72 13.508 -13.200 10.378 1.00 0.00 H new ATOM 0 HG21 THR A 72 11.797 -11.786 9.489 1.00 0.00 H new ATOM 0 HG22 THR A 72 10.553 -11.211 10.625 1.00 0.00 H new ATOM 0 HG23 THR A 72 12.212 -10.575 10.725 1.00 0.00 H new ATOM 1063 N ARG A 73 13.886 -11.194 13.496 1.00 0.00 N ATOM 1064 CA ARG A 73 14.833 -10.132 13.816 1.00 0.00 C ATOM 1065 C ARG A 73 14.676 -8.956 12.856 1.00 0.00 C ATOM 1066 O ARG A 73 14.317 -7.852 13.265 1.00 0.00 O ATOM 1067 CB ARG A 73 16.266 -10.664 13.758 1.00 0.00 C ATOM 1068 CG ARG A 73 17.262 -9.814 14.531 1.00 0.00 C ATOM 1069 CD ARG A 73 17.164 -10.064 16.028 1.00 0.00 C ATOM 1070 NE ARG A 73 16.023 -9.374 16.624 1.00 0.00 N ATOM 1071 CZ ARG A 73 15.542 -9.655 17.830 1.00 0.00 C ATOM 1072 NH1 ARG A 73 16.101 -10.608 18.564 1.00 0.00 N ATOM 1073 NH2 ARG A 73 14.501 -8.983 18.304 1.00 0.00 N ATOM 0 H ARG A 73 14.293 -12.129 13.474 1.00 0.00 H new ATOM 0 HA ARG A 73 14.622 -9.784 14.827 1.00 0.00 H new ATOM 0 HB2 ARG A 73 16.284 -11.680 14.153 1.00 0.00 H new ATOM 0 HB3 ARG A 73 16.582 -10.722 12.716 1.00 0.00 H new ATOM 0 HG2 ARG A 73 18.273 -10.035 14.189 1.00 0.00 H new ATOM 0 HG3 ARG A 73 17.080 -8.759 14.324 1.00 0.00 H new ATOM 0 HD2 ARG A 73 17.077 -11.135 16.212 1.00 0.00 H new ATOM 0 HD3 ARG A 73 18.082 -9.731 16.512 1.00 0.00 H new ATOM 0 HE ARG A 73 15.571 -8.636 16.085 1.00 0.00 H new ATOM 0 HH11 ARG A 73 16.902 -11.127 18.203 1.00 0.00 H new ATOM 0 HH12 ARG A 73 15.730 -10.822 19.490 1.00 0.00 H new ATOM 0 HH21 ARG A 73 14.069 -8.249 17.742 1.00 0.00 H new ATOM 0 HH22 ARG A 73 14.133 -9.200 19.230 1.00 0.00 H new ATOM 1087 N ARG A 74 14.947 -9.202 11.578 1.00 0.00 N ATOM 1088 CA ARG A 74 14.838 -8.163 10.561 1.00 0.00 C ATOM 1089 C ARG A 74 14.150 -8.699 9.309 1.00 0.00 C ATOM 1090 O ARG A 74 14.516 -9.753 8.790 1.00 0.00 O ATOM 1091 CB ARG A 74 16.223 -7.622 10.203 1.00 0.00 C ATOM 1092 CG ARG A 74 17.014 -7.130 11.404 1.00 0.00 C ATOM 1093 CD ARG A 74 18.404 -6.662 11.002 1.00 0.00 C ATOM 1094 NE ARG A 74 18.363 -5.419 10.236 1.00 0.00 N ATOM 1095 CZ ARG A 74 18.173 -5.372 8.922 1.00 0.00 C ATOM 1096 NH1 ARG A 74 18.007 -6.491 8.232 1.00 0.00 N ATOM 1097 NH2 ARG A 74 18.148 -4.202 8.296 1.00 0.00 N ATOM 0 H ARG A 74 15.243 -10.111 11.223 1.00 0.00 H new ATOM 0 HA ARG A 74 14.234 -7.352 10.969 1.00 0.00 H new ATOM 0 HB2 ARG A 74 16.791 -8.405 9.701 1.00 0.00 H new ATOM 0 HB3 ARG A 74 16.111 -6.803 9.492 1.00 0.00 H new ATOM 0 HG2 ARG A 74 16.478 -6.311 11.884 1.00 0.00 H new ATOM 0 HG3 ARG A 74 17.097 -7.930 12.139 1.00 0.00 H new ATOM 0 HD2 ARG A 74 19.010 -6.517 11.896 1.00 0.00 H new ATOM 0 HD3 ARG A 74 18.890 -7.437 10.410 1.00 0.00 H new ATOM 0 HE ARG A 74 18.487 -4.539 10.737 1.00 0.00 H new ATOM 0 HH11 ARG A 74 18.025 -7.392 8.710 1.00 0.00 H new ATOM 0 HH12 ARG A 74 17.861 -6.451 7.223 1.00 0.00 H new ATOM 0 HH21 ARG A 74 18.275 -3.338 8.824 1.00 0.00 H new ATOM 0 HH22 ARG A 74 18.002 -4.166 7.287 1.00 0.00 H new ATOM 1111 N GLY A 75 13.150 -7.965 8.829 1.00 0.00 N ATOM 1112 CA GLY A 75 12.426 -8.383 7.643 1.00 0.00 C ATOM 1113 C GLY A 75 11.100 -7.665 7.490 1.00 0.00 C ATOM 1114 O GLY A 75 10.066 -8.297 7.279 1.00 0.00 O ATOM 0 H GLY A 75 12.829 -7.089 9.241 1.00 0.00 H new ATOM 0 HA2 GLY A 75 13.040 -8.197 6.762 1.00 0.00 H new ATOM 0 HA3 GLY A 75 12.251 -9.458 7.688 1.00 0.00 H new ATOM 1118 N GLU A 76 11.130 -6.340 7.598 1.00 0.00 N ATOM 1119 CA GLU A 76 9.919 -5.537 7.473 1.00 0.00 C ATOM 1120 C GLU A 76 9.559 -5.321 6.006 1.00 0.00 C ATOM 1121 O GLU A 76 10.327 -5.670 5.110 1.00 0.00 O ATOM 1122 CB GLU A 76 10.103 -4.186 8.168 1.00 0.00 C ATOM 1123 CG GLU A 76 10.210 -4.289 9.680 1.00 0.00 C ATOM 1124 CD GLU A 76 11.022 -3.160 10.286 1.00 0.00 C ATOM 1125 OE1 GLU A 76 10.606 -1.991 10.147 1.00 0.00 O ATOM 1126 OE2 GLU A 76 12.072 -3.446 10.898 1.00 0.00 O ATOM 0 H GLU A 76 11.978 -5.801 7.771 1.00 0.00 H new ATOM 0 HA GLU A 76 9.104 -6.077 7.954 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.002 -3.707 7.780 1.00 0.00 H new ATOM 0 HB3 GLU A 76 9.263 -3.539 7.915 1.00 0.00 H new ATOM 0 HG2 GLU A 76 9.209 -4.285 10.112 1.00 0.00 H new ATOM 0 HG3 GLU A 76 10.667 -5.243 9.944 1.00 0.00 H new ATOM 1133 N MET A 77 8.385 -4.745 5.770 1.00 0.00 N ATOM 1134 CA MET A 77 7.922 -4.483 4.412 1.00 0.00 C ATOM 1135 C MET A 77 6.646 -3.648 4.424 1.00 0.00 C ATOM 1136 O MET A 77 5.724 -3.919 5.193 1.00 0.00 O ATOM 1137 CB MET A 77 7.678 -5.798 3.670 1.00 0.00 C ATOM 1138 CG MET A 77 7.883 -5.696 2.167 1.00 0.00 C ATOM 1139 SD MET A 77 9.608 -5.905 1.686 1.00 0.00 S ATOM 1140 CE MET A 77 9.550 -5.371 -0.023 1.00 0.00 C ATOM 0 H MET A 77 7.737 -4.451 6.501 1.00 0.00 H new ATOM 0 HA MET A 77 8.698 -3.921 3.893 1.00 0.00 H new ATOM 0 HB2 MET A 77 8.348 -6.560 4.069 1.00 0.00 H new ATOM 0 HB3 MET A 77 6.660 -6.133 3.867 1.00 0.00 H new ATOM 0 HG2 MET A 77 7.277 -6.453 1.669 1.00 0.00 H new ATOM 0 HG3 MET A 77 7.528 -4.725 1.821 1.00 0.00 H new ATOM 0 HE1 MET A 77 10.546 -5.443 -0.461 1.00 0.00 H new ATOM 0 HE2 MET A 77 8.862 -6.007 -0.580 1.00 0.00 H new ATOM 0 HE3 MET A 77 9.207 -4.338 -0.070 1.00 0.00 H new ATOM 1150 N GLU A 78 6.600 -2.632 3.568 1.00 0.00 N ATOM 1151 CA GLU A 78 5.436 -1.758 3.483 1.00 0.00 C ATOM 1152 C GLU A 78 4.719 -1.935 2.147 1.00 0.00 C ATOM 1153 O GLU A 78 5.333 -2.297 1.142 1.00 0.00 O ATOM 1154 CB GLU A 78 5.853 -0.297 3.660 1.00 0.00 C ATOM 1155 CG GLU A 78 6.661 0.251 2.495 1.00 0.00 C ATOM 1156 CD GLU A 78 5.834 0.403 1.233 1.00 0.00 C ATOM 1157 OE1 GLU A 78 4.749 1.018 1.306 1.00 0.00 O ATOM 1158 OE2 GLU A 78 6.271 -0.092 0.174 1.00 0.00 O ATOM 0 H GLU A 78 7.355 -2.394 2.924 1.00 0.00 H new ATOM 0 HA GLU A 78 4.749 -2.032 4.284 1.00 0.00 H new ATOM 0 HB2 GLU A 78 4.960 0.314 3.791 1.00 0.00 H new ATOM 0 HB3 GLU A 78 6.440 -0.204 4.574 1.00 0.00 H new ATOM 0 HG2 GLU A 78 7.078 1.220 2.771 1.00 0.00 H new ATOM 0 HG3 GLU A 78 7.502 -0.413 2.296 1.00 0.00 H new ATOM 1165 N THR A 79 3.415 -1.676 2.143 1.00 0.00 N ATOM 1166 CA THR A 79 2.613 -1.808 0.933 1.00 0.00 C ATOM 1167 C THR A 79 1.344 -0.969 1.020 1.00 0.00 C ATOM 1168 O THR A 79 0.501 -1.187 1.891 1.00 0.00 O ATOM 1169 CB THR A 79 2.227 -3.276 0.672 1.00 0.00 C ATOM 1170 OG1 THR A 79 3.404 -4.091 0.623 1.00 0.00 O ATOM 1171 CG2 THR A 79 1.458 -3.410 -0.634 1.00 0.00 C ATOM 0 H THR A 79 2.892 -1.373 2.965 1.00 0.00 H new ATOM 0 HA THR A 79 3.227 -1.449 0.107 1.00 0.00 H new ATOM 0 HB THR A 79 1.587 -3.610 1.488 1.00 0.00 H new ATOM 0 HG1 THR A 79 4.183 -3.529 0.431 1.00 0.00 H new ATOM 0 HG21 THR A 79 1.196 -4.456 -0.797 1.00 0.00 H new ATOM 0 HG22 THR A 79 0.548 -2.812 -0.583 1.00 0.00 H new ATOM 0 HG23 THR A 79 2.078 -3.059 -1.459 1.00 0.00 H new ATOM 1179 N LEU A 80 1.213 -0.008 0.112 1.00 0.00 N ATOM 1180 CA LEU A 80 0.044 0.865 0.086 1.00 0.00 C ATOM 1181 C LEU A 80 -0.856 0.534 -1.100 1.00 0.00 C ATOM 1182 O LEU A 80 -0.377 0.305 -2.210 1.00 0.00 O ATOM 1183 CB LEU A 80 0.479 2.330 0.017 1.00 0.00 C ATOM 1184 CG LEU A 80 1.432 2.695 -1.122 1.00 0.00 C ATOM 1185 CD1 LEU A 80 0.666 2.866 -2.424 1.00 0.00 C ATOM 1186 CD2 LEU A 80 2.205 3.962 -0.785 1.00 0.00 C ATOM 0 H LEU A 80 1.901 0.186 -0.615 1.00 0.00 H new ATOM 0 HA LEU A 80 -0.521 0.703 1.004 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -0.414 2.949 -0.071 1.00 0.00 H new ATOM 0 HB3 LEU A 80 0.957 2.591 0.961 1.00 0.00 H new ATOM 0 HG LEU A 80 2.146 1.881 -1.249 1.00 0.00 H new ATOM 0 HD11 LEU A 80 1.360 3.126 -3.223 1.00 0.00 H new ATOM 0 HD12 LEU A 80 0.158 1.934 -2.673 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -0.071 3.661 -2.311 1.00 0.00 H new ATOM 0 HD21 LEU A 80 2.878 4.207 -1.607 1.00 0.00 H new ATOM 0 HD22 LEU A 80 1.506 4.784 -0.631 1.00 0.00 H new ATOM 0 HD23 LEU A 80 2.785 3.803 0.124 1.00 0.00 H new ATOM 1198 N GLU A 81 -2.163 0.513 -0.857 1.00 0.00 N ATOM 1199 CA GLU A 81 -3.130 0.212 -1.906 1.00 0.00 C ATOM 1200 C GLU A 81 -4.273 1.223 -1.899 1.00 0.00 C ATOM 1201 O GLU A 81 -5.190 1.155 -1.081 1.00 0.00 O ATOM 1202 CB GLU A 81 -3.685 -1.203 -1.727 1.00 0.00 C ATOM 1203 CG GLU A 81 -5.087 -1.382 -2.284 1.00 0.00 C ATOM 1204 CD GLU A 81 -5.352 -2.798 -2.756 1.00 0.00 C ATOM 1205 OE1 GLU A 81 -4.539 -3.320 -3.548 1.00 0.00 O ATOM 1206 OE2 GLU A 81 -6.370 -3.384 -2.335 1.00 0.00 O ATOM 0 H GLU A 81 -2.576 0.701 0.057 1.00 0.00 H new ATOM 0 HA GLU A 81 -2.618 0.275 -2.866 1.00 0.00 H new ATOM 0 HB2 GLU A 81 -3.016 -1.911 -2.216 1.00 0.00 H new ATOM 0 HB3 GLU A 81 -3.691 -1.450 -0.665 1.00 0.00 H new ATOM 0 HG2 GLU A 81 -5.815 -1.117 -1.517 1.00 0.00 H new ATOM 0 HG3 GLU A 81 -5.234 -0.693 -3.115 1.00 0.00 H new ATOM 1213 N PRO A 82 -4.218 2.184 -2.833 1.00 0.00 N ATOM 1214 CA PRO A 82 -5.240 3.227 -2.956 1.00 0.00 C ATOM 1215 C PRO A 82 -6.571 2.679 -3.459 1.00 0.00 C ATOM 1216 O PRO A 82 -7.620 3.290 -3.259 1.00 0.00 O ATOM 1217 CB PRO A 82 -4.639 4.193 -3.980 1.00 0.00 C ATOM 1218 CG PRO A 82 -3.703 3.359 -4.785 1.00 0.00 C ATOM 1219 CD PRO A 82 -3.154 2.325 -3.841 1.00 0.00 C ATOM 0 HA PRO A 82 -5.468 3.689 -1.995 1.00 0.00 H new ATOM 0 HB2 PRO A 82 -5.412 4.637 -4.607 1.00 0.00 H new ATOM 0 HB3 PRO A 82 -4.116 5.014 -3.490 1.00 0.00 H new ATOM 0 HG2 PRO A 82 -4.220 2.889 -5.621 1.00 0.00 H new ATOM 0 HG3 PRO A 82 -2.902 3.967 -5.206 1.00 0.00 H new ATOM 0 HD2 PRO A 82 -2.955 1.382 -4.350 1.00 0.00 H new ATOM 0 HD3 PRO A 82 -2.215 2.649 -3.392 1.00 0.00 H new ATOM 1227 N ASN A 83 -6.520 1.523 -4.113 1.00 0.00 N ATOM 1228 CA ASN A 83 -7.723 0.892 -4.644 1.00 0.00 C ATOM 1229 C ASN A 83 -8.853 0.924 -3.619 1.00 0.00 C ATOM 1230 O ASN A 83 -9.831 1.652 -3.781 1.00 0.00 O ATOM 1231 CB ASN A 83 -7.429 -0.553 -5.051 1.00 0.00 C ATOM 1232 CG ASN A 83 -6.188 -0.670 -5.914 1.00 0.00 C ATOM 1233 OD1 ASN A 83 -5.221 -1.336 -5.544 1.00 0.00 O ATOM 1234 ND2 ASN A 83 -6.210 -0.020 -7.072 1.00 0.00 N ATOM 0 H ASN A 83 -5.659 1.004 -4.288 1.00 0.00 H new ATOM 0 HA ASN A 83 -8.039 1.453 -5.524 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -7.304 -1.161 -4.155 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -8.284 -0.956 -5.593 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -5.404 -0.061 -7.695 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -7.033 0.520 -7.338 1.00 0.00 H new ATOM 1241 N ASN A 84 -8.709 0.129 -2.564 1.00 0.00 N ATOM 1242 CA ASN A 84 -9.717 0.066 -1.511 1.00 0.00 C ATOM 1243 C ASN A 84 -9.083 0.264 -0.138 1.00 0.00 C ATOM 1244 O ASN A 84 -7.858 0.292 -0.005 1.00 0.00 O ATOM 1245 CB ASN A 84 -10.450 -1.276 -1.558 1.00 0.00 C ATOM 1246 CG ASN A 84 -11.028 -1.571 -2.929 1.00 0.00 C ATOM 1247 OD1 ASN A 84 -10.553 -2.459 -3.637 1.00 0.00 O ATOM 1248 ND2 ASN A 84 -12.058 -0.825 -3.310 1.00 0.00 N ATOM 0 H ASN A 84 -7.905 -0.480 -2.415 1.00 0.00 H new ATOM 0 HA ASN A 84 -10.433 0.870 -1.680 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -9.761 -2.073 -1.278 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -11.253 -1.274 -0.821 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -12.488 -0.977 -4.222 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -12.419 -0.100 -2.690 1.00 0.00 H new ATOM 1255 N LEU A 85 -9.923 0.400 0.882 1.00 0.00 N ATOM 1256 CA LEU A 85 -9.446 0.595 2.246 1.00 0.00 C ATOM 1257 C LEU A 85 -9.116 -0.742 2.903 1.00 0.00 C ATOM 1258 O LEU A 85 -8.989 -0.829 4.125 1.00 0.00 O ATOM 1259 CB LEU A 85 -10.496 1.338 3.074 1.00 0.00 C ATOM 1260 CG LEU A 85 -11.085 2.597 2.437 1.00 0.00 C ATOM 1261 CD1 LEU A 85 -12.264 3.106 3.252 1.00 0.00 C ATOM 1262 CD2 LEU A 85 -10.020 3.676 2.305 1.00 0.00 C ATOM 0 H LEU A 85 -10.939 0.379 0.790 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.536 1.193 2.204 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -11.312 0.649 3.291 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -10.048 1.613 4.029 1.00 0.00 H new ATOM 0 HG LEU A 85 -11.442 2.343 1.439 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -12.670 4.002 2.783 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -13.036 2.337 3.295 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -11.932 3.343 4.263 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.457 4.565 1.850 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -9.632 3.927 3.292 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -9.207 3.310 1.678 1.00 0.00 H new ATOM 1274 N TRP A 86 -8.977 -1.779 2.085 1.00 0.00 N ATOM 1275 CA TRP A 86 -8.659 -3.111 2.587 1.00 0.00 C ATOM 1276 C TRP A 86 -7.693 -3.829 1.652 1.00 0.00 C ATOM 1277 O TRP A 86 -7.634 -3.533 0.458 1.00 0.00 O ATOM 1278 CB TRP A 86 -9.937 -3.935 2.751 1.00 0.00 C ATOM 1279 CG TRP A 86 -10.762 -4.006 1.501 1.00 0.00 C ATOM 1280 CD1 TRP A 86 -11.887 -3.285 1.220 1.00 0.00 C ATOM 1281 CD2 TRP A 86 -10.527 -4.845 0.365 1.00 0.00 C ATOM 1282 NE1 TRP A 86 -12.366 -3.626 -0.022 1.00 0.00 N ATOM 1283 CE2 TRP A 86 -11.548 -4.580 -0.568 1.00 0.00 C ATOM 1284 CE3 TRP A 86 -9.551 -5.793 0.045 1.00 0.00 C ATOM 1285 CZ2 TRP A 86 -11.621 -5.231 -1.796 1.00 0.00 C ATOM 1286 CZ3 TRP A 86 -9.625 -6.438 -1.175 1.00 0.00 C ATOM 1287 CH2 TRP A 86 -10.653 -6.154 -2.084 1.00 0.00 C ATOM 0 H TRP A 86 -9.079 -1.723 1.072 1.00 0.00 H new ATOM 0 HA TRP A 86 -8.179 -3.001 3.559 1.00 0.00 H new ATOM 0 HB2 TRP A 86 -9.672 -4.946 3.061 1.00 0.00 H new ATOM 0 HB3 TRP A 86 -10.539 -3.504 3.551 1.00 0.00 H new ATOM 0 HD1 TRP A 86 -12.335 -2.554 1.877 1.00 0.00 H new ATOM 0 HE1 TRP A 86 -13.196 -3.233 -0.466 1.00 0.00 H new ATOM 0 HE3 TRP A 86 -8.754 -6.017 0.738 1.00 0.00 H new ATOM 0 HZ2 TRP A 86 -12.414 -5.015 -2.497 1.00 0.00 H new ATOM 0 HZ3 TRP A 86 -8.877 -7.174 -1.432 1.00 0.00 H new ATOM 0 HH2 TRP A 86 -10.682 -6.674 -3.030 1.00 0.00 H new ATOM 1298 N TYR A 87 -6.936 -4.773 2.201 1.00 0.00 N ATOM 1299 CA TYR A 87 -5.970 -5.531 1.415 1.00 0.00 C ATOM 1300 C TYR A 87 -6.069 -7.022 1.723 1.00 0.00 C ATOM 1301 O TYR A 87 -5.879 -7.447 2.864 1.00 0.00 O ATOM 1302 CB TYR A 87 -4.551 -5.034 1.695 1.00 0.00 C ATOM 1303 CG TYR A 87 -3.543 -5.462 0.652 1.00 0.00 C ATOM 1304 CD1 TYR A 87 -3.111 -6.781 0.576 1.00 0.00 C ATOM 1305 CD2 TYR A 87 -3.023 -4.549 -0.256 1.00 0.00 C ATOM 1306 CE1 TYR A 87 -2.189 -7.177 -0.374 1.00 0.00 C ATOM 1307 CE2 TYR A 87 -2.102 -4.936 -1.211 1.00 0.00 C ATOM 1308 CZ TYR A 87 -1.689 -6.251 -1.265 1.00 0.00 C ATOM 1309 OH TYR A 87 -0.771 -6.640 -2.214 1.00 0.00 O ATOM 0 H TYR A 87 -6.973 -5.031 3.187 1.00 0.00 H new ATOM 0 HA TYR A 87 -6.199 -5.380 0.360 1.00 0.00 H new ATOM 0 HB2 TYR A 87 -4.561 -3.946 1.753 1.00 0.00 H new ATOM 0 HB3 TYR A 87 -4.232 -5.403 2.670 1.00 0.00 H new ATOM 0 HD1 TYR A 87 -3.503 -7.509 1.271 1.00 0.00 H new ATOM 0 HD2 TYR A 87 -3.344 -3.519 -0.215 1.00 0.00 H new ATOM 0 HE1 TYR A 87 -1.862 -8.205 -0.418 1.00 0.00 H new ATOM 0 HE2 TYR A 87 -1.708 -4.213 -1.910 1.00 0.00 H new ATOM 0 HH TYR A 87 -0.521 -5.868 -2.763 1.00 0.00 H new ATOM 1319 N LEU A 88 -6.366 -7.813 0.698 1.00 0.00 N ATOM 1320 CA LEU A 88 -6.490 -9.258 0.856 1.00 0.00 C ATOM 1321 C LEU A 88 -5.198 -9.962 0.452 1.00 0.00 C ATOM 1322 O LEU A 88 -4.864 -10.039 -0.730 1.00 0.00 O ATOM 1323 CB LEU A 88 -7.655 -9.785 0.017 1.00 0.00 C ATOM 1324 CG LEU A 88 -8.178 -11.172 0.391 1.00 0.00 C ATOM 1325 CD1 LEU A 88 -7.095 -12.222 0.195 1.00 0.00 C ATOM 1326 CD2 LEU A 88 -8.679 -11.183 1.828 1.00 0.00 C ATOM 0 H LEU A 88 -6.526 -7.478 -0.252 1.00 0.00 H new ATOM 0 HA LEU A 88 -6.684 -9.469 1.908 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -8.479 -9.076 0.091 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -7.344 -9.805 -1.028 1.00 0.00 H new ATOM 0 HG LEU A 88 -9.013 -11.414 -0.267 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -7.486 -13.203 0.466 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -6.783 -12.232 -0.849 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -6.239 -11.985 0.827 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -9.048 -12.178 2.077 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -7.862 -10.920 2.500 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -9.487 -10.459 1.937 1.00 0.00 H new ATOM 1338 N PHE A 89 -4.476 -10.476 1.443 1.00 0.00 N ATOM 1339 CA PHE A 89 -3.222 -11.176 1.191 1.00 0.00 C ATOM 1340 C PHE A 89 -3.463 -12.669 0.989 1.00 0.00 C ATOM 1341 O PHE A 89 -4.350 -13.257 1.608 1.00 0.00 O ATOM 1342 CB PHE A 89 -2.250 -10.957 2.352 1.00 0.00 C ATOM 1343 CG PHE A 89 -1.707 -9.559 2.425 1.00 0.00 C ATOM 1344 CD1 PHE A 89 -0.570 -9.205 1.717 1.00 0.00 C ATOM 1345 CD2 PHE A 89 -2.334 -8.598 3.202 1.00 0.00 C ATOM 1346 CE1 PHE A 89 -0.068 -7.919 1.782 1.00 0.00 C ATOM 1347 CE2 PHE A 89 -1.838 -7.310 3.270 1.00 0.00 C ATOM 1348 CZ PHE A 89 -0.703 -6.970 2.560 1.00 0.00 C ATOM 0 H PHE A 89 -4.738 -10.421 2.427 1.00 0.00 H new ATOM 0 HA PHE A 89 -2.785 -10.770 0.278 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -2.757 -11.190 3.288 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.419 -11.656 2.256 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -0.070 -9.943 1.107 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -3.221 -8.859 3.761 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.819 -7.656 1.225 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.337 -6.570 3.878 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.313 -5.964 2.613 1.00 0.00 H new ATOM 1358 N THR A 90 -2.666 -13.278 0.116 1.00 0.00 N ATOM 1359 CA THR A 90 -2.793 -14.701 -0.171 1.00 0.00 C ATOM 1360 C THR A 90 -1.425 -15.368 -0.258 1.00 0.00 C ATOM 1361 O THR A 90 -0.487 -14.811 -0.827 1.00 0.00 O ATOM 1362 CB THR A 90 -3.554 -14.943 -1.488 1.00 0.00 C ATOM 1363 OG1 THR A 90 -2.886 -14.283 -2.569 1.00 0.00 O ATOM 1364 CG2 THR A 90 -4.986 -14.440 -1.386 1.00 0.00 C ATOM 0 H THR A 90 -1.926 -12.807 -0.404 1.00 0.00 H new ATOM 0 HA THR A 90 -3.357 -15.140 0.652 1.00 0.00 H new ATOM 0 HB THR A 90 -3.576 -16.016 -1.677 1.00 0.00 H new ATOM 0 HG1 THR A 90 -3.375 -14.443 -3.403 1.00 0.00 H new ATOM 0 HG21 THR A 90 -5.503 -14.622 -2.328 1.00 0.00 H new ATOM 0 HG22 THR A 90 -5.500 -14.967 -0.582 1.00 0.00 H new ATOM 0 HG23 THR A 90 -4.982 -13.371 -1.175 1.00 0.00 H new ATOM 1372 N GLY A 91 -1.319 -16.566 0.310 1.00 0.00 N ATOM 1373 CA GLY A 91 -0.061 -17.290 0.284 1.00 0.00 C ATOM 1374 C GLY A 91 0.762 -17.066 1.538 1.00 0.00 C ATOM 1375 O GLY A 91 1.946 -16.736 1.461 1.00 0.00 O ATOM 0 H GLY A 91 -2.081 -17.048 0.787 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -0.261 -18.355 0.169 1.00 0.00 H new ATOM 0 HA3 GLY A 91 0.516 -16.978 -0.586 1.00 0.00 H new ATOM 1379 N LEU A 92 0.135 -17.243 2.695 1.00 0.00 N ATOM 1380 CA LEU A 92 0.816 -17.057 3.971 1.00 0.00 C ATOM 1381 C LEU A 92 1.104 -18.399 4.636 1.00 0.00 C ATOM 1382 O LEU A 92 0.493 -19.412 4.299 1.00 0.00 O ATOM 1383 CB LEU A 92 -0.029 -16.185 4.901 1.00 0.00 C ATOM 1384 CG LEU A 92 -0.561 -14.883 4.301 1.00 0.00 C ATOM 1385 CD1 LEU A 92 -1.562 -14.231 5.242 1.00 0.00 C ATOM 1386 CD2 LEU A 92 0.586 -13.929 3.996 1.00 0.00 C ATOM 0 H LEU A 92 -0.845 -17.515 2.776 1.00 0.00 H new ATOM 0 HA LEU A 92 1.765 -16.557 3.778 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -0.877 -16.775 5.248 1.00 0.00 H new ATOM 0 HB3 LEU A 92 0.569 -15.939 5.779 1.00 0.00 H new ATOM 0 HG LEU A 92 -1.071 -15.118 3.367 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -1.930 -13.306 4.798 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -2.398 -14.910 5.411 1.00 0.00 H new ATOM 0 HD13 LEU A 92 -1.077 -14.009 6.193 1.00 0.00 H new ATOM 0 HD21 LEU A 92 0.189 -13.008 3.570 1.00 0.00 H new ATOM 0 HD22 LEU A 92 1.124 -13.701 4.916 1.00 0.00 H new ATOM 0 HD23 LEU A 92 1.267 -14.395 3.284 1.00 0.00 H new ATOM 1398 N GLU A 93 2.037 -18.397 5.583 1.00 0.00 N ATOM 1399 CA GLU A 93 2.403 -19.615 6.296 1.00 0.00 C ATOM 1400 C GLU A 93 1.342 -19.981 7.330 1.00 0.00 C ATOM 1401 O GLU A 93 0.763 -19.108 7.978 1.00 0.00 O ATOM 1402 CB GLU A 93 3.761 -19.442 6.982 1.00 0.00 C ATOM 1403 CG GLU A 93 4.928 -19.367 6.012 1.00 0.00 C ATOM 1404 CD GLU A 93 6.238 -19.036 6.699 1.00 0.00 C ATOM 1405 OE1 GLU A 93 6.599 -19.744 7.663 1.00 0.00 O ATOM 1406 OE2 GLU A 93 6.902 -18.069 6.274 1.00 0.00 O ATOM 0 H GLU A 93 2.553 -17.566 5.874 1.00 0.00 H new ATOM 0 HA GLU A 93 2.471 -20.424 5.569 1.00 0.00 H new ATOM 0 HB2 GLU A 93 3.741 -18.534 7.584 1.00 0.00 H new ATOM 0 HB3 GLU A 93 3.921 -20.275 7.667 1.00 0.00 H new ATOM 0 HG2 GLU A 93 5.025 -20.320 5.492 1.00 0.00 H new ATOM 0 HG3 GLU A 93 4.718 -18.611 5.255 1.00 0.00 H new ATOM 1413 N LYS A 94 1.091 -21.277 7.478 1.00 0.00 N ATOM 1414 CA LYS A 94 0.101 -21.761 8.432 1.00 0.00 C ATOM 1415 C LYS A 94 0.656 -21.735 9.853 1.00 0.00 C ATOM 1416 O LYS A 94 1.869 -21.763 10.057 1.00 0.00 O ATOM 1417 CB LYS A 94 -0.335 -23.183 8.070 1.00 0.00 C ATOM 1418 CG LYS A 94 0.792 -24.199 8.133 1.00 0.00 C ATOM 1419 CD LYS A 94 0.260 -25.612 8.301 1.00 0.00 C ATOM 1420 CE LYS A 94 1.280 -26.515 8.979 1.00 0.00 C ATOM 1421 NZ LYS A 94 1.019 -27.954 8.699 1.00 0.00 N ATOM 0 H LYS A 94 1.560 -22.012 6.949 1.00 0.00 H new ATOM 0 HA LYS A 94 -0.764 -21.099 8.386 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -1.131 -23.493 8.747 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -0.755 -23.180 7.064 1.00 0.00 H new ATOM 0 HG2 LYS A 94 1.388 -24.140 7.222 1.00 0.00 H new ATOM 0 HG3 LYS A 94 1.455 -23.958 8.964 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -0.656 -25.589 8.891 1.00 0.00 H new ATOM 0 HD3 LYS A 94 0.001 -26.023 7.325 1.00 0.00 H new ATOM 0 HE2 LYS A 94 2.281 -26.254 8.636 1.00 0.00 H new ATOM 0 HE3 LYS A 94 1.257 -26.344 10.055 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 1.735 -28.536 9.178 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 0.074 -28.210 9.049 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 1.066 -28.122 7.674 1.00 0.00 H new ATOM 1435 N GLY A 95 -0.241 -21.682 10.833 1.00 0.00 N ATOM 1436 CA GLY A 95 0.178 -21.654 12.222 1.00 0.00 C ATOM 1437 C GLY A 95 1.399 -20.782 12.442 1.00 0.00 C ATOM 1438 O GLY A 95 2.435 -21.259 12.905 1.00 0.00 O ATOM 0 H GLY A 95 -1.251 -21.658 10.690 1.00 0.00 H new ATOM 0 HA2 GLY A 95 -0.643 -21.287 12.838 1.00 0.00 H new ATOM 0 HA3 GLY A 95 0.396 -22.669 12.553 1.00 0.00 H new ATOM 1442 N SER A 96 1.277 -19.502 12.107 1.00 0.00 N ATOM 1443 CA SER A 96 2.381 -18.562 12.265 1.00 0.00 C ATOM 1444 C SER A 96 1.873 -17.200 12.727 1.00 0.00 C ATOM 1445 O SER A 96 0.688 -16.893 12.601 1.00 0.00 O ATOM 1446 CB SER A 96 3.146 -18.415 10.948 1.00 0.00 C ATOM 1447 OG SER A 96 4.172 -19.386 10.843 1.00 0.00 O ATOM 0 H SER A 96 0.425 -19.092 11.724 1.00 0.00 H new ATOM 0 HA SER A 96 3.055 -18.956 13.026 1.00 0.00 H new ATOM 0 HB2 SER A 96 2.457 -18.518 10.110 1.00 0.00 H new ATOM 0 HB3 SER A 96 3.578 -17.416 10.884 1.00 0.00 H new ATOM 0 HG SER A 96 4.645 -19.272 9.992 1.00 0.00 H new ATOM 1453 N GLN A 97 2.779 -16.388 13.262 1.00 0.00 N ATOM 1454 CA GLN A 97 2.423 -15.058 13.743 1.00 0.00 C ATOM 1455 C GLN A 97 2.577 -14.019 12.637 1.00 0.00 C ATOM 1456 O GLN A 97 3.505 -14.088 11.832 1.00 0.00 O ATOM 1457 CB GLN A 97 3.293 -14.677 14.942 1.00 0.00 C ATOM 1458 CG GLN A 97 2.634 -13.678 15.879 1.00 0.00 C ATOM 1459 CD GLN A 97 3.091 -13.836 17.316 1.00 0.00 C ATOM 1460 OE1 GLN A 97 4.244 -13.557 17.647 1.00 0.00 O ATOM 1461 NE2 GLN A 97 2.188 -14.285 18.179 1.00 0.00 N ATOM 0 H GLN A 97 3.764 -16.627 13.373 1.00 0.00 H new ATOM 0 HA GLN A 97 1.378 -15.079 14.053 1.00 0.00 H new ATOM 0 HB2 GLN A 97 3.541 -15.579 15.502 1.00 0.00 H new ATOM 0 HB3 GLN A 97 4.232 -14.258 14.580 1.00 0.00 H new ATOM 0 HG2 GLN A 97 2.857 -12.666 15.540 1.00 0.00 H new ATOM 0 HG3 GLN A 97 1.552 -13.799 15.830 1.00 0.00 H new ATOM 0 HE21 GLN A 97 1.244 -14.504 17.861 1.00 0.00 H new ATOM 0 HE22 GLN A 97 2.438 -14.411 19.160 1.00 0.00 H new ATOM 1470 N TYR A 98 1.661 -13.058 12.604 1.00 0.00 N ATOM 1471 CA TYR A 98 1.693 -12.006 11.595 1.00 0.00 C ATOM 1472 C TYR A 98 1.136 -10.700 12.152 1.00 0.00 C ATOM 1473 O TYR A 98 -0.008 -10.641 12.602 1.00 0.00 O ATOM 1474 CB TYR A 98 0.894 -12.429 10.361 1.00 0.00 C ATOM 1475 CG TYR A 98 1.638 -13.385 9.456 1.00 0.00 C ATOM 1476 CD1 TYR A 98 2.740 -12.962 8.722 1.00 0.00 C ATOM 1477 CD2 TYR A 98 1.240 -14.710 9.335 1.00 0.00 C ATOM 1478 CE1 TYR A 98 3.422 -13.831 7.893 1.00 0.00 C ATOM 1479 CE2 TYR A 98 1.918 -15.587 8.510 1.00 0.00 C ATOM 1480 CZ TYR A 98 3.007 -15.143 7.791 1.00 0.00 C ATOM 1481 OH TYR A 98 3.685 -16.012 6.967 1.00 0.00 O ATOM 0 H TYR A 98 0.887 -12.986 13.264 1.00 0.00 H new ATOM 0 HA TYR A 98 2.732 -11.844 11.309 1.00 0.00 H new ATOM 0 HB2 TYR A 98 -0.036 -12.897 10.684 1.00 0.00 H new ATOM 0 HB3 TYR A 98 0.623 -11.540 9.792 1.00 0.00 H new ATOM 0 HD1 TYR A 98 3.069 -11.936 8.801 1.00 0.00 H new ATOM 0 HD2 TYR A 98 0.386 -15.061 9.895 1.00 0.00 H new ATOM 0 HE1 TYR A 98 4.275 -13.486 7.328 1.00 0.00 H new ATOM 0 HE2 TYR A 98 1.596 -16.615 8.429 1.00 0.00 H new ATOM 0 HH TYR A 98 4.627 -15.746 6.915 1.00 0.00 H new ATOM 1491 N SER A 99 1.954 -9.653 12.117 1.00 0.00 N ATOM 1492 CA SER A 99 1.546 -8.347 12.621 1.00 0.00 C ATOM 1493 C SER A 99 1.255 -7.388 11.471 1.00 0.00 C ATOM 1494 O SER A 99 2.010 -7.315 10.501 1.00 0.00 O ATOM 1495 CB SER A 99 2.634 -7.762 13.524 1.00 0.00 C ATOM 1496 OG SER A 99 2.075 -6.914 14.512 1.00 0.00 O ATOM 0 H SER A 99 2.903 -9.684 11.745 1.00 0.00 H new ATOM 0 HA SER A 99 0.633 -8.479 13.202 1.00 0.00 H new ATOM 0 HB2 SER A 99 3.186 -8.570 14.004 1.00 0.00 H new ATOM 0 HB3 SER A 99 3.349 -7.202 12.921 1.00 0.00 H new ATOM 0 HG SER A 99 1.099 -6.912 14.427 1.00 0.00 H new ATOM 1502 N PHE A 100 0.154 -6.652 11.587 1.00 0.00 N ATOM 1503 CA PHE A 100 -0.240 -5.698 10.557 1.00 0.00 C ATOM 1504 C PHE A 100 -0.437 -4.307 11.152 1.00 0.00 C ATOM 1505 O PHE A 100 -0.858 -4.166 12.300 1.00 0.00 O ATOM 1506 CB PHE A 100 -1.527 -6.159 9.869 1.00 0.00 C ATOM 1507 CG PHE A 100 -1.345 -7.378 9.012 1.00 0.00 C ATOM 1508 CD1 PHE A 100 -0.755 -7.280 7.762 1.00 0.00 C ATOM 1509 CD2 PHE A 100 -1.762 -8.622 9.456 1.00 0.00 C ATOM 1510 CE1 PHE A 100 -0.587 -8.401 6.970 1.00 0.00 C ATOM 1511 CE2 PHE A 100 -1.597 -9.747 8.669 1.00 0.00 C ATOM 1512 CZ PHE A 100 -1.007 -9.636 7.425 1.00 0.00 C ATOM 0 H PHE A 100 -0.481 -6.698 12.384 1.00 0.00 H new ATOM 0 HA PHE A 100 0.560 -5.648 9.818 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -2.281 -6.368 10.628 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -1.912 -5.346 9.253 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -0.423 -6.317 7.402 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -2.222 -8.714 10.429 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -0.128 -8.311 5.997 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -1.929 -10.711 9.026 1.00 0.00 H new ATOM 0 HZ PHE A 100 -0.874 -10.513 6.809 1.00 0.00 H new ATOM 1522 N GLN A 101 -0.130 -3.283 10.362 1.00 0.00 N ATOM 1523 CA GLN A 101 -0.273 -1.903 10.811 1.00 0.00 C ATOM 1524 C GLN A 101 -0.840 -1.025 9.700 1.00 0.00 C ATOM 1525 O GLN A 101 -0.493 -1.185 8.530 1.00 0.00 O ATOM 1526 CB GLN A 101 1.077 -1.353 11.273 1.00 0.00 C ATOM 1527 CG GLN A 101 0.964 -0.299 12.363 1.00 0.00 C ATOM 1528 CD GLN A 101 2.311 0.258 12.779 1.00 0.00 C ATOM 1529 OE1 GLN A 101 2.941 1.011 12.035 1.00 0.00 O ATOM 1530 NE2 GLN A 101 2.761 -0.110 13.973 1.00 0.00 N ATOM 0 H GLN A 101 0.219 -3.383 9.409 1.00 0.00 H new ATOM 0 HA GLN A 101 -0.969 -1.890 11.650 1.00 0.00 H new ATOM 0 HB2 GLN A 101 1.690 -2.177 11.638 1.00 0.00 H new ATOM 0 HB3 GLN A 101 1.597 -0.924 10.417 1.00 0.00 H new ATOM 0 HG2 GLN A 101 0.331 0.516 12.011 1.00 0.00 H new ATOM 0 HG3 GLN A 101 0.470 -0.733 13.233 1.00 0.00 H new ATOM 0 HE21 GLN A 101 2.206 -0.736 14.557 1.00 0.00 H new ATOM 0 HE22 GLN A 101 3.662 0.233 14.306 1.00 0.00 H new ATOM 1539 N VAL A 102 -1.715 -0.097 10.074 1.00 0.00 N ATOM 1540 CA VAL A 102 -2.330 0.807 9.110 1.00 0.00 C ATOM 1541 C VAL A 102 -2.083 2.264 9.487 1.00 0.00 C ATOM 1542 O VAL A 102 -2.044 2.612 10.668 1.00 0.00 O ATOM 1543 CB VAL A 102 -3.847 0.566 9.003 1.00 0.00 C ATOM 1544 CG1 VAL A 102 -4.456 1.461 7.934 1.00 0.00 C ATOM 1545 CG2 VAL A 102 -4.134 -0.899 8.709 1.00 0.00 C ATOM 0 H VAL A 102 -2.014 0.048 11.038 1.00 0.00 H new ATOM 0 HA VAL A 102 -1.868 0.601 8.144 1.00 0.00 H new ATOM 0 HB VAL A 102 -4.306 0.818 9.959 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -5.529 1.277 7.873 1.00 0.00 H new ATOM 0 HG12 VAL A 102 -4.282 2.506 8.191 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -3.995 1.243 6.971 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -5.211 -1.051 8.637 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -3.664 -1.180 7.767 1.00 0.00 H new ATOM 0 HG23 VAL A 102 -3.733 -1.517 9.513 1.00 0.00 H new ATOM 1555 N SER A 103 -1.919 3.112 8.477 1.00 0.00 N ATOM 1556 CA SER A 103 -1.672 4.531 8.703 1.00 0.00 C ATOM 1557 C SER A 103 -2.353 5.377 7.631 1.00 0.00 C ATOM 1558 O SER A 103 -2.330 5.038 6.448 1.00 0.00 O ATOM 1559 CB SER A 103 -0.169 4.814 8.713 1.00 0.00 C ATOM 1560 OG SER A 103 0.309 5.081 7.406 1.00 0.00 O ATOM 0 H SER A 103 -1.953 2.841 7.494 1.00 0.00 H new ATOM 0 HA SER A 103 -2.091 4.798 9.673 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.039 5.666 9.361 1.00 0.00 H new ATOM 0 HB3 SER A 103 0.362 3.959 9.130 1.00 0.00 H new ATOM 0 HG SER A 103 1.272 5.260 7.440 1.00 0.00 H new ATOM 1566 N ALA A 104 -2.960 6.481 8.055 1.00 0.00 N ATOM 1567 CA ALA A 104 -3.645 7.378 7.133 1.00 0.00 C ATOM 1568 C ALA A 104 -2.666 8.345 6.476 1.00 0.00 C ATOM 1569 O ALA A 104 -1.834 8.952 7.149 1.00 0.00 O ATOM 1570 CB ALA A 104 -4.740 8.146 7.859 1.00 0.00 C ATOM 0 H ALA A 104 -2.991 6.775 9.031 1.00 0.00 H new ATOM 0 HA ALA A 104 -4.099 6.773 6.348 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -5.243 8.812 7.158 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -5.463 7.444 8.275 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -4.300 8.733 8.665 1.00 0.00 H new ATOM 1576 N MET A 105 -2.770 8.481 5.158 1.00 0.00 N ATOM 1577 CA MET A 105 -1.892 9.375 4.411 1.00 0.00 C ATOM 1578 C MET A 105 -2.662 10.586 3.895 1.00 0.00 C ATOM 1579 O MET A 105 -3.734 10.448 3.304 1.00 0.00 O ATOM 1580 CB MET A 105 -1.246 8.630 3.242 1.00 0.00 C ATOM 1581 CG MET A 105 -0.087 7.738 3.655 1.00 0.00 C ATOM 1582 SD MET A 105 1.130 7.526 2.341 1.00 0.00 S ATOM 1583 CE MET A 105 0.326 6.284 1.332 1.00 0.00 C ATOM 0 H MET A 105 -3.453 7.984 4.586 1.00 0.00 H new ATOM 0 HA MET A 105 -1.110 9.724 5.086 1.00 0.00 H new ATOM 0 HB2 MET A 105 -2.003 8.022 2.747 1.00 0.00 H new ATOM 0 HB3 MET A 105 -0.892 9.356 2.510 1.00 0.00 H new ATOM 0 HG2 MET A 105 0.401 8.165 4.531 1.00 0.00 H new ATOM 0 HG3 MET A 105 -0.472 6.762 3.949 1.00 0.00 H new ATOM 0 HE1 MET A 105 0.550 6.468 0.281 1.00 0.00 H new ATOM 0 HE2 MET A 105 0.690 5.296 1.613 1.00 0.00 H new ATOM 0 HE3 MET A 105 -0.752 6.332 1.487 1.00 0.00 H new ATOM 1593 N THR A 106 -2.110 11.774 4.121 1.00 0.00 N ATOM 1594 CA THR A 106 -2.745 13.009 3.680 1.00 0.00 C ATOM 1595 C THR A 106 -1.890 13.727 2.642 1.00 0.00 C ATOM 1596 O THR A 106 -0.683 13.504 2.555 1.00 0.00 O ATOM 1597 CB THR A 106 -3.003 13.962 4.863 1.00 0.00 C ATOM 1598 OG1 THR A 106 -1.771 14.257 5.532 1.00 0.00 O ATOM 1599 CG2 THR A 106 -3.986 13.348 5.848 1.00 0.00 C ATOM 0 H THR A 106 -1.223 11.907 4.608 1.00 0.00 H new ATOM 0 HA THR A 106 -3.699 12.731 3.232 1.00 0.00 H new ATOM 0 HB THR A 106 -3.433 14.884 4.471 1.00 0.00 H new ATOM 0 HG1 THR A 106 -1.943 14.865 6.281 1.00 0.00 H new ATOM 0 HG21 THR A 106 -4.152 14.039 6.674 1.00 0.00 H new ATOM 0 HG22 THR A 106 -4.932 13.151 5.343 1.00 0.00 H new ATOM 0 HG23 THR A 106 -3.579 12.413 6.233 1.00 0.00 H new ATOM 1607 N VAL A 107 -2.524 14.590 1.855 1.00 0.00 N ATOM 1608 CA VAL A 107 -1.821 15.343 0.823 1.00 0.00 C ATOM 1609 C VAL A 107 -0.452 15.800 1.312 1.00 0.00 C ATOM 1610 O VAL A 107 0.485 15.937 0.528 1.00 0.00 O ATOM 1611 CB VAL A 107 -2.632 16.573 0.374 1.00 0.00 C ATOM 1612 CG1 VAL A 107 -2.831 17.534 1.536 1.00 0.00 C ATOM 1613 CG2 VAL A 107 -1.944 17.268 -0.791 1.00 0.00 C ATOM 0 H VAL A 107 -3.524 14.785 1.912 1.00 0.00 H new ATOM 0 HA VAL A 107 -1.694 14.672 -0.027 1.00 0.00 H new ATOM 0 HB VAL A 107 -3.613 16.237 0.039 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -3.406 18.397 1.200 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -3.370 17.029 2.338 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -1.860 17.866 1.904 1.00 0.00 H new ATOM 0 HG21 VAL A 107 -2.531 18.135 -1.095 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -0.949 17.592 -0.485 1.00 0.00 H new ATOM 0 HG23 VAL A 107 -1.858 16.576 -1.628 1.00 0.00 H new ATOM 1623 N ASN A 108 -0.345 16.036 2.616 1.00 0.00 N ATOM 1624 CA ASN A 108 0.910 16.480 3.212 1.00 0.00 C ATOM 1625 C ASN A 108 1.945 15.358 3.197 1.00 0.00 C ATOM 1626 O ASN A 108 2.884 15.376 2.403 1.00 0.00 O ATOM 1627 CB ASN A 108 0.678 16.956 4.647 1.00 0.00 C ATOM 1628 CG ASN A 108 -0.160 18.219 4.708 1.00 0.00 C ATOM 1629 OD1 ASN A 108 -0.010 19.117 3.881 1.00 0.00 O ATOM 1630 ND2 ASN A 108 -1.048 18.292 5.693 1.00 0.00 N ATOM 0 H ASN A 108 -1.112 15.927 3.280 1.00 0.00 H new ATOM 0 HA ASN A 108 1.291 17.311 2.619 1.00 0.00 H new ATOM 0 HB2 ASN A 108 0.183 16.167 5.213 1.00 0.00 H new ATOM 0 HB3 ASN A 108 1.640 17.138 5.127 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -1.640 19.117 5.786 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -1.138 17.523 6.357 1.00 0.00 H new ATOM 1637 N GLY A 109 1.765 14.383 4.083 1.00 0.00 N ATOM 1638 CA GLY A 109 2.690 13.267 4.156 1.00 0.00 C ATOM 1639 C GLY A 109 2.010 11.976 4.568 1.00 0.00 C ATOM 1640 O GLY A 109 0.985 11.596 4.000 1.00 0.00 O ATOM 0 H GLY A 109 0.995 14.346 4.751 1.00 0.00 H new ATOM 0 HA2 GLY A 109 3.166 13.130 3.185 1.00 0.00 H new ATOM 0 HA3 GLY A 109 3.481 13.501 4.869 1.00 0.00 H new ATOM 1644 N THR A 110 2.581 11.298 5.558 1.00 0.00 N ATOM 1645 CA THR A 110 2.026 10.041 6.044 1.00 0.00 C ATOM 1646 C THR A 110 1.710 10.119 7.533 1.00 0.00 C ATOM 1647 O THR A 110 2.597 10.342 8.355 1.00 0.00 O ATOM 1648 CB THR A 110 2.992 8.867 5.796 1.00 0.00 C ATOM 1649 OG1 THR A 110 3.325 8.792 4.406 1.00 0.00 O ATOM 1650 CG2 THR A 110 2.372 7.553 6.246 1.00 0.00 C ATOM 0 H THR A 110 3.428 11.599 6.039 1.00 0.00 H new ATOM 0 HA THR A 110 1.104 9.867 5.489 1.00 0.00 H new ATOM 0 HB THR A 110 3.898 9.041 6.377 1.00 0.00 H new ATOM 0 HG1 THR A 110 2.579 8.393 3.912 1.00 0.00 H new ATOM 0 HG21 THR A 110 3.072 6.738 6.061 1.00 0.00 H new ATOM 0 HG22 THR A 110 2.146 7.603 7.311 1.00 0.00 H new ATOM 0 HG23 THR A 110 1.452 7.375 5.688 1.00 0.00 H new ATOM 1658 N GLY A 111 0.438 9.932 7.874 1.00 0.00 N ATOM 1659 CA GLY A 111 0.028 9.985 9.265 1.00 0.00 C ATOM 1660 C GLY A 111 0.637 8.870 10.092 1.00 0.00 C ATOM 1661 O GLY A 111 1.166 7.892 9.561 1.00 0.00 O ATOM 0 H GLY A 111 -0.315 9.745 7.212 1.00 0.00 H new ATOM 0 HA2 GLY A 111 0.316 10.947 9.689 1.00 0.00 H new ATOM 0 HA3 GLY A 111 -1.059 9.924 9.323 1.00 0.00 H new ATOM 1665 N PRO A 112 0.569 9.010 11.424 1.00 0.00 N ATOM 1666 CA PRO A 112 1.114 8.016 12.354 1.00 0.00 C ATOM 1667 C PRO A 112 0.313 6.719 12.351 1.00 0.00 C ATOM 1668 O PRO A 112 -0.914 6.719 12.248 1.00 0.00 O ATOM 1669 CB PRO A 112 1.007 8.708 13.715 1.00 0.00 C ATOM 1670 CG PRO A 112 -0.104 9.688 13.555 1.00 0.00 C ATOM 1671 CD PRO A 112 -0.047 10.149 12.125 1.00 0.00 C ATOM 0 HA PRO A 112 2.130 7.723 12.088 1.00 0.00 H new ATOM 0 HB2 PRO A 112 0.792 7.991 14.508 1.00 0.00 H new ATOM 0 HB3 PRO A 112 1.939 9.206 13.980 1.00 0.00 H new ATOM 0 HG2 PRO A 112 -1.066 9.227 13.778 1.00 0.00 H new ATOM 0 HG3 PRO A 112 0.014 10.527 14.241 1.00 0.00 H new ATOM 0 HD2 PRO A 112 -1.040 10.372 11.735 1.00 0.00 H new ATOM 0 HD3 PRO A 112 0.548 11.056 12.019 1.00 0.00 H new ATOM 1679 N PRO A 113 1.020 5.585 12.466 1.00 0.00 N ATOM 1680 CA PRO A 113 0.394 4.259 12.481 1.00 0.00 C ATOM 1681 C PRO A 113 -0.402 4.008 13.757 1.00 0.00 C ATOM 1682 O PRO A 113 -0.543 4.897 14.597 1.00 0.00 O ATOM 1683 CB PRO A 113 1.587 3.304 12.398 1.00 0.00 C ATOM 1684 CG PRO A 113 2.730 4.074 12.964 1.00 0.00 C ATOM 1685 CD PRO A 113 2.485 5.510 12.593 1.00 0.00 C ATOM 0 HA PRO A 113 -0.324 4.138 11.670 1.00 0.00 H new ATOM 0 HB2 PRO A 113 1.404 2.392 12.966 1.00 0.00 H new ATOM 0 HB3 PRO A 113 1.783 3.004 11.369 1.00 0.00 H new ATOM 0 HG2 PRO A 113 2.784 3.954 14.046 1.00 0.00 H new ATOM 0 HG3 PRO A 113 3.678 3.722 12.557 1.00 0.00 H new ATOM 0 HD2 PRO A 113 2.857 6.192 13.358 1.00 0.00 H new ATOM 0 HD3 PRO A 113 2.983 5.775 11.660 1.00 0.00 H new ATOM 1693 N SER A 114 -0.920 2.792 13.896 1.00 0.00 N ATOM 1694 CA SER A 114 -1.705 2.425 15.068 1.00 0.00 C ATOM 1695 C SER A 114 -1.063 1.256 15.808 1.00 0.00 C ATOM 1696 O SER A 114 -0.093 0.665 15.334 1.00 0.00 O ATOM 1697 CB SER A 114 -3.134 2.061 14.658 1.00 0.00 C ATOM 1698 OG SER A 114 -3.184 0.768 14.080 1.00 0.00 O ATOM 0 H SER A 114 -0.810 2.044 13.211 1.00 0.00 H new ATOM 0 HA SER A 114 -1.735 3.284 15.738 1.00 0.00 H new ATOM 0 HB2 SER A 114 -3.787 2.099 15.530 1.00 0.00 H new ATOM 0 HB3 SER A 114 -3.510 2.796 13.946 1.00 0.00 H new ATOM 0 HG SER A 114 -3.527 0.832 13.164 1.00 0.00 H new ATOM 1704 N ASN A 115 -1.611 0.927 16.973 1.00 0.00 N ATOM 1705 CA ASN A 115 -1.092 -0.171 17.780 1.00 0.00 C ATOM 1706 C ASN A 115 -0.729 -1.365 16.904 1.00 0.00 C ATOM 1707 O ASN A 115 -1.482 -1.740 16.005 1.00 0.00 O ATOM 1708 CB ASN A 115 -2.122 -0.590 18.832 1.00 0.00 C ATOM 1709 CG ASN A 115 -2.711 0.597 19.569 1.00 0.00 C ATOM 1710 OD1 ASN A 115 -2.133 1.684 19.580 1.00 0.00 O ATOM 1711 ND2 ASN A 115 -3.866 0.393 20.191 1.00 0.00 N ATOM 0 H ASN A 115 -2.415 1.405 17.380 1.00 0.00 H new ATOM 0 HA ASN A 115 -0.189 0.176 18.283 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -2.924 -1.149 18.349 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -1.652 -1.263 19.549 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -4.310 1.154 20.705 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -4.309 -0.525 20.155 1.00 0.00 H new ATOM 1718 N TRP A 116 0.429 -1.959 17.173 1.00 0.00 N ATOM 1719 CA TRP A 116 0.892 -3.112 16.409 1.00 0.00 C ATOM 1720 C TRP A 116 -0.002 -4.322 16.655 1.00 0.00 C ATOM 1721 O TRP A 116 0.240 -5.108 17.571 1.00 0.00 O ATOM 1722 CB TRP A 116 2.338 -3.446 16.778 1.00 0.00 C ATOM 1723 CG TRP A 116 3.347 -2.633 16.025 1.00 0.00 C ATOM 1724 CD1 TRP A 116 4.037 -1.550 16.488 1.00 0.00 C ATOM 1725 CD2 TRP A 116 3.777 -2.838 14.675 1.00 0.00 C ATOM 1726 NE1 TRP A 116 4.870 -1.068 15.507 1.00 0.00 N ATOM 1727 CE2 TRP A 116 4.730 -1.842 14.386 1.00 0.00 C ATOM 1728 CE3 TRP A 116 3.451 -3.767 13.683 1.00 0.00 C ATOM 1729 CZ2 TRP A 116 5.357 -1.750 13.146 1.00 0.00 C ATOM 1730 CZ3 TRP A 116 4.075 -3.674 12.453 1.00 0.00 C ATOM 1731 CH2 TRP A 116 5.020 -2.672 12.193 1.00 0.00 C ATOM 0 H TRP A 116 1.064 -1.661 17.914 1.00 0.00 H new ATOM 0 HA TRP A 116 0.844 -2.859 15.350 1.00 0.00 H new ATOM 0 HB2 TRP A 116 2.479 -3.287 17.847 1.00 0.00 H new ATOM 0 HB3 TRP A 116 2.519 -4.504 16.587 1.00 0.00 H new ATOM 0 HD1 TRP A 116 3.942 -1.133 17.480 1.00 0.00 H new ATOM 0 HE1 TRP A 116 5.491 -0.264 15.599 1.00 0.00 H new ATOM 0 HE3 TRP A 116 2.725 -4.543 13.874 1.00 0.00 H new ATOM 0 HZ2 TRP A 116 6.084 -0.978 12.944 1.00 0.00 H new ATOM 0 HZ3 TRP A 116 3.830 -4.386 11.679 1.00 0.00 H new ATOM 0 HH2 TRP A 116 5.491 -2.627 11.222 1.00 0.00 H new ATOM 1742 N TYR A 117 -1.034 -4.467 15.831 1.00 0.00 N ATOM 1743 CA TYR A 117 -1.965 -5.581 15.961 1.00 0.00 C ATOM 1744 C TYR A 117 -1.381 -6.853 15.355 1.00 0.00 C ATOM 1745 O TYR A 117 -0.721 -6.814 14.316 1.00 0.00 O ATOM 1746 CB TYR A 117 -3.295 -5.244 15.284 1.00 0.00 C ATOM 1747 CG TYR A 117 -4.070 -4.151 15.983 1.00 0.00 C ATOM 1748 CD1 TYR A 117 -4.958 -4.450 17.010 1.00 0.00 C ATOM 1749 CD2 TYR A 117 -3.917 -2.819 15.617 1.00 0.00 C ATOM 1750 CE1 TYR A 117 -5.669 -3.454 17.652 1.00 0.00 C ATOM 1751 CE2 TYR A 117 -4.623 -1.818 16.254 1.00 0.00 C ATOM 1752 CZ TYR A 117 -5.498 -2.140 17.270 1.00 0.00 C ATOM 1753 OH TYR A 117 -6.204 -1.145 17.906 1.00 0.00 O ATOM 0 H TYR A 117 -1.247 -3.827 15.066 1.00 0.00 H new ATOM 0 HA TYR A 117 -2.139 -5.753 17.023 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -3.103 -4.940 14.255 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -3.910 -6.143 15.241 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -5.095 -5.478 17.311 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -3.234 -2.563 14.821 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -6.355 -3.703 18.448 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -4.491 -0.788 15.958 1.00 0.00 H new ATOM 0 HH TYR A 117 -5.967 -0.277 17.518 1.00 0.00 H new ATOM 1763 N THR A 118 -1.629 -7.982 16.011 1.00 0.00 N ATOM 1764 CA THR A 118 -1.128 -9.267 15.539 1.00 0.00 C ATOM 1765 C THR A 118 -2.257 -10.282 15.406 1.00 0.00 C ATOM 1766 O THR A 118 -3.210 -10.270 16.184 1.00 0.00 O ATOM 1767 CB THR A 118 -0.053 -9.833 16.486 1.00 0.00 C ATOM 1768 OG1 THR A 118 0.878 -8.805 16.841 1.00 0.00 O ATOM 1769 CG2 THR A 118 0.688 -10.990 15.833 1.00 0.00 C ATOM 0 H THR A 118 -2.174 -8.033 16.872 1.00 0.00 H new ATOM 0 HA THR A 118 -0.683 -9.092 14.559 1.00 0.00 H new ATOM 0 HB THR A 118 -0.549 -10.200 17.385 1.00 0.00 H new ATOM 0 HG1 THR A 118 1.164 -8.329 16.033 1.00 0.00 H new ATOM 0 HG21 THR A 118 1.442 -11.373 16.520 1.00 0.00 H new ATOM 0 HG22 THR A 118 -0.018 -11.784 15.590 1.00 0.00 H new ATOM 0 HG23 THR A 118 1.172 -10.643 14.920 1.00 0.00 H new ATOM 1777 N ALA A 119 -2.143 -11.160 14.414 1.00 0.00 N ATOM 1778 CA ALA A 119 -3.154 -12.184 14.181 1.00 0.00 C ATOM 1779 C ALA A 119 -2.510 -13.540 13.914 1.00 0.00 C ATOM 1780 O ALA A 119 -1.589 -13.651 13.105 1.00 0.00 O ATOM 1781 CB ALA A 119 -4.051 -11.785 13.018 1.00 0.00 C ATOM 0 H ALA A 119 -1.361 -11.182 13.759 1.00 0.00 H new ATOM 0 HA ALA A 119 -3.762 -12.271 15.081 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -4.801 -12.559 12.855 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -4.546 -10.842 13.248 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -3.449 -11.668 12.117 1.00 0.00 H new ATOM 1787 N GLU A 120 -3.000 -14.568 14.600 1.00 0.00 N ATOM 1788 CA GLU A 120 -2.470 -15.917 14.436 1.00 0.00 C ATOM 1789 C GLU A 120 -3.296 -16.707 13.426 1.00 0.00 C ATOM 1790 O GLU A 120 -4.526 -16.655 13.434 1.00 0.00 O ATOM 1791 CB GLU A 120 -2.452 -16.648 15.780 1.00 0.00 C ATOM 1792 CG GLU A 120 -1.187 -16.409 16.587 1.00 0.00 C ATOM 1793 CD GLU A 120 -0.035 -17.286 16.138 1.00 0.00 C ATOM 1794 OE1 GLU A 120 -0.093 -17.807 15.005 1.00 0.00 O ATOM 1795 OE2 GLU A 120 0.925 -17.451 16.919 1.00 0.00 O ATOM 0 H GLU A 120 -3.762 -14.493 15.274 1.00 0.00 H new ATOM 0 HA GLU A 120 -1.450 -15.836 14.061 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -3.313 -16.331 16.368 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -2.563 -17.718 15.603 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -0.897 -15.362 16.500 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -1.392 -16.596 17.641 1.00 0.00 H new ATOM 1802 N THR A 121 -2.610 -17.440 12.554 1.00 0.00 N ATOM 1803 CA THR A 121 -3.278 -18.241 11.535 1.00 0.00 C ATOM 1804 C THR A 121 -3.674 -19.607 12.082 1.00 0.00 C ATOM 1805 O THR A 121 -2.999 -20.180 12.937 1.00 0.00 O ATOM 1806 CB THR A 121 -2.382 -18.436 10.298 1.00 0.00 C ATOM 1807 OG1 THR A 121 -1.057 -18.795 10.704 1.00 0.00 O ATOM 1808 CG2 THR A 121 -2.335 -17.168 9.458 1.00 0.00 C ATOM 0 H THR A 121 -1.592 -17.495 12.533 1.00 0.00 H new ATOM 0 HA THR A 121 -4.175 -17.696 11.242 1.00 0.00 H new ATOM 0 HB THR A 121 -2.806 -19.238 9.693 1.00 0.00 H new ATOM 0 HG1 THR A 121 -0.539 -19.073 9.920 1.00 0.00 H new ATOM 0 HG21 THR A 121 -1.696 -17.330 8.590 1.00 0.00 H new ATOM 0 HG22 THR A 121 -3.342 -16.914 9.125 1.00 0.00 H new ATOM 0 HG23 THR A 121 -1.934 -16.350 10.056 1.00 0.00 H new ATOM 1816 N PRO A 122 -4.796 -20.144 11.579 1.00 0.00 N ATOM 1817 CA PRO A 122 -5.306 -21.451 12.002 1.00 0.00 C ATOM 1818 C PRO A 122 -4.425 -22.601 11.526 1.00 0.00 C ATOM 1819 O PRO A 122 -4.325 -22.861 10.327 1.00 0.00 O ATOM 1820 CB PRO A 122 -6.685 -21.525 11.341 1.00 0.00 C ATOM 1821 CG PRO A 122 -6.585 -20.625 10.157 1.00 0.00 C ATOM 1822 CD PRO A 122 -5.650 -19.517 10.557 1.00 0.00 C ATOM 0 HA PRO A 122 -5.332 -21.545 13.088 1.00 0.00 H new ATOM 0 HB2 PRO A 122 -6.928 -22.545 11.044 1.00 0.00 H new ATOM 0 HB3 PRO A 122 -7.469 -21.197 12.023 1.00 0.00 H new ATOM 0 HG2 PRO A 122 -6.204 -21.163 9.289 1.00 0.00 H new ATOM 0 HG3 PRO A 122 -7.563 -20.230 9.883 1.00 0.00 H new ATOM 0 HD2 PRO A 122 -5.066 -19.159 9.710 1.00 0.00 H new ATOM 0 HD3 PRO A 122 -6.191 -18.659 10.956 1.00 0.00 H new ATOM 1830 N GLU A 123 -3.789 -23.284 12.471 1.00 0.00 N ATOM 1831 CA GLU A 123 -2.915 -24.406 12.146 1.00 0.00 C ATOM 1832 C GLU A 123 -3.535 -25.281 11.061 1.00 0.00 C ATOM 1833 O GLU A 123 -2.832 -25.831 10.215 1.00 0.00 O ATOM 1834 CB GLU A 123 -2.637 -25.244 13.396 1.00 0.00 C ATOM 1835 CG GLU A 123 -1.494 -24.711 14.243 1.00 0.00 C ATOM 1836 CD GLU A 123 -1.579 -25.164 15.688 1.00 0.00 C ATOM 1837 OE1 GLU A 123 -2.404 -24.601 16.438 1.00 0.00 O ATOM 1838 OE2 GLU A 123 -0.821 -26.080 16.069 1.00 0.00 O ATOM 0 H GLU A 123 -3.862 -23.081 13.468 1.00 0.00 H new ATOM 0 HA GLU A 123 -1.974 -24.004 11.771 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -3.541 -25.285 14.004 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -2.409 -26.266 13.095 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -0.546 -25.042 13.818 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -1.497 -23.622 14.207 1.00 0.00 H new ATOM 1845 N ASN A 124 -4.858 -25.405 11.093 1.00 0.00 N ATOM 1846 CA ASN A 124 -5.574 -26.215 10.114 1.00 0.00 C ATOM 1847 C ASN A 124 -5.715 -25.468 8.790 1.00 0.00 C ATOM 1848 O ASN A 124 -5.624 -26.065 7.718 1.00 0.00 O ATOM 1849 CB ASN A 124 -6.957 -26.594 10.648 1.00 0.00 C ATOM 1850 CG ASN A 124 -7.621 -25.454 11.394 1.00 0.00 C ATOM 1851 OD1 ASN A 124 -7.340 -25.219 12.570 1.00 0.00 O ATOM 1852 ND2 ASN A 124 -8.509 -24.739 10.713 1.00 0.00 N ATOM 0 H ASN A 124 -5.456 -24.955 11.786 1.00 0.00 H new ATOM 0 HA ASN A 124 -4.998 -27.124 9.940 1.00 0.00 H new ATOM 0 HB2 ASN A 124 -7.593 -26.900 9.817 1.00 0.00 H new ATOM 0 HB3 ASN A 124 -6.864 -27.454 11.312 1.00 0.00 H new ATOM 0 HD21 ASN A 124 -8.989 -23.960 11.163 1.00 0.00 H new ATOM 0 HD22 ASN A 124 -8.711 -24.969 9.740 1.00 0.00 H new TER 1859 ASN A 124