USER MOD reduce.3.24.130724 H: found=0, std=0, add=1125, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1125 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 66 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 106 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 24 TYR OH : rot 27:sc= 0.928 USER MOD Set 2.2: A 76 HIS : no HD1:sc= -0.0239 X(o=0.9,f=0.56) USER MOD Set 3.1: A 10 TYR OH : rot 63:sc= 0.231 USER MOD Set 3.2: A 121 ASN : amide:sc= 0.493 K(o=0.72,f=-3.4!) USER MOD Set 4.1: A 7 TYR OH : rot -18:sc= -0.0128 USER MOD Set 4.2: A 28 LYS NZ :NH3+ 136:sc= 1.12 (180deg=0.752) USER MOD Single : A 1 MET CE :methyl 157:sc= -0.123 (180deg=-0.732) USER MOD Single : A 1 MET N :NH3+ -174:sc= 1.04 (180deg=0.877) USER MOD Single : A 5 THR OG1 : rot 180:sc=0.000585 USER MOD Single : A 11 THR OG1 : rot 141:sc= 0.532 USER MOD Single : A 14 SER OG : rot 93:sc= 0.0837 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= -3.67! K(o=-3.7!,f=-1) USER MOD Single : A 19 GLN : amide:sc= 0.573 K(o=0.57,f=-0.025) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ -159:sc= 1.2 (180deg=0.757) USER MOD Single : A 33 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 34 TYR OH : rot 165:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -0.0643 X(o=-0.064,f=-0.064) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 MET CE :methyl 161:sc= -0.141 (180deg=-0.662) USER MOD Single : A 50 ASN : amide:sc= 1.16 K(o=1.2,f=-0.089) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 LYS NZ :NH3+ 171:sc= -0.0227 (180deg=-0.165) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 GLN : amide:sc= -3.81! K(o=-3.8!,f=-1.2) USER MOD Single : A 71 LYS NZ :NH3+ -146:sc= 0.0277 (180deg=0) USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 86 THR OG1 : rot -85:sc= 1.22 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN : amide:sc= -0.0584 X(o=-0.058,f=-0.53) USER MOD Single : A 96 THR OG1 : rot -160:sc= 0.897 USER MOD Single : A 97 GLN : amide:sc= -0.187 X(o=-0.19,f=-0.55) USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc= 0 X(o=0,f=-0.02) USER MOD Single : A 105 GLN : amide:sc= -0.094 X(o=-0.094,f=-0.012) USER MOD Single : A 110 TYR OH : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 180:sc= -0.0358 USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 LYS NZ :NH3+ 167:sc=-0.00842 (180deg=-0.183) USER MOD Single : A 118 HIS : no HE2:sc= 0.733 K(o=0.73,f=-5.8!) USER MOD Single : A 119 SER OG : rot 180:sc= 0 USER MOD Single : A 124 ASN : amide:sc= 0.395 K(o=0.4,f=-4.3!) USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 129 MET CE :methyl -125:sc= 0 (180deg=-1.9!) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 132 LYS NZ :NH3+ -174:sc= 1.22 (180deg=1.11) USER MOD Single : A 133 SER OG : rot 64:sc= 0.925 USER MOD Single : A 142 HIS : no HD1:sc= -0.0322 X(o=-0.032,f=-0.032) USER MOD Single : A 143 HIS : no HD1:sc= -0.117 X(o=-0.12,f=-0.00018) USER MOD Single : A 144 HIS : no HE2:sc= 1.08 K(o=1.1,f=-4.2!) USER MOD Single : A 145 HIS : no HD1:sc= -0.0125 X(o=-0.012,f=0) USER MOD Single : A 146 HIS : no HD1:sc=-0.000949 X(o=-0.00095,f=0) USER MOD Single : A 147 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -12.275 13.968 2.340 1.00 12.11 N ATOM 2 CA MET A 1 -13.395 13.579 1.448 1.00 13.13 C ATOM 3 C MET A 1 -13.628 14.646 0.383 1.00 34.51 C ATOM 4 O MET A 1 -14.432 14.461 -0.533 1.00 0.35 O ATOM 5 CB MET A 1 -14.674 13.343 2.252 1.00 72.25 C ATOM 6 CG MET A 1 -14.543 12.238 3.287 1.00 71.14 C ATOM 7 SD MET A 1 -16.119 11.795 4.040 1.00 43.54 S ATOM 8 CE MET A 1 -16.979 11.091 2.636 1.00 23.31 C ATOM 0 H1 MET A 1 -12.064 13.187 2.993 1.00 12.11 H new ATOM 0 H2 MET A 1 -11.432 14.178 1.768 1.00 12.11 H new ATOM 0 H3 MET A 1 -12.542 14.812 2.885 1.00 12.11 H new ATOM 0 HA MET A 1 -13.124 12.647 0.953 1.00 13.13 H new ATOM 0 HB2 MET A 1 -14.954 14.269 2.754 1.00 72.25 H new ATOM 0 HB3 MET A 1 -15.484 13.094 1.567 1.00 72.25 H new ATOM 0 HG2 MET A 1 -14.110 11.355 2.816 1.00 71.14 H new ATOM 0 HG3 MET A 1 -13.850 12.556 4.066 1.00 71.14 H new ATOM 0 HE1 MET A 1 -17.763 10.420 2.988 1.00 23.31 H new ATOM 0 HE2 MET A 1 -17.425 11.890 2.044 1.00 23.31 H new ATOM 0 HE3 MET A 1 -16.274 10.533 2.020 1.00 23.31 H new ATOM 20 N ASP A 2 -12.913 15.763 0.506 1.00 61.42 N ATOM 21 CA ASP A 2 -12.883 16.796 -0.527 1.00 4.01 C ATOM 22 C ASP A 2 -11.794 16.448 -1.534 1.00 55.21 C ATOM 23 O ASP A 2 -11.019 17.297 -1.978 1.00 43.34 O ATOM 24 CB ASP A 2 -12.623 18.174 0.102 1.00 52.42 C ATOM 25 CG ASP A 2 -11.376 18.205 0.967 1.00 2.21 C ATOM 26 OD1 ASP A 2 -11.389 17.577 2.052 1.00 44.23 O ATOM 27 OD2 ASP A 2 -10.382 18.855 0.574 1.00 64.14 O ATOM 0 H ASP A 2 -12.340 15.977 1.322 1.00 61.42 H new ATOM 0 HA ASP A 2 -13.846 16.839 -1.035 1.00 4.01 H new ATOM 0 HB2 ASP A 2 -12.528 18.917 -0.690 1.00 52.42 H new ATOM 0 HB3 ASP A 2 -13.484 18.460 0.705 1.00 52.42 H new ATOM 32 N ASP A 3 -11.782 15.182 -1.910 1.00 74.24 N ATOM 33 CA ASP A 3 -10.731 14.598 -2.708 1.00 5.41 C ATOM 34 C ASP A 3 -11.328 13.482 -3.556 1.00 33.01 C ATOM 35 O ASP A 3 -11.946 12.549 -3.037 1.00 11.41 O ATOM 36 CB ASP A 3 -9.608 14.070 -1.799 1.00 4.33 C ATOM 37 CG ASP A 3 -10.118 13.213 -0.651 1.00 33.01 C ATOM 38 OD1 ASP A 3 -10.484 13.778 0.407 1.00 32.43 O ATOM 39 OD2 ASP A 3 -10.161 11.974 -0.791 1.00 14.35 O ATOM 0 H ASP A 3 -12.519 14.522 -1.662 1.00 74.24 H new ATOM 0 HA ASP A 3 -10.294 15.349 -3.366 1.00 5.41 H new ATOM 0 HB2 ASP A 3 -8.910 13.485 -2.398 1.00 4.33 H new ATOM 0 HB3 ASP A 3 -9.051 14.914 -1.393 1.00 4.33 H new ATOM 44 N ARG A 4 -11.184 13.604 -4.861 1.00 42.42 N ATOM 45 CA ARG A 4 -11.846 12.686 -5.787 1.00 30.41 C ATOM 46 C ARG A 4 -10.959 12.284 -6.961 1.00 11.35 C ATOM 47 O ARG A 4 -11.146 11.223 -7.553 1.00 52.40 O ATOM 48 CB ARG A 4 -13.121 13.329 -6.340 1.00 3.24 C ATOM 49 CG ARG A 4 -12.837 14.529 -7.234 1.00 24.44 C ATOM 50 CD ARG A 4 -14.051 14.958 -8.037 1.00 71.33 C ATOM 51 NE ARG A 4 -13.677 15.873 -9.115 1.00 51.43 N ATOM 52 CZ ARG A 4 -14.451 16.154 -10.162 1.00 33.34 C ATOM 53 NH1 ARG A 4 -15.686 15.671 -10.236 1.00 42.42 N ATOM 54 NH2 ARG A 4 -13.994 16.931 -11.134 1.00 4.11 N ATOM 0 H ARG A 4 -10.618 14.325 -5.310 1.00 42.42 H new ATOM 0 HA ARG A 4 -12.077 11.787 -5.216 1.00 30.41 H new ATOM 0 HB2 ARG A 4 -13.682 12.585 -6.906 1.00 3.24 H new ATOM 0 HB3 ARG A 4 -13.754 13.642 -5.510 1.00 3.24 H new ATOM 0 HG2 ARG A 4 -12.499 15.363 -6.620 1.00 24.44 H new ATOM 0 HG3 ARG A 4 -12.023 14.285 -7.916 1.00 24.44 H new ATOM 0 HD2 ARG A 4 -14.542 14.080 -8.456 1.00 71.33 H new ATOM 0 HD3 ARG A 4 -14.772 15.443 -7.379 1.00 71.33 H new ATOM 0 HE ARG A 4 -12.764 16.325 -9.062 1.00 51.43 H new ATOM 0 HH11 ARG A 4 -16.048 15.080 -9.488 1.00 42.42 H new ATOM 0 HH12 ARG A 4 -16.272 15.891 -11.041 1.00 42.42 H new ATOM 0 HH21 ARG A 4 -13.050 17.313 -11.080 1.00 4.11 H new ATOM 0 HH22 ARG A 4 -14.586 17.146 -11.936 1.00 4.11 H new ATOM 68 N THR A 5 -9.999 13.119 -7.285 1.00 63.43 N ATOM 69 CA THR A 5 -9.296 12.999 -8.555 1.00 50.13 C ATOM 70 C THR A 5 -8.205 11.936 -8.543 1.00 33.32 C ATOM 71 O THR A 5 -7.083 12.204 -8.121 1.00 44.13 O ATOM 72 CB THR A 5 -8.682 14.343 -8.979 1.00 70.30 C ATOM 73 OG1 THR A 5 -8.729 15.275 -7.888 1.00 64.31 O ATOM 74 CG2 THR A 5 -9.419 14.916 -10.176 1.00 63.25 C ATOM 0 H THR A 5 -9.683 13.888 -6.694 1.00 63.43 H new ATOM 0 HA THR A 5 -10.052 12.690 -9.277 1.00 50.13 H new ATOM 0 HB THR A 5 -7.643 14.170 -9.259 1.00 70.30 H new ATOM 0 HG1 THR A 5 -8.334 16.127 -8.168 1.00 64.31 H new ATOM 0 HG21 THR A 5 -8.968 15.867 -10.460 1.00 63.25 H new ATOM 0 HG22 THR A 5 -9.353 14.219 -11.012 1.00 63.25 H new ATOM 0 HG23 THR A 5 -10.466 15.073 -9.917 1.00 63.25 H new ATOM 82 N GLU A 6 -8.572 10.736 -9.009 1.00 73.03 N ATOM 83 CA GLU A 6 -7.629 9.647 -9.295 1.00 54.42 C ATOM 84 C GLU A 6 -6.569 9.493 -8.207 1.00 24.24 C ATOM 85 O GLU A 6 -5.498 10.098 -8.271 1.00 30.30 O ATOM 86 CB GLU A 6 -6.985 9.864 -10.665 1.00 52.22 C ATOM 87 CG GLU A 6 -6.261 8.648 -11.213 1.00 15.32 C ATOM 88 CD GLU A 6 -6.053 8.752 -12.706 1.00 21.43 C ATOM 89 OE1 GLU A 6 -5.042 9.339 -13.135 1.00 34.23 O ATOM 90 OE2 GLU A 6 -6.921 8.272 -13.465 1.00 61.31 O ATOM 0 H GLU A 6 -9.543 10.491 -9.200 1.00 73.03 H new ATOM 0 HA GLU A 6 -8.193 8.714 -9.309 1.00 54.42 H new ATOM 0 HB2 GLU A 6 -7.757 10.163 -11.374 1.00 52.22 H new ATOM 0 HB3 GLU A 6 -6.279 10.692 -10.595 1.00 52.22 H new ATOM 0 HG2 GLU A 6 -5.296 8.544 -10.717 1.00 15.32 H new ATOM 0 HG3 GLU A 6 -6.835 7.749 -10.986 1.00 15.32 H new ATOM 97 N TYR A 7 -6.866 8.669 -7.222 1.00 12.25 N ATOM 98 CA TYR A 7 -6.009 8.554 -6.057 1.00 41.21 C ATOM 99 C TYR A 7 -4.720 7.819 -6.409 1.00 4.12 C ATOM 100 O TYR A 7 -4.745 6.729 -6.984 1.00 63.22 O ATOM 101 CB TYR A 7 -6.750 7.833 -4.931 1.00 72.31 C ATOM 102 CG TYR A 7 -8.149 8.363 -4.700 1.00 72.31 C ATOM 103 CD1 TYR A 7 -8.367 9.692 -4.363 1.00 64.52 C ATOM 104 CD2 TYR A 7 -9.252 7.529 -4.814 1.00 11.02 C ATOM 105 CE1 TYR A 7 -9.643 10.173 -4.145 1.00 45.25 C ATOM 106 CE2 TYR A 7 -10.532 8.002 -4.602 1.00 61.30 C ATOM 107 CZ TYR A 7 -10.721 9.325 -4.265 1.00 72.13 C ATOM 108 OH TYR A 7 -11.993 9.801 -4.043 1.00 21.34 O ATOM 0 H TYR A 7 -7.692 8.070 -7.204 1.00 12.25 H new ATOM 0 HA TYR A 7 -5.745 9.555 -5.717 1.00 41.21 H new ATOM 0 HB2 TYR A 7 -6.806 6.770 -5.164 1.00 72.31 H new ATOM 0 HB3 TYR A 7 -6.176 7.927 -4.009 1.00 72.31 H new ATOM 0 HD1 TYR A 7 -7.524 10.361 -4.270 1.00 64.52 H new ATOM 0 HD2 TYR A 7 -9.107 6.491 -5.073 1.00 11.02 H new ATOM 0 HE1 TYR A 7 -9.795 11.209 -3.882 1.00 45.25 H new ATOM 0 HE2 TYR A 7 -11.379 7.340 -4.700 1.00 61.30 H new ATOM 0 HH TYR A 7 -11.945 10.643 -3.544 1.00 21.34 H new ATOM 118 N ASP A 8 -3.596 8.426 -6.072 1.00 15.44 N ATOM 119 CA ASP A 8 -2.300 7.864 -6.409 1.00 45.44 C ATOM 120 C ASP A 8 -1.604 7.384 -5.145 1.00 23.52 C ATOM 121 O ASP A 8 -1.060 8.182 -4.384 1.00 35.03 O ATOM 122 CB ASP A 8 -1.445 8.908 -7.133 1.00 2.40 C ATOM 123 CG ASP A 8 -0.248 8.304 -7.838 1.00 64.25 C ATOM 124 OD1 ASP A 8 -0.446 7.447 -8.720 1.00 64.31 O ATOM 125 OD2 ASP A 8 0.894 8.713 -7.548 1.00 23.44 O ATOM 0 H ASP A 8 -3.555 9.310 -5.564 1.00 15.44 H new ATOM 0 HA ASP A 8 -2.440 7.013 -7.076 1.00 45.44 H new ATOM 0 HB2 ASP A 8 -2.062 9.434 -7.862 1.00 2.40 H new ATOM 0 HB3 ASP A 8 -1.100 9.650 -6.413 1.00 2.40 H new ATOM 130 N VAL A 9 -1.665 6.083 -4.907 1.00 74.23 N ATOM 131 CA VAL A 9 -1.080 5.487 -3.715 1.00 30.54 C ATOM 132 C VAL A 9 0.306 4.934 -4.029 1.00 22.31 C ATOM 133 O VAL A 9 0.451 3.965 -4.778 1.00 54.01 O ATOM 134 CB VAL A 9 -1.975 4.352 -3.166 1.00 63.13 C ATOM 135 CG1 VAL A 9 -1.360 3.713 -1.932 1.00 60.04 C ATOM 136 CG2 VAL A 9 -3.369 4.874 -2.861 1.00 13.43 C ATOM 0 H VAL A 9 -2.118 5.414 -5.530 1.00 74.23 H new ATOM 0 HA VAL A 9 -0.999 6.265 -2.956 1.00 30.54 H new ATOM 0 HB VAL A 9 -2.052 3.584 -3.935 1.00 63.13 H new ATOM 0 HG11 VAL A 9 -2.013 2.919 -1.570 1.00 60.04 H new ATOM 0 HG12 VAL A 9 -0.386 3.295 -2.186 1.00 60.04 H new ATOM 0 HG13 VAL A 9 -1.239 4.467 -1.154 1.00 60.04 H new ATOM 0 HG21 VAL A 9 -3.985 4.062 -2.476 1.00 13.43 H new ATOM 0 HG22 VAL A 9 -3.306 5.667 -2.116 1.00 13.43 H new ATOM 0 HG23 VAL A 9 -3.817 5.268 -3.773 1.00 13.43 H new ATOM 146 N TYR A 10 1.322 5.557 -3.459 1.00 74.01 N ATOM 147 CA TYR A 10 2.697 5.158 -3.705 1.00 21.10 C ATOM 148 C TYR A 10 3.523 5.301 -2.440 1.00 54.45 C ATOM 149 O TYR A 10 3.224 6.132 -1.583 1.00 33.25 O ATOM 150 CB TYR A 10 3.310 6.000 -4.832 1.00 62.54 C ATOM 151 CG TYR A 10 3.289 7.490 -4.560 1.00 61.14 C ATOM 152 CD1 TYR A 10 2.171 8.248 -4.865 1.00 44.33 C ATOM 153 CD2 TYR A 10 4.384 8.136 -3.993 1.00 14.11 C ATOM 154 CE1 TYR A 10 2.134 9.605 -4.616 1.00 34.45 C ATOM 155 CE2 TYR A 10 4.354 9.495 -3.737 1.00 43.32 C ATOM 156 CZ TYR A 10 3.227 10.223 -4.053 1.00 31.24 C ATOM 157 OH TYR A 10 3.186 11.574 -3.798 1.00 1.23 O ATOM 0 H TYR A 10 1.220 6.345 -2.819 1.00 74.01 H new ATOM 0 HA TYR A 10 2.700 4.112 -4.011 1.00 21.10 H new ATOM 0 HB2 TYR A 10 4.341 5.683 -4.991 1.00 62.54 H new ATOM 0 HB3 TYR A 10 2.769 5.801 -5.757 1.00 62.54 H new ATOM 0 HD1 TYR A 10 1.311 7.768 -5.307 1.00 44.33 H new ATOM 0 HD2 TYR A 10 5.270 7.568 -3.749 1.00 14.11 H new ATOM 0 HE1 TYR A 10 1.252 10.178 -4.862 1.00 34.45 H new ATOM 0 HE2 TYR A 10 5.209 9.983 -3.292 1.00 43.32 H new ATOM 0 HH TYR A 10 2.484 11.762 -3.140 1.00 1.23 H new ATOM 167 N THR A 11 4.545 4.478 -2.314 1.00 3.12 N ATOM 168 CA THR A 11 5.461 4.572 -1.197 1.00 71.11 C ATOM 169 C THR A 11 6.866 4.172 -1.637 1.00 55.33 C ATOM 170 O THR A 11 7.258 3.009 -1.551 1.00 30.53 O ATOM 171 CB THR A 11 4.997 3.696 -0.016 1.00 41.44 C ATOM 172 OG1 THR A 11 3.644 4.030 0.335 1.00 0.23 O ATOM 173 CG2 THR A 11 5.899 3.891 1.194 1.00 25.45 C ATOM 0 H THR A 11 4.762 3.733 -2.976 1.00 3.12 H new ATOM 0 HA THR A 11 5.476 5.607 -0.857 1.00 71.11 H new ATOM 0 HB THR A 11 5.051 2.652 -0.323 1.00 41.44 H new ATOM 0 HG1 THR A 11 3.151 3.212 0.554 1.00 0.23 H new ATOM 0 HG21 THR A 11 5.550 3.262 2.013 1.00 25.45 H new ATOM 0 HG22 THR A 11 6.921 3.615 0.934 1.00 25.45 H new ATOM 0 HG23 THR A 11 5.873 4.936 1.503 1.00 25.45 H new ATOM 181 N ASP A 12 7.600 5.142 -2.162 1.00 62.13 N ATOM 182 CA ASP A 12 8.968 4.914 -2.603 1.00 62.42 C ATOM 183 C ASP A 12 9.912 5.740 -1.745 1.00 40.44 C ATOM 184 O ASP A 12 10.058 6.946 -1.947 1.00 72.04 O ATOM 185 CB ASP A 12 9.133 5.285 -4.079 1.00 22.11 C ATOM 186 CG ASP A 12 10.400 4.713 -4.693 1.00 71.03 C ATOM 187 OD1 ASP A 12 11.482 4.845 -4.089 1.00 13.43 O ATOM 188 OD2 ASP A 12 10.311 4.106 -5.780 1.00 30.01 O ATOM 0 H ASP A 12 7.269 6.098 -2.293 1.00 62.13 H new ATOM 0 HA ASP A 12 9.205 3.856 -2.495 1.00 62.42 H new ATOM 0 HB2 ASP A 12 8.269 4.925 -4.638 1.00 22.11 H new ATOM 0 HB3 ASP A 12 9.146 6.371 -4.177 1.00 22.11 H new ATOM 193 N GLY A 13 10.515 5.091 -0.768 1.00 55.41 N ATOM 194 CA GLY A 13 11.381 5.781 0.163 1.00 4.42 C ATOM 195 C GLY A 13 11.326 5.142 1.529 1.00 64.22 C ATOM 196 O GLY A 13 10.411 5.406 2.306 1.00 63.20 O ATOM 0 H GLY A 13 10.421 4.089 -0.600 1.00 55.41 H new ATOM 0 HA2 GLY A 13 12.406 5.766 -0.208 1.00 4.42 H new ATOM 0 HA3 GLY A 13 11.084 6.827 0.235 1.00 4.42 H new ATOM 200 N SER A 14 12.290 4.282 1.809 1.00 34.10 N ATOM 201 CA SER A 14 12.295 3.524 3.048 1.00 72.12 C ATOM 202 C SER A 14 13.690 3.002 3.378 1.00 65.44 C ATOM 203 O SER A 14 13.847 2.088 4.192 1.00 54.52 O ATOM 204 CB SER A 14 11.302 2.366 2.932 1.00 54.21 C ATOM 205 OG SER A 14 11.453 1.684 1.695 1.00 24.43 O ATOM 0 H SER A 14 13.081 4.091 1.194 1.00 34.10 H new ATOM 0 HA SER A 14 11.996 4.184 3.862 1.00 72.12 H new ATOM 0 HB2 SER A 14 11.454 1.669 3.756 1.00 54.21 H new ATOM 0 HB3 SER A 14 10.284 2.746 3.019 1.00 54.21 H new ATOM 0 HG SER A 14 12.065 0.928 1.811 1.00 24.43 H new ATOM 211 N TYR A 15 14.711 3.591 2.758 1.00 61.51 N ATOM 212 CA TYR A 15 16.083 3.186 3.021 1.00 72.23 C ATOM 213 C TYR A 15 17.022 4.386 2.956 1.00 11.15 C ATOM 214 O TYR A 15 16.981 5.181 2.015 1.00 22.11 O ATOM 215 CB TYR A 15 16.535 2.082 2.052 1.00 72.31 C ATOM 216 CG TYR A 15 16.655 2.500 0.600 1.00 74.23 C ATOM 217 CD1 TYR A 15 15.528 2.693 -0.191 1.00 63.25 C ATOM 218 CD2 TYR A 15 17.902 2.681 0.018 1.00 50.50 C ATOM 219 CE1 TYR A 15 15.643 3.058 -1.520 1.00 64.14 C ATOM 220 CE2 TYR A 15 18.024 3.048 -1.308 1.00 30.14 C ATOM 221 CZ TYR A 15 16.894 3.234 -2.072 1.00 4.22 C ATOM 222 OH TYR A 15 17.016 3.596 -3.396 1.00 21.05 O ATOM 0 H TYR A 15 14.612 4.343 2.076 1.00 61.51 H new ATOM 0 HA TYR A 15 16.123 2.776 4.030 1.00 72.23 H new ATOM 0 HB2 TYR A 15 17.502 1.704 2.385 1.00 72.31 H new ATOM 0 HB3 TYR A 15 15.829 1.254 2.117 1.00 72.31 H new ATOM 0 HD1 TYR A 15 14.547 2.556 0.239 1.00 63.25 H new ATOM 0 HD2 TYR A 15 18.792 2.532 0.612 1.00 50.50 H new ATOM 0 HE1 TYR A 15 14.758 3.204 -2.122 1.00 64.14 H new ATOM 0 HE2 TYR A 15 19.002 3.189 -1.744 1.00 30.14 H new ATOM 0 HH TYR A 15 17.965 3.679 -3.626 1.00 21.05 H new ATOM 232 N VAL A 16 17.856 4.518 3.973 1.00 72.44 N ATOM 233 CA VAL A 16 18.800 5.619 4.055 1.00 64.31 C ATOM 234 C VAL A 16 19.998 5.220 4.918 1.00 4.23 C ATOM 235 O VAL A 16 19.832 4.581 5.958 1.00 3.44 O ATOM 236 CB VAL A 16 18.125 6.896 4.616 1.00 73.21 C ATOM 237 CG1 VAL A 16 17.563 6.654 6.008 1.00 44.03 C ATOM 238 CG2 VAL A 16 19.091 8.071 4.619 1.00 50.13 C ATOM 0 H VAL A 16 17.898 3.870 4.760 1.00 72.44 H new ATOM 0 HA VAL A 16 19.150 5.844 3.048 1.00 64.31 H new ATOM 0 HB VAL A 16 17.293 7.146 3.957 1.00 73.21 H new ATOM 0 HG11 VAL A 16 17.096 7.568 6.376 1.00 44.03 H new ATOM 0 HG12 VAL A 16 16.820 5.857 5.967 1.00 44.03 H new ATOM 0 HG13 VAL A 16 18.370 6.363 6.681 1.00 44.03 H new ATOM 0 HG21 VAL A 16 18.590 8.953 5.018 1.00 50.13 H new ATOM 0 HG22 VAL A 16 19.953 7.831 5.241 1.00 50.13 H new ATOM 0 HG23 VAL A 16 19.423 8.272 3.600 1.00 50.13 H new ATOM 248 N ASN A 17 21.200 5.563 4.456 1.00 35.35 N ATOM 249 CA ASN A 17 22.440 5.215 5.157 1.00 44.50 C ATOM 250 C ASN A 17 22.582 3.703 5.317 1.00 55.52 C ATOM 251 O ASN A 17 23.222 3.223 6.255 1.00 43.50 O ATOM 252 CB ASN A 17 22.513 5.899 6.532 1.00 15.24 C ATOM 253 CG ASN A 17 22.847 7.379 6.444 1.00 12.41 C ATOM 254 OD1 ASN A 17 24.017 7.761 6.443 1.00 23.31 O ATOM 255 ND2 ASN A 17 21.826 8.222 6.385 1.00 64.30 N ATOM 0 H ASN A 17 21.344 6.086 3.592 1.00 35.35 H new ATOM 0 HA ASN A 17 23.267 5.576 4.546 1.00 44.50 H new ATOM 0 HB2 ASN A 17 21.558 5.778 7.043 1.00 15.24 H new ATOM 0 HB3 ASN A 17 23.266 5.398 7.141 1.00 15.24 H new ATOM 0 HD21 ASN A 17 21.996 9.227 6.337 1.00 64.30 H new ATOM 0 HD22 ASN A 17 20.870 7.866 6.388 1.00 64.30 H new ATOM 262 N GLY A 18 22.000 2.956 4.387 1.00 34.23 N ATOM 263 CA GLY A 18 22.102 1.511 4.422 1.00 30.55 C ATOM 264 C GLY A 18 21.071 0.882 5.334 1.00 12.15 C ATOM 265 O GLY A 18 20.996 -0.339 5.447 1.00 15.04 O ATOM 0 H GLY A 18 21.458 3.327 3.607 1.00 34.23 H new ATOM 0 HA2 GLY A 18 21.980 1.116 3.413 1.00 30.55 H new ATOM 0 HA3 GLY A 18 23.100 1.228 4.756 1.00 30.55 H new ATOM 269 N GLN A 19 20.284 1.715 5.998 1.00 21.25 N ATOM 270 CA GLN A 19 19.247 1.231 6.890 1.00 72.41 C ATOM 271 C GLN A 19 17.922 1.151 6.146 1.00 50.31 C ATOM 272 O GLN A 19 17.543 2.089 5.447 1.00 51.03 O ATOM 273 CB GLN A 19 19.124 2.143 8.110 1.00 23.52 C ATOM 274 CG GLN A 19 20.390 2.206 8.946 1.00 61.02 C ATOM 275 CD GLN A 19 20.231 3.070 10.180 1.00 65.13 C ATOM 276 OE1 GLN A 19 20.497 4.273 10.150 1.00 64.33 O ATOM 277 NE2 GLN A 19 19.794 2.465 11.272 1.00 21.50 N ATOM 0 H GLN A 19 20.346 2.731 5.934 1.00 21.25 H new ATOM 0 HA GLN A 19 19.516 0.233 7.237 1.00 72.41 H new ATOM 0 HB2 GLN A 19 18.866 3.149 7.778 1.00 23.52 H new ATOM 0 HB3 GLN A 19 18.302 1.793 8.735 1.00 23.52 H new ATOM 0 HG2 GLN A 19 20.673 1.197 9.247 1.00 61.02 H new ATOM 0 HG3 GLN A 19 21.205 2.596 8.336 1.00 61.02 H new ATOM 0 HE21 GLN A 19 19.586 1.467 11.253 1.00 21.50 H new ATOM 0 HE22 GLN A 19 19.665 2.997 12.133 1.00 21.50 H new ATOM 286 N TYR A 20 17.231 0.028 6.292 1.00 13.02 N ATOM 287 CA TYR A 20 16.004 -0.216 5.545 1.00 70.30 C ATOM 288 C TYR A 20 14.885 -0.701 6.465 1.00 63.13 C ATOM 289 O TYR A 20 15.090 -1.583 7.303 1.00 73.33 O ATOM 290 CB TYR A 20 16.279 -1.250 4.444 1.00 22.11 C ATOM 291 CG TYR A 20 15.071 -1.627 3.601 1.00 4.22 C ATOM 292 CD1 TYR A 20 14.674 -0.840 2.527 1.00 60.43 C ATOM 293 CD2 TYR A 20 14.337 -2.780 3.873 1.00 5.15 C ATOM 294 CE1 TYR A 20 13.581 -1.185 1.752 1.00 35.32 C ATOM 295 CE2 TYR A 20 13.247 -3.133 3.100 1.00 42.11 C ATOM 296 CZ TYR A 20 12.873 -2.333 2.041 1.00 24.50 C ATOM 297 OH TYR A 20 11.790 -2.686 1.266 1.00 3.44 O ATOM 0 H TYR A 20 17.499 -0.729 6.921 1.00 13.02 H new ATOM 0 HA TYR A 20 15.676 0.720 5.093 1.00 70.30 H new ATOM 0 HB2 TYR A 20 17.055 -0.860 3.786 1.00 22.11 H new ATOM 0 HB3 TYR A 20 16.677 -2.153 4.906 1.00 22.11 H new ATOM 0 HD1 TYR A 20 15.228 0.057 2.293 1.00 60.43 H new ATOM 0 HD2 TYR A 20 14.625 -3.409 4.702 1.00 5.15 H new ATOM 0 HE1 TYR A 20 13.283 -0.558 0.924 1.00 35.32 H new ATOM 0 HE2 TYR A 20 12.691 -4.031 3.324 1.00 42.11 H new ATOM 0 HH TYR A 20 11.404 -3.521 1.604 1.00 3.44 H new ATOM 307 N ALA A 21 13.707 -0.120 6.294 1.00 51.42 N ATOM 308 CA ALA A 21 12.517 -0.521 7.030 1.00 62.04 C ATOM 309 C ALA A 21 11.295 -0.201 6.187 1.00 12.34 C ATOM 310 O ALA A 21 11.203 0.891 5.628 1.00 72.53 O ATOM 311 CB ALA A 21 12.449 0.196 8.373 1.00 52.14 C ATOM 0 H ALA A 21 13.549 0.645 5.639 1.00 51.42 H new ATOM 0 HA ALA A 21 12.552 -1.592 7.231 1.00 62.04 H new ATOM 0 HB1 ALA A 21 11.552 -0.117 8.908 1.00 52.14 H new ATOM 0 HB2 ALA A 21 13.330 -0.054 8.964 1.00 52.14 H new ATOM 0 HB3 ALA A 21 12.416 1.273 8.209 1.00 52.14 H new ATOM 317 N TRP A 22 10.366 -1.136 6.078 1.00 43.01 N ATOM 318 CA TRP A 22 9.246 -0.953 5.170 1.00 70.22 C ATOM 319 C TRP A 22 8.156 -0.108 5.812 1.00 20.40 C ATOM 320 O TRP A 22 7.912 -0.179 7.020 1.00 44.11 O ATOM 321 CB TRP A 22 8.693 -2.300 4.681 1.00 41.42 C ATOM 322 CG TRP A 22 8.008 -3.122 5.731 1.00 32.34 C ATOM 323 CD1 TRP A 22 8.596 -3.953 6.635 1.00 31.21 C ATOM 324 CD2 TRP A 22 6.598 -3.206 5.963 1.00 3.04 C ATOM 325 NE1 TRP A 22 7.640 -4.553 7.416 1.00 73.32 N ATOM 326 CE2 TRP A 22 6.402 -4.104 7.027 1.00 63.53 C ATOM 327 CE3 TRP A 22 5.483 -2.600 5.378 1.00 65.43 C ATOM 328 CZ2 TRP A 22 5.134 -4.419 7.513 1.00 62.31 C ATOM 329 CZ3 TRP A 22 4.226 -2.911 5.858 1.00 31.24 C ATOM 330 CH2 TRP A 22 4.060 -3.810 6.919 1.00 62.21 C ATOM 0 H TRP A 22 10.363 -2.014 6.597 1.00 43.01 H new ATOM 0 HA TRP A 22 9.613 -0.416 4.296 1.00 70.22 H new ATOM 0 HB2 TRP A 22 7.989 -2.114 3.870 1.00 41.42 H new ATOM 0 HB3 TRP A 22 9.514 -2.883 4.263 1.00 41.42 H new ATOM 0 HD1 TRP A 22 9.660 -4.116 6.725 1.00 31.21 H new ATOM 0 HE1 TRP A 22 7.820 -5.223 8.164 1.00 73.32 H new ATOM 0 HE3 TRP A 22 5.602 -1.900 4.564 1.00 65.43 H new ATOM 0 HZ2 TRP A 22 5.003 -5.117 8.327 1.00 62.31 H new ATOM 0 HZ3 TRP A 22 3.357 -2.454 5.408 1.00 31.24 H new ATOM 0 HH2 TRP A 22 3.064 -4.028 7.276 1.00 62.21 H new ATOM 341 N ALA A 23 7.521 0.703 4.989 1.00 65.14 N ATOM 342 CA ALA A 23 6.472 1.599 5.432 1.00 42.13 C ATOM 343 C ALA A 23 5.448 1.755 4.324 1.00 3.02 C ATOM 344 O ALA A 23 5.692 1.330 3.193 1.00 74.44 O ATOM 345 CB ALA A 23 7.053 2.955 5.816 1.00 21.02 C ATOM 0 H ALA A 23 7.719 0.759 3.990 1.00 65.14 H new ATOM 0 HA ALA A 23 5.989 1.179 6.314 1.00 42.13 H new ATOM 0 HB1 ALA A 23 6.250 3.614 6.146 1.00 21.02 H new ATOM 0 HB2 ALA A 23 7.773 2.827 6.624 1.00 21.02 H new ATOM 0 HB3 ALA A 23 7.552 3.395 4.952 1.00 21.02 H new ATOM 351 N TYR A 24 4.311 2.350 4.644 1.00 21.42 N ATOM 352 CA TYR A 24 3.285 2.610 3.647 1.00 41.24 C ATOM 353 C TYR A 24 2.559 3.909 3.950 1.00 4.40 C ATOM 354 O TYR A 24 2.191 4.179 5.095 1.00 0.13 O ATOM 355 CB TYR A 24 2.280 1.457 3.587 1.00 31.43 C ATOM 356 CG TYR A 24 2.420 0.583 2.357 1.00 55.24 C ATOM 357 CD1 TYR A 24 1.806 0.937 1.163 1.00 0.03 C ATOM 358 CD2 TYR A 24 3.164 -0.592 2.390 1.00 74.53 C ATOM 359 CE1 TYR A 24 1.929 0.149 0.036 1.00 63.31 C ATOM 360 CE2 TYR A 24 3.292 -1.386 1.264 1.00 22.33 C ATOM 361 CZ TYR A 24 2.671 -1.011 0.090 1.00 60.14 C ATOM 362 OH TYR A 24 2.796 -1.795 -1.037 1.00 51.53 O ATOM 0 H TYR A 24 4.075 2.662 5.586 1.00 21.42 H new ATOM 0 HA TYR A 24 3.776 2.698 2.678 1.00 41.24 H new ATOM 0 HB2 TYR A 24 2.399 0.838 4.476 1.00 31.43 H new ATOM 0 HB3 TYR A 24 1.270 1.866 3.617 1.00 31.43 H new ATOM 0 HD1 TYR A 24 1.222 1.844 1.115 1.00 0.03 H new ATOM 0 HD2 TYR A 24 3.649 -0.889 3.308 1.00 74.53 H new ATOM 0 HE1 TYR A 24 1.445 0.441 -0.885 1.00 63.31 H new ATOM 0 HE2 TYR A 24 3.875 -2.294 1.304 1.00 22.33 H new ATOM 0 HH TYR A 24 2.695 -1.237 -1.836 1.00 51.53 H new ATOM 372 N ALA A 25 2.333 4.692 2.910 1.00 75.13 N ATOM 373 CA ALA A 25 1.636 5.955 3.038 1.00 2.20 C ATOM 374 C ALA A 25 0.507 6.024 2.025 1.00 73.14 C ATOM 375 O ALA A 25 0.742 6.062 0.815 1.00 1.13 O ATOM 376 CB ALA A 25 2.600 7.113 2.844 1.00 55.14 C ATOM 0 H ALA A 25 2.627 4.470 1.959 1.00 75.13 H new ATOM 0 HA ALA A 25 1.214 6.028 4.040 1.00 2.20 H new ATOM 0 HB1 ALA A 25 2.061 8.055 2.943 1.00 55.14 H new ATOM 0 HB2 ALA A 25 3.385 7.063 3.598 1.00 55.14 H new ATOM 0 HB3 ALA A 25 3.046 7.053 1.851 1.00 55.14 H new ATOM 382 N PHE A 26 -0.717 6.015 2.519 1.00 32.52 N ATOM 383 CA PHE A 26 -1.881 6.074 1.657 1.00 53.20 C ATOM 384 C PHE A 26 -2.360 7.507 1.510 1.00 50.04 C ATOM 385 O PHE A 26 -3.066 8.040 2.374 1.00 72.13 O ATOM 386 CB PHE A 26 -3.006 5.186 2.197 1.00 75.20 C ATOM 387 CG PHE A 26 -2.807 3.724 1.906 1.00 63.14 C ATOM 388 CD1 PHE A 26 -1.854 2.985 2.591 1.00 60.51 C ATOM 389 CD2 PHE A 26 -3.572 3.090 0.938 1.00 24.54 C ATOM 390 CE1 PHE A 26 -1.669 1.644 2.314 1.00 13.43 C ATOM 391 CE2 PHE A 26 -3.390 1.749 0.659 1.00 43.12 C ATOM 392 CZ PHE A 26 -2.437 1.025 1.346 1.00 71.33 C ATOM 0 H PHE A 26 -0.930 5.967 3.515 1.00 32.52 H new ATOM 0 HA PHE A 26 -1.595 5.700 0.674 1.00 53.20 H new ATOM 0 HB2 PHE A 26 -3.084 5.327 3.275 1.00 75.20 H new ATOM 0 HB3 PHE A 26 -3.953 5.509 1.764 1.00 75.20 H new ATOM 0 HD1 PHE A 26 -1.250 3.463 3.349 1.00 60.51 H new ATOM 0 HD2 PHE A 26 -4.319 3.651 0.396 1.00 24.54 H new ATOM 0 HE1 PHE A 26 -0.924 1.079 2.854 1.00 13.43 H new ATOM 0 HE2 PHE A 26 -3.993 1.268 -0.096 1.00 43.12 H new ATOM 0 HZ PHE A 26 -2.292 -0.023 1.128 1.00 71.33 H new ATOM 402 N VAL A 27 -1.951 8.125 0.415 1.00 42.22 N ATOM 403 CA VAL A 27 -2.359 9.476 0.098 1.00 35.45 C ATOM 404 C VAL A 27 -3.527 9.445 -0.883 1.00 42.22 C ATOM 405 O VAL A 27 -3.409 8.968 -2.010 1.00 22.24 O ATOM 406 CB VAL A 27 -1.179 10.314 -0.463 1.00 32.51 C ATOM 407 CG1 VAL A 27 -0.483 9.599 -1.614 1.00 34.41 C ATOM 408 CG2 VAL A 27 -1.655 11.697 -0.891 1.00 0.02 C ATOM 0 H VAL A 27 -1.329 7.703 -0.275 1.00 42.22 H new ATOM 0 HA VAL A 27 -2.683 9.962 1.018 1.00 35.45 H new ATOM 0 HB VAL A 27 -0.449 10.435 0.337 1.00 32.51 H new ATOM 0 HG11 VAL A 27 0.338 10.215 -1.982 1.00 34.41 H new ATOM 0 HG12 VAL A 27 -0.092 8.643 -1.265 1.00 34.41 H new ATOM 0 HG13 VAL A 27 -1.196 9.426 -2.420 1.00 34.41 H new ATOM 0 HG21 VAL A 27 -0.812 12.267 -1.281 1.00 0.02 H new ATOM 0 HG22 VAL A 27 -2.415 11.597 -1.666 1.00 0.02 H new ATOM 0 HG23 VAL A 27 -2.079 12.218 -0.032 1.00 0.02 H new ATOM 418 N LYS A 28 -4.666 9.922 -0.421 1.00 55.21 N ATOM 419 CA LYS A 28 -5.880 9.918 -1.208 1.00 70.53 C ATOM 420 C LYS A 28 -6.143 11.321 -1.749 1.00 55.43 C ATOM 421 O LYS A 28 -6.606 12.197 -1.020 1.00 42.42 O ATOM 422 CB LYS A 28 -7.034 9.426 -0.319 1.00 60.11 C ATOM 423 CG LYS A 28 -8.378 9.295 -1.013 1.00 72.01 C ATOM 424 CD LYS A 28 -9.372 8.549 -0.133 1.00 10.43 C ATOM 425 CE LYS A 28 -10.744 8.449 -0.781 1.00 3.33 C ATOM 426 NZ LYS A 28 -11.461 9.752 -0.781 1.00 53.33 N ATOM 0 H LYS A 28 -4.774 10.323 0.511 1.00 55.21 H new ATOM 0 HA LYS A 28 -5.787 9.248 -2.063 1.00 70.53 H new ATOM 0 HB2 LYS A 28 -6.762 8.456 0.097 1.00 60.11 H new ATOM 0 HB3 LYS A 28 -7.143 10.113 0.520 1.00 60.11 H new ATOM 0 HG2 LYS A 28 -8.768 10.285 -1.250 1.00 72.01 H new ATOM 0 HG3 LYS A 28 -8.254 8.766 -1.958 1.00 72.01 H new ATOM 0 HD2 LYS A 28 -8.994 7.547 0.072 1.00 10.43 H new ATOM 0 HD3 LYS A 28 -9.461 9.059 0.826 1.00 10.43 H new ATOM 0 HE2 LYS A 28 -10.635 8.096 -1.807 1.00 3.33 H new ATOM 0 HE3 LYS A 28 -11.341 7.707 -0.251 1.00 3.33 H new ATOM 0 HZ1 LYS A 28 -11.902 9.905 -1.710 1.00 53.33 H new ATOM 0 HZ2 LYS A 28 -12.196 9.744 -0.046 1.00 53.33 H new ATOM 0 HZ3 LYS A 28 -10.786 10.519 -0.587 1.00 53.33 H new ATOM 440 N ASP A 29 -5.812 11.512 -3.027 1.00 51.14 N ATOM 441 CA ASP A 29 -5.970 12.797 -3.722 1.00 54.20 C ATOM 442 C ASP A 29 -5.456 13.963 -2.867 1.00 35.34 C ATOM 443 O ASP A 29 -6.140 14.970 -2.676 1.00 73.42 O ATOM 444 CB ASP A 29 -7.432 13.018 -4.128 1.00 4.53 C ATOM 445 CG ASP A 29 -7.601 14.130 -5.150 1.00 34.00 C ATOM 446 OD1 ASP A 29 -6.634 14.434 -5.879 1.00 32.43 O ATOM 447 OD2 ASP A 29 -8.716 14.686 -5.260 1.00 62.33 O ATOM 0 H ASP A 29 -5.423 10.776 -3.616 1.00 51.14 H new ATOM 0 HA ASP A 29 -5.365 12.762 -4.628 1.00 54.20 H new ATOM 0 HB2 ASP A 29 -7.834 12.091 -4.537 1.00 4.53 H new ATOM 0 HB3 ASP A 29 -8.018 13.255 -3.240 1.00 4.53 H new ATOM 452 N GLY A 30 -4.245 13.804 -2.342 1.00 25.42 N ATOM 453 CA GLY A 30 -3.618 14.866 -1.575 1.00 55.45 C ATOM 454 C GLY A 30 -3.772 14.699 -0.072 1.00 4.00 C ATOM 455 O GLY A 30 -3.015 15.290 0.698 1.00 33.54 O ATOM 0 H GLY A 30 -3.685 12.956 -2.434 1.00 25.42 H new ATOM 0 HA2 GLY A 30 -2.557 14.904 -1.822 1.00 55.45 H new ATOM 0 HA3 GLY A 30 -4.049 15.822 -1.873 1.00 55.45 H new ATOM 459 N LYS A 31 -4.740 13.896 0.354 1.00 34.40 N ATOM 460 CA LYS A 31 -4.977 13.688 1.781 1.00 64.32 C ATOM 461 C LYS A 31 -4.248 12.447 2.273 1.00 42.32 C ATOM 462 O LYS A 31 -4.427 11.358 1.734 1.00 2.23 O ATOM 463 CB LYS A 31 -6.466 13.514 2.073 1.00 33.14 C ATOM 464 CG LYS A 31 -7.371 14.484 1.338 1.00 72.43 C ATOM 465 CD LYS A 31 -7.098 15.928 1.719 1.00 25.14 C ATOM 466 CE LYS A 31 -8.061 16.866 1.011 1.00 50.15 C ATOM 467 NZ LYS A 31 -7.837 18.287 1.385 1.00 22.34 N ATOM 0 H LYS A 31 -5.370 13.381 -0.261 1.00 34.40 H new ATOM 0 HA LYS A 31 -4.603 14.571 2.299 1.00 64.32 H new ATOM 0 HB2 LYS A 31 -6.758 12.497 1.812 1.00 33.14 H new ATOM 0 HB3 LYS A 31 -6.628 13.627 3.145 1.00 33.14 H new ATOM 0 HG2 LYS A 31 -7.234 14.362 0.264 1.00 72.43 H new ATOM 0 HG3 LYS A 31 -8.411 14.243 1.556 1.00 72.43 H new ATOM 0 HD2 LYS A 31 -7.194 16.048 2.798 1.00 25.14 H new ATOM 0 HD3 LYS A 31 -6.072 16.189 1.459 1.00 25.14 H new ATOM 0 HE2 LYS A 31 -7.948 16.754 -0.067 1.00 50.15 H new ATOM 0 HE3 LYS A 31 -9.085 16.585 1.255 1.00 50.15 H new ATOM 0 HZ1 LYS A 31 -8.695 18.839 1.183 1.00 22.34 H new ATOM 0 HZ2 LYS A 31 -7.617 18.348 2.400 1.00 22.34 H new ATOM 0 HZ3 LYS A 31 -7.042 18.670 0.834 1.00 22.34 H new ATOM 481 N VAL A 32 -3.452 12.595 3.309 1.00 21.04 N ATOM 482 CA VAL A 32 -2.758 11.453 3.887 1.00 3.35 C ATOM 483 C VAL A 32 -3.655 10.793 4.929 1.00 41.54 C ATOM 484 O VAL A 32 -3.750 11.253 6.066 1.00 74.41 O ATOM 485 CB VAL A 32 -1.412 11.852 4.531 1.00 42.22 C ATOM 486 CG1 VAL A 32 -0.697 10.633 5.097 1.00 15.20 C ATOM 487 CG2 VAL A 32 -0.529 12.569 3.519 1.00 53.25 C ATOM 0 H VAL A 32 -3.266 13.486 3.770 1.00 21.04 H new ATOM 0 HA VAL A 32 -2.536 10.754 3.081 1.00 3.35 H new ATOM 0 HB VAL A 32 -1.619 12.535 5.355 1.00 42.22 H new ATOM 0 HG11 VAL A 32 0.248 10.941 5.545 1.00 15.20 H new ATOM 0 HG12 VAL A 32 -1.323 10.164 5.856 1.00 15.20 H new ATOM 0 HG13 VAL A 32 -0.504 9.920 4.296 1.00 15.20 H new ATOM 0 HG21 VAL A 32 0.415 12.843 3.990 1.00 53.25 H new ATOM 0 HG22 VAL A 32 -0.335 11.909 2.673 1.00 53.25 H new ATOM 0 HG23 VAL A 32 -1.034 13.469 3.168 1.00 53.25 H new ATOM 497 N HIS A 33 -4.332 9.727 4.529 1.00 63.04 N ATOM 498 CA HIS A 33 -5.299 9.077 5.404 1.00 54.41 C ATOM 499 C HIS A 33 -4.611 8.070 6.311 1.00 4.40 C ATOM 500 O HIS A 33 -5.056 7.830 7.432 1.00 62.14 O ATOM 501 CB HIS A 33 -6.397 8.395 4.582 1.00 73.13 C ATOM 502 CG HIS A 33 -7.611 8.011 5.382 1.00 34.21 C ATOM 503 ND1 HIS A 33 -8.134 6.733 5.400 1.00 30.13 N ATOM 504 CD2 HIS A 33 -8.428 8.757 6.168 1.00 45.21 C ATOM 505 CE1 HIS A 33 -9.216 6.713 6.161 1.00 3.43 C ATOM 506 NE2 HIS A 33 -9.412 7.925 6.637 1.00 4.42 N ATOM 0 H HIS A 33 -4.232 9.295 3.610 1.00 63.04 H new ATOM 0 HA HIS A 33 -5.761 9.842 6.029 1.00 54.41 H new ATOM 0 HB2 HIS A 33 -6.702 9.063 3.777 1.00 73.13 H new ATOM 0 HB3 HIS A 33 -5.984 7.501 4.115 1.00 73.13 H new ATOM 0 HD2 HIS A 33 -8.323 9.810 6.384 1.00 45.21 H new ATOM 0 HE1 HIS A 33 -9.834 5.849 6.358 1.00 3.43 H new ATOM 0 HE2 HIS A 33 -10.174 8.201 7.256 1.00 4.42 H new ATOM 515 N TYR A 34 -3.526 7.477 5.825 1.00 23.53 N ATOM 516 CA TYR A 34 -2.764 6.527 6.620 1.00 41.44 C ATOM 517 C TYR A 34 -1.277 6.629 6.338 1.00 3.22 C ATOM 518 O TYR A 34 -0.859 6.826 5.197 1.00 43.34 O ATOM 519 CB TYR A 34 -3.247 5.094 6.385 1.00 72.21 C ATOM 520 CG TYR A 34 -4.375 4.695 7.306 1.00 4.41 C ATOM 521 CD1 TYR A 34 -4.158 4.590 8.674 1.00 25.51 C ATOM 522 CD2 TYR A 34 -5.652 4.441 6.822 1.00 33.54 C ATOM 523 CE1 TYR A 34 -5.178 4.244 9.535 1.00 43.13 C ATOM 524 CE2 TYR A 34 -6.681 4.098 7.678 1.00 41.35 C ATOM 525 CZ TYR A 34 -6.436 3.998 9.035 1.00 35.23 C ATOM 526 OH TYR A 34 -7.457 3.666 9.898 1.00 54.32 O ATOM 0 H TYR A 34 -3.157 7.638 4.888 1.00 23.53 H new ATOM 0 HA TYR A 34 -2.930 6.782 7.667 1.00 41.44 H new ATOM 0 HB2 TYR A 34 -3.576 4.992 5.351 1.00 72.21 H new ATOM 0 HB3 TYR A 34 -2.412 4.407 6.523 1.00 72.21 H new ATOM 0 HD1 TYR A 34 -3.172 4.783 9.071 1.00 25.51 H new ATOM 0 HD2 TYR A 34 -5.843 4.513 5.761 1.00 33.54 H new ATOM 0 HE1 TYR A 34 -4.990 4.167 10.596 1.00 43.13 H new ATOM 0 HE2 TYR A 34 -7.671 3.909 7.289 1.00 41.35 H new ATOM 0 HH TYR A 34 -8.317 3.758 9.438 1.00 54.32 H new ATOM 536 N GLU A 35 -0.502 6.497 7.400 1.00 3.13 N ATOM 537 CA GLU A 35 0.948 6.550 7.345 1.00 30.14 C ATOM 538 C GLU A 35 1.497 5.724 8.499 1.00 50.42 C ATOM 539 O GLU A 35 1.191 5.998 9.664 1.00 42.43 O ATOM 540 CB GLU A 35 1.429 8.006 7.438 1.00 15.42 C ATOM 541 CG GLU A 35 2.915 8.164 7.731 1.00 43.34 C ATOM 542 CD GLU A 35 3.801 7.565 6.659 1.00 51.53 C ATOM 543 OE1 GLU A 35 4.111 8.274 5.685 1.00 54.21 O ATOM 544 OE2 GLU A 35 4.198 6.390 6.806 1.00 44.15 O ATOM 0 H GLU A 35 -0.869 6.348 8.340 1.00 3.13 H new ATOM 0 HA GLU A 35 1.306 6.143 6.399 1.00 30.14 H new ATOM 0 HB2 GLU A 35 1.201 8.511 6.499 1.00 15.42 H new ATOM 0 HB3 GLU A 35 0.862 8.513 8.219 1.00 15.42 H new ATOM 0 HG2 GLU A 35 3.148 9.224 7.835 1.00 43.34 H new ATOM 0 HG3 GLU A 35 3.143 7.692 8.687 1.00 43.34 H new ATOM 551 N ASP A 36 2.278 4.706 8.184 1.00 63.54 N ATOM 552 CA ASP A 36 2.775 3.794 9.206 1.00 40.42 C ATOM 553 C ASP A 36 3.990 3.027 8.697 1.00 33.01 C ATOM 554 O ASP A 36 4.254 2.990 7.496 1.00 12.34 O ATOM 555 CB ASP A 36 1.677 2.813 9.620 1.00 2.34 C ATOM 556 CG ASP A 36 1.729 2.469 11.096 1.00 40.12 C ATOM 557 OD1 ASP A 36 2.814 2.110 11.592 1.00 12.52 O ATOM 558 OD2 ASP A 36 0.683 2.586 11.770 1.00 12.51 O ATOM 0 H ASP A 36 2.582 4.488 7.235 1.00 63.54 H new ATOM 0 HA ASP A 36 3.072 4.383 10.074 1.00 40.42 H new ATOM 0 HB2 ASP A 36 0.703 3.243 9.385 1.00 2.34 H new ATOM 0 HB3 ASP A 36 1.772 1.899 9.034 1.00 2.34 H new ATOM 563 N ALA A 37 4.704 2.391 9.614 1.00 65.20 N ATOM 564 CA ALA A 37 5.940 1.695 9.288 1.00 42.24 C ATOM 565 C ALA A 37 6.139 0.513 10.223 1.00 22.53 C ATOM 566 O ALA A 37 5.609 0.501 11.336 1.00 24.42 O ATOM 567 CB ALA A 37 7.121 2.650 9.389 1.00 34.33 C ATOM 0 H ALA A 37 4.445 2.343 10.599 1.00 65.20 H new ATOM 0 HA ALA A 37 5.875 1.324 8.265 1.00 42.24 H new ATOM 0 HB1 ALA A 37 8.041 2.119 9.143 1.00 34.33 H new ATOM 0 HB2 ALA A 37 6.982 3.476 8.692 1.00 34.33 H new ATOM 0 HB3 ALA A 37 7.188 3.040 10.405 1.00 34.33 H new ATOM 573 N ASP A 38 6.896 -0.479 9.777 1.00 20.11 N ATOM 574 CA ASP A 38 7.158 -1.655 10.593 1.00 44.05 C ATOM 575 C ASP A 38 8.536 -2.212 10.274 1.00 3.13 C ATOM 576 O ASP A 38 9.158 -1.828 9.282 1.00 20.25 O ATOM 577 CB ASP A 38 6.095 -2.725 10.339 1.00 74.03 C ATOM 578 CG ASP A 38 5.782 -3.559 11.570 1.00 3.31 C ATOM 579 OD1 ASP A 38 6.706 -3.858 12.359 1.00 71.11 O ATOM 580 OD2 ASP A 38 4.593 -3.893 11.768 1.00 53.45 O ATOM 0 H ASP A 38 7.338 -0.493 8.858 1.00 20.11 H new ATOM 0 HA ASP A 38 7.123 -1.366 11.643 1.00 44.05 H new ATOM 0 HB2 ASP A 38 5.181 -2.245 9.991 1.00 74.03 H new ATOM 0 HB3 ASP A 38 6.434 -3.383 9.539 1.00 74.03 H new ATOM 585 N VAL A 39 9.009 -3.112 11.112 1.00 70.23 N ATOM 586 CA VAL A 39 10.290 -3.743 10.904 1.00 33.23 C ATOM 587 C VAL A 39 10.098 -5.196 10.498 1.00 4.45 C ATOM 588 O VAL A 39 9.056 -5.792 10.773 1.00 24.04 O ATOM 589 CB VAL A 39 11.164 -3.669 12.169 1.00 74.40 C ATOM 590 CG1 VAL A 39 11.566 -2.232 12.461 1.00 3.03 C ATOM 591 CG2 VAL A 39 10.444 -4.280 13.362 1.00 72.42 C ATOM 0 H VAL A 39 8.518 -3.423 11.950 1.00 70.23 H new ATOM 0 HA VAL A 39 10.800 -3.205 10.105 1.00 33.23 H new ATOM 0 HB VAL A 39 12.070 -4.247 11.989 1.00 74.40 H new ATOM 0 HG11 VAL A 39 12.183 -2.202 13.359 1.00 3.03 H new ATOM 0 HG12 VAL A 39 12.132 -1.834 11.619 1.00 3.03 H new ATOM 0 HG13 VAL A 39 10.672 -1.628 12.615 1.00 3.03 H new ATOM 0 HG21 VAL A 39 11.082 -4.216 14.244 1.00 72.42 H new ATOM 0 HG22 VAL A 39 9.517 -3.737 13.545 1.00 72.42 H new ATOM 0 HG23 VAL A 39 10.217 -5.326 13.154 1.00 72.42 H new ATOM 601 N GLY A 40 11.089 -5.758 9.831 1.00 42.40 N ATOM 602 CA GLY A 40 11.004 -7.141 9.417 1.00 10.32 C ATOM 603 C GLY A 40 10.312 -7.290 8.083 1.00 11.45 C ATOM 604 O GLY A 40 9.205 -7.822 7.996 1.00 65.40 O ATOM 0 H GLY A 40 11.952 -5.282 9.568 1.00 42.40 H new ATOM 0 HA2 GLY A 40 12.007 -7.563 9.354 1.00 10.32 H new ATOM 0 HA3 GLY A 40 10.464 -7.713 10.172 1.00 10.32 H new ATOM 608 N LYS A 41 10.960 -6.805 7.037 1.00 23.34 N ATOM 609 CA LYS A 41 10.413 -6.914 5.699 1.00 1.24 C ATOM 610 C LYS A 41 10.775 -8.273 5.110 1.00 62.24 C ATOM 611 O LYS A 41 11.827 -8.438 4.492 1.00 3.53 O ATOM 612 CB LYS A 41 10.915 -5.760 4.816 1.00 62.42 C ATOM 613 CG LYS A 41 10.230 -5.664 3.457 1.00 31.13 C ATOM 614 CD LYS A 41 10.956 -6.476 2.395 1.00 43.52 C ATOM 615 CE LYS A 41 10.256 -6.408 1.047 1.00 42.30 C ATOM 616 NZ LYS A 41 10.961 -7.218 0.019 1.00 51.53 N ATOM 0 H LYS A 41 11.863 -6.334 7.090 1.00 23.34 H new ATOM 0 HA LYS A 41 9.326 -6.838 5.742 1.00 1.24 H new ATOM 0 HB2 LYS A 41 10.770 -4.821 5.350 1.00 62.42 H new ATOM 0 HB3 LYS A 41 11.988 -5.877 4.661 1.00 62.42 H new ATOM 0 HG2 LYS A 41 9.202 -6.016 3.543 1.00 31.13 H new ATOM 0 HG3 LYS A 41 10.184 -4.620 3.147 1.00 31.13 H new ATOM 0 HD2 LYS A 41 11.977 -6.108 2.292 1.00 43.52 H new ATOM 0 HD3 LYS A 41 11.023 -7.515 2.716 1.00 43.52 H new ATOM 0 HE2 LYS A 41 9.231 -6.764 1.151 1.00 42.30 H new ATOM 0 HE3 LYS A 41 10.201 -5.370 0.718 1.00 42.30 H new ATOM 0 HZ1 LYS A 41 10.454 -7.147 -0.886 1.00 51.53 H new ATOM 0 HZ2 LYS A 41 11.931 -6.862 -0.098 1.00 51.53 H new ATOM 0 HZ3 LYS A 41 10.991 -8.213 0.322 1.00 51.53 H new ATOM 630 N ASN A 42 9.919 -9.253 5.361 1.00 12.35 N ATOM 631 CA ASN A 42 10.116 -10.601 4.847 1.00 12.34 C ATOM 632 C ASN A 42 8.774 -11.196 4.440 1.00 1.12 C ATOM 633 O ASN A 42 7.736 -10.815 4.986 1.00 33.14 O ATOM 634 CB ASN A 42 10.769 -11.507 5.904 1.00 32.54 C ATOM 635 CG ASN A 42 12.114 -10.995 6.387 1.00 31.12 C ATOM 636 OD1 ASN A 42 13.144 -11.220 5.749 1.00 2.23 O ATOM 637 ND2 ASN A 42 12.117 -10.329 7.534 1.00 71.52 N ATOM 0 H ASN A 42 9.075 -9.138 5.922 1.00 12.35 H new ATOM 0 HA ASN A 42 10.777 -10.541 3.983 1.00 12.34 H new ATOM 0 HB2 ASN A 42 10.097 -11.601 6.757 1.00 32.54 H new ATOM 0 HB3 ASN A 42 10.897 -12.506 5.487 1.00 32.54 H new ATOM 0 HD21 ASN A 42 12.995 -9.981 7.920 1.00 71.52 H new ATOM 0 HD22 ASN A 42 11.241 -10.164 8.030 1.00 71.52 H new ATOM 644 N PRO A 43 8.767 -12.126 3.470 1.00 33.13 N ATOM 645 CA PRO A 43 7.547 -12.831 3.057 1.00 52.42 C ATOM 646 C PRO A 43 6.960 -13.676 4.187 1.00 13.44 C ATOM 647 O PRO A 43 5.763 -13.961 4.205 1.00 42.44 O ATOM 648 CB PRO A 43 8.008 -13.724 1.897 1.00 23.45 C ATOM 649 CG PRO A 43 9.486 -13.829 2.044 1.00 53.22 C ATOM 650 CD PRO A 43 9.936 -12.545 2.678 1.00 71.34 C ATOM 0 HA PRO A 43 6.755 -12.137 2.776 1.00 52.42 H new ATOM 0 HB2 PRO A 43 7.537 -14.706 1.946 1.00 23.45 H new ATOM 0 HB3 PRO A 43 7.739 -13.289 0.935 1.00 23.45 H new ATOM 0 HG2 PRO A 43 9.756 -14.684 2.663 1.00 53.22 H new ATOM 0 HG3 PRO A 43 9.964 -13.973 1.075 1.00 53.22 H new ATOM 0 HD2 PRO A 43 10.814 -12.694 3.306 1.00 71.34 H new ATOM 0 HD3 PRO A 43 10.202 -11.799 1.929 1.00 71.34 H new ATOM 658 N ALA A 44 7.807 -14.066 5.134 1.00 34.32 N ATOM 659 CA ALA A 44 7.368 -14.828 6.298 1.00 1.55 C ATOM 660 C ALA A 44 6.438 -14.000 7.177 1.00 52.23 C ATOM 661 O ALA A 44 5.586 -14.542 7.877 1.00 4.35 O ATOM 662 CB ALA A 44 8.568 -15.294 7.106 1.00 22.32 C ATOM 0 H ALA A 44 8.807 -13.866 5.118 1.00 34.32 H new ATOM 0 HA ALA A 44 6.817 -15.699 5.942 1.00 1.55 H new ATOM 0 HB1 ALA A 44 8.226 -15.861 7.972 1.00 22.32 H new ATOM 0 HB2 ALA A 44 9.201 -15.927 6.485 1.00 22.32 H new ATOM 0 HB3 ALA A 44 9.139 -14.428 7.442 1.00 22.32 H new ATOM 668 N ALA A 45 6.597 -12.686 7.117 1.00 64.21 N ATOM 669 CA ALA A 45 5.820 -11.774 7.944 1.00 3.11 C ATOM 670 C ALA A 45 4.549 -11.322 7.233 1.00 13.01 C ATOM 671 O ALA A 45 3.842 -10.449 7.725 1.00 12.45 O ATOM 672 CB ALA A 45 6.663 -10.569 8.333 1.00 74.43 C ATOM 0 H ALA A 45 7.263 -12.224 6.498 1.00 64.21 H new ATOM 0 HA ALA A 45 5.525 -12.310 8.846 1.00 3.11 H new ATOM 0 HB1 ALA A 45 6.070 -9.895 8.951 1.00 74.43 H new ATOM 0 HB2 ALA A 45 7.537 -10.902 8.894 1.00 74.43 H new ATOM 0 HB3 ALA A 45 6.987 -10.046 7.433 1.00 74.43 H new ATOM 678 N ALA A 46 4.273 -11.924 6.078 1.00 75.44 N ATOM 679 CA ALA A 46 3.154 -11.520 5.219 1.00 41.34 C ATOM 680 C ALA A 46 1.835 -11.348 5.977 1.00 23.11 C ATOM 681 O ALA A 46 1.101 -10.387 5.739 1.00 41.21 O ATOM 682 CB ALA A 46 2.974 -12.524 4.091 1.00 24.41 C ATOM 0 H ALA A 46 4.816 -12.705 5.709 1.00 75.44 H new ATOM 0 HA ALA A 46 3.413 -10.541 4.816 1.00 41.34 H new ATOM 0 HB1 ALA A 46 2.141 -12.216 3.459 1.00 24.41 H new ATOM 0 HB2 ALA A 46 3.885 -12.568 3.495 1.00 24.41 H new ATOM 0 HB3 ALA A 46 2.766 -13.509 4.510 1.00 24.41 H new ATOM 688 N THR A 47 1.527 -12.272 6.877 1.00 43.50 N ATOM 689 CA THR A 47 0.271 -12.217 7.609 1.00 64.10 C ATOM 690 C THR A 47 0.447 -11.487 8.949 1.00 2.40 C ATOM 691 O THR A 47 -0.481 -10.846 9.448 1.00 72.23 O ATOM 692 CB THR A 47 -0.287 -13.636 7.845 1.00 24.25 C ATOM 693 OG1 THR A 47 -0.225 -14.397 6.625 1.00 52.34 O ATOM 694 CG2 THR A 47 -1.729 -13.583 8.325 1.00 24.22 C ATOM 0 H THR A 47 2.125 -13.063 7.116 1.00 43.50 H new ATOM 0 HA THR A 47 -0.443 -11.658 7.004 1.00 64.10 H new ATOM 0 HB THR A 47 0.322 -14.113 8.613 1.00 24.25 H new ATOM 0 HG1 THR A 47 -0.579 -15.297 6.783 1.00 52.34 H new ATOM 0 HG21 THR A 47 -2.097 -14.597 8.483 1.00 24.22 H new ATOM 0 HG22 THR A 47 -1.781 -13.028 9.262 1.00 24.22 H new ATOM 0 HG23 THR A 47 -2.344 -13.087 7.575 1.00 24.22 H new ATOM 702 N MET A 48 1.650 -11.557 9.511 1.00 61.30 N ATOM 703 CA MET A 48 1.928 -10.937 10.805 1.00 53.35 C ATOM 704 C MET A 48 2.545 -9.543 10.637 1.00 55.34 C ATOM 705 O MET A 48 3.707 -9.306 10.979 1.00 73.23 O ATOM 706 CB MET A 48 2.832 -11.841 11.662 1.00 65.40 C ATOM 707 CG MET A 48 4.104 -12.294 10.958 1.00 30.31 C ATOM 708 SD MET A 48 5.166 -13.309 12.006 1.00 21.11 S ATOM 709 CE MET A 48 4.075 -14.684 12.366 1.00 61.52 C ATOM 0 H MET A 48 2.448 -12.036 9.093 1.00 61.30 H new ATOM 0 HA MET A 48 0.978 -10.815 11.326 1.00 53.35 H new ATOM 0 HB2 MET A 48 3.104 -11.307 12.572 1.00 65.40 H new ATOM 0 HB3 MET A 48 2.265 -12.721 11.966 1.00 65.40 H new ATOM 0 HG2 MET A 48 3.837 -12.859 10.065 1.00 30.31 H new ATOM 0 HG3 MET A 48 4.661 -11.418 10.626 1.00 30.31 H new ATOM 0 HE1 MET A 48 4.664 -15.536 12.705 1.00 61.52 H new ATOM 0 HE2 MET A 48 3.371 -14.395 13.146 1.00 61.52 H new ATOM 0 HE3 MET A 48 3.526 -14.958 11.465 1.00 61.52 H new ATOM 719 N ARG A 49 1.753 -8.629 10.096 1.00 25.11 N ATOM 720 CA ARG A 49 2.167 -7.240 9.943 1.00 1.12 C ATOM 721 C ARG A 49 1.286 -6.340 10.803 1.00 75.52 C ATOM 722 O ARG A 49 0.063 -6.383 10.696 1.00 10.11 O ATOM 723 CB ARG A 49 2.073 -6.811 8.475 1.00 73.34 C ATOM 724 CG ARG A 49 3.060 -7.521 7.560 1.00 60.45 C ATOM 725 CD ARG A 49 2.821 -7.175 6.100 1.00 44.05 C ATOM 726 NE ARG A 49 3.785 -7.830 5.214 1.00 43.32 N ATOM 727 CZ ARG A 49 3.477 -8.326 4.012 1.00 31.02 C ATOM 728 NH1 ARG A 49 2.227 -8.271 3.566 1.00 60.32 N ATOM 729 NH2 ARG A 49 4.418 -8.885 3.258 1.00 30.13 N ATOM 0 H ARG A 49 0.813 -8.826 9.753 1.00 25.11 H new ATOM 0 HA ARG A 49 3.203 -7.147 10.268 1.00 1.12 H new ATOM 0 HB2 ARG A 49 1.061 -6.998 8.116 1.00 73.34 H new ATOM 0 HB3 ARG A 49 2.241 -5.736 8.410 1.00 73.34 H new ATOM 0 HG2 ARG A 49 4.077 -7.245 7.838 1.00 60.45 H new ATOM 0 HG3 ARG A 49 2.973 -8.599 7.698 1.00 60.45 H new ATOM 0 HD2 ARG A 49 1.811 -7.472 5.818 1.00 44.05 H new ATOM 0 HD3 ARG A 49 2.884 -6.095 5.969 1.00 44.05 H new ATOM 0 HE ARG A 49 4.750 -7.913 5.534 1.00 43.32 H new ATOM 0 HH11 ARG A 49 1.498 -7.849 4.142 1.00 60.32 H new ATOM 0 HH12 ARG A 49 1.996 -8.651 2.648 1.00 60.32 H new ATOM 0 HH21 ARG A 49 5.379 -8.936 3.596 1.00 30.13 H new ATOM 0 HH22 ARG A 49 4.179 -9.263 2.341 1.00 30.13 H new ATOM 743 N ASN A 50 1.907 -5.522 11.649 1.00 71.32 N ATOM 744 CA ASN A 50 1.157 -4.654 12.560 1.00 64.15 C ATOM 745 C ASN A 50 0.432 -3.567 11.779 1.00 44.24 C ATOM 746 O ASN A 50 -0.722 -3.245 12.066 1.00 33.33 O ATOM 747 CB ASN A 50 2.080 -4.007 13.600 1.00 4.51 C ATOM 748 CG ASN A 50 2.849 -5.024 14.422 1.00 20.13 C ATOM 749 OD1 ASN A 50 2.347 -5.533 15.425 1.00 75.11 O ATOM 750 ND2 ASN A 50 4.078 -5.308 14.017 1.00 12.33 N ATOM 0 H ASN A 50 2.921 -5.440 11.725 1.00 71.32 H new ATOM 0 HA ASN A 50 0.429 -5.275 13.082 1.00 64.15 H new ATOM 0 HB2 ASN A 50 2.786 -3.349 13.093 1.00 4.51 H new ATOM 0 HB3 ASN A 50 1.486 -3.383 14.267 1.00 4.51 H new ATOM 0 HD21 ASN A 50 4.647 -5.972 14.542 1.00 12.33 H new ATOM 0 HD22 ASN A 50 4.455 -4.863 13.180 1.00 12.33 H new ATOM 757 N VAL A 51 1.115 -3.026 10.777 1.00 11.11 N ATOM 758 CA VAL A 51 0.564 -1.963 9.938 1.00 73.14 C ATOM 759 C VAL A 51 -0.703 -2.427 9.214 1.00 24.41 C ATOM 760 O VAL A 51 -1.614 -1.635 8.967 1.00 71.23 O ATOM 761 CB VAL A 51 1.608 -1.486 8.902 1.00 2.10 C ATOM 762 CG1 VAL A 51 1.076 -0.331 8.069 1.00 33.34 C ATOM 763 CG2 VAL A 51 2.896 -1.082 9.595 1.00 31.22 C ATOM 0 H VAL A 51 2.061 -3.308 10.522 1.00 11.11 H new ATOM 0 HA VAL A 51 0.305 -1.132 10.594 1.00 73.14 H new ATOM 0 HB VAL A 51 1.813 -2.319 8.230 1.00 2.10 H new ATOM 0 HG11 VAL A 51 1.835 -0.020 7.351 1.00 33.34 H new ATOM 0 HG12 VAL A 51 0.180 -0.649 7.535 1.00 33.34 H new ATOM 0 HG13 VAL A 51 0.831 0.506 8.722 1.00 33.34 H new ATOM 0 HG21 VAL A 51 3.620 -0.749 8.852 1.00 31.22 H new ATOM 0 HG22 VAL A 51 2.694 -0.270 10.294 1.00 31.22 H new ATOM 0 HG23 VAL A 51 3.300 -1.936 10.138 1.00 31.22 H new ATOM 773 N ALA A 52 -0.769 -3.722 8.913 1.00 74.33 N ATOM 774 CA ALA A 52 -1.883 -4.294 8.156 1.00 2.14 C ATOM 775 C ALA A 52 -3.225 -4.072 8.856 1.00 52.12 C ATOM 776 O ALA A 52 -4.277 -4.092 8.215 1.00 73.32 O ATOM 777 CB ALA A 52 -1.652 -5.779 7.924 1.00 60.24 C ATOM 0 H ALA A 52 -0.058 -4.401 9.184 1.00 74.33 H new ATOM 0 HA ALA A 52 -1.925 -3.780 7.196 1.00 2.14 H new ATOM 0 HB1 ALA A 52 -2.488 -6.193 7.360 1.00 60.24 H new ATOM 0 HB2 ALA A 52 -0.729 -5.920 7.362 1.00 60.24 H new ATOM 0 HB3 ALA A 52 -1.574 -6.289 8.884 1.00 60.24 H new ATOM 783 N GLY A 53 -3.184 -3.864 10.168 1.00 65.31 N ATOM 784 CA GLY A 53 -4.398 -3.585 10.912 1.00 53.20 C ATOM 785 C GLY A 53 -5.046 -2.292 10.459 1.00 71.52 C ATOM 786 O GLY A 53 -6.230 -2.263 10.116 1.00 1.03 O ATOM 0 H GLY A 53 -2.332 -3.884 10.729 1.00 65.31 H new ATOM 0 HA2 GLY A 53 -5.101 -4.409 10.785 1.00 53.20 H new ATOM 0 HA3 GLY A 53 -4.168 -3.524 11.976 1.00 53.20 H new ATOM 790 N GLU A 54 -4.253 -1.230 10.432 1.00 32.45 N ATOM 791 CA GLU A 54 -4.725 0.088 10.023 1.00 51.12 C ATOM 792 C GLU A 54 -4.990 0.137 8.519 1.00 41.34 C ATOM 793 O GLU A 54 -5.926 0.792 8.066 1.00 44.03 O ATOM 794 CB GLU A 54 -3.702 1.163 10.411 1.00 21.32 C ATOM 795 CG GLU A 54 -3.735 1.560 11.884 1.00 10.21 C ATOM 796 CD GLU A 54 -3.626 0.383 12.832 1.00 60.30 C ATOM 797 OE1 GLU A 54 -2.547 -0.240 12.899 1.00 72.21 O ATOM 798 OE2 GLU A 54 -4.632 0.065 13.503 1.00 13.34 O ATOM 0 H GLU A 54 -3.267 -1.256 10.692 1.00 32.45 H new ATOM 0 HA GLU A 54 -5.664 0.284 10.541 1.00 51.12 H new ATOM 0 HB2 GLU A 54 -2.703 0.802 10.167 1.00 21.32 H new ATOM 0 HB3 GLU A 54 -3.878 2.051 9.804 1.00 21.32 H new ATOM 0 HG2 GLU A 54 -2.918 2.253 12.083 1.00 10.21 H new ATOM 0 HG3 GLU A 54 -4.663 2.095 12.087 1.00 10.21 H new ATOM 805 N ILE A 55 -4.167 -0.570 7.753 1.00 34.40 N ATOM 806 CA ILE A 55 -4.302 -0.598 6.298 1.00 33.34 C ATOM 807 C ILE A 55 -5.637 -1.221 5.879 1.00 12.23 C ATOM 808 O ILE A 55 -6.208 -0.860 4.845 1.00 70.24 O ATOM 809 CB ILE A 55 -3.135 -1.371 5.639 1.00 35.14 C ATOM 810 CG1 ILE A 55 -1.794 -0.737 6.019 1.00 73.34 C ATOM 811 CG2 ILE A 55 -3.286 -1.408 4.125 1.00 24.43 C ATOM 812 CD1 ILE A 55 -1.693 0.737 5.685 1.00 64.50 C ATOM 0 H ILE A 55 -3.397 -1.133 8.114 1.00 34.40 H new ATOM 0 HA ILE A 55 -4.273 0.436 5.953 1.00 33.34 H new ATOM 0 HB ILE A 55 -3.161 -2.396 6.009 1.00 35.14 H new ATOM 0 HG12 ILE A 55 -1.632 -0.869 7.089 1.00 73.34 H new ATOM 0 HG13 ILE A 55 -0.993 -1.271 5.507 1.00 73.34 H new ATOM 0 HG21 ILE A 55 -2.452 -1.958 3.689 1.00 24.43 H new ATOM 0 HG22 ILE A 55 -4.222 -1.903 3.865 1.00 24.43 H new ATOM 0 HG23 ILE A 55 -3.293 -0.390 3.735 1.00 24.43 H new ATOM 0 HD11 ILE A 55 -0.714 1.112 5.985 1.00 64.50 H new ATOM 0 HD12 ILE A 55 -1.822 0.877 4.612 1.00 64.50 H new ATOM 0 HD13 ILE A 55 -2.470 1.285 6.218 1.00 64.50 H new ATOM 824 N ALA A 56 -6.136 -2.145 6.693 1.00 22.25 N ATOM 825 CA ALA A 56 -7.401 -2.818 6.413 1.00 71.10 C ATOM 826 C ALA A 56 -8.570 -1.836 6.406 1.00 71.10 C ATOM 827 O ALA A 56 -9.555 -2.035 5.698 1.00 62.23 O ATOM 828 CB ALA A 56 -7.646 -3.918 7.433 1.00 52.30 C ATOM 0 H ALA A 56 -5.682 -2.446 7.555 1.00 22.25 H new ATOM 0 HA ALA A 56 -7.331 -3.259 5.419 1.00 71.10 H new ATOM 0 HB1 ALA A 56 -8.592 -4.413 7.214 1.00 52.30 H new ATOM 0 HB2 ALA A 56 -6.836 -4.646 7.385 1.00 52.30 H new ATOM 0 HB3 ALA A 56 -7.686 -3.485 8.433 1.00 52.30 H new ATOM 834 N ALA A 57 -8.447 -0.765 7.181 1.00 30.24 N ATOM 835 CA ALA A 57 -9.499 0.241 7.265 1.00 74.12 C ATOM 836 C ALA A 57 -9.575 1.060 5.980 1.00 63.51 C ATOM 837 O ALA A 57 -10.634 1.573 5.615 1.00 13.51 O ATOM 838 CB ALA A 57 -9.270 1.147 8.463 1.00 50.41 C ATOM 0 H ALA A 57 -7.630 -0.571 7.760 1.00 30.24 H new ATOM 0 HA ALA A 57 -10.452 -0.272 7.394 1.00 74.12 H new ATOM 0 HB1 ALA A 57 -10.063 1.893 8.512 1.00 50.41 H new ATOM 0 HB2 ALA A 57 -9.275 0.551 9.376 1.00 50.41 H new ATOM 0 HB3 ALA A 57 -8.307 1.648 8.362 1.00 50.41 H new ATOM 844 N ALA A 58 -8.447 1.171 5.289 1.00 13.44 N ATOM 845 CA ALA A 58 -8.385 1.907 4.035 1.00 62.34 C ATOM 846 C ALA A 58 -8.994 1.093 2.900 1.00 51.51 C ATOM 847 O ALA A 58 -9.417 1.640 1.882 1.00 2.20 O ATOM 848 CB ALA A 58 -6.949 2.283 3.716 1.00 64.32 C ATOM 0 H ALA A 58 -7.560 0.758 5.578 1.00 13.44 H new ATOM 0 HA ALA A 58 -8.967 2.822 4.143 1.00 62.34 H new ATOM 0 HB1 ALA A 58 -6.917 2.833 2.775 1.00 64.32 H new ATOM 0 HB2 ALA A 58 -6.550 2.908 4.515 1.00 64.32 H new ATOM 0 HB3 ALA A 58 -6.347 1.379 3.628 1.00 64.32 H new ATOM 854 N LEU A 59 -9.046 -0.221 3.092 1.00 24.54 N ATOM 855 CA LEU A 59 -9.564 -1.134 2.079 1.00 52.24 C ATOM 856 C LEU A 59 -11.039 -0.857 1.794 1.00 65.45 C ATOM 857 O LEU A 59 -11.513 -1.056 0.675 1.00 40.21 O ATOM 858 CB LEU A 59 -9.389 -2.580 2.544 1.00 12.23 C ATOM 859 CG LEU A 59 -9.683 -3.651 1.489 1.00 5.45 C ATOM 860 CD1 LEU A 59 -8.735 -3.516 0.307 1.00 14.44 C ATOM 861 CD2 LEU A 59 -9.577 -5.038 2.103 1.00 53.30 C ATOM 0 H LEU A 59 -8.733 -0.680 3.947 1.00 24.54 H new ATOM 0 HA LEU A 59 -9.002 -0.977 1.159 1.00 52.24 H new ATOM 0 HB2 LEU A 59 -8.365 -2.710 2.893 1.00 12.23 H new ATOM 0 HB3 LEU A 59 -10.041 -2.750 3.401 1.00 12.23 H new ATOM 0 HG LEU A 59 -10.701 -3.508 1.126 1.00 5.45 H new ATOM 0 HD11 LEU A 59 -8.961 -4.286 -0.430 1.00 14.44 H new ATOM 0 HD12 LEU A 59 -8.857 -2.532 -0.147 1.00 14.44 H new ATOM 0 HD13 LEU A 59 -7.707 -3.633 0.650 1.00 14.44 H new ATOM 0 HD21 LEU A 59 -9.788 -5.790 1.342 1.00 53.30 H new ATOM 0 HD22 LEU A 59 -8.570 -5.188 2.491 1.00 53.30 H new ATOM 0 HD23 LEU A 59 -10.297 -5.132 2.916 1.00 53.30 H new ATOM 873 N TYR A 60 -11.755 -0.391 2.812 1.00 13.11 N ATOM 874 CA TYR A 60 -13.170 -0.052 2.666 1.00 1.24 C ATOM 875 C TYR A 60 -13.370 1.042 1.620 1.00 4.53 C ATOM 876 O TYR A 60 -14.350 1.028 0.873 1.00 4.00 O ATOM 877 CB TYR A 60 -13.759 0.393 4.006 1.00 42.15 C ATOM 878 CG TYR A 60 -13.931 -0.733 4.999 1.00 5.43 C ATOM 879 CD1 TYR A 60 -15.059 -1.543 4.960 1.00 73.45 C ATOM 880 CD2 TYR A 60 -12.974 -0.984 5.973 1.00 74.54 C ATOM 881 CE1 TYR A 60 -15.229 -2.573 5.865 1.00 63.12 C ATOM 882 CE2 TYR A 60 -13.137 -2.011 6.883 1.00 12.11 C ATOM 883 CZ TYR A 60 -14.265 -2.803 6.825 1.00 74.34 C ATOM 884 OH TYR A 60 -14.432 -3.824 7.735 1.00 61.31 O ATOM 0 H TYR A 60 -11.380 -0.239 3.748 1.00 13.11 H new ATOM 0 HA TYR A 60 -13.692 -0.948 2.330 1.00 1.24 H new ATOM 0 HB2 TYR A 60 -13.112 1.154 4.442 1.00 42.15 H new ATOM 0 HB3 TYR A 60 -14.728 0.861 3.829 1.00 42.15 H new ATOM 0 HD1 TYR A 60 -15.815 -1.365 4.210 1.00 73.45 H new ATOM 0 HD2 TYR A 60 -12.089 -0.367 6.020 1.00 74.54 H new ATOM 0 HE1 TYR A 60 -16.111 -3.194 5.821 1.00 63.12 H new ATOM 0 HE2 TYR A 60 -12.385 -2.193 7.636 1.00 12.11 H new ATOM 0 HH TYR A 60 -13.662 -3.851 8.341 1.00 61.31 H new ATOM 894 N ALA A 61 -12.427 1.975 1.564 1.00 2.11 N ATOM 895 CA ALA A 61 -12.475 3.052 0.585 1.00 63.11 C ATOM 896 C ALA A 61 -12.240 2.501 -0.816 1.00 5.24 C ATOM 897 O ALA A 61 -12.845 2.957 -1.785 1.00 2.14 O ATOM 898 CB ALA A 61 -11.448 4.125 0.920 1.00 60.25 C ATOM 0 H ALA A 61 -11.619 2.007 2.186 1.00 2.11 H new ATOM 0 HA ALA A 61 -13.465 3.507 0.616 1.00 63.11 H new ATOM 0 HB1 ALA A 61 -11.499 4.921 0.178 1.00 60.25 H new ATOM 0 HB2 ALA A 61 -11.659 4.535 1.907 1.00 60.25 H new ATOM 0 HB3 ALA A 61 -10.450 3.687 0.915 1.00 60.25 H new ATOM 904 N VAL A 62 -11.371 1.500 -0.905 1.00 2.04 N ATOM 905 CA VAL A 62 -11.082 0.834 -2.169 1.00 2.45 C ATOM 906 C VAL A 62 -12.312 0.069 -2.654 1.00 3.33 C ATOM 907 O VAL A 62 -12.628 0.056 -3.847 1.00 31.24 O ATOM 908 CB VAL A 62 -9.892 -0.141 -2.023 1.00 34.44 C ATOM 909 CG1 VAL A 62 -9.545 -0.792 -3.354 1.00 41.33 C ATOM 910 CG2 VAL A 62 -8.679 0.574 -1.441 1.00 11.02 C ATOM 0 H VAL A 62 -10.851 1.130 -0.109 1.00 2.04 H new ATOM 0 HA VAL A 62 -10.817 1.599 -2.899 1.00 2.45 H new ATOM 0 HB VAL A 62 -10.190 -0.931 -1.333 1.00 34.44 H new ATOM 0 HG11 VAL A 62 -8.704 -1.472 -3.218 1.00 41.33 H new ATOM 0 HG12 VAL A 62 -10.407 -1.349 -3.722 1.00 41.33 H new ATOM 0 HG13 VAL A 62 -9.275 -0.022 -4.076 1.00 41.33 H new ATOM 0 HG21 VAL A 62 -7.852 -0.130 -1.346 1.00 11.02 H new ATOM 0 HG22 VAL A 62 -8.386 1.390 -2.101 1.00 11.02 H new ATOM 0 HG23 VAL A 62 -8.929 0.974 -0.458 1.00 11.02 H new ATOM 920 N LYS A 63 -13.015 -0.550 -1.713 1.00 54.12 N ATOM 921 CA LYS A 63 -14.229 -1.296 -2.021 1.00 23.03 C ATOM 922 C LYS A 63 -15.308 -0.359 -2.569 1.00 73.14 C ATOM 923 O LYS A 63 -16.049 -0.714 -3.487 1.00 5.35 O ATOM 924 CB LYS A 63 -14.715 -2.039 -0.764 1.00 14.11 C ATOM 925 CG LYS A 63 -15.938 -2.922 -0.980 1.00 12.33 C ATOM 926 CD LYS A 63 -17.231 -2.164 -0.723 1.00 50.13 C ATOM 927 CE LYS A 63 -18.454 -3.011 -1.035 1.00 54.13 C ATOM 928 NZ LYS A 63 -18.478 -4.274 -0.250 1.00 45.22 N ATOM 0 H LYS A 63 -12.763 -0.550 -0.725 1.00 54.12 H new ATOM 0 HA LYS A 63 -14.012 -2.035 -2.793 1.00 23.03 H new ATOM 0 HB2 LYS A 63 -13.900 -2.656 -0.385 1.00 14.11 H new ATOM 0 HB3 LYS A 63 -14.945 -1.306 0.009 1.00 14.11 H new ATOM 0 HG2 LYS A 63 -15.936 -3.303 -2.001 1.00 12.33 H new ATOM 0 HG3 LYS A 63 -15.885 -3.786 -0.318 1.00 12.33 H new ATOM 0 HD2 LYS A 63 -17.265 -1.847 0.319 1.00 50.13 H new ATOM 0 HD3 LYS A 63 -17.250 -1.260 -1.332 1.00 50.13 H new ATOM 0 HE2 LYS A 63 -19.356 -2.436 -0.823 1.00 54.13 H new ATOM 0 HE3 LYS A 63 -18.469 -3.246 -2.099 1.00 54.13 H new ATOM 0 HZ1 LYS A 63 -19.396 -4.745 -0.378 1.00 45.22 H new ATOM 0 HZ2 LYS A 63 -17.718 -4.902 -0.580 1.00 45.22 H new ATOM 0 HZ3 LYS A 63 -18.337 -4.059 0.758 1.00 45.22 H new ATOM 942 N LYS A 64 -15.389 0.844 -2.014 1.00 65.20 N ATOM 943 CA LYS A 64 -16.332 1.840 -2.508 1.00 5.11 C ATOM 944 C LYS A 64 -15.850 2.447 -3.823 1.00 1.15 C ATOM 945 O LYS A 64 -16.657 2.846 -4.660 1.00 61.43 O ATOM 946 CB LYS A 64 -16.577 2.939 -1.472 1.00 0.44 C ATOM 947 CG LYS A 64 -17.423 2.483 -0.295 1.00 43.23 C ATOM 948 CD LYS A 64 -17.896 3.660 0.541 1.00 54.04 C ATOM 949 CE LYS A 64 -18.883 3.225 1.610 1.00 14.13 C ATOM 950 NZ LYS A 64 -19.444 4.387 2.348 1.00 3.34 N ATOM 0 H LYS A 64 -14.818 1.152 -1.227 1.00 65.20 H new ATOM 0 HA LYS A 64 -17.278 1.330 -2.690 1.00 5.11 H new ATOM 0 HB2 LYS A 64 -15.617 3.299 -1.102 1.00 0.44 H new ATOM 0 HB3 LYS A 64 -17.068 3.782 -1.957 1.00 0.44 H new ATOM 0 HG2 LYS A 64 -18.285 1.925 -0.660 1.00 43.23 H new ATOM 0 HG3 LYS A 64 -16.844 1.802 0.329 1.00 43.23 H new ATOM 0 HD2 LYS A 64 -17.038 4.141 1.011 1.00 54.04 H new ATOM 0 HD3 LYS A 64 -18.363 4.402 -0.106 1.00 54.04 H new ATOM 0 HE2 LYS A 64 -19.694 2.661 1.149 1.00 14.13 H new ATOM 0 HE3 LYS A 64 -18.387 2.554 2.311 1.00 14.13 H new ATOM 0 HZ1 LYS A 64 -20.113 4.050 3.069 1.00 3.34 H new ATOM 0 HZ2 LYS A 64 -18.673 4.910 2.809 1.00 3.34 H new ATOM 0 HZ3 LYS A 64 -19.939 5.015 1.683 1.00 3.34 H new ATOM 964 N ALA A 65 -14.538 2.495 -4.010 1.00 11.23 N ATOM 965 CA ALA A 65 -13.958 3.037 -5.235 1.00 3.13 C ATOM 966 C ALA A 65 -14.410 2.239 -6.458 1.00 33.24 C ATOM 967 O ALA A 65 -14.635 2.801 -7.532 1.00 11.54 O ATOM 968 CB ALA A 65 -12.441 3.056 -5.141 1.00 14.12 C ATOM 0 H ALA A 65 -13.853 2.165 -3.330 1.00 11.23 H new ATOM 0 HA ALA A 65 -14.313 4.061 -5.352 1.00 3.13 H new ATOM 0 HB1 ALA A 65 -12.024 3.463 -6.062 1.00 14.12 H new ATOM 0 HB2 ALA A 65 -12.136 3.678 -4.299 1.00 14.12 H new ATOM 0 HB3 ALA A 65 -12.073 2.041 -4.994 1.00 14.12 H new ATOM 974 N SER A 66 -14.560 0.929 -6.282 1.00 22.43 N ATOM 975 CA SER A 66 -15.050 0.057 -7.345 1.00 12.21 C ATOM 976 C SER A 66 -16.473 0.451 -7.737 1.00 61.05 C ATOM 977 O SER A 66 -16.837 0.427 -8.913 1.00 52.53 O ATOM 978 CB SER A 66 -15.021 -1.403 -6.879 1.00 31.41 C ATOM 979 OG SER A 66 -15.409 -2.291 -7.916 1.00 63.53 O ATOM 0 H SER A 66 -14.348 0.446 -5.409 1.00 22.43 H new ATOM 0 HA SER A 66 -14.403 0.166 -8.215 1.00 12.21 H new ATOM 0 HB2 SER A 66 -14.017 -1.657 -6.539 1.00 31.41 H new ATOM 0 HB3 SER A 66 -15.688 -1.526 -6.025 1.00 31.41 H new ATOM 0 HG SER A 66 -15.378 -3.213 -7.586 1.00 63.53 H new ATOM 985 N GLN A 67 -17.260 0.833 -6.737 1.00 21.22 N ATOM 986 CA GLN A 67 -18.646 1.214 -6.938 1.00 1.44 C ATOM 987 C GLN A 67 -18.750 2.587 -7.594 1.00 43.04 C ATOM 988 O GLN A 67 -19.481 2.767 -8.570 1.00 24.12 O ATOM 989 CB GLN A 67 -19.362 1.224 -5.590 1.00 2.31 C ATOM 990 CG GLN A 67 -19.467 -0.147 -4.946 1.00 14.22 C ATOM 991 CD GLN A 67 -19.964 -0.080 -3.517 1.00 44.13 C ATOM 992 OE1 GLN A 67 -21.168 -0.111 -3.262 1.00 4.45 O ATOM 993 NE2 GLN A 67 -19.042 0.010 -2.575 1.00 50.12 N ATOM 0 H GLN A 67 -16.952 0.886 -5.766 1.00 21.22 H new ATOM 0 HA GLN A 67 -19.116 0.489 -7.603 1.00 1.44 H new ATOM 0 HB2 GLN A 67 -18.833 1.895 -4.913 1.00 2.31 H new ATOM 0 HB3 GLN A 67 -20.364 1.631 -5.724 1.00 2.31 H new ATOM 0 HG2 GLN A 67 -20.142 -0.770 -5.533 1.00 14.22 H new ATOM 0 HG3 GLN A 67 -18.490 -0.630 -4.965 1.00 14.22 H new ATOM 0 HE21 GLN A 67 -18.054 0.033 -2.829 1.00 50.12 H new ATOM 0 HE22 GLN A 67 -19.318 0.057 -1.594 1.00 50.12 H new ATOM 1002 N LEU A 68 -18.008 3.550 -7.054 1.00 3.21 N ATOM 1003 CA LEU A 68 -18.032 4.922 -7.561 1.00 54.41 C ATOM 1004 C LEU A 68 -17.407 5.011 -8.948 1.00 52.22 C ATOM 1005 O LEU A 68 -17.735 5.902 -9.728 1.00 1.35 O ATOM 1006 CB LEU A 68 -17.297 5.869 -6.604 1.00 64.40 C ATOM 1007 CG LEU A 68 -18.126 6.418 -5.433 1.00 5.41 C ATOM 1008 CD1 LEU A 68 -18.636 5.299 -4.536 1.00 65.32 C ATOM 1009 CD2 LEU A 68 -17.300 7.405 -4.623 1.00 63.32 C ATOM 0 H LEU A 68 -17.380 3.406 -6.263 1.00 3.21 H new ATOM 0 HA LEU A 68 -19.077 5.224 -7.631 1.00 54.41 H new ATOM 0 HB2 LEU A 68 -16.433 5.344 -6.197 1.00 64.40 H new ATOM 0 HB3 LEU A 68 -16.915 6.712 -7.180 1.00 64.40 H new ATOM 0 HG LEU A 68 -18.992 6.932 -5.850 1.00 5.41 H new ATOM 0 HD11 LEU A 68 -19.218 5.725 -3.719 1.00 65.32 H new ATOM 0 HD12 LEU A 68 -19.265 4.625 -5.117 1.00 65.32 H new ATOM 0 HD13 LEU A 68 -17.790 4.745 -4.129 1.00 65.32 H new ATOM 0 HD21 LEU A 68 -17.898 7.787 -3.796 1.00 63.32 H new ATOM 0 HD22 LEU A 68 -16.416 6.903 -4.230 1.00 63.32 H new ATOM 0 HD23 LEU A 68 -16.993 8.233 -5.262 1.00 63.32 H new ATOM 1021 N GLY A 69 -16.510 4.084 -9.249 1.00 11.51 N ATOM 1022 CA GLY A 69 -15.904 4.042 -10.565 1.00 51.21 C ATOM 1023 C GLY A 69 -14.590 4.793 -10.632 1.00 20.11 C ATOM 1024 O GLY A 69 -14.049 5.009 -11.717 1.00 3.34 O ATOM 0 H GLY A 69 -16.190 3.360 -8.606 1.00 11.51 H new ATOM 0 HA2 GLY A 69 -15.738 3.003 -10.850 1.00 51.21 H new ATOM 0 HA3 GLY A 69 -16.597 4.466 -11.292 1.00 51.21 H new ATOM 1028 N VAL A 70 -14.070 5.187 -9.478 1.00 62.34 N ATOM 1029 CA VAL A 70 -12.800 5.897 -9.424 1.00 52.42 C ATOM 1030 C VAL A 70 -11.644 4.906 -9.373 1.00 52.44 C ATOM 1031 O VAL A 70 -11.794 3.792 -8.869 1.00 52.20 O ATOM 1032 CB VAL A 70 -12.720 6.861 -8.219 1.00 70.23 C ATOM 1033 CG1 VAL A 70 -13.706 8.003 -8.390 1.00 52.23 C ATOM 1034 CG2 VAL A 70 -12.985 6.127 -6.913 1.00 23.04 C ATOM 0 H VAL A 70 -14.506 5.028 -8.570 1.00 62.34 H new ATOM 0 HA VAL A 70 -12.728 6.498 -10.331 1.00 52.42 H new ATOM 0 HB VAL A 70 -11.710 7.270 -8.180 1.00 70.23 H new ATOM 0 HG11 VAL A 70 -13.638 8.674 -7.533 1.00 52.23 H new ATOM 0 HG12 VAL A 70 -13.471 8.553 -9.301 1.00 52.23 H new ATOM 0 HG13 VAL A 70 -14.718 7.603 -8.458 1.00 52.23 H new ATOM 0 HG21 VAL A 70 -12.922 6.829 -6.082 1.00 23.04 H new ATOM 0 HG22 VAL A 70 -13.981 5.684 -6.940 1.00 23.04 H new ATOM 0 HG23 VAL A 70 -12.242 5.341 -6.780 1.00 23.04 H new ATOM 1044 N LYS A 71 -10.501 5.307 -9.909 1.00 70.42 N ATOM 1045 CA LYS A 71 -9.362 4.405 -10.045 1.00 4.43 C ATOM 1046 C LYS A 71 -8.189 4.887 -9.205 1.00 64.54 C ATOM 1047 O LYS A 71 -7.975 6.093 -9.059 1.00 51.03 O ATOM 1048 CB LYS A 71 -8.942 4.311 -11.517 1.00 44.11 C ATOM 1049 CG LYS A 71 -10.103 4.073 -12.471 1.00 10.43 C ATOM 1050 CD LYS A 71 -10.847 2.795 -12.137 1.00 12.31 C ATOM 1051 CE LYS A 71 -12.108 2.643 -12.969 1.00 41.34 C ATOM 1052 NZ LYS A 71 -12.830 1.385 -12.644 1.00 70.14 N ATOM 0 H LYS A 71 -10.335 6.251 -10.258 1.00 70.42 H new ATOM 0 HA LYS A 71 -9.661 3.419 -9.690 1.00 4.43 H new ATOM 0 HB2 LYS A 71 -8.434 5.233 -11.800 1.00 44.11 H new ATOM 0 HB3 LYS A 71 -8.220 3.502 -11.629 1.00 44.11 H new ATOM 0 HG2 LYS A 71 -10.791 4.917 -12.426 1.00 10.43 H new ATOM 0 HG3 LYS A 71 -9.729 4.021 -13.494 1.00 10.43 H new ATOM 0 HD2 LYS A 71 -10.194 1.939 -12.307 1.00 12.31 H new ATOM 0 HD3 LYS A 71 -11.107 2.792 -11.079 1.00 12.31 H new ATOM 0 HE2 LYS A 71 -12.765 3.495 -12.795 1.00 41.34 H new ATOM 0 HE3 LYS A 71 -11.849 2.651 -14.028 1.00 41.34 H new ATOM 0 HZ1 LYS A 71 -13.282 1.012 -13.503 1.00 70.14 H new ATOM 0 HZ2 LYS A 71 -12.157 0.684 -12.275 1.00 70.14 H new ATOM 0 HZ3 LYS A 71 -13.557 1.578 -11.926 1.00 70.14 H new ATOM 1066 N ILE A 72 -7.444 3.945 -8.640 1.00 60.10 N ATOM 1067 CA ILE A 72 -6.271 4.283 -7.844 1.00 44.55 C ATOM 1068 C ILE A 72 -5.043 3.513 -8.329 1.00 22.34 C ATOM 1069 O ILE A 72 -5.164 2.443 -8.927 1.00 31.11 O ATOM 1070 CB ILE A 72 -6.484 3.989 -6.336 1.00 71.00 C ATOM 1071 CG1 ILE A 72 -6.500 2.484 -6.058 1.00 65.32 C ATOM 1072 CG2 ILE A 72 -7.780 4.621 -5.854 1.00 32.13 C ATOM 1073 CD1 ILE A 72 -6.697 2.135 -4.598 1.00 5.23 C ATOM 0 H ILE A 72 -7.630 2.945 -8.718 1.00 60.10 H new ATOM 0 HA ILE A 72 -6.110 5.354 -7.970 1.00 44.55 H new ATOM 0 HB ILE A 72 -5.647 4.425 -5.790 1.00 71.00 H new ATOM 0 HG12 ILE A 72 -7.297 2.024 -6.643 1.00 65.32 H new ATOM 0 HG13 ILE A 72 -5.561 2.050 -6.402 1.00 65.32 H new ATOM 0 HG21 ILE A 72 -7.917 4.407 -4.794 1.00 32.13 H new ATOM 0 HG22 ILE A 72 -7.736 5.700 -6.004 1.00 32.13 H new ATOM 0 HG23 ILE A 72 -8.617 4.210 -6.418 1.00 32.13 H new ATOM 0 HD11 ILE A 72 -6.697 1.051 -4.480 1.00 5.23 H new ATOM 0 HD12 ILE A 72 -5.887 2.564 -4.009 1.00 5.23 H new ATOM 0 HD13 ILE A 72 -7.649 2.538 -4.253 1.00 5.23 H new ATOM 1085 N ARG A 73 -3.864 4.072 -8.092 1.00 44.44 N ATOM 1086 CA ARG A 73 -2.617 3.357 -8.352 1.00 31.21 C ATOM 1087 C ARG A 73 -2.112 2.747 -7.060 1.00 62.24 C ATOM 1088 O ARG A 73 -2.131 3.402 -6.023 1.00 23.44 O ATOM 1089 CB ARG A 73 -1.525 4.272 -8.923 1.00 2.44 C ATOM 1090 CG ARG A 73 -1.780 4.766 -10.338 1.00 11.24 C ATOM 1091 CD ARG A 73 -2.690 5.978 -10.361 1.00 3.05 C ATOM 1092 NE ARG A 73 -2.674 6.638 -11.663 1.00 24.32 N ATOM 1093 CZ ARG A 73 -2.257 7.886 -11.851 1.00 23.22 C ATOM 1094 NH1 ARG A 73 -1.734 8.571 -10.842 1.00 55.30 N ATOM 1095 NH2 ARG A 73 -2.322 8.435 -13.054 1.00 20.23 N ATOM 0 H ARG A 73 -3.742 5.015 -7.722 1.00 44.44 H new ATOM 0 HA ARG A 73 -2.832 2.588 -9.094 1.00 31.21 H new ATOM 0 HB2 ARG A 73 -1.415 5.135 -8.267 1.00 2.44 H new ATOM 0 HB3 ARG A 73 -0.576 3.736 -8.906 1.00 2.44 H new ATOM 0 HG2 ARG A 73 -0.831 5.017 -10.811 1.00 11.24 H new ATOM 0 HG3 ARG A 73 -2.228 3.965 -10.926 1.00 11.24 H new ATOM 0 HD2 ARG A 73 -3.708 5.674 -10.119 1.00 3.05 H new ATOM 0 HD3 ARG A 73 -2.377 6.683 -9.591 1.00 3.05 H new ATOM 0 HE ARG A 73 -3.001 6.112 -12.474 1.00 24.32 H new ATOM 0 HH11 ARG A 73 -1.652 8.140 -9.921 1.00 55.30 H new ATOM 0 HH12 ARG A 73 -1.414 9.529 -10.987 1.00 55.30 H new ATOM 0 HH21 ARG A 73 -2.693 7.900 -13.839 1.00 20.23 H new ATOM 0 HH22 ARG A 73 -2.001 9.393 -13.195 1.00 20.23 H new ATOM 1109 N ILE A 74 -1.686 1.497 -7.112 1.00 70.33 N ATOM 1110 CA ILE A 74 -1.137 0.845 -5.936 1.00 54.13 C ATOM 1111 C ILE A 74 0.326 0.480 -6.155 1.00 22.45 C ATOM 1112 O ILE A 74 0.650 -0.352 -7.003 1.00 71.12 O ATOM 1113 CB ILE A 74 -1.940 -0.419 -5.551 1.00 4.34 C ATOM 1114 CG1 ILE A 74 -3.350 -0.038 -5.093 1.00 31.41 C ATOM 1115 CG2 ILE A 74 -1.226 -1.211 -4.461 1.00 11.32 C ATOM 1116 CD1 ILE A 74 -3.375 0.834 -3.853 1.00 62.31 C ATOM 0 H ILE A 74 -1.709 0.916 -7.950 1.00 70.33 H new ATOM 0 HA ILE A 74 -1.210 1.556 -5.113 1.00 54.13 H new ATOM 0 HB ILE A 74 -2.017 -1.051 -6.435 1.00 4.34 H new ATOM 0 HG12 ILE A 74 -3.857 0.485 -5.904 1.00 31.41 H new ATOM 0 HG13 ILE A 74 -3.917 -0.948 -4.897 1.00 31.41 H new ATOM 0 HG21 ILE A 74 -1.813 -2.095 -4.210 1.00 11.32 H new ATOM 0 HG22 ILE A 74 -0.243 -1.518 -4.819 1.00 11.32 H new ATOM 0 HG23 ILE A 74 -1.111 -0.588 -3.574 1.00 11.32 H new ATOM 0 HD11 ILE A 74 -4.408 1.062 -3.590 1.00 62.31 H new ATOM 0 HD12 ILE A 74 -2.898 0.306 -3.027 1.00 62.31 H new ATOM 0 HD13 ILE A 74 -2.837 1.761 -4.049 1.00 62.31 H new ATOM 1128 N LEU A 75 1.207 1.118 -5.401 1.00 31.05 N ATOM 1129 CA LEU A 75 2.615 0.755 -5.410 1.00 3.20 C ATOM 1130 C LEU A 75 2.811 -0.443 -4.486 1.00 11.42 C ATOM 1131 O LEU A 75 2.924 -0.293 -3.270 1.00 53.13 O ATOM 1132 CB LEU A 75 3.480 1.947 -4.966 1.00 13.41 C ATOM 1133 CG LEU A 75 4.950 1.935 -5.426 1.00 2.15 C ATOM 1134 CD1 LEU A 75 5.733 0.810 -4.769 1.00 23.31 C ATOM 1135 CD2 LEU A 75 5.031 1.824 -6.941 1.00 1.12 C ATOM 0 H LEU A 75 0.972 1.889 -4.776 1.00 31.05 H new ATOM 0 HA LEU A 75 2.926 0.487 -6.420 1.00 3.20 H new ATOM 0 HB2 LEU A 75 3.015 2.862 -5.332 1.00 13.41 H new ATOM 0 HB3 LEU A 75 3.463 1.995 -3.877 1.00 13.41 H new ATOM 0 HG LEU A 75 5.402 2.877 -5.116 1.00 2.15 H new ATOM 0 HD11 LEU A 75 6.765 0.833 -5.118 1.00 23.31 H new ATOM 0 HD12 LEU A 75 5.713 0.936 -3.687 1.00 23.31 H new ATOM 0 HD13 LEU A 75 5.283 -0.148 -5.031 1.00 23.31 H new ATOM 0 HD21 LEU A 75 6.076 1.817 -7.250 1.00 1.12 H new ATOM 0 HD22 LEU A 75 4.551 0.900 -7.264 1.00 1.12 H new ATOM 0 HD23 LEU A 75 4.524 2.675 -7.396 1.00 1.12 H new ATOM 1147 N HIS A 76 2.814 -1.634 -5.063 1.00 24.10 N ATOM 1148 CA HIS A 76 2.851 -2.861 -4.282 1.00 53.24 C ATOM 1149 C HIS A 76 3.876 -3.823 -4.872 1.00 40.31 C ATOM 1150 O HIS A 76 4.395 -3.587 -5.964 1.00 41.04 O ATOM 1151 CB HIS A 76 1.459 -3.502 -4.289 1.00 11.03 C ATOM 1152 CG HIS A 76 1.174 -4.395 -3.120 1.00 50.55 C ATOM 1153 ND1 HIS A 76 1.334 -5.763 -3.154 1.00 33.13 N ATOM 1154 CD2 HIS A 76 0.698 -4.107 -1.886 1.00 3.41 C ATOM 1155 CE1 HIS A 76 0.968 -6.275 -1.993 1.00 31.44 C ATOM 1156 NE2 HIS A 76 0.575 -5.291 -1.205 1.00 12.15 N ATOM 0 H HIS A 76 2.791 -1.778 -6.073 1.00 24.10 H new ATOM 0 HA HIS A 76 3.140 -2.633 -3.256 1.00 53.24 H new ATOM 0 HB2 HIS A 76 0.710 -2.711 -4.315 1.00 11.03 H new ATOM 0 HB3 HIS A 76 1.345 -4.080 -5.206 1.00 11.03 H new ATOM 0 HD2 HIS A 76 0.459 -3.124 -1.507 1.00 3.41 H new ATOM 0 HE1 HIS A 76 0.987 -7.323 -1.732 1.00 31.44 H new ATOM 0 HE2 HIS A 76 0.236 -5.394 -0.248 1.00 12.15 H new ATOM 1165 N ASP A 77 4.170 -4.893 -4.143 1.00 33.33 N ATOM 1166 CA ASP A 77 5.073 -5.930 -4.627 1.00 51.13 C ATOM 1167 C ASP A 77 4.459 -6.655 -5.826 1.00 70.21 C ATOM 1168 O ASP A 77 3.238 -6.828 -5.902 1.00 53.31 O ATOM 1169 CB ASP A 77 5.390 -6.920 -3.505 1.00 15.23 C ATOM 1170 CG ASP A 77 6.370 -7.989 -3.941 1.00 13.31 C ATOM 1171 OD1 ASP A 77 7.592 -7.779 -3.796 1.00 21.42 O ATOM 1172 OD2 ASP A 77 5.920 -9.038 -4.439 1.00 4.33 O ATOM 0 H ASP A 77 3.794 -5.065 -3.211 1.00 33.33 H new ATOM 0 HA ASP A 77 6.003 -5.462 -4.949 1.00 51.13 H new ATOM 0 HB2 ASP A 77 5.801 -6.380 -2.652 1.00 15.23 H new ATOM 0 HB3 ASP A 77 4.467 -7.392 -3.169 1.00 15.23 H new ATOM 1177 N TYR A 78 5.316 -7.085 -6.743 1.00 63.44 N ATOM 1178 CA TYR A 78 4.890 -7.613 -8.038 1.00 4.02 C ATOM 1179 C TYR A 78 4.623 -9.120 -8.010 1.00 62.31 C ATOM 1180 O TYR A 78 4.237 -9.702 -9.026 1.00 52.25 O ATOM 1181 CB TYR A 78 5.954 -7.292 -9.096 1.00 1.32 C ATOM 1182 CG TYR A 78 7.373 -7.425 -8.578 1.00 4.11 C ATOM 1183 CD1 TYR A 78 8.009 -8.658 -8.533 1.00 72.22 C ATOM 1184 CD2 TYR A 78 8.066 -6.312 -8.112 1.00 54.15 C ATOM 1185 CE1 TYR A 78 9.293 -8.779 -8.036 1.00 1.45 C ATOM 1186 CE2 TYR A 78 9.352 -6.425 -7.619 1.00 22.22 C ATOM 1187 CZ TYR A 78 9.959 -7.660 -7.580 1.00 52.30 C ATOM 1188 OH TYR A 78 11.236 -7.777 -7.073 1.00 70.30 O ATOM 0 H TYR A 78 6.328 -7.079 -6.612 1.00 63.44 H new ATOM 0 HA TYR A 78 3.945 -7.130 -8.288 1.00 4.02 H new ATOM 0 HB2 TYR A 78 5.822 -7.958 -9.948 1.00 1.32 H new ATOM 0 HB3 TYR A 78 5.801 -6.276 -9.459 1.00 1.32 H new ATOM 0 HD1 TYR A 78 7.493 -9.536 -8.892 1.00 72.22 H new ATOM 0 HD2 TYR A 78 7.590 -5.343 -8.136 1.00 54.15 H new ATOM 0 HE1 TYR A 78 9.773 -9.746 -8.005 1.00 1.45 H new ATOM 0 HE2 TYR A 78 9.878 -5.550 -7.266 1.00 22.22 H new ATOM 0 HH TYR A 78 11.561 -6.894 -6.797 1.00 70.30 H new ATOM 1198 N ALA A 79 4.822 -9.758 -6.866 1.00 43.34 N ATOM 1199 CA ALA A 79 4.575 -11.191 -6.755 1.00 74.44 C ATOM 1200 C ALA A 79 3.121 -11.469 -6.385 1.00 30.44 C ATOM 1201 O ALA A 79 2.608 -12.567 -6.615 1.00 63.34 O ATOM 1202 CB ALA A 79 5.513 -11.815 -5.733 1.00 31.12 C ATOM 0 H ALA A 79 5.150 -9.313 -6.009 1.00 43.34 H new ATOM 0 HA ALA A 79 4.769 -11.644 -7.727 1.00 74.44 H new ATOM 0 HB1 ALA A 79 5.315 -12.885 -5.663 1.00 31.12 H new ATOM 0 HB2 ALA A 79 6.546 -11.657 -6.043 1.00 31.12 H new ATOM 0 HB3 ALA A 79 5.351 -11.351 -4.760 1.00 31.12 H new ATOM 1208 N GLY A 80 2.458 -10.460 -5.835 1.00 14.42 N ATOM 1209 CA GLY A 80 1.093 -10.624 -5.366 1.00 14.54 C ATOM 1210 C GLY A 80 0.084 -10.759 -6.492 1.00 42.53 C ATOM 1211 O GLY A 80 -0.869 -11.529 -6.385 1.00 72.33 O ATOM 0 H GLY A 80 2.843 -9.525 -5.704 1.00 14.42 H new ATOM 0 HA2 GLY A 80 1.038 -11.508 -4.730 1.00 14.54 H new ATOM 0 HA3 GLY A 80 0.824 -9.769 -4.747 1.00 14.54 H new ATOM 1215 N ILE A 81 0.297 -10.024 -7.581 1.00 61.04 N ATOM 1216 CA ILE A 81 -0.654 -10.008 -8.693 1.00 3.14 C ATOM 1217 C ILE A 81 -0.902 -11.415 -9.249 1.00 20.15 C ATOM 1218 O ILE A 81 -2.046 -11.795 -9.508 1.00 42.25 O ATOM 1219 CB ILE A 81 -0.193 -9.066 -9.835 1.00 61.43 C ATOM 1220 CG1 ILE A 81 -1.190 -9.114 -11.001 1.00 1.53 C ATOM 1221 CG2 ILE A 81 1.211 -9.424 -10.307 1.00 32.43 C ATOM 1222 CD1 ILE A 81 -0.841 -8.189 -12.148 1.00 74.42 C ATOM 0 H ILE A 81 1.117 -9.433 -7.718 1.00 61.04 H new ATOM 0 HA ILE A 81 -1.591 -9.625 -8.288 1.00 3.14 H new ATOM 0 HB ILE A 81 -0.163 -8.048 -9.447 1.00 61.43 H new ATOM 0 HG12 ILE A 81 -1.246 -10.136 -11.376 1.00 1.53 H new ATOM 0 HG13 ILE A 81 -2.182 -8.856 -10.629 1.00 1.53 H new ATOM 0 HG21 ILE A 81 1.509 -8.748 -11.108 1.00 32.43 H new ATOM 0 HG22 ILE A 81 1.909 -9.331 -9.475 1.00 32.43 H new ATOM 0 HG23 ILE A 81 1.220 -10.450 -10.676 1.00 32.43 H new ATOM 0 HD11 ILE A 81 -1.593 -8.281 -12.932 1.00 74.42 H new ATOM 0 HD12 ILE A 81 -0.814 -7.160 -11.790 1.00 74.42 H new ATOM 0 HD13 ILE A 81 0.136 -8.459 -12.549 1.00 74.42 H new ATOM 1234 N ALA A 82 0.163 -12.192 -9.396 1.00 14.13 N ATOM 1235 CA ALA A 82 0.057 -13.538 -9.937 1.00 42.24 C ATOM 1236 C ALA A 82 -0.498 -14.497 -8.895 1.00 43.33 C ATOM 1237 O ALA A 82 -1.053 -15.541 -9.229 1.00 43.41 O ATOM 1238 CB ALA A 82 1.413 -14.021 -10.426 1.00 22.31 C ATOM 0 H ALA A 82 1.112 -11.911 -9.147 1.00 14.13 H new ATOM 0 HA ALA A 82 -0.632 -13.512 -10.781 1.00 42.24 H new ATOM 0 HB1 ALA A 82 1.317 -15.030 -10.828 1.00 22.31 H new ATOM 0 HB2 ALA A 82 1.778 -13.353 -11.206 1.00 22.31 H new ATOM 0 HB3 ALA A 82 2.118 -14.027 -9.595 1.00 22.31 H new ATOM 1244 N PHE A 83 -0.359 -14.123 -7.633 1.00 42.42 N ATOM 1245 CA PHE A 83 -0.793 -14.968 -6.531 1.00 32.04 C ATOM 1246 C PHE A 83 -2.317 -14.963 -6.432 1.00 4.12 C ATOM 1247 O PHE A 83 -2.942 -16.006 -6.229 1.00 41.31 O ATOM 1248 CB PHE A 83 -0.168 -14.469 -5.226 1.00 23.12 C ATOM 1249 CG PHE A 83 0.085 -15.551 -4.214 1.00 22.41 C ATOM 1250 CD1 PHE A 83 1.283 -16.251 -4.222 1.00 41.23 C ATOM 1251 CD2 PHE A 83 -0.860 -15.866 -3.254 1.00 73.41 C ATOM 1252 CE1 PHE A 83 1.530 -17.243 -3.295 1.00 74.31 C ATOM 1253 CE2 PHE A 83 -0.617 -16.859 -2.323 1.00 12.52 C ATOM 1254 CZ PHE A 83 0.579 -17.547 -2.342 1.00 61.41 C ATOM 0 H PHE A 83 0.053 -13.235 -7.345 1.00 42.42 H new ATOM 0 HA PHE A 83 -0.465 -15.992 -6.711 1.00 32.04 H new ATOM 0 HB2 PHE A 83 0.775 -13.972 -5.454 1.00 23.12 H new ATOM 0 HB3 PHE A 83 -0.825 -13.720 -4.784 1.00 23.12 H new ATOM 0 HD1 PHE A 83 2.032 -16.016 -4.964 1.00 41.23 H new ATOM 0 HD2 PHE A 83 -1.798 -15.331 -3.231 1.00 73.41 H new ATOM 0 HE1 PHE A 83 2.466 -17.781 -3.315 1.00 74.31 H new ATOM 0 HE2 PHE A 83 -1.364 -17.096 -1.580 1.00 12.52 H new ATOM 0 HZ PHE A 83 0.770 -18.321 -1.613 1.00 61.41 H new ATOM 1264 N TRP A 84 -2.911 -13.785 -6.599 1.00 5.14 N ATOM 1265 CA TRP A 84 -4.363 -13.640 -6.548 1.00 20.14 C ATOM 1266 C TRP A 84 -5.032 -14.270 -7.767 1.00 11.53 C ATOM 1267 O TRP A 84 -6.001 -15.016 -7.634 1.00 62.32 O ATOM 1268 CB TRP A 84 -4.759 -12.161 -6.467 1.00 15.20 C ATOM 1269 CG TRP A 84 -4.455 -11.518 -5.150 1.00 1.54 C ATOM 1270 CD1 TRP A 84 -3.295 -10.903 -4.785 1.00 10.13 C ATOM 1271 CD2 TRP A 84 -5.334 -11.413 -4.026 1.00 24.02 C ATOM 1272 NE1 TRP A 84 -3.393 -10.430 -3.502 1.00 41.31 N ATOM 1273 CE2 TRP A 84 -4.635 -10.731 -3.012 1.00 44.33 C ATOM 1274 CE3 TRP A 84 -6.642 -11.837 -3.775 1.00 41.13 C ATOM 1275 CZ2 TRP A 84 -5.205 -10.457 -1.770 1.00 12.24 C ATOM 1276 CZ3 TRP A 84 -7.206 -11.565 -2.544 1.00 23.43 C ATOM 1277 CH2 TRP A 84 -6.488 -10.884 -1.553 1.00 32.23 C ATOM 0 H TRP A 84 -2.408 -12.915 -6.771 1.00 5.14 H new ATOM 0 HA TRP A 84 -4.705 -14.159 -5.653 1.00 20.14 H new ATOM 0 HB2 TRP A 84 -4.241 -11.614 -7.255 1.00 15.20 H new ATOM 0 HB3 TRP A 84 -5.827 -12.071 -6.665 1.00 15.20 H new ATOM 0 HD1 TRP A 84 -2.424 -10.803 -5.416 1.00 10.13 H new ATOM 0 HE1 TRP A 84 -2.660 -9.934 -2.995 1.00 41.31 H new ATOM 0 HE3 TRP A 84 -7.202 -12.368 -4.531 1.00 41.13 H new ATOM 0 HZ2 TRP A 84 -4.655 -9.927 -1.006 1.00 12.24 H new ATOM 0 HZ3 TRP A 84 -8.218 -11.883 -2.342 1.00 23.43 H new ATOM 0 HH2 TRP A 84 -6.955 -10.692 -0.599 1.00 32.23 H new ATOM 1288 N ALA A 85 -4.495 -13.987 -8.948 1.00 64.10 N ATOM 1289 CA ALA A 85 -5.136 -14.384 -10.204 1.00 71.12 C ATOM 1290 C ALA A 85 -5.019 -15.884 -10.471 1.00 33.35 C ATOM 1291 O ALA A 85 -5.574 -16.390 -11.446 1.00 41.30 O ATOM 1292 CB ALA A 85 -4.549 -13.592 -11.364 1.00 35.04 C ATOM 0 H ALA A 85 -3.616 -13.483 -9.066 1.00 64.10 H new ATOM 0 HA ALA A 85 -6.198 -14.159 -10.110 1.00 71.12 H new ATOM 0 HB1 ALA A 85 -5.032 -13.895 -12.293 1.00 35.04 H new ATOM 0 HB2 ALA A 85 -4.715 -12.527 -11.199 1.00 35.04 H new ATOM 0 HB3 ALA A 85 -3.479 -13.786 -11.432 1.00 35.04 H new ATOM 1298 N THR A 86 -4.291 -16.590 -9.621 1.00 60.21 N ATOM 1299 CA THR A 86 -4.200 -18.038 -9.735 1.00 65.00 C ATOM 1300 C THR A 86 -4.883 -18.709 -8.551 1.00 14.40 C ATOM 1301 O THR A 86 -4.873 -19.935 -8.424 1.00 32.15 O ATOM 1302 CB THR A 86 -2.736 -18.513 -9.832 1.00 24.31 C ATOM 1303 OG1 THR A 86 -1.963 -17.966 -8.755 1.00 11.01 O ATOM 1304 CG2 THR A 86 -2.121 -18.107 -11.164 1.00 71.51 C ATOM 0 H THR A 86 -3.758 -16.188 -8.850 1.00 60.21 H new ATOM 0 HA THR A 86 -4.709 -18.324 -10.656 1.00 65.00 H new ATOM 0 HB THR A 86 -2.729 -19.601 -9.762 1.00 24.31 H new ATOM 0 HG1 THR A 86 -1.643 -17.074 -9.003 1.00 11.01 H new ATOM 0 HG21 THR A 86 -1.088 -18.453 -11.209 1.00 71.51 H new ATOM 0 HG22 THR A 86 -2.689 -18.555 -11.979 1.00 71.51 H new ATOM 0 HG23 THR A 86 -2.144 -17.021 -11.260 1.00 71.51 H new ATOM 1312 N GLY A 87 -5.487 -17.895 -7.693 1.00 33.32 N ATOM 1313 CA GLY A 87 -6.162 -18.416 -6.523 1.00 43.24 C ATOM 1314 C GLY A 87 -5.204 -18.701 -5.384 1.00 62.31 C ATOM 1315 O GLY A 87 -4.533 -19.733 -5.375 1.00 74.52 O ATOM 0 H GLY A 87 -5.520 -16.880 -7.789 1.00 33.32 H new ATOM 0 HA2 GLY A 87 -6.914 -17.700 -6.191 1.00 43.24 H new ATOM 0 HA3 GLY A 87 -6.689 -19.332 -6.789 1.00 43.24 H new ATOM 1319 N GLU A 88 -5.122 -17.779 -4.432 1.00 45.02 N ATOM 1320 CA GLU A 88 -4.285 -17.971 -3.256 1.00 44.41 C ATOM 1321 C GLU A 88 -4.905 -18.997 -2.314 1.00 15.13 C ATOM 1322 O GLU A 88 -4.202 -19.693 -1.578 1.00 43.52 O ATOM 1323 CB GLU A 88 -4.047 -16.644 -2.528 1.00 60.35 C ATOM 1324 CG GLU A 88 -5.306 -15.840 -2.248 1.00 63.20 C ATOM 1325 CD GLU A 88 -5.012 -14.581 -1.459 1.00 21.05 C ATOM 1326 OE1 GLU A 88 -4.052 -13.863 -1.813 1.00 23.54 O ATOM 1327 OE2 GLU A 88 -5.718 -14.315 -0.465 1.00 44.33 O ATOM 0 H GLU A 88 -5.625 -16.892 -4.452 1.00 45.02 H new ATOM 0 HA GLU A 88 -3.319 -18.351 -3.590 1.00 44.41 H new ATOM 0 HB2 GLU A 88 -3.545 -16.849 -1.582 1.00 60.35 H new ATOM 0 HB3 GLU A 88 -3.368 -16.035 -3.124 1.00 60.35 H new ATOM 0 HG2 GLU A 88 -5.783 -15.574 -3.191 1.00 63.20 H new ATOM 0 HG3 GLU A 88 -6.015 -16.457 -1.695 1.00 63.20 H new ATOM 1334 N TRP A 89 -6.227 -19.092 -2.351 1.00 63.31 N ATOM 1335 CA TRP A 89 -6.941 -20.089 -1.571 1.00 32.23 C ATOM 1336 C TRP A 89 -7.261 -21.291 -2.451 1.00 3.30 C ATOM 1337 O TRP A 89 -6.874 -21.318 -3.620 1.00 4.11 O ATOM 1338 CB TRP A 89 -8.207 -19.489 -0.957 1.00 71.11 C ATOM 1339 CG TRP A 89 -7.902 -18.327 -0.069 1.00 44.22 C ATOM 1340 CD1 TRP A 89 -8.312 -17.042 -0.241 1.00 12.23 C ATOM 1341 CD2 TRP A 89 -7.093 -18.337 1.111 1.00 32.12 C ATOM 1342 NE1 TRP A 89 -7.823 -16.251 0.768 1.00 15.05 N ATOM 1343 CE2 TRP A 89 -7.069 -17.024 1.609 1.00 31.14 C ATOM 1344 CE3 TRP A 89 -6.392 -19.333 1.799 1.00 22.45 C ATOM 1345 CZ2 TRP A 89 -6.369 -16.677 2.760 1.00 33.02 C ATOM 1346 CZ3 TRP A 89 -5.695 -18.986 2.940 1.00 21.53 C ATOM 1347 CH2 TRP A 89 -5.689 -17.667 3.411 1.00 2.41 C ATOM 0 H TRP A 89 -6.826 -18.489 -2.914 1.00 63.31 H new ATOM 0 HA TRP A 89 -6.310 -20.423 -0.748 1.00 32.23 H new ATOM 0 HB2 TRP A 89 -8.880 -19.170 -1.753 1.00 71.11 H new ATOM 0 HB3 TRP A 89 -8.730 -20.255 -0.385 1.00 71.11 H new ATOM 0 HD1 TRP A 89 -8.932 -16.694 -1.054 1.00 12.23 H new ATOM 0 HE1 TRP A 89 -7.993 -15.251 0.874 1.00 15.05 H new ATOM 0 HE3 TRP A 89 -6.396 -20.353 1.445 1.00 22.45 H new ATOM 0 HZ2 TRP A 89 -6.363 -15.661 3.126 1.00 33.02 H new ATOM 0 HZ3 TRP A 89 -5.146 -19.744 3.478 1.00 21.53 H new ATOM 0 HH2 TRP A 89 -5.136 -17.428 4.307 1.00 2.41 H new ATOM 1358 N LYS A 90 -7.957 -22.277 -1.901 1.00 22.21 N ATOM 1359 CA LYS A 90 -8.196 -23.523 -2.616 1.00 42.13 C ATOM 1360 C LYS A 90 -9.103 -23.301 -3.821 1.00 44.50 C ATOM 1361 O LYS A 90 -10.269 -22.927 -3.682 1.00 30.02 O ATOM 1362 CB LYS A 90 -8.803 -24.577 -1.685 1.00 71.45 C ATOM 1363 CG LYS A 90 -8.723 -26.004 -2.222 1.00 20.42 C ATOM 1364 CD LYS A 90 -7.318 -26.592 -2.094 1.00 11.12 C ATOM 1365 CE LYS A 90 -6.331 -25.964 -3.070 1.00 72.41 C ATOM 1366 NZ LYS A 90 -4.936 -26.394 -2.802 1.00 12.42 N ATOM 0 H LYS A 90 -8.364 -22.239 -0.967 1.00 22.21 H new ATOM 0 HA LYS A 90 -7.233 -23.887 -2.975 1.00 42.13 H new ATOM 0 HB2 LYS A 90 -8.293 -24.533 -0.723 1.00 71.45 H new ATOM 0 HB3 LYS A 90 -9.848 -24.327 -1.503 1.00 71.45 H new ATOM 0 HG2 LYS A 90 -9.429 -26.634 -1.681 1.00 20.42 H new ATOM 0 HG3 LYS A 90 -9.025 -26.014 -3.269 1.00 20.42 H new ATOM 0 HD2 LYS A 90 -6.959 -26.447 -1.075 1.00 11.12 H new ATOM 0 HD3 LYS A 90 -7.361 -27.667 -2.267 1.00 11.12 H new ATOM 0 HE2 LYS A 90 -6.605 -26.237 -4.089 1.00 72.41 H new ATOM 0 HE3 LYS A 90 -6.395 -24.878 -3.002 1.00 72.41 H new ATOM 0 HZ1 LYS A 90 -4.296 -25.944 -3.488 1.00 12.42 H new ATOM 0 HZ2 LYS A 90 -4.665 -26.111 -1.839 1.00 12.42 H new ATOM 0 HZ3 LYS A 90 -4.868 -27.428 -2.892 1.00 12.42 H new ATOM 1380 N ALA A 91 -8.547 -23.516 -5.004 1.00 52.43 N ATOM 1381 CA ALA A 91 -9.286 -23.359 -6.243 1.00 45.43 C ATOM 1382 C ALA A 91 -10.115 -24.598 -6.554 1.00 65.11 C ATOM 1383 O ALA A 91 -9.638 -25.729 -6.438 1.00 4.21 O ATOM 1384 CB ALA A 91 -8.329 -23.059 -7.386 1.00 4.40 C ATOM 0 H ALA A 91 -7.576 -23.803 -5.130 1.00 52.43 H new ATOM 0 HA ALA A 91 -9.973 -22.521 -6.125 1.00 45.43 H new ATOM 0 HB1 ALA A 91 -8.893 -22.943 -8.312 1.00 4.40 H new ATOM 0 HB2 ALA A 91 -7.786 -22.138 -7.174 1.00 4.40 H new ATOM 0 HB3 ALA A 91 -7.621 -23.881 -7.493 1.00 4.40 H new ATOM 1390 N LYS A 92 -11.369 -24.375 -6.923 1.00 33.55 N ATOM 1391 CA LYS A 92 -12.229 -25.447 -7.387 1.00 5.43 C ATOM 1392 C LYS A 92 -11.784 -25.860 -8.788 1.00 12.03 C ATOM 1393 O LYS A 92 -11.203 -25.051 -9.515 1.00 21.43 O ATOM 1394 CB LYS A 92 -13.692 -24.985 -7.386 1.00 32.23 C ATOM 1395 CG LYS A 92 -14.703 -26.121 -7.411 1.00 73.13 C ATOM 1396 CD LYS A 92 -14.557 -27.025 -6.195 1.00 45.40 C ATOM 1397 CE LYS A 92 -15.732 -27.980 -6.060 1.00 12.23 C ATOM 1398 NZ LYS A 92 -15.533 -28.958 -4.954 1.00 32.02 N ATOM 0 H LYS A 92 -11.812 -23.456 -6.909 1.00 33.55 H new ATOM 0 HA LYS A 92 -12.152 -26.306 -6.721 1.00 5.43 H new ATOM 0 HB2 LYS A 92 -13.869 -24.376 -6.500 1.00 32.23 H new ATOM 0 HB3 LYS A 92 -13.860 -24.345 -8.252 1.00 32.23 H new ATOM 0 HG2 LYS A 92 -15.712 -25.711 -7.441 1.00 73.13 H new ATOM 0 HG3 LYS A 92 -14.570 -26.708 -8.320 1.00 73.13 H new ATOM 0 HD2 LYS A 92 -13.632 -27.596 -6.275 1.00 45.40 H new ATOM 0 HD3 LYS A 92 -14.479 -26.415 -5.295 1.00 45.40 H new ATOM 0 HE2 LYS A 92 -16.643 -27.410 -5.880 1.00 12.23 H new ATOM 0 HE3 LYS A 92 -15.872 -28.517 -6.998 1.00 12.23 H new ATOM 0 HZ1 LYS A 92 -16.357 -29.590 -4.897 1.00 32.02 H new ATOM 0 HZ2 LYS A 92 -14.678 -29.520 -5.138 1.00 32.02 H new ATOM 0 HZ3 LYS A 92 -15.425 -28.447 -4.054 1.00 32.02 H new ATOM 1412 N ASN A 93 -12.068 -27.107 -9.153 1.00 63.44 N ATOM 1413 CA ASN A 93 -11.550 -27.715 -10.385 1.00 2.42 C ATOM 1414 C ASN A 93 -11.717 -26.816 -11.607 1.00 43.34 C ATOM 1415 O ASN A 93 -10.792 -26.675 -12.405 1.00 71.43 O ATOM 1416 CB ASN A 93 -12.233 -29.060 -10.633 1.00 55.14 C ATOM 1417 CG ASN A 93 -12.080 -30.011 -9.463 1.00 2.53 C ATOM 1418 OD1 ASN A 93 -12.896 -30.006 -8.538 1.00 64.10 O ATOM 1419 ND2 ASN A 93 -11.041 -30.828 -9.489 1.00 10.21 N ATOM 0 H ASN A 93 -12.664 -27.729 -8.606 1.00 63.44 H new ATOM 0 HA ASN A 93 -10.480 -27.860 -10.239 1.00 2.42 H new ATOM 0 HB2 ASN A 93 -13.293 -28.896 -10.828 1.00 55.14 H new ATOM 0 HB3 ASN A 93 -11.812 -29.519 -11.528 1.00 55.14 H new ATOM 0 HD21 ASN A 93 -10.891 -31.487 -8.725 1.00 10.21 H new ATOM 0 HD22 ASN A 93 -10.390 -30.800 -10.273 1.00 10.21 H new ATOM 1426 N GLU A 94 -12.890 -26.225 -11.775 1.00 43.24 N ATOM 1427 CA GLU A 94 -13.118 -25.311 -12.887 1.00 23.12 C ATOM 1428 C GLU A 94 -13.580 -23.943 -12.393 1.00 62.22 C ATOM 1429 O GLU A 94 -13.096 -22.914 -12.860 1.00 22.03 O ATOM 1430 CB GLU A 94 -14.152 -25.892 -13.858 1.00 1.32 C ATOM 1431 CG GLU A 94 -14.400 -25.018 -15.078 1.00 61.23 C ATOM 1432 CD GLU A 94 -15.445 -25.591 -16.013 1.00 12.23 C ATOM 1433 OE1 GLU A 94 -16.650 -25.390 -15.755 1.00 74.25 O ATOM 1434 OE2 GLU A 94 -15.069 -26.233 -17.019 1.00 74.11 O ATOM 0 H GLU A 94 -13.694 -26.359 -11.162 1.00 43.24 H new ATOM 0 HA GLU A 94 -12.170 -25.184 -13.410 1.00 23.12 H new ATOM 0 HB2 GLU A 94 -13.816 -26.875 -14.188 1.00 1.32 H new ATOM 0 HB3 GLU A 94 -15.094 -26.038 -13.329 1.00 1.32 H new ATOM 0 HG2 GLU A 94 -14.717 -24.028 -14.751 1.00 61.23 H new ATOM 0 HG3 GLU A 94 -13.464 -24.889 -15.622 1.00 61.23 H new ATOM 1441 N PHE A 95 -14.499 -23.944 -11.430 1.00 14.23 N ATOM 1442 CA PHE A 95 -15.150 -22.713 -10.970 1.00 74.04 C ATOM 1443 C PHE A 95 -14.146 -21.626 -10.579 1.00 54.14 C ATOM 1444 O PHE A 95 -14.170 -20.529 -11.138 1.00 23.32 O ATOM 1445 CB PHE A 95 -16.077 -23.017 -9.792 1.00 43.32 C ATOM 1446 CG PHE A 95 -17.206 -23.946 -10.141 1.00 71.24 C ATOM 1447 CD1 PHE A 95 -18.354 -23.461 -10.744 1.00 74.15 C ATOM 1448 CD2 PHE A 95 -17.119 -25.302 -9.872 1.00 45.42 C ATOM 1449 CE1 PHE A 95 -19.392 -24.311 -11.070 1.00 44.05 C ATOM 1450 CE2 PHE A 95 -18.153 -26.158 -10.195 1.00 5.31 C ATOM 1451 CZ PHE A 95 -19.292 -25.662 -10.795 1.00 42.11 C ATOM 0 H PHE A 95 -14.813 -24.787 -10.949 1.00 14.23 H new ATOM 0 HA PHE A 95 -15.731 -22.327 -11.808 1.00 74.04 H new ATOM 0 HB2 PHE A 95 -15.492 -23.456 -8.984 1.00 43.32 H new ATOM 0 HB3 PHE A 95 -16.490 -22.082 -9.414 1.00 43.32 H new ATOM 0 HD1 PHE A 95 -18.438 -22.407 -10.962 1.00 74.15 H new ATOM 0 HD2 PHE A 95 -16.229 -25.695 -9.403 1.00 45.42 H new ATOM 0 HE1 PHE A 95 -20.282 -23.920 -11.540 1.00 44.05 H new ATOM 0 HE2 PHE A 95 -18.070 -27.213 -9.979 1.00 5.31 H new ATOM 0 HZ PHE A 95 -20.104 -26.328 -11.049 1.00 42.11 H new ATOM 1461 N THR A 96 -13.260 -21.925 -9.638 1.00 11.03 N ATOM 1462 CA THR A 96 -12.301 -20.932 -9.172 1.00 11.25 C ATOM 1463 C THR A 96 -11.237 -20.652 -10.234 1.00 5.22 C ATOM 1464 O THR A 96 -10.818 -19.510 -10.411 1.00 44.42 O ATOM 1465 CB THR A 96 -11.623 -21.372 -7.864 1.00 22.21 C ATOM 1466 OG1 THR A 96 -12.607 -21.894 -6.962 1.00 65.14 O ATOM 1467 CG2 THR A 96 -10.906 -20.199 -7.212 1.00 53.21 C ATOM 0 H THR A 96 -13.185 -22.837 -9.187 1.00 11.03 H new ATOM 0 HA THR A 96 -12.860 -20.016 -8.981 1.00 11.25 H new ATOM 0 HB THR A 96 -10.891 -22.145 -8.095 1.00 22.21 H new ATOM 0 HG1 THR A 96 -12.255 -21.876 -6.048 1.00 65.14 H new ATOM 0 HG21 THR A 96 -10.432 -20.530 -6.288 1.00 53.21 H new ATOM 0 HG22 THR A 96 -10.146 -19.814 -7.892 1.00 53.21 H new ATOM 0 HG23 THR A 96 -11.626 -19.411 -6.989 1.00 53.21 H new ATOM 1475 N GLN A 97 -10.818 -21.697 -10.945 1.00 45.42 N ATOM 1476 CA GLN A 97 -9.837 -21.565 -12.010 1.00 72.13 C ATOM 1477 C GLN A 97 -10.292 -20.553 -13.064 1.00 52.41 C ATOM 1478 O GLN A 97 -9.498 -19.750 -13.557 1.00 45.14 O ATOM 1479 CB GLN A 97 -9.606 -22.927 -12.656 1.00 41.53 C ATOM 1480 CG GLN A 97 -8.772 -23.875 -11.810 1.00 15.51 C ATOM 1481 CD GLN A 97 -7.358 -23.367 -11.589 1.00 70.43 C ATOM 1482 OE1 GLN A 97 -7.086 -22.655 -10.623 1.00 3.31 O ATOM 1483 NE2 GLN A 97 -6.451 -23.724 -12.485 1.00 24.10 N ATOM 0 H GLN A 97 -11.149 -22.651 -10.798 1.00 45.42 H new ATOM 0 HA GLN A 97 -8.905 -21.199 -11.579 1.00 72.13 H new ATOM 0 HB2 GLN A 97 -10.571 -23.390 -12.859 1.00 41.53 H new ATOM 0 HB3 GLN A 97 -9.113 -22.784 -13.617 1.00 41.53 H new ATOM 0 HG2 GLN A 97 -9.258 -24.018 -10.845 1.00 15.51 H new ATOM 0 HG3 GLN A 97 -8.732 -24.850 -12.295 1.00 15.51 H new ATOM 0 HE21 GLN A 97 -6.717 -24.316 -13.272 1.00 24.10 H new ATOM 0 HE22 GLN A 97 -5.486 -23.407 -12.388 1.00 24.10 H new ATOM 1492 N ALA A 98 -11.574 -20.603 -13.404 1.00 24.24 N ATOM 1493 CA ALA A 98 -12.150 -19.670 -14.361 1.00 45.43 C ATOM 1494 C ALA A 98 -12.353 -18.298 -13.730 1.00 55.42 C ATOM 1495 O ALA A 98 -12.071 -17.271 -14.347 1.00 41.31 O ATOM 1496 CB ALA A 98 -13.471 -20.206 -14.892 1.00 73.11 C ATOM 0 H ALA A 98 -12.236 -21.283 -13.029 1.00 24.24 H new ATOM 0 HA ALA A 98 -11.453 -19.563 -15.192 1.00 45.43 H new ATOM 0 HB1 ALA A 98 -13.890 -19.498 -15.607 1.00 73.11 H new ATOM 0 HB2 ALA A 98 -13.303 -21.163 -15.386 1.00 73.11 H new ATOM 0 HB3 ALA A 98 -14.168 -20.342 -14.065 1.00 73.11 H new ATOM 1502 N TYR A 99 -12.829 -18.289 -12.491 1.00 61.22 N ATOM 1503 CA TYR A 99 -13.127 -17.044 -11.790 1.00 3.13 C ATOM 1504 C TYR A 99 -11.865 -16.211 -11.575 1.00 60.22 C ATOM 1505 O TYR A 99 -11.883 -14.995 -11.748 1.00 5.20 O ATOM 1506 CB TYR A 99 -13.800 -17.339 -10.447 1.00 23.13 C ATOM 1507 CG TYR A 99 -14.368 -16.114 -9.768 1.00 33.31 C ATOM 1508 CD1 TYR A 99 -15.601 -15.600 -10.146 1.00 54.51 C ATOM 1509 CD2 TYR A 99 -13.673 -15.474 -8.749 1.00 40.33 C ATOM 1510 CE1 TYR A 99 -16.125 -14.481 -9.531 1.00 13.42 C ATOM 1511 CE2 TYR A 99 -14.192 -14.355 -8.127 1.00 3.35 C ATOM 1512 CZ TYR A 99 -15.417 -13.862 -8.522 1.00 14.21 C ATOM 1513 OH TYR A 99 -15.939 -12.748 -7.901 1.00 34.53 O ATOM 0 H TYR A 99 -13.018 -19.132 -11.949 1.00 61.22 H new ATOM 0 HA TYR A 99 -13.810 -16.465 -12.412 1.00 3.13 H new ATOM 0 HB2 TYR A 99 -14.602 -18.061 -10.604 1.00 23.13 H new ATOM 0 HB3 TYR A 99 -13.074 -17.808 -9.783 1.00 23.13 H new ATOM 0 HD1 TYR A 99 -16.159 -16.084 -10.934 1.00 54.51 H new ATOM 0 HD2 TYR A 99 -12.712 -15.857 -8.439 1.00 40.33 H new ATOM 0 HE1 TYR A 99 -17.085 -14.092 -9.838 1.00 13.42 H new ATOM 0 HE2 TYR A 99 -13.641 -13.869 -7.335 1.00 3.35 H new ATOM 0 HH TYR A 99 -15.316 -12.435 -7.213 1.00 34.53 H new ATOM 1523 N ALA A 100 -10.773 -16.871 -11.204 1.00 55.15 N ATOM 1524 CA ALA A 100 -9.496 -16.193 -10.997 1.00 72.13 C ATOM 1525 C ALA A 100 -8.943 -15.673 -12.317 1.00 52.21 C ATOM 1526 O ALA A 100 -8.304 -14.623 -12.367 1.00 12.24 O ATOM 1527 CB ALA A 100 -8.508 -17.142 -10.341 1.00 54.11 C ATOM 0 H ALA A 100 -10.746 -17.877 -11.040 1.00 55.15 H new ATOM 0 HA ALA A 100 -9.655 -15.339 -10.338 1.00 72.13 H new ATOM 0 HB1 ALA A 100 -7.558 -16.630 -10.189 1.00 54.11 H new ATOM 0 HB2 ALA A 100 -8.902 -17.469 -9.379 1.00 54.11 H new ATOM 0 HB3 ALA A 100 -8.355 -18.009 -10.984 1.00 54.11 H new ATOM 1533 N LYS A 101 -9.216 -16.407 -13.387 1.00 20.33 N ATOM 1534 CA LYS A 101 -8.757 -16.033 -14.716 1.00 22.05 C ATOM 1535 C LYS A 101 -9.517 -14.807 -15.217 1.00 74.35 C ATOM 1536 O LYS A 101 -8.959 -13.950 -15.904 1.00 45.50 O ATOM 1537 CB LYS A 101 -8.949 -17.201 -15.689 1.00 11.22 C ATOM 1538 CG LYS A 101 -8.410 -16.955 -17.097 1.00 30.34 C ATOM 1539 CD LYS A 101 -6.896 -17.129 -17.180 1.00 11.31 C ATOM 1540 CE LYS A 101 -6.136 -15.997 -16.501 1.00 42.34 C ATOM 1541 NZ LYS A 101 -4.668 -16.211 -16.564 1.00 24.44 N ATOM 0 H LYS A 101 -9.757 -17.271 -13.359 1.00 20.33 H new ATOM 0 HA LYS A 101 -7.696 -15.788 -14.660 1.00 22.05 H new ATOM 0 HB2 LYS A 101 -8.460 -18.084 -15.277 1.00 11.22 H new ATOM 0 HB3 LYS A 101 -10.013 -17.428 -15.757 1.00 11.22 H new ATOM 0 HG2 LYS A 101 -8.891 -17.643 -17.792 1.00 30.34 H new ATOM 0 HG3 LYS A 101 -8.675 -15.946 -17.413 1.00 30.34 H new ATOM 0 HD2 LYS A 101 -6.617 -18.076 -16.718 1.00 11.31 H new ATOM 0 HD3 LYS A 101 -6.598 -17.185 -18.227 1.00 11.31 H new ATOM 0 HE2 LYS A 101 -6.387 -15.051 -16.980 1.00 42.34 H new ATOM 0 HE3 LYS A 101 -6.449 -15.921 -15.460 1.00 42.34 H new ATOM 0 HZ1 LYS A 101 -4.182 -15.422 -16.092 1.00 24.44 H new ATOM 0 HZ2 LYS A 101 -4.426 -17.102 -16.086 1.00 24.44 H new ATOM 0 HZ3 LYS A 101 -4.367 -16.259 -17.558 1.00 24.44 H new ATOM 1555 N LEU A 102 -10.790 -14.726 -14.858 1.00 14.52 N ATOM 1556 CA LEU A 102 -11.644 -13.632 -15.299 1.00 50.03 C ATOM 1557 C LEU A 102 -11.813 -12.586 -14.204 1.00 10.31 C ATOM 1558 O LEU A 102 -12.669 -11.710 -14.299 1.00 42.12 O ATOM 1559 CB LEU A 102 -13.015 -14.169 -15.721 1.00 31.24 C ATOM 1560 CG LEU A 102 -12.993 -15.199 -16.852 1.00 22.42 C ATOM 1561 CD1 LEU A 102 -14.403 -15.664 -17.172 1.00 5.22 C ATOM 1562 CD2 LEU A 102 -12.328 -14.624 -18.093 1.00 43.30 C ATOM 0 H LEU A 102 -11.256 -15.408 -14.260 1.00 14.52 H new ATOM 0 HA LEU A 102 -11.163 -13.156 -16.154 1.00 50.03 H new ATOM 0 HB2 LEU A 102 -13.494 -14.619 -14.851 1.00 31.24 H new ATOM 0 HB3 LEU A 102 -13.637 -13.329 -16.029 1.00 31.24 H new ATOM 0 HG LEU A 102 -12.410 -16.058 -16.521 1.00 22.42 H new ATOM 0 HD11 LEU A 102 -14.370 -16.396 -17.979 1.00 5.22 H new ATOM 0 HD12 LEU A 102 -14.846 -16.119 -16.286 1.00 5.22 H new ATOM 0 HD13 LEU A 102 -15.006 -14.810 -17.481 1.00 5.22 H new ATOM 0 HD21 LEU A 102 -12.324 -15.374 -18.884 1.00 43.30 H new ATOM 0 HD22 LEU A 102 -12.880 -13.746 -18.428 1.00 43.30 H new ATOM 0 HD23 LEU A 102 -11.303 -14.339 -17.857 1.00 43.30 H new ATOM 1574 N MET A 103 -10.986 -12.667 -13.173 1.00 50.02 N ATOM 1575 CA MET A 103 -11.061 -11.721 -12.068 1.00 12.55 C ATOM 1576 C MET A 103 -10.579 -10.350 -12.524 1.00 4.40 C ATOM 1577 O MET A 103 -11.048 -9.319 -12.042 1.00 12.04 O ATOM 1578 CB MET A 103 -10.223 -12.208 -10.886 1.00 31.21 C ATOM 1579 CG MET A 103 -10.493 -11.450 -9.597 1.00 25.43 C ATOM 1580 SD MET A 103 -9.482 -12.030 -8.221 1.00 64.40 S ATOM 1581 CE MET A 103 -10.234 -11.147 -6.856 1.00 34.13 C ATOM 0 H MET A 103 -10.258 -13.375 -13.077 1.00 50.02 H new ATOM 0 HA MET A 103 -12.099 -11.644 -11.745 1.00 12.55 H new ATOM 0 HB2 MET A 103 -10.421 -13.267 -10.723 1.00 31.21 H new ATOM 0 HB3 MET A 103 -9.166 -12.116 -11.138 1.00 31.21 H new ATOM 0 HG2 MET A 103 -10.304 -10.389 -9.759 1.00 25.43 H new ATOM 0 HG3 MET A 103 -11.546 -11.550 -9.336 1.00 25.43 H new ATOM 0 HE1 MET A 103 -9.718 -11.401 -5.930 1.00 34.13 H new ATOM 0 HE2 MET A 103 -10.158 -10.074 -7.031 1.00 34.13 H new ATOM 0 HE3 MET A 103 -11.284 -11.428 -6.775 1.00 34.13 H new ATOM 1591 N ASN A 104 -9.645 -10.364 -13.471 1.00 33.23 N ATOM 1592 CA ASN A 104 -9.112 -9.143 -14.080 1.00 3.33 C ATOM 1593 C ASN A 104 -10.225 -8.328 -14.728 1.00 51.05 C ATOM 1594 O ASN A 104 -10.164 -7.101 -14.771 1.00 14.33 O ATOM 1595 CB ASN A 104 -8.068 -9.512 -15.137 1.00 14.53 C ATOM 1596 CG ASN A 104 -7.375 -8.309 -15.752 1.00 42.21 C ATOM 1597 OD1 ASN A 104 -7.833 -7.755 -16.753 1.00 63.01 O ATOM 1598 ND2 ASN A 104 -6.254 -7.907 -15.173 1.00 24.30 N ATOM 0 H ASN A 104 -9.234 -11.222 -13.840 1.00 33.23 H new ATOM 0 HA ASN A 104 -8.651 -8.540 -13.298 1.00 3.33 H new ATOM 0 HB2 ASN A 104 -7.318 -10.161 -14.684 1.00 14.53 H new ATOM 0 HB3 ASN A 104 -8.551 -10.086 -15.928 1.00 14.53 H new ATOM 0 HD21 ASN A 104 -5.739 -7.114 -15.555 1.00 24.30 H new ATOM 0 HD22 ASN A 104 -5.906 -8.391 -14.345 1.00 24.30 H new ATOM 1605 N GLN A 105 -11.231 -9.030 -15.233 1.00 10.04 N ATOM 1606 CA GLN A 105 -12.372 -8.412 -15.887 1.00 74.21 C ATOM 1607 C GLN A 105 -13.096 -7.452 -14.941 1.00 23.13 C ATOM 1608 O GLN A 105 -13.388 -6.312 -15.303 1.00 33.50 O ATOM 1609 CB GLN A 105 -13.311 -9.524 -16.359 1.00 44.25 C ATOM 1610 CG GLN A 105 -14.219 -9.161 -17.514 1.00 62.53 C ATOM 1611 CD GLN A 105 -15.491 -8.454 -17.082 1.00 60.05 C ATOM 1612 OE1 GLN A 105 -16.495 -9.095 -16.768 1.00 4.25 O ATOM 1613 NE2 GLN A 105 -15.474 -7.132 -17.093 1.00 31.41 N ATOM 0 H GLN A 105 -11.277 -10.048 -15.199 1.00 10.04 H new ATOM 0 HA GLN A 105 -12.033 -7.823 -16.740 1.00 74.21 H new ATOM 0 HB2 GLN A 105 -12.709 -10.385 -16.649 1.00 44.25 H new ATOM 0 HB3 GLN A 105 -13.929 -9.836 -15.517 1.00 44.25 H new ATOM 0 HG2 GLN A 105 -13.674 -8.521 -18.208 1.00 62.53 H new ATOM 0 HG3 GLN A 105 -14.483 -10.068 -18.058 1.00 62.53 H new ATOM 0 HE21 GLN A 105 -14.624 -6.635 -17.359 1.00 31.41 H new ATOM 0 HE22 GLN A 105 -16.311 -6.609 -16.836 1.00 31.41 H new ATOM 1622 N TYR A 106 -13.362 -7.906 -13.721 1.00 44.30 N ATOM 1623 CA TYR A 106 -14.080 -7.083 -12.755 1.00 53.41 C ATOM 1624 C TYR A 106 -13.128 -6.149 -12.020 1.00 2.33 C ATOM 1625 O TYR A 106 -13.463 -4.995 -11.746 1.00 3.55 O ATOM 1626 CB TYR A 106 -14.837 -7.953 -11.744 1.00 3.23 C ATOM 1627 CG TYR A 106 -15.629 -7.141 -10.739 1.00 42.04 C ATOM 1628 CD1 TYR A 106 -16.875 -6.621 -11.066 1.00 33.10 C ATOM 1629 CD2 TYR A 106 -15.119 -6.873 -9.473 1.00 12.53 C ATOM 1630 CE1 TYR A 106 -17.589 -5.861 -10.161 1.00 45.51 C ATOM 1631 CE2 TYR A 106 -15.827 -6.110 -8.565 1.00 50.14 C ATOM 1632 CZ TYR A 106 -17.061 -5.607 -8.914 1.00 44.04 C ATOM 1633 OH TYR A 106 -17.767 -4.840 -8.015 1.00 45.54 O ATOM 0 H TYR A 106 -13.095 -8.829 -13.380 1.00 44.30 H new ATOM 0 HA TYR A 106 -14.802 -6.483 -13.310 1.00 53.41 H new ATOM 0 HB2 TYR A 106 -15.514 -8.617 -12.280 1.00 3.23 H new ATOM 0 HB3 TYR A 106 -14.125 -8.585 -11.212 1.00 3.23 H new ATOM 0 HD1 TYR A 106 -17.292 -6.814 -12.043 1.00 33.10 H new ATOM 0 HD2 TYR A 106 -14.153 -7.268 -9.195 1.00 12.53 H new ATOM 0 HE1 TYR A 106 -18.558 -5.467 -10.430 1.00 45.51 H new ATOM 0 HE2 TYR A 106 -15.415 -5.909 -7.587 1.00 50.14 H new ATOM 0 HH TYR A 106 -17.256 -4.757 -7.183 1.00 45.54 H new ATOM 1643 N ARG A 107 -11.941 -6.650 -11.694 1.00 41.23 N ATOM 1644 CA ARG A 107 -10.965 -5.857 -10.961 1.00 33.10 C ATOM 1645 C ARG A 107 -10.447 -4.715 -11.828 1.00 44.53 C ATOM 1646 O ARG A 107 -9.791 -4.938 -12.845 1.00 71.14 O ATOM 1647 CB ARG A 107 -9.798 -6.737 -10.494 1.00 72.01 C ATOM 1648 CG ARG A 107 -8.644 -5.956 -9.882 1.00 73.10 C ATOM 1649 CD ARG A 107 -7.498 -6.872 -9.479 1.00 30.55 C ATOM 1650 NE ARG A 107 -7.781 -7.613 -8.248 1.00 13.12 N ATOM 1651 CZ ARG A 107 -7.130 -8.714 -7.870 1.00 61.22 C ATOM 1652 NH1 ARG A 107 -6.215 -9.254 -8.668 1.00 22.25 N ATOM 1653 NH2 ARG A 107 -7.393 -9.280 -6.694 1.00 55.32 N ATOM 0 H ARG A 107 -11.634 -7.595 -11.925 1.00 41.23 H new ATOM 0 HA ARG A 107 -11.456 -5.435 -10.084 1.00 33.10 H new ATOM 0 HB2 ARG A 107 -10.167 -7.455 -9.761 1.00 72.01 H new ATOM 0 HB3 ARG A 107 -9.426 -7.311 -11.343 1.00 72.01 H new ATOM 0 HG2 ARG A 107 -8.285 -5.216 -10.598 1.00 73.10 H new ATOM 0 HG3 ARG A 107 -8.997 -5.409 -9.008 1.00 73.10 H new ATOM 0 HD2 ARG A 107 -7.299 -7.577 -10.286 1.00 30.55 H new ATOM 0 HD3 ARG A 107 -6.593 -6.279 -9.343 1.00 30.55 H new ATOM 0 HE ARG A 107 -8.523 -7.265 -7.641 1.00 13.12 H new ATOM 0 HH11 ARG A 107 -6.010 -8.826 -9.571 1.00 22.25 H new ATOM 0 HH12 ARG A 107 -5.718 -10.096 -8.378 1.00 22.25 H new ATOM 0 HH21 ARG A 107 -8.095 -8.872 -6.077 1.00 55.32 H new ATOM 0 HH22 ARG A 107 -6.892 -10.122 -6.410 1.00 55.32 H new ATOM 1667 N GLY A 108 -10.750 -3.496 -11.417 1.00 12.41 N ATOM 1668 CA GLY A 108 -10.254 -2.331 -12.116 1.00 50.02 C ATOM 1669 C GLY A 108 -10.130 -1.142 -11.196 1.00 72.04 C ATOM 1670 O GLY A 108 -10.046 -0.008 -11.646 1.00 43.13 O ATOM 0 H GLY A 108 -11.334 -3.291 -10.607 1.00 12.41 H new ATOM 0 HA2 GLY A 108 -9.282 -2.556 -12.554 1.00 50.02 H new ATOM 0 HA3 GLY A 108 -10.926 -2.086 -12.939 1.00 50.02 H new ATOM 1674 N ILE A 109 -10.128 -1.411 -9.896 1.00 14.23 N ATOM 1675 CA ILE A 109 -10.040 -0.358 -8.892 1.00 74.21 C ATOM 1676 C ILE A 109 -8.629 0.193 -8.825 1.00 65.01 C ATOM 1677 O ILE A 109 -8.423 1.396 -8.688 1.00 34.35 O ATOM 1678 CB ILE A 109 -10.403 -0.886 -7.490 1.00 54.23 C ATOM 1679 CG1 ILE A 109 -11.605 -1.826 -7.562 1.00 65.45 C ATOM 1680 CG2 ILE A 109 -10.694 0.278 -6.555 1.00 32.45 C ATOM 1681 CD1 ILE A 109 -11.867 -2.572 -6.270 1.00 5.43 C ATOM 0 H ILE A 109 -10.187 -2.354 -9.511 1.00 14.23 H new ATOM 0 HA ILE A 109 -10.744 0.420 -9.186 1.00 74.21 H new ATOM 0 HB ILE A 109 -9.555 -1.448 -7.099 1.00 54.23 H new ATOM 0 HG12 ILE A 109 -12.492 -1.250 -7.826 1.00 65.45 H new ATOM 0 HG13 ILE A 109 -11.444 -2.548 -8.363 1.00 65.45 H new ATOM 0 HG21 ILE A 109 -10.950 -0.104 -5.567 1.00 32.45 H new ATOM 0 HG22 ILE A 109 -9.812 0.914 -6.481 1.00 32.45 H new ATOM 0 HG23 ILE A 109 -11.529 0.859 -6.946 1.00 32.45 H new ATOM 0 HD11 ILE A 109 -12.734 -3.221 -6.394 1.00 5.43 H new ATOM 0 HD12 ILE A 109 -10.996 -3.176 -6.015 1.00 5.43 H new ATOM 0 HD13 ILE A 109 -12.060 -1.857 -5.470 1.00 5.43 H new ATOM 1693 N TYR A 110 -7.664 -0.702 -8.932 1.00 74.13 N ATOM 1694 CA TYR A 110 -6.274 -0.340 -8.761 1.00 50.51 C ATOM 1695 C TYR A 110 -5.400 -1.061 -9.767 1.00 71.14 C ATOM 1696 O TYR A 110 -5.711 -2.173 -10.196 1.00 41.30 O ATOM 1697 CB TYR A 110 -5.811 -0.648 -7.331 1.00 50.21 C ATOM 1698 CG TYR A 110 -6.119 -2.055 -6.862 1.00 65.31 C ATOM 1699 CD1 TYR A 110 -5.217 -3.092 -7.061 1.00 43.43 C ATOM 1700 CD2 TYR A 110 -7.310 -2.339 -6.208 1.00 51.34 C ATOM 1701 CE1 TYR A 110 -5.497 -4.373 -6.626 1.00 71.40 C ATOM 1702 CE2 TYR A 110 -7.598 -3.617 -5.773 1.00 64.51 C ATOM 1703 CZ TYR A 110 -6.688 -4.628 -5.983 1.00 72.54 C ATOM 1704 OH TYR A 110 -6.972 -5.902 -5.547 1.00 44.42 O ATOM 0 H TYR A 110 -7.821 -1.689 -9.138 1.00 74.13 H new ATOM 0 HA TYR A 110 -6.179 0.732 -8.934 1.00 50.51 H new ATOM 0 HB2 TYR A 110 -4.735 -0.484 -7.267 1.00 50.21 H new ATOM 0 HB3 TYR A 110 -6.282 0.060 -6.649 1.00 50.21 H new ATOM 0 HD1 TYR A 110 -4.282 -2.894 -7.564 1.00 43.43 H new ATOM 0 HD2 TYR A 110 -8.023 -1.547 -6.037 1.00 51.34 H new ATOM 0 HE1 TYR A 110 -4.786 -5.170 -6.789 1.00 71.40 H new ATOM 0 HE2 TYR A 110 -8.532 -3.822 -5.271 1.00 64.51 H new ATOM 0 HH TYR A 110 -7.851 -5.911 -5.113 1.00 44.42 H new ATOM 1714 N SER A 111 -4.320 -0.410 -10.151 1.00 23.21 N ATOM 1715 CA SER A 111 -3.357 -0.991 -11.065 1.00 32.05 C ATOM 1716 C SER A 111 -1.973 -0.437 -10.760 1.00 74.42 C ATOM 1717 O SER A 111 -1.844 0.560 -10.044 1.00 60.42 O ATOM 1718 CB SER A 111 -3.746 -0.680 -12.514 1.00 44.35 C ATOM 1719 OG SER A 111 -5.062 -1.128 -12.794 1.00 44.14 O ATOM 0 H SER A 111 -4.086 0.533 -9.840 1.00 23.21 H new ATOM 0 HA SER A 111 -3.347 -2.073 -10.937 1.00 32.05 H new ATOM 0 HB2 SER A 111 -3.678 0.394 -12.690 1.00 44.35 H new ATOM 0 HB3 SER A 111 -3.042 -1.160 -13.194 1.00 44.35 H new ATOM 0 HG SER A 111 -5.288 -0.917 -13.724 1.00 44.14 H new ATOM 1725 N PHE A 112 -0.945 -1.083 -11.283 1.00 44.43 N ATOM 1726 CA PHE A 112 0.415 -0.613 -11.082 1.00 42.23 C ATOM 1727 C PHE A 112 1.188 -0.642 -12.391 1.00 1.22 C ATOM 1728 O PHE A 112 1.005 -1.540 -13.215 1.00 71.23 O ATOM 1729 CB PHE A 112 1.135 -1.441 -10.006 1.00 54.32 C ATOM 1730 CG PHE A 112 1.252 -2.909 -10.315 1.00 71.12 C ATOM 1731 CD1 PHE A 112 0.232 -3.787 -9.987 1.00 74.11 C ATOM 1732 CD2 PHE A 112 2.389 -3.411 -10.931 1.00 34.35 C ATOM 1733 CE1 PHE A 112 0.339 -5.134 -10.269 1.00 1.55 C ATOM 1734 CE2 PHE A 112 2.502 -4.758 -11.214 1.00 22.13 C ATOM 1735 CZ PHE A 112 1.476 -5.620 -10.883 1.00 11.13 C ATOM 0 H PHE A 112 -1.025 -1.929 -11.847 1.00 44.43 H new ATOM 0 HA PHE A 112 0.367 0.418 -10.732 1.00 42.23 H new ATOM 0 HB2 PHE A 112 2.136 -1.033 -9.862 1.00 54.32 H new ATOM 0 HB3 PHE A 112 0.604 -1.324 -9.061 1.00 54.32 H new ATOM 0 HD1 PHE A 112 -0.659 -3.413 -9.504 1.00 74.11 H new ATOM 0 HD2 PHE A 112 3.195 -2.741 -11.192 1.00 34.35 H new ATOM 0 HE1 PHE A 112 -0.465 -5.807 -10.010 1.00 1.55 H new ATOM 0 HE2 PHE A 112 3.392 -5.137 -11.694 1.00 22.13 H new ATOM 0 HZ PHE A 112 1.563 -6.674 -11.104 1.00 11.13 H new ATOM 1745 N GLU A 113 2.023 0.361 -12.582 1.00 4.05 N ATOM 1746 CA GLU A 113 2.859 0.458 -13.763 1.00 64.32 C ATOM 1747 C GLU A 113 4.204 1.023 -13.339 1.00 14.32 C ATOM 1748 O GLU A 113 4.257 1.976 -12.557 1.00 32.24 O ATOM 1749 CB GLU A 113 2.181 1.354 -14.807 1.00 45.45 C ATOM 1750 CG GLU A 113 2.470 0.971 -16.255 1.00 11.22 C ATOM 1751 CD GLU A 113 3.816 1.447 -16.761 1.00 44.24 C ATOM 1752 OE1 GLU A 113 3.898 2.589 -17.256 1.00 23.15 O ATOM 1753 OE2 GLU A 113 4.792 0.674 -16.698 1.00 1.22 O ATOM 0 H GLU A 113 2.141 1.131 -11.924 1.00 4.05 H new ATOM 0 HA GLU A 113 3.006 -0.522 -14.218 1.00 64.32 H new ATOM 0 HB2 GLU A 113 1.103 1.326 -14.646 1.00 45.45 H new ATOM 0 HB3 GLU A 113 2.501 2.383 -14.646 1.00 45.45 H new ATOM 0 HG2 GLU A 113 2.420 -0.114 -16.350 1.00 11.22 H new ATOM 0 HG3 GLU A 113 1.687 1.383 -16.892 1.00 11.22 H new ATOM 1760 N LYS A 114 5.283 0.418 -13.807 1.00 24.21 N ATOM 1761 CA LYS A 114 6.612 0.815 -13.374 1.00 41.22 C ATOM 1762 C LYS A 114 6.990 2.174 -13.958 1.00 63.31 C ATOM 1763 O LYS A 114 7.558 2.264 -15.050 1.00 30.23 O ATOM 1764 CB LYS A 114 7.652 -0.245 -13.753 1.00 51.13 C ATOM 1765 CG LYS A 114 9.019 -0.002 -13.137 1.00 20.15 C ATOM 1766 CD LYS A 114 8.923 0.096 -11.622 1.00 22.23 C ATOM 1767 CE LYS A 114 10.265 0.408 -10.988 1.00 73.13 C ATOM 1768 NZ LYS A 114 10.141 0.613 -9.521 1.00 12.03 N ATOM 0 H LYS A 114 5.265 -0.346 -14.483 1.00 24.21 H new ATOM 0 HA LYS A 114 6.598 0.902 -12.288 1.00 41.22 H new ATOM 0 HB2 LYS A 114 7.291 -1.225 -13.440 1.00 51.13 H new ATOM 0 HB3 LYS A 114 7.751 -0.273 -14.838 1.00 51.13 H new ATOM 0 HG2 LYS A 114 9.695 -0.812 -13.411 1.00 20.15 H new ATOM 0 HG3 LYS A 114 9.445 0.918 -13.539 1.00 20.15 H new ATOM 0 HD2 LYS A 114 8.206 0.872 -11.353 1.00 22.23 H new ATOM 0 HD3 LYS A 114 8.542 -0.843 -11.221 1.00 22.23 H new ATOM 0 HE2 LYS A 114 10.960 -0.408 -11.185 1.00 73.13 H new ATOM 0 HE3 LYS A 114 10.686 1.303 -11.447 1.00 73.13 H new ATOM 0 HZ1 LYS A 114 11.077 0.824 -9.120 1.00 12.03 H new ATOM 0 HZ2 LYS A 114 9.497 1.408 -9.335 1.00 12.03 H new ATOM 0 HZ3 LYS A 114 9.762 -0.250 -9.081 1.00 12.03 H new ATOM 1782 N VAL A 115 6.641 3.226 -13.233 1.00 25.31 N ATOM 1783 CA VAL A 115 6.954 4.584 -13.642 1.00 15.30 C ATOM 1784 C VAL A 115 7.708 5.305 -12.531 1.00 34.11 C ATOM 1785 O VAL A 115 7.105 5.756 -11.551 1.00 41.25 O ATOM 1786 CB VAL A 115 5.684 5.399 -13.969 1.00 4.21 C ATOM 1787 CG1 VAL A 115 6.049 6.729 -14.609 1.00 53.42 C ATOM 1788 CG2 VAL A 115 4.737 4.616 -14.865 1.00 54.32 C ATOM 0 H VAL A 115 6.136 3.162 -12.349 1.00 25.31 H new ATOM 0 HA VAL A 115 7.566 4.510 -14.541 1.00 15.30 H new ATOM 0 HB VAL A 115 5.167 5.597 -13.030 1.00 4.21 H new ATOM 0 HG11 VAL A 115 5.140 7.287 -14.831 1.00 53.42 H new ATOM 0 HG12 VAL A 115 6.670 7.305 -13.923 1.00 53.42 H new ATOM 0 HG13 VAL A 115 6.600 6.549 -15.532 1.00 53.42 H new ATOM 0 HG21 VAL A 115 3.854 5.219 -15.076 1.00 54.32 H new ATOM 0 HG22 VAL A 115 5.240 4.371 -15.800 1.00 54.32 H new ATOM 0 HG23 VAL A 115 4.437 3.696 -14.362 1.00 54.32 H new ATOM 1798 N LYS A 116 9.022 5.389 -12.663 1.00 60.23 N ATOM 1799 CA LYS A 116 9.825 6.140 -11.713 1.00 65.24 C ATOM 1800 C LYS A 116 9.709 7.627 -12.034 1.00 33.25 C ATOM 1801 O LYS A 116 10.529 8.190 -12.759 1.00 63.54 O ATOM 1802 CB LYS A 116 11.291 5.683 -11.759 1.00 52.25 C ATOM 1803 CG LYS A 116 12.059 5.888 -10.454 1.00 63.33 C ATOM 1804 CD LYS A 116 12.187 7.356 -10.074 1.00 42.21 C ATOM 1805 CE LYS A 116 12.974 7.541 -8.786 1.00 41.34 C ATOM 1806 NZ LYS A 116 14.378 7.071 -8.916 1.00 63.32 N ATOM 0 H LYS A 116 9.553 4.949 -13.415 1.00 60.23 H new ATOM 0 HA LYS A 116 9.457 5.959 -10.703 1.00 65.24 H new ATOM 0 HB2 LYS A 116 11.321 4.625 -12.021 1.00 52.25 H new ATOM 0 HB3 LYS A 116 11.802 6.223 -12.556 1.00 52.25 H new ATOM 0 HG2 LYS A 116 11.553 5.352 -9.651 1.00 63.33 H new ATOM 0 HG3 LYS A 116 13.054 5.453 -10.550 1.00 63.33 H new ATOM 0 HD2 LYS A 116 12.679 7.899 -10.881 1.00 42.21 H new ATOM 0 HD3 LYS A 116 11.193 7.789 -9.958 1.00 42.21 H new ATOM 0 HE2 LYS A 116 12.969 8.595 -8.507 1.00 41.34 H new ATOM 0 HE3 LYS A 116 12.483 6.996 -7.980 1.00 41.34 H new ATOM 0 HZ1 LYS A 116 14.934 7.411 -8.105 1.00 63.32 H new ATOM 0 HZ2 LYS A 116 14.396 6.031 -8.937 1.00 63.32 H new ATOM 0 HZ3 LYS A 116 14.788 7.442 -9.797 1.00 63.32 H new ATOM 1820 N ALA A 117 8.656 8.237 -11.515 1.00 13.52 N ATOM 1821 CA ALA A 117 8.392 9.653 -11.731 1.00 12.01 C ATOM 1822 C ALA A 117 7.691 10.236 -10.514 1.00 43.34 C ATOM 1823 O ALA A 117 8.133 11.233 -9.944 1.00 43.21 O ATOM 1824 CB ALA A 117 7.548 9.850 -12.982 1.00 44.43 C ATOM 0 H ALA A 117 7.961 7.768 -10.934 1.00 13.52 H new ATOM 0 HA ALA A 117 9.339 10.174 -11.875 1.00 12.01 H new ATOM 0 HB1 ALA A 117 7.359 10.913 -13.130 1.00 44.43 H new ATOM 0 HB2 ALA A 117 8.080 9.452 -13.846 1.00 44.43 H new ATOM 0 HB3 ALA A 117 6.599 9.326 -12.867 1.00 44.43 H new ATOM 1830 N HIS A 118 6.607 9.589 -10.098 1.00 22.31 N ATOM 1831 CA HIS A 118 5.917 9.972 -8.866 1.00 42.32 C ATOM 1832 C HIS A 118 6.634 9.370 -7.659 1.00 41.12 C ATOM 1833 O HIS A 118 6.116 9.361 -6.547 1.00 12.13 O ATOM 1834 CB HIS A 118 4.437 9.538 -8.897 1.00 14.12 C ATOM 1835 CG HIS A 118 4.195 8.049 -8.873 1.00 73.04 C ATOM 1836 ND1 HIS A 118 3.047 7.485 -8.359 1.00 43.21 N ATOM 1837 CD2 HIS A 118 4.944 7.012 -9.325 1.00 30.43 C ATOM 1838 CE1 HIS A 118 3.101 6.175 -8.491 1.00 65.51 C ATOM 1839 NE2 HIS A 118 4.242 5.859 -9.075 1.00 71.31 N ATOM 0 H HIS A 118 6.187 8.801 -10.591 1.00 22.31 H new ATOM 0 HA HIS A 118 5.938 11.059 -8.783 1.00 42.32 H new ATOM 0 HB2 HIS A 118 3.928 9.985 -8.043 1.00 14.12 H new ATOM 0 HB3 HIS A 118 3.975 9.949 -9.795 1.00 14.12 H new ATOM 0 HD1 HIS A 118 2.274 8.002 -7.941 1.00 43.21 H new ATOM 0 HD2 HIS A 118 5.914 7.081 -9.795 1.00 30.43 H new ATOM 0 HE1 HIS A 118 2.340 5.477 -8.175 1.00 65.51 H new ATOM 1848 N SER A 119 7.837 8.869 -7.907 1.00 64.33 N ATOM 1849 CA SER A 119 8.658 8.260 -6.878 1.00 13.21 C ATOM 1850 C SER A 119 9.687 9.264 -6.361 1.00 50.22 C ATOM 1851 O SER A 119 10.620 8.907 -5.641 1.00 52.15 O ATOM 1852 CB SER A 119 9.355 7.030 -7.455 1.00 23.02 C ATOM 1853 OG SER A 119 8.443 6.248 -8.211 1.00 54.43 O ATOM 0 H SER A 119 8.269 8.875 -8.831 1.00 64.33 H new ATOM 0 HA SER A 119 8.028 7.957 -6.042 1.00 13.21 H new ATOM 0 HB2 SER A 119 10.187 7.340 -8.087 1.00 23.02 H new ATOM 0 HB3 SER A 119 9.774 6.430 -6.647 1.00 23.02 H new ATOM 0 HG SER A 119 8.907 5.465 -8.575 1.00 54.43 H new ATOM 1859 N GLY A 120 9.503 10.523 -6.744 1.00 33.51 N ATOM 1860 CA GLY A 120 10.381 11.585 -6.295 1.00 31.12 C ATOM 1861 C GLY A 120 9.601 12.824 -5.907 1.00 13.31 C ATOM 1862 O GLY A 120 10.076 13.949 -6.067 1.00 11.52 O ATOM 0 H GLY A 120 8.753 10.828 -7.364 1.00 33.51 H new ATOM 0 HA2 GLY A 120 10.965 11.239 -5.442 1.00 31.12 H new ATOM 0 HA3 GLY A 120 11.089 11.832 -7.086 1.00 31.12 H new ATOM 1866 N ASN A 121 8.400 12.607 -5.391 1.00 2.35 N ATOM 1867 CA ASN A 121 7.504 13.693 -5.023 1.00 10.50 C ATOM 1868 C ASN A 121 7.711 14.059 -3.556 1.00 1.51 C ATOM 1869 O ASN A 121 8.352 13.316 -2.814 1.00 4.13 O ATOM 1870 CB ASN A 121 6.052 13.265 -5.283 1.00 62.13 C ATOM 1871 CG ASN A 121 5.047 14.390 -5.107 1.00 32.03 C ATOM 1872 OD1 ASN A 121 5.366 15.563 -5.283 1.00 23.21 O ATOM 1873 ND2 ASN A 121 3.824 14.037 -4.765 1.00 13.13 N ATOM 0 H ASN A 121 8.020 11.677 -5.216 1.00 2.35 H new ATOM 0 HA ASN A 121 7.722 14.573 -5.628 1.00 10.50 H new ATOM 0 HB2 ASN A 121 5.973 12.874 -6.297 1.00 62.13 H new ATOM 0 HB3 ASN A 121 5.795 12.450 -4.606 1.00 62.13 H new ATOM 0 HD21 ASN A 121 3.105 14.749 -4.638 1.00 13.13 H new ATOM 0 HD22 ASN A 121 3.597 13.052 -4.628 1.00 13.13 H new ATOM 1880 N GLU A 122 7.170 15.198 -3.143 1.00 0.44 N ATOM 1881 CA GLU A 122 7.332 15.695 -1.778 1.00 2.21 C ATOM 1882 C GLU A 122 6.864 14.666 -0.743 1.00 4.14 C ATOM 1883 O GLU A 122 7.436 14.556 0.344 1.00 3.34 O ATOM 1884 CB GLU A 122 6.542 16.992 -1.611 1.00 1.52 C ATOM 1885 CG GLU A 122 6.825 17.719 -0.311 1.00 42.00 C ATOM 1886 CD GLU A 122 8.252 18.212 -0.215 1.00 10.24 C ATOM 1887 OE1 GLU A 122 8.534 19.325 -0.707 1.00 12.50 O ATOM 1888 OE2 GLU A 122 9.097 17.496 0.357 1.00 20.22 O ATOM 0 H GLU A 122 6.608 15.804 -3.741 1.00 0.44 H new ATOM 0 HA GLU A 122 8.393 15.880 -1.608 1.00 2.21 H new ATOM 0 HB2 GLU A 122 6.771 17.656 -2.445 1.00 1.52 H new ATOM 0 HB3 GLU A 122 5.477 16.767 -1.666 1.00 1.52 H new ATOM 0 HG2 GLU A 122 6.145 18.566 -0.218 1.00 42.00 H new ATOM 0 HG3 GLU A 122 6.619 17.052 0.526 1.00 42.00 H new ATOM 1895 N PHE A 123 5.829 13.915 -1.095 1.00 53.14 N ATOM 1896 CA PHE A 123 5.262 12.904 -0.201 1.00 33.25 C ATOM 1897 C PHE A 123 6.239 11.755 0.036 1.00 72.34 C ATOM 1898 O PHE A 123 6.190 11.094 1.071 1.00 33.44 O ATOM 1899 CB PHE A 123 3.945 12.363 -0.762 1.00 23.24 C ATOM 1900 CG PHE A 123 2.818 13.363 -0.748 1.00 51.11 C ATOM 1901 CD1 PHE A 123 2.686 14.293 -1.765 1.00 1.31 C ATOM 1902 CD2 PHE A 123 1.893 13.370 0.285 1.00 44.10 C ATOM 1903 CE1 PHE A 123 1.653 15.212 -1.754 1.00 71.42 C ATOM 1904 CE2 PHE A 123 0.858 14.284 0.301 1.00 64.51 C ATOM 1905 CZ PHE A 123 0.738 15.207 -0.719 1.00 0.25 C ATOM 0 H PHE A 123 5.360 13.985 -1.998 1.00 53.14 H new ATOM 0 HA PHE A 123 5.068 13.388 0.756 1.00 33.25 H new ATOM 0 HB2 PHE A 123 4.108 12.029 -1.787 1.00 23.24 H new ATOM 0 HB3 PHE A 123 3.648 11.488 -0.185 1.00 23.24 H new ATOM 0 HD1 PHE A 123 3.398 14.301 -2.577 1.00 1.31 H new ATOM 0 HD2 PHE A 123 1.983 12.652 1.087 1.00 44.10 H new ATOM 0 HE1 PHE A 123 1.562 15.933 -2.553 1.00 71.42 H new ATOM 0 HE2 PHE A 123 0.143 14.277 1.110 1.00 64.51 H new ATOM 0 HZ PHE A 123 -0.070 15.924 -0.708 1.00 0.25 H new ATOM 1915 N ASN A 124 7.132 11.527 -0.919 1.00 74.54 N ATOM 1916 CA ASN A 124 8.121 10.458 -0.801 1.00 15.12 C ATOM 1917 C ASN A 124 9.052 10.714 0.375 1.00 25.15 C ATOM 1918 O ASN A 124 9.426 9.789 1.090 1.00 65.35 O ATOM 1919 CB ASN A 124 8.931 10.319 -2.091 1.00 50.13 C ATOM 1920 CG ASN A 124 8.118 9.744 -3.230 1.00 11.42 C ATOM 1921 OD1 ASN A 124 7.442 10.468 -3.955 1.00 71.45 O ATOM 1922 ND2 ASN A 124 8.202 8.439 -3.415 1.00 0.44 N ATOM 0 H ASN A 124 7.193 12.066 -1.783 1.00 74.54 H new ATOM 0 HA ASN A 124 7.585 9.525 -0.627 1.00 15.12 H new ATOM 0 HB2 ASN A 124 9.315 11.297 -2.381 1.00 50.13 H new ATOM 0 HB3 ASN A 124 9.794 9.679 -1.906 1.00 50.13 H new ATOM 0 HD21 ASN A 124 7.694 7.999 -4.182 1.00 0.44 H new ATOM 0 HD22 ASN A 124 8.775 7.871 -2.790 1.00 0.44 H new ATOM 1929 N ASP A 125 9.406 11.977 0.584 1.00 4.25 N ATOM 1930 CA ASP A 125 10.274 12.349 1.696 1.00 44.41 C ATOM 1931 C ASP A 125 9.530 12.207 3.020 1.00 21.21 C ATOM 1932 O ASP A 125 10.129 11.910 4.051 1.00 4.14 O ATOM 1933 CB ASP A 125 10.783 13.784 1.527 1.00 1.32 C ATOM 1934 CG ASP A 125 11.657 14.238 2.685 1.00 43.22 C ATOM 1935 OD1 ASP A 125 12.872 13.929 2.686 1.00 72.44 O ATOM 1936 OD2 ASP A 125 11.141 14.928 3.589 1.00 72.13 O ATOM 0 H ASP A 125 9.107 12.758 0.001 1.00 4.25 H new ATOM 0 HA ASP A 125 11.132 11.676 1.701 1.00 44.41 H new ATOM 0 HB2 ASP A 125 11.350 13.857 0.599 1.00 1.32 H new ATOM 0 HB3 ASP A 125 9.932 14.458 1.434 1.00 1.32 H new ATOM 1941 N TYR A 126 8.215 12.401 2.975 1.00 15.43 N ATOM 1942 CA TYR A 126 7.380 12.292 4.164 1.00 42.32 C ATOM 1943 C TYR A 126 7.471 10.889 4.761 1.00 13.04 C ATOM 1944 O TYR A 126 7.728 10.731 5.954 1.00 21.04 O ATOM 1945 CB TYR A 126 5.925 12.633 3.820 1.00 21.22 C ATOM 1946 CG TYR A 126 4.985 12.591 5.003 1.00 24.43 C ATOM 1947 CD1 TYR A 126 4.979 13.611 5.945 1.00 41.03 C ATOM 1948 CD2 TYR A 126 4.103 11.533 5.176 1.00 21.02 C ATOM 1949 CE1 TYR A 126 4.121 13.576 7.027 1.00 51.41 C ATOM 1950 CE2 TYR A 126 3.241 11.492 6.257 1.00 12.21 C ATOM 1951 CZ TYR A 126 3.257 12.514 7.179 1.00 1.21 C ATOM 1952 OH TYR A 126 2.402 12.476 8.259 1.00 11.30 O ATOM 0 H TYR A 126 7.704 12.635 2.124 1.00 15.43 H new ATOM 0 HA TYR A 126 7.742 13.003 4.907 1.00 42.32 H new ATOM 0 HB2 TYR A 126 5.891 13.629 3.378 1.00 21.22 H new ATOM 0 HB3 TYR A 126 5.569 11.935 3.062 1.00 21.22 H new ATOM 0 HD1 TYR A 126 5.656 14.445 5.830 1.00 41.03 H new ATOM 0 HD2 TYR A 126 4.090 10.729 4.455 1.00 21.02 H new ATOM 0 HE1 TYR A 126 4.128 14.378 7.751 1.00 51.41 H new ATOM 0 HE2 TYR A 126 2.559 10.663 6.377 1.00 12.21 H new ATOM 0 HH TYR A 126 1.859 11.661 8.218 1.00 11.30 H new ATOM 1962 N VAL A 127 7.282 9.876 3.924 1.00 44.23 N ATOM 1963 CA VAL A 127 7.358 8.492 4.382 1.00 11.41 C ATOM 1964 C VAL A 127 8.818 8.067 4.578 1.00 73.00 C ATOM 1965 O VAL A 127 9.132 7.261 5.459 1.00 71.33 O ATOM 1966 CB VAL A 127 6.640 7.526 3.406 1.00 0.55 C ATOM 1967 CG1 VAL A 127 7.286 7.541 2.028 1.00 43.32 C ATOM 1968 CG2 VAL A 127 6.610 6.115 3.971 1.00 75.42 C ATOM 0 H VAL A 127 7.076 9.984 2.931 1.00 44.23 H new ATOM 0 HA VAL A 127 6.844 8.436 5.342 1.00 11.41 H new ATOM 0 HB VAL A 127 5.614 7.875 3.292 1.00 0.55 H new ATOM 0 HG11 VAL A 127 6.756 6.852 1.370 1.00 43.32 H new ATOM 0 HG12 VAL A 127 7.237 8.548 1.614 1.00 43.32 H new ATOM 0 HG13 VAL A 127 8.328 7.234 2.112 1.00 43.32 H new ATOM 0 HG21 VAL A 127 6.101 5.453 3.270 1.00 75.42 H new ATOM 0 HG22 VAL A 127 7.630 5.764 4.127 1.00 75.42 H new ATOM 0 HG23 VAL A 127 6.077 6.115 4.922 1.00 75.42 H new ATOM 1978 N ASP A 128 9.708 8.637 3.765 1.00 53.40 N ATOM 1979 CA ASP A 128 11.141 8.362 3.872 1.00 75.23 C ATOM 1980 C ASP A 128 11.645 8.709 5.268 1.00 62.23 C ATOM 1981 O ASP A 128 12.293 7.895 5.920 1.00 10.33 O ATOM 1982 CB ASP A 128 11.916 9.152 2.809 1.00 62.31 C ATOM 1983 CG ASP A 128 13.415 8.906 2.851 1.00 43.23 C ATOM 1984 OD1 ASP A 128 13.854 7.800 2.473 1.00 64.43 O ATOM 1985 OD2 ASP A 128 14.162 9.826 3.245 1.00 33.42 O ATOM 0 H ASP A 128 9.461 9.293 3.024 1.00 53.40 H new ATOM 0 HA ASP A 128 11.305 7.298 3.700 1.00 75.23 H new ATOM 0 HB2 ASP A 128 11.539 8.886 1.822 1.00 62.31 H new ATOM 0 HB3 ASP A 128 11.726 10.216 2.947 1.00 62.31 H new ATOM 1990 N MET A 129 11.314 9.911 5.734 1.00 23.23 N ATOM 1991 CA MET A 129 11.705 10.348 7.072 1.00 22.20 C ATOM 1992 C MET A 129 10.908 9.603 8.145 1.00 72.53 C ATOM 1993 O MET A 129 11.393 9.394 9.258 1.00 73.52 O ATOM 1994 CB MET A 129 11.546 11.865 7.240 1.00 30.12 C ATOM 1995 CG MET A 129 10.110 12.356 7.226 1.00 32.45 C ATOM 1996 SD MET A 129 9.996 14.145 7.418 1.00 54.25 S ATOM 1997 CE MET A 129 8.220 14.362 7.402 1.00 24.32 C ATOM 0 H MET A 129 10.777 10.599 5.206 1.00 23.23 H new ATOM 0 HA MET A 129 12.761 10.108 7.197 1.00 22.20 H new ATOM 0 HB2 MET A 129 12.009 12.163 8.181 1.00 30.12 H new ATOM 0 HB3 MET A 129 12.095 12.365 6.442 1.00 30.12 H new ATOM 0 HG2 MET A 129 9.637 12.063 6.289 1.00 32.45 H new ATOM 0 HG3 MET A 129 9.555 11.871 8.029 1.00 32.45 H new ATOM 0 HE1 MET A 129 7.948 15.079 6.627 1.00 24.32 H new ATOM 0 HE2 MET A 129 7.738 13.406 7.197 1.00 24.32 H new ATOM 0 HE3 MET A 129 7.890 14.734 8.372 1.00 24.32 H new ATOM 2007 N LYS A 130 9.679 9.222 7.808 1.00 71.43 N ATOM 2008 CA LYS A 130 8.815 8.495 8.731 1.00 63.32 C ATOM 2009 C LYS A 130 9.487 7.190 9.161 1.00 34.51 C ATOM 2010 O LYS A 130 9.647 6.926 10.354 1.00 11.41 O ATOM 2011 CB LYS A 130 7.468 8.210 8.060 1.00 3.22 C ATOM 2012 CG LYS A 130 6.287 8.121 9.017 1.00 11.02 C ATOM 2013 CD LYS A 130 6.347 6.891 9.910 1.00 52.32 C ATOM 2014 CE LYS A 130 5.098 6.781 10.765 1.00 64.12 C ATOM 2015 NZ LYS A 130 5.174 5.648 11.724 1.00 5.42 N ATOM 0 H LYS A 130 9.258 9.406 6.897 1.00 71.43 H new ATOM 0 HA LYS A 130 8.644 9.103 9.619 1.00 63.32 H new ATOM 0 HB2 LYS A 130 7.268 8.994 7.330 1.00 3.22 H new ATOM 0 HB3 LYS A 130 7.543 7.273 7.509 1.00 3.22 H new ATOM 0 HG2 LYS A 130 6.260 9.016 9.639 1.00 11.02 H new ATOM 0 HG3 LYS A 130 5.360 8.104 8.443 1.00 11.02 H new ATOM 0 HD2 LYS A 130 6.453 5.996 9.297 1.00 52.32 H new ATOM 0 HD3 LYS A 130 7.227 6.944 10.550 1.00 52.32 H new ATOM 0 HE2 LYS A 130 4.952 7.711 11.314 1.00 64.12 H new ATOM 0 HE3 LYS A 130 4.228 6.652 10.121 1.00 64.12 H new ATOM 0 HZ1 LYS A 130 4.300 5.611 12.287 1.00 5.42 H new ATOM 0 HZ2 LYS A 130 5.287 4.757 11.200 1.00 5.42 H new ATOM 0 HZ3 LYS A 130 5.988 5.783 12.357 1.00 5.42 H new ATOM 2029 N ALA A 131 9.899 6.390 8.182 1.00 1.31 N ATOM 2030 CA ALA A 131 10.602 5.143 8.460 1.00 41.51 C ATOM 2031 C ALA A 131 12.009 5.426 8.975 1.00 43.02 C ATOM 2032 O ALA A 131 12.550 4.684 9.792 1.00 54.42 O ATOM 2033 CB ALA A 131 10.654 4.273 7.213 1.00 41.12 C ATOM 0 H ALA A 131 9.758 6.583 7.190 1.00 1.31 H new ATOM 0 HA ALA A 131 10.056 4.604 9.234 1.00 41.51 H new ATOM 0 HB1 ALA A 131 11.182 3.346 7.438 1.00 41.12 H new ATOM 0 HB2 ALA A 131 9.640 4.043 6.887 1.00 41.12 H new ATOM 0 HB3 ALA A 131 11.178 4.806 6.419 1.00 41.12 H new ATOM 2039 N LYS A 132 12.580 6.523 8.494 1.00 12.31 N ATOM 2040 CA LYS A 132 13.914 6.965 8.891 1.00 40.01 C ATOM 2041 C LYS A 132 14.005 7.172 10.402 1.00 50.12 C ATOM 2042 O LYS A 132 15.037 6.895 11.014 1.00 15.12 O ATOM 2043 CB LYS A 132 14.233 8.268 8.161 1.00 14.11 C ATOM 2044 CG LYS A 132 15.655 8.767 8.315 1.00 41.22 C ATOM 2045 CD LYS A 132 15.873 10.010 7.465 1.00 62.20 C ATOM 2046 CE LYS A 132 15.526 9.743 6.007 1.00 24.50 C ATOM 2047 NZ LYS A 132 15.603 10.965 5.165 1.00 72.24 N ATOM 0 H LYS A 132 12.130 7.135 7.814 1.00 12.31 H new ATOM 0 HA LYS A 132 14.638 6.195 8.623 1.00 40.01 H new ATOM 0 HB2 LYS A 132 14.027 8.130 7.100 1.00 14.11 H new ATOM 0 HB3 LYS A 132 13.554 9.041 8.519 1.00 14.11 H new ATOM 0 HG2 LYS A 132 15.857 8.994 9.362 1.00 41.22 H new ATOM 0 HG3 LYS A 132 16.356 7.987 8.017 1.00 41.22 H new ATOM 0 HD2 LYS A 132 15.259 10.827 7.845 1.00 62.20 H new ATOM 0 HD3 LYS A 132 16.912 10.330 7.542 1.00 62.20 H new ATOM 0 HE2 LYS A 132 16.205 8.989 5.609 1.00 24.50 H new ATOM 0 HE3 LYS A 132 14.520 9.329 5.948 1.00 24.50 H new ATOM 0 HZ1 LYS A 132 15.260 10.749 4.207 1.00 72.24 H new ATOM 0 HZ2 LYS A 132 15.013 11.713 5.583 1.00 72.24 H new ATOM 0 HZ3 LYS A 132 16.590 11.290 5.114 1.00 72.24 H new ATOM 2061 N SER A 133 12.914 7.641 10.998 1.00 33.14 N ATOM 2062 CA SER A 133 12.871 7.895 12.432 1.00 72.43 C ATOM 2063 C SER A 133 12.994 6.591 13.218 1.00 72.02 C ATOM 2064 O SER A 133 13.573 6.558 14.302 1.00 13.54 O ATOM 2065 CB SER A 133 11.571 8.616 12.795 1.00 25.23 C ATOM 2066 OG SER A 133 11.441 9.829 12.067 1.00 44.03 O ATOM 0 H SER A 133 12.045 7.853 10.507 1.00 33.14 H new ATOM 0 HA SER A 133 13.716 8.531 12.697 1.00 72.43 H new ATOM 0 HB2 SER A 133 10.720 7.968 12.584 1.00 25.23 H new ATOM 0 HB3 SER A 133 11.554 8.826 13.864 1.00 25.23 H new ATOM 0 HG SER A 133 11.366 9.630 11.110 1.00 44.03 H new ATOM 2072 N ALA A 134 12.464 5.511 12.647 1.00 44.45 N ATOM 2073 CA ALA A 134 12.527 4.196 13.276 1.00 3.12 C ATOM 2074 C ALA A 134 13.912 3.577 13.104 1.00 72.54 C ATOM 2075 O ALA A 134 14.209 2.524 13.667 1.00 72.52 O ATOM 2076 CB ALA A 134 11.460 3.274 12.699 1.00 73.04 C ATOM 0 H ALA A 134 11.985 5.523 11.747 1.00 44.45 H new ATOM 0 HA ALA A 134 12.338 4.322 14.342 1.00 3.12 H new ATOM 0 HB1 ALA A 134 11.523 2.298 13.181 1.00 73.04 H new ATOM 0 HB2 ALA A 134 10.474 3.703 12.876 1.00 73.04 H new ATOM 0 HB3 ALA A 134 11.619 3.160 11.627 1.00 73.04 H new ATOM 2082 N LEU A 135 14.752 4.240 12.317 1.00 0.30 N ATOM 2083 CA LEU A 135 16.104 3.763 12.053 1.00 24.23 C ATOM 2084 C LEU A 135 17.106 4.455 12.971 1.00 61.04 C ATOM 2085 O LEU A 135 18.293 4.126 12.981 1.00 63.00 O ATOM 2086 CB LEU A 135 16.470 4.011 10.588 1.00 34.14 C ATOM 2087 CG LEU A 135 15.561 3.326 9.565 1.00 71.51 C ATOM 2088 CD1 LEU A 135 15.921 3.758 8.152 1.00 72.44 C ATOM 2089 CD2 LEU A 135 15.651 1.813 9.703 1.00 23.43 C ATOM 0 H LEU A 135 14.518 5.115 11.848 1.00 0.30 H new ATOM 0 HA LEU A 135 16.139 2.692 12.251 1.00 24.23 H new ATOM 0 HB2 LEU A 135 16.454 5.085 10.403 1.00 34.14 H new ATOM 0 HB3 LEU A 135 17.494 3.674 10.424 1.00 34.14 H new ATOM 0 HG LEU A 135 14.533 3.629 9.761 1.00 71.51 H new ATOM 0 HD11 LEU A 135 15.263 3.259 7.440 1.00 72.44 H new ATOM 0 HD12 LEU A 135 15.803 4.838 8.060 1.00 72.44 H new ATOM 0 HD13 LEU A 135 16.955 3.487 7.941 1.00 72.44 H new ATOM 0 HD21 LEU A 135 14.999 1.341 8.968 1.00 23.43 H new ATOM 0 HD22 LEU A 135 16.679 1.493 9.534 1.00 23.43 H new ATOM 0 HD23 LEU A 135 15.340 1.520 10.706 1.00 23.43 H new ATOM 2101 N GLY A 136 16.621 5.420 13.741 1.00 30.42 N ATOM 2102 CA GLY A 136 17.478 6.125 14.673 1.00 13.21 C ATOM 2103 C GLY A 136 17.916 7.475 14.151 1.00 23.04 C ATOM 2104 O GLY A 136 18.552 8.250 14.863 1.00 53.10 O ATOM 0 H GLY A 136 15.648 5.727 13.737 1.00 30.42 H new ATOM 0 HA2 GLY A 136 16.950 6.258 15.617 1.00 13.21 H new ATOM 0 HA3 GLY A 136 18.358 5.517 14.883 1.00 13.21 H new ATOM 2108 N ILE A 137 17.590 7.762 12.905 1.00 34.03 N ATOM 2109 CA ILE A 137 17.929 9.047 12.321 1.00 30.31 C ATOM 2110 C ILE A 137 16.846 10.058 12.660 1.00 1.14 C ATOM 2111 O ILE A 137 15.682 9.860 12.313 1.00 53.44 O ATOM 2112 CB ILE A 137 18.109 8.955 10.793 1.00 2.21 C ATOM 2113 CG1 ILE A 137 19.159 7.892 10.453 1.00 23.44 C ATOM 2114 CG2 ILE A 137 18.508 10.310 10.220 1.00 42.11 C ATOM 2115 CD1 ILE A 137 19.375 7.697 8.968 1.00 24.42 C ATOM 0 H ILE A 137 17.093 7.127 12.280 1.00 34.03 H new ATOM 0 HA ILE A 137 18.882 9.368 12.742 1.00 30.31 H new ATOM 0 HB ILE A 137 17.160 8.664 10.343 1.00 2.21 H new ATOM 0 HG12 ILE A 137 20.106 8.170 10.915 1.00 23.44 H new ATOM 0 HG13 ILE A 137 18.856 6.942 10.894 1.00 23.44 H new ATOM 0 HG21 ILE A 137 18.631 10.227 9.140 1.00 42.11 H new ATOM 0 HG22 ILE A 137 17.731 11.042 10.441 1.00 42.11 H new ATOM 0 HG23 ILE A 137 19.448 10.632 10.668 1.00 42.11 H new ATOM 0 HD11 ILE A 137 20.132 6.929 8.808 1.00 24.42 H new ATOM 0 HD12 ILE A 137 18.440 7.387 8.502 1.00 24.42 H new ATOM 0 HD13 ILE A 137 19.709 8.634 8.523 1.00 24.42 H new ATOM 2127 N ARG A 138 17.245 11.125 13.353 1.00 14.03 N ATOM 2128 CA ARG A 138 16.317 12.132 13.861 1.00 41.41 C ATOM 2129 C ARG A 138 15.466 11.518 14.974 1.00 24.41 C ATOM 2130 O ARG A 138 14.236 11.561 14.954 1.00 12.44 O ATOM 2131 CB ARG A 138 15.455 12.708 12.720 1.00 45.42 C ATOM 2132 CG ARG A 138 14.472 13.796 13.141 1.00 44.34 C ATOM 2133 CD ARG A 138 13.805 14.435 11.932 1.00 70.11 C ATOM 2134 NE ARG A 138 12.571 15.143 12.281 1.00 15.32 N ATOM 2135 CZ ARG A 138 12.441 16.469 12.307 1.00 75.02 C ATOM 2136 NH1 ARG A 138 13.481 17.257 12.060 1.00 52.21 N ATOM 2137 NH2 ARG A 138 11.258 17.003 12.581 1.00 15.31 N ATOM 0 H ARG A 138 18.222 11.314 13.577 1.00 14.03 H new ATOM 0 HA ARG A 138 16.877 12.968 14.281 1.00 41.41 H new ATOM 0 HB2 ARG A 138 16.116 13.113 11.954 1.00 45.42 H new ATOM 0 HB3 ARG A 138 14.896 11.893 12.260 1.00 45.42 H new ATOM 0 HG2 ARG A 138 13.712 13.369 13.795 1.00 44.34 H new ATOM 0 HG3 ARG A 138 14.996 14.560 13.716 1.00 44.34 H new ATOM 0 HD2 ARG A 138 14.500 15.132 11.464 1.00 70.11 H new ATOM 0 HD3 ARG A 138 13.582 13.664 11.195 1.00 70.11 H new ATOM 0 HE ARG A 138 11.754 14.582 12.521 1.00 15.32 H new ATOM 0 HH11 ARG A 138 14.391 16.849 11.848 1.00 52.21 H new ATOM 0 HH12 ARG A 138 13.370 18.271 12.083 1.00 52.21 H new ATOM 0 HH21 ARG A 138 10.457 16.400 12.770 1.00 15.31 H new ATOM 0 HH22 ARG A 138 11.149 18.017 12.603 1.00 15.31 H new ATOM 2151 N ASP A 139 16.153 10.944 15.959 1.00 75.04 N ATOM 2152 CA ASP A 139 15.498 10.356 17.121 1.00 64.02 C ATOM 2153 C ASP A 139 16.347 10.605 18.368 1.00 11.01 C ATOM 2154 O ASP A 139 17.557 10.831 18.270 1.00 24.12 O ATOM 2155 CB ASP A 139 15.240 8.850 16.905 1.00 60.13 C ATOM 2156 CG ASP A 139 15.986 7.954 17.877 1.00 72.13 C ATOM 2157 OD1 ASP A 139 15.429 7.645 18.955 1.00 25.14 O ATOM 2158 OD2 ASP A 139 17.120 7.543 17.563 1.00 31.04 O ATOM 0 H ASP A 139 17.171 10.874 15.973 1.00 75.04 H new ATOM 0 HA ASP A 139 14.527 10.831 17.262 1.00 64.02 H new ATOM 0 HB2 ASP A 139 14.171 8.658 16.996 1.00 60.13 H new ATOM 0 HB3 ASP A 139 15.527 8.584 15.887 1.00 60.13 H new ATOM 2163 N LEU A 140 15.712 10.570 19.532 1.00 74.21 N ATOM 2164 CA LEU A 140 16.358 10.965 20.780 1.00 30.51 C ATOM 2165 C LEU A 140 17.343 9.905 21.281 1.00 13.10 C ATOM 2166 O LEU A 140 18.380 10.241 21.857 1.00 62.11 O ATOM 2167 CB LEU A 140 15.279 11.254 21.844 1.00 70.23 C ATOM 2168 CG LEU A 140 15.738 11.989 23.119 1.00 3.13 C ATOM 2169 CD1 LEU A 140 16.411 11.041 24.103 1.00 40.01 C ATOM 2170 CD2 LEU A 140 16.674 13.136 22.763 1.00 34.33 C ATOM 0 H LEU A 140 14.743 10.270 19.640 1.00 74.21 H new ATOM 0 HA LEU A 140 16.939 11.868 20.591 1.00 30.51 H new ATOM 0 HB2 LEU A 140 14.491 11.845 21.377 1.00 70.23 H new ATOM 0 HB3 LEU A 140 14.832 10.305 22.141 1.00 70.23 H new ATOM 0 HG LEU A 140 14.850 12.394 23.604 1.00 3.13 H new ATOM 0 HD11 LEU A 140 16.721 11.596 24.989 1.00 40.01 H new ATOM 0 HD12 LEU A 140 15.710 10.258 24.392 1.00 40.01 H new ATOM 0 HD13 LEU A 140 17.285 10.590 23.634 1.00 40.01 H new ATOM 0 HD21 LEU A 140 16.989 13.645 23.674 1.00 34.33 H new ATOM 0 HD22 LEU A 140 17.549 12.744 22.245 1.00 34.33 H new ATOM 0 HD23 LEU A 140 16.155 13.842 22.115 1.00 34.33 H new ATOM 2182 N GLU A 141 17.048 8.636 21.040 1.00 2.34 N ATOM 2183 CA GLU A 141 17.805 7.564 21.676 1.00 44.42 C ATOM 2184 C GLU A 141 18.835 6.954 20.725 1.00 53.43 C ATOM 2185 O GLU A 141 19.365 5.869 20.976 1.00 75.54 O ATOM 2186 CB GLU A 141 16.847 6.498 22.210 1.00 62.10 C ATOM 2187 CG GLU A 141 17.449 5.634 23.307 1.00 5.12 C ATOM 2188 CD GLU A 141 16.393 4.995 24.181 1.00 34.44 C ATOM 2189 OE1 GLU A 141 15.659 5.739 24.867 1.00 71.40 O ATOM 2190 OE2 GLU A 141 16.289 3.751 24.192 1.00 5.24 O ATOM 0 H GLU A 141 16.302 8.325 20.418 1.00 2.34 H new ATOM 0 HA GLU A 141 18.361 7.989 22.512 1.00 44.42 H new ATOM 0 HB2 GLU A 141 15.951 6.986 22.594 1.00 62.10 H new ATOM 0 HB3 GLU A 141 16.533 5.858 21.386 1.00 62.10 H new ATOM 0 HG2 GLU A 141 18.064 4.855 22.856 1.00 5.12 H new ATOM 0 HG3 GLU A 141 18.109 6.243 23.925 1.00 5.12 H new ATOM 2197 N HIS A 142 19.127 7.661 19.642 1.00 30.10 N ATOM 2198 CA HIS A 142 20.197 7.262 18.736 1.00 42.31 C ATOM 2199 C HIS A 142 21.522 7.269 19.493 1.00 61.33 C ATOM 2200 O HIS A 142 21.799 8.212 20.236 1.00 71.02 O ATOM 2201 CB HIS A 142 20.262 8.215 17.541 1.00 72.22 C ATOM 2202 CG HIS A 142 21.119 7.729 16.414 1.00 52.40 C ATOM 2203 ND1 HIS A 142 22.091 8.502 15.822 1.00 61.14 N ATOM 2204 CD2 HIS A 142 21.116 6.554 15.743 1.00 31.14 C ATOM 2205 CE1 HIS A 142 22.645 7.826 14.834 1.00 31.23 C ATOM 2206 NE2 HIS A 142 22.073 6.639 14.763 1.00 63.01 N ATOM 0 H HIS A 142 18.638 8.514 19.369 1.00 30.10 H new ATOM 0 HA HIS A 142 20.000 6.258 18.361 1.00 42.31 H new ATOM 0 HB2 HIS A 142 19.251 8.382 17.168 1.00 72.22 H new ATOM 0 HB3 HIS A 142 20.640 9.180 17.880 1.00 72.22 H new ATOM 0 HD2 HIS A 142 20.478 5.706 15.942 1.00 31.14 H new ATOM 0 HE1 HIS A 142 23.435 8.184 14.191 1.00 31.23 H new ATOM 0 HE2 HIS A 142 22.304 5.907 14.092 1.00 63.01 H new ATOM 2215 N HIS A 143 22.327 6.222 19.308 1.00 45.02 N ATOM 2216 CA HIS A 143 23.519 6.001 20.126 1.00 10.32 C ATOM 2217 C HIS A 143 23.066 5.782 21.573 1.00 50.45 C ATOM 2218 O HIS A 143 22.514 4.728 21.877 1.00 15.54 O ATOM 2219 CB HIS A 143 24.517 7.174 20.008 1.00 11.14 C ATOM 2220 CG HIS A 143 25.900 6.883 20.526 1.00 74.43 C ATOM 2221 ND1 HIS A 143 27.022 6.893 19.722 1.00 4.21 N ATOM 2222 CD2 HIS A 143 26.345 6.609 21.775 1.00 34.21 C ATOM 2223 CE1 HIS A 143 28.090 6.635 20.454 1.00 51.12 C ATOM 2224 NE2 HIS A 143 27.706 6.460 21.702 1.00 42.12 N ATOM 0 H HIS A 143 22.173 5.510 18.594 1.00 45.02 H new ATOM 0 HA HIS A 143 24.053 5.119 19.771 1.00 10.32 H new ATOM 0 HB2 HIS A 143 24.591 7.465 18.960 1.00 11.14 H new ATOM 0 HB3 HIS A 143 24.115 8.030 20.549 1.00 11.14 H new ATOM 0 HD2 HIS A 143 25.739 6.524 22.665 1.00 34.21 H new ATOM 0 HE1 HIS A 143 29.106 6.577 20.091 1.00 51.12 H new ATOM 0 HE2 HIS A 143 28.322 6.248 22.487 1.00 42.12 H new ATOM 2233 N HIS A 144 23.263 6.799 22.427 1.00 54.23 N ATOM 2234 CA HIS A 144 22.770 6.822 23.820 1.00 64.42 C ATOM 2235 C HIS A 144 22.576 5.431 24.438 1.00 72.45 C ATOM 2236 O HIS A 144 21.446 4.976 24.620 1.00 60.52 O ATOM 2237 CB HIS A 144 21.453 7.603 23.905 1.00 63.12 C ATOM 2238 CG HIS A 144 21.593 9.078 23.669 1.00 44.31 C ATOM 2239 ND1 HIS A 144 21.427 9.668 22.434 1.00 71.22 N ATOM 2240 CD2 HIS A 144 21.868 10.090 24.529 1.00 24.32 C ATOM 2241 CE1 HIS A 144 21.592 10.973 22.542 1.00 14.51 C ATOM 2242 NE2 HIS A 144 21.861 11.254 23.800 1.00 4.41 N ATOM 0 H HIS A 144 23.776 7.642 22.169 1.00 54.23 H new ATOM 0 HA HIS A 144 23.550 7.316 24.400 1.00 64.42 H new ATOM 0 HB2 HIS A 144 20.754 7.195 23.175 1.00 63.12 H new ATOM 0 HB3 HIS A 144 21.013 7.445 24.890 1.00 63.12 H new ATOM 0 HD1 HIS A 144 21.210 9.172 21.570 1.00 71.22 H new ATOM 0 HD2 HIS A 144 22.057 9.998 25.588 1.00 24.32 H new ATOM 0 HE1 HIS A 144 21.519 11.688 21.736 1.00 14.51 H new ATOM 2251 N HIS A 145 23.667 4.749 24.744 1.00 43.33 N ATOM 2252 CA HIS A 145 23.584 3.463 25.422 1.00 71.13 C ATOM 2253 C HIS A 145 24.089 3.598 26.847 1.00 30.42 C ATOM 2254 O HIS A 145 24.209 2.603 27.567 1.00 31.13 O ATOM 2255 CB HIS A 145 24.384 2.384 24.682 1.00 62.15 C ATOM 2256 CG HIS A 145 23.786 1.969 23.371 1.00 34.30 C ATOM 2257 ND1 HIS A 145 22.617 1.243 23.268 1.00 41.10 N ATOM 2258 CD2 HIS A 145 24.203 2.181 22.102 1.00 31.41 C ATOM 2259 CE1 HIS A 145 22.345 1.030 21.994 1.00 64.14 C ATOM 2260 NE2 HIS A 145 23.291 1.588 21.265 1.00 12.04 N ATOM 0 H HIS A 145 24.616 5.060 24.536 1.00 43.33 H new ATOM 0 HA HIS A 145 22.538 3.155 25.433 1.00 71.13 H new ATOM 0 HB2 HIS A 145 25.395 2.752 24.508 1.00 62.15 H new ATOM 0 HB3 HIS A 145 24.470 1.507 25.323 1.00 62.15 H new ATOM 0 HD2 HIS A 145 25.091 2.718 21.802 1.00 31.41 H new ATOM 0 HE1 HIS A 145 21.491 0.490 21.613 1.00 64.14 H new ATOM 0 HE2 HIS A 145 23.338 1.580 20.246 1.00 12.04 H new ATOM 2269 N HIS A 146 24.382 4.843 27.234 1.00 5.21 N ATOM 2270 CA HIS A 146 24.887 5.178 28.568 1.00 42.25 C ATOM 2271 C HIS A 146 26.313 4.660 28.749 1.00 1.11 C ATOM 2272 O HIS A 146 27.267 5.436 28.761 1.00 71.23 O ATOM 2273 CB HIS A 146 23.958 4.622 29.660 1.00 53.11 C ATOM 2274 CG HIS A 146 24.239 5.145 31.041 1.00 44.12 C ATOM 2275 ND1 HIS A 146 23.479 6.123 31.638 1.00 2.22 N ATOM 2276 CD2 HIS A 146 25.184 4.804 31.951 1.00 22.51 C ATOM 2277 CE1 HIS A 146 23.942 6.361 32.851 1.00 44.11 C ATOM 2278 NE2 HIS A 146 24.975 5.573 33.069 1.00 3.14 N ATOM 0 H HIS A 146 24.274 5.654 26.624 1.00 5.21 H new ATOM 0 HA HIS A 146 24.905 6.264 28.664 1.00 42.25 H new ATOM 0 HB2 HIS A 146 22.927 4.859 29.398 1.00 53.11 H new ATOM 0 HB3 HIS A 146 24.042 3.535 29.672 1.00 53.11 H new ATOM 0 HD2 HIS A 146 25.959 4.063 31.821 1.00 22.51 H new ATOM 0 HE1 HIS A 146 23.541 7.082 33.548 1.00 44.11 H new ATOM 0 HE2 HIS A 146 25.528 5.540 33.926 1.00 3.14 H new ATOM 2287 N HIS A 147 26.452 3.352 28.870 1.00 51.22 N ATOM 2288 CA HIS A 147 27.752 2.733 29.048 1.00 72.23 C ATOM 2289 C HIS A 147 28.050 1.831 27.858 1.00 32.42 C ATOM 2290 O HIS A 147 28.662 2.318 26.884 1.00 37.70 O ATOM 2291 CB HIS A 147 27.776 1.934 30.352 1.00 22.42 C ATOM 2292 CG HIS A 147 29.146 1.495 30.773 1.00 10.41 C ATOM 2293 ND1 HIS A 147 29.696 0.285 30.418 1.00 1.14 N ATOM 2294 CD2 HIS A 147 30.074 2.114 31.540 1.00 63.21 C ATOM 2295 CE1 HIS A 147 30.898 0.178 30.948 1.00 30.12 C ATOM 2296 NE2 HIS A 147 31.152 1.275 31.635 1.00 41.45 N ATOM 2297 OXT HIS A 147 27.632 0.655 27.883 1.00 37.70 O ATOM 0 H HIS A 147 25.673 2.694 28.848 1.00 51.22 H new ATOM 0 HA HIS A 147 28.520 3.505 29.106 1.00 72.23 H new ATOM 0 HB2 HIS A 147 27.340 2.541 31.146 1.00 22.42 H new ATOM 0 HB3 HIS A 147 27.143 1.054 30.239 1.00 22.42 H new ATOM 0 HD2 HIS A 147 29.981 3.090 31.993 1.00 63.21 H new ATOM 0 HE1 HIS A 147 31.563 -0.666 30.838 1.00 30.12 H new ATOM 0 HE2 HIS A 147 32.010 1.467 32.152 1.00 41.45 H new TER 2306 HIS A 147