USER MOD reduce.3.24.130724 H: found=0, std=0, add=1218, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 1218 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 156 HIS : no HE2:sc= -0.186! C(o=-0.69!,f=-6.8!) USER MOD Set 1.2: A 163 HIS : no HD1:sc= -0.507 X(o=-0.69,f=-0.73) USER MOD Set 2.1: A 132 TYR OH : rot 150:sc= 0 USER MOD Set 2.2: A 152 SER OG : rot 30:sc= 0.707 USER MOD Set 3.1: A 9 CYS SG : rot 10:sc= -1.08 USER MOD Set 3.2: A 100 SER OG : rot 35:sc= 0.264 USER MOD Single : A 1 MET CE :methyl -137:sc= -0.152 (180deg=-0.707) USER MOD Single : A 1 MET N :NH3+ -157:sc= -0.411 (180deg=-0.646) USER MOD Single : A 5 CYS SG : rot 180:sc= -0.648 USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 LYS NZ :NH3+ 160:sc= 1.24 (180deg=1) USER MOD Single : A 24 THR OG1 : rot 180:sc= -1.56! USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 26 THR OG1 : rot 88:sc= -1.11! USER MOD Single : A 28 MET CE :methyl 167:sc= -0.0847 (180deg=-0.424) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot 122:sc= 1.45 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 HIS : no HE2:sc= 1.17 K(o=1.2,f=-3.7!) USER MOD Single : A 44 GLN :FLIP amide:sc= -0.837 F(o=-1.9!,f=-0.84) USER MOD Single : A 49 GLN :FLIP amide:sc= -0.692 F(o=-2,f=-0.69) USER MOD Single : A 51 LYS NZ :NH3+ 155:sc= 0.967 (180deg=0.608) USER MOD Single : A 52 SER OG : rot 180:sc= -0.0845 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 61 TYR OH : rot 166:sc= 1.26 USER MOD Single : A 64 MET CE :methyl -120:sc= -1.19 (180deg=-2.48) USER MOD Single : A 65 SER OG : rot 180:sc= -0.0721 USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc=-0.00275 USER MOD Single : A 89 THR OG1 : rot 40:sc= 0.671 USER MOD Single : A 92 THR OG1 : rot 108:sc= 1.58 USER MOD Single : A 94 SER OG : rot 41:sc= 1.02 USER MOD Single : A 96 LYS NZ :NH3+ -179:sc= 0.568 (180deg=0.568) USER MOD Single : A 99 SER OG : rot 140:sc= 0 USER MOD Single : A 102 TYR OH : rot 1:sc= 0.191 USER MOD Single : A 106 TYR OH : rot 59:sc= 1.18 USER MOD Single : A 113 TYR OH : rot 25:sc= -0.479 USER MOD Single : A 117 MET CE :methyl -116:sc= -0.28 (180deg=-3.09!) USER MOD Single : A 118 LYS NZ :NH3+ -161:sc= 1.26 (180deg=1.21) USER MOD Single : A 123 ASN : amide:sc= 0 X(o=0,f=-0.48) USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 135 TYR OH : rot 70:sc= 1.23 USER MOD Single : A 138 ASN : amide:sc= -2.52 K(o=-2.5,f=-5.3!) USER MOD Single : A 142 THR OG1 : rot -115:sc= 1.27 USER MOD Single : A 146 GLN :FLIP amide:sc= 0 F(o=-0.59,f=0) USER MOD Single : A 149 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 MET CE :methyl 175:sc= -0.724 (180deg=-0.862) USER MOD Single : A 158 SER OG : rot 180:sc= 0.138 USER MOD Single : A 161 HIS : no HD1:sc= -0.086 K(o=-0.086,f=-1.3) USER MOD Single : A 162 HIS : no HE2:sc= 0.641 K(o=0.64,f=-4.9!) USER MOD Single : A 164 HIS : no HD1:sc= -0.0655 X(o=-0.066,f=-0.0011) USER MOD Single : A 165 HIS : no HD1:sc= -0.0136 X(o=-0.014,f=-0.014) USER MOD Single : A 166 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.346 -2.213 22.493 1.00 13.44 N ATOM 2 CA MET A 1 -5.383 -1.213 22.846 1.00 44.41 C ATOM 3 C MET A 1 -4.803 -0.102 23.726 1.00 71.24 C ATOM 4 O MET A 1 -5.453 0.919 23.952 1.00 72.00 O ATOM 5 CB MET A 1 -6.555 -1.897 23.564 1.00 72.13 C ATOM 6 CG MET A 1 -7.739 -0.977 23.839 1.00 3.31 C ATOM 7 SD MET A 1 -9.129 -1.834 24.606 1.00 25.44 S ATOM 8 CE MET A 1 -9.581 -2.980 23.305 1.00 24.24 C ATOM 0 H1 MET A 1 -4.626 -2.711 21.624 1.00 13.44 H new ATOM 0 H2 MET A 1 -3.437 -1.731 22.338 1.00 13.44 H new ATOM 0 H3 MET A 1 -4.247 -2.899 23.269 1.00 13.44 H new ATOM 0 HA MET A 1 -5.744 -0.760 21.923 1.00 44.41 H new ATOM 0 HB2 MET A 1 -6.895 -2.739 22.961 1.00 72.13 H new ATOM 0 HB3 MET A 1 -6.199 -2.306 24.510 1.00 72.13 H new ATOM 0 HG2 MET A 1 -7.417 -0.163 24.489 1.00 3.31 H new ATOM 0 HG3 MET A 1 -8.068 -0.527 22.903 1.00 3.31 H new ATOM 0 HE1 MET A 1 -10.666 -3.008 23.205 1.00 24.24 H new ATOM 0 HE2 MET A 1 -9.138 -2.655 22.364 1.00 24.24 H new ATOM 0 HE3 MET A 1 -9.214 -3.976 23.554 1.00 24.24 H new ATOM 20 N ASP A 2 -3.581 -0.290 24.225 1.00 51.03 N ATOM 21 CA ASP A 2 -2.985 0.701 25.115 1.00 31.02 C ATOM 22 C ASP A 2 -2.452 1.905 24.330 1.00 22.24 C ATOM 23 O ASP A 2 -3.178 2.889 24.161 1.00 71.20 O ATOM 24 CB ASP A 2 -1.901 0.078 26.021 1.00 10.31 C ATOM 25 CG ASP A 2 -0.811 -0.665 25.270 1.00 41.03 C ATOM 26 OD1 ASP A 2 -0.990 -1.864 24.978 1.00 31.30 O ATOM 27 OD2 ASP A 2 0.235 -0.054 24.977 1.00 53.24 O ATOM 0 H ASP A 2 -2.996 -1.103 24.032 1.00 51.03 H new ATOM 0 HA ASP A 2 -3.773 1.066 25.773 1.00 31.02 H new ATOM 0 HB2 ASP A 2 -1.443 0.868 26.615 1.00 10.31 H new ATOM 0 HB3 ASP A 2 -2.379 -0.610 26.719 1.00 10.31 H new ATOM 32 N PHE A 3 -1.220 1.827 23.831 1.00 41.44 N ATOM 33 CA PHE A 3 -0.614 2.935 23.094 1.00 13.51 C ATOM 34 C PHE A 3 0.810 2.601 22.658 1.00 2.05 C ATOM 35 O PHE A 3 1.210 2.895 21.533 1.00 5.44 O ATOM 36 CB PHE A 3 -0.593 4.203 23.964 1.00 42.23 C ATOM 37 CG PHE A 3 0.011 5.402 23.285 1.00 51.34 C ATOM 38 CD1 PHE A 3 -0.682 6.074 22.294 1.00 63.11 C ATOM 39 CD2 PHE A 3 1.273 5.854 23.642 1.00 53.33 C ATOM 40 CE1 PHE A 3 -0.130 7.177 21.671 1.00 70.23 C ATOM 41 CE2 PHE A 3 1.830 6.956 23.022 1.00 25.22 C ATOM 42 CZ PHE A 3 1.127 7.617 22.036 1.00 63.35 C ATOM 0 H PHE A 3 -0.621 1.007 23.924 1.00 41.44 H new ATOM 0 HA PHE A 3 -1.218 3.108 22.204 1.00 13.51 H new ATOM 0 HB2 PHE A 3 -1.613 4.443 24.262 1.00 42.23 H new ATOM 0 HB3 PHE A 3 -0.034 3.996 24.877 1.00 42.23 H new ATOM 0 HD1 PHE A 3 -1.665 5.733 22.004 1.00 63.11 H new ATOM 0 HD2 PHE A 3 1.826 5.339 24.413 1.00 53.33 H new ATOM 0 HE1 PHE A 3 -0.681 7.694 20.900 1.00 70.23 H new ATOM 0 HE2 PHE A 3 2.813 7.299 23.309 1.00 25.22 H new ATOM 0 HZ PHE A 3 1.560 8.479 21.550 1.00 63.35 H new ATOM 52 N GLU A 4 1.565 1.974 23.546 1.00 0.01 N ATOM 53 CA GLU A 4 2.996 1.817 23.336 1.00 24.40 C ATOM 54 C GLU A 4 3.345 0.476 22.703 1.00 10.51 C ATOM 55 O GLU A 4 3.550 -0.525 23.393 1.00 33.02 O ATOM 56 CB GLU A 4 3.749 2.000 24.654 1.00 4.20 C ATOM 57 CG GLU A 4 3.583 3.391 25.245 1.00 61.42 C ATOM 58 CD GLU A 4 4.319 3.572 26.553 1.00 70.24 C ATOM 59 OE1 GLU A 4 5.519 3.909 26.523 1.00 21.23 O ATOM 60 OE2 GLU A 4 3.698 3.387 27.620 1.00 21.33 O ATOM 0 H GLU A 4 1.214 1.568 24.413 1.00 0.01 H new ATOM 0 HA GLU A 4 3.307 2.591 22.635 1.00 24.40 H new ATOM 0 HB2 GLU A 4 3.396 1.261 25.373 1.00 4.20 H new ATOM 0 HB3 GLU A 4 4.809 1.805 24.491 1.00 4.20 H new ATOM 0 HG2 GLU A 4 3.942 4.129 24.528 1.00 61.42 H new ATOM 0 HG3 GLU A 4 2.523 3.588 25.401 1.00 61.42 H new ATOM 67 N CYS A 5 3.393 0.465 21.380 1.00 71.21 N ATOM 68 CA CYS A 5 3.853 -0.693 20.633 1.00 51.43 C ATOM 69 C CYS A 5 4.950 -0.263 19.668 1.00 0.41 C ATOM 70 O CYS A 5 4.688 0.034 18.502 1.00 72.11 O ATOM 71 CB CYS A 5 2.696 -1.345 19.872 1.00 73.40 C ATOM 72 SG CYS A 5 1.313 -1.860 20.919 1.00 61.34 S ATOM 0 H CYS A 5 3.116 1.255 20.797 1.00 71.21 H new ATOM 0 HA CYS A 5 4.251 -1.431 21.329 1.00 51.43 H new ATOM 0 HB2 CYS A 5 2.328 -0.644 19.123 1.00 73.40 H new ATOM 0 HB3 CYS A 5 3.074 -2.215 19.335 1.00 73.40 H new ATOM 0 HG CYS A 5 0.387 -2.397 20.181 1.00 61.34 H new ATOM 78 N GLN A 6 6.175 -0.200 20.166 1.00 74.33 N ATOM 79 CA GLN A 6 7.285 0.323 19.391 1.00 2.33 C ATOM 80 C GLN A 6 7.897 -0.760 18.516 1.00 5.42 C ATOM 81 O GLN A 6 8.645 -1.614 18.994 1.00 71.33 O ATOM 82 CB GLN A 6 8.351 0.916 20.313 1.00 32.22 C ATOM 83 CG GLN A 6 7.837 2.042 21.196 1.00 22.41 C ATOM 84 CD GLN A 6 8.906 2.591 22.117 1.00 71.11 C ATOM 85 OE1 GLN A 6 9.092 2.102 23.227 1.00 71.44 O ATOM 86 NE2 GLN A 6 9.609 3.619 21.668 1.00 54.14 N ATOM 0 H GLN A 6 6.424 -0.506 21.107 1.00 74.33 H new ATOM 0 HA GLN A 6 6.900 1.111 18.744 1.00 2.33 H new ATOM 0 HB2 GLN A 6 8.753 0.124 20.946 1.00 32.22 H new ATOM 0 HB3 GLN A 6 9.176 1.289 19.707 1.00 32.22 H new ATOM 0 HG2 GLN A 6 7.455 2.847 20.568 1.00 22.41 H new ATOM 0 HG3 GLN A 6 7.000 1.679 21.792 1.00 22.41 H new ATOM 0 HE21 GLN A 6 9.424 3.997 20.739 1.00 54.14 H new ATOM 0 HE22 GLN A 6 10.336 4.033 22.251 1.00 54.14 H new ATOM 95 N PHE A 7 7.545 -0.743 17.244 1.00 51.53 N ATOM 96 CA PHE A 7 8.142 -1.645 16.271 1.00 35.11 C ATOM 97 C PHE A 7 9.259 -0.934 15.519 1.00 52.14 C ATOM 98 O PHE A 7 9.134 0.245 15.174 1.00 53.51 O ATOM 99 CB PHE A 7 7.086 -2.165 15.293 1.00 11.31 C ATOM 100 CG PHE A 7 6.098 -3.107 15.920 1.00 21.25 C ATOM 101 CD1 PHE A 7 6.342 -4.471 15.945 1.00 44.24 C ATOM 102 CD2 PHE A 7 4.926 -2.630 16.485 1.00 2.53 C ATOM 103 CE1 PHE A 7 5.435 -5.341 16.521 1.00 44.42 C ATOM 104 CE2 PHE A 7 4.016 -3.495 17.063 1.00 71.04 C ATOM 105 CZ PHE A 7 4.272 -4.853 17.081 1.00 75.41 C ATOM 0 H PHE A 7 6.844 -0.111 16.857 1.00 51.53 H new ATOM 0 HA PHE A 7 8.562 -2.500 16.802 1.00 35.11 H new ATOM 0 HB2 PHE A 7 6.548 -1.318 14.868 1.00 11.31 H new ATOM 0 HB3 PHE A 7 7.586 -2.672 14.468 1.00 11.31 H new ATOM 0 HD1 PHE A 7 7.251 -4.859 15.510 1.00 44.24 H new ATOM 0 HD2 PHE A 7 4.721 -1.570 16.474 1.00 2.53 H new ATOM 0 HE1 PHE A 7 5.637 -6.402 16.533 1.00 44.42 H new ATOM 0 HE2 PHE A 7 3.106 -3.110 17.500 1.00 71.04 H new ATOM 0 HZ PHE A 7 3.563 -5.531 17.533 1.00 75.41 H new ATOM 115 N VAL A 8 10.352 -1.650 15.281 1.00 4.14 N ATOM 116 CA VAL A 8 11.519 -1.081 14.622 1.00 53.25 C ATOM 117 C VAL A 8 11.178 -0.603 13.209 1.00 74.23 C ATOM 118 O VAL A 8 10.527 -1.309 12.434 1.00 1.44 O ATOM 119 CB VAL A 8 12.692 -2.090 14.588 1.00 3.15 C ATOM 120 CG1 VAL A 8 12.325 -3.347 13.807 1.00 44.51 C ATOM 121 CG2 VAL A 8 13.948 -1.445 14.025 1.00 10.42 C ATOM 0 H VAL A 8 10.453 -2.632 15.537 1.00 4.14 H new ATOM 0 HA VAL A 8 11.835 -0.216 15.206 1.00 53.25 H new ATOM 0 HB VAL A 8 12.898 -2.391 15.615 1.00 3.15 H new ATOM 0 HG11 VAL A 8 13.172 -4.033 13.804 1.00 44.51 H new ATOM 0 HG12 VAL A 8 11.468 -3.830 14.277 1.00 44.51 H new ATOM 0 HG13 VAL A 8 12.072 -3.077 12.782 1.00 44.51 H new ATOM 0 HG21 VAL A 8 14.757 -2.175 14.012 1.00 10.42 H new ATOM 0 HG22 VAL A 8 13.755 -1.099 13.010 1.00 10.42 H new ATOM 0 HG23 VAL A 8 14.233 -0.598 14.649 1.00 10.42 H new ATOM 131 N CYS A 9 11.608 0.608 12.894 1.00 55.12 N ATOM 132 CA CYS A 9 11.275 1.232 11.626 1.00 3.24 C ATOM 133 C CYS A 9 12.465 1.175 10.674 1.00 13.51 C ATOM 134 O CYS A 9 13.613 1.323 11.098 1.00 23.31 O ATOM 135 CB CYS A 9 10.856 2.680 11.869 1.00 73.23 C ATOM 136 SG CYS A 9 9.680 2.876 13.231 1.00 51.14 S ATOM 0 H CYS A 9 12.192 1.180 13.504 1.00 55.12 H new ATOM 0 HA CYS A 9 10.448 0.691 11.167 1.00 3.24 H new ATOM 0 HB2 CYS A 9 11.744 3.276 12.079 1.00 73.23 H new ATOM 0 HB3 CYS A 9 10.412 3.079 10.957 1.00 73.23 H new ATOM 0 HG CYS A 9 9.584 1.757 13.886 1.00 51.14 H new ATOM 142 N GLU A 10 12.191 0.951 9.396 1.00 21.14 N ATOM 143 CA GLU A 10 13.241 0.870 8.392 1.00 13.44 C ATOM 144 C GLU A 10 13.112 1.995 7.374 1.00 33.20 C ATOM 145 O GLU A 10 12.027 2.544 7.160 1.00 72.51 O ATOM 146 CB GLU A 10 13.182 -0.460 7.629 1.00 21.33 C ATOM 147 CG GLU A 10 13.266 -1.703 8.496 1.00 5.31 C ATOM 148 CD GLU A 10 13.432 -2.962 7.667 1.00 22.25 C ATOM 149 OE1 GLU A 10 12.597 -3.213 6.771 1.00 41.10 O ATOM 150 OE2 GLU A 10 14.417 -3.699 7.887 1.00 34.12 O ATOM 0 H GLU A 10 11.248 0.822 9.030 1.00 21.14 H new ATOM 0 HA GLU A 10 14.188 0.951 8.925 1.00 13.44 H new ATOM 0 HB2 GLU A 10 12.253 -0.494 7.061 1.00 21.33 H new ATOM 0 HB3 GLU A 10 13.998 -0.484 6.907 1.00 21.33 H new ATOM 0 HG2 GLU A 10 14.106 -1.609 9.185 1.00 5.31 H new ATOM 0 HG3 GLU A 10 12.364 -1.784 9.102 1.00 5.31 H new ATOM 157 N LEU A 11 14.230 2.330 6.753 1.00 4.52 N ATOM 158 CA LEU A 11 14.221 3.163 5.568 1.00 11.21 C ATOM 159 C LEU A 11 14.028 2.245 4.370 1.00 22.15 C ATOM 160 O LEU A 11 14.863 1.380 4.097 1.00 73.41 O ATOM 161 CB LEU A 11 15.532 3.971 5.473 1.00 22.51 C ATOM 162 CG LEU A 11 15.666 4.966 4.300 1.00 75.51 C ATOM 163 CD1 LEU A 11 15.989 4.253 2.995 1.00 30.23 C ATOM 164 CD2 LEU A 11 14.404 5.803 4.143 1.00 14.32 C ATOM 0 H LEU A 11 15.159 2.035 7.054 1.00 4.52 H new ATOM 0 HA LEU A 11 13.410 3.891 5.602 1.00 11.21 H new ATOM 0 HB2 LEU A 11 15.654 4.527 6.403 1.00 22.51 H new ATOM 0 HB3 LEU A 11 16.360 3.265 5.413 1.00 22.51 H new ATOM 0 HG LEU A 11 16.496 5.631 4.537 1.00 75.51 H new ATOM 0 HD11 LEU A 11 16.076 4.985 2.192 1.00 30.23 H new ATOM 0 HD12 LEU A 11 16.931 3.714 3.098 1.00 30.23 H new ATOM 0 HD13 LEU A 11 15.192 3.548 2.759 1.00 30.23 H new ATOM 0 HD21 LEU A 11 14.527 6.495 3.310 1.00 14.32 H new ATOM 0 HD22 LEU A 11 13.555 5.148 3.948 1.00 14.32 H new ATOM 0 HD23 LEU A 11 14.225 6.367 5.059 1.00 14.32 H new ATOM 176 N LYS A 12 12.905 2.397 3.696 1.00 52.04 N ATOM 177 CA LYS A 12 12.583 1.546 2.565 1.00 23.22 C ATOM 178 C LYS A 12 12.394 2.396 1.323 1.00 53.41 C ATOM 179 O LYS A 12 11.940 3.536 1.410 1.00 63.24 O ATOM 180 CB LYS A 12 11.307 0.743 2.842 1.00 73.01 C ATOM 181 CG LYS A 12 11.434 -0.744 2.542 1.00 23.14 C ATOM 182 CD LYS A 12 12.374 -1.433 3.521 1.00 62.52 C ATOM 183 CE LYS A 12 12.469 -2.928 3.249 1.00 24.24 C ATOM 184 NZ LYS A 12 13.327 -3.627 4.245 1.00 4.23 N ATOM 0 H LYS A 12 12.200 3.102 3.911 1.00 52.04 H new ATOM 0 HA LYS A 12 13.406 0.849 2.407 1.00 23.22 H new ATOM 0 HB2 LYS A 12 11.030 0.870 3.889 1.00 73.01 H new ATOM 0 HB3 LYS A 12 10.494 1.155 2.245 1.00 73.01 H new ATOM 0 HG2 LYS A 12 10.450 -1.211 2.591 1.00 23.14 H new ATOM 0 HG3 LYS A 12 11.802 -0.881 1.525 1.00 23.14 H new ATOM 0 HD2 LYS A 12 13.366 -0.986 3.450 1.00 62.52 H new ATOM 0 HD3 LYS A 12 12.023 -1.270 4.540 1.00 62.52 H new ATOM 0 HE2 LYS A 12 11.470 -3.363 3.264 1.00 24.24 H new ATOM 0 HE3 LYS A 12 12.871 -3.089 2.249 1.00 24.24 H new ATOM 0 HZ1 LYS A 12 13.105 -4.643 4.243 1.00 4.23 H new ATOM 0 HZ2 LYS A 12 14.328 -3.491 3.997 1.00 4.23 H new ATOM 0 HZ3 LYS A 12 13.149 -3.236 5.192 1.00 4.23 H new ATOM 198 N GLU A 13 12.751 1.860 0.172 1.00 24.21 N ATOM 199 CA GLU A 13 12.553 2.581 -1.066 1.00 63.14 C ATOM 200 C GLU A 13 11.510 1.886 -1.925 1.00 4.24 C ATOM 201 O GLU A 13 11.530 0.667 -2.094 1.00 23.23 O ATOM 202 CB GLU A 13 13.868 2.752 -1.825 1.00 34.03 C ATOM 203 CG GLU A 13 14.537 1.455 -2.243 1.00 62.42 C ATOM 204 CD GLU A 13 15.826 1.708 -2.988 1.00 25.43 C ATOM 205 OE1 GLU A 13 15.801 2.464 -3.981 1.00 62.53 O ATOM 206 OE2 GLU A 13 16.878 1.193 -2.559 1.00 75.13 O ATOM 0 H GLU A 13 13.175 0.938 0.070 1.00 24.21 H new ATOM 0 HA GLU A 13 12.186 3.578 -0.823 1.00 63.14 H new ATOM 0 HB2 GLU A 13 13.681 3.351 -2.716 1.00 34.03 H new ATOM 0 HB3 GLU A 13 14.561 3.316 -1.201 1.00 34.03 H new ATOM 0 HG2 GLU A 13 14.740 0.849 -1.360 1.00 62.42 H new ATOM 0 HG3 GLU A 13 13.858 0.882 -2.874 1.00 62.42 H new ATOM 213 N LEU A 14 10.583 2.671 -2.436 1.00 42.55 N ATOM 214 CA LEU A 14 9.514 2.150 -3.263 1.00 14.54 C ATOM 215 C LEU A 14 10.042 1.842 -4.659 1.00 51.24 C ATOM 216 O LEU A 14 10.634 2.701 -5.313 1.00 63.40 O ATOM 217 CB LEU A 14 8.365 3.163 -3.338 1.00 2.32 C ATOM 218 CG LEU A 14 6.955 2.576 -3.214 1.00 60.32 C ATOM 219 CD1 LEU A 14 6.652 1.633 -4.366 1.00 51.24 C ATOM 220 CD2 LEU A 14 6.796 1.855 -1.885 1.00 51.50 C ATOM 0 H LEU A 14 10.549 3.680 -2.291 1.00 42.55 H new ATOM 0 HA LEU A 14 9.136 1.229 -2.819 1.00 14.54 H new ATOM 0 HB2 LEU A 14 8.503 3.901 -2.547 1.00 2.32 H new ATOM 0 HB3 LEU A 14 8.435 3.695 -4.287 1.00 2.32 H new ATOM 0 HG LEU A 14 6.242 3.400 -3.254 1.00 60.32 H new ATOM 0 HD11 LEU A 14 5.645 1.231 -4.252 1.00 51.24 H new ATOM 0 HD12 LEU A 14 6.722 2.176 -5.309 1.00 51.24 H new ATOM 0 HD13 LEU A 14 7.372 0.814 -4.365 1.00 51.24 H new ATOM 0 HD21 LEU A 14 5.789 1.444 -1.812 1.00 51.50 H new ATOM 0 HD22 LEU A 14 7.524 1.046 -1.820 1.00 51.50 H new ATOM 0 HD23 LEU A 14 6.961 2.557 -1.068 1.00 51.50 H new ATOM 232 N ALA A 15 9.852 0.611 -5.093 1.00 74.50 N ATOM 233 CA ALA A 15 10.265 0.198 -6.422 1.00 71.44 C ATOM 234 C ALA A 15 9.156 0.480 -7.426 1.00 64.05 C ATOM 235 O ALA A 15 7.976 0.427 -7.077 1.00 65.44 O ATOM 236 CB ALA A 15 10.623 -1.280 -6.422 1.00 42.24 C ATOM 0 H ALA A 15 9.412 -0.125 -4.541 1.00 74.50 H new ATOM 0 HA ALA A 15 11.148 0.768 -6.713 1.00 71.44 H new ATOM 0 HB1 ALA A 15 10.931 -1.580 -7.424 1.00 42.24 H new ATOM 0 HB2 ALA A 15 11.440 -1.456 -5.723 1.00 42.24 H new ATOM 0 HB3 ALA A 15 9.754 -1.865 -6.120 1.00 42.24 H new ATOM 242 N PRO A 16 9.512 0.812 -8.675 1.00 61.23 N ATOM 243 CA PRO A 16 8.533 1.026 -9.741 1.00 1.30 C ATOM 244 C PRO A 16 7.834 -0.271 -10.126 1.00 10.41 C ATOM 245 O PRO A 16 8.389 -1.102 -10.845 1.00 15.44 O ATOM 246 CB PRO A 16 9.366 1.565 -10.916 1.00 23.02 C ATOM 247 CG PRO A 16 10.692 1.928 -10.329 1.00 71.13 C ATOM 248 CD PRO A 16 10.886 1.018 -9.151 1.00 61.33 C ATOM 0 HA PRO A 16 7.740 1.709 -9.437 1.00 1.30 H new ATOM 0 HB2 PRO A 16 9.475 0.813 -11.698 1.00 23.02 H new ATOM 0 HB3 PRO A 16 8.888 2.432 -11.372 1.00 23.02 H new ATOM 0 HG2 PRO A 16 11.491 1.797 -11.059 1.00 71.13 H new ATOM 0 HG3 PRO A 16 10.710 2.974 -10.021 1.00 71.13 H new ATOM 0 HD2 PRO A 16 11.361 0.080 -9.438 1.00 61.33 H new ATOM 0 HD3 PRO A 16 11.516 1.473 -8.387 1.00 61.33 H new ATOM 256 N VAL A 17 6.631 -0.452 -9.610 1.00 61.11 N ATOM 257 CA VAL A 17 5.868 -1.662 -9.855 1.00 21.24 C ATOM 258 C VAL A 17 4.563 -1.317 -10.561 1.00 63.31 C ATOM 259 O VAL A 17 3.951 -0.288 -10.265 1.00 31.14 O ATOM 260 CB VAL A 17 5.558 -2.385 -8.518 1.00 21.01 C ATOM 261 CG1 VAL A 17 4.785 -3.673 -8.743 1.00 63.43 C ATOM 262 CG2 VAL A 17 6.839 -2.670 -7.747 1.00 3.51 C ATOM 0 H VAL A 17 6.159 0.229 -9.015 1.00 61.11 H new ATOM 0 HA VAL A 17 6.460 -2.324 -10.487 1.00 21.24 H new ATOM 0 HB VAL A 17 4.932 -1.716 -7.927 1.00 21.01 H new ATOM 0 HG11 VAL A 17 4.587 -4.151 -7.784 1.00 63.43 H new ATOM 0 HG12 VAL A 17 3.841 -3.449 -9.239 1.00 63.43 H new ATOM 0 HG13 VAL A 17 5.372 -4.345 -9.368 1.00 63.43 H new ATOM 0 HG21 VAL A 17 6.596 -3.177 -6.813 1.00 3.51 H new ATOM 0 HG22 VAL A 17 7.491 -3.306 -8.347 1.00 3.51 H new ATOM 0 HG23 VAL A 17 7.348 -1.732 -7.528 1.00 3.51 H new ATOM 272 N PRO A 18 4.129 -2.155 -11.516 1.00 74.03 N ATOM 273 CA PRO A 18 2.828 -2.005 -12.164 1.00 22.22 C ATOM 274 C PRO A 18 1.690 -2.387 -11.223 1.00 71.24 C ATOM 275 O PRO A 18 1.466 -3.568 -10.943 1.00 72.11 O ATOM 276 CB PRO A 18 2.889 -2.972 -13.359 1.00 24.44 C ATOM 277 CG PRO A 18 4.318 -3.400 -13.458 1.00 15.14 C ATOM 278 CD PRO A 18 4.883 -3.284 -12.073 1.00 31.53 C ATOM 0 HA PRO A 18 2.635 -0.974 -12.462 1.00 22.22 H new ATOM 0 HB2 PRO A 18 2.233 -3.829 -13.204 1.00 24.44 H new ATOM 0 HB3 PRO A 18 2.562 -2.482 -14.276 1.00 24.44 H new ATOM 0 HG2 PRO A 18 4.394 -4.423 -13.826 1.00 15.14 H new ATOM 0 HG3 PRO A 18 4.867 -2.769 -14.157 1.00 15.14 H new ATOM 0 HD2 PRO A 18 4.733 -4.196 -11.496 1.00 31.53 H new ATOM 0 HD3 PRO A 18 5.955 -3.088 -12.087 1.00 31.53 H new ATOM 286 N ALA A 19 0.994 -1.387 -10.714 1.00 41.33 N ATOM 287 CA ALA A 19 -0.087 -1.609 -9.773 1.00 1.43 C ATOM 288 C ALA A 19 -1.405 -1.102 -10.337 1.00 44.04 C ATOM 289 O ALA A 19 -1.421 -0.182 -11.153 1.00 23.21 O ATOM 290 CB ALA A 19 0.223 -0.923 -8.452 1.00 23.41 C ATOM 0 H ALA A 19 1.160 -0.406 -10.939 1.00 41.33 H new ATOM 0 HA ALA A 19 -0.181 -2.681 -9.600 1.00 1.43 H new ATOM 0 HB1 ALA A 19 -0.594 -1.095 -7.752 1.00 23.41 H new ATOM 0 HB2 ALA A 19 1.146 -1.329 -8.039 1.00 23.41 H new ATOM 0 HB3 ALA A 19 0.340 0.148 -8.617 1.00 23.41 H new ATOM 296 N LEU A 20 -2.496 -1.714 -9.910 1.00 22.22 N ATOM 297 CA LEU A 20 -3.830 -1.317 -10.327 1.00 42.14 C ATOM 298 C LEU A 20 -4.730 -1.223 -9.103 1.00 64.02 C ATOM 299 O LEU A 20 -4.636 -2.047 -8.186 1.00 44.22 O ATOM 300 CB LEU A 20 -4.387 -2.323 -11.346 1.00 73.54 C ATOM 301 CG LEU A 20 -5.763 -1.995 -11.938 1.00 2.22 C ATOM 302 CD1 LEU A 20 -5.877 -2.565 -13.340 1.00 24.32 C ATOM 303 CD2 LEU A 20 -6.882 -2.554 -11.070 1.00 60.31 C ATOM 0 H LEU A 20 -2.482 -2.502 -9.263 1.00 22.22 H new ATOM 0 HA LEU A 20 -3.790 -0.340 -10.809 1.00 42.14 H new ATOM 0 HB2 LEU A 20 -3.674 -2.411 -12.165 1.00 73.54 H new ATOM 0 HB3 LEU A 20 -4.444 -3.300 -10.867 1.00 73.54 H new ATOM 0 HG LEU A 20 -5.862 -0.910 -11.975 1.00 2.22 H new ATOM 0 HD11 LEU A 20 -6.858 -2.326 -13.751 1.00 24.32 H new ATOM 0 HD12 LEU A 20 -5.103 -2.131 -13.973 1.00 24.32 H new ATOM 0 HD13 LEU A 20 -5.752 -3.647 -13.304 1.00 24.32 H new ATOM 0 HD21 LEU A 20 -7.846 -2.306 -11.515 1.00 60.31 H new ATOM 0 HD22 LEU A 20 -6.782 -3.637 -11.001 1.00 60.31 H new ATOM 0 HD23 LEU A 20 -6.820 -2.120 -10.072 1.00 60.31 H new ATOM 315 N LEU A 21 -5.580 -0.207 -9.072 1.00 34.33 N ATOM 316 CA LEU A 21 -6.457 0.003 -7.935 1.00 12.24 C ATOM 317 C LEU A 21 -7.651 0.876 -8.290 1.00 11.53 C ATOM 318 O LEU A 21 -7.700 1.491 -9.359 1.00 35.44 O ATOM 319 CB LEU A 21 -5.694 0.600 -6.721 1.00 21.52 C ATOM 320 CG LEU A 21 -4.834 1.880 -6.921 1.00 53.44 C ATOM 321 CD1 LEU A 21 -3.619 1.621 -7.800 1.00 51.01 C ATOM 322 CD2 LEU A 21 -5.647 3.040 -7.479 1.00 20.22 C ATOM 0 H LEU A 21 -5.679 0.481 -9.819 1.00 34.33 H new ATOM 0 HA LEU A 21 -6.832 -0.980 -7.651 1.00 12.24 H new ATOM 0 HB2 LEU A 21 -6.429 0.816 -5.946 1.00 21.52 H new ATOM 0 HB3 LEU A 21 -5.038 -0.178 -6.331 1.00 21.52 H new ATOM 0 HG LEU A 21 -4.483 2.162 -5.928 1.00 53.44 H new ATOM 0 HD11 LEU A 21 -3.048 2.543 -7.912 1.00 51.01 H new ATOM 0 HD12 LEU A 21 -2.991 0.859 -7.338 1.00 51.01 H new ATOM 0 HD13 LEU A 21 -3.946 1.275 -8.781 1.00 51.01 H new ATOM 0 HD21 LEU A 21 -5.003 3.911 -7.601 1.00 20.22 H new ATOM 0 HD22 LEU A 21 -6.065 2.760 -8.446 1.00 20.22 H new ATOM 0 HD23 LEU A 21 -6.457 3.281 -6.790 1.00 20.22 H new ATOM 334 N ILE A 22 -8.617 0.897 -7.385 1.00 5.40 N ATOM 335 CA ILE A 22 -9.708 1.847 -7.436 1.00 44.10 C ATOM 336 C ILE A 22 -9.363 3.010 -6.527 1.00 11.21 C ATOM 337 O ILE A 22 -9.164 2.813 -5.325 1.00 31.52 O ATOM 338 CB ILE A 22 -11.042 1.230 -6.947 1.00 51.25 C ATOM 339 CG1 ILE A 22 -11.387 -0.030 -7.736 1.00 31.02 C ATOM 340 CG2 ILE A 22 -12.174 2.245 -7.045 1.00 73.13 C ATOM 341 CD1 ILE A 22 -11.574 0.212 -9.212 1.00 50.14 C ATOM 0 H ILE A 22 -8.663 0.253 -6.595 1.00 5.40 H new ATOM 0 HA ILE A 22 -9.839 2.160 -8.472 1.00 44.10 H new ATOM 0 HB ILE A 22 -10.916 0.951 -5.901 1.00 51.25 H new ATOM 0 HG12 ILE A 22 -10.594 -0.765 -7.595 1.00 31.02 H new ATOM 0 HG13 ILE A 22 -12.300 -0.464 -7.329 1.00 31.02 H new ATOM 0 HG21 ILE A 22 -13.101 1.790 -6.697 1.00 73.13 H new ATOM 0 HG22 ILE A 22 -11.940 3.112 -6.427 1.00 73.13 H new ATOM 0 HG23 ILE A 22 -12.292 2.560 -8.082 1.00 73.13 H new ATOM 0 HD11 ILE A 22 -11.817 -0.728 -9.707 1.00 50.14 H new ATOM 0 HD12 ILE A 22 -12.386 0.923 -9.364 1.00 50.14 H new ATOM 0 HD13 ILE A 22 -10.654 0.617 -9.634 1.00 50.14 H new ATOM 353 N ARG A 23 -9.271 4.209 -7.069 1.00 31.24 N ATOM 354 CA ARG A 23 -8.992 5.355 -6.228 1.00 5.31 C ATOM 355 C ARG A 23 -10.289 5.807 -5.569 1.00 55.43 C ATOM 356 O ARG A 23 -11.148 6.438 -6.185 1.00 22.33 O ATOM 357 CB ARG A 23 -8.304 6.486 -7.004 1.00 11.41 C ATOM 358 CG ARG A 23 -9.113 7.083 -8.143 1.00 43.41 C ATOM 359 CD ARG A 23 -8.349 8.219 -8.796 1.00 61.02 C ATOM 360 NE ARG A 23 -9.179 9.010 -9.700 1.00 74.23 N ATOM 361 CZ ARG A 23 -8.815 10.194 -10.186 1.00 45.43 C ATOM 362 NH1 ARG A 23 -7.619 10.693 -9.891 1.00 10.01 N ATOM 363 NH2 ARG A 23 -9.641 10.872 -10.970 1.00 64.02 N ATOM 0 H ARG A 23 -9.382 4.412 -8.062 1.00 31.24 H new ATOM 0 HA ARG A 23 -8.284 5.067 -5.451 1.00 5.31 H new ATOM 0 HB2 ARG A 23 -8.052 7.283 -6.304 1.00 11.41 H new ATOM 0 HB3 ARG A 23 -7.365 6.107 -7.408 1.00 11.41 H new ATOM 0 HG2 ARG A 23 -9.335 6.313 -8.882 1.00 43.41 H new ATOM 0 HG3 ARG A 23 -10.068 7.448 -7.766 1.00 43.41 H new ATOM 0 HD2 ARG A 23 -7.941 8.869 -8.022 1.00 61.02 H new ATOM 0 HD3 ARG A 23 -7.503 7.812 -9.349 1.00 61.02 H new ATOM 0 HE ARG A 23 -10.087 8.635 -9.974 1.00 74.23 H new ATOM 0 HH11 ARG A 23 -6.981 10.168 -9.293 1.00 10.01 H new ATOM 0 HH12 ARG A 23 -7.339 11.601 -10.263 1.00 10.01 H new ATOM 0 HH21 ARG A 23 -10.556 10.486 -11.201 1.00 64.02 H new ATOM 0 HH22 ARG A 23 -9.361 11.780 -11.342 1.00 64.02 H new ATOM 377 N THR A 24 -10.434 5.418 -4.318 1.00 31.12 N ATOM 378 CA THR A 24 -11.671 5.595 -3.591 1.00 12.23 C ATOM 379 C THR A 24 -11.534 6.682 -2.537 1.00 53.25 C ATOM 380 O THR A 24 -10.432 7.145 -2.253 1.00 43.33 O ATOM 381 CB THR A 24 -12.092 4.272 -2.923 1.00 62.54 C ATOM 382 OG1 THR A 24 -10.967 3.383 -2.839 1.00 5.10 O ATOM 383 CG2 THR A 24 -13.208 3.599 -3.698 1.00 64.14 C ATOM 0 H THR A 24 -9.694 4.969 -3.777 1.00 31.12 H new ATOM 0 HA THR A 24 -12.438 5.899 -4.303 1.00 12.23 H new ATOM 0 HB THR A 24 -12.454 4.503 -1.921 1.00 62.54 H new ATOM 0 HG1 THR A 24 -11.243 2.545 -2.412 1.00 5.10 H new ATOM 0 HG21 THR A 24 -13.484 2.668 -3.203 1.00 64.14 H new ATOM 0 HG22 THR A 24 -14.074 4.260 -3.737 1.00 64.14 H new ATOM 0 HG23 THR A 24 -12.869 3.385 -4.712 1.00 64.14 H new ATOM 391 N GLN A 25 -12.655 7.100 -1.983 1.00 0.14 N ATOM 392 CA GLN A 25 -12.664 8.095 -0.927 1.00 73.34 C ATOM 393 C GLN A 25 -13.668 7.698 0.143 1.00 30.20 C ATOM 394 O GLN A 25 -14.702 7.099 -0.158 1.00 0.25 O ATOM 395 CB GLN A 25 -12.992 9.475 -1.496 1.00 30.55 C ATOM 396 CG GLN A 25 -14.267 9.507 -2.326 1.00 63.33 C ATOM 397 CD GLN A 25 -14.508 10.853 -2.982 1.00 44.53 C ATOM 398 OE1 GLN A 25 -14.122 11.895 -2.452 1.00 13.04 O ATOM 399 NE2 GLN A 25 -15.144 10.842 -4.145 1.00 41.40 N ATOM 0 H GLN A 25 -13.580 6.763 -2.249 1.00 0.14 H new ATOM 0 HA GLN A 25 -11.673 8.145 -0.475 1.00 73.34 H new ATOM 0 HB2 GLN A 25 -13.086 10.184 -0.674 1.00 30.55 H new ATOM 0 HB3 GLN A 25 -12.159 9.811 -2.113 1.00 30.55 H new ATOM 0 HG2 GLN A 25 -14.213 8.737 -3.096 1.00 63.33 H new ATOM 0 HG3 GLN A 25 -15.116 9.261 -1.688 1.00 63.33 H new ATOM 0 HE21 GLN A 25 -15.448 9.957 -4.552 1.00 41.40 H new ATOM 0 HE22 GLN A 25 -15.329 11.718 -4.633 1.00 41.40 H new ATOM 408 N THR A 26 -13.363 8.023 1.385 1.00 71.32 N ATOM 409 CA THR A 26 -14.189 7.601 2.499 1.00 71.12 C ATOM 410 C THR A 26 -14.109 8.617 3.635 1.00 25.25 C ATOM 411 O THR A 26 -13.431 9.641 3.518 1.00 61.21 O ATOM 412 CB THR A 26 -13.766 6.190 2.989 1.00 2.44 C ATOM 413 OG1 THR A 26 -14.589 5.750 4.077 1.00 21.51 O ATOM 414 CG2 THR A 26 -12.306 6.170 3.422 1.00 25.44 C ATOM 0 H THR A 26 -12.549 8.578 1.647 1.00 71.32 H new ATOM 0 HA THR A 26 -15.224 7.546 2.162 1.00 71.12 H new ATOM 0 HB THR A 26 -13.896 5.509 2.148 1.00 2.44 H new ATOM 0 HG1 THR A 26 -15.380 5.291 3.724 1.00 21.51 H new ATOM 0 HG21 THR A 26 -12.040 5.168 3.760 1.00 25.44 H new ATOM 0 HG22 THR A 26 -11.673 6.449 2.580 1.00 25.44 H new ATOM 0 HG23 THR A 26 -12.158 6.879 4.237 1.00 25.44 H new ATOM 422 N ALA A 27 -14.809 8.339 4.722 1.00 13.13 N ATOM 423 CA ALA A 27 -14.834 9.232 5.866 1.00 30.23 C ATOM 424 C ALA A 27 -13.705 8.894 6.833 1.00 30.20 C ATOM 425 O ALA A 27 -12.864 8.038 6.545 1.00 74.32 O ATOM 426 CB ALA A 27 -16.183 9.148 6.562 1.00 73.24 C ATOM 0 H ALA A 27 -15.371 7.495 4.835 1.00 13.13 H new ATOM 0 HA ALA A 27 -14.686 10.254 5.518 1.00 30.23 H new ATOM 0 HB1 ALA A 27 -16.193 9.821 7.419 1.00 73.24 H new ATOM 0 HB2 ALA A 27 -16.970 9.436 5.865 1.00 73.24 H new ATOM 0 HB3 ALA A 27 -16.354 8.126 6.901 1.00 73.24 H new ATOM 432 N MET A 28 -13.683 9.562 7.978 1.00 32.21 N ATOM 433 CA MET A 28 -12.654 9.317 8.975 1.00 72.44 C ATOM 434 C MET A 28 -12.940 8.004 9.695 1.00 22.43 C ATOM 435 O MET A 28 -13.784 7.948 10.587 1.00 32.12 O ATOM 436 CB MET A 28 -12.578 10.483 9.966 1.00 54.12 C ATOM 437 CG MET A 28 -11.496 10.325 11.025 1.00 54.42 C ATOM 438 SD MET A 28 -11.236 11.830 11.986 1.00 10.13 S ATOM 439 CE MET A 28 -12.879 12.102 12.650 1.00 23.30 C ATOM 0 H MET A 28 -14.364 10.275 8.238 1.00 32.21 H new ATOM 0 HA MET A 28 -11.686 9.239 8.479 1.00 72.44 H new ATOM 0 HB2 MET A 28 -12.399 11.405 9.413 1.00 54.12 H new ATOM 0 HB3 MET A 28 -13.543 10.590 10.461 1.00 54.12 H new ATOM 0 HG2 MET A 28 -11.768 9.512 11.698 1.00 54.42 H new ATOM 0 HG3 MET A 28 -10.561 10.041 10.543 1.00 54.42 H new ATOM 0 HE1 MET A 28 -12.833 12.851 13.441 1.00 23.30 H new ATOM 0 HE2 MET A 28 -13.539 12.453 11.856 1.00 23.30 H new ATOM 0 HE3 MET A 28 -13.266 11.168 13.057 1.00 23.30 H new ATOM 449 N SER A 29 -12.244 6.953 9.262 1.00 14.24 N ATOM 450 CA SER A 29 -12.441 5.597 9.768 1.00 23.33 C ATOM 451 C SER A 29 -13.775 5.031 9.272 1.00 41.31 C ATOM 452 O SER A 29 -14.767 4.980 10.003 1.00 23.14 O ATOM 453 CB SER A 29 -12.354 5.546 11.300 1.00 42.10 C ATOM 454 OG SER A 29 -12.322 4.208 11.770 1.00 63.33 O ATOM 0 H SER A 29 -11.522 7.021 8.545 1.00 14.24 H new ATOM 0 HA SER A 29 -11.635 4.974 9.380 1.00 23.33 H new ATOM 0 HB2 SER A 29 -11.460 6.072 11.633 1.00 42.10 H new ATOM 0 HB3 SER A 29 -13.209 6.065 11.732 1.00 42.10 H new ATOM 0 HG SER A 29 -12.265 4.206 12.748 1.00 63.33 H new ATOM 460 N GLU A 30 -13.801 4.667 7.994 1.00 73.40 N ATOM 461 CA GLU A 30 -14.968 4.031 7.385 1.00 62.22 C ATOM 462 C GLU A 30 -14.508 3.065 6.293 1.00 15.24 C ATOM 463 O GLU A 30 -15.288 2.284 5.760 1.00 33.23 O ATOM 464 CB GLU A 30 -15.906 5.110 6.813 1.00 2.43 C ATOM 465 CG GLU A 30 -17.296 4.620 6.407 1.00 42.50 C ATOM 466 CD GLU A 30 -17.377 4.124 4.972 1.00 3.33 C ATOM 467 OE1 GLU A 30 -17.057 4.904 4.046 1.00 60.41 O ATOM 468 OE2 GLU A 30 -17.770 2.958 4.760 1.00 43.14 O ATOM 0 H GLU A 30 -13.019 4.803 7.353 1.00 73.40 H new ATOM 0 HA GLU A 30 -15.518 3.465 8.137 1.00 62.22 H new ATOM 0 HB2 GLU A 30 -16.020 5.900 7.556 1.00 2.43 H new ATOM 0 HB3 GLU A 30 -15.428 5.558 5.942 1.00 2.43 H new ATOM 0 HG2 GLU A 30 -17.597 3.815 7.077 1.00 42.50 H new ATOM 0 HG3 GLU A 30 -18.011 5.432 6.542 1.00 42.50 H new ATOM 475 N LEU A 31 -13.205 3.082 6.021 1.00 43.31 N ATOM 476 CA LEU A 31 -12.628 2.334 4.906 1.00 61.04 C ATOM 477 C LEU A 31 -12.874 0.826 5.008 1.00 60.04 C ATOM 478 O LEU A 31 -12.738 0.112 4.018 1.00 11.20 O ATOM 479 CB LEU A 31 -11.125 2.639 4.790 1.00 51.10 C ATOM 480 CG LEU A 31 -10.318 2.594 6.095 1.00 40.13 C ATOM 481 CD1 LEU A 31 -10.058 1.162 6.543 1.00 4.11 C ATOM 482 CD2 LEU A 31 -9.005 3.343 5.929 1.00 42.14 C ATOM 0 H LEU A 31 -12.523 3.611 6.564 1.00 43.31 H new ATOM 0 HA LEU A 31 -13.135 2.664 3.999 1.00 61.04 H new ATOM 0 HB2 LEU A 31 -10.685 1.928 4.091 1.00 51.10 H new ATOM 0 HB3 LEU A 31 -11.010 3.630 4.351 1.00 51.10 H new ATOM 0 HG LEU A 31 -10.910 3.081 6.870 1.00 40.13 H new ATOM 0 HD11 LEU A 31 -9.484 1.169 7.470 1.00 4.11 H new ATOM 0 HD12 LEU A 31 -11.008 0.654 6.708 1.00 4.11 H new ATOM 0 HD13 LEU A 31 -9.495 0.636 5.772 1.00 4.11 H new ATOM 0 HD21 LEU A 31 -8.443 3.303 6.862 1.00 42.14 H new ATOM 0 HD22 LEU A 31 -8.421 2.881 5.133 1.00 42.14 H new ATOM 0 HD23 LEU A 31 -9.209 4.383 5.673 1.00 42.14 H new ATOM 494 N GLY A 32 -13.248 0.350 6.193 1.00 2.12 N ATOM 495 CA GLY A 32 -13.500 -1.070 6.382 1.00 54.54 C ATOM 496 C GLY A 32 -14.548 -1.605 5.421 1.00 62.30 C ATOM 497 O GLY A 32 -14.368 -2.660 4.814 1.00 51.42 O ATOM 0 H GLY A 32 -13.381 0.922 7.027 1.00 2.12 H new ATOM 0 HA2 GLY A 32 -12.570 -1.623 6.246 1.00 54.54 H new ATOM 0 HA3 GLY A 32 -13.828 -1.245 7.407 1.00 54.54 H new ATOM 501 N SER A 33 -15.634 -0.863 5.265 1.00 64.12 N ATOM 502 CA SER A 33 -16.705 -1.256 4.364 1.00 22.32 C ATOM 503 C SER A 33 -16.321 -0.997 2.907 1.00 34.20 C ATOM 504 O SER A 33 -16.725 -1.731 2.001 1.00 31.05 O ATOM 505 CB SER A 33 -17.977 -0.489 4.729 1.00 1.25 C ATOM 506 OG SER A 33 -17.694 0.528 5.683 1.00 62.40 O ATOM 0 H SER A 33 -15.796 0.018 5.753 1.00 64.12 H new ATOM 0 HA SER A 33 -16.883 -2.326 4.472 1.00 22.32 H new ATOM 0 HB2 SER A 33 -18.409 -0.044 3.833 1.00 1.25 H new ATOM 0 HB3 SER A 33 -18.719 -1.177 5.133 1.00 1.25 H new ATOM 0 HG SER A 33 -17.957 1.399 5.320 1.00 62.40 H new ATOM 512 N LEU A 34 -15.513 0.033 2.697 1.00 23.22 N ATOM 513 CA LEU A 34 -15.135 0.460 1.356 1.00 12.14 C ATOM 514 C LEU A 34 -14.142 -0.514 0.718 1.00 21.31 C ATOM 515 O LEU A 34 -14.211 -0.779 -0.483 1.00 4.11 O ATOM 516 CB LEU A 34 -14.544 1.869 1.410 1.00 75.24 C ATOM 517 CG LEU A 34 -14.291 2.528 0.051 1.00 61.41 C ATOM 518 CD1 LEU A 34 -15.585 2.637 -0.744 1.00 34.10 C ATOM 519 CD2 LEU A 34 -13.671 3.900 0.241 1.00 15.05 C ATOM 0 H LEU A 34 -15.103 0.593 3.445 1.00 23.22 H new ATOM 0 HA LEU A 34 -16.030 0.469 0.735 1.00 12.14 H new ATOM 0 HB2 LEU A 34 -15.218 2.505 1.984 1.00 75.24 H new ATOM 0 HB3 LEU A 34 -13.602 1.829 1.956 1.00 75.24 H new ATOM 0 HG LEU A 34 -13.596 1.903 -0.511 1.00 61.41 H new ATOM 0 HD11 LEU A 34 -15.382 3.108 -1.706 1.00 34.10 H new ATOM 0 HD12 LEU A 34 -15.997 1.641 -0.907 1.00 34.10 H new ATOM 0 HD13 LEU A 34 -16.303 3.240 -0.189 1.00 34.10 H new ATOM 0 HD21 LEU A 34 -13.496 4.358 -0.732 1.00 15.05 H new ATOM 0 HD22 LEU A 34 -14.347 4.528 0.821 1.00 15.05 H new ATOM 0 HD23 LEU A 34 -12.724 3.801 0.771 1.00 15.05 H new ATOM 531 N PHE A 35 -13.226 -1.048 1.522 1.00 73.35 N ATOM 532 CA PHE A 35 -12.231 -1.998 1.026 1.00 5.54 C ATOM 533 C PHE A 35 -12.890 -3.245 0.444 1.00 51.02 C ATOM 534 O PHE A 35 -12.455 -3.764 -0.583 1.00 33.11 O ATOM 535 CB PHE A 35 -11.258 -2.389 2.140 1.00 21.11 C ATOM 536 CG PHE A 35 -10.045 -1.503 2.224 1.00 74.31 C ATOM 537 CD1 PHE A 35 -10.169 -0.139 2.431 1.00 24.33 C ATOM 538 CD2 PHE A 35 -8.776 -2.042 2.087 1.00 70.24 C ATOM 539 CE1 PHE A 35 -9.053 0.671 2.502 1.00 11.15 C ATOM 540 CE2 PHE A 35 -7.654 -1.237 2.157 1.00 14.44 C ATOM 541 CZ PHE A 35 -7.794 0.122 2.366 1.00 14.12 C ATOM 0 H PHE A 35 -13.151 -0.840 2.518 1.00 73.35 H new ATOM 0 HA PHE A 35 -11.676 -1.505 0.227 1.00 5.54 H new ATOM 0 HB2 PHE A 35 -11.783 -2.362 3.095 1.00 21.11 H new ATOM 0 HB3 PHE A 35 -10.935 -3.418 1.983 1.00 21.11 H new ATOM 0 HD1 PHE A 35 -11.151 0.297 2.538 1.00 24.33 H new ATOM 0 HD2 PHE A 35 -8.662 -3.103 1.924 1.00 70.24 H new ATOM 0 HE1 PHE A 35 -9.165 1.733 2.664 1.00 11.15 H new ATOM 0 HE2 PHE A 35 -6.670 -1.669 2.049 1.00 14.44 H new ATOM 0 HZ PHE A 35 -6.920 0.753 2.423 1.00 14.12 H new ATOM 551 N GLU A 36 -13.947 -3.710 1.096 1.00 13.32 N ATOM 552 CA GLU A 36 -14.687 -4.872 0.616 1.00 73.14 C ATOM 553 C GLU A 36 -15.287 -4.578 -0.759 1.00 34.14 C ATOM 554 O GLU A 36 -15.201 -5.396 -1.682 1.00 24.20 O ATOM 555 CB GLU A 36 -15.778 -5.245 1.633 1.00 42.32 C ATOM 556 CG GLU A 36 -16.634 -6.446 1.249 1.00 5.32 C ATOM 557 CD GLU A 36 -17.884 -6.059 0.483 1.00 1.40 C ATOM 558 OE1 GLU A 36 -18.884 -5.678 1.128 1.00 34.51 O ATOM 559 OE2 GLU A 36 -17.877 -6.134 -0.761 1.00 4.30 O ATOM 0 H GLU A 36 -14.312 -3.302 1.957 1.00 13.32 H new ATOM 0 HA GLU A 36 -14.011 -5.720 0.512 1.00 73.14 H new ATOM 0 HB2 GLU A 36 -15.304 -5.448 2.593 1.00 42.32 H new ATOM 0 HB3 GLU A 36 -16.431 -4.384 1.775 1.00 42.32 H new ATOM 0 HG2 GLU A 36 -16.040 -7.130 0.643 1.00 5.32 H new ATOM 0 HG3 GLU A 36 -16.920 -6.986 2.152 1.00 5.32 H new ATOM 566 N ALA A 37 -15.868 -3.392 -0.890 1.00 72.33 N ATOM 567 CA ALA A 37 -16.466 -2.961 -2.143 1.00 61.22 C ATOM 568 C ALA A 37 -15.406 -2.829 -3.232 1.00 61.00 C ATOM 569 O ALA A 37 -15.615 -3.255 -4.365 1.00 25.25 O ATOM 570 CB ALA A 37 -17.195 -1.639 -1.950 1.00 74.32 C ATOM 0 H ALA A 37 -15.937 -2.708 -0.136 1.00 72.33 H new ATOM 0 HA ALA A 37 -17.186 -3.717 -2.458 1.00 61.22 H new ATOM 0 HB1 ALA A 37 -17.639 -1.327 -2.895 1.00 74.32 H new ATOM 0 HB2 ALA A 37 -17.980 -1.762 -1.204 1.00 74.32 H new ATOM 0 HB3 ALA A 37 -16.489 -0.880 -1.612 1.00 74.32 H new ATOM 576 N GLY A 38 -14.266 -2.252 -2.870 1.00 23.40 N ATOM 577 CA GLY A 38 -13.186 -2.055 -3.821 1.00 75.32 C ATOM 578 C GLY A 38 -12.635 -3.361 -4.361 1.00 70.21 C ATOM 579 O GLY A 38 -12.306 -3.457 -5.543 1.00 42.15 O ATOM 0 H GLY A 38 -14.069 -1.915 -1.928 1.00 23.40 H new ATOM 0 HA2 GLY A 38 -13.545 -1.446 -4.651 1.00 75.32 H new ATOM 0 HA3 GLY A 38 -12.382 -1.497 -3.341 1.00 75.32 H new ATOM 583 N TYR A 39 -12.540 -4.367 -3.498 1.00 10.14 N ATOM 584 CA TYR A 39 -12.037 -5.677 -3.901 1.00 42.41 C ATOM 585 C TYR A 39 -12.968 -6.309 -4.936 1.00 43.14 C ATOM 586 O TYR A 39 -12.519 -6.892 -5.921 1.00 22.14 O ATOM 587 CB TYR A 39 -11.900 -6.590 -2.678 1.00 64.13 C ATOM 588 CG TYR A 39 -11.187 -7.895 -2.958 1.00 64.35 C ATOM 589 CD1 TYR A 39 -9.801 -7.946 -3.035 1.00 45.22 C ATOM 590 CD2 TYR A 39 -11.898 -9.075 -3.136 1.00 51.34 C ATOM 591 CE1 TYR A 39 -9.142 -9.136 -3.282 1.00 53.32 C ATOM 592 CE2 TYR A 39 -11.247 -10.269 -3.383 1.00 22.21 C ATOM 593 CZ TYR A 39 -9.869 -10.294 -3.457 1.00 30.13 C ATOM 594 OH TYR A 39 -9.213 -11.480 -3.702 1.00 21.42 O ATOM 0 H TYR A 39 -12.804 -4.301 -2.515 1.00 10.14 H new ATOM 0 HA TYR A 39 -11.053 -5.550 -4.353 1.00 42.41 H new ATOM 0 HB2 TYR A 39 -11.361 -6.054 -1.897 1.00 64.13 H new ATOM 0 HB3 TYR A 39 -12.894 -6.808 -2.288 1.00 64.13 H new ATOM 0 HD1 TYR A 39 -9.228 -7.040 -2.900 1.00 45.22 H new ATOM 0 HD2 TYR A 39 -12.976 -9.059 -3.081 1.00 51.34 H new ATOM 0 HE1 TYR A 39 -8.064 -9.158 -3.338 1.00 53.32 H new ATOM 0 HE2 TYR A 39 -11.814 -11.178 -3.517 1.00 22.21 H new ATOM 0 HH TYR A 39 -9.868 -12.202 -3.800 1.00 21.42 H new ATOM 604 N HIS A 40 -14.270 -6.191 -4.703 1.00 65.00 N ATOM 605 CA HIS A 40 -15.269 -6.713 -5.631 1.00 23.54 C ATOM 606 C HIS A 40 -15.348 -5.869 -6.903 1.00 34.24 C ATOM 607 O HIS A 40 -15.648 -6.378 -7.981 1.00 41.43 O ATOM 608 CB HIS A 40 -16.644 -6.795 -4.959 1.00 51.14 C ATOM 609 CG HIS A 40 -16.776 -7.953 -4.016 1.00 42.13 C ATOM 610 ND1 HIS A 40 -17.008 -7.816 -2.662 1.00 53.41 N ATOM 611 CD2 HIS A 40 -16.710 -9.285 -4.248 1.00 11.34 C ATOM 612 CE1 HIS A 40 -17.075 -9.012 -2.107 1.00 74.30 C ATOM 613 NE2 HIS A 40 -16.898 -9.918 -3.047 1.00 43.03 N ATOM 0 H HIS A 40 -14.660 -5.737 -3.877 1.00 65.00 H new ATOM 0 HA HIS A 40 -14.958 -7.718 -5.915 1.00 23.54 H new ATOM 0 HB2 HIS A 40 -16.830 -5.869 -4.415 1.00 51.14 H new ATOM 0 HB3 HIS A 40 -17.412 -6.873 -5.728 1.00 51.14 H new ATOM 0 HD1 HIS A 40 -17.111 -6.930 -2.168 1.00 53.41 H new ATOM 0 HD2 HIS A 40 -16.541 -9.761 -5.203 1.00 11.34 H new ATOM 0 HE1 HIS A 40 -17.246 -9.214 -1.060 1.00 74.30 H new ATOM 622 N ASP A 41 -15.075 -4.578 -6.764 1.00 61.22 N ATOM 623 CA ASP A 41 -15.223 -3.620 -7.863 1.00 23.43 C ATOM 624 C ASP A 41 -14.317 -3.964 -9.047 1.00 72.44 C ATOM 625 O ASP A 41 -14.703 -3.794 -10.203 1.00 43.35 O ATOM 626 CB ASP A 41 -14.914 -2.206 -7.362 1.00 1.34 C ATOM 627 CG ASP A 41 -15.485 -1.128 -8.260 1.00 34.41 C ATOM 628 OD1 ASP A 41 -16.650 -0.731 -8.044 1.00 13.11 O ATOM 629 OD2 ASP A 41 -14.775 -0.658 -9.170 1.00 52.05 O ATOM 0 H ASP A 41 -14.746 -4.162 -5.893 1.00 61.22 H new ATOM 0 HA ASP A 41 -16.254 -3.671 -8.212 1.00 23.43 H new ATOM 0 HB2 ASP A 41 -15.316 -2.086 -6.356 1.00 1.34 H new ATOM 0 HB3 ASP A 41 -13.834 -2.079 -7.290 1.00 1.34 H new ATOM 634 N ILE A 42 -13.125 -4.475 -8.758 1.00 0.20 N ATOM 635 CA ILE A 42 -12.144 -4.775 -9.805 1.00 53.43 C ATOM 636 C ILE A 42 -12.355 -6.162 -10.414 1.00 65.35 C ATOM 637 O ILE A 42 -11.561 -6.607 -11.247 1.00 43.13 O ATOM 638 CB ILE A 42 -10.697 -4.681 -9.272 1.00 31.00 C ATOM 639 CG1 ILE A 42 -10.494 -5.636 -8.092 1.00 35.40 C ATOM 640 CG2 ILE A 42 -10.371 -3.251 -8.871 1.00 31.03 C ATOM 641 CD1 ILE A 42 -9.079 -5.656 -7.552 1.00 61.32 C ATOM 0 H ILE A 42 -12.812 -4.691 -7.812 1.00 0.20 H new ATOM 0 HA ILE A 42 -12.296 -4.023 -10.580 1.00 53.43 H new ATOM 0 HB ILE A 42 -10.015 -4.977 -10.069 1.00 31.00 H new ATOM 0 HG12 ILE A 42 -11.175 -5.354 -7.289 1.00 35.40 H new ATOM 0 HG13 ILE A 42 -10.768 -6.644 -8.403 1.00 35.40 H new ATOM 0 HG21 ILE A 42 -9.348 -3.202 -8.498 1.00 31.03 H new ATOM 0 HG22 ILE A 42 -10.473 -2.598 -9.738 1.00 31.03 H new ATOM 0 HG23 ILE A 42 -11.058 -2.927 -8.090 1.00 31.03 H new ATOM 0 HD11 ILE A 42 -9.017 -6.356 -6.719 1.00 61.32 H new ATOM 0 HD12 ILE A 42 -8.393 -5.968 -8.340 1.00 61.32 H new ATOM 0 HD13 ILE A 42 -8.807 -4.658 -7.208 1.00 61.32 H new ATOM 653 N LEU A 43 -13.431 -6.831 -10.014 1.00 72.34 N ATOM 654 CA LEU A 43 -13.716 -8.190 -10.470 1.00 73.10 C ATOM 655 C LEU A 43 -13.745 -8.288 -11.997 1.00 25.34 C ATOM 656 O LEU A 43 -13.103 -9.161 -12.581 1.00 51.15 O ATOM 657 CB LEU A 43 -15.057 -8.663 -9.906 1.00 30.21 C ATOM 658 CG LEU A 43 -15.461 -10.090 -10.285 1.00 12.25 C ATOM 659 CD1 LEU A 43 -14.497 -11.100 -9.681 1.00 12.22 C ATOM 660 CD2 LEU A 43 -16.887 -10.373 -9.840 1.00 11.24 C ATOM 0 H LEU A 43 -14.126 -6.452 -9.370 1.00 72.34 H new ATOM 0 HA LEU A 43 -12.912 -8.829 -10.106 1.00 73.10 H new ATOM 0 HB2 LEU A 43 -15.021 -8.590 -8.819 1.00 30.21 H new ATOM 0 HB3 LEU A 43 -15.836 -7.980 -10.246 1.00 30.21 H new ATOM 0 HG LEU A 43 -15.414 -10.185 -11.370 1.00 12.25 H new ATOM 0 HD11 LEU A 43 -14.802 -12.108 -9.963 1.00 12.22 H new ATOM 0 HD12 LEU A 43 -13.490 -10.909 -10.052 1.00 12.22 H new ATOM 0 HD13 LEU A 43 -14.507 -11.008 -8.595 1.00 12.22 H new ATOM 0 HD21 LEU A 43 -17.159 -11.392 -10.117 1.00 11.24 H new ATOM 0 HD22 LEU A 43 -16.960 -10.259 -8.758 1.00 11.24 H new ATOM 0 HD23 LEU A 43 -17.566 -9.672 -10.325 1.00 11.24 H new ATOM 672 N GLN A 44 -14.477 -7.380 -12.634 1.00 72.02 N ATOM 673 CA GLN A 44 -14.698 -7.440 -14.077 1.00 14.33 C ATOM 674 C GLN A 44 -13.385 -7.306 -14.852 1.00 62.52 C ATOM 675 O GLN A 44 -13.139 -8.039 -15.806 1.00 34.53 O ATOM 676 CB GLN A 44 -15.675 -6.331 -14.491 1.00 23.22 C ATOM 677 CG GLN A 44 -16.647 -6.708 -15.608 1.00 30.12 C ATOM 678 CD GLN A 44 -15.966 -7.058 -16.917 1.00 31.53 C ATOM 679 OE1 GLN A 44 -15.729 -8.339 -17.139 1.00 63.22 O flip ATOM 680 NE2 GLN A 44 -15.688 -6.188 -17.738 1.00 12.31 N flip ATOM 0 H GLN A 44 -14.929 -6.591 -12.173 1.00 72.02 H new ATOM 0 HA GLN A 44 -15.124 -8.414 -14.319 1.00 14.33 H new ATOM 0 HB2 GLN A 44 -16.251 -6.030 -13.616 1.00 23.22 H new ATOM 0 HB3 GLN A 44 -15.100 -5.461 -14.809 1.00 23.22 H new ATOM 0 HG2 GLN A 44 -17.248 -7.557 -15.283 1.00 30.12 H new ATOM 0 HG3 GLN A 44 -17.333 -5.878 -15.776 1.00 30.12 H new ATOM 0 HE21 GLN A 44 -15.886 -5.209 -17.531 1.00 12.31 H new ATOM 0 HE22 GLN A 44 -15.259 -6.444 -18.627 1.00 12.31 H new ATOM 689 N LEU A 45 -12.523 -6.394 -14.425 1.00 53.32 N ATOM 690 CA LEU A 45 -11.309 -6.106 -15.179 1.00 15.13 C ATOM 691 C LEU A 45 -10.266 -7.212 -14.997 1.00 5.45 C ATOM 692 O LEU A 45 -9.404 -7.409 -15.855 1.00 75.15 O ATOM 693 CB LEU A 45 -10.732 -4.746 -14.773 1.00 45.45 C ATOM 694 CG LEU A 45 -9.568 -4.249 -15.637 1.00 3.22 C ATOM 695 CD1 LEU A 45 -10.009 -4.073 -17.082 1.00 71.20 C ATOM 696 CD2 LEU A 45 -9.019 -2.943 -15.093 1.00 14.13 C ATOM 0 H LEU A 45 -12.638 -5.847 -13.572 1.00 53.32 H new ATOM 0 HA LEU A 45 -11.573 -6.068 -16.236 1.00 15.13 H new ATOM 0 HB2 LEU A 45 -11.531 -4.005 -14.806 1.00 45.45 H new ATOM 0 HB3 LEU A 45 -10.396 -4.806 -13.738 1.00 45.45 H new ATOM 0 HG LEU A 45 -8.777 -4.999 -15.605 1.00 3.22 H new ATOM 0 HD11 LEU A 45 -9.168 -3.720 -17.679 1.00 71.20 H new ATOM 0 HD12 LEU A 45 -10.357 -5.028 -17.475 1.00 71.20 H new ATOM 0 HD13 LEU A 45 -10.819 -3.345 -17.129 1.00 71.20 H new ATOM 0 HD21 LEU A 45 -8.193 -2.606 -15.720 1.00 14.13 H new ATOM 0 HD22 LEU A 45 -9.806 -2.189 -15.094 1.00 14.13 H new ATOM 0 HD23 LEU A 45 -8.663 -3.094 -14.074 1.00 14.13 H new ATOM 708 N LEU A 46 -10.348 -7.938 -13.893 1.00 51.11 N ATOM 709 CA LEU A 46 -9.414 -9.030 -13.639 1.00 54.33 C ATOM 710 C LEU A 46 -9.952 -10.362 -14.162 1.00 20.23 C ATOM 711 O LEU A 46 -9.301 -11.028 -14.974 1.00 25.13 O ATOM 712 CB LEU A 46 -9.093 -9.148 -12.143 1.00 72.54 C ATOM 713 CG LEU A 46 -7.910 -8.305 -11.640 1.00 21.42 C ATOM 714 CD1 LEU A 46 -6.639 -8.654 -12.400 1.00 33.43 C ATOM 715 CD2 LEU A 46 -8.199 -6.818 -11.751 1.00 21.22 C ATOM 0 H LEU A 46 -11.045 -7.795 -13.162 1.00 51.11 H new ATOM 0 HA LEU A 46 -8.496 -8.796 -14.177 1.00 54.33 H new ATOM 0 HB2 LEU A 46 -9.981 -8.866 -11.578 1.00 72.54 H new ATOM 0 HB3 LEU A 46 -8.890 -10.195 -11.916 1.00 72.54 H new ATOM 0 HG LEU A 46 -7.764 -8.541 -10.586 1.00 21.42 H new ATOM 0 HD11 LEU A 46 -5.814 -8.046 -12.028 1.00 33.43 H new ATOM 0 HD12 LEU A 46 -6.406 -9.709 -12.255 1.00 33.43 H new ATOM 0 HD13 LEU A 46 -6.785 -8.457 -13.462 1.00 33.43 H new ATOM 0 HD21 LEU A 46 -7.341 -6.252 -11.387 1.00 21.22 H new ATOM 0 HD22 LEU A 46 -8.387 -6.561 -12.793 1.00 21.22 H new ATOM 0 HD23 LEU A 46 -9.076 -6.572 -11.153 1.00 21.22 H new ATOM 727 N ALA A 47 -11.150 -10.732 -13.725 1.00 34.30 N ATOM 728 CA ALA A 47 -11.696 -12.052 -14.025 1.00 35.44 C ATOM 729 C ALA A 47 -12.397 -12.070 -15.378 1.00 51.00 C ATOM 730 O ALA A 47 -12.470 -13.110 -16.033 1.00 4.25 O ATOM 731 CB ALA A 47 -12.656 -12.485 -12.925 1.00 24.01 C ATOM 0 H ALA A 47 -11.761 -10.139 -13.163 1.00 34.30 H new ATOM 0 HA ALA A 47 -10.866 -12.757 -14.071 1.00 35.44 H new ATOM 0 HB1 ALA A 47 -13.057 -13.471 -13.159 1.00 24.01 H new ATOM 0 HB2 ALA A 47 -12.125 -12.526 -11.974 1.00 24.01 H new ATOM 0 HB3 ALA A 47 -13.474 -11.768 -12.853 1.00 24.01 H new ATOM 737 N GLY A 48 -12.893 -10.911 -15.797 1.00 75.32 N ATOM 738 CA GLY A 48 -13.617 -10.817 -17.051 1.00 25.42 C ATOM 739 C GLY A 48 -12.767 -11.198 -18.243 1.00 13.14 C ATOM 740 O GLY A 48 -13.264 -11.774 -19.210 1.00 35.22 O ATOM 0 H GLY A 48 -12.806 -10.031 -15.288 1.00 75.32 H new ATOM 0 HA2 GLY A 48 -14.492 -11.466 -17.011 1.00 25.42 H new ATOM 0 HA3 GLY A 48 -13.982 -9.798 -17.180 1.00 25.42 H new ATOM 744 N GLN A 49 -11.482 -10.878 -18.172 1.00 62.13 N ATOM 745 CA GLN A 49 -10.547 -11.248 -19.221 1.00 42.12 C ATOM 746 C GLN A 49 -9.891 -12.576 -18.878 1.00 13.34 C ATOM 747 O GLN A 49 -10.108 -13.582 -19.548 1.00 2.42 O ATOM 748 CB GLN A 49 -9.469 -10.170 -19.413 1.00 54.21 C ATOM 749 CG GLN A 49 -9.940 -8.922 -20.149 1.00 32.31 C ATOM 750 CD GLN A 49 -10.965 -8.119 -19.374 1.00 70.14 C ATOM 751 OE1 GLN A 49 -10.493 -7.209 -18.539 1.00 12.24 O flip ATOM 752 NE2 GLN A 49 -12.170 -8.317 -19.520 1.00 15.03 N flip ATOM 0 H GLN A 49 -11.065 -10.362 -17.397 1.00 62.13 H new ATOM 0 HA GLN A 49 -11.102 -11.342 -20.154 1.00 42.12 H new ATOM 0 HB2 GLN A 49 -9.090 -9.876 -18.434 1.00 54.21 H new ATOM 0 HB3 GLN A 49 -8.633 -10.605 -19.961 1.00 54.21 H new ATOM 0 HG2 GLN A 49 -9.079 -8.289 -20.363 1.00 32.31 H new ATOM 0 HG3 GLN A 49 -10.367 -9.214 -21.108 1.00 32.31 H new ATOM 0 HE21 GLN A 49 -12.494 -9.029 -20.175 1.00 15.03 H new ATOM 0 HE22 GLN A 49 -12.845 -7.769 -18.986 1.00 15.03 H new ATOM 761 N GLY A 50 -9.116 -12.578 -17.804 1.00 71.23 N ATOM 762 CA GLY A 50 -8.392 -13.768 -17.416 1.00 72.10 C ATOM 763 C GLY A 50 -7.007 -13.436 -16.911 1.00 62.15 C ATOM 764 O GLY A 50 -6.005 -13.884 -17.470 1.00 3.32 O ATOM 0 H GLY A 50 -8.976 -11.773 -17.193 1.00 71.23 H new ATOM 0 HA2 GLY A 50 -8.946 -14.295 -16.640 1.00 72.10 H new ATOM 0 HA3 GLY A 50 -8.317 -14.443 -18.268 1.00 72.10 H new ATOM 768 N LYS A 51 -6.951 -12.621 -15.871 1.00 55.02 N ATOM 769 CA LYS A 51 -5.685 -12.238 -15.271 1.00 14.15 C ATOM 770 C LYS A 51 -5.857 -12.033 -13.771 1.00 22.55 C ATOM 771 O LYS A 51 -6.971 -12.123 -13.250 1.00 74.13 O ATOM 772 CB LYS A 51 -5.135 -10.981 -15.952 1.00 42.21 C ATOM 773 CG LYS A 51 -6.094 -9.801 -15.954 1.00 71.33 C ATOM 774 CD LYS A 51 -5.689 -8.771 -16.993 1.00 43.33 C ATOM 775 CE LYS A 51 -5.923 -9.298 -18.400 1.00 34.35 C ATOM 776 NZ LYS A 51 -5.398 -8.383 -19.451 1.00 74.01 N ATOM 0 H LYS A 51 -7.771 -12.211 -15.424 1.00 55.02 H new ATOM 0 HA LYS A 51 -4.960 -13.039 -15.418 1.00 14.15 H new ATOM 0 HB2 LYS A 51 -4.213 -10.684 -15.451 1.00 42.21 H new ATOM 0 HB3 LYS A 51 -4.874 -11.224 -16.982 1.00 42.21 H new ATOM 0 HG2 LYS A 51 -7.106 -10.151 -16.159 1.00 71.33 H new ATOM 0 HG3 LYS A 51 -6.110 -9.340 -14.967 1.00 71.33 H new ATOM 0 HD2 LYS A 51 -6.260 -7.855 -16.844 1.00 43.33 H new ATOM 0 HD3 LYS A 51 -4.637 -8.515 -16.866 1.00 43.33 H new ATOM 0 HE2 LYS A 51 -5.447 -10.273 -18.502 1.00 34.35 H new ATOM 0 HE3 LYS A 51 -6.992 -9.447 -18.555 1.00 34.35 H new ATOM 0 HZ1 LYS A 51 -5.190 -8.927 -20.312 1.00 74.01 H new ATOM 0 HZ2 LYS A 51 -6.110 -7.655 -19.665 1.00 74.01 H new ATOM 0 HZ3 LYS A 51 -4.528 -7.927 -19.111 1.00 74.01 H new ATOM 790 N SER A 52 -4.762 -11.776 -13.077 1.00 34.25 N ATOM 791 CA SER A 52 -4.788 -11.655 -11.625 1.00 51.11 C ATOM 792 C SER A 52 -3.668 -10.738 -11.145 1.00 74.23 C ATOM 793 O SER A 52 -2.756 -10.412 -11.912 1.00 40.55 O ATOM 794 CB SER A 52 -4.637 -13.041 -10.983 1.00 62.00 C ATOM 795 OG SER A 52 -5.634 -13.935 -11.450 1.00 5.41 O ATOM 0 H SER A 52 -3.840 -11.646 -13.494 1.00 34.25 H new ATOM 0 HA SER A 52 -5.744 -11.223 -11.329 1.00 51.11 H new ATOM 0 HB2 SER A 52 -3.650 -13.443 -11.209 1.00 62.00 H new ATOM 0 HB3 SER A 52 -4.704 -12.952 -9.899 1.00 62.00 H new ATOM 0 HG SER A 52 -5.513 -14.810 -11.026 1.00 5.41 H new ATOM 801 N PRO A 53 -3.742 -10.273 -9.884 1.00 14.32 N ATOM 802 CA PRO A 53 -2.637 -9.557 -9.250 1.00 23.52 C ATOM 803 C PRO A 53 -1.423 -10.471 -9.087 1.00 4.01 C ATOM 804 O PRO A 53 -1.570 -11.687 -8.961 1.00 14.04 O ATOM 805 CB PRO A 53 -3.193 -9.154 -7.877 1.00 12.40 C ATOM 806 CG PRO A 53 -4.673 -9.281 -8.001 1.00 1.31 C ATOM 807 CD PRO A 53 -4.905 -10.386 -8.988 1.00 40.41 C ATOM 0 HA PRO A 53 -2.302 -8.702 -9.837 1.00 23.52 H new ATOM 0 HB2 PRO A 53 -2.807 -9.802 -7.090 1.00 12.40 H new ATOM 0 HB3 PRO A 53 -2.906 -8.135 -7.620 1.00 12.40 H new ATOM 0 HG2 PRO A 53 -5.128 -9.514 -7.038 1.00 1.31 H new ATOM 0 HG3 PRO A 53 -5.118 -8.348 -8.346 1.00 1.31 H new ATOM 0 HD2 PRO A 53 -4.948 -11.360 -8.501 1.00 40.41 H new ATOM 0 HD3 PRO A 53 -5.844 -10.257 -9.526 1.00 40.41 H new ATOM 815 N SER A 54 -0.234 -9.897 -9.091 1.00 72.33 N ATOM 816 CA SER A 54 0.984 -10.693 -9.028 1.00 11.12 C ATOM 817 C SER A 54 1.604 -10.638 -7.634 1.00 43.12 C ATOM 818 O SER A 54 2.203 -11.609 -7.175 1.00 14.02 O ATOM 819 CB SER A 54 1.990 -10.210 -10.080 1.00 74.41 C ATOM 820 OG SER A 54 3.125 -11.057 -10.137 1.00 0.12 O ATOM 0 H SER A 54 -0.083 -8.889 -9.137 1.00 72.33 H new ATOM 0 HA SER A 54 0.723 -11.730 -9.240 1.00 11.12 H new ATOM 0 HB2 SER A 54 1.509 -10.177 -11.058 1.00 74.41 H new ATOM 0 HB3 SER A 54 2.304 -9.193 -9.845 1.00 74.41 H new ATOM 0 HG SER A 54 3.747 -10.725 -10.817 1.00 0.12 H new ATOM 826 N GLY A 55 1.437 -9.514 -6.951 1.00 54.35 N ATOM 827 CA GLY A 55 2.066 -9.341 -5.659 1.00 44.32 C ATOM 828 C GLY A 55 1.079 -8.934 -4.587 1.00 72.32 C ATOM 829 O GLY A 55 -0.117 -8.822 -4.860 1.00 20.22 O ATOM 0 H GLY A 55 0.879 -8.721 -7.268 1.00 54.35 H new ATOM 0 HA2 GLY A 55 2.552 -10.272 -5.367 1.00 44.32 H new ATOM 0 HA3 GLY A 55 2.847 -8.584 -5.736 1.00 44.32 H new ATOM 833 N PRO A 56 1.553 -8.708 -3.355 1.00 21.44 N ATOM 834 CA PRO A 56 0.699 -8.292 -2.242 1.00 25.22 C ATOM 835 C PRO A 56 0.270 -6.831 -2.369 1.00 14.22 C ATOM 836 O PRO A 56 0.987 -6.017 -2.952 1.00 71.22 O ATOM 837 CB PRO A 56 1.594 -8.477 -1.008 1.00 53.23 C ATOM 838 CG PRO A 56 2.824 -9.179 -1.489 1.00 22.32 C ATOM 839 CD PRO A 56 2.952 -8.845 -2.943 1.00 2.24 C ATOM 0 HA PRO A 56 -0.226 -8.868 -2.200 1.00 25.22 H new ATOM 0 HB2 PRO A 56 1.844 -7.515 -0.560 1.00 53.23 H new ATOM 0 HB3 PRO A 56 1.085 -9.062 -0.242 1.00 53.23 H new ATOM 0 HG2 PRO A 56 3.703 -8.849 -0.935 1.00 22.32 H new ATOM 0 HG3 PRO A 56 2.740 -10.256 -1.343 1.00 22.32 H new ATOM 0 HD2 PRO A 56 3.515 -7.925 -3.101 1.00 2.24 H new ATOM 0 HD3 PRO A 56 3.464 -9.631 -3.498 1.00 2.24 H new ATOM 847 N PRO A 57 -0.892 -6.476 -1.804 1.00 71.40 N ATOM 848 CA PRO A 57 -1.454 -5.133 -1.929 1.00 73.12 C ATOM 849 C PRO A 57 -0.873 -4.134 -0.932 1.00 33.32 C ATOM 850 O PRO A 57 -0.386 -4.505 0.140 1.00 22.24 O ATOM 851 CB PRO A 57 -2.931 -5.361 -1.635 1.00 25.41 C ATOM 852 CG PRO A 57 -2.948 -6.495 -0.668 1.00 31.15 C ATOM 853 CD PRO A 57 -1.761 -7.363 -1.007 1.00 65.31 C ATOM 0 HA PRO A 57 -1.240 -4.699 -2.906 1.00 73.12 H new ATOM 0 HB2 PRO A 57 -3.393 -4.470 -1.210 1.00 25.41 H new ATOM 0 HB3 PRO A 57 -3.483 -5.605 -2.542 1.00 25.41 H new ATOM 0 HG2 PRO A 57 -2.883 -6.132 0.358 1.00 31.15 H new ATOM 0 HG3 PRO A 57 -3.877 -7.059 -0.748 1.00 31.15 H new ATOM 0 HD2 PRO A 57 -1.255 -7.717 -0.109 1.00 65.31 H new ATOM 0 HD3 PRO A 57 -2.059 -8.245 -1.574 1.00 65.31 H new ATOM 861 N PHE A 58 -0.946 -2.865 -1.294 1.00 54.04 N ATOM 862 CA PHE A 58 -0.511 -1.783 -0.428 1.00 22.34 C ATOM 863 C PHE A 58 -1.511 -0.636 -0.495 1.00 72.51 C ATOM 864 O PHE A 58 -1.729 -0.042 -1.552 1.00 35.02 O ATOM 865 CB PHE A 58 0.908 -1.309 -0.791 1.00 72.32 C ATOM 866 CG PHE A 58 1.142 -1.066 -2.259 1.00 53.23 C ATOM 867 CD1 PHE A 58 1.428 -2.121 -3.114 1.00 22.44 C ATOM 868 CD2 PHE A 58 1.086 0.215 -2.779 1.00 11.24 C ATOM 869 CE1 PHE A 58 1.652 -1.899 -4.460 1.00 33.53 C ATOM 870 CE2 PHE A 58 1.310 0.443 -4.123 1.00 74.54 C ATOM 871 CZ PHE A 58 1.592 -0.615 -4.963 1.00 0.31 C ATOM 0 H PHE A 58 -1.308 -2.556 -2.196 1.00 54.04 H new ATOM 0 HA PHE A 58 -0.471 -2.153 0.597 1.00 22.34 H new ATOM 0 HB2 PHE A 58 1.117 -0.387 -0.248 1.00 72.32 H new ATOM 0 HB3 PHE A 58 1.624 -2.054 -0.443 1.00 72.32 H new ATOM 0 HD1 PHE A 58 1.476 -3.127 -2.723 1.00 22.44 H new ATOM 0 HD2 PHE A 58 0.865 1.047 -2.126 1.00 11.24 H new ATOM 0 HE1 PHE A 58 1.873 -2.728 -5.116 1.00 33.53 H new ATOM 0 HE2 PHE A 58 1.264 1.448 -4.516 1.00 74.54 H new ATOM 0 HZ PHE A 58 1.766 -0.438 -6.014 1.00 0.31 H new ATOM 881 N ALA A 59 -2.112 -0.324 0.642 1.00 73.01 N ATOM 882 CA ALA A 59 -3.206 0.634 0.689 1.00 33.32 C ATOM 883 C ALA A 59 -2.704 2.033 0.997 1.00 24.23 C ATOM 884 O ALA A 59 -2.197 2.298 2.084 1.00 63.25 O ATOM 885 CB ALA A 59 -4.237 0.200 1.719 1.00 52.54 C ATOM 0 H ALA A 59 -1.860 -0.721 1.547 1.00 73.01 H new ATOM 0 HA ALA A 59 -3.675 0.660 -0.294 1.00 33.32 H new ATOM 0 HB1 ALA A 59 -5.051 0.924 1.746 1.00 52.54 H new ATOM 0 HB2 ALA A 59 -4.631 -0.780 1.449 1.00 52.54 H new ATOM 0 HB3 ALA A 59 -3.768 0.144 2.702 1.00 52.54 H new ATOM 891 N ARG A 60 -2.840 2.917 0.021 1.00 24.14 N ATOM 892 CA ARG A 60 -2.427 4.305 0.167 1.00 44.12 C ATOM 893 C ARG A 60 -3.624 5.156 0.561 1.00 52.10 C ATOM 894 O ARG A 60 -4.636 5.153 -0.135 1.00 31.12 O ATOM 895 CB ARG A 60 -1.873 4.844 -1.154 1.00 74.22 C ATOM 896 CG ARG A 60 -1.113 3.828 -1.987 1.00 50.30 C ATOM 897 CD ARG A 60 -0.785 4.400 -3.353 1.00 23.22 C ATOM 898 NE ARG A 60 -0.317 3.381 -4.293 1.00 1.04 N ATOM 899 CZ ARG A 60 -0.646 3.369 -5.587 1.00 2.43 C ATOM 900 NH1 ARG A 60 -1.510 4.261 -6.057 1.00 24.51 N ATOM 901 NH2 ARG A 60 -0.136 2.450 -6.402 1.00 13.54 N ATOM 0 H ARG A 60 -3.238 2.694 -0.891 1.00 24.14 H new ATOM 0 HA ARG A 60 -1.654 4.351 0.935 1.00 44.12 H new ATOM 0 HB2 ARG A 60 -2.701 5.233 -1.747 1.00 74.22 H new ATOM 0 HB3 ARG A 60 -1.212 5.684 -0.939 1.00 74.22 H new ATOM 0 HG2 ARG A 60 -0.194 3.544 -1.475 1.00 50.30 H new ATOM 0 HG3 ARG A 60 -1.709 2.922 -2.099 1.00 50.30 H new ATOM 0 HD2 ARG A 60 -1.671 4.886 -3.761 1.00 23.22 H new ATOM 0 HD3 ARG A 60 -0.020 5.169 -3.246 1.00 23.22 H new ATOM 0 HE ARG A 60 0.292 2.642 -3.942 1.00 1.04 H new ATOM 0 HH11 ARG A 60 -1.920 4.953 -5.430 1.00 24.51 H new ATOM 0 HH12 ARG A 60 -1.763 4.254 -7.045 1.00 24.51 H new ATOM 0 HH21 ARG A 60 0.510 1.749 -6.039 1.00 13.54 H new ATOM 0 HH22 ARG A 60 -0.391 2.446 -7.390 1.00 13.54 H new ATOM 915 N TYR A 61 -3.529 5.871 1.665 1.00 23.13 N ATOM 916 CA TYR A 61 -4.591 6.786 2.043 1.00 73.03 C ATOM 917 C TYR A 61 -4.048 8.168 2.368 1.00 1.22 C ATOM 918 O TYR A 61 -3.061 8.326 3.096 1.00 23.34 O ATOM 919 CB TYR A 61 -5.434 6.233 3.203 1.00 64.53 C ATOM 920 CG TYR A 61 -4.669 5.784 4.434 1.00 55.44 C ATOM 921 CD1 TYR A 61 -4.240 6.697 5.390 1.00 71.45 C ATOM 922 CD2 TYR A 61 -4.411 4.436 4.655 1.00 73.55 C ATOM 923 CE1 TYR A 61 -3.571 6.281 6.525 1.00 41.23 C ATOM 924 CE2 TYR A 61 -3.750 4.013 5.790 1.00 53.32 C ATOM 925 CZ TYR A 61 -3.331 4.939 6.721 1.00 5.04 C ATOM 926 OH TYR A 61 -2.675 4.520 7.856 1.00 74.41 O ATOM 0 H TYR A 61 -2.739 5.838 2.309 1.00 23.13 H new ATOM 0 HA TYR A 61 -5.249 6.884 1.180 1.00 73.03 H new ATOM 0 HB2 TYR A 61 -6.147 7.000 3.504 1.00 64.53 H new ATOM 0 HB3 TYR A 61 -6.013 5.387 2.832 1.00 64.53 H new ATOM 0 HD1 TYR A 61 -4.433 7.749 5.243 1.00 71.45 H new ATOM 0 HD2 TYR A 61 -4.733 3.707 3.926 1.00 73.55 H new ATOM 0 HE1 TYR A 61 -3.238 7.004 7.255 1.00 41.23 H new ATOM 0 HE2 TYR A 61 -3.562 2.961 5.948 1.00 53.32 H new ATOM 0 HH TYR A 61 -2.781 3.551 7.956 1.00 74.41 H new ATOM 936 N PHE A 62 -4.686 9.166 1.786 1.00 3.30 N ATOM 937 CA PHE A 62 -4.341 10.549 2.032 1.00 11.33 C ATOM 938 C PHE A 62 -5.492 11.238 2.742 1.00 51.51 C ATOM 939 O PHE A 62 -6.560 11.424 2.165 1.00 13.42 O ATOM 940 CB PHE A 62 -4.025 11.262 0.714 1.00 62.50 C ATOM 941 CG PHE A 62 -3.563 12.684 0.886 1.00 35.33 C ATOM 942 CD1 PHE A 62 -2.250 12.958 1.229 1.00 51.21 C ATOM 943 CD2 PHE A 62 -4.438 13.742 0.703 1.00 52.44 C ATOM 944 CE1 PHE A 62 -1.817 14.261 1.385 1.00 34.23 C ATOM 945 CE2 PHE A 62 -4.011 15.047 0.859 1.00 2.21 C ATOM 946 CZ PHE A 62 -2.699 15.307 1.200 1.00 4.42 C ATOM 0 H PHE A 62 -5.457 9.039 1.130 1.00 3.30 H new ATOM 0 HA PHE A 62 -3.454 10.590 2.664 1.00 11.33 H new ATOM 0 HB2 PHE A 62 -3.255 10.701 0.185 1.00 62.50 H new ATOM 0 HB3 PHE A 62 -4.915 11.253 0.085 1.00 62.50 H new ATOM 0 HD1 PHE A 62 -1.556 12.144 1.376 1.00 51.21 H new ATOM 0 HD2 PHE A 62 -5.466 13.545 0.435 1.00 52.44 H new ATOM 0 HE1 PHE A 62 -0.790 14.461 1.651 1.00 34.23 H new ATOM 0 HE2 PHE A 62 -4.703 15.863 0.714 1.00 2.21 H new ATOM 0 HZ PHE A 62 -2.363 16.326 1.322 1.00 4.42 H new ATOM 956 N GLY A 63 -5.276 11.576 4.002 1.00 20.31 N ATOM 957 CA GLY A 63 -6.283 12.285 4.767 1.00 44.24 C ATOM 958 C GLY A 63 -5.668 13.079 5.894 1.00 61.30 C ATOM 959 O GLY A 63 -6.310 13.344 6.905 1.00 22.00 O ATOM 0 H GLY A 63 -4.417 11.372 4.513 1.00 20.31 H new ATOM 0 HA2 GLY A 63 -6.836 12.955 4.109 1.00 44.24 H new ATOM 0 HA3 GLY A 63 -7.001 11.572 5.173 1.00 44.24 H new ATOM 963 N MET A 64 -4.410 13.451 5.715 1.00 50.11 N ATOM 964 CA MET A 64 -3.679 14.200 6.729 1.00 62.12 C ATOM 965 C MET A 64 -3.535 15.657 6.308 1.00 12.31 C ATOM 966 O MET A 64 -2.898 16.463 6.987 1.00 23.32 O ATOM 967 CB MET A 64 -2.309 13.560 6.964 1.00 32.40 C ATOM 968 CG MET A 64 -1.477 13.405 5.700 1.00 3.05 C ATOM 969 SD MET A 64 -0.086 12.280 5.917 1.00 1.51 S ATOM 970 CE MET A 64 -0.936 10.748 6.289 1.00 74.02 C ATOM 0 H MET A 64 -3.871 13.246 4.874 1.00 50.11 H new ATOM 0 HA MET A 64 -4.237 14.172 7.665 1.00 62.12 H new ATOM 0 HB2 MET A 64 -1.754 14.165 7.681 1.00 32.40 H new ATOM 0 HB3 MET A 64 -2.450 12.579 7.417 1.00 32.40 H new ATOM 0 HG2 MET A 64 -2.113 13.039 4.894 1.00 3.05 H new ATOM 0 HG3 MET A 64 -1.104 14.382 5.393 1.00 3.05 H new ATOM 0 HE1 MET A 64 -0.633 10.393 7.274 1.00 74.02 H new ATOM 0 HE2 MET A 64 -2.013 10.918 6.280 1.00 74.02 H new ATOM 0 HE3 MET A 64 -0.681 9.999 5.539 1.00 74.02 H new ATOM 980 N SER A 65 -4.138 15.983 5.176 1.00 54.44 N ATOM 981 CA SER A 65 -4.140 17.339 4.654 1.00 73.24 C ATOM 982 C SER A 65 -5.371 17.533 3.778 1.00 10.11 C ATOM 983 O SER A 65 -6.013 16.548 3.401 1.00 13.35 O ATOM 984 CB SER A 65 -2.867 17.607 3.844 1.00 54.43 C ATOM 985 OG SER A 65 -1.702 17.351 4.613 1.00 44.31 O ATOM 0 H SER A 65 -4.640 15.314 4.593 1.00 54.44 H new ATOM 0 HA SER A 65 -4.167 18.044 5.485 1.00 73.24 H new ATOM 0 HB2 SER A 65 -2.862 16.980 2.953 1.00 54.43 H new ATOM 0 HB3 SER A 65 -2.861 18.643 3.505 1.00 54.43 H new ATOM 0 HG SER A 65 -0.906 17.529 4.070 1.00 44.31 H new ATOM 991 N ALA A 66 -5.701 18.793 3.484 1.00 51.25 N ATOM 992 CA ALA A 66 -6.842 19.155 2.633 1.00 55.54 C ATOM 993 C ALA A 66 -8.176 18.944 3.353 1.00 31.22 C ATOM 994 O ALA A 66 -9.023 19.839 3.375 1.00 64.22 O ATOM 995 CB ALA A 66 -6.809 18.395 1.310 1.00 3.42 C ATOM 0 H ALA A 66 -5.181 19.599 3.832 1.00 51.25 H new ATOM 0 HA ALA A 66 -6.754 20.219 2.412 1.00 55.54 H new ATOM 0 HB1 ALA A 66 -7.666 18.685 0.702 1.00 3.42 H new ATOM 0 HB2 ALA A 66 -5.889 18.633 0.776 1.00 3.42 H new ATOM 0 HB3 ALA A 66 -6.848 17.323 1.505 1.00 3.42 H new ATOM 1001 N GLY A 67 -8.360 17.775 3.949 1.00 62.31 N ATOM 1002 CA GLY A 67 -9.582 17.496 4.676 1.00 30.11 C ATOM 1003 C GLY A 67 -10.315 16.293 4.124 1.00 60.13 C ATOM 1004 O GLY A 67 -11.188 15.728 4.783 1.00 73.23 O ATOM 0 H GLY A 67 -7.683 17.012 3.942 1.00 62.31 H new ATOM 0 HA2 GLY A 67 -9.347 17.325 5.726 1.00 30.11 H new ATOM 0 HA3 GLY A 67 -10.235 18.368 4.633 1.00 30.11 H new ATOM 1008 N THR A 68 -9.961 15.911 2.907 1.00 74.13 N ATOM 1009 CA THR A 68 -10.551 14.752 2.260 1.00 64.51 C ATOM 1010 C THR A 68 -9.698 13.514 2.524 1.00 24.33 C ATOM 1011 O THR A 68 -8.473 13.607 2.601 1.00 11.24 O ATOM 1012 CB THR A 68 -10.681 14.984 0.740 1.00 0.45 C ATOM 1013 OG1 THR A 68 -11.309 16.251 0.497 1.00 44.13 O ATOM 1014 CG2 THR A 68 -11.499 13.883 0.080 1.00 21.11 C ATOM 0 H THR A 68 -9.261 16.393 2.344 1.00 74.13 H new ATOM 0 HA THR A 68 -11.547 14.597 2.675 1.00 64.51 H new ATOM 0 HB THR A 68 -9.679 14.973 0.310 1.00 0.45 H new ATOM 0 HG1 THR A 68 -11.389 16.397 -0.469 1.00 44.13 H new ATOM 0 HG21 THR A 68 -11.572 14.076 -0.990 1.00 21.11 H new ATOM 0 HG22 THR A 68 -11.013 12.921 0.243 1.00 21.11 H new ATOM 0 HG23 THR A 68 -12.499 13.863 0.514 1.00 21.11 H new ATOM 1022 N PHE A 69 -10.344 12.368 2.681 1.00 55.30 N ATOM 1023 CA PHE A 69 -9.640 11.127 2.944 1.00 15.24 C ATOM 1024 C PHE A 69 -9.873 10.154 1.804 1.00 21.44 C ATOM 1025 O PHE A 69 -10.998 9.708 1.567 1.00 12.50 O ATOM 1026 CB PHE A 69 -10.111 10.528 4.267 1.00 33.34 C ATOM 1027 CG PHE A 69 -9.278 9.386 4.772 1.00 33.25 C ATOM 1028 CD1 PHE A 69 -9.572 8.082 4.418 1.00 5.42 C ATOM 1029 CD2 PHE A 69 -8.206 9.621 5.617 1.00 1.12 C ATOM 1030 CE1 PHE A 69 -8.813 7.031 4.893 1.00 43.21 C ATOM 1031 CE2 PHE A 69 -7.444 8.574 6.099 1.00 14.45 C ATOM 1032 CZ PHE A 69 -7.748 7.277 5.737 1.00 42.24 C ATOM 0 H PHE A 69 -11.358 12.274 2.630 1.00 55.30 H new ATOM 0 HA PHE A 69 -8.571 11.328 3.019 1.00 15.24 H new ATOM 0 HB2 PHE A 69 -10.121 11.314 5.022 1.00 33.34 H new ATOM 0 HB3 PHE A 69 -11.139 10.185 4.149 1.00 33.34 H new ATOM 0 HD1 PHE A 69 -10.406 7.883 3.761 1.00 5.42 H new ATOM 0 HD2 PHE A 69 -7.963 10.634 5.902 1.00 1.12 H new ATOM 0 HE1 PHE A 69 -9.052 6.018 4.605 1.00 43.21 H new ATOM 0 HE2 PHE A 69 -6.611 8.770 6.758 1.00 14.45 H new ATOM 0 HZ PHE A 69 -7.154 6.457 6.113 1.00 42.24 H new ATOM 1042 N GLU A 70 -8.810 9.838 1.097 1.00 11.43 N ATOM 1043 CA GLU A 70 -8.894 8.945 -0.051 1.00 22.43 C ATOM 1044 C GLU A 70 -8.100 7.679 0.188 1.00 34.22 C ATOM 1045 O GLU A 70 -7.192 7.659 1.014 1.00 40.33 O ATOM 1046 CB GLU A 70 -8.403 9.636 -1.317 1.00 52.22 C ATOM 1047 CG GLU A 70 -9.190 10.883 -1.637 1.00 54.54 C ATOM 1048 CD GLU A 70 -8.941 11.403 -3.036 1.00 50.33 C ATOM 1049 OE1 GLU A 70 -9.545 10.868 -3.990 1.00 31.11 O ATOM 1050 OE2 GLU A 70 -8.153 12.357 -3.191 1.00 71.31 O ATOM 0 H GLU A 70 -7.871 10.185 1.294 1.00 11.43 H new ATOM 0 HA GLU A 70 -9.942 8.678 -0.184 1.00 22.43 H new ATOM 0 HB2 GLU A 70 -7.350 9.894 -1.201 1.00 52.22 H new ATOM 0 HB3 GLU A 70 -8.471 8.942 -2.155 1.00 52.22 H new ATOM 0 HG2 GLU A 70 -10.253 10.674 -1.518 1.00 54.54 H new ATOM 0 HG3 GLU A 70 -8.935 11.660 -0.917 1.00 54.54 H new ATOM 1057 N VAL A 71 -8.447 6.632 -0.548 1.00 35.05 N ATOM 1058 CA VAL A 71 -7.843 5.326 -0.365 1.00 10.31 C ATOM 1059 C VAL A 71 -7.571 4.631 -1.700 1.00 44.20 C ATOM 1060 O VAL A 71 -8.403 4.640 -2.607 1.00 14.20 O ATOM 1061 CB VAL A 71 -8.735 4.410 0.507 1.00 15.30 C ATOM 1062 CG1 VAL A 71 -8.635 4.798 1.972 1.00 51.13 C ATOM 1063 CG2 VAL A 71 -10.184 4.472 0.054 1.00 13.55 C ATOM 0 H VAL A 71 -9.152 6.667 -1.284 1.00 35.05 H new ATOM 0 HA VAL A 71 -6.893 5.496 0.143 1.00 10.31 H new ATOM 0 HB VAL A 71 -8.376 3.388 0.388 1.00 15.30 H new ATOM 0 HG11 VAL A 71 -9.270 4.141 2.567 1.00 51.13 H new ATOM 0 HG12 VAL A 71 -7.601 4.702 2.304 1.00 51.13 H new ATOM 0 HG13 VAL A 71 -8.962 5.830 2.098 1.00 51.13 H new ATOM 0 HG21 VAL A 71 -10.790 3.820 0.683 1.00 13.55 H new ATOM 0 HG22 VAL A 71 -10.548 5.496 0.137 1.00 13.55 H new ATOM 0 HG23 VAL A 71 -10.255 4.145 -0.983 1.00 13.55 H new ATOM 1073 N GLU A 72 -6.385 4.057 -1.816 1.00 40.13 N ATOM 1074 CA GLU A 72 -6.027 3.221 -2.952 1.00 64.12 C ATOM 1075 C GLU A 72 -5.472 1.898 -2.438 1.00 5.23 C ATOM 1076 O GLU A 72 -4.334 1.846 -1.977 1.00 24.34 O ATOM 1077 CB GLU A 72 -4.970 3.905 -3.829 1.00 72.52 C ATOM 1078 CG GLU A 72 -5.363 5.285 -4.336 1.00 52.13 C ATOM 1079 CD GLU A 72 -4.325 5.870 -5.277 1.00 15.10 C ATOM 1080 OE1 GLU A 72 -3.158 6.025 -4.859 1.00 61.53 O ATOM 1081 OE2 GLU A 72 -4.663 6.155 -6.444 1.00 31.42 O ATOM 0 H GLU A 72 -5.642 4.157 -1.125 1.00 40.13 H new ATOM 0 HA GLU A 72 -6.919 3.053 -3.556 1.00 64.12 H new ATOM 0 HB2 GLU A 72 -4.045 3.992 -3.259 1.00 72.52 H new ATOM 0 HB3 GLU A 72 -4.758 3.265 -4.685 1.00 72.52 H new ATOM 0 HG2 GLU A 72 -6.322 5.221 -4.851 1.00 52.13 H new ATOM 0 HG3 GLU A 72 -5.500 5.956 -3.488 1.00 52.13 H new ATOM 1088 N PHE A 73 -6.276 0.837 -2.496 1.00 55.13 N ATOM 1089 CA PHE A 73 -5.861 -0.462 -1.958 1.00 25.32 C ATOM 1090 C PHE A 73 -4.658 -1.031 -2.716 1.00 41.40 C ATOM 1091 O PHE A 73 -3.934 -1.868 -2.185 1.00 60.51 O ATOM 1092 CB PHE A 73 -7.028 -1.458 -1.957 1.00 51.25 C ATOM 1093 CG PHE A 73 -7.763 -1.570 -3.266 1.00 34.32 C ATOM 1094 CD1 PHE A 73 -7.272 -2.361 -4.292 1.00 34.04 C ATOM 1095 CD2 PHE A 73 -8.956 -0.892 -3.462 1.00 51.52 C ATOM 1096 CE1 PHE A 73 -7.953 -2.473 -5.487 1.00 31.41 C ATOM 1097 CE2 PHE A 73 -9.642 -1.003 -4.654 1.00 24.11 C ATOM 1098 CZ PHE A 73 -9.139 -1.793 -5.668 1.00 50.01 C ATOM 0 H PHE A 73 -7.210 0.848 -2.906 1.00 55.13 H new ATOM 0 HA PHE A 73 -5.551 -0.301 -0.925 1.00 25.32 H new ATOM 0 HB2 PHE A 73 -6.647 -2.442 -1.685 1.00 51.25 H new ATOM 0 HB3 PHE A 73 -7.737 -1.165 -1.182 1.00 51.25 H new ATOM 0 HD1 PHE A 73 -6.344 -2.897 -4.155 1.00 34.04 H new ATOM 0 HD2 PHE A 73 -9.353 -0.270 -2.673 1.00 51.52 H new ATOM 0 HE1 PHE A 73 -7.558 -3.092 -6.279 1.00 31.41 H new ATOM 0 HE2 PHE A 73 -10.572 -0.472 -4.794 1.00 24.11 H new ATOM 0 HZ PHE A 73 -9.674 -1.879 -6.602 1.00 50.01 H new ATOM 1108 N GLY A 74 -4.497 -0.587 -3.965 1.00 41.14 N ATOM 1109 CA GLY A 74 -3.278 -0.821 -4.735 1.00 2.43 C ATOM 1110 C GLY A 74 -2.790 -2.259 -4.777 1.00 23.33 C ATOM 1111 O GLY A 74 -2.000 -2.675 -3.930 1.00 51.42 O ATOM 0 H GLY A 74 -5.208 -0.056 -4.468 1.00 41.14 H new ATOM 0 HA2 GLY A 74 -3.446 -0.484 -5.758 1.00 2.43 H new ATOM 0 HA3 GLY A 74 -2.484 -0.199 -4.321 1.00 2.43 H new ATOM 1115 N PHE A 75 -3.228 -3.013 -5.777 1.00 20.41 N ATOM 1116 CA PHE A 75 -2.671 -4.339 -6.007 1.00 25.24 C ATOM 1117 C PHE A 75 -1.678 -4.279 -7.158 1.00 21.32 C ATOM 1118 O PHE A 75 -1.915 -3.586 -8.141 1.00 52.13 O ATOM 1119 CB PHE A 75 -3.774 -5.347 -6.355 1.00 2.05 C ATOM 1120 CG PHE A 75 -4.531 -5.883 -5.174 1.00 35.44 C ATOM 1121 CD1 PHE A 75 -5.545 -5.148 -4.585 1.00 22.30 C ATOM 1122 CD2 PHE A 75 -4.234 -7.138 -4.665 1.00 33.43 C ATOM 1123 CE1 PHE A 75 -6.251 -5.654 -3.510 1.00 41.31 C ATOM 1124 CE2 PHE A 75 -4.935 -7.648 -3.591 1.00 13.51 C ATOM 1125 CZ PHE A 75 -5.944 -6.904 -3.012 1.00 24.21 C ATOM 0 H PHE A 75 -3.957 -2.734 -6.433 1.00 20.41 H new ATOM 0 HA PHE A 75 -2.174 -4.663 -5.093 1.00 25.24 H new ATOM 0 HB2 PHE A 75 -4.480 -4.872 -7.036 1.00 2.05 H new ATOM 0 HB3 PHE A 75 -3.327 -6.183 -6.892 1.00 2.05 H new ATOM 0 HD1 PHE A 75 -5.787 -4.168 -4.970 1.00 22.30 H new ATOM 0 HD2 PHE A 75 -3.445 -7.723 -5.114 1.00 33.43 H new ATOM 0 HE1 PHE A 75 -7.042 -5.072 -3.060 1.00 41.31 H new ATOM 0 HE2 PHE A 75 -4.695 -8.627 -3.204 1.00 13.51 H new ATOM 0 HZ PHE A 75 -6.492 -7.300 -2.170 1.00 24.21 H new ATOM 1135 N PRO A 76 -0.560 -4.999 -7.060 1.00 44.24 N ATOM 1136 CA PRO A 76 0.368 -5.156 -8.173 1.00 63.50 C ATOM 1137 C PRO A 76 -0.181 -6.154 -9.178 1.00 10.31 C ATOM 1138 O PRO A 76 -0.727 -7.189 -8.792 1.00 43.23 O ATOM 1139 CB PRO A 76 1.650 -5.696 -7.517 1.00 2.31 C ATOM 1140 CG PRO A 76 1.408 -5.630 -6.043 1.00 15.30 C ATOM 1141 CD PRO A 76 -0.080 -5.683 -5.860 1.00 55.20 C ATOM 0 HA PRO A 76 0.538 -4.227 -8.718 1.00 63.50 H new ATOM 0 HB2 PRO A 76 1.852 -6.719 -7.835 1.00 2.31 H new ATOM 0 HB3 PRO A 76 2.516 -5.097 -7.799 1.00 2.31 H new ATOM 0 HG2 PRO A 76 1.893 -6.461 -5.531 1.00 15.30 H new ATOM 0 HG3 PRO A 76 1.820 -4.713 -5.622 1.00 15.30 H new ATOM 0 HD2 PRO A 76 -0.447 -6.708 -5.800 1.00 55.20 H new ATOM 0 HD3 PRO A 76 -0.397 -5.177 -4.948 1.00 55.20 H new ATOM 1149 N VAL A 77 -0.024 -5.875 -10.457 1.00 1.22 N ATOM 1150 CA VAL A 77 -0.656 -6.696 -11.474 1.00 71.50 C ATOM 1151 C VAL A 77 0.368 -7.429 -12.318 1.00 5.45 C ATOM 1152 O VAL A 77 1.564 -7.146 -12.262 1.00 72.25 O ATOM 1153 CB VAL A 77 -1.579 -5.873 -12.397 1.00 24.21 C ATOM 1154 CG1 VAL A 77 -2.784 -5.366 -11.625 1.00 65.11 C ATOM 1155 CG2 VAL A 77 -0.824 -4.715 -13.034 1.00 23.33 C ATOM 0 H VAL A 77 0.529 -5.096 -10.815 1.00 1.22 H new ATOM 0 HA VAL A 77 -1.263 -7.424 -10.936 1.00 71.50 H new ATOM 0 HB VAL A 77 -1.928 -6.526 -13.197 1.00 24.21 H new ATOM 0 HG11 VAL A 77 -3.425 -4.787 -12.290 1.00 65.11 H new ATOM 0 HG12 VAL A 77 -3.344 -6.212 -11.227 1.00 65.11 H new ATOM 0 HG13 VAL A 77 -2.449 -4.734 -10.803 1.00 65.11 H new ATOM 0 HG21 VAL A 77 -1.498 -4.152 -13.679 1.00 23.33 H new ATOM 0 HG22 VAL A 77 -0.437 -4.060 -12.254 1.00 23.33 H new ATOM 0 HG23 VAL A 77 0.005 -5.103 -13.626 1.00 23.33 H new ATOM 1165 N GLU A 78 -0.129 -8.380 -13.090 1.00 52.13 N ATOM 1166 CA GLU A 78 0.706 -9.245 -13.907 1.00 52.31 C ATOM 1167 C GLU A 78 1.363 -8.464 -15.043 1.00 60.44 C ATOM 1168 O GLU A 78 2.509 -8.727 -15.415 1.00 24.32 O ATOM 1169 CB GLU A 78 -0.164 -10.368 -14.472 1.00 33.55 C ATOM 1170 CG GLU A 78 0.584 -11.380 -15.312 1.00 11.54 C ATOM 1171 CD GLU A 78 -0.354 -12.377 -15.953 1.00 64.25 C ATOM 1172 OE1 GLU A 78 -0.895 -12.068 -17.035 1.00 34.34 O ATOM 1173 OE2 GLU A 78 -0.574 -13.461 -15.368 1.00 61.03 O ATOM 0 H GLU A 78 -1.127 -8.575 -13.168 1.00 52.13 H new ATOM 0 HA GLU A 78 1.503 -9.661 -13.291 1.00 52.31 H new ATOM 0 HB2 GLU A 78 -0.647 -10.888 -13.644 1.00 33.55 H new ATOM 0 HB3 GLU A 78 -0.956 -9.927 -15.077 1.00 33.55 H new ATOM 0 HG2 GLU A 78 1.150 -10.863 -16.087 1.00 11.54 H new ATOM 0 HG3 GLU A 78 1.306 -11.908 -14.689 1.00 11.54 H new ATOM 1180 N GLY A 79 0.636 -7.494 -15.574 1.00 51.30 N ATOM 1181 CA GLY A 79 1.117 -6.741 -16.710 1.00 53.43 C ATOM 1182 C GLY A 79 0.236 -6.952 -17.920 1.00 13.34 C ATOM 1183 O GLY A 79 -0.163 -8.084 -18.210 1.00 12.40 O ATOM 0 H GLY A 79 -0.284 -7.214 -15.235 1.00 51.30 H new ATOM 0 HA2 GLY A 79 1.147 -5.681 -16.460 1.00 53.43 H new ATOM 0 HA3 GLY A 79 2.138 -7.043 -16.943 1.00 53.43 H new ATOM 1187 N GLY A 80 -0.084 -5.873 -18.612 1.00 11.42 N ATOM 1188 CA GLY A 80 -0.968 -5.965 -19.751 1.00 54.34 C ATOM 1189 C GLY A 80 -2.419 -5.916 -19.324 1.00 14.04 C ATOM 1190 O GLY A 80 -3.218 -6.774 -19.700 1.00 11.13 O ATOM 0 H GLY A 80 0.253 -4.933 -18.405 1.00 11.42 H new ATOM 0 HA2 GLY A 80 -0.762 -5.147 -20.442 1.00 54.34 H new ATOM 0 HA3 GLY A 80 -0.776 -6.893 -20.290 1.00 54.34 H new ATOM 1194 N VAL A 81 -2.751 -4.924 -18.510 1.00 75.50 N ATOM 1195 CA VAL A 81 -4.111 -4.754 -18.022 1.00 1.52 C ATOM 1196 C VAL A 81 -4.650 -3.394 -18.452 1.00 0.34 C ATOM 1197 O VAL A 81 -3.884 -2.442 -18.625 1.00 65.22 O ATOM 1198 CB VAL A 81 -4.195 -4.873 -16.480 1.00 23.14 C ATOM 1199 CG1 VAL A 81 -5.635 -5.057 -16.024 1.00 44.33 C ATOM 1200 CG2 VAL A 81 -3.332 -6.017 -15.974 1.00 32.32 C ATOM 0 H VAL A 81 -2.093 -4.222 -18.173 1.00 75.50 H new ATOM 0 HA VAL A 81 -4.714 -5.553 -18.454 1.00 1.52 H new ATOM 0 HB VAL A 81 -3.816 -3.943 -16.056 1.00 23.14 H new ATOM 0 HG11 VAL A 81 -5.665 -5.138 -14.937 1.00 44.33 H new ATOM 0 HG12 VAL A 81 -6.229 -4.200 -16.341 1.00 44.33 H new ATOM 0 HG13 VAL A 81 -6.044 -5.965 -16.467 1.00 44.33 H new ATOM 0 HG21 VAL A 81 -3.409 -6.078 -14.888 1.00 32.32 H new ATOM 0 HG22 VAL A 81 -3.673 -6.953 -16.416 1.00 32.32 H new ATOM 0 HG23 VAL A 81 -2.294 -5.841 -16.255 1.00 32.32 H new ATOM 1210 N GLU A 82 -5.958 -3.312 -18.627 1.00 13.44 N ATOM 1211 CA GLU A 82 -6.603 -2.096 -19.104 1.00 74.01 C ATOM 1212 C GLU A 82 -6.960 -1.167 -17.946 1.00 63.25 C ATOM 1213 O GLU A 82 -6.613 -1.432 -16.794 1.00 11.20 O ATOM 1214 CB GLU A 82 -7.866 -2.453 -19.894 1.00 32.34 C ATOM 1215 CG GLU A 82 -7.810 -2.040 -21.355 1.00 71.10 C ATOM 1216 CD GLU A 82 -7.600 -0.553 -21.529 1.00 63.12 C ATOM 1217 OE1 GLU A 82 -8.414 0.230 -21.001 1.00 4.24 O ATOM 1218 OE2 GLU A 82 -6.611 -0.159 -22.177 1.00 33.13 O ATOM 0 H GLU A 82 -6.602 -4.081 -18.444 1.00 13.44 H new ATOM 0 HA GLU A 82 -5.902 -1.573 -19.754 1.00 74.01 H new ATOM 0 HB2 GLU A 82 -8.028 -3.529 -19.836 1.00 32.34 H new ATOM 0 HB3 GLU A 82 -8.725 -1.975 -19.423 1.00 32.34 H new ATOM 0 HG2 GLU A 82 -7.002 -2.578 -21.851 1.00 71.10 H new ATOM 0 HG3 GLU A 82 -8.737 -2.333 -21.848 1.00 71.10 H new ATOM 1225 N GLY A 83 -7.650 -0.082 -18.264 1.00 61.22 N ATOM 1226 CA GLY A 83 -8.086 0.857 -17.253 1.00 63.23 C ATOM 1227 C GLY A 83 -9.506 1.307 -17.511 1.00 21.20 C ATOM 1228 O GLY A 83 -9.952 1.324 -18.657 1.00 55.12 O ATOM 0 H GLY A 83 -7.918 0.166 -19.216 1.00 61.22 H new ATOM 0 HA2 GLY A 83 -8.020 0.394 -16.268 1.00 63.23 H new ATOM 0 HA3 GLY A 83 -7.422 1.722 -17.244 1.00 63.23 H new ATOM 1232 N SER A 84 -10.226 1.656 -16.462 1.00 44.42 N ATOM 1233 CA SER A 84 -11.619 2.049 -16.599 1.00 52.10 C ATOM 1234 C SER A 84 -11.999 3.114 -15.574 1.00 33.13 C ATOM 1235 O SER A 84 -12.608 2.810 -14.546 1.00 21.30 O ATOM 1236 CB SER A 84 -12.528 0.825 -16.461 1.00 35.21 C ATOM 1237 OG SER A 84 -12.226 -0.141 -17.455 1.00 53.32 O ATOM 0 H SER A 84 -9.872 1.676 -15.506 1.00 44.42 H new ATOM 0 HA SER A 84 -11.753 2.480 -17.591 1.00 52.10 H new ATOM 0 HB2 SER A 84 -12.406 0.385 -15.471 1.00 35.21 H new ATOM 0 HB3 SER A 84 -13.571 1.129 -16.548 1.00 35.21 H new ATOM 0 HG SER A 84 -12.817 -0.916 -17.348 1.00 53.32 H new ATOM 1243 N GLY A 85 -11.598 4.352 -15.850 1.00 44.44 N ATOM 1244 CA GLY A 85 -12.005 5.486 -15.035 1.00 5.20 C ATOM 1245 C GLY A 85 -11.495 5.414 -13.610 1.00 44.44 C ATOM 1246 O GLY A 85 -10.390 5.866 -13.312 1.00 1.44 O ATOM 0 H GLY A 85 -10.991 4.593 -16.634 1.00 44.44 H new ATOM 0 HA2 GLY A 85 -11.644 6.405 -15.497 1.00 5.20 H new ATOM 0 HA3 GLY A 85 -13.093 5.543 -15.022 1.00 5.20 H new ATOM 1250 N ARG A 86 -12.312 4.852 -12.729 1.00 65.03 N ATOM 1251 CA ARG A 86 -11.946 4.692 -11.332 1.00 3.51 C ATOM 1252 C ARG A 86 -10.962 3.537 -11.180 1.00 13.04 C ATOM 1253 O ARG A 86 -10.199 3.480 -10.216 1.00 1.24 O ATOM 1254 CB ARG A 86 -13.196 4.446 -10.478 1.00 40.21 C ATOM 1255 CG ARG A 86 -13.894 3.128 -10.774 1.00 34.34 C ATOM 1256 CD ARG A 86 -15.215 3.015 -10.034 1.00 50.14 C ATOM 1257 NE ARG A 86 -15.765 1.665 -10.118 1.00 2.31 N ATOM 1258 CZ ARG A 86 -16.914 1.355 -10.708 1.00 31.33 C ATOM 1259 NH1 ARG A 86 -17.618 2.280 -11.353 1.00 24.01 N ATOM 1260 NH2 ARG A 86 -17.350 0.108 -10.666 1.00 43.10 N ATOM 0 H ARG A 86 -13.240 4.497 -12.962 1.00 65.03 H new ATOM 0 HA ARG A 86 -11.468 5.608 -10.986 1.00 3.51 H new ATOM 0 HB2 ARG A 86 -12.915 4.469 -9.425 1.00 40.21 H new ATOM 0 HB3 ARG A 86 -13.900 5.263 -10.638 1.00 40.21 H new ATOM 0 HG2 ARG A 86 -14.069 3.041 -11.846 1.00 34.34 H new ATOM 0 HG3 ARG A 86 -13.245 2.300 -10.489 1.00 34.34 H new ATOM 0 HD2 ARG A 86 -15.071 3.285 -8.988 1.00 50.14 H new ATOM 0 HD3 ARG A 86 -15.928 3.726 -10.451 1.00 50.14 H new ATOM 0 HE ARG A 86 -15.230 0.907 -9.694 1.00 2.31 H new ATOM 0 HH11 ARG A 86 -17.277 3.240 -11.399 1.00 24.01 H new ATOM 0 HH12 ARG A 86 -18.499 2.029 -11.802 1.00 24.01 H new ATOM 0 HH21 ARG A 86 -16.805 -0.607 -10.183 1.00 43.10 H new ATOM 0 HH22 ARG A 86 -18.231 -0.140 -11.116 1.00 43.10 H new ATOM 1274 N VAL A 87 -10.991 2.622 -12.146 1.00 71.05 N ATOM 1275 CA VAL A 87 -10.089 1.478 -12.156 1.00 14.05 C ATOM 1276 C VAL A 87 -8.835 1.829 -12.942 1.00 72.23 C ATOM 1277 O VAL A 87 -8.846 1.800 -14.171 1.00 42.44 O ATOM 1278 CB VAL A 87 -10.742 0.233 -12.804 1.00 71.23 C ATOM 1279 CG1 VAL A 87 -10.039 -1.035 -12.348 1.00 65.05 C ATOM 1280 CG2 VAL A 87 -12.234 0.168 -12.507 1.00 53.22 C ATOM 0 H VAL A 87 -11.635 2.653 -12.936 1.00 71.05 H new ATOM 0 HA VAL A 87 -9.847 1.242 -11.120 1.00 14.05 H new ATOM 0 HB VAL A 87 -10.629 0.319 -13.885 1.00 71.23 H new ATOM 0 HG11 VAL A 87 -10.511 -1.900 -12.813 1.00 65.05 H new ATOM 0 HG12 VAL A 87 -8.989 -0.994 -12.639 1.00 65.05 H new ATOM 0 HG13 VAL A 87 -10.111 -1.121 -11.264 1.00 65.05 H new ATOM 0 HG21 VAL A 87 -12.660 -0.718 -12.977 1.00 53.22 H new ATOM 0 HG22 VAL A 87 -12.389 0.117 -11.429 1.00 53.22 H new ATOM 0 HG23 VAL A 87 -12.723 1.059 -12.902 1.00 53.22 H new ATOM 1290 N VAL A 88 -7.762 2.174 -12.253 1.00 54.21 N ATOM 1291 CA VAL A 88 -6.561 2.639 -12.930 1.00 41.31 C ATOM 1292 C VAL A 88 -5.338 1.820 -12.554 1.00 5.44 C ATOM 1293 O VAL A 88 -5.253 1.265 -11.457 1.00 14.45 O ATOM 1294 CB VAL A 88 -6.286 4.130 -12.647 1.00 13.33 C ATOM 1295 CG1 VAL A 88 -7.318 4.998 -13.346 1.00 34.21 C ATOM 1296 CG2 VAL A 88 -6.280 4.409 -11.151 1.00 1.41 C ATOM 0 H VAL A 88 -7.695 2.142 -11.236 1.00 54.21 H new ATOM 0 HA VAL A 88 -6.749 2.511 -13.996 1.00 41.31 H new ATOM 0 HB VAL A 88 -5.299 4.375 -13.039 1.00 13.33 H new ATOM 0 HG11 VAL A 88 -7.112 6.048 -13.138 1.00 34.21 H new ATOM 0 HG12 VAL A 88 -7.270 4.825 -14.421 1.00 34.21 H new ATOM 0 HG13 VAL A 88 -8.314 4.745 -12.982 1.00 34.21 H new ATOM 0 HG21 VAL A 88 -6.084 5.467 -10.979 1.00 1.41 H new ATOM 0 HG22 VAL A 88 -7.250 4.146 -10.728 1.00 1.41 H new ATOM 0 HG23 VAL A 88 -5.502 3.814 -10.673 1.00 1.41 H new ATOM 1306 N THR A 89 -4.400 1.749 -13.486 1.00 34.40 N ATOM 1307 CA THR A 89 -3.149 1.053 -13.265 1.00 72.42 C ATOM 1308 C THR A 89 -1.982 1.928 -13.697 1.00 71.41 C ATOM 1309 O THR A 89 -2.173 2.990 -14.297 1.00 44.01 O ATOM 1310 CB THR A 89 -3.100 -0.300 -14.017 1.00 13.25 C ATOM 1311 OG1 THR A 89 -1.897 -1.018 -13.702 1.00 62.31 O ATOM 1312 CG2 THR A 89 -3.199 -0.106 -15.525 1.00 20.44 C ATOM 0 H THR A 89 -4.487 2.171 -14.411 1.00 34.40 H new ATOM 0 HA THR A 89 -3.074 0.842 -12.198 1.00 72.42 H new ATOM 0 HB THR A 89 -3.961 -0.882 -13.686 1.00 13.25 H new ATOM 0 HG1 THR A 89 -1.693 -0.912 -12.749 1.00 62.31 H new ATOM 0 HG21 THR A 89 -3.161 -1.076 -16.020 1.00 20.44 H new ATOM 0 HG22 THR A 89 -4.140 0.389 -15.767 1.00 20.44 H new ATOM 0 HG23 THR A 89 -2.367 0.509 -15.868 1.00 20.44 H new ATOM 1320 N GLY A 90 -0.788 1.478 -13.380 1.00 0.35 N ATOM 1321 CA GLY A 90 0.411 2.210 -13.733 1.00 64.44 C ATOM 1322 C GLY A 90 1.583 1.820 -12.860 1.00 53.12 C ATOM 1323 O GLY A 90 1.456 0.937 -12.013 1.00 52.51 O ATOM 0 H GLY A 90 -0.620 0.607 -12.877 1.00 0.35 H new ATOM 0 HA2 GLY A 90 0.657 2.022 -14.778 1.00 64.44 H new ATOM 0 HA3 GLY A 90 0.226 3.280 -13.637 1.00 64.44 H new ATOM 1327 N LEU A 91 2.718 2.473 -13.053 1.00 73.34 N ATOM 1328 CA LEU A 91 3.909 2.163 -12.272 1.00 53.41 C ATOM 1329 C LEU A 91 4.096 3.184 -11.162 1.00 41.44 C ATOM 1330 O LEU A 91 3.779 4.364 -11.329 1.00 30.52 O ATOM 1331 CB LEU A 91 5.163 2.115 -13.159 1.00 71.12 C ATOM 1332 CG LEU A 91 5.387 0.803 -13.919 1.00 14.43 C ATOM 1333 CD1 LEU A 91 4.302 0.573 -14.958 1.00 24.13 C ATOM 1334 CD2 LEU A 91 6.762 0.801 -14.569 1.00 55.03 C ATOM 0 H LEU A 91 2.841 3.217 -13.739 1.00 73.34 H new ATOM 0 HA LEU A 91 3.768 1.177 -11.830 1.00 53.41 H new ATOM 0 HB2 LEU A 91 5.105 2.928 -13.883 1.00 71.12 H new ATOM 0 HB3 LEU A 91 6.036 2.306 -12.534 1.00 71.12 H new ATOM 0 HG LEU A 91 5.336 -0.017 -13.202 1.00 14.43 H new ATOM 0 HD11 LEU A 91 4.490 -0.366 -15.479 1.00 24.13 H new ATOM 0 HD12 LEU A 91 3.331 0.526 -14.466 1.00 24.13 H new ATOM 0 HD13 LEU A 91 4.306 1.393 -15.676 1.00 24.13 H new ATOM 0 HD21 LEU A 91 6.909 -0.136 -15.106 1.00 55.03 H new ATOM 0 HD22 LEU A 91 6.836 1.635 -15.267 1.00 55.03 H new ATOM 0 HD23 LEU A 91 7.528 0.903 -13.800 1.00 55.03 H new ATOM 1346 N THR A 92 4.588 2.718 -10.028 1.00 53.42 N ATOM 1347 CA THR A 92 4.844 3.578 -8.889 1.00 64.32 C ATOM 1348 C THR A 92 6.178 4.306 -9.030 1.00 52.14 C ATOM 1349 O THR A 92 7.142 3.755 -9.568 1.00 63.21 O ATOM 1350 CB THR A 92 4.845 2.750 -7.592 1.00 11.03 C ATOM 1351 OG1 THR A 92 5.527 1.503 -7.813 1.00 52.14 O ATOM 1352 CG2 THR A 92 3.426 2.479 -7.120 1.00 35.03 C ATOM 0 H THR A 92 4.820 1.737 -9.872 1.00 53.42 H new ATOM 0 HA THR A 92 4.049 4.323 -8.849 1.00 64.32 H new ATOM 0 HB THR A 92 5.362 3.320 -6.821 1.00 11.03 H new ATOM 0 HG1 THR A 92 6.394 1.519 -7.357 1.00 52.14 H new ATOM 0 HG21 THR A 92 3.454 1.892 -6.202 1.00 35.03 H new ATOM 0 HG22 THR A 92 2.919 3.425 -6.931 1.00 35.03 H new ATOM 0 HG23 THR A 92 2.887 1.925 -7.888 1.00 35.03 H new ATOM 1360 N PRO A 93 6.249 5.561 -8.564 1.00 23.22 N ATOM 1361 CA PRO A 93 7.496 6.319 -8.549 1.00 60.54 C ATOM 1362 C PRO A 93 8.435 5.818 -7.456 1.00 64.51 C ATOM 1363 O PRO A 93 7.989 5.420 -6.378 1.00 3.44 O ATOM 1364 CB PRO A 93 7.040 7.753 -8.265 1.00 22.45 C ATOM 1365 CG PRO A 93 5.760 7.602 -7.517 1.00 70.44 C ATOM 1366 CD PRO A 93 5.117 6.341 -8.029 1.00 21.23 C ATOM 0 HA PRO A 93 8.056 6.226 -9.479 1.00 60.54 H new ATOM 0 HB2 PRO A 93 7.781 8.295 -7.677 1.00 22.45 H new ATOM 0 HB3 PRO A 93 6.895 8.313 -9.189 1.00 22.45 H new ATOM 0 HG2 PRO A 93 5.942 7.538 -6.444 1.00 70.44 H new ATOM 0 HG3 PRO A 93 5.111 8.463 -7.679 1.00 70.44 H new ATOM 0 HD2 PRO A 93 4.601 5.803 -7.233 1.00 21.23 H new ATOM 0 HD3 PRO A 93 4.378 6.554 -8.801 1.00 21.23 H new ATOM 1374 N SER A 94 9.728 5.824 -7.733 1.00 62.44 N ATOM 1375 CA SER A 94 10.697 5.336 -6.771 1.00 24.31 C ATOM 1376 C SER A 94 11.100 6.447 -5.810 1.00 62.24 C ATOM 1377 O SER A 94 11.369 7.578 -6.221 1.00 23.02 O ATOM 1378 CB SER A 94 11.929 4.776 -7.478 1.00 51.13 C ATOM 1379 OG SER A 94 12.730 4.022 -6.584 1.00 34.43 O ATOM 0 H SER A 94 10.127 6.159 -8.610 1.00 62.44 H new ATOM 0 HA SER A 94 10.233 4.531 -6.201 1.00 24.31 H new ATOM 0 HB2 SER A 94 11.619 4.147 -8.313 1.00 51.13 H new ATOM 0 HB3 SER A 94 12.516 5.594 -7.896 1.00 51.13 H new ATOM 0 HG SER A 94 12.154 3.477 -6.009 1.00 34.43 H new ATOM 1385 N GLY A 95 11.140 6.111 -4.535 1.00 0.44 N ATOM 1386 CA GLY A 95 11.494 7.072 -3.511 1.00 73.44 C ATOM 1387 C GLY A 95 11.757 6.389 -2.188 1.00 0.21 C ATOM 1388 O GLY A 95 11.331 5.256 -1.984 1.00 44.33 O ATOM 0 H GLY A 95 10.931 5.176 -4.184 1.00 0.44 H new ATOM 0 HA2 GLY A 95 12.380 7.626 -3.820 1.00 73.44 H new ATOM 0 HA3 GLY A 95 10.689 7.797 -3.395 1.00 73.44 H new ATOM 1392 N LYS A 96 12.462 7.065 -1.292 1.00 24.22 N ATOM 1393 CA LYS A 96 12.796 6.487 0.004 1.00 3.51 C ATOM 1394 C LYS A 96 11.852 7.026 1.069 1.00 14.45 C ATOM 1395 O LYS A 96 11.697 8.237 1.217 1.00 51.11 O ATOM 1396 CB LYS A 96 14.252 6.785 0.395 1.00 25.42 C ATOM 1397 CG LYS A 96 15.307 6.036 -0.422 1.00 35.03 C ATOM 1398 CD LYS A 96 15.291 6.454 -1.883 1.00 0.41 C ATOM 1399 CE LYS A 96 16.624 6.187 -2.569 1.00 10.30 C ATOM 1400 NZ LYS A 96 16.905 4.734 -2.734 1.00 70.30 N ATOM 0 H LYS A 96 12.813 8.012 -1.437 1.00 24.22 H new ATOM 0 HA LYS A 96 12.684 5.405 -0.071 1.00 3.51 H new ATOM 0 HB2 LYS A 96 14.428 7.856 0.293 1.00 25.42 H new ATOM 0 HB3 LYS A 96 14.387 6.539 1.448 1.00 25.42 H new ATOM 0 HG2 LYS A 96 16.294 6.225 -0.001 1.00 35.03 H new ATOM 0 HG3 LYS A 96 15.129 4.963 -0.349 1.00 35.03 H new ATOM 0 HD2 LYS A 96 14.500 5.915 -2.405 1.00 0.41 H new ATOM 0 HD3 LYS A 96 15.054 7.515 -1.954 1.00 0.41 H new ATOM 0 HE2 LYS A 96 16.627 6.667 -3.548 1.00 10.30 H new ATOM 0 HE3 LYS A 96 17.425 6.644 -1.988 1.00 10.30 H new ATOM 0 HZ1 LYS A 96 17.831 4.609 -3.190 1.00 70.30 H new ATOM 0 HZ2 LYS A 96 16.914 4.274 -1.801 1.00 70.30 H new ATOM 0 HZ3 LYS A 96 16.167 4.303 -3.326 1.00 70.30 H new ATOM 1414 N ALA A 97 11.228 6.122 1.801 1.00 51.11 N ATOM 1415 CA ALA A 97 10.242 6.497 2.805 1.00 2.45 C ATOM 1416 C ALA A 97 10.427 5.700 4.092 1.00 75.44 C ATOM 1417 O ALA A 97 11.171 4.716 4.126 1.00 0.24 O ATOM 1418 CB ALA A 97 8.835 6.300 2.258 1.00 2.45 C ATOM 0 H ALA A 97 11.386 5.117 1.721 1.00 51.11 H new ATOM 0 HA ALA A 97 10.388 7.551 3.042 1.00 2.45 H new ATOM 0 HB1 ALA A 97 8.106 6.584 3.017 1.00 2.45 H new ATOM 0 HB2 ALA A 97 8.698 6.922 1.374 1.00 2.45 H new ATOM 0 HB3 ALA A 97 8.692 5.253 1.991 1.00 2.45 H new ATOM 1424 N ALA A 98 9.749 6.129 5.148 1.00 12.21 N ATOM 1425 CA ALA A 98 9.832 5.455 6.433 1.00 62.01 C ATOM 1426 C ALA A 98 8.700 4.453 6.591 1.00 23.01 C ATOM 1427 O ALA A 98 7.512 4.815 6.513 1.00 75.03 O ATOM 1428 CB ALA A 98 9.801 6.459 7.571 1.00 32.04 C ATOM 0 H ALA A 98 9.134 6.943 5.138 1.00 12.21 H new ATOM 0 HA ALA A 98 10.780 4.918 6.468 1.00 62.01 H new ATOM 0 HB1 ALA A 98 9.864 5.932 8.523 1.00 32.04 H new ATOM 0 HB2 ALA A 98 10.646 7.141 7.477 1.00 32.04 H new ATOM 0 HB3 ALA A 98 8.871 7.026 7.531 1.00 32.04 H new ATOM 1434 N SER A 99 9.076 3.200 6.805 1.00 74.13 N ATOM 1435 CA SER A 99 8.122 2.124 6.983 1.00 0.22 C ATOM 1436 C SER A 99 8.551 1.239 8.149 1.00 72.34 C ATOM 1437 O SER A 99 9.712 0.840 8.235 1.00 55.22 O ATOM 1438 CB SER A 99 8.018 1.296 5.698 1.00 45.22 C ATOM 1439 OG SER A 99 7.000 0.316 5.799 1.00 73.31 O ATOM 0 H SER A 99 10.051 2.905 6.859 1.00 74.13 H new ATOM 0 HA SER A 99 7.143 2.549 7.204 1.00 0.22 H new ATOM 0 HB2 SER A 99 7.810 1.954 4.854 1.00 45.22 H new ATOM 0 HB3 SER A 99 8.973 0.812 5.496 1.00 45.22 H new ATOM 0 HG SER A 99 6.516 0.258 4.949 1.00 73.31 H new ATOM 1445 N SER A 100 7.627 0.958 9.053 1.00 65.41 N ATOM 1446 CA SER A 100 7.910 0.091 10.184 1.00 44.11 C ATOM 1447 C SER A 100 7.327 -1.294 9.933 1.00 61.23 C ATOM 1448 O SER A 100 6.356 -1.442 9.184 1.00 15.41 O ATOM 1449 CB SER A 100 7.327 0.685 11.469 1.00 74.41 C ATOM 1450 OG SER A 100 7.685 -0.086 12.602 1.00 3.02 O ATOM 0 H SER A 100 6.673 1.318 9.025 1.00 65.41 H new ATOM 0 HA SER A 100 8.990 0.006 10.301 1.00 44.11 H new ATOM 0 HB2 SER A 100 7.685 1.707 11.594 1.00 74.41 H new ATOM 0 HB3 SER A 100 6.241 0.735 11.389 1.00 74.41 H new ATOM 0 HG SER A 100 8.590 -0.442 12.483 1.00 3.02 H new ATOM 1456 N LEU A 101 7.921 -2.302 10.553 1.00 32.23 N ATOM 1457 CA LEU A 101 7.446 -3.663 10.401 1.00 24.44 C ATOM 1458 C LEU A 101 6.457 -3.998 11.507 1.00 71.15 C ATOM 1459 O LEU A 101 6.847 -4.303 12.634 1.00 70.42 O ATOM 1460 CB LEU A 101 8.618 -4.650 10.431 1.00 43.02 C ATOM 1461 CG LEU A 101 9.644 -4.484 9.307 1.00 75.31 C ATOM 1462 CD1 LEU A 101 10.781 -5.479 9.471 1.00 72.32 C ATOM 1463 CD2 LEU A 101 8.982 -4.662 7.950 1.00 1.24 C ATOM 0 H LEU A 101 8.731 -2.201 11.164 1.00 32.23 H new ATOM 0 HA LEU A 101 6.945 -3.748 9.437 1.00 24.44 H new ATOM 0 HB2 LEU A 101 9.132 -4.549 11.387 1.00 43.02 H new ATOM 0 HB3 LEU A 101 8.219 -5.663 10.389 1.00 43.02 H new ATOM 0 HG LEU A 101 10.054 -3.476 9.365 1.00 75.31 H new ATOM 0 HD11 LEU A 101 11.500 -5.346 8.663 1.00 72.32 H new ATOM 0 HD12 LEU A 101 11.275 -5.312 10.428 1.00 72.32 H new ATOM 0 HD13 LEU A 101 10.384 -6.494 9.440 1.00 72.32 H new ATOM 0 HD21 LEU A 101 9.727 -4.541 7.163 1.00 1.24 H new ATOM 0 HD22 LEU A 101 8.546 -5.659 7.886 1.00 1.24 H new ATOM 0 HD23 LEU A 101 8.198 -3.914 7.827 1.00 1.24 H new ATOM 1475 N TYR A 102 5.178 -3.920 11.180 1.00 44.33 N ATOM 1476 CA TYR A 102 4.129 -4.287 12.112 1.00 24.31 C ATOM 1477 C TYR A 102 3.975 -5.802 12.096 1.00 14.11 C ATOM 1478 O TYR A 102 3.412 -6.368 11.161 1.00 72.00 O ATOM 1479 CB TYR A 102 2.822 -3.590 11.716 1.00 14.30 C ATOM 1480 CG TYR A 102 1.769 -3.550 12.799 1.00 43.42 C ATOM 1481 CD1 TYR A 102 2.023 -2.935 14.015 1.00 40.40 C ATOM 1482 CD2 TYR A 102 0.512 -4.102 12.593 1.00 72.53 C ATOM 1483 CE1 TYR A 102 1.058 -2.876 15.001 1.00 11.50 C ATOM 1484 CE2 TYR A 102 -0.463 -4.040 13.570 1.00 54.13 C ATOM 1485 CZ TYR A 102 -0.184 -3.427 14.772 1.00 35.12 C ATOM 1486 OH TYR A 102 -1.151 -3.350 15.746 1.00 31.21 O ATOM 0 H TYR A 102 4.841 -3.604 10.271 1.00 44.33 H new ATOM 0 HA TYR A 102 4.384 -3.969 13.123 1.00 24.31 H new ATOM 0 HB2 TYR A 102 3.050 -2.568 11.413 1.00 14.30 H new ATOM 0 HB3 TYR A 102 2.407 -4.096 10.844 1.00 14.30 H new ATOM 0 HD1 TYR A 102 2.993 -2.494 14.194 1.00 40.40 H new ATOM 0 HD2 TYR A 102 0.293 -4.588 11.654 1.00 72.53 H new ATOM 0 HE1 TYR A 102 1.275 -2.401 15.946 1.00 11.50 H new ATOM 0 HE2 TYR A 102 -1.438 -4.469 13.393 1.00 54.13 H new ATOM 0 HH TYR A 102 -0.797 -2.865 16.520 1.00 31.21 H new ATOM 1496 N ILE A 103 4.515 -6.454 13.111 1.00 20.10 N ATOM 1497 CA ILE A 103 4.587 -7.906 13.129 1.00 72.04 C ATOM 1498 C ILE A 103 3.387 -8.504 13.850 1.00 4.14 C ATOM 1499 O ILE A 103 3.118 -8.181 15.006 1.00 12.12 O ATOM 1500 CB ILE A 103 5.891 -8.387 13.801 1.00 20.53 C ATOM 1501 CG1 ILE A 103 7.108 -7.812 13.066 1.00 12.23 C ATOM 1502 CG2 ILE A 103 5.950 -9.908 13.830 1.00 21.23 C ATOM 1503 CD1 ILE A 103 8.433 -8.167 13.706 1.00 53.45 C ATOM 0 H ILE A 103 4.911 -6.001 13.935 1.00 20.10 H new ATOM 0 HA ILE A 103 4.579 -8.246 12.093 1.00 72.04 H new ATOM 0 HB ILE A 103 5.905 -8.028 14.830 1.00 20.53 H new ATOM 0 HG12 ILE A 103 7.104 -8.173 12.038 1.00 12.23 H new ATOM 0 HG13 ILE A 103 7.015 -6.727 13.023 1.00 12.23 H new ATOM 0 HG21 ILE A 103 6.876 -10.227 14.307 1.00 21.23 H new ATOM 0 HG22 ILE A 103 5.100 -10.294 14.392 1.00 21.23 H new ATOM 0 HG23 ILE A 103 5.916 -10.293 12.811 1.00 21.23 H new ATOM 0 HD11 ILE A 103 9.246 -7.725 13.130 1.00 53.45 H new ATOM 0 HD12 ILE A 103 8.460 -7.782 14.725 1.00 53.45 H new ATOM 0 HD13 ILE A 103 8.549 -9.251 13.725 1.00 53.45 H new ATOM 1515 N GLY A 104 2.669 -9.368 13.148 1.00 44.31 N ATOM 1516 CA GLY A 104 1.491 -9.986 13.713 1.00 44.44 C ATOM 1517 C GLY A 104 0.246 -9.622 12.936 1.00 41.23 C ATOM 1518 O GLY A 104 0.330 -9.302 11.746 1.00 41.11 O ATOM 0 H GLY A 104 2.884 -9.652 12.192 1.00 44.31 H new ATOM 0 HA2 GLY A 104 1.614 -11.069 13.718 1.00 44.44 H new ATOM 0 HA3 GLY A 104 1.377 -9.673 14.751 1.00 44.44 H new ATOM 1522 N PRO A 105 -0.928 -9.661 13.578 1.00 15.44 N ATOM 1523 CA PRO A 105 -2.187 -9.289 12.934 1.00 43.33 C ATOM 1524 C PRO A 105 -2.300 -7.782 12.725 1.00 1.43 C ATOM 1525 O PRO A 105 -1.504 -7.008 13.256 1.00 34.44 O ATOM 1526 CB PRO A 105 -3.247 -9.777 13.919 1.00 45.31 C ATOM 1527 CG PRO A 105 -2.569 -9.757 15.246 1.00 14.10 C ATOM 1528 CD PRO A 105 -1.121 -10.066 14.981 1.00 12.30 C ATOM 0 HA PRO A 105 -2.284 -9.723 11.939 1.00 43.33 H new ATOM 0 HB2 PRO A 105 -4.123 -9.128 13.912 1.00 45.31 H new ATOM 0 HB3 PRO A 105 -3.591 -10.780 13.665 1.00 45.31 H new ATOM 0 HG2 PRO A 105 -2.678 -8.784 15.725 1.00 14.10 H new ATOM 0 HG3 PRO A 105 -3.008 -10.494 15.919 1.00 14.10 H new ATOM 0 HD2 PRO A 105 -0.464 -9.512 15.652 1.00 12.30 H new ATOM 0 HD3 PRO A 105 -0.905 -11.124 15.126 1.00 12.30 H new ATOM 1536 N TYR A 106 -3.295 -7.368 11.957 1.00 71.43 N ATOM 1537 CA TYR A 106 -3.484 -5.958 11.663 1.00 24.35 C ATOM 1538 C TYR A 106 -4.512 -5.353 12.612 1.00 25.20 C ATOM 1539 O TYR A 106 -5.561 -5.950 12.860 1.00 53.32 O ATOM 1540 CB TYR A 106 -3.930 -5.777 10.206 1.00 34.32 C ATOM 1541 CG TYR A 106 -4.186 -4.338 9.825 1.00 54.32 C ATOM 1542 CD1 TYR A 106 -3.153 -3.414 9.811 1.00 60.10 C ATOM 1543 CD2 TYR A 106 -5.462 -3.906 9.487 1.00 21.31 C ATOM 1544 CE1 TYR A 106 -3.381 -2.100 9.469 1.00 42.33 C ATOM 1545 CE2 TYR A 106 -5.698 -2.589 9.141 1.00 71.25 C ATOM 1546 CZ TYR A 106 -4.653 -1.690 9.136 1.00 65.32 C ATOM 1547 OH TYR A 106 -4.873 -0.379 8.792 1.00 74.30 O ATOM 0 H TYR A 106 -3.982 -7.987 11.527 1.00 71.43 H new ATOM 0 HA TYR A 106 -2.535 -5.440 11.805 1.00 24.35 H new ATOM 0 HB2 TYR A 106 -3.165 -6.188 9.547 1.00 34.32 H new ATOM 0 HB3 TYR A 106 -4.839 -6.355 10.039 1.00 34.32 H new ATOM 0 HD1 TYR A 106 -2.154 -3.730 10.072 1.00 60.10 H new ATOM 0 HD2 TYR A 106 -6.282 -4.609 9.495 1.00 21.31 H new ATOM 0 HE1 TYR A 106 -2.565 -1.393 9.462 1.00 42.33 H new ATOM 0 HE2 TYR A 106 -6.694 -2.266 8.876 1.00 71.25 H new ATOM 0 HH TYR A 106 -4.325 -0.149 8.013 1.00 74.30 H new ATOM 1557 N GLY A 107 -4.212 -4.179 13.153 1.00 2.11 N ATOM 1558 CA GLY A 107 -5.136 -3.540 14.067 1.00 33.13 C ATOM 1559 C GLY A 107 -4.772 -2.105 14.390 1.00 20.13 C ATOM 1560 O GLY A 107 -5.367 -1.172 13.855 1.00 52.31 O ATOM 0 H GLY A 107 -3.351 -3.661 12.976 1.00 2.11 H new ATOM 0 HA2 GLY A 107 -6.137 -3.564 13.635 1.00 33.13 H new ATOM 0 HA3 GLY A 107 -5.174 -4.114 14.993 1.00 33.13 H new ATOM 1564 N GLU A 108 -3.786 -1.927 15.254 1.00 42.52 N ATOM 1565 CA GLU A 108 -3.465 -0.606 15.779 1.00 50.11 C ATOM 1566 C GLU A 108 -2.314 0.049 15.027 1.00 0.11 C ATOM 1567 O GLU A 108 -1.156 -0.347 15.174 1.00 24.10 O ATOM 1568 CB GLU A 108 -3.128 -0.712 17.263 1.00 34.41 C ATOM 1569 CG GLU A 108 -4.299 -1.184 18.100 1.00 64.32 C ATOM 1570 CD GLU A 108 -3.908 -1.487 19.525 1.00 11.55 C ATOM 1571 OE1 GLU A 108 -3.801 -0.543 20.334 1.00 2.31 O ATOM 1572 OE2 GLU A 108 -3.716 -2.679 19.846 1.00 61.20 O ATOM 0 H GLU A 108 -3.194 -2.678 15.607 1.00 42.52 H new ATOM 0 HA GLU A 108 -4.342 0.027 15.641 1.00 50.11 H new ATOM 0 HB2 GLU A 108 -2.294 -1.401 17.393 1.00 34.41 H new ATOM 0 HB3 GLU A 108 -2.797 0.261 17.626 1.00 34.41 H new ATOM 0 HG2 GLU A 108 -5.076 -0.420 18.095 1.00 64.32 H new ATOM 0 HG3 GLU A 108 -4.728 -2.078 17.647 1.00 64.32 H new ATOM 1579 N ILE A 109 -2.643 1.040 14.208 1.00 21.31 N ATOM 1580 CA ILE A 109 -1.636 1.807 13.487 1.00 1.52 C ATOM 1581 C ILE A 109 -0.949 2.807 14.407 1.00 65.01 C ATOM 1582 O ILE A 109 0.271 2.886 14.434 1.00 60.25 O ATOM 1583 CB ILE A 109 -2.237 2.550 12.271 1.00 40.01 C ATOM 1584 CG1 ILE A 109 -2.724 1.540 11.235 1.00 44.03 C ATOM 1585 CG2 ILE A 109 -1.223 3.506 11.648 1.00 3.23 C ATOM 1586 CD1 ILE A 109 -1.630 0.627 10.723 1.00 2.14 C ATOM 0 H ILE A 109 -3.603 1.332 14.026 1.00 21.31 H new ATOM 0 HA ILE A 109 -0.900 1.092 13.121 1.00 1.52 H new ATOM 0 HB ILE A 109 -3.083 3.144 12.617 1.00 40.01 H new ATOM 0 HG12 ILE A 109 -3.516 0.934 11.674 1.00 44.03 H new ATOM 0 HG13 ILE A 109 -3.162 2.077 10.394 1.00 44.03 H new ATOM 0 HG21 ILE A 109 -1.676 4.013 10.796 1.00 3.23 H new ATOM 0 HG22 ILE A 109 -0.917 4.245 12.389 1.00 3.23 H new ATOM 0 HG23 ILE A 109 -0.351 2.944 11.314 1.00 3.23 H new ATOM 0 HD11 ILE A 109 -2.046 -0.065 9.991 1.00 2.14 H new ATOM 0 HD12 ILE A 109 -0.848 1.224 10.254 1.00 2.14 H new ATOM 0 HD13 ILE A 109 -1.207 0.064 11.555 1.00 2.14 H new ATOM 1598 N GLU A 110 -1.739 3.543 15.179 1.00 10.00 N ATOM 1599 CA GLU A 110 -1.216 4.619 16.023 1.00 2.42 C ATOM 1600 C GLU A 110 -0.213 4.091 17.050 1.00 70.12 C ATOM 1601 O GLU A 110 0.741 4.788 17.408 1.00 23.52 O ATOM 1602 CB GLU A 110 -2.353 5.388 16.721 1.00 23.41 C ATOM 1603 CG GLU A 110 -3.264 4.535 17.597 1.00 60.52 C ATOM 1604 CD GLU A 110 -4.130 3.585 16.798 1.00 62.31 C ATOM 1605 OE1 GLU A 110 -5.064 4.051 16.116 1.00 34.15 O ATOM 1606 OE2 GLU A 110 -3.867 2.370 16.829 1.00 62.02 O ATOM 0 H GLU A 110 -2.749 3.416 15.240 1.00 10.00 H new ATOM 0 HA GLU A 110 -0.690 5.313 15.368 1.00 2.42 H new ATOM 0 HB2 GLU A 110 -1.916 6.175 17.336 1.00 23.41 H new ATOM 0 HB3 GLU A 110 -2.960 5.878 15.960 1.00 23.41 H new ATOM 0 HG2 GLU A 110 -2.655 3.962 18.296 1.00 60.52 H new ATOM 0 HG3 GLU A 110 -3.903 5.188 18.192 1.00 60.52 H new ATOM 1613 N ALA A 111 -0.416 2.852 17.492 1.00 11.12 N ATOM 1614 CA ALA A 111 0.480 2.219 18.455 1.00 1.45 C ATOM 1615 C ALA A 111 1.919 2.184 17.934 1.00 5.33 C ATOM 1616 O ALA A 111 2.859 2.523 18.653 1.00 60.41 O ATOM 1617 CB ALA A 111 -0.006 0.813 18.771 1.00 65.52 C ATOM 0 H ALA A 111 -1.196 2.265 17.197 1.00 11.12 H new ATOM 0 HA ALA A 111 0.472 2.812 19.370 1.00 1.45 H new ATOM 0 HB1 ALA A 111 0.668 0.348 19.490 1.00 65.52 H new ATOM 0 HB2 ALA A 111 -1.010 0.861 19.193 1.00 65.52 H new ATOM 0 HB3 ALA A 111 -0.025 0.221 17.856 1.00 65.52 H new ATOM 1623 N VAL A 112 2.082 1.774 16.679 1.00 25.23 N ATOM 1624 CA VAL A 112 3.397 1.748 16.045 1.00 13.35 C ATOM 1625 C VAL A 112 3.720 3.115 15.437 1.00 71.42 C ATOM 1626 O VAL A 112 4.883 3.503 15.324 1.00 74.22 O ATOM 1627 CB VAL A 112 3.495 0.639 14.963 1.00 21.53 C ATOM 1628 CG1 VAL A 112 2.481 0.848 13.850 1.00 63.40 C ATOM 1629 CG2 VAL A 112 4.903 0.559 14.392 1.00 42.13 C ATOM 0 H VAL A 112 1.320 1.455 16.081 1.00 25.23 H new ATOM 0 HA VAL A 112 4.131 1.518 16.818 1.00 13.35 H new ATOM 0 HB VAL A 112 3.264 -0.308 15.450 1.00 21.53 H new ATOM 0 HG11 VAL A 112 2.581 0.052 13.112 1.00 63.40 H new ATOM 0 HG12 VAL A 112 1.474 0.832 14.267 1.00 63.40 H new ATOM 0 HG13 VAL A 112 2.660 1.811 13.371 1.00 63.40 H new ATOM 0 HG21 VAL A 112 4.945 -0.225 13.636 1.00 42.13 H new ATOM 0 HG22 VAL A 112 5.166 1.514 13.938 1.00 42.13 H new ATOM 0 HG23 VAL A 112 5.608 0.331 15.192 1.00 42.13 H new ATOM 1639 N TYR A 113 2.669 3.838 15.066 1.00 0.05 N ATOM 1640 CA TYR A 113 2.788 5.156 14.454 1.00 3.03 C ATOM 1641 C TYR A 113 3.573 6.108 15.361 1.00 15.54 C ATOM 1642 O TYR A 113 4.385 6.900 14.882 1.00 60.01 O ATOM 1643 CB TYR A 113 1.389 5.718 14.182 1.00 44.31 C ATOM 1644 CG TYR A 113 1.328 6.755 13.085 1.00 3.33 C ATOM 1645 CD1 TYR A 113 1.588 8.091 13.350 1.00 73.32 C ATOM 1646 CD2 TYR A 113 1.006 6.394 11.783 1.00 30.54 C ATOM 1647 CE1 TYR A 113 1.527 9.041 12.349 1.00 40.10 C ATOM 1648 CE2 TYR A 113 0.941 7.337 10.777 1.00 25.12 C ATOM 1649 CZ TYR A 113 1.204 8.660 11.063 1.00 54.34 C ATOM 1650 OH TYR A 113 1.150 9.602 10.063 1.00 32.01 O ATOM 0 H TYR A 113 1.705 3.524 15.182 1.00 0.05 H new ATOM 0 HA TYR A 113 3.331 5.061 13.514 1.00 3.03 H new ATOM 0 HB2 TYR A 113 0.725 4.894 13.921 1.00 44.31 H new ATOM 0 HB3 TYR A 113 1.004 6.159 15.102 1.00 44.31 H new ATOM 0 HD1 TYR A 113 1.842 8.394 14.355 1.00 73.32 H new ATOM 0 HD2 TYR A 113 0.803 5.358 11.554 1.00 30.54 H new ATOM 0 HE1 TYR A 113 1.731 10.078 12.572 1.00 40.10 H new ATOM 0 HE2 TYR A 113 0.685 7.040 9.771 1.00 25.12 H new ATOM 0 HH TYR A 113 1.721 10.362 10.299 1.00 32.01 H new ATOM 1660 N ASP A 114 3.328 6.017 16.669 1.00 0.33 N ATOM 1661 CA ASP A 114 4.044 6.841 17.649 1.00 42.44 C ATOM 1662 C ASP A 114 5.552 6.617 17.553 1.00 51.43 C ATOM 1663 O ASP A 114 6.336 7.565 17.593 1.00 24.00 O ATOM 1664 CB ASP A 114 3.564 6.534 19.074 1.00 20.33 C ATOM 1665 CG ASP A 114 4.236 7.410 20.121 1.00 23.44 C ATOM 1666 OD1 ASP A 114 5.306 7.019 20.636 1.00 44.20 O ATOM 1667 OD2 ASP A 114 3.697 8.494 20.437 1.00 34.12 O ATOM 0 H ASP A 114 2.641 5.383 17.076 1.00 0.33 H new ATOM 0 HA ASP A 114 3.830 7.885 17.422 1.00 42.44 H new ATOM 0 HB2 ASP A 114 2.484 6.674 19.128 1.00 20.33 H new ATOM 0 HB3 ASP A 114 3.761 5.486 19.302 1.00 20.33 H new ATOM 1672 N ALA A 115 5.948 5.360 17.397 1.00 21.20 N ATOM 1673 CA ALA A 115 7.359 5.009 17.282 1.00 45.30 C ATOM 1674 C ALA A 115 7.933 5.501 15.957 1.00 23.43 C ATOM 1675 O ALA A 115 9.050 6.013 15.901 1.00 53.13 O ATOM 1676 CB ALA A 115 7.544 3.504 17.411 1.00 63.03 C ATOM 0 H ALA A 115 5.311 4.565 17.347 1.00 21.20 H new ATOM 0 HA ALA A 115 7.899 5.499 18.093 1.00 45.30 H new ATOM 0 HB1 ALA A 115 8.602 3.259 17.323 1.00 63.03 H new ATOM 0 HB2 ALA A 115 7.175 3.174 18.382 1.00 63.03 H new ATOM 0 HB3 ALA A 115 6.988 3.000 16.621 1.00 63.03 H new ATOM 1682 N LEU A 116 7.148 5.347 14.897 1.00 13.14 N ATOM 1683 CA LEU A 116 7.548 5.771 13.559 1.00 34.11 C ATOM 1684 C LEU A 116 7.881 7.260 13.511 1.00 70.33 C ATOM 1685 O LEU A 116 8.908 7.658 12.956 1.00 32.53 O ATOM 1686 CB LEU A 116 6.434 5.457 12.562 1.00 63.54 C ATOM 1687 CG LEU A 116 6.520 4.087 11.895 1.00 4.41 C ATOM 1688 CD1 LEU A 116 5.160 3.670 11.355 1.00 5.50 C ATOM 1689 CD2 LEU A 116 7.545 4.121 10.771 1.00 52.12 C ATOM 0 H LEU A 116 6.220 4.926 14.939 1.00 13.14 H new ATOM 0 HA LEU A 116 8.450 5.220 13.292 1.00 34.11 H new ATOM 0 HB2 LEU A 116 5.476 5.532 13.077 1.00 63.54 H new ATOM 0 HB3 LEU A 116 6.439 6.222 11.785 1.00 63.54 H new ATOM 0 HG LEU A 116 6.833 3.355 12.639 1.00 4.41 H new ATOM 0 HD11 LEU A 116 5.241 2.691 10.883 1.00 5.50 H new ATOM 0 HD12 LEU A 116 4.443 3.620 12.174 1.00 5.50 H new ATOM 0 HD13 LEU A 116 4.821 4.400 10.620 1.00 5.50 H new ATOM 0 HD21 LEU A 116 7.601 3.140 10.300 1.00 52.12 H new ATOM 0 HD22 LEU A 116 7.248 4.863 10.030 1.00 52.12 H new ATOM 0 HD23 LEU A 116 8.522 4.385 11.177 1.00 52.12 H new ATOM 1701 N MET A 117 7.018 8.082 14.093 1.00 63.50 N ATOM 1702 CA MET A 117 7.225 9.525 14.074 1.00 5.21 C ATOM 1703 C MET A 117 8.388 9.924 14.980 1.00 73.04 C ATOM 1704 O MET A 117 9.048 10.934 14.744 1.00 31.24 O ATOM 1705 CB MET A 117 5.948 10.280 14.462 1.00 71.42 C ATOM 1706 CG MET A 117 5.487 10.053 15.889 1.00 3.34 C ATOM 1707 SD MET A 117 4.005 10.999 16.284 1.00 51.41 S ATOM 1708 CE MET A 117 3.758 10.525 17.990 1.00 15.22 C ATOM 0 H MET A 117 6.175 7.779 14.580 1.00 63.50 H new ATOM 0 HA MET A 117 7.479 9.806 13.052 1.00 5.21 H new ATOM 0 HB2 MET A 117 6.114 11.347 14.313 1.00 71.42 H new ATOM 0 HB3 MET A 117 5.147 9.984 13.784 1.00 71.42 H new ATOM 0 HG2 MET A 117 5.290 8.992 16.041 1.00 3.34 H new ATOM 0 HG3 MET A 117 6.287 10.330 16.576 1.00 3.34 H new ATOM 0 HE1 MET A 117 2.817 9.982 18.084 1.00 15.22 H new ATOM 0 HE2 MET A 117 4.580 9.886 18.313 1.00 15.22 H new ATOM 0 HE3 MET A 117 3.726 11.418 18.615 1.00 15.22 H new ATOM 1718 N LYS A 118 8.648 9.133 16.012 1.00 22.03 N ATOM 1719 CA LYS A 118 9.786 9.393 16.881 1.00 50.42 C ATOM 1720 C LYS A 118 11.078 9.021 16.149 1.00 24.31 C ATOM 1721 O LYS A 118 12.106 9.685 16.292 1.00 61.43 O ATOM 1722 CB LYS A 118 9.669 8.607 18.194 1.00 63.04 C ATOM 1723 CG LYS A 118 10.110 9.394 19.426 1.00 54.43 C ATOM 1724 CD LYS A 118 11.527 9.930 19.278 1.00 12.23 C ATOM 1725 CE LYS A 118 11.918 10.829 20.437 1.00 53.52 C ATOM 1726 NZ LYS A 118 13.217 11.508 20.194 1.00 41.24 N ATOM 0 H LYS A 118 8.093 8.315 16.266 1.00 22.03 H new ATOM 0 HA LYS A 118 9.802 10.454 17.131 1.00 50.42 H new ATOM 0 HB2 LYS A 118 8.634 8.292 18.327 1.00 63.04 H new ATOM 0 HB3 LYS A 118 10.270 7.701 18.119 1.00 63.04 H new ATOM 0 HG2 LYS A 118 9.423 10.224 19.592 1.00 54.43 H new ATOM 0 HG3 LYS A 118 10.054 8.753 20.306 1.00 54.43 H new ATOM 0 HD2 LYS A 118 12.226 9.096 19.214 1.00 12.23 H new ATOM 0 HD3 LYS A 118 11.609 10.486 18.344 1.00 12.23 H new ATOM 0 HE2 LYS A 118 11.141 11.577 20.595 1.00 53.52 H new ATOM 0 HE3 LYS A 118 11.982 10.238 21.350 1.00 53.52 H new ATOM 0 HZ1 LYS A 118 13.607 11.845 21.097 1.00 41.24 H new ATOM 0 HZ2 LYS A 118 13.882 10.838 19.758 1.00 41.24 H new ATOM 0 HZ3 LYS A 118 13.072 12.317 19.557 1.00 41.24 H new ATOM 1740 N TRP A 119 11.007 7.964 15.350 1.00 12.34 N ATOM 1741 CA TRP A 119 12.147 7.504 14.566 1.00 15.53 C ATOM 1742 C TRP A 119 12.634 8.601 13.623 1.00 42.55 C ATOM 1743 O TRP A 119 13.835 8.869 13.529 1.00 23.14 O ATOM 1744 CB TRP A 119 11.768 6.250 13.767 1.00 51.22 C ATOM 1745 CG TRP A 119 12.906 5.659 12.986 1.00 11.10 C ATOM 1746 CD1 TRP A 119 13.889 4.845 13.467 1.00 43.41 C ATOM 1747 CD2 TRP A 119 13.173 5.828 11.587 1.00 4.52 C ATOM 1748 NE1 TRP A 119 14.755 4.504 12.458 1.00 11.32 N ATOM 1749 CE2 TRP A 119 14.336 5.091 11.293 1.00 30.21 C ATOM 1750 CE3 TRP A 119 12.544 6.532 10.553 1.00 72.42 C ATOM 1751 CZ2 TRP A 119 14.882 5.038 10.012 1.00 72.30 C ATOM 1752 CZ3 TRP A 119 13.086 6.477 9.283 1.00 13.15 C ATOM 1753 CH2 TRP A 119 14.246 5.733 9.021 1.00 30.04 C ATOM 0 H TRP A 119 10.163 7.404 15.227 1.00 12.34 H new ATOM 0 HA TRP A 119 12.957 7.256 15.252 1.00 15.53 H new ATOM 0 HB2 TRP A 119 11.382 5.497 14.454 1.00 51.22 H new ATOM 0 HB3 TRP A 119 10.960 6.500 13.080 1.00 51.22 H new ATOM 0 HD1 TRP A 119 13.974 4.517 14.492 1.00 43.41 H new ATOM 0 HE1 TRP A 119 15.578 3.910 12.559 1.00 11.32 H new ATOM 0 HE3 TRP A 119 11.651 7.108 10.745 1.00 72.42 H new ATOM 0 HZ2 TRP A 119 15.776 4.468 9.809 1.00 72.30 H new ATOM 0 HZ3 TRP A 119 12.608 7.016 8.478 1.00 13.15 H new ATOM 0 HH2 TRP A 119 14.644 5.709 8.017 1.00 30.04 H new ATOM 1764 N VAL A 120 11.696 9.248 12.941 1.00 23.02 N ATOM 1765 CA VAL A 120 12.040 10.282 11.972 1.00 31.30 C ATOM 1766 C VAL A 120 12.530 11.546 12.667 1.00 71.51 C ATOM 1767 O VAL A 120 13.386 12.263 12.143 1.00 44.11 O ATOM 1768 CB VAL A 120 10.859 10.624 11.048 1.00 4.53 C ATOM 1769 CG1 VAL A 120 9.706 11.266 11.803 1.00 50.54 C ATOM 1770 CG2 VAL A 120 11.328 11.516 9.917 1.00 53.03 C ATOM 0 H VAL A 120 10.696 9.076 13.040 1.00 23.02 H new ATOM 0 HA VAL A 120 12.845 9.877 11.358 1.00 31.30 H new ATOM 0 HB VAL A 120 10.481 9.690 10.633 1.00 4.53 H new ATOM 0 HG11 VAL A 120 8.896 11.489 11.109 1.00 50.54 H new ATOM 0 HG12 VAL A 120 9.347 10.580 12.571 1.00 50.54 H new ATOM 0 HG13 VAL A 120 10.047 12.189 12.272 1.00 50.54 H new ATOM 0 HG21 VAL A 120 10.485 11.753 9.267 1.00 53.03 H new ATOM 0 HG22 VAL A 120 11.741 12.438 10.328 1.00 53.03 H new ATOM 0 HG23 VAL A 120 12.096 11.000 9.341 1.00 53.03 H new ATOM 1780 N ASP A 121 11.980 11.808 13.847 1.00 42.30 N ATOM 1781 CA ASP A 121 12.448 12.910 14.692 1.00 12.55 C ATOM 1782 C ASP A 121 13.960 12.832 14.875 1.00 12.54 C ATOM 1783 O ASP A 121 14.663 13.841 14.812 1.00 72.20 O ATOM 1784 CB ASP A 121 11.752 12.877 16.058 1.00 42.54 C ATOM 1785 CG ASP A 121 12.461 13.730 17.098 1.00 11.24 C ATOM 1786 OD1 ASP A 121 12.491 14.970 16.944 1.00 14.22 O ATOM 1787 OD2 ASP A 121 12.982 13.160 18.082 1.00 60.40 O ATOM 0 H ASP A 121 11.208 11.273 14.244 1.00 42.30 H new ATOM 0 HA ASP A 121 12.200 13.849 14.198 1.00 12.55 H new ATOM 0 HB2 ASP A 121 10.725 13.226 15.947 1.00 42.54 H new ATOM 0 HB3 ASP A 121 11.702 11.847 16.411 1.00 42.54 H new ATOM 1792 N ASP A 122 14.452 11.618 15.063 1.00 31.23 N ATOM 1793 CA ASP A 122 15.879 11.385 15.229 1.00 25.32 C ATOM 1794 C ASP A 122 16.604 11.360 13.883 1.00 71.52 C ATOM 1795 O ASP A 122 17.657 11.974 13.731 1.00 33.14 O ATOM 1796 CB ASP A 122 16.111 10.069 15.976 1.00 60.34 C ATOM 1797 CG ASP A 122 17.573 9.680 16.035 1.00 22.23 C ATOM 1798 OD1 ASP A 122 18.331 10.324 16.790 1.00 32.21 O ATOM 1799 OD2 ASP A 122 17.968 8.728 15.331 1.00 14.20 O ATOM 0 H ASP A 122 13.881 10.774 15.105 1.00 31.23 H new ATOM 0 HA ASP A 122 16.288 12.210 15.813 1.00 25.32 H new ATOM 0 HB2 ASP A 122 15.722 10.158 16.990 1.00 60.34 H new ATOM 0 HB3 ASP A 122 15.547 9.274 15.487 1.00 60.34 H new ATOM 1804 N ASN A 123 16.027 10.657 12.910 1.00 43.24 N ATOM 1805 CA ASN A 123 16.669 10.458 11.613 1.00 63.05 C ATOM 1806 C ASN A 123 16.827 11.773 10.842 1.00 70.14 C ATOM 1807 O ASN A 123 17.849 12.001 10.195 1.00 51.42 O ATOM 1808 CB ASN A 123 15.851 9.465 10.790 1.00 41.24 C ATOM 1809 CG ASN A 123 16.604 8.955 9.582 1.00 62.42 C ATOM 1810 OD1 ASN A 123 16.545 9.541 8.502 1.00 13.33 O ATOM 1811 ND2 ASN A 123 17.317 7.854 9.757 1.00 72.01 N ATOM 0 H ASN A 123 15.112 10.214 12.997 1.00 43.24 H new ATOM 0 HA ASN A 123 17.669 10.063 11.790 1.00 63.05 H new ATOM 0 HB2 ASN A 123 15.568 8.622 11.420 1.00 41.24 H new ATOM 0 HB3 ASN A 123 14.927 9.943 10.463 1.00 41.24 H new ATOM 0 HD21 ASN A 123 17.846 7.460 8.979 1.00 72.01 H new ATOM 0 HD22 ASN A 123 17.338 7.400 10.670 1.00 72.01 H new ATOM 1818 N GLY A 124 15.824 12.640 10.923 1.00 71.33 N ATOM 1819 CA GLY A 124 15.921 13.953 10.302 1.00 54.11 C ATOM 1820 C GLY A 124 15.433 13.995 8.859 1.00 61.34 C ATOM 1821 O GLY A 124 15.612 15.003 8.173 1.00 4.40 O ATOM 0 H GLY A 124 14.944 12.460 11.407 1.00 71.33 H new ATOM 0 HA2 GLY A 124 15.343 14.665 10.891 1.00 54.11 H new ATOM 0 HA3 GLY A 124 16.960 14.282 10.333 1.00 54.11 H new ATOM 1825 N PHE A 125 14.814 12.918 8.393 1.00 53.52 N ATOM 1826 CA PHE A 125 14.262 12.893 7.039 1.00 20.21 C ATOM 1827 C PHE A 125 12.852 13.481 7.059 1.00 43.51 C ATOM 1828 O PHE A 125 12.336 13.798 8.129 1.00 12.53 O ATOM 1829 CB PHE A 125 14.228 11.458 6.491 1.00 34.32 C ATOM 1830 CG PHE A 125 14.069 11.373 4.993 1.00 54.33 C ATOM 1831 CD1 PHE A 125 15.049 11.872 4.150 1.00 64.52 C ATOM 1832 CD2 PHE A 125 12.947 10.786 4.428 1.00 0.04 C ATOM 1833 CE1 PHE A 125 14.911 11.790 2.778 1.00 63.11 C ATOM 1834 CE2 PHE A 125 12.804 10.703 3.057 1.00 53.45 C ATOM 1835 CZ PHE A 125 13.789 11.205 2.231 1.00 14.41 C ATOM 0 H PHE A 125 14.681 12.057 8.924 1.00 53.52 H new ATOM 0 HA PHE A 125 14.899 13.490 6.386 1.00 20.21 H new ATOM 0 HB2 PHE A 125 15.149 10.950 6.777 1.00 34.32 H new ATOM 0 HB3 PHE A 125 13.407 10.920 6.964 1.00 34.32 H new ATOM 0 HD1 PHE A 125 15.932 12.331 4.571 1.00 64.52 H new ATOM 0 HD2 PHE A 125 12.174 10.388 5.069 1.00 0.04 H new ATOM 0 HE1 PHE A 125 15.683 12.184 2.133 1.00 63.11 H new ATOM 0 HE2 PHE A 125 11.923 10.246 2.632 1.00 53.45 H new ATOM 0 HZ PHE A 125 13.681 11.140 1.158 1.00 14.41 H new ATOM 1845 N ASP A 126 12.243 13.645 5.892 1.00 1.44 N ATOM 1846 CA ASP A 126 10.870 14.131 5.817 1.00 54.25 C ATOM 1847 C ASP A 126 10.288 13.904 4.429 1.00 0.32 C ATOM 1848 O ASP A 126 11.003 13.954 3.427 1.00 23.02 O ATOM 1849 CB ASP A 126 10.781 15.624 6.173 1.00 62.52 C ATOM 1850 CG ASP A 126 11.272 16.534 5.064 1.00 50.35 C ATOM 1851 OD1 ASP A 126 12.491 16.792 4.992 1.00 22.30 O ATOM 1852 OD2 ASP A 126 10.438 17.003 4.263 1.00 71.10 O ATOM 0 H ASP A 126 12.674 13.450 4.989 1.00 1.44 H new ATOM 0 HA ASP A 126 10.289 13.565 6.545 1.00 54.25 H new ATOM 0 HB2 ASP A 126 9.746 15.874 6.407 1.00 62.52 H new ATOM 0 HB3 ASP A 126 11.366 15.811 7.073 1.00 62.52 H new ATOM 1857 N LEU A 127 8.992 13.628 4.391 1.00 73.10 N ATOM 1858 CA LEU A 127 8.241 13.530 3.143 1.00 34.23 C ATOM 1859 C LEU A 127 6.875 14.153 3.341 1.00 23.02 C ATOM 1860 O LEU A 127 6.475 14.418 4.473 1.00 3.21 O ATOM 1861 CB LEU A 127 8.061 12.077 2.690 1.00 44.50 C ATOM 1862 CG LEU A 127 9.331 11.362 2.221 1.00 51.12 C ATOM 1863 CD1 LEU A 127 9.019 9.920 1.860 1.00 31.33 C ATOM 1864 CD2 LEU A 127 9.938 12.079 1.024 1.00 73.41 C ATOM 0 H LEU A 127 8.429 13.465 5.226 1.00 73.10 H new ATOM 0 HA LEU A 127 8.805 14.055 2.372 1.00 34.23 H new ATOM 0 HB2 LEU A 127 7.631 11.510 3.516 1.00 44.50 H new ATOM 0 HB3 LEU A 127 7.335 12.057 1.878 1.00 44.50 H new ATOM 0 HG LEU A 127 10.054 11.375 3.037 1.00 51.12 H new ATOM 0 HD11 LEU A 127 9.930 9.423 1.528 1.00 31.33 H new ATOM 0 HD12 LEU A 127 8.622 9.404 2.734 1.00 31.33 H new ATOM 0 HD13 LEU A 127 8.281 9.897 1.058 1.00 31.33 H new ATOM 0 HD21 LEU A 127 10.840 11.556 0.705 1.00 73.41 H new ATOM 0 HD22 LEU A 127 9.218 12.094 0.205 1.00 73.41 H new ATOM 0 HD23 LEU A 127 10.191 13.102 1.303 1.00 73.41 H new ATOM 1876 N SER A 128 6.168 14.384 2.252 1.00 0.02 N ATOM 1877 CA SER A 128 4.817 14.908 2.322 1.00 72.24 C ATOM 1878 C SER A 128 3.935 14.303 1.232 1.00 33.44 C ATOM 1879 O SER A 128 3.739 14.894 0.170 1.00 15.23 O ATOM 1880 CB SER A 128 4.839 16.438 2.236 1.00 14.21 C ATOM 1881 OG SER A 128 5.765 16.887 1.256 1.00 32.23 O ATOM 0 H SER A 128 6.508 14.217 1.305 1.00 0.02 H new ATOM 0 HA SER A 128 4.385 14.625 3.282 1.00 72.24 H new ATOM 0 HB2 SER A 128 3.842 16.805 1.992 1.00 14.21 H new ATOM 0 HB3 SER A 128 5.104 16.855 3.208 1.00 14.21 H new ATOM 0 HG SER A 128 5.756 17.866 1.222 1.00 32.23 H new ATOM 1887 N GLY A 129 3.447 13.096 1.488 1.00 45.05 N ATOM 1888 CA GLY A 129 2.540 12.451 0.563 1.00 75.21 C ATOM 1889 C GLY A 129 1.430 11.708 1.280 1.00 42.24 C ATOM 1890 O GLY A 129 0.767 12.266 2.155 1.00 75.22 O ATOM 0 H GLY A 129 3.665 12.552 2.323 1.00 45.05 H new ATOM 0 HA2 GLY A 129 2.106 13.199 -0.100 1.00 75.21 H new ATOM 0 HA3 GLY A 129 3.096 11.754 -0.064 1.00 75.21 H new ATOM 1894 N GLU A 130 1.244 10.448 0.928 1.00 44.32 N ATOM 1895 CA GLU A 130 0.189 9.636 1.522 1.00 10.44 C ATOM 1896 C GLU A 130 0.772 8.665 2.537 1.00 61.31 C ATOM 1897 O GLU A 130 1.990 8.506 2.635 1.00 15.32 O ATOM 1898 CB GLU A 130 -0.573 8.824 0.462 1.00 33.42 C ATOM 1899 CG GLU A 130 -1.160 9.639 -0.679 1.00 64.04 C ATOM 1900 CD GLU A 130 -0.128 10.015 -1.717 1.00 13.54 C ATOM 1901 OE1 GLU A 130 0.590 9.112 -2.195 1.00 54.54 O ATOM 1902 OE2 GLU A 130 -0.019 11.213 -2.049 1.00 5.03 O ATOM 0 H GLU A 130 1.810 9.961 0.233 1.00 44.32 H new ATOM 0 HA GLU A 130 -0.502 10.325 2.008 1.00 10.44 H new ATOM 0 HB2 GLU A 130 0.103 8.078 0.044 1.00 33.42 H new ATOM 0 HB3 GLU A 130 -1.381 8.283 0.954 1.00 33.42 H new ATOM 0 HG2 GLU A 130 -1.957 9.068 -1.155 1.00 64.04 H new ATOM 0 HG3 GLU A 130 -1.613 10.546 -0.277 1.00 64.04 H new ATOM 1909 N ALA A 131 -0.105 8.025 3.293 1.00 73.34 N ATOM 1910 CA ALA A 131 0.291 6.942 4.172 1.00 34.11 C ATOM 1911 C ALA A 131 -0.166 5.629 3.567 1.00 62.11 C ATOM 1912 O ALA A 131 -1.349 5.458 3.281 1.00 33.43 O ATOM 1913 CB ALA A 131 -0.305 7.129 5.558 1.00 52.13 C ATOM 0 H ALA A 131 -1.102 8.240 3.314 1.00 73.34 H new ATOM 0 HA ALA A 131 1.376 6.938 4.277 1.00 34.11 H new ATOM 0 HB1 ALA A 131 0.005 6.305 6.201 1.00 52.13 H new ATOM 0 HB2 ALA A 131 0.045 8.071 5.980 1.00 52.13 H new ATOM 0 HB3 ALA A 131 -1.393 7.145 5.487 1.00 52.13 H new ATOM 1919 N TYR A 132 0.759 4.713 3.346 1.00 15.53 N ATOM 1920 CA TYR A 132 0.424 3.471 2.674 1.00 40.23 C ATOM 1921 C TYR A 132 0.940 2.260 3.438 1.00 3.21 C ATOM 1922 O TYR A 132 2.085 2.227 3.891 1.00 42.14 O ATOM 1923 CB TYR A 132 0.929 3.469 1.223 1.00 60.53 C ATOM 1924 CG TYR A 132 2.406 3.750 1.052 1.00 34.40 C ATOM 1925 CD1 TYR A 132 2.901 5.048 1.111 1.00 24.13 C ATOM 1926 CD2 TYR A 132 3.302 2.718 0.816 1.00 23.34 C ATOM 1927 CE1 TYR A 132 4.247 5.306 0.946 1.00 33.41 C ATOM 1928 CE2 TYR A 132 4.649 2.969 0.647 1.00 22.25 C ATOM 1929 CZ TYR A 132 5.116 4.264 0.712 1.00 53.53 C ATOM 1930 OH TYR A 132 6.458 4.514 0.548 1.00 31.50 O ATOM 0 H TYR A 132 1.738 4.803 3.618 1.00 15.53 H new ATOM 0 HA TYR A 132 -0.663 3.400 2.649 1.00 40.23 H new ATOM 0 HB2 TYR A 132 0.707 2.498 0.780 1.00 60.53 H new ATOM 0 HB3 TYR A 132 0.367 4.213 0.659 1.00 60.53 H new ATOM 0 HD1 TYR A 132 2.221 5.868 1.289 1.00 24.13 H new ATOM 0 HD2 TYR A 132 2.940 1.702 0.764 1.00 23.34 H new ATOM 0 HE1 TYR A 132 4.616 6.319 1.000 1.00 33.41 H new ATOM 0 HE2 TYR A 132 5.334 2.154 0.465 1.00 22.25 H new ATOM 0 HH TYR A 132 6.975 3.743 0.863 1.00 31.50 H new ATOM 1940 N GLU A 133 0.071 1.274 3.578 1.00 44.34 N ATOM 1941 CA GLU A 133 0.379 0.063 4.318 1.00 3.42 C ATOM 1942 C GLU A 133 0.494 -1.127 3.375 1.00 4.23 C ATOM 1943 O GLU A 133 -0.465 -1.472 2.681 1.00 12.21 O ATOM 1944 CB GLU A 133 -0.717 -0.196 5.347 1.00 42.12 C ATOM 1945 CG GLU A 133 -0.907 0.948 6.328 1.00 65.23 C ATOM 1946 CD GLU A 133 -2.181 0.815 7.134 1.00 52.43 C ATOM 1947 OE1 GLU A 133 -2.765 -0.287 7.151 1.00 20.15 O ATOM 1948 OE2 GLU A 133 -2.608 1.818 7.745 1.00 43.42 O ATOM 0 H GLU A 133 -0.869 1.291 3.181 1.00 44.34 H new ATOM 0 HA GLU A 133 1.335 0.194 4.826 1.00 3.42 H new ATOM 0 HB2 GLU A 133 -1.657 -0.379 4.827 1.00 42.12 H new ATOM 0 HB3 GLU A 133 -0.478 -1.104 5.901 1.00 42.12 H new ATOM 0 HG2 GLU A 133 -0.054 0.986 7.006 1.00 65.23 H new ATOM 0 HG3 GLU A 133 -0.923 1.891 5.782 1.00 65.23 H new ATOM 1955 N ILE A 134 1.664 -1.743 3.351 1.00 52.04 N ATOM 1956 CA ILE A 134 1.907 -2.899 2.502 1.00 74.01 C ATOM 1957 C ILE A 134 1.558 -4.177 3.254 1.00 31.22 C ATOM 1958 O ILE A 134 2.209 -4.525 4.244 1.00 73.41 O ATOM 1959 CB ILE A 134 3.383 -2.988 2.020 1.00 73.34 C ATOM 1960 CG1 ILE A 134 3.781 -1.768 1.177 1.00 72.12 C ATOM 1961 CG2 ILE A 134 3.603 -4.265 1.219 1.00 43.31 C ATOM 1962 CD1 ILE A 134 4.086 -0.525 1.987 1.00 63.30 C ATOM 0 H ILE A 134 2.466 -1.460 3.914 1.00 52.04 H new ATOM 0 HA ILE A 134 1.273 -2.783 1.623 1.00 74.01 H new ATOM 0 HB ILE A 134 4.016 -3.004 2.907 1.00 73.34 H new ATOM 0 HG12 ILE A 134 4.657 -2.023 0.580 1.00 72.12 H new ATOM 0 HG13 ILE A 134 2.974 -1.544 0.479 1.00 72.12 H new ATOM 0 HG21 ILE A 134 4.641 -4.313 0.889 1.00 43.31 H new ATOM 0 HG22 ILE A 134 3.381 -5.130 1.844 1.00 43.31 H new ATOM 0 HG23 ILE A 134 2.945 -4.267 0.350 1.00 43.31 H new ATOM 0 HD11 ILE A 134 4.358 0.289 1.315 1.00 63.30 H new ATOM 0 HD12 ILE A 134 3.205 -0.241 2.563 1.00 63.30 H new ATOM 0 HD13 ILE A 134 4.914 -0.727 2.666 1.00 63.30 H new ATOM 1974 N TYR A 135 0.528 -4.864 2.789 1.00 61.43 N ATOM 1975 CA TYR A 135 0.126 -6.129 3.378 1.00 51.13 C ATOM 1976 C TYR A 135 0.734 -7.273 2.575 1.00 52.05 C ATOM 1977 O TYR A 135 0.109 -7.783 1.644 1.00 53.42 O ATOM 1978 CB TYR A 135 -1.402 -6.269 3.396 1.00 63.14 C ATOM 1979 CG TYR A 135 -2.139 -5.090 3.993 1.00 62.44 C ATOM 1980 CD1 TYR A 135 -2.190 -4.896 5.368 1.00 31.54 C ATOM 1981 CD2 TYR A 135 -2.801 -4.179 3.176 1.00 50.23 C ATOM 1982 CE1 TYR A 135 -2.876 -3.826 5.912 1.00 33.13 C ATOM 1983 CE2 TYR A 135 -3.492 -3.111 3.713 1.00 71.30 C ATOM 1984 CZ TYR A 135 -3.527 -2.938 5.080 1.00 33.54 C ATOM 1985 OH TYR A 135 -4.223 -1.878 5.614 1.00 74.04 O ATOM 0 H TYR A 135 -0.047 -4.565 2.002 1.00 61.43 H new ATOM 0 HA TYR A 135 0.484 -6.162 4.407 1.00 51.13 H new ATOM 0 HB2 TYR A 135 -1.751 -6.419 2.374 1.00 63.14 H new ATOM 0 HB3 TYR A 135 -1.664 -7.166 3.957 1.00 63.14 H new ATOM 0 HD1 TYR A 135 -1.686 -5.592 6.022 1.00 31.54 H new ATOM 0 HD2 TYR A 135 -2.774 -4.309 2.104 1.00 50.23 H new ATOM 0 HE1 TYR A 135 -2.902 -3.686 6.983 1.00 33.13 H new ATOM 0 HE2 TYR A 135 -4.003 -2.414 3.065 1.00 71.30 H new ATOM 0 HH TYR A 135 -3.593 -1.230 5.992 1.00 74.04 H new ATOM 1995 N LEU A 136 1.957 -7.651 2.915 1.00 40.55 N ATOM 1996 CA LEU A 136 2.675 -8.663 2.151 1.00 63.33 C ATOM 1997 C LEU A 136 2.403 -10.057 2.691 1.00 14.05 C ATOM 1998 O LEU A 136 1.993 -10.217 3.842 1.00 2.10 O ATOM 1999 CB LEU A 136 4.186 -8.390 2.129 1.00 15.10 C ATOM 2000 CG LEU A 136 4.886 -8.370 3.489 1.00 42.42 C ATOM 2001 CD1 LEU A 136 6.360 -8.695 3.326 1.00 75.12 C ATOM 2002 CD2 LEU A 136 4.728 -7.011 4.151 1.00 70.20 C ATOM 0 H LEU A 136 2.472 -7.275 3.711 1.00 40.55 H new ATOM 0 HA LEU A 136 2.306 -8.610 1.127 1.00 63.33 H new ATOM 0 HB2 LEU A 136 4.663 -9.149 1.509 1.00 15.10 H new ATOM 0 HB3 LEU A 136 4.354 -7.429 1.642 1.00 15.10 H new ATOM 0 HG LEU A 136 4.423 -9.125 4.124 1.00 42.42 H new ATOM 0 HD11 LEU A 136 6.846 -8.677 4.301 1.00 75.12 H new ATOM 0 HD12 LEU A 136 6.467 -9.686 2.885 1.00 75.12 H new ATOM 0 HD13 LEU A 136 6.826 -7.955 2.675 1.00 75.12 H new ATOM 0 HD21 LEU A 136 5.232 -7.016 5.117 1.00 70.20 H new ATOM 0 HD22 LEU A 136 5.169 -6.243 3.515 1.00 70.20 H new ATOM 0 HD23 LEU A 136 3.669 -6.798 4.296 1.00 70.20 H new ATOM 2014 N ASP A 137 2.640 -11.054 1.835 1.00 51.20 N ATOM 2015 CA ASP A 137 2.394 -12.458 2.160 1.00 71.12 C ATOM 2016 C ASP A 137 0.904 -12.716 2.371 1.00 13.44 C ATOM 2017 O ASP A 137 0.077 -11.807 2.264 1.00 2.22 O ATOM 2018 CB ASP A 137 3.195 -12.893 3.398 1.00 22.40 C ATOM 2019 CG ASP A 137 4.698 -12.897 3.164 1.00 33.32 C ATOM 2020 OD1 ASP A 137 5.174 -13.697 2.327 1.00 40.14 O ATOM 2021 OD2 ASP A 137 5.416 -12.114 3.821 1.00 33.21 O ATOM 0 H ASP A 137 3.009 -10.908 0.895 1.00 51.20 H new ATOM 0 HA ASP A 137 2.731 -13.055 1.313 1.00 71.12 H new ATOM 0 HB2 ASP A 137 2.964 -12.224 4.227 1.00 22.40 H new ATOM 0 HB3 ASP A 137 2.877 -13.892 3.697 1.00 22.40 H new ATOM 2026 N ASN A 138 0.555 -13.964 2.638 1.00 21.41 N ATOM 2027 CA ASN A 138 -0.827 -14.316 2.927 1.00 42.32 C ATOM 2028 C ASN A 138 -0.996 -14.537 4.421 1.00 10.31 C ATOM 2029 O ASN A 138 -0.095 -15.049 5.078 1.00 65.45 O ATOM 2030 CB ASN A 138 -1.262 -15.563 2.137 1.00 0.30 C ATOM 2031 CG ASN A 138 -0.256 -16.708 2.182 1.00 15.13 C ATOM 2032 OD1 ASN A 138 0.528 -16.844 3.117 1.00 24.42 O ATOM 2033 ND2 ASN A 138 -0.295 -17.560 1.173 1.00 3.50 N ATOM 0 H ASN A 138 1.207 -14.748 2.661 1.00 21.41 H new ATOM 0 HA ASN A 138 -1.469 -13.492 2.614 1.00 42.32 H new ATOM 0 HB2 ASN A 138 -2.216 -15.915 2.530 1.00 0.30 H new ATOM 0 HB3 ASN A 138 -1.430 -15.282 1.098 1.00 0.30 H new ATOM 0 HD21 ASN A 138 0.338 -18.359 1.156 1.00 3.50 H new ATOM 0 HD22 ASN A 138 -0.959 -17.418 0.411 1.00 3.50 H new ATOM 2040 N PRO A 139 -2.139 -14.143 4.995 1.00 12.42 N ATOM 2041 CA PRO A 139 -2.368 -14.293 6.429 1.00 53.45 C ATOM 2042 C PRO A 139 -2.637 -15.744 6.812 1.00 33.24 C ATOM 2043 O PRO A 139 -3.152 -16.515 6.000 1.00 21.42 O ATOM 2044 CB PRO A 139 -3.616 -13.433 6.696 1.00 54.54 C ATOM 2045 CG PRO A 139 -3.878 -12.686 5.425 1.00 23.11 C ATOM 2046 CD PRO A 139 -3.273 -13.505 4.323 1.00 32.32 C ATOM 0 HA PRO A 139 -1.499 -13.989 7.012 1.00 53.45 H new ATOM 0 HB2 PRO A 139 -4.469 -14.055 6.966 1.00 54.54 H new ATOM 0 HB3 PRO A 139 -3.447 -12.746 7.525 1.00 54.54 H new ATOM 0 HG2 PRO A 139 -4.948 -12.551 5.267 1.00 23.11 H new ATOM 0 HG3 PRO A 139 -3.433 -11.692 5.460 1.00 23.11 H new ATOM 0 HD2 PRO A 139 -3.976 -14.238 3.928 1.00 32.32 H new ATOM 0 HD3 PRO A 139 -2.953 -12.886 3.485 1.00 32.32 H new ATOM 2054 N ALA A 140 -2.276 -16.094 8.050 1.00 31.55 N ATOM 2055 CA ALA A 140 -2.526 -17.419 8.637 1.00 64.12 C ATOM 2056 C ALA A 140 -1.671 -18.516 7.996 1.00 71.44 C ATOM 2057 O ALA A 140 -1.164 -19.401 8.684 1.00 22.45 O ATOM 2058 CB ALA A 140 -4.003 -17.778 8.559 1.00 31.32 C ATOM 0 H ALA A 140 -1.794 -15.457 8.684 1.00 31.55 H new ATOM 0 HA ALA A 140 -2.234 -17.357 9.685 1.00 64.12 H new ATOM 0 HB1 ALA A 140 -4.162 -18.762 9.000 1.00 31.32 H new ATOM 0 HB2 ALA A 140 -4.587 -17.037 9.105 1.00 31.32 H new ATOM 0 HB3 ALA A 140 -4.319 -17.792 7.516 1.00 31.32 H new ATOM 2064 N GLU A 141 -1.498 -18.434 6.687 1.00 64.42 N ATOM 2065 CA GLU A 141 -0.787 -19.458 5.928 1.00 72.14 C ATOM 2066 C GLU A 141 0.723 -19.309 6.105 1.00 13.23 C ATOM 2067 O GLU A 141 1.484 -20.246 5.879 1.00 41.53 O ATOM 2068 CB GLU A 141 -1.143 -19.358 4.440 1.00 40.52 C ATOM 2069 CG GLU A 141 -2.636 -19.256 4.160 1.00 75.32 C ATOM 2070 CD GLU A 141 -3.409 -20.480 4.605 1.00 72.35 C ATOM 2071 OE1 GLU A 141 -3.505 -21.446 3.823 1.00 45.11 O ATOM 2072 OE2 GLU A 141 -3.936 -20.478 5.737 1.00 72.14 O ATOM 0 H GLU A 141 -1.844 -17.660 6.119 1.00 64.42 H new ATOM 0 HA GLU A 141 -1.091 -20.434 6.306 1.00 72.14 H new ATOM 0 HB2 GLU A 141 -0.645 -18.486 4.017 1.00 40.52 H new ATOM 0 HB3 GLU A 141 -0.747 -20.233 3.924 1.00 40.52 H new ATOM 0 HG2 GLU A 141 -3.035 -18.377 4.667 1.00 75.32 H new ATOM 0 HG3 GLU A 141 -2.790 -19.105 3.091 1.00 75.32 H new ATOM 2079 N THR A 142 1.138 -18.121 6.522 1.00 31.40 N ATOM 2080 CA THR A 142 2.541 -17.801 6.716 1.00 52.52 C ATOM 2081 C THR A 142 3.023 -18.205 8.103 1.00 14.21 C ATOM 2082 O THR A 142 4.185 -17.977 8.448 1.00 73.01 O ATOM 2083 CB THR A 142 2.737 -16.295 6.548 1.00 72.24 C ATOM 2084 OG1 THR A 142 1.541 -15.629 6.964 1.00 73.52 O ATOM 2085 CG2 THR A 142 3.057 -15.931 5.109 1.00 20.13 C ATOM 0 H THR A 142 0.506 -17.350 6.736 1.00 31.40 H new ATOM 0 HA THR A 142 3.119 -18.355 5.976 1.00 52.52 H new ATOM 0 HB THR A 142 3.582 -15.981 7.161 1.00 72.24 H new ATOM 0 HG1 THR A 142 1.131 -15.182 6.194 1.00 73.52 H new ATOM 0 HG21 THR A 142 3.190 -14.852 5.027 1.00 20.13 H new ATOM 0 HG22 THR A 142 3.974 -16.434 4.802 1.00 20.13 H new ATOM 0 HG23 THR A 142 2.237 -16.245 4.463 1.00 20.13 H new ATOM 2093 N ALA A 143 2.115 -18.799 8.883 1.00 12.50 N ATOM 2094 CA ALA A 143 2.370 -19.175 10.274 1.00 52.10 C ATOM 2095 C ALA A 143 2.392 -17.956 11.184 1.00 30.45 C ATOM 2096 O ALA A 143 2.692 -16.841 10.751 1.00 43.00 O ATOM 2097 CB ALA A 143 3.671 -19.947 10.424 1.00 41.00 C ATOM 0 H ALA A 143 1.175 -19.034 8.563 1.00 12.50 H new ATOM 0 HA ALA A 143 1.548 -19.825 10.574 1.00 52.10 H new ATOM 0 HB1 ALA A 143 3.821 -20.206 11.472 1.00 41.00 H new ATOM 0 HB2 ALA A 143 3.624 -20.858 9.828 1.00 41.00 H new ATOM 0 HB3 ALA A 143 4.502 -19.331 10.080 1.00 41.00 H new ATOM 2103 N PRO A 144 2.046 -18.155 12.460 1.00 0.25 N ATOM 2104 CA PRO A 144 2.108 -17.102 13.466 1.00 52.42 C ATOM 2105 C PRO A 144 3.488 -16.468 13.556 1.00 72.40 C ATOM 2106 O PRO A 144 4.505 -17.120 13.317 1.00 60.51 O ATOM 2107 CB PRO A 144 1.779 -17.825 14.771 1.00 70.40 C ATOM 2108 CG PRO A 144 1.001 -19.022 14.357 1.00 62.01 C ATOM 2109 CD PRO A 144 1.537 -19.418 13.014 1.00 14.23 C ATOM 0 HA PRO A 144 1.426 -16.284 13.232 1.00 52.42 H new ATOM 0 HB2 PRO A 144 2.686 -18.108 15.306 1.00 70.40 H new ATOM 0 HB3 PRO A 144 1.200 -17.189 15.440 1.00 70.40 H new ATOM 0 HG2 PRO A 144 1.117 -19.831 15.078 1.00 62.01 H new ATOM 0 HG3 PRO A 144 -0.064 -18.795 14.301 1.00 62.01 H new ATOM 0 HD2 PRO A 144 2.326 -20.165 13.101 1.00 14.23 H new ATOM 0 HD3 PRO A 144 0.760 -19.848 12.383 1.00 14.23 H new ATOM 2117 N ASP A 145 3.486 -15.188 13.890 1.00 70.13 N ATOM 2118 CA ASP A 145 4.707 -14.406 14.149 1.00 0.41 C ATOM 2119 C ASP A 145 5.436 -14.009 12.858 1.00 14.23 C ATOM 2120 O ASP A 145 6.264 -13.100 12.861 1.00 72.02 O ATOM 2121 CB ASP A 145 5.650 -15.186 15.084 1.00 44.44 C ATOM 2122 CG ASP A 145 6.923 -14.440 15.427 1.00 32.11 C ATOM 2123 OD1 ASP A 145 6.920 -13.684 16.420 1.00 53.15 O ATOM 2124 OD2 ASP A 145 7.940 -14.628 14.724 1.00 0.11 O ATOM 0 H ASP A 145 2.629 -14.645 13.993 1.00 70.13 H new ATOM 0 HA ASP A 145 4.400 -13.480 14.636 1.00 0.41 H new ATOM 0 HB2 ASP A 145 5.119 -15.423 16.006 1.00 44.44 H new ATOM 0 HB3 ASP A 145 5.911 -16.134 14.614 1.00 44.44 H new ATOM 2129 N GLN A 146 5.107 -14.654 11.749 1.00 22.05 N ATOM 2130 CA GLN A 146 5.790 -14.381 10.491 1.00 1.02 C ATOM 2131 C GLN A 146 4.950 -13.493 9.567 1.00 11.45 C ATOM 2132 O GLN A 146 5.168 -13.460 8.357 1.00 73.35 O ATOM 2133 CB GLN A 146 6.154 -15.692 9.792 1.00 4.33 C ATOM 2134 CG GLN A 146 7.202 -16.503 10.543 1.00 61.32 C ATOM 2135 CD GLN A 146 7.672 -17.718 9.768 1.00 51.52 C ATOM 2136 OE1 GLN A 146 7.037 -18.853 9.997 1.00 32.34 O flip ATOM 2137 NE2 GLN A 146 8.616 -17.638 8.983 1.00 53.12 N flip ATOM 0 H GLN A 146 4.378 -15.365 11.693 1.00 22.05 H new ATOM 0 HA GLN A 146 6.705 -13.835 10.722 1.00 1.02 H new ATOM 0 HB2 GLN A 146 5.254 -16.295 9.674 1.00 4.33 H new ATOM 0 HB3 GLN A 146 6.524 -15.472 8.791 1.00 4.33 H new ATOM 0 HG2 GLN A 146 8.058 -15.866 10.764 1.00 61.32 H new ATOM 0 HG3 GLN A 146 6.789 -16.825 11.499 1.00 61.32 H new ATOM 0 HE21 GLN A 146 9.081 -16.742 8.834 1.00 53.12 H new ATOM 0 HE22 GLN A 146 8.934 -18.467 8.482 1.00 53.12 H new ATOM 2146 N LEU A 147 4.005 -12.760 10.144 1.00 54.32 N ATOM 2147 CA LEU A 147 3.207 -11.806 9.377 1.00 52.21 C ATOM 2148 C LEU A 147 3.805 -10.408 9.478 1.00 52.14 C ATOM 2149 O LEU A 147 4.196 -9.971 10.563 1.00 34.44 O ATOM 2150 CB LEU A 147 1.750 -11.781 9.856 1.00 42.42 C ATOM 2151 CG LEU A 147 0.824 -12.815 9.210 1.00 43.43 C ATOM 2152 CD1 LEU A 147 0.902 -12.724 7.695 1.00 3.40 C ATOM 2153 CD2 LEU A 147 1.156 -14.220 9.689 1.00 35.02 C ATOM 0 H LEU A 147 3.772 -12.806 11.136 1.00 54.32 H new ATOM 0 HA LEU A 147 3.220 -12.130 8.336 1.00 52.21 H new ATOM 0 HB2 LEU A 147 1.738 -11.933 10.935 1.00 42.42 H new ATOM 0 HB3 LEU A 147 1.342 -10.788 9.670 1.00 42.42 H new ATOM 0 HG LEU A 147 -0.199 -12.595 9.514 1.00 43.43 H new ATOM 0 HD11 LEU A 147 0.238 -13.466 7.251 1.00 3.40 H new ATOM 0 HD12 LEU A 147 0.599 -11.727 7.374 1.00 3.40 H new ATOM 0 HD13 LEU A 147 1.925 -12.914 7.371 1.00 3.40 H new ATOM 0 HD21 LEU A 147 0.483 -14.935 9.215 1.00 35.02 H new ATOM 0 HD22 LEU A 147 2.186 -14.461 9.425 1.00 35.02 H new ATOM 0 HD23 LEU A 147 1.037 -14.273 10.771 1.00 35.02 H new ATOM 2165 N ARG A 148 3.879 -9.709 8.351 1.00 35.44 N ATOM 2166 CA ARG A 148 4.451 -8.371 8.327 1.00 45.00 C ATOM 2167 C ARG A 148 3.465 -7.371 7.740 1.00 41.13 C ATOM 2168 O ARG A 148 2.922 -7.584 6.660 1.00 24.43 O ATOM 2169 CB ARG A 148 5.742 -8.317 7.499 1.00 34.24 C ATOM 2170 CG ARG A 148 6.801 -9.336 7.886 1.00 54.31 C ATOM 2171 CD ARG A 148 6.657 -10.630 7.099 1.00 51.00 C ATOM 2172 NE ARG A 148 7.727 -11.568 7.417 1.00 14.22 N ATOM 2173 CZ ARG A 148 7.957 -12.704 6.763 1.00 63.20 C ATOM 2174 NH1 ARG A 148 7.210 -13.050 5.717 1.00 42.24 N ATOM 2175 NH2 ARG A 148 8.946 -13.496 7.160 1.00 72.31 N ATOM 0 H ARG A 148 3.551 -10.046 7.446 1.00 35.44 H new ATOM 0 HA ARG A 148 4.678 -8.112 9.361 1.00 45.00 H new ATOM 0 HB2 ARG A 148 5.488 -8.462 6.449 1.00 34.24 H new ATOM 0 HB3 ARG A 148 6.171 -7.319 7.589 1.00 34.24 H new ATOM 0 HG2 ARG A 148 7.791 -8.914 7.713 1.00 54.31 H new ATOM 0 HG3 ARG A 148 6.727 -9.549 8.952 1.00 54.31 H new ATOM 0 HD2 ARG A 148 5.693 -11.087 7.321 1.00 51.00 H new ATOM 0 HD3 ARG A 148 6.668 -10.411 6.031 1.00 51.00 H new ATOM 0 HE ARG A 148 8.343 -11.337 8.196 1.00 14.22 H new ATOM 0 HH11 ARG A 148 6.451 -12.442 5.409 1.00 42.24 H new ATOM 0 HH12 ARG A 148 7.396 -13.923 5.224 1.00 42.24 H new ATOM 0 HH21 ARG A 148 9.521 -13.232 7.960 1.00 72.31 H new ATOM 0 HH22 ARG A 148 9.130 -14.369 6.665 1.00 72.31 H new ATOM 2189 N THR A 149 3.231 -6.291 8.460 1.00 1.40 N ATOM 2190 CA THR A 149 2.467 -5.177 7.931 1.00 3.22 C ATOM 2191 C THR A 149 3.384 -3.965 7.780 1.00 11.13 C ATOM 2192 O THR A 149 3.728 -3.310 8.764 1.00 40.34 O ATOM 2193 CB THR A 149 1.281 -4.827 8.850 1.00 14.03 C ATOM 2194 OG1 THR A 149 0.574 -6.022 9.207 1.00 32.32 O ATOM 2195 CG2 THR A 149 0.332 -3.856 8.162 1.00 52.43 C ATOM 0 H THR A 149 3.560 -6.161 9.417 1.00 1.40 H new ATOM 0 HA THR A 149 2.064 -5.462 6.959 1.00 3.22 H new ATOM 0 HB THR A 149 1.671 -4.351 9.750 1.00 14.03 H new ATOM 0 HG1 THR A 149 -0.178 -5.795 9.793 1.00 32.32 H new ATOM 0 HG21 THR A 149 -0.498 -3.623 8.830 1.00 52.43 H new ATOM 0 HG22 THR A 149 0.866 -2.939 7.914 1.00 52.43 H new ATOM 0 HG23 THR A 149 -0.053 -4.309 7.249 1.00 52.43 H new ATOM 2203 N ARG A 150 3.816 -3.691 6.557 1.00 73.30 N ATOM 2204 CA ARG A 150 4.751 -2.599 6.321 1.00 30.05 C ATOM 2205 C ARG A 150 4.007 -1.279 6.210 1.00 52.34 C ATOM 2206 O ARG A 150 3.501 -0.927 5.147 1.00 21.23 O ATOM 2207 CB ARG A 150 5.577 -2.844 5.056 1.00 41.50 C ATOM 2208 CG ARG A 150 6.510 -4.039 5.150 1.00 43.33 C ATOM 2209 CD ARG A 150 7.323 -4.200 3.878 1.00 50.31 C ATOM 2210 NE ARG A 150 8.168 -5.391 3.910 1.00 44.03 N ATOM 2211 CZ ARG A 150 8.810 -5.876 2.850 1.00 35.31 C ATOM 2212 NH1 ARG A 150 8.734 -5.261 1.676 1.00 24.42 N ATOM 2213 NH2 ARG A 150 9.527 -6.981 2.968 1.00 1.34 N ATOM 0 H ARG A 150 3.538 -4.204 5.720 1.00 73.30 H new ATOM 0 HA ARG A 150 5.433 -2.552 7.170 1.00 30.05 H new ATOM 0 HB2 ARG A 150 4.900 -2.990 4.215 1.00 41.50 H new ATOM 0 HB3 ARG A 150 6.166 -1.952 4.840 1.00 41.50 H new ATOM 0 HG2 ARG A 150 7.180 -3.915 6.000 1.00 43.33 H new ATOM 0 HG3 ARG A 150 5.930 -4.944 5.331 1.00 43.33 H new ATOM 0 HD2 ARG A 150 6.649 -4.258 3.023 1.00 50.31 H new ATOM 0 HD3 ARG A 150 7.947 -3.318 3.733 1.00 50.31 H new ATOM 0 HE ARG A 150 8.272 -5.881 4.799 1.00 44.03 H new ATOM 0 HH11 ARG A 150 8.180 -4.410 1.581 1.00 24.42 H new ATOM 0 HH12 ARG A 150 9.229 -5.640 0.869 1.00 24.42 H new ATOM 0 HH21 ARG A 150 9.586 -7.457 3.868 1.00 1.34 H new ATOM 0 HH22 ARG A 150 10.021 -7.357 2.159 1.00 1.34 H new ATOM 2227 N VAL A 151 3.921 -0.566 7.314 1.00 1.10 N ATOM 2228 CA VAL A 151 3.252 0.720 7.328 1.00 15.52 C ATOM 2229 C VAL A 151 4.254 1.840 7.046 1.00 41.54 C ATOM 2230 O VAL A 151 5.193 2.061 7.812 1.00 14.11 O ATOM 2231 CB VAL A 151 2.514 0.965 8.671 1.00 10.24 C ATOM 2232 CG1 VAL A 151 3.441 0.747 9.859 1.00 4.45 C ATOM 2233 CG2 VAL A 151 1.903 2.361 8.706 1.00 33.32 C ATOM 0 H VAL A 151 4.306 -0.854 8.214 1.00 1.10 H new ATOM 0 HA VAL A 151 2.499 0.716 6.540 1.00 15.52 H new ATOM 0 HB VAL A 151 1.705 0.238 8.745 1.00 10.24 H new ATOM 0 HG11 VAL A 151 2.894 0.926 10.785 1.00 4.45 H new ATOM 0 HG12 VAL A 151 3.811 -0.278 9.849 1.00 4.45 H new ATOM 0 HG13 VAL A 151 4.283 1.437 9.795 1.00 4.45 H new ATOM 0 HG21 VAL A 151 1.391 2.510 9.657 1.00 33.32 H new ATOM 0 HG22 VAL A 151 2.691 3.106 8.598 1.00 33.32 H new ATOM 0 HG23 VAL A 151 1.189 2.466 7.889 1.00 33.32 H new ATOM 2243 N SER A 152 4.076 2.512 5.920 1.00 40.02 N ATOM 2244 CA SER A 152 4.935 3.622 5.551 1.00 22.31 C ATOM 2245 C SER A 152 4.143 4.918 5.640 1.00 31.51 C ATOM 2246 O SER A 152 3.015 4.992 5.151 1.00 34.43 O ATOM 2247 CB SER A 152 5.492 3.429 4.138 1.00 24.54 C ATOM 2248 OG SER A 152 6.484 4.401 3.844 1.00 73.10 O ATOM 0 H SER A 152 3.341 2.306 5.244 1.00 40.02 H new ATOM 0 HA SER A 152 5.779 3.666 6.239 1.00 22.31 H new ATOM 0 HB2 SER A 152 5.918 2.430 4.045 1.00 24.54 H new ATOM 0 HB3 SER A 152 4.682 3.499 3.412 1.00 24.54 H new ATOM 0 HG SER A 152 6.943 4.660 4.670 1.00 73.10 H new ATOM 2254 N LEU A 153 4.724 5.935 6.259 1.00 43.12 N ATOM 2255 CA LEU A 153 3.963 7.150 6.555 1.00 54.30 C ATOM 2256 C LEU A 153 4.644 8.425 6.080 1.00 20.21 C ATOM 2257 O LEU A 153 5.772 8.403 5.579 1.00 23.44 O ATOM 2258 CB LEU A 153 3.673 7.252 8.058 1.00 63.12 C ATOM 2259 CG LEU A 153 4.823 6.885 9.013 1.00 63.54 C ATOM 2260 CD1 LEU A 153 6.030 7.792 8.826 1.00 72.33 C ATOM 2261 CD2 LEU A 153 4.340 6.964 10.448 1.00 21.14 C ATOM 0 H LEU A 153 5.698 5.950 6.562 1.00 43.12 H new ATOM 0 HA LEU A 153 3.031 7.061 5.998 1.00 54.30 H new ATOM 0 HB2 LEU A 153 3.364 8.274 8.276 1.00 63.12 H new ATOM 0 HB3 LEU A 153 2.824 6.607 8.285 1.00 63.12 H new ATOM 0 HG LEU A 153 5.136 5.867 8.780 1.00 63.54 H new ATOM 0 HD11 LEU A 153 6.817 7.497 9.520 1.00 72.33 H new ATOM 0 HD12 LEU A 153 6.396 7.704 7.803 1.00 72.33 H new ATOM 0 HD13 LEU A 153 5.742 8.825 9.021 1.00 72.33 H new ATOM 0 HD21 LEU A 153 5.156 6.704 11.122 1.00 21.14 H new ATOM 0 HD22 LEU A 153 4.002 7.978 10.663 1.00 21.14 H new ATOM 0 HD23 LEU A 153 3.514 6.268 10.593 1.00 21.14 H new ATOM 2273 N MET A 154 3.938 9.541 6.256 1.00 24.53 N ATOM 2274 CA MET A 154 4.492 10.856 6.004 1.00 12.03 C ATOM 2275 C MET A 154 5.429 11.233 7.138 1.00 44.31 C ATOM 2276 O MET A 154 5.010 11.824 8.134 1.00 63.45 O ATOM 2277 CB MET A 154 3.388 11.911 5.890 1.00 51.32 C ATOM 2278 CG MET A 154 3.904 13.262 5.429 1.00 33.32 C ATOM 2279 SD MET A 154 2.644 14.550 5.427 1.00 75.51 S ATOM 2280 CE MET A 154 2.238 14.621 7.169 1.00 45.53 C ATOM 0 H MET A 154 2.970 9.552 6.576 1.00 24.53 H new ATOM 0 HA MET A 154 5.035 10.823 5.059 1.00 12.03 H new ATOM 0 HB2 MET A 154 2.629 11.560 5.191 1.00 51.32 H new ATOM 0 HB3 MET A 154 2.901 12.025 6.858 1.00 51.32 H new ATOM 0 HG2 MET A 154 4.725 13.569 6.077 1.00 33.32 H new ATOM 0 HG3 MET A 154 4.312 13.162 4.423 1.00 33.32 H new ATOM 0 HE1 MET A 154 1.534 15.434 7.346 1.00 45.53 H new ATOM 0 HE2 MET A 154 1.787 13.678 7.476 1.00 45.53 H new ATOM 0 HE3 MET A 154 3.146 14.794 7.747 1.00 45.53 H new ATOM 2290 N LEU A 155 6.696 10.880 6.995 1.00 34.32 N ATOM 2291 CA LEU A 155 7.682 11.147 8.033 1.00 3.03 C ATOM 2292 C LEU A 155 8.152 12.591 7.985 1.00 2.22 C ATOM 2293 O LEU A 155 9.334 12.892 8.056 1.00 54.53 O ATOM 2294 CB LEU A 155 8.860 10.189 7.935 1.00 1.04 C ATOM 2295 CG LEU A 155 9.726 10.271 6.670 1.00 24.41 C ATOM 2296 CD1 LEU A 155 11.074 9.615 6.918 1.00 20.01 C ATOM 2297 CD2 LEU A 155 9.039 9.597 5.499 1.00 24.43 C ATOM 0 H LEU A 155 7.067 10.408 6.171 1.00 34.32 H new ATOM 0 HA LEU A 155 7.198 10.983 8.996 1.00 3.03 H new ATOM 0 HB2 LEU A 155 9.505 10.357 8.798 1.00 1.04 H new ATOM 0 HB3 LEU A 155 8.476 9.172 8.017 1.00 1.04 H new ATOM 0 HG LEU A 155 9.873 11.323 6.427 1.00 24.41 H new ATOM 0 HD11 LEU A 155 11.681 9.678 6.015 1.00 20.01 H new ATOM 0 HD12 LEU A 155 11.583 10.127 7.734 1.00 20.01 H new ATOM 0 HD13 LEU A 155 10.926 8.568 7.183 1.00 20.01 H new ATOM 0 HD21 LEU A 155 9.673 9.669 4.615 1.00 24.43 H new ATOM 0 HD22 LEU A 155 8.863 8.548 5.735 1.00 24.43 H new ATOM 0 HD23 LEU A 155 8.086 10.089 5.303 1.00 24.43 H new ATOM 2309 N HIS A 156 7.192 13.466 7.861 1.00 60.15 N ATOM 2310 CA HIS A 156 7.435 14.898 7.882 1.00 24.10 C ATOM 2311 C HIS A 156 7.806 15.302 9.306 1.00 74.11 C ATOM 2312 O HIS A 156 8.924 15.741 9.574 1.00 32.11 O ATOM 2313 CB HIS A 156 6.175 15.635 7.419 1.00 30.10 C ATOM 2314 CG HIS A 156 6.432 16.976 6.804 1.00 13.41 C ATOM 2315 ND1 HIS A 156 6.228 18.159 7.467 1.00 61.31 N ATOM 2316 CD2 HIS A 156 6.830 17.313 5.556 1.00 64.31 C ATOM 2317 CE1 HIS A 156 6.489 19.166 6.660 1.00 22.21 C ATOM 2318 NE2 HIS A 156 6.856 18.683 5.492 1.00 42.03 N ATOM 0 H HIS A 156 6.211 13.213 7.742 1.00 60.15 H new ATOM 0 HA HIS A 156 8.251 15.160 7.209 1.00 24.10 H new ATOM 0 HB2 HIS A 156 5.650 15.012 6.695 1.00 30.10 H new ATOM 0 HB3 HIS A 156 5.509 15.762 8.273 1.00 30.10 H new ATOM 0 HD1 HIS A 156 5.921 18.245 8.436 1.00 61.31 H new ATOM 0 HD2 HIS A 156 7.081 16.630 4.758 1.00 64.31 H new ATOM 0 HE1 HIS A 156 6.414 20.213 6.914 1.00 22.21 H new ATOM 2327 N GLU A 157 6.844 15.140 10.209 1.00 53.34 N ATOM 2328 CA GLU A 157 7.086 15.237 11.644 1.00 35.43 C ATOM 2329 C GLU A 157 6.291 14.154 12.362 1.00 11.13 C ATOM 2330 O GLU A 157 6.786 13.511 13.288 1.00 23.54 O ATOM 2331 CB GLU A 157 6.687 16.602 12.223 1.00 51.51 C ATOM 2332 CG GLU A 157 7.500 17.781 11.713 1.00 51.23 C ATOM 2333 CD GLU A 157 6.921 18.392 10.456 1.00 75.14 C ATOM 2334 OE1 GLU A 157 5.809 17.992 10.048 1.00 62.14 O ATOM 2335 OE2 GLU A 157 7.568 19.288 9.878 1.00 41.21 O ATOM 0 H GLU A 157 5.874 14.938 9.966 1.00 53.34 H new ATOM 0 HA GLU A 157 8.158 15.111 11.797 1.00 35.43 H new ATOM 0 HB2 GLU A 157 5.636 16.781 11.998 1.00 51.51 H new ATOM 0 HB3 GLU A 157 6.778 16.560 13.308 1.00 51.51 H new ATOM 0 HG2 GLU A 157 7.554 18.543 12.491 1.00 51.23 H new ATOM 0 HG3 GLU A 157 8.521 17.454 11.516 1.00 51.23 H new ATOM 2342 N SER A 158 5.051 13.958 11.923 1.00 34.13 N ATOM 2343 CA SER A 158 4.158 13.008 12.568 1.00 72.13 C ATOM 2344 C SER A 158 2.962 12.664 11.676 1.00 31.44 C ATOM 2345 O SER A 158 2.893 11.584 11.089 1.00 22.22 O ATOM 2346 CB SER A 158 3.666 13.602 13.892 1.00 72.53 C ATOM 2347 OG SER A 158 3.138 14.908 13.692 1.00 71.12 O ATOM 0 H SER A 158 4.645 14.445 11.124 1.00 34.13 H new ATOM 0 HA SER A 158 4.710 12.086 12.751 1.00 72.13 H new ATOM 0 HB2 SER A 158 2.901 12.957 14.323 1.00 72.53 H new ATOM 0 HB3 SER A 158 4.488 13.642 14.606 1.00 72.53 H new ATOM 0 HG SER A 158 2.827 15.270 14.548 1.00 71.12 H new ATOM 2353 N LEU A 159 2.050 13.618 11.560 1.00 53.32 N ATOM 2354 CA LEU A 159 0.758 13.411 10.918 1.00 12.21 C ATOM 2355 C LEU A 159 0.115 14.771 10.664 1.00 35.54 C ATOM 2356 O LEU A 159 -0.543 14.985 9.643 1.00 25.53 O ATOM 2357 CB LEU A 159 -0.134 12.537 11.829 1.00 34.44 C ATOM 2358 CG LEU A 159 -1.496 12.088 11.263 1.00 55.02 C ATOM 2359 CD1 LEU A 159 -2.530 13.205 11.342 1.00 34.54 C ATOM 2360 CD2 LEU A 159 -1.352 11.599 9.831 1.00 32.31 C ATOM 0 H LEU A 159 2.186 14.566 11.911 1.00 53.32 H new ATOM 0 HA LEU A 159 0.882 12.895 9.966 1.00 12.21 H new ATOM 0 HB2 LEU A 159 0.431 11.644 12.098 1.00 34.44 H new ATOM 0 HB3 LEU A 159 -0.317 13.088 12.751 1.00 34.44 H new ATOM 0 HG LEU A 159 -1.849 11.261 11.879 1.00 55.02 H new ATOM 0 HD11 LEU A 159 -3.478 12.853 10.934 1.00 34.54 H new ATOM 0 HD12 LEU A 159 -2.669 13.499 12.382 1.00 34.54 H new ATOM 0 HD13 LEU A 159 -2.184 14.063 10.766 1.00 34.54 H new ATOM 0 HD21 LEU A 159 -2.326 11.288 9.453 1.00 32.31 H new ATOM 0 HD22 LEU A 159 -0.962 12.405 9.209 1.00 32.31 H new ATOM 0 HD23 LEU A 159 -0.665 10.754 9.803 1.00 32.31 H new ATOM 2372 N GLU A 160 0.311 15.688 11.607 1.00 53.22 N ATOM 2373 CA GLU A 160 -0.217 17.040 11.483 1.00 45.33 C ATOM 2374 C GLU A 160 0.398 17.757 10.292 1.00 60.10 C ATOM 2375 O GLU A 160 1.614 17.722 10.098 1.00 42.24 O ATOM 2376 CB GLU A 160 0.058 17.852 12.746 1.00 22.11 C ATOM 2377 CG GLU A 160 -0.591 17.291 13.994 1.00 52.10 C ATOM 2378 CD GLU A 160 -0.423 18.206 15.187 1.00 73.22 C ATOM 2379 OE1 GLU A 160 0.651 18.177 15.820 1.00 30.30 O ATOM 2380 OE2 GLU A 160 -1.364 18.969 15.491 1.00 74.01 O ATOM 0 H GLU A 160 0.833 15.517 12.467 1.00 53.22 H new ATOM 0 HA GLU A 160 -1.294 16.954 11.336 1.00 45.33 H new ATOM 0 HB2 GLU A 160 1.135 17.907 12.903 1.00 22.11 H new ATOM 0 HB3 GLU A 160 -0.294 18.872 12.593 1.00 22.11 H new ATOM 0 HG2 GLU A 160 -1.653 17.131 13.808 1.00 52.10 H new ATOM 0 HG3 GLU A 160 -0.156 16.317 14.221 1.00 52.10 H new ATOM 2387 N HIS A 161 -0.441 18.403 9.502 1.00 30.54 N ATOM 2388 CA HIS A 161 0.035 19.216 8.393 1.00 32.33 C ATOM 2389 C HIS A 161 0.675 20.502 8.920 1.00 43.52 C ATOM 2390 O HIS A 161 -0.008 21.481 9.219 1.00 63.23 O ATOM 2391 CB HIS A 161 -1.102 19.512 7.397 1.00 2.04 C ATOM 2392 CG HIS A 161 -2.369 20.034 8.017 1.00 34.43 C ATOM 2393 ND1 HIS A 161 -3.333 19.215 8.570 1.00 4.42 N ATOM 2394 CD2 HIS A 161 -2.828 21.300 8.168 1.00 1.23 C ATOM 2395 CE1 HIS A 161 -4.326 19.955 9.026 1.00 42.14 C ATOM 2396 NE2 HIS A 161 -4.045 21.224 8.799 1.00 1.52 N ATOM 0 H HIS A 161 -1.455 18.382 9.606 1.00 30.54 H new ATOM 0 HA HIS A 161 0.798 18.657 7.851 1.00 32.33 H new ATOM 0 HB2 HIS A 161 -0.746 20.239 6.667 1.00 2.04 H new ATOM 0 HB3 HIS A 161 -1.333 18.598 6.850 1.00 2.04 H new ATOM 0 HD2 HIS A 161 -2.328 22.203 7.850 1.00 1.23 H new ATOM 0 HE1 HIS A 161 -5.220 19.584 9.505 1.00 42.14 H new ATOM 0 HE2 HIS A 161 -4.634 22.017 9.051 1.00 1.52 H new ATOM 2405 N HIS A 162 1.994 20.468 9.067 1.00 61.13 N ATOM 2406 CA HIS A 162 2.745 21.585 9.621 1.00 72.23 C ATOM 2407 C HIS A 162 4.221 21.392 9.302 1.00 41.02 C ATOM 2408 O HIS A 162 4.566 20.478 8.557 1.00 2.54 O ATOM 2409 CB HIS A 162 2.513 21.690 11.142 1.00 34.34 C ATOM 2410 CG HIS A 162 3.218 20.653 11.976 1.00 21.55 C ATOM 2411 ND1 HIS A 162 3.069 19.294 11.800 1.00 20.32 N ATOM 2412 CD2 HIS A 162 4.075 20.799 13.012 1.00 21.01 C ATOM 2413 CE1 HIS A 162 3.799 18.653 12.693 1.00 73.01 C ATOM 2414 NE2 HIS A 162 4.421 19.542 13.445 1.00 31.32 N ATOM 0 H HIS A 162 2.570 19.668 8.806 1.00 61.13 H new ATOM 0 HA HIS A 162 2.403 22.518 9.174 1.00 72.23 H new ATOM 0 HB2 HIS A 162 2.833 22.678 11.474 1.00 34.34 H new ATOM 0 HB3 HIS A 162 1.442 21.620 11.335 1.00 34.34 H new ATOM 0 HD1 HIS A 162 2.485 18.852 11.090 1.00 20.32 H new ATOM 0 HD2 HIS A 162 4.424 21.734 13.424 1.00 21.01 H new ATOM 0 HE1 HIS A 162 3.875 17.580 12.792 1.00 73.01 H new ATOM 2423 N HIS A 163 5.085 22.237 9.844 1.00 12.54 N ATOM 2424 CA HIS A 163 6.512 22.099 9.595 1.00 40.52 C ATOM 2425 C HIS A 163 7.307 22.467 10.843 1.00 63.22 C ATOM 2426 O HIS A 163 7.426 23.639 11.193 1.00 72.34 O ATOM 2427 CB HIS A 163 6.935 22.973 8.413 1.00 71.15 C ATOM 2428 CG HIS A 163 8.231 22.551 7.792 1.00 31.44 C ATOM 2429 ND1 HIS A 163 9.052 23.409 7.101 1.00 31.44 N ATOM 2430 CD2 HIS A 163 8.823 21.336 7.730 1.00 13.35 C ATOM 2431 CE1 HIS A 163 10.091 22.743 6.636 1.00 20.13 C ATOM 2432 NE2 HIS A 163 9.979 21.478 7.006 1.00 11.02 N ATOM 0 H HIS A 163 4.828 23.015 10.451 1.00 12.54 H new ATOM 0 HA HIS A 163 6.722 21.059 9.346 1.00 40.52 H new ATOM 0 HB2 HIS A 163 6.153 22.948 7.655 1.00 71.15 H new ATOM 0 HB3 HIS A 163 7.021 24.007 8.748 1.00 71.15 H new ATOM 0 HD2 HIS A 163 8.453 20.422 8.170 1.00 13.35 H new ATOM 0 HE1 HIS A 163 10.898 23.160 6.051 1.00 20.13 H new ATOM 0 HE2 HIS A 163 10.641 20.733 6.789 1.00 11.02 H new ATOM 2441 N HIS A 164 7.850 21.459 11.509 1.00 34.34 N ATOM 2442 CA HIS A 164 8.585 21.668 12.752 1.00 23.24 C ATOM 2443 C HIS A 164 10.002 21.121 12.612 1.00 3.32 C ATOM 2444 O HIS A 164 10.501 20.404 13.479 1.00 63.50 O ATOM 2445 CB HIS A 164 7.861 20.994 13.922 1.00 71.34 C ATOM 2446 CG HIS A 164 8.209 21.574 15.260 1.00 13.45 C ATOM 2447 ND1 HIS A 164 7.400 22.473 15.915 1.00 43.11 N ATOM 2448 CD2 HIS A 164 9.282 21.384 16.064 1.00 11.43 C ATOM 2449 CE1 HIS A 164 7.956 22.815 17.059 1.00 75.21 C ATOM 2450 NE2 HIS A 164 9.098 22.167 17.174 1.00 2.22 N ATOM 0 H HIS A 164 7.796 20.485 11.210 1.00 34.34 H new ATOM 0 HA HIS A 164 8.639 22.737 12.956 1.00 23.24 H new ATOM 0 HB2 HIS A 164 6.785 21.077 13.768 1.00 71.34 H new ATOM 0 HB3 HIS A 164 8.102 19.931 13.923 1.00 71.34 H new ATOM 0 HD2 HIS A 164 10.124 20.737 15.868 1.00 11.43 H new ATOM 0 HE1 HIS A 164 7.546 23.508 17.779 1.00 75.21 H new ATOM 0 HE2 HIS A 164 9.741 22.237 17.962 1.00 2.22 H new ATOM 2459 N HIS A 165 10.629 21.464 11.502 1.00 5.24 N ATOM 2460 CA HIS A 165 11.988 21.039 11.205 1.00 41.03 C ATOM 2461 C HIS A 165 12.471 21.817 9.991 1.00 55.44 C ATOM 2462 O HIS A 165 11.653 22.277 9.197 1.00 34.22 O ATOM 2463 CB HIS A 165 12.023 19.529 10.928 1.00 21.02 C ATOM 2464 CG HIS A 165 13.401 18.955 10.820 1.00 43.51 C ATOM 2465 ND1 HIS A 165 14.029 18.730 9.615 1.00 34.32 N ATOM 2466 CD2 HIS A 165 14.268 18.550 11.777 1.00 24.33 C ATOM 2467 CE1 HIS A 165 15.223 18.214 9.835 1.00 44.11 C ATOM 2468 NE2 HIS A 165 15.394 18.093 11.137 1.00 34.51 N ATOM 0 H HIS A 165 10.210 22.047 10.777 1.00 5.24 H new ATOM 0 HA HIS A 165 12.640 21.236 12.056 1.00 41.03 H new ATOM 0 HB2 HIS A 165 11.488 19.013 11.725 1.00 21.02 H new ATOM 0 HB3 HIS A 165 11.485 19.329 10.002 1.00 21.02 H new ATOM 0 HD2 HIS A 165 14.105 18.580 12.844 1.00 24.33 H new ATOM 0 HE1 HIS A 165 15.940 17.937 9.076 1.00 44.11 H new ATOM 0 HE2 HIS A 165 16.226 17.721 11.594 1.00 34.51 H new ATOM 2477 N HIS A 166 13.771 21.996 9.851 1.00 33.41 N ATOM 2478 CA HIS A 166 14.301 22.712 8.705 1.00 35.33 C ATOM 2479 C HIS A 166 15.628 22.104 8.272 1.00 70.51 C ATOM 2480 O HIS A 166 16.665 22.448 8.873 1.00 37.99 O ATOM 2481 CB HIS A 166 14.471 24.195 9.039 1.00 32.35 C ATOM 2482 CG HIS A 166 14.376 25.092 7.845 1.00 72.34 C ATOM 2483 ND1 HIS A 166 15.409 25.889 7.413 1.00 22.32 N ATOM 2484 CD2 HIS A 166 13.343 25.330 7.002 1.00 50.23 C ATOM 2485 CE1 HIS A 166 15.017 26.584 6.362 1.00 72.21 C ATOM 2486 NE2 HIS A 166 13.764 26.264 6.090 1.00 44.35 N ATOM 2487 OXT HIS A 166 15.623 21.269 7.348 1.00 37.99 O ATOM 0 H HIS A 166 14.474 21.659 10.509 1.00 33.41 H new ATOM 0 HA HIS A 166 13.596 22.624 7.879 1.00 35.33 H new ATOM 0 HB2 HIS A 166 13.710 24.486 9.763 1.00 32.35 H new ATOM 0 HB3 HIS A 166 15.439 24.342 9.518 1.00 32.35 H new ATOM 0 HD2 HIS A 166 12.367 24.869 7.041 1.00 50.23 H new ATOM 0 HE1 HIS A 166 15.619 27.295 5.816 1.00 72.21 H new ATOM 0 HE2 HIS A 166 13.204 26.648 5.329 1.00 44.35 H new TER 2496 HIS A 166