USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 924 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 93 GLN :FLIP amide:sc= 0.232 F(o=-0.19!,f=0.41) USER MOD Set 1.2: A 112 SER OG : rot 180:sc= 0.178 USER MOD Set 2.1: A 69 ASN : amide:sc= -0.106 X(o=-6.1,f=-6.3) USER MOD Set 2.2: A 95 GLN : amide:sc= -0.445! K(o=-6.1!,f=-6.9) USER MOD Set 2.3: A 97 ASN : amide:sc= -5.54! C(o=-6.1!,f=-7.7!) USER MOD Set 3.1: A 83 TYR OH : rot 180:sc= 0 USER MOD Set 3.2: A 102 LYS NZ :NH3+ -175:sc= 1.23 (180deg=1.05) USER MOD Set 4.1: A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 80 THR OG1 : rot 180:sc= -0.0908 USER MOD Set 5.1: A 35 LYS NZ :NH3+ -168:sc= 0.893 (180deg=-0.184) USER MOD Set 5.2: A 47 THR OG1 : rot 69:sc= 1.92 USER MOD Set 6.1: A 32 ASN : amide:sc= -0.176 K(o=0.93,f=-5.2!) USER MOD Set 6.2: A 33 SER OG : rot 123:sc= 1.1 USER MOD Set 7.1: A 29 GLN : amide:sc= -0.451 K(o=-0.96,f=-5.2) USER MOD Set 7.2: A 31 GLN :FLIP amide:sc= -0.509 F(o=-2.6!,f=-0.96) USER MOD Set 8.1: A 4 THR OG1 : rot 44:sc= 0.0395 USER MOD Set 8.2: A 5 MET CE :methyl 133:sc= -0.32 (180deg=-1.28) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -171:sc= 0 (180deg=-0.0647) USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 11 ASN : amide:sc= 0.0593 X(o=0.059,f=0) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 ASN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 19 ASN : amide:sc= -0.0248 K(o=-0.025,f=-1.8) USER MOD Single : A 20 ASN : amide:sc= -0.2 K(o=-0.2,f=-1.1!) USER MOD Single : A 26 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= -0.448 X(o=-0.45,f=0) USER MOD Single : A 55 THR OG1 : rot 75:sc= 0.31 USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=-0.33) USER MOD Single : A 59 GLN : amide:sc= -0.0685 K(o=-0.069,f=-0.85) USER MOD Single : A 60 SER OG : rot 69:sc= 1.2 USER MOD Single : A 61 GLN : amide:sc= 0.0312 X(o=0.031,f=0) USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 ASN : amide:sc=-0.00515 K(o=-0.0051,f=-0.88) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0.0112 USER MOD Single : A 74 LYS NZ :NH3+ -142:sc= -0.497 (180deg=-2.81!) USER MOD Single : A 81 ASN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 89 ASN : amide:sc= -0.295 X(o=-0.3,f=-0.013) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 THR OG1 : rot 180:sc= 0 USER MOD Single : A 105 GLN : amide:sc= -0.448 K(o=-0.45,f=-1.3) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.535 USER MOD Single : A 110 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : A 115 GLN : amide:sc= -0.183 X(o=-0.18,f=-0.31) USER MOD Single : A 116 ASN : amide:sc= -0.944 K(o=-0.94,f=-1.9) USER MOD Single : A 117 ASN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 119 THR OG1 : rot 92:sc= 0.0535 USER MOD Single : A 122 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 123 HIS : no HD1:sc= 0 X(o=0,f=-0.0035) USER MOD Single : A 124 HIS : no HD1:sc= 0.676 K(o=0.68,f=-5.2!) USER MOD Single : A 125 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 126 HIS : no HE2:sc= 0.0066 X(o=0.0066,f=-0.11) USER MOD Single : A 127 HIS : no HE2:sc= -0.0386 K(o=-0.039,f=-1.7) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 30.422 106.933 -10.773 1.00 0.00 N ATOM 2 CA MET A 1 29.689 106.696 -9.509 1.00 52.33 C ATOM 3 C MET A 1 29.233 105.246 -9.423 1.00 71.33 C ATOM 4 O MET A 1 29.638 104.510 -8.524 1.00 1.24 O ATOM 5 CB MET A 1 28.477 107.623 -9.395 1.00 2.44 C ATOM 6 CG MET A 1 28.832 109.094 -9.266 1.00 75.50 C ATOM 7 SD MET A 1 27.369 110.146 -9.156 1.00 21.34 S ATOM 8 CE MET A 1 28.126 111.767 -9.123 1.00 13.04 C ATOM 0 H1 MET A 1 30.856 107.878 -10.750 1.00 0.00 H new ATOM 0 H2 MET A 1 31.164 106.213 -10.884 1.00 0.00 H new ATOM 0 H3 MET A 1 29.761 106.875 -11.574 1.00 0.00 H new ATOM 0 HA MET A 1 30.369 106.909 -8.684 1.00 52.33 H new ATOM 0 HB2 MET A 1 27.846 107.488 -10.273 1.00 2.44 H new ATOM 0 HB3 MET A 1 27.886 107.326 -8.529 1.00 2.44 H new ATOM 0 HG2 MET A 1 29.449 109.240 -8.379 1.00 75.50 H new ATOM 0 HG3 MET A 1 29.431 109.397 -10.125 1.00 75.50 H new ATOM 0 HE1 MET A 1 27.350 112.530 -9.056 1.00 13.04 H new ATOM 0 HE2 MET A 1 28.785 111.843 -8.258 1.00 13.04 H new ATOM 0 HE3 MET A 1 28.705 111.917 -10.035 1.00 13.04 H new ATOM 20 N ALA A 2 28.395 104.838 -10.370 1.00 12.30 N ATOM 21 CA ALA A 2 27.848 103.488 -10.384 1.00 21.34 C ATOM 22 C ALA A 2 28.908 102.472 -10.791 1.00 14.20 C ATOM 23 O ALA A 2 29.946 102.829 -11.351 1.00 72.13 O ATOM 24 CB ALA A 2 26.655 103.417 -11.326 1.00 74.23 C ATOM 0 H ALA A 2 28.079 105.427 -11.141 1.00 12.30 H new ATOM 0 HA ALA A 2 27.517 103.242 -9.375 1.00 21.34 H new ATOM 0 HB1 ALA A 2 26.254 102.404 -11.329 1.00 74.23 H new ATOM 0 HB2 ALA A 2 25.885 104.111 -10.991 1.00 74.23 H new ATOM 0 HB3 ALA A 2 26.971 103.685 -12.334 1.00 74.23 H new ATOM 30 N GLY A 3 28.647 101.209 -10.498 1.00 50.23 N ATOM 31 CA GLY A 3 29.586 100.162 -10.830 1.00 65.14 C ATOM 32 C GLY A 3 29.302 99.550 -12.183 1.00 23.21 C ATOM 33 O GLY A 3 28.792 98.434 -12.271 1.00 32.24 O ATOM 0 H GLY A 3 27.797 100.890 -10.034 1.00 50.23 H new ATOM 0 HA2 GLY A 3 30.598 100.567 -10.821 1.00 65.14 H new ATOM 0 HA3 GLY A 3 29.547 99.385 -10.066 1.00 65.14 H new ATOM 37 N THR A 4 29.615 100.288 -13.238 1.00 43.32 N ATOM 38 CA THR A 4 29.405 99.812 -14.594 1.00 31.21 C ATOM 39 C THR A 4 30.440 98.755 -14.969 1.00 2.41 C ATOM 40 O THR A 4 31.645 99.025 -14.956 1.00 63.23 O ATOM 41 CB THR A 4 29.456 100.978 -15.599 1.00 4.31 C ATOM 42 OG1 THR A 4 30.535 101.866 -15.267 1.00 72.25 O ATOM 43 CG2 THR A 4 28.147 101.752 -15.602 1.00 71.44 C ATOM 0 H THR A 4 30.017 101.223 -13.178 1.00 43.32 H new ATOM 0 HA THR A 4 28.415 99.358 -14.635 1.00 31.21 H new ATOM 0 HB THR A 4 29.617 100.561 -16.593 1.00 4.31 H new ATOM 0 HG1 THR A 4 31.333 101.342 -15.046 1.00 72.25 H new ATOM 0 HG21 THR A 4 28.209 102.570 -16.320 1.00 71.44 H new ATOM 0 HG22 THR A 4 27.331 101.086 -15.881 1.00 71.44 H new ATOM 0 HG23 THR A 4 27.961 102.156 -14.607 1.00 71.44 H new ATOM 51 N MET A 5 29.953 97.551 -15.285 1.00 11.31 N ATOM 52 CA MET A 5 30.792 96.403 -15.646 1.00 75.43 C ATOM 53 C MET A 5 31.610 95.918 -14.454 1.00 15.13 C ATOM 54 O MET A 5 31.303 94.869 -13.893 1.00 24.32 O ATOM 55 CB MET A 5 31.722 96.707 -16.831 1.00 22.24 C ATOM 56 CG MET A 5 31.002 96.916 -18.156 1.00 23.44 C ATOM 57 SD MET A 5 30.263 98.554 -18.308 1.00 11.43 S ATOM 58 CE MET A 5 31.726 99.586 -18.242 1.00 45.42 C ATOM 0 H MET A 5 28.954 97.343 -15.298 1.00 11.31 H new ATOM 0 HA MET A 5 30.110 95.610 -15.953 1.00 75.43 H new ATOM 0 HB2 MET A 5 32.303 97.600 -16.602 1.00 22.24 H new ATOM 0 HB3 MET A 5 32.430 95.886 -16.942 1.00 22.24 H new ATOM 0 HG2 MET A 5 31.707 96.764 -18.974 1.00 23.44 H new ATOM 0 HG3 MET A 5 30.223 96.161 -18.263 1.00 23.44 H new ATOM 0 HE1 MET A 5 31.686 100.326 -19.041 1.00 45.42 H new ATOM 0 HE2 MET A 5 31.770 100.094 -17.279 1.00 45.42 H new ATOM 0 HE3 MET A 5 32.614 98.966 -18.366 1.00 45.42 H new ATOM 68 N THR A 6 32.624 96.716 -14.077 1.00 41.42 N ATOM 69 CA THR A 6 33.585 96.432 -12.994 1.00 43.12 C ATOM 70 C THR A 6 34.249 95.039 -13.110 1.00 64.43 C ATOM 71 O THR A 6 35.459 94.951 -13.336 1.00 60.42 O ATOM 72 CB THR A 6 33.003 96.700 -11.564 1.00 74.21 C ATOM 73 OG1 THR A 6 34.041 96.582 -10.584 1.00 54.11 O ATOM 74 CG2 THR A 6 31.856 95.771 -11.180 1.00 62.12 C ATOM 0 H THR A 6 32.804 97.610 -14.534 1.00 41.42 H new ATOM 0 HA THR A 6 34.387 97.157 -13.134 1.00 43.12 H new ATOM 0 HB THR A 6 32.599 97.712 -11.591 1.00 74.21 H new ATOM 0 HG1 THR A 6 33.670 96.752 -9.693 1.00 54.11 H new ATOM 0 HG21 THR A 6 31.507 96.019 -10.177 1.00 62.12 H new ATOM 0 HG22 THR A 6 31.037 95.892 -11.889 1.00 62.12 H new ATOM 0 HG23 THR A 6 32.203 94.738 -11.199 1.00 62.12 H new ATOM 82 N PHE A 7 33.481 93.965 -12.975 1.00 42.33 N ATOM 83 CA PHE A 7 34.010 92.624 -13.158 1.00 74.33 C ATOM 84 C PHE A 7 33.868 92.220 -14.620 1.00 63.13 C ATOM 85 O PHE A 7 34.862 91.967 -15.301 1.00 64.35 O ATOM 86 CB PHE A 7 33.276 91.621 -12.259 1.00 24.13 C ATOM 87 CG PHE A 7 33.421 91.907 -10.789 1.00 71.12 C ATOM 88 CD1 PHE A 7 34.621 91.664 -10.138 1.00 75.04 C ATOM 89 CD2 PHE A 7 32.356 92.409 -10.058 1.00 54.44 C ATOM 90 CE1 PHE A 7 34.756 91.921 -8.787 1.00 24.44 C ATOM 91 CE2 PHE A 7 32.487 92.668 -8.706 1.00 13.11 C ATOM 92 CZ PHE A 7 33.689 92.422 -8.070 1.00 63.23 C ATOM 0 H PHE A 7 32.489 93.999 -12.739 1.00 42.33 H new ATOM 0 HA PHE A 7 35.064 92.620 -12.879 1.00 74.33 H new ATOM 0 HB2 PHE A 7 32.217 91.622 -12.518 1.00 24.13 H new ATOM 0 HB3 PHE A 7 33.653 90.619 -12.464 1.00 24.13 H new ATOM 0 HD1 PHE A 7 35.459 91.270 -10.693 1.00 75.04 H new ATOM 0 HD2 PHE A 7 31.414 92.600 -10.550 1.00 54.44 H new ATOM 0 HE1 PHE A 7 35.697 91.730 -8.292 1.00 24.44 H new ATOM 0 HE2 PHE A 7 31.651 93.062 -8.148 1.00 13.11 H new ATOM 0 HZ PHE A 7 33.793 92.622 -7.014 1.00 63.23 H new ATOM 102 N GLN A 8 32.619 92.178 -15.093 1.00 31.11 N ATOM 103 CA GLN A 8 32.311 91.880 -16.495 1.00 22.32 C ATOM 104 C GLN A 8 32.846 90.499 -16.899 1.00 73.41 C ATOM 105 O GLN A 8 33.138 90.236 -18.066 1.00 70.13 O ATOM 106 CB GLN A 8 32.880 92.986 -17.403 1.00 44.31 C ATOM 107 CG GLN A 8 32.408 92.917 -18.849 1.00 2.34 C ATOM 108 CD GLN A 8 32.897 94.079 -19.687 1.00 35.43 C ATOM 109 OE1 GLN A 8 33.953 94.657 -19.425 1.00 50.31 O ATOM 110 NE2 GLN A 8 32.132 94.427 -20.707 1.00 14.45 N ATOM 0 H GLN A 8 31.795 92.349 -14.517 1.00 31.11 H new ATOM 0 HA GLN A 8 31.228 91.854 -16.616 1.00 22.32 H new ATOM 0 HB2 GLN A 8 32.605 93.956 -16.990 1.00 44.31 H new ATOM 0 HB3 GLN A 8 33.968 92.929 -17.386 1.00 44.31 H new ATOM 0 HG2 GLN A 8 32.754 91.984 -19.294 1.00 2.34 H new ATOM 0 HG3 GLN A 8 31.318 92.895 -18.869 1.00 2.34 H new ATOM 0 HE21 GLN A 8 31.265 93.922 -20.890 1.00 14.45 H new ATOM 0 HE22 GLN A 8 32.409 95.200 -21.312 1.00 14.45 H new ATOM 119 N PHE A 9 32.946 89.602 -15.933 1.00 73.24 N ATOM 120 CA PHE A 9 33.428 88.264 -16.207 1.00 4.13 C ATOM 121 C PHE A 9 32.286 87.267 -16.110 1.00 32.53 C ATOM 122 O PHE A 9 31.893 86.855 -15.016 1.00 20.24 O ATOM 123 CB PHE A 9 34.553 87.878 -15.248 1.00 55.13 C ATOM 124 CG PHE A 9 35.159 86.536 -15.555 1.00 3.12 C ATOM 125 CD1 PHE A 9 35.007 85.470 -14.686 1.00 54.02 C ATOM 126 CD2 PHE A 9 35.876 86.342 -16.725 1.00 53.11 C ATOM 127 CE1 PHE A 9 35.559 84.235 -14.975 1.00 4.52 C ATOM 128 CE2 PHE A 9 36.430 85.110 -17.020 1.00 31.40 C ATOM 129 CZ PHE A 9 36.271 84.056 -16.144 1.00 63.11 C ATOM 0 H PHE A 9 32.701 89.777 -14.958 1.00 73.24 H new ATOM 0 HA PHE A 9 33.829 88.247 -17.221 1.00 4.13 H new ATOM 0 HB2 PHE A 9 35.332 88.639 -15.287 1.00 55.13 H new ATOM 0 HB3 PHE A 9 34.166 87.870 -14.229 1.00 55.13 H new ATOM 0 HD1 PHE A 9 34.450 85.604 -13.770 1.00 54.02 H new ATOM 0 HD2 PHE A 9 36.004 87.163 -17.415 1.00 53.11 H new ATOM 0 HE1 PHE A 9 35.433 83.412 -14.287 1.00 4.52 H new ATOM 0 HE2 PHE A 9 36.987 84.973 -17.935 1.00 31.40 H new ATOM 0 HZ PHE A 9 36.703 83.093 -16.372 1.00 63.11 H new ATOM 139 N ARG A 10 31.736 86.914 -17.259 1.00 62.51 N ATOM 140 CA ARG A 10 30.669 85.931 -17.337 1.00 44.32 C ATOM 141 C ARG A 10 31.059 84.831 -18.312 1.00 21.34 C ATOM 142 O ARG A 10 32.175 84.843 -18.833 1.00 35.21 O ATOM 143 CB ARG A 10 29.357 86.589 -17.775 1.00 21.20 C ATOM 144 CG ARG A 10 28.767 87.540 -16.743 1.00 72.03 C ATOM 145 CD ARG A 10 28.420 86.811 -15.455 1.00 53.43 C ATOM 146 NE ARG A 10 27.453 85.731 -15.674 1.00 61.25 N ATOM 147 CZ ARG A 10 27.332 84.664 -14.878 1.00 52.03 C ATOM 148 NH1 ARG A 10 28.095 84.545 -13.798 1.00 11.40 N1+ ATOM 149 NH2 ARG A 10 26.433 83.724 -15.154 1.00 60.33 N ATOM 0 H ARG A 10 32.015 87.299 -18.161 1.00 62.51 H new ATOM 0 HA ARG A 10 30.517 85.498 -16.348 1.00 44.32 H new ATOM 0 HB2 ARG A 10 29.529 87.136 -18.702 1.00 21.20 H new ATOM 0 HB3 ARG A 10 28.627 85.810 -17.995 1.00 21.20 H new ATOM 0 HG2 ARG A 10 29.479 88.338 -16.531 1.00 72.03 H new ATOM 0 HG3 ARG A 10 27.872 88.011 -17.149 1.00 72.03 H new ATOM 0 HD2 ARG A 10 29.329 86.399 -15.016 1.00 53.43 H new ATOM 0 HD3 ARG A 10 28.012 87.521 -14.736 1.00 53.43 H new ATOM 0 HE ARG A 10 26.835 85.798 -16.483 1.00 61.25 H new ATOM 0 HH11 ARG A 10 28.777 85.269 -13.573 1.00 11.40 H new ATOM 0 HH12 ARG A 10 27.999 83.729 -13.193 1.00 11.40 H new ATOM 0 HH21 ARG A 10 25.834 83.816 -15.974 1.00 60.33 H new ATOM 0 HH22 ARG A 10 26.342 82.911 -14.545 1.00 60.33 H new ATOM 163 N ASN A 11 30.139 83.900 -18.556 1.00 4.11 N ATOM 164 CA ASN A 11 30.394 82.753 -19.434 1.00 44.33 C ATOM 165 C ASN A 11 31.496 81.867 -18.852 1.00 62.55 C ATOM 166 O ASN A 11 32.672 82.018 -19.184 1.00 3.33 O ATOM 167 CB ASN A 11 30.780 83.209 -20.848 1.00 42.41 C ATOM 168 CG ASN A 11 30.821 82.060 -21.836 1.00 62.50 C ATOM 169 OD1 ASN A 11 29.843 81.789 -22.529 1.00 63.14 O ATOM 170 ND2 ASN A 11 31.944 81.368 -21.896 1.00 43.24 N ATOM 0 H ASN A 11 29.201 83.916 -18.155 1.00 4.11 H new ATOM 0 HA ASN A 11 29.472 82.176 -19.501 1.00 44.33 H new ATOM 0 HB2 ASN A 11 30.065 83.956 -21.193 1.00 42.41 H new ATOM 0 HB3 ASN A 11 31.756 83.692 -20.817 1.00 42.41 H new ATOM 0 HD21 ASN A 11 32.022 80.576 -22.535 1.00 43.24 H new ATOM 0 HD22 ASN A 11 32.734 81.625 -21.304 1.00 43.24 H new ATOM 177 N PRO A 12 31.130 80.950 -17.953 1.00 71.33 N ATOM 178 CA PRO A 12 32.078 80.047 -17.310 1.00 34.14 C ATOM 179 C PRO A 12 32.421 78.848 -18.189 1.00 51.42 C ATOM 180 O PRO A 12 31.529 78.196 -18.734 1.00 63.23 O ATOM 181 CB PRO A 12 31.340 79.587 -16.040 1.00 5.44 C ATOM 182 CG PRO A 12 29.998 80.260 -16.064 1.00 13.40 C ATOM 183 CD PRO A 12 29.769 80.715 -17.477 1.00 22.12 C ATOM 0 HA PRO A 12 33.030 80.537 -17.108 1.00 34.14 H new ATOM 0 HB2 PRO A 12 31.231 78.503 -16.025 1.00 5.44 H new ATOM 0 HB3 PRO A 12 31.897 79.863 -15.145 1.00 5.44 H new ATOM 0 HG2 PRO A 12 29.214 79.572 -15.747 1.00 13.40 H new ATOM 0 HG3 PRO A 12 29.977 81.106 -15.377 1.00 13.40 H new ATOM 0 HD2 PRO A 12 29.256 79.958 -18.070 1.00 22.12 H new ATOM 0 HD3 PRO A 12 29.161 81.619 -17.520 1.00 22.12 H new ATOM 191 N ASN A 13 33.720 78.576 -18.316 1.00 41.30 N ATOM 192 CA ASN A 13 34.227 77.415 -19.052 1.00 75.43 C ATOM 193 C ASN A 13 34.043 77.527 -20.561 1.00 53.44 C ATOM 194 O ASN A 13 32.945 77.348 -21.092 1.00 60.03 O ATOM 195 CB ASN A 13 33.587 76.114 -18.550 1.00 5.35 C ATOM 196 CG ASN A 13 34.384 75.465 -17.438 1.00 12.51 C ATOM 197 OD1 ASN A 13 34.201 75.770 -16.259 1.00 74.54 O ATOM 198 ND2 ASN A 13 35.265 74.548 -17.808 1.00 31.22 N ATOM 0 H ASN A 13 34.454 79.156 -17.910 1.00 41.30 H new ATOM 0 HA ASN A 13 35.299 77.393 -18.857 1.00 75.43 H new ATOM 0 HB2 ASN A 13 32.578 76.323 -18.195 1.00 5.35 H new ATOM 0 HB3 ASN A 13 33.494 75.415 -19.381 1.00 5.35 H new ATOM 0 HD21 ASN A 13 35.823 74.064 -17.105 1.00 31.22 H new ATOM 0 HD22 ASN A 13 35.385 74.326 -18.796 1.00 31.22 H new ATOM 205 N PHE A 14 35.135 77.833 -21.247 1.00 62.35 N ATOM 206 CA PHE A 14 35.197 77.691 -22.694 1.00 0.14 C ATOM 207 C PHE A 14 35.710 76.297 -23.038 1.00 75.23 C ATOM 208 O PHE A 14 36.524 75.732 -22.303 1.00 23.43 O ATOM 209 CB PHE A 14 36.116 78.742 -23.321 1.00 41.22 C ATOM 210 CG PHE A 14 35.515 80.116 -23.410 1.00 21.33 C ATOM 211 CD1 PHE A 14 35.820 81.087 -22.469 1.00 5.43 C ATOM 212 CD2 PHE A 14 34.655 80.441 -24.449 1.00 23.12 C ATOM 213 CE1 PHE A 14 35.279 82.355 -22.562 1.00 32.32 C ATOM 214 CE2 PHE A 14 34.110 81.706 -24.545 1.00 54.41 C ATOM 215 CZ PHE A 14 34.421 82.665 -23.602 1.00 3.14 C ATOM 0 H PHE A 14 35.994 78.183 -20.822 1.00 62.35 H new ATOM 0 HA PHE A 14 34.195 77.837 -23.096 1.00 0.14 H new ATOM 0 HB2 PHE A 14 37.035 78.798 -22.738 1.00 41.22 H new ATOM 0 HB3 PHE A 14 36.393 78.414 -24.323 1.00 41.22 H new ATOM 0 HD1 PHE A 14 36.488 80.850 -21.654 1.00 5.43 H new ATOM 0 HD2 PHE A 14 34.409 79.696 -25.191 1.00 23.12 H new ATOM 0 HE1 PHE A 14 35.526 83.103 -21.823 1.00 32.32 H new ATOM 0 HE2 PHE A 14 33.440 81.945 -25.358 1.00 54.41 H new ATOM 0 HZ PHE A 14 33.996 83.655 -23.676 1.00 3.14 H new ATOM 225 N GLY A 15 35.221 75.737 -24.130 1.00 54.15 N ATOM 226 CA GLY A 15 35.655 74.417 -24.536 1.00 71.23 C ATOM 227 C GLY A 15 36.969 74.452 -25.287 1.00 65.22 C ATOM 228 O GLY A 15 37.976 73.914 -24.820 1.00 42.44 O ATOM 0 H GLY A 15 34.531 76.171 -24.744 1.00 54.15 H new ATOM 0 HA2 GLY A 15 35.759 73.784 -23.655 1.00 71.23 H new ATOM 0 HA3 GLY A 15 34.890 73.963 -25.166 1.00 71.23 H new ATOM 232 N GLY A 16 36.961 75.088 -26.448 1.00 14.53 N ATOM 233 CA GLY A 16 38.158 75.172 -27.260 1.00 0.24 C ATOM 234 C GLY A 16 37.851 75.005 -28.733 1.00 22.35 C ATOM 235 O GLY A 16 36.687 74.843 -29.115 1.00 73.33 O ATOM 0 H GLY A 16 36.143 75.550 -26.845 1.00 14.53 H new ATOM 0 HA2 GLY A 16 38.641 76.135 -27.096 1.00 0.24 H new ATOM 0 HA3 GLY A 16 38.865 74.403 -26.947 1.00 0.24 H new ATOM 239 N ASN A 17 38.883 75.038 -29.564 1.00 43.33 N ATOM 240 CA ASN A 17 38.703 74.917 -31.005 1.00 1.12 C ATOM 241 C ASN A 17 39.484 73.726 -31.545 1.00 62.33 C ATOM 242 O ASN A 17 40.590 73.443 -31.088 1.00 61.32 O ATOM 243 CB ASN A 17 39.157 76.201 -31.713 1.00 21.55 C ATOM 244 CG ASN A 17 38.243 77.384 -31.440 1.00 72.14 C ATOM 245 OD1 ASN A 17 37.033 77.231 -31.288 1.00 51.22 O ATOM 246 ND2 ASN A 17 38.819 78.576 -31.375 1.00 0.34 N ATOM 0 H ASN A 17 39.853 75.147 -29.266 1.00 43.33 H new ATOM 0 HA ASN A 17 37.642 74.760 -31.202 1.00 1.12 H new ATOM 0 HB2 ASN A 17 40.169 76.449 -31.391 1.00 21.55 H new ATOM 0 HB3 ASN A 17 39.199 76.022 -32.787 1.00 21.55 H new ATOM 0 HD21 ASN A 17 38.255 79.406 -31.193 1.00 0.34 H new ATOM 0 HD22 ASN A 17 39.827 78.663 -31.506 1.00 0.34 H new ATOM 253 N PRO A 18 38.919 73.014 -32.530 1.00 24.35 N ATOM 254 CA PRO A 18 39.557 71.855 -33.134 1.00 21.23 C ATOM 255 C PRO A 18 40.414 72.214 -34.350 1.00 14.44 C ATOM 256 O PRO A 18 40.157 73.202 -35.037 1.00 61.41 O ATOM 257 CB PRO A 18 38.359 71.009 -33.551 1.00 45.30 C ATOM 258 CG PRO A 18 37.295 72.002 -33.901 1.00 32.23 C ATOM 259 CD PRO A 18 37.590 73.262 -33.116 1.00 15.21 C ATOM 0 HA PRO A 18 40.249 71.358 -32.454 1.00 21.23 H new ATOM 0 HB2 PRO A 18 38.601 70.372 -34.402 1.00 45.30 H new ATOM 0 HB3 PRO A 18 38.037 70.353 -32.742 1.00 45.30 H new ATOM 0 HG2 PRO A 18 37.295 72.206 -34.972 1.00 32.23 H new ATOM 0 HG3 PRO A 18 36.308 71.614 -33.650 1.00 32.23 H new ATOM 0 HD2 PRO A 18 37.596 74.141 -33.760 1.00 15.21 H new ATOM 0 HD3 PRO A 18 36.840 73.437 -32.345 1.00 15.21 H new ATOM 267 N ASN A 19 41.434 71.409 -34.601 1.00 23.42 N ATOM 268 CA ASN A 19 42.288 71.586 -35.770 1.00 64.52 C ATOM 269 C ASN A 19 41.850 70.618 -36.861 1.00 63.24 C ATOM 270 O ASN A 19 41.273 69.572 -36.570 1.00 74.52 O ATOM 271 CB ASN A 19 43.758 71.344 -35.399 1.00 34.52 C ATOM 272 CG ASN A 19 44.713 71.645 -36.540 1.00 65.20 C ATOM 273 OD1 ASN A 19 44.455 72.516 -37.371 1.00 30.24 O ATOM 274 ND2 ASN A 19 45.819 70.920 -36.595 1.00 44.43 N ATOM 0 H ASN A 19 41.694 70.621 -34.008 1.00 23.42 H new ATOM 0 HA ASN A 19 42.194 72.609 -36.135 1.00 64.52 H new ATOM 0 HB2 ASN A 19 44.018 71.964 -34.541 1.00 34.52 H new ATOM 0 HB3 ASN A 19 43.884 70.306 -35.091 1.00 34.52 H new ATOM 0 HD21 ASN A 19 46.493 71.074 -37.345 1.00 44.43 H new ATOM 0 HD22 ASN A 19 45.997 70.207 -35.887 1.00 44.43 H new ATOM 281 N ASN A 20 42.106 70.965 -38.112 1.00 0.34 N ATOM 282 CA ASN A 20 41.702 70.121 -39.226 1.00 2.02 C ATOM 283 C ASN A 20 42.874 69.856 -40.161 1.00 40.34 C ATOM 284 O ASN A 20 43.850 70.606 -40.181 1.00 74.24 O ATOM 285 CB ASN A 20 40.525 70.745 -39.996 1.00 1.51 C ATOM 286 CG ASN A 20 40.773 72.177 -40.453 1.00 51.11 C ATOM 287 OD1 ASN A 20 41.905 72.586 -40.702 1.00 52.43 O ATOM 288 ND2 ASN A 20 39.703 72.948 -40.569 1.00 2.01 N ATOM 0 H ASN A 20 42.590 71.822 -38.381 1.00 0.34 H new ATOM 0 HA ASN A 20 41.370 69.167 -38.816 1.00 2.02 H new ATOM 0 HB2 ASN A 20 40.307 70.129 -40.868 1.00 1.51 H new ATOM 0 HB3 ASN A 20 39.638 70.725 -39.362 1.00 1.51 H new ATOM 0 HD21 ASN A 20 39.803 73.916 -40.874 1.00 2.01 H new ATOM 0 HD22 ASN A 20 38.779 72.574 -40.354 1.00 2.01 H new ATOM 295 N GLY A 21 42.777 68.777 -40.922 1.00 62.44 N ATOM 296 CA GLY A 21 43.827 68.436 -41.861 1.00 13.55 C ATOM 297 C GLY A 21 43.426 68.732 -43.292 1.00 0.45 C ATOM 298 O GLY A 21 44.166 68.413 -44.227 1.00 25.41 O ATOM 0 H GLY A 21 41.989 68.130 -40.907 1.00 62.44 H new ATOM 0 HA2 GLY A 21 44.730 68.995 -41.614 1.00 13.55 H new ATOM 0 HA3 GLY A 21 44.071 67.378 -41.764 1.00 13.55 H new ATOM 302 N ALA A 22 42.246 69.344 -43.445 1.00 11.14 N ATOM 303 CA ALA A 22 41.671 69.696 -44.752 1.00 24.15 C ATOM 304 C ALA A 22 41.183 68.459 -45.502 1.00 21.32 C ATOM 305 O ALA A 22 40.016 68.385 -45.885 1.00 64.10 O ATOM 306 CB ALA A 22 42.654 70.499 -45.598 1.00 21.11 C ATOM 0 H ALA A 22 41.656 69.612 -42.658 1.00 11.14 H new ATOM 0 HA ALA A 22 40.805 70.329 -44.562 1.00 24.15 H new ATOM 0 HB1 ALA A 22 42.195 70.742 -46.557 1.00 21.11 H new ATOM 0 HB2 ALA A 22 42.914 71.420 -45.077 1.00 21.11 H new ATOM 0 HB3 ALA A 22 43.556 69.910 -45.766 1.00 21.11 H new ATOM 312 N PHE A 23 42.080 67.493 -45.693 1.00 32.04 N ATOM 313 CA PHE A 23 41.757 66.242 -46.376 1.00 53.22 C ATOM 314 C PHE A 23 41.197 66.500 -47.774 1.00 65.32 C ATOM 315 O PHE A 23 40.210 65.896 -48.183 1.00 62.34 O ATOM 316 CB PHE A 23 40.770 65.409 -45.549 1.00 65.22 C ATOM 317 CG PHE A 23 41.356 64.875 -44.272 1.00 71.25 C ATOM 318 CD1 PHE A 23 41.042 65.454 -43.055 1.00 53.43 C ATOM 319 CD2 PHE A 23 42.219 63.791 -44.290 1.00 21.43 C ATOM 320 CE1 PHE A 23 41.578 64.963 -41.878 1.00 0.12 C ATOM 321 CE2 PHE A 23 42.759 63.297 -43.118 1.00 3.24 C ATOM 322 CZ PHE A 23 42.438 63.882 -41.910 1.00 64.54 C ATOM 0 H PHE A 23 43.049 67.555 -45.379 1.00 32.04 H new ATOM 0 HA PHE A 23 42.683 65.677 -46.484 1.00 53.22 H new ATOM 0 HB2 PHE A 23 39.900 66.022 -45.312 1.00 65.22 H new ATOM 0 HB3 PHE A 23 40.416 64.574 -46.154 1.00 65.22 H new ATOM 0 HD1 PHE A 23 40.370 66.299 -43.024 1.00 53.43 H new ATOM 0 HD2 PHE A 23 42.473 63.327 -45.232 1.00 21.43 H new ATOM 0 HE1 PHE A 23 41.324 65.424 -40.935 1.00 0.12 H new ATOM 0 HE2 PHE A 23 43.432 62.453 -43.147 1.00 3.24 H new ATOM 0 HZ PHE A 23 42.858 63.496 -40.993 1.00 64.54 H new ATOM 332 N LEU A 24 41.855 67.387 -48.511 1.00 53.34 N ATOM 333 CA LEU A 24 41.432 67.712 -49.871 1.00 51.34 C ATOM 334 C LEU A 24 41.846 66.616 -50.856 1.00 45.44 C ATOM 335 O LEU A 24 41.467 66.647 -52.028 1.00 10.11 O ATOM 336 CB LEU A 24 41.982 69.085 -50.295 1.00 62.32 C ATOM 337 CG LEU A 24 43.438 69.389 -49.901 1.00 3.14 C ATOM 338 CD1 LEU A 24 44.423 68.571 -50.719 1.00 23.03 C ATOM 339 CD2 LEU A 24 43.725 70.874 -50.060 1.00 11.23 C ATOM 0 H LEU A 24 42.681 67.893 -48.193 1.00 53.34 H new ATOM 0 HA LEU A 24 40.343 67.767 -49.885 1.00 51.34 H new ATOM 0 HB2 LEU A 24 41.897 69.168 -51.379 1.00 62.32 H new ATOM 0 HB3 LEU A 24 41.343 69.857 -49.865 1.00 62.32 H new ATOM 0 HG LEU A 24 43.565 69.109 -48.855 1.00 3.14 H new ATOM 0 HD11 LEU A 24 45.440 68.813 -50.412 1.00 23.03 H new ATOM 0 HD12 LEU A 24 44.238 67.509 -50.556 1.00 23.03 H new ATOM 0 HD13 LEU A 24 44.298 68.803 -51.777 1.00 23.03 H new ATOM 0 HD21 LEU A 24 44.758 71.077 -49.778 1.00 11.23 H new ATOM 0 HD22 LEU A 24 43.568 71.166 -51.098 1.00 11.23 H new ATOM 0 HD23 LEU A 24 43.055 71.445 -49.417 1.00 11.23 H new ATOM 351 N LEU A 25 42.617 65.647 -50.349 1.00 14.23 N ATOM 352 CA LEU A 25 43.015 64.457 -51.105 1.00 22.42 C ATOM 353 C LEU A 25 43.891 64.793 -52.312 1.00 42.44 C ATOM 354 O LEU A 25 44.137 65.958 -52.627 1.00 41.32 O ATOM 355 CB LEU A 25 41.781 63.672 -51.565 1.00 52.44 C ATOM 356 CG LEU A 25 40.892 63.140 -50.438 1.00 3.52 C ATOM 357 CD1 LEU A 25 39.700 62.385 -51.008 1.00 35.34 C ATOM 358 CD2 LEU A 25 41.694 62.247 -49.504 1.00 34.05 C ATOM 0 H LEU A 25 42.984 65.668 -49.397 1.00 14.23 H new ATOM 0 HA LEU A 25 43.609 63.843 -50.428 1.00 22.42 H new ATOM 0 HB2 LEU A 25 41.180 64.315 -52.208 1.00 52.44 H new ATOM 0 HB3 LEU A 25 42.111 62.831 -52.174 1.00 52.44 H new ATOM 0 HG LEU A 25 40.518 63.988 -49.865 1.00 3.52 H new ATOM 0 HD11 LEU A 25 39.080 62.014 -50.192 1.00 35.34 H new ATOM 0 HD12 LEU A 25 39.112 63.054 -51.636 1.00 35.34 H new ATOM 0 HD13 LEU A 25 40.053 61.545 -51.605 1.00 35.34 H new ATOM 0 HD21 LEU A 25 41.047 61.878 -48.709 1.00 34.05 H new ATOM 0 HD22 LEU A 25 42.098 61.404 -50.064 1.00 34.05 H new ATOM 0 HD23 LEU A 25 42.513 62.819 -49.068 1.00 34.05 H new ATOM 370 N ASN A 26 44.383 63.755 -52.970 1.00 73.20 N ATOM 371 CA ASN A 26 45.145 63.915 -54.200 1.00 60.40 C ATOM 372 C ASN A 26 44.542 63.037 -55.285 1.00 55.24 C ATOM 373 O ASN A 26 43.724 63.489 -56.091 1.00 70.31 O ATOM 374 CB ASN A 26 46.620 63.541 -53.999 1.00 52.12 C ATOM 375 CG ASN A 26 47.320 64.398 -52.961 1.00 31.52 C ATOM 376 OD1 ASN A 26 47.772 65.503 -53.260 1.00 61.41 O ATOM 377 ND2 ASN A 26 47.450 63.882 -51.747 1.00 0.40 N ATOM 0 H ASN A 26 44.268 62.787 -52.671 1.00 73.20 H new ATOM 0 HA ASN A 26 45.099 64.963 -54.495 1.00 60.40 H new ATOM 0 HB2 ASN A 26 46.685 62.495 -53.700 1.00 52.12 H new ATOM 0 HB3 ASN A 26 47.144 63.634 -54.950 1.00 52.12 H new ATOM 0 HD21 ASN A 26 47.939 64.405 -51.020 1.00 0.40 H new ATOM 0 HD22 ASN A 26 47.061 62.962 -51.539 1.00 0.40 H new ATOM 384 N SER A 27 44.922 61.770 -55.262 1.00 41.42 N ATOM 385 CA SER A 27 44.439 60.782 -56.210 1.00 71.35 C ATOM 386 C SER A 27 44.920 59.402 -55.780 1.00 32.44 C ATOM 387 O SER A 27 46.083 59.242 -55.404 1.00 10.41 O ATOM 388 CB SER A 27 44.929 61.109 -57.627 1.00 30.22 C ATOM 389 OG SER A 27 46.319 61.393 -57.633 1.00 62.34 O ATOM 0 H SER A 27 45.580 61.396 -54.578 1.00 41.42 H new ATOM 0 HA SER A 27 43.349 60.796 -56.223 1.00 71.35 H new ATOM 0 HB2 SER A 27 44.723 60.268 -58.289 1.00 30.22 H new ATOM 0 HB3 SER A 27 44.378 61.965 -58.017 1.00 30.22 H new ATOM 0 HG SER A 27 46.607 61.597 -58.547 1.00 62.34 H new ATOM 395 N ALA A 28 44.035 58.417 -55.810 1.00 11.40 N ATOM 396 CA ALA A 28 44.385 57.077 -55.360 1.00 74.12 C ATOM 397 C ALA A 28 43.813 56.016 -56.288 1.00 32.20 C ATOM 398 O ALA A 28 42.596 55.891 -56.430 1.00 40.33 O ATOM 399 CB ALA A 28 43.905 56.860 -53.932 1.00 11.11 C ATOM 0 H ALA A 28 43.075 58.518 -56.139 1.00 11.40 H new ATOM 0 HA ALA A 28 45.471 56.984 -55.382 1.00 74.12 H new ATOM 0 HB1 ALA A 28 44.173 55.855 -53.607 1.00 11.11 H new ATOM 0 HB2 ALA A 28 44.376 57.591 -53.275 1.00 11.11 H new ATOM 0 HB3 ALA A 28 42.822 56.979 -53.890 1.00 11.11 H new ATOM 405 N GLN A 29 44.694 55.259 -56.922 1.00 51.32 N ATOM 406 CA GLN A 29 44.276 54.191 -57.817 1.00 50.44 C ATOM 407 C GLN A 29 44.556 52.838 -57.162 1.00 51.32 C ATOM 408 O GLN A 29 43.787 51.892 -57.327 1.00 65.31 O ATOM 409 CB GLN A 29 45.002 54.323 -59.164 1.00 25.01 C ATOM 410 CG GLN A 29 44.225 53.763 -60.352 1.00 22.41 C ATOM 411 CD GLN A 29 44.257 52.251 -60.438 1.00 13.34 C ATOM 412 OE1 GLN A 29 45.233 51.620 -60.055 1.00 43.24 O ATOM 413 NE2 GLN A 29 43.192 51.661 -60.952 1.00 45.43 N ATOM 0 H GLN A 29 45.705 55.364 -56.833 1.00 51.32 H new ATOM 0 HA GLN A 29 43.205 54.265 -58.006 1.00 50.44 H new ATOM 0 HB2 GLN A 29 45.215 55.376 -59.347 1.00 25.01 H new ATOM 0 HB3 GLN A 29 45.962 53.811 -59.098 1.00 25.01 H new ATOM 0 HG2 GLN A 29 43.188 54.093 -60.286 1.00 22.41 H new ATOM 0 HG3 GLN A 29 44.634 54.180 -61.272 1.00 22.41 H new ATOM 0 HE21 GLN A 29 42.397 52.221 -61.260 1.00 45.43 H new ATOM 0 HE22 GLN A 29 43.165 50.645 -61.040 1.00 45.43 H new ATOM 422 N ALA A 30 45.675 52.771 -56.426 1.00 32.35 N ATOM 423 CA ALA A 30 46.049 51.602 -55.608 1.00 75.25 C ATOM 424 C ALA A 30 46.574 50.435 -56.448 1.00 2.24 C ATOM 425 O ALA A 30 47.511 49.758 -56.036 1.00 44.53 O ATOM 426 CB ALA A 30 44.889 51.147 -54.726 1.00 53.52 C ATOM 0 H ALA A 30 46.353 53.532 -56.380 1.00 32.35 H new ATOM 0 HA ALA A 30 46.867 51.929 -54.966 1.00 75.25 H new ATOM 0 HB1 ALA A 30 45.197 50.284 -54.136 1.00 53.52 H new ATOM 0 HB2 ALA A 30 44.600 51.958 -54.058 1.00 53.52 H new ATOM 0 HB3 ALA A 30 44.041 50.873 -55.353 1.00 53.52 H new ATOM 432 N GLN A 31 45.973 50.238 -57.625 1.00 62.43 N ATOM 433 CA GLN A 31 46.333 49.176 -58.589 1.00 45.15 C ATOM 434 C GLN A 31 46.554 47.796 -57.948 1.00 11.34 C ATOM 435 O GLN A 31 45.633 46.974 -57.904 1.00 33.30 O ATOM 436 CB GLN A 31 47.534 49.567 -59.492 1.00 15.14 C ATOM 437 CG GLN A 31 48.774 50.102 -58.776 1.00 52.33 C ATOM 438 CD GLN A 31 48.738 51.604 -58.549 1.00 4.22 C ATOM 439 OE1 GLN A 31 48.119 52.332 -59.464 1.00 75.53 O flip ATOM 440 NE2 GLN A 31 49.279 52.109 -57.566 1.00 5.45 N flip ATOM 0 H GLN A 31 45.203 50.823 -57.949 1.00 62.43 H new ATOM 0 HA GLN A 31 45.453 49.081 -59.225 1.00 45.15 H new ATOM 0 HB2 GLN A 31 47.825 48.691 -60.072 1.00 15.14 H new ATOM 0 HB3 GLN A 31 47.197 50.322 -60.202 1.00 15.14 H new ATOM 0 HG2 GLN A 31 48.875 49.599 -57.814 1.00 52.33 H new ATOM 0 HG3 GLN A 31 49.659 49.851 -59.361 1.00 52.33 H new ATOM 0 HE21 GLN A 31 49.747 51.516 -56.881 1.00 5.45 H new ATOM 0 HE22 GLN A 31 49.259 53.121 -57.436 1.00 5.45 H new ATOM 449 N ASN A 32 47.756 47.546 -57.451 1.00 32.35 N ATOM 450 CA ASN A 32 48.137 46.221 -56.978 1.00 60.00 C ATOM 451 C ASN A 32 48.325 46.223 -55.466 1.00 24.31 C ATOM 452 O ASN A 32 48.958 47.123 -54.913 1.00 12.35 O ATOM 453 CB ASN A 32 49.440 45.783 -57.656 1.00 55.23 C ATOM 454 CG ASN A 32 49.716 44.292 -57.541 1.00 52.21 C ATOM 455 OD1 ASN A 32 49.249 43.618 -56.622 1.00 64.01 O ATOM 456 ND2 ASN A 32 50.503 43.771 -58.471 1.00 12.22 N ATOM 0 H ASN A 32 48.490 48.249 -57.364 1.00 32.35 H new ATOM 0 HA ASN A 32 47.340 45.522 -57.230 1.00 60.00 H new ATOM 0 HB2 ASN A 32 49.401 46.056 -58.710 1.00 55.23 H new ATOM 0 HB3 ASN A 32 50.272 46.333 -57.215 1.00 55.23 H new ATOM 0 HD21 ASN A 32 50.741 42.780 -58.441 1.00 12.22 H new ATOM 0 HD22 ASN A 32 50.871 44.361 -59.217 1.00 12.22 H new ATOM 463 N SER A 33 47.771 45.215 -54.806 1.00 43.41 N ATOM 464 CA SER A 33 47.970 45.030 -53.381 1.00 24.32 C ATOM 465 C SER A 33 49.439 44.737 -53.100 1.00 0.13 C ATOM 466 O SER A 33 50.057 45.382 -52.249 1.00 23.01 O ATOM 467 CB SER A 33 47.076 43.891 -52.878 1.00 74.21 C ATOM 468 OG SER A 33 47.106 42.787 -53.771 1.00 5.52 O ATOM 0 H SER A 33 47.177 44.510 -55.242 1.00 43.41 H new ATOM 0 HA SER A 33 47.695 45.942 -52.851 1.00 24.32 H new ATOM 0 HB2 SER A 33 47.408 43.573 -51.890 1.00 74.21 H new ATOM 0 HB3 SER A 33 46.052 44.248 -52.770 1.00 74.21 H new ATOM 0 HG SER A 33 47.392 41.983 -53.288 1.00 5.52 H new ATOM 474 N TYR A 34 49.980 43.750 -53.825 1.00 44.31 N ATOM 475 CA TYR A 34 51.409 43.413 -53.808 1.00 61.24 C ATOM 476 C TYR A 34 51.832 42.740 -52.497 1.00 73.24 C ATOM 477 O TYR A 34 52.810 41.986 -52.463 1.00 62.43 O ATOM 478 CB TYR A 34 52.252 44.668 -54.073 1.00 13.13 C ATOM 479 CG TYR A 34 53.724 44.392 -54.296 1.00 74.24 C ATOM 480 CD1 TYR A 34 54.668 44.729 -53.334 1.00 25.42 C ATOM 481 CD2 TYR A 34 54.167 43.791 -55.468 1.00 64.13 C ATOM 482 CE1 TYR A 34 56.011 44.479 -53.537 1.00 53.30 C ATOM 483 CE2 TYR A 34 55.509 43.539 -55.676 1.00 70.13 C ATOM 484 CZ TYR A 34 56.426 43.883 -54.706 1.00 21.34 C ATOM 485 OH TYR A 34 57.763 43.633 -54.908 1.00 74.43 O ATOM 0 H TYR A 34 49.432 43.156 -54.447 1.00 44.31 H new ATOM 0 HA TYR A 34 51.585 42.690 -54.605 1.00 61.24 H new ATOM 0 HB2 TYR A 34 51.854 45.181 -54.948 1.00 13.13 H new ATOM 0 HB3 TYR A 34 52.145 45.349 -53.228 1.00 13.13 H new ATOM 0 HD1 TYR A 34 54.347 45.194 -52.413 1.00 25.42 H new ATOM 0 HD2 TYR A 34 53.451 43.517 -56.228 1.00 64.13 H new ATOM 0 HE1 TYR A 34 56.733 44.750 -52.781 1.00 53.30 H new ATOM 0 HE2 TYR A 34 55.838 43.075 -56.594 1.00 70.13 H new ATOM 0 HH TYR A 34 57.888 43.208 -55.782 1.00 74.43 H new ATOM 495 N LYS A 35 51.100 43.006 -51.433 1.00 52.32 N ATOM 496 CA LYS A 35 51.414 42.460 -50.125 1.00 32.34 C ATOM 497 C LYS A 35 50.124 42.060 -49.410 1.00 3.52 C ATOM 498 O LYS A 35 50.035 42.101 -48.187 1.00 34.43 O ATOM 499 CB LYS A 35 52.192 43.503 -49.310 1.00 4.45 C ATOM 500 CG LYS A 35 52.709 43.000 -47.969 1.00 64.01 C ATOM 501 CD LYS A 35 53.771 41.928 -48.128 1.00 53.33 C ATOM 502 CE LYS A 35 54.160 41.334 -46.783 1.00 71.43 C ATOM 503 NZ LYS A 35 54.596 42.376 -45.813 1.00 25.44 N1+ ATOM 0 H LYS A 35 50.274 43.604 -51.449 1.00 52.32 H new ATOM 0 HA LYS A 35 52.035 41.571 -50.235 1.00 32.34 H new ATOM 0 HB2 LYS A 35 53.037 43.852 -49.903 1.00 4.45 H new ATOM 0 HB3 LYS A 35 51.547 44.364 -49.136 1.00 4.45 H new ATOM 0 HG2 LYS A 35 53.121 43.836 -47.404 1.00 64.01 H new ATOM 0 HG3 LYS A 35 51.878 42.602 -47.388 1.00 64.01 H new ATOM 0 HD2 LYS A 35 53.400 41.140 -48.783 1.00 53.33 H new ATOM 0 HD3 LYS A 35 54.652 42.354 -48.609 1.00 53.33 H new ATOM 0 HE2 LYS A 35 53.312 40.788 -46.370 1.00 71.43 H new ATOM 0 HE3 LYS A 35 54.965 40.613 -46.925 1.00 71.43 H new ATOM 0 HZ1 LYS A 35 55.040 41.920 -44.990 1.00 25.44 H new ATOM 0 HZ2 LYS A 35 55.282 43.010 -46.270 1.00 25.44 H new ATOM 0 HZ3 LYS A 35 53.771 42.926 -45.500 1.00 25.44 H new ATOM 517 N ASP A 36 49.128 41.654 -50.187 1.00 74.53 N ATOM 518 CA ASP A 36 47.832 41.263 -49.630 1.00 12.22 C ATOM 519 C ASP A 36 47.972 40.068 -48.681 1.00 2.12 C ATOM 520 O ASP A 36 48.949 39.317 -48.753 1.00 1.02 O ATOM 521 CB ASP A 36 46.828 40.940 -50.747 1.00 13.10 C ATOM 522 CG ASP A 36 47.335 39.901 -51.721 1.00 53.20 C ATOM 523 OD1 ASP A 36 47.868 40.299 -52.779 1.00 0.23 O ATOM 524 OD2 ASP A 36 47.196 38.694 -51.447 1.00 61.43 O1- ATOM 0 H ASP A 36 49.189 41.586 -51.203 1.00 74.53 H new ATOM 0 HA ASP A 36 47.453 42.110 -49.058 1.00 12.22 H new ATOM 0 HB2 ASP A 36 45.898 40.587 -50.300 1.00 13.10 H new ATOM 0 HB3 ASP A 36 46.593 41.855 -51.291 1.00 13.10 H new ATOM 529 N PRO A 37 47.004 39.907 -47.757 1.00 13.20 N ATOM 530 CA PRO A 37 47.014 38.838 -46.751 1.00 63.51 C ATOM 531 C PRO A 37 47.237 37.445 -47.333 1.00 54.33 C ATOM 532 O PRO A 37 46.735 37.108 -48.408 1.00 45.11 O ATOM 533 CB PRO A 37 45.615 38.921 -46.116 1.00 21.24 C ATOM 534 CG PRO A 37 44.830 39.841 -46.989 1.00 41.34 C ATOM 535 CD PRO A 37 45.831 40.771 -47.600 1.00 70.22 C ATOM 0 HA PRO A 37 47.838 38.978 -46.051 1.00 63.51 H new ATOM 0 HB2 PRO A 37 45.149 37.937 -46.065 1.00 21.24 H new ATOM 0 HB3 PRO A 37 45.670 39.301 -45.096 1.00 21.24 H new ATOM 0 HG2 PRO A 37 44.291 39.287 -47.757 1.00 41.34 H new ATOM 0 HG3 PRO A 37 44.087 40.390 -46.411 1.00 41.34 H new ATOM 0 HD2 PRO A 37 45.487 41.168 -48.555 1.00 70.22 H new ATOM 0 HD3 PRO A 37 46.038 41.626 -46.956 1.00 70.22 H new ATOM 543 N SER A 38 47.976 36.637 -46.592 1.00 14.04 N ATOM 544 CA SER A 38 48.257 35.267 -46.972 1.00 55.00 C ATOM 545 C SER A 38 48.175 34.376 -45.741 1.00 15.51 C ATOM 546 O SER A 38 48.678 34.745 -44.678 1.00 61.15 O ATOM 547 CB SER A 38 49.648 35.167 -47.611 1.00 62.11 C ATOM 548 OG SER A 38 50.000 33.820 -47.883 1.00 2.22 O ATOM 0 H SER A 38 48.399 36.916 -45.707 1.00 14.04 H new ATOM 0 HA SER A 38 47.520 34.937 -47.704 1.00 55.00 H new ATOM 0 HB2 SER A 38 49.667 35.743 -48.536 1.00 62.11 H new ATOM 0 HB3 SER A 38 50.388 35.610 -46.945 1.00 62.11 H new ATOM 0 HG SER A 38 50.890 33.791 -48.291 1.00 2.22 H new ATOM 554 N TYR A 39 47.522 33.225 -45.891 1.00 43.44 N ATOM 555 CA TYR A 39 47.364 32.261 -44.804 1.00 20.45 C ATOM 556 C TYR A 39 46.686 32.918 -43.600 1.00 62.10 C ATOM 557 O TYR A 39 47.314 33.156 -42.565 1.00 24.30 O ATOM 558 CB TYR A 39 48.725 31.661 -44.414 1.00 32.34 C ATOM 559 CG TYR A 39 48.640 30.502 -43.441 1.00 55.01 C ATOM 560 CD1 TYR A 39 48.152 29.268 -43.847 1.00 1.41 C ATOM 561 CD2 TYR A 39 49.059 30.643 -42.123 1.00 62.40 C ATOM 562 CE1 TYR A 39 48.080 28.207 -42.966 1.00 74.42 C ATOM 563 CE2 TYR A 39 48.989 29.588 -41.237 1.00 23.44 C ATOM 564 CZ TYR A 39 48.500 28.374 -41.664 1.00 40.22 C ATOM 565 OH TYR A 39 48.430 27.317 -40.783 1.00 3.35 O ATOM 0 H TYR A 39 47.088 32.935 -46.768 1.00 43.44 H new ATOM 0 HA TYR A 39 46.724 31.449 -45.149 1.00 20.45 H new ATOM 0 HB2 TYR A 39 49.233 31.325 -45.318 1.00 32.34 H new ATOM 0 HB3 TYR A 39 49.342 32.445 -43.974 1.00 32.34 H new ATOM 0 HD1 TYR A 39 47.824 29.135 -44.867 1.00 1.41 H new ATOM 0 HD2 TYR A 39 49.446 31.594 -41.787 1.00 62.40 H new ATOM 0 HE1 TYR A 39 47.697 27.252 -43.295 1.00 74.42 H new ATOM 0 HE2 TYR A 39 49.316 29.714 -40.215 1.00 23.44 H new ATOM 0 HH TYR A 39 48.765 27.599 -39.906 1.00 3.35 H new ATOM 575 N ASN A 40 45.405 33.249 -43.774 1.00 65.22 N ATOM 576 CA ASN A 40 44.602 33.879 -42.721 1.00 3.22 C ATOM 577 C ASN A 40 45.169 35.247 -42.353 1.00 70.45 C ATOM 578 O ASN A 40 44.927 35.752 -41.259 1.00 15.21 O ATOM 579 CB ASN A 40 44.536 32.984 -41.476 1.00 75.20 C ATOM 580 CG ASN A 40 43.791 31.687 -41.726 1.00 64.02 C ATOM 581 OD1 ASN A 40 44.378 30.689 -42.147 1.00 40.50 O ATOM 582 ND2 ASN A 40 42.494 31.682 -41.451 1.00 70.04 N ATOM 0 H ASN A 40 44.896 33.090 -44.643 1.00 65.22 H new ATOM 0 HA ASN A 40 43.591 34.013 -43.107 1.00 3.22 H new ATOM 0 HB2 ASN A 40 45.549 32.758 -41.142 1.00 75.20 H new ATOM 0 HB3 ASN A 40 44.048 33.529 -40.668 1.00 75.20 H new ATOM 0 HD21 ASN A 40 41.947 30.832 -41.587 1.00 70.04 H new ATOM 0 HD22 ASN A 40 42.043 32.528 -41.104 1.00 70.04 H new ATOM 589 N ASP A 41 45.894 35.843 -43.301 1.00 1.43 N ATOM 590 CA ASP A 41 46.600 37.116 -43.100 1.00 42.41 C ATOM 591 C ASP A 41 47.686 36.994 -42.040 1.00 73.04 C ATOM 592 O ASP A 41 47.407 36.909 -40.842 1.00 20.40 O ATOM 593 CB ASP A 41 45.650 38.262 -42.734 1.00 75.34 C ATOM 594 CG ASP A 41 46.406 39.544 -42.421 1.00 44.10 C ATOM 595 OD1 ASP A 41 47.095 40.068 -43.322 1.00 61.14 O ATOM 596 OD2 ASP A 41 46.314 40.028 -41.273 1.00 31.02 O1- ATOM 0 H ASP A 41 46.011 35.456 -44.237 1.00 1.43 H new ATOM 0 HA ASP A 41 47.064 37.354 -44.057 1.00 42.41 H new ATOM 0 HB2 ASP A 41 44.960 38.439 -43.559 1.00 75.34 H new ATOM 0 HB3 ASP A 41 45.049 37.975 -41.871 1.00 75.34 H new ATOM 601 N ASP A 42 48.928 36.972 -42.488 1.00 64.11 N ATOM 602 CA ASP A 42 50.063 36.949 -41.580 1.00 22.32 C ATOM 603 C ASP A 42 50.465 38.371 -41.219 1.00 12.21 C ATOM 604 O ASP A 42 50.746 38.673 -40.056 1.00 2.23 O ATOM 605 CB ASP A 42 51.245 36.213 -42.215 1.00 70.12 C ATOM 606 CG ASP A 42 52.474 36.219 -41.329 1.00 70.01 C ATOM 607 OD1 ASP A 42 53.377 37.054 -41.557 1.00 24.15 O ATOM 608 OD2 ASP A 42 52.545 35.388 -40.399 1.00 23.10 O1- ATOM 0 H ASP A 42 49.178 36.970 -43.477 1.00 64.11 H new ATOM 0 HA ASP A 42 49.774 36.418 -40.673 1.00 22.32 H new ATOM 0 HB2 ASP A 42 50.957 35.183 -42.425 1.00 70.12 H new ATOM 0 HB3 ASP A 42 51.487 36.678 -43.171 1.00 70.12 H new ATOM 613 N PHE A 43 50.470 39.243 -42.220 1.00 34.33 N ATOM 614 CA PHE A 43 50.840 40.639 -42.027 1.00 42.52 C ATOM 615 C PHE A 43 50.503 41.451 -43.279 1.00 55.15 C ATOM 616 O PHE A 43 50.994 42.564 -43.468 1.00 42.21 O ATOM 617 CB PHE A 43 52.339 40.726 -41.717 1.00 45.40 C ATOM 618 CG PHE A 43 52.795 42.051 -41.168 1.00 60.21 C ATOM 619 CD1 PHE A 43 53.583 42.900 -41.931 1.00 61.42 C ATOM 620 CD2 PHE A 43 52.446 42.444 -39.886 1.00 74.23 C ATOM 621 CE1 PHE A 43 54.008 44.113 -41.428 1.00 3.13 C ATOM 622 CE2 PHE A 43 52.870 43.658 -39.379 1.00 34.35 C ATOM 623 CZ PHE A 43 53.651 44.493 -40.151 1.00 75.22 C ATOM 0 H PHE A 43 50.220 39.005 -43.180 1.00 34.33 H new ATOM 0 HA PHE A 43 50.277 41.053 -41.190 1.00 42.52 H new ATOM 0 HB2 PHE A 43 52.593 39.945 -41.000 1.00 45.40 H new ATOM 0 HB3 PHE A 43 52.897 40.515 -42.629 1.00 45.40 H new ATOM 0 HD1 PHE A 43 53.868 42.608 -42.931 1.00 61.42 H new ATOM 0 HD2 PHE A 43 51.836 41.794 -39.276 1.00 74.23 H new ATOM 0 HE1 PHE A 43 54.620 44.765 -42.034 1.00 3.13 H new ATOM 0 HE2 PHE A 43 52.590 43.953 -38.379 1.00 34.35 H new ATOM 0 HZ PHE A 43 53.982 45.442 -39.756 1.00 75.22 H new ATOM 633 N GLY A 44 49.621 40.911 -44.109 1.00 3.11 N ATOM 634 CA GLY A 44 49.353 41.520 -45.394 1.00 42.15 C ATOM 635 C GLY A 44 48.545 42.789 -45.266 1.00 3.45 C ATOM 636 O GLY A 44 48.794 43.773 -45.962 1.00 74.52 O ATOM 0 H GLY A 44 49.088 40.063 -43.915 1.00 3.11 H new ATOM 0 HA2 GLY A 44 50.296 41.741 -45.893 1.00 42.15 H new ATOM 0 HA3 GLY A 44 48.816 40.812 -46.025 1.00 42.15 H new ATOM 640 N ILE A 45 47.597 42.777 -44.347 1.00 51.24 N ATOM 641 CA ILE A 45 46.719 43.922 -44.147 1.00 71.42 C ATOM 642 C ILE A 45 47.459 45.014 -43.383 1.00 20.41 C ATOM 643 O ILE A 45 47.083 46.187 -43.405 1.00 25.51 O ATOM 644 CB ILE A 45 45.434 43.518 -43.385 1.00 34.42 C ATOM 645 CG1 ILE A 45 44.746 42.355 -44.104 1.00 11.31 C ATOM 646 CG2 ILE A 45 44.481 44.702 -43.258 1.00 54.24 C ATOM 647 CD1 ILE A 45 43.495 41.854 -43.413 1.00 75.24 C ATOM 0 H ILE A 45 47.413 41.989 -43.726 1.00 51.24 H new ATOM 0 HA ILE A 45 46.424 44.300 -45.126 1.00 71.42 H new ATOM 0 HB ILE A 45 45.713 43.201 -42.380 1.00 34.42 H new ATOM 0 HG12 ILE A 45 44.488 42.669 -45.116 1.00 11.31 H new ATOM 0 HG13 ILE A 45 45.452 41.530 -44.196 1.00 11.31 H new ATOM 0 HG21 ILE A 45 43.586 44.392 -42.719 1.00 54.24 H new ATOM 0 HG22 ILE A 45 44.972 45.508 -42.713 1.00 54.24 H new ATOM 0 HG23 ILE A 45 44.203 45.053 -44.252 1.00 54.24 H new ATOM 0 HD11 ILE A 45 43.068 41.030 -43.985 1.00 75.24 H new ATOM 0 HD12 ILE A 45 43.747 41.507 -42.411 1.00 75.24 H new ATOM 0 HD13 ILE A 45 42.768 42.663 -43.345 1.00 75.24 H new ATOM 659 N GLU A 46 48.540 44.620 -42.732 1.00 65.21 N ATOM 660 CA GLU A 46 49.319 45.541 -41.926 1.00 41.54 C ATOM 661 C GLU A 46 50.498 46.106 -42.712 1.00 5.12 C ATOM 662 O GLU A 46 51.365 46.772 -42.146 1.00 43.23 O ATOM 663 CB GLU A 46 49.815 44.839 -40.664 1.00 55.55 C ATOM 664 CG GLU A 46 48.692 44.347 -39.767 1.00 14.53 C ATOM 665 CD GLU A 46 47.868 45.482 -39.191 1.00 0.14 C ATOM 666 OE1 GLU A 46 48.173 45.925 -38.066 1.00 65.32 O ATOM 667 OE2 GLU A 46 46.912 45.934 -39.855 1.00 5.55 O1- ATOM 0 H GLU A 46 48.898 43.665 -42.747 1.00 65.21 H new ATOM 0 HA GLU A 46 48.674 46.374 -41.645 1.00 41.54 H new ATOM 0 HB2 GLU A 46 50.439 43.992 -40.950 1.00 55.55 H new ATOM 0 HB3 GLU A 46 50.447 45.525 -40.100 1.00 55.55 H new ATOM 0 HG2 GLU A 46 48.042 43.683 -40.336 1.00 14.53 H new ATOM 0 HG3 GLU A 46 49.114 43.759 -38.952 1.00 14.53 H new ATOM 674 N THR A 47 50.532 45.837 -44.011 1.00 53.34 N ATOM 675 CA THR A 47 51.560 46.398 -44.876 1.00 11.21 C ATOM 676 C THR A 47 50.931 47.326 -45.914 1.00 2.33 C ATOM 677 O THR A 47 50.575 46.894 -47.010 1.00 31.14 O ATOM 678 CB THR A 47 52.364 45.305 -45.603 1.00 14.13 C ATOM 679 OG1 THR A 47 52.755 44.275 -44.685 1.00 60.32 O ATOM 680 CG2 THR A 47 53.607 45.897 -46.252 1.00 31.14 C ATOM 0 H THR A 47 49.861 45.235 -44.487 1.00 53.34 H new ATOM 0 HA THR A 47 52.243 46.958 -44.237 1.00 11.21 H new ATOM 0 HB THR A 47 51.726 44.876 -46.375 1.00 14.13 H new ATOM 0 HG1 THR A 47 51.961 43.781 -44.390 1.00 60.32 H new ATOM 0 HG21 THR A 47 54.162 45.109 -46.761 1.00 31.14 H new ATOM 0 HG22 THR A 47 53.313 46.658 -46.975 1.00 31.14 H new ATOM 0 HG23 THR A 47 54.238 46.348 -45.486 1.00 31.14 H new ATOM 688 N PRO A 48 50.737 48.606 -45.564 1.00 63.35 N ATOM 689 CA PRO A 48 50.147 49.577 -46.475 1.00 21.13 C ATOM 690 C PRO A 48 51.150 50.058 -47.523 1.00 23.22 C ATOM 691 O PRO A 48 51.817 51.080 -47.345 1.00 30.10 O ATOM 692 CB PRO A 48 49.723 50.714 -45.546 1.00 72.10 C ATOM 693 CG PRO A 48 50.678 50.649 -44.403 1.00 2.42 C ATOM 694 CD PRO A 48 51.077 49.203 -44.258 1.00 3.12 C ATOM 0 HA PRO A 48 49.320 49.164 -47.053 1.00 21.13 H new ATOM 0 HB2 PRO A 48 49.776 51.678 -46.051 1.00 72.10 H new ATOM 0 HB3 PRO A 48 48.694 50.587 -45.209 1.00 72.10 H new ATOM 0 HG2 PRO A 48 51.550 51.275 -44.591 1.00 2.42 H new ATOM 0 HG3 PRO A 48 50.213 51.016 -43.488 1.00 2.42 H new ATOM 0 HD2 PRO A 48 52.140 49.102 -44.038 1.00 3.12 H new ATOM 0 HD3 PRO A 48 50.536 48.719 -43.445 1.00 3.12 H new ATOM 702 N SER A 49 51.276 49.292 -48.599 1.00 1.52 N ATOM 703 CA SER A 49 52.190 49.632 -49.678 1.00 71.45 C ATOM 704 C SER A 49 51.531 50.575 -50.682 1.00 5.40 C ATOM 705 O SER A 49 51.739 51.785 -50.636 1.00 55.33 O ATOM 706 CB SER A 49 52.666 48.359 -50.380 1.00 4.01 C ATOM 707 OG SER A 49 53.169 47.429 -49.443 1.00 52.25 O ATOM 0 H SER A 49 50.754 48.428 -48.746 1.00 1.52 H new ATOM 0 HA SER A 49 53.049 50.147 -49.248 1.00 71.45 H new ATOM 0 HB2 SER A 49 51.840 47.913 -50.934 1.00 4.01 H new ATOM 0 HB3 SER A 49 53.441 48.606 -51.106 1.00 4.01 H new ATOM 0 HG SER A 49 53.467 46.621 -49.911 1.00 52.25 H new ATOM 713 N ALA A 50 50.722 50.025 -51.577 1.00 4.34 N ATOM 714 CA ALA A 50 50.083 50.831 -52.607 1.00 71.23 C ATOM 715 C ALA A 50 48.695 51.284 -52.175 1.00 52.43 C ATOM 716 O ALA A 50 48.289 52.415 -52.443 1.00 63.35 O ATOM 717 CB ALA A 50 50.008 50.054 -53.910 1.00 52.42 C ATOM 0 H ALA A 50 50.494 49.031 -51.611 1.00 4.34 H new ATOM 0 HA ALA A 50 50.690 51.723 -52.762 1.00 71.23 H new ATOM 0 HB1 ALA A 50 49.528 50.668 -54.672 1.00 52.42 H new ATOM 0 HB2 ALA A 50 51.015 49.792 -54.236 1.00 52.42 H new ATOM 0 HB3 ALA A 50 49.427 49.144 -53.758 1.00 52.42 H new ATOM 723 N LEU A 51 47.983 50.401 -51.483 1.00 14.24 N ATOM 724 CA LEU A 51 46.624 50.682 -51.012 1.00 65.24 C ATOM 725 C LEU A 51 46.621 51.781 -49.955 1.00 54.11 C ATOM 726 O LEU A 51 45.575 52.339 -49.632 1.00 73.42 O ATOM 727 CB LEU A 51 45.983 49.420 -50.418 1.00 34.13 C ATOM 728 CG LEU A 51 46.619 48.909 -49.114 1.00 14.14 C ATOM 729 CD1 LEU A 51 45.608 48.126 -48.299 1.00 42.24 C ATOM 730 CD2 LEU A 51 47.837 48.039 -49.399 1.00 32.32 C ATOM 0 H LEU A 51 48.326 49.474 -51.232 1.00 14.24 H new ATOM 0 HA LEU A 51 46.047 51.015 -51.875 1.00 65.24 H new ATOM 0 HB2 LEU A 51 44.928 49.621 -50.233 1.00 34.13 H new ATOM 0 HB3 LEU A 51 46.030 48.624 -51.162 1.00 34.13 H new ATOM 0 HG LEU A 51 46.942 49.778 -48.541 1.00 14.14 H new ATOM 0 HD11 LEU A 51 46.076 47.773 -47.380 1.00 42.24 H new ATOM 0 HD12 LEU A 51 44.764 48.769 -48.052 1.00 42.24 H new ATOM 0 HD13 LEU A 51 45.256 47.272 -48.878 1.00 42.24 H new ATOM 0 HD21 LEU A 51 48.265 47.693 -48.458 1.00 32.32 H new ATOM 0 HD22 LEU A 51 47.538 47.180 -50.000 1.00 32.32 H new ATOM 0 HD23 LEU A 51 48.581 48.621 -49.943 1.00 32.32 H new ATOM 742 N ASP A 52 47.804 52.085 -49.439 1.00 2.23 N ATOM 743 CA ASP A 52 47.978 53.041 -48.346 1.00 12.25 C ATOM 744 C ASP A 52 47.238 54.356 -48.595 1.00 34.31 C ATOM 745 O ASP A 52 46.441 54.791 -47.763 1.00 33.15 O ATOM 746 CB ASP A 52 49.467 53.308 -48.153 1.00 5.20 C ATOM 747 CG ASP A 52 49.751 54.399 -47.144 1.00 62.52 C ATOM 748 OD1 ASP A 52 49.881 55.570 -47.554 1.00 12.41 O ATOM 749 OD2 ASP A 52 49.875 54.086 -45.945 1.00 63.02 O1- ATOM 0 H ASP A 52 48.678 51.674 -49.767 1.00 2.23 H new ATOM 0 HA ASP A 52 47.549 52.603 -47.445 1.00 12.25 H new ATOM 0 HB2 ASP A 52 49.956 52.388 -47.831 1.00 5.20 H new ATOM 0 HB3 ASP A 52 49.907 53.585 -49.111 1.00 5.20 H new ATOM 754 N ASN A 53 47.491 54.971 -49.742 1.00 61.25 N ATOM 755 CA ASN A 53 46.868 56.252 -50.070 1.00 42.12 C ATOM 756 C ASN A 53 45.377 56.089 -50.350 1.00 63.01 C ATOM 757 O ASN A 53 44.582 56.993 -50.085 1.00 23.25 O ATOM 758 CB ASN A 53 47.551 56.891 -51.279 1.00 44.53 C ATOM 759 CG ASN A 53 48.785 57.701 -50.915 1.00 73.01 C ATOM 760 OD1 ASN A 53 49.129 58.661 -51.606 1.00 72.42 O ATOM 761 ND2 ASN A 53 49.460 57.332 -49.834 1.00 31.23 N ATOM 0 H ASN A 53 48.119 54.609 -50.459 1.00 61.25 H new ATOM 0 HA ASN A 53 46.988 56.904 -49.205 1.00 42.12 H new ATOM 0 HB2 ASN A 53 47.833 56.109 -51.983 1.00 44.53 H new ATOM 0 HB3 ASN A 53 46.838 57.538 -51.790 1.00 44.53 H new ATOM 0 HD21 ASN A 53 50.293 57.849 -49.552 1.00 31.23 H new ATOM 0 HD22 ASN A 53 49.146 56.532 -49.285 1.00 31.23 H new ATOM 768 N PHE A 54 45.004 54.932 -50.877 1.00 22.14 N ATOM 769 CA PHE A 54 43.613 54.656 -51.222 1.00 43.23 C ATOM 770 C PHE A 54 42.757 54.574 -49.959 1.00 0.30 C ATOM 771 O PHE A 54 41.670 55.148 -49.897 1.00 51.31 O ATOM 772 CB PHE A 54 43.525 53.350 -52.020 1.00 64.13 C ATOM 773 CG PHE A 54 42.146 53.026 -52.521 1.00 32.43 C ATOM 774 CD1 PHE A 54 41.443 51.949 -52.009 1.00 20.25 C ATOM 775 CD2 PHE A 54 41.556 53.802 -53.503 1.00 52.44 C ATOM 776 CE1 PHE A 54 40.174 51.651 -52.466 1.00 74.25 C ATOM 777 CE2 PHE A 54 40.287 53.510 -53.967 1.00 41.13 C ATOM 778 CZ PHE A 54 39.595 52.432 -53.447 1.00 1.54 C ATOM 0 H PHE A 54 45.646 54.165 -51.076 1.00 22.14 H new ATOM 0 HA PHE A 54 43.232 55.470 -51.838 1.00 43.23 H new ATOM 0 HB2 PHE A 54 44.204 53.411 -52.871 1.00 64.13 H new ATOM 0 HB3 PHE A 54 43.873 52.530 -51.392 1.00 64.13 H new ATOM 0 HD1 PHE A 54 41.892 51.334 -51.243 1.00 20.25 H new ATOM 0 HD2 PHE A 54 42.093 54.645 -53.912 1.00 52.44 H new ATOM 0 HE1 PHE A 54 39.636 50.809 -52.057 1.00 74.25 H new ATOM 0 HE2 PHE A 54 39.837 54.123 -54.734 1.00 41.13 H new ATOM 0 HZ PHE A 54 38.603 52.201 -53.807 1.00 1.54 H new ATOM 788 N THR A 55 43.272 53.873 -48.956 1.00 75.41 N ATOM 789 CA THR A 55 42.599 53.731 -47.669 1.00 62.12 C ATOM 790 C THR A 55 42.273 55.094 -47.051 1.00 21.25 C ATOM 791 O THR A 55 41.210 55.293 -46.455 1.00 1.24 O ATOM 792 CB THR A 55 43.493 52.934 -46.699 1.00 4.21 C ATOM 793 OG1 THR A 55 43.789 51.651 -47.258 1.00 21.43 O ATOM 794 CG2 THR A 55 42.835 52.762 -45.340 1.00 4.31 C ATOM 0 H THR A 55 44.167 53.387 -49.011 1.00 75.41 H new ATOM 0 HA THR A 55 41.663 53.200 -47.840 1.00 62.12 H new ATOM 0 HB THR A 55 44.415 53.498 -46.555 1.00 4.21 H new ATOM 0 HG1 THR A 55 44.454 51.750 -47.971 1.00 21.43 H new ATOM 0 HG21 THR A 55 43.496 52.195 -44.685 1.00 4.31 H new ATOM 0 HG22 THR A 55 42.643 53.742 -44.902 1.00 4.31 H new ATOM 0 HG23 THR A 55 41.893 52.226 -45.457 1.00 4.31 H new ATOM 802 N GLN A 56 43.178 56.039 -47.233 1.00 32.54 N ATOM 803 CA GLN A 56 43.059 57.348 -46.607 1.00 40.22 C ATOM 804 C GLN A 56 42.095 58.232 -47.384 1.00 42.31 C ATOM 805 O GLN A 56 41.394 59.063 -46.806 1.00 33.50 O ATOM 806 CB GLN A 56 44.435 58.000 -46.498 1.00 24.31 C ATOM 807 CG GLN A 56 45.369 57.245 -45.568 1.00 3.12 C ATOM 808 CD GLN A 56 46.802 57.722 -45.649 1.00 23.51 C ATOM 809 OE1 GLN A 56 47.067 58.887 -45.939 1.00 22.43 O ATOM 810 NE2 GLN A 56 47.732 56.819 -45.395 1.00 51.20 N ATOM 0 H GLN A 56 44.009 55.925 -47.813 1.00 32.54 H new ATOM 0 HA GLN A 56 42.655 57.222 -45.602 1.00 40.22 H new ATOM 0 HB2 GLN A 56 44.885 58.058 -47.489 1.00 24.31 H new ATOM 0 HB3 GLN A 56 44.321 59.023 -46.139 1.00 24.31 H new ATOM 0 HG2 GLN A 56 45.015 57.351 -44.543 1.00 3.12 H new ATOM 0 HG3 GLN A 56 45.332 56.183 -45.810 1.00 3.12 H new ATOM 0 HE21 GLN A 56 47.464 55.864 -45.158 1.00 51.20 H new ATOM 0 HE22 GLN A 56 48.718 57.077 -45.435 1.00 51.20 H new ATOM 819 N ALA A 57 42.046 58.029 -48.694 1.00 43.12 N ATOM 820 CA ALA A 57 41.103 58.742 -49.545 1.00 74.22 C ATOM 821 C ALA A 57 39.672 58.373 -49.172 1.00 13.44 C ATOM 822 O ALA A 57 38.737 59.143 -49.393 1.00 44.41 O ATOM 823 CB ALA A 57 41.370 58.427 -51.010 1.00 32.32 C ATOM 0 H ALA A 57 42.650 57.375 -49.191 1.00 43.12 H new ATOM 0 HA ALA A 57 41.235 59.813 -49.393 1.00 74.22 H new ATOM 0 HB1 ALA A 57 40.658 58.967 -51.634 1.00 32.32 H new ATOM 0 HB2 ALA A 57 42.384 58.733 -51.269 1.00 32.32 H new ATOM 0 HB3 ALA A 57 41.260 57.356 -51.178 1.00 32.32 H new ATOM 829 N ILE A 58 39.509 57.191 -48.594 1.00 52.41 N ATOM 830 CA ILE A 58 38.198 56.729 -48.178 1.00 43.42 C ATOM 831 C ILE A 58 37.862 57.230 -46.779 1.00 42.32 C ATOM 832 O ILE A 58 36.763 57.719 -46.541 1.00 2.22 O ATOM 833 CB ILE A 58 38.090 55.195 -48.212 1.00 4.31 C ATOM 834 CG1 ILE A 58 38.623 54.668 -49.546 1.00 33.32 C ATOM 835 CG2 ILE A 58 36.644 54.767 -47.992 1.00 22.11 C ATOM 836 CD1 ILE A 58 38.079 53.312 -49.935 1.00 75.03 C ATOM 0 H ILE A 58 40.269 56.538 -48.404 1.00 52.41 H new ATOM 0 HA ILE A 58 37.482 57.138 -48.890 1.00 43.42 H new ATOM 0 HB ILE A 58 38.694 54.772 -47.409 1.00 4.31 H new ATOM 0 HG12 ILE A 58 38.380 55.384 -50.331 1.00 33.32 H new ATOM 0 HG13 ILE A 58 39.710 54.610 -49.493 1.00 33.32 H new ATOM 0 HG21 ILE A 58 36.579 53.679 -48.018 1.00 22.11 H new ATOM 0 HG22 ILE A 58 36.301 55.128 -47.022 1.00 22.11 H new ATOM 0 HG23 ILE A 58 36.017 55.187 -48.778 1.00 22.11 H new ATOM 0 HD11 ILE A 58 38.505 53.010 -50.892 1.00 75.03 H new ATOM 0 HD12 ILE A 58 38.345 52.581 -49.172 1.00 75.03 H new ATOM 0 HD13 ILE A 58 36.994 53.367 -50.022 1.00 75.03 H new ATOM 848 N GLN A 59 38.808 57.127 -45.856 1.00 20.32 N ATOM 849 CA GLN A 59 38.581 57.592 -44.488 1.00 43.14 C ATOM 850 C GLN A 59 38.238 59.080 -44.458 1.00 30.01 C ATOM 851 O GLN A 59 37.480 59.534 -43.602 1.00 22.32 O ATOM 852 CB GLN A 59 39.800 57.306 -43.610 1.00 0.24 C ATOM 853 CG GLN A 59 39.991 55.829 -43.310 1.00 33.03 C ATOM 854 CD GLN A 59 41.148 55.565 -42.368 1.00 32.54 C ATOM 855 OE1 GLN A 59 41.488 56.405 -41.533 1.00 24.13 O ATOM 856 NE2 GLN A 59 41.749 54.390 -42.483 1.00 51.23 N ATOM 0 H GLN A 59 39.733 56.730 -46.023 1.00 20.32 H new ATOM 0 HA GLN A 59 37.729 57.042 -44.088 1.00 43.14 H new ATOM 0 HB2 GLN A 59 40.693 57.688 -44.105 1.00 0.24 H new ATOM 0 HB3 GLN A 59 39.699 57.850 -42.671 1.00 0.24 H new ATOM 0 HG2 GLN A 59 39.075 55.430 -42.874 1.00 33.03 H new ATOM 0 HG3 GLN A 59 40.159 55.292 -44.244 1.00 33.03 H new ATOM 0 HE21 GLN A 59 41.435 53.724 -43.189 1.00 51.23 H new ATOM 0 HE22 GLN A 59 42.525 54.152 -41.866 1.00 51.23 H new ATOM 865 N SER A 60 38.772 59.827 -45.416 1.00 51.04 N ATOM 866 CA SER A 60 38.492 61.252 -45.521 1.00 11.41 C ATOM 867 C SER A 60 37.023 61.502 -45.878 1.00 54.31 C ATOM 868 O SER A 60 36.403 62.432 -45.365 1.00 71.15 O ATOM 869 CB SER A 60 39.407 61.887 -46.569 1.00 73.34 C ATOM 870 OG SER A 60 40.773 61.658 -46.260 1.00 3.51 O ATOM 0 H SER A 60 39.403 59.468 -46.133 1.00 51.04 H new ATOM 0 HA SER A 60 38.685 61.711 -44.551 1.00 11.41 H new ATOM 0 HB2 SER A 60 39.179 61.476 -47.552 1.00 73.34 H new ATOM 0 HB3 SER A 60 39.217 62.959 -46.620 1.00 73.34 H new ATOM 0 HG SER A 60 40.980 60.707 -46.378 1.00 3.51 H new ATOM 876 N GLN A 61 36.460 60.659 -46.740 1.00 30.10 N ATOM 877 CA GLN A 61 35.073 60.836 -47.169 1.00 24.42 C ATOM 878 C GLN A 61 34.105 60.229 -46.153 1.00 14.32 C ATOM 879 O GLN A 61 32.934 60.609 -46.092 1.00 1.12 O ATOM 880 CB GLN A 61 34.847 60.247 -48.570 1.00 64.21 C ATOM 881 CG GLN A 61 35.016 58.741 -48.656 1.00 32.32 C ATOM 882 CD GLN A 61 34.859 58.224 -50.070 1.00 64.01 C ATOM 883 OE1 GLN A 61 33.760 57.869 -50.500 1.00 52.54 O ATOM 884 NE2 GLN A 61 35.958 58.183 -50.804 1.00 61.52 N ATOM 0 H GLN A 61 36.935 59.856 -47.152 1.00 30.10 H new ATOM 0 HA GLN A 61 34.873 61.906 -47.224 1.00 24.42 H new ATOM 0 HB2 GLN A 61 33.841 60.506 -48.901 1.00 64.21 H new ATOM 0 HB3 GLN A 61 35.543 60.718 -49.265 1.00 64.21 H new ATOM 0 HG2 GLN A 61 36.001 58.466 -48.279 1.00 32.32 H new ATOM 0 HG3 GLN A 61 34.282 58.258 -48.011 1.00 32.32 H new ATOM 0 HE21 GLN A 61 36.847 58.487 -50.408 1.00 61.52 H new ATOM 0 HE22 GLN A 61 35.916 57.848 -51.766 1.00 61.52 H new ATOM 893 N ILE A 62 34.610 59.310 -45.335 1.00 25.21 N ATOM 894 CA ILE A 62 33.805 58.696 -44.285 1.00 60.23 C ATOM 895 C ILE A 62 33.438 59.739 -43.236 1.00 4.22 C ATOM 896 O ILE A 62 32.367 59.681 -42.632 1.00 73.53 O ATOM 897 CB ILE A 62 34.543 57.513 -43.610 1.00 31.41 C ATOM 898 CG1 ILE A 62 34.783 56.392 -44.622 1.00 75.12 C ATOM 899 CG2 ILE A 62 33.748 56.988 -42.415 1.00 11.33 C ATOM 900 CD1 ILE A 62 35.591 55.236 -44.069 1.00 54.33 C ATOM 0 H ILE A 62 35.572 58.975 -45.379 1.00 25.21 H new ATOM 0 HA ILE A 62 32.900 58.304 -44.749 1.00 60.23 H new ATOM 0 HB ILE A 62 35.506 57.872 -43.248 1.00 31.41 H new ATOM 0 HG12 ILE A 62 33.821 56.017 -44.971 1.00 75.12 H new ATOM 0 HG13 ILE A 62 35.299 56.802 -45.490 1.00 75.12 H new ATOM 0 HG21 ILE A 62 34.285 56.158 -41.957 1.00 11.33 H new ATOM 0 HG22 ILE A 62 33.621 57.786 -41.683 1.00 11.33 H new ATOM 0 HG23 ILE A 62 32.769 56.645 -42.751 1.00 11.33 H new ATOM 0 HD11 ILE A 62 35.721 54.480 -44.843 1.00 54.33 H new ATOM 0 HD12 ILE A 62 36.568 55.596 -43.746 1.00 54.33 H new ATOM 0 HD13 ILE A 62 35.067 54.799 -43.219 1.00 54.33 H new ATOM 912 N LEU A 63 34.327 60.712 -43.053 1.00 64.35 N ATOM 913 CA LEU A 63 34.108 61.804 -42.109 1.00 53.53 C ATOM 914 C LEU A 63 32.822 62.559 -42.437 1.00 34.31 C ATOM 915 O LEU A 63 32.137 63.060 -41.543 1.00 74.53 O ATOM 916 CB LEU A 63 35.300 62.766 -42.134 1.00 24.15 C ATOM 917 CG LEU A 63 36.649 62.145 -41.760 1.00 14.34 C ATOM 918 CD1 LEU A 63 37.764 63.171 -41.892 1.00 52.54 C ATOM 919 CD2 LEU A 63 36.605 61.585 -40.345 1.00 61.01 C ATOM 0 H LEU A 63 35.215 60.766 -43.552 1.00 64.35 H new ATOM 0 HA LEU A 63 34.010 61.378 -41.110 1.00 53.53 H new ATOM 0 HB2 LEU A 63 35.380 63.194 -43.133 1.00 24.15 H new ATOM 0 HB3 LEU A 63 35.096 63.590 -41.450 1.00 24.15 H new ATOM 0 HG LEU A 63 36.852 61.325 -42.449 1.00 14.34 H new ATOM 0 HD11 LEU A 63 38.715 62.712 -41.622 1.00 52.54 H new ATOM 0 HD12 LEU A 63 37.812 63.526 -42.921 1.00 52.54 H new ATOM 0 HD13 LEU A 63 37.566 64.012 -41.227 1.00 52.54 H new ATOM 0 HD21 LEU A 63 37.572 61.148 -40.097 1.00 61.01 H new ATOM 0 HD22 LEU A 63 36.378 62.387 -39.643 1.00 61.01 H new ATOM 0 HD23 LEU A 63 35.833 60.818 -40.281 1.00 61.01 H new ATOM 931 N GLY A 64 32.500 62.635 -43.723 1.00 54.14 N ATOM 932 CA GLY A 64 31.267 63.270 -44.148 1.00 43.53 C ATOM 933 C GLY A 64 30.064 62.398 -43.862 1.00 42.50 C ATOM 934 O GLY A 64 29.026 62.882 -43.420 1.00 45.41 O ATOM 0 H GLY A 64 33.074 62.266 -44.482 1.00 54.14 H new ATOM 0 HA2 GLY A 64 31.154 64.226 -43.636 1.00 43.53 H new ATOM 0 HA3 GLY A 64 31.316 63.484 -45.216 1.00 43.53 H new ATOM 938 N GLY A 65 30.216 61.098 -44.096 1.00 25.24 N ATOM 939 CA GLY A 65 29.142 60.158 -43.823 1.00 5.50 C ATOM 940 C GLY A 65 28.795 60.094 -42.349 1.00 33.53 C ATOM 941 O GLY A 65 27.666 59.769 -41.975 1.00 11.34 O ATOM 0 H GLY A 65 31.066 60.677 -44.471 1.00 25.24 H new ATOM 0 HA2 GLY A 65 28.257 60.446 -44.390 1.00 5.50 H new ATOM 0 HA3 GLY A 65 29.433 59.166 -44.169 1.00 5.50 H new ATOM 945 N LEU A 66 29.770 60.419 -41.510 1.00 53.33 N ATOM 946 CA LEU A 66 29.571 60.434 -40.067 1.00 72.23 C ATOM 947 C LEU A 66 28.587 61.529 -39.664 1.00 34.12 C ATOM 948 O LEU A 66 28.017 61.490 -38.580 1.00 33.03 O ATOM 949 CB LEU A 66 30.903 60.631 -39.342 1.00 31.31 C ATOM 950 CG LEU A 66 31.921 59.504 -39.521 1.00 64.21 C ATOM 951 CD1 LEU A 66 33.210 59.834 -38.783 1.00 22.03 C ATOM 952 CD2 LEU A 66 31.347 58.181 -39.027 1.00 65.03 C ATOM 0 H LEU A 66 30.711 60.677 -41.806 1.00 53.33 H new ATOM 0 HA LEU A 66 29.153 59.470 -39.776 1.00 72.23 H new ATOM 0 HB2 LEU A 66 31.352 61.562 -39.689 1.00 31.31 H new ATOM 0 HB3 LEU A 66 30.703 60.751 -38.277 1.00 31.31 H new ATOM 0 HG LEU A 66 32.145 59.405 -40.583 1.00 64.21 H new ATOM 0 HD11 LEU A 66 33.925 59.023 -38.919 1.00 22.03 H new ATOM 0 HD12 LEU A 66 33.630 60.758 -39.180 1.00 22.03 H new ATOM 0 HD13 LEU A 66 33.000 59.957 -37.721 1.00 22.03 H new ATOM 0 HD21 LEU A 66 32.085 57.391 -39.162 1.00 65.03 H new ATOM 0 HD22 LEU A 66 31.096 58.266 -37.970 1.00 65.03 H new ATOM 0 HD23 LEU A 66 30.449 57.939 -39.595 1.00 65.03 H new ATOM 964 N LEU A 67 28.374 62.493 -40.552 1.00 53.21 N ATOM 965 CA LEU A 67 27.434 63.580 -40.294 1.00 64.45 C ATOM 966 C LEU A 67 26.016 63.167 -40.684 1.00 60.43 C ATOM 967 O LEU A 67 25.089 63.975 -40.656 1.00 44.24 O ATOM 968 CB LEU A 67 27.849 64.838 -41.064 1.00 51.43 C ATOM 969 CG LEU A 67 29.227 65.396 -40.704 1.00 3.00 C ATOM 970 CD1 LEU A 67 29.553 66.608 -41.563 1.00 70.32 C ATOM 971 CD2 LEU A 67 29.282 65.761 -39.228 1.00 22.21 C ATOM 0 H LEU A 67 28.839 62.545 -41.458 1.00 53.21 H new ATOM 0 HA LEU A 67 27.450 63.801 -39.227 1.00 64.45 H new ATOM 0 HB2 LEU A 67 27.833 64.614 -42.131 1.00 51.43 H new ATOM 0 HB3 LEU A 67 27.103 65.614 -40.890 1.00 51.43 H new ATOM 0 HG LEU A 67 29.973 64.625 -40.899 1.00 3.00 H new ATOM 0 HD11 LEU A 67 30.537 66.991 -41.293 1.00 70.32 H new ATOM 0 HD12 LEU A 67 29.552 66.320 -42.614 1.00 70.32 H new ATOM 0 HD13 LEU A 67 28.804 67.383 -41.398 1.00 70.32 H new ATOM 0 HD21 LEU A 67 30.269 66.157 -38.988 1.00 22.21 H new ATOM 0 HD22 LEU A 67 28.526 66.516 -39.011 1.00 22.21 H new ATOM 0 HD23 LEU A 67 29.091 64.873 -38.626 1.00 22.21 H new ATOM 983 N SER A 68 25.861 61.903 -41.055 1.00 40.32 N ATOM 984 CA SER A 68 24.563 61.363 -41.434 1.00 11.31 C ATOM 985 C SER A 68 24.241 60.112 -40.615 1.00 75.02 C ATOM 986 O SER A 68 23.124 59.944 -40.122 1.00 75.11 O ATOM 987 CB SER A 68 24.553 61.039 -42.935 1.00 0.14 C ATOM 988 OG SER A 68 23.317 60.473 -43.339 1.00 4.11 O ATOM 0 H SER A 68 26.625 61.228 -41.101 1.00 40.32 H new ATOM 0 HA SER A 68 23.797 62.110 -41.228 1.00 11.31 H new ATOM 0 HB2 SER A 68 24.741 61.949 -43.505 1.00 0.14 H new ATOM 0 HB3 SER A 68 25.363 60.346 -43.164 1.00 0.14 H new ATOM 0 HG SER A 68 23.344 60.280 -44.299 1.00 4.11 H new ATOM 994 N ASN A 69 25.242 59.257 -40.436 1.00 22.22 N ATOM 995 CA ASN A 69 25.043 57.958 -39.793 1.00 3.21 C ATOM 996 C ASN A 69 24.888 58.068 -38.279 1.00 33.23 C ATOM 997 O ASN A 69 24.814 57.058 -37.581 1.00 41.32 O ATOM 998 CB ASN A 69 26.206 57.023 -40.124 1.00 53.44 C ATOM 999 CG ASN A 69 26.298 56.713 -41.603 1.00 25.14 C ATOM 1000 OD1 ASN A 69 25.294 56.712 -42.314 1.00 41.35 O ATOM 1001 ND2 ASN A 69 27.508 56.455 -42.079 1.00 2.13 N ATOM 0 H ASN A 69 26.203 59.438 -40.727 1.00 22.22 H new ATOM 0 HA ASN A 69 24.112 57.550 -40.187 1.00 3.21 H new ATOM 0 HB2 ASN A 69 27.139 57.478 -39.793 1.00 53.44 H new ATOM 0 HB3 ASN A 69 26.090 56.093 -39.568 1.00 53.44 H new ATOM 0 HD21 ASN A 69 27.632 56.245 -43.069 1.00 2.13 H new ATOM 0 HD22 ASN A 69 28.315 56.466 -41.455 1.00 2.13 H new ATOM 1008 N ILE A 70 24.841 59.285 -37.764 1.00 71.41 N ATOM 1009 CA ILE A 70 24.609 59.495 -36.342 1.00 54.25 C ATOM 1010 C ILE A 70 23.143 59.855 -36.108 1.00 15.54 C ATOM 1011 O ILE A 70 22.636 59.805 -34.986 1.00 23.53 O ATOM 1012 CB ILE A 70 25.537 60.600 -35.775 1.00 3.10 C ATOM 1013 CG1 ILE A 70 27.006 60.240 -36.025 1.00 23.53 C ATOM 1014 CG2 ILE A 70 25.303 60.813 -34.284 1.00 12.32 C ATOM 1015 CD1 ILE A 70 27.445 58.950 -35.359 1.00 42.43 C ATOM 0 H ILE A 70 24.960 60.141 -38.306 1.00 71.41 H new ATOM 0 HA ILE A 70 24.841 58.569 -35.815 1.00 54.25 H new ATOM 0 HB ILE A 70 25.300 61.530 -36.292 1.00 3.10 H new ATOM 0 HG12 ILE A 70 27.172 60.157 -37.099 1.00 23.53 H new ATOM 0 HG13 ILE A 70 27.635 61.055 -35.667 1.00 23.53 H new ATOM 0 HG21 ILE A 70 25.970 61.594 -33.919 1.00 12.32 H new ATOM 0 HG22 ILE A 70 24.268 61.112 -34.117 1.00 12.32 H new ATOM 0 HG23 ILE A 70 25.503 59.885 -33.748 1.00 12.32 H new ATOM 0 HD11 ILE A 70 28.495 58.764 -35.583 1.00 42.43 H new ATOM 0 HD12 ILE A 70 27.313 59.034 -34.280 1.00 42.43 H new ATOM 0 HD13 ILE A 70 26.842 58.123 -35.735 1.00 42.43 H new ATOM 1027 N ASN A 71 22.453 60.182 -37.193 1.00 10.14 N ATOM 1028 CA ASN A 71 21.045 60.558 -37.120 1.00 44.34 C ATOM 1029 C ASN A 71 20.153 59.375 -37.476 1.00 55.34 C ATOM 1030 O ASN A 71 18.940 59.517 -37.623 1.00 20.43 O ATOM 1031 CB ASN A 71 20.760 61.740 -38.052 1.00 33.10 C ATOM 1032 CG ASN A 71 21.436 63.020 -37.590 1.00 24.15 C ATOM 1033 OD1 ASN A 71 21.610 63.247 -36.392 1.00 2.11 O ATOM 1034 ND2 ASN A 71 21.825 63.863 -38.533 1.00 61.43 N ATOM 0 H ASN A 71 22.845 60.195 -38.135 1.00 10.14 H new ATOM 0 HA ASN A 71 20.823 60.859 -36.096 1.00 44.34 H new ATOM 0 HB2 ASN A 71 21.100 61.496 -39.058 1.00 33.10 H new ATOM 0 HB3 ASN A 71 19.684 61.902 -38.110 1.00 33.10 H new ATOM 0 HD21 ASN A 71 22.287 64.736 -38.278 1.00 61.43 H new ATOM 0 HD22 ASN A 71 21.663 63.640 -39.515 1.00 61.43 H new ATOM 1041 N THR A 72 20.765 58.207 -37.600 1.00 12.11 N ATOM 1042 CA THR A 72 20.040 56.982 -37.896 1.00 23.30 C ATOM 1043 C THR A 72 19.534 56.335 -36.605 1.00 44.31 C ATOM 1044 O THR A 72 19.501 56.980 -35.552 1.00 44.23 O ATOM 1045 CB THR A 72 20.934 55.993 -38.666 1.00 2.13 C ATOM 1046 OG1 THR A 72 22.187 55.839 -37.986 1.00 14.23 O ATOM 1047 CG2 THR A 72 21.177 56.477 -40.089 1.00 53.31 C ATOM 0 H THR A 72 21.772 58.082 -37.499 1.00 12.11 H new ATOM 0 HA THR A 72 19.184 57.237 -38.521 1.00 23.30 H new ATOM 0 HB THR A 72 20.423 55.031 -38.711 1.00 2.13 H new ATOM 0 HG1 THR A 72 22.751 55.208 -38.479 1.00 14.23 H new ATOM 0 HG21 THR A 72 21.811 55.762 -40.613 1.00 53.31 H new ATOM 0 HG22 THR A 72 20.224 56.567 -40.610 1.00 53.31 H new ATOM 0 HG23 THR A 72 21.670 57.449 -40.064 1.00 53.31 H new ATOM 1055 N GLY A 73 19.145 55.071 -36.681 1.00 3.13 N ATOM 1056 CA GLY A 73 18.609 54.390 -35.518 1.00 42.41 C ATOM 1057 C GLY A 73 17.214 53.857 -35.757 1.00 24.53 C ATOM 1058 O GLY A 73 16.548 53.405 -34.826 1.00 71.02 O ATOM 0 H GLY A 73 19.190 54.503 -37.527 1.00 3.13 H new ATOM 0 HA2 GLY A 73 19.269 53.566 -35.246 1.00 42.41 H new ATOM 0 HA3 GLY A 73 18.593 55.078 -34.672 1.00 42.41 H new ATOM 1062 N LYS A 74 16.761 53.941 -37.002 1.00 31.51 N ATOM 1063 CA LYS A 74 15.450 53.429 -37.383 1.00 51.44 C ATOM 1064 C LYS A 74 15.319 51.940 -37.055 1.00 44.43 C ATOM 1065 O LYS A 74 16.304 51.197 -37.097 1.00 24.01 O ATOM 1066 CB LYS A 74 15.200 53.667 -38.873 1.00 23.21 C ATOM 1067 CG LYS A 74 16.197 52.977 -39.796 1.00 4.23 C ATOM 1068 CD LYS A 74 15.823 53.182 -41.255 1.00 20.20 C ATOM 1069 CE LYS A 74 15.870 54.652 -41.640 1.00 35.24 C ATOM 1070 NZ LYS A 74 15.240 54.896 -42.962 1.00 22.45 N1+ ATOM 0 H LYS A 74 17.286 54.361 -37.769 1.00 31.51 H new ATOM 0 HA LYS A 74 14.698 53.968 -36.806 1.00 51.44 H new ATOM 0 HB2 LYS A 74 14.196 53.323 -39.120 1.00 23.21 H new ATOM 0 HB3 LYS A 74 15.226 54.739 -39.067 1.00 23.21 H new ATOM 0 HG2 LYS A 74 17.197 53.370 -39.615 1.00 4.23 H new ATOM 0 HG3 LYS A 74 16.228 51.911 -39.571 1.00 4.23 H new ATOM 0 HD2 LYS A 74 16.505 52.616 -41.890 1.00 20.20 H new ATOM 0 HD3 LYS A 74 14.822 52.790 -41.434 1.00 20.20 H new ATOM 0 HE2 LYS A 74 15.360 55.243 -40.880 1.00 35.24 H new ATOM 0 HE3 LYS A 74 16.906 54.989 -41.664 1.00 35.24 H new ATOM 0 HZ1 LYS A 74 15.782 55.619 -43.477 1.00 22.45 H new ATOM 0 HZ2 LYS A 74 15.232 54.013 -43.511 1.00 22.45 H new ATOM 0 HZ3 LYS A 74 14.264 55.227 -42.825 1.00 22.45 H new ATOM 1084 N PRO A 75 14.098 51.488 -36.720 1.00 62.34 N ATOM 1085 CA PRO A 75 13.839 50.083 -36.391 1.00 2.31 C ATOM 1086 C PRO A 75 13.855 49.175 -37.625 1.00 25.45 C ATOM 1087 O PRO A 75 13.854 47.949 -37.499 1.00 34.43 O ATOM 1088 CB PRO A 75 12.444 50.120 -35.764 1.00 60.25 C ATOM 1089 CG PRO A 75 11.784 51.312 -36.367 1.00 23.21 C ATOM 1090 CD PRO A 75 12.878 52.315 -36.618 1.00 65.03 C ATOM 0 HA PRO A 75 14.606 49.671 -35.735 1.00 2.31 H new ATOM 0 HB2 PRO A 75 11.888 49.208 -35.982 1.00 60.25 H new ATOM 0 HB3 PRO A 75 12.501 50.206 -34.679 1.00 60.25 H new ATOM 0 HG2 PRO A 75 11.277 51.048 -37.295 1.00 23.21 H new ATOM 0 HG3 PRO A 75 11.028 51.720 -35.696 1.00 23.21 H new ATOM 0 HD2 PRO A 75 12.700 52.880 -37.533 1.00 65.03 H new ATOM 0 HD3 PRO A 75 12.952 53.038 -35.806 1.00 65.03 H new ATOM 1098 N GLY A 76 13.881 49.779 -38.811 1.00 12.10 N ATOM 1099 CA GLY A 76 13.894 49.012 -40.044 1.00 14.01 C ATOM 1100 C GLY A 76 15.285 48.564 -40.430 1.00 13.34 C ATOM 1101 O GLY A 76 15.762 48.853 -41.529 1.00 72.12 O ATOM 0 H GLY A 76 13.893 50.791 -38.939 1.00 12.10 H new ATOM 0 HA2 GLY A 76 13.252 48.138 -39.932 1.00 14.01 H new ATOM 0 HA3 GLY A 76 13.473 49.615 -40.848 1.00 14.01 H new ATOM 1105 N ARG A 77 15.937 47.858 -39.521 1.00 2.44 N ATOM 1106 CA ARG A 77 17.279 47.351 -39.754 1.00 13.33 C ATOM 1107 C ARG A 77 17.235 45.848 -39.982 1.00 22.11 C ATOM 1108 O ARG A 77 16.160 45.256 -40.034 1.00 0.25 O ATOM 1109 CB ARG A 77 18.185 47.680 -38.561 1.00 21.41 C ATOM 1110 CG ARG A 77 17.654 47.161 -37.235 1.00 30.43 C ATOM 1111 CD ARG A 77 18.589 47.490 -36.085 1.00 20.32 C ATOM 1112 NE ARG A 77 18.026 47.087 -34.798 1.00 45.02 N ATOM 1113 CZ ARG A 77 18.626 47.290 -33.627 1.00 1.11 C ATOM 1114 NH1 ARG A 77 19.841 47.824 -33.580 1.00 21.40 N1+ ATOM 1115 NH2 ARG A 77 18.015 46.935 -32.505 1.00 14.15 N ATOM 0 H ARG A 77 15.554 47.621 -38.606 1.00 2.44 H new ATOM 0 HA ARG A 77 17.687 47.831 -40.644 1.00 13.33 H new ATOM 0 HB2 ARG A 77 19.174 47.257 -38.738 1.00 21.41 H new ATOM 0 HB3 ARG A 77 18.308 48.761 -38.496 1.00 21.41 H new ATOM 0 HG2 ARG A 77 16.673 47.595 -37.041 1.00 30.43 H new ATOM 0 HG3 ARG A 77 17.518 46.081 -37.296 1.00 30.43 H new ATOM 0 HD2 ARG A 77 19.544 46.988 -36.238 1.00 20.32 H new ATOM 0 HD3 ARG A 77 18.790 48.561 -36.075 1.00 20.32 H new ATOM 0 HE ARG A 77 17.118 46.622 -34.797 1.00 45.02 H new ATOM 0 HH11 ARG A 77 20.319 48.081 -34.444 1.00 21.40 H new ATOM 0 HH12 ARG A 77 20.296 47.977 -32.680 1.00 21.40 H new ATOM 0 HH21 ARG A 77 17.089 46.508 -32.541 1.00 14.15 H new ATOM 0 HH22 ARG A 77 18.471 47.089 -31.606 1.00 14.15 H new ATOM 1129 N MET A 78 18.397 45.236 -40.127 1.00 12.00 N ATOM 1130 CA MET A 78 18.478 43.796 -40.318 1.00 2.03 C ATOM 1131 C MET A 78 19.338 43.162 -39.232 1.00 70.13 C ATOM 1132 O MET A 78 20.537 43.430 -39.142 1.00 44.34 O ATOM 1133 CB MET A 78 19.047 43.473 -41.701 1.00 63.14 C ATOM 1134 CG MET A 78 19.185 41.982 -41.971 1.00 52.15 C ATOM 1135 SD MET A 78 19.833 41.626 -43.615 1.00 73.31 S ATOM 1136 CE MET A 78 19.871 39.835 -43.577 1.00 35.54 C ATOM 0 H MET A 78 19.299 45.713 -40.116 1.00 12.00 H new ATOM 0 HA MET A 78 17.472 43.382 -40.250 1.00 2.03 H new ATOM 0 HB2 MET A 78 18.402 43.913 -42.462 1.00 63.14 H new ATOM 0 HB3 MET A 78 20.025 43.944 -41.801 1.00 63.14 H new ATOM 0 HG2 MET A 78 19.844 41.542 -41.223 1.00 52.15 H new ATOM 0 HG3 MET A 78 18.211 41.505 -41.858 1.00 52.15 H new ATOM 0 HE1 MET A 78 20.250 39.459 -44.527 1.00 35.54 H new ATOM 0 HE2 MET A 78 20.522 39.502 -42.769 1.00 35.54 H new ATOM 0 HE3 MET A 78 18.864 39.453 -43.412 1.00 35.54 H new ATOM 1146 N VAL A 79 18.721 42.325 -38.411 1.00 63.22 N ATOM 1147 CA VAL A 79 19.426 41.673 -37.319 1.00 53.31 C ATOM 1148 C VAL A 79 20.109 40.400 -37.803 1.00 34.33 C ATOM 1149 O VAL A 79 19.482 39.345 -37.936 1.00 23.05 O ATOM 1150 CB VAL A 79 18.480 41.345 -36.140 1.00 51.15 C ATOM 1151 CG1 VAL A 79 19.249 40.714 -34.991 1.00 62.34 C ATOM 1152 CG2 VAL A 79 17.753 42.593 -35.672 1.00 20.14 C ATOM 0 H VAL A 79 17.733 42.082 -38.481 1.00 63.22 H new ATOM 0 HA VAL A 79 20.182 42.372 -36.962 1.00 53.31 H new ATOM 0 HB VAL A 79 17.739 40.627 -36.491 1.00 51.15 H new ATOM 0 HG11 VAL A 79 18.564 40.492 -34.173 1.00 62.34 H new ATOM 0 HG12 VAL A 79 19.719 39.791 -35.331 1.00 62.34 H new ATOM 0 HG13 VAL A 79 20.016 41.406 -34.644 1.00 62.34 H new ATOM 0 HG21 VAL A 79 17.093 42.340 -34.842 1.00 20.14 H new ATOM 0 HG22 VAL A 79 18.480 43.336 -35.344 1.00 20.14 H new ATOM 0 HG23 VAL A 79 17.164 43.000 -36.493 1.00 20.14 H new ATOM 1162 N THR A 80 21.392 40.523 -38.094 1.00 24.24 N ATOM 1163 CA THR A 80 22.199 39.396 -38.522 1.00 43.31 C ATOM 1164 C THR A 80 23.248 39.103 -37.448 1.00 22.22 C ATOM 1165 O THR A 80 23.691 40.013 -36.747 1.00 20.53 O ATOM 1166 CB THR A 80 22.875 39.692 -39.877 1.00 4.42 C ATOM 1167 OG1 THR A 80 21.920 40.285 -40.766 1.00 23.43 O ATOM 1168 CG2 THR A 80 23.427 38.423 -40.511 1.00 23.11 C ATOM 0 H THR A 80 21.902 41.405 -38.040 1.00 24.24 H new ATOM 0 HA THR A 80 21.561 38.522 -38.656 1.00 43.31 H new ATOM 0 HB THR A 80 23.705 40.376 -39.700 1.00 4.42 H new ATOM 0 HG1 THR A 80 22.348 40.475 -41.627 1.00 23.43 H new ATOM 0 HG21 THR A 80 23.896 38.667 -41.464 1.00 23.11 H new ATOM 0 HG22 THR A 80 24.166 37.976 -39.846 1.00 23.11 H new ATOM 0 HG23 THR A 80 22.614 37.716 -40.677 1.00 23.11 H new ATOM 1176 N ASN A 81 23.628 37.840 -37.310 1.00 12.13 N ATOM 1177 CA ASN A 81 24.464 37.413 -36.192 1.00 13.33 C ATOM 1178 C ASN A 81 25.908 37.876 -36.349 1.00 53.52 C ATOM 1179 O ASN A 81 26.422 38.616 -35.510 1.00 72.31 O ATOM 1180 CB ASN A 81 24.413 35.889 -36.036 1.00 31.34 C ATOM 1181 CG ASN A 81 23.014 35.389 -35.725 1.00 23.22 C ATOM 1182 OD1 ASN A 81 22.219 36.081 -35.086 1.00 55.05 O ATOM 1183 ND2 ASN A 81 22.700 34.186 -36.177 1.00 51.02 N ATOM 0 H ASN A 81 23.372 37.093 -37.956 1.00 12.13 H new ATOM 0 HA ASN A 81 24.064 37.880 -35.292 1.00 13.33 H new ATOM 0 HB2 ASN A 81 24.769 35.420 -36.953 1.00 31.34 H new ATOM 0 HB3 ASN A 81 25.091 35.585 -35.239 1.00 31.34 H new ATOM 0 HD21 ASN A 81 21.772 33.801 -36.000 1.00 51.02 H new ATOM 0 HD22 ASN A 81 23.386 33.644 -36.702 1.00 51.02 H new ATOM 1190 N ASP A 82 26.556 37.455 -37.427 1.00 32.11 N ATOM 1191 CA ASP A 82 27.976 37.744 -37.621 1.00 24.13 C ATOM 1192 C ASP A 82 28.186 39.131 -38.206 1.00 61.51 C ATOM 1193 O ASP A 82 29.302 39.650 -38.212 1.00 75.51 O ATOM 1194 CB ASP A 82 28.623 36.711 -38.543 1.00 23.52 C ATOM 1195 CG ASP A 82 28.513 35.302 -38.012 1.00 72.21 C ATOM 1196 OD1 ASP A 82 27.709 34.523 -38.564 1.00 63.25 O ATOM 1197 OD2 ASP A 82 29.223 34.966 -37.046 1.00 30.43 O1- ATOM 0 H ASP A 82 26.127 36.915 -38.178 1.00 32.11 H new ATOM 0 HA ASP A 82 28.446 37.699 -36.639 1.00 24.13 H new ATOM 0 HB2 ASP A 82 28.153 36.762 -39.525 1.00 23.52 H new ATOM 0 HB3 ASP A 82 29.675 36.962 -38.680 1.00 23.52 H new ATOM 1202 N TYR A 83 27.119 39.722 -38.708 1.00 2.10 N ATOM 1203 CA TYR A 83 27.198 41.030 -39.338 1.00 61.22 C ATOM 1204 C TYR A 83 26.076 41.928 -38.842 1.00 25.13 C ATOM 1205 O TYR A 83 24.902 41.593 -38.973 1.00 35.42 O ATOM 1206 CB TYR A 83 27.132 40.902 -40.867 1.00 22.35 C ATOM 1207 CG TYR A 83 28.381 40.314 -41.495 1.00 63.34 C ATOM 1208 CD1 TYR A 83 29.317 41.133 -42.115 1.00 54.31 C ATOM 1209 CD2 TYR A 83 28.630 38.948 -41.456 1.00 61.31 C ATOM 1210 CE1 TYR A 83 30.466 40.607 -42.680 1.00 54.50 C ATOM 1211 CE2 TYR A 83 29.774 38.414 -42.020 1.00 43.02 C ATOM 1212 CZ TYR A 83 30.690 39.246 -42.629 1.00 0.23 C ATOM 1213 OH TYR A 83 31.833 38.713 -43.186 1.00 35.22 O ATOM 0 H TYR A 83 26.183 39.317 -38.693 1.00 2.10 H new ATOM 0 HA TYR A 83 28.154 41.479 -39.068 1.00 61.22 H new ATOM 0 HB2 TYR A 83 26.278 40.279 -41.132 1.00 22.35 H new ATOM 0 HB3 TYR A 83 26.953 41.888 -41.296 1.00 22.35 H new ATOM 0 HD1 TYR A 83 29.145 42.198 -42.157 1.00 54.31 H new ATOM 0 HD2 TYR A 83 27.918 38.292 -40.977 1.00 61.31 H new ATOM 0 HE1 TYR A 83 31.183 41.258 -43.158 1.00 54.50 H new ATOM 0 HE2 TYR A 83 29.950 37.349 -41.984 1.00 43.02 H new ATOM 0 HH TYR A 83 31.835 37.741 -43.062 1.00 35.22 H new ATOM 1223 N ILE A 84 26.435 43.058 -38.257 1.00 71.04 N ATOM 1224 CA ILE A 84 25.445 44.036 -37.837 1.00 33.43 C ATOM 1225 C ILE A 84 25.043 44.883 -39.035 1.00 24.33 C ATOM 1226 O ILE A 84 25.788 45.758 -39.477 1.00 13.30 O ATOM 1227 CB ILE A 84 25.949 44.944 -36.681 1.00 35.11 C ATOM 1228 CG1 ILE A 84 26.110 44.151 -35.373 1.00 70.51 C ATOM 1229 CG2 ILE A 84 25.000 46.119 -36.459 1.00 63.41 C ATOM 1230 CD1 ILE A 84 27.299 43.210 -35.345 1.00 21.15 C ATOM 0 H ILE A 84 27.401 43.321 -38.062 1.00 71.04 H new ATOM 0 HA ILE A 84 24.583 43.492 -37.450 1.00 33.43 H new ATOM 0 HB ILE A 84 26.926 45.328 -36.974 1.00 35.11 H new ATOM 0 HG12 ILE A 84 26.202 44.855 -34.546 1.00 70.51 H new ATOM 0 HG13 ILE A 84 25.202 43.573 -35.200 1.00 70.51 H new ATOM 0 HG21 ILE A 84 25.374 46.740 -35.645 1.00 63.41 H new ATOM 0 HG22 ILE A 84 24.938 46.714 -37.370 1.00 63.41 H new ATOM 0 HG23 ILE A 84 24.009 45.743 -36.203 1.00 63.41 H new ATOM 0 HD11 ILE A 84 27.332 42.694 -34.385 1.00 21.15 H new ATOM 0 HD12 ILE A 84 27.203 42.478 -36.147 1.00 21.15 H new ATOM 0 HD13 ILE A 84 28.218 43.780 -35.482 1.00 21.15 H new ATOM 1242 N VAL A 85 23.878 44.583 -39.585 1.00 45.21 N ATOM 1243 CA VAL A 85 23.403 45.259 -40.777 1.00 41.00 C ATOM 1244 C VAL A 85 22.455 46.397 -40.412 1.00 52.13 C ATOM 1245 O VAL A 85 21.254 46.188 -40.207 1.00 43.50 O ATOM 1246 CB VAL A 85 22.692 44.276 -41.733 1.00 62.43 C ATOM 1247 CG1 VAL A 85 22.267 44.980 -43.011 1.00 1.04 C ATOM 1248 CG2 VAL A 85 23.593 43.092 -42.056 1.00 64.33 C ATOM 0 H VAL A 85 23.243 43.872 -39.222 1.00 45.21 H new ATOM 0 HA VAL A 85 24.274 45.671 -41.287 1.00 41.00 H new ATOM 0 HB VAL A 85 21.799 43.904 -41.231 1.00 62.43 H new ATOM 0 HG11 VAL A 85 21.768 44.269 -43.670 1.00 1.04 H new ATOM 0 HG12 VAL A 85 21.582 45.792 -42.768 1.00 1.04 H new ATOM 0 HG13 VAL A 85 23.146 45.385 -43.513 1.00 1.04 H new ATOM 0 HG21 VAL A 85 23.073 42.412 -42.731 1.00 64.33 H new ATOM 0 HG22 VAL A 85 24.506 43.449 -42.533 1.00 64.33 H new ATOM 0 HG23 VAL A 85 23.847 42.566 -41.136 1.00 64.33 H new ATOM 1258 N ASP A 86 23.002 47.597 -40.302 1.00 31.13 N ATOM 1259 CA ASP A 86 22.198 48.763 -39.981 1.00 20.21 C ATOM 1260 C ASP A 86 21.870 49.516 -41.260 1.00 24.31 C ATOM 1261 O ASP A 86 22.764 50.008 -41.954 1.00 74.51 O ATOM 1262 CB ASP A 86 22.924 49.678 -38.991 1.00 4.42 C ATOM 1263 CG ASP A 86 21.977 50.645 -38.307 1.00 33.31 C ATOM 1264 OD1 ASP A 86 21.134 50.182 -37.511 1.00 21.44 O ATOM 1265 OD2 ASP A 86 22.079 51.869 -38.540 1.00 45.22 O1- ATOM 0 H ASP A 86 23.996 47.788 -40.430 1.00 31.13 H new ATOM 0 HA ASP A 86 21.273 48.433 -39.507 1.00 20.21 H new ATOM 0 HB2 ASP A 86 23.427 49.071 -38.239 1.00 4.42 H new ATOM 0 HB3 ASP A 86 23.697 50.239 -39.516 1.00 4.42 H new ATOM 1270 N ILE A 87 20.591 49.567 -41.589 1.00 70.13 N ATOM 1271 CA ILE A 87 20.147 50.182 -42.828 1.00 11.31 C ATOM 1272 C ILE A 87 20.050 51.696 -42.673 1.00 5.45 C ATOM 1273 O ILE A 87 19.041 52.228 -42.204 1.00 31.44 O ATOM 1274 CB ILE A 87 18.788 49.599 -43.286 1.00 73.15 C ATOM 1275 CG1 ILE A 87 18.922 48.090 -43.521 1.00 41.53 C ATOM 1276 CG2 ILE A 87 18.300 50.298 -44.549 1.00 33.35 C ATOM 1277 CD1 ILE A 87 17.630 47.411 -43.922 1.00 31.30 C ATOM 0 H ILE A 87 19.839 49.188 -41.013 1.00 70.13 H new ATOM 0 HA ILE A 87 20.888 49.957 -43.595 1.00 11.31 H new ATOM 0 HB ILE A 87 18.051 49.769 -42.501 1.00 73.15 H new ATOM 0 HG12 ILE A 87 19.667 47.919 -44.298 1.00 41.53 H new ATOM 0 HG13 ILE A 87 19.298 47.623 -42.611 1.00 41.53 H new ATOM 0 HG21 ILE A 87 17.344 49.873 -44.854 1.00 33.35 H new ATOM 0 HG22 ILE A 87 18.177 51.363 -44.351 1.00 33.35 H new ATOM 0 HG23 ILE A 87 19.029 50.159 -45.347 1.00 33.35 H new ATOM 0 HD11 ILE A 87 17.809 46.346 -44.069 1.00 31.30 H new ATOM 0 HD12 ILE A 87 16.887 47.549 -43.136 1.00 31.30 H new ATOM 0 HD13 ILE A 87 17.262 47.849 -44.850 1.00 31.30 H new ATOM 1289 N ALA A 88 21.117 52.383 -43.059 1.00 34.53 N ATOM 1290 CA ALA A 88 21.191 53.825 -42.919 1.00 21.21 C ATOM 1291 C ALA A 88 20.630 54.525 -44.150 1.00 23.43 C ATOM 1292 O ALA A 88 21.370 55.031 -44.996 1.00 54.14 O ATOM 1293 CB ALA A 88 22.624 54.269 -42.659 1.00 40.44 C ATOM 0 H ALA A 88 21.946 51.958 -43.474 1.00 34.53 H new ATOM 0 HA ALA A 88 20.581 54.109 -42.061 1.00 21.21 H new ATOM 0 HB1 ALA A 88 22.656 55.354 -42.557 1.00 40.44 H new ATOM 0 HB2 ALA A 88 22.987 53.808 -41.741 1.00 40.44 H new ATOM 0 HB3 ALA A 88 23.256 53.964 -43.493 1.00 40.44 H new ATOM 1299 N ASN A 89 19.314 54.516 -44.270 1.00 52.24 N ATOM 1300 CA ASN A 89 18.649 55.272 -45.317 1.00 21.13 C ATOM 1301 C ASN A 89 18.365 56.675 -44.814 1.00 22.12 C ATOM 1302 O ASN A 89 17.350 56.917 -44.163 1.00 62.21 O ATOM 1303 CB ASN A 89 17.349 54.594 -45.759 1.00 44.43 C ATOM 1304 CG ASN A 89 16.621 55.357 -46.859 1.00 51.24 C ATOM 1305 OD1 ASN A 89 15.392 55.355 -46.916 1.00 34.21 O ATOM 1306 ND2 ASN A 89 17.367 56.003 -47.747 1.00 52.10 N ATOM 0 H ASN A 89 18.686 53.995 -43.658 1.00 52.24 H new ATOM 0 HA ASN A 89 19.306 55.316 -46.185 1.00 21.13 H new ATOM 0 HB2 ASN A 89 17.573 53.587 -46.111 1.00 44.43 H new ATOM 0 HB3 ASN A 89 16.689 54.492 -44.898 1.00 44.43 H new ATOM 0 HD21 ASN A 89 16.923 56.519 -48.507 1.00 52.10 H new ATOM 0 HD22 ASN A 89 18.384 55.983 -47.669 1.00 52.10 H new ATOM 1313 N ARG A 90 19.289 57.581 -45.083 1.00 34.23 N ATOM 1314 CA ARG A 90 19.167 58.954 -44.631 1.00 61.53 C ATOM 1315 C ARG A 90 19.494 59.903 -45.776 1.00 14.51 C ATOM 1316 O ARG A 90 20.219 59.526 -46.705 1.00 31.12 O ATOM 1317 CB ARG A 90 20.106 59.209 -43.445 1.00 1.00 C ATOM 1318 CG ARG A 90 19.881 60.550 -42.762 1.00 75.44 C ATOM 1319 CD ARG A 90 18.510 60.608 -42.110 1.00 14.21 C ATOM 1320 NE ARG A 90 18.098 61.975 -41.802 1.00 45.22 N ATOM 1321 CZ ARG A 90 17.148 62.283 -40.920 1.00 45.51 C ATOM 1322 NH1 ARG A 90 16.562 61.328 -40.205 1.00 34.45 N1+ ATOM 1323 NH2 ARG A 90 16.787 63.549 -40.743 1.00 21.12 N ATOM 0 H ARG A 90 20.137 57.387 -45.616 1.00 34.23 H new ATOM 0 HA ARG A 90 18.142 59.131 -44.304 1.00 61.53 H new ATOM 0 HB2 ARG A 90 19.976 58.412 -42.713 1.00 1.00 H new ATOM 0 HB3 ARG A 90 21.138 59.157 -43.793 1.00 1.00 H new ATOM 0 HG2 ARG A 90 20.652 60.712 -42.009 1.00 75.44 H new ATOM 0 HG3 ARG A 90 19.974 61.354 -43.492 1.00 75.44 H new ATOM 0 HD2 ARG A 90 17.776 60.151 -42.773 1.00 14.21 H new ATOM 0 HD3 ARG A 90 18.522 60.019 -41.193 1.00 14.21 H new ATOM 0 HE ARG A 90 18.565 62.739 -42.291 1.00 45.22 H new ATOM 0 HH11 ARG A 90 16.839 60.354 -40.330 1.00 34.45 H new ATOM 0 HH12 ARG A 90 15.835 61.569 -39.531 1.00 34.45 H new ATOM 0 HH21 ARG A 90 17.237 64.288 -41.283 1.00 21.12 H new ATOM 0 HH22 ARG A 90 16.059 63.782 -40.067 1.00 21.12 H new ATOM 1337 N ASP A 91 18.936 61.112 -45.707 1.00 14.33 N ATOM 1338 CA ASP A 91 19.161 62.163 -46.703 1.00 71.02 C ATOM 1339 C ASP A 91 18.492 61.815 -48.033 1.00 43.52 C ATOM 1340 O ASP A 91 17.524 62.459 -48.436 1.00 61.51 O ATOM 1341 CB ASP A 91 20.658 62.421 -46.907 1.00 34.34 C ATOM 1342 CG ASP A 91 20.925 63.716 -47.646 1.00 2.00 C ATOM 1343 OD1 ASP A 91 20.741 63.755 -48.880 1.00 21.24 O ATOM 1344 OD2 ASP A 91 21.331 64.704 -46.993 1.00 32.31 O1- ATOM 0 H ASP A 91 18.310 61.393 -44.952 1.00 14.33 H new ATOM 0 HA ASP A 91 18.707 63.078 -46.322 1.00 71.02 H new ATOM 0 HB2 ASP A 91 21.154 62.450 -45.937 1.00 34.34 H new ATOM 0 HB3 ASP A 91 21.094 61.592 -47.463 1.00 34.34 H new ATOM 1349 N GLY A 92 19.004 60.794 -48.705 1.00 75.32 N ATOM 1350 CA GLY A 92 18.416 60.362 -49.958 1.00 62.34 C ATOM 1351 C GLY A 92 19.163 59.219 -50.611 1.00 52.21 C ATOM 1352 O GLY A 92 19.078 59.028 -51.822 1.00 23.30 O ATOM 0 H GLY A 92 19.817 60.256 -48.405 1.00 75.32 H new ATOM 0 HA2 GLY A 92 17.384 60.058 -49.781 1.00 62.34 H new ATOM 0 HA3 GLY A 92 18.385 61.206 -50.647 1.00 62.34 H new ATOM 1356 N GLN A 93 19.900 58.450 -49.824 1.00 55.42 N ATOM 1357 CA GLN A 93 20.626 57.305 -50.356 1.00 43.03 C ATOM 1358 C GLN A 93 20.503 56.117 -49.411 1.00 53.23 C ATOM 1359 O GLN A 93 20.316 56.290 -48.205 1.00 62.41 O ATOM 1360 CB GLN A 93 22.109 57.643 -50.575 1.00 32.14 C ATOM 1361 CG GLN A 93 22.376 58.688 -51.658 1.00 62.32 C ATOM 1362 CD GLN A 93 22.456 58.115 -53.073 1.00 5.43 C ATOM 1363 OE1 GLN A 93 21.748 57.027 -53.338 1.00 25.23 O flip ATOM 1364 NE2 GLN A 93 23.168 58.648 -53.925 1.00 33.20 N flip ATOM 0 H GLN A 93 20.011 58.596 -48.821 1.00 55.42 H new ATOM 0 HA GLN A 93 20.185 57.047 -51.319 1.00 43.03 H new ATOM 0 HB2 GLN A 93 22.528 58.000 -49.634 1.00 32.14 H new ATOM 0 HB3 GLN A 93 22.641 56.728 -50.834 1.00 32.14 H new ATOM 0 HG2 GLN A 93 21.586 59.439 -51.626 1.00 62.32 H new ATOM 0 HG3 GLN A 93 23.311 59.199 -51.431 1.00 62.32 H new ATOM 0 HE21 GLN A 93 23.702 59.485 -53.692 1.00 33.20 H new ATOM 0 HE22 GLN A 93 23.224 58.252 -54.863 1.00 33.20 H new ATOM 1373 N LEU A 94 20.595 54.918 -49.962 1.00 22.14 N ATOM 1374 CA LEU A 94 20.564 53.704 -49.164 1.00 50.31 C ATOM 1375 C LEU A 94 21.977 53.329 -48.743 1.00 43.43 C ATOM 1376 O LEU A 94 22.709 52.694 -49.496 1.00 52.24 O ATOM 1377 CB LEU A 94 19.930 52.544 -49.948 1.00 41.23 C ATOM 1378 CG LEU A 94 18.396 52.530 -50.027 1.00 41.02 C ATOM 1379 CD1 LEU A 94 17.788 52.405 -48.641 1.00 1.43 C ATOM 1380 CD2 LEU A 94 17.862 53.765 -50.740 1.00 42.11 C ATOM 0 H LEU A 94 20.692 54.759 -50.965 1.00 22.14 H new ATOM 0 HA LEU A 94 19.956 53.892 -48.279 1.00 50.31 H new ATOM 0 HB2 LEU A 94 20.324 52.563 -50.964 1.00 41.23 H new ATOM 0 HB3 LEU A 94 20.257 51.607 -49.496 1.00 41.23 H new ATOM 0 HG LEU A 94 18.104 51.658 -50.613 1.00 41.02 H new ATOM 0 HD11 LEU A 94 16.701 52.397 -48.720 1.00 1.43 H new ATOM 0 HD12 LEU A 94 18.125 51.477 -48.178 1.00 1.43 H new ATOM 0 HD13 LEU A 94 18.101 53.251 -48.029 1.00 1.43 H new ATOM 0 HD21 LEU A 94 16.774 53.721 -50.777 1.00 42.11 H new ATOM 0 HD22 LEU A 94 18.171 54.659 -50.199 1.00 42.11 H new ATOM 0 HD23 LEU A 94 18.259 53.799 -51.755 1.00 42.11 H new ATOM 1392 N GLN A 95 22.373 53.752 -47.559 1.00 22.34 N ATOM 1393 CA GLN A 95 23.707 53.465 -47.073 1.00 52.10 C ATOM 1394 C GLN A 95 23.669 52.249 -46.158 1.00 55.53 C ATOM 1395 O GLN A 95 23.117 52.296 -45.062 1.00 20.22 O ATOM 1396 CB GLN A 95 24.282 54.688 -46.355 1.00 54.30 C ATOM 1397 CG GLN A 95 25.753 54.560 -45.994 1.00 4.25 C ATOM 1398 CD GLN A 95 26.387 55.884 -45.592 1.00 5.40 C ATOM 1399 OE1 GLN A 95 27.290 55.927 -44.758 1.00 14.41 O ATOM 1400 NE2 GLN A 95 25.952 56.972 -46.210 1.00 5.31 N ATOM 0 H GLN A 95 21.793 54.293 -46.918 1.00 22.34 H new ATOM 0 HA GLN A 95 24.361 53.237 -47.915 1.00 52.10 H new ATOM 0 HB2 GLN A 95 24.149 55.564 -46.990 1.00 54.30 H new ATOM 0 HB3 GLN A 95 23.709 54.864 -45.444 1.00 54.30 H new ATOM 0 HG2 GLN A 95 25.859 53.850 -45.174 1.00 4.25 H new ATOM 0 HG3 GLN A 95 26.295 54.148 -46.845 1.00 4.25 H new ATOM 0 HE21 GLN A 95 25.201 56.903 -46.897 1.00 5.31 H new ATOM 0 HE22 GLN A 95 26.368 57.879 -45.999 1.00 5.31 H new ATOM 1409 N LEU A 96 24.219 51.150 -46.638 1.00 75.11 N ATOM 1410 CA LEU A 96 24.200 49.903 -45.896 1.00 53.33 C ATOM 1411 C LEU A 96 25.434 49.795 -45.007 1.00 12.32 C ATOM 1412 O LEU A 96 26.514 49.435 -45.472 1.00 51.50 O ATOM 1413 CB LEU A 96 24.140 48.716 -46.862 1.00 11.23 C ATOM 1414 CG LEU A 96 23.877 47.359 -46.212 1.00 54.15 C ATOM 1415 CD1 LEU A 96 22.494 47.333 -45.582 1.00 12.31 C ATOM 1416 CD2 LEU A 96 24.021 46.242 -47.233 1.00 11.35 C ATOM 0 H LEU A 96 24.687 51.095 -47.543 1.00 75.11 H new ATOM 0 HA LEU A 96 23.313 49.888 -45.263 1.00 53.33 H new ATOM 0 HB2 LEU A 96 23.358 48.906 -47.597 1.00 11.23 H new ATOM 0 HB3 LEU A 96 25.083 48.663 -47.406 1.00 11.23 H new ATOM 0 HG LEU A 96 24.617 47.202 -45.427 1.00 54.15 H new ATOM 0 HD11 LEU A 96 22.322 46.360 -45.123 1.00 12.31 H new ATOM 0 HD12 LEU A 96 22.426 48.110 -44.821 1.00 12.31 H new ATOM 0 HD13 LEU A 96 21.741 47.511 -46.350 1.00 12.31 H new ATOM 0 HD21 LEU A 96 23.830 45.283 -46.752 1.00 11.35 H new ATOM 0 HD22 LEU A 96 23.304 46.392 -48.040 1.00 11.35 H new ATOM 0 HD23 LEU A 96 25.032 46.249 -47.640 1.00 11.35 H new ATOM 1428 N ASN A 97 25.274 50.121 -43.737 1.00 24.34 N ATOM 1429 CA ASN A 97 26.386 50.077 -42.800 1.00 24.31 C ATOM 1430 C ASN A 97 26.471 48.713 -42.138 1.00 43.41 C ATOM 1431 O ASN A 97 25.800 48.443 -41.141 1.00 33.42 O ATOM 1432 CB ASN A 97 26.255 51.179 -41.745 1.00 32.34 C ATOM 1433 CG ASN A 97 26.626 52.547 -42.285 1.00 4.11 C ATOM 1434 OD1 ASN A 97 26.503 52.811 -43.477 1.00 11.22 O ATOM 1435 ND2 ASN A 97 27.081 53.428 -41.410 1.00 2.51 N ATOM 0 H ASN A 97 24.387 50.419 -43.330 1.00 24.34 H new ATOM 0 HA ASN A 97 27.307 50.249 -43.358 1.00 24.31 H new ATOM 0 HB2 ASN A 97 25.230 51.204 -41.375 1.00 32.34 H new ATOM 0 HB3 ASN A 97 26.895 50.942 -40.895 1.00 32.34 H new ATOM 0 HD21 ASN A 97 27.344 54.364 -41.718 1.00 2.51 H new ATOM 0 HD22 ASN A 97 27.169 53.171 -40.427 1.00 2.51 H new ATOM 1442 N VAL A 98 27.278 47.843 -42.721 1.00 45.14 N ATOM 1443 CA VAL A 98 27.483 46.513 -42.179 1.00 72.02 C ATOM 1444 C VAL A 98 28.686 46.491 -41.253 1.00 15.31 C ATOM 1445 O VAL A 98 29.820 46.699 -41.678 1.00 42.35 O ATOM 1446 CB VAL A 98 27.675 45.462 -43.292 1.00 44.14 C ATOM 1447 CG1 VAL A 98 28.111 44.130 -42.709 1.00 50.42 C ATOM 1448 CG2 VAL A 98 26.395 45.286 -44.079 1.00 24.02 C ATOM 0 H VAL A 98 27.804 48.036 -43.574 1.00 45.14 H new ATOM 0 HA VAL A 98 26.585 46.257 -41.617 1.00 72.02 H new ATOM 0 HB VAL A 98 28.457 45.820 -43.962 1.00 44.14 H new ATOM 0 HG11 VAL A 98 28.240 43.406 -43.513 1.00 50.42 H new ATOM 0 HG12 VAL A 98 29.055 44.256 -42.180 1.00 50.42 H new ATOM 0 HG13 VAL A 98 27.351 43.770 -42.015 1.00 50.42 H new ATOM 0 HG21 VAL A 98 26.548 44.541 -44.860 1.00 24.02 H new ATOM 0 HG22 VAL A 98 25.600 44.954 -43.411 1.00 24.02 H new ATOM 0 HG23 VAL A 98 26.114 46.236 -44.533 1.00 24.02 H new ATOM 1458 N THR A 99 28.430 46.253 -39.988 1.00 13.53 N ATOM 1459 CA THR A 99 29.485 46.162 -39.004 1.00 63.52 C ATOM 1460 C THR A 99 29.746 44.700 -38.649 1.00 34.14 C ATOM 1461 O THR A 99 28.912 44.048 -38.024 1.00 52.04 O ATOM 1462 CB THR A 99 29.106 46.949 -37.742 1.00 15.12 C ATOM 1463 OG1 THR A 99 28.740 48.286 -38.107 1.00 32.14 O ATOM 1464 CG2 THR A 99 30.259 46.985 -36.748 1.00 64.32 C ATOM 0 H THR A 99 27.491 46.118 -39.613 1.00 13.53 H new ATOM 0 HA THR A 99 30.393 46.592 -39.426 1.00 63.52 H new ATOM 0 HB THR A 99 28.263 46.450 -37.265 1.00 15.12 H new ATOM 0 HG1 THR A 99 28.496 48.790 -37.302 1.00 32.14 H new ATOM 0 HG21 THR A 99 29.960 47.549 -35.865 1.00 64.32 H new ATOM 0 HG22 THR A 99 30.521 45.968 -36.457 1.00 64.32 H new ATOM 0 HG23 THR A 99 31.123 47.464 -37.210 1.00 64.32 H new ATOM 1472 N ASP A 100 30.886 44.181 -39.082 1.00 61.11 N ATOM 1473 CA ASP A 100 31.244 42.790 -38.803 1.00 23.41 C ATOM 1474 C ASP A 100 31.378 42.556 -37.299 1.00 63.40 C ATOM 1475 O ASP A 100 31.878 43.414 -36.573 1.00 62.23 O ATOM 1476 CB ASP A 100 32.547 42.419 -39.513 1.00 14.41 C ATOM 1477 CG ASP A 100 33.036 41.033 -39.143 1.00 53.52 C ATOM 1478 OD1 ASP A 100 34.048 40.938 -38.425 1.00 4.12 O ATOM 1479 OD2 ASP A 100 32.410 40.037 -39.558 1.00 11.31 O1- ATOM 0 H ASP A 100 31.579 44.696 -39.626 1.00 61.11 H new ATOM 0 HA ASP A 100 30.445 42.152 -39.182 1.00 23.41 H new ATOM 0 HB2 ASP A 100 32.397 42.472 -40.591 1.00 14.41 H new ATOM 0 HB3 ASP A 100 33.315 43.151 -39.262 1.00 14.41 H new ATOM 1484 N ARG A 101 30.920 41.401 -36.843 1.00 1.22 N ATOM 1485 CA ARG A 101 30.938 41.073 -35.425 1.00 70.42 C ATOM 1486 C ARG A 101 32.237 40.354 -35.065 1.00 41.44 C ATOM 1487 O ARG A 101 32.705 40.436 -33.934 1.00 3.54 O ATOM 1488 CB ARG A 101 29.724 40.193 -35.099 1.00 70.04 C ATOM 1489 CG ARG A 101 29.229 40.276 -33.661 1.00 12.41 C ATOM 1490 CD ARG A 101 29.690 39.094 -32.817 1.00 13.24 C ATOM 1491 NE ARG A 101 31.019 39.296 -32.244 1.00 14.53 N ATOM 1492 CZ ARG A 101 31.477 38.647 -31.176 1.00 32.32 C ATOM 1493 NH1 ARG A 101 30.747 37.696 -30.606 1.00 20.33 N1+ ATOM 1494 NH2 ARG A 101 32.673 38.944 -30.681 1.00 52.25 N ATOM 0 H ARG A 101 30.529 40.671 -37.438 1.00 1.22 H new ATOM 0 HA ARG A 101 30.886 41.989 -34.836 1.00 70.42 H new ATOM 0 HB2 ARG A 101 28.906 40.470 -35.764 1.00 70.04 H new ATOM 0 HB3 ARG A 101 29.978 39.156 -35.320 1.00 70.04 H new ATOM 0 HG2 ARG A 101 29.586 41.202 -33.210 1.00 12.41 H new ATOM 0 HG3 ARG A 101 28.140 40.319 -33.657 1.00 12.41 H new ATOM 0 HD2 ARG A 101 28.974 38.925 -32.013 1.00 13.24 H new ATOM 0 HD3 ARG A 101 29.697 38.194 -33.432 1.00 13.24 H new ATOM 0 HE ARG A 101 31.634 39.977 -32.690 1.00 14.53 H new ATOM 0 HH11 ARG A 101 29.831 37.460 -30.986 1.00 20.33 H new ATOM 0 HH12 ARG A 101 31.103 37.202 -29.788 1.00 20.33 H new ATOM 0 HH21 ARG A 101 33.241 39.669 -31.119 1.00 52.25 H new ATOM 0 HH22 ARG A 101 33.024 38.447 -29.863 1.00 52.25 H new ATOM 1508 N LYS A 102 32.827 39.677 -36.043 1.00 25.22 N ATOM 1509 CA LYS A 102 34.006 38.849 -35.802 1.00 51.24 C ATOM 1510 C LYS A 102 35.232 39.711 -35.491 1.00 24.03 C ATOM 1511 O LYS A 102 35.717 39.735 -34.360 1.00 61.52 O ATOM 1512 CB LYS A 102 34.296 37.960 -37.014 1.00 63.24 C ATOM 1513 CG LYS A 102 33.094 37.169 -37.501 1.00 64.00 C ATOM 1514 CD LYS A 102 33.486 36.177 -38.586 1.00 42.35 C ATOM 1515 CE LYS A 102 34.141 36.864 -39.778 1.00 32.33 C ATOM 1516 NZ LYS A 102 33.199 37.749 -40.513 1.00 73.14 N1+ ATOM 0 H LYS A 102 32.509 39.684 -37.012 1.00 25.22 H new ATOM 0 HA LYS A 102 33.796 38.219 -34.938 1.00 51.24 H new ATOM 0 HB2 LYS A 102 34.663 38.583 -37.830 1.00 63.24 H new ATOM 0 HB3 LYS A 102 35.096 37.265 -36.759 1.00 63.24 H new ATOM 0 HG2 LYS A 102 32.644 36.636 -36.664 1.00 64.00 H new ATOM 0 HG3 LYS A 102 32.338 37.853 -37.887 1.00 64.00 H new ATOM 0 HD2 LYS A 102 34.172 35.438 -38.171 1.00 42.35 H new ATOM 0 HD3 LYS A 102 32.600 35.637 -38.921 1.00 42.35 H new ATOM 0 HE2 LYS A 102 34.992 37.451 -39.432 1.00 32.33 H new ATOM 0 HE3 LYS A 102 34.531 36.108 -40.460 1.00 32.33 H new ATOM 0 HZ1 LYS A 102 33.667 38.126 -41.362 1.00 73.14 H new ATOM 0 HZ2 LYS A 102 32.359 37.204 -40.794 1.00 73.14 H new ATOM 0 HZ3 LYS A 102 32.911 38.537 -39.898 1.00 73.14 H new ATOM 1530 N THR A 103 35.719 40.420 -36.495 1.00 32.11 N ATOM 1531 CA THR A 103 36.888 41.267 -36.336 1.00 65.25 C ATOM 1532 C THR A 103 36.451 42.715 -36.135 1.00 51.12 C ATOM 1533 O THR A 103 37.145 43.510 -35.496 1.00 72.12 O ATOM 1534 CB THR A 103 37.842 41.152 -37.549 1.00 3.51 C ATOM 1535 OG1 THR A 103 39.040 41.900 -37.312 1.00 71.14 O ATOM 1536 CG2 THR A 103 37.183 41.642 -38.830 1.00 15.44 C ATOM 0 H THR A 103 35.320 40.425 -37.434 1.00 32.11 H new ATOM 0 HA THR A 103 37.436 40.930 -35.456 1.00 65.25 H new ATOM 0 HB THR A 103 38.087 40.097 -37.672 1.00 3.51 H new ATOM 0 HG1 THR A 103 39.635 41.818 -38.086 1.00 71.14 H new ATOM 0 HG21 THR A 103 37.884 41.546 -39.659 1.00 15.44 H new ATOM 0 HG22 THR A 103 36.295 41.044 -39.034 1.00 15.44 H new ATOM 0 HG23 THR A 103 36.898 42.688 -38.715 1.00 15.44 H new ATOM 1544 N GLY A 104 35.280 43.038 -36.667 1.00 65.24 N ATOM 1545 CA GLY A 104 34.724 44.360 -36.490 1.00 42.41 C ATOM 1546 C GLY A 104 35.261 45.363 -37.487 1.00 24.42 C ATOM 1547 O GLY A 104 36.154 46.150 -37.175 1.00 13.23 O ATOM 0 H GLY A 104 34.705 42.403 -37.220 1.00 65.24 H new ATOM 0 HA2 GLY A 104 33.639 44.308 -36.583 1.00 42.41 H new ATOM 0 HA3 GLY A 104 34.941 44.708 -35.480 1.00 42.41 H new ATOM 1551 N GLN A 105 34.720 45.322 -38.692 1.00 51.35 N ATOM 1552 CA GLN A 105 35.052 46.290 -39.721 1.00 72.04 C ATOM 1553 C GLN A 105 33.783 46.951 -40.226 1.00 12.40 C ATOM 1554 O GLN A 105 32.730 46.310 -40.312 1.00 64.30 O ATOM 1555 CB GLN A 105 35.796 45.634 -40.891 1.00 71.44 C ATOM 1556 CG GLN A 105 37.224 45.222 -40.568 1.00 11.23 C ATOM 1557 CD GLN A 105 38.060 46.370 -40.029 1.00 44.43 C ATOM 1558 OE1 GLN A 105 37.810 47.541 -40.329 1.00 42.45 O ATOM 1559 NE2 GLN A 105 39.077 46.040 -39.252 1.00 23.32 N ATOM 0 H GLN A 105 34.041 44.619 -38.983 1.00 51.35 H new ATOM 0 HA GLN A 105 35.711 47.039 -39.282 1.00 72.04 H new ATOM 0 HB2 GLN A 105 35.240 44.754 -41.213 1.00 71.44 H new ATOM 0 HB3 GLN A 105 35.811 46.327 -41.732 1.00 71.44 H new ATOM 0 HG2 GLN A 105 37.208 44.415 -39.835 1.00 11.23 H new ATOM 0 HG3 GLN A 105 37.695 44.826 -41.468 1.00 11.23 H new ATOM 0 HE21 GLN A 105 39.250 45.060 -39.027 1.00 23.32 H new ATOM 0 HE22 GLN A 105 39.689 46.765 -38.877 1.00 23.32 H new ATOM 1568 N THR A 106 33.880 48.230 -40.545 1.00 25.35 N ATOM 1569 CA THR A 106 32.735 48.982 -41.012 1.00 43.25 C ATOM 1570 C THR A 106 32.607 48.884 -42.529 1.00 44.11 C ATOM 1571 O THR A 106 33.267 49.610 -43.271 1.00 33.22 O ATOM 1572 CB THR A 106 32.847 50.461 -40.596 1.00 61.32 C ATOM 1573 OG1 THR A 106 33.240 50.542 -39.220 1.00 1.35 O ATOM 1574 CG2 THR A 106 31.522 51.185 -40.783 1.00 5.13 C ATOM 0 H THR A 106 34.744 48.768 -40.488 1.00 25.35 H new ATOM 0 HA THR A 106 31.844 48.552 -40.553 1.00 43.25 H new ATOM 0 HB THR A 106 33.595 50.939 -41.229 1.00 61.32 H new ATOM 0 HG1 THR A 106 33.313 51.483 -38.955 1.00 1.35 H new ATOM 0 HG21 THR A 106 31.631 52.227 -40.481 1.00 5.13 H new ATOM 0 HG22 THR A 106 31.227 51.140 -41.831 1.00 5.13 H new ATOM 0 HG23 THR A 106 30.757 50.708 -40.170 1.00 5.13 H new ATOM 1582 N SER A 107 31.777 47.961 -42.983 1.00 30.10 N ATOM 1583 CA SER A 107 31.518 47.802 -44.400 1.00 71.15 C ATOM 1584 C SER A 107 30.368 48.713 -44.811 1.00 42.21 C ATOM 1585 O SER A 107 29.215 48.286 -44.885 1.00 53.14 O ATOM 1586 CB SER A 107 31.195 46.335 -44.723 1.00 62.32 C ATOM 1587 OG SER A 107 30.938 46.151 -46.108 1.00 35.01 O ATOM 0 H SER A 107 31.269 47.308 -42.386 1.00 30.10 H new ATOM 0 HA SER A 107 32.408 48.082 -44.964 1.00 71.15 H new ATOM 0 HB2 SER A 107 32.029 45.702 -44.420 1.00 62.32 H new ATOM 0 HB3 SER A 107 30.327 46.017 -44.145 1.00 62.32 H new ATOM 0 HG SER A 107 30.737 45.207 -46.281 1.00 35.01 H new ATOM 1593 N THR A 108 30.683 49.982 -45.025 1.00 61.34 N ATOM 1594 CA THR A 108 29.689 50.964 -45.415 1.00 45.01 C ATOM 1595 C THR A 108 29.432 50.904 -46.917 1.00 51.14 C ATOM 1596 O THR A 108 30.221 51.405 -47.719 1.00 24.12 O ATOM 1597 CB THR A 108 30.141 52.381 -45.024 1.00 51.54 C ATOM 1598 OG1 THR A 108 30.501 52.410 -43.638 1.00 42.23 O ATOM 1599 CG2 THR A 108 29.038 53.392 -45.278 1.00 12.31 C ATOM 0 H THR A 108 31.628 50.355 -44.933 1.00 61.34 H new ATOM 0 HA THR A 108 28.764 50.730 -44.888 1.00 45.01 H new ATOM 0 HB THR A 108 31.004 52.644 -45.636 1.00 51.54 H new ATOM 0 HG1 THR A 108 30.790 53.314 -43.394 1.00 42.23 H new ATOM 0 HG21 THR A 108 29.383 54.386 -44.993 1.00 12.31 H new ATOM 0 HG22 THR A 108 28.777 53.388 -46.336 1.00 12.31 H new ATOM 0 HG23 THR A 108 28.161 53.129 -44.687 1.00 12.31 H new ATOM 1607 N ILE A 109 28.334 50.273 -47.293 1.00 13.34 N ATOM 1608 CA ILE A 109 27.984 50.122 -48.693 1.00 55.11 C ATOM 1609 C ILE A 109 26.940 51.156 -49.097 1.00 14.15 C ATOM 1610 O ILE A 109 25.740 50.946 -48.922 1.00 1.14 O ATOM 1611 CB ILE A 109 27.452 48.704 -48.998 1.00 61.20 C ATOM 1612 CG1 ILE A 109 28.450 47.652 -48.507 1.00 73.01 C ATOM 1613 CG2 ILE A 109 27.195 48.538 -50.491 1.00 4.42 C ATOM 1614 CD1 ILE A 109 27.976 46.225 -48.694 1.00 12.41 C ATOM 0 H ILE A 109 27.667 49.855 -46.644 1.00 13.34 H new ATOM 0 HA ILE A 109 28.894 50.278 -49.273 1.00 55.11 H new ATOM 0 HB ILE A 109 26.508 48.565 -48.471 1.00 61.20 H new ATOM 0 HG12 ILE A 109 29.393 47.784 -49.037 1.00 73.01 H new ATOM 0 HG13 ILE A 109 28.652 47.822 -47.450 1.00 73.01 H new ATOM 0 HG21 ILE A 109 26.821 47.533 -50.686 1.00 4.42 H new ATOM 0 HG22 ILE A 109 26.456 49.270 -50.817 1.00 4.42 H new ATOM 0 HG23 ILE A 109 28.124 48.692 -51.039 1.00 4.42 H new ATOM 0 HD11 ILE A 109 28.736 45.538 -48.323 1.00 12.41 H new ATOM 0 HD12 ILE A 109 27.049 46.074 -48.141 1.00 12.41 H new ATOM 0 HD13 ILE A 109 27.801 46.035 -49.753 1.00 12.41 H new ATOM 1626 N GLN A 110 27.403 52.292 -49.595 1.00 42.43 N ATOM 1627 CA GLN A 110 26.503 53.310 -50.109 1.00 3.53 C ATOM 1628 C GLN A 110 25.913 52.852 -51.433 1.00 10.22 C ATOM 1629 O GLN A 110 26.611 52.807 -52.445 1.00 61.10 O ATOM 1630 CB GLN A 110 27.239 54.636 -50.312 1.00 51.25 C ATOM 1631 CG GLN A 110 27.810 55.235 -49.039 1.00 2.41 C ATOM 1632 CD GLN A 110 28.526 56.545 -49.291 1.00 4.14 C ATOM 1633 OE1 GLN A 110 28.181 57.294 -50.207 1.00 23.33 O ATOM 1634 NE2 GLN A 110 29.531 56.830 -48.480 1.00 32.10 N ATOM 0 H GLN A 110 28.393 52.531 -49.654 1.00 42.43 H new ATOM 0 HA GLN A 110 25.706 53.462 -49.382 1.00 3.53 H new ATOM 0 HB2 GLN A 110 28.051 54.482 -51.023 1.00 51.25 H new ATOM 0 HB3 GLN A 110 26.553 55.354 -50.761 1.00 51.25 H new ATOM 0 HG2 GLN A 110 27.004 55.396 -48.323 1.00 2.41 H new ATOM 0 HG3 GLN A 110 28.503 54.526 -48.586 1.00 2.41 H new ATOM 0 HE21 GLN A 110 29.784 56.182 -47.734 1.00 32.10 H new ATOM 0 HE22 GLN A 110 30.053 57.698 -48.600 1.00 32.10 H new ATOM 1643 N VAL A 111 24.643 52.483 -51.421 1.00 22.34 N ATOM 1644 CA VAL A 111 23.957 52.079 -52.638 1.00 74.24 C ATOM 1645 C VAL A 111 23.615 53.310 -53.467 1.00 21.00 C ATOM 1646 O VAL A 111 22.709 54.075 -53.125 1.00 75.11 O ATOM 1647 CB VAL A 111 22.671 51.283 -52.330 1.00 73.33 C ATOM 1648 CG1 VAL A 111 21.977 50.849 -53.611 1.00 13.23 C ATOM 1649 CG2 VAL A 111 22.984 50.078 -51.454 1.00 44.35 C ATOM 0 H VAL A 111 24.065 52.455 -50.581 1.00 22.34 H new ATOM 0 HA VAL A 111 24.626 51.428 -53.200 1.00 74.24 H new ATOM 0 HB VAL A 111 21.991 51.938 -51.785 1.00 73.33 H new ATOM 0 HG11 VAL A 111 21.074 50.290 -53.364 1.00 13.23 H new ATOM 0 HG12 VAL A 111 21.711 51.729 -54.197 1.00 13.23 H new ATOM 0 HG13 VAL A 111 22.648 50.216 -54.192 1.00 13.23 H new ATOM 0 HG21 VAL A 111 22.065 49.530 -51.248 1.00 44.35 H new ATOM 0 HG22 VAL A 111 23.688 49.425 -51.971 1.00 44.35 H new ATOM 0 HG23 VAL A 111 23.424 50.415 -50.515 1.00 44.35 H new ATOM 1659 N SER A 112 24.371 53.513 -54.533 1.00 13.43 N ATOM 1660 CA SER A 112 24.183 54.667 -55.391 1.00 25.44 C ATOM 1661 C SER A 112 24.532 54.317 -56.832 1.00 41.43 C ATOM 1662 O SER A 112 25.621 53.813 -57.116 1.00 54.32 O ATOM 1663 CB SER A 112 25.050 55.833 -54.900 1.00 73.52 C ATOM 1664 OG SER A 112 24.767 57.031 -55.610 1.00 50.04 O ATOM 0 H SER A 112 25.124 52.889 -54.824 1.00 13.43 H new ATOM 0 HA SER A 112 23.136 54.968 -55.352 1.00 25.44 H new ATOM 0 HB2 SER A 112 24.879 55.991 -53.835 1.00 73.52 H new ATOM 0 HB3 SER A 112 26.103 55.579 -55.019 1.00 73.52 H new ATOM 0 HG SER A 112 25.335 57.754 -55.271 1.00 50.04 H new ATOM 1670 N GLY A 113 23.594 54.561 -57.731 1.00 3.12 N ATOM 1671 CA GLY A 113 23.844 54.355 -59.140 1.00 51.54 C ATOM 1672 C GLY A 113 23.435 52.979 -59.619 1.00 51.43 C ATOM 1673 O GLY A 113 24.234 52.265 -60.225 1.00 53.21 O ATOM 0 H GLY A 113 22.658 54.900 -57.508 1.00 3.12 H new ATOM 0 HA2 GLY A 113 23.304 55.108 -59.713 1.00 51.54 H new ATOM 0 HA3 GLY A 113 24.905 54.503 -59.340 1.00 51.54 H new ATOM 1677 N LEU A 114 22.198 52.595 -59.346 1.00 24.32 N ATOM 1678 CA LEU A 114 21.666 51.339 -59.858 1.00 41.32 C ATOM 1679 C LEU A 114 20.679 51.612 -60.985 1.00 21.34 C ATOM 1680 O LEU A 114 20.994 51.420 -62.161 1.00 34.33 O ATOM 1681 CB LEU A 114 20.975 50.535 -58.753 1.00 64.43 C ATOM 1682 CG LEU A 114 21.888 49.994 -57.652 1.00 3.52 C ATOM 1683 CD1 LEU A 114 21.075 49.215 -56.632 1.00 71.24 C ATOM 1684 CD2 LEU A 114 22.979 49.115 -58.243 1.00 25.04 C ATOM 0 H LEU A 114 21.545 53.132 -58.775 1.00 24.32 H new ATOM 0 HA LEU A 114 22.502 50.751 -60.237 1.00 41.32 H new ATOM 0 HB2 LEU A 114 20.216 51.166 -58.291 1.00 64.43 H new ATOM 0 HB3 LEU A 114 20.455 49.695 -59.213 1.00 64.43 H new ATOM 0 HG LEU A 114 22.363 50.838 -57.151 1.00 3.52 H new ATOM 0 HD11 LEU A 114 21.736 48.835 -55.853 1.00 71.24 H new ATOM 0 HD12 LEU A 114 20.327 49.871 -56.185 1.00 71.24 H new ATOM 0 HD13 LEU A 114 20.577 48.380 -57.125 1.00 71.24 H new ATOM 0 HD21 LEU A 114 23.618 48.740 -57.443 1.00 25.04 H new ATOM 0 HD22 LEU A 114 22.525 48.275 -58.768 1.00 25.04 H new ATOM 0 HD23 LEU A 114 23.578 49.699 -58.942 1.00 25.04 H new ATOM 1696 N GLN A 115 19.480 52.058 -60.606 1.00 45.34 N ATOM 1697 CA GLN A 115 18.415 52.400 -61.553 1.00 40.42 C ATOM 1698 C GLN A 115 17.915 51.161 -62.293 1.00 4.04 C ATOM 1699 O GLN A 115 17.226 51.264 -63.310 1.00 53.53 O ATOM 1700 CB GLN A 115 18.875 53.473 -62.545 1.00 34.14 C ATOM 1701 CG GLN A 115 19.268 54.782 -61.878 1.00 25.34 C ATOM 1702 CD GLN A 115 18.156 55.358 -61.022 1.00 62.34 C ATOM 1703 OE1 GLN A 115 18.062 55.071 -59.826 1.00 30.31 O ATOM 1704 NE2 GLN A 115 17.302 56.161 -61.632 1.00 61.02 N ATOM 0 H GLN A 115 19.218 52.193 -59.629 1.00 45.34 H new ATOM 0 HA GLN A 115 17.585 52.808 -60.976 1.00 40.42 H new ATOM 0 HB2 GLN A 115 19.725 53.093 -63.112 1.00 34.14 H new ATOM 0 HB3 GLN A 115 18.075 53.664 -63.260 1.00 34.14 H new ATOM 0 HG2 GLN A 115 20.151 54.619 -61.259 1.00 25.34 H new ATOM 0 HG3 GLN A 115 19.545 55.507 -62.644 1.00 25.34 H new ATOM 0 HE21 GLN A 115 17.418 56.371 -62.623 1.00 61.02 H new ATOM 0 HE22 GLN A 115 16.526 56.571 -61.111 1.00 61.02 H new ATOM 1713 N ASN A 116 18.258 49.995 -61.771 1.00 43.54 N ATOM 1714 CA ASN A 116 17.742 48.743 -62.294 1.00 10.42 C ATOM 1715 C ASN A 116 16.611 48.243 -61.406 1.00 30.14 C ATOM 1716 O ASN A 116 16.831 47.583 -60.391 1.00 42.14 O ATOM 1717 CB ASN A 116 18.857 47.693 -62.425 1.00 13.45 C ATOM 1718 CG ASN A 116 19.769 47.612 -61.210 1.00 41.32 C ATOM 1719 OD1 ASN A 116 20.758 48.332 -61.118 1.00 22.52 O ATOM 1720 ND2 ASN A 116 19.453 46.728 -60.277 1.00 63.44 N ATOM 0 H ASN A 116 18.895 49.891 -60.981 1.00 43.54 H new ATOM 0 HA ASN A 116 17.348 48.917 -63.295 1.00 10.42 H new ATOM 0 HB2 ASN A 116 18.405 46.716 -62.594 1.00 13.45 H new ATOM 0 HB3 ASN A 116 19.458 47.923 -63.305 1.00 13.45 H new ATOM 0 HD21 ASN A 116 20.040 46.629 -59.448 1.00 63.44 H new ATOM 0 HD22 ASN A 116 18.623 46.146 -60.387 1.00 63.44 H new ATOM 1727 N ASN A 117 15.394 48.599 -61.780 1.00 33.24 N ATOM 1728 CA ASN A 117 14.225 48.250 -60.993 1.00 2.33 C ATOM 1729 C ASN A 117 13.450 47.124 -61.659 1.00 51.41 C ATOM 1730 O ASN A 117 12.732 47.343 -62.635 1.00 1.42 O ATOM 1731 CB ASN A 117 13.319 49.471 -60.815 1.00 61.13 C ATOM 1732 CG ASN A 117 12.144 49.194 -59.899 1.00 30.42 C ATOM 1733 OD1 ASN A 117 12.249 48.415 -58.952 1.00 34.24 O ATOM 1734 ND2 ASN A 117 11.012 49.818 -60.182 1.00 5.04 N ATOM 0 H ASN A 117 15.190 49.131 -62.626 1.00 33.24 H new ATOM 0 HA ASN A 117 14.561 47.912 -60.013 1.00 2.33 H new ATOM 0 HB2 ASN A 117 13.904 50.297 -60.411 1.00 61.13 H new ATOM 0 HB3 ASN A 117 12.949 49.790 -61.789 1.00 61.13 H new ATOM 0 HD21 ASN A 117 10.185 49.661 -59.606 1.00 5.04 H new ATOM 0 HD22 ASN A 117 10.966 50.456 -60.976 1.00 5.04 H new ATOM 1741 N SER A 118 13.617 45.918 -61.151 1.00 14.15 N ATOM 1742 CA SER A 118 12.849 44.789 -61.633 1.00 75.22 C ATOM 1743 C SER A 118 11.496 44.767 -60.937 1.00 42.11 C ATOM 1744 O SER A 118 11.398 44.379 -59.769 1.00 3.43 O ATOM 1745 CB SER A 118 13.608 43.485 -61.380 1.00 22.31 C ATOM 1746 OG SER A 118 14.894 43.515 -61.983 1.00 43.44 O ATOM 0 H SER A 118 14.277 45.696 -60.406 1.00 14.15 H new ATOM 0 HA SER A 118 12.695 44.887 -62.708 1.00 75.22 H new ATOM 0 HB2 SER A 118 13.710 43.323 -60.307 1.00 22.31 H new ATOM 0 HB3 SER A 118 13.037 42.646 -61.777 1.00 22.31 H new ATOM 0 HG SER A 118 15.359 42.671 -61.805 1.00 43.44 H new ATOM 1752 N THR A 119 10.470 45.225 -61.645 1.00 1.13 N ATOM 1753 CA THR A 119 9.130 45.316 -61.092 1.00 11.34 C ATOM 1754 C THR A 119 8.654 43.949 -60.612 1.00 73.20 C ATOM 1755 O THR A 119 8.589 42.988 -61.385 1.00 53.00 O ATOM 1756 CB THR A 119 8.141 45.864 -62.135 1.00 14.15 C ATOM 1757 OG1 THR A 119 8.807 46.792 -63.001 1.00 61.21 O ATOM 1758 CG2 THR A 119 6.973 46.565 -61.460 1.00 31.13 C ATOM 0 H THR A 119 10.546 45.541 -62.612 1.00 1.13 H new ATOM 0 HA THR A 119 9.167 46.002 -60.246 1.00 11.34 H new ATOM 0 HB THR A 119 7.761 45.022 -62.714 1.00 14.15 H new ATOM 0 HG1 THR A 119 9.153 46.317 -63.785 1.00 61.21 H new ATOM 0 HG21 THR A 119 6.288 46.944 -62.219 1.00 31.13 H new ATOM 0 HG22 THR A 119 6.448 45.859 -60.817 1.00 31.13 H new ATOM 0 HG23 THR A 119 7.345 47.396 -60.860 1.00 31.13 H new ATOM 1766 N ASP A 120 8.350 43.863 -59.330 1.00 14.24 N ATOM 1767 CA ASP A 120 7.936 42.611 -58.722 1.00 62.41 C ATOM 1768 C ASP A 120 6.548 42.752 -58.112 1.00 11.22 C ATOM 1769 O ASP A 120 6.346 43.546 -57.194 1.00 34.13 O ATOM 1770 CB ASP A 120 8.952 42.189 -57.653 1.00 21.11 C ATOM 1771 CG ASP A 120 8.558 40.920 -56.922 1.00 5.01 C ATOM 1772 OD1 ASP A 120 7.960 41.015 -55.828 1.00 42.22 O ATOM 1773 OD2 ASP A 120 8.862 39.821 -57.426 1.00 22.14 O1- ATOM 0 H ASP A 120 8.382 44.652 -58.685 1.00 14.24 H new ATOM 0 HA ASP A 120 7.895 41.840 -59.492 1.00 62.41 H new ATOM 0 HB2 ASP A 120 9.925 42.043 -58.123 1.00 21.11 H new ATOM 0 HB3 ASP A 120 9.066 42.997 -56.930 1.00 21.11 H new ATOM 1778 N PHE A 121 5.594 42.000 -58.646 1.00 13.21 N ATOM 1779 CA PHE A 121 4.230 42.011 -58.137 1.00 25.12 C ATOM 1780 C PHE A 121 3.645 40.608 -58.152 1.00 43.12 C ATOM 1781 O PHE A 121 3.144 40.149 -59.182 1.00 24.43 O ATOM 1782 CB PHE A 121 3.328 42.947 -58.952 1.00 11.52 C ATOM 1783 CG PHE A 121 3.543 44.409 -58.675 1.00 23.13 C ATOM 1784 CD1 PHE A 121 3.279 44.932 -57.420 1.00 75.24 C ATOM 1785 CD2 PHE A 121 3.994 45.261 -59.671 1.00 41.35 C ATOM 1786 CE1 PHE A 121 3.465 46.277 -57.160 1.00 60.15 C ATOM 1787 CE2 PHE A 121 4.183 46.607 -59.417 1.00 43.42 C ATOM 1788 CZ PHE A 121 3.918 47.116 -58.160 1.00 30.42 C ATOM 0 H PHE A 121 5.742 41.372 -59.436 1.00 13.21 H new ATOM 0 HA PHE A 121 4.271 42.380 -57.112 1.00 25.12 H new ATOM 0 HB2 PHE A 121 3.496 42.762 -60.013 1.00 11.52 H new ATOM 0 HB3 PHE A 121 2.287 42.699 -58.746 1.00 11.52 H new ATOM 0 HD1 PHE A 121 2.923 44.281 -56.635 1.00 75.24 H new ATOM 0 HD2 PHE A 121 4.200 44.869 -60.656 1.00 41.35 H new ATOM 0 HE1 PHE A 121 3.256 46.671 -56.176 1.00 60.15 H new ATOM 0 HE2 PHE A 121 4.538 47.260 -60.201 1.00 43.42 H new ATOM 0 HZ PHE A 121 4.065 48.167 -57.960 1.00 30.42 H new ATOM 1798 N HIS A 122 3.737 39.927 -57.010 1.00 74.33 N ATOM 1799 CA HIS A 122 3.146 38.597 -56.829 1.00 33.51 C ATOM 1800 C HIS A 122 3.795 37.569 -57.757 1.00 61.51 C ATOM 1801 O HIS A 122 4.832 37.838 -58.368 1.00 44.21 O ATOM 1802 CB HIS A 122 1.628 38.634 -57.078 1.00 14.54 C ATOM 1803 CG HIS A 122 0.909 39.705 -56.315 1.00 14.41 C ATOM 1804 ND1 HIS A 122 0.231 40.739 -56.926 1.00 72.31 N ATOM 1805 CD2 HIS A 122 0.773 39.905 -54.984 1.00 55.51 C ATOM 1806 CE1 HIS A 122 -0.282 41.530 -56.002 1.00 74.34 C ATOM 1807 NE2 HIS A 122 0.030 41.046 -54.818 1.00 72.12 N ATOM 0 H HIS A 122 4.222 40.279 -56.185 1.00 74.33 H new ATOM 0 HA HIS A 122 3.330 38.298 -55.797 1.00 33.51 H new ATOM 0 HB2 HIS A 122 1.449 38.779 -58.143 1.00 14.54 H new ATOM 0 HB3 HIS A 122 1.203 37.666 -56.812 1.00 14.54 H new ATOM 0 HD2 HIS A 122 1.175 39.282 -54.198 1.00 55.51 H new ATOM 0 HE1 HIS A 122 -0.860 42.423 -56.186 1.00 74.34 H new ATOM 0 HE2 HIS A 122 -0.238 41.454 -53.922 1.00 72.12 H new ATOM 1816 N HIS A 123 3.180 36.388 -57.836 1.00 41.22 N ATOM 1817 CA HIS A 123 3.633 35.320 -58.730 1.00 40.20 C ATOM 1818 C HIS A 123 5.073 34.926 -58.424 1.00 14.21 C ATOM 1819 O HIS A 123 5.895 34.762 -59.325 1.00 55.44 O ATOM 1820 CB HIS A 123 3.494 35.745 -60.197 1.00 64.15 C ATOM 1821 CG HIS A 123 2.075 35.985 -60.617 1.00 33.35 C ATOM 1822 ND1 HIS A 123 1.645 37.163 -61.194 1.00 51.31 N ATOM 1823 CD2 HIS A 123 0.979 35.190 -60.540 1.00 23.32 C ATOM 1824 CE1 HIS A 123 0.352 37.084 -61.445 1.00 62.03 C ATOM 1825 NE2 HIS A 123 -0.075 35.899 -61.061 1.00 11.12 N ATOM 0 H HIS A 123 2.357 36.145 -57.285 1.00 41.22 H new ATOM 0 HA HIS A 123 2.999 34.450 -58.561 1.00 40.20 H new ATOM 0 HB2 HIS A 123 4.072 36.655 -60.360 1.00 64.15 H new ATOM 0 HB3 HIS A 123 3.928 34.974 -60.833 1.00 64.15 H new ATOM 0 HD2 HIS A 123 0.942 34.186 -60.143 1.00 23.32 H new ATOM 0 HE1 HIS A 123 -0.253 37.860 -61.890 1.00 62.03 H new ATOM 0 HE2 HIS A 123 -1.035 35.562 -61.138 1.00 11.12 H new ATOM 1834 N HIS A 124 5.358 34.741 -57.143 1.00 75.21 N ATOM 1835 CA HIS A 124 6.706 34.410 -56.694 1.00 61.31 C ATOM 1836 C HIS A 124 6.965 32.910 -56.798 1.00 45.43 C ATOM 1837 O HIS A 124 7.954 32.396 -56.274 1.00 72.22 O ATOM 1838 CB HIS A 124 6.924 34.881 -55.254 1.00 55.11 C ATOM 1839 CG HIS A 124 6.881 36.369 -55.094 1.00 30.43 C ATOM 1840 ND1 HIS A 124 5.935 37.015 -54.331 1.00 72.32 N ATOM 1841 CD2 HIS A 124 7.679 37.341 -55.600 1.00 11.23 C ATOM 1842 CE1 HIS A 124 6.150 38.317 -54.375 1.00 60.11 C ATOM 1843 NE2 HIS A 124 7.201 38.539 -55.138 1.00 42.31 N ATOM 0 H HIS A 124 4.672 34.815 -56.392 1.00 75.21 H new ATOM 0 HA HIS A 124 7.411 34.927 -57.345 1.00 61.31 H new ATOM 0 HB2 HIS A 124 6.162 34.434 -54.616 1.00 55.11 H new ATOM 0 HB3 HIS A 124 7.889 34.515 -54.903 1.00 55.11 H new ATOM 0 HD2 HIS A 124 8.532 37.198 -56.247 1.00 11.23 H new ATOM 0 HE1 HIS A 124 5.564 39.072 -53.871 1.00 60.11 H new ATOM 0 HE2 HIS A 124 7.595 39.455 -55.351 1.00 42.31 H new ATOM 1852 N HIS A 125 6.069 32.208 -57.469 1.00 33.11 N ATOM 1853 CA HIS A 125 6.243 30.789 -57.713 1.00 42.42 C ATOM 1854 C HIS A 125 5.802 30.450 -59.127 1.00 12.25 C ATOM 1855 O HIS A 125 4.617 30.509 -59.450 1.00 65.23 O ATOM 1856 CB HIS A 125 5.449 29.959 -56.701 1.00 11.44 C ATOM 1857 CG HIS A 125 5.752 28.493 -56.774 1.00 60.43 C ATOM 1858 ND1 HIS A 125 4.808 27.536 -57.079 1.00 71.41 N ATOM 1859 CD2 HIS A 125 6.913 27.824 -56.583 1.00 3.32 C ATOM 1860 CE1 HIS A 125 5.377 26.344 -57.071 1.00 54.41 C ATOM 1861 NE2 HIS A 125 6.654 26.492 -56.773 1.00 54.24 N ATOM 0 H HIS A 125 5.211 32.600 -57.856 1.00 33.11 H new ATOM 0 HA HIS A 125 7.299 30.547 -57.598 1.00 42.42 H new ATOM 0 HB2 HIS A 125 5.666 30.319 -55.695 1.00 11.44 H new ATOM 0 HB3 HIS A 125 4.383 30.112 -56.871 1.00 11.44 H new ATOM 0 HD2 HIS A 125 7.868 28.260 -56.328 1.00 3.32 H new ATOM 0 HE1 HIS A 125 4.881 25.406 -57.274 1.00 54.41 H new ATOM 0 HE2 HIS A 125 7.337 25.738 -56.697 1.00 54.24 H new ATOM 1870 N HIS A 126 6.768 30.130 -59.966 1.00 22.41 N ATOM 1871 CA HIS A 126 6.495 29.703 -61.331 1.00 73.13 C ATOM 1872 C HIS A 126 7.539 28.689 -61.778 1.00 14.44 C ATOM 1873 O HIS A 126 8.726 28.830 -61.477 1.00 61.23 O ATOM 1874 CB HIS A 126 6.437 30.903 -62.299 1.00 23.41 C ATOM 1875 CG HIS A 126 7.493 31.950 -62.073 1.00 43.53 C ATOM 1876 ND1 HIS A 126 7.208 33.201 -61.567 1.00 63.22 N ATOM 1877 CD2 HIS A 126 8.829 31.935 -62.293 1.00 54.42 C ATOM 1878 CE1 HIS A 126 8.317 33.906 -61.485 1.00 42.22 C ATOM 1879 NE2 HIS A 126 9.316 33.163 -61.919 1.00 15.42 N ATOM 0 H HIS A 126 7.759 30.157 -59.726 1.00 22.41 H new ATOM 0 HA HIS A 126 5.514 29.228 -61.350 1.00 73.13 H new ATOM 0 HB2 HIS A 126 6.526 30.532 -63.320 1.00 23.41 H new ATOM 0 HB3 HIS A 126 5.457 31.372 -62.215 1.00 23.41 H new ATOM 0 HD1 HIS A 126 6.281 33.530 -61.298 1.00 63.22 H new ATOM 0 HD2 HIS A 126 9.404 31.111 -62.689 1.00 54.42 H new ATOM 0 HE1 HIS A 126 8.395 34.921 -61.124 1.00 42.22 H new ATOM 1888 N HIS A 127 7.090 27.665 -62.479 1.00 12.35 N ATOM 1889 CA HIS A 127 7.961 26.578 -62.898 1.00 31.34 C ATOM 1890 C HIS A 127 7.863 26.399 -64.406 1.00 12.31 C ATOM 1891 O HIS A 127 7.028 25.589 -64.859 1.00 54.42 O ATOM 1892 CB HIS A 127 7.562 25.286 -62.176 1.00 12.42 C ATOM 1893 CG HIS A 127 8.401 24.090 -62.528 1.00 22.42 C ATOM 1894 ND1 HIS A 127 8.219 23.358 -63.677 1.00 5.05 N ATOM 1895 CD2 HIS A 127 9.409 23.483 -61.858 1.00 4.12 C ATOM 1896 CE1 HIS A 127 9.072 22.355 -63.700 1.00 42.13 C ATOM 1897 NE2 HIS A 127 9.810 22.404 -62.607 1.00 54.43 N ATOM 1898 OXT HIS A 127 8.595 27.092 -65.133 1.00 0.00 O1- ATOM 0 H HIS A 127 6.119 27.561 -62.773 1.00 12.35 H new ATOM 0 HA HIS A 127 8.993 26.816 -62.639 1.00 31.34 H new ATOM 0 HB2 HIS A 127 7.623 25.452 -61.100 1.00 12.42 H new ATOM 0 HB3 HIS A 127 6.520 25.063 -62.406 1.00 12.42 H new ATOM 0 HD1 HIS A 127 7.529 23.561 -64.401 1.00 5.05 H new ATOM 0 HD2 HIS A 127 9.822 23.791 -60.909 1.00 4.12 H new ATOM 0 HE1 HIS A 127 9.154 21.616 -64.483 1.00 42.13 H new TER 1907 HIS A 127