#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3h1c s ALA 1040N 0.00 -0.72 0.23 4.61 0.00 -1.26 -5.18 121.76 119.45 3h1c s ALA 1040Ca 0.00 0.42 0.07 0.00 0.00 0.00 0.00 51.96 52.45 3h1c s ALA 1040Cb 0.00 -0.08 -0.04 0.00 0.00 0.00 0.00 23.12 23.00 3h1c s ALA 1040CO 0.00 -0.22 0.13 0.00 0.00 0.00 0.00 175.76 175.67 3h1c s ALA 1041N -0.92 3.46 0.00 0.00 0.00 -1.26 -4.84 121.76 118.20 3h1c s ALA 1041Ca -0.10 -1.43 0.00 0.00 0.00 0.00 0.00 51.96 50.43 3h1c s ALA 1041Cb -0.05 -1.18 0.00 0.00 0.00 0.00 0.00 23.12 21.89 3h1c s ALA 1041CO 0.03 0.32 0.00 0.41 0.00 0.00 0.00 175.76 176.52 3h1c n GLY 1042N -0.89 2.16 0.19 0.00 0.00 -1.26 -4.83 105.19 100.55 3h1c n GLY 1042Ca -0.08 -2.10 0.14 0.00 0.00 0.00 0.00 46.02 43.98 3h1c n GLY 1042CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3h1c h GLY 1043N 0.00 0.00 2.00 -0.02 0.00 -2.01 -2.99 103.07 100.05 3h1c h GLY 1043Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3h1c h GLY 1043CO 0.00 0.00 -0.07 1.12 0.00 0.00 0.00 176.54 177.59 3h1c h HIS 1044N 0.00 0.00 -0.54 5.60 -0.00 -1.99 -3.14 115.15 115.08 3h1c h HIS 1044Ca 0.00 0.00 -0.12 0.00 -0.00 0.00 0.00 60.37 60.25 3h1c h HIS 1044Cb 0.56 0.00 -0.07 0.00 -0.00 0.00 0.00 27.41 27.90 3h1c h HIS 1044CO 0.00 0.07 0.15 0.25 -0.00 0.00 0.00 177.93 178.41 3h1c n THR 1045N -3.14 2.29 -2.25 6.12 -2.24 -1.13 -4.95 114.28 108.98 3h1c n THR 1045Ca 0.02 -1.19 -0.42 0.00 -2.27 0.00 0.00 64.05 60.19 3h1c n THR 1045Cb 0.46 -0.41 -0.03 0.00 -2.10 0.00 0.00 70.33 68.25 3h1c n THR 1045CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3h1c s ALA 1046N -2.40 3.53 0.01 6.98 0.00 -1.19 -4.93 121.76 123.77 3h1c s ALA 1046Ca 0.42 0.99 0.27 0.00 0.00 0.00 0.00 51.96 53.64 3h1c s ALA 1046Cb 0.33 -3.52 0.93 0.00 0.00 0.00 0.00 23.12 20.86 3h1c s ALA 1046CO 0.11 -0.63 1.82 0.00 0.00 0.00 0.00 175.76 177.06 3h1c h THR 1047N 4.47 0.29 -3.28 0.00 1.03 -1.93 -3.41 112.91 110.07 3h1c h THR 1047Ca -0.41 -0.96 -0.43 0.00 -0.01 0.00 0.00 66.41 64.59 3h1c h THR 1047Cb 1.20 1.76 -0.37 0.00 -1.07 0.00 0.00 68.15 69.67 3h1c h THR 1047CO 0.86 0.13 -0.77 -1.00 -0.01 0.00 0.00 175.52 174.73 3h1c s HIS 1048N -3.54 0.69 -0.13 0.00 3.76 -1.26 -5.14 115.29 109.66 3h1c s HIS 1048Ca 0.02 -0.18 0.00 0.00 -0.15 0.00 0.00 55.06 54.75 3h1c s HIS 1048Cb 0.09 -0.78 -0.01 0.00 1.11 0.00 0.00 32.58 32.98 3h1c s HIS 1048CO 0.62 -0.31 -0.15 -1.58 -0.85 0.00 0.00 174.74 172.47 3h1c s HIS 1049N 1.81 2.77 -0.08 1.40 5.04 -1.26 -5.11 115.29 119.86 3h1c s HIS 1049Ca 0.03 -0.80 -0.08 0.00 -1.54 0.00 0.00 55.06 52.67 3h1c s HIS 1049Cb -0.13 -1.84 0.02 0.00 0.04 0.00 0.00 32.58 30.67 3h1c s HIS 1049CO -0.05 -0.31 0.22 0.00 -2.34 0.00 0.00 174.74 172.26 3h1c s ALA 1050N 0.48 -0.53 0.03 1.58 0.00 -1.26 -5.17 121.76 116.88 3h1c s ALA 1050Ca -0.10 0.56 -0.00 0.00 0.00 0.00 0.00 51.96 52.42 3h1c s ALA 1050Cb -0.16 -0.32 -0.02 0.00 0.00 0.00 0.00 23.12 22.62 3h1c s ALA 1050CO 0.05 -0.11 -0.03 0.45 0.00 0.00 0.00 175.76 176.11 3h1c s SER 1051N -0.01 0.31 -0.05 0.00 0.15 -1.26 -5.17 113.70 107.67 3h1c s SER 1051Ca -0.01 -0.58 -0.09 0.00 0.70 0.00 0.00 55.95 55.97 3h1c s SER 1051Cb -0.02 0.11 0.02 0.00 -1.71 0.00 0.00 66.02 64.42 3h1c s SER 1051CO 0.00 -0.34 0.21 0.00 1.20 0.00 0.00 173.24 174.32 3h1c s ALA 1052N -1.84 -0.53 0.25 5.45 0.00 -1.26 -5.17 121.76 118.66 3h1c s ALA 1052Ca -0.12 0.34 -0.11 0.00 0.00 0.00 0.00 51.96 52.07 3h1c s ALA 1052Cb -0.07 -0.14 -0.08 0.00 0.00 0.00 0.00 23.12 22.83 3h1c s ALA 1052CO -0.02 -0.17 0.59 0.00 0.00 0.00 0.00 175.76 176.16 3h1c s ALA 1053N -0.61 3.51 0.04 0.00 0.00 -1.26 -5.03 121.76 118.42 3h1c s ALA 1053Ca -0.07 -0.20 -0.30 0.00 0.00 0.00 0.00 51.96 51.39 3h1c s ALA 1053Cb -0.04 -2.51 -0.08 0.00 0.00 0.00 0.00 23.12 20.49 3h1c s ALA 1053CO 0.01 0.47 1.82 -1.25 0.00 0.00 0.00 175.76 176.81 3h1c s PRO 1054N -2.83 4.16 0.28 0.00 0.04 -1.26 -4.97 135.00 130.43 3h1c s PRO 1054Ca 0.49 2.47 -0.13 0.00 0.04 0.00 0.00 61.00 63.87 3h1c s PRO 1054Cb -0.11 -3.91 0.01 0.00 0.04 0.00 0.00 34.50 30.52 3h1c s PRO 1054CO 0.20 -0.87 0.55 0.00 0.04 0.00 0.00 177.00 176.92 3h1c s ALA 1055N 3.71 -0.27 0.81 8.56 0.00 -1.26 -5.17 121.76 128.14 3h1c s ALA 1055Ca 0.81 -0.89 -0.11 0.00 0.00 0.00 0.00 51.96 51.78 3h1c s ALA 1055Cb -0.41 1.01 0.08 0.00 0.00 0.00 0.00 23.12 23.80 3h1c s ALA 1055CO 0.36 -0.89 1.10 1.03 0.00 0.00 0.00 175.76 177.36 3h1c s ARG 1056N -3.65 1.92 1.10 0.00 0.52 -1.26 -5.04 118.95 112.53 3h1c s ARG 1056Ca 0.21 1.15 -0.13 0.00 -0.52 0.00 0.00 55.73 56.44 3h1c s ARG 1056Cb -0.02 -1.86 0.21 0.00 0.52 0.00 0.00 34.95 33.80 3h1c s ARG 1056CO 0.11 -1.88 0.81 -2.30 0.02 0.00 0.00 175.30 172.06 3h1c n PRO 1057N -3.68 -1.73 -0.30 3.54 -0.02 -1.26 -4.96 135.00 126.60 3h1c n PRO 1057Ca 0.09 -0.47 -0.03 0.00 -2.02 0.00 0.00 63.50 61.07 3h1c n PRO 1057Cb 0.53 -2.10 0.13 0.00 -0.02 0.00 0.00 33.50 32.04 3h1c n PRO 1057CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 3h1c h GLN 1058N -2.33 1.19 -0.03 -0.52 3.07 -2.08 -3.57 115.11 110.85 3h1c h GLN 1058Ca -0.55 -0.13 0.00 0.00 0.09 0.00 0.00 58.65 58.06 3h1c h GLN 1058Cb 1.32 -0.24 0.00 0.00 0.08 0.00 0.00 27.48 28.64 3h1c h GLN 1058CO 0.44 0.86 0.00 -0.35 0.09 0.00 0.00 178.83 179.87