#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 -0.17 0.12 4.61 0.00 -1.26 -5.18 121.76 119.88 3h1c s ALA 1040Ca 0.00 -0.79 0.10 0.00 0.00 0.00 0.00 51.96 51.27 3h1c s ALA 1040Cb 0.00 0.90 -0.04 0.00 0.00 0.00 0.00 23.12 23.98 3h1c s ALA 1040CO 0.00 -0.70 -0.25 0.00 0.00 0.00 0.00 175.76 174.81 3h1c s ALA 1041N -3.96 2.20 0.00 0.00 0.00 -1.26 -4.90 121.76 113.84 3h1c s ALA 1041Ca 0.17 -1.39 0.00 0.00 0.00 0.00 0.00 51.96 50.74 3h1c s ALA 1041Cb 0.02 -0.34 0.00 0.00 0.00 0.00 0.00 23.12 22.80 3h1c s ALA 1041CO 0.01 0.48 0.00 0.41 0.00 0.00 0.00 175.76 176.67 3h1c n GLY 1042N 1.01 1.78 0.23 0.00 0.00 -1.26 -4.84 105.19 102.10 3h1c n GLY 1042Ca -0.18 -2.03 0.15 0.00 0.00 0.00 0.00 46.02 43.96 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 -2.71 103.07 100.33 3h1c h GLY 1043Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 3h1c h GLY 1043CO 0.00 0.00 -0.12 1.12 0.00 0.00 0.00 176.54 177.54 3h1c h HIS 1044N 0.00 0.00 -0.97 5.60 2.07 -2.00 -3.17 115.15 116.68 3h1c h HIS 1044Ca 0.00 0.00 -0.56 0.00 -2.85 0.00 0.00 60.37 56.96 3h1c h HIS 1044Cb 0.51 0.00 -0.29 0.00 2.57 0.00 0.00 27.41 30.20 3h1c h HIS 1044CO 0.00 0.12 0.72 2.41 -3.07 0.00 0.00 177.93 178.11 3h1c n THR 1045N -3.17 3.31 -2.82 6.12 -1.04 -1.02 -4.97 114.28 110.69 3h1c n THR 1045Ca 0.02 -2.25 -0.41 0.00 -2.04 0.00 0.00 64.05 59.38 3h1c n THR 1045Cb 0.49 -0.76 -0.05 0.00 -1.82 0.00 0.00 70.33 68.19 3h1c n THR 1045CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3h1c s ALA 1046N -3.39 3.30 -0.05 2.41 0.00 -1.20 -4.90 121.76 117.92 3h1c s ALA 1046Ca 0.58 0.47 0.21 0.00 0.00 0.00 0.00 51.96 53.23 3h1c s ALA 1046Cb 0.48 -3.17 0.57 0.00 0.00 0.00 0.00 23.12 20.99 3h1c s ALA 1046CO 0.06 0.03 1.67 0.00 0.00 0.00 0.00 175.76 177.52 3h1c h THR 1047N 3.98 0.55 -3.61 0.00 1.03 -1.93 -3.43 112.91 109.50 3h1c h THR 1047Ca -0.44 -1.44 -0.36 0.00 -0.01 0.00 0.00 66.41 64.16 3h1c h THR 1047Cb 1.21 2.01 -0.32 0.00 -1.07 0.00 0.00 68.15 69.98 3h1c h THR 1047CO 0.71 0.27 -0.76 -1.00 -0.01 0.00 0.00 175.52 174.73 3h1c s HIS 1048N -3.35 0.51 -0.03 0.00 3.76 -1.26 -5.15 115.29 109.76 3h1c s HIS 1048Ca 0.03 -0.10 0.04 0.00 -0.15 0.00 0.00 55.06 54.87 3h1c s HIS 1048Cb 0.08 -0.46 -0.00 0.00 1.11 0.00 0.00 32.58 33.31 3h1c s HIS 1048CO 0.67 -0.11 -0.14 -1.58 -0.85 0.00 0.00 174.74 172.74 3h1c s HIS 1049N 0.61 1.38 -0.09 1.40 2.46 -1.26 -5.14 115.29 114.64 3h1c s HIS 1049Ca -0.07 -0.36 -0.06 0.00 0.47 0.00 0.00 55.06 55.03 3h1c s HIS 1049Cb -0.10 -0.94 0.03 0.00 -0.13 0.00 0.00 32.58 31.44 3h1c s HIS 1049CO -0.00 -0.12 0.23 0.00 -2.47 0.00 0.00 174.74 172.38 3h1c s ALA 1050N 0.05 -0.55 0.02 1.58 0.00 -1.26 -5.17 121.76 116.43 3h1c s ALA 1050Ca -0.02 0.81 0.05 0.00 0.00 0.00 0.00 51.96 52.79 3h1c s ALA 1050Cb -0.10 -0.50 -0.02 0.00 0.00 0.00 0.00 23.12 22.51 3h1c s ALA 1050CO 0.01 -0.15 -0.14 0.45 0.00 0.00 0.00 175.76 175.93 3h1c s SER 1051N 0.68 1.63 0.05 0.00 0.15 -1.26 -5.16 113.70 109.79 3h1c s SER 1051Ca -0.05 -0.38 0.00 0.00 0.70 0.00 0.00 55.95 56.23 3h1c s SER 1051Cb -0.06 -0.13 -0.03 0.00 -1.71 0.00 0.00 66.02 64.09 3h1c s SER 1051CO -0.04 0.08 -0.04 0.00 1.20 0.00 0.00 173.24 174.44 3h1c s ALA 1052N -0.65 0.45 0.12 5.45 0.00 -1.26 -5.17 121.76 120.70 3h1c s ALA 1052Ca 0.03 -0.97 0.06 0.00 0.00 0.00 0.00 51.96 51.08 3h1c s ALA 1052Cb -0.07 0.19 -0.04 0.00 0.00 0.00 0.00 23.12 23.20 3h1c s ALA 1052CO 0.01 -0.24 -0.04 0.00 0.00 0.00 0.00 175.76 175.49 3h1c s ALA 1053N -2.76 3.15 0.08 0.00 0.00 -1.26 -5.08 121.76 115.89 3h1c s ALA 1053Ca -0.02 -1.24 -0.30 0.00 0.00 0.00 0.00 51.96 50.40 3h1c s ALA 1053Cb -0.00 -1.03 -0.10 0.00 0.00 0.00 0.00 23.12 21.99 3h1c s ALA 1053CO -0.05 0.62 1.91 -1.25 0.00 0.00 0.00 175.76 176.99 3h1c s PRO 1054N -2.47 4.14 0.09 0.00 0.04 -1.26 -4.97 135.00 130.57 3h1c s PRO 1054Ca 0.25 2.62 -0.13 0.00 0.04 0.00 0.00 61.00 63.77 3h1c s PRO 1054Cb -0.11 -3.89 0.02 0.00 0.04 0.00 0.00 34.50 30.56 3h1c s PRO 1054CO 0.17 -0.91 0.31 0.00 0.04 0.00 0.00 177.00 176.61 3h1c s ALA 1055N 3.65 -0.66 0.08 8.56 0.00 -1.26 -5.14 121.76 126.99 3h1c s ALA 1055Ca 0.85 -0.20 -0.31 0.00 0.00 0.00 0.00 51.96 52.30 3h1c s ALA 1055Cb -0.45 0.53 -0.06 0.00 0.00 0.00 0.00 23.12 23.14 3h1c s ALA 1055CO 0.39 -0.54 1.24 0.50 0.00 0.00 0.00 175.76 177.35 3h1c s ARG 1056N -3.50 4.41 0.62 0.00 3.52 -1.26 -5.00 118.95 117.74 3h1c s ARG 1056Ca 0.02 1.85 -0.18 0.00 -0.13 0.00 0.00 55.73 57.28 3h1c s ARG 1056Cb 0.02 -3.32 -0.02 0.00 -1.56 0.00 0.00 34.95 30.07 3h1c s ARG 1056CO -0.09 -0.30 1.22 -1.25 -0.81 0.00 0.00 175.30 174.07 3h1c s PRO 1057N 1.04 2.79 -0.19 5.12 0.04 -1.26 -4.96 135.00 137.58 3h1c s PRO 1057Ca 0.60 1.84 -0.29 0.00 0.04 0.00 0.00 61.00 63.18 3h1c s PRO 1057Cb -0.31 -1.90 -0.02 0.00 0.04 0.00 0.00 34.50 32.30 3h1c s PRO 1057CO 0.30 -1.35 1.49 -1.14 0.04 0.00 0.00 177.00 176.34 3h1c s GLN 1058N -3.45 3.97 0.00 4.56 2.00 -1.26 -5.36 119.66 120.13 3h1c s GLN 1058Ca 0.77 1.68 0.19 0.00 -2.00 0.00 0.00 55.36 56.00 3h1c s GLN 1058Cb -0.31 -3.94 1.13 0.00 0.80 0.00 0.00 33.01 30.68 3h1c s GLN 1058CO 0.36 -1.07 1.52 -0.35 -0.50 0.00 0.00 175.29 175.25