#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 3.36 0.09 4.61 0.00 -1.26 -5.14 121.76 123.43 3h1c s ALA 1040Ca 0.00 -1.47 0.03 0.00 0.00 0.00 0.00 51.96 50.51 3h1c s ALA 1040Cb 0.00 -1.06 -0.04 0.00 0.00 0.00 0.00 23.12 22.02 3h1c s ALA 1040CO 0.00 0.32 0.12 0.00 0.00 0.00 0.00 175.76 176.21 3h1c s ALA 1041N -2.09 3.68 0.00 0.00 0.00 -1.26 -4.84 121.76 117.25 3h1c s ALA 1041Ca 0.31 -1.01 0.00 0.00 0.00 0.00 0.00 51.96 51.26 3h1c s ALA 1041Cb -0.08 -1.52 0.00 0.00 0.00 0.00 0.00 23.12 21.52 3h1c s ALA 1041CO 0.22 0.72 0.00 0.41 0.00 0.00 0.00 175.76 177.11 3h1c n GLY 1042N 0.26 2.80 0.24 0.00 0.00 -1.26 -4.87 105.19 102.35 3h1c n GLY 1042Ca -0.08 -1.83 0.11 0.00 0.00 0.00 0.00 46.02 44.22 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 1.95 -0.02 0.00 -2.03 -2.89 103.07 100.08 3h1c h GLY 1043Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3h1c h GLY 1043CO 0.00 0.00 -0.05 1.12 0.00 0.00 0.00 176.54 177.61 3h1c h HIS 1044N 0.00 0.00 -0.64 5.60 -0.00 -1.99 -3.31 115.15 114.81 3h1c h HIS 1044Ca -0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 60.37 59.98 3h1c h HIS 1044Cb 0.58 0.00 -0.19 0.00 -0.00 0.00 0.00 27.41 27.80 3h1c h HIS 1044CO 0.00 0.00 0.50 0.25 -0.00 0.00 0.00 177.93 178.68 3h1c n THR 1045N -2.73 2.76 -2.79 6.12 -2.24 -1.09 -4.95 114.28 109.36 3h1c n THR 1045Ca 0.04 -1.67 -0.40 0.00 -2.27 0.00 0.00 64.05 59.75 3h1c n THR 1045Cb 0.49 -1.00 -0.06 0.00 -2.10 0.00 0.00 70.33 67.66 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 -2.29 3.35 0.16 6.98 0.00 -1.25 -4.93 121.76 123.79 3h1c s ALA 1046Ca 0.39 0.57 -0.01 0.00 0.00 0.00 0.00 51.96 52.91 3h1c s ALA 1046Cb 0.32 -3.17 0.01 0.00 0.00 0.00 0.00 23.12 20.28 3h1c s ALA 1046CO 0.03 0.21 1.39 0.00 0.00 0.00 0.00 175.76 177.39 3h1c h THR 1047N 3.25 1.40 -3.91 0.00 1.03 -1.95 -3.44 112.91 109.29 3h1c h THR 1047Ca -0.45 -2.29 -0.36 0.00 -0.01 0.00 0.00 66.41 63.30 3h1c h THR 1047Cb 1.20 2.25 -0.29 0.00 -1.07 0.00 0.00 68.15 70.24 3h1c h THR 1047CO 0.68 0.68 -0.77 -1.00 -0.01 0.00 0.00 175.52 175.11 3h1c s HIS 1048N -3.46 0.63 -0.04 0.00 0.09 -1.26 -5.16 115.29 106.09 3h1c s HIS 1048Ca -0.05 -0.12 0.03 0.00 -0.00 0.00 0.00 55.06 54.92 3h1c s HIS 1048Cb 0.10 -0.43 0.00 0.00 -0.00 0.00 0.00 32.58 32.26 3h1c s HIS 1048CO 0.84 -0.03 -0.13 -1.58 -0.00 0.00 0.00 174.74 173.85 3h1c s HIS 1049N -0.04 1.31 -0.11 1.40 5.04 -1.26 -5.13 115.29 116.49 3h1c s HIS 1049Ca 0.01 -0.36 -0.09 0.00 -1.54 0.00 0.00 55.06 53.08 3h1c s HIS 1049Cb -0.04 -0.91 0.03 0.00 0.04 0.00 0.00 32.58 31.70 3h1c s HIS 1049CO -0.00 -0.14 0.27 0.00 -2.34 0.00 0.00 174.74 172.53 3h1c s ALA 1050N 0.16 -0.67 0.01 1.58 0.00 -1.26 -5.17 121.76 116.41 3h1c s ALA 1050Ca -0.04 0.84 -0.07 0.00 0.00 0.00 0.00 51.96 52.69 3h1c s ALA 1050Cb -0.10 -0.50 -0.00 0.00 0.00 0.00 0.00 23.12 22.52 3h1c s ALA 1050CO 0.01 -0.15 0.12 -1.54 0.00 0.00 0.00 175.76 174.21 3h1c s SER 1051N 0.38 0.07 -0.02 0.00 1.04 -1.26 -5.17 113.70 108.74 3h1c s SER 1051Ca -0.02 -0.31 -0.03 0.00 0.48 0.00 0.00 55.95 56.07 3h1c s SER 1051Cb -0.04 0.21 0.00 0.00 0.10 0.00 0.00 66.02 66.30 3h1c s SER 1051CO -0.02 -0.41 0.07 0.00 0.98 0.00 0.00 173.24 173.86 3h1c s ALA 1052N -1.75 -0.16 0.41 5.32 0.00 -1.26 -5.16 121.76 119.15 3h1c s ALA 1052Ca -0.12 0.07 -0.16 0.00 0.00 0.00 0.00 51.96 51.75 3h1c s ALA 1052Cb -0.06 -0.06 -0.09 0.00 0.00 0.00 0.00 23.12 22.91 3h1c s ALA 1052CO -0.00 -0.07 0.86 0.00 0.00 0.00 0.00 175.76 176.54 3h1c s ALA 1053N -0.32 3.19 -0.22 0.00 0.00 -1.26 -4.99 121.76 118.16 3h1c s ALA 1053Ca -0.04 0.14 -0.28 0.00 0.00 0.00 0.00 51.96 51.78 3h1c s ALA 1053Cb -0.03 -2.95 -0.05 0.00 0.00 0.00 0.00 23.12 20.10 3h1c s ALA 1053CO 0.00 0.09 2.12 -1.25 0.00 0.00 0.00 175.76 176.73 3h1c s PRO 1054N -3.42 3.23 0.22 0.00 0.04 -1.26 -4.94 135.00 128.87 3h1c s PRO 1054Ca 0.57 1.95 -0.06 0.00 0.04 0.00 0.00 61.00 63.50 3h1c s PRO 1054Cb -0.10 -4.33 -0.02 0.00 0.04 0.00 0.00 34.50 30.09 3h1c s PRO 1054CO 0.21 -1.99 0.28 0.00 0.04 0.00 0.00 177.00 175.55 3h1c s ALA 1055N 7.80 0.52 0.03 8.56 0.00 -1.26 -5.14 121.76 132.28 3h1c s ALA 1055Ca 0.96 -1.32 -0.30 0.00 0.00 0.00 0.00 51.96 51.30 3h1c s ALA 1055Cb -0.32 1.22 -0.06 0.00 0.00 0.00 0.00 23.12 23.97 3h1c s ALA 1055CO 0.35 -0.70 1.33 0.50 0.00 0.00 0.00 175.76 177.24 3h1c s ARG 1056N -4.09 4.33 0.64 0.00 3.52 -1.26 -5.01 118.95 117.08 3h1c s ARG 1056Ca 0.31 1.92 -0.16 0.00 -0.13 0.00 0.00 55.73 57.66 3h1c s ARG 1056Cb 0.04 -3.45 -0.01 0.00 -1.56 0.00 0.00 34.95 29.97 3h1c s ARG 1056CO 0.10 -0.46 1.14 -1.25 -0.81 0.00 0.00 175.30 174.02 3h1c s PRO 1057N 1.78 2.82 -0.19 5.12 0.04 -1.26 -4.96 135.00 138.36 3h1c s PRO 1057Ca 0.62 1.54 -0.29 0.00 0.04 0.00 0.00 61.00 62.90 3h1c s PRO 1057Cb -0.32 -1.94 -0.03 0.00 0.04 0.00 0.00 34.50 32.25 3h1c s PRO 1057CO 0.27 -1.26 1.61 1.14 0.04 0.00 0.00 177.00 178.81 3h1c s GLN 1058N -3.83 3.89 0.00 4.56 -2.07 -1.26 -5.35 119.66 115.60 3h1c s GLN 1058Ca 0.70 1.77 0.29 0.00 -1.82 0.00 0.00 55.36 56.30 3h1c s GLN 1058Cb -0.23 -4.01 1.22 0.00 -1.09 0.00 0.00 33.01 28.90 3h1c s GLN 1058CO 0.38 -1.18 1.84 -0.35 -1.32 0.00 0.00 175.29 174.66