#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3e1d n LYS 2 N 0.00 1.06 0.00 2.12 4.81 -1.26 -4.93 118.16 119.96 3e1d n LYS 2 Ca 0.00 -0.05 0.00 0.00 -0.87 0.00 0.00 58.31 57.39 3e1d n LYS 2 Cb 0.00 -1.50 0.00 0.00 0.02 0.00 0.00 35.03 33.55 3e1d n LYS 2 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 3e1d n ARG 3 N -0.00 0.00 0.00 1.64 0.63 -1.26 -4.90 116.66 112.77 3e1d n ARG 3 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 3e1d n ARG 3 Cb 0.26 0.00 0.00 0.00 0.45 0.00 0.00 32.46 33.17 3e1d n ARG 3 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 3e1d n THR 4 N 0.25 0.00 0.80 5.15 -2.24 -1.26 -5.05 114.28 111.93 3e1d n THR 4 Ca 0.00 0.00 0.10 0.00 -2.27 0.00 0.00 64.05 61.88 3e1d n THR 4 Cb 0.00 0.00 0.47 0.00 -2.10 0.00 0.00 70.33 68.70 3e1d n THR 4 CO 0.00 0.00 0.00 0.33 -0.57 0.00 0.00 175.07 174.83 3e1d n PHE 5 N -1.77 0.00 -1.45 4.78 -0.00 -1.26 -5.00 117.46 112.77 3e1d n PHE 5 Ca 0.00 0.00 -0.34 0.00 -0.00 0.00 0.00 57.45 57.11 3e1d n PHE 5 Cb 0.00 -0.42 0.09 0.00 -0.00 0.00 0.00 39.48 39.15 3e1d n PHE 5 CO 0.00 0.00 0.00 -0.65 -0.00 0.00 0.00 176.76 176.11 3e1d s GLN 6 N -2.85 2.17 0.39 -4.13 -0.21 -1.26 -5.05 119.66 108.73 3e1d s GLN 6 Ca 0.13 1.72 -0.23 0.00 0.02 0.00 0.00 55.36 57.01 3e1d s GLN 6 Cb 0.14 -1.84 -0.10 0.00 1.00 0.00 0.00 33.01 32.20 3e1d s GLN 6 CO 0.35 -1.80 0.96 -1.25 -2.12 0.00 0.00 175.29 171.42 3e1d s PRO 7 N -3.94 4.34 -0.21 2.91 0.04 -1.26 -5.07 135.00 131.81 3e1d s PRO 7 Ca 0.74 1.22 -0.33 0.00 0.04 0.00 0.00 61.00 62.67 3e1d s PRO 7 Cb -0.28 -2.42 0.15 0.00 0.04 0.00 0.00 34.50 31.98 3e1d s PRO 7 CO 0.45 0.07 1.21 0.45 0.04 0.00 0.00 177.00 179.22 3e1d s SER 8 N -1.94 -0.15 -0.20 6.66 0.15 -1.26 -5.10 113.70 111.87 3e1d s SER 8 Ca 0.58 0.07 -0.13 0.00 0.70 0.00 0.00 55.95 57.16 3e1d s SER 8 Cb -0.13 0.14 -0.20 0.00 -1.71 0.00 0.00 66.02 64.12 3e1d s SER 8 CO 0.18 -0.20 0.13 0.55 1.20 0.00 0.00 173.24 175.09 3e1d n VAL 9 N 0.17 1.61 0.31 4.45 3.14 -1.26 -4.65 118.33 122.09 3e1d n VAL 9 Ca -0.01 -0.34 0.17 0.00 -2.96 0.00 0.00 64.34 61.20 3e1d n VAL 9 Cb 0.58 -1.86 0.76 0.00 -1.06 0.00 0.00 33.84 32.27 3e1d n VAL 9 CO 0.00 0.00 0.00 0.17 -6.46 0.00 0.00 176.83 170.54 3e1d h LEU 10 N -0.57 0.00 -0.84 6.55 -0.00 -2.02 -2.55 115.31 115.89 3e1d h LEU 10 Ca -0.45 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.43 3e1d h LEU 10 Cb 1.64 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.30 3e1d h LEU 10 CO -0.14 0.00 0.00 0.29 -0.00 0.00 0.00 178.44 178.59 3e1d n LYS 11 N -2.87 1.53 0.02 0.17 4.76 -1.26 -4.02 118.16 116.50 3e1d n LYS 11 Ca -0.00 -0.76 0.11 0.00 -2.87 0.00 0.00 58.31 54.79 3e1d n LYS 11 Cb 0.22 -1.20 -0.08 0.00 -1.84 0.00 0.00 35.03 32.12 3e1d n LYS 11 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3e1d n ARG 12 N 0.11 0.50 0.19 1.97 1.74 -0.96 -4.45 116.66 115.77 3e1d n ARG 12 Ca 0.07 -0.07 0.14 0.00 -0.77 0.00 0.00 57.85 57.22 3e1d n ARG 12 Cb 0.20 -1.60 0.63 0.00 -1.02 0.00 0.00 32.46 30.67 3e1d n ARG 12 CO 0.00 0.00 0.00 -0.97 -1.52 0.00 0.00 177.63 175.14 3e1d h ASN 13 N 0.00 0.00 0.00 0.55 -1.24 -1.82 0.32 115.58 113.40 3e1d h ASN 13 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 3e1d h ASN 13 Cb 0.89 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.94 3e1d h ASN 13 CO 0.00 0.00 0.00 0.54 -1.29 0.00 0.00 177.43 176.68 3e1d n ARG 14 N -2.54 0.78 0.15 6.67 5.12 -1.26 -4.89 116.66 120.68 3e1d n ARG 14 Ca 0.01 -0.38 0.00 0.00 -1.93 0.00 0.00 57.85 55.54 3e1d n ARG 14 Cb 0.20 -0.88 0.00 0.00 -1.16 0.00 0.00 32.46 30.62 3e1d n ARG 14 CO 0.00 0.00 0.00 0.45 -1.93 0.00 0.00 177.63 176.15 3e1d n SER 15 N -0.22 -0.77 -1.07 0.55 2.88 -0.99 -5.01 113.62 109.00 3e1d n SER 15 Ca 0.00 0.52 0.09 0.00 -1.33 0.00 0.00 58.87 58.15 3e1d n SER 15 Cb 0.00 0.91 0.26 0.00 -0.75 0.00 0.00 64.21 64.63 3e1d n SER 15 CO 0.00 0.00 0.00 1.41 -1.23 0.00 0.00 175.04 175.22 3e1d n HIS 16 N -3.40 0.84 -3.33 0.66 8.25 0.01 -4.99 115.22 113.26 3e1d n HIS 16 Ca 0.00 -0.54 -0.38 0.00 -0.26 0.00 0.00 57.72 56.54 3e1d n HIS 16 Cb 0.00 -0.06 -0.06 0.00 1.12 0.00 0.00 29.99 30.98 3e1d n HIS 16 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3e1d s GLY 17 N -1.04 2.25 0.04 -1.41 0.00 -0.63 -4.97 107.32 101.56 3e1d s GLY 17 Ca 0.38 -0.32 -0.24 0.00 0.00 0.00 0.00 44.72 44.55 3e1d s GLY 17 CO 0.24 0.83 1.50 0.74 0.00 0.00 0.00 173.10 176.40 3e1d h PHE 18 N 7.00 0.08 -0.72 1.90 0.04 -1.96 0.38 116.94 123.67 3e1d h PHE 18 Ca -0.38 -0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.37 3e1d h PHE 18 Cb 1.17 -0.02 -0.04 0.00 2.20 0.00 0.00 35.95 39.26 3e1d h PHE 18 CO 0.65 0.31 0.45 0.00 -0.60 0.00 0.00 178.31 179.12 3e1d h ARG 19 N -0.18 0.97 0.00 1.51 3.08 -1.99 -2.39 114.38 115.38 3e1d h ARG 19 Ca 0.01 -0.07 -0.07 0.00 0.07 0.00 0.00 59.98 59.92 3e1d h ARG 19 Cb 0.27 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.10 3e1d h ARG 19 CO 0.00 0.67 -0.34 0.00 -1.07 0.00 0.00 179.97 179.23 3e1d h ALA 20 N 1.51 1.24 0.00 0.04 0.00 -1.88 0.28 119.26 120.45 3e1d h ALA 20 Ca 0.26 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3e1d h ALA 20 Cb -0.06 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.67 3e1d h ALA 20 CO -0.05 0.42 0.00 0.54 0.00 0.00 0.00 179.25 180.16 3e1d n ARG 21 N -3.84 0.09 -0.11 0.00 1.74 0.10 -0.47 116.66 114.17 3e1d n ARG 21 Ca -0.01 0.34 -0.15 0.00 -0.77 0.00 0.00 57.85 57.25 3e1d n ARG 21 Cb 0.41 -1.68 -0.11 0.00 -1.02 0.00 0.00 32.46 30.06 3e1d n ARG 21 CO 0.00 0.00 0.00 -1.33 -1.52 0.00 0.00 177.63 174.78 3e1d n MET 22 N -1.86 0.64 0.19 5.56 2.81 -0.91 -1.29 117.12 122.27 3e1d n MET 22 Ca 0.03 0.12 -0.15 0.00 -1.81 0.00 0.00 57.70 55.89 3e1d n MET 22 Cb 0.19 -1.47 -0.07 0.00 -0.71 0.00 0.00 33.22 31.16 3e1d n MET 22 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 3e1d h ALA 23 N 0.11 -0.61 -2.51 3.04 0.00 -0.33 -3.41 119.26 115.56 3e1d h ALA 23 Ca -0.52 -0.09 -0.53 0.00 0.00 0.00 0.00 54.91 53.76 3e1d h ALA 23 Cb 1.86 0.42 0.01 0.00 0.00 0.00 0.00 17.79 20.07 3e1d h ALA 23 CO -0.07 -0.88 0.57 0.95 0.00 0.00 0.00 179.25 179.82 3e1d s THR 24 N -6.05 3.95 0.34 0.00 -4.23 0.39 -4.96 115.64 105.09 3e1d s THR 24 Ca -0.16 1.43 0.06 0.00 -1.18 0.00 0.00 61.69 61.84 3e1d s THR 24 Cb 0.06 -3.91 0.13 0.00 1.34 0.00 0.00 72.50 70.12 3e1d s THR 24 CO 0.64 0.12 1.85 0.50 -0.54 0.00 0.00 174.62 177.20 3e1d h LYS 25 N 6.62 0.37 -0.57 3.99 3.64 -1.88 -2.36 116.57 126.38 3e1d h LYS 25 Ca -0.42 -0.10 0.12 0.00 -1.27 0.00 0.00 60.65 58.98 3e1d h LYS 25 Cb 1.21 -0.04 -0.10 0.00 -0.41 0.00 0.00 32.23 32.89 3e1d h LYS 25 CO 0.81 0.51 -0.07 -0.91 -2.27 0.00 0.00 179.45 177.51 3e1d h ASN 26 N 0.35 -0.39 -0.29 4.20 2.35 -1.92 -0.07 115.58 119.80 3e1d h ASN 26 Ca 0.07 0.16 -0.05 0.00 -0.55 0.00 0.00 56.30 55.92 3e1d h ASN 26 Cb 0.44 0.30 -0.02 0.00 0.05 0.00 0.00 38.32 39.10 3e1d h ASN 26 CO 0.03 -0.15 0.01 1.23 -1.65 0.00 0.00 177.43 176.90 3e1d h GLY 27 N 0.06 0.66 1.31 2.83 0.00 -1.73 -3.40 103.07 102.80 3e1d h GLY 27 Ca 0.29 -0.40 -0.05 0.00 0.00 0.00 0.00 47.33 47.17 3e1d h GLY 27 CO -0.54 0.38 0.16 -0.09 0.00 0.00 0.00 176.54 176.45 3e1d h ARG 28 N 0.59 0.87 -0.43 4.80 2.43 0.36 -2.04 114.38 120.96 3e1d h ARG 28 Ca 0.12 -0.17 -0.08 0.00 -0.81 0.00 0.00 59.98 59.05 3e1d h ARG 28 Cb 0.35 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 3e1d h ARG 28 CO 0.01 0.77 -0.03 1.96 -1.51 0.00 0.00 179.97 181.17 3e1d h GLN 29 N 0.84 0.78 -0.40 0.20 7.50 -1.76 -2.99 115.11 119.29 3e1d h GLN 29 Ca 0.19 -0.26 0.05 0.00 0.50 0.00 0.00 58.65 59.12 3e1d h GLN 29 Cb 0.27 -0.06 -0.04 0.00 0.05 0.00 0.00 27.48 27.70 3e1d h GLN 29 CO -0.01 0.86 0.15 0.28 -1.50 0.00 0.00 178.83 178.61 3e1d h VAL 30 N 0.62 0.88 0.28 -0.54 2.07 -1.60 -0.05 116.25 117.90 3e1d h VAL 30 Ca 0.12 -0.11 -0.01 0.00 0.82 0.00 0.00 66.70 67.53 3e1d h VAL 30 Cb 0.53 0.55 -0.00 0.00 -1.52 0.00 0.00 31.29 30.84 3e1d h VAL 30 CO 0.03 0.06 -0.17 0.25 0.02 0.00 0.00 177.57 177.75 3e1d h LEU 31 N 0.31 -0.43 0.30 2.57 7.12 -1.38 0.18 115.31 123.98 3e1d h LEU 31 Ca 0.18 0.03 -0.00 0.00 0.13 0.00 0.00 57.88 58.22 3e1d h LEU 31 Cb 0.16 0.13 -0.02 0.00 -0.53 0.00 0.00 40.66 40.40 3e1d h LEU 31 CO -0.19 -0.28 -0.29 0.00 -0.13 0.00 0.00 178.44 177.56 3e1d h ALA 32 N 0.27 -0.62 0.00 1.25 0.00 -1.55 -1.99 119.26 116.63 3e1d h ALA 32 Ca -0.03 -0.10 -0.00 0.00 0.00 0.00 0.00 54.91 54.79 3e1d h ALA 32 Cb 0.36 0.41 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 3e1d h ALA 32 CO 0.03 -0.88 -0.00 -0.09 0.00 0.00 0.00 179.25 178.31 3e1d h ARG 33 N -0.62 0.00 0.00 0.00 2.43 -0.44 -0.99 114.38 114.76 3e1d h ARG 33 Ca -0.01 0.00 -0.16 0.00 -0.81 0.00 0.00 59.98 59.00 3e1d h ARG 33 Cb 0.56 0.00 -0.03 0.00 -0.42 0.00 0.00 29.97 30.09 3e1d h ARG 33 CO -0.05 0.00 -1.13 -0.09 -1.51 0.00 0.00 179.97 177.19 3e1d h ARG 34 N 0.00 0.00 0.00 0.20 9.65 -0.57 -3.05 114.38 120.61 3e1d h ARG 34 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 3e1d h ARG 34 Cb 0.00 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.58 3e1d h ARG 34 CO 0.00 0.40 0.00 2.89 2.80 0.00 0.00 179.97 186.06 3e1d n ARG 35 N -3.02 0.00 -0.30 0.20 1.85 -0.76 -4.43 116.66 110.20 3e1d n ARG 35 Ca -0.06 0.00 -0.04 0.00 -1.00 0.00 0.00 57.85 56.75 3e1d n ARG 35 Cb 0.82 0.00 0.08 0.00 -1.05 0.00 0.00 32.46 32.31 3e1d n ARG 35 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3e1d h ALA 36 N 0.00 1.05 0.04 2.89 0.00 -1.61 -2.65 119.26 118.99 3e1d h ALA 36 Ca 0.00 -0.08 -0.37 0.00 0.00 0.00 0.00 54.91 54.46 3e1d h ALA 36 Cb 0.00 -0.33 -0.05 0.00 0.00 0.00 0.00 17.79 17.41 3e1d h ALA 36 CO 0.00 0.49 -2.24 1.17 0.00 0.00 0.00 179.25 178.67 3e1d n LYS 37 N -4.48 0.69 0.00 0.00 3.00 -0.41 -4.59 118.16 112.37 3e1d n LYS 37 Ca 0.08 0.18 0.00 0.00 -0.00 0.00 0.00 58.31 58.58 3e1d n LYS 37 Cb 0.04 -1.61 0.00 0.00 0.00 0.00 0.00 35.03 33.46 3e1d n LYS 37 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 3e1d n GLY 38 N 2.06 0.80 3.57 3.14 0.00 -1.15 -4.79 105.19 108.82 3e1d n GLY 38 Ca -0.38 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.64 3e1d n GLY 38 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 3e1d n ARG 39 N 0.53 -0.62 0.00 1.61 3.00 -1.01 -4.57 116.66 115.60 3e1d n ARG 39 Ca 0.00 0.14 0.00 0.00 -0.00 0.00 0.00 57.85 57.99 3e1d n ARG 39 Cb 0.17 -4.42 0.00 0.00 0.00 0.00 0.00 32.46 28.21 3e1d n ARG 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 3e1d n ALA 40 N 0.98 0.00 -3.15 5.13 0.00 -1.14 -5.07 120.51 117.26 3e1d n ALA 40 Ca 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.33 3e1d n ALA 40 Cb 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.56 3e1d n ALA 40 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3e1d s ARG 41 N 3.14 1.15 0.08 0.00 0.52 -1.26 -4.83 118.95 117.75 3e1d s ARG 41 Ca 0.00 -0.63 0.00 0.00 -0.52 0.00 0.00 55.73 54.58 3e1d s ARG 41 Cb 0.00 0.51 0.00 0.00 0.52 0.00 0.00 34.95 35.98 3e1d s ARG 41 CO 0.00 -0.47 0.00 1.28 0.02 0.00 0.00 175.30 176.13 3e1d n LEU 42 N -0.28 0.42 0.00 2.53 4.77 -1.26 -4.93 117.00 118.26 3e1d n LEU 42 Ca -0.16 0.13 0.00 0.00 -0.03 0.00 0.00 56.01 55.94 3e1d n LEU 42 Cb 0.64 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.65 3e1d n LEU 42 CO 0.15 -0.47 0.00 0.35 -1.33 0.00 0.00 177.39 176.09 3e1d n THR 43 N -3.21 0.00 0.72 -5.08 -2.24 -1.26 -4.80 114.28 98.41 3e1d n THR 43 Ca 0.00 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.78 3e1d n THR 43 Cb 0.17 -0.39 0.05 0.00 -2.10 0.00 0.00 70.33 68.06 3e1d n THR 43 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 3e1d n VAL 44 N -1.71 0.68 0.08 2.28 3.14 -1.26 -4.62 118.33 116.91 3e1d n VAL 44 Ca 0.00 -0.22 0.01 0.00 -2.96 0.00 0.00 64.34 61.17 3e1d n VAL 44 Cb 0.00 -0.61 0.07 0.00 -1.06 0.00 0.00 33.84 32.24 3e1d n VAL 44 CO 0.00 0.00 0.00 -1.20 -6.46 0.00 0.00 176.83 169.17 3e1d n SER 45 N 0.14 0.02 0.00 6.55 7.64 -1.26 -5.20 113.62 121.51 3e1d n SER 45 Ca 0.05 0.51 0.04 0.00 1.01 0.00 0.00 58.87 60.48 3e1d n SER 45 Cb 0.47 -0.51 0.26 0.00 -1.01 0.00 0.00 64.21 63.42 3e1d n SER 45 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20