#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b22 n GLU 17 N 0.00 0.63 -2.15 3.49 0.28 -1.26 -5.11 120.64 116.52 1b22 n GLU 17 Ca 0.00 0.00 -0.24 0.00 -0.16 0.00 0.00 57.16 56.76 1b22 n GLU 17 Cb 0.00 0.00 0.15 0.00 1.43 0.00 0.00 31.44 33.02 1b22 n GLU 17 CO 0.00 0.00 0.00 0.39 -0.16 0.00 0.00 177.13 177.36 1b22 n GLU 18 N 0.00 -0.57 -3.74 3.44 -0.58 -1.26 -5.12 120.64 112.81 1b22 n GLU 18 Ca 0.00 -2.27 -0.17 0.00 -0.42 0.00 0.00 57.16 54.30 1b22 n GLU 18 Cb 0.00 -0.91 -0.06 0.00 -0.57 0.00 0.00 31.44 29.90 1b22 n GLU 18 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1b22 n SER 19 N -3.30 0.19 -1.45 1.62 2.88 -1.26 -5.10 113.62 107.19 1b22 n SER 19 Ca 0.15 -2.65 0.00 0.00 -1.33 0.00 0.00 58.87 55.05 1b22 n SER 19 Cb 0.55 1.06 0.00 0.00 -0.75 0.00 0.00 64.21 65.06 1b22 n SER 19 CO 0.00 0.00 0.00 0.49 -1.23 0.00 0.00 175.04 174.30 1b22 n PHE 20 N -0.57 -3.97 0.00 0.66 3.72 -1.26 -5.07 117.46 110.97 1b22 n PHE 20 Ca 0.01 2.15 0.00 0.00 -0.05 0.00 0.00 57.45 59.56 1b22 n PHE 20 Cb 0.46 -3.36 0.00 0.00 -0.94 0.00 0.00 39.48 35.64 1b22 n PHE 20 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1b22 n GLY 21 N -2.30 2.87 0.16 1.37 0.00 -1.26 -4.86 105.19 101.16 1b22 n GLY 21 Ca 0.00 -1.37 0.13 0.00 0.00 0.00 0.00 46.02 44.78 1b22 n GLY 21 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1b22 h PRO 22 N 0.00 0.00 -4.65 1.61 0.13 -1.88 -3.47 132.00 123.75 1b22 h PRO 22 Ca 0.00 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.72 1b22 h PRO 22 Cb 0.00 0.00 0.07 0.00 0.13 0.00 0.00 31.00 31.20 1b22 h PRO 22 CO 0.00 0.00 -0.62 1.04 -0.23 0.00 0.00 178.00 178.19 1b22 n GLN 23 N -2.40 -5.31 -0.49 0.86 3.00 -1.26 -4.44 117.38 107.34 1b22 n GLN 23 Ca 0.02 0.91 -0.15 0.00 -0.01 0.00 0.00 57.00 57.76 1b22 n GLN 23 Cb 0.24 -5.80 -0.01 0.00 0.00 0.00 0.00 30.24 24.67 1b22 n GLN 23 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 1b22 n PRO 24 N -4.17 1.30 0.05 -1.09 -0.04 -1.26 -1.43 135.00 128.36 1b22 n PRO 24 Ca -0.10 -1.13 0.11 0.00 -0.04 0.00 0.00 63.50 62.35 1b22 n PRO 24 Cb 0.61 -2.31 0.46 0.00 -0.04 0.00 0.00 33.50 32.23 1b22 n PRO 24 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1b22 n ILE 25 N 4.59 0.58 0.00 0.52 -5.35 -1.26 -4.10 119.36 114.33 1b22 n ILE 25 Ca 0.29 0.06 0.00 0.00 -0.27 0.00 0.00 62.75 62.83 1b22 n ILE 25 Cb 0.10 -0.79 0.00 0.00 -1.74 0.00 0.00 39.64 37.20 1b22 n ILE 25 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 1b22 n SER 26 N -1.81 0.00 0.03 7.28 2.88 -1.24 -0.09 113.62 120.67 1b22 n SER 26 Ca 0.05 0.93 0.20 0.00 -1.33 0.00 0.00 58.87 58.71 1b22 n SER 26 Cb 0.29 -0.43 0.70 0.00 -0.75 0.00 0.00 64.21 64.02 1b22 n SER 26 CO 0.00 0.00 0.00 0.03 -1.23 0.00 0.00 175.04 173.84 1b22 h ARG 27 N 0.00 0.00 0.00 -1.46 3.08 -1.84 0.54 114.38 114.70 1b22 h ARG 27 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1b22 h ARG 27 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 1b22 h ARG 27 CO 0.00 0.00 0.00 1.28 -1.07 0.00 0.00 179.97 180.18 1b22 n LEU 28 N -4.29 0.29 0.07 3.04 7.99 0.87 -2.61 117.00 122.36 1b22 n LEU 28 Ca 0.09 0.66 -0.19 0.00 -0.01 0.00 0.00 56.01 56.56 1b22 n LEU 28 Cb 0.58 -0.40 -0.10 0.00 -0.11 0.00 0.00 43.42 43.39 1b22 n LEU 28 CO 0.35 -0.40 0.03 1.05 -1.51 0.00 0.00 177.39 176.92 1b22 h GLU 29 N 0.00 0.57 -0.26 3.23 4.11 -0.88 -2.03 114.58 119.32 1b22 h GLU 29 Ca 0.00 -0.69 -0.02 0.00 0.07 0.00 0.00 59.36 58.72 1b22 h GLU 29 Cb 0.00 0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 1b22 h GLU 29 CO 0.00 1.29 0.07 0.37 0.07 0.00 0.00 179.01 180.81 1b22 h GLN 30 N 0.28 0.36 0.00 1.06 4.15 -0.00 0.12 115.11 121.09 1b22 h GLN 30 Ca -0.14 -0.04 0.00 0.00 0.77 0.00 0.00 58.65 59.23 1b22 h GLN 30 Cb 1.78 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 29.40 1b22 h GLN 30 CO 0.21 0.33 0.00 0.00 -1.93 0.00 0.00 178.83 177.44 1b22 n GLY 32 N 1.21 0.58 0.00 0.00 0.00 0.42 -5.06 105.19 102.34 1b22 n GLY 32 Ca 0.06 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.31 1b22 n GLY 32 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1b22 n ILE 33 N 0.00 0.00 0.00 -0.61 0.13 -0.77 -4.92 119.36 113.19 1b22 n ILE 33 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 1b22 n ILE 33 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 38.80 1b22 n ILE 33 CO 0.00 0.00 0.00 -3.20 2.80 0.00 0.00 176.55 176.15 1b22 n ASN 34 N 0.00 0.00 0.22 9.51 2.85 -1.26 -4.77 115.26 121.81 1b22 n ASN 34 Ca 0.00 0.00 0.10 0.00 -0.11 0.00 0.00 54.58 54.57 1b22 n ASN 34 Cb 0.00 0.00 0.55 0.00 1.24 0.00 0.00 39.78 41.57 1b22 n ASN 34 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1b22 h ALA 35 N -2.00 1.20 -0.16 5.20 0.00 -1.96 -3.16 119.26 118.38 1b22 h ALA 35 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1b22 h ALA 35 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1b22 h ALA 35 CO 0.00 -0.20 0.00 0.09 0.00 0.00 0.00 179.25 179.14 1b22 n ASN 36 N -2.35 0.00 0.00 0.00 4.13 -1.26 -1.84 115.26 113.94 1b22 n ASN 36 Ca -0.01 0.97 0.00 0.00 1.68 0.00 0.00 54.58 57.22 1b22 n ASN 36 Cb 0.28 -0.47 0.00 0.00 -1.54 0.00 0.00 39.78 38.05 1b22 n ASN 36 CO 0.00 0.00 0.00 -0.67 0.28 0.00 0.00 177.26 176.87 1b22 n ASP 37 N -2.39 0.00 -0.04 6.41 -0.08 -1.20 0.19 116.55 119.44 1b22 n ASP 37 Ca 0.00 0.42 -0.10 0.00 -1.51 0.00 0.00 54.79 53.61 1b22 n ASP 37 Cb 0.00 -0.18 -0.07 0.00 2.34 0.00 0.00 41.12 43.21 1b22 n ASP 37 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 1b22 h VAL 38 N 0.00 0.00 0.00 5.18 2.07 -1.78 -2.99 116.25 118.73 1b22 h VAL 38 Ca 0.00 0.00 -0.16 0.00 0.82 0.00 0.00 66.70 67.36 1b22 h VAL 38 Cb 0.00 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.75 1b22 h VAL 38 CO 0.00 0.00 -0.92 0.11 0.02 0.00 0.00 177.57 176.78 1b22 h LYS 39 N -0.33 0.00 -0.24 1.57 1.79 -0.36 -3.00 116.57 116.00 1b22 h LYS 39 Ca 0.03 0.00 0.04 0.00 -2.18 0.00 0.00 60.65 58.54 1b22 h LYS 39 Cb 0.42 0.00 -0.07 0.00 -1.58 0.00 0.00 32.23 31.00 1b22 h LYS 39 CO -0.33 0.88 -0.52 0.87 -1.08 0.00 0.00 179.45 179.26 1b22 h LYS 40 N -1.00 -0.46 0.00 3.15 1.57 0.20 -1.66 116.57 118.36 1b22 h LYS 40 Ca -0.24 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 1b22 h LYS 40 Cb 1.14 0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.55 1b22 h LYS 40 CO -0.15 -0.31 0.00 1.37 -0.57 0.00 0.00 179.45 179.80 1b22 h LEU 41 N -0.48 0.00 0.22 2.94 8.10 -1.39 -3.17 115.31 121.54 1b22 h LEU 41 Ca 0.05 0.00 -0.01 0.00 0.11 0.00 0.00 57.88 58.03 1b22 h LEU 41 Cb 0.61 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.84 1b22 h LEU 41 CO -0.48 0.00 -0.11 -0.33 -4.11 0.00 0.00 178.44 173.41 1b22 h GLU 42 N 0.00 -0.29 0.00 0.17 4.39 -1.15 0.29 114.58 117.99 1b22 h GLU 42 Ca 0.00 0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.72 1b22 h GLU 42 Cb 0.68 0.07 -0.00 0.00 -0.10 0.00 0.00 28.75 29.39 1b22 h GLU 42 CO 0.00 -0.19 -0.00 1.49 -1.16 0.00 0.00 179.01 179.14 1b22 h GLU 43 N -0.68 0.00 0.00 2.33 4.81 -1.72 -3.38 114.58 115.93 1b22 h GLU 43 Ca -0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.20 1b22 h GLU 43 Cb 0.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.61 1b22 h GLU 43 CO 0.05 0.00 0.00 0.00 -0.73 0.00 0.00 179.01 178.33 1b22 n ALA 44 N -2.10 3.00 0.00 2.92 0.00 -1.23 -5.09 120.51 118.01 1b22 n ALA 44 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1b22 n ALA 44 Cb 0.11 0.05 0.00 0.00 0.00 0.00 0.00 19.45 19.61 1b22 n ALA 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1b22 n GLY 45 N 2.17 0.84 0.50 0.00 0.00 0.10 -4.97 105.19 103.83 1b22 n GLY 45 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1b22 n GLY 45 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1b22 n PHE 46 N 0.00 0.05 -0.36 1.61 3.01 -1.25 -4.66 117.46 115.85 1b22 n PHE 46 Ca 0.00 -0.02 -0.16 0.00 1.01 0.00 0.00 57.45 58.29 1b22 n PHE 46 Cb 0.00 -0.10 -0.03 0.00 -0.01 0.00 0.00 39.48 39.34 1b22 n PHE 46 CO 0.00 0.00 0.00 -2.39 1.01 0.00 0.00 176.76 175.38 1b22 n HIS 47 N -0.02 0.51 0.00 1.38 1.44 -1.26 -4.42 115.22 112.85 1b22 n HIS 47 Ca 0.01 -0.99 0.00 0.00 -2.01 0.00 0.00 57.72 54.72 1b22 n HIS 47 Cb 0.25 -0.99 0.00 0.00 0.12 0.00 0.00 29.99 29.37 1b22 n HIS 47 CO 0.00 0.00 0.00 -2.37 -2.81 0.00 0.00 176.34 171.16 1b22 n THR 48 N 5.15 0.00 -0.23 0.61 5.66 -1.26 -3.62 114.28 120.59 1b22 n THR 48 Ca 0.22 0.00 0.27 0.00 -3.05 0.00 0.00 64.05 61.49 1b22 n THR 48 Cb 0.13 0.00 0.42 0.00 -1.55 0.00 0.00 70.33 69.32 1b22 n THR 48 CO 0.00 0.00 0.00 1.33 -3.05 0.00 0.00 175.07 173.35 1b22 n VAL 49 N -0.59 0.00 -0.38 1.08 0.24 -0.52 -1.53 118.33 116.63 1b22 n VAL 49 Ca 0.00 1.14 0.35 0.00 -2.04 0.00 0.00 64.34 63.79 1b22 n VAL 49 Cb 0.00 -2.03 0.53 0.00 -1.47 0.00 0.00 33.84 30.87 1b22 n VAL 49 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1b22 n GLU 50 N -3.09 0.01 0.26 7.34 -0.58 -1.26 0.34 120.64 123.65 1b22 n GLU 50 Ca 0.23 0.93 0.13 0.00 -0.42 0.00 0.00 57.16 58.02 1b22 n GLU 50 Cb 1.41 -2.23 0.58 0.00 -0.57 0.00 0.00 31.44 30.63 1b22 n GLU 50 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1b22 h ALA 51 N 0.64 1.73 -2.68 0.62 0.00 -1.49 -3.40 119.26 114.70 1b22 h ALA 51 Ca 0.61 -0.00 -0.61 0.00 0.00 0.00 0.00 54.91 54.90 1b22 h ALA 51 Cb 2.93 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 20.68 1b22 h ALA 51 CO -0.01 -0.65 -0.29 0.14 0.00 0.00 0.00 179.25 178.45 1b22 s VAL 52 N -4.17 5.17 -0.03 0.00 -7.23 0.15 -4.72 120.40 109.57 1b22 s VAL 52 Ca -0.03 0.49 -0.01 0.00 -1.81 0.00 0.00 61.98 60.63 1b22 s VAL 52 Cb 0.08 -3.62 0.00 0.00 0.56 0.00 0.00 36.38 33.40 1b22 s VAL 52 CO 0.26 0.44 0.01 0.00 -0.31 0.00 0.00 175.10 175.49 1b22 n ALA 53 N 1.36 -1.87 0.00 1.32 0.00 -1.26 -4.86 120.51 115.21 1b22 n ALA 53 Ca -0.12 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1b22 n ALA 53 Cb 0.53 -0.71 0.00 0.00 0.00 0.00 0.00 19.45 19.27 1b22 n ALA 53 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1b22 n TYR 54 N 1.65 -1.61 -3.53 0.00 9.36 -1.26 -5.01 117.16 116.77 1b22 n TYR 54 Ca -0.02 0.01 -0.13 0.00 3.32 0.00 0.00 57.90 61.08 1b22 n TYR 54 Cb 0.32 0.34 -0.05 0.00 -0.63 0.00 0.00 39.34 39.32 1b22 n TYR 54 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1b22 s ALA 55 N -2.00 -1.82 -0.18 2.98 0.00 -1.26 -5.11 121.76 114.37 1b22 s ALA 55 Ca 0.00 1.27 -0.29 0.00 0.00 0.00 0.00 51.96 52.94 1b22 s ALA 55 Cb 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 23.12 23.01 1b22 s ALA 55 CO 0.00 -0.45 1.64 -1.25 0.00 0.00 0.00 175.76 175.71 1b22 s PRO 56 N -1.77 3.88 0.37 0.00 0.04 -1.26 -4.85 135.00 131.41 1b22 s PRO 56 Ca -0.04 1.81 0.23 0.00 0.04 0.00 0.00 61.00 63.04 1b22 s PRO 56 Cb -0.00 -4.03 1.30 0.00 0.04 0.00 0.00 34.50 31.80 1b22 s PRO 56 CO 0.01 -1.20 1.46 1.63 0.04 0.00 0.00 177.00 178.95 1b22 n LYS 57 N 7.55 -0.05 0.17 4.56 4.76 -1.26 0.25 118.16 134.14 1b22 n LYS 57 Ca 0.19 1.24 0.13 0.00 -2.87 0.00 0.00 58.31 57.00 1b22 n LYS 57 Cb 0.45 -2.30 0.68 0.00 -1.84 0.00 0.00 35.03 32.01 1b22 n LYS 57 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 1b22 h LYS 58 N 0.00 0.00 0.00 1.97 3.11 -1.90 0.10 116.57 119.85 1b22 h LYS 58 Ca 0.80 0.00 -0.04 0.00 -2.81 0.00 0.00 60.65 58.60 1b22 h LYS 58 Cb 2.27 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 33.49 1b22 h LYS 58 CO -0.62 0.00 -0.23 1.49 -2.81 0.00 0.00 179.45 177.27 1b22 h GLU 59 N 0.00 0.00 0.40 1.90 4.81 0.31 -2.80 114.58 119.20 1b22 h GLU 59 Ca 0.09 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.31 1b22 h GLU 59 Cb 0.37 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.73 1b22 h GLU 59 CO -0.00 0.99 -0.39 1.25 -0.73 0.00 0.00 179.01 180.13 1b22 h LEU 60 N -1.00 -1.06 -1.96 1.64 5.85 -1.19 -0.12 115.31 117.47 1b22 h LEU 60 Ca -0.06 0.08 0.33 0.00 0.84 0.00 0.00 57.88 59.07 1b22 h LEU 60 Cb 1.05 0.35 -0.05 0.00 0.37 0.00 0.00 40.66 42.37 1b22 h LEU 60 CO -0.04 -0.52 0.83 0.16 -0.34 0.00 0.00 178.44 178.54 1b22 h ILE 61 N -0.78 0.42 0.00 4.05 -0.00 -1.14 0.72 117.51 120.78 1b22 h ILE 61 Ca -0.05 -0.01 0.00 0.00 -0.00 0.00 0.00 64.86 64.80 1b22 h ILE 61 Cb 0.67 0.40 0.00 0.00 -0.00 0.00 0.00 36.82 37.89 1b22 h ILE 61 CO -0.04 0.00 0.33 -3.20 -0.00 0.00 0.00 178.15 175.24 1b22 n ASN 62 N -4.21 0.18 0.00 2.16 5.15 -0.06 -1.74 115.26 116.74 1b22 n ASN 62 Ca 0.25 0.41 0.00 0.00 -0.60 0.00 0.00 54.58 54.64 1b22 n ASN 62 Cb 1.21 -0.35 0.00 0.00 -0.53 0.00 0.00 39.78 40.11 1b22 n ASN 62 CO 0.00 0.00 0.00 -0.38 1.40 0.00 0.00 177.26 178.28 1b22 n ILE 63 N -1.71 0.00 -0.02 -1.44 5.41 0.25 -3.80 119.36 118.04 1b22 n ILE 63 Ca -0.00 0.64 -0.16 0.00 1.00 0.00 0.00 62.75 64.23 1b22 n ILE 63 Cb 0.34 -1.21 -0.11 0.00 -0.71 0.00 0.00 39.64 37.94 1b22 n ILE 63 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 176.55 177.05 1b22 h LYS 64 N 0.00 0.24 0.00 0.38 1.63 -1.84 -3.47 116.57 113.51 1b22 h LYS 64 Ca 0.00 -0.25 0.00 0.00 -0.85 0.00 0.00 60.65 59.55 1b22 h LYS 64 Cb 0.00 0.07 0.00 0.00 -0.60 0.00 0.00 32.23 31.70 1b22 h LYS 64 CO 0.00 0.97 0.00 0.41 -3.45 0.00 0.00 179.45 177.38 1b22 n GLY 65 N 1.05 0.00 0.00 5.01 0.00 -1.18 -5.17 105.19 104.91 1b22 n GLY 65 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1b22 n GLY 65 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1b22 n ILE 66 N 0.00 0.00 0.00 -0.61 5.41 -0.71 -4.98 119.36 118.47 1b22 n ILE 66 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 1b22 n ILE 66 Cb 0.00 0.00 0.00 0.00 -0.71 0.00 0.00 39.64 38.93 1b22 n ILE 66 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 1b22 n SER 67 N 0.00 0.00 0.34 4.38 3.41 -1.26 -4.46 113.62 116.03 1b22 n SER 67 Ca 0.00 0.00 0.18 0.00 -0.26 0.00 0.00 58.87 58.79 1b22 n SER 67 Cb 0.00 0.00 0.95 0.00 -0.26 0.00 0.00 64.21 64.90 1b22 n SER 67 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1b22 h GLU 68 N 0.00 0.00 0.00 4.33 5.08 -1.96 -2.82 114.58 119.22 1b22 h GLU 68 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1b22 h GLU 68 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1b22 h GLU 68 CO 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 179.01 178.01 1b22 n ALA 69 N -1.95 -0.01 -0.07 3.43 0.00 -1.26 -1.40 120.51 119.25 1b22 n ALA 69 Ca -0.02 0.00 -0.12 0.00 0.00 0.00 0.00 53.44 53.30 1b22 n ALA 69 Cb 0.27 0.24 -0.10 0.00 0.00 0.00 0.00 19.45 19.87 1b22 n ALA 69 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1b22 h LYS 70 N 0.00 0.00 -0.02 0.00 6.56 -1.94 -2.74 116.57 118.43 1b22 h LYS 70 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1b22 h LYS 70 Cb 0.00 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.65 1b22 h LYS 70 CO 0.00 0.77 -0.04 0.00 -2.06 0.00 0.00 179.45 178.12 1b22 h ALA 71 N -0.27 -0.39 -0.88 3.86 0.00 -1.61 -0.19 119.26 119.78 1b22 h ALA 71 Ca -0.03 -0.00 0.17 0.00 0.00 0.00 0.00 54.91 55.05 1b22 h ALA 71 Cb 0.81 0.68 -0.07 0.00 0.00 0.00 0.00 17.79 19.21 1b22 h ALA 71 CO -0.02 -0.41 0.57 0.22 0.00 0.00 0.00 179.25 179.62 1b22 h ASP 72 N -0.04 0.55 -0.03 0.00 3.58 -1.37 0.30 116.42 119.40 1b22 h ASP 72 Ca 0.00 0.04 0.01 0.00 0.42 0.00 0.00 57.03 57.51 1b22 h ASP 72 Cb 0.05 -0.06 -0.00 0.00 1.72 0.00 0.00 39.33 41.03 1b22 h ASP 72 CO -0.04 0.26 0.06 0.50 -2.88 0.00 0.00 179.24 177.14 1b22 h LYS 73 N 0.57 0.00 0.18 0.28 3.64 -0.71 -1.84 116.57 118.69 1b22 h LYS 73 Ca 0.45 0.00 -0.26 0.00 -1.27 0.00 0.00 60.65 59.58 1b22 h LYS 73 Cb 0.89 0.00 0.02 0.00 -0.41 0.00 0.00 32.23 32.73 1b22 h LYS 73 CO -0.20 0.00 -1.17 0.82 -2.27 0.00 0.00 179.45 176.63 1b22 h ILE 74 N 0.00 1.33 0.00 2.00 1.08 0.73 -2.74 117.51 119.91 1b22 h ILE 74 Ca 0.02 -2.56 -0.00 0.00 -0.39 0.00 0.00 64.86 61.92 1b22 h ILE 74 Cb 0.13 3.05 -0.00 0.00 -3.07 0.00 0.00 36.82 36.94 1b22 h ILE 74 CO -0.00 0.75 -0.01 -0.07 -0.69 0.00 0.00 178.15 178.13 1b22 h LEU 75 N -0.18 0.00 0.00 1.44 4.07 -1.26 0.32 115.31 119.71 1b22 h LEU 75 Ca -0.22 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 57.69 1b22 h LEU 75 Cb 1.85 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.58 1b22 h LEU 75 CO 0.18 0.01 -0.34 0.00 -1.08 0.00 0.00 178.44 177.21 1b22 h ALA 76 N 1.99 0.07 -0.41 1.53 0.00 -1.43 -2.92 119.26 118.08 1b22 h ALA 76 Ca -0.00 -0.63 -0.12 0.00 0.00 0.00 0.00 54.91 54.16 1b22 h ALA 76 Cb 0.17 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1b22 h ALA 76 CO 0.00 0.20 -0.25 0.93 0.00 0.00 0.00 179.25 180.14 1b22 h GLU 77 N -1.00 0.84 -0.62 0.00 4.39 -1.24 -2.21 114.58 114.74 1b22 h GLU 77 Ca -0.09 -0.36 -0.05 0.00 0.34 0.00 0.00 59.36 59.21 1b22 h GLU 77 Cb 0.95 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 29.55 1b22 h GLU 77 CO -0.05 0.99 0.21 0.00 -1.16 0.00 0.00 179.01 179.00 1b22 h ALA 78 N 1.00 0.81 0.00 3.43 0.00 -0.51 0.13 119.26 124.12 1b22 h ALA 78 Ca 0.09 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 1b22 h ALA 78 Cb 0.78 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.33 1b22 h ALA 78 CO 0.06 0.47 -0.02 0.00 0.00 0.00 0.00 179.25 179.76 1b22 h ALA 79 N 1.08 1.00 -0.01 0.00 0.00 -1.39 0.30 119.26 120.24 1b22 h ALA 79 Ca 0.20 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1b22 h ALA 79 Cb 0.27 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.05 1b22 h ALA 79 CO -0.01 0.02 -0.63 1.17 0.00 0.00 0.00 179.25 179.80 1b22 n LYS 80 N -3.11 0.46 -0.00 0.00 4.81 -0.83 -4.20 118.16 115.29 1b22 n LYS 80 Ca 0.01 -0.35 -0.03 0.00 -0.87 0.00 0.00 58.31 57.07 1b22 n LYS 80 Cb 0.35 -1.49 -0.01 0.00 0.02 0.00 0.00 35.03 33.90 1b22 n LYS 80 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1b22 n LEU 81 N -0.97 0.53 -3.73 3.14 7.99 -0.03 -4.89 117.00 119.05 1b22 n LEU 81 Ca 0.07 0.08 -0.28 0.00 -0.01 0.00 0.00 56.01 55.87 1b22 n LEU 81 Cb 0.37 -0.19 -0.10 0.00 -0.11 0.00 0.00 43.42 43.39 1b22 n LEU 81 CO 0.35 -0.16 0.03 1.33 -1.51 0.00 0.00 177.39 177.43 1b22 n VAL 82 N -3.29 1.98 0.19 4.08 0.24 0.10 -4.87 118.33 116.76 1b22 n VAL 82 Ca -0.05 -5.02 0.06 0.00 -2.04 0.00 0.00 64.34 57.29 1b22 n VAL 82 Cb 0.41 -2.16 0.30 0.00 -1.47 0.00 0.00 33.84 30.91 1b22 n VAL 82 CO 0.00 0.00 0.00 1.55 -2.14 0.00 0.00 176.83 176.24 1b22 h PRO 83 N 4.95 0.00 0.00 7.34 0.13 -1.73 -3.42 132.00 139.27 1b22 h PRO 83 Ca 0.17 0.00 -0.17 0.00 -0.87 0.00 0.00 66.00 65.13 1b22 h PRO 83 Cb 0.72 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.81 1b22 h PRO 83 CO 0.77 0.35 -0.07 -0.12 -0.23 0.00 0.00 178.00 178.70 1b22 n MET 84 N -3.41 0.48 -0.66 0.86 1.56 -1.26 -4.57 117.12 110.11 1b22 n MET 84 Ca 0.00 -1.77 0.00 0.00 -0.27 0.00 0.00 57.70 55.66 1b22 n MET 84 Cb 0.54 1.74 0.00 0.00 2.15 0.00 0.00 33.22 37.65 1b22 n MET 84 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65