#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 -1.50 -2.05 3.44 4.07 -1.26 -5.00 120.64 118.33 1b22 n GLU 17 Ca 0.00 1.37 -0.01 0.00 -0.06 0.00 0.00 57.16 58.46 1b22 n GLU 17 Cb 0.00 -2.27 -0.00 0.00 -0.06 0.00 0.00 31.44 29.11 1b22 n GLU 17 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 1b22 n GLU 18 N 0.40 1.03 -4.21 5.31 1.02 -1.26 -5.18 120.64 117.76 1b22 n GLU 18 Ca -0.03 -0.08 -0.17 0.00 -0.02 0.00 0.00 57.16 56.86 1b22 n GLU 18 Cb 0.55 0.04 -0.07 0.00 -0.02 0.00 0.00 31.44 31.94 1b22 n GLU 18 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1b22 s SER 19 N -1.06 1.24 0.60 1.62 1.04 -1.26 -5.11 113.70 110.77 1b22 s SER 19 Ca 0.00 -1.62 0.00 0.00 0.48 0.00 0.00 55.95 54.82 1b22 s SER 19 Cb 0.00 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.69 1b22 s SER 19 CO 0.00 -1.12 0.00 0.49 0.98 0.00 0.00 173.24 173.59 1b22 n PHE 20 N -0.56 -4.24 0.00 5.02 3.72 -1.26 -5.05 117.46 115.09 1b22 n PHE 20 Ca 0.05 2.31 0.00 0.00 -0.05 0.00 0.00 57.45 59.75 1b22 n PHE 20 Cb 0.62 -3.62 0.00 0.00 -0.94 0.00 0.00 39.48 35.54 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 -2.97 0.98 3.83 1.37 0.00 -1.26 -5.05 105.19 102.09 1b22 n GLY 21 Ca -0.02 -1.34 -0.30 0.00 0.00 0.00 0.00 46.02 44.36 1b22 n GLY 21 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1b22 s PRO 22 N -4.87 2.56 -0.39 1.61 0.04 -1.26 -5.03 135.00 127.67 1b22 s PRO 22 Ca 0.00 0.70 0.11 0.00 0.04 0.00 0.00 61.00 61.85 1b22 s PRO 22 Cb 0.00 -1.97 0.35 0.00 0.04 0.00 0.00 34.50 32.92 1b22 s PRO 22 CO 0.00 -1.30 0.83 1.04 0.04 0.00 0.00 177.00 177.61 1b22 n GLN 23 N -3.22 0.99 -0.91 4.56 3.00 -1.26 -4.76 117.38 115.78 1b22 n GLN 23 Ca 0.07 -3.05 -0.30 0.00 -0.01 0.00 0.00 57.00 53.71 1b22 n GLN 23 Cb 0.56 -1.54 -0.03 0.00 0.00 0.00 0.00 30.24 29.23 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 0.28 1.89 -0.30 -1.09 -0.04 -1.26 -2.79 135.00 131.70 1b22 n PRO 24 Ca 0.20 -1.62 -0.05 0.00 -0.04 0.00 0.00 63.50 61.99 1b22 n PRO 24 Cb 0.67 -2.64 -0.04 0.00 -0.04 0.00 0.00 33.50 31.45 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 4.87 0.91 0.00 0.52 -5.35 -1.23 -4.43 119.36 114.65 1b22 n ILE 25 Ca 0.46 -0.48 0.00 0.00 -0.27 0.00 0.00 62.75 62.47 1b22 n ILE 25 Cb 0.23 -1.67 0.00 0.00 -1.74 0.00 0.00 39.64 36.46 1b22 n ILE 25 CO 0.00 0.00 0.00 -1.54 -1.76 0.00 0.00 176.55 173.25 1b22 n SER 26 N 3.15 0.00 0.16 7.28 3.41 -1.26 -2.77 113.62 123.60 1b22 n SER 26 Ca 0.14 0.54 0.13 0.00 -0.26 0.00 0.00 58.87 59.42 1b22 n SER 26 Cb 0.23 -0.33 0.46 0.00 -0.26 0.00 0.00 64.21 64.31 1b22 n SER 26 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 1b22 h ARG 27 N 0.00 0.00 0.00 4.33 2.47 -1.87 -2.51 114.38 116.80 1b22 h ARG 27 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 1b22 h ARG 27 Cb 0.00 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.32 1b22 h ARG 27 CO 0.00 0.00 0.00 1.28 0.56 0.00 0.00 179.97 181.81 1b22 n LEU 28 N -2.53 0.06 0.01 3.04 4.77 -1.25 -2.54 117.00 118.56 1b22 n LEU 28 Ca 0.03 0.61 -0.07 0.00 -0.03 0.00 0.00 56.01 56.55 1b22 n LEU 28 Cb 0.34 -0.12 -0.13 0.00 -2.33 0.00 0.00 43.42 41.18 1b22 n LEU 28 CO 0.26 -0.12 -0.25 1.05 -1.33 0.00 0.00 177.39 177.00 1b22 h GLU 29 N 0.00 0.00 -0.23 3.23 -0.00 -1.71 -2.00 114.58 113.86 1b22 h GLU 29 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 59.36 59.28 1b22 h GLU 29 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 28.74 1b22 h GLU 29 CO 0.00 0.66 -0.22 0.37 -0.00 0.00 0.00 179.01 179.81 1b22 h GLN 30 N 0.00 0.42 0.00 1.06 -0.00 -1.57 -1.27 115.11 113.75 1b22 h GLN 30 Ca -0.17 -0.14 0.00 0.00 -0.00 0.00 0.00 58.65 58.33 1b22 h GLN 30 Cb 1.89 -0.03 0.00 0.00 0.00 0.00 0.00 27.48 29.33 1b22 h GLN 30 CO 0.09 0.62 0.00 0.00 0.00 0.00 0.00 178.83 179.54 1b22 n GLY 32 N 1.26 0.65 0.00 0.00 0.00 -0.48 -5.06 105.19 101.56 1b22 n GLY 32 Ca 0.06 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.37 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 -0.76 -4.91 119.36 113.21 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 0.09 9.51 4.05 -1.26 -4.81 115.26 122.84 1b22 n ASN 34 Ca 0.00 0.00 0.12 0.00 0.45 0.00 0.00 54.58 55.15 1b22 n ASN 34 Cb 0.00 0.00 0.10 0.00 1.23 0.00 0.00 39.78 41.11 1b22 n ASN 34 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1b22 h ALA 35 N -2.00 0.57 -1.19 5.20 0.00 -1.94 -3.35 119.26 116.56 1b22 h ALA 35 Ca 0.00 0.00 0.38 0.00 0.00 0.00 0.00 54.91 55.29 1b22 h ALA 35 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 17.66 1b22 h ALA 35 CO 0.00 0.00 0.74 -0.91 0.00 0.00 0.00 179.25 179.08 1b22 h ASN 36 N 0.00 0.34 0.00 0.00 4.21 -1.88 -2.22 115.58 116.03 1b22 h ASN 36 Ca 0.00 0.15 0.00 0.00 1.21 0.00 0.00 56.30 57.66 1b22 h ASN 36 Cb 0.87 0.12 0.00 0.00 -1.12 0.00 0.00 38.32 38.19 1b22 h ASN 36 CO 0.00 -0.14 0.00 -0.90 -1.29 0.00 0.00 177.43 175.10 1b22 n ASP 37 N -4.79 0.00 -0.07 5.81 5.68 -1.26 0.18 116.55 122.11 1b22 n ASP 37 Ca 0.34 0.77 -0.11 0.00 -0.50 0.00 0.00 54.79 55.29 1b22 n ASP 37 Cb 1.24 -0.27 -0.05 0.00 -1.14 0.00 0.00 41.12 40.90 1b22 n ASP 37 CO 0.00 0.00 0.00 0.58 -1.33 0.00 0.00 177.20 176.45 1b22 h VAL 38 N 0.00 1.25 0.06 2.12 2.07 -1.75 -2.99 116.25 117.00 1b22 h VAL 38 Ca 0.00 -0.84 -0.00 0.00 0.82 0.00 0.00 66.70 66.68 1b22 h VAL 38 Cb 0.00 1.38 0.00 0.00 -1.52 0.00 0.00 31.29 31.15 1b22 h VAL 38 CO 0.00 0.26 -0.03 0.11 0.02 0.00 0.00 177.57 177.93 1b22 h LYS 39 N 0.15 -0.07 0.28 1.57 6.56 -1.13 -2.58 116.57 121.34 1b22 h LYS 39 Ca 0.06 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.64 1b22 h LYS 39 Cb 0.38 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 32.05 1b22 h LYS 39 CO 0.01 0.12 -0.13 0.87 -2.06 0.00 0.00 179.45 178.26 1b22 h LYS 40 N -1.01 -0.36 0.00 3.15 1.79 0.18 -2.82 116.57 117.50 1b22 h LYS 40 Ca -0.01 0.02 -0.13 0.00 -2.18 0.00 0.00 60.65 58.36 1b22 h LYS 40 Cb 0.23 0.08 -0.02 0.00 -1.58 0.00 0.00 32.23 30.94 1b22 h LYS 40 CO 0.01 -0.21 -1.21 1.37 -1.08 0.00 0.00 179.45 178.33 1b22 h LEU 41 N -0.41 0.00 0.17 2.94 8.10 -1.06 -3.11 115.31 121.94 1b22 h LEU 41 Ca -0.04 0.00 -0.35 0.00 0.11 0.00 0.00 57.88 57.61 1b22 h LEU 41 Cb 0.31 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.53 1b22 h LEU 41 CO 0.06 0.45 -1.77 -0.08 -4.11 0.00 0.00 178.44 173.00 1b22 h GLU 42 N 0.00 0.35 -0.11 0.17 4.81 -1.36 1.27 114.58 119.72 1b22 h GLU 42 Ca -0.11 -0.60 0.00 0.00 -0.13 0.00 0.00 59.36 58.52 1b22 h GLU 42 Cb 1.45 0.22 0.00 0.00 0.63 0.00 0.00 28.75 31.05 1b22 h GLU 42 CO 0.04 1.29 0.00 0.39 -0.73 0.00 0.00 179.01 180.00 1b22 n GLU 43 N -3.61 1.30 0.00 1.92 -0.58 -1.07 -4.35 120.64 114.25 1b22 n GLU 43 Ca -0.26 -0.46 0.00 0.00 -0.42 0.00 0.00 57.16 56.02 1b22 n GLU 43 Cb 1.05 -1.19 0.00 0.00 -0.57 0.00 0.00 31.44 30.73 1b22 n GLU 43 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1b22 n ALA 44 N -0.21 0.14 -0.55 0.62 0.00 -1.24 -4.92 120.51 114.35 1b22 n ALA 44 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1b22 n ALA 44 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.58 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 -0.96 1.00 2.53 0.00 0.00 0.44 -4.92 105.19 103.29 1b22 n GLY 45 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 45.95 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 -2.00 0.31 -2.23 1.61 3.72 -1.21 -4.67 117.46 112.99 1b22 n PHE 46 Ca 0.00 -0.80 -0.41 0.00 -0.05 0.00 0.00 57.45 56.18 1b22 n PHE 46 Cb 0.00 -0.94 0.00 0.00 -0.94 0.00 0.00 39.48 37.61 1b22 n PHE 46 CO 0.00 0.00 0.00 -2.39 -0.05 0.00 0.00 176.76 174.32 1b22 n HIS 47 N 3.57 2.70 -3.12 1.38 1.44 -1.26 -4.61 115.22 115.32 1b22 n HIS 47 Ca 0.18 -2.77 0.00 0.00 -2.01 0.00 0.00 57.72 53.11 1b22 n HIS 47 Cb 0.19 -1.80 0.00 0.00 0.12 0.00 0.00 29.99 28.50 1b22 n HIS 47 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1b22 n THR 48 N 2.21 0.00 -0.21 0.61 -2.24 -1.11 -4.01 114.28 109.52 1b22 n THR 48 Ca 0.50 0.00 0.26 0.00 -2.27 0.00 0.00 64.05 62.54 1b22 n THR 48 Cb 0.30 0.00 0.40 0.00 -2.10 0.00 0.00 70.33 68.93 1b22 n THR 48 CO 0.00 0.00 0.00 0.55 -0.57 0.00 0.00 175.07 175.05 1b22 n VAL 49 N 1.11 0.00 0.17 2.28 3.14 -1.12 -0.94 118.33 122.97 1b22 n VAL 49 Ca 0.00 1.13 0.05 0.00 -2.96 0.00 0.00 64.34 62.56 1b22 n VAL 49 Cb 0.00 -2.01 0.28 0.00 -1.06 0.00 0.00 33.84 31.05 1b22 n VAL 49 CO 0.00 0.00 0.00 -0.33 -6.46 0.00 0.00 176.83 170.04 1b22 h GLU 50 N 0.00 0.00 -3.66 1.45 5.08 -1.86 -3.30 114.58 112.28 1b22 h GLU 50 Ca 0.46 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.63 1b22 h GLU 50 Cb 2.65 0.00 0.01 0.00 0.50 0.00 0.00 28.75 31.91 1b22 h GLU 50 CO -0.00 0.00 1.78 0.00 -1.00 0.00 0.00 179.01 179.79 1b22 n ALA 51 N -1.50 2.94 0.00 3.43 0.00 -0.11 -4.65 120.51 120.62 1b22 n ALA 51 Ca -0.01 -1.03 0.00 0.00 0.00 0.00 0.00 53.44 52.41 1b22 n ALA 51 Cb 0.42 -2.74 0.00 0.00 0.00 0.00 0.00 19.45 17.13 1b22 n ALA 51 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.50 179.05 1b22 n VAL 52 N 4.50 0.00 -0.79 0.00 3.14 -1.24 -4.77 118.33 119.17 1b22 n VAL 52 Ca 0.23 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.61 1b22 n VAL 52 Cb 0.08 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.86 1b22 n VAL 52 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1b22 n ALA 53 N -0.41 0.00 -0.22 1.55 0.00 -1.26 -4.39 120.51 115.78 1b22 n ALA 53 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1b22 n ALA 53 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1b22 n ALA 53 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1b22 n TYR 54 N 0.00 0.00 -4.11 0.00 4.02 -1.26 -4.11 117.16 111.70 1b22 n TYR 54 Ca 0.00 0.00 -0.34 0.00 -0.01 0.00 0.00 57.90 57.55 1b22 n TYR 54 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 39.22 1b22 n TYR 54 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1b22 s ALA 55 N -1.00 3.32 0.10 -0.72 0.00 -1.26 -5.06 121.76 117.13 1b22 s ALA 55 Ca 0.00 -0.76 -0.31 0.00 0.00 0.00 0.00 51.96 50.89 1b22 s ALA 55 Cb 0.00 -1.82 -0.08 0.00 0.00 0.00 0.00 23.12 21.22 1b22 s ALA 55 CO 0.00 0.21 1.38 -1.25 0.00 0.00 0.00 175.76 176.10 1b22 s PRO 56 N 0.29 4.32 0.51 0.00 0.04 -1.26 -4.62 135.00 134.29 1b22 s PRO 56 Ca 0.02 2.05 0.43 0.00 0.04 0.00 0.00 61.00 63.54 1b22 s PRO 56 Cb -0.13 -3.29 1.64 0.00 0.04 0.00 0.00 34.50 32.76 1b22 s PRO 56 CO 0.01 -0.44 1.59 0.87 0.04 0.00 0.00 177.00 179.07 1b22 h LYS 57 N 6.91 0.01 0.00 4.56 6.56 -1.97 2.23 116.57 134.87 1b22 h LYS 57 Ca -0.42 -0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.17 1b22 h LYS 57 Cb 1.21 -0.00 0.00 0.00 -0.57 0.00 0.00 32.23 32.86 1b22 h LYS 57 CO 0.87 0.01 0.00 -0.22 -2.06 0.00 0.00 179.45 178.04 1b22 h LYS 58 N 0.01 0.00 0.14 3.15 3.64 -1.90 -2.14 116.57 119.47 1b22 h LYS 58 Ca 0.90 0.00 -0.32 0.00 -1.27 0.00 0.00 60.65 59.96 1b22 h LYS 58 Cb 3.33 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 35.15 1b22 h LYS 58 CO -0.18 0.00 -1.65 1.49 -2.27 0.00 0.00 179.45 176.84 1b22 h GLU 59 N 0.00 0.29 0.40 1.90 4.81 0.34 -2.88 114.58 119.43 1b22 h GLU 59 Ca 0.00 -0.50 -0.02 0.00 -0.13 0.00 0.00 59.36 58.71 1b22 h GLU 59 Cb 0.72 0.19 0.00 0.00 0.63 0.00 0.00 28.75 30.29 1b22 h GLU 59 CO 0.00 1.24 -0.19 1.25 -0.73 0.00 0.00 179.01 180.58 1b22 h LEU 60 N -0.11 -0.45 -1.88 1.64 5.85 -1.44 -1.96 115.31 116.96 1b22 h LEU 60 Ca -0.35 0.02 0.40 0.00 0.84 0.00 0.00 57.88 58.79 1b22 h LEU 60 Cb 1.92 0.12 -0.05 0.00 0.37 0.00 0.00 40.66 43.01 1b22 h LEU 60 CO 0.10 -0.28 1.06 0.16 -0.34 0.00 0.00 178.44 179.13 1b22 h ILE 61 N -0.62 0.22 -0.16 4.05 -0.00 -1.56 1.19 117.51 120.63 1b22 h ILE 61 Ca -0.05 0.00 0.05 0.00 -0.00 0.00 0.00 64.86 64.85 1b22 h ILE 61 Cb 0.41 0.24 -0.01 0.00 -0.00 0.00 0.00 36.82 37.47 1b22 h ILE 61 CO 0.09 0.00 0.74 -1.13 -0.00 0.00 0.00 178.15 177.85 1b22 h ASN 62 N 0.00 0.00 0.00 2.16 -1.24 -1.12 0.36 115.58 115.74 1b22 h ASN 62 Ca 0.65 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.66 1b22 h ASN 62 Cb 2.76 0.00 0.00 0.00 0.73 0.00 0.00 38.32 41.81 1b22 h ASN 62 CO -0.01 0.00 0.00 2.30 -1.29 0.00 0.00 177.43 178.43 1b22 n ILE 63 N -2.84 0.00 -0.21 2.57 -5.35 0.41 -3.21 119.36 110.73 1b22 n ILE 63 Ca 0.03 0.00 0.31 0.00 -0.27 0.00 0.00 62.75 62.82 1b22 n ILE 63 Cb 0.81 -0.23 0.67 0.00 -1.74 0.00 0.00 39.64 39.14 1b22 n ILE 63 CO 0.00 0.00 0.00 0.50 -1.76 0.00 0.00 176.55 175.29 1b22 h LYS 64 N 0.00 0.00 0.00 6.28 1.63 -1.84 -3.42 116.57 119.22 1b22 h LYS 64 Ca 0.00 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.80 1b22 h LYS 64 Cb 0.00 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.63 1b22 h LYS 64 CO 0.00 0.00 0.00 0.41 -3.45 0.00 0.00 179.45 176.41 1b22 n GLY 65 N -1.69 1.94 0.00 5.01 0.00 -0.88 -5.14 105.19 104.43 1b22 n GLY 65 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 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 -0.00 0.06 -4.92 119.36 113.90 1b22 n ILE 66 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 62.75 62.75 1b22 n ILE 66 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.64 39.64 1b22 n ILE 66 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.55 176.31 1b22 n SER 67 N 0.00 0.00 0.21 4.38 2.88 -1.26 -4.53 113.62 115.29 1b22 n SER 67 Ca 0.00 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.66 1b22 n SER 67 Cb 0.00 0.00 0.66 0.00 -0.75 0.00 0.00 64.21 64.12 1b22 n SER 67 CO 0.00 0.00 0.00 -0.33 -1.23 0.00 0.00 175.04 173.48 1b22 h GLU 68 N 0.00 0.00 0.00 -1.46 5.08 -1.96 -2.87 114.58 113.38 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 -1.79 -0.00 0.03 3.43 0.00 -1.26 -1.55 120.51 119.37 1b22 n ALA 69 Ca -0.02 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.20 1b22 n ALA 69 Cb 0.15 0.22 -0.14 0.00 0.00 0.00 0.00 19.45 19.68 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 0.30 0.00 0.00 1.79 -1.97 -2.90 116.57 113.79 1b22 h LYS 70 Ca 0.00 -0.51 0.01 0.00 -2.18 0.00 0.00 60.65 57.97 1b22 h LYS 70 Cb 0.00 0.19 -0.04 0.00 -1.58 0.00 0.00 32.23 30.80 1b22 h LYS 70 CO 0.00 1.24 -0.35 0.00 -1.08 0.00 0.00 179.45 179.26 1b22 h ALA 71 N 0.02 -0.80 -0.89 3.86 0.00 -1.61 -1.43 119.26 118.41 1b22 h ALA 71 Ca -0.35 -0.06 0.02 0.00 0.00 0.00 0.00 54.91 54.52 1b22 h ALA 71 Cb 1.94 0.80 -0.05 0.00 0.00 0.00 0.00 17.79 20.48 1b22 h ALA 71 CO 0.10 -0.90 0.58 0.22 0.00 0.00 0.00 179.25 179.25 1b22 h ASP 72 N -0.44 0.99 -1.29 0.00 3.58 -1.43 -0.98 116.42 116.83 1b22 h ASP 72 Ca 0.01 -0.02 0.37 0.00 0.42 0.00 0.00 57.03 57.82 1b22 h ASP 72 Cb 0.48 -0.23 -0.07 0.00 1.72 0.00 0.00 39.33 41.22 1b22 h ASP 72 CO -0.23 0.69 0.90 0.50 -2.88 0.00 0.00 179.24 178.22 1b22 h LYS 73 N 1.16 0.08 0.04 0.28 1.63 -1.08 0.30 116.57 118.98 1b22 h LYS 73 Ca 0.34 -0.01 -0.10 0.00 -0.85 0.00 0.00 60.65 60.04 1b22 h LYS 73 Cb -0.06 -0.02 0.01 0.00 -0.60 0.00 0.00 32.23 31.56 1b22 h LYS 73 CO -0.10 0.06 -0.41 0.82 -3.45 0.00 0.00 179.45 176.37 1b22 h ILE 74 N 0.09 1.57 -0.04 2.00 1.08 -0.29 -2.96 117.51 118.95 1b22 h ILE 74 Ca 0.66 -2.21 0.01 0.00 -0.39 0.00 0.00 64.86 62.93 1b22 h ILE 74 Cb 2.38 2.99 -0.00 0.00 -3.07 0.00 0.00 36.82 39.12 1b22 h ILE 74 CO -0.12 0.61 0.26 0.25 -0.69 0.00 0.00 178.15 178.46 1b22 h LEU 75 N -0.51 0.00 0.14 1.44 5.85 -0.30 0.65 115.31 122.59 1b22 h LEU 75 Ca -0.06 0.00 -0.30 0.00 0.84 0.00 0.00 57.88 58.36 1b22 h LEU 75 Cb 1.23 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.26 1b22 h LEU 75 CO 0.08 0.00 -1.53 0.00 -0.34 0.00 0.00 178.44 176.65 1b22 h ALA 76 N 1.52 0.16 0.00 1.25 0.00 -1.24 -2.40 119.26 118.55 1b22 h ALA 76 Ca 0.02 -1.10 -0.13 0.00 0.00 0.00 0.00 54.91 53.70 1b22 h ALA 76 Cb 0.54 0.46 -0.02 0.00 0.00 0.00 0.00 17.79 18.77 1b22 h ALA 76 CO -0.00 0.89 -0.73 0.93 0.00 0.00 0.00 179.25 180.33 1b22 h GLU 77 N -0.16 0.00 0.10 0.00 5.08 -1.04 -2.42 114.58 116.13 1b22 h GLU 77 Ca -0.32 0.00 -0.32 0.00 -1.00 0.00 0.00 59.36 57.73 1b22 h GLU 77 Cb 1.88 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 31.11 1b22 h GLU 77 CO 0.10 0.51 -1.69 0.00 -1.00 0.00 0.00 179.01 176.93 1b22 h ALA 78 N 1.44 0.42 0.00 3.43 0.00 0.11 -1.44 119.26 123.21 1b22 h ALA 78 Ca -0.04 -1.26 0.00 0.00 0.00 0.00 0.00 54.91 53.62 1b22 h ALA 78 Cb 1.46 0.43 0.00 0.00 0.00 0.00 0.00 17.79 19.68 1b22 h ALA 78 CO 0.07 1.28 -0.44 0.00 0.00 0.00 0.00 179.25 180.16 1b22 h ALA 79 N 0.49 0.73 -0.00 0.00 0.00 -1.54 -0.35 119.26 118.59 1b22 h ALA 79 Ca -0.30 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.61 1b22 h ALA 79 Cb 2.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.81 1b22 h ALA 79 CO 0.13 0.00 -0.38 1.17 0.00 0.00 0.00 179.25 180.17 1b22 n LYS 80 N -2.38 3.63 0.00 0.00 4.81 -0.91 -4.67 118.16 118.64 1b22 n LYS 80 Ca 0.03 -0.12 0.00 0.00 -0.87 0.00 0.00 58.31 57.35 1b22 n LYS 80 Cb 0.47 -0.95 0.00 0.00 0.02 0.00 0.00 35.03 34.56 1b22 n LYS 80 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1b22 n LEU 81 N -1.02 0.07 -2.72 3.14 7.94 -0.55 -4.87 117.00 118.99 1b22 n LEU 81 Ca 0.02 -0.16 -0.20 0.00 -1.11 0.00 0.00 56.01 54.57 1b22 n LEU 81 Cb 0.15 0.00 -0.00 0.00 0.53 0.00 0.00 43.42 44.10 1b22 n LEU 81 CO 0.17 0.02 0.02 0.52 -1.11 0.00 0.00 177.39 177.00 1b22 n VAL 82 N -0.17 1.64 -1.51 1.96 0.31 -0.14 -4.94 118.33 115.47 1b22 n VAL 82 Ca 0.00 -4.36 -0.42 0.00 -0.01 0.00 0.00 64.34 59.55 1b22 n VAL 82 Cb 0.05 -0.49 -0.03 0.00 -0.91 0.00 0.00 33.84 32.46 1b22 n VAL 82 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1b22 n PRO 83 N -0.19 2.13 -2.15 5.55 -0.04 -1.24 -4.72 135.00 134.34 1b22 n PRO 83 Ca 0.26 -2.26 -0.28 0.00 -0.04 0.00 0.00 63.50 61.18 1b22 n PRO 83 Cb 0.67 -3.14 0.18 0.00 -0.04 0.00 0.00 33.50 31.16 1b22 n PRO 83 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 1b22 n MET 84 N 6.80 -0.93 0.00 0.54 2.81 -1.26 -5.08 117.12 120.00 1b22 n MET 84 Ca 0.50 -2.31 0.00 0.00 -1.81 0.00 0.00 57.70 54.08 1b22 n MET 84 Cb 0.41 -1.16 0.00 0.00 -0.71 0.00 0.00 33.22 31.76 1b22 n MET 84 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89