#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1b22 s GLU 17 N 0.00 0.72 -0.75 3.49 2.12 -1.26 -4.64 118.70 118.37 1b22 s GLU 17 Ca 0.00 0.86 -0.03 0.00 0.36 0.00 0.00 54.97 56.16 1b22 s GLU 17 Cb 0.00 0.34 -0.03 0.00 0.26 0.00 0.00 34.13 34.70 1b22 s GLU 17 CO 0.00 -0.09 0.67 -1.91 -0.54 0.00 0.00 175.26 173.40 1b22 n GLU 18 N 2.58 -1.52 -1.93 4.30 2.13 -1.26 -4.71 120.64 120.23 1b22 n GLU 18 Ca -0.14 0.95 0.00 0.00 0.66 0.00 0.00 57.16 58.63 1b22 n GLU 18 Cb 0.55 -4.99 0.00 0.00 0.27 0.00 0.00 31.44 27.27 1b22 n GLU 18 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 1b22 n SER 19 N -2.38 -9.51 0.00 4.31 7.64 -1.26 -5.03 113.62 107.38 1b22 n SER 19 Ca -0.03 1.40 0.00 0.00 1.01 0.00 0.00 58.87 61.24 1b22 n SER 19 Cb 0.56 -5.21 0.00 0.00 -1.01 0.00 0.00 64.21 58.54 1b22 n SER 19 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1b22 n PHE 20 N 0.54 0.00 0.00 1.43 -0.00 -1.26 -4.75 117.46 113.42 1b22 n PHE 20 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.45 1b22 n PHE 20 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 39.48 39.48 1b22 n PHE 20 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.76 177.17 1b22 n GLY 21 N 0.00 3.25 3.77 7.13 0.00 -1.26 -4.49 105.19 113.58 1b22 n GLY 21 Ca 0.00 -0.75 -0.41 0.00 0.00 0.00 0.00 46.02 44.86 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 0.00 4.42 0.21 1.61 0.04 -1.26 -4.44 135.00 135.57 1b22 s PRO 22 Ca 0.00 2.12 0.00 0.00 0.04 0.00 0.00 61.00 63.16 1b22 s PRO 22 Cb 0.00 -3.10 0.00 0.00 0.04 0.00 0.00 34.50 31.44 1b22 s PRO 22 CO 0.00 -0.10 0.00 1.04 0.04 0.00 0.00 177.00 177.98 1b22 n GLN 23 N 0.93 0.00 -0.68 4.56 1.13 -1.26 -4.91 117.38 117.15 1b22 n GLN 23 Ca -0.00 0.00 -0.16 0.00 -1.94 0.00 0.00 57.00 54.90 1b22 n GLN 23 Cb 0.42 0.00 -0.05 0.00 0.11 0.00 0.00 30.24 30.72 1b22 n GLN 23 CO 0.00 0.00 0.00 -0.35 -1.44 0.00 0.00 177.06 175.27 1b22 n PRO 24 N -3.01 1.72 0.07 -1.09 -0.04 -1.26 0.17 135.00 131.56 1b22 n PRO 24 Ca 0.00 -1.10 0.11 0.00 -0.04 0.00 0.00 63.50 62.47 1b22 n PRO 24 Cb 0.00 -2.18 0.45 0.00 -0.04 0.00 0.00 33.50 31.73 1b22 n PRO 24 CO 0.00 0.00 0.00 -0.89 -0.04 0.00 0.00 175.50 174.57 1b22 n ILE 25 N 3.58 0.67 0.00 0.52 -0.00 -1.26 -4.06 119.36 118.80 1b22 n ILE 25 Ca 0.37 0.07 0.00 0.00 -0.00 0.00 0.00 62.75 63.19 1b22 n ILE 25 Cb 0.29 -0.87 0.00 0.00 -0.00 0.00 0.00 39.64 39.07 1b22 n ILE 25 CO 0.00 0.00 0.00 -0.24 -0.00 0.00 0.00 176.55 176.31 1b22 n SER 26 N -1.94 0.00 -0.35 4.38 2.88 -1.25 -1.21 113.62 116.13 1b22 n SER 26 Ca 0.04 0.78 0.37 0.00 -1.33 0.00 0.00 58.87 58.73 1b22 n SER 26 Cb 0.28 -0.28 0.70 0.00 -0.75 0.00 0.00 64.21 64.17 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 0.02 -1.46 2.47 -1.84 1.65 114.38 115.23 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 -0.01 1.25 0.56 0.00 0.00 179.97 181.77 1b22 h LEU 28 N 0.00 -0.03 0.00 3.04 5.85 -1.36 -2.75 115.31 120.06 1b22 h LEU 28 Ca 0.60 0.00 -0.09 0.00 0.84 0.00 0.00 57.88 59.24 1b22 h LEU 28 Cb 2.68 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 43.71 1b22 h LEU 28 CO -0.01 -0.00 -0.49 1.05 -0.34 0.00 0.00 178.44 178.65 1b22 h GLU 29 N -0.07 0.00 -0.03 1.25 4.11 -0.78 -2.30 114.58 116.76 1b22 h GLU 29 Ca -0.00 0.00 -0.18 0.00 0.07 0.00 0.00 59.36 59.25 1b22 h GLU 29 Cb 0.03 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 1b22 h GLU 29 CO 0.01 0.40 -0.78 0.37 0.07 0.00 0.00 179.01 179.08 1b22 h GLN 30 N 0.00 0.23 0.00 1.06 4.15 0.23 -2.85 115.11 117.93 1b22 h GLN 30 Ca -0.01 -0.21 0.00 0.00 0.77 0.00 0.00 58.65 59.19 1b22 h GLN 30 Cb 1.33 0.05 0.00 0.00 0.21 0.00 0.00 27.48 29.07 1b22 h GLN 30 CO 0.05 0.90 0.00 0.00 -1.93 0.00 0.00 178.83 177.85 1b22 n GLY 32 N 1.26 0.53 0.00 0.00 0.00 -1.08 -5.07 105.19 100.83 1b22 n GLY 32 Ca 0.06 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.32 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 -0.29 -0.61 0.13 -0.87 -4.94 119.36 112.78 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 0.59 2.80 0.00 0.00 176.55 179.94 1b22 n ASN 34 N 0.00 0.00 -0.01 9.51 4.13 -1.26 -4.82 115.26 122.81 1b22 n ASN 34 Ca 0.00 0.00 0.23 0.00 1.68 0.00 0.00 54.58 56.49 1b22 n ASN 34 Cb 0.00 0.00 0.70 0.00 -1.54 0.00 0.00 39.78 38.94 1b22 n ASN 34 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1b22 h ALA 35 N -1.78 2.37 -1.97 5.41 0.00 -1.96 -3.16 119.26 118.17 1b22 h ALA 35 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1b22 h ALA 35 Cb 0.00 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.83 1b22 h ALA 35 CO 0.00 -0.90 0.00 0.09 0.00 0.00 0.00 179.25 178.44 1b22 n ASN 36 N -3.74 0.00 -0.13 0.00 3.02 -1.26 -1.61 115.26 111.53 1b22 n ASN 36 Ca 0.12 0.63 -0.02 0.00 -0.03 0.00 0.00 54.58 55.28 1b22 n ASN 36 Cb 0.82 -0.15 -0.01 0.00 -0.61 0.00 0.00 39.78 39.82 1b22 n ASN 36 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 1b22 n ASP 37 N -1.61 -0.28 0.00 6.41 2.03 -1.19 0.18 116.55 122.08 1b22 n ASP 37 Ca 0.00 0.56 0.00 0.00 0.52 0.00 0.00 54.79 55.87 1b22 n ASP 37 Cb 0.00 -0.10 0.00 0.00 -0.72 0.00 0.00 41.12 40.30 1b22 n ASP 37 CO 0.00 0.00 0.00 0.52 -1.92 0.00 0.00 177.20 175.80 1b22 n VAL 38 N -4.43 0.00 0.06 5.18 0.31 -0.64 -2.80 118.33 116.01 1b22 n VAL 38 Ca 0.02 1.47 -0.22 0.00 -0.01 0.00 0.00 64.34 65.60 1b22 n VAL 38 Cb 0.10 -2.31 -0.15 0.00 -0.91 0.00 0.00 33.84 30.58 1b22 n VAL 38 CO 0.00 0.00 0.00 0.11 -1.32 0.00 0.00 176.83 175.62 1b22 h LYS 39 N 0.00 0.34 0.16 5.55 6.56 -0.77 -3.01 116.57 125.41 1b22 h LYS 39 Ca 0.00 -0.58 -0.01 0.00 -1.06 0.00 0.00 60.65 59.00 1b22 h LYS 39 Cb 0.00 0.22 -0.00 0.00 -0.57 0.00 0.00 32.23 31.87 1b22 h LYS 39 CO 0.00 1.25 -0.12 -0.22 -2.06 0.00 0.00 179.45 178.30 1b22 h LYS 40 N 0.09 -0.26 0.00 3.15 3.64 0.17 -3.18 116.57 120.19 1b22 h LYS 40 Ca -0.35 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.05 1b22 h LYS 40 Cb 2.08 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 33.95 1b22 h LYS 40 CO 0.15 -0.17 -0.01 1.37 -2.27 0.00 0.00 179.45 178.52 1b22 h LEU 41 N -0.27 0.00 0.00 5.20 8.10 -1.49 -3.26 115.31 123.60 1b22 h LEU 41 Ca -0.02 -0.00 -0.10 0.00 0.11 0.00 0.00 57.88 57.87 1b22 h LEU 41 Cb 0.22 0.00 0.01 0.00 -0.44 0.00 0.00 40.66 40.45 1b22 h LEU 41 CO 0.01 0.00 -0.40 -0.08 -4.11 0.00 0.00 178.44 173.86 1b22 h GLU 42 N 0.00 0.26 -0.05 0.17 4.81 -1.38 -2.16 114.58 116.23 1b22 h GLU 42 Ca 0.00 -0.29 -0.04 0.00 -0.13 0.00 0.00 59.36 58.90 1b22 h GLU 42 Cb 0.83 0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.29 1b22 h GLU 42 CO 0.00 1.00 -0.12 1.49 -0.73 0.00 0.00 179.01 180.65 1b22 h GLU 43 N -0.36 0.18 0.00 1.92 4.57 -1.71 -3.42 114.58 115.76 1b22 h GLU 43 Ca -0.05 -0.12 0.00 0.00 -1.18 0.00 0.00 59.36 58.01 1b22 h GLU 43 Cb 1.15 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.75 1b22 h GLU 43 CO 0.08 0.71 -0.31 0.00 -1.18 0.00 0.00 179.01 178.31 1b22 n ALA 44 N -2.43 0.74 0.00 2.92 0.00 -1.25 -5.08 120.51 115.41 1b22 n ALA 44 Ca -0.08 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 52.97 1b22 n ALA 44 Cb 0.37 0.02 0.00 0.00 0.00 0.00 0.00 19.45 19.84 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 1.80 0.59 0.38 0.00 0.00 -0.81 -5.00 105.19 102.14 1b22 n GLY 45 Ca -0.04 -0.31 0.01 0.00 0.00 0.00 0.00 46.02 45.68 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 0.17 -0.53 1.61 3.01 -1.25 -4.56 117.46 115.91 1b22 n PHE 46 Ca 0.00 -0.07 -0.15 0.00 1.01 0.00 0.00 57.45 58.24 1b22 n PHE 46 Cb 0.00 -0.06 -0.01 0.00 -0.01 0.00 0.00 39.48 39.39 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 -0.11 0.95 0.00 1.38 1.44 -1.26 -2.78 115.22 114.84 1b22 n HIS 47 Ca 0.03 -1.53 0.00 0.00 -2.01 0.00 0.00 57.72 54.21 1b22 n HIS 47 Cb 0.20 -1.36 0.00 0.00 0.12 0.00 0.00 29.99 28.95 1b22 n HIS 47 CO 0.00 0.00 0.00 2.41 -2.81 0.00 0.00 176.34 175.94 1b22 n THR 48 N 4.38 0.00 0.00 0.61 -1.04 -1.26 -3.78 114.28 113.18 1b22 n THR 48 Ca 0.32 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.33 1b22 n THR 48 Cb 0.10 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.61 1b22 n THR 48 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1b22 n VAL 49 N 0.00 0.00 -0.56 12.58 0.31 0.46 -4.39 118.33 126.72 1b22 n VAL 49 Ca 0.00 0.00 0.44 0.00 -0.01 0.00 0.00 64.34 64.77 1b22 n VAL 49 Cb 0.00 0.00 0.67 0.00 -0.91 0.00 0.00 33.84 33.60 1b22 n VAL 49 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1b22 n GLU 50 N 0.00 0.00 0.22 5.55 4.07 -1.26 0.14 120.64 129.37 1b22 n GLU 50 Ca 0.00 0.93 0.15 0.00 -0.06 0.00 0.00 57.16 58.18 1b22 n GLU 50 Cb 0.00 -2.16 0.64 0.00 -0.06 0.00 0.00 31.44 29.85 1b22 n GLU 50 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1b22 h ALA 51 N 0.81 1.78 -0.77 4.31 0.00 -1.72 -3.26 119.26 120.41 1b22 h ALA 51 Ca 0.77 -0.01 -0.14 0.00 0.00 0.00 0.00 54.91 55.53 1b22 h ALA 51 Cb 3.18 0.01 -0.16 0.00 0.00 0.00 0.00 17.79 20.83 1b22 h ALA 51 CO -0.01 -0.65 -0.44 1.55 0.00 0.00 0.00 179.25 179.71 1b22 n VAL 52 N -3.07 0.00 0.04 0.00 3.14 0.37 -4.77 118.33 114.04 1b22 n VAL 52 Ca 0.03 -0.96 0.00 0.00 -2.96 0.00 0.00 64.34 60.45 1b22 n VAL 52 Cb 0.64 1.01 0.00 0.00 -1.06 0.00 0.00 33.84 34.43 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 2.72 1.52 -0.02 1.55 0.00 -1.23 -4.64 120.51 120.40 1b22 n ALA 53 Ca 0.16 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.57 1b22 n ALA 53 Cb 0.58 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 20.02 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 -2.72 0.00 -1.87 0.00 4.01 -1.26 -4.98 117.16 110.33 1b22 n TYR 54 Ca 0.00 0.00 -0.41 0.00 -0.16 0.00 0.00 57.90 57.33 1b22 n TYR 54 Cb 0.00 -0.17 -0.01 0.00 -0.31 0.00 0.00 39.34 38.84 1b22 n TYR 54 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1b22 s ALA 55 N -2.60 3.65 -0.18 -0.72 0.00 -1.26 -4.92 121.76 115.74 1b22 s ALA 55 Ca -0.10 1.49 -0.29 0.00 0.00 0.00 0.00 51.96 53.05 1b22 s ALA 55 Cb 0.01 -3.60 -0.02 0.00 0.00 0.00 0.00 23.12 19.51 1b22 s ALA 55 CO 0.15 -0.92 1.41 -1.25 0.00 0.00 0.00 175.76 175.15 1b22 s PRO 56 N -1.00 4.09 0.41 0.00 0.04 -1.26 -4.81 135.00 132.47 1b22 s PRO 56 Ca 0.58 1.70 0.30 0.00 0.04 0.00 0.00 61.00 63.62 1b22 s PRO 56 Cb -0.45 -3.88 1.37 0.00 0.04 0.00 0.00 34.50 31.58 1b22 s PRO 56 CO 0.51 -0.91 1.44 0.36 0.04 0.00 0.00 177.00 178.44 1b22 n LYS 57 N 7.02 -0.03 0.23 4.56 2.85 -1.26 0.25 118.16 131.77 1b22 n LYS 57 Ca 0.16 1.16 0.08 0.00 -1.05 0.00 0.00 58.31 58.65 1b22 n LYS 57 Cb 0.45 -2.28 0.56 0.00 -0.65 0.00 0.00 35.03 33.11 1b22 n LYS 57 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 177.40 178.22 1b22 h LYS 58 N 0.00 0.00 0.00 -1.58 1.57 -1.90 -1.90 116.57 112.76 1b22 h LYS 58 Ca 0.81 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 59.57 1b22 h LYS 58 Cb 2.61 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 34.92 1b22 h LYS 58 CO -0.43 0.19 -0.14 1.49 -0.57 0.00 0.00 179.45 179.99 1b22 h GLU 59 N 0.00 0.00 0.26 3.15 4.57 0.28 -2.84 114.58 120.01 1b22 h GLU 59 Ca -0.00 0.00 -0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1b22 h GLU 59 Cb 0.38 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.94 1b22 h GLU 59 CO 0.02 0.87 -0.44 1.25 -1.18 0.00 0.00 179.01 179.54 1b22 h LEU 60 N -1.00 -1.28 -1.94 1.64 5.85 -1.45 0.15 115.31 117.28 1b22 h LEU 60 Ca -0.04 0.12 0.33 0.00 0.84 0.00 0.00 57.88 59.13 1b22 h LEU 60 Cb 0.91 0.45 -0.05 0.00 0.37 0.00 0.00 40.66 42.35 1b22 h LEU 60 CO -0.02 -0.52 0.86 0.16 -0.34 0.00 0.00 178.44 178.57 1b22 h ILE 61 N -0.75 0.36 0.00 4.05 -0.00 -1.49 0.45 117.51 120.14 1b22 h ILE 61 Ca -0.03 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.83 1b22 h ILE 61 Cb 0.70 0.39 0.00 0.00 -0.00 0.00 0.00 36.82 37.91 1b22 h ILE 61 CO -0.15 0.00 0.55 -1.13 -0.00 0.00 0.00 178.15 177.41 1b22 h ASN 62 N 0.00 0.00 0.00 2.16 -0.73 -0.44 -1.35 115.58 115.22 1b22 h ASN 62 Ca 0.54 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.71 1b22 h ASN 62 Cb 2.25 0.00 0.00 0.00 0.27 0.00 0.00 38.32 40.84 1b22 h ASN 62 CO -0.01 0.00 0.00 -0.38 -0.37 0.00 0.00 177.43 176.67 1b22 n ILE 63 N -2.29 0.00 0.15 2.57 5.41 0.16 -2.73 119.36 122.64 1b22 n ILE 63 Ca -0.01 0.30 0.10 0.00 1.00 0.00 0.00 62.75 64.14 1b22 n ILE 63 Cb 0.56 -1.09 0.54 0.00 -0.71 0.00 0.00 39.64 38.94 1b22 n ILE 63 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 1b22 n LYS 64 N 0.00 0.13 0.00 0.38 0.00 -1.21 -4.74 118.16 112.72 1b22 n LYS 64 Ca 0.00 0.62 0.00 0.00 0.00 0.00 0.00 58.31 58.93 1b22 n LYS 64 Cb 0.00 -1.95 0.00 0.00 0.00 0.00 0.00 35.03 33.08 1b22 n LYS 64 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1b22 n GLY 65 N -1.31 1.52 0.00 3.14 0.00 -0.93 -5.10 105.19 102.51 1b22 n GLY 65 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.28 0.00 0.00 -0.61 -0.00 -0.55 -4.91 119.36 112.01 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 -4.53 113.62 115.30 1b22 n SER 67 Ca 0.00 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.67 1b22 n SER 67 Cb 0.00 0.00 0.70 0.00 -0.75 0.00 0.00 64.21 64.16 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 -1.95 -2.95 114.58 113.29 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 -1.81 0.00 0.01 3.43 0.00 -1.26 -0.82 120.51 120.05 1b22 n ALA 69 Ca -0.02 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.28 1b22 n ALA 69 Cb 0.12 0.19 -0.14 0.00 0.00 0.00 0.00 19.45 19.62 1b22 n ALA 69 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 177.50 179.07 1b22 h LYS 70 N 0.00 0.14 0.54 0.00 2.10 -1.97 -3.13 116.57 114.25 1b22 h LYS 70 Ca 0.00 -0.24 -0.02 0.00 -2.00 0.00 0.00 60.65 58.39 1b22 h LYS 70 Cb 0.00 0.09 -0.02 0.00 -0.90 0.00 0.00 32.23 31.40 1b22 h LYS 70 CO 0.00 0.88 -0.47 0.00 -2.00 0.00 0.00 179.45 177.86 1b22 h ALA 71 N 0.58 -1.09 -0.49 0.07 0.00 -1.57 -2.02 119.26 114.73 1b22 h ALA 71 Ca -0.32 -0.19 0.07 0.00 0.00 0.00 0.00 54.91 54.47 1b22 h ALA 71 Cb 2.02 0.65 -0.06 0.00 0.00 0.00 0.00 17.79 20.40 1b22 h ALA 71 CO 0.10 -1.14 0.14 0.22 0.00 0.00 0.00 179.25 178.57 1b22 h ASP 72 N -1.00 0.10 0.00 0.00 3.58 -1.12 0.27 116.42 118.25 1b22 h ASP 72 Ca -0.06 0.07 0.00 0.00 0.42 0.00 0.00 57.03 57.46 1b22 h ASP 72 Cb 0.85 0.08 0.00 0.00 1.72 0.00 0.00 39.33 41.98 1b22 h ASP 72 CO -0.02 0.08 0.42 0.50 -2.88 0.00 0.00 179.24 177.35 1b22 h LYS 73 N 0.30 0.00 0.00 0.28 1.63 -1.35 -0.53 116.57 116.89 1b22 h LYS 73 Ca 0.24 0.00 -0.10 0.00 -0.85 0.00 0.00 60.65 59.94 1b22 h LYS 73 Cb 0.29 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 31.90 1b22 h LYS 73 CO -0.28 0.00 -0.71 0.97 -3.45 0.00 0.00 179.45 175.98 1b22 h ILE 74 N 0.00 0.58 0.00 2.00 6.09 0.24 -3.03 117.51 123.38 1b22 h ILE 74 Ca 0.00 -1.64 0.00 0.00 -1.37 0.00 0.00 64.86 61.85 1b22 h ILE 74 Cb 0.85 1.30 0.00 0.00 0.47 0.00 0.00 36.82 39.43 1b22 h ILE 74 CO 0.00 0.20 0.00 0.17 -3.07 0.00 0.00 178.15 175.45 1b22 h LEU 75 N -1.00 0.00 0.02 2.19 8.10 -1.12 0.51 115.31 124.01 1b22 h LEU 75 Ca -0.15 0.00 -0.09 0.00 0.11 0.00 0.00 57.88 57.75 1b22 h LEU 75 Cb 0.84 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 41.06 1b22 h LEU 75 CO -0.09 0.00 -0.46 0.00 -4.11 0.00 0.00 178.44 173.78 1b22 h ALA 76 N 2.05 0.06 0.00 0.17 0.00 -1.24 -2.69 119.26 117.62 1b22 h ALA 76 Ca 0.00 -0.72 -0.14 0.00 0.00 0.00 0.00 54.91 54.05 1b22 h ALA 76 Cb 0.12 0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.10 1b22 h ALA 76 CO 0.00 0.25 -0.68 0.93 0.00 0.00 0.00 179.25 179.76 1b22 h GLU 77 N -0.88 0.00 0.24 0.00 5.08 -1.32 -2.85 114.58 114.84 1b22 h GLU 77 Ca -0.11 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1b22 h GLU 77 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1b22 h GLU 77 CO -0.03 0.68 -0.11 0.00 -1.00 0.00 0.00 179.01 178.55 1b22 h ALA 78 N 1.32 -0.32 -0.13 3.43 0.00 -0.11 0.18 119.26 123.63 1b22 h ALA 78 Ca -0.01 -0.16 0.04 0.00 0.00 0.00 0.00 54.91 54.78 1b22 h ALA 78 Cb 1.39 0.12 -0.01 0.00 0.00 0.00 0.00 17.79 19.30 1b22 h ALA 78 CO 0.09 -0.34 0.11 0.00 0.00 0.00 0.00 179.25 179.10 1b22 h ALA 79 N -0.72 1.99 0.00 0.00 0.00 -1.59 0.96 119.26 119.89 1b22 h ALA 79 Ca -0.03 -0.00 -0.25 0.00 0.00 0.00 0.00 54.91 54.62 1b22 h ALA 79 Cb 0.43 0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.19 1b22 h ALA 79 CO 0.05 -0.18 -1.44 0.87 0.00 0.00 0.00 179.25 178.56 1b22 h LYS 80 N 0.00 0.00 0.00 0.00 1.79 -1.52 -3.32 116.57 113.52 1b22 h LYS 80 Ca 0.06 0.00 -0.17 0.00 -2.18 0.00 0.00 60.65 58.36 1b22 h LYS 80 Cb 0.28 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 30.90 1b22 h LYS 80 CO -0.00 0.61 -1.36 -0.11 -1.08 0.00 0.00 179.45 177.51 1b22 n LEU 81 N -3.12 1.90 -3.78 2.94 7.94 0.63 -4.74 117.00 118.78 1b22 n LEU 81 Ca -0.11 0.42 -0.30 0.00 -1.11 0.00 0.00 56.01 54.91 1b22 n LEU 81 Cb 0.99 -0.84 -0.09 0.00 0.53 0.00 0.00 43.42 44.01 1b22 n LEU 81 CO 0.45 0.02 0.14 1.33 -1.11 0.00 0.00 177.39 178.22 1b22 n VAL 82 N -4.43 2.36 0.00 1.96 0.24 0.32 -4.96 118.33 113.83 1b22 n VAL 82 Ca -0.27 -5.10 0.00 0.00 -2.04 0.00 0.00 64.34 56.93 1b22 n VAL 82 Cb 0.59 -2.19 0.00 0.00 -1.47 0.00 0.00 33.84 30.78 1b22 n VAL 82 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1b22 n PRO 83 N 1.58 0.00 -3.59 7.34 -0.04 -1.22 -4.21 135.00 134.86 1b22 n PRO 83 Ca 0.24 0.00 -0.11 0.00 -0.04 0.00 0.00 63.50 63.59 1b22 n PRO 83 Cb 0.37 -0.22 -0.04 0.00 -0.04 0.00 0.00 33.50 33.57 1b22 n PRO 83 CO 0.00 0.00 0.00 1.41 -0.04 0.00 0.00 175.50 176.87 1b22 s MET 84 N -0.05 1.11 0.00 0.54 1.75 -1.26 -4.48 119.30 116.91 1b22 s MET 84 Ca 0.00 -0.66 0.00 0.00 -1.25 0.00 0.00 55.69 53.78 1b22 s MET 84 Cb 0.00 0.49 0.00 0.00 2.84 0.00 0.00 34.83 38.16 1b22 s MET 84 CO 0.00 -0.45 0.00 0.41 -0.65 0.00 0.00 175.02 174.33