#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 0.00 -4.29 3.49 1.02 -1.26 -5.11 120.64 114.49 1b22 n GLU 17 Ca 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 57.16 56.98 1b22 n GLU 17 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 31.44 31.32 1b22 n GLU 17 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1b22 s GLU 18 N 0.00 1.23 0.00 3.49 8.01 -1.26 -5.10 118.70 125.07 1b22 s GLU 18 Ca 0.00 -1.60 0.00 0.00 0.01 0.00 0.00 54.97 53.38 1b22 s GLU 18 Cb 0.00 -0.52 0.00 0.00 -4.31 0.00 0.00 34.13 29.30 1b22 s GLU 18 CO 0.00 -0.08 0.00 0.43 0.01 0.00 0.00 175.26 175.62 1b22 n SER 19 N -0.33 0.00 -4.00 -0.19 7.64 -1.26 -5.06 113.62 110.41 1b22 n SER 19 Ca -0.06 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.46 1b22 n SER 19 Cb 0.63 0.00 0.04 0.00 -1.01 0.00 0.00 64.21 63.87 1b22 n SER 19 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1b22 n PHE 20 N -0.62 -4.95 0.00 1.43 3.72 -1.26 -4.86 117.46 110.92 1b22 n PHE 20 Ca 0.00 0.02 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 1b22 n PHE 20 Cb 0.00 -1.45 0.00 0.00 -0.94 0.00 0.00 39.48 37.09 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 3.37 3.06 0.00 1.37 0.00 -1.26 -4.86 105.19 106.87 1b22 n GLY 21 Ca -0.01 -1.38 0.11 0.00 0.00 0.00 0.00 46.02 44.74 1b22 n GLY 21 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1b22 n PRO 22 N 1.11 0.87 -3.48 1.61 -0.04 -1.26 -4.89 135.00 128.91 1b22 n PRO 22 Ca 0.00 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.26 1b22 n PRO 22 Cb 0.00 -1.41 0.06 0.00 -0.04 0.00 0.00 33.50 32.11 1b22 n PRO 22 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 1b22 n GLN 23 N -0.91 -3.89 -0.57 0.54 6.02 -1.26 -4.38 117.38 112.93 1b22 n GLN 23 Ca 0.17 0.73 -0.17 0.00 -0.01 0.00 0.00 57.00 57.72 1b22 n GLN 23 Cb 0.08 -5.40 -0.01 0.00 1.02 0.00 0.00 30.24 25.92 1b22 n GLN 23 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1b22 n PRO 24 N -3.88 1.57 0.00 -1.09 -0.04 -1.26 -2.65 135.00 127.65 1b22 n PRO 24 Ca -0.19 -1.23 0.07 0.00 -0.04 0.00 0.00 63.50 62.11 1b22 n PRO 24 Cb 0.64 -2.35 0.37 0.00 -0.04 0.00 0.00 33.50 32.13 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 4.43 0.52 0.00 0.52 -5.35 -1.26 -4.26 119.36 113.96 1b22 n ILE 25 Ca 0.34 0.13 0.00 0.00 -0.27 0.00 0.00 62.75 62.95 1b22 n ILE 25 Cb 0.10 -0.89 0.00 0.00 -1.74 0.00 0.00 39.64 37.11 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 -1.25 0.00 0.14 7.28 2.88 -1.25 -0.23 113.62 121.19 1b22 n SER 26 Ca 0.07 0.32 0.08 0.00 -1.33 0.00 0.00 58.87 58.01 1b22 n SER 26 Cb 0.11 -0.14 0.05 0.00 -0.75 0.00 0.00 64.21 63.48 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 0.17 -1.46 3.08 -1.85 -2.84 114.38 111.48 1b22 h ARG 27 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.04 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 0.15 -0.09 1.25 -1.07 0.00 0.00 179.97 180.21 1b22 h LEU 28 N 0.00 -0.23 0.00 3.04 5.85 -0.82 -1.55 115.31 121.60 1b22 h LEU 28 Ca -0.03 0.01 -0.23 0.00 0.84 0.00 0.00 57.88 58.47 1b22 h LEU 28 Cb 1.18 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 42.23 1b22 h LEU 28 CO 0.02 -0.15 -1.20 1.05 -0.34 0.00 0.00 178.44 177.82 1b22 h GLU 29 N -0.24 0.00 -0.05 1.25 -0.00 -1.37 -2.18 114.58 111.99 1b22 h GLU 29 Ca -0.02 0.00 -0.10 0.00 -0.00 0.00 0.00 59.36 59.24 1b22 h GLU 29 Cb 0.19 0.00 -0.01 0.00 -0.00 0.00 0.00 28.75 28.93 1b22 h GLU 29 CO 0.03 0.83 -0.42 0.37 -0.00 0.00 0.00 179.01 179.82 1b22 h GLN 30 N 0.00 0.10 0.00 1.06 4.15 -1.56 -1.81 115.11 117.05 1b22 h GLN 30 Ca -0.09 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.28 1b22 h GLN 30 Cb 1.83 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.52 1b22 h GLN 30 CO 0.11 0.51 0.00 0.00 -1.93 0.00 0.00 178.83 177.52 1b22 n GLY 32 N 1.23 0.56 0.00 0.00 0.00 -0.68 -5.07 105.19 101.22 1b22 n GLY 32 Ca 0.06 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.33 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 -0.10 -0.61 3.06 -0.82 -4.93 119.36 115.96 1b22 n ILE 33 Ca 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.25 1b22 n ILE 33 Cb 0.00 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.18 1b22 n ILE 33 CO 0.00 0.00 0.00 -3.20 -2.50 0.00 0.00 176.55 170.85 1b22 n ASN 34 N 0.00 0.00 -0.05 9.51 2.85 -1.26 -4.75 115.26 121.56 1b22 n ASN 34 Ca 0.00 0.00 0.25 0.00 -0.11 0.00 0.00 54.58 54.72 1b22 n ASN 34 Cb 0.00 0.00 0.66 0.00 1.24 0.00 0.00 39.78 41.68 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 -1.92 2.50 -0.77 5.20 0.00 -1.94 -2.73 119.26 119.60 1b22 h ALA 35 Ca 0.00 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.96 1b22 h ALA 35 Cb 0.00 0.05 -0.10 0.00 0.00 0.00 0.00 17.79 17.75 1b22 h ALA 35 CO 0.00 -1.09 -0.49 -0.91 0.00 0.00 0.00 179.25 176.76 1b22 h ASN 36 N 0.00 -1.77 0.00 0.00 2.35 -1.86 -2.55 115.58 111.75 1b22 h ASN 36 Ca 0.33 0.27 0.00 0.00 -0.55 0.00 0.00 56.30 56.35 1b22 h ASN 36 Cb 1.79 0.78 0.00 0.00 0.05 0.00 0.00 38.32 40.94 1b22 h ASN 36 CO -0.00 -0.21 0.00 -0.67 -1.65 0.00 0.00 177.43 174.90 1b22 n ASP 37 N -4.88 0.00 0.19 5.81 -0.08 -1.03 0.25 116.55 116.81 1b22 n ASP 37 Ca 0.01 0.31 -0.14 0.00 -1.51 0.00 0.00 54.79 53.46 1b22 n ASP 37 Cb 0.23 -0.15 -0.08 0.00 2.34 0.00 0.00 41.12 43.46 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 -1.71 -2.97 116.25 118.82 1b22 h VAL 38 Ca 0.00 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.45 1b22 h VAL 38 Cb 0.00 0.00 -0.01 0.00 -1.52 0.00 0.00 31.29 29.76 1b22 h VAL 38 CO 0.00 0.00 -0.40 0.11 0.02 0.00 0.00 177.57 177.30 1b22 h LYS 39 N -0.73 0.00 0.20 1.57 6.56 -0.90 -2.87 116.57 120.39 1b22 h LYS 39 Ca -0.04 0.00 0.01 0.00 -1.06 0.00 0.00 60.65 59.56 1b22 h LYS 39 Cb 0.65 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 32.28 1b22 h LYS 39 CO -0.09 0.97 -0.36 0.87 -2.06 0.00 0.00 179.45 178.79 1b22 h LYS 40 N -1.00 -0.61 0.00 3.15 1.79 0.31 -2.63 116.57 117.57 1b22 h LYS 40 Ca -0.11 0.04 -0.02 0.00 -2.18 0.00 0.00 60.65 58.38 1b22 h LYS 40 Cb 1.07 0.14 -0.00 0.00 -1.58 0.00 0.00 32.23 31.86 1b22 h LYS 40 CO -0.07 -0.41 -0.90 1.37 -1.08 0.00 0.00 179.45 178.37 1b22 h LEU 41 N -0.64 0.00 0.00 2.94 8.10 -1.37 -3.23 115.31 121.12 1b22 h LEU 41 Ca 0.01 0.00 -0.22 0.00 0.11 0.00 0.00 57.88 57.78 1b22 h LEU 41 Cb 0.63 0.00 -0.04 0.00 -0.44 0.00 0.00 40.66 40.81 1b22 h LEU 41 CO -0.16 0.08 -1.38 -0.08 -4.11 0.00 0.00 178.44 172.79 1b22 h GLU 42 N 0.00 0.00 0.00 0.17 4.81 -1.46 -0.78 114.58 117.32 1b22 h GLU 42 Ca -0.02 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1b22 h GLU 42 Cb 1.08 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.46 1b22 h GLU 42 CO 0.01 0.52 0.00 0.39 -0.73 0.00 0.00 179.01 179.20 1b22 n GLU 43 N -3.07 0.06 0.00 1.92 -0.58 -0.99 -4.57 120.64 113.41 1b22 n GLU 43 Ca -0.10 0.27 0.00 0.00 -0.42 0.00 0.00 57.16 56.91 1b22 n GLU 43 Cb 0.94 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 30.31 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 -1.41 0.00 0.00 0.62 0.00 -1.24 -5.04 120.51 113.45 1b22 n ALA 44 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1b22 n ALA 44 Cb 0.10 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.55 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 -1.09 0.76 0.21 0.00 0.00 -0.30 -5.00 105.19 99.77 1b22 n GLY 45 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 -0.54 1.61 3.01 -1.22 -4.65 117.46 115.67 1b22 n PHE 46 Ca 0.00 0.00 -0.37 0.00 1.01 0.00 0.00 57.45 58.09 1b22 n PHE 46 Cb 0.00 -0.04 -0.09 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 -0.27 0.35 -3.77 1.38 1.44 -1.26 -4.41 115.22 108.68 1b22 n HIS 47 Ca 0.00 -0.76 0.04 0.00 -2.01 0.00 0.00 57.72 54.99 1b22 n HIS 47 Cb 0.09 -0.91 0.00 0.00 0.12 0.00 0.00 29.99 29.29 1b22 n HIS 47 CO 0.00 0.00 0.00 0.95 -2.81 0.00 0.00 176.34 174.48 1b22 s THR 48 N 6.25 0.00 0.53 0.61 -4.23 -1.26 -3.81 115.64 113.72 1b22 s THR 48 Ca 0.56 -0.03 0.30 0.00 -1.18 0.00 0.00 61.69 61.34 1b22 s THR 48 Cb 0.12 -2.44 0.45 0.00 1.34 0.00 0.00 72.50 71.97 1b22 s THR 48 CO 0.25 0.00 1.23 1.33 -0.54 0.00 0.00 174.62 176.89 1b22 n VAL 49 N -0.71 0.00 0.25 2.29 0.24 -1.08 -1.46 118.33 117.85 1b22 n VAL 49 Ca -0.03 1.19 0.06 0.00 -2.04 0.00 0.00 64.34 63.52 1b22 n VAL 49 Cb 0.61 -2.08 0.15 0.00 -1.47 0.00 0.00 33.84 31.06 1b22 n VAL 49 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 1b22 h GLU 50 N 0.00 0.00 0.00 7.34 3.07 -1.80 0.06 114.58 123.25 1b22 h GLU 50 Ca 0.57 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.43 1b22 h GLU 50 Cb 2.87 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 30.78 1b22 h GLU 50 CO -0.01 0.00 0.00 0.00 -1.40 0.00 0.00 179.01 177.60 1b22 n ALA 51 N -1.65 1.10 -2.88 3.43 0.00 -0.54 -2.89 120.51 117.08 1b22 n ALA 51 Ca 0.03 -0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.26 1b22 n ALA 51 Cb 1.01 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 19.43 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 -1.43 1.48 0.00 0.00 3.14 0.01 -4.45 118.33 117.07 1b22 n VAL 52 Ca 0.00 -4.63 0.00 0.00 -2.96 0.00 0.00 64.34 56.76 1b22 n VAL 52 Cb 0.01 -0.58 0.00 0.00 -1.06 0.00 0.00 33.84 32.20 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 -0.08 0.00 -0.48 1.55 0.00 -1.14 -4.95 120.51 115.40 1b22 n ALA 53 Ca 0.26 0.00 0.42 0.00 0.00 0.00 0.00 53.44 54.12 1b22 n ALA 53 Cb 0.61 0.00 0.64 0.00 0.00 0.00 0.00 19.45 20.71 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 -3.57 0.00 4.02 -1.23 -4.51 117.16 111.87 1b22 n TYR 54 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.77 1b22 n TYR 54 Cb 0.00 -0.39 -0.05 0.00 -0.02 0.00 0.00 39.34 38.88 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 -4.66 -1.90 0.12 -0.72 0.00 -1.25 -5.09 121.76 108.26 1b22 s ALA 55 Ca -0.04 1.54 -0.30 0.00 0.00 0.00 0.00 51.96 53.16 1b22 s ALA 55 Cb 0.21 -0.59 -0.07 0.00 0.00 0.00 0.00 23.12 22.68 1b22 s ALA 55 CO 0.70 -0.32 1.20 -1.25 0.00 0.00 0.00 175.76 176.09 1b22 s PRO 56 N -1.05 4.46 0.59 0.00 0.04 -1.26 -4.53 135.00 133.25 1b22 s PRO 56 Ca -0.04 1.82 0.33 0.00 0.04 0.00 0.00 61.00 63.16 1b22 s PRO 56 Cb -0.01 -3.30 1.15 0.00 0.04 0.00 0.00 34.50 32.39 1b22 s PRO 56 CO 0.03 -0.18 1.39 1.57 0.04 0.00 0.00 177.00 179.84 1b22 h LYS 57 N 6.13 0.00 0.00 4.56 2.10 -1.95 1.84 116.57 129.24 1b22 h LYS 57 Ca -0.43 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.14 1b22 h LYS 57 Cb 1.21 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.53 1b22 h LYS 57 CO 0.79 0.00 -0.52 -0.22 -2.00 0.00 0.00 179.45 177.50 1b22 h LYS 58 N 0.00 0.00 0.08 0.07 3.64 -1.91 -2.99 116.57 115.45 1b22 h LYS 58 Ca 0.61 0.00 -0.17 0.00 -1.27 0.00 0.00 60.65 59.82 1b22 h LYS 58 Cb 3.13 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 34.95 1b22 h LYS 58 CO -0.01 0.33 -0.86 1.49 -2.27 0.00 0.00 179.45 178.14 1b22 h GLU 59 N 0.00 0.16 0.76 1.90 4.81 0.25 -2.74 114.58 119.73 1b22 h GLU 59 Ca -0.02 -0.27 -0.04 0.00 -0.13 0.00 0.00 59.36 58.90 1b22 h GLU 59 Cb 1.30 0.10 0.01 0.00 0.63 0.00 0.00 28.75 30.79 1b22 h GLU 59 CO 0.04 1.13 -0.37 1.25 -0.73 0.00 0.00 179.01 180.34 1b22 h LEU 60 N -0.60 -0.87 -1.92 1.64 5.85 -1.58 -1.02 115.31 116.81 1b22 h LEU 60 Ca -0.19 0.03 0.31 0.00 0.84 0.00 0.00 57.88 58.87 1b22 h LEU 60 Cb 1.47 0.22 -0.04 0.00 0.37 0.00 0.00 40.66 42.68 1b22 h LEU 60 CO 0.03 -0.62 0.82 0.16 -0.34 0.00 0.00 178.44 178.49 1b22 h ILE 61 N -1.03 0.37 0.00 4.05 -0.00 -1.69 0.67 117.51 119.88 1b22 h ILE 61 Ca -0.10 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.76 1b22 h ILE 61 Cb 0.79 0.41 0.00 0.00 -0.00 0.00 0.00 36.82 38.02 1b22 h ILE 61 CO 0.17 0.00 0.58 -1.13 -0.00 0.00 0.00 178.15 177.77 1b22 h ASN 62 N 0.00 0.00 0.00 2.16 -1.24 -0.85 0.15 115.58 115.80 1b22 h ASN 62 Ca 0.50 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.51 1b22 h ASN 62 Cb 2.14 0.00 0.00 0.00 0.73 0.00 0.00 38.32 41.19 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 -2.38 0.00 -0.00 2.57 -5.35 0.23 -2.94 119.36 111.49 1b22 n ILE 63 Ca -0.01 0.00 0.23 0.00 -0.27 0.00 0.00 62.75 62.70 1b22 n ILE 63 Cb 0.60 -0.37 0.61 0.00 -1.74 0.00 0.00 39.64 38.74 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 -1.85 -3.42 116.57 119.21 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 -1.56 2.00 0.00 5.01 0.00 -0.95 -5.14 105.19 104.55 1b22 n GLY 65 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.13 0.00 0.00 -0.61 -0.00 0.48 -4.89 119.36 114.21 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 0.29 4.38 2.88 -1.26 -4.43 113.62 115.48 1b22 n SER 67 Ca 0.00 0.00 0.17 0.00 -1.33 0.00 0.00 58.87 57.71 1b22 n SER 67 Cb 0.00 0.00 0.84 0.00 -0.75 0.00 0.00 64.21 64.30 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 -2.64 114.58 113.60 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 -2.01 -0.01 0.09 3.43 0.00 -1.26 -0.95 120.51 119.80 1b22 n ALA 69 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 53.44 53.36 1b22 n ALA 69 Cb 0.40 0.24 -0.05 0.00 0.00 0.00 0.00 19.45 20.03 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 6.56 -1.92 -3.00 116.57 117.91 1b22 h LYS 70 Ca 0.00 0.02 0.00 0.00 -1.06 0.00 0.00 60.65 59.61 1b22 h LYS 70 Cb 0.00 0.07 0.00 0.00 -0.57 0.00 0.00 32.23 31.73 1b22 h LYS 70 CO 0.00 -0.02 0.00 0.00 -2.06 0.00 0.00 179.45 177.37 1b22 n ALA 71 N -2.67 -0.05 -0.37 3.86 0.00 -1.01 -2.00 120.51 118.27 1b22 n ALA 71 Ca -0.06 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.39 1b22 n ALA 71 Cb 0.21 0.26 0.07 0.00 0.00 0.00 0.00 19.45 19.98 1b22 n ALA 71 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1b22 n ASP 72 N -1.58 -0.56 -0.34 0.00 -0.08 -0.12 0.22 116.55 114.09 1b22 n ASP 72 Ca 0.00 1.71 0.36 0.00 -1.51 0.00 0.00 54.79 55.35 1b22 n ASP 72 Cb 0.00 -0.42 0.69 0.00 2.34 0.00 0.00 41.12 43.73 1b22 n ASP 72 CO 0.00 0.00 0.00 0.50 0.12 0.00 0.00 177.20 177.82 1b22 h LYS 73 N 0.00 0.00 0.19 -0.67 1.63 -1.20 0.47 116.57 116.98 1b22 h LYS 73 Ca 0.38 0.00 -0.30 0.00 -0.85 0.00 0.00 60.65 59.88 1b22 h LYS 73 Cb 0.62 0.00 0.02 0.00 -0.60 0.00 0.00 32.23 32.27 1b22 h LYS 73 CO -0.99 0.00 -1.41 0.97 -3.45 0.00 0.00 179.45 174.58 1b22 h ILE 74 N 0.00 1.18 0.00 2.00 6.09 0.32 -3.13 117.51 123.97 1b22 h ILE 74 Ca 0.59 -2.55 0.00 0.00 -1.37 0.00 0.00 64.86 61.53 1b22 h ILE 74 Cb 2.67 2.93 0.00 0.00 0.47 0.00 0.00 36.82 42.90 1b22 h ILE 74 CO -0.01 0.78 0.00 -0.07 -3.07 0.00 0.00 178.15 175.79 1b22 h LEU 75 N -0.06 0.00 0.00 2.19 4.07 0.21 0.25 115.31 121.97 1b22 h LEU 75 Ca -0.27 0.00 -0.09 0.00 0.08 0.00 0.00 57.88 57.60 1b22 h LEU 75 Cb 1.96 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 43.69 1b22 h LEU 75 CO 0.18 0.00 -0.59 0.00 -1.08 0.00 0.00 178.44 176.95 1b22 h ALA 76 N 2.04 0.11 0.00 1.53 0.00 -1.38 -2.99 119.26 118.57 1b22 h ALA 76 Ca 0.00 -0.72 -0.04 0.00 0.00 0.00 0.00 54.91 54.15 1b22 h ALA 76 Cb 0.15 0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1b22 h ALA 76 CO 0.00 0.37 -0.20 0.93 0.00 0.00 0.00 179.25 180.34 1b22 h GLU 77 N -1.00 0.00 0.17 0.00 4.39 -1.47 -2.65 114.58 114.03 1b22 h GLU 77 Ca -0.14 0.00 -0.24 0.00 0.34 0.00 0.00 59.36 59.32 1b22 h GLU 77 Cb 0.90 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.58 1b22 h GLU 77 CO -0.08 0.20 -1.06 0.00 -1.16 0.00 0.00 179.01 176.91 1b22 h ALA 78 N 1.80 -0.09 0.00 3.43 0.00 -0.66 -1.56 119.26 122.18 1b22 h ALA 78 Ca -0.00 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.13 1b22 h ALA 78 Cb 0.92 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1b22 h ALA 78 CO 0.03 0.51 0.00 0.00 0.00 0.00 0.00 179.25 179.78 1b22 h ALA 79 N 0.09 1.00 -0.01 0.00 0.00 -1.58 -2.46 119.26 116.30 1b22 h ALA 79 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1b22 h ALA 79 Cb 1.81 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.60 1b22 h ALA 79 CO 0.18 0.00 -0.03 1.17 0.00 0.00 0.00 179.25 180.58 1b22 n LYS 80 N -2.56 0.55 0.00 0.00 0.00 -1.00 -4.70 118.16 110.45 1b22 n LYS 80 Ca 0.05 -0.97 0.00 0.00 0.00 0.00 0.00 58.31 57.38 1b22 n LYS 80 Cb 0.44 -1.15 0.00 0.00 0.00 0.00 0.00 35.03 34.31 1b22 n LYS 80 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.40 177.29 1b22 n LEU 81 N 0.39 0.78 -3.84 3.14 0.00 -0.59 -4.93 117.00 111.96 1b22 n LEU 81 Ca 0.05 0.00 -0.29 0.00 0.00 0.00 0.00 56.01 55.77 1b22 n LEU 81 Cb 0.22 0.00 -0.11 0.00 0.00 0.00 0.00 43.42 43.54 1b22 n LEU 81 CO 0.06 0.04 0.04 0.52 0.00 0.00 0.00 177.39 178.06 1b22 n VAL 82 N -2.63 1.97 0.06 1.96 0.31 -0.93 -4.91 118.33 114.17 1b22 n VAL 82 Ca 0.00 -4.98 -0.05 0.00 -0.01 0.00 0.00 64.34 59.30 1b22 n VAL 82 Cb 0.36 -2.19 -0.03 0.00 -0.91 0.00 0.00 33.84 31.07 1b22 n VAL 82 CO 0.00 0.00 0.00 1.55 -1.32 0.00 0.00 176.83 177.06 1b22 h PRO 83 N 5.22 -0.24 -2.93 5.55 0.13 -1.84 -3.43 132.00 134.45 1b22 h PRO 83 Ca 0.16 0.02 -0.61 0.00 -0.87 0.00 0.00 66.00 64.70 1b22 h PRO 83 Cb 0.74 0.05 -0.40 0.00 0.13 0.00 0.00 31.00 31.52 1b22 h PRO 83 CO 0.76 -0.11 -0.74 1.41 -0.23 0.00 0.00 178.00 179.09 1b22 s MET 84 N -2.45 1.43 0.00 0.86 1.75 -1.26 -4.93 119.30 114.70 1b22 s MET 84 Ca -0.05 -2.24 0.00 0.00 -1.25 0.00 0.00 55.69 52.15 1b22 s MET 84 Cb 0.00 -2.40 0.00 0.00 2.84 0.00 0.00 34.83 35.27 1b22 s MET 84 CO 0.15 -1.21 0.00 0.41 -0.65 0.00 0.00 175.02 173.72