#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1c01 s ALA 2 N 0.00 3.46 -0.73 -0.43 0.00 -0.96 -4.70 121.76 118.40 1c01 s ALA 2 Ca 0.00 -0.77 -0.16 0.00 0.00 0.00 0.00 51.96 51.03 1c01 s ALA 2 Cb 0.00 -2.00 0.17 0.00 0.00 0.00 0.00 23.12 21.29 1c01 s ALA 2 CO 0.00 0.11 0.73 0.12 0.00 0.00 0.00 175.76 176.72 1c01 s PHE 3 N 0.49 3.46 0.57 0.00 5.36 -0.97 -1.03 117.98 125.85 1c01 s PHE 3 Ca 0.04 -1.60 -0.16 0.00 -0.96 0.00 0.00 56.93 54.26 1c01 s PHE 3 Cb -0.12 -3.89 -0.05 0.00 -0.34 0.00 0.00 43.02 38.61 1c01 s PHE 3 CO 0.00 -1.09 1.02 0.99 -1.46 0.00 0.00 175.22 174.68 1c01 s THR 4 N 1.16 4.18 0.14 0.12 2.01 0.13 -0.90 115.64 122.48 1c01 s THR 4 Ca 0.15 1.00 -0.17 0.00 0.31 0.00 0.00 61.69 62.98 1c01 s THR 4 Cb -0.17 -3.56 0.04 0.00 0.01 0.00 0.00 72.50 68.83 1c01 s THR 4 CO -0.04 -0.64 0.43 0.68 -0.69 0.00 0.00 174.62 174.37 1c01 s VAL 5 N -2.60 0.06 -0.01 3.82 -7.23 0.03 -0.55 120.40 113.92 1c01 s VAL 5 Ca 0.61 -0.53 0.00 0.00 -1.81 0.00 0.00 61.98 60.25 1c01 s VAL 5 Cb -0.13 -1.18 0.01 0.00 0.56 0.00 0.00 36.38 35.64 1c01 s VAL 5 CO 0.36 -0.26 0.01 0.26 -0.31 0.00 0.00 175.10 175.16 1c01 s TRP 6 N -3.80 0.05 0.31 2.82 0.51 0.15 -1.95 118.94 117.02 1c01 s TRP 6 Ca 0.03 0.04 0.05 0.00 -2.12 0.00 0.00 56.10 54.10 1c01 s TRP 6 Cb 0.01 -0.13 0.82 0.00 -0.81 0.00 0.00 33.47 33.37 1c01 s TRP 6 CO -0.11 -0.04 1.62 0.66 -0.51 0.00 0.00 176.95 178.57 1c01 h SER 7 N 6.62 -0.07 -2.58 2.95 4.64 -1.81 -1.76 113.55 121.54 1c01 h SER 7 Ca -0.33 0.23 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 1c01 h SER 7 Cb 1.17 0.32 0.00 0.00 -0.31 0.00 0.00 62.40 63.58 1c01 h SER 7 CO 0.50 -0.25 0.00 0.61 -0.87 0.00 0.00 176.83 176.82 1c01 n GLY 8 N -1.39 4.25 0.05 -0.77 0.00 -1.26 -1.68 105.19 104.39 1c01 n GLY 8 Ca 0.24 -1.03 -0.00 0.00 0.00 0.00 0.00 46.02 45.23 1c01 n GLY 8 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1c01 h PRO 9 N 0.00 -0.03 0.00 1.61 0.13 -1.92 -3.41 132.00 128.38 1c01 h PRO 9 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1c01 h PRO 9 Cb 0.00 0.01 0.00 0.00 0.13 0.00 0.00 31.00 31.14 1c01 h PRO 9 CO 0.00 -0.02 0.00 0.41 -0.23 0.00 0.00 178.00 178.16 1c01 n GLY 10 N 1.75 1.91 2.47 1.56 0.00 -1.26 -2.81 105.19 108.82 1c01 n GLY 10 Ca -0.00 -1.47 -0.30 0.00 0.00 0.00 0.00 46.02 44.24 1c01 n GLY 10 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c01 n ASN 12 N 1.19 0.00 0.00 0.00 3.02 -1.26 -5.02 115.26 113.19 1c01 n ASN 12 Ca 0.53 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 55.08 1c01 n ASN 12 Cb 0.48 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.65 1c01 n ASN 12 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 1c01 n ASN 13 N 0.00 0.00 -4.76 6.41 0.23 -1.26 -4.54 115.26 111.34 1c01 n ASN 13 Ca 0.00 0.00 -0.36 0.00 -0.53 0.00 0.00 54.58 53.69 1c01 n ASN 13 Cb 0.00 0.00 0.02 0.00 -2.08 0.00 0.00 39.78 37.72 1c01 n ASN 13 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 1c01 s ARG 14 N 0.00 3.15 0.10 -3.83 3.52 -1.26 -4.91 118.95 115.71 1c01 s ARG 14 Ca 0.00 1.81 0.09 0.00 -0.13 0.00 0.00 55.73 57.50 1c01 s ARG 14 Cb 0.00 -2.02 -0.03 0.00 -1.56 0.00 0.00 34.95 31.34 1c01 s ARG 14 CO 0.00 -1.06 -0.23 0.00 -0.81 0.00 0.00 175.30 173.20 1c01 s ALA 15 N -1.60 2.00 -0.08 6.12 0.00 -1.26 -3.01 121.76 123.92 1c01 s ALA 15 Ca 0.75 -1.28 -0.30 0.00 0.00 0.00 0.00 51.96 51.13 1c01 s ALA 15 Cb -0.30 -0.32 0.11 0.00 0.00 0.00 0.00 23.12 22.61 1c01 s ALA 15 CO 0.33 0.43 0.91 -2.00 0.00 0.00 0.00 175.76 175.43 1c01 s GLU 16 N -1.78 0.75 0.16 0.00 2.12 -0.82 -5.00 118.70 114.12 1c01 s GLU 16 Ca 0.09 -0.00 0.10 0.00 0.36 0.00 0.00 54.97 55.52 1c01 s GLU 16 Cb -0.10 0.35 -0.04 0.00 0.26 0.00 0.00 34.13 34.60 1c01 s GLU 16 CO 0.04 -0.27 -0.21 1.03 -0.54 0.00 0.00 175.26 175.31 1c01 s ARG 17 N -1.85 1.33 -0.49 4.30 0.52 -1.26 -0.79 118.95 120.70 1c01 s ARG 17 Ca -0.01 -1.39 0.04 0.00 -0.52 0.00 0.00 55.73 53.86 1c01 s ARG 17 Cb -0.01 -1.55 0.17 0.00 0.52 0.00 0.00 34.95 34.09 1c01 s ARG 17 CO -0.01 0.34 0.39 0.66 0.02 0.00 0.00 175.30 176.69 1c01 n TYR 18 N 0.51 0.20 -0.20 -0.53 4.02 -0.08 -4.90 117.16 116.18 1c01 n TYR 18 Ca -0.15 -3.58 0.10 0.00 -0.01 0.00 0.00 57.90 54.26 1c01 n TYR 18 Cb 0.56 0.02 0.25 0.00 -0.02 0.00 0.00 39.34 40.15 1c01 n TYR 18 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1c01 n SER 19 N 2.58 3.55 -4.75 7.72 3.41 -1.26 -2.30 113.62 122.58 1c01 n SER 19 Ca 0.27 -1.98 -0.42 0.00 -0.26 0.00 0.00 58.87 56.48 1c01 n SER 19 Cb 0.45 -0.37 -0.01 0.00 -0.26 0.00 0.00 64.21 64.02 1c01 n SER 19 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 1c01 n LYS 20 N 1.29 2.55 -1.97 4.33 3.00 -1.26 -4.92 118.16 121.19 1c01 n LYS 20 Ca 0.20 0.90 -0.32 0.00 -0.00 0.00 0.00 58.31 59.09 1c01 n LYS 20 Cb 0.56 -2.62 0.02 0.00 0.00 0.00 0.00 35.03 32.98 1c01 n LYS 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1c01 n GLY 22 N -1.28 1.95 3.61 0.00 0.00 0.36 -4.82 105.19 105.02 1c01 n GLY 22 Ca 0.08 -0.17 -0.04 0.00 0.00 0.00 0.00 46.02 45.89 1c01 n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c01 s SER 24 N -2.63 -0.73 0.14 0.00 1.04 -0.80 -4.97 113.70 105.75 1c01 s SER 24 Ca 0.10 1.32 -0.30 0.00 0.48 0.00 0.00 55.95 57.56 1c01 s SER 24 Cb 0.00 1.31 -0.07 0.00 0.10 0.00 0.00 66.02 67.37 1c01 s SER 24 CO -0.04 -0.31 0.97 0.00 0.98 0.00 0.00 173.24 174.84 1c01 s ALA 25 N 0.11 3.28 0.18 5.32 0.00 -1.26 -1.14 121.76 128.25 1c01 s ALA 25 Ca -0.02 0.61 0.04 0.00 0.00 0.00 0.00 51.96 52.60 1c01 s ALA 25 Cb -0.04 -3.27 -0.04 0.00 0.00 0.00 0.00 23.12 19.77 1c01 s ALA 25 CO 0.03 -0.00 0.23 0.42 0.00 0.00 0.00 175.76 176.43 1c01 s ILE 26 N -0.25 4.87 0.00 0.00 1.09 -0.50 -4.96 121.20 121.46 1c01 s ILE 26 Ca 0.46 -0.98 0.00 0.00 -1.10 0.00 0.00 60.65 59.03 1c01 s ILE 26 Cb -0.25 -3.54 0.00 0.00 -1.06 0.00 0.00 42.46 37.61 1c01 s ILE 26 CO 0.31 -0.17 0.00 1.41 -0.10 0.00 0.00 174.94 176.39 1c01 n HIS 27 N -0.69 0.00 -2.17 3.97 8.25 -1.26 -4.82 115.22 118.51 1c01 n HIS 27 Ca -0.08 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.01 1c01 n HIS 27 Cb 0.55 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.63 1c01 n HIS 27 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 1c01 s GLN 28 N -1.88 2.78 -1.31 -0.41 1.11 -1.26 -4.87 119.66 113.82 1c01 s GLN 28 Ca 0.00 0.16 -0.06 0.00 0.01 0.00 0.00 55.36 55.46 1c01 s GLN 28 Cb 0.00 -4.55 0.13 0.00 -1.01 0.00 0.00 33.01 27.58 1c01 s GLN 28 CO 0.00 -2.72 2.24 1.17 0.01 0.00 0.00 175.29 175.99 1c01 n LYS 29 N 9.14 4.33 0.00 2.91 0.00 -1.17 -4.72 118.16 128.65 1c01 n LYS 29 Ca 0.22 -3.49 0.00 0.00 0.00 0.00 0.00 58.31 55.04 1c01 n LYS 29 Cb 0.50 -2.71 0.00 0.00 0.00 0.00 0.00 35.03 32.82 1c01 n LYS 29 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1c01 n GLY 30 N 2.02 4.10 3.95 3.14 0.00 -0.67 -4.44 105.19 113.28 1c01 n GLY 30 Ca 0.56 -0.52 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 1c01 n GLY 30 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1c01 s GLY 31 N 0.00 1.50 -0.28 -0.02 0.00 -0.67 -2.09 107.32 105.76 1c01 s GLY 31 Ca 0.00 -0.99 -0.21 0.00 0.00 0.00 0.00 44.72 43.52 1c01 s GLY 31 CO 0.00 -0.85 0.77 -2.52 0.00 0.00 0.00 173.10 170.50 1c01 s TYR 32 N -2.49 -0.82 0.35 1.90 1.13 -0.61 -0.68 117.35 116.13 1c01 s TYR 32 Ca 0.46 1.84 0.09 0.00 -1.41 0.00 0.00 57.07 58.04 1c01 s TYR 32 Cb -0.10 0.41 -0.07 0.00 -1.10 0.00 0.00 41.96 41.10 1c01 s TYR 32 CO 0.38 -0.40 -0.07 0.34 -2.51 0.00 0.00 175.55 173.28 1c01 s ASP 33 N 0.84 3.63 0.09 -0.18 2.15 0.29 -1.25 116.67 122.24 1c01 s ASP 33 Ca -0.04 -1.23 0.03 0.00 0.43 0.00 0.00 52.55 51.75 1c01 s ASP 33 Cb -0.05 -0.33 -0.04 0.00 -0.30 0.00 0.00 42.92 42.20 1c01 s ASP 33 CO -0.08 -0.27 -0.09 0.12 -0.17 0.00 0.00 175.17 174.68 1c01 s PHE 34 N -2.68 0.99 -0.41 -5.34 5.36 -0.66 0.20 117.98 115.44 1c01 s PHE 34 Ca 0.33 -0.69 0.04 0.00 -0.96 0.00 0.00 56.93 55.65 1c01 s PHE 34 Cb 0.04 -0.55 0.16 0.00 -0.34 0.00 0.00 43.02 42.34 1c01 s PHE 34 CO 0.16 -0.04 0.41 -1.12 -1.46 0.00 0.00 175.22 173.18 1c01 s SER 35 N -2.46 0.91 0.17 6.13 0.01 -0.20 -1.74 113.70 116.51 1c01 s SER 35 Ca 0.05 -2.08 -0.33 0.00 1.31 0.00 0.00 55.95 54.90 1c01 s SER 35 Cb -0.02 0.44 -0.16 0.00 0.21 0.00 0.00 66.02 66.49 1c01 s SER 35 CO -0.01 -0.20 1.22 0.00 0.41 0.00 0.00 173.24 174.66 1c01 n TYR 36 N 3.60 1.42 -3.08 2.43 9.36 -1.26 0.91 117.16 130.54 1c01 n TYR 36 Ca 0.18 0.64 -0.12 0.00 3.32 0.00 0.00 57.90 61.92 1c01 n TYR 36 Cb 0.47 -2.31 -0.04 0.00 -0.63 0.00 0.00 39.34 36.84 1c01 n TYR 36 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 1c01 s THR 37 N -0.07 -0.52 -1.85 2.97 2.01 -1.26 -4.31 115.64 112.61 1c01 s THR 37 Ca 0.74 -1.34 0.00 0.00 0.31 0.00 0.00 61.69 61.40 1c01 s THR 37 Cb -0.84 -0.45 0.00 0.00 0.01 0.00 0.00 72.50 71.21 1c01 s THR 37 CO 0.51 -0.44 0.00 0.61 -0.69 0.00 0.00 174.62 174.61 1c01 n GLY 38 N 3.30 1.69 3.48 4.40 0.00 -1.26 -4.18 105.19 112.61 1c01 n GLY 38 Ca 0.19 -0.09 -0.11 0.00 0.00 0.00 0.00 46.02 46.01 1c01 n GLY 38 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1c01 s GLN 39 N -3.46 1.34 0.52 1.61 2.00 -1.26 -5.00 119.66 115.41 1c01 s GLN 39 Ca 0.00 -0.55 0.05 0.00 -2.00 0.00 0.00 55.36 52.86 1c01 s GLN 39 Cb 0.00 0.59 0.02 0.00 0.80 0.00 0.00 33.01 34.42 1c01 s GLN 39 CO 0.00 -0.59 0.28 0.95 -0.50 0.00 0.00 175.29 175.43 1c01 s THR 40 N -3.77 1.62 0.25 -0.34 -4.23 -1.26 -4.71 115.64 103.21 1c01 s THR 40 Ca 0.02 -1.63 -0.05 0.00 -1.18 0.00 0.00 61.69 58.85 1c01 s THR 40 Cb -0.02 -2.26 -0.02 0.00 1.34 0.00 0.00 72.50 71.55 1c01 s THR 40 CO -0.10 0.00 0.33 0.00 -0.54 0.00 0.00 174.62 174.31 1c01 s ALA 41 N -2.77 0.64 -0.02 3.99 0.00 -0.57 -3.16 121.76 119.87 1c01 s ALA 41 Ca 0.28 -1.40 -0.22 0.00 0.00 0.00 0.00 51.96 50.62 1c01 s ALA 41 Cb -0.01 1.24 0.05 0.00 0.00 0.00 0.00 23.12 24.40 1c01 s ALA 41 CO 0.17 -0.73 0.48 0.00 0.00 0.00 0.00 175.76 175.68 1c01 s ALA 42 N -3.84 -1.24 -0.19 0.00 0.00 -0.19 -1.97 121.76 114.32 1c01 s ALA 42 Ca 0.32 0.74 -0.06 0.00 0.00 0.00 0.00 51.96 52.96 1c01 s ALA 42 Cb 0.03 0.09 -0.03 0.00 0.00 0.00 0.00 23.12 23.21 1c01 s ALA 42 CO 0.14 -0.34 0.02 -0.51 0.00 0.00 0.00 175.76 175.07 1c01 s LEU 43 N -1.38 3.47 -0.45 0.00 2.01 0.24 -0.76 118.68 121.81 1c01 s LEU 43 Ca -0.11 -0.09 -0.08 0.00 0.01 0.00 0.00 54.13 53.85 1c01 s LEU 43 Cb -0.02 -1.88 0.11 0.00 0.01 0.00 0.00 46.19 44.40 1c01 s LEU 43 CO 0.05 0.11 0.30 -0.31 1.01 0.00 0.00 176.35 177.51 1c01 s TYR 44 N 0.74 3.42 -0.41 0.29 1.51 -0.23 -0.98 117.35 121.69 1c01 s TYR 44 Ca 0.01 -1.85 0.17 0.00 -1.01 0.00 0.00 57.07 54.40 1c01 s TYR 44 Cb -0.14 -3.30 0.90 0.00 -0.11 0.00 0.00 41.96 39.31 1c01 s TYR 44 CO 0.02 -0.95 1.53 -1.71 -1.11 0.00 0.00 175.55 173.33 1c01 n ASN 45 N 4.87 0.44 -4.73 2.29 5.15 -1.26 -1.04 115.26 120.99 1c01 n ASN 45 Ca -0.08 0.69 -0.38 0.00 -0.60 0.00 0.00 54.58 54.22 1c01 n ASN 45 Cb 0.41 -0.76 -0.06 0.00 -0.53 0.00 0.00 39.78 38.85 1c01 n ASN 45 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 1c01 s GLN 46 N -3.40 4.30 0.66 1.20 -1.52 -1.26 -3.83 119.66 115.81 1c01 s GLN 46 Ca -0.01 0.37 -0.17 0.00 -1.95 0.00 0.00 55.36 53.59 1c01 s GLN 46 Cb 0.05 -3.42 -0.03 0.00 -0.22 0.00 0.00 33.01 29.39 1c01 s GLN 46 CO 0.18 0.20 0.88 0.00 -0.25 0.00 0.00 175.29 176.30 1c01 n ALA 47 N 3.56 -0.26 -1.73 6.09 0.00 -1.26 -2.59 120.51 124.31 1c01 n ALA 47 Ca -0.08 -0.10 -0.17 0.00 0.00 0.00 0.00 53.44 53.09 1c01 n ALA 47 Cb 0.52 -2.06 -0.05 0.00 0.00 0.00 0.00 19.45 17.85 1c01 n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1c01 n GLY 48 N 1.31 1.10 2.82 0.00 0.00 -1.26 -2.36 105.19 106.80 1c01 n GLY 48 Ca 0.13 -0.21 -0.08 0.00 0.00 0.00 0.00 46.02 45.86 1c01 n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1c01 n SER 50 N -1.09 7.22 0.00 0.00 7.64 -0.99 -4.78 113.62 121.61 1c01 n SER 50 Ca -0.08 -3.02 0.00 0.00 1.01 0.00 0.00 58.87 56.78 1c01 n SER 50 Cb 0.57 -1.44 0.00 0.00 -1.01 0.00 0.00 64.21 62.32 1c01 n SER 50 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1c01 n GLY 51 N 2.45 4.75 3.28 0.23 0.00 -1.26 -4.75 105.19 109.90 1c01 n GLY 51 Ca 0.59 -0.55 -0.18 0.00 0.00 0.00 0.00 46.02 45.89 1c01 n GLY 51 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1c01 s VAL 52 N 1.57 0.11 0.17 1.61 0.11 -1.26 -5.04 120.40 117.67 1c01 s VAL 52 Ca 0.00 -2.00 -0.17 0.00 -2.93 0.00 0.00 61.98 56.88 1c01 s VAL 52 Cb 0.00 -2.50 -0.07 0.00 -1.53 0.00 0.00 36.38 32.28 1c01 s VAL 52 CO 0.00 0.00 0.62 0.00 -3.33 0.00 0.00 175.10 172.39 1c01 s ALA 53 N -3.67 3.51 0.02 1.54 0.00 -1.26 -4.00 121.76 117.90 1c01 s ALA 53 Ca 0.38 0.01 0.00 0.00 0.00 0.00 0.00 51.96 52.35 1c01 s ALA 53 Cb 0.04 -2.66 0.00 0.00 0.00 0.00 0.00 23.12 20.50 1c01 s ALA 53 CO 0.20 0.40 0.00 0.72 0.00 0.00 0.00 175.76 177.08 1c01 n HIS 54 N 0.86 -0.01 -4.19 0.00 -0.00 -0.15 -4.95 115.22 106.78 1c01 n HIS 54 Ca -0.05 0.00 -0.31 0.00 -0.00 0.00 0.00 57.72 57.37 1c01 n HIS 54 Cb 0.51 0.01 -0.16 0.00 -0.00 0.00 0.00 29.99 30.35 1c01 n HIS 54 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.34 177.33 1c01 s THR 55 N -2.00 1.72 -0.24 1.59 2.01 -1.26 -4.96 115.64 112.50 1c01 s THR 55 Ca 0.00 -0.74 -0.05 0.00 0.31 0.00 0.00 61.69 61.21 1c01 s THR 55 Cb 0.00 -1.58 -0.01 0.00 0.01 0.00 0.00 72.50 70.92 1c01 s THR 55 CO 0.00 0.48 0.01 -0.13 -0.69 0.00 0.00 174.62 174.30 1c01 s ARG 56 N 1.28 3.39 -0.70 4.92 0.52 -1.26 -0.59 118.95 126.51 1c01 s ARG 56 Ca 0.02 -0.63 -0.13 0.00 -0.52 0.00 0.00 55.73 54.46 1c01 s ARG 56 Cb -0.13 -3.17 0.18 0.00 0.52 0.00 0.00 34.95 32.35 1c01 s ARG 56 CO -0.09 -0.25 0.62 -0.06 0.02 0.00 0.00 175.30 175.55 1c01 s PHE 57 N 1.52 3.57 -0.20 -0.53 0.08 -0.83 -4.85 117.98 116.73 1c01 s PHE 57 Ca 0.05 -1.89 0.19 0.00 0.12 0.00 0.00 56.93 55.40 1c01 s PHE 57 Cb -0.15 -3.72 0.01 0.00 -0.57 0.00 0.00 43.02 38.59 1c01 s PHE 57 CO -0.00 -0.98 1.14 0.78 -0.10 0.00 0.00 175.22 176.05 1c01 h GLY 58 N 8.04 0.00 -5.10 4.36 0.00 -1.90 -1.50 103.07 106.97 1c01 h GLY 58 Ca -0.04 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 46.98 1c01 h GLY 58 CO 0.83 0.00 -0.75 -0.45 0.00 0.00 0.00 176.54 176.17 1c01 s SER 59 N -5.89 0.77 -0.23 0.19 0.15 -1.26 -4.61 113.70 102.82 1c01 s SER 59 Ca 0.01 -0.29 -0.33 0.00 0.70 0.00 0.00 55.95 56.04 1c01 s SER 59 Cb 0.08 -0.03 -0.15 0.00 -1.71 0.00 0.00 66.02 64.21 1c01 s SER 59 CO 0.77 -0.04 1.04 -1.20 1.20 0.00 0.00 173.24 175.02 1c01 n SER 60 N 2.33 0.54 -3.64 5.45 7.64 -1.26 -4.71 113.62 119.98 1c01 n SER 60 Ca -0.17 0.89 -0.28 0.00 1.01 0.00 0.00 58.87 60.32 1c01 n SER 60 Cb 0.57 -0.67 -0.16 0.00 -1.01 0.00 0.00 64.21 62.93 1c01 n SER 60 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1c01 s ALA 61 N 1.35 0.76 -1.23 -0.43 0.00 -0.71 -4.91 121.76 116.60 1c01 s ALA 61 Ca 0.75 -0.81 -0.18 0.00 0.00 0.00 0.00 51.96 51.72 1c01 s ALA 61 Cb -1.06 -1.25 -0.01 0.00 0.00 0.00 0.00 23.12 20.80 1c01 s ALA 61 CO 0.54 -1.38 1.96 0.54 0.00 0.00 0.00 175.76 177.42 1c01 n ARG 62 N 5.16 2.50 -3.26 0.00 5.12 -1.26 -1.66 116.66 123.26 1c01 n ARG 62 Ca -0.07 -2.67 -0.30 0.00 -1.93 0.00 0.00 57.85 52.89 1c01 n ARG 62 Cb 0.46 -3.37 -0.04 0.00 -1.16 0.00 0.00 32.46 28.35 1c01 n ARG 62 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1c01 s ALA 63 N 5.29 3.56 0.00 7.54 0.00 -0.38 -4.94 121.76 132.83 1c01 s ALA 63 Ca 0.55 -0.43 0.00 0.00 0.00 0.00 0.00 51.96 52.08 1c01 s ALA 63 Cb 0.08 -2.41 0.00 0.00 0.00 0.00 0.00 23.12 20.80 1c01 s ALA 63 CO 0.05 0.25 0.93 0.00 0.00 0.00 0.00 175.76 176.99 1c01 s ASN 65 N -0.86 5.21 0.57 0.00 -0.87 -1.26 -4.11 114.94 113.62 1c01 s ASN 65 Ca 0.00 1.13 -0.20 0.00 -1.57 0.00 0.00 52.86 52.22 1c01 s ASN 65 Cb 0.00 -1.89 -0.05 0.00 -0.02 0.00 0.00 41.25 39.29 1c01 s ASN 65 CO 0.00 -1.49 1.07 -2.65 -2.57 0.00 0.00 177.10 171.46 1c01 n PRO 66 N -3.10 1.12 -0.94 -0.60 -0.02 -1.25 -3.91 135.00 126.30 1c01 n PRO 66 Ca 0.07 0.42 -0.29 0.00 -2.02 0.00 0.00 63.50 61.68 1c01 n PRO 66 Cb 0.57 -2.25 0.22 0.00 -0.02 0.00 0.00 33.50 32.02 1c01 n PRO 66 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 1c01 s PHE 67 N -1.43 1.21 0.00 6.00 5.36 -0.89 -4.94 117.98 123.30 1c01 s PHE 67 Ca 0.74 0.83 0.00 0.00 -0.96 0.00 0.00 56.93 57.54 1c01 s PHE 67 Cb -0.43 -3.25 0.00 0.00 -0.34 0.00 0.00 43.02 39.00 1c01 s PHE 67 CO 0.48 -3.62 0.00 0.41 -1.46 0.00 0.00 175.22 171.03 1c01 n GLY 68 N -0.42 0.99 0.46 13.12 0.00 -1.26 -4.98 105.19 113.10 1c01 n GLY 68 Ca 0.07 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.06 1c01 n GLY 68 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 1c01 n TRP 69 N 0.00 0.05 0.00 1.61 8.01 -1.26 -4.80 117.44 121.05 1c01 n TRP 69 Ca 0.00 -0.35 0.00 0.00 -1.31 0.00 0.00 57.50 55.84 1c01 n TRP 69 Cb 0.43 -0.01 0.00 0.00 -2.01 0.00 0.00 31.31 29.72 1c01 n TRP 69 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.69 177.85 1c01 n LYS 70 N -0.13 2.33 -3.95 -0.99 3.00 -0.94 -4.87 118.16 112.60 1c01 n LYS 70 Ca -0.01 0.00 -0.09 0.00 -0.00 0.00 0.00 58.31 58.20 1c01 n LYS 70 Cb 0.08 -0.83 -0.07 0.00 0.00 0.00 0.00 35.03 34.21 1c01 n LYS 70 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1c01 s SER 71 N -1.77 0.10 -0.18 3.14 1.04 -0.20 -1.41 113.70 114.41 1c01 s SER 71 Ca 0.00 -0.84 0.00 0.00 0.48 0.00 0.00 55.95 55.59 1c01 s SER 71 Cb 0.00 0.39 0.04 0.00 0.10 0.00 0.00 66.02 66.55 1c01 s SER 71 CO 0.00 -0.83 -0.07 -0.51 0.98 0.00 0.00 173.24 172.81 1c01 s ILE 72 N -3.94 1.34 -0.25 -1.02 1.10 -0.29 -1.06 121.20 117.07 1c01 s ILE 72 Ca 0.14 -0.81 -0.17 0.00 -0.51 0.00 0.00 60.65 59.31 1c01 s ILE 72 Cb 0.04 -1.48 -0.03 0.00 0.15 0.00 0.00 42.46 41.14 1c01 s ILE 72 CO -0.03 0.13 0.45 0.12 -2.11 0.00 0.00 174.94 173.50 1c01 s PHE 73 N 1.53 3.28 -0.07 3.50 5.36 0.06 -1.91 117.98 129.74 1c01 s PHE 73 Ca -0.00 0.56 0.02 0.00 -0.96 0.00 0.00 56.93 56.54 1c01 s PHE 73 Cb -0.16 -2.64 0.02 0.00 -0.34 0.00 0.00 43.02 39.90 1c01 s PHE 73 CO -0.08 -0.21 -0.10 0.42 -1.46 0.00 0.00 175.22 173.79 1c01 s ILE 74 N 2.03 0.99 -2.00 3.12 1.01 0.19 -1.02 121.20 125.52 1c01 s ILE 74 Ca 0.19 -0.37 0.00 0.00 0.00 0.00 0.00 60.65 60.47 1c01 s ILE 74 Cb -0.16 -0.93 0.01 0.00 0.01 0.00 0.00 42.46 41.39 1c01 s ILE 74 CO 0.09 0.33 0.93 0.00 0.00 0.00 0.00 174.94 176.29 1c01 n GLN 75 N 4.02 0.92 0.00 2.79 3.00 -1.19 -0.48 117.38 126.43 1c01 n GLN 75 Ca -0.22 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.77 1c01 n GLN 75 Cb 0.51 -1.01 0.00 0.00 0.00 0.00 0.00 30.24 29.75 1c01 n GLN 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06