#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hz2 n ALA 2 N 0.00 0.60 -1.63 5.41 0.00 -1.26 -4.71 120.51 118.91 3hz2 n ALA 2 Ca 0.00 0.28 -0.46 0.00 0.00 0.00 0.00 53.44 53.26 3hz2 n ALA 2 Cb 0.00 -2.15 -0.03 0.00 0.00 0.00 0.00 19.45 17.27 3hz2 n ALA 2 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hz2 n ALA 3 N -0.22 0.35 -3.38 0.00 0.00 -1.26 -4.73 120.51 111.28 3hz2 n ALA 3 Ca 0.08 0.42 -0.13 0.00 0.00 0.00 0.00 53.44 53.80 3hz2 n ALA 3 Cb 0.38 -2.16 -0.09 0.00 0.00 0.00 0.00 19.45 17.58 3hz2 n ALA 3 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 3hz2 s GLU 4 N -0.76 0.58 -0.06 0.00 2.12 -0.49 -4.57 118.70 115.52 3hz2 s GLU 4 Ca 0.66 0.63 -0.05 0.00 0.36 0.00 0.00 54.97 56.57 3hz2 s GLU 4 Cb -0.71 0.28 0.02 0.00 0.26 0.00 0.00 34.13 33.98 3hz2 s GLU 4 CO 0.54 -0.08 0.16 0.54 -0.54 0.00 0.00 175.26 175.88 3hz2 s VAL 5 N 0.15 -0.00 -0.14 3.70 0.11 -0.37 -1.13 120.40 122.71 3hz2 s VAL 5 Ca -0.01 0.01 0.01 0.00 -2.93 0.00 0.00 61.98 59.06 3hz2 s VAL 5 Cb -0.03 -0.23 -0.00 0.00 -1.53 0.00 0.00 36.38 34.58 3hz2 s VAL 5 CO 0.01 0.00 -0.16 -0.63 -3.33 0.00 0.00 175.10 170.99 3hz2 s ILE 6 N 0.13 2.62 0.03 7.04 1.01 -0.03 -0.43 121.20 131.58 3hz2 s ILE 6 Ca -0.00 -0.80 0.03 0.00 0.00 0.00 0.00 60.65 59.88 3hz2 s ILE 6 Cb -0.02 -2.09 -0.04 0.00 0.01 0.00 0.00 42.46 40.33 3hz2 s ILE 6 CO -0.00 0.52 -0.02 0.68 0.00 0.00 0.00 174.94 176.12 3hz2 s VAL 7 N 0.66 3.94 0.06 2.92 -7.23 -0.74 -0.59 120.40 119.43 3hz2 s VAL 7 Ca -0.08 -0.80 0.06 0.00 -1.81 0.00 0.00 61.98 59.34 3hz2 s VAL 7 Cb -0.16 -2.79 -0.03 0.00 0.56 0.00 0.00 36.38 33.96 3hz2 s VAL 7 CO 0.02 0.28 -0.16 -0.31 -0.31 0.00 0.00 175.10 174.62 3hz2 s TYR 8 N -1.14 1.42 0.08 2.82 1.51 -0.24 -1.63 117.35 120.17 3hz2 s TYR 8 Ca 0.21 -0.40 -0.20 0.00 -1.01 0.00 0.00 57.07 55.67 3hz2 s TYR 8 Cb -0.11 -0.82 -0.10 0.00 -0.11 0.00 0.00 41.96 40.82 3hz2 s TYR 8 CO 0.12 0.09 1.58 1.49 -1.11 0.00 0.00 175.55 177.72 3hz2 h GLU 9 N 4.54 0.30 -6.17 -0.62 4.81 -0.34 -0.12 114.58 116.97 3hz2 h GLU 9 Ca -0.41 -0.07 -0.51 0.00 -0.13 0.00 0.00 59.36 58.24 3hz2 h GLU 9 Cb 1.18 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.47 3hz2 h GLU 9 CO 0.42 0.42 -0.49 -1.01 -0.73 0.00 0.00 179.01 177.62 3hz2 s HIS 10 N -5.34 2.88 0.91 0.92 3.76 0.60 -3.48 115.29 115.53 3hz2 s HIS 10 Ca -0.14 -0.29 -0.11 0.00 -0.15 0.00 0.00 55.06 54.37 3hz2 s HIS 10 Cb 0.07 -1.68 0.14 0.00 1.11 0.00 0.00 32.58 32.22 3hz2 s HIS 10 CO 0.71 0.29 1.11 0.14 -0.85 0.00 0.00 174.74 176.14 3hz2 s VAL 11 N -2.31 2.47 -1.63 -0.90 -7.23 -1.26 -2.59 120.40 106.95 3hz2 s VAL 11 Ca 0.39 0.15 -0.03 0.00 -1.81 0.00 0.00 61.98 60.68 3hz2 s VAL 11 Cb -0.05 -2.38 0.01 0.00 0.56 0.00 0.00 36.38 34.52 3hz2 s VAL 11 CO 0.25 -0.20 0.35 0.59 -0.31 0.00 0.00 175.10 175.78 3hz2 n ASN 12 N -4.10 -5.94 -3.46 4.85 3.02 0.26 -3.14 115.26 106.75 3hz2 n ASN 12 Ca 0.09 -0.17 -0.24 0.00 -0.03 0.00 0.00 54.58 54.23 3hz2 n ASN 12 Cb 0.53 -4.86 0.06 0.00 -0.61 0.00 0.00 39.78 34.91 3hz2 n ASN 12 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3hz2 n PHE 13 N -4.28 -2.58 -3.24 3.10 3.01 -1.18 -5.01 117.46 107.29 3hz2 n PHE 13 Ca -0.16 0.87 -0.20 0.00 1.01 0.00 0.00 57.45 58.96 3hz2 n PHE 13 Cb 0.65 -4.78 0.02 0.00 -0.01 0.00 0.00 39.48 35.36 3hz2 n PHE 13 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 3hz2 s GLY 14 N -3.14 1.96 0.00 1.37 0.00 -1.07 -4.93 107.32 101.51 3hz2 s GLY 14 Ca 0.52 -1.84 0.00 0.00 0.00 0.00 0.00 44.72 43.40 3hz2 s GLY 14 CO 0.64 -1.67 0.00 0.61 0.00 0.00 0.00 173.10 172.68 3hz2 n GLY 15 N -1.94 -0.32 3.77 0.20 0.00 -1.26 -0.30 105.19 105.35 3hz2 n GLY 15 Ca 0.09 -1.07 -0.41 0.00 0.00 0.00 0.00 46.02 44.63 3hz2 n GLY 15 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3hz2 s LYS 16 N 0.00 4.04 0.12 1.61 2.47 -1.26 -4.63 119.74 122.09 3hz2 s LYS 16 Ca 0.00 2.48 0.03 0.00 -1.56 0.00 0.00 55.97 56.92 3hz2 s LYS 16 Cb 0.00 -2.90 -0.04 0.00 -1.46 0.00 0.00 37.83 33.43 3hz2 s LYS 16 CO 0.00 -0.56 -0.09 -1.54 0.16 0.00 0.00 175.35 173.33 3hz2 s SER 17 N -0.29 1.50 -0.06 1.43 1.04 -1.26 -0.28 113.70 115.78 3hz2 s SER 17 Ca 0.54 -0.98 -0.02 0.00 0.48 0.00 0.00 55.95 55.97 3hz2 s SER 17 Cb -0.45 0.03 0.04 0.00 0.10 0.00 0.00 66.02 65.74 3hz2 s SER 17 CO 0.60 -0.37 0.11 0.12 0.98 0.00 0.00 173.24 174.69 3hz2 s PHE 18 N -3.28 -0.10 -0.43 5.02 5.36 -0.64 -4.99 117.98 118.93 3hz2 s PHE 18 Ca 0.13 0.42 -0.18 0.00 -0.96 0.00 0.00 56.93 56.35 3hz2 s PHE 18 Cb 0.03 -0.23 0.02 0.00 -0.34 0.00 0.00 43.02 42.49 3hz2 s PHE 18 CO -0.01 -0.19 0.45 0.34 -1.46 0.00 0.00 175.22 174.35 3hz2 s ASP 19 N 1.67 6.20 -0.15 6.13 -1.08 -1.26 -1.79 116.67 126.39 3hz2 s ASP 19 Ca -0.03 -0.67 -0.05 0.00 -0.52 0.00 0.00 52.55 51.28 3hz2 s ASP 19 Cb -0.12 -2.23 -0.04 0.00 -1.46 0.00 0.00 42.92 39.07 3hz2 s ASP 19 CO -0.05 -0.60 0.03 0.00 0.52 0.00 0.00 175.17 175.07 3hz2 s ALA 20 N 2.18 3.30 0.00 3.66 0.00 0.43 -4.93 121.76 126.39 3hz2 s ALA 20 Ca 0.13 -0.77 0.00 0.00 0.00 0.00 0.00 51.96 51.32 3hz2 s ALA 20 Cb -0.17 -1.73 0.00 0.00 0.00 0.00 0.00 23.12 21.22 3hz2 s ALA 20 CO 0.14 0.30 0.56 0.25 0.00 0.00 0.00 175.76 177.01 3hz2 n THR 21 N 3.14 0.23 -4.14 0.00 -2.24 -1.26 -1.24 114.28 108.77 3hz2 n THR 21 Ca -0.17 -0.54 -0.10 0.00 -2.27 0.00 0.00 64.05 60.96 3hz2 n THR 21 Cb 0.53 0.99 -0.10 0.00 -2.10 0.00 0.00 70.33 69.65 3hz2 n THR 21 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3hz2 s SER 22 N -0.23 0.27 0.49 3.42 1.04 -1.26 -4.88 113.70 112.56 3hz2 s SER 22 Ca 0.00 -1.20 -0.23 0.00 0.48 0.00 0.00 55.95 55.00 3hz2 s SER 22 Cb 0.00 0.32 -0.06 0.00 0.10 0.00 0.00 66.02 66.37 3hz2 s SER 22 CO 0.00 -0.75 1.33 -1.81 0.98 0.00 0.00 173.24 172.99 3hz2 s ASP 23 N -3.05 5.67 -0.41 7.02 1.01 -1.26 -4.92 116.67 120.73 3hz2 s ASP 23 Ca 0.25 2.70 0.02 0.00 0.71 0.00 0.00 52.55 56.23 3hz2 s ASP 23 Cb 0.07 -2.63 0.12 0.00 1.01 0.00 0.00 42.92 41.49 3hz2 s ASP 23 CO 0.03 -1.29 0.17 -1.10 0.21 0.00 0.00 175.17 173.18 3hz2 s GLN 24 N -2.70 1.36 0.00 8.23 -1.52 0.70 -4.96 119.66 120.77 3hz2 s GLN 24 Ca 0.66 -1.91 0.16 0.00 -1.95 0.00 0.00 55.36 52.32 3hz2 s GLN 24 Cb -0.39 -2.68 0.81 0.00 -0.22 0.00 0.00 33.01 30.53 3hz2 s GLN 24 CO 0.47 -1.06 1.45 -0.35 -0.25 0.00 0.00 175.29 175.55 3hz2 n PRO 25 N 3.90 0.24 0.00 2.91 -0.04 -1.26 -0.78 135.00 139.97 3hz2 n PRO 25 Ca 0.04 0.13 0.00 0.00 -0.04 0.00 0.00 63.50 63.63 3hz2 n PRO 25 Cb 0.37 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.33 3hz2 n PRO 25 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3hz2 n GLY 26 N 0.06 1.28 2.19 0.55 0.00 -1.25 -0.75 105.19 107.27 3hz2 n GLY 26 Ca 0.08 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.06 3hz2 n GLY 26 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hz2 n ALA 27 N -0.33 -0.06 0.00 4.61 0.00 -1.02 -4.27 120.51 119.43 3hz2 n ALA 27 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.51 3hz2 n ALA 27 Cb 0.28 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 18.95 3hz2 n ALA 27 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hz2 n GLY 28 N -2.22 -1.84 3.55 0.00 0.00 -1.26 -4.44 105.19 98.98 3hz2 n GLY 28 Ca -0.04 -1.94 -0.41 0.00 0.00 0.00 0.00 46.02 43.63 3hz2 n GLY 28 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hz2 s ASP 29 N -4.00 6.09 -1.42 1.61 3.68 -1.26 -4.20 116.67 117.17 3hz2 s ASP 29 Ca 0.00 -0.35 -0.11 0.00 2.13 0.00 0.00 52.55 54.22 3hz2 s ASP 29 Cb 0.00 -2.56 0.07 0.00 -1.45 0.00 0.00 42.92 38.99 3hz2 s ASP 29 CO 0.00 -1.88 0.67 0.59 0.13 0.00 0.00 175.17 174.68 3hz2 n ASN 30 N 9.66 -4.33 -0.21 -0.34 5.03 -1.26 -4.86 115.26 118.95 3hz2 n ASN 30 Ca 0.05 -0.53 0.06 0.00 0.87 0.00 0.00 54.58 55.03 3hz2 n ASN 30 Cb 0.49 -3.53 0.11 0.00 -1.02 0.00 0.00 39.78 35.84 3hz2 n ASN 30 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 3hz2 n LEU 31 N -4.08 2.49 -4.71 3.41 4.77 -1.26 -4.98 117.00 112.64 3hz2 n LEU 31 Ca -0.00 -2.65 -0.42 0.00 -0.03 0.00 0.00 56.01 52.91 3hz2 n LEU 31 Cb 0.54 -0.29 -0.03 0.00 -2.33 0.00 0.00 43.42 41.31 3hz2 n LEU 31 CO 0.60 0.64 1.10 0.21 -1.33 0.00 0.00 177.39 178.61 3hz2 s ASN 32 N -2.01 6.79 -1.46 -1.43 2.47 -1.26 -2.68 114.94 115.35 3hz2 s ASN 32 Ca 0.23 2.35 -0.05 0.00 0.42 0.00 0.00 52.86 55.80 3hz2 s ASN 32 Cb 0.19 -2.58 0.01 0.00 -1.45 0.00 0.00 41.25 37.41 3hz2 s ASN 32 CO 0.04 -0.69 0.72 0.47 -3.72 0.00 0.00 177.10 173.92 3hz2 n ASP 33 N 4.16 -6.06 0.00 -4.21 8.00 -0.35 -4.85 116.55 113.23 3hz2 n ASP 33 Ca 0.12 -0.33 0.00 0.00 0.71 0.00 0.00 54.79 55.29 3hz2 n ASP 33 Cb 0.42 -4.83 0.00 0.00 -0.02 0.00 0.00 41.12 36.69 3hz2 n ASP 33 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 3hz2 n LYS 34 N -4.14 4.79 -1.69 -1.24 5.02 -1.09 -4.54 118.16 115.26 3hz2 n LYS 34 Ca -0.08 0.00 -0.44 0.00 -2.02 0.00 0.00 58.31 55.77 3hz2 n LYS 34 Cb 0.60 -0.55 -0.04 0.00 -0.02 0.00 0.00 35.03 35.03 3hz2 n LYS 34 CO 0.00 0.00 0.00 -0.89 -0.52 0.00 0.00 177.40 175.99 3hz2 n ILE 35 N -0.21 0.30 0.00 -0.18 5.41 -1.24 -4.53 119.36 118.91 3hz2 n ILE 35 Ca 0.00 -0.05 0.00 0.00 1.00 0.00 0.00 62.75 63.70 3hz2 n ILE 35 Cb 0.01 -1.96 0.00 0.00 -0.71 0.00 0.00 39.64 36.97 3hz2 n ILE 35 CO 0.00 0.00 0.00 -1.20 0.00 0.00 0.00 176.55 175.35 3hz2 n SER 36 N 5.24 1.85 -3.83 4.38 7.64 -0.06 -3.00 113.62 125.84 3hz2 n SER 36 Ca 0.18 -0.19 -0.11 0.00 1.01 0.00 0.00 58.87 59.76 3hz2 n SER 36 Cb 0.34 0.76 -0.09 0.00 -1.01 0.00 0.00 64.21 64.21 3hz2 n SER 36 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3hz2 s SER 37 N -1.13 -0.02 -0.01 6.43 1.04 -1.18 -0.63 113.70 118.21 3hz2 s SER 37 Ca 0.00 -0.22 -0.07 0.00 0.48 0.00 0.00 55.95 56.13 3hz2 s SER 37 Cb 0.00 0.27 0.00 0.00 0.10 0.00 0.00 66.02 66.39 3hz2 s SER 37 CO 0.00 -0.48 0.15 -0.63 0.98 0.00 0.00 173.24 173.26 3hz2 s ILE 38 N -1.94 0.07 -0.24 -1.02 1.01 -0.60 -1.08 121.20 117.40 3hz2 s ILE 38 Ca -0.10 -0.58 -0.00 0.00 0.00 0.00 0.00 60.65 59.97 3hz2 s ILE 38 Cb -0.04 -0.41 0.07 0.00 0.01 0.00 0.00 42.46 42.09 3hz2 s ILE 38 CO -0.00 -0.32 0.01 -0.54 0.00 0.00 0.00 174.94 174.09 3hz2 s LYS 39 N -1.16 1.13 -0.59 2.79 1.02 0.24 -0.53 119.74 122.65 3hz2 s LYS 39 Ca -0.12 -0.88 -0.21 0.00 0.02 0.00 0.00 55.97 54.78 3hz2 s LYS 39 Cb -0.07 -2.36 0.07 0.00 -0.52 0.00 0.00 37.83 34.96 3hz2 s LYS 39 CO 0.01 -0.71 0.82 0.08 -0.92 0.00 0.00 175.35 174.63 3hz2 s VAL 40 N 1.56 4.59 0.16 3.17 1.01 -0.08 -0.85 120.40 129.96 3hz2 s VAL 40 Ca -0.00 -0.46 -0.09 0.00 0.00 0.00 0.00 61.98 61.42 3hz2 s VAL 40 Cb -0.18 -4.53 -0.03 0.00 0.00 0.00 0.00 36.38 31.65 3hz2 s VAL 40 CO -0.11 -1.17 1.51 0.11 0.00 0.00 0.00 175.10 175.44 3hz2 h LYS 41 N 9.30 0.90 -2.05 2.72 1.79 -1.40 -1.97 116.57 125.85 3hz2 h LYS 41 Ca -0.28 -0.45 0.02 0.00 -2.18 0.00 0.00 60.65 57.75 3hz2 h LYS 41 Cb 1.08 0.01 -0.19 0.00 -1.58 0.00 0.00 32.23 31.55 3hz2 h LYS 41 CO 1.10 1.10 0.35 -1.54 -1.08 0.00 0.00 179.45 179.38 3hz2 s SER 42 N -6.82 -0.51 0.00 0.86 1.04 -1.01 -4.87 113.70 102.38 3hz2 s SER 42 Ca -0.11 0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.73 3hz2 s SER 42 Cb 0.12 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.69 3hz2 s SER 42 CO 0.87 -0.58 0.00 0.61 0.98 0.00 0.00 173.24 175.12 3hz2 n GLY 43 N 0.49 -1.49 3.43 7.32 0.00 -1.26 -1.40 105.19 112.28 3hz2 n GLY 43 Ca -0.14 -1.55 -0.33 0.00 0.00 0.00 0.00 46.02 43.99 3hz2 n GLY 43 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hz2 s THR 44 N -1.57 3.24 0.02 2.61 2.01 -1.26 -3.60 115.64 117.09 3hz2 s THR 44 Ca 0.00 -0.61 0.08 0.00 0.31 0.00 0.00 61.69 61.47 3hz2 s THR 44 Cb 0.00 -2.35 -0.02 0.00 0.01 0.00 0.00 72.50 70.13 3hz2 s THR 44 CO 0.00 0.54 -0.25 0.26 -0.69 0.00 0.00 174.62 174.48 3hz2 s TRP 45 N 0.03 2.21 -0.18 4.92 0.52 -0.39 -1.72 118.94 124.34 3hz2 s TRP 45 Ca -0.03 -0.41 -0.05 0.00 0.02 0.00 0.00 56.10 55.62 3hz2 s TRP 45 Cb -0.14 -1.36 -0.03 0.00 -1.15 0.00 0.00 33.47 30.78 3hz2 s TRP 45 CO 0.04 0.06 0.00 0.50 0.02 0.00 0.00 176.95 177.57 3hz2 s ARG 46 N -0.96 3.74 -0.16 4.98 3.52 0.15 -0.50 118.95 129.72 3hz2 s ARG 46 Ca 0.10 -0.47 -0.03 0.00 -0.13 0.00 0.00 55.73 55.20 3hz2 s ARG 46 Cb -0.10 -3.05 -0.02 0.00 -1.56 0.00 0.00 34.95 30.22 3hz2 s ARG 46 CO 0.01 0.18 -0.05 -0.06 -0.81 0.00 0.00 175.30 174.56 3hz2 s PHE 47 N 0.57 2.98 0.09 5.12 0.40 0.10 -1.54 117.98 125.70 3hz2 s PHE 47 Ca -0.00 -0.42 0.04 0.00 -0.60 0.00 0.00 56.93 55.94 3hz2 s PHE 47 Cb -0.14 -1.95 -0.04 0.00 0.51 0.00 0.00 43.02 41.40 3hz2 s PHE 47 CO 0.02 -0.12 0.04 0.71 0.70 0.00 0.00 175.22 176.57 3hz2 s TYR 48 N 0.48 3.09 -0.81 0.36 2.02 0.45 -1.24 117.35 121.70 3hz2 s TYR 48 Ca -0.04 0.02 0.27 0.00 -0.37 0.00 0.00 57.07 56.95 3hz2 s TYR 48 Cb -0.15 -1.58 0.88 0.00 -0.40 0.00 0.00 41.96 40.72 3hz2 s TYR 48 CO 0.03 0.50 1.77 -0.85 -1.57 0.00 0.00 175.55 175.43 3hz2 n GLU 49 N 0.50 0.18 -4.35 -0.62 0.28 -0.56 -1.09 120.64 114.98 3hz2 n GLU 49 Ca -0.10 0.13 -0.21 0.00 -0.16 0.00 0.00 57.16 56.82 3hz2 n GLU 49 Cb 0.52 -1.70 -0.11 0.00 1.43 0.00 0.00 31.44 31.58 3hz2 n GLU 49 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 3hz2 s TYR 50 N -3.07 1.84 0.99 -1.84 4.12 -0.07 -4.09 117.35 115.22 3hz2 s TYR 50 Ca 0.11 -0.48 -0.11 0.00 0.02 0.00 0.00 57.07 56.61 3hz2 s TYR 50 Cb 0.15 -0.89 0.19 0.00 -1.52 0.00 0.00 41.96 39.88 3hz2 s TYR 50 CO 0.59 0.37 1.09 0.96 0.02 0.00 0.00 175.55 178.58 3hz2 s ILE 51 N -2.30 2.26 -1.46 2.71 -4.36 -1.26 -2.45 121.20 114.34 3hz2 s ILE 51 Ca 0.19 0.08 -0.10 0.00 -0.26 0.00 0.00 60.65 60.56 3hz2 s ILE 51 Cb -0.04 -2.26 0.05 0.00 1.25 0.00 0.00 42.46 41.46 3hz2 s ILE 51 CO 0.07 -0.11 0.82 0.59 0.24 0.00 0.00 174.94 176.56 3hz2 n ASN 52 N -4.36 -5.18 -3.69 4.36 3.02 0.07 -2.66 115.26 106.83 3hz2 n ASN 52 Ca 0.07 -0.54 -0.21 0.00 -0.03 0.00 0.00 54.58 53.87 3hz2 n ASN 52 Cb 0.54 -4.16 0.04 0.00 -0.61 0.00 0.00 39.78 35.59 3hz2 n ASN 52 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 3hz2 n TYR 53 N -4.54 -1.97 -4.10 3.10 4.02 -1.21 -5.00 117.16 107.46 3hz2 n TYR 53 Ca -0.01 0.86 -0.22 0.00 -0.01 0.00 0.00 57.90 58.51 3hz2 n TYR 53 Cb 0.56 -4.44 -0.05 0.00 -0.02 0.00 0.00 39.34 35.38 3hz2 n TYR 53 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 3hz2 s GLY 54 N -4.29 1.56 0.00 2.72 0.00 -1.02 -4.97 107.32 101.32 3hz2 s GLY 54 Ca 0.05 -1.54 0.00 0.00 0.00 0.00 0.00 44.72 43.23 3hz2 s GLY 54 CO 0.80 -1.56 0.00 0.61 0.00 0.00 0.00 173.10 172.96 3hz2 n GLY 55 N -1.15 -0.95 3.76 0.20 0.00 -1.26 -0.90 105.19 104.89 3hz2 n GLY 55 Ca -0.06 -1.19 -0.32 0.00 0.00 0.00 0.00 46.02 44.44 3hz2 n GLY 55 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hz2 s ARG 56 N 0.00 2.46 0.10 1.61 0.52 -1.26 -4.71 118.95 117.67 3hz2 s ARG 56 Ca 0.00 1.37 -0.01 0.00 -0.52 0.00 0.00 55.73 56.56 3hz2 s ARG 56 Cb 0.00 -1.91 -0.04 0.00 0.52 0.00 0.00 34.95 33.52 3hz2 s ARG 56 CO 0.00 -1.51 0.03 1.52 0.02 0.00 0.00 175.30 175.36 3hz2 s TYR 57 N -2.50 0.68 -0.02 -0.53 -0.85 -1.26 -1.49 117.35 111.39 3hz2 s TYR 57 Ca 0.66 -1.14 0.00 0.00 -0.52 0.00 0.00 57.07 56.07 3hz2 s TYR 57 Cb -0.20 -0.42 0.02 0.00 0.38 0.00 0.00 41.96 41.74 3hz2 s TYR 57 CO 0.47 -0.46 0.01 -1.58 -1.52 0.00 0.00 175.55 172.47 3hz2 s TRP 58 N -3.99 0.09 -0.24 -3.49 0.51 -0.37 -4.96 118.94 106.50 3hz2 s TRP 58 Ca 0.16 0.06 -0.09 0.00 -2.12 0.00 0.00 56.10 54.12 3hz2 s TRP 58 Cb 0.08 -0.21 -0.04 0.00 -0.81 0.00 0.00 33.47 32.49 3hz2 s TRP 58 CO -0.04 -0.07 0.11 -0.51 -0.51 0.00 0.00 176.95 175.93 3hz2 s ASP 59 N 0.71 5.61 -0.12 2.95 1.01 -1.26 -0.72 116.67 124.85 3hz2 s ASP 59 Ca -0.06 -0.04 0.02 0.00 0.71 0.00 0.00 52.55 53.18 3hz2 s ASP 59 Cb -0.09 -2.00 -0.00 0.00 1.01 0.00 0.00 42.92 41.83 3hz2 s ASP 59 CO -0.02 0.04 -0.20 -0.76 0.21 0.00 0.00 175.17 174.44 3hz2 s LEU 60 N 1.21 2.31 0.00 1.23 1.43 0.35 -4.97 118.68 120.25 3hz2 s LEU 60 Ca 0.06 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 52.68 3hz2 s LEU 60 Cb -0.14 -1.49 0.14 0.00 0.03 0.00 0.00 46.19 44.73 3hz2 s LEU 60 CO 0.05 0.14 0.97 0.61 0.23 0.00 0.00 176.35 178.35 3hz2 n GLY 61 N 3.67 0.85 3.58 -3.19 0.00 -1.26 -1.26 105.19 107.59 3hz2 n GLY 61 Ca -0.19 -2.06 -0.50 0.00 0.00 0.00 0.00 46.02 43.26 3hz2 n GLY 61 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hz2 n PRO 62 N -2.76 1.13 0.00 1.61 -0.02 -1.24 -4.72 135.00 129.01 3hz2 n PRO 62 Ca 0.17 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 62.05 3hz2 n PRO 62 Cb 0.59 -1.97 0.00 0.00 -0.02 0.00 0.00 33.50 32.11 3hz2 n PRO 62 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3hz2 n GLY 63 N 2.24 0.25 3.34 -1.23 0.00 -0.74 -4.98 105.19 104.08 3hz2 n GLY 63 Ca 0.17 -1.64 -0.31 0.00 0.00 0.00 0.00 46.02 44.24 3hz2 n GLY 63 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3hz2 s GLU 64 N -1.51 2.00 -0.40 1.61 2.02 -1.26 -0.90 118.70 120.25 3hz2 s GLU 64 Ca 0.00 -1.00 0.02 0.00 0.02 0.00 0.00 54.97 54.01 3hz2 s GLU 64 Cb 0.00 -2.04 0.12 0.00 0.10 0.00 0.00 34.13 32.31 3hz2 s GLU 64 CO 0.00 0.54 0.18 0.71 0.02 0.00 0.00 175.26 176.71 3hz2 s TYR 65 N -0.72 2.21 0.66 1.61 1.51 0.31 -4.97 117.35 117.97 3hz2 s TYR 65 Ca 0.11 -2.38 0.40 0.00 -1.01 0.00 0.00 57.07 54.19 3hz2 s TYR 65 Cb -0.10 -2.04 2.19 0.00 -0.11 0.00 0.00 41.96 41.90 3hz2 s TYR 65 CO 0.01 -0.82 2.25 0.66 -1.11 0.00 0.00 175.55 176.54 3hz2 h SER 66 N 7.16 0.00 -3.22 2.29 4.64 -1.90 -1.59 113.55 120.93 3hz2 h SER 66 Ca -0.05 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 61.00 3hz2 h SER 66 Cb 0.96 0.00 -0.34 0.00 -0.31 0.00 0.00 62.40 62.71 3hz2 h SER 66 CO 0.50 0.00 -0.61 -0.55 -0.87 0.00 0.00 176.83 175.30 3hz2 s SER 67 N -5.07 0.34 0.53 4.97 0.15 -1.25 -0.58 113.70 112.79 3hz2 s SER 67 Ca -0.05 0.34 0.21 0.00 0.70 0.00 0.00 55.95 57.16 3hz2 s SER 67 Cb 0.12 0.27 1.38 0.00 -1.71 0.00 0.00 66.02 66.08 3hz2 s SER 67 CO 0.39 -0.20 2.10 -0.37 1.20 0.00 0.00 173.24 176.36 3hz2 h VAL 68 N 6.22 0.83 0.00 4.45 -1.51 -1.06 -0.25 116.25 124.94 3hz2 h VAL 68 Ca -0.27 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.20 3hz2 h VAL 68 Cb 1.13 0.89 -0.00 0.00 -2.13 0.00 0.00 31.29 31.18 3hz2 h VAL 68 CO 0.27 0.00 -0.03 -0.33 -1.23 0.00 0.00 177.57 176.25 3hz2 h GLU 69 N 0.00 0.00 0.00 5.19 5.08 -1.79 0.36 114.58 123.42 3hz2 h GLU 69 Ca 0.10 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 3hz2 h GLU 69 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 3hz2 h GLU 69 CO -0.00 0.03 0.00 0.66 -1.00 0.00 0.00 179.01 178.70 3hz2 h SER 70 N 0.00 0.00 -0.69 1.42 4.64 -1.33 -0.81 113.55 116.77 3hz2 h SER 70 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3hz2 h SER 70 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 3hz2 h SER 70 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 3hz2 n ALA 71 N -2.04 2.57 -1.00 5.18 0.00 0.12 -4.92 120.51 120.43 3hz2 n ALA 71 Ca 0.01 -1.32 0.00 0.00 0.00 0.00 0.00 53.44 52.13 3hz2 n ALA 71 Cb 0.32 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.81 3hz2 n ALA 71 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hz2 n GLY 72 N 1.50 0.41 3.74 0.00 0.00 -0.31 -4.97 105.19 105.57 3hz2 n GLY 72 Ca 0.24 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.90 3hz2 n GLY 72 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hz2 s ILE 73 N -1.86 5.31 0.45 -0.61 1.01 -0.83 -4.96 121.20 119.72 3hz2 s ILE 73 Ca 0.00 0.51 -0.25 0.00 0.00 0.00 0.00 60.65 60.91 3hz2 s ILE 73 Cb 0.00 -3.61 -0.08 0.00 0.01 0.00 0.00 42.46 38.79 3hz2 s ILE 73 CO 0.00 0.42 1.30 -2.16 0.00 0.00 0.00 174.94 174.50 3hz2 s PRO 74 N 0.29 3.75 0.47 2.79 0.04 -1.26 -2.69 135.00 138.39 3hz2 s PRO 74 Ca 0.16 2.13 -0.23 0.00 0.04 0.00 0.00 61.00 63.10 3hz2 s PRO 74 Cb -0.13 -2.59 -0.07 0.00 0.04 0.00 0.00 34.50 31.75 3hz2 s PRO 74 CO 0.04 -0.67 1.23 0.34 0.04 0.00 0.00 177.00 177.98 3hz2 s ASP 75 N -0.87 5.96 -1.52 6.66 2.15 -1.26 -3.40 116.67 124.40 3hz2 s ASP 75 Ca 0.61 2.46 -0.13 0.00 0.43 0.00 0.00 52.55 55.91 3hz2 s ASP 75 Cb -0.37 -2.61 0.08 0.00 -0.30 0.00 0.00 42.92 39.71 3hz2 s ASP 75 CO 0.47 -1.07 0.99 0.59 -0.17 0.00 0.00 175.17 175.98 3hz2 n ASN 76 N -0.55 -4.98 0.00 -0.34 3.02 -1.16 -4.87 115.26 106.38 3hz2 n ASN 76 Ca 0.08 -0.75 0.00 0.00 -0.03 0.00 0.00 54.58 53.88 3hz2 n ASN 76 Cb 0.47 -3.97 0.00 0.00 -0.61 0.00 0.00 39.78 35.67 3hz2 n ASN 76 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3hz2 n SER 77 N -2.83 1.71 -4.74 6.41 3.41 -1.22 -4.26 113.62 112.10 3hz2 n SER 77 Ca 0.04 -0.18 -0.41 0.00 -0.26 0.00 0.00 58.87 58.06 3hz2 n SER 77 Cb 0.53 0.70 -0.03 0.00 -0.26 0.00 0.00 64.21 65.15 3hz2 n SER 77 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 3hz2 s ILE 78 N -1.04 2.77 0.00 -1.33 1.01 -1.26 -4.50 121.20 116.85 3hz2 s ILE 78 Ca 0.00 0.63 0.00 0.00 0.00 0.00 0.00 60.65 61.28 3hz2 s ILE 78 Cb 0.00 -3.40 0.00 0.00 0.01 0.00 0.00 42.46 39.07 3hz2 s ILE 78 CO 0.00 0.09 0.11 -1.20 0.00 0.00 0.00 174.94 173.94 3hz2 n SER 79 N 2.64 0.22 -3.57 3.58 7.64 -0.25 -1.22 113.62 122.67 3hz2 n SER 79 Ca 0.08 -0.56 -0.08 0.00 1.01 0.00 0.00 58.87 59.32 3hz2 n SER 79 Cb 0.40 0.46 -0.03 0.00 -1.01 0.00 0.00 64.21 64.03 3hz2 n SER 79 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 3hz2 s SER 80 N -0.46 -0.28 -0.05 6.43 1.04 -1.19 -2.54 113.70 116.65 3hz2 s SER 80 Ca 0.00 0.17 -0.30 0.00 0.48 0.00 0.00 55.95 56.30 3hz2 s SER 80 Cb 0.00 0.26 0.07 0.00 0.10 0.00 0.00 66.02 66.45 3hz2 s SER 80 CO 0.00 -0.36 0.66 0.72 0.98 0.00 0.00 173.24 175.24 3hz2 s PHE 81 N -1.94 -0.64 0.16 5.02 -0.12 0.04 -0.41 117.98 120.08 3hz2 s PHE 81 Ca 0.04 1.09 -0.12 0.00 -0.05 0.00 0.00 56.93 57.88 3hz2 s PHE 81 Cb -0.01 0.39 0.01 0.00 -0.63 0.00 0.00 43.02 42.78 3hz2 s PHE 81 CO -0.04 -0.60 0.35 -0.98 -0.05 0.00 0.00 175.22 173.91 3hz2 s ARG 82 N -1.18 1.16 0.40 1.99 1.70 -0.59 -0.21 118.95 122.22 3hz2 s ARG 82 Ca -0.11 -0.99 -0.24 0.00 -0.47 0.00 0.00 55.73 53.92 3hz2 s ARG 82 Cb -0.00 0.43 -0.09 0.00 -0.57 0.00 0.00 34.95 34.71 3hz2 s ARG 82 CO 0.10 -0.44 1.02 -1.14 -1.08 0.00 0.00 175.30 173.76 3hz2 s GLN 83 N -3.90 4.20 0.00 3.89 0.74 -1.26 -0.68 119.66 122.65 3hz2 s GLN 83 Ca 0.11 1.44 0.00 0.00 0.05 0.00 0.00 55.36 56.96 3hz2 s GLN 83 Cb 0.02 -2.50 0.00 0.00 1.10 0.00 0.00 33.01 31.63 3hz2 s GLN 83 CO -0.04 -0.10 0.02 0.44 -0.55 0.00 0.00 175.29 175.06