#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wap s PHE 9 N 0.00 0.79 0.02 -0.67 -0.12 -1.26 -0.94 117.98 115.80 1wap s PHE 9 Ca 0.00 -1.19 0.05 0.00 -0.05 0.00 0.00 56.93 55.74 1wap s PHE 9 Cb 0.00 -0.45 -0.02 0.00 -0.63 0.00 0.00 43.02 41.92 1wap s PHE 9 CO 0.00 -0.51 -0.16 0.14 -0.05 0.00 0.00 175.22 174.64 1wap s VAL 10 N -4.03 1.26 -0.15 -2.49 -7.23 -0.02 -4.66 120.40 103.08 1wap s VAL 10 Ca 0.21 -0.89 -0.05 0.00 -1.81 0.00 0.00 61.98 59.45 1wap s VAL 10 Cb 0.07 -1.09 -0.03 0.00 0.56 0.00 0.00 36.38 35.89 1wap s VAL 10 CO 0.00 0.19 0.01 -0.69 -0.31 0.00 0.00 175.10 174.30 1wap s VAL 11 N -0.63 4.33 -0.07 1.32 1.01 -0.29 -1.14 120.40 124.93 1wap s VAL 11 Ca 0.05 -0.21 0.01 0.00 0.00 0.00 0.00 61.98 61.83 1wap s VAL 11 Cb -0.07 -2.90 0.02 0.00 0.00 0.00 0.00 36.38 33.42 1wap s VAL 11 CO 0.01 0.51 -0.09 -0.63 0.00 0.00 0.00 175.10 174.89 1wap s ILE 12 N 0.10 0.97 -0.15 2.22 1.01 0.36 -1.10 121.20 124.60 1wap s ILE 12 Ca 0.02 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.32 1wap s ILE 12 Cb -0.13 -0.92 -0.00 0.00 0.01 0.00 0.00 42.46 41.42 1wap s ILE 12 CO 0.02 0.33 -0.16 -0.75 0.00 0.00 0.00 174.94 174.38 1wap s LYS 13 N 0.92 3.20 0.03 2.79 2.20 -0.04 -0.71 119.74 128.12 1wap s LYS 13 Ca -0.10 -0.76 -0.30 0.00 -0.36 0.00 0.00 55.97 54.45 1wap s LYS 13 Cb -0.15 -2.61 -0.05 0.00 -1.51 0.00 0.00 37.83 33.52 1wap s LYS 13 CO 0.01 0.01 1.15 0.00 -0.36 0.00 0.00 175.35 176.16 1wap s ALA 14 N 0.81 3.36 -0.21 3.13 0.00 -0.31 -1.17 121.76 127.37 1wap s ALA 14 Ca -0.05 0.74 0.22 0.00 0.00 0.00 0.00 51.96 52.86 1wap s ALA 14 Cb -0.15 -3.43 -0.24 0.00 0.00 0.00 0.00 23.12 19.29 1wap s ALA 14 CO -0.00 -0.44 0.66 0.28 0.00 0.00 0.00 175.76 176.25 1wap n VAL 15 N 4.04 0.11 -4.20 0.00 0.31 0.18 -0.34 118.33 118.44 1wap n VAL 15 Ca 0.09 -0.44 -0.12 0.00 -0.01 0.00 0.00 64.34 63.86 1wap n VAL 15 Cb 0.47 0.06 -0.10 0.00 -0.91 0.00 0.00 33.84 33.36 1wap n VAL 15 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1wap s GLU 16 N -3.42 1.13 0.70 5.55 0.41 -1.17 -4.73 118.70 117.18 1wap s GLU 16 Ca -0.04 -1.58 -0.14 0.00 -0.41 0.00 0.00 54.97 52.80 1wap s GLU 16 Cb 0.14 0.18 0.02 0.00 -1.78 0.00 0.00 34.13 32.69 1wap s GLU 16 CO 0.88 -0.33 1.11 -0.51 -0.49 0.00 0.00 175.26 175.92 1wap s ASP 17 N -3.14 4.85 0.00 -0.19 1.01 -1.26 -3.46 116.67 114.47 1wap s ASP 17 Ca 0.34 1.99 0.00 0.00 0.71 0.00 0.00 52.55 55.58 1wap s ASP 17 Cb 0.07 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.45 1wap s ASP 17 CO 0.09 -1.81 0.00 0.61 0.21 0.00 0.00 175.17 174.27 1wap n GLY 18 N -0.60 0.57 3.76 0.21 0.00 -1.24 -4.85 105.19 103.05 1wap n GLY 18 Ca 0.10 -0.65 -0.40 0.00 0.00 0.00 0.00 46.02 45.08 1wap n GLY 18 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1wap s VAL 19 N -2.00 3.31 -0.05 1.61 1.01 -1.13 -4.71 120.40 118.44 1wap s VAL 19 Ca 0.00 1.28 0.06 0.00 0.00 0.00 0.00 61.98 63.31 1wap s VAL 19 Cb 0.00 -3.79 -0.01 0.00 0.00 0.00 0.00 36.38 32.58 1wap s VAL 19 CO 0.00 0.27 -0.23 0.20 0.00 0.00 0.00 175.10 175.34 1wap s ASN 20 N -0.88 2.85 -0.29 3.32 -0.87 -0.31 -0.82 114.94 117.94 1wap s ASN 20 Ca 0.48 -0.47 -0.05 0.00 -1.57 0.00 0.00 52.86 51.25 1wap s ASN 20 Cb -0.33 -0.79 0.02 0.00 -0.02 0.00 0.00 41.25 40.13 1wap s ASN 20 CO 0.42 0.22 0.03 -0.69 -2.57 0.00 0.00 177.10 174.51 1wap s VAL 21 N -0.10 3.48 -0.14 1.60 1.01 0.14 -1.81 120.40 124.57 1wap s VAL 21 Ca -0.04 -0.96 -0.02 0.00 0.00 0.00 0.00 61.98 60.96 1wap s VAL 21 Cb -0.13 -2.84 -0.02 0.00 0.00 0.00 0.00 36.38 33.38 1wap s VAL 21 CO 0.03 0.04 -0.07 -0.63 0.00 0.00 0.00 175.10 174.48 1wap s ILE 22 N 1.40 3.59 -0.21 2.22 1.01 0.81 -0.47 121.20 129.56 1wap s ILE 22 Ca 0.00 -0.47 -0.13 0.00 0.00 0.00 0.00 60.65 60.05 1wap s ILE 22 Cb -0.18 -2.55 -0.05 0.00 0.01 0.00 0.00 42.46 39.70 1wap s ILE 22 CO -0.00 0.51 0.26 -0.83 0.00 0.00 0.00 174.94 174.88 1wap s GLY 23 N 0.30 2.06 -0.07 6.18 0.00 0.02 -0.85 107.32 114.96 1wap s GLY 23 Ca -0.06 -0.67 -0.13 0.00 0.00 0.00 0.00 44.72 43.86 1wap s GLY 23 CO 0.04 0.51 0.31 1.08 0.00 0.00 0.00 173.10 175.04 1wap s LEU 24 N 0.95 4.39 0.28 0.66 1.02 -0.06 -0.80 118.68 125.12 1wap s LEU 24 Ca 0.13 0.72 -0.30 0.00 0.02 0.00 0.00 54.13 54.71 1wap s LEU 24 Cb -0.13 -2.41 -0.10 0.00 0.02 0.00 0.00 46.19 43.57 1wap s LEU 24 CO 0.05 0.28 1.41 0.42 0.02 0.00 0.00 176.35 178.53 1wap s THR 25 N -0.64 2.62 0.25 5.49 -4.23 -0.14 -2.11 115.64 116.88 1wap s THR 25 Ca 0.20 0.55 -0.30 0.00 -1.18 0.00 0.00 61.69 60.96 1wap s THR 25 Cb -0.15 -3.35 -0.09 0.00 1.34 0.00 0.00 72.50 70.25 1wap s THR 25 CO 0.09 0.10 1.00 -0.60 -0.54 0.00 0.00 174.62 174.67 1wap s ARG 26 N -0.85 4.77 0.00 3.99 3.52 -0.79 -4.58 118.95 125.02 1wap s ARG 26 Ca 0.56 1.61 0.00 0.00 -0.13 0.00 0.00 55.73 57.77 1wap s ARG 26 Cb -0.42 -3.25 0.00 0.00 -1.56 0.00 0.00 34.95 29.72 1wap s ARG 26 CO 0.47 0.39 0.00 0.41 -0.81 0.00 0.00 175.30 175.76 1wap n GLY 27 N 1.41 0.65 0.20 8.12 0.00 -1.26 -4.82 105.19 109.49 1wap n GLY 27 Ca -0.01 -2.14 0.04 0.00 0.00 0.00 0.00 46.02 43.90 1wap n GLY 27 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1wap h THR 28 N 0.00 1.17 -2.64 2.61 1.35 -2.05 -3.43 112.91 109.92 1wap h THR 28 Ca 0.00 -1.06 -0.56 0.00 -0.55 0.00 0.00 66.41 64.24 1wap h THR 28 Cb 0.00 1.58 -0.06 0.00 -1.73 0.00 0.00 68.15 67.93 1wap h THR 28 CO 0.00 0.30 -0.55 -1.81 -0.25 0.00 0.00 175.52 173.21 1wap s ASP 29 N -6.89 5.60 -0.33 5.36 1.01 -1.26 -5.09 116.67 115.07 1wap s ASP 29 Ca -0.03 -0.11 0.01 0.00 0.71 0.00 0.00 52.55 53.13 1wap s ASP 29 Cb 0.15 -1.48 0.10 0.00 1.01 0.00 0.00 42.92 42.69 1wap s ASP 29 CO 0.71 0.06 0.09 -0.89 0.21 0.00 0.00 175.17 175.35 1wap s THR 30 N -1.79 1.35 0.17 -1.27 2.01 -1.26 -4.61 115.64 110.24 1wap s THR 30 Ca 0.31 -1.78 0.02 0.00 0.31 0.00 0.00 61.69 60.56 1wap s THR 30 Cb -0.10 -2.01 -0.05 0.00 0.01 0.00 0.00 72.50 70.36 1wap s THR 30 CO 0.24 -0.67 -0.02 -1.59 -0.69 0.00 0.00 174.62 171.90 1wap s LYS 31 N 1.30 1.11 -0.12 4.92 -2.85 -1.26 -4.92 119.74 117.93 1wap s LYS 31 Ca 0.11 -1.53 -0.30 0.00 -1.00 0.00 0.00 55.97 53.25 1wap s LYS 31 Cb -0.18 -0.35 -0.02 0.00 -2.06 0.00 0.00 37.83 35.21 1wap s LYS 31 CO -0.18 -0.09 1.19 -0.06 0.10 0.00 0.00 175.35 176.30 1wap s PHE 32 N -3.58 3.12 -0.60 1.78 0.40 -1.26 -0.96 117.98 116.87 1wap s PHE 32 Ca 0.23 1.20 0.21 0.00 -0.60 0.00 0.00 56.93 57.98 1wap s PHE 32 Cb 0.06 -3.41 -0.27 0.00 0.51 0.00 0.00 43.02 39.91 1wap s PHE 32 CO 0.04 -1.26 0.73 -2.39 0.70 0.00 0.00 175.22 173.04 1wap n HIS 33 N 5.79 0.01 -3.64 0.36 1.44 0.02 -4.95 115.22 114.26 1wap n HIS 33 Ca 0.12 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.74 1wap n HIS 33 Cb 0.46 -0.22 -0.07 0.00 0.12 0.00 0.00 29.99 30.28 1wap n HIS 33 CO 0.00 0.00 0.00 -1.58 -2.81 0.00 0.00 176.34 171.95 1wap s HIS 34 N -3.22 -0.78 -0.27 -1.40 5.65 -1.23 -5.01 115.29 109.04 1wap s HIS 34 Ca 0.01 1.71 0.03 0.00 0.25 0.00 0.00 55.06 57.06 1wap s HIS 34 Cb 0.15 0.41 0.06 0.00 -1.18 0.00 0.00 32.58 32.03 1wap s HIS 34 CO 0.88 -0.38 -0.08 0.45 -0.65 0.00 0.00 174.74 174.96 1wap s SER 35 N 0.88 4.40 -0.22 9.88 0.15 -1.26 -0.80 113.70 126.72 1wap s SER 35 Ca -0.04 -1.45 -0.22 0.00 0.70 0.00 0.00 55.95 54.94 1wap s SER 35 Cb -0.05 -1.50 -0.02 0.00 -1.71 0.00 0.00 66.02 62.74 1wap s SER 35 CO -0.09 -0.22 0.69 -0.70 1.20 0.00 0.00 173.24 174.11 1wap s GLU 36 N 1.12 4.18 -0.09 5.44 2.56 0.38 -4.88 118.70 127.42 1wap s GLU 36 Ca -0.06 0.69 -0.29 0.00 0.00 0.00 0.00 54.97 55.31 1wap s GLU 36 Cb -0.20 -3.62 -0.02 0.00 2.00 0.00 0.00 34.13 32.30 1wap s GLU 36 CO -0.06 -0.36 0.97 0.21 -0.56 0.00 0.00 175.26 175.46 1wap s LYS 37 N 2.32 4.44 -0.21 4.30 2.47 -1.26 -0.68 119.74 131.11 1wap s LYS 37 Ca 0.30 1.33 0.00 0.00 -1.56 0.00 0.00 55.97 56.04 1wap s LYS 37 Cb -0.16 -3.53 0.02 0.00 -1.46 0.00 0.00 37.83 32.71 1wap s LYS 37 CO 0.09 -0.25 -0.14 -0.51 0.16 0.00 0.00 175.35 174.70 1wap s LEU 38 N 1.77 2.63 0.55 5.43 1.43 0.00 -4.99 118.68 125.51 1wap s LEU 38 Ca 0.47 -0.79 -0.09 0.00 -1.03 0.00 0.00 54.13 52.70 1wap s LEU 38 Cb -0.19 -1.55 -0.04 0.00 0.03 0.00 0.00 46.19 44.44 1wap s LEU 38 CO 0.19 -0.06 0.92 -1.81 0.23 0.00 0.00 176.35 175.82 1wap s ASP 39 N 1.28 6.26 -0.04 2.29 1.01 -1.26 -2.86 116.67 123.35 1wap s ASP 39 Ca 0.02 1.20 -0.39 0.00 0.71 0.00 0.00 52.55 54.09 1wap s ASP 39 Cb -0.15 -2.37 -0.18 0.00 1.01 0.00 0.00 42.92 41.23 1wap s ASP 39 CO -0.09 -0.73 1.31 1.17 0.21 0.00 0.00 175.17 177.04 1wap n LYS 40 N -2.48 0.61 0.00 8.23 4.81 -1.22 -1.22 118.16 126.88 1wap n LYS 40 Ca 0.04 0.22 0.00 0.00 -0.87 0.00 0.00 58.31 57.70 1wap n LYS 40 Cb 0.54 -1.80 0.00 0.00 0.02 0.00 0.00 35.03 33.79 1wap n LYS 40 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1wap n GLY 41 N 2.45 2.83 3.81 3.14 0.00 0.54 -4.93 105.19 113.03 1wap n GLY 41 Ca 0.21 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.90 1wap n GLY 41 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wap s GLU 42 N -0.55 3.59 -0.02 1.61 2.02 -0.36 -4.77 118.70 120.22 1wap s GLU 42 Ca 0.00 1.17 0.06 0.00 0.02 0.00 0.00 54.97 56.22 1wap s GLU 42 Cb 0.00 -2.07 -0.01 0.00 0.10 0.00 0.00 34.13 32.14 1wap s GLU 42 CO 0.00 -0.58 -0.19 0.08 0.02 0.00 0.00 175.26 174.58 1wap s VAL 43 N -2.41 1.53 -0.03 2.63 1.01 -1.26 -1.16 120.40 120.70 1wap s VAL 43 Ca 0.63 -0.83 0.04 0.00 0.00 0.00 0.00 61.98 61.83 1wap s VAL 43 Cb -0.14 -1.27 -0.01 0.00 0.00 0.00 0.00 36.38 34.96 1wap s VAL 43 CO 0.32 0.43 -0.16 -0.51 0.00 0.00 0.00 175.10 175.18 1wap s ILE 44 N -0.45 1.31 -0.25 2.22 2.07 0.11 -5.00 121.20 121.22 1wap s ILE 44 Ca 0.07 -0.67 -0.01 0.00 -1.41 0.00 0.00 60.65 58.63 1wap s ILE 44 Cb -0.08 -1.12 0.03 0.00 0.13 0.00 0.00 42.46 41.42 1wap s ILE 44 CO -0.01 0.38 -0.06 -0.63 -1.91 0.00 0.00 174.94 172.71 1wap s ILE 45 N -0.07 2.84 -0.05 2.00 1.09 -1.26 -0.49 121.20 125.26 1wap s ILE 45 Ca -0.01 -1.09 0.04 0.00 -1.10 0.00 0.00 60.65 58.50 1wap s ILE 45 Cb -0.10 -2.47 -0.00 0.00 -1.06 0.00 0.00 42.46 38.83 1wap s ILE 45 CO 0.01 0.16 -0.18 0.00 -0.10 0.00 0.00 174.94 174.83 1wap s ALA 46 N 1.31 1.66 0.49 9.38 0.00 -0.29 -4.95 121.76 129.36 1wap s ALA 46 Ca -0.01 -0.74 -0.02 0.00 0.00 0.00 0.00 51.96 51.20 1wap s ALA 46 Cb -0.17 -0.57 -0.00 0.00 0.00 0.00 0.00 23.12 22.38 1wap s ALA 46 CO -0.04 0.28 0.74 -0.65 0.00 0.00 0.00 175.76 176.09 1wap s GLN 47 N 0.12 3.06 0.26 0.00 -0.21 -1.26 -0.84 119.66 120.79 1wap s GLN 47 Ca -0.07 -0.31 -0.20 0.00 0.02 0.00 0.00 55.36 54.80 1wap s GLN 47 Cb -0.13 -2.47 -0.09 0.00 1.00 0.00 0.00 33.01 31.32 1wap s GLN 47 CO 0.03 -0.38 0.76 -0.06 -2.12 0.00 0.00 175.29 173.53 1wap s PHE 48 N -2.68 3.59 0.25 0.91 0.08 -0.12 -4.93 117.98 115.08 1wap s PHE 48 Ca 0.50 1.41 0.01 0.00 0.12 0.00 0.00 56.93 58.97 1wap s PHE 48 Cb -0.10 -2.65 -0.00 0.00 -0.57 0.00 0.00 43.02 39.69 1wap s PHE 48 CO 0.40 0.25 0.30 0.25 -0.10 0.00 0.00 175.22 176.33 1wap n THR 49 N 0.43 0.00 -0.19 0.64 -2.24 -0.51 -4.53 114.28 107.87 1wap n THR 49 Ca -0.00 -1.50 0.14 0.00 -2.27 0.00 0.00 64.05 60.42 1wap n THR 49 Cb 0.51 0.84 0.47 0.00 -2.10 0.00 0.00 70.33 70.05 1wap n THR 49 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1wap h GLU 50 N 0.00 0.48 0.00 -0.78 3.07 -2.02 -3.05 114.58 112.28 1wap h GLU 50 Ca -0.19 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.64 1wap h GLU 50 Cb 0.88 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.68 1wap h GLU 50 CO 0.26 0.32 -1.79 0.72 -1.40 0.00 0.00 179.01 177.13 1wap n HIS 51 N -4.50 0.00 -4.09 4.33 8.25 -1.26 -4.63 115.22 113.32 1wap n HIS 51 Ca 0.15 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.29 1wap n HIS 51 Cb 0.50 -0.40 -0.15 0.00 1.12 0.00 0.00 29.99 31.07 1wap n HIS 51 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 1wap s THR 52 N -3.38 2.14 -0.91 1.59 2.01 -1.15 -1.88 115.64 114.06 1wap s THR 52 Ca -0.05 -1.36 0.08 0.00 0.31 0.00 0.00 61.69 60.66 1wap s THR 52 Cb 0.14 -2.12 0.09 0.00 0.01 0.00 0.00 72.50 70.62 1wap s THR 52 CO 0.88 0.19 0.83 -1.54 -0.69 0.00 0.00 174.62 174.28 1wap n SER 53 N 4.51 1.83 -3.65 3.53 3.41 -0.90 -1.43 113.62 120.93 1wap n SER 53 Ca -0.17 -1.45 -0.15 0.00 -0.26 0.00 0.00 58.87 56.84 1wap n SER 53 Cb 0.45 -0.03 -0.08 0.00 -0.26 0.00 0.00 64.21 64.30 1wap n SER 53 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1wap s ALA 54 N -0.71 -1.35 -0.09 7.33 0.00 -1.24 -5.03 121.76 120.68 1wap s ALA 54 Ca 0.10 1.11 0.02 0.00 0.00 0.00 0.00 51.96 53.19 1wap s ALA 54 Cb 0.07 -0.28 0.01 0.00 0.00 0.00 0.00 23.12 22.93 1wap s ALA 54 CO 0.10 -0.30 -0.13 0.42 0.00 0.00 0.00 175.76 175.85 1wap s ILE 55 N -0.74 1.26 -0.09 0.00 1.01 -1.26 -0.88 121.20 120.50 1wap s ILE 55 Ca -0.08 -0.52 -0.01 0.00 0.00 0.00 0.00 60.65 60.04 1wap s ILE 55 Cb -0.03 -1.16 -0.03 0.00 0.01 0.00 0.00 42.46 41.25 1wap s ILE 55 CO 0.05 0.39 -0.04 -0.75 0.00 0.00 0.00 174.94 174.59 1wap s LYS 56 N 0.89 2.99 -0.09 2.79 2.20 -0.03 -4.93 119.74 123.55 1wap s LYS 56 Ca -0.10 -0.50 0.04 0.00 -0.36 0.00 0.00 55.97 55.05 1wap s LYS 56 Cb -0.15 -2.71 -0.00 0.00 -1.51 0.00 0.00 37.83 33.45 1wap s LYS 56 CO 0.01 0.60 -0.23 0.08 -0.36 0.00 0.00 175.35 175.45 1wap s VAL 57 N -0.62 2.19 -0.04 4.02 1.01 -1.26 -0.13 120.40 125.57 1wap s VAL 57 Ca 0.10 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 61.10 1wap s VAL 57 Cb -0.12 -1.83 0.02 0.00 0.00 0.00 0.00 36.38 34.45 1wap s VAL 57 CO 0.02 0.56 -0.04 -0.60 0.00 0.00 0.00 175.10 175.04 1wap s ARG 58 N 0.20 0.68 0.00 2.72 3.52 -0.75 -4.97 118.95 120.35 1wap s ARG 58 Ca -0.14 -0.08 0.00 0.00 -0.13 0.00 0.00 55.73 55.38 1wap s ARG 58 Cb -0.17 -0.72 0.00 0.00 -1.56 0.00 0.00 34.95 32.51 1wap s ARG 58 CO 0.07 -0.07 0.00 0.41 -0.81 0.00 0.00 175.30 174.90 1wap n GLY 59 N 3.94 1.44 3.63 8.12 0.00 -1.26 -1.17 105.19 119.89 1wap n GLY 59 Ca -0.25 -2.20 -0.42 0.00 0.00 0.00 0.00 46.02 43.15 1wap n GLY 59 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1wap s GLU 60 N -1.46 4.05 0.03 1.61 2.56 -1.26 -3.33 118.70 120.91 1wap s GLU 60 Ca 0.00 0.90 -0.27 0.00 0.00 0.00 0.00 54.97 55.60 1wap s GLU 60 Cb 0.00 -3.72 0.08 0.00 2.00 0.00 0.00 34.13 32.49 1wap s GLU 60 CO 0.00 -0.77 0.72 0.00 -0.56 0.00 0.00 175.26 174.65 1wap s ALA 61 N 3.29 -1.73 -0.19 6.30 0.00 -0.88 -0.64 121.76 127.91 1wap s ALA 61 Ca 0.40 0.94 -0.07 0.00 0.00 0.00 0.00 51.96 53.23 1wap s ALA 61 Cb -0.13 0.38 -0.04 0.00 0.00 0.00 0.00 23.12 23.32 1wap s ALA 61 CO 0.13 -0.59 0.06 -1.17 0.00 0.00 0.00 175.76 174.19 1wap s LEU 62 N -2.08 3.74 -0.05 0.00 2.96 -0.32 -1.05 118.68 121.89 1wap s LEU 62 Ca -0.02 0.03 0.06 0.00 -0.22 0.00 0.00 54.13 53.98 1wap s LEU 62 Cb -0.01 -1.95 -0.02 0.00 0.50 0.00 0.00 46.19 44.72 1wap s LEU 62 CO -0.04 0.14 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.26 1wap s ILE 63 N 0.56 2.20 -0.09 6.68 1.01 0.34 -0.87 121.20 131.04 1wap s ILE 63 Ca 0.03 -1.03 0.03 0.00 0.00 0.00 0.00 60.65 59.69 1wap s ILE 63 Cb -0.13 -1.80 0.01 0.00 0.01 0.00 0.00 42.46 40.55 1wap s ILE 63 CO 0.01 0.57 -0.19 -1.10 0.00 0.00 0.00 174.94 174.24 1wap s GLN 64 N -0.33 2.47 0.39 2.79 -0.21 -0.26 -1.15 119.66 123.37 1wap s GLN 64 Ca 0.02 -0.68 0.05 0.00 0.02 0.00 0.00 55.36 54.77 1wap s GLN 64 Cb -0.12 -1.92 -0.02 0.00 1.00 0.00 0.00 33.01 31.95 1wap s GLN 64 CO 0.02 0.11 0.20 0.95 -2.12 0.00 0.00 175.29 174.45 1wap s THR 65 N 0.48 0.31 0.60 -0.19 -4.23 -0.53 -1.14 115.64 110.95 1wap s THR 65 Ca -0.17 -2.00 0.29 0.00 -1.18 0.00 0.00 61.69 58.63 1wap s THR 65 Cb -0.17 -2.36 0.36 0.00 1.34 0.00 0.00 72.50 71.67 1wap s THR 65 CO 0.07 0.00 1.93 0.00 -0.54 0.00 0.00 174.62 176.08 1wap h ALA 66 N 1.87 1.96 -0.67 3.99 0.00 -2.01 -1.57 119.26 122.83 1wap h ALA 66 Ca -0.30 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1wap h ALA 66 Cb 1.26 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.07 1wap h ALA 66 CO 0.47 -0.58 0.00 0.66 0.00 0.00 0.00 179.25 179.80 1wap n TYR 67 N -3.57 0.95 0.00 0.00 4.01 -1.26 -5.08 117.16 112.21 1wap n TYR 67 Ca 0.05 -0.51 0.00 0.00 -0.16 0.00 0.00 57.90 57.28 1wap n TYR 67 Cb 0.56 -0.03 0.00 0.00 -0.31 0.00 0.00 39.34 39.57 1wap n TYR 67 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1wap n GLY 68 N 1.43 0.09 3.91 2.72 0.00 -0.59 -5.06 105.19 107.69 1wap n GLY 68 Ca 0.23 -2.25 -0.31 0.00 0.00 0.00 0.00 46.02 43.68 1wap n GLY 68 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1wap s GLU 69 N 0.00 3.48 -0.03 1.61 2.02 -1.26 -1.45 118.70 123.07 1wap s GLU 69 Ca 0.00 -0.35 -0.07 0.00 0.02 0.00 0.00 54.97 54.58 1wap s GLU 69 Cb 0.00 -3.00 0.01 0.00 0.10 0.00 0.00 34.13 31.24 1wap s GLU 69 CO 0.00 0.58 0.16 1.41 0.02 0.00 0.00 175.26 177.43 1wap s MET 70 N -2.50 0.33 -0.15 1.61 1.75 -0.30 -5.01 119.30 115.03 1wap s MET 70 Ca 0.36 -0.05 -0.00 0.00 -1.25 0.00 0.00 55.69 54.75 1wap s MET 70 Cb -0.13 0.14 -0.01 0.00 2.84 0.00 0.00 34.83 37.68 1wap s MET 70 CO 0.27 -0.06 -0.13 0.21 -0.65 0.00 0.00 175.02 174.65 1wap s LYS 71 N -0.57 3.30 0.29 4.11 2.20 -1.26 -0.50 119.74 127.30 1wap s LYS 71 Ca -0.07 -0.71 -0.10 0.00 -0.36 0.00 0.00 55.97 54.73 1wap s LYS 71 Cb -0.04 -2.67 -0.07 0.00 -1.51 0.00 0.00 37.83 33.54 1wap s LYS 71 CO 0.01 0.07 0.63 -1.54 -0.36 0.00 0.00 175.35 174.16 1wap s SER 72 N 0.71 6.61 -0.02 1.43 1.04 -0.21 -4.97 113.70 118.29 1wap s SER 72 Ca -0.06 1.00 0.06 0.00 0.48 0.00 0.00 55.95 57.43 1wap s SER 72 Cb -0.15 -2.26 -0.01 0.00 0.10 0.00 0.00 66.02 63.69 1wap s SER 72 CO 0.02 -0.18 -0.22 -1.61 0.98 0.00 0.00 173.24 172.23 1wap s GLU 73 N -3.14 1.88 0.26 4.02 2.02 -1.21 -2.06 118.70 120.46 1wap s GLU 73 Ca 0.49 -0.78 -0.29 0.00 0.02 0.00 0.00 54.97 54.41 1wap s GLU 73 Cb -0.11 -1.76 -0.15 0.00 0.10 0.00 0.00 34.13 32.22 1wap s GLU 73 CO 0.23 0.43 1.03 1.17 0.02 0.00 0.00 175.26 178.15 1wap n LYS 74 N 2.66 1.26 0.00 1.61 4.81 -1.26 -4.37 118.16 122.87 1wap n LYS 74 Ca -0.16 0.44 0.13 0.00 -0.87 0.00 0.00 58.31 57.85 1wap n LYS 74 Cb 0.52 -1.83 0.24 0.00 0.02 0.00 0.00 35.03 33.98 1wap n LYS 74 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74