#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 0.78 0.08 -0.67 -0.12 -1.26 -0.66 117.98 116.13 1wap s PHE 9 Ca 0.00 -1.07 0.07 0.00 -0.05 0.00 0.00 56.93 55.88 1wap s PHE 9 Cb 0.00 -0.17 -0.03 0.00 -0.63 0.00 0.00 43.02 42.19 1wap s PHE 9 CO 0.00 -0.85 -0.18 0.14 -0.05 0.00 0.00 175.22 174.28 1wap s VAL 10 N -4.00 1.45 -0.22 -2.49 -7.23 0.09 -4.76 120.40 103.24 1wap s VAL 10 Ca 0.31 -1.38 -0.05 0.00 -1.81 0.00 0.00 61.98 59.04 1wap s VAL 10 Cb 0.03 -1.33 -0.02 0.00 0.56 0.00 0.00 36.38 35.62 1wap s VAL 10 CO 0.12 -0.09 0.00 -0.69 -0.31 0.00 0.00 175.10 174.13 1wap s VAL 11 N -1.14 3.82 -0.10 1.32 1.01 -0.33 -1.10 120.40 123.89 1wap s VAL 11 Ca 0.03 -0.34 0.02 0.00 0.00 0.00 0.00 61.98 61.69 1wap s VAL 11 Cb -0.10 -2.75 0.01 0.00 0.00 0.00 0.00 36.38 33.54 1wap s VAL 11 CO 0.03 0.40 -0.17 -0.63 0.00 0.00 0.00 175.10 174.73 1wap s ILE 12 N 1.39 1.57 -0.17 2.22 1.01 0.57 -0.51 121.20 127.28 1wap s ILE 12 Ca 0.05 -0.70 -0.02 0.00 0.00 0.00 0.00 60.65 59.98 1wap s ILE 12 Cb -0.15 -1.42 -0.01 0.00 0.01 0.00 0.00 42.46 40.89 1wap s ILE 12 CO 0.00 0.45 -0.09 -0.75 0.00 0.00 0.00 174.94 174.56 1wap s LYS 13 N 0.84 3.42 -0.06 2.79 2.20 0.12 -0.51 119.74 128.53 1wap s LYS 13 Ca -0.09 -0.64 -0.30 0.00 -0.36 0.00 0.00 55.97 54.58 1wap s LYS 13 Cb -0.15 -2.81 -0.02 0.00 -1.51 0.00 0.00 37.83 33.33 1wap s LYS 13 CO 0.01 0.06 1.00 0.00 -0.36 0.00 0.00 175.35 176.05 1wap s ALA 14 N 0.79 3.30 -0.11 3.13 0.00 -0.71 -0.22 121.76 127.94 1wap s ALA 14 Ca -0.03 0.45 0.20 0.00 0.00 0.00 0.00 51.96 52.58 1wap s ALA 14 Cb -0.15 -3.40 -0.27 0.00 0.00 0.00 0.00 23.12 19.30 1wap s ALA 14 CO 0.01 -0.45 0.36 0.28 0.00 0.00 0.00 175.76 175.96 1wap n VAL 15 N 4.28 0.71 -4.45 0.00 0.31 0.22 -0.14 118.33 119.25 1wap n VAL 15 Ca 0.08 -0.67 -0.22 0.00 -0.01 0.00 0.00 64.34 63.52 1wap n VAL 15 Cb 0.50 -0.27 -0.11 0.00 -0.91 0.00 0.00 33.84 33.05 1wap n VAL 15 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 1wap s GLU 16 N -3.03 1.65 0.59 5.55 -1.05 -1.10 -4.64 118.70 116.67 1wap s GLU 16 Ca -0.08 -1.91 -0.14 0.00 -0.15 0.00 0.00 54.97 52.69 1wap s GLU 16 Cb 0.10 -0.92 -0.04 0.00 -0.44 0.00 0.00 34.13 32.83 1wap s GLU 16 CO 0.86 -0.16 1.03 -0.51 0.95 0.00 0.00 175.26 177.43 1wap s ASP 17 N -3.49 6.11 0.00 0.83 1.01 -1.26 -3.47 116.67 116.40 1wap s ASP 17 Ca 0.36 1.61 0.00 0.00 0.71 0.00 0.00 52.55 55.23 1wap s ASP 17 Cb 0.08 -2.50 0.00 0.00 1.01 0.00 0.00 42.92 41.51 1wap s ASP 17 CO 0.15 -0.94 0.00 0.61 0.21 0.00 0.00 175.17 175.20 1wap n GLY 18 N -1.74 0.44 3.76 0.21 0.00 -1.21 -4.89 105.19 101.77 1wap n GLY 18 Ca 0.07 -0.97 -0.39 0.00 0.00 0.00 0.00 46.02 44.72 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 3.67 -0.10 1.61 1.01 -1.05 -4.77 120.40 118.77 1wap s VAL 19 Ca 0.00 1.60 0.04 0.00 0.00 0.00 0.00 61.98 63.62 1wap s VAL 19 Cb 0.00 -3.98 -0.00 0.00 0.00 0.00 0.00 36.38 32.39 1wap s VAL 19 CO 0.00 0.32 -0.23 0.20 0.00 0.00 0.00 175.10 175.39 1wap s ASN 20 N -1.09 3.20 -0.29 3.32 -0.87 -0.32 0.05 114.94 118.94 1wap s ASN 20 Ca 0.46 -0.53 -0.04 0.00 -1.57 0.00 0.00 52.86 51.19 1wap s ASN 20 Cb -0.28 -1.37 0.03 0.00 -0.02 0.00 0.00 41.25 39.61 1wap s ASN 20 CO 0.36 0.17 0.02 -0.69 -2.57 0.00 0.00 177.10 174.40 1wap s VAL 21 N 0.28 3.39 -0.17 1.60 1.01 0.10 -1.80 120.40 124.81 1wap s VAL 21 Ca -0.16 -1.02 -0.03 0.00 0.00 0.00 0.00 61.98 60.77 1wap s VAL 21 Cb -0.17 -2.81 -0.02 0.00 0.00 0.00 0.00 36.38 33.37 1wap s VAL 21 CO 0.08 0.03 -0.05 -0.63 0.00 0.00 0.00 175.10 174.53 1wap s ILE 22 N 1.38 3.64 -0.09 2.22 1.01 0.02 0.83 121.20 130.21 1wap s ILE 22 Ca -0.01 -0.43 -0.13 0.00 0.00 0.00 0.00 60.65 60.08 1wap s ILE 22 Cb -0.18 -2.61 -0.05 0.00 0.01 0.00 0.00 42.46 39.64 1wap s ILE 22 CO -0.00 0.47 0.32 -0.83 0.00 0.00 0.00 174.94 174.89 1wap s GLY 23 N 0.70 2.31 -0.08 6.18 0.00 0.97 -1.12 107.32 116.28 1wap s GLY 23 Ca -0.02 -0.39 -0.02 0.00 0.00 0.00 0.00 44.72 44.29 1wap s GLY 23 CO 0.02 0.17 -0.01 1.08 0.00 0.00 0.00 173.10 174.37 1wap s LEU 24 N -0.44 3.53 0.24 0.66 1.02 -0.36 -1.28 118.68 122.05 1wap s LEU 24 Ca 0.19 0.12 -0.30 0.00 0.02 0.00 0.00 54.13 54.17 1wap s LEU 24 Cb -0.14 -1.80 -0.10 0.00 0.02 0.00 0.00 46.19 44.16 1wap s LEU 24 CO 0.08 0.37 1.44 0.42 0.02 0.00 0.00 176.35 178.68 1wap s THR 25 N -0.86 2.71 0.14 5.49 -4.23 0.18 -2.57 115.64 116.50 1wap s THR 25 Ca 0.13 0.59 -0.30 0.00 -1.18 0.00 0.00 61.69 60.93 1wap s THR 25 Cb -0.11 -3.38 -0.07 0.00 1.34 0.00 0.00 72.50 70.28 1wap s THR 25 CO 0.02 0.09 1.11 -0.60 -0.54 0.00 0.00 174.62 174.70 1wap s ARG 26 N -0.24 4.56 0.00 3.99 3.52 -0.74 -4.54 118.95 125.50 1wap s ARG 26 Ca 0.60 1.70 0.00 0.00 -0.13 0.00 0.00 55.73 57.90 1wap s ARG 26 Cb -0.41 -3.31 0.00 0.00 -1.56 0.00 0.00 34.95 29.67 1wap s ARG 26 CO 0.42 -0.00 0.00 0.41 -0.81 0.00 0.00 175.30 175.32 1wap n GLY 27 N 2.36 0.85 0.30 8.12 0.00 -1.26 -4.82 105.19 110.74 1wap n GLY 27 Ca 0.04 -2.00 -0.02 0.00 0.00 0.00 0.00 46.02 44.04 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 1.22 -2.71 2.61 1.35 -2.05 -3.42 112.91 109.91 1wap h THR 28 Ca 0.00 -0.77 -0.54 0.00 -0.55 0.00 0.00 66.41 64.55 1wap h THR 28 Cb 0.00 0.64 -0.02 0.00 -1.73 0.00 0.00 68.15 67.04 1wap h THR 28 CO 0.00 0.29 -0.40 -1.81 -0.25 0.00 0.00 175.52 173.36 1wap s ASP 29 N -6.57 6.36 -0.28 5.36 1.01 -1.26 -5.09 116.67 116.20 1wap s ASP 29 Ca -0.10 0.29 -0.01 0.00 0.71 0.00 0.00 52.55 53.44 1wap s ASP 29 Cb 0.16 -1.96 0.09 0.00 1.01 0.00 0.00 42.92 42.21 1wap s ASP 29 CO 0.80 0.00 0.07 -0.89 0.21 0.00 0.00 175.17 175.36 1wap s THR 30 N -1.81 0.88 0.07 -1.27 2.01 -1.26 -4.59 115.64 109.67 1wap s THR 30 Ca 0.37 -1.25 0.04 0.00 0.31 0.00 0.00 61.69 61.15 1wap s THR 30 Cb -0.11 -1.58 -0.03 0.00 0.01 0.00 0.00 72.50 70.79 1wap s THR 30 CO 0.29 -0.55 -0.11 -0.54 -0.69 0.00 0.00 174.62 173.03 1wap s LYS 31 N 1.63 0.71 0.10 4.92 1.02 -1.26 -4.92 119.74 121.94 1wap s LYS 31 Ca 0.07 -0.94 -0.31 0.00 0.02 0.00 0.00 55.97 54.81 1wap s LYS 31 Cb -0.17 -0.54 -0.07 0.00 -0.52 0.00 0.00 37.83 36.53 1wap s LYS 31 CO -0.20 0.10 1.37 -0.06 -0.92 0.00 0.00 175.35 175.63 1wap s PHE 32 N -1.65 3.25 -0.12 3.18 0.08 -1.26 -0.65 117.98 120.81 1wap s PHE 32 Ca -0.03 0.99 0.15 0.00 0.12 0.00 0.00 56.93 58.16 1wap s PHE 32 Cb -0.08 -3.65 -0.23 0.00 -0.57 0.00 0.00 43.02 38.50 1wap s PHE 32 CO 0.01 -2.25 0.37 -2.39 -0.10 0.00 0.00 175.22 170.86 1wap n HIS 33 N 4.02 0.00 -3.64 0.36 1.44 -0.41 -4.90 115.22 112.10 1wap n HIS 33 Ca 0.11 0.00 -0.10 0.00 -2.01 0.00 0.00 57.72 55.73 1wap n HIS 33 Cb 0.43 -0.30 -0.07 0.00 0.12 0.00 0.00 29.99 30.17 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 -2.96 -0.73 -0.28 -1.40 5.65 -1.23 -5.01 115.29 109.32 1wap s HIS 34 Ca -0.04 1.65 0.01 0.00 0.25 0.00 0.00 55.06 56.93 1wap s HIS 34 Cb 0.10 0.38 0.06 0.00 -1.18 0.00 0.00 32.58 31.94 1wap s HIS 34 CO 0.63 -0.36 -0.05 0.45 -0.65 0.00 0.00 174.74 174.77 1wap s SER 35 N 0.73 4.68 -0.17 9.88 0.15 -1.26 -0.02 113.70 127.70 1wap s SER 35 Ca -0.02 -1.38 -0.22 0.00 0.70 0.00 0.00 55.95 55.03 1wap s SER 35 Cb -0.05 -1.63 -0.03 0.00 -1.71 0.00 0.00 66.02 62.60 1wap s SER 35 CO -0.08 -0.24 0.66 -0.70 1.20 0.00 0.00 173.24 174.09 1wap s GLU 36 N 1.17 4.27 -0.18 5.44 2.56 0.24 -4.89 118.70 127.32 1wap s GLU 36 Ca -0.06 0.71 -0.19 0.00 0.00 0.00 0.00 54.97 55.43 1wap s GLU 36 Cb -0.20 -3.55 -0.03 0.00 2.00 0.00 0.00 34.13 32.35 1wap s GLU 36 CO -0.03 -0.18 0.56 0.21 -0.56 0.00 0.00 175.26 175.26 1wap s LYS 37 N 1.68 4.24 -0.15 4.30 2.20 -1.26 -0.72 119.74 130.03 1wap s LYS 37 Ca 0.31 0.51 -0.04 0.00 -0.36 0.00 0.00 55.97 56.40 1wap s LYS 37 Cb -0.16 -3.54 -0.03 0.00 -1.51 0.00 0.00 37.83 32.59 1wap s LYS 37 CO 0.12 -0.12 -0.01 -0.51 -0.36 0.00 0.00 175.35 174.47 1wap s LEU 38 N 1.52 3.43 0.57 5.43 1.43 0.11 -4.99 118.68 126.17 1wap s LEU 38 Ca 0.27 -0.04 -0.14 0.00 -1.03 0.00 0.00 54.13 53.19 1wap s LEU 38 Cb -0.16 -1.83 -0.05 0.00 0.03 0.00 0.00 46.19 44.18 1wap s LEU 38 CO 0.10 0.21 1.02 -1.81 0.23 0.00 0.00 176.35 176.09 1wap s ASP 39 N 0.16 6.28 0.10 2.29 1.01 -1.26 -2.53 116.67 122.71 1wap s ASP 39 Ca 0.00 1.57 -0.36 0.00 0.71 0.00 0.00 52.55 54.48 1wap s ASP 39 Cb -0.13 -2.50 -0.15 0.00 1.01 0.00 0.00 42.92 41.14 1wap s ASP 39 CO 0.02 -0.83 1.48 1.17 0.21 0.00 0.00 175.17 177.22 1wap n LYS 40 N -2.10 1.62 0.00 8.23 4.81 -1.23 -1.73 118.16 127.77 1wap n LYS 40 Ca 0.07 0.58 0.00 0.00 -0.87 0.00 0.00 58.31 58.09 1wap n LYS 40 Cb 0.54 -2.29 0.00 0.00 0.02 0.00 0.00 35.03 33.30 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 3.05 2.90 3.86 3.14 0.00 0.80 -4.99 105.19 113.94 1wap n GLY 41 Ca 0.18 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.89 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 -0.05 3.81 -0.04 1.61 2.02 -0.70 -4.81 118.70 120.54 1wap s GLU 42 Ca 0.00 0.80 0.04 0.00 0.02 0.00 0.00 54.97 55.83 1wap s GLU 42 Cb 0.00 -2.17 -0.00 0.00 0.10 0.00 0.00 34.13 32.06 1wap s GLU 42 CO 0.00 -0.32 -0.18 0.08 0.02 0.00 0.00 175.26 174.86 1wap s VAL 43 N -2.75 1.46 -0.03 2.63 1.01 -1.26 -1.74 120.40 119.73 1wap s VAL 43 Ca 0.56 -0.74 0.07 0.00 0.00 0.00 0.00 61.98 61.88 1wap s VAL 43 Cb -0.10 -1.25 -0.02 0.00 0.00 0.00 0.00 36.38 35.00 1wap s VAL 43 CO 0.38 0.42 -0.24 -0.51 0.00 0.00 0.00 175.10 175.15 1wap s ILE 44 N 0.00 2.20 -0.30 2.22 2.07 0.33 -4.99 121.20 122.73 1wap s ILE 44 Ca -0.03 -1.05 -0.02 0.00 -1.41 0.00 0.00 60.65 58.13 1wap s ILE 44 Cb -0.11 -1.78 0.04 0.00 0.13 0.00 0.00 42.46 40.74 1wap s ILE 44 CO 0.02 0.58 0.01 -0.63 -1.91 0.00 0.00 174.94 173.01 1wap s ILE 45 N -0.59 3.10 -0.06 2.00 1.09 -1.26 -0.32 121.20 125.16 1wap s ILE 45 Ca 0.09 -1.28 0.04 0.00 -1.10 0.00 0.00 60.65 58.40 1wap s ILE 45 Cb -0.10 -2.75 -0.00 0.00 -1.06 0.00 0.00 42.46 38.55 1wap s ILE 45 CO -0.00 -0.07 -0.20 0.00 -0.10 0.00 0.00 174.94 174.57 1wap s ALA 46 N 1.29 1.80 0.48 9.38 0.00 -0.26 -4.95 121.76 129.50 1wap s ALA 46 Ca -0.04 -0.81 -0.10 0.00 0.00 0.00 0.00 51.96 51.02 1wap s ALA 46 Cb -0.19 -0.63 -0.05 0.00 0.00 0.00 0.00 23.12 22.25 1wap s ALA 46 CO -0.01 0.29 0.84 -0.65 0.00 0.00 0.00 175.76 176.24 1wap s GLN 47 N 0.14 3.69 0.31 0.00 -0.21 -1.26 -0.74 119.66 121.59 1wap s GLN 47 Ca -0.09 0.48 -0.20 0.00 0.02 0.00 0.00 55.36 55.58 1wap s GLN 47 Cb -0.14 -2.31 -0.09 0.00 1.00 0.00 0.00 33.01 31.47 1wap s GLN 47 CO 0.04 -0.20 0.81 -0.06 -2.12 0.00 0.00 175.29 173.77 1wap s PHE 48 N -2.65 3.53 0.21 0.91 0.08 0.16 -4.94 117.98 115.28 1wap s PHE 48 Ca 0.51 1.47 0.03 0.00 0.12 0.00 0.00 56.93 59.06 1wap s PHE 48 Cb -0.10 -2.70 -0.01 0.00 -0.57 0.00 0.00 43.02 39.63 1wap s PHE 48 CO 0.39 0.17 0.22 0.25 -0.10 0.00 0.00 175.22 176.15 1wap n THR 49 N 0.17 0.00 -0.16 0.64 -2.24 -0.32 -4.59 114.28 107.79 1wap n THR 49 Ca 0.02 -1.36 0.13 0.00 -2.27 0.00 0.00 64.05 60.56 1wap n THR 49 Cb 0.52 0.73 0.47 0.00 -2.10 0.00 0.00 70.33 69.94 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 -3.09 114.58 112.24 1wap h GLU 50 Ca -0.15 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.68 1wap h GLU 50 Cb 0.74 -0.11 0.00 0.00 -0.84 0.00 0.00 28.75 28.54 1wap h GLU 50 CO 0.22 0.32 -1.53 0.72 -1.40 0.00 0.00 179.01 177.34 1wap n HIS 51 N -4.49 0.00 -4.07 4.33 8.25 -1.26 -4.65 115.22 113.33 1wap n HIS 51 Ca 0.13 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 57.27 1wap n HIS 51 Cb 0.43 -0.29 -0.16 0.00 1.12 0.00 0.00 29.99 31.10 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 -3.14 2.01 -0.03 1.59 2.01 -1.17 -1.80 115.64 115.11 1wap s THR 52 Ca -0.02 -1.24 0.00 0.00 0.31 0.00 0.00 61.69 60.74 1wap s THR 52 Cb 0.13 -2.00 0.00 0.00 0.01 0.00 0.00 72.50 70.65 1wap s THR 52 CO 0.79 0.23 0.49 -1.54 -0.69 0.00 0.00 174.62 173.90 1wap n SER 53 N 4.56 0.98 -3.76 3.53 3.41 -1.06 -1.17 113.62 120.11 1wap n SER 53 Ca -0.17 -0.99 -0.13 0.00 -0.26 0.00 0.00 58.87 57.32 1wap n SER 53 Cb 0.46 0.04 -0.10 0.00 -0.26 0.00 0.00 64.21 64.35 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 -0.06 -0.82 -0.05 7.33 0.00 -1.25 -5.04 121.76 121.88 1wap s ALA 54 Ca 0.00 0.67 0.02 0.00 0.00 0.00 0.00 51.96 52.65 1wap s ALA 54 Cb 0.00 -0.26 0.01 0.00 0.00 0.00 0.00 23.12 22.87 1wap s ALA 54 CO 0.00 -0.21 -0.11 0.42 0.00 0.00 0.00 175.76 175.87 1wap s ILE 55 N -0.52 1.00 0.01 0.00 1.01 -1.26 -1.22 121.20 120.21 1wap s ILE 55 Ca -0.06 -0.42 0.05 0.00 0.00 0.00 0.00 60.65 60.21 1wap s ILE 55 Cb -0.04 -0.91 -0.03 0.00 0.01 0.00 0.00 42.46 41.49 1wap s ILE 55 CO 0.02 0.32 -0.13 -0.75 0.00 0.00 0.00 174.94 174.39 1wap s LYS 56 N 0.53 2.33 -0.10 2.79 2.20 -0.28 -4.95 119.74 122.27 1wap s LYS 56 Ca -0.11 -0.83 0.03 0.00 -0.36 0.00 0.00 55.97 54.71 1wap s LYS 56 Cb -0.14 -2.33 0.01 0.00 -1.51 0.00 0.00 37.83 33.85 1wap s LYS 56 CO 0.02 0.58 -0.21 0.08 -0.36 0.00 0.00 175.35 175.46 1wap s VAL 57 N -0.90 1.86 -0.11 4.02 1.01 -1.26 -0.80 120.40 124.22 1wap s VAL 57 Ca 0.15 -0.89 0.01 0.00 0.00 0.00 0.00 61.98 61.25 1wap s VAL 57 Cb -0.11 -1.63 0.02 0.00 0.00 0.00 0.00 36.38 34.66 1wap s VAL 57 CO 0.05 0.51 -0.12 -0.60 0.00 0.00 0.00 175.10 174.94 1wap s ARG 58 N 0.53 1.92 0.00 2.72 3.52 -0.75 -4.99 118.95 121.90 1wap s ARG 58 Ca -0.15 -0.44 0.00 0.00 -0.13 0.00 0.00 55.73 55.01 1wap s ARG 58 Cb -0.17 -1.73 0.00 0.00 -1.56 0.00 0.00 34.95 31.49 1wap s ARG 58 CO 0.05 -0.13 0.00 0.41 -0.81 0.00 0.00 175.30 174.82 1wap n GLY 59 N 4.42 1.71 3.64 8.12 0.00 -1.26 -1.17 105.19 120.65 1wap n GLY 59 Ca -0.18 -2.12 -0.43 0.00 0.00 0.00 0.00 46.02 43.30 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 -1.78 4.02 0.07 1.61 2.12 -1.25 -4.01 118.70 119.50 1wap s GLU 60 Ca 0.00 1.39 -0.18 0.00 0.36 0.00 0.00 54.97 56.54 1wap s GLU 60 Cb 0.00 -3.84 0.04 0.00 0.26 0.00 0.00 34.13 30.59 1wap s GLU 60 CO 0.00 -0.98 0.42 0.00 -0.54 0.00 0.00 175.26 174.17 1wap s ALA 61 N 4.08 -1.03 -0.18 6.30 0.00 -0.77 -0.61 121.76 129.56 1wap s ALA 61 Ca 0.56 0.22 -0.06 0.00 0.00 0.00 0.00 51.96 52.68 1wap s ALA 61 Cb -0.18 0.48 -0.03 0.00 0.00 0.00 0.00 23.12 23.39 1wap s ALA 61 CO 0.20 -0.53 0.01 -1.17 0.00 0.00 0.00 175.76 174.27 1wap s LEU 62 N -2.30 3.47 -0.12 0.00 2.96 0.69 -1.77 118.68 121.61 1wap s LEU 62 Ca -0.02 -0.07 -0.01 0.00 -0.22 0.00 0.00 54.13 53.80 1wap s LEU 62 Cb 0.00 -1.87 -0.02 0.00 0.50 0.00 0.00 46.19 44.80 1wap s LEU 62 CO -0.06 0.14 -0.08 -0.63 -1.32 0.00 0.00 176.35 174.40 1wap s ILE 63 N 0.58 3.54 -0.08 6.68 1.01 0.23 -0.70 121.20 132.46 1wap s ILE 63 Ca 0.00 -0.50 0.04 0.00 0.00 0.00 0.00 60.65 60.20 1wap s ILE 63 Cb -0.14 -2.50 -0.00 0.00 0.01 0.00 0.00 42.46 39.83 1wap s ILE 63 CO 0.02 0.53 -0.23 -1.10 0.00 0.00 0.00 174.94 174.16 1wap s GLN 64 N 0.06 2.77 0.31 2.79 -0.21 0.34 -1.52 119.66 124.20 1wap s GLN 64 Ca -0.02 -0.84 0.05 0.00 0.02 0.00 0.00 55.36 54.57 1wap s GLN 64 Cb -0.14 -2.17 -0.02 0.00 1.00 0.00 0.00 33.01 31.68 1wap s GLN 64 CO 0.03 0.22 0.18 0.25 -2.12 0.00 0.00 175.29 173.86 1wap n THR 65 N 3.38 0.00 0.19 -0.19 -2.24 -0.18 -1.19 114.28 114.05 1wap n THR 65 Ca -0.19 -2.01 0.15 0.00 -2.27 0.00 0.00 64.05 59.74 1wap n THR 65 Cb 0.53 0.87 0.77 0.00 -2.10 0.00 0.00 70.33 70.40 1wap n THR 65 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wap h ALA 66 N 1.73 1.95 -0.39 6.98 0.00 -2.00 -2.43 119.26 125.10 1wap h ALA 66 Ca -0.23 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1wap h ALA 66 Cb 1.01 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1wap h ALA 66 CO 0.35 -0.26 0.00 0.66 0.00 0.00 0.00 179.25 180.00 1wap n TYR 67 N -4.08 0.52 0.00 0.00 4.01 -1.26 -5.06 117.16 111.29 1wap n TYR 67 Ca 0.02 -0.26 0.00 0.00 -0.16 0.00 0.00 57.90 57.50 1wap n TYR 67 Cb 0.30 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.33 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 1.36 0.53 3.36 2.72 0.00 -0.91 -5.07 105.19 107.17 1wap n GLY 68 Ca 0.18 -2.18 -0.29 0.00 0.00 0.00 0.00 46.02 43.73 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 -0.25 1.52 0.01 1.61 2.02 -1.26 -1.01 118.70 121.34 1wap s GLU 69 Ca 0.00 -1.23 0.02 0.00 0.02 0.00 0.00 54.97 53.78 1wap s GLU 69 Cb 0.00 -1.86 -0.01 0.00 0.10 0.00 0.00 34.13 32.36 1wap s GLU 69 CO 0.00 0.46 -0.06 1.41 0.02 0.00 0.00 175.26 177.08 1wap s MET 70 N -1.70 0.47 -0.16 1.61 1.75 -0.57 -5.00 119.30 115.70 1wap s MET 70 Ca 0.12 -0.41 -0.01 0.00 -1.25 0.00 0.00 55.69 54.14 1wap s MET 70 Cb -0.10 -0.38 -0.01 0.00 2.84 0.00 0.00 34.83 37.19 1wap s MET 70 CO 0.04 0.09 -0.11 0.21 -0.65 0.00 0.00 175.02 174.60 1wap s LYS 71 N -0.69 3.33 0.29 4.11 2.20 -1.26 -0.60 119.74 127.12 1wap s LYS 71 Ca -0.03 -0.69 -0.19 0.00 -0.36 0.00 0.00 55.97 54.71 1wap s LYS 71 Cb -0.05 -2.73 -0.09 0.00 -1.51 0.00 0.00 37.83 33.45 1wap s LYS 71 CO 0.00 0.04 0.77 -1.54 -0.36 0.00 0.00 175.35 174.26 1wap s SER 72 N 0.80 6.97 0.22 1.43 1.04 -0.73 -4.97 113.70 118.45 1wap s SER 72 Ca -0.04 1.43 0.06 0.00 0.48 0.00 0.00 55.95 57.87 1wap s SER 72 Cb -0.15 -2.43 -0.04 0.00 0.10 0.00 0.00 66.02 63.51 1wap s SER 72 CO 0.01 -0.10 0.20 -1.61 0.98 0.00 0.00 173.24 172.72 1wap s GLU 73 N -2.46 3.01 0.00 4.02 2.02 -1.26 -1.84 118.70 122.18 1wap s GLU 73 Ca 0.49 -0.94 0.00 0.00 0.02 0.00 0.00 54.97 54.55 1wap s GLU 73 Cb -0.14 -2.65 0.00 0.00 0.10 0.00 0.00 34.13 31.44 1wap s GLU 73 CO 0.19 0.44 0.00 1.17 0.02 0.00 0.00 175.26 177.08