#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 0.90 0.01 -0.67 -0.12 -1.26 -1.58 117.98 115.25 1wap s PHE 9 Ca 0.00 -1.17 0.04 0.00 -0.05 0.00 0.00 56.93 55.75 1wap s PHE 9 Cb 0.00 -0.33 -0.01 0.00 -0.63 0.00 0.00 43.02 42.04 1wap s PHE 9 CO 0.00 -0.73 -0.12 0.14 -0.05 0.00 0.00 175.22 174.46 1wap s VAL 10 N -4.11 0.95 -0.21 -2.49 -7.23 -0.27 -4.61 120.40 102.44 1wap s VAL 10 Ca 0.33 -0.65 -0.08 0.00 -1.81 0.00 0.00 61.98 59.77 1wap s VAL 10 Cb 0.05 -0.82 -0.04 0.00 0.56 0.00 0.00 36.38 36.13 1wap s VAL 10 CO 0.10 0.16 0.07 -0.69 -0.31 0.00 0.00 175.10 174.44 1wap s VAL 11 N -0.47 4.67 -0.09 1.32 1.01 -0.60 -1.11 120.40 125.13 1wap s VAL 11 Ca 0.03 -0.07 0.02 0.00 0.00 0.00 0.00 61.98 61.96 1wap s VAL 11 Cb -0.06 -3.13 0.02 0.00 0.00 0.00 0.00 36.38 33.21 1wap s VAL 11 CO 0.00 0.41 -0.13 -0.63 0.00 0.00 0.00 175.10 174.76 1wap s ILE 12 N 0.80 1.27 -0.18 2.22 1.01 0.44 -1.64 121.20 125.13 1wap s ILE 12 Ca 0.04 -0.51 -0.01 0.00 0.00 0.00 0.00 60.65 60.16 1wap s ILE 12 Cb -0.13 -1.18 -0.00 0.00 0.01 0.00 0.00 42.46 41.15 1wap s ILE 12 CO 0.02 0.39 -0.12 -0.75 0.00 0.00 0.00 174.94 174.49 1wap s LYS 13 N 0.99 3.26 -0.08 2.79 2.20 -0.30 -1.04 119.74 127.57 1wap s LYS 13 Ca -0.08 -0.71 -0.30 0.00 -0.36 0.00 0.00 55.97 54.53 1wap s LYS 13 Cb -0.15 -2.75 -0.04 0.00 -1.51 0.00 0.00 37.83 33.38 1wap s LYS 13 CO -0.01 -0.07 1.41 0.00 -0.36 0.00 0.00 175.35 176.32 1wap s ALA 14 N 1.05 3.61 -0.12 3.13 0.00 -0.44 -0.98 121.76 128.01 1wap s ALA 14 Ca -0.00 0.73 0.16 0.00 0.00 0.00 0.00 51.96 52.84 1wap s ALA 14 Cb -0.15 -3.64 -0.10 0.00 0.00 0.00 0.00 23.12 19.24 1wap s ALA 14 CO -0.03 -1.12 0.97 0.28 0.00 0.00 0.00 175.76 175.86 1wap h VAL 15 N 5.30 0.63 -4.40 0.00 2.07 -1.44 0.30 116.25 118.71 1wap h VAL 15 Ca -0.34 -2.11 -0.20 0.00 0.82 0.00 0.00 66.70 64.87 1wap h VAL 15 Cb 1.15 2.15 -0.14 0.00 -1.52 0.00 0.00 31.29 32.93 1wap h VAL 15 CO 0.94 0.36 -0.54 -1.61 0.02 0.00 0.00 177.57 176.73 1wap s GLU 16 N -2.92 1.19 0.97 1.57 0.41 -1.16 -4.60 118.70 114.17 1wap s GLU 16 Ca -0.01 -1.52 -0.12 0.00 -0.41 0.00 0.00 54.97 52.91 1wap s GLU 16 Cb 0.08 0.30 0.18 0.00 -1.78 0.00 0.00 34.13 32.91 1wap s GLU 16 CO 0.80 -0.40 1.08 -0.51 -0.49 0.00 0.00 175.26 175.74 1wap s ASP 17 N -3.11 2.70 -0.52 -0.19 1.01 -1.26 -3.66 116.67 111.63 1wap s ASP 17 Ca 0.33 1.56 0.00 0.00 0.71 0.00 0.00 52.55 55.15 1wap s ASP 17 Cb 0.06 -2.22 0.00 0.00 1.01 0.00 0.00 42.92 41.77 1wap s ASP 17 CO 0.09 -3.14 0.00 0.61 0.21 0.00 0.00 175.17 172.94 1wap n GLY 18 N -0.48 0.18 3.77 0.21 0.00 -1.26 -4.80 105.19 102.82 1wap n GLY 18 Ca 0.06 -0.65 -0.39 0.00 0.00 0.00 0.00 46.02 45.04 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 -2.29 4.50 -0.04 1.61 1.01 -1.16 -4.58 120.40 119.44 1wap s VAL 19 Ca 0.00 1.62 0.06 0.00 0.00 0.00 0.00 61.98 63.65 1wap s VAL 19 Cb 0.00 -4.10 -0.01 0.00 0.00 0.00 0.00 36.38 32.27 1wap s VAL 19 CO 0.00 0.49 -0.22 0.20 0.00 0.00 0.00 175.10 175.58 1wap s ASN 20 N -0.91 2.63 -0.25 3.32 -0.87 -0.43 -0.80 114.94 117.63 1wap s ASN 20 Ca 0.35 -0.43 -0.03 0.00 -1.57 0.00 0.00 52.86 51.19 1wap s ASN 20 Cb -0.22 -0.62 0.02 0.00 -0.02 0.00 0.00 41.25 40.41 1wap s ASN 20 CO 0.24 0.22 -0.04 -0.69 -2.57 0.00 0.00 177.10 174.26 1wap s VAL 21 N -0.18 3.07 -0.12 1.60 1.01 -0.10 -1.83 120.40 123.85 1wap s VAL 21 Ca -0.01 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.06 1wap s VAL 21 Cb -0.12 -2.55 -0.01 0.00 0.00 0.00 0.00 36.38 33.71 1wap s VAL 21 CO 0.02 0.20 -0.17 -0.63 0.00 0.00 0.00 175.10 174.52 1wap s ILE 22 N 1.36 2.64 -0.12 2.22 1.01 0.53 0.23 121.20 129.08 1wap s ILE 22 Ca 0.01 -0.80 -0.07 0.00 0.00 0.00 0.00 60.65 59.79 1wap s ILE 22 Cb -0.16 -2.08 -0.04 0.00 0.01 0.00 0.00 42.46 40.18 1wap s ILE 22 CO -0.03 0.54 0.12 -0.83 0.00 0.00 0.00 174.94 174.73 1wap s GLY 23 N 0.41 2.11 -0.07 6.18 0.00 -0.22 -1.30 107.32 114.42 1wap s GLY 23 Ca -0.13 -0.66 -0.03 0.00 0.00 0.00 0.00 44.72 43.89 1wap s GLY 23 CO 0.06 -0.35 0.08 1.08 0.00 0.00 0.00 173.10 173.97 1wap s LEU 24 N -0.88 4.00 0.27 0.66 1.02 0.04 -1.77 118.68 122.02 1wap s LEU 24 Ca 0.14 0.28 -0.29 0.00 0.02 0.00 0.00 54.13 54.27 1wap s LEU 24 Cb -0.12 -2.06 -0.10 0.00 0.02 0.00 0.00 46.19 43.93 1wap s LEU 24 CO 0.03 0.36 1.27 0.42 0.02 0.00 0.00 176.35 178.45 1wap s THR 25 N -1.04 3.04 0.27 5.49 -4.23 0.15 -2.66 115.64 116.65 1wap s THR 25 Ca 0.17 0.96 -0.29 0.00 -1.18 0.00 0.00 61.69 61.35 1wap s THR 25 Cb -0.12 -3.61 -0.09 0.00 1.34 0.00 0.00 72.50 70.02 1wap s THR 25 CO 0.07 0.20 1.02 -0.60 -0.54 0.00 0.00 174.62 174.76 1wap s ARG 26 N -1.09 4.72 0.00 3.99 3.52 -0.47 -4.53 118.95 125.09 1wap s ARG 26 Ca 0.51 1.63 0.00 0.00 -0.13 0.00 0.00 55.73 57.74 1wap s ARG 26 Cb -0.37 -3.19 0.00 0.00 -1.56 0.00 0.00 34.95 29.82 1wap s ARG 26 CO 0.45 0.35 0.00 0.41 -0.81 0.00 0.00 175.30 175.70 1wap n GLY 27 N 1.28 0.57 0.34 8.12 0.00 -1.26 -4.83 105.19 109.40 1wap n GLY 27 Ca -0.01 -2.14 -0.05 0.00 0.00 0.00 0.00 46.02 43.81 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 1.25 -3.21 2.61 1.35 -2.05 -3.42 112.91 109.44 1wap h THR 28 Ca 0.00 -0.80 -0.57 0.00 -0.55 0.00 0.00 66.41 64.49 1wap h THR 28 Cb 0.00 0.33 -0.04 0.00 -1.73 0.00 0.00 68.15 66.72 1wap h THR 28 CO 0.00 0.32 -0.26 -1.81 -0.25 0.00 0.00 175.52 173.53 1wap s ASP 29 N -6.39 6.55 -0.28 5.36 1.01 -1.26 -5.09 116.67 116.58 1wap s ASP 29 Ca -0.12 0.70 0.02 0.00 0.71 0.00 0.00 52.55 53.86 1wap s ASP 29 Cb 0.16 -2.14 0.08 0.00 1.01 0.00 0.00 42.92 42.03 1wap s ASP 29 CO 0.83 0.05 -0.01 -0.89 0.21 0.00 0.00 175.17 175.37 1wap s THR 30 N -1.63 1.67 0.18 -1.27 2.01 -1.26 -4.63 115.64 110.71 1wap s THR 30 Ca 0.41 -1.59 -0.07 0.00 0.31 0.00 0.00 61.69 60.75 1wap s THR 30 Cb -0.12 -2.05 -0.02 0.00 0.01 0.00 0.00 72.50 70.32 1wap s THR 30 CO 0.22 -0.32 0.25 -1.59 -0.69 0.00 0.00 174.62 172.49 1wap s LYS 31 N 1.28 1.19 -0.09 4.92 -2.85 -1.26 -4.92 119.74 118.00 1wap s LYS 31 Ca 0.01 -1.31 -0.30 0.00 -1.00 0.00 0.00 55.97 53.37 1wap s LYS 31 Cb -0.19 0.35 -0.03 0.00 -2.06 0.00 0.00 37.83 35.91 1wap s LYS 31 CO -0.10 -0.43 1.23 -0.06 0.10 0.00 0.00 175.35 176.10 1wap s PHE 32 N -4.02 3.06 -0.24 1.78 0.08 -1.26 -0.68 117.98 116.69 1wap s PHE 32 Ca 0.23 1.13 0.20 0.00 0.12 0.00 0.00 56.93 58.61 1wap s PHE 32 Cb 0.04 -3.46 -0.29 0.00 -0.57 0.00 0.00 43.02 38.74 1wap s PHE 32 CO 0.04 -1.50 0.53 -2.39 -0.10 0.00 0.00 175.22 171.80 1wap n HIS 33 N 5.68 0.00 -3.62 0.36 1.44 -0.73 -4.93 115.22 113.42 1wap n HIS 33 Ca 0.12 0.00 -0.13 0.00 -2.01 0.00 0.00 57.72 55.70 1wap n HIS 33 Cb 0.46 -0.35 -0.07 0.00 0.12 0.00 0.00 29.99 30.15 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 -3.26 -0.72 -0.20 -1.40 5.65 -1.24 -5.02 115.29 109.11 1wap s HIS 34 Ca -0.04 1.71 0.01 0.00 0.25 0.00 0.00 55.06 56.99 1wap s HIS 34 Cb 0.13 0.30 0.05 0.00 -1.18 0.00 0.00 32.58 31.88 1wap s HIS 34 CO 0.82 -0.37 -0.08 0.45 -0.65 0.00 0.00 174.74 174.91 1wap s SER 35 N 0.20 3.36 -0.28 9.88 0.15 -1.26 -1.06 113.70 124.69 1wap s SER 35 Ca -0.00 -0.89 -0.17 0.00 0.70 0.00 0.00 55.95 55.58 1wap s SER 35 Cb -0.05 -1.15 -0.03 0.00 -1.71 0.00 0.00 66.02 63.08 1wap s SER 35 CO 0.01 -0.17 0.47 -0.70 1.20 0.00 0.00 173.24 174.05 1wap s GLU 36 N 1.45 3.97 0.16 5.44 2.56 0.14 -4.89 118.70 127.52 1wap s GLU 36 Ca -0.02 0.15 -0.30 0.00 0.00 0.00 0.00 54.97 54.80 1wap s GLU 36 Cb -0.16 -3.68 -0.08 0.00 2.00 0.00 0.00 34.13 32.21 1wap s GLU 36 CO -0.08 -0.38 1.18 0.15 -0.56 0.00 0.00 175.26 175.57 1wap s LYS 37 N 2.25 4.50 -0.23 4.30 1.02 -1.26 -0.92 119.74 129.40 1wap s LYS 37 Ca 0.19 1.83 0.02 0.00 0.02 0.00 0.00 55.97 58.03 1wap s LYS 37 Cb -0.16 -3.27 0.05 0.00 -0.52 0.00 0.00 37.83 33.94 1wap s LYS 37 CO 0.10 -0.09 -0.13 -0.51 -0.92 0.00 0.00 175.35 173.81 1wap s LEU 38 N -0.03 2.89 0.57 3.17 1.43 0.02 -4.96 118.68 121.77 1wap s LEU 38 Ca 0.53 -1.13 -0.08 0.00 -1.03 0.00 0.00 54.13 52.42 1wap s LEU 38 Cb -0.31 -1.45 -0.03 0.00 0.03 0.00 0.00 46.19 44.42 1wap s LEU 38 CO 0.35 -0.14 0.93 -1.81 0.23 0.00 0.00 176.35 175.91 1wap s ASP 39 N 1.21 6.16 0.15 2.29 1.01 -1.26 -2.97 116.67 123.27 1wap s ASP 39 Ca -0.04 1.17 -0.33 0.00 0.71 0.00 0.00 52.55 54.06 1wap s ASP 39 Cb -0.18 -2.31 -0.16 0.00 1.01 0.00 0.00 42.92 41.28 1wap s ASP 39 CO -0.07 -0.80 1.11 1.17 0.21 0.00 0.00 175.17 176.79 1wap n LYS 40 N -2.57 0.95 0.00 8.23 4.81 -1.24 -1.28 118.16 127.07 1wap n LYS 40 Ca 0.04 0.34 0.00 0.00 -0.87 0.00 0.00 58.31 57.82 1wap n LYS 40 Cb 0.55 -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 1.97 2.92 3.85 3.14 0.00 0.11 -4.96 105.19 112.22 1wap n GLY 41 Ca 0.16 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.86 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 3.87 -0.02 1.61 2.02 -0.40 -4.80 118.70 120.94 1wap s GLU 42 Ca 0.00 0.82 0.04 0.00 0.02 0.00 0.00 54.97 55.85 1wap s GLU 42 Cb 0.00 -2.19 -0.01 0.00 0.10 0.00 0.00 34.13 32.04 1wap s GLU 42 CO 0.00 -0.25 -0.12 0.08 0.02 0.00 0.00 175.26 174.99 1wap s VAL 43 N -2.63 0.98 -0.04 2.63 1.01 -1.26 -1.33 120.40 119.76 1wap s VAL 43 Ca 0.57 -0.51 0.04 0.00 0.00 0.00 0.00 61.98 62.08 1wap s VAL 43 Cb -0.10 -0.83 -0.00 0.00 0.00 0.00 0.00 36.38 35.44 1wap s VAL 43 CO 0.34 0.28 -0.16 -0.51 0.00 0.00 0.00 175.10 175.05 1wap s ILE 44 N -0.14 1.36 -0.27 2.22 2.07 -0.20 -4.99 121.20 121.24 1wap s ILE 44 Ca 0.02 -0.69 -0.04 0.00 -1.41 0.00 0.00 60.65 58.53 1wap s ILE 44 Cb -0.06 -1.16 0.02 0.00 0.13 0.00 0.00 42.46 41.39 1wap s ILE 44 CO 0.00 0.39 -0.00 -0.63 -1.91 0.00 0.00 174.94 172.79 1wap s ILE 45 N -0.04 3.31 -0.04 2.00 1.09 -1.26 -0.42 121.20 125.83 1wap s ILE 45 Ca -0.01 -0.93 0.06 0.00 -1.10 0.00 0.00 60.65 58.66 1wap s ILE 45 Cb -0.10 -2.71 -0.01 0.00 -1.06 0.00 0.00 42.46 38.58 1wap s ILE 45 CO 0.01 0.13 -0.21 0.00 -0.10 0.00 0.00 174.94 174.77 1wap s ALA 46 N 1.39 1.83 0.28 9.38 0.00 -0.27 -4.95 121.76 129.42 1wap s ALA 46 Ca 0.01 -0.89 0.03 0.00 0.00 0.00 0.00 51.96 51.11 1wap s ALA 46 Cb -0.17 -0.55 -0.03 0.00 0.00 0.00 0.00 23.12 22.37 1wap s ALA 46 CO -0.01 0.37 0.43 -0.65 0.00 0.00 0.00 175.76 175.90 1wap s GLN 47 N -0.18 3.46 0.36 0.00 -0.21 -1.26 -1.11 119.66 120.71 1wap s GLN 47 Ca -0.00 -0.58 -0.24 0.00 0.02 0.00 0.00 55.36 54.55 1wap s GLN 47 Cb -0.11 -2.80 -0.10 0.00 1.00 0.00 0.00 33.01 30.99 1wap s GLN 47 CO 0.02 0.32 0.94 -0.06 -2.12 0.00 0.00 175.29 174.39 1wap s PHE 48 N -2.11 3.55 0.21 0.91 0.08 -0.62 -4.94 117.98 115.07 1wap s PHE 48 Ca 0.36 1.70 0.01 0.00 0.12 0.00 0.00 56.93 59.13 1wap s PHE 48 Cb -0.09 -2.88 -0.00 0.00 -0.57 0.00 0.00 43.02 39.47 1wap s PHE 48 CO 0.32 0.10 0.26 0.25 -0.10 0.00 0.00 175.22 176.04 1wap n THR 49 N 0.12 0.00 -0.18 0.64 -2.24 -0.38 -4.58 114.28 107.65 1wap n THR 49 Ca 0.04 -1.21 0.03 0.00 -2.27 0.00 0.00 64.05 60.63 1wap n THR 49 Cb 0.52 0.69 0.30 0.00 -2.10 0.00 0.00 70.33 69.74 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 0.84 0.00 -0.78 3.07 -2.02 -3.04 114.58 112.65 1wap h GLU 50 Ca -0.16 -0.05 -0.06 0.00 -0.50 0.00 0.00 59.36 58.59 1wap h GLU 50 Cb 0.73 -0.19 -0.01 0.00 -0.84 0.00 0.00 28.75 28.43 1wap h GLU 50 CO 0.22 0.56 -1.63 0.72 -1.40 0.00 0.00 179.01 177.47 1wap n HIS 51 N -4.45 0.46 -4.01 4.33 8.25 -1.26 -4.63 115.22 113.91 1wap n HIS 51 Ca 0.08 0.14 -0.31 0.00 -0.26 0.00 0.00 57.72 57.37 1wap n HIS 51 Cb 0.10 -0.79 -0.16 0.00 1.12 0.00 0.00 29.99 30.27 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 -3.27 1.80 -0.67 1.59 2.01 -1.15 -1.36 115.64 114.58 1wap s THR 52 Ca -0.05 -1.26 0.06 0.00 0.31 0.00 0.00 61.69 60.75 1wap s THR 52 Cb 0.11 -1.92 0.06 0.00 0.01 0.00 0.00 72.50 70.75 1wap s THR 52 CO 0.85 0.05 0.73 -1.54 -0.69 0.00 0.00 174.62 174.02 1wap n SER 53 N 4.60 1.57 -3.69 3.53 3.41 -1.09 -1.25 113.62 120.71 1wap n SER 53 Ca -0.14 -1.32 -0.14 0.00 -0.26 0.00 0.00 58.87 57.01 1wap n SER 53 Cb 0.45 -0.01 -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 -0.52 -1.21 -0.06 7.33 0.00 -1.25 -5.03 121.76 121.01 1wap s ALA 54 Ca 0.07 1.11 0.03 0.00 0.00 0.00 0.00 51.96 53.16 1wap s ALA 54 Cb 0.05 -0.43 0.01 0.00 0.00 0.00 0.00 23.12 22.74 1wap s ALA 54 CO 0.07 -0.27 -0.13 0.42 0.00 0.00 0.00 175.76 175.85 1wap s ILE 55 N -0.42 1.19 -0.10 0.00 1.01 -1.26 -0.78 121.20 120.85 1wap s ILE 55 Ca -0.06 -0.53 0.02 0.00 0.00 0.00 0.00 60.65 60.08 1wap s ILE 55 Cb -0.03 -1.07 -0.02 0.00 0.01 0.00 0.00 42.46 41.35 1wap s ILE 55 CO 0.03 0.36 -0.15 -0.75 0.00 0.00 0.00 174.94 174.44 1wap s LYS 56 N 0.48 3.06 -0.15 2.79 2.20 -0.42 -4.97 119.74 122.72 1wap s LYS 56 Ca -0.12 -0.72 0.01 0.00 -0.36 0.00 0.00 55.97 54.79 1wap s LYS 56 Cb -0.14 -2.51 0.00 0.00 -1.51 0.00 0.00 37.83 33.67 1wap s LYS 56 CO 0.03 0.34 -0.17 0.08 -0.36 0.00 0.00 175.35 175.27 1wap s VAL 57 N 0.01 2.50 -0.09 4.02 1.01 -1.26 -0.35 120.40 126.24 1wap s VAL 57 Ca -0.05 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.14 1wap s VAL 57 Cb -0.14 -2.05 0.01 0.00 0.00 0.00 0.00 36.38 34.20 1wap s VAL 57 CO 0.04 0.52 -0.16 -0.60 0.00 0.00 0.00 175.10 174.90 1wap s ARG 58 N 0.87 2.24 0.00 2.72 3.52 -0.76 -4.96 118.95 122.57 1wap s ARG 58 Ca -0.05 -0.59 0.00 0.00 -0.13 0.00 0.00 55.73 54.96 1wap s ARG 58 Cb -0.15 -1.81 0.00 0.00 -1.56 0.00 0.00 34.95 31.43 1wap s ARG 58 CO -0.01 0.04 0.00 0.41 -0.81 0.00 0.00 175.30 174.93 1wap n GLY 59 N 3.85 1.71 3.62 8.12 0.00 -1.26 -1.31 105.19 119.92 1wap n GLY 59 Ca -0.21 -2.18 -0.43 0.00 0.00 0.00 0.00 46.02 43.20 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 -1.61 3.89 0.14 1.61 2.56 -1.26 -3.23 118.70 120.80 1wap s GLU 60 Ca 0.00 0.77 -0.19 0.00 0.00 0.00 0.00 54.97 55.55 1wap s GLU 60 Cb 0.00 -3.81 0.05 0.00 2.00 0.00 0.00 34.13 32.37 1wap s GLU 60 CO 0.00 -1.08 0.49 0.00 -0.56 0.00 0.00 175.26 174.11 1wap s ALA 61 N 3.88 -1.21 -0.15 6.30 0.00 -0.66 -1.07 121.76 128.85 1wap s ALA 61 Ca 0.44 0.17 -0.07 0.00 0.00 0.00 0.00 51.96 52.50 1wap s ALA 61 Cb -0.10 0.78 -0.04 0.00 0.00 0.00 0.00 23.12 23.76 1wap s ALA 61 CO 0.22 -0.70 0.10 -1.17 0.00 0.00 0.00 175.76 174.20 1wap s LEU 62 N -2.78 4.07 -0.10 0.00 2.96 -0.15 -1.21 118.68 121.47 1wap s LEU 62 Ca 0.02 0.26 0.03 0.00 -0.22 0.00 0.00 54.13 54.22 1wap s LEU 62 Cb 0.01 -2.01 0.01 0.00 0.50 0.00 0.00 46.19 44.69 1wap s LEU 62 CO -0.12 0.29 -0.19 -0.63 -1.32 0.00 0.00 176.35 174.37 1wap s ILE 63 N -0.30 1.74 -0.09 6.68 1.01 0.55 -1.15 121.20 129.64 1wap s ILE 63 Ca 0.10 -0.81 0.02 0.00 0.00 0.00 0.00 60.65 59.96 1wap s ILE 63 Cb -0.12 -1.53 -0.02 0.00 0.01 0.00 0.00 42.46 40.80 1wap s ILE 63 CO 0.01 0.49 -0.16 -1.10 0.00 0.00 0.00 174.94 174.18 1wap s GLN 64 N 0.62 2.96 0.26 2.79 -0.21 -0.65 -0.72 119.66 124.71 1wap s GLN 64 Ca -0.14 -0.73 0.05 0.00 0.02 0.00 0.00 55.36 54.57 1wap s GLN 64 Cb -0.17 -2.46 -0.02 0.00 1.00 0.00 0.00 33.01 31.36 1wap s GLN 64 CO 0.04 0.37 0.19 0.25 -2.12 0.00 0.00 175.29 174.03 1wap n THR 65 N 3.04 0.00 0.10 -0.19 -2.24 -0.22 -1.55 114.28 113.22 1wap n THR 65 Ca -0.18 -1.82 0.20 0.00 -2.27 0.00 0.00 64.05 59.97 1wap n THR 65 Cb 0.52 0.87 0.75 0.00 -2.10 0.00 0.00 70.33 70.37 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 1.75 2.14 -0.63 6.98 0.00 -2.01 -1.55 119.26 125.94 1wap h ALA 66 Ca -0.19 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1wap h ALA 66 Cb 0.90 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.72 1wap h ALA 66 CO 0.28 -0.56 0.00 0.66 0.00 0.00 0.00 179.25 179.63 1wap n TYR 67 N -3.91 0.83 0.00 0.00 4.01 -1.26 -5.06 117.16 111.77 1wap n TYR 67 Ca 0.06 -0.42 0.00 0.00 -0.16 0.00 0.00 57.90 57.39 1wap n TYR 67 Cb 0.54 0.00 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 1.57 0.11 3.67 2.72 0.00 -0.59 -5.06 105.19 107.62 1wap n GLY 68 Ca 0.22 -2.18 -0.29 0.00 0.00 0.00 0.00 46.02 43.77 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 2.48 -0.01 1.61 2.02 -1.26 -1.05 118.70 122.49 1wap s GLU 69 Ca 0.00 -0.91 -0.05 0.00 0.02 0.00 0.00 54.97 54.03 1wap s GLU 69 Cb 0.00 -2.48 0.00 0.00 0.10 0.00 0.00 34.13 31.75 1wap s GLU 69 CO 0.00 0.52 0.11 1.41 0.02 0.00 0.00 175.26 177.32 1wap s MET 70 N -2.45 0.33 -0.17 1.61 -2.45 0.11 -5.01 119.30 111.27 1wap s MET 70 Ca 0.26 -0.21 -0.01 0.00 -1.25 0.00 0.00 55.69 54.48 1wap s MET 70 Cb -0.11 0.14 -0.01 0.00 1.25 0.00 0.00 34.83 36.10 1wap s MET 70 CO 0.18 -0.07 -0.12 0.21 1.05 0.00 0.00 175.02 176.28 1wap s LYS 71 N -0.84 3.31 0.28 4.11 2.20 -1.26 -0.33 119.74 127.21 1wap s LYS 71 Ca -0.09 -0.69 -0.09 0.00 -0.36 0.00 0.00 55.97 54.73 1wap s LYS 71 Cb -0.05 -2.73 -0.07 0.00 -1.51 0.00 0.00 37.83 33.46 1wap s LYS 71 CO 0.01 0.01 0.60 -1.54 -0.36 0.00 0.00 175.35 174.07 1wap s SER 72 N 0.86 6.58 -0.01 1.43 1.04 -0.35 -4.97 113.70 118.28 1wap s SER 72 Ca -0.03 0.93 0.03 0.00 0.48 0.00 0.00 55.95 57.36 1wap s SER 72 Cb -0.15 -2.23 -0.01 0.00 0.10 0.00 0.00 66.02 63.73 1wap s SER 72 CO 0.00 -0.16 -0.10 -1.61 0.98 0.00 0.00 173.24 172.35 1wap s GLU 73 N -3.16 0.79 0.00 4.02 2.02 -1.20 -1.65 118.70 119.52 1wap s GLU 73 Ca 0.48 -0.35 0.29 0.00 0.02 0.00 0.00 54.97 55.41 1wap s GLU 73 Cb -0.11 -0.76 1.30 0.00 0.10 0.00 0.00 34.13 34.66 1wap s GLU 73 CO 0.24 0.21 1.88 1.17 0.02 0.00 0.00 175.26 178.79