#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 0.43 0.01 -0.67 -0.12 -1.26 -1.99 117.98 114.37 1wap s PHE 9 Ca 0.00 -0.94 0.08 0.00 -0.05 0.00 0.00 56.93 56.01 1wap s PHE 9 Cb 0.00 -0.31 -0.02 0.00 -0.63 0.00 0.00 43.02 42.06 1wap s PHE 9 CO 0.00 -0.42 -0.24 0.14 -0.05 0.00 0.00 175.22 174.65 1wap s VAL 10 N -3.87 1.93 -0.19 -2.49 -7.23 -0.13 -4.57 120.40 103.86 1wap s VAL 10 Ca 0.06 -1.14 -0.06 0.00 -1.81 0.00 0.00 61.98 59.03 1wap s VAL 10 Cb 0.07 -1.62 -0.03 0.00 0.56 0.00 0.00 36.38 35.36 1wap s VAL 10 CO -0.10 0.45 0.01 -0.69 -0.31 0.00 0.00 175.10 174.46 1wap s VAL 11 N -0.66 4.22 -0.11 1.32 1.01 -0.49 -1.64 120.40 124.06 1wap s VAL 11 Ca 0.10 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.85 1wap s VAL 11 Cb -0.09 -2.90 0.02 0.00 0.00 0.00 0.00 36.38 33.41 1wap s VAL 11 CO 0.00 0.45 -0.11 -0.63 0.00 0.00 0.00 175.10 174.81 1wap s ILE 12 N 0.66 1.25 -0.21 2.22 1.01 -0.21 -0.53 121.20 125.39 1wap s ILE 12 Ca 0.01 -0.46 -0.05 0.00 0.00 0.00 0.00 60.65 60.15 1wap s ILE 12 Cb -0.14 -1.19 -0.02 0.00 0.01 0.00 0.00 42.46 41.12 1wap s ILE 12 CO 0.02 0.40 -0.01 -0.75 0.00 0.00 0.00 174.94 174.60 1wap s LYS 13 N 1.34 3.51 -0.01 2.79 2.20 -0.17 -0.99 119.74 128.41 1wap s LYS 13 Ca -0.01 -0.56 -0.30 0.00 -0.36 0.00 0.00 55.97 54.74 1wap s LYS 13 Cb -0.14 -3.08 -0.05 0.00 -1.51 0.00 0.00 37.83 33.06 1wap s LYS 13 CO -0.05 -0.10 1.30 0.00 -0.36 0.00 0.00 175.35 176.13 1wap s ALA 14 N 1.28 3.53 -0.93 3.13 0.00 -0.28 -1.47 121.76 127.02 1wap s ALA 14 Ca 0.04 0.79 0.19 0.00 0.00 0.00 0.00 51.96 52.97 1wap s ALA 14 Cb -0.15 -3.54 -0.20 0.00 0.00 0.00 0.00 23.12 19.24 1wap s ALA 14 CO 0.00 -0.78 0.81 0.28 0.00 0.00 0.00 175.76 176.06 1wap n VAL 15 N 4.52 0.00 -4.19 0.00 0.31 0.57 -0.39 118.33 119.15 1wap n VAL 15 Ca 0.12 -0.07 -0.11 0.00 -0.01 0.00 0.00 64.34 64.27 1wap n VAL 15 Cb 0.45 1.01 -0.10 0.00 -0.91 0.00 0.00 33.84 34.29 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 -2.75 1.04 0.64 5.55 -1.05 -1.19 -4.80 118.70 116.14 1wap s GLU 16 Ca 0.07 -1.51 -0.15 0.00 -0.15 0.00 0.00 54.97 53.24 1wap s GLU 16 Cb 0.14 0.08 -0.01 0.00 -0.44 0.00 0.00 34.13 33.90 1wap s GLU 16 CO 0.76 -0.25 1.09 -0.51 0.95 0.00 0.00 175.26 177.31 1wap s ASP 17 N -3.11 5.35 -0.89 0.83 1.01 -1.26 -3.48 116.67 115.12 1wap s ASP 17 Ca 0.27 1.93 0.00 0.00 0.71 0.00 0.00 52.55 55.45 1wap s ASP 17 Cb 0.07 -2.54 0.00 0.00 1.01 0.00 0.00 42.92 41.46 1wap s ASP 17 CO 0.04 -1.46 0.00 0.61 0.21 0.00 0.00 175.17 174.57 1wap n GLY 18 N -0.71 0.12 3.77 0.21 0.00 -1.09 -4.88 105.19 102.60 1wap n GLY 18 Ca 0.10 -0.48 -0.38 0.00 0.00 0.00 0.00 46.02 45.26 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 -2.49 2.83 -0.11 1.61 1.01 -0.58 -4.81 120.40 117.86 1wap s VAL 19 Ca 0.00 0.65 0.02 0.00 0.00 0.00 0.00 61.98 62.65 1wap s VAL 19 Cb 0.00 -3.34 -0.01 0.00 0.00 0.00 0.00 36.38 33.03 1wap s VAL 19 CO 0.00 0.01 -0.19 0.20 0.00 0.00 0.00 175.10 175.12 1wap s ASN 20 N -1.17 3.51 -0.28 3.32 -0.87 -0.45 -0.38 114.94 118.61 1wap s ASN 20 Ca 0.64 -0.45 -0.04 0.00 -1.57 0.00 0.00 52.86 51.43 1wap s ASN 20 Cb -0.32 -1.49 0.02 0.00 -0.02 0.00 0.00 41.25 39.44 1wap s ASN 20 CO 0.40 0.16 0.01 -0.69 -2.57 0.00 0.00 177.10 174.42 1wap s VAL 21 N 0.33 3.38 -0.16 1.60 1.01 0.32 -1.78 120.40 125.09 1wap s VAL 21 Ca -0.15 -0.95 -0.03 0.00 0.00 0.00 0.00 61.98 60.85 1wap s VAL 21 Cb -0.17 -2.77 -0.02 0.00 0.00 0.00 0.00 36.38 33.42 1wap s VAL 21 CO 0.07 0.08 -0.06 -0.63 0.00 0.00 0.00 175.10 174.57 1wap s ILE 22 N 1.39 3.60 -0.14 2.22 1.01 -0.23 0.86 121.20 129.91 1wap s ILE 22 Ca 0.00 -0.45 -0.09 0.00 0.00 0.00 0.00 60.65 60.11 1wap s ILE 22 Cb -0.17 -2.58 -0.04 0.00 0.01 0.00 0.00 42.46 39.67 1wap s ILE 22 CO -0.01 0.49 0.16 -0.83 0.00 0.00 0.00 174.94 174.74 1wap s GLY 23 N 0.58 2.14 -0.11 6.18 0.00 0.15 -1.23 107.32 115.04 1wap s GLY 23 Ca -0.04 -0.63 -0.05 0.00 0.00 0.00 0.00 44.72 44.00 1wap s GLY 23 CO 0.03 -0.14 0.08 1.08 0.00 0.00 0.00 173.10 174.14 1wap s LEU 24 N -0.50 4.03 0.27 0.66 1.02 -0.19 -0.60 118.68 123.38 1wap s LEU 24 Ca 0.13 0.32 -0.30 0.00 0.02 0.00 0.00 54.13 54.31 1wap s LEU 24 Cb -0.12 -1.96 -0.10 0.00 0.02 0.00 0.00 46.19 44.03 1wap s LEU 24 CO 0.02 0.39 1.43 0.42 0.02 0.00 0.00 176.35 178.64 1wap s THR 25 N -0.93 2.58 0.23 5.49 -4.23 -0.24 -2.38 115.64 116.17 1wap s THR 25 Ca 0.14 0.51 -0.30 0.00 -1.18 0.00 0.00 61.69 60.86 1wap s THR 25 Cb -0.12 -3.32 -0.09 0.00 1.34 0.00 0.00 72.50 70.31 1wap s THR 25 CO 0.03 0.09 1.11 -0.60 -0.54 0.00 0.00 174.62 174.71 1wap s ARG 26 N -0.72 4.62 0.00 3.99 3.52 -0.41 -4.57 118.95 125.37 1wap s ARG 26 Ca 0.58 1.77 0.00 0.00 -0.13 0.00 0.00 55.73 57.95 1wap s ARG 26 Cb -0.42 -3.23 0.00 0.00 -1.56 0.00 0.00 34.95 29.74 1wap s ARG 26 CO 0.46 0.14 0.00 0.41 -0.81 0.00 0.00 175.30 175.51 1wap n GLY 27 N 1.60 0.71 0.23 8.12 0.00 -1.26 -4.82 105.19 109.77 1wap n GLY 27 Ca 0.01 -2.10 -0.03 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 1.26 -2.97 2.61 1.35 -2.05 -3.43 112.91 109.68 1wap h THR 28 Ca 0.00 -1.27 -0.61 0.00 -0.55 0.00 0.00 66.41 63.98 1wap h THR 28 Cb 0.00 1.40 -0.07 0.00 -1.73 0.00 0.00 68.15 67.75 1wap h THR 28 CO 0.00 0.40 -0.55 -1.81 -0.25 0.00 0.00 175.52 173.30 1wap s ASP 29 N -6.83 5.86 -0.27 5.36 1.01 -1.26 -5.08 116.67 115.45 1wap s ASP 29 Ca -0.06 0.08 0.01 0.00 0.71 0.00 0.00 52.55 53.29 1wap s ASP 29 Cb 0.14 -1.66 0.08 0.00 1.01 0.00 0.00 42.92 42.48 1wap s ASP 29 CO 0.78 0.15 -0.01 -0.89 0.21 0.00 0.00 175.17 175.41 1wap s THR 30 N -1.51 1.66 0.05 -1.27 2.01 -1.26 -4.61 115.64 110.71 1wap s THR 30 Ca 0.32 -1.55 0.02 0.00 0.31 0.00 0.00 61.69 60.79 1wap s THR 30 Cb -0.12 -2.03 -0.03 0.00 0.01 0.00 0.00 72.50 70.34 1wap s THR 30 CO 0.25 -0.30 -0.08 -0.54 -0.69 0.00 0.00 174.62 173.25 1wap s LYS 31 N 1.29 0.59 0.15 4.92 1.02 -1.26 -4.93 119.74 121.51 1wap s LYS 31 Ca 0.00 -0.83 -0.30 0.00 0.02 0.00 0.00 55.97 54.86 1wap s LYS 31 Cb -0.19 -0.34 -0.07 0.00 -0.52 0.00 0.00 37.83 36.71 1wap s LYS 31 CO -0.09 0.06 1.18 -0.06 -0.92 0.00 0.00 175.35 175.51 1wap s PHE 32 N -1.58 3.47 -0.26 3.18 0.40 -1.26 -1.07 117.98 120.86 1wap s PHE 32 Ca -0.07 1.43 0.08 0.00 -0.60 0.00 0.00 56.93 57.77 1wap s PHE 32 Cb -0.09 -3.39 -0.11 0.00 0.51 0.00 0.00 43.02 39.95 1wap s PHE 32 CO 0.00 -1.09 0.30 -2.39 0.70 0.00 0.00 175.22 172.74 1wap n HIS 33 N 2.84 0.00 -3.64 0.36 1.44 0.23 -4.90 115.22 111.55 1wap n HIS 33 Ca 0.05 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.69 1wap n HIS 33 Cb 0.45 -0.07 -0.07 0.00 0.12 0.00 0.00 29.99 30.42 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 -2.08 -0.44 -0.18 -1.40 5.65 -1.24 -5.00 115.29 110.60 1wap s HIS 34 Ca 0.01 1.03 0.01 0.00 0.25 0.00 0.00 55.06 56.35 1wap s HIS 34 Cb 0.06 0.37 0.03 0.00 -1.18 0.00 0.00 32.58 31.87 1wap s HIS 34 CO 0.35 -0.21 -0.13 0.45 -0.65 0.00 0.00 174.74 174.55 1wap s SER 35 N 0.39 3.15 -0.26 9.88 0.15 -1.26 0.34 113.70 126.10 1wap s SER 35 Ca 0.02 -0.74 -0.14 0.00 0.70 0.00 0.00 55.95 55.79 1wap s SER 35 Cb -0.05 -1.25 -0.04 0.00 -1.71 0.00 0.00 66.02 62.97 1wap s SER 35 CO -0.09 -0.10 0.34 -0.70 1.20 0.00 0.00 173.24 173.89 1wap s GLU 36 N 1.41 4.04 0.06 5.44 2.56 0.25 -4.88 118.70 127.57 1wap s GLU 36 Ca 0.01 0.01 -0.27 0.00 0.00 0.00 0.00 54.97 54.72 1wap s GLU 36 Cb -0.15 -3.62 -0.05 0.00 2.00 0.00 0.00 34.13 32.31 1wap s GLU 36 CO -0.09 -0.19 0.84 0.21 -0.56 0.00 0.00 175.26 175.46 1wap s LYS 37 N 1.80 4.56 -0.09 4.30 2.20 -1.26 -0.52 119.74 130.73 1wap s LYS 37 Ca 0.14 1.20 0.02 0.00 -0.36 0.00 0.00 55.97 56.98 1wap s LYS 37 Cb -0.15 -3.38 0.01 0.00 -1.51 0.00 0.00 37.83 32.80 1wap s LYS 37 CO 0.09 0.22 -0.14 -0.51 -0.36 0.00 0.00 175.35 174.65 1wap s LEU 38 N 0.09 1.69 0.59 5.43 1.43 0.49 -4.98 118.68 123.42 1wap s LEU 38 Ca 0.42 -0.38 -0.01 0.00 -1.03 0.00 0.00 54.13 53.13 1wap s LEU 38 Cb -0.21 -0.99 0.04 0.00 0.03 0.00 0.00 46.19 45.06 1wap s LEU 38 CO 0.25 0.03 0.84 -1.81 0.23 0.00 0.00 176.35 175.89 1wap s ASP 39 N 0.83 5.16 0.19 2.29 1.01 -1.26 -1.52 116.67 123.37 1wap s ASP 39 Ca -0.11 0.14 -0.32 0.00 0.71 0.00 0.00 52.55 52.98 1wap s ASP 39 Cb -0.15 -0.97 -0.12 0.00 1.01 0.00 0.00 42.92 42.69 1wap s ASP 39 CO 0.01 -1.26 1.72 -0.75 0.21 0.00 0.00 175.17 175.10 1wap s LYS 40 N -4.90 4.13 0.00 8.23 2.20 -1.23 -1.67 119.74 126.51 1wap s LYS 40 Ca 0.58 2.58 0.00 0.00 -0.36 0.00 0.00 55.97 58.77 1wap s LYS 40 Cb -0.10 -3.15 0.00 0.00 -1.51 0.00 0.00 37.83 33.07 1wap s LYS 40 CO 0.40 -0.75 0.00 0.41 -0.36 0.00 0.00 175.35 175.05 1wap n GLY 41 N 3.99 1.53 3.86 5.54 0.00 0.48 -4.96 105.19 115.62 1wap n GLY 41 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 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 -0.57 3.83 -0.02 1.61 2.02 -0.67 -4.81 118.70 120.09 1wap s GLU 42 Ca 0.00 0.75 0.04 0.00 0.02 0.00 0.00 54.97 55.78 1wap s GLU 42 Cb 0.00 -2.21 -0.01 0.00 0.10 0.00 0.00 34.13 32.01 1wap s GLU 42 CO 0.00 -0.24 -0.15 0.08 0.02 0.00 0.00 175.26 174.97 1wap s VAL 43 N -2.64 1.20 -0.03 2.63 1.01 -1.26 -1.13 120.40 120.17 1wap s VAL 43 Ca 0.55 -0.62 0.06 0.00 0.00 0.00 0.00 61.98 61.97 1wap s VAL 43 Cb -0.10 -1.02 -0.01 0.00 0.00 0.00 0.00 36.38 35.25 1wap s VAL 43 CO 0.35 0.35 -0.21 -0.51 0.00 0.00 0.00 175.10 175.08 1wap s ILE 44 N -0.15 1.71 -0.25 2.22 2.07 -0.16 -5.00 121.20 121.63 1wap s ILE 44 Ca 0.02 -0.90 -0.03 0.00 -1.41 0.00 0.00 60.65 58.33 1wap s ILE 44 Cb -0.08 -1.43 0.02 0.00 0.13 0.00 0.00 42.46 41.09 1wap s ILE 44 CO 0.00 0.48 -0.03 -0.63 -1.91 0.00 0.00 174.94 172.85 1wap s ILE 45 N -0.31 3.14 -0.04 2.00 1.09 -1.26 -1.04 121.20 124.78 1wap s ILE 45 Ca 0.03 -0.88 0.03 0.00 -1.10 0.00 0.00 60.65 58.73 1wap s ILE 45 Cb -0.10 -2.57 0.00 0.00 -1.06 0.00 0.00 42.46 38.73 1wap s ILE 45 CO 0.01 0.22 -0.12 0.00 -0.10 0.00 0.00 174.94 174.94 1wap s ALA 46 N 1.38 1.17 0.31 9.38 0.00 -0.65 -4.97 121.76 128.38 1wap s ALA 46 Ca 0.02 -0.47 -0.03 0.00 0.00 0.00 0.00 51.96 51.48 1wap s ALA 46 Cb -0.16 -0.43 -0.04 0.00 0.00 0.00 0.00 23.12 22.48 1wap s ALA 46 CO -0.03 0.18 0.55 -0.65 0.00 0.00 0.00 175.76 175.81 1wap s GLN 47 N 0.24 3.57 0.45 0.00 -0.21 -1.26 -0.95 119.66 121.50 1wap s GLN 47 Ca -0.06 -0.12 -0.21 0.00 0.02 0.00 0.00 55.36 54.99 1wap s GLN 47 Cb -0.11 -2.66 -0.09 0.00 1.00 0.00 0.00 33.01 31.15 1wap s GLN 47 CO 0.02 0.19 1.02 -0.06 -2.12 0.00 0.00 175.29 174.34 1wap s PHE 48 N -2.16 3.14 0.34 0.91 0.08 -0.84 -4.94 117.98 114.50 1wap s PHE 48 Ca 0.42 1.60 -0.04 0.00 0.12 0.00 0.00 56.93 59.04 1wap s PHE 48 Cb -0.10 -3.03 0.02 0.00 -0.57 0.00 0.00 43.02 39.34 1wap s PHE 48 CO 0.32 -0.59 0.50 0.25 -0.10 0.00 0.00 175.22 175.60 1wap n THR 49 N -0.67 0.00 -0.24 0.64 -2.24 -0.49 -4.63 114.28 106.66 1wap n THR 49 Ca 0.08 -1.56 0.08 0.00 -2.27 0.00 0.00 64.05 60.38 1wap n THR 49 Cb 0.52 1.01 0.35 0.00 -2.10 0.00 0.00 70.33 70.11 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 0.75 0.00 -0.78 3.07 -2.02 -3.05 114.58 112.54 1wap h GLU 50 Ca -0.26 -0.04 0.00 0.00 -0.50 0.00 0.00 59.36 58.55 1wap h GLU 50 Cb 1.12 -0.17 0.00 0.00 -0.84 0.00 0.00 28.75 28.86 1wap h GLU 50 CO 0.35 0.49 -1.53 0.72 -1.40 0.00 0.00 179.01 177.64 1wap n HIS 51 N -4.51 0.43 -4.05 4.33 8.25 -1.26 -4.66 115.22 113.75 1wap n HIS 51 Ca 0.14 0.12 -0.33 0.00 -0.26 0.00 0.00 57.72 57.39 1wap n HIS 51 Cb 0.32 -0.69 -0.15 0.00 1.12 0.00 0.00 29.99 30.59 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 -3.44 2.43 0.00 1.59 2.01 -1.15 -1.29 115.64 115.79 1wap s THR 52 Ca -0.04 -0.98 0.00 0.00 0.31 0.00 0.00 61.69 60.98 1wap s THR 52 Cb 0.12 -2.13 0.00 0.00 0.01 0.00 0.00 72.50 70.50 1wap s THR 52 CO 0.85 0.38 0.63 -1.54 -0.69 0.00 0.00 174.62 174.26 1wap n SER 53 N 4.63 1.26 -3.71 3.53 3.41 -1.00 -1.39 113.62 120.35 1wap n SER 53 Ca -0.19 -1.29 -0.14 0.00 -0.26 0.00 0.00 58.87 56.99 1wap n SER 53 Cb 0.49 0.00 -0.08 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 -0.29 -1.04 -0.08 7.33 0.00 -1.24 -5.02 121.76 121.42 1wap s ALA 54 Ca 0.00 0.74 0.02 0.00 0.00 0.00 0.00 51.96 52.71 1wap s ALA 54 Cb 0.00 -0.14 0.02 0.00 0.00 0.00 0.00 23.12 23.00 1wap s ALA 54 CO 0.00 -0.27 -0.11 0.42 0.00 0.00 0.00 175.76 175.80 1wap s ILE 55 N -0.91 1.12 -0.07 0.00 1.01 -1.26 -1.02 121.20 120.07 1wap s ILE 55 Ca -0.10 -0.43 0.03 0.00 0.00 0.00 0.00 60.65 60.15 1wap s ILE 55 Cb -0.04 -1.05 -0.02 0.00 0.01 0.00 0.00 42.46 41.36 1wap s ILE 55 CO 0.04 0.36 -0.15 -0.75 0.00 0.00 0.00 174.94 174.45 1wap s LYS 56 N 0.96 2.70 -0.13 2.79 2.20 -0.36 -4.96 119.74 122.93 1wap s LYS 56 Ca -0.09 -0.71 0.00 0.00 -0.36 0.00 0.00 55.97 54.81 1wap s LYS 56 Cb -0.15 -2.42 -0.01 0.00 -1.51 0.00 0.00 37.83 33.74 1wap s LYS 56 CO 0.00 0.51 -0.14 0.08 -0.36 0.00 0.00 175.35 175.44 1wap s VAL 57 N -0.45 2.87 -0.11 4.02 1.01 -1.26 -1.07 120.40 125.42 1wap s VAL 57 Ca 0.05 -0.72 0.01 0.00 0.00 0.00 0.00 61.98 61.32 1wap s VAL 57 Cb -0.12 -2.20 0.02 0.00 0.00 0.00 0.00 36.38 34.08 1wap s VAL 57 CO 0.02 0.52 -0.12 -0.60 0.00 0.00 0.00 175.10 174.92 1wap s ARG 58 N 0.46 1.92 0.00 2.72 3.52 -0.74 -4.98 118.95 121.85 1wap s ARG 58 Ca -0.10 -0.43 0.00 0.00 -0.13 0.00 0.00 55.73 55.06 1wap s ARG 58 Cb -0.16 -1.76 0.00 0.00 -1.56 0.00 0.00 34.95 31.47 1wap s ARG 58 CO 0.05 -0.16 0.00 0.41 -0.81 0.00 0.00 175.30 174.79 1wap n GLY 59 N 4.53 2.67 3.67 8.12 0.00 -1.25 -1.34 105.19 121.59 1wap n GLY 59 Ca -0.17 -2.01 -0.43 0.00 0.00 0.00 0.00 46.02 43.42 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 -2.64 4.26 -0.05 1.61 2.12 -1.04 -4.09 118.70 118.87 1wap s GLU 60 Ca 0.00 1.80 -0.30 0.00 0.36 0.00 0.00 54.97 56.84 1wap s GLU 60 Cb 0.00 -3.72 0.07 0.00 0.26 0.00 0.00 34.13 30.74 1wap s GLU 60 CO 0.00 -0.65 0.65 0.00 -0.54 0.00 0.00 175.26 174.72 1wap s ALA 61 N 3.11 -1.69 -0.20 6.30 0.00 -0.95 -0.32 121.76 128.01 1wap s ALA 61 Ca 0.60 1.23 -0.14 0.00 0.00 0.00 0.00 51.96 53.65 1wap s ALA 61 Cb -0.26 0.01 -0.04 0.00 0.00 0.00 0.00 23.12 22.83 1wap s ALA 61 CO 0.21 -0.36 0.31 -1.17 0.00 0.00 0.00 175.76 174.75 1wap s LEU 62 N -1.21 4.16 -0.10 0.00 2.96 -0.54 -1.33 118.68 122.62 1wap s LEU 62 Ca -0.11 0.40 0.02 0.00 -0.22 0.00 0.00 54.13 54.22 1wap s LEU 62 Cb -0.00 -2.37 -0.02 0.00 0.50 0.00 0.00 46.19 44.30 1wap s LEU 62 CO 0.09 -0.00 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.33 1wap s ILE 63 N 1.08 2.79 -0.04 6.68 1.01 0.19 -1.00 121.20 131.90 1wap s ILE 63 Ca 0.15 -0.78 0.07 0.00 0.00 0.00 0.00 60.65 60.09 1wap s ILE 63 Cb -0.14 -2.12 -0.02 0.00 0.01 0.00 0.00 42.46 40.20 1wap s ILE 63 CO 0.06 0.55 -0.25 -1.10 0.00 0.00 0.00 174.94 174.20 1wap s GLN 64 N 0.01 2.36 0.32 2.79 -0.21 0.31 -1.61 119.66 123.62 1wap s GLN 64 Ca -0.05 -0.90 0.01 0.00 0.02 0.00 0.00 55.36 54.43 1wap s GLN 64 Cb -0.15 -2.12 -0.01 0.00 1.00 0.00 0.00 33.01 31.73 1wap s GLN 64 CO 0.05 0.47 0.37 0.95 -2.12 0.00 0.00 175.29 175.01 1wap s THR 65 N -0.39 0.00 0.63 -0.19 -4.23 -0.20 -1.39 115.64 109.87 1wap s THR 65 Ca 0.03 -1.78 0.27 0.00 -1.18 0.00 0.00 61.69 59.04 1wap s THR 65 Cb -0.12 -2.55 0.32 0.00 1.34 0.00 0.00 72.50 71.49 1wap s THR 65 CO 0.01 0.00 1.80 0.00 -0.54 0.00 0.00 174.62 175.90 1wap h ALA 66 N 2.18 1.89 -0.09 3.99 0.00 -2.01 -1.01 119.26 124.21 1wap h ALA 66 Ca -0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1wap h ALA 66 Cb 1.24 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1wap h ALA 66 CO 0.39 -0.66 0.00 0.66 0.00 0.00 0.00 179.25 179.65 1wap n TYR 67 N -3.27 0.09 0.00 0.00 4.01 -1.26 -5.08 117.16 111.64 1wap n TYR 67 Ca 0.05 -0.04 0.00 0.00 -0.16 0.00 0.00 57.90 57.74 1wap n TYR 67 Cb 0.64 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.67 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 1.30 0.22 3.83 2.72 0.00 -0.39 -5.06 105.19 107.82 1wap n GLY 68 Ca 0.16 -2.17 -0.32 0.00 0.00 0.00 0.00 46.02 43.70 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 3.16 -0.04 1.61 2.02 -1.26 -1.03 118.70 123.16 1wap s GLU 69 Ca 0.00 -0.51 -0.03 0.00 0.02 0.00 0.00 54.97 54.45 1wap s GLU 69 Cb 0.00 -2.90 0.01 0.00 0.10 0.00 0.00 34.13 31.34 1wap s GLU 69 CO 0.00 0.62 0.10 1.41 0.02 0.00 0.00 175.26 177.41 1wap s MET 70 N -2.16 0.11 -0.15 1.61 -2.45 -0.64 -5.02 119.30 110.61 1wap s MET 70 Ca 0.29 0.16 -0.03 0.00 -1.25 0.00 0.00 55.69 54.86 1wap s MET 70 Cb -0.12 0.03 -0.02 0.00 1.25 0.00 0.00 34.83 35.97 1wap s MET 70 CO 0.21 -0.03 -0.06 0.21 1.05 0.00 0.00 175.02 176.40 1wap s LYS 71 N 0.15 3.58 0.25 4.11 2.20 -1.26 -0.64 119.74 128.13 1wap s LYS 71 Ca -0.01 -0.57 -0.14 0.00 -0.36 0.00 0.00 55.97 54.89 1wap s LYS 71 Cb -0.02 -2.84 -0.08 0.00 -1.51 0.00 0.00 37.83 33.38 1wap s LYS 71 CO -0.00 0.21 0.65 -1.54 -0.36 0.00 0.00 175.35 174.31 1wap s SER 72 N 0.42 6.77 0.40 1.43 1.04 -0.44 -4.96 113.70 118.36 1wap s SER 72 Ca -0.06 1.16 0.03 0.00 0.48 0.00 0.00 55.95 57.56 1wap s SER 72 Cb -0.15 -2.32 -0.01 0.00 0.10 0.00 0.00 66.02 63.65 1wap s SER 72 CO 0.04 -0.09 0.58 -1.61 0.98 0.00 0.00 173.24 173.14 1wap s GLU 73 N -2.64 3.08 0.37 4.02 0.41 -1.26 -2.25 118.70 120.43 1wap s GLU 73 Ca 0.48 -0.73 -0.26 0.00 -0.41 0.00 0.00 54.97 54.05 1wap s GLU 73 Cb -0.12 -2.68 -0.12 0.00 -1.78 0.00 0.00 34.13 29.43 1wap s GLU 73 CO 0.19 -0.13 1.05 1.63 -0.49 0.00 0.00 175.26 177.52 1wap n LYS 74 N -1.88 1.48 0.00 1.61 5.02 -1.26 -2.51 118.16 120.62 1wap n LYS 74 Ca 0.01 0.52 0.12 0.00 -2.02 0.00 0.00 58.31 56.94 1wap n LYS 74 Cb 0.58 -2.03 0.69 0.00 -0.02 0.00 0.00 35.03 34.25 1wap n LYS 74 CO 0.00 0.00 0.00 0.36 -0.52 0.00 0.00 177.40 177.24