#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 1.19 0.07 -0.67 -0.12 -1.26 -1.94 117.98 115.25 1wap s PHE 9 Ca 0.00 -1.39 0.07 0.00 -0.05 0.00 0.00 56.93 55.55 1wap s PHE 9 Cb 0.00 -0.57 -0.03 0.00 -0.63 0.00 0.00 43.02 41.79 1wap s PHE 9 CO 0.00 -0.65 -0.18 0.14 -0.05 0.00 0.00 175.22 174.48 1wap s VAL 10 N -4.13 1.41 -0.18 -2.49 -7.23 -0.07 -4.72 120.40 102.99 1wap s VAL 10 Ca 0.39 -1.31 -0.05 0.00 -1.81 0.00 0.00 61.98 59.20 1wap s VAL 10 Cb 0.07 -1.29 -0.03 0.00 0.56 0.00 0.00 36.38 35.69 1wap s VAL 10 CO 0.13 -0.05 0.01 -0.69 -0.31 0.00 0.00 175.10 174.19 1wap s VAL 11 N -1.07 4.21 -0.07 1.32 1.01 -0.30 -1.41 120.40 124.09 1wap s VAL 11 Ca 0.03 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.79 1wap s VAL 11 Cb -0.09 -2.89 0.02 0.00 0.00 0.00 0.00 36.38 33.42 1wap s VAL 11 CO 0.03 0.45 -0.07 -0.63 0.00 0.00 0.00 175.10 174.88 1wap s ILE 12 N 0.63 0.82 -0.19 2.22 1.01 0.12 -1.20 121.20 124.60 1wap s ILE 12 Ca 0.00 -0.24 -0.02 0.00 0.00 0.00 0.00 60.65 60.39 1wap s ILE 12 Cb -0.14 -0.82 0.00 0.00 0.01 0.00 0.00 42.46 41.51 1wap s ILE 12 CO 0.02 0.30 -0.11 -0.75 0.00 0.00 0.00 174.94 174.40 1wap s LYS 13 N 1.15 3.24 0.02 2.79 2.20 0.53 -0.91 119.74 128.76 1wap s LYS 13 Ca -0.06 -0.70 -0.30 0.00 -0.36 0.00 0.00 55.97 54.54 1wap s LYS 13 Cb -0.14 -2.81 -0.05 0.00 -1.51 0.00 0.00 37.83 33.32 1wap s LYS 13 CO -0.01 -0.15 1.20 0.00 -0.36 0.00 0.00 175.35 176.03 1wap s ALA 14 N 1.27 3.43 -0.17 3.13 0.00 -0.33 -0.60 121.76 128.48 1wap s ALA 14 Ca 0.03 0.77 0.21 0.00 0.00 0.00 0.00 51.96 52.97 1wap s ALA 14 Cb -0.14 -3.47 -0.31 0.00 0.00 0.00 0.00 23.12 19.19 1wap s ALA 14 CO -0.05 -0.56 0.53 0.28 0.00 0.00 0.00 175.76 175.96 1wap n VAL 15 N 4.18 0.00 -4.23 0.00 0.31 -0.16 -0.46 118.33 117.97 1wap n VAL 15 Ca 0.10 -0.42 -0.15 0.00 -0.01 0.00 0.00 64.34 63.87 1wap n VAL 15 Cb 0.46 0.16 -0.09 0.00 -0.91 0.00 0.00 33.84 33.46 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 -3.40 1.38 0.72 5.55 -1.05 -1.17 -4.70 118.70 116.03 1wap s GLU 16 Ca -0.05 -1.75 -0.11 0.00 -0.15 0.00 0.00 54.97 52.90 1wap s GLU 16 Cb 0.14 0.25 0.02 0.00 -0.44 0.00 0.00 34.13 34.10 1wap s GLU 16 CO 0.88 -0.46 1.07 -0.51 0.95 0.00 0.00 175.26 177.19 1wap s ASP 17 N -3.23 5.11 -1.72 0.83 1.01 -1.26 -3.32 116.67 114.08 1wap s ASP 17 Ca 0.39 1.69 0.00 0.00 0.71 0.00 0.00 52.55 55.35 1wap s ASP 17 Cb 0.06 -2.51 0.00 0.00 1.01 0.00 0.00 42.92 41.48 1wap s ASP 17 CO 0.17 -1.63 0.00 0.61 0.21 0.00 0.00 175.17 174.53 1wap n GLY 18 N -1.70 1.60 3.69 0.21 0.00 -1.16 -4.88 105.19 102.96 1wap n GLY 18 Ca 0.08 -0.14 -0.40 0.00 0.00 0.00 0.00 46.02 45.56 1wap n GLY 18 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1wap n VAL 19 N -2.44 2.89 -4.66 1.61 0.31 -0.85 -4.75 118.33 110.43 1wap n VAL 19 Ca -0.16 -0.50 -0.33 0.00 -0.01 0.00 0.00 64.34 63.34 1wap n VAL 19 Cb 0.58 -1.51 -0.14 0.00 -0.91 0.00 0.00 33.84 31.85 1wap n VAL 19 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 1wap s ASN 20 N -0.69 4.08 -0.34 4.52 -0.87 0.85 -0.89 114.94 121.60 1wap s ASN 20 Ca 0.64 -0.32 -0.05 0.00 -1.57 0.00 0.00 52.86 51.56 1wap s ASN 20 Cb -0.48 -1.63 0.05 0.00 -0.02 0.00 0.00 41.25 39.16 1wap s ASN 20 CO 0.55 0.15 0.09 -0.69 -2.57 0.00 0.00 177.10 174.63 1wap s VAL 21 N 0.46 3.55 -0.18 1.60 1.01 -0.21 -1.70 120.40 124.93 1wap s VAL 21 Ca -0.09 -1.27 -0.04 0.00 0.00 0.00 0.00 61.98 60.58 1wap s VAL 21 Cb -0.16 -3.05 -0.02 0.00 0.00 0.00 0.00 36.38 33.15 1wap s VAL 21 CO 0.04 -0.20 -0.02 -0.63 0.00 0.00 0.00 175.10 174.28 1wap s ILE 22 N 1.34 3.81 -0.19 2.22 1.01 0.28 -0.17 121.20 129.51 1wap s ILE 22 Ca -0.02 -0.37 -0.14 0.00 0.00 0.00 0.00 60.65 60.12 1wap s ILE 22 Cb -0.20 -2.70 -0.04 0.00 0.01 0.00 0.00 42.46 39.52 1wap s ILE 22 CO 0.01 0.45 0.31 -0.83 0.00 0.00 0.00 174.94 174.89 1wap s GLY 23 N 0.81 2.13 -0.12 6.18 0.00 -0.35 -1.10 107.32 114.88 1wap s GLY 23 Ca -0.01 -0.55 -0.06 0.00 0.00 0.00 0.00 44.72 44.11 1wap s GLY 23 CO 0.02 0.57 0.10 1.08 0.00 0.00 0.00 173.10 174.87 1wap s LEU 24 N 0.87 4.13 0.27 0.66 1.02 -0.34 -1.06 118.68 124.24 1wap s LEU 24 Ca 0.16 0.36 -0.30 0.00 0.02 0.00 0.00 54.13 54.37 1wap s LEU 24 Cb -0.14 -2.00 -0.10 0.00 0.02 0.00 0.00 46.19 43.98 1wap s LEU 24 CO 0.05 0.38 1.39 0.42 0.02 0.00 0.00 176.35 178.62 1wap s THR 25 N -0.89 2.71 0.28 5.49 -4.23 -0.46 -2.09 115.64 116.44 1wap s THR 25 Ca 0.14 0.63 -0.29 0.00 -1.18 0.00 0.00 61.69 60.99 1wap s THR 25 Cb -0.12 -3.40 -0.09 0.00 1.34 0.00 0.00 72.50 70.23 1wap s THR 25 CO 0.03 0.12 1.00 -0.60 -0.54 0.00 0.00 174.62 174.63 1wap s ARG 26 N -0.79 4.70 0.00 3.99 3.52 -0.78 -4.57 118.95 125.03 1wap s ARG 26 Ca 0.56 1.58 0.00 0.00 -0.13 0.00 0.00 55.73 57.74 1wap s ARG 26 Cb -0.41 -3.14 0.00 0.00 -1.56 0.00 0.00 34.95 29.84 1wap s ARG 26 CO 0.46 0.33 0.00 0.41 -0.81 0.00 0.00 175.30 175.69 1wap n GLY 27 N 1.19 0.56 0.34 8.12 0.00 -1.26 -4.83 105.19 109.31 1wap n GLY 27 Ca -0.01 -2.15 -0.05 0.00 0.00 0.00 0.00 46.02 43.82 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 -3.30 2.61 1.35 -2.05 -3.42 112.91 109.34 1wap h THR 28 Ca 0.00 -0.78 -0.56 0.00 -0.55 0.00 0.00 66.41 64.52 1wap h THR 28 Cb 0.00 0.33 -0.04 0.00 -1.73 0.00 0.00 68.15 66.71 1wap h THR 28 CO 0.00 0.32 -0.17 -1.81 -0.25 0.00 0.00 175.52 173.61 1wap s ASP 29 N -6.39 6.65 -0.28 5.36 1.01 -1.26 -5.08 116.67 116.68 1wap s ASP 29 Ca -0.12 0.88 0.02 0.00 0.71 0.00 0.00 52.55 54.04 1wap s ASP 29 Cb 0.16 -2.21 0.08 0.00 1.01 0.00 0.00 42.92 41.96 1wap s ASP 29 CO 0.83 0.04 -0.01 -0.89 0.21 0.00 0.00 175.17 175.35 1wap s THR 30 N -1.62 1.75 0.14 -1.27 2.01 -1.26 -4.59 115.64 110.80 1wap s THR 30 Ca 0.41 -1.64 -0.02 0.00 0.31 0.00 0.00 61.69 60.75 1wap s THR 30 Cb -0.13 -2.11 -0.04 0.00 0.01 0.00 0.00 72.50 70.24 1wap s THR 30 CO 0.21 -0.32 0.09 -1.59 -0.69 0.00 0.00 174.62 172.32 1wap s LYS 31 N 1.24 0.97 -0.11 4.92 -2.85 -1.26 -4.93 119.74 117.73 1wap s LYS 31 Ca 0.01 -1.42 -0.30 0.00 -1.00 0.00 0.00 55.97 53.27 1wap s LYS 31 Cb -0.19 0.26 -0.02 0.00 -2.06 0.00 0.00 37.83 35.82 1wap s LYS 31 CO -0.09 -0.29 1.21 -0.06 0.10 0.00 0.00 175.35 176.21 1wap s PHE 32 N -4.04 3.08 -0.08 1.78 0.08 -1.26 -1.36 117.98 116.18 1wap s PHE 32 Ca 0.24 1.16 0.22 0.00 0.12 0.00 0.00 56.93 58.68 1wap s PHE 32 Cb 0.07 -3.44 -0.29 0.00 -0.57 0.00 0.00 43.02 38.80 1wap s PHE 32 CO 0.02 -1.38 0.57 -2.39 -0.10 0.00 0.00 175.22 171.95 1wap n HIS 33 N 5.76 0.14 -3.63 0.36 1.44 -0.22 -4.95 115.22 114.13 1wap n HIS 33 Ca 0.12 0.04 -0.11 0.00 -2.01 0.00 0.00 57.72 55.76 1wap n HIS 33 Cb 0.46 -0.56 -0.07 0.00 0.12 0.00 0.00 29.99 29.94 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 -3.49 -0.73 -0.27 -1.40 5.65 -1.24 -5.02 115.29 108.79 1wap s HIS 34 Ca -0.07 1.71 0.02 0.00 0.25 0.00 0.00 55.06 56.97 1wap s HIS 34 Cb 0.13 0.35 0.06 0.00 -1.18 0.00 0.00 32.58 31.95 1wap s HIS 34 CO 0.89 -0.36 -0.09 0.45 -0.65 0.00 0.00 174.74 174.99 1wap s SER 35 N 0.59 4.53 -0.25 9.88 0.15 -1.26 -1.21 113.70 126.12 1wap s SER 35 Ca -0.01 -1.38 -0.21 0.00 0.70 0.00 0.00 55.95 55.04 1wap s SER 35 Cb -0.05 -1.58 -0.02 0.00 -1.71 0.00 0.00 66.02 62.67 1wap s SER 35 CO -0.05 -0.20 0.68 -0.70 1.20 0.00 0.00 173.24 174.16 1wap s GLU 36 N 1.13 4.12 0.18 5.44 2.56 0.76 -4.89 118.70 127.99 1wap s GLU 36 Ca -0.08 0.63 -0.29 0.00 0.00 0.00 0.00 54.97 55.23 1wap s GLU 36 Cb -0.20 -3.65 -0.08 0.00 2.00 0.00 0.00 34.13 32.20 1wap s GLU 36 CO -0.04 -0.45 0.90 -1.59 -0.56 0.00 0.00 175.26 173.52 1wap s LYS 37 N 2.59 4.74 -0.17 4.30 -2.85 -1.26 -1.04 119.74 126.05 1wap s LYS 37 Ca 0.28 1.39 0.01 0.00 -1.00 0.00 0.00 55.97 56.65 1wap s LYS 37 Cb -0.15 -3.31 0.02 0.00 -2.06 0.00 0.00 37.83 32.33 1wap s LYS 37 CO 0.08 0.44 -0.18 -0.51 0.10 0.00 0.00 175.35 175.29 1wap s LEU 38 N -0.82 2.03 0.56 2.77 1.43 -0.07 -4.97 118.68 119.62 1wap s LEU 38 Ca 0.41 -0.63 -0.08 0.00 -1.03 0.00 0.00 54.13 52.81 1wap s LEU 38 Cb -0.24 -1.38 -0.03 0.00 0.03 0.00 0.00 46.19 44.56 1wap s LEU 38 CO 0.30 -0.03 0.92 -1.81 0.23 0.00 0.00 176.35 175.96 1wap s ASP 39 N 1.35 6.12 0.09 2.29 1.01 -1.26 -2.01 116.67 124.26 1wap s ASP 39 Ca 0.04 1.11 -0.36 0.00 0.71 0.00 0.00 52.55 54.05 1wap s ASP 39 Cb -0.13 -2.26 -0.17 0.00 1.01 0.00 0.00 42.92 41.37 1wap s ASP 39 CO -0.12 -0.80 1.33 1.17 0.21 0.00 0.00 175.17 176.97 1wap n LYS 40 N -2.54 1.16 0.00 8.23 4.81 -1.21 -1.43 118.16 127.19 1wap n LYS 40 Ca 0.04 0.42 0.00 0.00 -0.87 0.00 0.00 58.31 57.89 1wap n LYS 40 Cb 0.55 -2.05 0.00 0.00 0.02 0.00 0.00 35.03 33.55 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 2.50 2.57 3.82 3.14 0.00 0.39 -4.98 105.19 112.63 1wap n GLY 41 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.26 3.50 -0.06 1.61 2.02 -0.51 -4.82 118.70 120.18 1wap s GLU 42 Ca 0.00 1.09 0.03 0.00 0.02 0.00 0.00 54.97 56.11 1wap s GLU 42 Cb 0.00 -2.06 0.01 0.00 0.10 0.00 0.00 34.13 32.18 1wap s GLU 42 CO 0.00 -0.65 -0.13 0.08 0.02 0.00 0.00 175.26 174.58 1wap s VAL 43 N -2.58 1.16 -0.03 2.63 1.01 -1.26 -1.19 120.40 120.14 1wap s VAL 43 Ca 0.61 -0.51 0.07 0.00 0.00 0.00 0.00 61.98 62.15 1wap s VAL 43 Cb -0.14 -1.05 -0.02 0.00 0.00 0.00 0.00 36.38 35.18 1wap s VAL 43 CO 0.37 0.36 -0.25 -0.51 0.00 0.00 0.00 175.10 175.07 1wap s ILE 44 N 0.51 1.98 -0.36 2.22 2.07 -0.09 -4.99 121.20 122.54 1wap s ILE 44 Ca -0.12 -1.06 -0.06 0.00 -1.41 0.00 0.00 60.65 58.00 1wap s ILE 44 Cb -0.14 -1.66 0.05 0.00 0.13 0.00 0.00 42.46 40.84 1wap s ILE 44 CO 0.03 0.56 0.13 -0.63 -1.91 0.00 0.00 174.94 173.13 1wap s ILE 45 N -0.43 3.79 -0.04 2.00 1.09 -1.26 -0.70 121.20 125.65 1wap s ILE 45 Ca 0.05 -1.26 0.06 0.00 -1.10 0.00 0.00 60.65 58.40 1wap s ILE 45 Cb -0.11 -3.21 -0.01 0.00 -1.06 0.00 0.00 42.46 38.07 1wap s ILE 45 CO 0.01 -0.27 -0.22 0.00 -0.10 0.00 0.00 174.94 174.35 1wap s ALA 46 N 1.38 1.91 0.33 9.38 0.00 -0.50 -4.94 121.76 129.32 1wap s ALA 46 Ca -0.00 -0.94 -0.01 0.00 0.00 0.00 0.00 51.96 51.02 1wap s ALA 46 Cb -0.20 -0.56 -0.04 0.00 0.00 0.00 0.00 23.12 22.32 1wap s ALA 46 CO 0.02 0.40 0.55 -0.65 0.00 0.00 0.00 175.76 176.08 1wap s GLN 47 N -0.26 3.51 0.36 0.00 -0.21 -1.26 -0.90 119.66 120.90 1wap s GLN 47 Ca 0.01 -0.27 -0.25 0.00 0.02 0.00 0.00 55.36 54.88 1wap s GLN 47 Cb -0.11 -2.66 -0.10 0.00 1.00 0.00 0.00 33.01 31.13 1wap s GLN 47 CO 0.02 0.16 0.96 -0.06 -2.12 0.00 0.00 175.29 174.25 1wap s PHE 48 N -2.27 3.55 0.17 0.91 0.08 -0.82 -4.93 117.98 114.67 1wap s PHE 48 Ca 0.41 1.73 -0.00 0.00 0.12 0.00 0.00 56.93 59.18 1wap s PHE 48 Cb -0.10 -2.94 0.00 0.00 -0.57 0.00 0.00 43.02 39.41 1wap s PHE 48 CO 0.35 0.02 0.22 0.25 -0.10 0.00 0.00 175.22 175.96 1wap n THR 49 N 0.23 0.00 -0.08 0.64 -2.24 -0.31 -4.64 114.28 107.89 1wap n THR 49 Ca 0.03 -0.89 0.09 0.00 -2.27 0.00 0.00 64.05 61.01 1wap n THR 49 Cb 0.51 0.53 0.45 0.00 -2.10 0.00 0.00 70.33 69.72 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 0.50 0.00 -0.78 3.07 -2.02 -2.96 114.58 112.39 1wap h GLU 50 Ca -0.13 -0.03 -0.05 0.00 -0.50 0.00 0.00 59.36 58.66 1wap h GLU 50 Cb 0.57 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.36 1wap h GLU 50 CO 0.18 0.33 -2.00 0.72 -1.40 0.00 0.00 179.01 176.83 1wap n HIS 51 N -4.47 0.00 -4.08 4.33 8.25 -1.26 -4.65 115.22 113.34 1wap n HIS 51 Ca 0.08 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.21 1wap n HIS 51 Cb 0.26 -0.54 -0.16 0.00 1.12 0.00 0.00 29.99 30.67 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 -3.32 2.26 0.00 1.59 2.01 -1.12 -1.86 115.64 115.20 1wap s THR 52 Ca -0.08 -1.01 0.00 0.00 0.31 0.00 0.00 61.69 60.91 1wap s THR 52 Cb 0.12 -2.03 0.00 0.00 0.01 0.00 0.00 72.50 70.60 1wap s THR 52 CO 0.86 0.41 0.49 -1.54 -0.69 0.00 0.00 174.62 174.15 1wap n SER 53 N 4.61 0.97 -3.68 3.53 3.41 -0.89 -1.16 113.62 120.42 1wap n SER 53 Ca -0.19 -1.05 -0.15 0.00 -0.26 0.00 0.00 58.87 57.22 1wap n SER 53 Cb 0.49 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.36 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 -0.05 -1.16 -0.04 7.33 0.00 -1.25 -5.03 121.76 121.56 1wap s ALA 54 Ca 0.00 0.83 0.01 0.00 0.00 0.00 0.00 51.96 52.80 1wap s ALA 54 Cb 0.00 -0.11 0.02 0.00 0.00 0.00 0.00 23.12 23.03 1wap s ALA 54 CO 0.00 -0.29 -0.05 0.42 0.00 0.00 0.00 175.76 175.85 1wap s ILE 55 N -0.98 0.54 -0.08 0.00 1.01 -1.26 -1.20 121.20 119.23 1wap s ILE 55 Ca -0.10 -0.14 0.03 0.00 0.00 0.00 0.00 60.65 60.44 1wap s ILE 55 Cb -0.03 -0.56 -0.02 0.00 0.01 0.00 0.00 42.46 41.86 1wap s ILE 55 CO 0.05 0.22 -0.17 -0.75 0.00 0.00 0.00 174.94 174.29 1wap s LYS 56 N 0.85 2.82 -0.08 2.79 2.20 -0.26 -4.96 119.74 123.11 1wap s LYS 56 Ca -0.12 -0.76 0.05 0.00 -0.36 0.00 0.00 55.97 54.78 1wap s LYS 56 Cb -0.14 -2.39 -0.01 0.00 -1.51 0.00 0.00 37.83 33.78 1wap s LYS 56 CO 0.00 0.40 -0.24 0.08 -0.36 0.00 0.00 175.35 175.24 1wap s VAL 57 N -0.18 2.09 -0.06 4.02 1.01 -1.26 -0.55 120.40 125.47 1wap s VAL 57 Ca -0.01 -1.04 -0.00 0.00 0.00 0.00 0.00 61.98 60.93 1wap s VAL 57 Cb -0.13 -1.77 0.03 0.00 0.00 0.00 0.00 36.38 34.50 1wap s VAL 57 CO 0.03 0.57 -0.01 -0.60 0.00 0.00 0.00 175.10 175.09 1wap s ARG 58 N 0.03 0.63 0.00 2.72 3.52 -0.69 -4.99 118.95 120.18 1wap s ARG 58 Ca -0.09 0.04 0.00 0.00 -0.13 0.00 0.00 55.73 55.55 1wap s ARG 58 Cb -0.15 -0.87 0.00 0.00 -1.56 0.00 0.00 34.95 32.37 1wap s ARG 58 CO 0.06 -0.22 0.00 0.41 -0.81 0.00 0.00 175.30 174.74 1wap n GLY 59 N 4.70 1.95 3.67 8.12 0.00 -1.26 -0.11 105.19 122.26 1wap n GLY 59 Ca -0.15 -2.21 -0.41 0.00 0.00 0.00 0.00 46.02 43.25 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 -1.63 4.29 0.02 1.61 2.12 -1.24 -3.62 118.70 120.24 1wap s GLU 60 Ca 0.00 1.02 -0.28 0.00 0.36 0.00 0.00 54.97 56.08 1wap s GLU 60 Cb 0.00 -3.58 0.08 0.00 0.26 0.00 0.00 34.13 30.90 1wap s GLU 60 CO 0.00 -0.34 0.74 0.00 -0.54 0.00 0.00 175.26 175.11 1wap s ALA 61 N 2.21 -1.74 -0.15 6.30 0.00 -0.78 -0.99 121.76 126.61 1wap s ALA 61 Ca 0.38 1.01 -0.06 0.00 0.00 0.00 0.00 51.96 53.29 1wap s ALA 61 Cb -0.16 0.29 -0.04 0.00 0.00 0.00 0.00 23.12 23.20 1wap s ALA 61 CO 0.12 -0.56 0.07 -1.17 0.00 0.00 0.00 175.76 174.22 1wap s LEU 62 N -1.96 3.89 -0.09 0.00 2.96 0.23 -1.36 118.68 122.35 1wap s LEU 62 Ca -0.03 0.17 0.05 0.00 -0.22 0.00 0.00 54.13 54.10 1wap s LEU 62 Cb -0.01 -1.96 -0.00 0.00 0.50 0.00 0.00 46.19 44.72 1wap s LEU 62 CO -0.03 0.26 -0.24 -0.63 -1.32 0.00 0.00 176.35 174.39 1wap s ILE 63 N -0.15 2.06 -0.09 6.68 1.01 0.58 -0.35 121.20 130.94 1wap s ILE 63 Ca 0.07 -1.03 0.04 0.00 0.00 0.00 0.00 60.65 59.74 1wap s ILE 63 Cb -0.12 -1.77 -0.00 0.00 0.01 0.00 0.00 42.46 40.58 1wap s ILE 63 CO 0.01 0.56 -0.24 -1.10 0.00 0.00 0.00 174.94 174.17 1wap s GLN 64 N 0.21 2.95 0.25 2.79 -0.21 -0.34 -1.25 119.66 124.05 1wap s GLN 64 Ca -0.15 -0.88 0.05 0.00 0.02 0.00 0.00 55.36 54.40 1wap s GLN 64 Cb -0.17 -2.28 -0.02 0.00 1.00 0.00 0.00 33.01 31.55 1wap s GLN 64 CO 0.08 0.22 0.19 0.25 -2.12 0.00 0.00 175.29 173.90 1wap n THR 65 N 3.40 0.00 0.32 -0.19 -2.24 -0.66 -1.15 114.28 113.76 1wap n THR 65 Ca -0.19 -1.74 0.20 0.00 -2.27 0.00 0.00 64.05 60.05 1wap n THR 65 Cb 0.53 0.83 1.06 0.00 -2.10 0.00 0.00 70.33 70.64 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 1.72 1.20 -0.52 6.98 0.00 -2.01 -2.47 119.26 124.16 1wap h ALA 66 Ca -0.18 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1wap h ALA 66 Cb 0.86 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1wap h ALA 66 CO 0.27 -0.12 0.00 0.66 0.00 0.00 0.00 179.25 180.05 1wap n TYR 67 N -3.12 1.09 0.00 0.00 4.01 -1.26 -5.08 117.16 112.79 1wap n TYR 67 Ca -0.02 -0.62 0.00 0.00 -0.16 0.00 0.00 57.90 57.10 1wap n TYR 67 Cb 0.18 -0.18 0.00 0.00 -0.31 0.00 0.00 39.34 39.04 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 0.75 0.29 3.71 2.72 0.00 -0.93 -5.06 105.19 106.66 1wap n GLY 68 Ca 0.21 -2.26 -0.29 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 2.61 -0.05 1.61 2.02 -1.26 -1.66 118.70 121.97 1wap s GLU 69 Ca 0.00 -0.86 -0.07 0.00 0.02 0.00 0.00 54.97 54.06 1wap s GLU 69 Cb 0.00 -2.55 0.01 0.00 0.10 0.00 0.00 34.13 31.69 1wap s GLU 69 CO 0.00 0.53 0.18 1.41 0.02 0.00 0.00 175.26 177.40 1wap s MET 70 N -2.48 0.32 -0.12 1.61 1.75 -0.38 -5.02 119.30 114.97 1wap s MET 70 Ca 0.27 0.06 0.02 0.00 -1.25 0.00 0.00 55.69 54.79 1wap s MET 70 Cb -0.11 0.14 0.00 0.00 2.84 0.00 0.00 34.83 37.70 1wap s MET 70 CO 0.19 -0.06 -0.20 0.21 -0.65 0.00 0.00 175.02 174.51 1wap s LYS 71 N -0.38 3.12 0.16 4.11 2.20 -1.26 -0.30 119.74 127.38 1wap s LYS 71 Ca -0.05 -0.82 -0.10 0.00 -0.36 0.00 0.00 55.97 54.64 1wap s LYS 71 Cb -0.03 -2.44 -0.07 0.00 -1.51 0.00 0.00 37.83 33.78 1wap s LYS 71 CO 0.01 0.10 0.49 -1.54 -0.36 0.00 0.00 175.35 174.05 1wap s SER 72 N 0.56 6.66 0.33 1.43 1.04 -0.46 -4.98 113.70 118.28 1wap s SER 72 Ca -0.12 0.89 0.08 0.00 0.48 0.00 0.00 55.95 57.27 1wap s SER 72 Cb -0.17 -2.21 -0.04 0.00 0.10 0.00 0.00 66.02 63.71 1wap s SER 72 CO 0.04 0.05 0.20 -1.61 0.98 0.00 0.00 173.24 172.89 1wap s GLU 73 N -2.37 2.54 0.00 4.02 0.41 -1.24 -1.87 118.70 120.21 1wap s GLU 73 Ca 0.41 -1.41 0.00 0.00 -0.41 0.00 0.00 54.97 53.56 1wap s GLU 73 Cb -0.13 -2.32 0.00 0.00 -1.78 0.00 0.00 34.13 29.90 1wap s GLU 73 CO 0.20 0.14 0.00 1.17 -0.49 0.00 0.00 175.26 176.28