#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 0.64 0.04 -0.67 -0.12 -1.26 -1.49 117.98 115.12 1wap s PHE 9 Ca 0.00 -1.13 0.06 0.00 -0.05 0.00 0.00 56.93 55.82 1wap s PHE 9 Cb 0.00 -0.42 -0.02 0.00 -0.63 0.00 0.00 43.02 41.95 1wap s PHE 9 CO 0.00 -0.43 -0.18 0.14 -0.05 0.00 0.00 175.22 174.70 1wap s VAL 10 N -3.97 1.42 -0.20 -2.49 -7.23 -0.26 -4.66 120.40 103.01 1wap s VAL 10 Ca 0.13 -1.10 -0.06 0.00 -1.81 0.00 0.00 61.98 59.13 1wap s VAL 10 Cb 0.08 -1.25 -0.03 0.00 0.56 0.00 0.00 36.38 35.74 1wap s VAL 10 CO -0.06 0.12 0.04 -0.69 -0.31 0.00 0.00 175.10 174.20 1wap s VAL 11 N -0.82 4.35 -0.07 1.32 1.01 -0.43 -1.07 120.40 124.68 1wap s VAL 11 Ca 0.05 -0.18 0.02 0.00 0.00 0.00 0.00 61.98 61.87 1wap s VAL 11 Cb -0.08 -2.97 0.02 0.00 0.00 0.00 0.00 36.38 33.34 1wap s VAL 11 CO 0.02 0.42 -0.11 -0.63 0.00 0.00 0.00 175.10 174.79 1wap s ILE 12 N 0.85 1.11 -0.20 2.22 1.01 0.22 -1.62 121.20 124.80 1wap s ILE 12 Ca 0.02 -0.45 -0.00 0.00 0.00 0.00 0.00 60.65 60.23 1wap s ILE 12 Cb -0.14 -1.04 0.02 0.00 0.01 0.00 0.00 42.46 41.31 1wap s ILE 12 CO 0.02 0.36 -0.15 -0.75 0.00 0.00 0.00 174.94 174.41 1wap s LYS 13 N 0.83 3.02 -0.09 2.79 2.20 -0.13 -0.76 119.74 127.60 1wap s LYS 13 Ca -0.11 -0.82 -0.30 0.00 -0.36 0.00 0.00 55.97 54.38 1wap s LYS 13 Cb -0.15 -2.70 -0.03 0.00 -1.51 0.00 0.00 37.83 33.43 1wap s LYS 13 CO 0.02 -0.24 1.32 0.00 -0.36 0.00 0.00 175.35 176.09 1wap s ALA 14 N 1.32 3.60 -0.18 3.13 0.00 -0.70 -1.30 121.76 127.64 1wap s ALA 14 Ca 0.04 0.65 0.22 0.00 0.00 0.00 0.00 51.96 52.87 1wap s ALA 14 Cb -0.14 -3.60 -0.09 0.00 0.00 0.00 0.00 23.12 19.29 1wap s ALA 14 CO -0.10 -1.04 0.89 0.28 0.00 0.00 0.00 175.76 175.79 1wap n VAL 15 N 5.03 0.49 -4.19 0.00 0.31 -0.57 -0.09 118.33 119.32 1wap n VAL 15 Ca 0.13 -0.54 -0.11 0.00 -0.01 0.00 0.00 64.34 63.81 1wap n VAL 15 Cb 0.45 -0.27 -0.10 0.00 -0.91 0.00 0.00 33.84 33.01 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 -3.39 0.98 0.82 5.55 0.41 -1.17 -4.74 118.70 117.16 1wap s GLU 16 Ca -0.03 -1.46 -0.11 0.00 -0.41 0.00 0.00 54.97 52.96 1wap s GLU 16 Cb 0.11 -0.01 0.08 0.00 -1.78 0.00 0.00 34.13 32.53 1wap s GLU 16 CO 0.82 -0.18 1.09 -0.51 -0.49 0.00 0.00 175.26 175.99 1wap s ASP 17 N -3.09 4.15 -0.53 -0.19 1.01 -1.26 -3.62 116.67 113.14 1wap s ASP 17 Ca 0.22 1.63 0.00 0.00 0.71 0.00 0.00 52.55 55.12 1wap s ASP 17 Cb 0.07 -2.34 0.00 0.00 1.01 0.00 0.00 42.92 41.66 1wap s ASP 17 CO 0.01 -2.23 0.00 0.61 0.21 0.00 0.00 175.17 173.77 1wap n GLY 18 N -1.30 0.59 3.78 0.21 0.00 -1.24 -4.86 105.19 102.37 1wap n GLY 18 Ca 0.08 -0.77 -0.36 0.00 0.00 0.00 0.00 46.02 44.97 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 -2.22 3.58 -0.04 1.61 1.01 -1.01 -4.77 120.40 118.56 1wap s VAL 19 Ca 0.00 1.14 0.04 0.00 0.00 0.00 0.00 61.98 63.16 1wap s VAL 19 Cb 0.00 -3.56 -0.00 0.00 0.00 0.00 0.00 36.38 32.82 1wap s VAL 19 CO 0.00 -0.06 -0.15 0.20 0.00 0.00 0.00 175.10 175.09 1wap s ASN 20 N -1.62 1.91 -0.26 3.32 -0.87 -0.08 -0.93 114.94 116.40 1wap s ASN 20 Ca 0.62 -0.31 -0.02 0.00 -1.57 0.00 0.00 52.86 51.58 1wap s ASN 20 Cb -0.22 -0.57 0.03 0.00 -0.02 0.00 0.00 41.25 40.48 1wap s ASN 20 CO 0.27 0.12 -0.04 -0.69 -2.57 0.00 0.00 177.10 174.19 1wap s VAL 21 N 0.14 2.90 -0.14 1.60 1.01 0.07 -1.75 120.40 124.23 1wap s VAL 21 Ca -0.05 -1.13 -0.00 0.00 0.00 0.00 0.00 61.98 60.80 1wap s VAL 21 Cb -0.11 -2.53 -0.01 0.00 0.00 0.00 0.00 36.38 33.72 1wap s VAL 21 CO 0.02 0.11 -0.13 -0.63 0.00 0.00 0.00 175.10 174.47 1wap s ILE 22 N 1.30 3.02 -0.17 2.22 1.01 -0.21 0.08 121.20 128.45 1wap s ILE 22 Ca -0.01 -0.66 -0.10 0.00 0.00 0.00 0.00 60.65 59.88 1wap s ILE 22 Cb -0.18 -2.28 -0.05 0.00 0.01 0.00 0.00 42.46 39.97 1wap s ILE 22 CO -0.03 0.51 0.15 -0.83 0.00 0.00 0.00 174.94 174.74 1wap s GLY 23 N 0.51 2.09 -0.10 6.18 0.00 0.11 -0.87 107.32 115.24 1wap s GLY 23 Ca -0.09 -0.66 -0.03 0.00 0.00 0.00 0.00 44.72 43.95 1wap s GLY 23 CO 0.04 0.03 0.04 1.08 0.00 0.00 0.00 173.10 174.29 1wap s LEU 24 N 0.00 3.80 0.30 0.66 1.02 -0.12 -1.21 118.68 123.13 1wap s LEU 24 Ca 0.11 0.23 -0.29 0.00 0.02 0.00 0.00 54.13 54.19 1wap s LEU 24 Cb -0.11 -1.89 -0.10 0.00 0.02 0.00 0.00 46.19 44.10 1wap s LEU 24 CO 0.00 0.38 1.45 0.42 0.02 0.00 0.00 176.35 178.62 1wap s THR 25 N -0.89 2.46 0.25 5.49 -4.23 -0.41 -2.23 115.64 116.08 1wap s THR 25 Ca 0.13 0.41 -0.30 0.00 -1.18 0.00 0.00 61.69 60.76 1wap s THR 25 Cb -0.12 -3.26 -0.09 0.00 1.34 0.00 0.00 72.50 70.37 1wap s THR 25 CO 0.03 0.08 0.99 -0.60 -0.54 0.00 0.00 174.62 174.57 1wap s ARG 26 N -1.01 4.79 0.00 3.99 3.52 -0.78 -4.55 118.95 124.92 1wap s ARG 26 Ca 0.57 1.58 0.00 0.00 -0.13 0.00 0.00 55.73 57.75 1wap s ARG 26 Cb -0.43 -3.26 0.00 0.00 -1.56 0.00 0.00 34.95 29.70 1wap s ARG 26 CO 0.50 0.42 0.00 0.41 -0.81 0.00 0.00 175.30 175.81 1wap n GLY 27 N 1.44 0.58 0.21 8.12 0.00 -1.26 -4.81 105.19 109.46 1wap n GLY 27 Ca -0.02 -2.16 0.05 0.00 0.00 0.00 0.00 46.02 43.89 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 1.13 -2.93 2.61 1.35 -2.06 -3.43 112.91 109.60 1wap h THR 28 Ca 0.00 -1.02 -0.61 0.00 -0.55 0.00 0.00 66.41 64.23 1wap h THR 28 Cb 0.00 1.56 -0.04 0.00 -1.73 0.00 0.00 68.15 67.94 1wap h THR 28 CO 0.00 0.28 -0.48 -1.81 -0.25 0.00 0.00 175.52 173.26 1wap s ASP 29 N -6.85 6.37 -0.32 5.36 1.01 -1.26 -5.08 116.67 115.90 1wap s ASP 29 Ca -0.03 0.30 0.02 0.00 0.71 0.00 0.00 52.55 53.55 1wap s ASP 29 Cb 0.14 -1.97 0.09 0.00 1.01 0.00 0.00 42.92 42.20 1wap s ASP 29 CO 0.70 0.16 0.05 -0.89 0.21 0.00 0.00 175.17 175.40 1wap s THR 30 N -1.53 1.74 0.21 -1.27 2.01 -1.26 -4.59 115.64 110.95 1wap s THR 30 Ca 0.36 -1.91 0.08 0.00 0.31 0.00 0.00 61.69 60.53 1wap s THR 30 Cb -0.13 -2.25 -0.05 0.00 0.01 0.00 0.00 72.50 70.08 1wap s THR 30 CO 0.28 -0.56 -0.15 -0.54 -0.69 0.00 0.00 174.62 172.96 1wap s LYS 31 N 1.19 1.36 -0.19 4.92 1.02 -1.26 -4.91 119.74 121.88 1wap s LYS 31 Ca 0.08 -1.61 -0.29 0.00 0.02 0.00 0.00 55.97 54.18 1wap s LYS 31 Cb -0.18 -1.18 -0.02 0.00 -0.52 0.00 0.00 37.83 35.93 1wap s LYS 31 CO -0.13 0.20 1.33 -0.06 -0.92 0.00 0.00 175.35 175.77 1wap s PHE 32 N -2.93 2.68 -0.42 3.18 0.40 -1.26 -1.29 117.98 118.33 1wap s PHE 32 Ca 0.23 0.87 0.22 0.00 -0.60 0.00 0.00 56.93 57.65 1wap s PHE 32 Cb -0.01 -3.66 -0.18 0.00 0.51 0.00 0.00 43.02 39.68 1wap s PHE 32 CO 0.08 -2.00 0.77 -2.39 0.70 0.00 0.00 175.22 172.37 1wap n HIS 33 N 6.99 0.15 -3.64 0.36 1.44 -0.35 -4.96 115.22 115.21 1wap n HIS 33 Ca 0.15 0.04 -0.11 0.00 -2.01 0.00 0.00 57.72 55.79 1wap n HIS 33 Cb 0.45 -0.41 -0.07 0.00 0.12 0.00 0.00 29.99 30.08 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 -3.30 -0.59 -0.19 -1.40 5.65 -1.24 -5.00 115.29 109.23 1wap s HIS 34 Ca -0.01 1.42 -0.00 0.00 0.25 0.00 0.00 55.06 56.72 1wap s HIS 34 Cb 0.14 0.33 0.05 0.00 -1.18 0.00 0.00 32.58 31.92 1wap s HIS 34 CO 0.86 -0.28 -0.05 0.45 -0.65 0.00 0.00 174.74 175.07 1wap s SER 35 N 0.31 3.09 -0.26 9.88 0.15 -1.26 -0.71 113.70 124.89 1wap s SER 35 Ca 0.02 -0.80 -0.13 0.00 0.70 0.00 0.00 55.95 55.74 1wap s SER 35 Cb -0.05 -0.95 -0.04 0.00 -1.71 0.00 0.00 66.02 63.26 1wap s SER 35 CO -0.04 -0.21 0.29 -0.70 1.20 0.00 0.00 173.24 173.78 1wap s GLU 36 N 1.59 4.02 0.01 5.44 2.56 0.11 -4.91 118.70 127.52 1wap s GLU 36 Ca -0.01 -0.11 -0.27 0.00 0.00 0.00 0.00 54.97 54.59 1wap s GLU 36 Cb -0.16 -3.63 -0.04 0.00 2.00 0.00 0.00 34.13 32.29 1wap s GLU 36 CO -0.07 -0.18 0.84 0.21 -0.56 0.00 0.00 175.26 175.50 1wap s LYS 37 N 1.76 4.53 -0.17 4.30 2.20 -1.26 -0.75 119.74 130.35 1wap s LYS 37 Ca 0.12 1.18 0.01 0.00 -0.36 0.00 0.00 55.97 56.92 1wap s LYS 37 Cb -0.15 -3.42 0.02 0.00 -1.51 0.00 0.00 37.83 32.77 1wap s LYS 37 CO 0.09 0.11 -0.19 -0.51 -0.36 0.00 0.00 175.35 174.50 1wap s LEU 38 N 0.50 2.04 0.74 5.43 1.43 -0.11 -4.99 118.68 123.72 1wap s LEU 38 Ca 0.44 -0.61 -0.11 0.00 -1.03 0.00 0.00 54.13 52.81 1wap s LEU 38 Cb -0.20 -1.41 0.04 0.00 0.03 0.00 0.00 46.19 44.64 1wap s LEU 38 CO 0.24 -0.00 1.12 -1.81 0.23 0.00 0.00 176.35 176.13 1wap s ASP 39 N 1.28 5.08 -0.02 2.29 1.01 -1.26 -2.40 116.67 122.64 1wap s ASP 39 Ca 0.04 0.96 -0.38 0.00 0.71 0.00 0.00 52.55 53.87 1wap s ASP 39 Cb -0.13 -1.64 -0.17 0.00 1.01 0.00 0.00 42.92 41.99 1wap s ASP 39 CO -0.11 -1.55 1.43 1.17 0.21 0.00 0.00 175.17 176.32 1wap n LYS 40 N -3.10 1.08 0.00 8.23 4.81 -1.24 -1.47 118.16 126.47 1wap n LYS 40 Ca 0.07 0.39 0.00 0.00 -0.87 0.00 0.00 58.31 57.90 1wap n LYS 40 Cb 0.59 -2.04 0.00 0.00 0.02 0.00 0.00 35.03 33.60 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 2.91 3.20 3.78 3.14 0.00 0.88 -4.96 105.19 114.13 1wap n GLY 41 Ca 0.21 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.43 2.53 -0.01 1.61 2.02 -0.54 -4.78 118.70 119.11 1wap s GLU 42 Ca 0.00 1.20 0.02 0.00 0.02 0.00 0.00 54.97 56.21 1wap s GLU 42 Cb 0.00 -1.93 -0.00 0.00 0.10 0.00 0.00 34.13 32.30 1wap s GLU 42 CO 0.00 -1.43 -0.06 0.08 0.02 0.00 0.00 175.26 173.87 1wap s VAL 43 N -2.76 0.46 -0.01 2.63 1.01 -1.26 -1.72 120.40 118.75 1wap s VAL 43 Ca 0.62 -0.24 0.04 0.00 0.00 0.00 0.00 61.98 62.40 1wap s VAL 43 Cb -0.17 -0.39 -0.01 0.00 0.00 0.00 0.00 36.38 35.80 1wap s VAL 43 CO 0.51 0.13 -0.14 -0.51 0.00 0.00 0.00 175.10 175.10 1wap s ILE 44 N -0.08 1.07 -0.24 2.22 2.07 0.06 -5.00 121.20 121.29 1wap s ILE 44 Ca 0.02 -0.59 -0.01 0.00 -1.41 0.00 0.00 60.65 58.65 1wap s ILE 44 Cb -0.03 -0.89 0.03 0.00 0.13 0.00 0.00 42.46 41.70 1wap s ILE 44 CO -0.00 0.29 -0.08 -0.63 -1.91 0.00 0.00 174.94 172.60 1wap s ILE 45 N -0.34 2.69 -0.02 2.00 1.09 -1.26 -0.61 121.20 124.75 1wap s ILE 45 Ca 0.05 -1.08 0.04 0.00 -1.10 0.00 0.00 60.65 58.56 1wap s ILE 45 Cb -0.05 -2.36 -0.01 0.00 -1.06 0.00 0.00 42.46 38.98 1wap s ILE 45 CO -0.00 0.22 -0.14 0.00 -0.10 0.00 0.00 174.94 174.91 1wap s ALA 46 N 1.29 1.21 0.40 9.38 0.00 -0.23 -4.95 121.76 128.86 1wap s ALA 46 Ca -0.00 -0.57 0.02 0.00 0.00 0.00 0.00 51.96 51.41 1wap s ALA 46 Cb -0.17 -0.36 -0.01 0.00 0.00 0.00 0.00 23.12 22.58 1wap s ALA 46 CO -0.06 0.25 0.60 -0.65 0.00 0.00 0.00 175.76 175.91 1wap s GLN 47 N -0.10 3.15 0.31 0.00 -0.21 -1.26 -1.10 119.66 120.45 1wap s GLN 47 Ca 0.01 -0.57 -0.27 0.00 0.02 0.00 0.00 55.36 54.55 1wap s GLN 47 Cb -0.08 -2.64 -0.10 0.00 1.00 0.00 0.00 33.01 31.20 1wap s GLN 47 CO 0.00 -0.12 0.96 -0.06 -2.12 0.00 0.00 175.29 173.95 1wap s PHE 48 N -2.43 3.72 0.27 0.91 0.08 -0.56 -4.94 117.98 115.04 1wap s PHE 48 Ca 0.46 1.80 0.04 0.00 0.12 0.00 0.00 56.93 59.34 1wap s PHE 48 Cb -0.10 -2.96 -0.01 0.00 -0.57 0.00 0.00 43.02 39.38 1wap s PHE 48 CO 0.36 0.18 0.28 0.25 -0.10 0.00 0.00 175.22 176.19 1wap n THR 49 N 0.74 0.00 -0.02 0.64 -2.24 -0.37 -4.59 114.28 108.44 1wap n THR 49 Ca 0.01 -1.76 0.09 0.00 -2.27 0.00 0.00 64.05 60.12 1wap n THR 49 Cb 0.49 0.94 0.50 0.00 -2.10 0.00 0.00 70.33 70.16 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 0.38 0.00 -0.78 3.07 -2.02 -2.89 114.58 112.34 1wap h GLU 50 Ca -0.20 -0.02 0.00 0.00 -0.50 0.00 0.00 59.36 58.64 1wap h GLU 50 Cb 0.95 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.78 1wap h GLU 50 CO 0.28 0.25 -1.60 0.72 -1.40 0.00 0.00 179.01 177.27 1wap n HIS 51 N -4.47 0.10 -4.06 4.33 8.25 -1.26 -4.64 115.22 113.47 1wap n HIS 51 Ca 0.06 0.03 -0.32 0.00 -0.26 0.00 0.00 57.72 57.24 1wap n HIS 51 Cb 0.26 -0.42 -0.16 0.00 1.12 0.00 0.00 29.99 30.79 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 -3.36 1.88 0.00 1.59 2.01 -1.09 -1.86 115.64 114.81 1wap s THR 52 Ca -0.03 -1.00 0.00 0.00 0.31 0.00 0.00 61.69 60.98 1wap s THR 52 Cb 0.14 -1.81 0.00 0.00 0.01 0.00 0.00 72.50 70.84 1wap s THR 52 CO 0.88 0.35 0.41 -1.54 -0.69 0.00 0.00 174.62 174.03 1wap n SER 53 N 4.64 0.81 -3.73 3.53 3.41 -0.95 -1.24 113.62 120.09 1wap n SER 53 Ca -0.18 -0.92 -0.14 0.00 -0.26 0.00 0.00 58.87 57.38 1wap n SER 53 Cb 0.48 0.16 -0.09 0.00 -0.26 0.00 0.00 64.21 64.50 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 -0.16 -0.92 -0.06 7.33 0.00 -1.24 -5.03 121.76 121.69 1wap s ALA 54 Ca 0.00 0.56 0.03 0.00 0.00 0.00 0.00 51.96 52.55 1wap s ALA 54 Cb 0.00 -0.05 0.01 0.00 0.00 0.00 0.00 23.12 23.08 1wap s ALA 54 CO 0.00 -0.26 -0.14 0.42 0.00 0.00 0.00 175.76 175.78 1wap s ILE 55 N -1.06 1.23 -0.04 0.00 1.01 -1.26 -0.95 121.20 120.14 1wap s ILE 55 Ca -0.11 -0.56 0.04 0.00 0.00 0.00 0.00 60.65 60.03 1wap s ILE 55 Cb -0.04 -1.11 -0.03 0.00 0.01 0.00 0.00 42.46 41.30 1wap s ILE 55 CO 0.04 0.37 -0.15 -0.75 0.00 0.00 0.00 174.94 174.45 1wap s LYS 56 N 0.49 2.44 -0.11 2.79 2.20 -0.05 -4.97 119.74 122.54 1wap s LYS 56 Ca -0.12 -0.73 0.03 0.00 -0.36 0.00 0.00 55.97 54.79 1wap s LYS 56 Cb -0.15 -2.34 -0.00 0.00 -1.51 0.00 0.00 37.83 33.83 1wap s LYS 56 CO 0.04 0.61 -0.23 0.08 -0.36 0.00 0.00 175.35 175.49 1wap s VAL 57 N -0.74 2.18 -0.07 4.02 1.01 -1.26 -1.04 120.40 124.50 1wap s VAL 57 Ca 0.12 -0.97 0.02 0.00 0.00 0.00 0.00 61.98 61.15 1wap s VAL 57 Cb -0.11 -1.84 0.01 0.00 0.00 0.00 0.00 36.38 34.44 1wap s VAL 57 CO 0.01 0.55 -0.13 -0.60 0.00 0.00 0.00 175.10 174.93 1wap s ARG 58 N 0.38 1.82 0.00 2.72 3.52 -0.72 -4.99 118.95 121.68 1wap s ARG 58 Ca -0.17 -0.45 0.00 0.00 -0.13 0.00 0.00 55.73 54.97 1wap s ARG 58 Cb -0.18 -1.48 0.00 0.00 -1.56 0.00 0.00 34.95 31.73 1wap s ARG 58 CO 0.08 0.04 0.00 0.41 -0.81 0.00 0.00 175.30 175.02 1wap n GLY 59 N 3.78 2.10 3.65 8.12 0.00 -1.26 -0.91 105.19 120.67 1wap n GLY 59 Ca -0.23 -2.15 -0.43 0.00 0.00 0.00 0.00 46.02 43.22 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 -1.84 4.14 -0.01 1.61 2.56 -1.26 -3.35 118.70 120.55 1wap s GLU 60 Ca 0.00 1.36 -0.28 0.00 0.00 0.00 0.00 54.97 56.05 1wap s GLU 60 Cb 0.00 -3.75 0.07 0.00 2.00 0.00 0.00 34.13 32.45 1wap s GLU 60 CO 0.00 -0.81 0.63 0.00 -0.56 0.00 0.00 175.26 174.52 1wap s ALA 61 N 3.63 -1.65 -0.17 6.30 0.00 -0.60 -1.52 121.76 127.76 1wap s ALA 61 Ca 0.50 1.06 -0.08 0.00 0.00 0.00 0.00 51.96 53.44 1wap s ALA 61 Cb -0.17 0.18 -0.04 0.00 0.00 0.00 0.00 23.12 23.09 1wap s ALA 61 CO 0.14 -0.44 0.10 -1.17 0.00 0.00 0.00 175.76 174.39 1wap s LEU 62 N -1.52 4.10 -0.08 0.00 2.96 -0.42 -1.28 118.68 122.43 1wap s LEU 62 Ca -0.09 0.24 0.03 0.00 -0.22 0.00 0.00 54.13 54.09 1wap s LEU 62 Cb -0.00 -2.03 0.01 0.00 0.50 0.00 0.00 46.19 44.66 1wap s LEU 62 CO 0.05 0.25 -0.16 -0.63 -1.32 0.00 0.00 176.35 174.53 1wap s ILE 63 N -0.05 1.46 -0.14 6.68 1.01 0.23 -0.96 121.20 129.44 1wap s ILE 63 Ca 0.09 -0.66 0.00 0.00 0.00 0.00 0.00 60.65 60.08 1wap s ILE 63 Cb -0.12 -1.31 -0.01 0.00 0.01 0.00 0.00 42.46 41.04 1wap s ILE 63 CO 0.00 0.43 -0.14 -1.10 0.00 0.00 0.00 174.94 174.13 1wap s GLN 64 N 0.65 3.30 0.33 2.79 -0.21 -0.64 -0.67 119.66 125.21 1wap s GLN 64 Ca -0.14 -0.72 0.04 0.00 0.02 0.00 0.00 55.36 54.56 1wap s GLN 64 Cb -0.16 -2.63 -0.01 0.00 1.00 0.00 0.00 33.01 31.20 1wap s GLN 64 CO 0.04 0.11 0.13 0.25 -2.12 0.00 0.00 175.29 173.70 1wap n THR 65 N 3.81 0.00 0.29 -0.19 -2.24 0.74 -1.32 114.28 115.37 1wap n THR 65 Ca -0.19 -1.97 0.17 0.00 -2.27 0.00 0.00 64.05 59.79 1wap n THR 65 Cb 0.52 0.74 0.89 0.00 -2.10 0.00 0.00 70.33 70.38 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 1.60 1.12 -0.03 6.98 0.00 -2.00 0.32 119.26 127.25 1wap h ALA 66 Ca -0.25 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1wap h ALA 66 Cb 1.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1wap h ALA 66 CO 0.40 -0.12 -0.05 0.66 0.00 0.00 0.00 179.25 180.14 1wap n TYR 67 N -2.75 0.00 0.00 0.00 4.01 -1.26 -5.09 117.16 112.07 1wap n TYR 67 Ca -0.02 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.72 1wap n TYR 67 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.21 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 1.32 0.30 3.83 2.72 0.00 0.10 -5.07 105.19 108.39 1wap n GLY 68 Ca 0.13 -2.14 -0.27 0.00 0.00 0.00 0.00 46.02 43.74 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 3.03 -0.13 1.61 2.02 -1.26 -0.18 118.70 123.79 1wap s GLU 69 Ca 0.00 -0.77 -0.12 0.00 0.02 0.00 0.00 54.97 54.10 1wap s GLU 69 Cb 0.00 -2.74 0.04 0.00 0.10 0.00 0.00 34.13 31.53 1wap s GLU 69 CO 0.00 0.51 0.36 1.41 0.02 0.00 0.00 175.26 177.56 1wap s MET 70 N -3.01 0.41 -0.17 1.61 1.75 0.15 -4.99 119.30 115.06 1wap s MET 70 Ca 0.32 0.51 -0.02 0.00 -1.25 0.00 0.00 55.69 55.24 1wap s MET 70 Cb -0.11 0.19 -0.02 0.00 2.84 0.00 0.00 34.83 37.74 1wap s MET 70 CO 0.24 -0.06 -0.08 0.21 -0.65 0.00 0.00 175.02 174.69 1wap s LYS 71 N 0.25 3.45 0.22 4.11 2.47 -1.26 -0.60 119.74 128.39 1wap s LYS 71 Ca -0.01 -0.62 -0.06 0.00 -1.56 0.00 0.00 55.97 53.72 1wap s LYS 71 Cb -0.03 -2.83 -0.06 0.00 -1.46 0.00 0.00 37.83 33.45 1wap s LYS 71 CO -0.00 0.08 0.49 -1.54 0.16 0.00 0.00 175.35 174.53 1wap s SER 72 N 0.74 6.52 0.13 1.43 1.04 -0.41 -4.96 113.70 118.20 1wap s SER 72 Ca -0.03 0.73 0.07 0.00 0.48 0.00 0.00 55.95 57.20 1wap s SER 72 Cb -0.15 -2.15 -0.04 0.00 0.10 0.00 0.00 66.02 63.79 1wap s SER 72 CO 0.02 -0.07 -0.17 -1.61 0.98 0.00 0.00 173.24 172.39 1wap s GLU 73 N -3.01 1.14 0.00 4.02 2.02 -1.21 -1.55 118.70 120.11 1wap s GLU 73 Ca 0.44 -1.28 0.29 0.00 0.02 0.00 0.00 54.97 54.44 1wap s GLU 73 Cb -0.11 -1.18 1.28 0.00 0.10 0.00 0.00 34.13 34.22 1wap s GLU 73 CO 0.25 0.25 1.88 1.17 0.02 0.00 0.00 175.26 178.82