#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wi0 n SER 2 N 0.00 -1.51 -4.56 1.61 3.41 -1.26 -5.05 113.62 106.26 1wi0 n SER 2 Ca 0.00 0.58 -0.37 0.00 -0.26 0.00 0.00 58.87 58.82 1wi0 n SER 2 Cb 0.00 1.68 -0.04 0.00 -0.26 0.00 0.00 64.21 65.59 1wi0 n SER 2 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1wi0 s SER 3 N -2.00 6.07 0.08 4.04 0.15 -1.26 -4.94 113.70 115.83 1wi0 s SER 3 Ca 0.00 -1.12 0.00 0.00 0.70 0.00 0.00 55.95 55.53 1wi0 s SER 3 Cb 0.00 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.74 1wi0 s SER 3 CO 0.00 -1.90 0.00 0.61 1.20 0.00 0.00 173.24 173.15 1wi0 n GLY 4 N 6.75 1.67 3.74 9.45 0.00 -1.26 -5.09 105.19 120.45 1wi0 n GLY 4 Ca 0.33 -2.08 -0.37 0.00 0.00 0.00 0.00 46.02 43.89 1wi0 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1wi0 s SER 5 N -1.00 6.60 -0.30 1.61 0.15 -1.26 -5.05 113.70 114.45 1wi0 s SER 5 Ca 0.00 0.71 -0.13 0.00 0.70 0.00 0.00 55.95 57.22 1wi0 s SER 5 Cb 0.00 -2.24 0.15 0.00 -1.71 0.00 0.00 66.02 62.23 1wi0 s SER 5 CO 0.00 0.09 0.88 -0.44 1.20 0.00 0.00 173.24 174.98 1wi0 s SER 6 N 0.29 -0.75 0.68 5.45 0.01 -1.26 -5.16 113.70 112.96 1wi0 s SER 6 Ca 0.22 1.04 -0.14 0.00 1.31 0.00 0.00 55.95 58.37 1wi0 s SER 6 Cb -0.14 1.85 0.01 0.00 0.21 0.00 0.00 66.02 67.95 1wi0 s SER 6 CO 0.08 -0.14 1.12 -0.83 0.41 0.00 0.00 173.24 173.88 1wi0 s GLY 7 N 2.58 2.11 0.28 3.44 0.00 -1.26 -4.99 107.32 109.48 1wi0 s GLY 7 Ca -0.04 0.56 -0.29 0.00 0.00 0.00 0.00 44.72 44.95 1wi0 s GLY 7 CO -0.18 0.92 1.08 2.56 0.00 0.00 0.00 173.10 177.47 1wi0 s PRO 8 N -4.17 4.65 -0.24 2.90 0.04 -1.26 -5.04 135.00 131.89 1wi0 s PRO 8 Ca 0.67 1.76 -0.27 0.00 0.04 0.00 0.00 61.00 63.20 1wi0 s PRO 8 Cb -0.21 -3.18 0.13 0.00 0.04 0.00 0.00 34.50 31.28 1wi0 s PRO 8 CO 0.44 0.24 1.04 0.12 0.04 0.00 0.00 177.00 178.88 1wi0 s PHE 9 N -1.18 -0.41 -0.30 0.56 5.36 -1.26 -5.13 117.98 115.61 1wi0 s PHE 9 Ca 0.45 0.90 -0.02 0.00 -0.96 0.00 0.00 56.93 57.29 1wi0 s PHE 9 Cb -0.31 0.40 0.19 0.00 -0.34 0.00 0.00 43.02 42.97 1wi0 s PHE 9 CO 0.40 -0.26 0.82 0.00 -1.46 0.00 0.00 175.22 174.71 1wi0 s ALA 11 N 2.77 -2.31 -0.30 0.00 0.00 -1.26 -5.16 121.76 115.50 1wi0 s ALA 11 Ca 0.18 2.21 -0.16 0.00 0.00 0.00 0.00 51.96 54.20 1wi0 s ALA 11 Cb -0.05 -1.77 0.21 0.00 0.00 0.00 0.00 23.12 21.51 1wi0 s ALA 11 CO -0.23 -0.57 1.26 1.41 0.00 0.00 0.00 175.76 177.63 1wi0 s MET 12 N 1.83 0.05 -0.42 0.00 1.75 -1.26 -5.10 119.30 116.16 1wi0 s MET 12 Ca -0.07 0.09 0.04 0.00 -1.25 0.00 0.00 55.69 54.50 1wi0 s MET 12 Cb -0.05 0.01 0.29 0.00 2.84 0.00 0.00 34.83 37.92 1wi0 s MET 12 CO -0.17 -0.01 1.12 -1.91 -0.65 0.00 0.00 175.02 173.40 1wi0 n GLU 13 N 3.12 0.62 -2.41 4.11 2.13 -1.26 -5.06 120.64 121.88 1wi0 n GLU 13 Ca -0.17 -1.41 -0.02 0.00 0.66 0.00 0.00 57.16 56.21 1wi0 n GLU 13 Cb 0.56 -0.86 -0.02 0.00 0.27 0.00 0.00 31.44 31.39 1wi0 n GLU 13 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1wi0 n ASN 14 N 1.01 -3.51 0.00 4.31 5.15 -1.26 -5.08 115.26 115.88 1wi0 n ASN 14 Ca 0.04 1.10 0.00 0.00 -0.60 0.00 0.00 54.58 55.12 1wi0 n ASN 14 Cb 0.69 -4.42 0.00 0.00 -0.53 0.00 0.00 39.78 35.52 1wi0 n ASN 14 CO 0.00 0.00 0.00 1.67 1.40 0.00 0.00 177.26 180.33 1wi0 n GLN 15 N 0.98 0.00 0.00 1.20 7.27 -1.26 -5.16 117.38 120.42 1wi0 n GLN 15 Ca -0.18 0.00 0.00 0.00 0.07 0.00 0.00 57.00 56.89 1wi0 n GLN 15 Cb 0.28 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.93 1wi0 n GLN 15 CO 0.00 0.00 0.00 1.33 0.07 0.00 0.00 177.06 178.46 1wi0 n VAL 16 N -0.14 0.00 -4.23 1.69 0.24 -1.26 -4.65 118.33 109.98 1wi0 n VAL 16 Ca 0.00 0.00 -0.35 0.00 -2.04 0.00 0.00 64.34 61.95 1wi0 n VAL 16 Cb 0.00 0.00 -0.09 0.00 -1.47 0.00 0.00 33.84 32.28 1wi0 n VAL 16 CO 0.00 0.00 0.00 -0.22 -2.14 0.00 0.00 176.83 174.47 1wi0 s LEU 17 N 0.00 3.73 -0.19 1.34 2.96 0.22 -5.01 118.68 121.72 1wi0 s LEU 17 Ca 0.00 0.16 0.01 0.00 -0.22 0.00 0.00 54.13 54.08 1wi0 s LEU 17 Cb 0.00 -1.88 0.04 0.00 0.50 0.00 0.00 46.19 44.85 1wi0 s LEU 17 CO 0.00 0.33 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.57 1wi0 s VAL 18 N -0.57 1.54 -0.27 1.68 1.01 -1.26 -0.19 120.40 122.35 1wi0 s VAL 18 Ca 0.10 -0.89 -0.16 0.00 0.00 0.00 0.00 61.98 61.03 1wi0 s VAL 18 Cb -0.12 -1.61 -0.03 0.00 0.00 0.00 0.00 36.38 34.62 1wi0 s VAL 18 CO 0.02 0.21 0.44 -0.63 0.00 0.00 0.00 175.10 175.13 1wi0 s ILE 19 N 1.45 5.13 -0.51 2.22 1.01 -0.82 0.06 121.20 129.73 1wi0 s ILE 19 Ca -0.00 0.71 -0.15 0.00 0.00 0.00 0.00 60.65 61.21 1wi0 s ILE 19 Cb -0.16 -3.76 0.11 0.00 0.01 0.00 0.00 42.46 38.67 1wi0 s ILE 19 CO -0.08 0.13 0.45 -0.60 0.00 0.00 0.00 174.94 174.83 1wi0 s ARG 20 N 2.18 2.96 -0.04 2.79 3.52 -0.93 0.86 118.95 130.29 1wi0 s ARG 20 Ca 0.18 -1.58 -0.30 0.00 -0.13 0.00 0.00 55.73 53.90 1wi0 s ARG 20 Cb -0.16 -4.21 -0.03 0.00 -1.56 0.00 0.00 34.95 28.99 1wi0 s ARG 20 CO 0.10 -1.21 1.14 0.42 -0.81 0.00 0.00 175.30 174.94 1wi0 s ILE 21 N 1.60 4.37 -0.49 4.11 1.09 0.18 -0.94 121.20 131.13 1wi0 s ILE 21 Ca 0.03 1.69 -0.29 0.00 -1.10 0.00 0.00 60.65 60.99 1wi0 s ILE 21 Cb -0.28 -4.09 0.02 0.00 -1.06 0.00 0.00 42.46 37.06 1wi0 s ILE 21 CO 0.04 0.04 1.26 -0.54 -0.10 0.00 0.00 174.94 175.64 1wi0 s LYS 22 N 1.85 3.59 0.17 2.79 -0.14 -0.33 -1.84 119.74 125.83 1wi0 s LYS 22 Ca 0.55 0.60 -0.23 0.00 -1.36 0.00 0.00 55.97 55.52 1wi0 s LYS 22 Cb -0.24 -3.99 -0.08 0.00 -1.68 0.00 0.00 37.83 31.84 1wi0 s LYS 22 CO 0.23 -1.56 0.74 0.42 -0.76 0.00 0.00 175.35 174.42 1wi0 s ILE 23 N 5.04 4.46 -0.21 2.17 -1.09 -0.51 -4.52 121.20 126.55 1wi0 s ILE 23 Ca 0.51 1.54 -0.29 0.00 -2.23 0.00 0.00 60.65 60.19 1wi0 s ILE 23 Cb -0.09 -4.04 -0.01 0.00 -1.58 0.00 0.00 42.46 36.74 1wi0 s ILE 23 CO 0.30 0.44 1.30 -2.16 -1.23 0.00 0.00 174.94 173.59 1wi0 s PRO 24 N -1.36 4.12 -0.59 2.79 0.04 -1.26 -3.92 135.00 134.81 1wi0 s PRO 24 Ca 0.37 1.55 -0.24 0.00 0.04 0.00 0.00 61.00 62.72 1wi0 s PRO 24 Cb -0.21 -3.82 0.04 0.00 0.04 0.00 0.00 34.50 30.55 1wi0 s PRO 24 CO 0.24 -0.86 0.64 0.09 0.04 0.00 0.00 177.00 177.14 1wi0 n ASN 25 N 7.01 -5.13 0.02 6.66 3.02 -1.26 -4.73 115.26 120.85 1wi0 n ASN 25 Ca 0.14 -0.49 0.00 0.00 -0.03 0.00 0.00 54.58 54.20 1wi0 n ASN 25 Cb 0.45 -1.57 0.00 0.00 -0.61 0.00 0.00 39.78 38.05 1wi0 n ASN 25 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1wi0 n SER 26 N -1.14 -0.28 0.00 6.41 7.64 -1.26 -5.15 113.62 119.85 1wi0 n SER 26 Ca -0.18 0.18 0.00 0.00 1.01 0.00 0.00 58.87 59.87 1wi0 n SER 26 Cb 0.69 0.44 0.00 0.00 -1.01 0.00 0.00 64.21 64.33 1wi0 n SER 26 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wi0 n GLY 27 N -1.10 -0.37 3.61 0.23 0.00 -1.25 -5.06 105.19 101.24 1wi0 n GLY 27 Ca 0.00 -0.03 -0.08 0.00 0.00 0.00 0.00 46.02 45.91 1wi0 n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wi0 s ALA 28 N -1.00 -2.01 0.06 4.61 0.00 -1.26 -1.42 121.76 120.74 1wi0 s ALA 28 Ca 0.00 1.72 0.07 0.00 0.00 0.00 0.00 51.96 53.75 1wi0 s ALA 28 Cb 0.00 -1.16 -0.03 0.00 0.00 0.00 0.00 23.12 21.93 1wi0 s ALA 28 CO 0.00 -0.25 -0.14 0.08 0.00 0.00 0.00 175.76 175.44 1wi0 s VAL 29 N -0.63 3.06 -0.23 0.00 1.01 -0.77 -4.91 120.40 117.93 1wi0 s VAL 29 Ca 0.02 -1.17 -0.07 0.00 0.00 0.00 0.00 61.98 60.76 1wi0 s VAL 29 Cb -0.02 -2.34 -0.03 0.00 0.00 0.00 0.00 36.38 33.99 1wi0 s VAL 29 CO -0.04 0.27 0.05 1.51 0.00 0.00 0.00 175.10 176.90 1wi0 s ASP 30 N -1.68 5.11 -0.32 3.32 -4.77 -1.25 0.48 116.67 117.56 1wi0 s ASP 30 Ca 0.17 -0.18 -0.15 0.00 -3.30 0.00 0.00 52.55 49.09 1wi0 s ASP 30 Cb -0.11 -1.90 -0.02 0.00 -1.09 0.00 0.00 42.92 39.80 1wi0 s ASP 30 CO 0.08 0.01 0.37 0.86 0.70 0.00 0.00 175.17 177.18 1wi0 s TRP 31 N 1.36 3.22 -0.11 2.11 -0.00 0.25 -4.89 118.94 120.88 1wi0 s TRP 31 Ca 0.05 0.14 -0.29 0.00 -0.00 0.00 0.00 56.10 55.99 1wi0 s TRP 31 Cb -0.15 -2.65 -0.05 0.00 -0.00 0.00 0.00 33.47 30.63 1wi0 s TRP 31 CO 0.03 -0.36 1.74 -0.08 -0.00 0.00 0.00 176.95 178.28 1wi0 s THR 32 N 2.05 3.48 -0.13 5.86 -1.32 -1.26 -1.95 115.64 122.37 1wi0 s THR 32 Ca 0.13 0.56 0.00 0.00 -1.21 0.00 0.00 61.69 61.17 1wi0 s THR 32 Cb -0.16 -3.43 0.02 0.00 -1.51 0.00 0.00 72.50 67.42 1wi0 s THR 32 CO 0.11 -0.12 -0.12 -0.69 -2.21 0.00 0.00 174.62 171.59 1wi0 s VAL 33 N 4.89 1.36 -0.10 5.08 1.01 0.73 -4.97 120.40 128.40 1wi0 s VAL 33 Ca 0.78 -0.51 0.12 0.00 0.00 0.00 0.00 61.98 62.37 1wi0 s VAL 33 Cb -0.32 -1.30 -0.18 0.00 0.00 0.00 0.00 36.38 34.59 1wi0 s VAL 33 CO 0.32 0.42 0.13 1.41 0.00 0.00 0.00 175.10 177.38 1wi0 n HIS 34 N 4.72 0.00 -1.59 5.22 8.25 -1.26 0.69 115.22 131.25 1wi0 n HIS 34 Ca -0.16 0.00 -0.32 0.00 -0.26 0.00 0.00 57.72 56.98 1wi0 n HIS 34 Cb 0.50 -0.55 0.00 0.00 1.12 0.00 0.00 29.99 31.07 1wi0 n HIS 34 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 1wi0 n SER 35 N -2.33 7.01 -0.36 0.41 7.64 -1.26 -4.74 113.62 119.99 1wi0 n SER 35 Ca -0.16 -3.50 0.02 0.00 1.01 0.00 0.00 58.87 56.25 1wi0 n SER 35 Cb 0.75 -1.13 0.09 0.00 -1.01 0.00 0.00 64.21 62.91 1wi0 n SER 35 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 1wi0 h GLY 36 N 3.26 0.40 1.51 0.23 0.00 -1.94 0.47 103.07 106.99 1wi0 h GLY 36 Ca 0.47 0.42 -0.22 0.00 0.00 0.00 0.00 47.33 48.00 1wi0 h GLY 36 CO 1.16 -0.29 -0.88 -0.56 0.00 0.00 0.00 176.54 175.97 1wi0 h PRO 37 N -0.01 0.46 -1.45 4.80 0.13 -1.99 -3.17 132.00 130.77 1wi0 h PRO 37 Ca 0.41 -0.45 -0.31 0.00 -0.87 0.00 0.00 66.00 64.78 1wi0 h PRO 37 Cb 0.66 0.12 -0.14 0.00 0.13 0.00 0.00 31.00 31.77 1wi0 h PRO 37 CO -0.99 1.10 0.40 0.94 -0.23 0.00 0.00 178.00 179.21 1wi0 n GLN 38 N -3.79 1.76 -4.29 0.86 7.27 0.13 -4.88 117.38 114.44 1wi0 n GLN 38 Ca -0.06 -1.53 -0.31 0.00 0.07 0.00 0.00 57.00 55.17 1wi0 n GLN 38 Cb 0.80 -1.60 -0.09 0.00 2.41 0.00 0.00 30.24 31.75 1wi0 n GLN 38 CO 0.00 0.00 0.00 -1.17 0.07 0.00 0.00 177.06 175.96 1wi0 s LEU 39 N -1.76 3.27 0.30 1.69 2.96 0.63 -4.84 118.68 120.92 1wi0 s LEU 39 Ca 0.30 -0.19 0.11 0.00 -0.22 0.00 0.00 54.13 54.13 1wi0 s LEU 39 Cb 0.24 -1.96 -0.05 0.00 0.50 0.00 0.00 46.19 44.92 1wi0 s LEU 39 CO 0.00 0.23 -0.16 -0.76 -1.32 0.00 0.00 176.35 174.34 1wi0 s LEU 40 N -1.86 2.66 0.17 -0.68 1.43 -1.26 -4.99 118.68 114.15 1wi0 s LEU 40 Ca 0.21 -1.05 -0.12 0.00 -1.03 0.00 0.00 54.13 52.14 1wi0 s LEU 40 Cb -0.11 -1.11 0.07 0.00 0.03 0.00 0.00 46.19 45.07 1wi0 s LEU 40 CO 0.12 -0.03 1.75 0.15 0.23 0.00 0.00 176.35 178.58 1wi0 h PHE 41 N 2.18 0.86 -0.44 0.29 3.57 -1.93 -2.77 116.94 118.69 1wi0 h PHE 41 Ca -0.41 -0.05 0.01 0.00 3.53 0.00 0.00 57.97 61.05 1wi0 h PHE 41 Cb 1.26 -0.26 -0.02 0.00 2.79 0.00 0.00 35.95 39.71 1wi0 h PHE 41 CO 0.79 0.67 0.29 0.00 -2.23 0.00 0.00 178.31 177.83 1wi0 h ARG 42 N 0.80 0.58 -0.73 1.11 2.47 -1.96 -2.24 114.38 114.40 1wi0 h ARG 42 Ca 0.20 -0.03 0.16 0.00 -1.26 0.00 0.00 59.98 59.05 1wi0 h ARG 42 Cb 0.14 -0.13 -0.13 0.00 -1.65 0.00 0.00 29.97 28.20 1wi0 h ARG 42 CO -0.02 0.38 -0.01 -0.44 0.56 0.00 0.00 179.97 180.44 1wi0 h ASP 43 N 0.59 -0.37 0.33 7.04 3.32 -1.91 1.52 116.42 126.95 1wi0 h ASP 43 Ca 0.16 0.19 -0.00 0.00 0.02 0.00 0.00 57.03 57.40 1wi0 h ASP 43 Cb -0.06 0.35 -0.02 0.00 0.22 0.00 0.00 39.33 39.81 1wi0 h ASP 43 CO -0.04 -0.18 -0.30 0.58 -1.72 0.00 0.00 179.24 177.59 1wi0 h VAL 44 N 0.09 0.38 -0.66 -1.35 2.07 -1.28 0.28 116.25 115.78 1wi0 h VAL 44 Ca 0.39 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.97 1wi0 h VAL 44 Cb 0.68 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.79 1wi0 h VAL 44 CO -0.66 0.00 0.44 -0.07 0.02 0.00 0.00 177.57 177.30 1wi0 h LEU 45 N -0.65 0.60 -1.29 2.57 -0.00 -0.46 0.97 115.31 117.06 1wi0 h LEU 45 Ca -0.02 0.00 -0.06 0.00 -0.00 0.00 0.00 57.88 57.79 1wi0 h LEU 45 Cb 0.58 -0.13 -0.01 0.00 -0.00 0.00 0.00 40.66 41.10 1wi0 h LEU 45 CO -0.04 0.39 -0.22 0.44 -0.00 0.00 0.00 178.44 179.02 1wi0 h ASP 46 N 0.69 0.20 0.00 -0.43 5.19 0.31 -0.61 116.42 121.77 1wi0 h ASP 46 Ca 0.28 -0.05 -0.02 0.00 -0.62 0.00 0.00 57.03 56.62 1wi0 h ASP 46 Cb 0.24 -0.05 -0.00 0.00 0.18 0.00 0.00 39.33 39.70 1wi0 h ASP 46 CO -0.09 0.43 -0.18 0.58 -3.12 0.00 0.00 179.24 176.87 1wi0 h VAL 47 N 0.19 0.47 -0.92 -1.35 2.07 0.27 -3.34 116.25 113.64 1wi0 h VAL 47 Ca 0.03 -1.39 0.27 0.00 0.82 0.00 0.00 66.70 66.43 1wi0 h VAL 47 Cb 0.50 0.93 -0.15 0.00 -1.52 0.00 0.00 31.29 31.05 1wi0 h VAL 47 CO 0.03 0.16 0.31 0.40 0.02 0.00 0.00 177.57 178.49 1wi0 h ILE 48 N -1.00 0.27 -0.55 4.57 2.04 0.82 1.55 117.51 125.20 1wi0 h ILE 48 Ca -0.03 -0.07 0.16 0.00 1.00 0.00 0.00 64.86 65.92 1wi0 h ILE 48 Cb 0.40 0.04 -0.02 0.00 -0.74 0.00 0.00 36.82 36.51 1wi0 h ILE 48 CO -0.02 0.04 0.75 1.23 0.00 0.00 0.00 178.15 180.16 1wi0 h GLY 49 N 0.20 0.00 1.28 5.37 0.00 -1.23 1.59 103.07 110.29 1wi0 h GLY 49 Ca 0.61 0.00 -0.28 0.00 0.00 0.00 0.00 47.33 47.66 1wi0 h GLY 49 CO -0.68 0.00 -1.50 1.46 0.00 0.00 0.00 176.54 175.82 1wi0 h GLN 50 N 0.00 0.12 0.01 4.80 4.20 0.21 -2.87 115.11 121.57 1wi0 h GLN 50 Ca 0.26 -0.20 -0.00 0.00 0.06 0.00 0.00 58.65 58.77 1wi0 h GLN 50 Cb 1.76 0.07 0.00 0.00 0.30 0.00 0.00 27.48 29.62 1wi0 h GLN 50 CO -0.00 0.90 -0.00 0.28 -0.67 0.00 0.00 178.83 179.33 1wi0 h VAL 51 N 0.03 1.54 -2.85 -0.54 2.07 0.22 -3.38 116.25 113.34 1wi0 h VAL 51 Ca -0.22 -1.67 -0.61 0.00 0.82 0.00 0.00 66.70 65.02 1wi0 h VAL 51 Cb 1.96 2.67 -0.42 0.00 -1.52 0.00 0.00 31.29 33.99 1wi0 h VAL 51 CO 0.12 0.43 -0.59 0.18 0.02 0.00 0.00 177.57 177.74 1wi0 n LEU 52 N -4.75 3.10 0.24 2.57 4.32 0.13 -4.87 117.00 117.74 1wi0 n LEU 52 Ca -0.09 -5.25 0.14 0.00 -0.02 0.00 0.00 56.01 50.79 1wi0 n LEU 52 Cb 0.35 -0.70 0.41 0.00 -1.62 0.00 0.00 43.42 41.87 1wi0 n LEU 52 CO 0.33 1.83 0.87 1.55 -1.22 0.00 0.00 177.39 180.76 1wi0 h PRO 53 N 5.09 0.00 -0.01 3.23 0.13 -1.69 -2.84 132.00 135.91 1wi0 h PRO 53 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1wi0 h PRO 53 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1wi0 h PRO 53 CO 0.74 0.05 -0.62 -1.91 -0.23 0.00 0.00 178.00 176.03 1wi0 n GLU 54 N -3.13 0.94 -3.86 0.86 2.13 -1.26 -4.80 120.64 111.51 1wi0 n GLU 54 Ca 0.02 -0.70 -0.29 0.00 0.66 0.00 0.00 57.16 56.85 1wi0 n GLU 54 Cb 0.44 -1.46 -0.16 0.00 0.27 0.00 0.00 31.44 30.52 1wi0 n GLU 54 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1wi0 s ALA 55 N -2.58 1.60 1.23 4.31 0.00 -1.07 -5.13 121.76 120.12 1wi0 s ALA 55 Ca 0.15 -1.11 -0.18 0.00 0.00 0.00 0.00 51.96 50.83 1wi0 s ALA 55 Cb 0.17 -1.33 0.26 0.00 0.00 0.00 0.00 23.12 22.21 1wi0 s ALA 55 CO 0.64 -1.18 0.59 2.41 0.00 0.00 0.00 175.76 178.22 1wi0 n THR 56 N 4.81 0.00 0.00 0.00 -1.04 -1.26 -4.62 114.28 112.18 1wi0 n THR 56 Ca -0.11 -0.22 0.00 0.00 -2.04 0.00 0.00 64.05 61.68 1wi0 n THR 56 Cb 0.45 -0.80 0.00 0.00 -1.82 0.00 0.00 70.33 68.16 1wi0 n THR 56 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1wi0 n THR 57 N -5.02 0.00 0.00 12.58 -1.04 -1.26 -4.08 114.28 115.46 1wi0 n THR 57 Ca 0.06 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 1wi0 n THR 57 Cb 0.54 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.05 1wi0 n THR 57 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1wi0 n THR 58 N -0.86 0.00 -4.39 12.58 -1.04 -1.26 -4.47 114.28 114.83 1wi0 n THR 58 Ca 0.00 0.00 -0.20 0.00 -2.04 0.00 0.00 64.05 61.81 1wi0 n THR 58 Cb 0.00 0.00 -0.10 0.00 -1.82 0.00 0.00 70.33 68.41 1wi0 n THR 58 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1wi0 s ALA 59 N 0.00 2.12 0.12 2.41 0.00 -1.26 -4.85 121.76 120.30 1wi0 s ALA 59 Ca 0.00 -1.90 -0.12 0.00 0.00 0.00 0.00 51.96 49.93 1wi0 s ALA 59 Cb 0.00 0.50 0.01 0.00 0.00 0.00 0.00 23.12 23.63 1wi0 s ALA 59 CO 0.00 -0.24 0.31 -0.59 0.00 0.00 0.00 175.76 175.24 1wi0 s PHE 60 N -3.29 0.03 0.23 0.00 -0.71 -1.17 -0.92 117.98 112.14 1wi0 s PHE 60 Ca 0.32 -0.40 0.10 0.00 -1.04 0.00 0.00 56.93 55.91 1wi0 s PHE 60 Cb 0.06 0.10 -0.04 0.00 -1.21 0.00 0.00 43.02 41.93 1wi0 s PHE 60 CO 0.12 -0.66 -0.11 -1.21 -1.34 0.00 0.00 175.22 172.03 1wi0 s GLU 61 N -3.85 1.99 -0.13 1.99 2.02 -0.12 -0.04 118.70 120.56 1wi0 s GLU 61 Ca 0.06 -1.44 -0.06 0.00 0.02 0.00 0.00 54.97 53.55 1wi0 s GLU 61 Cb 0.03 -2.04 0.05 0.00 0.10 0.00 0.00 34.13 32.27 1wi0 s GLU 61 CO -0.09 0.39 0.29 1.52 0.02 0.00 0.00 175.26 177.38 1wi0 s TYR 62 N -2.05 -0.42 0.26 1.61 -0.85 -0.73 -0.45 117.35 114.72 1wi0 s TYR 62 Ca 0.27 0.94 -0.30 0.00 -0.52 0.00 0.00 57.07 57.47 1wi0 s TYR 62 Cb -0.07 0.09 -0.11 0.00 0.38 0.00 0.00 41.96 42.25 1wi0 s TYR 62 CO 0.16 -0.28 1.53 -1.21 -1.52 0.00 0.00 175.55 174.22 1wi0 s GLU 63 N 1.49 4.19 0.00 -3.49 2.02 -1.25 0.16 118.70 121.82 1wi0 s GLU 63 Ca -0.08 2.44 0.00 0.00 0.02 0.00 0.00 54.97 57.35 1wi0 s GLU 63 Cb -0.10 -3.07 0.00 0.00 0.10 0.00 0.00 34.13 31.05 1wi0 s GLU 63 CO -0.10 -0.54 0.00 -3.47 0.02 0.00 0.00 175.26 171.18 1wi0 n ASP 64 N 2.44 0.21 -0.12 -0.19 -0.08 -1.26 -4.88 116.55 112.67 1wi0 n ASP 64 Ca 0.08 0.00 -0.12 0.00 -1.51 0.00 0.00 54.79 53.24 1wi0 n ASP 64 Cb 0.39 0.00 -0.02 0.00 2.34 0.00 0.00 41.12 43.82 1wi0 n ASP 64 CO 0.00 0.00 0.00 1.05 0.12 0.00 0.00 177.20 178.37 1wi0 h GLU 65 N 0.00 0.81 -0.17 -0.67 4.11 -2.00 -2.29 114.58 114.37 1wi0 h GLU 65 Ca 0.00 -0.37 0.00 0.00 0.07 0.00 0.00 59.36 59.06 1wi0 h GLU 65 Cb 0.00 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.24 1wi0 h GLU 65 CO 0.00 1.00 0.00 -0.25 0.07 0.00 0.00 179.01 179.83 1wi0 n ASP 66 N -4.24 1.00 -4.14 3.06 9.92 -1.26 -4.91 116.55 115.98 1wi0 n ASP 66 Ca -0.02 -1.89 -0.42 0.00 -0.53 0.00 0.00 54.79 51.93 1wi0 n ASP 66 Cb 0.44 -0.11 -0.02 0.00 -0.64 0.00 0.00 41.12 40.80 1wi0 n ASP 66 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1wi0 n GLY 67 N 0.85 -0.62 0.62 0.44 0.00 -0.86 -4.82 105.19 100.80 1wi0 n GLY 67 Ca 0.09 0.29 0.07 0.00 0.00 0.00 0.00 46.02 46.47 1wi0 n GLY 67 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1wi0 n ASP 68 N -2.39 2.37 -2.64 1.61 2.03 -1.26 -4.85 116.55 111.41 1wi0 n ASP 68 Ca -0.18 -1.67 -0.05 0.00 0.52 0.00 0.00 54.79 53.42 1wi0 n ASP 68 Cb 0.60 -0.05 -0.04 0.00 -0.72 0.00 0.00 41.12 40.91 1wi0 n ASP 68 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1wi0 n ARG 69 N 0.81 -4.36 -1.82 -0.67 5.12 -1.26 -4.97 116.66 109.51 1wi0 n ARG 69 Ca 0.09 3.31 -0.30 0.00 -1.93 0.00 0.00 57.85 59.03 1wi0 n ARG 69 Cb 0.38 -4.93 0.19 0.00 -1.16 0.00 0.00 32.46 26.94 1wi0 n ARG 69 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1wi0 s ILE 70 N -0.76 1.95 -0.01 0.55 -1.09 0.12 -4.72 121.20 117.24 1wi0 s ILE 70 Ca -0.25 0.00 0.02 0.00 -2.23 0.00 0.00 60.65 58.19 1wi0 s ILE 70 Cb 0.02 -2.93 -0.00 0.00 -1.58 0.00 0.00 42.46 37.96 1wi0 s ILE 70 CO 0.76 0.00 -0.08 -0.89 -1.23 0.00 0.00 174.94 173.51 1wi0 s THR 71 N -3.77 0.63 -0.32 2.92 2.01 -1.26 -1.77 115.64 114.07 1wi0 s THR 71 Ca 0.73 -0.31 0.02 0.00 0.31 0.00 0.00 61.69 62.45 1wi0 s THR 71 Cb -0.05 -0.55 0.09 0.00 0.01 0.00 0.00 72.50 72.00 1wi0 s THR 71 CO 0.53 0.19 0.02 -0.69 -0.69 0.00 0.00 174.62 173.99 1wi0 s VAL 72 N 0.02 2.46 -0.31 3.82 1.01 0.95 -4.86 120.40 123.49 1wi0 s VAL 72 Ca 0.00 -2.02 0.05 0.00 0.00 0.00 0.00 61.98 60.01 1wi0 s VAL 72 Cb -0.05 -2.66 0.13 0.00 0.00 0.00 0.00 36.38 33.80 1wi0 s VAL 72 CO -0.00 -0.41 1.10 0.54 0.00 0.00 0.00 175.10 176.33 1wi0 n ARG 73 N 4.38 2.85 -3.59 2.72 1.74 -1.26 -3.02 116.66 120.49 1wi0 n ARG 73 Ca -0.03 -1.79 -0.10 0.00 -0.77 0.00 0.00 57.85 55.16 1wi0 n ARG 73 Cb 0.42 -1.14 -0.05 0.00 -1.02 0.00 0.00 32.46 30.66 1wi0 n ARG 73 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1wi0 s SER 74 N -1.15 -0.37 0.37 0.55 0.15 -1.26 -5.01 113.70 106.98 1wi0 s SER 74 Ca 0.11 0.46 0.21 0.00 0.70 0.00 0.00 55.95 57.43 1wi0 s SER 74 Cb 0.07 0.38 1.32 0.00 -1.71 0.00 0.00 66.02 66.08 1wi0 s SER 74 CO 0.05 -0.31 1.59 0.44 1.20 0.00 0.00 173.24 176.22 1wi0 h ASP 75 N 2.79 0.34 -0.40 5.45 3.32 -1.97 0.35 116.42 126.31 1wi0 h ASP 75 Ca -0.20 0.24 0.05 0.00 0.02 0.00 0.00 57.03 57.14 1wi0 h ASP 75 Cb 1.16 0.24 -0.08 0.00 0.22 0.00 0.00 39.33 40.87 1wi0 h ASP 75 CO 0.28 -0.37 -0.54 -0.08 -1.72 0.00 0.00 179.24 176.80 1wi0 h GLU 76 N 0.05 -0.37 -0.86 3.56 4.81 -2.00 0.12 114.58 119.89 1wi0 h GLU 76 Ca 0.83 0.03 0.07 0.00 -0.13 0.00 0.00 59.36 60.16 1wi0 h GLU 76 Cb 2.21 0.08 -0.07 0.00 0.63 0.00 0.00 28.75 31.61 1wi0 h GLU 76 CO -0.72 -0.25 0.52 0.93 -0.73 0.00 0.00 179.01 178.77 1wi0 h GLU 77 N -0.39 0.90 -0.39 1.92 3.07 -0.66 -2.20 114.58 116.83 1wi0 h GLU 77 Ca 0.07 -0.05 0.08 0.00 -0.50 0.00 0.00 59.36 58.96 1wi0 h GLU 77 Cb 0.58 -0.20 -0.09 0.00 -0.84 0.00 0.00 28.75 28.19 1wi0 h GLU 77 CO -0.58 0.60 -0.24 1.98 -1.40 0.00 0.00 179.01 179.37 1wi0 h MET 78 N 0.93 -0.17 -0.06 2.33 4.05 -0.32 0.63 114.93 122.33 1wi0 h MET 78 Ca 0.39 0.01 0.02 0.00 -0.28 0.00 0.00 59.70 59.83 1wi0 h MET 78 Cb 0.23 0.04 -0.00 0.00 -0.80 0.00 0.00 31.60 31.06 1wi0 h MET 78 CO -0.19 -0.11 0.05 1.57 0.23 0.00 0.00 176.91 178.45 1wi0 h LYS 79 N -0.17 0.00 0.25 0.39 2.10 -0.43 -0.61 116.57 118.10 1wi0 h LYS 79 Ca 0.19 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.83 1wi0 h LYS 79 Cb 0.47 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.80 1wi0 h LYS 79 CO -0.49 0.00 -0.12 0.00 -2.00 0.00 0.00 179.45 176.83 1wi0 h ALA 80 N 1.96 -0.34 -0.93 0.07 0.00 0.44 0.31 119.26 120.76 1wi0 h ALA 80 Ca 0.03 -0.20 0.17 0.00 0.00 0.00 0.00 54.91 54.91 1wi0 h ALA 80 Cb 0.12 0.13 -0.10 0.00 0.00 0.00 0.00 17.79 17.94 1wi0 h ALA 80 CO -0.00 -0.41 0.52 1.98 0.00 0.00 0.00 179.25 181.34 1wi0 h MET 81 N -0.91 0.68 -0.05 0.00 1.85 0.43 0.19 114.93 117.11 1wi0 h MET 81 Ca -0.03 -0.04 -0.21 0.00 -0.61 0.00 0.00 59.70 58.80 1wi0 h MET 81 Cb 0.50 -0.15 0.00 0.00 0.43 0.00 0.00 31.60 32.38 1wi0 h MET 81 CO 0.06 0.45 -0.84 -0.07 -0.40 0.00 0.00 176.91 176.10 1wi0 h LEU 82 N 0.70 0.58 -2.34 3.39 3.38 -1.15 -1.05 115.31 118.82 1wi0 h LEU 82 Ca 0.52 -0.42 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1wi0 h LEU 82 Cb 0.78 -0.18 -0.00 0.00 0.09 0.00 0.00 40.66 41.35 1wi0 h LEU 82 CO -0.38 1.20 -0.03 -1.28 0.09 0.00 0.00 178.44 178.04 1wi0 h SER 83 N 0.30 0.00 0.00 -0.43 0.87 0.24 -2.35 113.55 112.19 1wi0 h SER 83 Ca -0.06 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.50 1wi0 h SER 83 Cb 1.45 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.41 1wi0 h SER 83 CO 0.15 0.03 -0.34 0.22 -0.53 0.00 0.00 176.83 176.36 1wi0 h TYR 84 N 0.00 0.00 -0.82 2.24 3.20 -0.73 -2.99 116.97 117.87 1wi0 h TYR 84 Ca -0.00 0.00 0.20 0.00 3.14 0.00 0.00 58.73 62.07 1wi0 h TYR 84 Cb 0.08 0.00 -0.15 0.00 1.54 0.00 0.00 36.73 38.20 1wi0 h TYR 84 CO 0.00 0.00 -0.06 0.98 -1.64 0.00 0.00 178.16 177.44 1wi0 n TYR 85 N -3.91 0.44 -0.04 -3.82 9.36 -0.42 0.13 117.16 118.91 1wi0 n TYR 85 Ca -0.05 1.00 -0.15 0.00 3.32 0.00 0.00 57.90 62.02 1wi0 n TYR 85 Cb 0.18 -1.07 -0.08 0.00 -0.63 0.00 0.00 39.34 37.74 1wi0 n TYR 85 CO 0.00 0.00 0.00 1.88 0.22 0.00 0.00 176.86 178.96 1wi0 h TYR 86 N 0.00 0.69 -0.09 2.98 0.05 -1.62 1.60 116.97 120.59 1wi0 h TYR 86 Ca 0.46 -0.28 0.02 0.00 0.05 0.00 0.00 58.73 58.99 1wi0 h TYR 86 Cb 0.87 -0.12 -0.00 0.00 1.01 0.00 0.00 36.73 38.49 1wi0 h TYR 86 CO -0.50 1.03 0.07 0.77 -1.05 0.00 0.00 178.16 178.48 1wi0 h SER 87 N 0.15 0.00 0.04 3.88 0.02 0.13 0.23 113.55 118.01 1wi0 h SER 87 Ca -0.01 0.00 -0.38 0.00 -0.84 0.00 0.00 61.79 60.56 1wi0 h SER 87 Cb 1.04 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.53 1wi0 h SER 87 CO 0.09 0.00 -2.28 1.07 -1.14 0.00 0.00 176.83 174.57 1wi0 n THR 88 N -4.25 1.59 -0.23 -2.27 5.66 0.28 -4.08 114.28 110.97 1wi0 n THR 88 Ca -0.01 -0.55 -0.01 0.00 -3.05 0.00 0.00 64.05 60.43 1wi0 n THR 88 Cb 0.18 -1.59 0.11 0.00 -1.55 0.00 0.00 70.33 67.47 1wi0 n THR 88 CO 0.00 0.00 0.00 0.58 -3.05 0.00 0.00 175.07 172.60 1wi0 h VAL 89 N -0.12 0.93 0.00 1.08 2.07 0.27 0.21 116.25 120.69 1wi0 h VAL 89 Ca -0.53 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 66.76 1wi0 h VAL 89 Cb 1.88 0.23 -0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1wi0 h VAL 89 CO -0.07 0.12 -0.01 0.00 0.02 0.00 0.00 177.57 177.62 1wi0 h MET 90 N 0.64 0.00 0.15 1.57 -0.00 -0.74 -0.85 114.93 115.71 1wi0 h MET 90 Ca 0.31 0.00 -0.29 0.00 -0.00 0.00 0.00 59.70 59.72 1wi0 h MET 90 Cb 0.24 0.00 0.01 0.00 -0.00 0.00 0.00 31.60 31.85 1wi0 h MET 90 CO -0.21 0.01 -1.28 1.49 -0.00 0.00 0.00 176.91 176.92 1wi0 h GLU 91 N 0.00 0.33 0.00 -0.10 4.81 -0.77 -2.39 114.58 116.45 1wi0 h GLU 91 Ca -0.00 -0.55 -0.03 0.00 -0.13 0.00 0.00 59.36 58.65 1wi0 h GLU 91 Cb 0.03 0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.61 1wi0 h GLU 91 CO 0.00 1.26 -0.14 1.96 -0.73 0.00 0.00 179.01 181.36 1wi0 h GLN 92 N 0.09 0.00 0.00 1.92 4.20 -0.03 0.56 115.11 121.85 1wi0 h GLN 92 Ca -0.16 0.00 -0.06 0.00 0.06 0.00 0.00 58.65 58.49 1wi0 h GLN 92 Cb 2.00 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.78 1wi0 h GLN 92 CO 0.22 0.14 -0.39 1.96 -0.67 0.00 0.00 178.83 180.09 1wi0 h GLN 93 N 0.00 0.00 0.00 1.46 4.20 -1.42 -0.82 115.11 118.53 1wi0 h GLN 93 Ca -0.00 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.71 1wi0 h GLN 93 Cb 0.44 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.22 1wi0 h GLN 93 CO 0.02 0.76 -0.01 -0.39 -0.67 0.00 0.00 178.83 178.53 1wi0 h VAL 94 N -1.00 0.65 0.00 -0.54 -1.51 -1.34 -2.68 116.25 109.82 1wi0 h VAL 94 Ca -0.09 -0.05 -0.01 0.00 -1.23 0.00 0.00 66.70 65.31 1wi0 h VAL 94 Cb 0.88 1.03 -0.00 0.00 -2.13 0.00 0.00 31.29 31.07 1wi0 h VAL 94 CO -0.06 0.01 -0.11 0.78 -1.23 0.00 0.00 177.57 176.97 1wi0 h ASN 95 N 0.00 0.00 0.00 4.19 -0.26 -0.98 -3.49 115.58 115.03 1wi0 h ASN 95 Ca -0.00 -0.37 0.00 0.00 -0.56 0.00 0.00 56.30 55.37 1wi0 h ASN 95 Cb 0.03 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.29 1wi0 h ASN 95 CO 0.00 0.75 0.00 0.61 -1.06 0.00 0.00 177.43 177.73 1wi0 n GLY 96 N 1.69 4.26 3.30 2.83 0.00 -0.41 -5.08 105.19 111.78 1wi0 n GLY 96 Ca -0.06 -0.67 -0.37 0.00 0.00 0.00 0.00 46.02 44.93 1wi0 n GLY 96 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1wi0 n GLN 97 N 0.00 0.12 -2.49 1.61 6.02 -0.65 -4.82 117.38 117.17 1wi0 n GLN 97 Ca 0.00 0.06 -0.33 0.00 -0.01 0.00 0.00 57.00 56.72 1wi0 n GLN 97 Cb 0.00 -1.40 -0.03 0.00 1.02 0.00 0.00 30.24 29.82 1wi0 n GLN 97 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1wi0 s LEU 98 N 3.10 3.75 0.25 1.08 1.43 -1.26 -4.15 118.68 122.88 1wi0 s LEU 98 Ca 0.57 1.76 -0.29 0.00 -1.03 0.00 0.00 54.13 55.14 1wi0 s LEU 98 Cb -0.35 -4.54 -0.09 0.00 0.03 0.00 0.00 46.19 41.24 1wi0 s LEU 98 CO 0.66 -0.70 0.93 -0.63 0.23 0.00 0.00 176.35 176.84 1wi0 s ILE 99 N -2.27 4.11 0.22 -0.59 -1.09 -1.26 -4.96 121.20 115.36 1wi0 s ILE 99 Ca 0.63 2.02 0.06 0.00 -2.23 0.00 0.00 60.65 61.13 1wi0 s ILE 99 Cb -0.13 -4.26 -0.04 0.00 -1.58 0.00 0.00 42.46 36.46 1wi0 s ILE 99 CO 0.24 0.44 0.20 -1.83 -1.23 0.00 0.00 174.94 172.75 1wi0 s GLU 100 N -1.34 2.99 0.39 2.79 -1.05 -1.26 -5.05 118.70 116.17 1wi0 s GLU 100 Ca 0.42 -0.95 -0.24 0.00 -0.15 0.00 0.00 54.97 54.05 1wi0 s GLU 100 Cb -0.24 -2.64 -0.09 0.00 -0.44 0.00 0.00 34.13 30.72 1wi0 s GLU 100 CO 0.30 0.43 1.06 -1.25 0.95 0.00 0.00 175.26 176.75 1wi0 s PRO 101 N -3.60 4.18 -1.01 -4.83 0.04 -1.26 -4.88 135.00 123.64 1wi0 s PRO 101 Ca 0.32 1.54 -0.26 0.00 0.04 0.00 0.00 61.00 62.65 1wi0 s PRO 101 Cb -0.09 -2.58 -0.20 0.00 0.04 0.00 0.00 34.50 31.67 1wi0 s PRO 101 CO 0.25 -0.13 2.00 -0.11 0.04 0.00 0.00 177.00 179.05 1wi0 n LEU 102 N 0.00 2.04 -4.54 -3.56 7.94 0.11 -4.73 117.00 114.26 1wi0 n LEU 102 Ca 0.05 -2.66 -0.41 0.00 -1.11 0.00 0.00 56.01 51.88 1wi0 n LEU 102 Cb 0.49 -1.60 -0.05 0.00 0.53 0.00 0.00 43.42 42.80 1wi0 n LEU 102 CO 0.46 -2.74 1.97 1.67 -1.11 0.00 0.00 177.39 177.63 1wi0 n GLN 103 N 8.11 1.19 -4.36 1.96 7.27 -1.26 -2.18 117.38 128.11 1wi0 n GLN 103 Ca 0.43 0.19 -0.24 0.00 0.07 0.00 0.00 57.00 57.45 1wi0 n GLN 103 Cb 0.46 -3.05 -0.08 0.00 2.41 0.00 0.00 30.24 29.98 1wi0 n GLN 103 CO 0.00 0.00 0.00 0.96 0.07 0.00 0.00 177.06 178.09 1wi0 s ILE 104 N 10.11 3.07 -0.08 1.69 -4.36 -0.11 -3.85 121.20 127.66 1wi0 s ILE 104 Ca 1.04 -2.07 0.01 0.00 -0.26 0.00 0.00 60.65 59.37 1wi0 s ILE 104 Cb -0.43 -2.62 0.02 0.00 1.25 0.00 0.00 42.46 40.68 1wi0 s ILE 104 CO 0.34 -0.36 -0.10 -0.36 0.24 0.00 0.00 174.94 174.70 1wi0 s PHE 105 N -2.33 1.44 -0.41 1.37 0.40 0.40 -1.19 117.98 117.66 1wi0 s PHE 105 Ca 0.30 -0.61 -0.29 0.00 -0.60 0.00 0.00 56.93 55.74 1wi0 s PHE 105 Cb -0.06 -1.12 0.01 0.00 0.51 0.00 0.00 43.02 42.36 1wi0 s PHE 105 CO 0.18 -0.37 1.41 -1.25 0.70 0.00 0.00 175.22 175.89 1wi0 s PRO 106 N 1.07 3.57 -0.81 0.24 0.04 -1.26 -0.95 135.00 136.90 1wi0 s PRO 106 Ca -0.07 0.94 -0.25 0.00 0.04 0.00 0.00 61.00 61.66 1wi0 s PRO 106 Cb -0.14 -4.03 -0.05 0.00 0.04 0.00 0.00 34.50 30.32 1wi0 s PRO 106 CO -0.01 -1.57 1.98 1.03 0.04 0.00 0.00 177.00 178.46 1wi0 s ARG 107 N 4.95 2.48 -0.60 4.56 0.52 -0.10 -4.89 118.95 125.87 1wi0 s ARG 107 Ca 0.61 0.04 -0.27 0.00 -0.52 0.00 0.00 55.73 55.59 1wi0 s ARG 107 Cb -0.14 -4.86 -0.01 0.00 0.52 0.00 0.00 34.95 30.46 1wi0 s ARG 107 CO 0.33 -3.30 1.70 -1.54 0.02 0.00 0.00 175.30 172.50 1wi0 s SER 108 N 8.40 5.59 -0.04 0.23 1.04 -1.26 -4.06 113.70 123.60 1wi0 s SER 108 Ca 0.72 0.28 -0.31 0.00 0.48 0.00 0.00 55.95 57.12 1wi0 s SER 108 Cb -0.09 -2.54 0.11 0.00 0.10 0.00 0.00 66.02 63.61 1wi0 s SER 108 CO 0.06 -2.14 1.16 -0.83 0.98 0.00 0.00 173.24 172.47 1wi0 s GLY 109 N 6.69 -0.35 0.91 7.32 0.00 -1.26 -5.01 107.32 115.60 1wi0 s GLY 109 Ca 0.61 0.93 -0.12 0.00 0.00 0.00 0.00 44.72 46.13 1wi0 s GLY 109 CO 0.21 0.26 1.14 2.56 0.00 0.00 0.00 173.10 177.27 1wi0 s PRO 110 N -2.65 1.17 -0.28 2.90 0.04 -1.26 -4.49 135.00 130.43 1wi0 s PRO 110 Ca 0.11 0.30 -0.29 0.00 0.04 0.00 0.00 61.00 61.16 1wi0 s PRO 110 Cb 0.01 -1.84 0.19 0.00 0.04 0.00 0.00 34.50 32.90 1wi0 s PRO 110 CO -0.04 -2.18 1.35 -1.12 0.04 0.00 0.00 177.00 175.05 1wi0 s SER 111 N -4.03 -0.05 -0.36 6.66 0.01 -1.26 -5.09 113.70 109.58 1wi0 s SER 111 Ca 0.64 0.06 -0.06 0.00 1.31 0.00 0.00 55.95 57.90 1wi0 s SER 111 Cb -0.15 0.05 0.21 0.00 0.21 0.00 0.00 66.02 66.34 1wi0 s SER 111 CO 0.53 -0.05 1.04 -0.55 0.41 0.00 0.00 173.24 174.63 1wi0 s SER 112 N -0.94 -0.43 0.00 2.44 0.15 -1.26 -5.17 113.70 108.49 1wi0 s SER 112 Ca 0.08 -0.45 0.16 0.00 0.70 0.00 0.00 55.95 56.45 1wi0 s SER 112 Cb -0.01 0.57 0.13 0.00 -1.71 0.00 0.00 66.02 64.99 1wi0 s SER 112 CO -0.08 -0.02 1.01 0.61 1.20 0.00 0.00 173.24 175.95