#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 0.53 -1.18 1.61 7.64 -1.26 -5.16 113.62 115.80 1wi0 n SER 2 Ca 0.00 0.24 0.05 0.00 1.01 0.00 0.00 58.87 60.17 1wi0 n SER 2 Cb 0.00 -0.04 -0.03 0.00 -1.01 0.00 0.00 64.21 63.14 1wi0 n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1wi0 n SER 3 N -3.40 -6.38 0.00 6.43 7.64 -1.26 -5.07 113.62 111.58 1wi0 n SER 3 Ca 0.00 1.34 0.00 0.00 1.01 0.00 0.00 58.87 61.22 1wi0 n SER 3 Cb 0.04 -3.77 0.00 0.00 -1.01 0.00 0.00 64.21 59.48 1wi0 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wi0 n GLY 4 N -2.90 5.21 3.01 0.23 0.00 -1.26 -4.94 105.19 104.53 1wi0 n GLY 4 Ca -0.03 -1.56 0.01 0.00 0.00 0.00 0.00 46.02 44.44 1wi0 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1wi0 s SER 5 N 1.00 -1.06 -0.05 1.61 1.04 -1.26 -5.05 113.70 109.93 1wi0 s SER 5 Ca 0.00 -0.59 -0.15 0.00 0.48 0.00 0.00 55.95 55.69 1wi0 s SER 5 Cb 0.00 1.35 -0.10 0.00 0.10 0.00 0.00 66.02 67.38 1wi0 s SER 5 CO 0.00 -0.11 0.62 -1.28 0.98 0.00 0.00 173.24 173.45 1wi0 h SER 6 N 6.24 -0.32 -5.00 7.02 0.87 -1.98 -3.47 113.55 116.91 1wi0 h SER 6 Ca 0.02 -0.10 0.00 0.00 -1.23 0.00 0.00 61.79 60.48 1wi0 h SER 6 Cb 1.20 0.08 0.00 0.00 -0.44 0.00 0.00 62.40 63.24 1wi0 h SER 6 CO 0.03 0.16 0.00 0.61 -0.53 0.00 0.00 176.83 177.09 1wi0 n GLY 7 N 0.63 2.79 3.57 5.77 0.00 -1.26 -4.88 105.19 111.81 1wi0 n GLY 7 Ca -0.06 -1.92 -0.35 0.00 0.00 0.00 0.00 46.02 43.68 1wi0 n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wi0 s PRO 8 N -3.11 3.20 -0.13 1.61 0.04 -1.26 -4.86 135.00 130.49 1wi0 s PRO 8 Ca 0.00 -1.29 -0.04 0.00 0.04 0.00 0.00 61.00 59.70 1wi0 s PRO 8 Cb 0.00 -5.33 0.07 0.00 0.04 0.00 0.00 34.50 29.27 1wi0 s PRO 8 CO 0.00 -2.99 0.23 0.12 0.04 0.00 0.00 177.00 174.39 1wi0 s PHE 9 N 7.52 -0.33 0.07 0.56 5.36 -1.26 -5.15 117.98 124.76 1wi0 s PHE 9 Ca 0.60 0.71 0.07 0.00 -0.96 0.00 0.00 56.93 57.35 1wi0 s PHE 9 Cb 0.00 -0.17 -0.03 0.00 -0.34 0.00 0.00 43.02 42.48 1wi0 s PHE 9 CO 0.05 -0.39 -0.19 0.00 -1.46 0.00 0.00 175.22 173.23 1wi0 s ALA 11 N -1.01 -0.92 0.00 0.00 0.00 -1.26 -5.08 121.76 113.49 1wi0 s ALA 11 Ca 0.05 -0.54 0.00 0.00 0.00 0.00 0.00 51.96 51.47 1wi0 s ALA 11 Cb -0.09 0.82 0.00 0.00 0.00 0.00 0.00 23.12 23.85 1wi0 s ALA 11 CO 0.03 -1.00 0.00 -1.33 0.00 0.00 0.00 175.76 173.46 1wi0 n MET 12 N -0.48 0.00 -0.78 0.00 2.81 -1.26 -4.82 117.12 112.59 1wi0 n MET 12 Ca -0.05 0.00 0.10 0.00 -1.81 0.00 0.00 57.70 55.94 1wi0 n MET 12 Cb 0.60 0.00 -0.03 0.00 -0.71 0.00 0.00 33.22 33.08 1wi0 n MET 12 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1wi0 n GLU 13 N -2.32 -1.61 0.12 0.03 4.71 -1.26 -4.54 120.64 115.77 1wi0 n GLU 13 Ca 0.00 1.11 -0.13 0.00 -0.01 0.00 0.00 57.16 58.14 1wi0 n GLU 13 Cb 0.00 -1.94 -0.08 0.00 -1.01 0.00 0.00 31.44 28.41 1wi0 n GLU 13 CO 0.00 0.00 0.00 -0.97 0.09 0.00 0.00 177.13 176.25 1wi0 h ASN 14 N -0.73 -0.28 -2.90 1.62 -1.24 -2.02 -3.45 115.58 106.58 1wi0 h ASN 14 Ca -0.01 -0.23 -0.63 0.00 0.71 0.00 0.00 56.30 56.14 1wi0 h ASN 14 Cb 0.72 0.07 -0.15 0.00 0.73 0.00 0.00 38.32 39.69 1wi0 h ASN 14 CO 0.01 0.13 -0.76 -1.10 -1.29 0.00 0.00 177.43 174.43 1wi0 s GLN 15 N -4.35 1.85 0.28 6.67 -0.21 -1.26 -5.14 119.66 117.49 1wi0 s GLN 15 Ca -0.14 -1.43 0.11 0.00 0.02 0.00 0.00 55.36 53.92 1wi0 s GLN 15 Cb 0.02 -2.00 -0.05 0.00 1.00 0.00 0.00 33.01 31.97 1wi0 s GLN 15 CO 0.53 0.40 -0.13 0.14 -2.12 0.00 0.00 175.29 174.12 1wi0 s VAL 16 N -1.85 2.72 -0.00 1.09 -7.23 -1.26 -4.78 120.40 109.09 1wi0 s VAL 16 Ca 0.25 -2.25 0.01 0.00 -1.81 0.00 0.00 61.98 58.18 1wi0 s VAL 16 Cb -0.08 -2.48 -0.04 0.00 0.56 0.00 0.00 36.38 34.34 1wi0 s VAL 16 CO 0.14 -0.37 0.02 -0.22 -0.31 0.00 0.00 175.10 174.36 1wi0 s LEU 17 N -3.57 3.60 -0.25 1.32 2.96 0.48 -4.97 118.68 118.26 1wi0 s LEU 17 Ca 0.31 0.02 0.01 0.00 -0.22 0.00 0.00 54.13 54.25 1wi0 s LEU 17 Cb -0.05 -2.08 0.07 0.00 0.50 0.00 0.00 46.19 44.63 1wi0 s LEU 17 CO 0.17 0.28 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.75 1wi0 s VAL 18 N -1.12 1.54 -0.23 1.68 1.01 -1.26 -0.06 120.40 121.96 1wi0 s VAL 18 Ca 0.20 -1.32 -0.12 0.00 0.00 0.00 0.00 61.98 60.74 1wi0 s VAL 18 Cb -0.12 -1.86 -0.05 0.00 0.00 0.00 0.00 36.38 34.36 1wi0 s VAL 18 CO 0.11 -0.18 0.23 -0.63 0.00 0.00 0.00 175.10 174.63 1wi0 s ILE 19 N 1.37 5.31 -0.63 2.22 1.01 -1.14 -0.45 121.20 128.89 1wi0 s ILE 19 Ca -0.03 0.33 -0.13 0.00 0.00 0.00 0.00 60.65 60.82 1wi0 s ILE 19 Cb -0.19 -3.57 0.16 0.00 0.01 0.00 0.00 42.46 38.87 1wi0 s ILE 19 CO -0.08 0.31 0.55 -0.60 0.00 0.00 0.00 174.94 175.12 1wi0 s ARG 20 N 1.20 3.04 0.10 2.79 3.52 -0.87 0.11 118.95 128.85 1wi0 s ARG 20 Ca 0.11 -2.06 -0.31 0.00 -0.13 0.00 0.00 55.73 53.34 1wi0 s ARG 20 Cb -0.14 -4.21 -0.08 0.00 -1.56 0.00 0.00 34.95 28.96 1wi0 s ARG 20 CO 0.06 -1.27 1.45 0.42 -0.81 0.00 0.00 175.30 175.15 1wi0 s ILE 21 N 0.90 3.20 0.13 4.11 1.09 0.18 -2.30 121.20 128.51 1wi0 s ILE 21 Ca 0.10 0.82 -0.31 0.00 -1.10 0.00 0.00 60.65 60.16 1wi0 s ILE 21 Cb -0.22 -3.53 -0.08 0.00 -1.06 0.00 0.00 42.46 37.58 1wi0 s ILE 21 CO -0.02 0.05 1.30 -0.75 -0.10 0.00 0.00 174.94 175.42 1wi0 s LYS 22 N 1.43 4.38 -0.03 2.79 2.47 -0.60 -2.01 119.74 128.17 1wi0 s LYS 22 Ca 0.66 1.98 0.04 0.00 -1.56 0.00 0.00 55.97 57.09 1wi0 s LYS 22 Cb -0.38 -3.25 -0.03 0.00 -1.46 0.00 0.00 37.83 32.71 1wi0 s LYS 22 CO 0.30 -0.31 -0.13 0.42 0.16 0.00 0.00 175.35 175.80 1wi0 s ILE 23 N 0.70 3.19 0.04 5.43 -1.09 -1.26 -4.56 121.20 123.65 1wi0 s ILE 23 Ca 0.60 -0.75 -0.30 0.00 -2.23 0.00 0.00 60.65 57.96 1wi0 s ILE 23 Cb -0.35 -2.28 -0.05 0.00 -1.58 0.00 0.00 42.46 38.20 1wi0 s ILE 23 CO 0.33 0.54 1.17 -2.16 -1.23 0.00 0.00 174.94 173.59 1wi0 s PRO 24 N -0.92 4.44 -1.48 2.79 0.04 -1.26 -3.58 135.00 135.04 1wi0 s PRO 24 Ca 0.13 1.72 -0.07 0.00 0.04 0.00 0.00 61.00 62.81 1wi0 s PRO 24 Cb -0.11 -3.38 0.01 0.00 0.04 0.00 0.00 34.50 31.06 1wi0 s PRO 24 CO 0.02 -0.25 0.13 0.09 0.04 0.00 0.00 177.00 177.03 1wi0 n ASN 25 N 4.06 -0.04 -3.64 6.66 4.13 -1.26 -4.88 115.26 120.29 1wi0 n ASN 25 Ca 0.09 -1.28 -0.02 0.00 1.68 0.00 0.00 54.58 55.04 1wi0 n ASN 25 Cb 0.47 -1.58 -0.05 0.00 -1.54 0.00 0.00 39.78 37.08 1wi0 n ASN 25 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 1wi0 s SER 26 N -4.22 -0.04 0.77 6.41 0.01 -1.23 -5.16 113.70 110.24 1wi0 s SER 26 Ca 0.10 0.06 -0.16 0.00 1.31 0.00 0.00 55.95 57.26 1wi0 s SER 26 Cb -0.06 0.05 -0.07 0.00 0.21 0.00 0.00 66.02 66.16 1wi0 s SER 26 CO 0.99 -0.03 0.17 0.61 0.41 0.00 0.00 173.24 175.39 1wi0 n GLY 27 N 0.86 -2.43 3.80 3.44 0.00 -1.26 -4.03 105.19 105.58 1wi0 n GLY 27 Ca -0.03 -0.48 -0.39 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.01 3.55 0.11 4.61 0.00 -1.26 -4.30 121.76 122.45 1wi0 s ALA 28 Ca 0.58 0.12 -0.09 0.00 0.00 0.00 0.00 51.96 52.57 1wi0 s ALA 28 Cb -0.32 -2.72 -0.06 0.00 0.00 0.00 0.00 23.12 20.02 1wi0 s ALA 28 CO 0.65 0.37 0.42 0.08 0.00 0.00 0.00 175.76 177.28 1wi0 s VAL 29 N -1.15 5.09 -0.23 0.00 1.01 -0.85 -4.87 120.40 119.40 1wi0 s VAL 29 Ca 0.32 0.38 -0.06 0.00 0.00 0.00 0.00 61.98 62.61 1wi0 s VAL 29 Cb -0.20 -3.64 -0.02 0.00 0.00 0.00 0.00 36.38 32.52 1wi0 s VAL 29 CO 0.21 0.20 0.02 1.51 0.00 0.00 0.00 175.10 177.04 1wi0 s ASP 30 N -1.96 4.81 -0.53 3.32 -4.77 -1.26 0.49 116.67 116.77 1wi0 s ASP 30 Ca 0.36 -0.26 -0.21 0.00 -3.30 0.00 0.00 52.55 49.14 1wi0 s ASP 30 Cb -0.13 -1.85 0.05 0.00 -1.09 0.00 0.00 42.92 39.90 1wi0 s ASP 30 CO 0.20 -0.01 0.75 0.86 0.70 0.00 0.00 175.17 177.67 1wi0 s TRP 31 N 1.45 2.94 -0.49 2.11 -0.00 0.31 -4.91 118.94 120.34 1wi0 s TRP 31 Ca 0.05 -0.34 -0.26 0.00 -0.00 0.00 0.00 56.10 55.55 1wi0 s TRP 31 Cb -0.15 -3.76 -0.07 0.00 -0.00 0.00 0.00 33.47 29.49 1wi0 s TRP 31 CO 0.01 -1.17 2.39 -0.08 -0.00 0.00 0.00 176.95 178.10 1wi0 s THR 32 N 3.16 3.02 -0.19 5.86 -1.32 -1.26 -2.90 115.64 122.01 1wi0 s THR 32 Ca 0.21 0.01 -0.06 0.00 -1.21 0.00 0.00 61.69 60.64 1wi0 s THR 32 Cb -0.17 -3.04 -0.03 0.00 -1.51 0.00 0.00 72.50 67.75 1wi0 s THR 32 CO 0.15 -0.04 0.04 -0.69 -2.21 0.00 0.00 174.62 171.86 1wi0 s VAL 33 N 12.12 4.43 -0.19 5.08 1.01 0.91 -4.96 120.40 138.80 1wi0 s VAL 33 Ca 0.97 -0.16 0.10 0.00 0.00 0.00 0.00 61.98 62.89 1wi0 s VAL 33 Cb -0.17 -3.00 -0.19 0.00 0.00 0.00 0.00 36.38 33.02 1wi0 s VAL 33 CO 0.26 0.44 -0.04 1.41 0.00 0.00 0.00 175.10 177.17 1wi0 n HIS 34 N 3.85 0.00 -1.44 5.22 8.25 -1.26 0.18 115.22 130.02 1wi0 n HIS 34 Ca -0.17 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.04 1wi0 n HIS 34 Cb 0.52 -0.87 -0.06 0.00 1.12 0.00 0.00 29.99 30.71 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 -2.84 6.42 -0.36 0.41 7.64 -1.26 -4.52 113.62 119.12 1wi0 n SER 35 Ca -0.33 -3.17 0.03 0.00 1.01 0.00 0.00 58.87 56.41 1wi0 n SER 35 Cb 1.02 -1.23 0.10 0.00 -1.01 0.00 0.00 64.21 63.08 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 3.89 0.46 0.97 0.23 0.00 -1.86 0.13 103.07 106.89 1wi0 h GLY 36 Ca 0.38 0.39 -0.19 0.00 0.00 0.00 0.00 47.33 47.91 1wi0 h GLY 36 CO 0.84 -0.31 -0.72 -0.56 0.00 0.00 0.00 176.54 175.80 1wi0 h PRO 37 N -0.01 0.57 -2.19 4.80 0.13 -1.94 -3.29 132.00 130.07 1wi0 h PRO 37 Ca 0.42 -0.55 -0.45 0.00 -0.87 0.00 0.00 66.00 64.55 1wi0 h PRO 37 Cb 0.67 0.14 -0.11 0.00 0.13 0.00 0.00 31.00 31.82 1wi0 h PRO 37 CO -0.99 1.17 0.77 0.94 -0.23 0.00 0.00 178.00 179.66 1wi0 n GLN 38 N -4.09 2.71 -5.14 0.86 7.27 0.36 -4.87 117.38 114.49 1wi0 n GLN 38 Ca -0.10 -2.04 -0.31 0.00 0.07 0.00 0.00 57.00 54.62 1wi0 n GLN 38 Cb 0.72 -2.23 -0.15 0.00 2.41 0.00 0.00 30.24 30.99 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 -1.22 2.12 0.23 1.69 2.96 -0.55 -4.78 118.68 119.14 1wi0 s LEU 39 Ca 0.62 -0.51 0.10 0.00 -0.22 0.00 0.00 54.13 54.12 1wi0 s LEU 39 Cb 0.31 -1.33 -0.04 0.00 0.50 0.00 0.00 46.19 45.63 1wi0 s LEU 39 CO -0.12 0.30 -0.12 -0.76 -1.32 0.00 0.00 176.35 174.33 1wi0 s LEU 40 N -0.87 2.86 0.20 -0.68 1.43 -1.26 -4.93 118.68 115.42 1wi0 s LEU 40 Ca 0.11 -0.76 -0.10 0.00 -1.03 0.00 0.00 54.13 52.35 1wi0 s LEU 40 Cb -0.10 -1.46 0.23 0.00 0.03 0.00 0.00 46.19 44.90 1wi0 s LEU 40 CO 0.00 0.06 1.77 0.15 0.23 0.00 0.00 176.35 178.57 1wi0 h PHE 41 N 2.50 0.51 0.40 0.29 3.57 -1.91 -2.68 116.94 119.62 1wi0 h PHE 41 Ca -0.44 0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.08 1wi0 h PHE 41 Cb 1.23 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 39.81 1wi0 h PHE 41 CO 0.71 0.20 -0.47 0.00 -2.23 0.00 0.00 178.31 176.52 1wi0 h ARG 42 N 0.52 -0.87 -0.83 1.11 -0.00 -1.98 -1.83 114.38 110.51 1wi0 h ARG 42 Ca 0.29 0.06 0.20 0.00 -0.50 0.00 0.00 59.98 60.02 1wi0 h ARG 42 Cb 0.26 0.20 -0.16 0.00 0.00 0.00 0.00 29.97 30.27 1wi0 h ARG 42 CO -0.23 -0.58 -0.09 -0.25 0.00 0.00 0.00 179.97 178.82 1wi0 n ASP 43 N -5.53 -0.19 0.09 7.04 8.00 -1.03 0.20 116.55 125.13 1wi0 n ASP 43 Ca -0.11 1.42 -0.12 0.00 0.71 0.00 0.00 54.79 56.69 1wi0 n ASP 43 Cb 0.43 -0.48 -0.05 0.00 -0.02 0.00 0.00 41.12 41.01 1wi0 n ASP 43 CO 0.00 0.00 0.00 0.58 -0.39 0.00 0.00 177.20 177.39 1wi0 h VAL 44 N 0.00 0.47 -0.90 2.53 2.07 -1.18 0.31 116.25 119.56 1wi0 h VAL 44 Ca 0.45 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.99 1wi0 h VAL 44 Cb 0.84 0.47 -0.05 0.00 -1.52 0.00 0.00 31.29 31.03 1wi0 h VAL 44 CO -0.81 0.00 0.59 -0.07 0.02 0.00 0.00 177.57 177.30 1wi0 h LEU 45 N -0.41 1.01 -2.21 2.57 -0.00 0.28 0.82 115.31 117.37 1wi0 h LEU 45 Ca 0.04 -0.02 -0.01 0.00 -0.00 0.00 0.00 57.88 57.89 1wi0 h LEU 45 Cb 0.45 -0.25 -0.00 0.00 -0.00 0.00 0.00 40.66 40.86 1wi0 h LEU 45 CO -0.17 0.72 -0.05 0.44 -0.00 0.00 0.00 178.44 179.39 1wi0 h ASP 46 N 1.19 0.00 0.00 -0.43 3.32 0.20 0.66 116.42 121.36 1wi0 h ASP 46 Ca 0.34 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.39 1wi0 h ASP 46 Cb -0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.45 1wi0 h ASP 46 CO -0.08 0.05 -0.34 0.58 -1.72 0.00 0.00 179.24 177.73 1wi0 h VAL 47 N 0.00 0.00 -0.91 -1.35 2.07 0.22 -3.37 116.25 112.91 1wi0 h VAL 47 Ca -0.00 -0.99 0.25 0.00 0.82 0.00 0.00 66.70 66.78 1wi0 h VAL 47 Cb 0.12 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 29.74 1wi0 h VAL 47 CO 0.01 0.00 0.20 0.40 0.02 0.00 0.00 177.57 178.20 1wi0 h ILE 48 N -0.99 0.23 -1.31 4.57 2.04 0.63 1.36 117.51 124.04 1wi0 h ILE 48 Ca 0.00 -0.05 0.38 0.00 1.00 0.00 0.00 64.86 66.19 1wi0 h ILE 48 Cb 0.34 0.07 -0.07 0.00 -0.74 0.00 0.00 36.82 36.42 1wi0 h ILE 48 CO 0.00 0.03 0.91 1.23 0.00 0.00 0.00 178.15 180.32 1wi0 h GLY 49 N 0.14 0.41 1.78 5.37 0.00 -1.03 1.66 103.07 111.41 1wi0 h GLY 49 Ca 0.58 -0.05 -0.24 0.00 0.00 0.00 0.00 47.33 47.61 1wi0 h GLY 49 CO -0.72 -0.08 -1.15 1.46 0.00 0.00 0.00 176.54 176.05 1wi0 h GLN 50 N 0.09 0.12 0.07 4.80 4.20 0.17 -2.32 115.11 122.23 1wi0 h GLN 50 Ca 0.67 -0.21 -0.00 0.00 0.06 0.00 0.00 58.65 59.17 1wi0 h GLN 50 Cb 2.41 0.08 0.00 0.00 0.30 0.00 0.00 27.48 30.27 1wi0 h GLN 50 CO -0.12 1.08 -0.03 0.28 -0.67 0.00 0.00 178.83 179.37 1wi0 h VAL 51 N 0.03 1.09 -2.89 -0.54 2.07 0.23 -3.39 116.25 112.85 1wi0 h VAL 51 Ca -0.08 -1.53 -0.61 0.00 0.82 0.00 0.00 66.70 65.29 1wi0 h VAL 51 Cb 1.87 1.95 -0.42 0.00 -1.52 0.00 0.00 31.29 33.17 1wi0 h VAL 51 CO 0.16 0.33 -0.60 0.18 0.02 0.00 0.00 177.57 177.66 1wi0 n LEU 52 N -4.79 2.98 0.24 2.57 4.32 0.34 -4.88 117.00 117.79 1wi0 n LEU 52 Ca -0.07 -5.21 0.15 0.00 -0.02 0.00 0.00 56.01 50.85 1wi0 n LEU 52 Cb 0.30 -0.67 0.44 0.00 -1.62 0.00 0.00 43.42 41.86 1wi0 n LEU 52 CO 0.25 1.82 0.90 1.55 -1.22 0.00 0.00 177.39 180.69 1wi0 h PRO 53 N 5.17 0.00 -0.00 3.23 0.13 -1.60 -2.75 132.00 136.18 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 0.74 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.87 1wi0 h PRO 53 CO 0.72 0.00 -0.69 -1.91 -0.23 0.00 0.00 178.00 175.89 1wi0 n GLU 54 N -3.06 0.13 -3.84 0.86 4.07 -1.26 -4.75 120.64 112.79 1wi0 n GLU 54 Ca 0.02 -0.09 -0.29 0.00 -0.06 0.00 0.00 57.16 56.74 1wi0 n GLU 54 Cb 0.41 -1.50 -0.16 0.00 -0.06 0.00 0.00 31.44 30.13 1wi0 n GLU 54 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1wi0 s ALA 55 N -2.94 1.57 1.46 4.31 0.00 -1.04 -5.13 121.76 120.00 1wi0 s ALA 55 Ca 0.11 -1.15 -0.23 0.00 0.00 0.00 0.00 51.96 50.69 1wi0 s ALA 55 Cb 0.17 -1.36 0.36 0.00 0.00 0.00 0.00 23.12 22.29 1wi0 s ALA 55 CO 0.75 -1.24 0.82 -2.37 0.00 0.00 0.00 175.76 173.73 1wi0 n THR 56 N 4.82 0.00 0.00 0.00 5.66 -1.26 -4.66 114.28 118.85 1wi0 n THR 56 Ca -0.10 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.90 1wi0 n THR 56 Cb 0.45 -0.93 0.00 0.00 -1.55 0.00 0.00 70.33 68.30 1wi0 n THR 56 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 1wi0 n THR 57 N -5.71 0.00 -1.11 1.09 -1.04 -1.25 -3.75 114.28 102.52 1wi0 n THR 57 Ca 0.13 0.00 -0.04 0.00 -2.04 0.00 0.00 64.05 62.10 1wi0 n THR 57 Cb 0.57 0.00 -0.02 0.00 -1.82 0.00 0.00 70.33 69.06 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 -1.15 0.00 0.00 12.58 -1.04 -1.26 -4.55 114.28 118.86 1wi0 n THR 58 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1wi0 n THR 58 Cb 0.00 -0.97 0.00 0.00 -1.82 0.00 0.00 70.33 67.54 1wi0 n THR 58 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1wi0 n ALA 59 N 1.07 0.00 -2.52 2.41 0.00 -1.26 -4.77 120.51 115.44 1wi0 n ALA 59 Ca -0.04 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.24 1wi0 n ALA 59 Cb 0.42 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 19.80 1wi0 n ALA 59 CO 0.00 0.00 0.00 -0.59 0.00 0.00 0.00 177.50 176.91 1wi0 s PHE 60 N -2.00 1.40 0.14 0.00 -0.71 -0.97 -1.10 117.98 114.75 1wi0 s PHE 60 Ca 0.00 -1.47 0.06 0.00 -1.04 0.00 0.00 56.93 54.48 1wi0 s PHE 60 Cb 0.00 -0.45 -0.04 0.00 -1.21 0.00 0.00 43.02 41.32 1wi0 s PHE 60 CO 0.00 -0.94 -0.14 -1.21 -1.34 0.00 0.00 175.22 171.58 1wi0 s GLU 61 N -3.41 1.12 -0.15 1.99 2.02 -0.80 0.31 118.70 119.79 1wi0 s GLU 61 Ca 0.36 -1.34 -0.07 0.00 0.02 0.00 0.00 54.97 53.95 1wi0 s GLU 61 Cb 0.02 -0.99 0.06 0.00 0.10 0.00 0.00 34.13 33.32 1wi0 s GLU 61 CO 0.23 0.18 0.33 1.52 0.02 0.00 0.00 175.26 177.54 1wi0 s TYR 62 N -2.35 -0.51 0.18 1.61 -0.85 -0.97 -1.73 117.35 112.72 1wi0 s TYR 62 Ca 0.13 1.10 -0.33 0.00 -0.52 0.00 0.00 57.07 57.45 1wi0 s TYR 62 Cb -0.04 0.14 -0.14 0.00 0.38 0.00 0.00 41.96 42.30 1wi0 s TYR 62 CO 0.04 -0.34 1.58 0.39 -1.52 0.00 0.00 175.55 175.70 1wi0 n GLU 63 N 4.70 2.21 -1.49 -3.49 1.02 -1.26 -0.35 120.64 121.98 1wi0 n GLU 63 Ca -0.17 0.80 -0.06 0.00 -0.02 0.00 0.00 57.16 57.70 1wi0 n GLU 63 Cb 0.52 -2.56 0.02 0.00 -0.02 0.00 0.00 31.44 29.40 1wi0 n GLU 63 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1wi0 n ASP 64 N 3.32 0.56 -0.12 1.62 5.75 -1.26 -4.85 116.55 121.57 1wi0 n ASP 64 Ca 0.16 -1.42 -0.04 0.00 -0.01 0.00 0.00 54.79 53.48 1wi0 n ASP 64 Cb 0.30 -0.14 0.03 0.00 -1.03 0.00 0.00 41.12 40.28 1wi0 n ASP 64 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 1wi0 h GLU 65 N 0.00 0.07 0.00 0.11 5.08 -1.98 0.34 114.58 118.20 1wi0 h GLU 65 Ca -0.08 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1wi0 h GLU 65 Cb 0.36 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.59 1wi0 h GLU 65 CO 0.11 0.05 0.00 -0.44 -1.00 0.00 0.00 179.01 177.73 1wi0 h ASP 66 N 0.07 0.00 -4.25 1.42 5.19 -2.01 -3.47 116.42 113.37 1wi0 h ASP 66 Ca 0.20 0.00 -0.10 0.00 -0.62 0.00 0.00 57.03 56.51 1wi0 h ASP 66 Cb 0.29 0.00 0.08 0.00 0.18 0.00 0.00 39.33 39.88 1wi0 h ASP 66 CO -0.35 0.00 -0.34 0.61 -3.12 0.00 0.00 179.24 176.03 1wi0 n GLY 67 N 0.42 -0.30 0.13 2.75 0.00 0.12 -4.97 105.19 103.35 1wi0 n GLY 67 Ca 0.02 0.16 0.02 0.00 0.00 0.00 0.00 46.02 46.22 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 -2.17 1.45 -2.54 1.61 2.03 -1.26 -4.82 116.55 110.85 1wi0 n ASP 68 Ca -0.03 -1.30 -0.06 0.00 0.52 0.00 0.00 54.79 53.92 1wi0 n ASP 68 Cb 0.55 -0.01 -0.05 0.00 -0.72 0.00 0.00 41.12 40.89 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 0.09 -4.41 -1.74 -0.67 5.12 -1.26 -4.94 116.66 108.86 1wi0 n ARG 69 Ca 0.02 3.34 -0.30 0.00 -1.93 0.00 0.00 57.85 58.98 1wi0 n ARG 69 Cb 0.12 -4.89 0.21 0.00 -1.16 0.00 0.00 32.46 26.74 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 -0.64 1.90 -0.05 0.55 -1.09 0.52 -4.71 121.20 117.68 1wi0 s ILE 70 Ca -0.28 0.00 0.01 0.00 -2.23 0.00 0.00 60.65 58.15 1wi0 s ILE 70 Cb 0.02 -2.88 0.02 0.00 -1.58 0.00 0.00 42.46 38.03 1wi0 s ILE 70 CO 0.76 0.00 -0.07 -0.89 -1.23 0.00 0.00 174.94 173.52 1wi0 s THR 71 N -3.72 0.72 -0.32 2.92 2.01 -1.26 -2.30 115.64 113.68 1wi0 s THR 71 Ca 0.75 -0.23 -0.03 0.00 0.31 0.00 0.00 61.69 62.48 1wi0 s THR 71 Cb -0.04 -0.71 0.05 0.00 0.01 0.00 0.00 72.50 71.81 1wi0 s THR 71 CO 0.54 0.26 0.04 -0.69 -0.69 0.00 0.00 174.62 174.09 1wi0 s VAL 72 N 0.84 3.28 -0.06 3.82 1.01 0.15 -4.88 120.40 124.56 1wi0 s VAL 72 Ca -0.12 -1.31 0.07 0.00 0.00 0.00 0.00 61.98 60.62 1wi0 s VAL 72 Cb -0.15 -2.88 -0.10 0.00 0.00 0.00 0.00 36.38 33.25 1wi0 s VAL 72 CO 0.01 -0.15 0.06 0.54 0.00 0.00 0.00 175.10 175.57 1wi0 n ARG 73 N 4.69 2.15 -4.34 2.72 1.74 -1.26 -2.28 116.66 120.08 1wi0 n ARG 73 Ca -0.13 -0.02 -0.17 0.00 -0.77 0.00 0.00 57.85 56.76 1wi0 n ARG 73 Cb 0.44 -1.20 -0.10 0.00 -1.02 0.00 0.00 32.46 30.58 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 -3.71 1.52 0.49 0.55 0.15 -1.26 -4.89 113.70 106.55 1wi0 s SER 74 Ca -0.04 -1.34 0.18 0.00 0.70 0.00 0.00 55.95 55.45 1wi0 s SER 74 Cb 0.03 0.09 1.22 0.00 -1.71 0.00 0.00 66.02 65.65 1wi0 s SER 74 CO 0.32 -0.66 2.05 0.44 1.20 0.00 0.00 173.24 176.59 1wi0 h ASP 75 N 2.37 0.13 -0.42 5.45 5.19 -1.97 -0.99 116.42 126.18 1wi0 h ASP 75 Ca -0.39 0.00 0.06 0.00 -0.62 0.00 0.00 57.03 56.09 1wi0 h ASP 75 Cb 1.24 -0.03 -0.06 0.00 0.18 0.00 0.00 39.33 40.67 1wi0 h ASP 75 CO 0.63 0.08 0.08 -0.33 -3.12 0.00 0.00 179.24 176.59 1wi0 h GLU 76 N 0.15 0.21 -0.27 3.56 3.07 -2.00 -0.50 114.58 118.79 1wi0 h GLU 76 Ca 0.17 -0.01 -0.13 0.00 -0.50 0.00 0.00 59.36 58.88 1wi0 h GLU 76 Cb 0.47 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.32 1wi0 h GLU 76 CO -0.02 0.14 -0.38 0.93 -1.40 0.00 0.00 179.01 178.27 1wi0 h GLU 77 N 0.22 0.63 0.24 2.33 5.08 -1.55 -3.11 114.58 118.42 1wi0 h GLU 77 Ca 0.20 -0.31 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1wi0 h GLU 77 Cb 0.24 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.49 1wi0 h GLU 77 CO -0.26 0.91 -0.22 1.98 -1.00 0.00 0.00 179.01 180.41 1wi0 h MET 78 N 0.52 -0.44 -1.47 2.33 4.05 -0.53 0.25 114.93 119.65 1wi0 h MET 78 Ca 0.05 0.03 0.43 0.00 -0.28 0.00 0.00 59.70 59.92 1wi0 h MET 78 Cb 0.90 0.10 -0.06 0.00 -0.80 0.00 0.00 31.60 31.74 1wi0 h MET 78 CO 0.08 -0.29 1.05 0.87 0.23 0.00 0.00 176.91 178.85 1wi0 h LYS 79 N -0.46 0.01 0.22 0.39 1.57 -1.21 0.58 116.57 117.67 1wi0 h LYS 79 Ca -0.03 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 1wi0 h LYS 79 Cb 0.39 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.70 1wi0 h LYS 79 CO -0.02 0.00 -0.11 0.00 -0.57 0.00 0.00 179.45 178.76 1wi0 h ALA 80 N 1.27 -0.29 -0.96 3.86 0.00 -1.14 0.57 119.26 122.57 1wi0 h ALA 80 Ca 0.70 -0.21 0.17 0.00 0.00 0.00 0.00 54.91 55.57 1wi0 h ALA 80 Cb 2.79 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 20.60 1wi0 h ALA 80 CO -0.02 -0.38 0.56 1.98 0.00 0.00 0.00 179.25 181.39 1wi0 h MET 81 N -0.86 0.73 0.00 0.00 1.85 0.35 0.45 114.93 117.44 1wi0 h MET 81 Ca -0.03 -0.04 -0.13 0.00 -0.61 0.00 0.00 59.70 58.88 1wi0 h MET 81 Cb 0.51 -0.16 -0.02 0.00 0.43 0.00 0.00 31.60 32.36 1wi0 h MET 81 CO 0.05 0.48 -0.63 -0.07 -0.40 0.00 0.00 176.91 176.34 1wi0 h LEU 82 N 0.75 0.00 -1.55 3.39 3.38 -0.96 -2.00 115.31 118.33 1wi0 h LEU 82 Ca 0.54 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.51 1wi0 h LEU 82 Cb 0.78 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.53 1wi0 h LEU 82 CO -0.36 0.63 0.00 0.28 0.09 0.00 0.00 178.44 179.08 1wi0 h SER 83 N 0.00 0.00 0.01 -0.43 0.02 0.22 -2.66 113.55 110.72 1wi0 h SER 83 Ca -0.01 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.60 1wi0 h SER 83 Cb 1.21 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.70 1wi0 h SER 83 CO 0.08 0.00 -1.89 0.00 -1.14 0.00 0.00 176.83 173.88 1wi0 n TYR 84 N -2.84 0.60 -0.21 3.45 9.36 -0.53 -3.20 117.16 123.80 1wi0 n TYR 84 Ca 0.00 0.23 0.01 0.00 3.32 0.00 0.00 57.90 61.46 1wi0 n TYR 84 Cb 0.23 -1.06 0.09 0.00 -0.63 0.00 0.00 39.34 37.97 1wi0 n TYR 84 CO 0.00 0.00 0.00 -0.92 0.22 0.00 0.00 176.86 176.16 1wi0 h TYR 85 N -0.82 -0.11 -0.19 2.98 3.20 -1.29 0.74 116.97 121.48 1wi0 h TYR 85 Ca -0.50 0.05 -0.19 0.00 3.14 0.00 0.00 58.73 61.23 1wi0 h TYR 85 Cb 1.53 0.14 -0.00 0.00 1.54 0.00 0.00 36.73 39.95 1wi0 h TYR 85 CO 0.02 -0.19 -0.63 1.88 -1.64 0.00 0.00 178.16 177.60 1wi0 h TYR 86 N 0.09 0.86 0.00 -3.82 0.05 -1.68 1.77 116.97 114.24 1wi0 h TYR 86 Ca 0.32 -0.33 -0.04 0.00 0.05 0.00 0.00 58.73 58.73 1wi0 h TYR 86 Cb 0.52 -0.15 -0.01 0.00 1.01 0.00 0.00 36.73 38.10 1wi0 h TYR 86 CO -0.40 1.12 -0.19 1.03 -1.05 0.00 0.00 178.16 178.67 1wi0 h SER 87 N 0.49 0.00 0.02 3.88 0.87 -1.01 -1.15 113.55 116.66 1wi0 h SER 87 Ca -0.01 0.00 -0.38 0.00 -1.23 0.00 0.00 61.79 60.17 1wi0 h SER 87 Cb 1.21 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.12 1wi0 h SER 87 CO 0.12 0.19 -2.20 1.07 -0.53 0.00 0.00 176.83 175.49 1wi0 n THR 88 N -4.20 1.57 -0.23 2.23 5.66 0.24 -4.04 114.28 115.51 1wi0 n THR 88 Ca -0.02 -0.43 0.04 0.00 -3.05 0.00 0.00 64.05 60.59 1wi0 n THR 88 Cb 0.26 -1.74 0.16 0.00 -1.55 0.00 0.00 70.33 67.46 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 -0.48 0.54 0.00 1.08 2.07 0.28 0.95 116.25 120.68 1wi0 h VAL 89 Ca -0.55 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 66.87 1wi0 h VAL 89 Cb 1.73 0.26 -0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1wi0 h VAL 89 CO -0.19 0.05 -0.04 0.00 0.02 0.00 0.00 177.57 177.41 1wi0 h MET 90 N 0.26 0.00 0.01 1.57 -0.00 -1.40 -0.73 114.93 114.64 1wi0 h MET 90 Ca 0.39 0.00 -0.22 0.00 -0.00 0.00 0.00 59.70 59.86 1wi0 h MET 90 Cb 0.64 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 32.21 1wi0 h MET 90 CO -0.49 0.04 -1.08 0.93 -0.00 0.00 0.00 176.91 176.31 1wi0 h GLU 91 N 0.00 0.02 0.00 -0.10 4.39 0.68 -2.89 114.58 116.68 1wi0 h GLU 91 Ca -0.00 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1wi0 h GLU 91 Cb 0.11 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 1wi0 h GLU 91 CO 0.01 0.97 0.00 1.96 -1.16 0.00 0.00 179.01 180.79 1wi0 h GLN 92 N 0.00 0.00 0.10 2.33 4.20 0.63 -0.55 115.11 121.83 1wi0 h GLN 92 Ca -0.04 0.00 -0.29 0.00 0.06 0.00 0.00 58.65 58.37 1wi0 h GLN 92 Cb 1.80 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.57 1wi0 h GLN 92 CO 0.13 0.00 -1.54 1.96 -0.67 0.00 0.00 178.83 178.71 1wi0 h GLN 93 N 0.00 0.22 -0.08 1.46 4.20 -1.45 0.11 115.11 119.56 1wi0 h GLN 93 Ca 0.00 -0.37 -0.07 0.00 0.06 0.00 0.00 58.65 58.27 1wi0 h GLN 93 Cb 0.47 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.38 1wi0 h GLN 93 CO 0.00 1.18 -0.29 -0.39 -0.67 0.00 0.00 178.83 178.66 1wi0 h VAL 94 N -0.31 1.24 -0.17 -0.54 -1.51 -1.35 -2.73 116.25 110.87 1wi0 h VAL 94 Ca -0.34 -1.13 -0.06 0.00 -1.23 0.00 0.00 66.70 63.94 1wi0 h VAL 94 Cb 1.77 1.50 -0.00 0.00 -2.13 0.00 0.00 31.29 32.42 1wi0 h VAL 94 CO 0.03 0.34 -0.13 0.78 -1.23 0.00 0.00 177.57 177.35 1wi0 h ASN 95 N 0.14 0.41 0.00 4.19 -0.26 -1.23 -3.48 115.58 115.36 1wi0 h ASN 95 Ca 0.02 -0.45 0.00 0.00 -0.56 0.00 0.00 56.30 55.31 1wi0 h ASN 95 Cb 0.58 -0.12 0.00 0.00 -1.06 0.00 0.00 38.32 37.73 1wi0 h ASN 95 CO 0.04 0.78 0.00 0.61 -1.06 0.00 0.00 177.43 177.80 1wi0 n GLY 96 N 0.11 1.97 3.49 2.83 0.00 -1.03 -5.10 105.19 107.47 1wi0 n GLY 96 Ca -0.06 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.72 1wi0 n GLY 96 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1wi0 s GLN 97 N -0.21 1.75 0.55 1.61 -0.21 0.36 -5.03 119.66 118.46 1wi0 s GLN 97 Ca 0.00 -1.77 -0.19 0.00 0.02 0.00 0.00 55.36 53.42 1wi0 s GLN 97 Cb 0.00 -1.79 -0.06 0.00 1.00 0.00 0.00 33.01 32.16 1wi0 s GLN 97 CO 0.00 0.31 1.10 -0.51 -2.12 0.00 0.00 175.29 174.07 1wi0 s LEU 98 N -3.54 3.71 0.29 2.90 1.43 -1.26 -4.17 118.68 118.05 1wi0 s LEU 98 Ca 0.30 2.08 -0.25 0.00 -1.03 0.00 0.00 54.13 55.24 1wi0 s LEU 98 Cb -0.04 -4.57 -0.09 0.00 0.03 0.00 0.00 46.19 41.51 1wi0 s LEU 98 CO 0.16 -1.17 0.89 -0.63 0.23 0.00 0.00 176.35 175.82 1wi0 s ILE 99 N -1.92 4.30 0.12 -0.59 -1.09 -1.26 -4.94 121.20 115.81 1wi0 s ILE 99 Ca 0.70 1.70 0.05 0.00 -2.23 0.00 0.00 60.65 60.87 1wi0 s ILE 99 Cb -0.21 -3.99 -0.04 0.00 -1.58 0.00 0.00 42.46 36.64 1wi0 s ILE 99 CO 0.28 0.18 0.07 -1.83 -1.23 0.00 0.00 174.94 172.40 1wi0 s GLU 100 N -1.98 2.75 0.39 2.79 -1.05 -1.26 -5.10 118.70 115.24 1wi0 s GLU 100 Ca 0.48 -0.83 -0.25 0.00 -0.15 0.00 0.00 54.97 54.23 1wi0 s GLU 100 Cb -0.18 -2.62 -0.09 0.00 -0.44 0.00 0.00 34.13 30.80 1wi0 s GLU 100 CO 0.23 0.52 1.06 -1.25 0.95 0.00 0.00 175.26 176.77 1wi0 s PRO 101 N -2.65 4.20 -0.90 -4.83 0.04 -1.26 -4.87 135.00 124.74 1wi0 s PRO 101 Ca 0.29 1.55 -0.25 0.00 0.04 0.00 0.00 61.00 62.63 1wi0 s PRO 101 Cb -0.11 -2.60 -0.19 0.00 0.04 0.00 0.00 34.50 31.64 1wi0 s PRO 101 CO 0.21 -0.12 2.23 -0.11 0.04 0.00 0.00 177.00 179.25 1wi0 n LEU 102 N 0.05 1.31 -4.55 -3.56 7.94 0.41 -4.65 117.00 113.94 1wi0 n LEU 102 Ca 0.04 -1.87 -0.33 0.00 -1.11 0.00 0.00 56.01 52.74 1wi0 n LEU 102 Cb 0.49 -1.61 -0.04 0.00 0.53 0.00 0.00 43.42 42.80 1wi0 n LEU 102 CO 0.46 -3.00 1.80 -1.58 -1.11 0.00 0.00 177.39 173.96 1wi0 s GLN 103 N 8.55 2.16 0.42 1.96 0.74 -1.26 -2.05 119.66 130.17 1wi0 s GLN 103 Ca 0.87 1.05 0.07 0.00 0.05 0.00 0.00 55.36 57.40 1wi0 s GLN 103 Cb -0.12 -4.59 -0.03 0.00 1.10 0.00 0.00 33.01 29.36 1wi0 s GLN 103 CO 0.15 -3.33 0.30 0.96 -0.55 0.00 0.00 175.29 172.82 1wi0 s ILE 104 N 11.83 2.51 -0.05 -2.34 -4.36 -0.97 -4.15 121.20 123.67 1wi0 s ILE 104 Ca 0.89 -1.48 -0.02 0.00 -0.26 0.00 0.00 60.65 59.79 1wi0 s ILE 104 Cb -0.15 -2.99 0.03 0.00 1.25 0.00 0.00 42.46 40.60 1wi0 s ILE 104 CO 0.21 0.00 0.08 -0.36 0.24 0.00 0.00 174.94 175.12 1wi0 s PHE 105 N -2.52 -0.03 -0.65 1.37 0.40 -0.70 -1.56 117.98 114.28 1wi0 s PHE 105 Ca 0.45 0.32 -0.27 0.00 -0.60 0.00 0.00 56.93 56.84 1wi0 s PHE 105 Cb -0.00 -0.29 0.01 0.00 0.51 0.00 0.00 43.02 43.24 1wi0 s PHE 105 CO 0.26 -0.17 1.55 -1.25 0.70 0.00 0.00 175.22 176.31 1wi0 s PRO 106 N 1.66 2.99 -0.57 0.24 0.04 -1.26 -1.90 135.00 136.20 1wi0 s PRO 106 Ca -0.02 0.26 -0.26 0.00 0.04 0.00 0.00 61.00 61.01 1wi0 s PRO 106 Cb -0.12 -4.25 -0.04 0.00 0.04 0.00 0.00 34.50 30.12 1wi0 s PRO 106 CO -0.04 -2.34 2.08 1.03 0.04 0.00 0.00 177.00 177.77 1wi0 s ARG 107 N 6.21 2.41 -0.33 4.56 0.52 -0.26 -4.86 118.95 127.21 1wi0 s ARG 107 Ca 0.52 0.91 -0.27 0.00 -0.52 0.00 0.00 55.73 56.37 1wi0 s ARG 107 Cb -0.11 -4.47 0.01 0.00 0.52 0.00 0.00 34.95 30.90 1wi0 s ARG 107 CO 0.19 -2.97 0.95 -1.54 0.02 0.00 0.00 175.30 171.96 1wi0 s SER 108 N 9.73 6.79 0.07 0.23 1.04 -1.25 -3.85 113.70 126.47 1wi0 s SER 108 Ca 0.79 0.82 -0.09 0.00 0.48 0.00 0.00 55.95 57.95 1wi0 s SER 108 Cb -0.14 -2.48 0.03 0.00 0.10 0.00 0.00 66.02 63.53 1wi0 s SER 108 CO 0.22 -0.79 0.42 0.61 0.98 0.00 0.00 173.24 174.68 1wi0 n GLY 109 N 4.09 1.00 3.73 7.32 0.00 -1.26 -5.01 105.19 115.05 1wi0 n GLY 109 Ca 0.08 -1.01 -0.41 0.00 0.00 0.00 0.00 46.02 44.68 1wi0 n GLY 109 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1wi0 s PRO 110 N -2.02 4.51 -0.31 1.61 0.04 -1.26 -4.75 135.00 132.82 1wi0 s PRO 110 Ca 0.09 1.73 -0.15 0.00 0.04 0.00 0.00 61.00 62.72 1wi0 s PRO 110 Cb -0.01 -3.31 -0.02 0.00 0.04 0.00 0.00 34.50 31.19 1wi0 s PRO 110 CO 0.02 -0.09 0.36 -1.12 0.04 0.00 0.00 177.00 176.21 1wi0 s SER 111 N 0.47 6.20 0.58 6.66 0.01 -1.26 -4.90 113.70 121.45 1wi0 s SER 111 Ca 0.54 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.77 1wi0 s SER 111 Cb -0.29 -2.20 0.00 0.00 0.21 0.00 0.00 66.02 63.74 1wi0 s SER 111 CO 0.32 -0.27 0.00 -0.24 0.41 0.00 0.00 173.24 173.46 1wi0 n SER 112 N 5.36 -8.61 0.00 2.44 2.88 -1.26 -5.22 113.62 109.20 1wi0 n SER 112 Ca -0.09 1.68 0.00 0.00 -1.33 0.00 0.00 58.87 59.13 1wi0 n SER 112 Cb 0.50 -5.06 0.00 0.00 -0.75 0.00 0.00 64.21 58.90 1wi0 n SER 112 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42