#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1wi0 s SER 2 N 0.00 5.89 -0.30 1.61 1.04 -1.26 -5.10 113.70 115.58 1wi0 s SER 2 Ca 0.00 0.37 -0.04 0.00 0.48 0.00 0.00 55.95 56.76 1wi0 s SER 2 Cb 0.00 -1.64 0.17 0.00 0.10 0.00 0.00 66.02 64.65 1wi0 s SER 2 CO 0.00 -0.68 0.63 -0.94 0.98 0.00 0.00 173.24 173.23 1wi0 s SER 3 N -4.20 -1.29 0.25 7.02 1.04 -1.26 -5.15 113.70 110.12 1wi0 s SER 3 Ca 0.48 1.10 -0.30 0.00 0.48 0.00 0.00 55.95 57.71 1wi0 s SER 3 Cb -0.10 2.20 -0.09 0.00 0.10 0.00 0.00 66.02 68.12 1wi0 s SER 3 CO 0.39 -0.24 1.28 -0.83 0.98 0.00 0.00 173.24 174.82 1wi0 s GLY 4 N 2.87 2.68 0.48 7.32 0.00 -1.26 -5.03 107.32 114.39 1wi0 s GLY 4 Ca 0.12 1.12 0.02 0.00 0.00 0.00 0.00 44.72 45.98 1wi0 s GLY 4 CO -0.20 1.96 0.69 -0.56 0.00 0.00 0.00 173.10 174.99 1wi0 s SER 5 N -0.04 5.57 0.04 1.64 0.01 -1.26 -5.12 113.70 114.55 1wi0 s SER 5 Ca 0.53 0.04 0.06 0.00 1.31 0.00 0.00 55.95 57.90 1wi0 s SER 5 Cb -0.37 -1.12 -0.02 0.00 0.21 0.00 0.00 66.02 64.72 1wi0 s SER 5 CO 0.43 -0.89 -0.18 -0.94 0.41 0.00 0.00 173.24 172.06 1wi0 s SER 6 N -4.32 2.17 0.00 2.44 1.04 -1.26 -5.01 113.70 108.76 1wi0 s SER 6 Ca 0.53 -0.51 0.00 0.00 0.48 0.00 0.00 55.95 56.45 1wi0 s SER 6 Cb -0.10 -0.16 0.00 0.00 0.10 0.00 0.00 66.02 65.85 1wi0 s SER 6 CO 0.37 0.11 0.00 0.61 0.98 0.00 0.00 173.24 175.31 1wi0 n GLY 7 N 1.83 0.05 3.81 7.32 0.00 -1.26 -5.10 105.19 111.84 1wi0 n GLY 7 Ca -0.18 -0.80 -0.30 0.00 0.00 0.00 0.00 46.02 44.74 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 -0.02 2.27 -0.03 1.61 0.04 -1.26 -5.09 135.00 132.53 1wi0 s PRO 8 Ca 0.00 0.71 -0.18 0.00 0.04 0.00 0.00 61.00 61.57 1wi0 s PRO 8 Cb 0.00 -1.93 0.03 0.00 0.04 0.00 0.00 34.50 32.64 1wi0 s PRO 8 CO 0.00 -1.51 0.38 0.12 0.04 0.00 0.00 177.00 176.03 1wi0 s PHE 9 N -3.13 -0.28 0.53 0.56 5.36 -1.26 -5.16 117.98 114.60 1wi0 s PHE 9 Ca 0.60 0.45 -0.17 0.00 -0.96 0.00 0.00 56.93 56.86 1wi0 s PHE 9 Cb -0.14 0.15 -0.07 0.00 -0.34 0.00 0.00 43.02 42.62 1wi0 s PHE 9 CO 0.54 -0.42 1.00 0.00 -1.46 0.00 0.00 175.22 174.88 1wi0 s ALA 11 N -2.56 2.65 -0.10 0.00 0.00 -1.26 -5.03 121.76 115.46 1wi0 s ALA 11 Ca 0.60 1.14 -0.05 0.00 0.00 0.00 0.00 51.96 53.65 1wi0 s ALA 11 Cb -0.11 -3.50 0.05 0.00 0.00 0.00 0.00 23.12 19.56 1wi0 s ALA 11 CO 0.31 -1.24 0.25 1.41 0.00 0.00 0.00 175.76 176.49 1wi0 s MET 12 N -3.13 0.21 -0.04 0.00 0.00 -1.26 -5.15 119.30 109.93 1wi0 s MET 12 Ca 0.75 0.53 -0.12 0.00 0.00 0.00 0.00 55.69 56.84 1wi0 s MET 12 Cb -0.35 -0.12 -0.05 0.00 0.00 0.00 0.00 34.83 34.31 1wi0 s MET 12 CO 0.39 -0.16 0.32 -1.21 0.00 0.00 0.00 175.02 174.36 1wi0 s GLU 13 N 1.25 3.78 0.00 4.11 0.41 -1.26 -4.97 118.70 122.02 1wi0 s GLU 13 Ca -0.09 0.24 0.00 0.00 -0.41 0.00 0.00 54.97 54.71 1wi0 s GLU 13 Cb -0.10 -3.22 0.00 0.00 -1.78 0.00 0.00 34.13 29.03 1wi0 s GLU 13 CO -0.08 0.71 0.00 0.27 -0.49 0.00 0.00 175.26 175.66 1wi0 n ASN 14 N 1.91 0.00 -1.41 -0.19 6.94 -1.26 -5.16 115.26 116.09 1wi0 n ASN 14 Ca -0.16 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.40 1wi0 n ASN 14 Cb 0.53 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.95 1wi0 n ASN 14 CO 0.00 0.00 0.00 1.67 -1.03 0.00 0.00 177.26 177.90 1wi0 n GLN 15 N -0.13 -3.82 -0.43 -3.83 -0.06 -1.26 -4.93 117.38 102.92 1wi0 n GLN 15 Ca 0.00 2.92 -0.29 0.00 -2.00 0.00 0.00 57.00 57.63 1wi0 n GLN 15 Cb 0.00 -3.52 0.27 0.00 -4.06 0.00 0.00 30.24 22.93 1wi0 n GLN 15 CO 0.00 0.00 0.00 1.33 -0.20 0.00 0.00 177.06 178.19 1wi0 n VAL 16 N -1.95 0.00 -3.78 1.69 0.24 -1.26 -4.82 118.33 108.45 1wi0 n VAL 16 Ca 0.00 -0.13 -0.19 0.00 -2.04 0.00 0.00 64.34 61.98 1wi0 n VAL 16 Cb 0.28 -1.01 -0.17 0.00 -1.47 0.00 0.00 33.84 31.47 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 0.70 -0.22 1.34 2.96 -1.26 -4.81 118.68 117.39 1wi0 s LEU 17 Ca 0.64 0.02 0.00 0.00 -0.22 0.00 0.00 54.13 54.57 1wi0 s LEU 17 Cb -0.10 -0.20 0.03 0.00 0.50 0.00 0.00 46.19 46.42 1wi0 s LEU 17 CO 0.52 -0.17 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.57 1wi0 s VAL 18 N 1.58 2.45 -0.21 1.68 1.01 -1.26 -1.72 120.40 123.93 1wi0 s VAL 18 Ca -0.02 -1.06 -0.17 0.00 0.00 0.00 0.00 61.98 60.73 1wi0 s VAL 18 Cb -0.13 -2.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.04 1wi0 s VAL 18 CO -0.03 0.32 0.44 -0.63 0.00 0.00 0.00 175.10 175.20 1wi0 s ILE 19 N 1.28 5.16 -0.50 2.22 1.01 -0.77 -0.05 121.20 129.54 1wi0 s ILE 19 Ca 0.01 0.79 -0.15 0.00 0.00 0.00 0.00 60.65 61.30 1wi0 s ILE 19 Cb -0.16 -3.77 0.11 0.00 0.01 0.00 0.00 42.46 38.65 1wi0 s ILE 19 CO -0.08 0.21 0.44 -0.60 0.00 0.00 0.00 174.94 174.90 1wi0 s ARG 20 N 1.57 2.93 -0.26 2.79 3.52 -0.58 0.58 118.95 129.49 1wi0 s ARG 20 Ca 0.20 -1.58 -0.29 0.00 -0.13 0.00 0.00 55.73 53.94 1wi0 s ARG 20 Cb -0.15 -4.19 -0.00 0.00 -1.56 0.00 0.00 34.95 29.05 1wi0 s ARG 20 CO 0.09 -1.20 1.27 0.42 -0.81 0.00 0.00 175.30 175.07 1wi0 s ILE 21 N 1.59 4.22 -0.41 4.11 1.09 0.46 -1.85 121.20 130.41 1wi0 s ILE 21 Ca 0.04 1.42 -0.28 0.00 -1.10 0.00 0.00 60.65 60.72 1wi0 s ILE 21 Cb -0.27 -4.14 -0.00 0.00 -1.06 0.00 0.00 42.46 36.98 1wi0 s ILE 21 CO 0.04 -0.38 1.61 -0.75 -0.10 0.00 0.00 174.94 175.36 1wi0 s LYS 22 N 3.92 3.36 0.25 2.79 2.36 -0.83 -2.12 119.74 129.47 1wi0 s LYS 22 Ca 0.55 1.05 -0.28 0.00 -2.55 0.00 0.00 55.97 54.74 1wi0 s LYS 22 Cb -0.18 -4.14 -0.09 0.00 -1.05 0.00 0.00 37.83 32.38 1wi0 s LYS 22 CO 0.20 -1.83 0.90 0.42 1.55 0.00 0.00 175.35 176.59 1wi0 s ILE 23 N 6.41 4.18 0.22 5.43 -1.09 -0.93 -4.46 121.20 130.95 1wi0 s ILE 23 Ca 0.68 1.92 -0.30 0.00 -2.23 0.00 0.00 60.65 60.73 1wi0 s ILE 23 Cb -0.17 -4.20 -0.08 0.00 -1.58 0.00 0.00 42.46 36.43 1wi0 s ILE 23 CO 0.31 0.40 1.10 -2.16 -1.23 0.00 0.00 174.94 173.37 1wi0 s PRO 24 N -1.43 4.61 -0.87 2.79 0.04 -1.26 -2.96 135.00 135.93 1wi0 s PRO 24 Ca 0.42 1.76 0.00 0.00 0.04 0.00 0.00 61.00 63.22 1wi0 s PRO 24 Cb -0.23 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.07 1wi0 s PRO 24 CO 0.29 0.13 0.00 -1.71 0.04 0.00 0.00 177.00 175.75 1wi0 n ASN 25 N 1.89 -2.78 -3.12 6.66 5.15 -1.26 -4.83 115.26 116.96 1wi0 n ASN 25 Ca 0.01 0.25 -0.15 0.00 -0.60 0.00 0.00 54.58 54.10 1wi0 n ASN 25 Cb 0.45 -2.56 -0.03 0.00 -0.53 0.00 0.00 39.78 37.11 1wi0 n ASN 25 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 1wi0 s SER 26 N -1.90 0.92 0.00 1.20 0.01 -1.16 -5.15 113.70 107.62 1wi0 s SER 26 Ca 0.00 -1.49 0.00 0.00 1.31 0.00 0.00 55.95 55.77 1wi0 s SER 26 Cb 0.00 0.70 0.00 0.00 0.21 0.00 0.00 66.02 66.93 1wi0 s SER 26 CO 0.00 -1.37 0.00 0.61 0.41 0.00 0.00 173.24 172.89 1wi0 n GLY 27 N -0.58 -0.51 3.60 3.44 0.00 -1.26 -4.39 105.19 105.48 1wi0 n GLY 27 Ca 0.00 -0.01 -0.05 0.00 0.00 0.00 0.00 46.02 45.96 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 -2.88 -2.04 -0.02 4.61 0.00 -1.26 -2.19 121.76 117.98 1wi0 s ALA 28 Ca 0.00 1.64 0.08 0.00 0.00 0.00 0.00 51.96 53.68 1wi0 s ALA 28 Cb 0.00 -0.57 -0.02 0.00 0.00 0.00 0.00 23.12 22.52 1wi0 s ALA 28 CO 0.00 -0.45 -0.25 0.08 0.00 0.00 0.00 175.76 175.14 1wi0 s VAL 29 N -1.82 2.12 -0.05 0.00 1.01 -0.90 -4.93 120.40 115.84 1wi0 s VAL 29 Ca 0.07 -1.11 -0.15 0.00 0.00 0.00 0.00 61.98 60.79 1wi0 s VAL 29 Cb -0.01 -1.74 -0.05 0.00 0.00 0.00 0.00 36.38 34.58 1wi0 s VAL 29 CO -0.04 0.57 0.39 1.51 0.00 0.00 0.00 175.10 177.52 1wi0 s ASP 30 N -0.66 6.72 -0.17 3.32 1.47 -1.26 -0.40 116.67 125.69 1wi0 s ASP 30 Ca 0.10 0.86 -0.02 0.00 1.18 0.00 0.00 52.55 54.67 1wi0 s ASP 30 Cb -0.10 -2.24 -0.01 0.00 -0.34 0.00 0.00 42.92 40.23 1wi0 s ASP 30 CO -0.01 0.25 -0.09 0.86 0.68 0.00 0.00 175.17 176.86 1wi0 s TRP 31 N -0.60 2.88 -0.06 2.11 -0.00 0.20 -4.94 118.94 118.53 1wi0 s TRP 31 Ca 0.23 -0.81 -0.30 0.00 -0.00 0.00 0.00 56.10 55.22 1wi0 s TRP 31 Cb -0.16 -1.96 -0.03 0.00 -0.00 0.00 0.00 33.47 31.32 1wi0 s TRP 31 CO 0.11 -0.37 1.23 -0.08 -0.00 0.00 0.00 176.95 177.84 1wi0 s THR 32 N 0.86 4.20 0.04 5.86 -1.32 -1.26 -1.85 115.64 122.16 1wi0 s THR 32 Ca -0.03 1.52 0.00 0.00 -1.21 0.00 0.00 61.69 61.97 1wi0 s THR 32 Cb -0.15 -3.98 0.00 0.00 -1.51 0.00 0.00 72.50 66.86 1wi0 s THR 32 CO 0.01 -0.01 0.00 0.52 -2.21 0.00 0.00 174.62 172.92 1wi0 n VAL 33 N 4.69 0.48 0.00 5.08 0.31 -0.70 -4.99 118.33 123.19 1wi0 n VAL 33 Ca 0.11 0.16 0.00 0.00 -0.01 0.00 0.00 64.34 64.60 1wi0 n VAL 33 Cb 0.46 -1.21 0.00 0.00 -0.91 0.00 0.00 33.84 32.18 1wi0 n VAL 33 CO 0.00 0.00 0.00 1.41 -1.32 0.00 0.00 176.83 176.92 1wi0 n HIS 34 N -2.89 0.00 -1.32 3.52 8.25 -0.99 -4.68 115.22 117.11 1wi0 n HIS 34 Ca 0.00 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.08 1wi0 n HIS 34 Cb 0.00 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.08 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 2.73 8.67 -0.24 0.41 7.64 -1.26 -4.03 113.62 127.54 1wi0 n SER 35 Ca 0.00 -2.59 0.04 0.00 1.01 0.00 0.00 58.87 57.33 1wi0 n SER 35 Cb 0.00 -1.55 0.14 0.00 -1.01 0.00 0.00 64.21 61.79 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 6.90 0.79 2.00 0.23 0.00 -1.87 0.23 103.07 111.35 1wi0 h GLY 36 Ca 0.86 0.10 -0.15 0.00 0.00 0.00 0.00 47.33 48.13 1wi0 h GLY 36 CO 1.74 -0.25 -0.71 -0.56 0.00 0.00 0.00 176.54 176.75 1wi0 h PRO 37 N 0.11 0.00 -1.66 4.80 0.13 -1.97 -3.21 132.00 130.21 1wi0 h PRO 37 Ca 0.38 0.00 -0.61 0.00 -0.87 0.00 0.00 66.00 64.90 1wi0 h PRO 37 Cb 0.66 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 31.55 1wi0 h PRO 37 CO -0.62 0.71 0.76 0.94 -0.23 0.00 0.00 178.00 179.56 1wi0 n GLN 38 N -3.62 2.50 -4.40 0.86 -0.06 0.73 -4.92 117.38 108.48 1wi0 n GLN 38 Ca -0.01 -2.88 -0.27 0.00 -2.00 0.00 0.00 57.00 51.85 1wi0 n GLN 38 Cb 0.71 -2.14 -0.12 0.00 -4.06 0.00 0.00 30.24 24.63 1wi0 n GLN 38 CO 0.00 0.00 0.00 -1.17 -0.20 0.00 0.00 177.06 175.69 1wi0 s LEU 39 N -3.21 2.39 0.16 1.69 2.96 -0.68 -4.83 118.68 117.17 1wi0 s LEU 39 Ca 0.54 -0.82 0.07 0.00 -0.22 0.00 0.00 54.13 53.69 1wi0 s LEU 39 Cb 0.41 -1.13 -0.04 0.00 0.50 0.00 0.00 46.19 45.93 1wi0 s LEU 39 CO -0.20 0.12 -0.14 -0.76 -1.32 0.00 0.00 176.35 174.05 1wi0 s LEU 40 N -2.45 2.49 0.18 -0.68 1.43 -1.26 -5.02 118.68 113.37 1wi0 s LEU 40 Ca 0.17 -0.93 -0.13 0.00 -1.03 0.00 0.00 54.13 52.22 1wi0 s LEU 40 Cb -0.08 -0.60 0.11 0.00 0.03 0.00 0.00 46.19 45.64 1wi0 s LEU 40 CO 0.08 -0.17 1.83 0.15 0.23 0.00 0.00 176.35 178.47 1wi0 h PHE 41 N 3.00 0.65 0.44 0.29 3.57 -1.92 -2.91 116.94 120.06 1wi0 h PHE 41 Ca -0.39 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.12 1wi0 h PHE 41 Cb 1.21 -0.21 -0.02 0.00 2.79 0.00 0.00 35.95 39.71 1wi0 h PHE 41 CO 0.68 0.38 -0.39 0.00 -2.23 0.00 0.00 178.31 176.75 1wi0 h ARG 42 N 0.69 -0.81 -0.82 1.11 -0.00 -1.96 -2.21 114.38 110.38 1wi0 h ARG 42 Ca 0.22 0.06 0.17 0.00 -0.50 0.00 0.00 59.98 59.93 1wi0 h ARG 42 Cb -0.00 0.18 -0.16 0.00 0.00 0.00 0.00 29.97 29.99 1wi0 h ARG 42 CO -0.09 -0.54 -0.18 -0.25 0.00 0.00 0.00 179.97 178.92 1wi0 n ASP 43 N -5.50 -0.27 0.05 7.04 9.92 -1.11 0.21 116.55 126.89 1wi0 n ASP 43 Ca -0.11 1.41 -0.11 0.00 -0.53 0.00 0.00 54.79 55.45 1wi0 n ASP 43 Cb 0.40 -0.44 -0.04 0.00 -0.64 0.00 0.00 41.12 40.40 1wi0 n ASP 43 CO 0.00 0.00 0.00 0.58 0.13 0.00 0.00 177.20 177.91 1wi0 h VAL 44 N 0.00 0.52 -0.55 2.53 2.07 -1.29 0.47 116.25 119.99 1wi0 h VAL 44 Ca 0.41 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.91 1wi0 h VAL 44 Cb 0.65 0.52 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 1wi0 h VAL 44 CO -0.84 0.00 0.29 -0.07 0.02 0.00 0.00 177.57 176.97 1wi0 h LEU 45 N -0.32 0.68 -1.63 2.57 -0.00 0.28 0.92 115.31 117.82 1wi0 h LEU 45 Ca 0.06 -0.05 -0.03 0.00 -0.00 0.00 0.00 57.88 57.86 1wi0 h LEU 45 Cb 0.40 -0.17 -0.00 0.00 -0.00 0.00 0.00 40.66 40.89 1wi0 h LEU 45 CO -0.20 0.56 -0.12 0.44 -0.00 0.00 0.00 178.44 179.12 1wi0 h ASP 46 N 0.77 0.00 0.00 -0.43 3.32 0.31 -1.89 116.42 118.51 1wi0 h ASP 46 Ca 0.20 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.25 1wi0 h ASP 46 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1wi0 h ASP 46 CO -0.03 0.12 -0.47 0.52 -1.72 0.00 0.00 179.24 177.66 1wi0 n VAL 47 N -3.39 1.29 -0.35 -1.35 0.31 0.15 -4.20 118.33 110.79 1wi0 n VAL 47 Ca -0.01 0.24 0.12 0.00 -0.01 0.00 0.00 64.34 64.69 1wi0 n VAL 47 Cb 0.31 -2.31 0.25 0.00 -0.91 0.00 0.00 33.84 31.17 1wi0 n VAL 47 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1wi0 h ILE 48 N -0.91 0.01 -0.98 2.52 2.04 0.70 1.48 117.51 122.38 1wi0 h ILE 48 Ca 0.00 -0.00 0.31 0.00 1.00 0.00 0.00 64.86 66.17 1wi0 h ILE 48 Cb 0.47 0.01 -0.15 0.00 -0.74 0.00 0.00 36.82 36.41 1wi0 h ILE 48 CO 0.00 0.00 0.49 1.23 0.00 0.00 0.00 178.15 179.87 1wi0 h GLY 49 N 0.00 1.94 1.73 5.37 0.00 -1.52 1.81 103.07 112.39 1wi0 h GLY 49 Ca 0.57 -0.18 -0.10 0.00 0.00 0.00 0.00 47.33 47.61 1wi0 h GLY 49 CO -0.95 -0.50 -0.36 1.46 0.00 0.00 0.00 176.54 176.19 1wi0 h GLN 50 N 0.27 0.31 0.12 4.80 4.20 0.19 -1.45 115.11 123.55 1wi0 h GLN 50 Ca 0.71 -0.14 -0.29 0.00 0.06 0.00 0.00 58.65 58.99 1wi0 h GLN 50 Cb 1.61 -0.01 0.02 0.00 0.30 0.00 0.00 27.48 29.40 1wi0 h GLN 50 CO -0.64 0.63 -1.23 0.28 -0.67 0.00 0.00 178.83 177.21 1wi0 h VAL 51 N 0.27 1.32 -2.81 -0.54 2.07 0.25 -3.37 116.25 113.43 1wi0 h VAL 51 Ca 0.03 -2.54 -0.61 0.00 0.82 0.00 0.00 66.70 64.40 1wi0 h VAL 51 Cb 0.76 2.71 -0.42 0.00 -1.52 0.00 0.00 31.29 32.83 1wi0 h VAL 51 CO 0.06 0.77 -0.61 0.18 0.02 0.00 0.00 177.57 177.99 1wi0 n LEU 52 N -3.75 2.97 0.24 2.57 4.32 0.39 -4.87 117.00 118.86 1wi0 n LEU 52 Ca -0.13 -5.22 0.13 0.00 -0.02 0.00 0.00 56.01 50.78 1wi0 n LEU 52 Cb 0.98 -0.64 0.41 0.00 -1.62 0.00 0.00 43.42 42.55 1wi0 n LEU 52 CO 0.57 1.84 0.86 1.55 -1.22 0.00 0.00 177.39 180.99 1wi0 h PRO 53 N 5.07 0.00 -0.02 3.23 0.13 -1.45 -2.80 132.00 136.16 1wi0 h PRO 53 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 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 0.06 -0.00 0.39 -0.23 0.00 0.00 178.00 178.95 1wi0 n GLU 54 N -3.14 1.74 -3.11 0.86 1.02 -1.26 -4.61 120.64 112.13 1wi0 n GLU 54 Ca 0.02 -1.67 -0.20 0.00 -0.02 0.00 0.00 57.16 55.29 1wi0 n GLU 54 Cb 0.44 -1.38 -0.05 0.00 -0.02 0.00 0.00 31.44 30.44 1wi0 n GLU 54 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wi0 n ALA 55 N 1.11 1.44 -0.84 0.62 0.00 -1.07 -5.13 120.51 116.64 1wi0 n ALA 55 Ca 0.12 -2.77 -0.34 0.00 0.00 0.00 0.00 53.44 50.45 1wi0 n ALA 55 Cb 0.49 -0.95 0.10 0.00 0.00 0.00 0.00 19.45 19.09 1wi0 n ALA 55 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 1wi0 n THR 56 N 1.87 0.00 -3.70 0.00 -1.04 -1.17 -4.69 114.28 105.55 1wi0 n THR 56 Ca 0.20 -0.27 -0.13 0.00 -2.04 0.00 0.00 64.05 61.82 1wi0 n THR 56 Cb 0.54 -0.43 -0.09 0.00 -1.82 0.00 0.00 70.33 68.53 1wi0 n THR 56 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1wi0 s THR 57 N -2.24 -0.00 -0.15 12.58 2.01 -1.26 -4.16 115.64 122.41 1wi0 s THR 57 Ca 0.51 0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.58 1wi0 s THR 57 Cb -0.16 -0.68 -0.13 0.00 0.01 0.00 0.00 72.50 71.54 1wi0 s THR 57 CO 0.71 0.01 -0.08 0.41 -0.69 0.00 0.00 174.62 174.98 1wi0 n THR 58 N 3.14 0.94 -4.44 -0.82 -1.04 -1.26 -4.77 114.28 106.02 1wi0 n THR 58 Ca -0.15 -0.44 -0.21 0.00 -2.04 0.00 0.00 64.05 61.20 1wi0 n THR 58 Cb 0.57 -0.93 -0.10 0.00 -1.82 0.00 0.00 70.33 68.04 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 -2.33 2.34 0.20 2.41 0.00 -1.26 -4.83 121.76 118.29 1wi0 s ALA 59 Ca -0.16 -1.99 -0.09 0.00 0.00 0.00 0.00 51.96 49.71 1wi0 s ALA 59 Cb 0.05 0.45 -0.01 0.00 0.00 0.00 0.00 23.12 23.61 1wi0 s ALA 59 CO 0.44 -0.21 0.33 -0.59 0.00 0.00 0.00 175.76 175.73 1wi0 s PHE 60 N -3.18 0.47 0.12 0.00 -0.71 -0.95 -1.89 117.98 111.84 1wi0 s PHE 60 Ca 0.33 -0.81 0.11 0.00 -1.04 0.00 0.00 56.93 55.51 1wi0 s PHE 60 Cb 0.07 -0.03 -0.04 0.00 -1.21 0.00 0.00 43.02 41.81 1wi0 s PHE 60 CO 0.14 -0.80 -0.26 -1.21 -1.34 0.00 0.00 175.22 171.74 1wi0 s GLU 61 N -4.01 1.41 -0.05 1.99 2.02 -0.30 0.62 118.70 120.39 1wi0 s GLU 61 Ca 0.21 -1.31 0.00 0.00 0.02 0.00 0.00 54.97 53.90 1wi0 s GLU 61 Cb 0.02 -1.85 0.03 0.00 0.10 0.00 0.00 34.13 32.43 1wi0 s GLU 61 CO 0.04 0.44 -0.01 1.52 0.02 0.00 0.00 175.26 177.27 1wi0 s TYR 62 N -1.05 0.55 0.29 1.61 -0.85 -0.99 0.21 117.35 117.12 1wi0 s TYR 62 Ca 0.13 -0.11 -0.30 0.00 -0.52 0.00 0.00 57.07 56.27 1wi0 s TYR 62 Cb -0.10 -0.61 -0.12 0.00 0.38 0.00 0.00 41.96 41.51 1wi0 s TYR 62 CO 0.05 -0.21 1.56 0.39 -1.52 0.00 0.00 175.55 175.83 1wi0 n GLU 63 N 4.43 2.61 0.00 -3.49 1.02 -1.19 -0.94 120.64 123.07 1wi0 n GLU 63 Ca -0.20 0.93 0.00 0.00 -0.02 0.00 0.00 57.16 57.87 1wi0 n GLU 63 Cb 0.50 -2.69 0.00 0.00 -0.02 0.00 0.00 31.44 29.23 1wi0 n GLU 63 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1wi0 n ASP 64 N 2.08 0.16 0.12 1.62 2.03 -1.26 -4.87 116.55 116.42 1wi0 n ASP 64 Ca 0.09 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.26 1wi0 n ASP 64 Cb 0.36 0.00 -0.08 0.00 -0.72 0.00 0.00 41.12 40.68 1wi0 n ASP 64 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 1wi0 h GLU 65 N 0.00 -0.24 -0.88 -0.67 5.08 -1.98 -2.45 114.58 113.44 1wi0 h GLU 65 Ca 0.00 0.02 -0.16 0.00 -1.00 0.00 0.00 59.36 58.22 1wi0 h GLU 65 Cb 0.00 0.06 -0.09 0.00 0.50 0.00 0.00 28.75 29.21 1wi0 h GLU 65 CO 0.00 -0.04 0.20 -0.25 -1.00 0.00 0.00 179.01 177.92 1wi0 n ASP 66 N -5.13 3.63 -4.12 1.42 8.00 -1.26 -4.86 116.55 114.23 1wi0 n ASP 66 Ca -0.09 -2.76 -0.34 0.00 0.71 0.00 0.00 54.79 52.31 1wi0 n ASP 66 Cb 0.18 -0.66 -0.06 0.00 -0.02 0.00 0.00 41.12 40.56 1wi0 n ASP 66 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1wi0 n GLY 67 N -0.06 -0.42 0.00 0.44 0.00 -0.92 -4.71 105.19 99.52 1wi0 n GLY 67 Ca 0.26 0.06 0.11 0.00 0.00 0.00 0.00 46.02 46.45 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 -2.26 0.00 -2.62 1.61 -0.08 -1.26 -4.72 116.55 107.22 1wi0 n ASP 68 Ca 0.09 -0.25 -0.03 0.00 -1.51 0.00 0.00 54.79 53.10 1wi0 n ASP 68 Cb 0.46 -0.19 -0.02 0.00 2.34 0.00 0.00 41.12 43.70 1wi0 n ASP 68 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1wi0 n ARG 69 N -1.19 -3.38 -2.10 -0.67 5.12 -1.26 -4.94 116.66 108.23 1wi0 n ARG 69 Ca 0.13 2.58 -0.28 0.00 -1.93 0.00 0.00 57.85 58.35 1wi0 n ARG 69 Cb 0.14 -3.42 0.16 0.00 -1.16 0.00 0.00 32.46 28.19 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 -0.41 2.04 -0.09 0.55 -1.09 -0.11 -4.79 121.20 117.30 1wi0 s ILE 70 Ca -0.13 -0.15 -0.01 0.00 -2.23 0.00 0.00 60.65 58.12 1wi0 s ILE 70 Cb 0.01 -2.89 0.03 0.00 -1.58 0.00 0.00 42.46 38.03 1wi0 s ILE 70 CO 0.36 0.00 -0.03 -0.89 -1.23 0.00 0.00 174.94 173.15 1wi0 s THR 71 N -3.68 0.65 -0.37 2.92 2.01 -1.26 -2.34 115.64 113.57 1wi0 s THR 71 Ca 0.71 -0.06 -0.11 0.00 0.31 0.00 0.00 61.69 62.54 1wi0 s THR 71 Cb -0.05 -0.76 0.02 0.00 0.01 0.00 0.00 72.50 71.73 1wi0 s THR 71 CO 0.50 0.30 0.21 -0.69 -0.69 0.00 0.00 174.62 174.26 1wi0 s VAL 72 N 1.86 4.70 -0.10 3.82 1.01 0.20 -4.87 120.40 127.02 1wi0 s VAL 72 Ca 0.05 -0.76 0.01 0.00 0.00 0.00 0.00 61.98 61.28 1wi0 s VAL 72 Cb -0.12 -3.59 0.00 0.00 0.00 0.00 0.00 36.38 32.67 1wi0 s VAL 72 CO -0.07 -0.20 0.38 0.54 0.00 0.00 0.00 175.10 175.76 1wi0 n ARG 73 N 5.02 1.46 -3.58 2.72 1.74 -1.26 -2.24 116.66 120.53 1wi0 n ARG 73 Ca -0.12 -0.39 -0.14 0.00 -0.77 0.00 0.00 57.85 56.44 1wi0 n ARG 73 Cb 0.47 -0.87 -0.05 0.00 -1.02 0.00 0.00 32.46 30.98 1wi0 n ARG 73 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1wi0 s SER 74 N -0.39 -0.43 0.31 0.55 1.04 -1.26 -4.97 113.70 108.55 1wi0 s SER 74 Ca 0.01 0.14 0.08 0.00 0.48 0.00 0.00 55.95 56.66 1wi0 s SER 74 Cb 0.01 0.49 0.88 0.00 0.10 0.00 0.00 66.02 67.50 1wi0 s SER 74 CO 0.02 -0.73 1.65 -2.24 0.98 0.00 0.00 173.24 172.92 1wi0 h ASP 75 N 2.75 0.20 -0.63 7.02 2.03 -1.97 0.31 116.42 126.13 1wi0 h ASP 75 Ca -0.31 0.20 0.11 0.00 -0.73 0.00 0.00 57.03 56.30 1wi0 h ASP 75 Cb 1.22 0.22 -0.12 0.00 -0.83 0.00 0.00 39.33 39.82 1wi0 h ASP 75 CO 0.41 -0.16 -0.32 -0.08 -1.03 0.00 0.00 179.24 178.06 1wi0 h GLU 76 N 0.24 -0.13 -0.42 4.15 4.81 -2.00 0.14 114.58 121.38 1wi0 h GLU 76 Ca 0.64 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.87 1wi0 h GLU 76 Cb 1.37 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 30.76 1wi0 h GLU 76 CO -0.65 -0.09 0.24 0.93 -0.73 0.00 0.00 179.01 178.71 1wi0 h GLU 77 N -0.13 0.57 -0.28 1.92 3.07 -0.77 -3.09 114.58 115.88 1wi0 h GLU 77 Ca 0.25 -0.06 0.03 0.00 -0.50 0.00 0.00 59.36 59.09 1wi0 h GLU 77 Cb 0.55 -0.12 -0.06 0.00 -0.84 0.00 0.00 28.75 28.29 1wi0 h GLU 77 CO -0.71 0.45 -0.39 1.98 -1.40 0.00 0.00 179.01 178.94 1wi0 h MET 78 N 0.54 -0.27 -0.87 2.33 4.05 -0.04 0.93 114.93 121.61 1wi0 h MET 78 Ca 0.15 0.02 0.25 0.00 -0.28 0.00 0.00 59.70 59.84 1wi0 h MET 78 Cb 0.03 0.06 -0.03 0.00 -0.80 0.00 0.00 31.60 30.86 1wi0 h MET 78 CO -0.03 -0.18 0.89 0.87 0.23 0.00 0.00 176.91 178.70 1wi0 h LYS 79 N -0.28 0.00 0.13 0.39 1.57 -1.11 0.58 116.57 117.85 1wi0 h LYS 79 Ca 0.05 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.82 1wi0 h LYS 79 Cb 0.41 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.73 1wi0 h LYS 79 CO -0.41 0.00 -0.06 0.00 -0.57 0.00 0.00 179.45 178.41 1wi0 h ALA 80 N 1.03 -0.17 -1.00 3.86 0.00 0.87 -0.79 119.26 123.06 1wi0 h ALA 80 Ca 0.41 -0.23 0.16 0.00 0.00 0.00 0.00 54.91 55.25 1wi0 h ALA 80 Cb 2.19 0.07 -0.10 0.00 0.00 0.00 0.00 17.79 19.95 1wi0 h ALA 80 CO -0.00 -0.23 0.62 1.98 0.00 0.00 0.00 179.25 181.61 1wi0 h MET 81 N -0.90 0.83 -0.04 0.00 1.85 0.22 0.29 114.93 117.18 1wi0 h MET 81 Ca -0.02 -0.05 -0.16 0.00 -0.61 0.00 0.00 59.70 58.86 1wi0 h MET 81 Cb 0.52 -0.19 -0.01 0.00 0.43 0.00 0.00 31.60 32.35 1wi0 h MET 81 CO 0.03 0.55 -0.68 -0.07 -0.40 0.00 0.00 176.91 176.34 1wi0 h LEU 82 N 0.85 0.23 -2.23 3.39 3.38 -1.09 -1.97 115.31 117.88 1wi0 h LEU 82 Ca 0.55 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.35 1wi0 h LEU 82 Cb 0.73 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.41 1wi0 h LEU 82 CO -0.34 0.84 -0.06 -1.28 0.09 0.00 0.00 178.44 177.70 1wi0 h SER 83 N 0.14 0.00 0.04 -0.43 0.87 0.11 -1.73 113.55 112.55 1wi0 h SER 83 Ca -0.02 0.00 -0.25 0.00 -1.23 0.00 0.00 61.79 60.29 1wi0 h SER 83 Cb 1.21 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 63.15 1wi0 h SER 83 CO 0.10 0.06 -1.36 0.22 -0.53 0.00 0.00 176.83 175.32 1wi0 h TYR 84 N 0.00 0.17 -0.70 2.24 3.20 -0.95 -3.07 116.97 117.86 1wi0 h TYR 84 Ca -0.00 -0.12 0.12 0.00 3.14 0.00 0.00 58.73 61.86 1wi0 h TYR 84 Cb 0.19 -0.01 -0.08 0.00 1.54 0.00 0.00 36.73 38.37 1wi0 h TYR 84 CO 0.00 1.53 0.28 -0.92 -1.64 0.00 0.00 178.16 177.41 1wi0 h TYR 85 N -0.67 0.48 -0.02 -3.82 3.20 -1.10 0.88 116.97 115.93 1wi0 h TYR 85 Ca -0.34 0.03 -0.14 0.00 3.14 0.00 0.00 58.73 61.42 1wi0 h TYR 85 Cb 1.51 -0.11 -0.02 0.00 1.54 0.00 0.00 36.73 39.65 1wi0 h TYR 85 CO 0.11 0.10 -0.64 1.88 -1.64 0.00 0.00 178.16 177.96 1wi0 h TYR 86 N 0.45 0.13 0.00 -3.82 0.05 -1.49 1.69 116.97 113.98 1wi0 h TYR 86 Ca 0.37 -0.05 -0.11 0.00 0.05 0.00 0.00 58.73 58.99 1wi0 h TYR 86 Cb 0.51 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.21 1wi0 h TYR 86 CO -0.16 0.71 -0.50 0.77 -1.05 0.00 0.00 178.16 177.93 1wi0 h SER 87 N 0.07 0.00 0.03 3.88 0.02 -0.86 -2.77 113.55 113.92 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 1.14 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 63.63 1wi0 h SER 87 CO 0.09 0.50 -2.19 1.07 -1.14 0.00 0.00 176.83 175.17 1wi0 n THR 88 N -3.44 1.58 0.00 -2.27 5.66 0.29 -4.05 114.28 112.04 1wi0 n THR 88 Ca 0.00 -0.45 -0.11 0.00 -3.05 0.00 0.00 64.05 60.44 1wi0 n THR 88 Cb 0.63 -1.72 -0.05 0.00 -1.55 0.00 0.00 70.33 67.64 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 -0.41 0.22 -0.67 1.08 2.07 0.24 0.38 116.25 119.16 1wi0 h VAL 89 Ca -0.54 0.00 0.19 0.00 0.82 0.00 0.00 66.70 67.18 1wi0 h VAL 89 Cb 1.76 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 1wi0 h VAL 89 CO -0.16 0.00 0.53 0.00 0.02 0.00 0.00 177.57 177.96 1wi0 h MET 90 N -0.45 0.00 0.00 1.57 -0.00 -1.67 0.86 114.93 115.24 1wi0 h MET 90 Ca 0.09 0.00 -0.13 0.00 -0.00 0.00 0.00 59.70 59.66 1wi0 h MET 90 Cb 0.59 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.17 1wi0 h MET 90 CO -0.37 0.00 -0.60 0.93 -0.00 0.00 0.00 176.91 176.86 1wi0 h GLU 91 N 0.00 0.00 0.00 -0.10 4.39 -0.52 -2.54 114.58 115.81 1wi0 h GLU 91 Ca 0.32 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.97 1wi0 h GLU 91 Cb 1.38 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 30.02 1wi0 h GLU 91 CO -0.00 0.60 -0.21 1.96 -1.16 0.00 0.00 179.01 180.20 1wi0 h GLN 92 N 0.00 0.00 0.03 2.33 4.20 0.31 -2.49 115.11 119.50 1wi0 h GLN 92 Ca -0.01 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.56 1wi0 h GLN 92 Cb 1.40 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.17 1wi0 h GLN 92 CO 0.08 0.21 -0.76 1.96 -0.67 0.00 0.00 178.83 179.65 1wi0 h GLN 93 N 0.00 0.07 -0.14 1.46 4.20 -1.27 -2.58 115.11 116.85 1wi0 h GLN 93 Ca -0.00 -0.12 0.04 0.00 0.06 0.00 0.00 58.65 58.63 1wi0 h GLN 93 Cb 0.92 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.74 1wi0 h GLN 93 CO 0.03 1.06 0.10 -0.39 -0.67 0.00 0.00 178.83 178.96 1wi0 h VAL 94 N -0.82 0.86 0.17 -0.54 -1.51 -1.49 -2.82 116.25 110.10 1wi0 h VAL 94 Ca -0.19 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.27 1wi0 h VAL 94 Cb 1.30 0.93 0.00 0.00 -2.13 0.00 0.00 31.29 31.39 1wi0 h VAL 94 CO -0.05 0.00 -0.08 0.78 -1.23 0.00 0.00 177.57 176.99 1wi0 h ASN 95 N 0.00 -0.19 0.00 4.19 2.35 -1.54 -3.50 115.58 116.89 1wi0 h ASN 95 Ca 0.06 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1wi0 h ASN 95 Cb 0.27 0.05 0.00 0.00 0.05 0.00 0.00 38.32 38.69 1wi0 h ASN 95 CO -0.00 0.12 0.00 0.61 -1.65 0.00 0.00 177.43 176.51 1wi0 n GLY 96 N 1.05 0.87 3.11 2.83 0.00 -0.98 -5.11 105.19 106.97 1wi0 n GLY 96 Ca -0.03 0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.66 1wi0 n GLY 96 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1wi0 n GLN 97 N 0.00 0.00 -1.40 1.61 10.64 -1.22 -4.80 117.38 122.22 1wi0 n GLN 97 Ca 0.00 0.00 -0.31 0.00 -1.83 0.00 0.00 57.00 54.86 1wi0 n GLN 97 Cb 0.00 -0.98 0.08 0.00 -0.86 0.00 0.00 30.24 28.48 1wi0 n GLN 97 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1wi0 s LEU 98 N 5.68 3.09 0.59 2.61 1.43 -1.26 -4.31 118.68 126.51 1wi0 s LEU 98 Ca 0.51 1.78 -0.18 0.00 -1.03 0.00 0.00 54.13 55.21 1wi0 s LEU 98 Cb -0.40 -4.52 -0.03 0.00 0.03 0.00 0.00 46.19 41.26 1wi0 s LEU 98 CO 0.69 -1.83 1.14 -0.63 0.23 0.00 0.00 176.35 175.96 1wi0 s ILE 99 N -2.89 3.03 0.15 -0.59 -1.09 -1.26 -4.95 121.20 113.59 1wi0 s ILE 99 Ca 0.61 0.59 0.06 0.00 -2.23 0.00 0.00 60.65 59.68 1wi0 s ILE 99 Cb -0.16 -3.19 -0.04 0.00 -1.58 0.00 0.00 42.46 37.49 1wi0 s ILE 99 CO 0.54 -0.18 0.03 -1.61 -1.23 0.00 0.00 174.94 172.49 1wi0 s GLU 100 N -3.52 2.56 0.28 2.79 0.41 -1.26 -5.10 118.70 114.86 1wi0 s GLU 100 Ca 0.72 -0.99 -0.29 0.00 -0.41 0.00 0.00 54.97 54.01 1wi0 s GLU 100 Cb -0.25 -2.47 -0.09 0.00 -1.78 0.00 0.00 34.13 29.54 1wi0 s GLU 100 CO 0.33 0.48 1.08 -1.25 -0.49 0.00 0.00 175.26 175.41 1wi0 s PRO 101 N -2.83 4.63 -0.84 0.39 0.04 -1.26 -4.87 135.00 130.26 1wi0 s PRO 101 Ca 0.28 1.75 -0.22 0.00 0.04 0.00 0.00 61.00 62.85 1wi0 s PRO 101 Cb -0.10 -3.15 -0.19 0.00 0.04 0.00 0.00 34.50 31.10 1wi0 s PRO 101 CO 0.20 0.22 2.32 -0.11 0.04 0.00 0.00 177.00 179.67 1wi0 n LEU 102 N 1.13 1.03 -4.55 -3.56 7.94 0.93 -4.62 117.00 115.30 1wi0 n LEU 102 Ca -0.01 -1.35 -0.37 0.00 -1.11 0.00 0.00 56.01 53.17 1wi0 n LEU 102 Cb 0.45 -1.41 -0.03 0.00 0.53 0.00 0.00 43.42 42.96 1wi0 n LEU 102 CO 0.53 -2.44 1.86 -1.58 -1.11 0.00 0.00 177.39 174.65 1wi0 s GLN 103 N 8.44 2.30 0.37 1.96 0.74 -1.26 -1.53 119.66 130.69 1wi0 s GLN 103 Ca 0.99 1.09 0.08 0.00 0.05 0.00 0.00 55.36 57.57 1wi0 s GLN 103 Cb -0.28 -4.51 -0.05 0.00 1.10 0.00 0.00 33.01 29.28 1wi0 s GLN 103 CO 0.19 -3.08 0.14 0.96 -0.55 0.00 0.00 175.29 172.96 1wi0 s ILE 104 N 11.01 2.63 -0.05 -2.34 -4.36 -0.77 -3.20 121.20 124.11 1wi0 s ILE 104 Ca 0.86 -1.73 -0.00 0.00 -0.26 0.00 0.00 60.65 59.51 1wi0 s ILE 104 Cb -0.15 -2.96 0.03 0.00 1.25 0.00 0.00 42.46 40.63 1wi0 s ILE 104 CO 0.24 -0.10 -0.01 -0.36 0.24 0.00 0.00 174.94 174.95 1wi0 s PHE 105 N -2.52 0.59 -0.24 1.37 0.40 0.13 -1.97 117.98 115.74 1wi0 s PHE 105 Ca 0.39 -0.12 -0.29 0.00 -0.60 0.00 0.00 56.93 56.30 1wi0 s PHE 105 Cb 0.01 -0.67 -0.01 0.00 0.51 0.00 0.00 43.02 42.86 1wi0 s PHE 105 CO 0.22 -0.24 1.31 -1.25 0.70 0.00 0.00 175.22 175.97 1wi0 s PRO 106 N 1.48 4.03 -1.10 0.24 0.04 -1.26 -1.15 135.00 137.29 1wi0 s PRO 106 Ca -0.03 1.45 -0.17 0.00 0.04 0.00 0.00 61.00 62.30 1wi0 s PRO 106 Cb -0.13 -3.85 0.13 0.00 0.04 0.00 0.00 34.50 30.69 1wi0 s PRO 106 CO -0.03 -0.97 1.36 1.03 0.04 0.00 0.00 177.00 178.43 1wi0 s ARG 107 N 3.94 3.85 -0.46 4.56 0.52 -0.79 -4.97 118.95 125.60 1wi0 s ARG 107 Ca 0.57 -2.06 -0.29 0.00 -0.52 0.00 0.00 55.73 53.43 1wi0 s ARG 107 Cb -0.19 -5.10 0.03 0.00 0.52 0.00 0.00 34.95 30.21 1wi0 s ARG 107 CO 0.20 -1.87 1.11 -1.12 0.02 0.00 0.00 175.30 173.64 1wi0 s SER 108 N 3.52 6.66 0.00 0.23 0.01 -1.26 -4.21 113.70 118.65 1wi0 s SER 108 Ca 0.41 0.52 0.00 0.00 1.31 0.00 0.00 55.95 58.18 1wi0 s SER 108 Cb -0.02 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.67 1wi0 s SER 108 CO -0.04 -1.19 0.00 0.61 0.41 0.00 0.00 173.24 173.04 1wi0 n GLY 109 N 4.72 2.71 3.80 3.44 0.00 -1.26 -5.06 105.19 113.55 1wi0 n GLY 109 Ca 0.11 -1.19 -0.33 0.00 0.00 0.00 0.00 46.02 44.61 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 -1.78 3.65 -0.20 1.61 0.04 -1.26 -4.94 135.00 132.13 1wi0 s PRO 110 Ca 0.00 1.29 -0.03 0.00 0.04 0.00 0.00 61.00 62.30 1wi0 s PRO 110 Cb 0.00 -2.08 -0.01 0.00 0.04 0.00 0.00 34.50 32.46 1wi0 s PRO 110 CO 0.00 -0.55 -0.08 -1.54 0.04 0.00 0.00 177.00 174.88 1wi0 s SER 111 N -2.31 4.12 0.17 6.66 1.04 -1.26 -4.92 113.70 117.20 1wi0 s SER 111 Ca 0.66 -0.41 0.00 0.00 0.48 0.00 0.00 55.95 56.68 1wi0 s SER 111 Cb -0.16 -1.69 0.00 0.00 0.10 0.00 0.00 66.02 64.27 1wi0 s SER 111 CO 0.26 0.01 0.00 -1.20 0.98 0.00 0.00 173.24 173.29 1wi0 n SER 112 N 4.57 -9.38 0.00 7.02 7.64 -1.26 -5.27 113.62 116.94 1wi0 n SER 112 Ca -0.19 1.55 0.00 0.00 1.01 0.00 0.00 58.87 61.24 1wi0 n SER 112 Cb 0.51 -5.26 0.00 0.00 -1.01 0.00 0.00 64.21 58.45 1wi0 n SER 112 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64