#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 -0.36 -4.07 1.61 2.88 -1.26 -5.11 113.62 107.31 1wi0 n SER 2 Ca 0.00 0.45 -0.30 0.00 -1.33 0.00 0.00 58.87 57.68 1wi0 n SER 2 Cb 0.00 0.71 -0.16 0.00 -0.75 0.00 0.00 64.21 64.00 1wi0 n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 1wi0 s SER 3 N -2.00 2.76 0.28 -3.46 0.15 -1.26 -5.13 113.70 105.05 1wi0 s SER 3 Ca 0.00 -0.51 0.03 0.00 0.70 0.00 0.00 55.95 56.16 1wi0 s SER 3 Cb 0.00 -1.25 0.04 0.00 -1.71 0.00 0.00 66.02 63.10 1wi0 s SER 3 CO 0.00 0.00 0.32 0.61 1.20 0.00 0.00 173.24 175.38 1wi0 n GLY 4 N 4.44 1.69 3.75 9.45 0.00 -1.26 -5.11 105.19 118.14 1wi0 n GLY 4 Ca -0.19 -2.13 -0.33 0.00 0.00 0.00 0.00 46.02 43.37 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 -2.42 5.55 -0.10 1.61 0.15 -1.26 -5.11 113.70 112.12 1wi0 s SER 5 Ca 0.24 0.13 -0.30 0.00 0.70 0.00 0.00 55.95 56.72 1wi0 s SER 5 Cb -0.02 -1.57 0.07 0.00 -1.71 0.00 0.00 66.02 62.79 1wi0 s SER 5 CO 0.15 0.29 0.69 -0.44 1.20 0.00 0.00 173.24 175.14 1wi0 s SER 6 N -1.55 -0.68 -0.45 5.45 0.01 -1.26 -5.10 113.70 110.12 1wi0 s SER 6 Ca 0.21 0.88 0.07 0.00 1.31 0.00 0.00 55.95 58.42 1wi0 s SER 6 Cb -0.12 0.75 0.27 0.00 0.21 0.00 0.00 66.02 67.13 1wi0 s SER 6 CO 0.11 -0.53 0.83 0.61 0.41 0.00 0.00 173.24 174.67 1wi0 n GLY 7 N 1.31 1.19 3.57 3.44 0.00 -1.26 -5.07 105.19 108.37 1wi0 n GLY 7 Ca -0.18 -0.48 -0.35 0.00 0.00 0.00 0.00 46.02 45.02 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 -0.16 3.15 -0.39 1.61 0.04 -1.26 -4.84 135.00 133.15 1wi0 s PRO 8 Ca 0.32 -1.05 0.01 0.00 0.04 0.00 0.00 61.00 60.31 1wi0 s PRO 8 Cb 0.24 -5.28 0.14 0.00 0.04 0.00 0.00 34.50 29.64 1wi0 s PRO 8 CO -0.16 -2.91 0.23 -0.06 0.04 0.00 0.00 177.00 174.15 1wi0 s PHE 9 N 7.51 1.22 -0.01 0.56 0.08 -1.26 -4.97 117.98 121.11 1wi0 s PHE 9 Ca 0.59 -1.97 -0.01 0.00 0.12 0.00 0.00 56.93 55.66 1wi0 s PHE 9 Cb -0.01 -1.28 -0.00 0.00 -0.57 0.00 0.00 43.02 41.16 1wi0 s PHE 9 CO 0.01 -0.81 -0.02 0.00 -0.10 0.00 0.00 175.22 174.30 1wi0 n ALA 11 N -2.62 -2.35 -3.69 0.00 0.00 -1.26 -5.10 120.51 105.49 1wi0 n ALA 11 Ca -0.01 0.41 -0.05 0.00 0.00 0.00 0.00 53.44 53.79 1wi0 n ALA 11 Cb 0.03 -1.16 -0.02 0.00 0.00 0.00 0.00 19.45 18.30 1wi0 n ALA 11 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1wi0 s MET 12 N -1.01 1.15 -0.95 0.00 -1.94 -1.26 -5.09 119.30 110.20 1wi0 s MET 12 Ca -0.01 -0.59 -0.20 0.00 -1.71 0.00 0.00 55.69 53.18 1wi0 s MET 12 Cb 0.00 0.42 0.11 0.00 2.01 0.00 0.00 34.83 37.37 1wi0 s MET 12 CO 0.02 -0.52 1.22 -1.21 -0.01 0.00 0.00 175.02 174.52 1wi0 s GLU 13 N -3.30 3.59 -0.11 2.03 8.01 -1.26 -4.89 118.70 122.76 1wi0 s GLU 13 Ca 0.10 -1.56 -0.33 0.00 0.01 0.00 0.00 54.97 53.19 1wi0 s GLU 13 Cb -0.02 -5.04 0.14 0.00 -4.31 0.00 0.00 34.13 24.91 1wi0 s GLU 13 CO -0.00 -1.90 1.38 0.54 0.01 0.00 0.00 175.26 175.28 1wi0 s ASN 14 N 4.03 -0.03 0.38 -0.19 4.22 -1.26 -3.98 114.94 118.12 1wi0 s ASN 14 Ca 0.37 -0.04 0.00 0.00 -2.14 0.00 0.00 52.86 51.05 1wi0 s ASN 14 Cb -0.03 0.05 0.00 0.00 1.28 0.00 0.00 41.25 42.55 1wi0 s ASN 14 CO -0.09 -0.10 0.00 1.67 -2.04 0.00 0.00 177.10 176.54 1wi0 n GLN 15 N -0.40 -2.74 0.00 3.55 -0.06 -1.26 -4.93 117.38 111.54 1wi0 n GLN 15 Ca -0.07 2.12 0.00 0.00 -2.00 0.00 0.00 57.00 57.05 1wi0 n GLN 15 Cb 0.62 -2.62 0.00 0.00 -4.06 0.00 0.00 30.24 24.18 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 -2.10 0.00 -4.83 1.69 0.24 -1.26 -4.67 118.33 107.41 1wi0 n VAL 16 Ca 0.00 0.00 -0.33 0.00 -2.04 0.00 0.00 64.34 61.97 1wi0 n VAL 16 Cb 0.28 0.00 -0.13 0.00 -1.47 0.00 0.00 33.84 32.52 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 2.79 -0.24 1.34 2.96 0.63 -5.03 118.68 121.13 1wi0 s LEU 17 Ca 0.00 -0.20 0.01 0.00 -0.22 0.00 0.00 54.13 53.72 1wi0 s LEU 17 Cb 0.00 -1.59 0.06 0.00 0.50 0.00 0.00 46.19 45.16 1wi0 s LEU 17 CO 0.00 0.30 -0.06 -0.69 -1.32 0.00 0.00 176.35 174.58 1wi0 s VAL 18 N -0.47 1.63 -0.24 1.68 1.01 -1.26 0.01 120.40 122.75 1wi0 s VAL 18 Ca 0.06 -1.29 -0.13 0.00 0.00 0.00 0.00 61.98 60.62 1wi0 s VAL 18 Cb -0.12 -1.87 -0.04 0.00 0.00 0.00 0.00 36.38 34.35 1wi0 s VAL 18 CO 0.02 -0.09 0.29 -0.63 0.00 0.00 0.00 175.10 174.69 1wi0 s ILE 19 N 1.35 5.26 -0.47 2.22 1.01 -1.13 -0.49 121.20 128.94 1wi0 s ILE 19 Ca -0.06 0.45 -0.11 0.00 0.00 0.00 0.00 60.65 60.92 1wi0 s ILE 19 Cb -0.19 -3.63 0.10 0.00 0.01 0.00 0.00 42.46 38.75 1wi0 s ILE 19 CO -0.06 0.26 0.36 -0.60 0.00 0.00 0.00 174.94 174.90 1wi0 s ARG 20 N 1.45 2.69 -0.27 2.79 3.52 -1.01 0.72 118.95 128.85 1wi0 s ARG 20 Ca 0.13 -1.61 -0.29 0.00 -0.13 0.00 0.00 55.73 53.84 1wi0 s ARG 20 Cb -0.15 -3.99 0.01 0.00 -1.56 0.00 0.00 34.95 29.26 1wi0 s ARG 20 CO 0.08 -1.13 1.14 0.42 -0.81 0.00 0.00 175.30 174.99 1wi0 s ILE 21 N 1.47 4.45 -0.15 4.11 1.01 0.10 -1.15 121.20 131.04 1wi0 s ILE 21 Ca 0.04 1.71 -0.29 0.00 0.00 0.00 0.00 60.65 62.11 1wi0 s ILE 21 Cb -0.26 -4.27 -0.05 0.00 0.01 0.00 0.00 42.46 37.89 1wi0 s ILE 21 CO 0.02 -0.34 1.79 -0.75 0.00 0.00 0.00 174.94 175.66 1wi0 s LYS 22 N 3.59 3.80 0.07 2.79 2.47 0.41 -2.38 119.74 130.49 1wi0 s LYS 22 Ca 0.48 1.97 -0.16 0.00 -1.56 0.00 0.00 55.97 56.70 1wi0 s LYS 22 Cb -0.15 -4.11 -0.06 0.00 -1.46 0.00 0.00 37.83 32.04 1wi0 s LYS 22 CO 0.14 -1.31 0.51 0.42 0.16 0.00 0.00 175.35 175.27 1wi0 s ILE 23 N 5.44 4.86 -0.13 5.43 -1.09 0.18 -4.52 121.20 131.37 1wi0 s ILE 23 Ca 0.80 0.99 -0.29 0.00 -2.23 0.00 0.00 60.65 59.91 1wi0 s ILE 23 Cb -0.31 -3.80 -0.02 0.00 -1.58 0.00 0.00 42.46 36.76 1wi0 s ILE 23 CO 0.32 0.48 1.26 -2.16 -1.23 0.00 0.00 174.94 173.61 1wi0 s PRO 24 N -1.33 4.26 -0.70 2.79 0.04 -1.26 -3.76 135.00 135.04 1wi0 s PRO 24 Ca 0.30 1.68 -0.13 0.00 0.04 0.00 0.00 61.00 62.89 1wi0 s PRO 24 Cb -0.17 -3.72 0.02 0.00 0.04 0.00 0.00 34.50 30.67 1wi0 s PRO 24 CO 0.17 -0.65 0.62 -1.71 0.04 0.00 0.00 177.00 175.48 1wi0 n ASN 25 N 6.26 -4.99 0.04 6.66 5.15 -1.26 -4.71 115.26 122.42 1wi0 n ASN 25 Ca 0.13 -0.72 0.00 0.00 -0.60 0.00 0.00 54.58 53.39 1wi0 n ASN 25 Cb 0.45 -1.58 0.00 0.00 -0.53 0.00 0.00 39.78 38.12 1wi0 n ASN 25 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1wi0 n SER 26 N -1.83 -0.78 0.00 1.20 2.88 -1.26 -5.15 113.62 108.68 1wi0 n SER 26 Ca -0.25 0.43 0.00 0.00 -1.33 0.00 0.00 58.87 57.72 1wi0 n SER 26 Cb 0.69 1.02 0.00 0.00 -0.75 0.00 0.00 64.21 65.18 1wi0 n SER 26 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1wi0 n GLY 27 N -1.13 -0.39 3.59 0.46 0.00 -1.25 -5.06 105.19 101.42 1wi0 n GLY 27 Ca 0.00 0.04 -0.09 0.00 0.00 0.00 0.00 46.02 45.97 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 -1.96 0.02 4.61 0.00 -1.26 -0.65 121.76 121.51 1wi0 s ALA 28 Ca 0.00 1.65 0.07 0.00 0.00 0.00 0.00 51.96 53.68 1wi0 s ALA 28 Cb 0.00 -0.90 -0.03 0.00 0.00 0.00 0.00 23.12 22.19 1wi0 s ALA 28 CO 0.00 -0.29 -0.20 0.08 0.00 0.00 0.00 175.76 175.35 1wi0 s VAL 29 N -0.92 2.60 -0.27 0.00 1.01 -1.00 -4.93 120.40 116.88 1wi0 s VAL 29 Ca 0.00 -1.14 -0.10 0.00 0.00 0.00 0.00 61.98 60.74 1wi0 s VAL 29 Cb -0.01 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.28 1wi0 s VAL 29 CO -0.01 0.42 0.17 1.51 0.00 0.00 0.00 175.10 177.19 1wi0 s ASP 30 N -1.16 5.90 -0.55 3.32 1.47 -1.26 -0.72 116.67 123.68 1wi0 s ASP 30 Ca 0.13 -0.02 -0.20 0.00 1.18 0.00 0.00 52.55 53.64 1wi0 s ASP 30 Cb -0.10 -2.09 0.08 0.00 -0.34 0.00 0.00 42.92 40.46 1wi0 s ASP 30 CO 0.03 -0.03 0.70 0.86 0.68 0.00 0.00 175.17 177.41 1wi0 s TRP 31 N 1.63 2.98 -0.50 2.11 -0.00 0.22 -4.90 118.94 120.48 1wi0 s TRP 31 Ca 0.07 -0.67 -0.26 0.00 -0.00 0.00 0.00 56.10 55.24 1wi0 s TRP 31 Cb -0.15 -3.81 -0.07 0.00 -0.00 0.00 0.00 33.47 29.43 1wi0 s TRP 31 CO 0.09 -1.20 2.42 -2.37 -0.00 0.00 0.00 176.95 175.89 1wi0 n THR 32 N 5.65 -0.08 -4.08 5.86 5.66 -1.26 -2.84 114.28 123.19 1wi0 n THR 32 Ca -0.07 -0.77 -0.35 0.00 -3.05 0.00 0.00 64.05 59.80 1wi0 n THR 32 Cb 0.44 -2.74 -0.09 0.00 -1.55 0.00 0.00 70.33 66.40 1wi0 n THR 32 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 175.07 171.33 1wi0 s VAL 33 N 12.09 4.80 -0.07 1.08 1.01 0.10 -4.97 120.40 134.44 1wi0 s VAL 33 Ca 0.99 -0.04 0.02 0.00 0.00 0.00 0.00 61.98 62.95 1wi0 s VAL 33 Cb -0.21 -3.11 -0.06 0.00 0.00 0.00 0.00 36.38 33.00 1wi0 s VAL 33 CO 0.27 0.53 -0.04 1.41 0.00 0.00 0.00 175.10 177.28 1wi0 n HIS 34 N 2.83 0.00 -1.67 5.22 8.25 -1.26 -0.27 115.22 128.32 1wi0 n HIS 34 Ca -0.18 0.00 -0.31 0.00 -0.26 0.00 0.00 57.72 56.97 1wi0 n HIS 34 Cb 0.53 -0.30 -0.04 0.00 1.12 0.00 0.00 29.99 31.31 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 -2.55 6.98 -0.27 0.41 7.64 -1.26 -4.73 113.62 119.83 1wi0 n SER 35 Ca -0.12 -3.20 -0.04 0.00 1.01 0.00 0.00 58.87 56.52 1wi0 n SER 35 Cb 0.66 -1.27 0.02 0.00 -1.01 0.00 0.00 64.21 62.61 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 4.43 -0.07 1.69 0.23 0.00 -1.95 0.17 103.07 107.58 1wi0 h GLY 36 Ca 0.49 0.48 -0.19 0.00 0.00 0.00 0.00 47.33 48.11 1wi0 h GLY 36 CO 1.07 -0.20 -0.82 -0.56 0.00 0.00 0.00 176.54 176.03 1wi0 h PRO 37 N -0.10 0.29 -1.54 4.80 0.13 -2.00 -3.20 132.00 130.37 1wi0 h PRO 37 Ca 0.27 -0.28 -0.44 0.00 -0.87 0.00 0.00 66.00 64.69 1wi0 h PRO 37 Cb 0.57 0.07 -0.18 0.00 0.13 0.00 0.00 31.00 31.59 1wi0 h PRO 37 CO -0.80 0.96 0.51 0.94 -0.23 0.00 0.00 178.00 179.39 1wi0 n GLN 38 N -3.74 2.11 -4.23 0.86 7.27 0.25 -4.90 117.38 115.00 1wi0 n GLN 38 Ca -0.04 -2.09 -0.29 0.00 0.07 0.00 0.00 57.00 54.65 1wi0 n GLN 38 Cb 0.77 -1.86 -0.10 0.00 2.41 0.00 0.00 30.24 31.46 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 -2.32 3.06 0.28 1.69 2.96 0.33 -4.80 118.68 119.88 1wi0 s LEU 39 Ca 0.43 -0.40 0.10 0.00 -0.22 0.00 0.00 54.13 54.04 1wi0 s LEU 39 Cb 0.32 -1.83 -0.05 0.00 0.50 0.00 0.00 46.19 45.13 1wi0 s LEU 39 CO -0.06 0.16 -0.15 -0.76 -1.32 0.00 0.00 176.35 174.22 1wi0 s LEU 40 N -2.34 2.60 0.07 -0.68 1.43 -1.26 -4.95 118.68 113.56 1wi0 s LEU 40 Ca 0.22 -1.08 -0.23 0.00 -1.03 0.00 0.00 54.13 52.01 1wi0 s LEU 40 Cb -0.11 -0.94 -0.15 0.00 0.03 0.00 0.00 46.19 45.02 1wi0 s LEU 40 CO 0.14 -0.10 1.66 0.15 0.23 0.00 0.00 176.35 178.43 1wi0 h PHE 41 N 2.27 0.05 -0.46 0.29 3.57 -1.91 -2.90 116.94 117.84 1wi0 h PHE 41 Ca -0.40 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.18 1wi0 h PHE 41 Cb 1.25 -0.01 -0.07 0.00 2.79 0.00 0.00 35.95 39.90 1wi0 h PHE 41 CO 0.77 0.12 0.04 0.00 -2.23 0.00 0.00 178.31 177.02 1wi0 h ARG 42 N -0.04 0.16 -0.74 1.11 2.47 -1.97 -1.21 114.38 114.17 1wi0 h ARG 42 Ca 0.01 -0.01 0.14 0.00 -1.26 0.00 0.00 59.98 58.86 1wi0 h ARG 42 Cb 0.09 -0.04 -0.14 0.00 -1.65 0.00 0.00 29.97 28.24 1wi0 h ARG 42 CO -0.00 0.11 -0.26 -0.44 0.56 0.00 0.00 179.97 179.94 1wi0 h ASP 43 N 0.16 -0.92 -0.38 7.04 5.19 -1.93 1.78 116.42 127.36 1wi0 h ASP 43 Ca 0.23 0.24 0.07 0.00 -0.62 0.00 0.00 57.03 56.95 1wi0 h ASP 43 Cb 0.33 0.54 -0.06 0.00 0.18 0.00 0.00 39.33 40.31 1wi0 h ASP 43 CO -0.35 -0.27 -0.01 0.58 -3.12 0.00 0.00 179.24 176.07 1wi0 h VAL 44 N -0.05 0.70 -0.28 -1.35 2.07 -1.10 0.54 116.25 116.77 1wi0 h VAL 44 Ca 0.33 -0.03 -0.06 0.00 0.82 0.00 0.00 66.70 67.76 1wi0 h VAL 44 Cb 0.56 0.60 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 1wi0 h VAL 44 CO -0.78 0.02 -0.08 -0.07 0.02 0.00 0.00 177.57 176.68 1wi0 h LEU 45 N 0.09 0.43 -1.25 2.57 -0.00 0.44 0.61 115.31 118.20 1wi0 h LEU 45 Ca 0.19 -0.10 -0.08 0.00 -0.00 0.00 0.00 57.88 57.89 1wi0 h LEU 45 Cb 0.27 -0.11 -0.01 0.00 -0.00 0.00 0.00 40.66 40.80 1wi0 h LEU 45 CO -0.33 0.56 -0.37 0.44 -0.00 0.00 0.00 178.44 178.74 1wi0 h ASP 46 N 0.43 0.00 0.00 -0.43 3.32 0.50 -0.11 116.42 120.14 1wi0 h ASP 46 Ca 0.09 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.10 1wi0 h ASP 46 Cb 0.41 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 1wi0 h ASP 46 CO 0.02 0.38 -0.27 0.58 -1.72 0.00 0.00 179.24 178.23 1wi0 h VAL 47 N 0.00 0.70 -0.93 -1.35 2.07 0.11 -3.35 116.25 113.51 1wi0 h VAL 47 Ca -0.00 -1.59 0.22 0.00 0.82 0.00 0.00 66.70 66.14 1wi0 h VAL 47 Cb 0.66 1.39 -0.12 0.00 -1.52 0.00 0.00 31.29 31.70 1wi0 h VAL 47 CO 0.05 0.24 0.47 0.40 0.02 0.00 0.00 177.57 178.74 1wi0 h ILE 48 N -1.00 0.54 -0.69 4.57 2.04 0.17 0.88 117.51 124.01 1wi0 h ILE 48 Ca -0.05 -0.17 0.20 0.00 1.00 0.00 0.00 64.86 65.84 1wi0 h ILE 48 Cb 0.59 -0.01 -0.03 0.00 -0.74 0.00 0.00 36.82 36.63 1wi0 h ILE 48 CO -0.03 0.09 0.65 1.23 0.00 0.00 0.00 178.15 180.09 1wi0 h GLY 49 N 0.50 0.00 1.42 5.37 0.00 -1.13 1.57 103.07 110.79 1wi0 h GLY 49 Ca 0.57 0.00 -0.10 0.00 0.00 0.00 0.00 47.33 47.80 1wi0 h GLY 49 CO -0.48 0.00 -0.91 1.46 0.00 0.00 0.00 176.54 176.60 1wi0 h GLN 50 N 0.00 0.00 0.06 4.80 4.20 0.65 -2.99 115.11 121.83 1wi0 h GLN 50 Ca 0.33 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.91 1wi0 h GLN 50 Cb 1.63 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.41 1wi0 h GLN 50 CO -0.00 0.28 -0.65 0.28 -0.67 0.00 0.00 178.83 178.07 1wi0 h VAL 51 N 0.00 1.47 -2.82 -0.54 2.07 0.22 -3.40 116.25 113.25 1wi0 h VAL 51 Ca -0.07 -2.39 -0.61 0.00 0.82 0.00 0.00 66.70 64.45 1wi0 h VAL 51 Cb 1.37 3.07 -0.42 0.00 -1.52 0.00 0.00 31.29 33.79 1wi0 h VAL 51 CO 0.04 0.62 -0.60 0.18 0.02 0.00 0.00 177.57 177.83 1wi0 n LEU 52 N -4.33 3.05 0.24 2.57 4.32 0.18 -4.87 117.00 118.17 1wi0 n LEU 52 Ca -0.17 -5.24 0.14 0.00 -0.02 0.00 0.00 56.01 50.73 1wi0 n LEU 52 Cb 0.68 -0.67 0.42 0.00 -1.62 0.00 0.00 43.42 42.23 1wi0 n LEU 52 CO 0.38 1.84 0.88 1.55 -1.22 0.00 0.00 177.39 180.82 1wi0 h PRO 53 N 5.06 0.00 -0.00 3.23 0.13 -1.75 -2.80 132.00 135.88 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 0.73 0.03 -0.77 -1.91 -0.23 0.00 0.00 178.00 175.85 1wi0 n GLU 54 N -3.12 0.08 -3.79 0.86 4.07 -1.26 -4.80 120.64 112.67 1wi0 n GLU 54 Ca 0.02 -0.06 -0.26 0.00 -0.06 0.00 0.00 57.16 56.81 1wi0 n GLU 54 Cb 0.43 -1.50 -0.17 0.00 -0.06 0.00 0.00 31.44 30.14 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 -2.96 1.00 1.12 4.31 0.00 -1.05 -5.14 121.76 119.03 1wi0 s ALA 55 Ca 0.10 -0.47 -0.08 0.00 0.00 0.00 0.00 51.96 51.51 1wi0 s ALA 55 Cb 0.17 -0.96 0.13 0.00 0.00 0.00 0.00 23.12 22.45 1wi0 s ALA 55 CO 0.78 -0.73 0.29 -2.37 0.00 0.00 0.00 175.76 173.73 1wi0 n THR 56 N 5.05 0.00 0.00 0.00 5.66 -1.26 -4.58 114.28 119.15 1wi0 n THR 56 Ca -0.09 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.91 1wi0 n THR 56 Cb 0.49 -0.33 0.00 0.00 -1.55 0.00 0.00 70.33 68.94 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 -3.92 0.00 0.00 1.09 -1.04 -1.26 -4.28 114.28 104.87 1wi0 n THR 57 Ca 0.05 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.06 1wi0 n THR 57 Cb 0.20 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.71 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 -0.59 0.00 -4.51 12.58 -1.04 -1.26 -4.57 114.28 114.89 1wi0 n THR 58 Ca 0.00 0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 61.77 1wi0 n THR 58 Cb 0.00 0.00 -0.11 0.00 -1.82 0.00 0.00 70.33 68.40 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 2.67 -0.04 2.41 0.00 -1.26 -4.84 121.76 120.70 1wi0 s ALA 59 Ca 0.00 -2.11 -0.20 0.00 0.00 0.00 0.00 51.96 49.65 1wi0 s ALA 59 Cb 0.00 0.32 0.04 0.00 0.00 0.00 0.00 23.12 23.48 1wi0 s ALA 59 CO 0.00 -0.15 0.44 -0.59 0.00 0.00 0.00 175.76 175.46 1wi0 s PHE 60 N -2.97 -0.36 0.07 0.00 -0.12 -1.23 -1.21 117.98 112.16 1wi0 s PHE 60 Ca 0.34 0.61 0.03 0.00 -0.05 0.00 0.00 56.93 57.86 1wi0 s PHE 60 Cb 0.07 0.21 -0.04 0.00 -0.63 0.00 0.00 43.02 42.63 1wi0 s PHE 60 CO 0.16 -0.46 0.05 -1.21 -0.05 0.00 0.00 175.22 173.71 1wi0 s GLU 61 N -1.19 2.80 -0.07 1.99 2.02 -0.83 -1.33 118.70 122.09 1wi0 s GLU 61 Ca -0.12 -0.71 -0.03 0.00 0.02 0.00 0.00 54.97 54.13 1wi0 s GLU 61 Cb -0.03 -2.69 0.04 0.00 0.10 0.00 0.00 34.13 31.55 1wi0 s GLU 61 CO 0.06 0.57 0.15 1.52 0.02 0.00 0.00 175.26 177.57 1wi0 s TYR 62 N -1.34 -0.16 0.02 1.61 -0.85 -1.07 -1.25 117.35 114.31 1wi0 s TYR 62 Ca 0.27 0.51 -0.32 0.00 -0.52 0.00 0.00 57.07 57.01 1wi0 s TYR 62 Cb -0.12 -0.14 -0.10 0.00 0.38 0.00 0.00 41.96 41.98 1wi0 s TYR 62 CO 0.20 -0.19 1.92 0.39 -1.52 0.00 0.00 175.55 176.34 1wi0 n GLU 63 N 4.51 2.64 -1.14 -3.49 1.02 -1.26 -0.80 120.64 122.12 1wi0 n GLU 63 Ca -0.21 0.97 -0.12 0.00 -0.02 0.00 0.00 57.16 57.78 1wi0 n GLU 63 Cb 0.51 -2.88 0.07 0.00 -0.02 0.00 0.00 31.44 29.13 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 6.85 0.31 0.28 1.62 5.75 -1.26 -4.82 116.55 125.29 1wi0 n ASP 64 Ca 0.20 -1.35 0.14 0.00 -0.01 0.00 0.00 54.79 53.78 1wi0 n ASP 64 Cb 0.37 -0.37 0.85 0.00 -1.03 0.00 0.00 41.12 40.94 1wi0 n ASP 64 CO 0.00 0.00 0.00 1.05 -0.11 0.00 0.00 177.20 178.14 1wi0 h GLU 65 N 0.00 0.00 -0.65 0.11 9.09 -1.98 0.22 114.58 121.37 1wi0 h GLU 65 Ca -0.17 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.24 1wi0 h GLU 65 Cb 0.53 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.63 1wi0 h GLU 65 CO 0.14 0.05 0.00 -0.25 0.05 0.00 0.00 179.01 179.00 1wi0 n ASP 66 N -3.75 4.83 -4.00 3.06 9.92 -1.26 -4.96 116.55 120.39 1wi0 n ASP 66 Ca -0.03 -2.48 -0.39 0.00 -0.53 0.00 0.00 54.79 51.36 1wi0 n ASP 66 Cb 0.14 -0.59 0.02 0.00 -0.64 0.00 0.00 41.12 40.05 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 1.09 -0.79 0.08 0.44 0.00 0.76 -4.82 105.19 101.96 1wi0 n GLY 67 Ca 0.26 0.32 0.01 0.00 0.00 0.00 0.00 46.02 46.61 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 -1.82 1.55 -2.49 1.61 2.03 -1.26 -4.86 116.55 111.30 1wi0 n ASP 68 Ca -0.12 -1.45 -0.02 0.00 0.52 0.00 0.00 54.79 53.71 1wi0 n ASP 68 Cb 0.51 -0.01 -0.02 0.00 -0.72 0.00 0.00 41.12 40.87 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 -0.08 -4.11 -2.27 -0.67 5.12 -1.26 -4.93 116.66 108.47 1wi0 n ARG 69 Ca 0.01 3.05 -0.26 0.00 -1.93 0.00 0.00 57.85 58.72 1wi0 n ARG 69 Cb 0.14 -4.09 0.12 0.00 -1.16 0.00 0.00 32.46 27.48 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 -0.51 2.13 -0.15 0.55 -1.09 0.02 -4.80 121.20 117.35 1wi0 s ILE 70 Ca -0.12 -0.31 -0.02 0.00 -2.23 0.00 0.00 60.65 57.97 1wi0 s ILE 70 Cb 0.01 -2.82 0.05 0.00 -1.58 0.00 0.00 42.46 38.12 1wi0 s ILE 70 CO 0.32 0.00 0.01 -0.89 -1.23 0.00 0.00 174.94 173.14 1wi0 s THR 71 N -3.42 0.61 -0.76 2.92 2.01 -1.26 -2.58 115.64 113.15 1wi0 s THR 71 Ca 0.67 -0.36 -0.18 0.00 0.31 0.00 0.00 61.69 62.13 1wi0 s THR 71 Cb -0.06 -0.94 0.14 0.00 0.01 0.00 0.00 72.50 71.66 1wi0 s THR 71 CO 0.47 0.01 0.86 -0.69 -0.69 0.00 0.00 174.62 174.58 1wi0 s VAL 72 N 1.84 5.00 -1.69 3.82 1.01 -0.44 -4.79 120.40 125.15 1wi0 s VAL 72 Ca 0.01 -1.57 0.17 0.00 0.00 0.00 0.00 61.98 60.59 1wi0 s VAL 72 Cb -0.15 -4.58 0.40 0.00 0.00 0.00 0.00 36.38 32.05 1wi0 s VAL 72 CO -0.07 -1.23 1.32 0.54 0.00 0.00 0.00 175.10 175.66 1wi0 n ARG 73 N 5.78 2.46 -3.73 2.72 1.74 -1.26 -3.53 116.66 120.83 1wi0 n ARG 73 Ca 0.07 -2.18 -0.02 0.00 -0.77 0.00 0.00 57.85 54.96 1wi0 n ARG 73 Cb 0.46 -1.41 -0.01 0.00 -1.02 0.00 0.00 32.46 30.48 1wi0 n ARG 73 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1wi0 s SER 74 N -1.13 -0.15 0.28 0.55 0.01 -1.26 -5.02 113.70 106.98 1wi0 s SER 74 Ca 0.33 -0.35 -0.02 0.00 1.31 0.00 0.00 55.95 57.22 1wi0 s SER 74 Cb 0.18 0.42 0.42 0.00 0.21 0.00 0.00 66.02 67.25 1wi0 s SER 74 CO 0.25 -0.77 1.92 -0.78 0.41 0.00 0.00 173.24 174.27 1wi0 h ASP 75 N 2.00 1.01 -0.56 2.44 3.58 -1.98 -2.13 116.42 120.78 1wi0 h ASP 75 Ca -0.25 -0.01 0.10 0.00 0.42 0.00 0.00 57.03 57.28 1wi0 h ASP 75 Cb 1.22 -0.23 -0.11 0.00 1.72 0.00 0.00 39.33 41.94 1wi0 h ASP 75 CO 0.26 0.69 -0.36 -0.08 -2.88 0.00 0.00 179.24 176.87 1wi0 h GLU 76 N 1.16 -0.19 -0.57 0.28 4.81 -2.00 0.12 114.58 118.20 1wi0 h GLU 76 Ca 0.37 0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.59 1wi0 h GLU 76 Cb 0.03 0.04 -0.03 0.00 0.63 0.00 0.00 28.75 29.43 1wi0 h GLU 76 CO -0.12 -0.12 0.26 0.93 -0.73 0.00 0.00 179.01 179.23 1wi0 h GLU 77 N -0.19 0.83 -0.03 1.92 5.08 -1.77 -2.79 114.58 117.63 1wi0 h GLU 77 Ca 0.21 -0.13 0.01 0.00 -1.00 0.00 0.00 59.36 58.44 1wi0 h GLU 77 Cb 0.55 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 1wi0 h GLU 77 CO -0.66 0.70 -0.11 1.98 -1.00 0.00 0.00 179.01 179.91 1wi0 h MET 78 N 0.78 -0.11 -1.05 2.33 4.05 -0.22 0.77 114.93 121.48 1wi0 h MET 78 Ca 0.19 0.01 0.34 0.00 -0.28 0.00 0.00 59.70 59.96 1wi0 h MET 78 Cb 0.15 0.02 -0.14 0.00 -0.80 0.00 0.00 31.60 30.83 1wi0 h MET 78 CO -0.02 -0.07 0.62 0.87 0.23 0.00 0.00 176.91 178.53 1wi0 h LYS 79 N -0.11 0.28 0.50 0.39 1.57 -1.06 0.43 116.57 118.56 1wi0 h LYS 79 Ca 0.01 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.75 1wi0 h LYS 79 Cb 0.13 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1wi0 h LYS 79 CO -0.09 0.18 -0.24 0.00 -0.57 0.00 0.00 179.45 178.73 1wi0 h ALA 80 N 1.80 -0.68 -1.00 3.86 0.00 -0.69 0.79 119.26 123.34 1wi0 h ALA 80 Ca 0.74 -0.18 0.21 0.00 0.00 0.00 0.00 54.91 55.68 1wi0 h ALA 80 Cb 1.81 0.26 -0.11 0.00 0.00 0.00 0.00 17.79 19.75 1wi0 h ALA 80 CO -0.56 -0.79 0.61 1.98 0.00 0.00 0.00 179.25 180.49 1wi0 h MET 81 N -0.85 0.64 -0.05 0.00 1.85 0.47 0.18 114.93 117.18 1wi0 h MET 81 Ca -0.07 -0.04 -0.22 0.00 -0.61 0.00 0.00 59.70 58.76 1wi0 h MET 81 Cb 0.59 -0.14 0.02 0.00 0.43 0.00 0.00 31.60 32.49 1wi0 h MET 81 CO 0.11 0.42 -0.84 -0.07 -0.40 0.00 0.00 176.91 176.13 1wi0 h LEU 82 N 0.66 0.82 -1.48 3.39 3.38 -0.57 -2.01 115.31 119.50 1wi0 h LEU 82 Ca 0.59 -0.71 0.11 0.00 0.09 0.00 0.00 57.88 57.97 1wi0 h LEU 82 Cb 1.06 -0.25 -0.05 0.00 0.09 0.00 0.00 40.66 41.51 1wi0 h LEU 82 CO -0.39 1.41 0.49 -1.28 0.09 0.00 0.00 178.44 178.76 1wi0 h SER 83 N 0.31 0.51 0.06 -0.43 0.87 0.33 -1.43 113.55 113.77 1wi0 h SER 83 Ca -0.09 0.02 -0.00 0.00 -1.23 0.00 0.00 61.79 60.48 1wi0 h SER 83 Cb 1.50 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 63.37 1wi0 h SER 83 CO 0.17 0.29 -0.03 0.22 -0.53 0.00 0.00 176.83 176.95 1wi0 h TYR 84 N 0.56 -0.07 -0.80 2.24 3.20 -0.76 -1.23 116.97 120.11 1wi0 h TYR 84 Ca 0.35 -0.00 0.22 0.00 3.14 0.00 0.00 58.73 62.44 1wi0 h TYR 84 Cb 0.59 0.02 -0.15 0.00 1.54 0.00 0.00 36.73 38.74 1wi0 h TYR 84 CO -0.00 -0.05 0.03 0.98 -1.64 0.00 0.00 178.16 177.48 1wi0 n TYR 85 N -2.98 0.52 -0.03 -3.82 9.36 -0.76 0.15 117.16 119.60 1wi0 n TYR 85 Ca -0.01 0.96 -0.15 0.00 3.32 0.00 0.00 57.90 62.02 1wi0 n TYR 85 Cb 0.03 -1.11 -0.08 0.00 -0.63 0.00 0.00 39.34 37.55 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 0.59 -0.21 2.98 0.05 -1.38 1.45 116.97 120.45 1wi0 h TYR 86 Ca 0.49 -0.25 0.06 0.00 0.05 0.00 0.00 58.73 59.08 1wi0 h TYR 86 Cb 1.03 -0.10 -0.01 0.00 1.01 0.00 0.00 36.73 38.66 1wi0 h TYR 86 CO -0.39 1.00 0.17 1.03 -1.05 0.00 0.00 178.16 178.91 1wi0 h SER 87 N 0.02 0.00 0.04 3.88 0.87 0.27 0.22 113.55 118.85 1wi0 h SER 87 Ca -0.02 0.00 -0.38 0.00 -1.23 0.00 0.00 61.79 60.16 1wi0 h SER 87 Cb 1.02 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.93 1wi0 h SER 87 CO 0.08 0.00 -2.21 1.07 -0.53 0.00 0.00 176.83 175.24 1wi0 n THR 88 N -4.29 1.59 -0.15 2.23 5.66 0.21 -4.01 114.28 115.52 1wi0 n THR 88 Ca 0.02 -0.50 -0.03 0.00 -3.05 0.00 0.00 64.05 60.49 1wi0 n THR 88 Cb 0.31 -1.66 0.06 0.00 -1.55 0.00 0.00 70.33 67.48 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 -0.26 0.75 -0.02 1.08 2.07 0.24 0.34 116.25 120.45 1wi0 h VAL 89 Ca -0.53 -0.08 0.01 0.00 0.82 0.00 0.00 66.70 66.91 1wi0 h VAL 89 Cb 1.83 0.48 -0.00 0.00 -1.52 0.00 0.00 31.29 32.08 1wi0 h VAL 89 CO -0.11 0.04 0.03 0.00 0.02 0.00 0.00 177.57 177.55 1wi0 h MET 90 N 0.24 0.00 0.01 1.57 -0.00 -0.77 0.29 114.93 116.27 1wi0 h MET 90 Ca 0.24 0.00 -0.22 0.00 -0.00 0.00 0.00 59.70 59.71 1wi0 h MET 90 Cb 0.30 0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 31.87 1wi0 h MET 90 CO -0.30 0.00 -1.09 0.93 -0.00 0.00 0.00 176.91 176.45 1wi0 h GLU 91 N 0.00 0.03 0.00 -0.10 4.39 -0.55 -2.35 114.58 116.00 1wi0 h GLU 91 Ca 0.01 -0.05 0.00 0.00 0.34 0.00 0.00 59.36 59.66 1wi0 h GLU 91 Cb 0.06 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.73 1wi0 h GLU 91 CO -0.00 0.98 0.00 1.96 -1.16 0.00 0.00 179.01 180.79 1wi0 h GLN 92 N 0.01 0.00 0.04 2.33 4.20 0.76 -1.29 115.11 121.16 1wi0 h GLN 92 Ca -0.05 0.00 -0.27 0.00 0.06 0.00 0.00 58.65 58.39 1wi0 h GLN 92 Cb 1.81 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 29.56 1wi0 h GLN 92 CO 0.13 0.00 -1.47 1.96 -0.67 0.00 0.00 178.83 178.78 1wi0 h GLN 93 N 0.00 0.08 0.00 1.46 4.20 -1.41 0.62 115.11 120.06 1wi0 h GLN 93 Ca 0.00 -0.14 -0.02 0.00 0.06 0.00 0.00 58.65 58.55 1wi0 h GLN 93 Cb 0.59 0.05 -0.00 0.00 0.30 0.00 0.00 27.48 28.42 1wi0 h GLN 93 CO 0.00 1.07 -0.09 -0.39 -0.67 0.00 0.00 178.83 178.74 1wi0 h VAL 94 N -0.68 0.65 0.00 -0.54 -1.51 -1.40 -2.87 116.25 109.90 1wi0 h VAL 94 Ca -0.37 -0.39 -0.00 0.00 -1.23 0.00 0.00 66.70 64.71 1wi0 h VAL 94 Cb 1.52 1.24 0.00 0.00 -2.13 0.00 0.00 31.29 31.92 1wi0 h VAL 94 CO -0.12 0.09 -0.00 0.78 -1.23 0.00 0.00 177.57 177.09 1wi0 h ASN 95 N 0.00 -0.00 0.00 4.19 -0.26 -1.37 -3.49 115.58 114.65 1wi0 h ASN 95 Ca -0.00 -0.42 0.00 0.00 -0.56 0.00 0.00 56.30 55.32 1wi0 h ASN 95 Cb 0.23 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.49 1wi0 h ASN 95 CO 0.01 0.71 0.00 0.61 -1.06 0.00 0.00 177.43 177.70 1wi0 n GLY 96 N 1.70 0.70 3.13 2.83 0.00 -1.02 -5.09 105.19 107.43 1wi0 n GLY 96 Ca -0.04 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.82 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 0.00 0.70 0.69 1.61 -0.21 0.21 -5.03 119.66 117.64 1wi0 s GLN 97 Ca 0.00 -0.91 -0.17 0.00 0.02 0.00 0.00 55.36 54.30 1wi0 s GLN 97 Cb 0.00 -0.55 0.01 0.00 1.00 0.00 0.00 33.01 33.47 1wi0 s GLN 97 CO 0.00 0.11 1.25 -0.48 -2.12 0.00 0.00 175.29 174.05 1wi0 s LEU 98 N -1.81 3.45 0.03 2.90 0.05 -1.26 -4.17 118.68 117.86 1wi0 s LEU 98 Ca -0.04 2.49 -0.14 0.00 0.05 0.00 0.00 54.13 56.49 1wi0 s LEU 98 Cb -0.09 -4.60 -0.06 0.00 -2.05 0.00 0.00 46.19 39.39 1wi0 s LEU 98 CO 0.01 -2.12 0.42 -0.63 -0.55 0.00 0.00 176.35 173.48 1wi0 s ILE 99 N -1.69 5.01 0.10 1.48 -1.09 -1.26 -4.95 121.20 118.82 1wi0 s ILE 99 Ca 0.78 0.79 0.01 0.00 -2.23 0.00 0.00 60.65 60.01 1wi0 s ILE 99 Cb -0.33 -3.71 -0.04 0.00 -1.58 0.00 0.00 42.46 36.80 1wi0 s ILE 99 CO 0.42 0.51 0.23 -1.61 -1.23 0.00 0.00 174.94 173.26 1wi0 s GLU 100 N -1.27 3.41 0.32 2.79 0.41 -1.26 -4.76 118.70 118.34 1wi0 s GLU 100 Ca 0.26 -0.52 -0.28 0.00 -0.41 0.00 0.00 54.97 54.03 1wi0 s GLU 100 Cb -0.16 -2.99 -0.09 0.00 -1.78 0.00 0.00 34.13 29.10 1wi0 s GLU 100 CO 0.15 0.57 1.07 -1.25 -0.49 0.00 0.00 175.26 175.31 1wi0 s PRO 101 N -2.81 4.49 -1.08 0.39 0.04 -1.26 -4.88 135.00 129.89 1wi0 s PRO 101 Ca 0.35 1.68 -0.26 0.00 0.04 0.00 0.00 61.00 62.81 1wi0 s PRO 101 Cb -0.12 -2.97 -0.21 0.00 0.04 0.00 0.00 34.50 31.24 1wi0 s PRO 101 CO 0.28 0.11 2.11 -1.17 0.04 0.00 0.00 177.00 178.37 1wi0 s LEU 102 N -1.84 2.47 -0.11 -3.56 2.96 0.36 -4.69 118.68 114.26 1wi0 s LEU 102 Ca 0.49 -1.00 -0.30 0.00 -0.22 0.00 0.00 54.13 53.10 1wi0 s LEU 102 Cb -0.28 -2.59 -0.08 0.00 0.50 0.00 0.00 46.19 43.74 1wi0 s LEU 102 CO 0.36 -4.53 2.10 1.67 -1.32 0.00 0.00 176.35 174.62 1wi0 n GLN 103 N 8.22 2.29 -4.33 1.98 7.27 -1.26 -2.39 117.38 129.15 1wi0 n GLN 103 Ca 0.42 0.75 -0.22 0.00 0.07 0.00 0.00 57.00 58.02 1wi0 n GLN 103 Cb 0.47 -3.05 -0.11 0.00 2.41 0.00 0.00 30.24 29.95 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 6.38 1.83 -0.09 1.69 -4.36 -0.30 -4.12 121.20 122.22 1wi0 s ILE 104 Ca 0.96 -1.92 0.02 0.00 -0.26 0.00 0.00 60.65 59.45 1wi0 s ILE 104 Cb -0.44 -1.85 0.01 0.00 1.25 0.00 0.00 42.46 41.43 1wi0 s ILE 104 CO 0.40 -0.32 -0.17 -0.36 0.24 0.00 0.00 174.94 174.74 1wi0 s PHE 105 N -2.06 1.97 -0.69 1.37 0.40 -0.38 -0.44 117.98 118.14 1wi0 s PHE 105 Ca 0.16 -0.84 -0.27 0.00 -0.60 0.00 0.00 56.93 55.38 1wi0 s PHE 105 Cb -0.06 -1.39 0.00 0.00 0.51 0.00 0.00 43.02 42.09 1wi0 s PHE 105 CO 0.07 -0.40 1.57 -1.25 0.70 0.00 0.00 175.22 175.90 1wi0 s PRO 106 N 0.72 2.92 -0.85 0.24 0.04 -1.26 -1.96 135.00 134.85 1wi0 s PRO 106 Ca -0.12 0.13 -0.23 0.00 0.04 0.00 0.00 61.00 60.82 1wi0 s PRO 106 Cb -0.16 -4.33 -0.18 0.00 0.04 0.00 0.00 34.50 29.87 1wi0 s PRO 106 CO 0.03 -2.45 2.25 0.54 0.04 0.00 0.00 177.00 177.40 1wi0 n ARG 107 N 9.27 0.35 -2.65 4.56 1.74 -0.35 -4.84 116.66 124.74 1wi0 n ARG 107 Ca 0.13 -0.91 -0.42 0.00 -0.77 0.00 0.00 57.85 55.87 1wi0 n ARG 107 Cb 0.50 -3.30 -0.03 0.00 -1.02 0.00 0.00 32.46 28.61 1wi0 n ARG 107 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1wi0 s SER 108 N 8.48 6.30 0.00 0.55 1.04 -1.26 -4.18 113.70 124.64 1wi0 s SER 108 Ca 0.91 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 57.05 1wi0 s SER 108 Cb -0.19 -2.52 0.00 0.00 0.10 0.00 0.00 66.02 63.41 1wi0 s SER 108 CO 0.16 -1.54 0.00 0.61 0.98 0.00 0.00 173.24 173.45 1wi0 n GLY 109 N 5.20 1.53 3.79 7.32 0.00 -1.26 -5.05 105.19 116.73 1wi0 n GLY 109 Ca 0.04 -0.60 -0.29 0.00 0.00 0.00 0.00 46.02 45.16 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 1.13 1.38 -0.22 1.61 0.04 -1.26 -4.82 135.00 132.87 1wi0 s PRO 110 Ca 0.00 0.38 -0.16 0.00 0.04 0.00 0.00 61.00 61.25 1wi0 s PRO 110 Cb 0.00 -1.86 -0.08 0.00 0.04 0.00 0.00 34.50 32.60 1wi0 s PRO 110 CO 0.00 -2.05 -0.34 0.43 0.04 0.00 0.00 177.00 175.08 1wi0 n SER 111 N -3.68 1.94 -1.52 6.66 7.64 -1.26 -5.06 113.62 118.34 1wi0 n SER 111 Ca 0.07 0.34 0.14 0.00 1.01 0.00 0.00 58.87 60.43 1wi0 n SER 111 Cb 0.59 -0.78 -0.08 0.00 -1.01 0.00 0.00 64.21 62.93 1wi0 n SER 111 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1wi0 n SER 112 N -4.39 -8.22 0.00 6.43 7.64 -1.26 -5.17 113.62 108.66 1wi0 n SER 112 Ca -0.30 1.62 0.00 0.00 1.01 0.00 0.00 58.87 61.20 1wi0 n SER 112 Cb 0.65 -5.16 0.00 0.00 -1.01 0.00 0.00 64.21 58.70 1wi0 n SER 112 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64