#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 -0.61 -0.24 1.61 0.15 -1.26 -5.11 113.70 108.25 1wi0 s SER 2 Ca 0.00 0.90 -0.10 0.00 0.70 0.00 0.00 55.95 57.45 1wi0 s SER 2 Cb 0.00 1.50 0.10 0.00 -1.71 0.00 0.00 66.02 65.91 1wi0 s SER 2 CO 0.00 -0.13 0.54 -0.55 1.20 0.00 0.00 173.24 174.29 1wi0 s SER 3 N 1.97 -0.70 -1.06 5.45 0.15 -1.26 -5.09 113.70 113.17 1wi0 s SER 3 Ca -0.06 1.25 -0.23 0.00 0.70 0.00 0.00 55.95 57.61 1wi0 s SER 3 Cb -0.05 1.56 0.00 0.00 -1.71 0.00 0.00 66.02 65.82 1wi0 s SER 3 CO -0.17 -0.22 1.72 -0.83 1.20 0.00 0.00 173.24 174.94 1wi0 s GLY 4 N 2.33 0.84 -0.28 9.45 0.00 -1.26 -4.85 107.32 113.55 1wi0 s GLY 4 Ca -0.06 -2.13 -0.19 0.00 0.00 0.00 0.00 44.72 42.35 1wi0 s GLY 4 CO -0.16 3.07 0.83 -0.56 0.00 0.00 0.00 173.10 176.28 1wi0 s SER 5 N 6.00 -0.71 0.02 1.64 0.01 -1.26 -5.08 113.70 114.32 1wi0 s SER 5 Ca 0.58 1.20 -0.04 0.00 1.31 0.00 0.00 55.95 59.00 1wi0 s SER 5 Cb -0.01 1.27 -0.01 0.00 0.21 0.00 0.00 66.02 67.47 1wi0 s SER 5 CO -0.01 -0.19 -0.08 -1.20 0.41 0.00 0.00 173.24 172.17 1wi0 n SER 6 N 3.55 1.04 -0.28 2.44 7.64 -1.26 -5.14 113.62 121.62 1wi0 n SER 6 Ca -0.17 0.15 0.00 0.00 1.01 0.00 0.00 58.87 59.85 1wi0 n SER 6 Cb 0.57 -0.38 0.00 0.00 -1.01 0.00 0.00 64.21 63.39 1wi0 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wi0 n GLY 7 N 2.93 -0.42 0.09 0.23 0.00 -1.26 -5.04 105.19 101.73 1wi0 n GLY 7 Ca -0.03 -0.73 -0.11 0.00 0.00 0.00 0.00 46.02 45.15 1wi0 n GLY 7 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wi0 h PRO 8 N 0.00 -0.09 -2.04 1.61 0.13 -2.00 -3.48 132.00 126.13 1wi0 h PRO 8 Ca 0.00 0.01 0.22 0.00 -0.87 0.00 0.00 66.00 65.36 1wi0 h PRO 8 Cb 0.00 0.02 -0.07 0.00 0.13 0.00 0.00 31.00 31.08 1wi0 h PRO 8 CO 0.00 0.49 -0.38 1.19 -0.23 0.00 0.00 178.00 179.07 1wi0 n PHE 9 N -4.80 -2.13 -3.99 1.56 3.72 -1.26 -4.80 117.46 105.75 1wi0 n PHE 9 Ca -0.08 1.08 -0.14 0.00 -0.05 0.00 0.00 57.45 58.26 1wi0 n PHE 9 Cb 0.31 -1.93 -0.14 0.00 -0.94 0.00 0.00 39.48 36.77 1wi0 n PHE 9 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1wi0 s ALA 11 N 0.06 3.57 -0.34 0.00 0.00 -1.24 -4.64 121.76 119.17 1wi0 s ALA 11 Ca -0.00 -0.83 -0.01 0.00 0.00 0.00 0.00 51.96 51.12 1wi0 s ALA 11 Cb -0.02 -1.61 0.13 0.00 0.00 0.00 0.00 23.12 21.62 1wi0 s ALA 11 CO -0.00 0.67 0.19 1.41 0.00 0.00 0.00 175.76 178.02 1wi0 s MET 12 N -1.51 0.51 0.04 0.00 1.75 -1.26 -4.89 119.30 113.93 1wi0 s MET 12 Ca 0.20 -1.18 0.00 0.00 -1.25 0.00 0.00 55.69 53.47 1wi0 s MET 12 Cb -0.12 -1.33 0.00 0.00 2.84 0.00 0.00 34.83 36.22 1wi0 s MET 12 CO 0.11 -1.16 0.00 -1.91 -0.65 0.00 0.00 175.02 171.41 1wi0 n GLU 13 N 4.30 0.00 0.00 4.11 2.13 -1.26 -5.04 120.64 124.88 1wi0 n GLU 13 Ca 0.08 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.90 1wi0 n GLU 13 Cb 0.38 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.09 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 -2.41 -0.00 -4.04 4.31 5.15 -1.26 -5.15 115.26 111.86 1wi0 n ASN 14 Ca 0.00 0.16 -0.10 0.00 -0.60 0.00 0.00 54.58 54.05 1wi0 n ASN 14 Cb 0.00 0.17 -0.07 0.00 -0.53 0.00 0.00 39.78 39.35 1wi0 n ASN 14 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1wi0 s GLN 15 N -2.00 1.32 0.51 1.20 -2.07 -1.26 -5.16 119.66 112.20 1wi0 s GLN 15 Ca 0.00 -1.32 -0.13 0.00 -1.82 0.00 0.00 55.36 52.09 1wi0 s GLN 15 Cb 0.00 0.39 -0.06 0.00 -1.09 0.00 0.00 33.01 32.24 1wi0 s GLN 15 CO 0.00 -0.50 0.93 0.14 -1.32 0.00 0.00 175.29 174.54 1wi0 s VAL 16 N -4.04 4.66 0.15 3.63 -7.23 -1.26 -4.89 120.40 111.42 1wi0 s VAL 16 Ca 0.25 0.93 -0.20 0.00 -1.81 0.00 0.00 61.98 61.15 1wi0 s VAL 16 Cb 0.03 -3.77 -0.07 0.00 0.56 0.00 0.00 36.38 33.12 1wi0 s VAL 16 CO 0.07 -0.77 0.66 -0.22 -0.31 0.00 0.00 175.10 174.52 1wi0 s LEU 17 N -4.33 4.44 -0.18 1.32 2.96 0.36 -4.94 118.68 118.32 1wi0 s LEU 17 Ca 0.55 1.35 0.01 0.00 -0.22 0.00 0.00 54.13 55.82 1wi0 s LEU 17 Cb -0.10 -3.27 0.03 0.00 0.50 0.00 0.00 46.19 43.35 1wi0 s LEU 17 CO 0.38 0.15 -0.12 -0.69 -1.32 0.00 0.00 176.35 174.75 1wi0 s VAL 18 N -1.32 1.60 -0.27 1.68 1.01 -1.26 0.08 120.40 121.92 1wi0 s VAL 18 Ca 0.37 -0.84 -0.10 0.00 0.00 0.00 0.00 61.98 61.40 1wi0 s VAL 18 Cb -0.18 -1.61 -0.05 0.00 0.00 0.00 0.00 36.38 34.54 1wi0 s VAL 18 CO 0.21 0.29 0.17 -0.63 0.00 0.00 0.00 175.10 175.14 1wi0 s ILE 19 N 1.44 5.20 -0.56 2.22 1.01 -1.05 -0.48 121.20 128.98 1wi0 s ILE 19 Ca 0.01 0.13 -0.17 0.00 0.00 0.00 0.00 60.65 60.62 1wi0 s ILE 19 Cb -0.15 -3.46 0.11 0.00 0.01 0.00 0.00 42.46 38.97 1wi0 s ILE 19 CO -0.09 0.28 0.59 -0.60 0.00 0.00 0.00 174.94 175.11 1wi0 s ARG 20 N 1.61 3.02 -0.19 2.79 3.52 -0.74 0.48 118.95 129.44 1wi0 s ARG 20 Ca 0.07 -1.49 -0.29 0.00 -0.13 0.00 0.00 55.73 53.88 1wi0 s ARG 20 Cb -0.15 -4.27 -0.00 0.00 -1.56 0.00 0.00 34.95 28.96 1wi0 s ARG 20 CO 0.09 -1.40 1.15 0.42 -0.81 0.00 0.00 175.30 174.75 1wi0 s ILE 21 N 2.11 4.48 -0.11 4.11 1.09 0.96 -1.28 121.20 132.56 1wi0 s ILE 21 Ca 0.07 1.79 -0.29 0.00 -1.10 0.00 0.00 60.65 61.12 1wi0 s ILE 21 Cb -0.27 -4.16 -0.04 0.00 -1.06 0.00 0.00 42.46 36.94 1wi0 s ILE 21 CO 0.05 -0.15 1.47 -0.54 -0.10 0.00 0.00 174.94 175.67 1wi0 s LYS 22 N 3.26 4.21 -0.05 2.79 -0.14 -0.18 -2.15 119.74 127.48 1wi0 s LYS 22 Ca 0.50 1.94 -0.10 0.00 -1.36 0.00 0.00 55.97 56.94 1wi0 s LYS 22 Cb -0.19 -3.88 -0.05 0.00 -1.68 0.00 0.00 37.83 32.04 1wi0 s LYS 22 CO 0.11 -0.78 0.27 0.42 -0.76 0.00 0.00 175.35 174.61 1wi0 s ILE 23 N 3.76 5.29 -0.36 2.17 -1.09 -0.86 -4.46 121.20 125.65 1wi0 s ILE 23 Ca 0.64 0.43 -0.29 0.00 -2.23 0.00 0.00 60.65 59.21 1wi0 s ILE 23 Cb -0.28 -3.55 0.00 0.00 -1.58 0.00 0.00 42.46 37.06 1wi0 s ILE 23 CO 0.22 0.55 1.39 -2.16 -1.23 0.00 0.00 174.94 173.71 1wi0 s PRO 24 N -1.21 3.70 -0.66 2.79 0.04 -1.26 -3.97 135.00 134.43 1wi0 s PRO 24 Ca 0.21 1.08 -0.15 0.00 0.04 0.00 0.00 61.00 62.19 1wi0 s PRO 24 Cb -0.14 -3.98 0.02 0.00 0.04 0.00 0.00 34.50 30.44 1wi0 s PRO 24 CO 0.10 -1.40 0.64 -1.71 0.04 0.00 0.00 177.00 174.66 1wi0 n ASN 25 N 8.41 -5.68 0.00 6.66 5.15 -1.26 -4.78 115.26 123.76 1wi0 n ASN 25 Ca 0.16 -0.46 0.00 0.00 -0.60 0.00 0.00 54.58 53.68 1wi0 n ASN 25 Cb 0.47 -2.42 0.00 0.00 -0.53 0.00 0.00 39.78 37.31 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 -1.51 0.00 0.00 1.20 2.88 -1.26 -5.14 113.62 109.79 1wi0 n SER 26 Ca -0.17 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.37 1wi0 n SER 26 Cb 0.65 0.07 0.00 0.00 -0.75 0.00 0.00 64.21 64.17 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 -0.98 0.31 3.64 0.46 0.00 -1.25 -5.06 105.19 102.31 1wi0 n GLY 27 Ca 0.00 -0.38 -0.04 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.12 0.08 4.61 0.00 -1.26 -2.02 121.76 120.05 1wi0 s ALA 28 Ca 0.00 1.76 0.07 0.00 0.00 0.00 0.00 51.96 53.80 1wi0 s ALA 28 Cb 0.00 -1.51 -0.04 0.00 0.00 0.00 0.00 23.12 21.57 1wi0 s ALA 28 CO 0.00 -0.19 -0.14 0.08 0.00 0.00 0.00 175.76 175.51 1wi0 s VAL 29 N -0.44 3.12 -0.27 0.00 1.01 -0.91 -4.93 120.40 117.98 1wi0 s VAL 29 Ca 0.06 -1.25 -0.07 0.00 0.00 0.00 0.00 61.98 60.71 1wi0 s VAL 29 Cb -0.03 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 33.93 1wi0 s VAL 29 CO -0.10 0.20 0.08 1.51 0.00 0.00 0.00 175.10 176.79 1wi0 s ASP 30 N -1.91 5.13 -0.51 3.32 -4.77 -1.26 -0.03 116.67 116.64 1wi0 s ASP 30 Ca 0.18 -0.42 -0.23 0.00 -3.30 0.00 0.00 52.55 48.78 1wi0 s ASP 30 Cb -0.11 -1.91 0.04 0.00 -1.09 0.00 0.00 42.92 39.85 1wi0 s ASP 30 CO 0.10 -0.11 0.84 0.86 0.70 0.00 0.00 175.17 177.57 1wi0 s TRP 31 N 1.57 2.90 -0.53 2.11 -0.00 0.18 -4.88 118.94 120.28 1wi0 s TRP 31 Ca 0.05 -0.00 -0.26 0.00 -0.00 0.00 0.00 56.10 55.89 1wi0 s TRP 31 Cb -0.16 -3.85 -0.05 0.00 -0.00 0.00 0.00 33.47 29.40 1wi0 s TRP 31 CO 0.03 -1.17 2.24 -0.08 -0.00 0.00 0.00 176.95 177.97 1wi0 s THR 32 N 3.54 3.12 -0.26 5.86 -1.32 -1.26 -2.53 115.64 122.78 1wi0 s THR 32 Ca 0.29 0.06 -0.08 0.00 -1.21 0.00 0.00 61.69 60.74 1wi0 s THR 32 Cb -0.13 -3.31 -0.04 0.00 -1.51 0.00 0.00 72.50 67.51 1wi0 s THR 32 CO 0.20 -0.30 0.11 -0.69 -2.21 0.00 0.00 174.62 171.72 1wi0 s VAL 33 N 11.26 4.62 -0.13 5.08 1.01 0.11 -4.94 120.40 137.42 1wi0 s VAL 33 Ca 0.88 -0.07 0.18 0.00 0.00 0.00 0.00 61.98 62.97 1wi0 s VAL 33 Cb -0.15 -3.17 -0.24 0.00 0.00 0.00 0.00 36.38 32.81 1wi0 s VAL 33 CO 0.24 0.31 0.39 1.41 0.00 0.00 0.00 175.10 177.46 1wi0 n HIS 34 N 4.94 0.33 -2.13 5.22 8.25 -1.26 0.13 115.22 130.70 1wi0 n HIS 34 Ca -0.16 0.11 -0.40 0.00 -0.26 0.00 0.00 57.72 57.02 1wi0 n HIS 34 Cb 0.52 -0.93 0.03 0.00 1.12 0.00 0.00 29.99 30.72 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 -2.71 7.48 -0.32 0.41 7.64 -1.26 -3.67 113.62 121.20 1wi0 n SER 35 Ca -0.20 -3.78 0.01 0.00 1.01 0.00 0.00 58.87 55.91 1wi0 n SER 35 Cb 0.95 -1.10 0.08 0.00 -1.01 0.00 0.00 64.21 63.13 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 3.39 0.38 1.04 0.23 0.00 -1.92 0.41 103.07 106.60 1wi0 h GLY 36 Ca 0.56 0.38 -0.21 0.00 0.00 0.00 0.00 47.33 48.05 1wi0 h GLY 36 CO 1.35 -0.28 -0.79 -0.56 0.00 0.00 0.00 176.54 176.26 1wi0 h PRO 37 N -0.03 0.62 -2.07 4.80 0.13 -1.97 -3.28 132.00 130.20 1wi0 h PRO 37 Ca 0.38 -0.60 -0.37 0.00 -0.87 0.00 0.00 66.00 64.53 1wi0 h PRO 37 Cb 0.62 0.16 -0.11 0.00 0.13 0.00 0.00 31.00 31.79 1wi0 h PRO 37 CO -0.90 1.21 0.24 0.94 -0.23 0.00 0.00 178.00 179.27 1wi0 n GLN 38 N -4.03 2.35 -5.25 0.86 7.27 0.04 -4.85 117.38 113.77 1wi0 n GLN 38 Ca -0.10 -1.74 -0.31 0.00 0.07 0.00 0.00 57.00 54.93 1wi0 n GLN 38 Cb 0.76 -2.12 -0.16 0.00 2.41 0.00 0.00 30.24 31.12 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 -1.03 2.05 0.20 1.69 2.96 -0.62 -4.78 118.68 119.14 1wi0 s LEU 39 Ca 0.63 -0.47 0.08 0.00 -0.22 0.00 0.00 54.13 54.15 1wi0 s LEU 39 Cb 0.34 -1.30 -0.04 0.00 0.50 0.00 0.00 46.19 45.68 1wi0 s LEU 39 CO -0.10 0.29 0.00 -0.76 -1.32 0.00 0.00 176.35 174.46 1wi0 s LEU 40 N -0.46 3.29 0.26 -0.68 1.43 -1.26 -4.90 118.68 116.36 1wi0 s LEU 40 Ca 0.06 -0.46 -0.03 0.00 -1.03 0.00 0.00 54.13 52.66 1wi0 s LEU 40 Cb -0.11 -1.90 0.42 0.00 0.03 0.00 0.00 46.19 44.63 1wi0 s LEU 40 CO 0.00 0.06 1.84 0.15 0.23 0.00 0.00 176.35 178.64 1wi0 h PHE 41 N 2.45 1.03 0.88 0.29 3.57 -1.90 -2.66 116.94 120.59 1wi0 h PHE 41 Ca -0.46 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.02 1wi0 h PHE 41 Cb 1.22 -0.33 0.01 0.00 2.79 0.00 0.00 35.95 39.63 1wi0 h PHE 41 CO 0.64 0.47 -0.45 0.00 -2.23 0.00 0.00 178.31 176.74 1wi0 h ARG 42 N 0.97 -1.17 -0.83 1.11 -0.00 -1.95 -2.56 114.38 109.95 1wi0 h ARG 42 Ca 0.42 0.08 0.22 0.00 -0.50 0.00 0.00 59.98 60.20 1wi0 h ARG 42 Cb 0.30 0.27 -0.16 0.00 0.00 0.00 0.00 29.97 30.38 1wi0 h ARG 42 CO -0.22 -0.78 -0.02 -0.25 0.00 0.00 0.00 179.97 178.71 1wi0 n ASP 43 N -5.62 -0.13 0.11 7.04 9.92 -1.02 0.20 116.55 127.05 1wi0 n ASP 43 Ca -0.16 1.41 -0.13 0.00 -0.53 0.00 0.00 54.79 55.39 1wi0 n ASP 43 Cb 0.49 -0.50 -0.06 0.00 -0.64 0.00 0.00 41.12 40.41 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 0.43 -0.82 2.53 2.07 -1.26 0.27 116.25 119.47 1wi0 h VAL 44 Ca 0.49 0.00 0.01 0.00 0.82 0.00 0.00 66.70 68.02 1wi0 h VAL 44 Cb 0.97 0.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.13 1wi0 h VAL 44 CO -0.79 0.00 0.54 -0.07 0.02 0.00 0.00 177.57 177.27 1wi0 h LEU 45 N -0.47 0.92 -1.99 2.57 -0.00 0.26 0.64 115.31 117.24 1wi0 h LEU 45 Ca 0.03 -0.02 -0.02 0.00 -0.00 0.00 0.00 57.88 57.87 1wi0 h LEU 45 Cb 0.49 -0.23 -0.00 0.00 -0.00 0.00 0.00 40.66 40.92 1wi0 h LEU 45 CO -0.15 0.66 -0.10 0.44 -0.00 0.00 0.00 178.44 179.29 1wi0 h ASP 46 N 1.09 0.00 0.00 -0.43 3.32 0.19 -0.37 116.42 120.22 1wi0 h ASP 46 Ca 0.30 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.33 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 -0.07 0.10 -0.41 0.58 -1.72 0.00 0.00 179.24 177.72 1wi0 h VAL 47 N 0.00 0.13 -0.89 -1.35 2.07 0.24 -3.36 116.25 113.09 1wi0 h VAL 47 Ca -0.00 -1.14 0.24 0.00 0.82 0.00 0.00 66.70 66.62 1wi0 h VAL 47 Cb 0.27 0.29 -0.15 0.00 -1.52 0.00 0.00 31.29 30.18 1wi0 h VAL 47 CO 0.01 0.05 0.13 0.40 0.02 0.00 0.00 177.57 178.18 1wi0 h ILE 48 N -1.00 0.21 -1.12 4.57 2.04 0.20 1.33 117.51 123.75 1wi0 h ILE 48 Ca -0.03 -0.04 0.31 0.00 1.00 0.00 0.00 64.86 66.10 1wi0 h ILE 48 Cb 0.45 0.09 -0.09 0.00 -0.74 0.00 0.00 36.82 36.53 1wi0 h ILE 48 CO -0.02 0.02 0.74 1.23 0.00 0.00 0.00 178.15 180.12 1wi0 h GLY 49 N 0.12 1.01 2.00 5.37 0.00 -1.22 1.57 103.07 111.91 1wi0 h GLY 49 Ca 0.55 -0.15 -0.15 0.00 0.00 0.00 0.00 47.33 47.58 1wi0 h GLY 49 CO -0.75 -0.16 -0.71 1.46 0.00 0.00 0.00 176.54 176.39 1wi0 h GLN 50 N 0.27 0.00 0.15 4.80 4.20 0.16 -2.10 115.11 122.58 1wi0 h GLN 50 Ca 0.63 0.00 -0.21 0.00 0.06 0.00 0.00 58.65 59.13 1wi0 h GLN 50 Cb 1.83 0.00 0.02 0.00 0.30 0.00 0.00 27.48 29.63 1wi0 h GLN 50 CO -0.27 0.71 -0.94 0.28 -0.67 0.00 0.00 178.83 177.94 1wi0 h VAL 51 N 0.00 1.43 -2.90 -0.54 2.07 0.20 -3.39 116.25 113.13 1wi0 h VAL 51 Ca -0.01 -2.53 -0.62 0.00 0.82 0.00 0.00 66.70 64.37 1wi0 h VAL 51 Cb 1.28 3.13 -0.42 0.00 -1.52 0.00 0.00 31.29 33.76 1wi0 h VAL 51 CO 0.09 0.72 -0.58 0.18 0.02 0.00 0.00 177.57 178.00 1wi0 n LEU 52 N -4.07 3.11 0.24 2.57 4.32 0.37 -4.87 117.00 118.67 1wi0 n LEU 52 Ca -0.16 -5.25 0.14 0.00 -0.02 0.00 0.00 56.01 50.73 1wi0 n LEU 52 Cb 0.85 -0.71 0.42 0.00 -1.62 0.00 0.00 43.42 42.36 1wi0 n LEU 52 CO 0.48 1.82 0.88 1.55 -1.22 0.00 0.00 177.39 180.91 1wi0 h PRO 53 N 5.15 0.00 -0.13 3.23 0.13 -1.59 -2.70 132.00 136.09 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 0.74 0.03 0.00 0.39 -0.23 0.00 0.00 178.00 178.93 1wi0 n GLU 54 N -3.12 2.31 -3.20 0.86 1.02 -1.26 -4.55 120.64 112.70 1wi0 n GLU 54 Ca 0.02 -1.93 -0.22 0.00 -0.02 0.00 0.00 57.16 55.01 1wi0 n GLU 54 Cb 0.43 -1.47 -0.07 0.00 -0.02 0.00 0.00 31.44 30.31 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 1.27 1.94 -1.63 0.62 0.00 -1.02 -5.12 120.51 116.57 1wi0 n ALA 55 Ca 0.16 -2.91 -0.46 0.00 0.00 0.00 0.00 53.44 50.22 1wi0 n ALA 55 Cb 0.58 -0.88 -0.03 0.00 0.00 0.00 0.00 19.45 19.11 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 2.16 1.04 -4.50 0.00 -1.04 -1.23 -4.75 114.28 105.97 1wi0 n THR 56 Ca 0.24 -0.26 -0.22 0.00 -2.04 0.00 0.00 64.05 61.76 1wi0 n THR 56 Cb 0.52 -1.22 -0.14 0.00 -1.82 0.00 0.00 70.33 67.67 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 -0.21 1.30 -0.09 12.58 2.01 -1.26 -2.99 115.64 126.99 1wi0 s THR 57 Ca 0.69 -1.01 0.02 0.00 0.31 0.00 0.00 61.69 61.70 1wi0 s THR 57 Cb -0.72 -1.15 -0.07 0.00 0.01 0.00 0.00 72.50 70.57 1wi0 s THR 57 CO 0.52 0.12 -0.06 0.41 -0.69 0.00 0.00 174.62 174.92 1wi0 n THR 58 N 2.00 0.51 -4.64 -0.82 -1.04 -1.24 -4.83 114.28 104.22 1wi0 n THR 58 Ca -0.17 -0.22 -0.29 0.00 -2.04 0.00 0.00 64.05 61.33 1wi0 n THR 58 Cb 0.54 -0.82 -0.09 0.00 -1.82 0.00 0.00 70.33 68.15 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 -2.18 3.45 -0.10 2.41 0.00 -1.26 -4.83 121.76 119.25 1wi0 s ALA 59 Ca -0.10 -1.11 -0.26 0.00 0.00 0.00 0.00 51.96 50.49 1wi0 s ALA 59 Cb 0.03 0.31 0.06 0.00 0.00 0.00 0.00 23.12 23.52 1wi0 s ALA 59 CO 0.23 -0.15 0.61 -0.59 0.00 0.00 0.00 175.76 175.85 1wi0 s PHE 60 N -2.98 -0.60 0.22 0.00 -0.12 -1.22 -1.58 117.98 111.70 1wi0 s PHE 60 Ca 0.19 1.17 0.05 0.00 -0.05 0.00 0.00 56.93 58.28 1wi0 s PHE 60 Cb 0.04 0.31 -0.03 0.00 -0.63 0.00 0.00 43.02 42.71 1wi0 s PHE 60 CO 0.10 -0.49 0.26 -1.21 -0.05 0.00 0.00 175.22 173.83 1wi0 s GLU 61 N -0.75 3.19 -0.24 1.99 2.02 -0.66 -1.74 118.70 122.51 1wi0 s GLU 61 Ca -0.08 -0.84 -0.12 0.00 0.02 0.00 0.00 54.97 53.94 1wi0 s GLU 61 Cb -0.02 -2.76 0.08 0.00 0.10 0.00 0.00 34.13 31.53 1wi0 s GLU 61 CO 0.06 0.45 0.57 1.52 0.02 0.00 0.00 175.26 177.88 1wi0 s TYR 62 N -1.95 -0.92 0.10 1.61 -0.85 -1.01 -0.44 117.35 113.89 1wi0 s TYR 62 Ca 0.33 1.83 -0.31 0.00 -0.52 0.00 0.00 57.07 58.41 1wi0 s TYR 62 Cb -0.09 0.51 -0.09 0.00 0.38 0.00 0.00 41.96 42.66 1wi0 s TYR 62 CO 0.27 -0.48 1.73 -1.21 -1.52 0.00 0.00 175.55 174.34 1wi0 s GLU 63 N 1.76 4.17 0.00 -3.49 2.02 -1.25 -0.62 118.70 121.29 1wi0 s GLU 63 Ca -0.09 2.47 0.00 0.00 0.02 0.00 0.00 54.97 57.37 1wi0 s GLU 63 Cb -0.07 -3.56 0.00 0.00 0.10 0.00 0.00 34.13 30.60 1wi0 s GLU 63 CO -0.17 -0.78 0.00 -0.40 0.02 0.00 0.00 175.26 173.93 1wi0 n ASP 64 N 5.51 0.00 0.00 -0.19 5.75 -0.78 -4.79 116.55 122.05 1wi0 n ASP 64 Ca 0.17 -0.16 0.03 0.00 -0.01 0.00 0.00 54.79 54.82 1wi0 n ASP 64 Cb 0.39 0.00 0.40 0.00 -1.03 0.00 0.00 41.12 40.88 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 0.53 -0.99 0.11 4.11 -1.94 -0.06 114.58 116.34 1wi0 h GLU 65 Ca 0.00 -0.05 -0.29 0.00 0.07 0.00 0.00 59.36 59.09 1wi0 h GLU 65 Cb 0.00 -0.11 -0.17 0.00 0.50 0.00 0.00 28.75 28.97 1wi0 h GLU 65 CO 0.00 0.40 0.37 -0.25 0.07 0.00 0.00 179.01 179.60 1wi0 n ASP 66 N -4.43 3.46 -2.17 3.06 8.00 -1.26 -4.84 116.55 118.38 1wi0 n ASP 66 Ca 0.03 -2.93 -0.03 0.00 0.71 0.00 0.00 54.79 52.57 1wi0 n ASP 66 Cb 0.10 -0.70 -0.00 0.00 -0.02 0.00 0.00 41.12 40.50 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 -0.43 -0.32 3.55 0.44 0.00 -0.04 -4.85 105.19 103.55 1wi0 n GLY 67 Ca 0.34 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.95 1wi0 n GLY 67 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1wi0 s ASP 68 N -1.84 6.22 -0.25 1.61 1.01 -1.26 -4.68 116.67 117.48 1wi0 s ASP 68 Ca 0.00 -0.19 -0.32 0.00 0.71 0.00 0.00 52.55 52.76 1wi0 s ASP 68 Cb 0.00 -2.22 -0.08 0.00 1.01 0.00 0.00 42.92 41.63 1wi0 s ASP 68 CO 0.00 -0.38 2.17 0.54 0.21 0.00 0.00 175.17 177.72 1wi0 n ARG 69 N 5.48 1.65 -2.38 8.23 5.12 -1.26 -1.86 116.66 131.64 1wi0 n ARG 69 Ca -0.08 0.47 -0.26 0.00 -1.93 0.00 0.00 57.85 56.06 1wi0 n ARG 69 Cb 0.49 -2.87 0.13 0.00 -1.16 0.00 0.00 32.46 29.05 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 7.46 2.09 -0.05 0.55 -1.09 0.21 -4.78 121.20 125.58 1wi0 s ILE 70 Ca 1.03 -0.41 -0.00 0.00 -2.23 0.00 0.00 60.65 59.05 1wi0 s ILE 70 Cb -0.58 -2.68 0.03 0.00 -1.58 0.00 0.00 42.46 37.65 1wi0 s ILE 70 CO 0.42 0.00 -0.01 -0.89 -1.23 0.00 0.00 174.94 173.23 1wi0 s THR 71 N -3.38 0.37 -0.37 2.92 2.01 -1.26 -2.40 115.64 113.53 1wi0 s THR 71 Ca 0.69 0.04 -0.05 0.00 0.31 0.00 0.00 61.69 62.67 1wi0 s THR 71 Cb -0.05 -0.47 0.07 0.00 0.01 0.00 0.00 72.50 72.06 1wi0 s THR 71 CO 0.47 0.22 0.15 -0.69 -0.69 0.00 0.00 174.62 174.08 1wi0 s VAL 72 N 1.39 3.59 -0.20 3.82 1.01 -0.71 -4.89 120.40 124.41 1wi0 s VAL 72 Ca -0.04 -1.51 0.09 0.00 0.00 0.00 0.00 61.98 60.51 1wi0 s VAL 72 Cb -0.13 -3.20 0.18 0.00 0.00 0.00 0.00 36.38 33.23 1wi0 s VAL 72 CO -0.02 -0.39 1.13 0.54 0.00 0.00 0.00 175.10 176.35 1wi0 n ARG 73 N 4.74 2.50 -3.51 2.72 1.74 -1.26 -3.40 116.66 120.19 1wi0 n ARG 73 Ca -0.09 -2.02 -0.09 0.00 -0.77 0.00 0.00 57.85 54.87 1wi0 n ARG 73 Cb 0.43 -1.27 -0.03 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 -1.61 -0.39 0.26 0.55 0.15 -1.26 -5.03 113.70 106.37 1wi0 s SER 74 Ca 0.17 0.08 -0.01 0.00 0.70 0.00 0.00 55.95 56.88 1wi0 s SER 74 Cb 0.13 0.39 0.55 0.00 -1.71 0.00 0.00 66.02 65.38 1wi0 s SER 74 CO 0.04 -0.61 1.73 0.44 1.20 0.00 0.00 173.24 176.05 1wi0 h ASP 75 N 2.11 0.38 -0.43 5.45 5.19 -1.97 -1.09 116.42 126.06 1wi0 h ASP 75 Ca -0.22 0.11 0.07 0.00 -0.62 0.00 0.00 57.03 56.36 1wi0 h ASP 75 Cb 1.23 0.07 -0.09 0.00 0.18 0.00 0.00 39.33 40.72 1wi0 h ASP 75 CO 0.32 0.12 -0.47 -0.33 -3.12 0.00 0.00 179.24 175.76 1wi0 h GLU 76 N 0.50 -0.33 -0.92 3.56 5.08 -2.00 0.33 114.58 120.81 1wi0 h GLU 76 Ca 0.47 0.02 0.11 0.00 -1.00 0.00 0.00 59.36 58.96 1wi0 h GLU 76 Cb 0.73 0.07 -0.07 0.00 0.50 0.00 0.00 28.75 29.99 1wi0 h GLU 76 CO -0.42 -0.22 0.59 0.93 -1.00 0.00 0.00 179.01 178.90 1wi0 h GLU 77 N -0.34 0.85 0.23 2.33 3.07 -1.58 -2.26 114.58 116.88 1wi0 h GLU 77 Ca 0.12 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.92 1wi0 h GLU 77 Cb 0.59 -0.19 -0.00 0.00 -0.84 0.00 0.00 28.75 28.30 1wi0 h GLU 77 CO -0.60 0.57 -0.13 0.52 -1.40 0.00 0.00 179.01 177.97 1wi0 h MET 78 N 0.88 -0.32 -1.42 2.33 2.86 0.23 0.26 114.93 119.75 1wi0 h MET 78 Ca 0.44 0.02 0.46 0.00 -2.06 0.00 0.00 59.70 58.56 1wi0 h MET 78 Cb 0.49 0.07 -0.12 0.00 0.06 0.00 0.00 31.60 32.10 1wi0 h MET 78 CO -0.20 -0.21 0.94 0.87 1.06 0.00 0.00 176.91 179.37 1wi0 h LYS 79 N -0.33 0.06 0.22 1.72 1.57 -0.70 0.97 116.57 120.09 1wi0 h LYS 79 Ca -0.03 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 1wi0 h LYS 79 Cb 0.26 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.56 1wi0 h LYS 79 CO 0.04 0.04 -0.11 0.00 -0.57 0.00 0.00 179.45 178.85 1wi0 h ALA 80 N 1.50 -0.30 -0.96 3.86 0.00 -0.84 0.23 119.26 122.74 1wi0 h ALA 80 Ca 0.83 -0.20 0.15 0.00 0.00 0.00 0.00 54.91 55.69 1wi0 h ALA 80 Cb 2.77 0.12 -0.10 0.00 0.00 0.00 0.00 17.79 20.58 1wi0 h ALA 80 CO -0.34 -0.43 0.58 1.98 0.00 0.00 0.00 179.25 181.03 1wi0 h MET 81 N -0.77 0.79 -0.07 0.00 1.85 0.44 0.21 114.93 117.37 1wi0 h MET 81 Ca -0.03 -0.05 -0.19 0.00 -0.61 0.00 0.00 59.70 58.83 1wi0 h MET 81 Cb 0.51 -0.18 -0.01 0.00 0.43 0.00 0.00 31.60 32.35 1wi0 h MET 81 CO 0.05 0.52 -0.75 -0.07 -0.40 0.00 0.00 176.91 176.27 1wi0 h LEU 82 N 0.81 0.46 -1.11 3.39 3.38 -0.61 -1.90 115.31 119.72 1wi0 h LEU 82 Ca 0.52 -0.31 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 1wi0 h LEU 82 Cb 0.69 -0.14 -0.04 0.00 0.09 0.00 0.00 40.66 41.27 1wi0 h LEU 82 CO -0.34 1.05 0.45 -1.28 0.09 0.00 0.00 178.44 178.41 1wi0 h SER 83 N 0.26 0.94 0.27 -0.43 0.87 0.24 -2.37 113.55 113.33 1wi0 h SER 83 Ca -0.03 -0.06 -0.01 0.00 -1.23 0.00 0.00 61.79 60.45 1wi0 h SER 83 Cb 1.32 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 63.05 1wi0 h SER 83 CO 0.13 0.74 -0.13 0.22 -0.53 0.00 0.00 176.83 177.26 1wi0 h TYR 84 N 1.08 -0.34 -0.85 2.24 3.20 -0.77 -1.43 116.97 120.09 1wi0 h TYR 84 Ca 0.28 -0.01 0.23 0.00 3.14 0.00 0.00 58.73 62.37 1wi0 h TYR 84 Cb -0.01 0.11 -0.16 0.00 1.54 0.00 0.00 36.73 38.21 1wi0 h TYR 84 CO 0.01 -0.21 -0.01 0.98 -1.64 0.00 0.00 178.16 177.29 1wi0 n TYR 85 N -4.53 0.52 -0.04 -3.82 9.36 -0.72 0.18 117.16 118.10 1wi0 n TYR 85 Ca -0.05 1.03 -0.16 0.00 3.32 0.00 0.00 57.90 62.04 1wi0 n TYR 85 Cb 0.14 -1.13 -0.06 0.00 -0.63 0.00 0.00 39.34 37.66 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 1.02 0.00 2.98 0.05 -1.51 1.55 116.97 121.05 1wi0 h TYR 86 Ca 0.51 -0.41 -0.01 0.00 0.05 0.00 0.00 58.73 58.86 1wi0 h TYR 86 Cb 1.02 -0.17 -0.00 0.00 1.01 0.00 0.00 36.73 38.59 1wi0 h TYR 86 CO -0.46 1.24 -0.06 1.03 -1.05 0.00 0.00 178.16 178.86 1wi0 h SER 87 N 0.51 0.00 0.04 3.88 0.87 0.30 0.86 113.55 120.01 1wi0 h SER 87 Ca -0.02 0.00 -0.38 0.00 -1.23 0.00 0.00 61.79 60.15 1wi0 h SER 87 Cb 1.26 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.17 1wi0 h SER 87 CO 0.14 0.06 -2.26 1.07 -0.53 0.00 0.00 176.83 175.31 1wi0 n THR 88 N -4.32 1.60 -0.16 2.23 5.66 0.23 -4.07 114.28 115.45 1wi0 n THR 88 Ca -0.03 -0.56 -0.03 0.00 -3.05 0.00 0.00 64.05 60.39 1wi0 n THR 88 Cb 0.14 -1.60 0.06 0.00 -1.55 0.00 0.00 70.33 67.39 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 -0.11 0.82 0.00 1.08 2.07 0.24 0.31 116.25 120.67 1wi0 h VAL 89 Ca -0.53 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 66.87 1wi0 h VAL 89 Cb 1.89 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 32.11 1wi0 h VAL 89 CO -0.06 0.06 -0.00 0.00 0.02 0.00 0.00 177.57 177.59 1wi0 h MET 90 N 0.35 0.00 0.15 1.57 -0.00 -1.03 -0.84 114.93 115.13 1wi0 h MET 90 Ca 0.24 0.00 -0.31 0.00 -0.00 0.00 0.00 59.70 59.63 1wi0 h MET 90 Cb 0.26 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.86 1wi0 h MET 90 CO -0.25 0.00 -1.53 1.49 -0.00 0.00 0.00 176.91 176.62 1wi0 h GLU 91 N 0.00 0.32 0.00 -0.10 4.81 -0.61 -3.13 114.58 115.86 1wi0 h GLU 91 Ca -0.00 -0.54 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 1wi0 h GLU 91 Cb 0.00 0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.59 1wi0 h GLU 91 CO 0.00 1.21 0.00 1.96 -0.73 0.00 0.00 179.01 181.45 1wi0 h GLN 92 N 0.09 0.00 0.17 1.92 4.20 0.41 -1.66 115.11 120.24 1wi0 h GLN 92 Ca -0.25 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.11 1wi0 h GLN 92 Cb 2.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.83 1wi0 h GLN 92 CO 0.19 0.00 -1.83 1.96 -0.67 0.00 0.00 178.83 178.48 1wi0 h GLN 93 N 0.00 0.36 0.00 1.46 4.20 -1.50 -2.65 115.11 116.99 1wi0 h GLN 93 Ca 0.00 -0.62 -0.06 0.00 0.06 0.00 0.00 58.65 58.03 1wi0 h GLN 93 Cb 0.22 0.23 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 1wi0 h GLN 93 CO 0.00 1.30 -0.27 -0.39 -0.67 0.00 0.00 178.83 178.79 1wi0 h VAL 94 N 0.10 1.04 0.06 -0.54 -1.51 -1.34 -3.23 116.25 110.83 1wi0 h VAL 94 Ca -0.37 -0.99 -0.00 0.00 -1.23 0.00 0.00 66.70 64.11 1wi0 h VAL 94 Cb 2.08 1.56 0.00 0.00 -2.13 0.00 0.00 31.29 32.80 1wi0 h VAL 94 CO 0.15 0.27 -0.03 0.78 -1.23 0.00 0.00 177.57 177.51 1wi0 h ASN 95 N 0.00 -0.07 0.00 4.19 -0.26 -1.43 -3.50 115.58 114.52 1wi0 h ASN 95 Ca -0.00 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.74 1wi0 h ASN 95 Cb 0.54 0.02 0.00 0.00 -1.06 0.00 0.00 38.32 37.81 1wi0 h ASN 95 CO 0.04 0.15 0.00 0.61 -1.06 0.00 0.00 177.43 177.17 1wi0 n GLY 96 N 1.49 1.60 2.97 2.83 0.00 -1.00 -5.11 105.19 107.98 1wi0 n GLY 96 Ca -0.01 -0.11 -0.36 0.00 0.00 0.00 0.00 46.02 45.55 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 -1.71 1.61 10.64 -1.22 -4.84 117.38 121.86 1wi0 n GLN 97 Ca 0.00 0.00 -0.32 0.00 -1.83 0.00 0.00 57.00 54.85 1wi0 n GLN 97 Cb 0.00 -0.93 0.05 0.00 -0.86 0.00 0.00 30.24 28.50 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 5.14 3.32 0.36 2.61 1.43 -1.26 -4.44 118.68 125.84 1wi0 s LEU 98 Ca 0.50 1.90 -0.26 0.00 -1.03 0.00 0.00 54.13 55.24 1wi0 s LEU 98 Cb -0.41 -4.54 -0.09 0.00 0.03 0.00 0.00 46.19 41.18 1wi0 s LEU 98 CO 0.64 -1.59 1.05 -0.63 0.23 0.00 0.00 176.35 176.05 1wi0 s ILE 99 N -2.53 3.71 0.08 -0.59 -1.09 -1.26 -4.98 121.20 114.53 1wi0 s ILE 99 Ca 0.64 1.42 0.02 0.00 -2.23 0.00 0.00 60.65 60.50 1wi0 s ILE 99 Cb -0.18 -3.79 -0.04 0.00 -1.58 0.00 0.00 42.46 36.87 1wi0 s ILE 99 CO 0.44 0.12 0.14 -1.61 -1.23 0.00 0.00 174.94 172.80 1wi0 s GLU 100 N -2.17 3.13 0.38 2.79 0.41 -1.26 -5.09 118.70 116.89 1wi0 s GLU 100 Ca 0.53 -0.59 -0.25 0.00 -0.41 0.00 0.00 54.97 54.26 1wi0 s GLU 100 Cb -0.24 -2.86 -0.09 0.00 -1.78 0.00 0.00 34.13 29.15 1wi0 s GLU 100 CO 0.31 0.58 1.06 -1.25 -0.49 0.00 0.00 175.26 175.47 1wi0 s PRO 101 N -2.49 4.24 -0.95 0.39 0.04 -1.26 -4.88 135.00 130.09 1wi0 s PRO 101 Ca 0.32 1.56 -0.26 0.00 0.04 0.00 0.00 61.00 62.66 1wi0 s PRO 101 Cb -0.12 -2.65 -0.19 0.00 0.04 0.00 0.00 34.50 31.58 1wi0 s PRO 101 CO 0.25 -0.09 2.25 -1.17 0.04 0.00 0.00 177.00 178.28 1wi0 s LEU 102 N -2.44 2.58 -0.45 -3.56 2.96 0.37 -4.66 118.68 113.47 1wi0 s LEU 102 Ca 0.56 -0.51 -0.26 0.00 -0.22 0.00 0.00 54.13 53.69 1wi0 s LEU 102 Cb -0.24 -2.58 -0.06 0.00 0.50 0.00 0.00 46.19 43.81 1wi0 s LEU 102 CO 0.30 -4.38 2.36 -1.58 -1.32 0.00 0.00 176.35 171.73 1wi0 s GLN 103 N 8.66 2.28 0.24 1.98 0.74 -1.26 -1.80 119.66 130.49 1wi0 s GLN 103 Ca 0.86 1.48 0.11 0.00 0.05 0.00 0.00 55.36 57.86 1wi0 s GLN 103 Cb -0.09 -4.54 -0.05 0.00 1.10 0.00 0.00 33.01 29.44 1wi0 s GLN 103 CO 0.13 -3.07 -0.14 0.96 -0.55 0.00 0.00 175.29 172.62 1wi0 s ILE 104 N 11.48 2.83 -0.10 -2.34 -4.36 -0.40 -3.89 121.20 124.42 1wi0 s ILE 104 Ca 0.97 -2.05 0.02 0.00 -0.26 0.00 0.00 60.65 59.33 1wi0 s ILE 104 Cb -0.19 -2.45 0.01 0.00 1.25 0.00 0.00 42.46 41.08 1wi0 s ILE 104 CO 0.27 -0.27 -0.15 -0.36 0.24 0.00 0.00 174.94 174.67 1wi0 s PHE 105 N -2.11 1.89 -0.36 1.37 0.40 0.42 -1.01 117.98 118.57 1wi0 s PHE 105 Ca 0.27 -0.83 -0.29 0.00 -0.60 0.00 0.00 56.93 55.48 1wi0 s PHE 105 Cb -0.07 -1.35 0.00 0.00 0.51 0.00 0.00 43.02 42.11 1wi0 s PHE 105 CO 0.15 -0.42 1.38 -1.25 0.70 0.00 0.00 175.22 175.79 1wi0 s PRO 106 N 0.84 3.72 -0.85 0.24 0.04 -1.26 -1.66 135.00 136.08 1wi0 s PRO 106 Ca -0.10 1.10 -0.22 0.00 0.04 0.00 0.00 61.00 61.82 1wi0 s PRO 106 Cb -0.15 -3.97 0.07 0.00 0.04 0.00 0.00 34.50 30.49 1wi0 s PRO 106 CO 0.01 -1.38 1.20 1.03 0.04 0.00 0.00 177.00 177.90 1wi0 s ARG 107 N 4.63 3.39 0.17 4.56 0.52 -0.61 -5.00 118.95 126.61 1wi0 s ARG 107 Ca 0.60 -1.07 -0.30 0.00 -0.52 0.00 0.00 55.73 54.44 1wi0 s ARG 107 Cb -0.15 -4.72 -0.08 0.00 0.52 0.00 0.00 34.95 30.52 1wi0 s ARG 107 CO 0.29 -1.97 1.14 -1.54 0.02 0.00 0.00 175.30 173.24 1wi0 s SER 108 N 4.03 7.18 0.19 0.23 1.04 -1.26 -3.58 113.70 121.53 1wi0 s SER 108 Ca 0.34 2.13 -0.11 0.00 0.48 0.00 0.00 55.95 58.79 1wi0 s SER 108 Cb -0.07 -2.60 -0.00 0.00 0.10 0.00 0.00 66.02 63.44 1wi0 s SER 108 CO 0.00 -0.30 0.37 -0.83 0.98 0.00 0.00 173.24 173.46 1wi0 s GLY 109 N 0.08 0.40 -0.01 7.32 0.00 -1.16 -5.02 107.32 108.93 1wi0 s GLY 109 Ca 0.51 -0.77 -0.22 0.00 0.00 0.00 0.00 44.72 44.24 1wi0 s GLY 109 CO 0.35 -0.69 1.10 -0.56 0.00 0.00 0.00 173.10 173.30 1wi0 h PRO 110 N 2.42 0.30 -4.89 2.90 0.13 -1.96 -3.45 132.00 127.45 1wi0 h PRO 110 Ca -0.30 -0.30 0.01 0.00 -0.87 0.00 0.00 66.00 64.54 1wi0 h PRO 110 Cb 1.24 0.08 -0.13 0.00 0.13 0.00 0.00 31.00 32.32 1wi0 h PRO 110 CO 0.43 0.98 -1.53 0.43 -0.23 0.00 0.00 178.00 178.08 1wi0 n SER 111 N -4.39 -0.70 -0.06 1.44 7.64 -1.26 -4.99 113.62 111.30 1wi0 n SER 111 Ca -0.09 1.32 -0.04 0.00 1.01 0.00 0.00 58.87 61.06 1wi0 n SER 111 Cb 0.56 -5.10 -0.02 0.00 -1.01 0.00 0.00 64.21 58.64 1wi0 n SER 111 CO 0.00 0.00 0.00 -1.28 -3.01 0.00 0.00 175.04 170.75 1wi0 h SER 112 N 3.94 0.00 0.00 6.43 0.87 -2.08 -3.55 113.55 119.16 1wi0 h SER 112 Ca -0.53 -0.09 0.00 0.00 -1.23 0.00 0.00 61.79 59.93 1wi0 h SER 112 Cb 1.20 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1wi0 h SER 112 CO 0.01 0.69 0.00 0.61 -0.53 0.00 0.00 176.83 177.61