#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 -0.11 -0.68 1.61 1.04 -1.26 -5.09 113.70 109.21 1wi0 s SER 2 Ca 0.00 -0.77 -0.26 0.00 0.48 0.00 0.00 55.95 55.40 1wi0 s SER 2 Cb 0.00 0.54 -0.03 0.00 0.10 0.00 0.00 66.02 66.63 1wi0 s SER 2 CO 0.00 -1.05 1.91 -0.44 0.98 0.00 0.00 173.24 174.65 1wi0 s SER 3 N -2.96 5.18 0.00 7.02 0.01 -1.26 -4.89 113.70 116.80 1wi0 s SER 3 Ca 0.17 0.13 0.00 0.00 1.31 0.00 0.00 55.95 57.55 1wi0 s SER 3 Cb 0.00 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.70 1wi0 s SER 3 CO 0.03 -2.51 0.00 0.61 0.41 0.00 0.00 173.24 171.78 1wi0 n GLY 4 N 6.00 0.07 3.25 3.44 0.00 -1.26 -5.01 105.19 111.68 1wi0 n GLY 4 Ca 0.26 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.24 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 -1.47 -0.63 -0.30 1.61 1.04 -1.26 -5.11 113.70 107.58 1wi0 s SER 5 Ca 0.00 0.93 -0.00 0.00 0.48 0.00 0.00 55.95 57.36 1wi0 s SER 5 Cb 0.00 1.73 0.14 0.00 0.10 0.00 0.00 66.02 67.98 1wi0 s SER 5 CO 0.00 -0.25 0.29 -0.94 0.98 0.00 0.00 173.24 173.32 1wi0 s SER 6 N 2.73 1.73 0.86 7.02 1.04 -1.26 -5.15 113.70 120.67 1wi0 s SER 6 Ca 0.06 -0.87 -0.11 0.00 0.48 0.00 0.00 55.95 55.51 1wi0 s SER 6 Cb -0.14 0.46 0.11 0.00 0.10 0.00 0.00 66.02 66.56 1wi0 s SER 6 CO -0.17 -0.38 1.09 -0.83 0.98 0.00 0.00 173.24 173.94 1wi0 s GLY 7 N 2.25 1.65 -0.86 7.32 0.00 -1.26 -4.86 107.32 111.56 1wi0 s GLY 7 Ca 0.10 0.14 -0.07 0.00 0.00 0.00 0.00 44.72 44.90 1wi0 s GLY 7 CO -0.30 0.57 2.59 -1.55 0.00 0.00 0.00 173.10 174.41 1wi0 n PRO 8 N -3.81 2.40 -4.08 2.90 -0.04 -1.26 -4.79 135.00 126.32 1wi0 n PRO 8 Ca 0.08 -1.47 -0.32 0.00 -0.04 0.00 0.00 63.50 61.75 1wi0 n PRO 8 Cb 0.54 -2.38 -0.15 0.00 -0.04 0.00 0.00 33.50 31.46 1wi0 n PRO 8 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 1wi0 s PHE 9 N 2.46 3.13 -0.61 0.54 0.08 -1.26 -5.05 117.98 117.28 1wi0 s PHE 9 Ca 0.52 -2.12 -0.26 0.00 0.12 0.00 0.00 56.93 55.19 1wi0 s PHE 9 Cb 0.17 -1.93 -0.08 0.00 -0.57 0.00 0.00 43.02 40.60 1wi0 s PHE 9 CO -0.03 -0.86 2.31 0.00 -0.10 0.00 0.00 175.22 176.54 1wi0 s ALA 11 N 12.36 3.33 -0.22 0.00 0.00 -1.26 -4.95 121.76 131.01 1wi0 s ALA 11 Ca 0.90 -1.12 -0.11 0.00 0.00 0.00 0.00 51.96 51.63 1wi0 s ALA 11 Cb -0.15 0.41 0.02 0.00 0.00 0.00 0.00 23.12 23.40 1wi0 s ALA 11 CO 0.19 -0.19 0.23 -1.33 0.00 0.00 0.00 175.76 174.65 1wi0 n MET 12 N -1.02 -1.62 -3.66 0.00 2.81 -1.26 -4.92 117.12 107.44 1wi0 n MET 12 Ca -0.10 1.53 -0.07 0.00 -1.81 0.00 0.00 57.70 57.25 1wi0 n MET 12 Cb 0.66 -2.76 -0.08 0.00 -0.71 0.00 0.00 33.22 30.33 1wi0 n MET 12 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 1wi0 s GLU 13 N -1.67 0.45 0.00 0.03 8.01 -1.26 -4.82 118.70 119.43 1wi0 s GLU 13 Ca 0.12 1.09 0.00 0.00 0.01 0.00 0.00 54.97 56.19 1wi0 s GLU 13 Cb -0.02 0.33 0.00 0.00 -4.31 0.00 0.00 34.13 30.13 1wi0 s GLU 13 CO 0.47 -0.20 0.00 0.27 0.01 0.00 0.00 175.26 175.81 1wi0 n ASN 14 N 4.98 0.00 -4.72 -0.19 6.94 -1.26 -5.13 115.26 115.88 1wi0 n ASN 14 Ca -0.14 0.00 -0.31 0.00 -0.02 0.00 0.00 54.58 54.10 1wi0 n ASN 14 Cb 0.52 0.22 0.13 0.00 -2.36 0.00 0.00 39.78 38.28 1wi0 n ASN 14 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1wi0 s GLN 15 N -1.67 1.69 0.74 -3.83 -2.07 -1.26 -5.00 119.66 108.26 1wi0 s GLN 15 Ca 0.00 1.37 -0.11 0.00 -1.82 0.00 0.00 55.36 54.80 1wi0 s GLN 15 Cb 0.00 -1.82 0.04 0.00 -1.09 0.00 0.00 33.01 30.14 1wi0 s GLN 15 CO 0.00 -2.10 1.08 0.14 -1.32 0.00 0.00 175.29 173.09 1wi0 s VAL 16 N -2.74 3.54 -0.03 3.63 -7.23 -1.26 -4.97 120.40 111.34 1wi0 s VAL 16 Ca 0.64 0.50 -0.10 0.00 -1.81 0.00 0.00 61.98 61.21 1wi0 s VAL 16 Cb -0.20 -3.27 -0.05 0.00 0.56 0.00 0.00 36.38 33.41 1wi0 s VAL 16 CO 0.56 -0.65 0.29 -0.22 -0.31 0.00 0.00 175.10 174.77 1wi0 s LEU 17 N -5.63 4.42 -0.20 1.32 2.96 0.35 -4.97 118.68 116.93 1wi0 s LEU 17 Ca 0.59 0.71 0.01 0.00 -0.22 0.00 0.00 54.13 55.22 1wi0 s LEU 17 Cb -0.14 -2.45 0.04 0.00 0.50 0.00 0.00 46.19 44.15 1wi0 s LEU 17 CO 0.54 0.33 -0.10 -0.69 -1.32 0.00 0.00 176.35 175.12 1wi0 s VAL 18 N -1.12 1.62 -0.23 1.68 1.01 -1.26 0.28 120.40 122.38 1wi0 s VAL 18 Ca 0.22 -1.03 -0.14 0.00 0.00 0.00 0.00 61.98 61.04 1wi0 s VAL 18 Cb -0.14 -1.72 -0.04 0.00 0.00 0.00 0.00 36.38 34.48 1wi0 s VAL 18 CO 0.11 0.14 0.31 -0.63 0.00 0.00 0.00 175.10 175.02 1wi0 s ILE 19 N 1.40 5.25 -0.44 2.22 1.01 -1.12 -0.79 121.20 128.73 1wi0 s ILE 19 Ca -0.02 0.50 -0.12 0.00 0.00 0.00 0.00 60.65 61.01 1wi0 s ILE 19 Cb -0.17 -3.64 0.08 0.00 0.01 0.00 0.00 42.46 38.74 1wi0 s ILE 19 CO -0.08 0.26 0.32 -0.60 0.00 0.00 0.00 174.94 174.85 1wi0 s ARG 20 N 1.39 2.76 -0.32 2.79 3.52 0.75 0.30 118.95 130.14 1wi0 s ARG 20 Ca 0.14 -1.43 -0.27 0.00 -0.13 0.00 0.00 55.73 54.04 1wi0 s ARG 20 Cb -0.15 -3.94 0.01 0.00 -1.56 0.00 0.00 34.95 29.32 1wi0 s ARG 20 CO 0.07 -1.00 0.99 0.42 -0.81 0.00 0.00 175.30 174.97 1wi0 s ILE 21 N 1.51 4.59 -0.73 4.11 1.09 0.73 -0.95 121.20 131.56 1wi0 s ILE 21 Ca 0.03 1.55 -0.26 0.00 -1.10 0.00 0.00 60.65 60.88 1wi0 s ILE 21 Cb -0.24 -4.34 -0.03 0.00 -1.06 0.00 0.00 42.46 36.79 1wi0 s ILE 21 CO 0.04 -0.42 1.91 -0.75 -0.10 0.00 0.00 174.94 175.62 1wi0 s LYS 22 N 3.45 2.57 0.34 2.79 2.47 -0.21 -2.08 119.74 129.07 1wi0 s LYS 22 Ca 0.41 0.27 -0.28 0.00 -1.56 0.00 0.00 55.97 54.81 1wi0 s LYS 22 Cb -0.13 -4.66 -0.10 0.00 -1.46 0.00 0.00 37.83 31.48 1wi0 s LYS 22 CO 0.15 -3.02 1.24 0.42 0.16 0.00 0.00 175.35 174.29 1wi0 s ILE 23 N 9.61 2.94 -0.42 5.43 -1.09 -0.37 -4.62 121.20 132.70 1wi0 s ILE 23 Ca 0.69 0.91 -0.29 0.00 -2.23 0.00 0.00 60.65 59.73 1wi0 s ILE 23 Cb -0.10 -3.56 0.01 0.00 -1.58 0.00 0.00 42.46 37.23 1wi0 s ILE 23 CO 0.12 0.18 1.41 -2.16 -1.23 0.00 0.00 174.94 173.27 1wi0 s PRO 24 N -1.88 3.56 -1.28 2.79 0.04 -1.26 -3.47 135.00 133.50 1wi0 s PRO 24 Ca 0.51 0.92 -0.03 0.00 0.04 0.00 0.00 61.00 62.44 1wi0 s PRO 24 Cb -0.36 -4.03 -0.01 0.00 0.04 0.00 0.00 34.50 30.14 1wi0 s PRO 24 CO 0.47 -1.58 0.70 -1.71 0.04 0.00 0.00 177.00 174.92 1wi0 n ASN 25 N 8.86 -1.83 -2.67 6.66 2.85 -1.26 -4.88 115.26 122.99 1wi0 n ASN 25 Ca 0.16 -0.84 -0.04 0.00 -0.11 0.00 0.00 54.58 53.75 1wi0 n ASN 25 Cb 0.48 -4.00 0.02 0.00 1.24 0.00 0.00 39.78 37.53 1wi0 n ASN 25 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 1wi0 n SER 26 N -3.02 -1.31 0.00 1.20 7.64 -1.23 -5.13 113.62 111.77 1wi0 n SER 26 Ca -0.27 -1.86 0.00 0.00 1.01 0.00 0.00 58.87 57.75 1wi0 n SER 26 Cb 0.67 1.04 0.00 0.00 -1.01 0.00 0.00 64.21 64.91 1wi0 n SER 26 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wi0 n GLY 27 N -0.41 2.98 3.52 0.23 0.00 -1.26 -4.56 105.19 105.68 1wi0 n GLY 27 Ca -0.20 -0.07 -0.11 0.00 0.00 0.00 0.00 46.02 45.64 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 -1.48 -1.43 0.09 4.61 0.00 -1.26 -1.23 121.76 121.06 1wi0 s ALA 28 Ca 0.00 0.23 0.09 0.00 0.00 0.00 0.00 51.96 52.28 1wi0 s ALA 28 Cb 0.00 0.87 -0.03 0.00 0.00 0.00 0.00 23.12 23.95 1wi0 s ALA 28 CO 0.00 -0.82 -0.23 0.08 0.00 0.00 0.00 175.76 174.78 1wi0 s VAL 29 N -3.80 1.91 -0.21 0.00 1.01 -0.89 -4.91 120.40 113.52 1wi0 s VAL 29 Ca 0.04 -1.52 -0.05 0.00 0.00 0.00 0.00 61.98 60.45 1wi0 s VAL 29 Cb -0.02 -1.69 -0.02 0.00 0.00 0.00 0.00 36.38 34.64 1wi0 s VAL 29 CO -0.08 0.09 0.01 1.51 0.00 0.00 0.00 175.10 176.62 1wi0 s ASP 30 N -1.73 4.84 -0.52 3.32 -4.77 -1.26 -0.20 116.67 116.36 1wi0 s ASP 30 Ca 0.09 -0.21 -0.18 0.00 -3.30 0.00 0.00 52.55 48.95 1wi0 s ASP 30 Cb -0.10 -1.83 0.08 0.00 -1.09 0.00 0.00 42.92 39.98 1wi0 s ASP 30 CO 0.04 0.05 0.57 0.86 0.70 0.00 0.00 175.17 177.39 1wi0 s TRP 31 N 1.10 3.11 -0.50 2.11 -0.00 0.15 -4.90 118.94 120.01 1wi0 s TRP 31 Ca 0.03 -0.85 -0.26 0.00 -0.00 0.00 0.00 56.10 55.02 1wi0 s TRP 31 Cb -0.14 -3.60 -0.07 0.00 -0.00 0.00 0.00 33.47 29.65 1wi0 s TRP 31 CO 0.02 -1.04 2.43 -2.37 -0.00 0.00 0.00 176.95 175.98 1wi0 n THR 32 N 5.44 -0.08 -3.79 5.86 5.66 -1.26 -2.78 114.28 123.32 1wi0 n THR 32 Ca -0.10 -0.79 -0.36 0.00 -3.05 0.00 0.00 64.05 59.75 1wi0 n THR 32 Cb 0.43 -2.76 -0.12 0.00 -1.55 0.00 0.00 70.33 66.33 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 12.19 4.48 -0.28 1.08 1.01 0.14 -4.94 120.40 134.08 1wi0 s VAL 33 Ca 0.99 -0.12 0.22 0.00 0.00 0.00 0.00 61.98 63.07 1wi0 s VAL 33 Cb -0.20 -3.09 -0.26 0.00 0.00 0.00 0.00 36.38 32.84 1wi0 s VAL 33 CO 0.27 0.35 0.67 1.41 0.00 0.00 0.00 175.10 177.79 1wi0 n HIS 34 N 4.73 0.13 -2.03 5.22 8.25 -1.26 0.13 115.22 130.38 1wi0 n HIS 34 Ca -0.16 0.04 -0.35 0.00 -0.26 0.00 0.00 57.72 56.99 1wi0 n HIS 34 Cb 0.52 -0.45 0.03 0.00 1.12 0.00 0.00 29.99 31.20 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 -2.14 6.59 -0.36 0.41 7.64 -1.26 -4.74 113.62 119.76 1wi0 n SER 35 Ca -0.02 -3.79 0.02 0.00 1.01 0.00 0.00 58.87 56.09 1wi0 n SER 35 Cb 0.51 -0.84 0.08 0.00 -1.01 0.00 0.00 64.21 62.95 1wi0 n SER 35 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wi0 n GLY 36 N -0.57 -1.83 0.18 0.23 0.00 -1.26 -0.25 105.19 101.70 1wi0 n GLY 36 Ca 0.50 1.06 -0.18 0.00 0.00 0.00 0.00 46.02 47.40 1wi0 n GLY 36 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wi0 h PRO 37 N 0.00 0.62 -1.92 1.61 0.13 -1.97 -3.26 132.00 127.21 1wi0 h PRO 37 Ca 0.40 -0.60 -0.29 0.00 -0.87 0.00 0.00 66.00 64.63 1wi0 h PRO 37 Cb 0.64 0.15 -0.11 0.00 0.13 0.00 0.00 31.00 31.81 1wi0 h PRO 37 CO -0.98 1.21 0.07 0.94 -0.23 0.00 0.00 178.00 179.01 1wi0 n GLN 38 N -4.03 1.97 -4.89 0.86 7.27 0.66 -4.84 117.38 114.38 1wi0 n GLN 38 Ca -0.10 -1.42 -0.33 0.00 0.07 0.00 0.00 57.00 55.23 1wi0 n GLN 38 Cb 0.75 -1.85 -0.15 0.00 2.41 0.00 0.00 30.24 31.40 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 -1.05 2.49 0.10 1.69 2.96 -0.22 -4.80 118.68 119.85 1wi0 s LEU 39 Ca 0.49 -0.42 0.03 0.00 -0.22 0.00 0.00 54.13 54.01 1wi0 s LEU 39 Cb 0.28 -1.54 -0.04 0.00 0.50 0.00 0.00 46.19 45.40 1wi0 s LEU 39 CO -0.08 0.15 0.16 -0.76 -1.32 0.00 0.00 176.35 174.51 1wi0 s LEU 40 N 0.40 4.05 0.19 -0.68 1.43 -1.26 -4.93 118.68 117.88 1wi0 s LEU 40 Ca -0.13 0.07 -0.13 0.00 -1.03 0.00 0.00 54.13 52.91 1wi0 s LEU 40 Cb -0.17 -2.67 0.20 0.00 0.03 0.00 0.00 46.19 43.59 1wi0 s LEU 40 CO 0.06 0.13 1.68 0.15 0.23 0.00 0.00 176.35 178.60 1wi0 h PHE 41 N 2.85 -0.02 0.26 0.29 3.57 -1.90 -2.22 116.94 119.78 1wi0 h PHE 41 Ca -0.47 0.04 0.01 0.00 3.53 0.00 0.00 57.97 61.08 1wi0 h PHE 41 Cb 1.18 0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.96 1wi0 h PHE 41 CO 0.59 -0.11 -0.45 0.00 -2.23 0.00 0.00 178.31 176.11 1wi0 h ARG 42 N 0.13 -0.75 -0.84 1.11 -0.00 -1.97 -1.63 114.38 110.42 1wi0 h ARG 42 Ca 0.26 0.05 0.19 0.00 -0.50 0.00 0.00 59.98 59.98 1wi0 h ARG 42 Cb 0.39 0.17 -0.16 0.00 0.00 0.00 0.00 29.97 30.37 1wi0 h ARG 42 CO -0.42 -0.50 -0.12 -0.25 0.00 0.00 0.00 179.97 178.68 1wi0 n ASP 43 N -5.50 -0.22 0.09 7.04 8.00 -0.86 0.19 116.55 125.29 1wi0 n ASP 43 Ca -0.09 1.44 -0.12 0.00 0.71 0.00 0.00 54.79 56.73 1wi0 n ASP 43 Cb 0.40 -0.47 -0.05 0.00 -0.02 0.00 0.00 41.12 40.98 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 0.46 -0.59 2.53 2.07 -1.03 0.29 116.25 119.98 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 0.79 0.46 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 1wi0 h VAL 44 CO -0.84 0.00 0.39 -0.07 0.02 0.00 0.00 177.57 177.08 1wi0 h LEU 45 N -0.41 0.63 -1.46 2.57 -0.00 0.26 0.62 115.31 117.50 1wi0 h LEU 45 Ca 0.04 -0.01 -0.06 0.00 -0.00 0.00 0.00 57.88 57.85 1wi0 h LEU 45 Cb 0.46 -0.15 -0.01 0.00 -0.00 0.00 0.00 40.66 40.96 1wi0 h LEU 45 CO -0.17 0.44 -0.27 0.44 -0.00 0.00 0.00 178.44 178.88 1wi0 h ASP 46 N 0.73 0.00 0.00 -0.43 5.19 0.24 -0.76 116.42 121.39 1wi0 h ASP 46 Ca 0.23 0.00 -0.01 0.00 -0.62 0.00 0.00 57.03 56.63 1wi0 h ASP 46 Cb 0.03 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.54 1wi0 h ASP 46 CO -0.06 0.27 -0.17 0.58 -3.12 0.00 0.00 179.24 176.75 1wi0 h VAL 47 N 0.00 0.23 -1.05 -1.35 2.07 0.24 -3.34 116.25 113.04 1wi0 h VAL 47 Ca -0.00 -1.19 0.33 0.00 0.82 0.00 0.00 66.70 66.66 1wi0 h VAL 47 Cb 0.49 0.45 -0.14 0.00 -1.52 0.00 0.00 31.29 30.57 1wi0 h VAL 47 CO 0.04 0.08 0.62 0.40 0.02 0.00 0.00 177.57 178.73 1wi0 h ILE 48 N -1.00 0.30 -0.90 4.57 2.04 0.10 1.47 117.51 124.09 1wi0 h ILE 48 Ca -0.01 -0.10 0.24 0.00 1.00 0.00 0.00 64.86 65.98 1wi0 h ILE 48 Cb 0.27 -0.03 -0.05 0.00 -0.74 0.00 0.00 36.82 36.28 1wi0 h ILE 48 CO -0.01 0.05 0.62 1.23 0.00 0.00 0.00 178.15 180.05 1wi0 h GLY 49 N 0.30 0.43 1.93 5.37 0.00 -1.25 1.16 103.07 111.02 1wi0 h GLY 49 Ca 0.73 -0.09 -0.22 0.00 0.00 0.00 0.00 47.33 47.75 1wi0 h GLY 49 CO -0.54 -0.01 -1.04 1.46 0.00 0.00 0.00 176.54 176.40 1wi0 h GLN 50 N 0.18 0.04 0.02 4.80 4.20 0.19 -2.57 115.11 121.97 1wi0 h GLN 50 Ca 0.45 -0.06 -0.09 0.00 0.06 0.00 0.00 58.65 59.01 1wi0 h GLN 50 Cb 1.48 0.02 0.01 0.00 0.30 0.00 0.00 27.48 29.29 1wi0 h GLN 50 CO -0.09 1.02 -0.36 0.28 -0.67 0.00 0.00 178.83 179.01 1wi0 h VAL 51 N 0.01 1.55 -2.84 -0.54 2.07 0.41 -3.38 116.25 113.53 1wi0 h VAL 51 Ca -0.03 -2.09 -0.61 0.00 0.82 0.00 0.00 66.70 64.78 1wi0 h VAL 51 Cb 1.80 2.87 -0.42 0.00 -1.52 0.00 0.00 31.29 34.02 1wi0 h VAL 51 CO 0.14 0.58 -0.59 0.18 0.02 0.00 0.00 177.57 177.90 1wi0 n LEU 52 N -4.42 3.10 0.24 2.57 4.32 0.35 -4.87 117.00 118.28 1wi0 n LEU 52 Ca -0.10 -5.25 0.13 0.00 -0.02 0.00 0.00 56.01 50.77 1wi0 n LEU 52 Cb 0.57 -0.69 0.41 0.00 -1.62 0.00 0.00 43.42 42.09 1wi0 n LEU 52 CO 0.41 1.84 0.86 1.55 -1.22 0.00 0.00 177.39 180.83 1wi0 h PRO 53 N 5.08 0.00 -0.00 3.23 0.13 -1.65 -2.82 132.00 135.97 1wi0 h PRO 53 Ca 0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.29 1wi0 h PRO 53 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1wi0 h PRO 53 CO 0.74 0.06 -0.83 -1.91 -0.23 0.00 0.00 178.00 175.82 1wi0 n GLU 54 N -3.14 0.09 -3.47 0.86 4.07 -1.26 -4.57 120.64 113.22 1wi0 n GLU 54 Ca 0.02 -0.07 -0.27 0.00 -0.06 0.00 0.00 57.16 56.78 1wi0 n GLU 54 Cb 0.44 -1.50 -0.10 0.00 -0.06 0.00 0.00 31.44 30.22 1wi0 n GLU 54 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1wi0 n ALA 55 N -1.40 2.98 -0.83 4.31 0.00 -1.07 -5.12 120.51 119.39 1wi0 n ALA 55 Ca 0.05 -3.54 -0.35 0.00 0.00 0.00 0.00 53.44 49.60 1wi0 n ALA 55 Cb 0.34 -0.83 0.11 0.00 0.00 0.00 0.00 19.45 19.07 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 2.34 0.00 -3.65 0.00 -1.04 -1.22 -4.71 114.28 106.01 1wi0 n THR 56 Ca 0.27 -0.22 -0.09 0.00 -2.04 0.00 0.00 64.05 61.96 1wi0 n THR 56 Cb 0.46 -0.35 -0.08 0.00 -1.82 0.00 0.00 70.33 68.54 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 -2.16 -0.00 -0.21 12.58 2.01 -1.26 -4.41 115.64 122.19 1wi0 s THR 57 Ca 0.48 0.01 0.02 0.00 0.31 0.00 0.00 61.69 62.51 1wi0 s THR 57 Cb -0.08 -0.94 0.04 0.00 0.01 0.00 0.00 72.50 71.52 1wi0 s THR 57 CO 0.69 0.00 0.81 0.35 -0.69 0.00 0.00 174.62 175.78 1wi0 n THR 58 N 3.89 0.50 -3.52 -0.82 -2.24 -1.26 -4.82 114.28 106.01 1wi0 n THR 58 Ca -0.19 -0.75 -0.10 0.00 -2.27 0.00 0.00 64.05 60.75 1wi0 n THR 58 Cb 0.58 0.77 -0.03 0.00 -2.10 0.00 0.00 70.33 69.54 1wi0 n THR 58 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1wi0 s ALA 59 N -0.59 -1.85 0.15 6.98 0.00 -1.26 -4.79 121.76 120.41 1wi0 s ALA 59 Ca 0.03 1.18 -0.07 0.00 0.00 0.00 0.00 51.96 53.11 1wi0 s ALA 59 Cb 0.02 0.10 -0.02 0.00 0.00 0.00 0.00 23.12 23.22 1wi0 s ALA 59 CO 0.03 -0.57 0.21 -0.59 0.00 0.00 0.00 175.76 174.84 1wi0 s PHE 60 N -2.48 0.51 0.09 0.00 -0.71 -1.08 -0.89 117.98 113.42 1wi0 s PHE 60 Ca 0.02 -0.89 0.09 0.00 -1.04 0.00 0.00 56.93 55.12 1wi0 s PHE 60 Cb -0.01 -0.18 -0.04 0.00 -1.21 0.00 0.00 43.02 41.59 1wi0 s PHE 60 CO -0.05 -0.65 -0.23 -1.21 -1.34 0.00 0.00 175.22 171.74 1wi0 s GLU 61 N -3.98 1.74 -0.06 1.99 2.02 0.13 0.17 118.70 120.72 1wi0 s GLU 61 Ca 0.18 -1.17 0.00 0.00 0.02 0.00 0.00 54.97 54.01 1wi0 s GLU 61 Cb 0.05 -2.04 0.02 0.00 0.10 0.00 0.00 34.13 32.26 1wi0 s GLU 61 CO -0.00 0.49 -0.04 1.52 0.02 0.00 0.00 175.26 177.25 1wi0 s TYR 62 N -0.98 0.83 0.26 1.61 -0.85 -0.96 0.43 117.35 117.68 1wi0 s TYR 62 Ca 0.14 -0.26 -0.31 0.00 -0.52 0.00 0.00 57.07 56.13 1wi0 s TYR 62 Cb -0.10 -0.77 -0.13 0.00 0.38 0.00 0.00 41.96 41.34 1wi0 s TYR 62 CO 0.06 -0.26 1.48 0.39 -1.52 0.00 0.00 175.55 175.70 1wi0 n GLU 63 N 4.42 2.30 -0.33 -3.49 1.02 -1.22 -0.99 120.64 122.35 1wi0 n GLU 63 Ca -0.19 0.82 0.00 0.00 -0.02 0.00 0.00 57.16 57.77 1wi0 n GLU 63 Cb 0.51 -2.52 0.00 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 2.13 0.79 0.00 1.62 5.75 -1.26 -4.86 116.55 120.71 1wi0 n ASP 64 Ca 0.10 -0.24 -0.10 0.00 -0.01 0.00 0.00 54.79 54.55 1wi0 n ASP 64 Cb 0.34 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.40 1wi0 n ASP 64 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 1wi0 h GLU 65 N 0.00 -0.28 -0.88 0.11 4.81 -1.99 0.14 114.58 116.50 1wi0 h GLU 65 Ca 0.00 0.02 -0.13 0.00 -0.13 0.00 0.00 59.36 59.12 1wi0 h GLU 65 Cb 0.00 0.06 -0.07 0.00 0.63 0.00 0.00 28.75 29.37 1wi0 h GLU 65 CO 0.00 -0.19 0.16 -0.25 -0.73 0.00 0.00 179.01 178.00 1wi0 n ASP 66 N -5.36 3.50 -3.86 1.04 9.92 -1.26 -4.86 116.55 115.67 1wi0 n ASP 66 Ca -0.03 -2.67 -0.32 0.00 -0.53 0.00 0.00 54.79 51.25 1wi0 n ASP 66 Cb 0.28 -0.64 -0.06 0.00 -0.64 0.00 0.00 41.12 40.06 1wi0 n ASP 66 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1wi0 n GLY 67 N 0.01 -0.35 0.00 0.44 0.00 0.50 -4.68 105.19 101.11 1wi0 n GLY 67 Ca 0.23 0.05 0.14 0.00 0.00 0.00 0.00 46.02 46.44 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 -1.89 0.00 -2.78 1.61 2.03 -1.26 -4.69 116.55 109.57 1wi0 n ASP 68 Ca 0.09 -0.82 -0.04 0.00 0.52 0.00 0.00 54.79 54.54 1wi0 n ASP 68 Cb 0.39 -0.02 -0.03 0.00 -0.72 0.00 0.00 41.12 40.74 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 -1.02 -3.41 -1.93 -0.67 5.12 -1.26 -4.94 116.66 108.57 1wi0 n ARG 69 Ca 0.20 2.67 -0.30 0.00 -1.93 0.00 0.00 57.85 58.50 1wi0 n ARG 69 Cb 0.10 -3.69 0.18 0.00 -1.16 0.00 0.00 32.46 27.90 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 -0.55 2.00 -0.04 0.55 -1.09 -0.16 -4.77 121.20 117.14 1wi0 s ILE 70 Ca -0.18 0.00 0.04 0.00 -2.23 0.00 0.00 60.65 58.28 1wi0 s ILE 70 Cb 0.01 -3.00 -0.00 0.00 -1.58 0.00 0.00 42.46 37.89 1wi0 s ILE 70 CO 0.53 0.00 -0.15 -0.89 -1.23 0.00 0.00 174.94 173.20 1wi0 s THR 71 N -3.87 1.24 -0.32 2.92 2.01 -1.26 -2.26 115.64 114.10 1wi0 s THR 71 Ca 0.73 -0.62 0.02 0.00 0.31 0.00 0.00 61.69 62.14 1wi0 s THR 71 Cb -0.04 -1.07 0.09 0.00 0.01 0.00 0.00 72.50 71.48 1wi0 s THR 71 CO 0.53 0.36 0.02 -0.69 -0.69 0.00 0.00 174.62 174.15 1wi0 s VAL 72 N 0.04 2.43 -0.23 3.82 1.01 0.13 -4.82 120.40 122.78 1wi0 s VAL 72 Ca -0.03 -2.02 0.09 0.00 0.00 0.00 0.00 61.98 60.02 1wi0 s VAL 72 Cb -0.10 -2.64 -0.12 0.00 0.00 0.00 0.00 36.38 33.52 1wi0 s VAL 72 CO 0.01 -0.40 0.30 0.54 0.00 0.00 0.00 175.10 175.55 1wi0 n ARG 73 N 4.38 2.25 -4.14 2.72 1.74 -1.26 -2.63 116.66 119.72 1wi0 n ARG 73 Ca -0.03 -0.04 -0.11 0.00 -0.77 0.00 0.00 57.85 56.89 1wi0 n ARG 73 Cb 0.42 -1.06 -0.09 0.00 -1.02 0.00 0.00 32.46 30.71 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 -2.43 0.09 0.34 0.55 0.01 -1.26 -4.96 113.70 106.03 1wi0 s SER 74 Ca 0.00 -1.26 0.06 0.00 1.31 0.00 0.00 55.95 56.06 1wi0 s SER 74 Cb 0.06 0.44 0.71 0.00 0.21 0.00 0.00 66.02 67.44 1wi0 s SER 74 CO 0.38 -0.93 1.90 -2.24 0.41 0.00 0.00 173.24 172.76 1wi0 h ASP 75 N 2.51 0.74 -0.12 2.44 2.03 -1.97 -2.48 116.42 119.56 1wi0 h ASP 75 Ca -0.33 0.02 0.02 0.00 -0.73 0.00 0.00 57.03 56.01 1wi0 h ASP 75 Cb 1.25 -0.13 -0.04 0.00 -0.83 0.00 0.00 39.33 39.58 1wi0 h ASP 75 CO 0.48 0.43 -0.27 -0.08 -1.03 0.00 0.00 179.24 178.77 1wi0 h GLU 76 N 0.81 -0.24 -0.80 4.15 4.57 -2.00 -0.00 114.58 121.07 1wi0 h GLU 76 Ca 0.40 0.02 0.16 0.00 -1.18 0.00 0.00 59.36 58.76 1wi0 h GLU 76 Cb 0.46 0.05 -0.10 0.00 -0.16 0.00 0.00 28.75 29.00 1wi0 h GLU 76 CO -0.17 -0.16 0.34 0.93 -1.18 0.00 0.00 179.01 178.77 1wi0 h GLU 77 N -0.25 0.44 -0.02 1.92 3.07 -1.79 -2.42 114.58 115.54 1wi0 h GLU 77 Ca 0.02 -0.03 0.01 0.00 -0.50 0.00 0.00 59.36 58.86 1wi0 h GLU 77 Cb 0.32 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.11 1wi0 h GLU 77 CO -0.25 0.29 -0.12 1.98 -1.40 0.00 0.00 179.01 179.51 1wi0 h MET 78 N 0.45 -0.14 -1.52 2.33 4.05 -0.70 0.37 114.93 119.78 1wi0 h MET 78 Ca 0.46 0.01 0.45 0.00 -0.28 0.00 0.00 59.70 60.33 1wi0 h MET 78 Cb 0.73 0.03 -0.08 0.00 -0.80 0.00 0.00 31.60 31.48 1wi0 h MET 78 CO -0.43 -0.09 1.07 0.87 0.23 0.00 0.00 176.91 178.55 1wi0 h LYS 79 N -0.14 0.04 0.31 0.39 1.57 -0.64 0.69 116.57 118.79 1wi0 h LYS 79 Ca 0.01 -0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.77 1wi0 h LYS 79 Cb 0.16 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1wi0 h LYS 79 CO -0.09 0.03 -0.15 0.00 -0.57 0.00 0.00 179.45 178.67 1wi0 h ALA 80 N 1.31 -0.42 -0.94 3.86 0.00 -0.25 0.32 119.26 123.14 1wi0 h ALA 80 Ca 0.77 -0.19 0.19 0.00 0.00 0.00 0.00 54.91 55.68 1wi0 h ALA 80 Cb 2.88 0.16 -0.11 0.00 0.00 0.00 0.00 17.79 20.73 1wi0 h ALA 80 CO -0.12 -0.50 0.52 1.98 0.00 0.00 0.00 179.25 181.13 1wi0 h MET 81 N -0.89 0.63 -0.00 0.00 1.85 0.41 0.46 114.93 117.39 1wi0 h MET 81 Ca -0.04 -0.04 -0.18 0.00 -0.61 0.00 0.00 59.70 58.83 1wi0 h MET 81 Cb 0.52 -0.14 -0.02 0.00 0.43 0.00 0.00 31.60 32.39 1wi0 h MET 81 CO 0.07 0.42 -0.81 -0.07 -0.40 0.00 0.00 176.91 176.12 1wi0 h LEU 82 N 0.65 0.11 -1.35 3.39 3.38 -0.98 -1.31 115.31 119.20 1wi0 h LEU 82 Ca 0.55 -0.08 -0.06 0.00 0.09 0.00 0.00 57.88 58.38 1wi0 h LEU 82 Cb 0.88 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.58 1wi0 h LEU 82 CO -0.41 0.87 -0.16 0.28 0.09 0.00 0.00 178.44 179.11 1wi0 h SER 83 N 0.05 0.23 0.00 -0.43 0.02 0.38 -2.43 113.55 111.37 1wi0 h SER 83 Ca -0.02 -0.05 -0.07 0.00 -0.84 0.00 0.00 61.79 60.81 1wi0 h SER 83 Cb 1.41 -0.06 -0.01 0.00 0.14 0.00 0.00 62.40 63.88 1wi0 h SER 83 CO 0.11 0.41 -0.36 0.22 -1.14 0.00 0.00 176.83 176.07 1wi0 h TYR 84 N 0.22 0.00 -0.83 3.45 3.20 -0.64 -2.68 116.97 119.69 1wi0 h TYR 84 Ca 0.04 0.00 0.20 0.00 3.14 0.00 0.00 58.73 62.12 1wi0 h TYR 84 Cb 0.42 0.00 -0.14 0.00 1.54 0.00 0.00 36.73 38.55 1wi0 h TYR 84 CO 0.01 1.09 0.06 -0.92 -1.64 0.00 0.00 178.16 176.76 1wi0 h TYR 85 N -1.00 0.05 -0.12 -3.82 3.20 -1.19 0.88 116.97 114.96 1wi0 h TYR 85 Ca -0.10 0.06 -0.11 0.00 3.14 0.00 0.00 58.73 61.71 1wi0 h TYR 85 Cb 1.04 0.11 0.00 0.00 1.54 0.00 0.00 36.73 39.43 1wi0 h TYR 85 CO 0.21 -0.26 -0.37 1.88 -1.64 0.00 0.00 178.16 177.98 1wi0 h TYR 86 N 0.12 0.61 -0.04 -3.82 0.05 -1.58 1.73 116.97 114.04 1wi0 h TYR 86 Ca 0.48 -0.24 0.01 0.00 0.05 0.00 0.00 58.73 59.03 1wi0 h TYR 86 Cb 0.90 -0.10 -0.00 0.00 1.01 0.00 0.00 36.73 38.54 1wi0 h TYR 86 CO -0.40 0.98 0.03 1.03 -1.05 0.00 0.00 178.16 178.76 1wi0 h SER 87 N 0.06 0.00 0.04 3.88 0.87 -0.53 0.97 113.55 118.83 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 0.99 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 62.90 1wi0 h SER 87 CO 0.08 0.00 -2.23 1.07 -0.53 0.00 0.00 176.83 175.22 1wi0 n THR 88 N -4.22 1.59 -0.08 2.23 5.66 0.28 -3.98 114.28 115.76 1wi0 n THR 88 Ca -0.02 -0.51 -0.06 0.00 -3.05 0.00 0.00 64.05 60.41 1wi0 n THR 88 Cb 0.13 -1.66 -0.00 0.00 -1.55 0.00 0.00 70.33 67.25 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 0.66 -0.07 1.08 2.07 0.29 0.34 116.25 120.37 1wi0 h VAL 89 Ca -0.53 0.00 0.02 0.00 0.82 0.00 0.00 66.70 67.01 1wi0 h VAL 89 Cb 1.83 0.66 -0.00 0.00 -1.52 0.00 0.00 31.29 32.25 1wi0 h VAL 89 CO -0.11 0.00 0.09 0.00 0.02 0.00 0.00 177.57 177.57 1wi0 h MET 90 N -0.02 0.00 0.07 1.57 -0.00 -1.01 0.49 114.93 116.03 1wi0 h MET 90 Ca 0.15 0.00 -0.25 0.00 -0.00 0.00 0.00 59.70 59.61 1wi0 h MET 90 Cb 0.25 0.00 -0.01 0.00 -0.00 0.00 0.00 31.60 31.84 1wi0 h MET 90 CO -0.33 0.00 -1.16 0.93 -0.00 0.00 0.00 176.91 176.35 1wi0 h GLU 91 N 0.00 0.14 0.00 -0.10 4.39 -0.57 -2.92 114.58 115.52 1wi0 h GLU 91 Ca 0.03 -0.24 0.00 0.00 0.34 0.00 0.00 59.36 59.50 1wi0 h GLU 91 Cb 0.21 0.09 0.00 0.00 -0.10 0.00 0.00 28.75 28.95 1wi0 h GLU 91 CO -0.00 1.09 0.00 1.96 -1.16 0.00 0.00 179.01 180.90 1wi0 h GLN 92 N 0.04 0.00 0.07 2.33 4.20 0.14 -2.00 115.11 119.88 1wi0 h GLN 92 Ca -0.09 0.00 -0.25 0.00 0.06 0.00 0.00 58.65 58.37 1wi0 h GLN 92 Cb 1.88 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.65 1wi0 h GLN 92 CO 0.16 0.00 -1.33 1.96 -0.67 0.00 0.00 178.83 178.95 1wi0 h GLN 93 N 0.00 0.15 -0.11 1.46 4.20 -1.40 -2.72 115.11 116.67 1wi0 h GLN 93 Ca 0.00 -0.25 -0.02 0.00 0.06 0.00 0.00 58.65 58.44 1wi0 h GLN 93 Cb 0.43 0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.29 1wi0 h GLN 93 CO 0.00 1.12 -0.03 -0.39 -0.67 0.00 0.00 178.83 178.86 1wi0 h VAL 94 N -0.54 1.10 0.10 -0.54 -1.51 -1.37 -3.14 116.25 110.35 1wi0 h VAL 94 Ca -0.31 -0.39 -0.01 0.00 -1.23 0.00 0.00 66.70 64.77 1wi0 h VAL 94 Cb 1.59 1.04 0.00 0.00 -2.13 0.00 0.00 31.29 31.79 1wi0 h VAL 94 CO -0.03 0.12 -0.05 0.78 -1.23 0.00 0.00 177.57 177.16 1wi0 h ASN 95 N 0.16 -0.12 0.00 4.19 2.35 -1.49 -3.50 115.58 117.18 1wi0 h ASN 95 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 1wi0 h ASN 95 Cb 0.16 0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.56 1wi0 h ASN 95 CO 0.01 0.03 0.00 0.61 -1.65 0.00 0.00 177.43 176.43 1wi0 n GLY 96 N 0.99 1.45 3.23 2.83 0.00 -1.03 -5.11 105.19 107.55 1wi0 n GLY 96 Ca -0.02 -0.07 -0.39 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 0.02 -1.95 1.61 10.64 -1.19 -4.83 117.38 121.68 1wi0 n GLN 97 Ca 0.00 0.01 -0.33 0.00 -1.83 0.00 0.00 57.00 54.85 1wi0 n GLN 97 Cb 0.00 -1.04 0.02 0.00 -0.86 0.00 0.00 30.24 28.37 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 5.19 3.45 0.39 2.61 1.43 -1.26 -4.35 118.68 126.14 1wi0 s LEU 98 Ca 0.55 1.86 -0.25 0.00 -1.03 0.00 0.00 54.13 55.26 1wi0 s LEU 98 Cb -0.45 -4.54 -0.09 0.00 0.03 0.00 0.00 46.19 41.14 1wi0 s LEU 98 CO 0.68 -1.31 1.13 -0.63 0.23 0.00 0.00 176.35 176.45 1wi0 s ILE 99 N -2.44 3.35 0.07 -0.59 -1.09 -1.26 -4.98 121.20 114.26 1wi0 s ILE 99 Ca 0.64 1.12 0.03 0.00 -2.23 0.00 0.00 60.65 60.22 1wi0 s ILE 99 Cb -0.17 -3.62 -0.04 0.00 -1.58 0.00 0.00 42.46 37.04 1wi0 s ILE 99 CO 0.39 0.09 0.05 -1.61 -1.23 0.00 0.00 174.94 172.63 1wi0 s GLU 100 N -2.27 2.80 0.21 2.79 0.41 -1.26 -5.09 118.70 116.29 1wi0 s GLU 100 Ca 0.56 -0.71 -0.30 0.00 -0.41 0.00 0.00 54.97 54.11 1wi0 s GLU 100 Cb -0.28 -2.68 -0.08 0.00 -1.78 0.00 0.00 34.13 29.30 1wi0 s GLU 100 CO 0.36 0.57 1.10 -1.25 -0.49 0.00 0.00 175.26 175.55 1wi0 s PRO 101 N -2.28 4.61 -0.85 0.39 0.04 -1.26 -4.86 135.00 130.79 1wi0 s PRO 101 Ca 0.27 1.75 -0.21 0.00 0.04 0.00 0.00 61.00 62.86 1wi0 s PRO 101 Cb -0.12 -3.25 -0.21 0.00 0.04 0.00 0.00 34.50 30.96 1wi0 s PRO 101 CO 0.20 0.12 2.37 -0.11 0.04 0.00 0.00 177.00 179.62 1wi0 n LEU 102 N 1.98 0.48 -4.56 -3.56 7.94 0.03 -4.53 117.00 114.79 1wi0 n LEU 102 Ca 0.01 -0.73 -0.34 0.00 -1.11 0.00 0.00 56.01 53.85 1wi0 n LEU 102 Cb 0.46 -1.13 -0.04 0.00 0.53 0.00 0.00 43.42 43.24 1wi0 n LEU 102 CO 0.54 -1.73 1.44 -1.58 -1.11 0.00 0.00 177.39 174.95 1wi0 s GLN 103 N 8.17 2.77 0.28 1.96 0.74 -1.26 -0.18 119.66 132.14 1wi0 s GLN 103 Ca 1.15 -0.06 0.08 0.00 0.05 0.00 0.00 55.36 56.58 1wi0 s GLN 103 Cb -0.58 -4.76 -0.04 0.00 1.10 0.00 0.00 33.01 28.74 1wi0 s GLN 103 CO 0.35 -2.87 0.19 0.96 -0.55 0.00 0.00 175.29 173.37 1wi0 s ILE 104 N 8.63 4.04 -0.09 -2.34 -4.36 -0.12 -3.45 121.20 123.50 1wi0 s ILE 104 Ca 0.62 -1.48 0.00 0.00 -0.26 0.00 0.00 60.65 59.54 1wi0 s ILE 104 Cb -0.08 -3.26 0.02 0.00 1.25 0.00 0.00 42.46 40.39 1wi0 s ILE 104 CO 0.08 -0.31 -0.08 -0.36 0.24 0.00 0.00 174.94 174.51 1wi0 s PHE 105 N -2.21 1.32 -0.44 1.37 0.08 0.17 -1.04 117.98 117.21 1wi0 s PHE 105 Ca 0.35 -0.57 -0.29 0.00 0.12 0.00 0.00 56.93 56.54 1wi0 s PHE 105 Cb -0.07 -1.08 0.01 0.00 -0.57 0.00 0.00 43.02 41.31 1wi0 s PHE 105 CO 0.24 -0.39 1.43 -1.25 -0.10 0.00 0.00 175.22 175.15 1wi0 s PRO 106 N 1.35 3.50 -0.86 0.24 0.04 -1.26 -0.69 135.00 137.31 1wi0 s PRO 106 Ca -0.02 0.85 -0.25 0.00 0.04 0.00 0.00 61.00 61.62 1wi0 s PRO 106 Cb -0.14 -4.05 -0.02 0.00 0.04 0.00 0.00 34.50 30.33 1wi0 s PRO 106 CO -0.04 -1.66 1.77 1.03 0.04 0.00 0.00 177.00 178.14 1wi0 s ARG 107 N 5.10 2.84 0.00 4.56 0.52 -0.06 -4.76 118.95 127.14 1wi0 s ARG 107 Ca 0.60 -0.31 0.00 0.00 -0.52 0.00 0.00 55.73 55.50 1wi0 s ARG 107 Cb -0.13 -4.94 0.00 0.00 0.52 0.00 0.00 34.95 30.40 1wi0 s ARG 107 CO 0.31 -2.92 0.00 -1.13 0.02 0.00 0.00 175.30 171.58 1wi0 n SER 108 N 12.31 0.00 0.00 0.23 3.41 -1.26 -4.32 113.62 123.98 1wi0 n SER 108 Ca 0.32 0.02 0.00 0.00 -0.26 0.00 0.00 58.87 58.95 1wi0 n SER 108 Cb 0.49 -0.09 0.00 0.00 -0.26 0.00 0.00 64.21 64.35 1wi0 n SER 108 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wi0 n GLY 109 N 2.34 0.98 0.09 5.00 0.00 -1.26 -3.83 105.19 108.50 1wi0 n GLY 109 Ca 0.00 -0.68 -0.15 0.00 0.00 0.00 0.00 46.02 45.20 1wi0 n GLY 109 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1wi0 h PRO 110 N 0.00 0.15 -6.30 1.61 0.13 -2.01 -3.46 132.00 122.13 1wi0 h PRO 110 Ca 0.00 -0.15 -0.59 0.00 -0.87 0.00 0.00 66.00 64.39 1wi0 h PRO 110 Cb 0.00 0.04 0.17 0.00 0.13 0.00 0.00 31.00 31.34 1wi0 h PRO 110 CO 0.00 0.86 -0.70 0.45 -0.23 0.00 0.00 178.00 178.38 1wi0 n SER 111 N -4.56 -2.12 0.05 1.44 2.88 -1.25 -4.81 113.62 105.26 1wi0 n SER 111 Ca -0.09 0.70 0.00 0.00 -1.33 0.00 0.00 58.87 58.15 1wi0 n SER 111 Cb 0.46 -1.04 0.00 0.00 -0.75 0.00 0.00 64.21 62.88 1wi0 n SER 111 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1wi0 n SER 112 N 1.32 -0.88 0.00 -3.46 3.41 -1.26 -4.91 113.62 107.84 1wi0 n SER 112 Ca 0.10 0.29 0.00 0.00 -0.26 0.00 0.00 58.87 59.00 1wi0 n SER 112 Cb 0.47 1.06 0.00 0.00 -0.26 0.00 0.00 64.21 65.48 1wi0 n SER 112 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49