#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 -0.98 -0.10 1.61 1.04 -1.26 -5.17 113.70 108.85 1wi0 s SER 2 Ca 0.00 1.50 -0.30 0.00 0.48 0.00 0.00 55.95 57.63 1wi0 s SER 2 Cb 0.00 1.67 0.10 0.00 0.10 0.00 0.00 66.02 67.89 1wi0 s SER 2 CO 0.00 -0.23 0.83 -0.44 0.98 0.00 0.00 173.24 174.38 1wi0 s SER 3 N 2.07 -0.51 0.00 7.02 0.01 -1.26 -5.16 113.70 115.87 1wi0 s SER 3 Ca -0.08 0.54 0.00 0.00 1.31 0.00 0.00 55.95 57.71 1wi0 s SER 3 Cb -0.08 0.43 0.00 0.00 0.21 0.00 0.00 66.02 66.58 1wi0 s SER 3 CO -0.19 -0.49 0.00 0.61 0.41 0.00 0.00 173.24 173.58 1wi0 n GLY 4 N 0.77 3.98 2.04 3.44 0.00 -1.26 -5.12 105.19 109.03 1wi0 n GLY 4 Ca -0.15 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.13 1wi0 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1wi0 n SER 5 N 0.00 -0.75 -4.69 1.61 3.41 -1.26 -5.08 113.62 106.87 1wi0 n SER 5 Ca 0.00 0.38 -0.42 0.00 -0.26 0.00 0.00 58.87 58.57 1wi0 n SER 5 Cb 0.00 0.86 -0.03 0.00 -0.26 0.00 0.00 64.21 64.78 1wi0 n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 1wi0 s SER 6 N -4.29 6.97 0.00 4.04 1.04 -1.26 -4.83 113.70 115.37 1wi0 s SER 6 Ca 0.00 1.93 0.00 0.00 0.48 0.00 0.00 55.95 58.36 1wi0 s SER 6 Cb 0.00 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.56 1wi0 s SER 6 CO 0.00 -0.64 0.00 0.61 0.98 0.00 0.00 173.24 174.19 1wi0 n GLY 7 N 3.47 -1.22 3.77 7.32 0.00 -1.26 -5.15 105.19 112.12 1wi0 n GLY 7 Ca 0.12 0.61 -0.39 0.00 0.00 0.00 0.00 46.02 46.36 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 0.00 4.44 -0.21 1.61 0.04 -1.26 -5.04 135.00 134.58 1wi0 s PRO 8 Ca 0.00 1.66 -0.04 0.00 0.04 0.00 0.00 61.00 62.66 1wi0 s PRO 8 Cb 0.00 -2.91 -0.02 0.00 0.04 0.00 0.00 34.50 31.62 1wi0 s PRO 8 CO 0.00 0.07 -0.03 -0.06 0.04 0.00 0.00 177.00 177.02 1wi0 s PHE 9 N -1.38 2.98 -0.30 0.56 0.08 -1.26 -5.04 117.98 113.62 1wi0 s PHE 9 Ca 0.50 -0.71 -0.13 0.00 0.12 0.00 0.00 56.93 56.71 1wi0 s PHE 9 Cb -0.27 -2.08 0.18 0.00 -0.57 0.00 0.00 43.02 40.28 1wi0 s PHE 9 CO 0.35 -0.40 1.04 0.00 -0.10 0.00 0.00 175.22 176.11 1wi0 s ALA 11 N 2.95 -1.56 0.27 0.00 0.00 -1.26 -5.07 121.76 117.09 1wi0 s ALA 11 Ca 0.02 1.82 0.00 0.00 0.00 0.00 0.00 51.96 53.80 1wi0 s ALA 11 Cb -0.10 -1.06 0.00 0.00 0.00 0.00 0.00 23.12 21.96 1wi0 s ALA 11 CO -0.12 -0.30 0.00 -1.33 0.00 0.00 0.00 175.76 174.01 1wi0 n MET 12 N 2.96 0.00 -2.98 0.00 2.81 -1.26 -5.12 117.12 113.54 1wi0 n MET 12 Ca -0.15 0.00 -0.30 0.00 -1.81 0.00 0.00 57.70 55.44 1wi0 n MET 12 Cb 0.56 0.00 -0.03 0.00 -0.71 0.00 0.00 33.22 33.04 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 -1.81 3.76 1.26 0.03 2.02 -1.26 -5.06 118.70 117.64 1wi0 s GLU 13 Ca 0.00 0.37 -0.16 0.00 0.02 0.00 0.00 54.97 55.20 1wi0 s GLU 13 Cb 0.00 -2.45 0.32 0.00 0.10 0.00 0.00 34.13 32.10 1wi0 s GLU 13 CO 0.00 0.03 0.99 1.21 0.02 0.00 0.00 175.26 177.51 1wi0 s ASN 14 N -3.12 0.18 -0.13 -0.19 2.47 -1.26 -5.06 114.94 107.83 1wi0 s ASN 14 Ca 0.50 1.29 -0.30 0.00 0.42 0.00 0.00 52.86 54.77 1wi0 s ASN 14 Cb -0.10 -1.97 0.10 0.00 -1.45 0.00 0.00 41.25 37.83 1wi0 s ASN 14 CO 0.30 -4.66 0.87 0.00 -3.72 0.00 0.00 177.10 169.89 1wi0 s GLN 15 N -4.63 0.77 0.70 0.43 -2.07 -1.26 -5.14 119.66 108.45 1wi0 s GLN 15 Ca 0.69 0.25 0.00 0.00 -1.82 0.00 0.00 55.36 54.48 1wi0 s GLN 15 Cb -0.22 0.36 0.00 0.00 -1.09 0.00 0.00 33.01 32.07 1wi0 s GLN 15 CO 0.63 -0.23 0.00 1.33 -1.32 0.00 0.00 175.29 175.70 1wi0 n VAL 16 N 0.98 0.00 -4.38 3.63 0.24 -1.26 -4.77 118.33 112.76 1wi0 n VAL 16 Ca -0.14 0.00 -0.30 0.00 -2.04 0.00 0.00 64.34 61.86 1wi0 n VAL 16 Cb 0.57 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.83 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 2.78 -0.13 1.34 2.96 -0.81 -5.03 118.68 119.78 1wi0 s LEU 17 Ca 0.00 -0.47 -0.01 0.00 -0.22 0.00 0.00 54.13 53.43 1wi0 s LEU 17 Cb 0.00 -1.62 0.04 0.00 0.50 0.00 0.00 46.19 45.11 1wi0 s LEU 17 CO 0.00 0.20 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.52 1wi0 s VAL 18 N -1.10 0.76 -0.29 1.68 1.01 -1.26 -0.76 120.40 120.43 1wi0 s VAL 18 Ca 0.18 -0.31 -0.12 0.00 0.00 0.00 0.00 61.98 61.73 1wi0 s VAL 18 Cb -0.11 -0.96 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 1wi0 s VAL 18 CO 0.10 0.16 0.22 -0.63 0.00 0.00 0.00 175.10 174.95 1wi0 s ILE 19 N 1.79 5.29 -0.60 2.22 1.01 -0.93 -0.71 121.20 129.27 1wi0 s ILE 19 Ca 0.03 0.11 -0.16 0.00 0.00 0.00 0.00 60.65 60.62 1wi0 s ILE 19 Cb -0.14 -3.59 0.14 0.00 0.01 0.00 0.00 42.46 38.88 1wi0 s ILE 19 CO -0.07 0.18 0.59 -0.60 0.00 0.00 0.00 174.94 175.04 1wi0 s ARG 20 N 1.78 3.11 -0.15 2.79 3.52 -0.67 0.15 118.95 129.48 1wi0 s ARG 20 Ca 0.08 -1.77 -0.29 0.00 -0.13 0.00 0.00 55.73 53.61 1wi0 s ARG 20 Cb -0.16 -4.33 -0.03 0.00 -1.56 0.00 0.00 34.95 28.87 1wi0 s ARG 20 CO 0.11 -1.37 1.41 0.42 -0.81 0.00 0.00 175.30 175.05 1wi0 s ILE 21 N 1.58 4.03 -0.81 4.11 1.09 0.21 -1.81 121.20 129.60 1wi0 s ILE 21 Ca 0.08 1.23 -0.26 0.00 -1.10 0.00 0.00 60.65 60.59 1wi0 s ILE 21 Cb -0.25 -3.84 0.03 0.00 -1.06 0.00 0.00 42.46 37.34 1wi0 s ILE 21 CO 0.01 -0.16 1.40 -0.75 -0.10 0.00 0.00 174.94 175.35 1wi0 s LYS 22 N 3.81 3.22 0.43 2.79 2.47 -1.03 -1.92 119.74 129.50 1wi0 s LYS 22 Ca 0.61 -0.39 -0.26 0.00 -1.56 0.00 0.00 55.97 54.37 1wi0 s LYS 22 Cb -0.25 -4.54 -0.09 0.00 -1.46 0.00 0.00 37.83 31.50 1wi0 s LYS 22 CO 0.21 -2.27 1.37 0.42 0.16 0.00 0.00 175.35 175.24 1wi0 s ILE 23 N 6.01 2.33 -0.36 5.43 -1.09 -0.88 -4.40 121.20 128.24 1wi0 s ILE 23 Ca 0.42 0.30 -0.29 0.00 -2.23 0.00 0.00 60.65 58.85 1wi0 s ILE 23 Cb -0.06 -3.18 0.00 0.00 -1.58 0.00 0.00 42.46 37.65 1wi0 s ILE 23 CO 0.08 0.04 1.38 -2.16 -1.23 0.00 0.00 174.94 173.06 1wi0 s PRO 24 N -2.34 3.71 -0.74 2.79 0.04 -1.26 -3.89 135.00 133.31 1wi0 s PRO 24 Ca 0.59 1.09 -0.03 0.00 0.04 0.00 0.00 61.00 62.68 1wi0 s PRO 24 Cb -0.41 -3.97 0.00 0.00 0.04 0.00 0.00 34.50 30.16 1wi0 s PRO 24 CO 0.53 -1.39 0.65 0.09 0.04 0.00 0.00 177.00 176.92 1wi0 n ASN 25 N 8.36 -6.54 0.00 6.66 3.02 -1.26 -4.87 115.26 120.64 1wi0 n ASN 25 Ca 0.16 -0.39 0.00 0.00 -0.03 0.00 0.00 54.58 54.32 1wi0 n ASN 25 Cb 0.47 -3.70 0.00 0.00 -0.61 0.00 0.00 39.78 35.94 1wi0 n ASN 25 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1wi0 n SER 26 N -1.92 0.00 0.00 6.41 7.64 -1.25 -5.16 113.62 119.33 1wi0 n SER 26 Ca -0.12 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.76 1wi0 n SER 26 Cb 0.58 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.78 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 0.00 4.22 3.54 0.23 0.00 -1.26 -5.03 105.19 106.89 1wi0 n GLY 27 Ca 0.00 -0.47 0.01 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.79 -2.64 0.03 4.61 0.00 -1.26 -2.07 121.76 118.64 1wi0 s ALA 28 Ca 0.00 2.04 -0.01 0.00 0.00 0.00 0.00 51.96 53.99 1wi0 s ALA 28 Cb 0.00 -1.95 -0.04 0.00 0.00 0.00 0.00 23.12 21.13 1wi0 s ALA 28 CO 0.00 -0.53 0.16 0.08 0.00 0.00 0.00 175.76 175.46 1wi0 s VAL 29 N 1.53 5.16 -0.26 0.00 1.01 -0.81 -4.86 120.40 122.17 1wi0 s VAL 29 Ca -0.06 -0.36 -0.07 0.00 0.00 0.00 0.00 61.98 61.48 1wi0 s VAL 29 Cb -0.03 -3.45 -0.02 0.00 0.00 0.00 0.00 36.38 32.88 1wi0 s VAL 29 CO -0.14 0.25 0.08 1.51 0.00 0.00 0.00 175.10 176.80 1wi0 s ASP 30 N -2.14 5.16 -0.53 3.32 -4.77 -1.25 0.68 116.67 117.14 1wi0 s ASP 30 Ca 0.29 -0.33 -0.22 0.00 -3.30 0.00 0.00 52.55 48.99 1wi0 s ASP 30 Cb -0.13 -1.92 0.05 0.00 -1.09 0.00 0.00 42.92 39.83 1wi0 s ASP 30 CO 0.21 -0.08 0.81 0.86 0.70 0.00 0.00 175.17 177.67 1wi0 s TRP 31 N 1.59 2.90 -0.53 2.11 -0.00 0.39 -4.87 118.94 120.53 1wi0 s TRP 31 Ca 0.06 -0.21 -0.26 0.00 -0.00 0.00 0.00 56.10 55.68 1wi0 s TRP 31 Cb -0.16 -3.84 -0.05 0.00 -0.00 0.00 0.00 33.47 29.43 1wi0 s TRP 31 CO 0.04 -1.21 2.16 -0.08 -0.00 0.00 0.00 176.95 177.86 1wi0 s THR 32 N 3.39 3.16 0.05 5.86 -1.32 -1.26 -2.20 115.64 123.32 1wi0 s THR 32 Ca 0.24 0.10 -0.01 0.00 -1.21 0.00 0.00 61.69 60.81 1wi0 s THR 32 Cb -0.15 -3.42 -0.04 0.00 -1.51 0.00 0.00 72.50 67.38 1wi0 s THR 32 CO 0.16 -0.40 0.21 -0.69 -2.21 0.00 0.00 174.62 171.69 1wi0 s VAL 33 N 10.73 5.40 0.00 5.08 1.01 0.06 -5.00 120.40 137.67 1wi0 s VAL 33 Ca 0.84 -0.34 0.00 0.00 0.00 0.00 0.00 61.98 62.49 1wi0 s VAL 33 Cb -0.16 -3.61 0.00 0.00 0.00 0.00 0.00 36.38 32.61 1wi0 s VAL 33 CO 0.24 0.18 0.00 1.41 0.00 0.00 0.00 175.10 176.93 1wi0 n HIS 34 N 0.42 0.00 -1.13 5.22 8.25 -1.26 -1.93 115.22 124.79 1wi0 n HIS 34 Ca -0.06 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.21 1wi0 n HIS 34 Cb 0.51 0.01 -0.04 0.00 1.12 0.00 0.00 29.99 31.59 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 -2.49 6.17 -0.36 0.41 7.64 -1.26 -4.68 113.62 119.05 1wi0 n SER 35 Ca 0.00 -2.97 0.02 0.00 1.01 0.00 0.00 58.87 56.93 1wi0 n SER 35 Cb 0.44 -1.20 0.08 0.00 -1.01 0.00 0.00 64.21 62.52 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 1.03 -1.82 0.15 0.23 0.00 -1.26 0.68 105.19 104.21 1wi0 n GLY 36 Ca 0.38 1.05 -0.10 0.00 0.00 0.00 0.00 46.02 47.34 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 0.33 -1.23 1.61 0.13 -2.00 -3.17 132.00 127.68 1wi0 h PRO 37 Ca 0.39 -0.33 -0.49 0.00 -0.87 0.00 0.00 66.00 64.70 1wi0 h PRO 37 Cb 0.63 0.08 -0.22 0.00 0.13 0.00 0.00 31.00 31.63 1wi0 h PRO 37 CO -0.97 1.00 0.63 0.94 -0.23 0.00 0.00 178.00 179.38 1wi0 n GLN 38 N -3.75 2.21 -4.16 0.86 7.27 0.21 -4.92 117.38 115.10 1wi0 n GLN 38 Ca -0.05 -2.41 -0.33 0.00 0.07 0.00 0.00 57.00 54.29 1wi0 n GLN 38 Cb 0.78 -1.94 -0.08 0.00 2.41 0.00 0.00 30.24 31.41 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 -2.78 3.75 0.33 1.69 2.96 0.20 -4.82 118.68 120.00 1wi0 s LEU 39 Ca 0.47 0.08 0.10 0.00 -0.22 0.00 0.00 54.13 54.56 1wi0 s LEU 39 Cb 0.37 -2.18 -0.05 0.00 0.50 0.00 0.00 46.19 44.83 1wi0 s LEU 39 CO 0.00 0.27 -0.04 -0.76 -1.32 0.00 0.00 176.35 174.51 1wi0 s LEU 40 N -1.70 2.91 0.06 -0.68 1.43 -1.26 -4.91 118.68 114.52 1wi0 s LEU 40 Ca 0.22 -1.00 -0.27 0.00 -1.03 0.00 0.00 54.13 52.04 1wi0 s LEU 40 Cb -0.12 -1.29 -0.17 0.00 0.03 0.00 0.00 46.19 44.64 1wi0 s LEU 40 CO 0.13 -0.17 1.56 0.15 0.23 0.00 0.00 176.35 178.25 1wi0 h PHE 41 N 1.91 -0.37 -0.53 0.29 3.57 -1.91 -3.02 116.94 116.89 1wi0 h PHE 41 Ca -0.42 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.17 1wi0 h PHE 41 Cb 1.25 0.12 -0.10 0.00 2.79 0.00 0.00 35.95 40.01 1wi0 h PHE 41 CO 0.73 -0.16 -0.18 0.00 -2.23 0.00 0.00 178.31 176.47 1wi0 h ARG 42 N -0.50 -0.05 -0.90 1.11 2.47 -1.98 0.39 114.38 114.92 1wi0 h ARG 42 Ca -0.04 0.00 0.17 0.00 -1.26 0.00 0.00 59.98 58.85 1wi0 h ARG 42 Cb 0.38 0.01 -0.16 0.00 -1.65 0.00 0.00 29.97 28.54 1wi0 h ARG 42 CO 0.07 -0.04 -0.27 -0.44 0.56 0.00 0.00 179.97 179.85 1wi0 h ASP 43 N -0.06 -1.01 -0.32 7.04 5.19 -1.94 1.69 116.42 127.01 1wi0 h ASP 43 Ca 0.25 0.28 0.06 0.00 -0.62 0.00 0.00 57.03 57.00 1wi0 h ASP 43 Cb 0.44 0.61 -0.05 0.00 0.18 0.00 0.00 39.33 40.51 1wi0 h ASP 43 CO -0.57 -0.30 -0.02 0.58 -3.12 0.00 0.00 179.24 175.81 1wi0 h VAL 44 N -0.02 0.74 -0.14 -1.35 2.07 -0.86 0.46 116.25 117.16 1wi0 h VAL 44 Ca 0.40 -0.03 -0.04 0.00 0.82 0.00 0.00 66.70 67.85 1wi0 h VAL 44 Cb 0.64 0.66 -0.01 0.00 -1.52 0.00 0.00 31.29 31.06 1wi0 h VAL 44 CO -0.92 0.01 -0.12 -0.07 0.02 0.00 0.00 177.57 176.49 1wi0 h LEU 45 N 0.07 0.20 -1.04 2.57 -0.00 0.12 0.64 115.31 117.88 1wi0 h LEU 45 Ca 0.16 -0.04 -0.08 0.00 -0.00 0.00 0.00 57.88 57.92 1wi0 h LEU 45 Cb 0.22 -0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 40.81 1wi0 h LEU 45 CO -0.28 0.35 -0.37 0.44 -0.00 0.00 0.00 178.44 178.58 1wi0 h ASP 46 N 0.21 0.00 0.00 -0.43 3.32 0.46 -1.99 116.42 117.99 1wi0 h ASP 46 Ca 0.04 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 1wi0 h ASP 46 Cb 0.34 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.89 1wi0 h ASP 46 CO 0.02 0.37 -0.36 0.58 -1.72 0.00 0.00 179.24 178.13 1wi0 h VAL 47 N 0.00 0.15 -0.98 -1.35 2.07 0.14 -3.36 116.25 112.93 1wi0 h VAL 47 Ca -0.00 -1.15 0.31 0.00 0.82 0.00 0.00 66.70 66.68 1wi0 h VAL 47 Cb 0.84 0.33 -0.15 0.00 -1.52 0.00 0.00 31.29 30.78 1wi0 h VAL 47 CO 0.05 0.05 0.47 0.40 0.02 0.00 0.00 177.57 178.56 1wi0 h ILE 48 N -1.00 0.25 -1.10 4.57 2.04 0.14 1.52 117.51 123.94 1wi0 h ILE 48 Ca -0.03 -0.08 0.31 0.00 1.00 0.00 0.00 64.86 66.06 1wi0 h ILE 48 Cb 0.41 -0.02 -0.06 0.00 -0.74 0.00 0.00 36.82 36.42 1wi0 h ILE 48 CO -0.02 0.05 0.77 1.23 0.00 0.00 0.00 178.15 180.18 1wi0 h GLY 49 N 0.25 0.28 1.94 5.37 0.00 -1.50 1.36 103.07 110.76 1wi0 h GLY 49 Ca 0.71 -0.05 -0.22 0.00 0.00 0.00 0.00 47.33 47.77 1wi0 h GLY 49 CO -0.65 -0.03 -1.04 1.46 0.00 0.00 0.00 176.54 176.27 1wi0 h GLN 50 N 0.09 0.05 0.10 4.80 4.20 0.20 -2.64 115.11 121.91 1wi0 h GLN 50 Ca 0.55 -0.08 -0.19 0.00 0.06 0.00 0.00 58.65 58.99 1wi0 h GLN 50 Cb 1.99 0.03 0.02 0.00 0.30 0.00 0.00 27.48 29.82 1wi0 h GLN 50 CO -0.07 1.04 -0.80 0.28 -0.67 0.00 0.00 178.83 178.60 1wi0 h VAL 51 N 0.01 1.47 -2.86 -0.54 2.07 0.13 -3.38 116.25 113.14 1wi0 h VAL 51 Ca -0.03 -2.40 -0.61 0.00 0.82 0.00 0.00 66.70 64.47 1wi0 h VAL 51 Cb 1.81 2.99 -0.42 0.00 -1.52 0.00 0.00 31.29 34.14 1wi0 h VAL 51 CO 0.14 0.69 -0.59 0.18 0.02 0.00 0.00 177.57 178.01 1wi0 n LEU 52 N -4.12 3.05 0.25 2.57 4.32 0.38 -4.87 117.00 118.58 1wi0 n LEU 52 Ca -0.13 -5.23 0.14 0.00 -0.02 0.00 0.00 56.01 50.77 1wi0 n LEU 52 Cb 0.80 -0.68 0.43 0.00 -1.62 0.00 0.00 43.42 42.34 1wi0 n LEU 52 CO 0.49 1.83 0.89 1.55 -1.22 0.00 0.00 177.39 180.93 1wi0 h PRO 53 N 5.12 0.00 -0.00 3.23 0.13 -1.67 -2.85 132.00 135.96 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 0.73 0.02 -0.96 -1.91 -0.23 0.00 0.00 178.00 175.66 1wi0 n GLU 54 N -3.11 0.05 -3.53 0.86 4.07 -1.26 -4.67 120.64 113.04 1wi0 n GLU 54 Ca 0.02 -0.04 -0.29 0.00 -0.06 0.00 0.00 57.16 56.80 1wi0 n GLU 54 Cb 0.42 -1.50 -0.12 0.00 -0.06 0.00 0.00 31.44 30.19 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 -2.98 1.54 1.03 4.31 0.00 -1.08 -5.13 121.76 119.45 1wi0 s ALA 55 Ca 0.09 -2.33 -0.13 0.00 0.00 0.00 0.00 51.96 49.59 1wi0 s ALA 55 Cb 0.16 -1.71 0.20 0.00 0.00 0.00 0.00 23.12 21.78 1wi0 s ALA 55 CO 0.85 -2.06 0.46 -2.37 0.00 0.00 0.00 175.76 172.64 1wi0 n THR 56 N 3.46 0.00 -3.64 0.00 5.66 -1.23 -4.63 114.28 113.90 1wi0 n THR 56 Ca 0.16 0.00 -0.03 0.00 -3.05 0.00 0.00 64.05 61.14 1wi0 n THR 56 Cb 0.39 -0.52 -0.07 0.00 -1.55 0.00 0.00 70.33 68.59 1wi0 n THR 56 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 175.07 171.13 1wi0 s THR 57 N -1.92 0.00 -0.07 1.09 2.01 -1.26 -4.00 115.64 111.49 1wi0 s THR 57 Ca 0.35 0.00 0.10 0.00 0.31 0.00 0.00 61.69 62.45 1wi0 s THR 57 Cb -0.06 -1.00 0.15 0.00 0.01 0.00 0.00 72.50 71.60 1wi0 s THR 57 CO 0.30 0.00 1.06 0.35 -0.69 0.00 0.00 174.62 175.63 1wi0 n THR 58 N 3.33 1.37 -3.63 -0.82 -2.24 -1.26 -4.81 114.28 106.22 1wi0 n THR 58 Ca -0.17 -1.57 -0.03 0.00 -2.27 0.00 0.00 64.05 60.01 1wi0 n THR 58 Cb 0.57 0.13 -0.02 0.00 -2.10 0.00 0.00 70.33 68.90 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 -1.90 -2.15 0.19 6.98 0.00 -1.26 -4.80 121.76 118.81 1wi0 s ALA 59 Ca 0.17 1.82 -0.14 0.00 0.00 0.00 0.00 51.96 53.81 1wi0 s ALA 59 Cb 0.15 -0.44 0.01 0.00 0.00 0.00 0.00 23.12 22.84 1wi0 s ALA 59 CO 0.02 -0.52 0.44 -0.59 0.00 0.00 0.00 175.76 175.10 1wi0 s PHE 60 N -2.03 0.11 0.25 0.00 -0.71 -1.02 -2.23 117.98 112.33 1wi0 s PHE 60 Ca 0.11 -0.46 0.10 0.00 -1.04 0.00 0.00 56.93 55.63 1wi0 s PHE 60 Cb -0.01 0.23 -0.04 0.00 -1.21 0.00 0.00 43.02 41.98 1wi0 s PHE 60 CO -0.04 -0.87 -0.05 -1.21 -1.34 0.00 0.00 175.22 171.72 1wi0 s GLU 61 N -3.92 2.16 -0.15 1.99 2.02 -0.83 0.11 118.70 120.08 1wi0 s GLU 61 Ca 0.13 -1.42 -0.08 0.00 0.02 0.00 0.00 54.97 53.62 1wi0 s GLU 61 Cb 0.00 -2.11 0.06 0.00 0.10 0.00 0.00 34.13 32.18 1wi0 s GLU 61 CO -0.00 0.38 0.37 1.52 0.02 0.00 0.00 175.26 177.55 1wi0 s TYR 62 N -2.19 -0.54 0.14 1.61 -0.85 -0.94 -1.31 117.35 113.27 1wi0 s TYR 62 Ca 0.30 1.17 -0.31 0.00 -0.52 0.00 0.00 57.07 57.70 1wi0 s TYR 62 Cb -0.07 0.21 -0.10 0.00 0.38 0.00 0.00 41.96 42.38 1wi0 s TYR 62 CO 0.18 -0.32 1.66 -1.21 -1.52 0.00 0.00 175.55 174.34 1wi0 s GLU 63 N 1.39 4.18 0.00 -3.49 2.02 -1.22 -0.60 118.70 120.98 1wi0 s GLU 63 Ca -0.09 2.43 0.00 0.00 0.02 0.00 0.00 54.97 57.33 1wi0 s GLU 63 Cb -0.09 -3.31 0.00 0.00 0.10 0.00 0.00 34.13 30.83 1wi0 s GLU 63 CO -0.12 -0.70 0.00 -3.47 0.02 0.00 0.00 175.26 170.99 1wi0 n ASP 64 N 4.60 0.00 -0.08 -0.19 2.03 -1.26 -4.86 116.55 116.79 1wi0 n ASP 64 Ca 0.15 0.00 -0.15 0.00 0.52 0.00 0.00 54.79 55.31 1wi0 n ASP 64 Cb 0.38 0.00 -0.04 0.00 -0.72 0.00 0.00 41.12 40.74 1wi0 n ASP 64 CO 0.00 0.00 0.00 1.05 -1.92 0.00 0.00 177.20 176.33 1wi0 h GLU 65 N 0.00 0.87 -0.65 -0.67 4.11 -1.99 -2.76 114.58 113.49 1wi0 h GLU 65 Ca 0.00 -0.55 0.00 0.00 0.07 0.00 0.00 59.36 58.88 1wi0 h GLU 65 Cb 0.00 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.31 1wi0 h GLU 65 CO 0.00 1.18 0.00 -0.25 0.07 0.00 0.00 179.01 180.01 1wi0 n ASP 66 N -4.03 3.70 -4.05 3.06 9.92 -1.26 -4.92 116.55 118.96 1wi0 n ASP 66 Ca -0.04 -2.43 -0.37 0.00 -0.53 0.00 0.00 54.79 51.42 1wi0 n ASP 66 Cb 0.62 -0.54 -0.01 0.00 -0.64 0.00 0.00 41.12 40.55 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 0.68 -0.53 1.00 0.44 0.00 -1.04 -4.80 105.19 100.94 1wi0 n GLY 67 Ca 0.18 0.24 0.10 0.00 0.00 0.00 0.00 46.02 46.55 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 -1.93 3.18 -2.75 1.61 2.03 -1.26 -4.84 116.55 112.59 1wi0 n ASP 68 Ca -0.15 -1.93 -0.04 0.00 0.52 0.00 0.00 54.79 53.19 1wi0 n ASP 68 Cb 0.52 -0.19 -0.03 0.00 -0.72 0.00 0.00 41.12 40.69 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 1.28 -3.62 -2.05 -0.67 5.12 -1.26 -4.96 116.66 110.50 1wi0 n ARG 69 Ca 0.16 2.81 -0.28 0.00 -1.93 0.00 0.00 57.85 58.61 1wi0 n ARG 69 Cb 0.55 -3.92 0.18 0.00 -1.16 0.00 0.00 32.46 28.11 1wi0 n ARG 69 CO 0.00 0.00 0.00 -0.89 -1.93 0.00 0.00 177.63 174.81 1wi0 n ILE 70 N 1.86 0.00 -3.76 0.55 2.08 0.23 -4.76 119.36 115.56 1wi0 n ILE 70 Ca -0.29 -1.12 -0.23 0.00 0.56 0.00 0.00 62.75 61.68 1wi0 n ILE 70 Cb 0.45 -1.36 -0.18 0.00 -0.75 0.00 0.00 39.64 37.80 1wi0 n ILE 70 CO 0.00 0.00 0.00 -0.89 0.56 0.00 0.00 176.55 176.22 1wi0 s THR 71 N -3.70 0.32 -0.45 1.39 2.01 -1.26 -2.22 115.64 111.72 1wi0 s THR 71 Ca 0.73 0.15 -0.16 0.00 0.31 0.00 0.00 61.69 62.73 1wi0 s THR 71 Cb -0.02 -0.49 0.05 0.00 0.01 0.00 0.00 72.50 72.04 1wi0 s THR 71 CO 0.51 0.24 0.38 -0.69 -0.69 0.00 0.00 174.62 174.37 1wi0 s VAL 72 N 2.00 5.21 -0.08 3.82 1.01 0.31 -4.84 120.40 127.83 1wi0 s VAL 72 Ca 0.05 -0.83 0.08 0.00 0.00 0.00 0.00 61.98 61.28 1wi0 s VAL 72 Cb -0.12 -4.06 -0.11 0.00 0.00 0.00 0.00 36.38 32.09 1wi0 s VAL 72 CO -0.05 -0.48 0.05 0.54 0.00 0.00 0.00 175.10 175.16 1wi0 n ARG 73 N 5.27 2.30 -4.37 2.72 1.74 -1.26 -2.45 116.66 120.61 1wi0 n ARG 73 Ca -0.11 -0.01 -0.19 0.00 -0.77 0.00 0.00 57.85 56.76 1wi0 n ARG 73 Cb 0.45 -1.23 -0.10 0.00 -1.02 0.00 0.00 32.46 30.56 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 -3.98 1.71 0.53 0.55 0.01 -1.26 -4.92 113.70 106.32 1wi0 s SER 74 Ca -0.04 -1.43 0.20 0.00 1.31 0.00 0.00 55.95 55.98 1wi0 s SER 74 Cb 0.03 0.16 1.33 0.00 0.21 0.00 0.00 66.02 67.75 1wi0 s SER 74 CO 0.37 -0.74 2.10 0.44 0.41 0.00 0.00 173.24 175.82 1wi0 h ASP 75 N 2.23 0.00 0.10 2.44 3.32 -1.98 -1.89 116.42 120.64 1wi0 h ASP 75 Ca -0.38 0.00 0.02 0.00 0.02 0.00 0.00 57.03 56.69 1wi0 h ASP 75 Cb 1.25 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.76 1wi0 h ASP 75 CO 0.62 0.00 -0.27 -0.33 -1.72 0.00 0.00 179.24 177.54 1wi0 h GLU 76 N 0.00 -0.45 -0.66 3.56 3.07 -2.00 -0.47 114.58 117.63 1wi0 h GLU 76 Ca 0.09 0.03 -0.04 0.00 -0.50 0.00 0.00 59.36 58.94 1wi0 h GLU 76 Cb 0.35 0.10 -0.03 0.00 -0.84 0.00 0.00 28.75 28.33 1wi0 h GLU 76 CO -0.00 -0.30 0.25 0.93 -1.40 0.00 0.00 179.01 178.49 1wi0 h GLU 77 N -0.47 0.97 0.03 2.33 5.08 -1.70 -2.73 114.58 118.10 1wi0 h GLU 77 Ca 0.04 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.23 1wi0 h GLU 77 Cb 0.50 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.59 1wi0 h GLU 77 CO -0.17 0.80 -0.04 1.98 -1.00 0.00 0.00 179.01 180.58 1wi0 h MET 78 N 0.95 -0.07 -1.00 2.33 4.05 -0.75 0.35 114.93 120.80 1wi0 h MET 78 Ca 0.22 0.00 0.35 0.00 -0.28 0.00 0.00 59.70 60.00 1wi0 h MET 78 Cb 0.20 0.02 -0.16 0.00 -0.80 0.00 0.00 31.60 30.85 1wi0 h MET 78 CO -0.02 -0.05 0.53 0.87 0.23 0.00 0.00 176.91 178.47 1wi0 h LYS 79 N -0.08 0.19 0.73 0.39 1.57 -1.13 0.50 116.57 118.74 1wi0 h LYS 79 Ca -0.00 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.73 1wi0 h LYS 79 Cb 0.07 -0.04 0.01 0.00 0.08 0.00 0.00 32.23 32.34 1wi0 h LYS 79 CO -0.01 0.12 -0.35 0.00 -0.57 0.00 0.00 179.45 178.65 1wi0 h ALA 80 N 1.91 -0.98 -0.91 3.86 0.00 -1.06 1.25 119.26 123.32 1wi0 h ALA 80 Ca 0.77 -0.22 0.22 0.00 0.00 0.00 0.00 54.91 55.68 1wi0 h ALA 80 Cb 1.85 0.38 -0.12 0.00 0.00 0.00 0.00 17.79 19.89 1wi0 h ALA 80 CO -0.68 -1.03 0.43 1.98 0.00 0.00 0.00 179.25 179.95 1wi0 h MET 81 N -1.02 0.43 -0.08 0.00 1.85 0.40 0.20 114.93 116.71 1wi0 h MET 81 Ca -0.10 -0.03 -0.13 0.00 -0.61 0.00 0.00 59.70 58.84 1wi0 h MET 81 Cb 0.76 -0.10 0.01 0.00 0.43 0.00 0.00 31.60 32.70 1wi0 h MET 81 CO 0.16 0.28 -0.44 -0.07 -0.40 0.00 0.00 176.91 176.45 1wi0 h LEU 82 N 0.44 0.52 -2.00 3.39 3.38 -0.69 -1.18 115.31 119.17 1wi0 h LEU 82 Ca 0.57 -0.66 0.21 0.00 0.09 0.00 0.00 57.88 58.09 1wi0 h LEU 82 Cb 1.06 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 41.63 1wi0 h LEU 82 CO -0.51 1.10 0.52 -1.28 0.09 0.00 0.00 178.44 178.36 1wi0 h SER 83 N -0.01 0.00 0.00 -0.43 0.87 0.41 -1.41 113.55 112.98 1wi0 h SER 83 Ca -0.03 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 1wi0 h SER 83 Cb 1.10 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.06 1wi0 h SER 83 CO 0.09 0.00 -0.15 0.22 -0.53 0.00 0.00 176.83 176.47 1wi0 h TYR 84 N 0.00 0.00 -0.84 2.24 3.20 -0.62 -2.60 116.97 118.35 1wi0 h TYR 84 Ca 0.34 0.00 0.21 0.00 3.14 0.00 0.00 58.73 62.42 1wi0 h TYR 84 Cb 1.37 0.00 -0.16 0.00 1.54 0.00 0.00 36.73 39.49 1wi0 h TYR 84 CO 0.00 0.00 -0.06 0.98 -1.64 0.00 0.00 178.16 177.44 1wi0 n TYR 85 N -4.08 0.46 -0.04 -3.82 9.36 -0.46 0.14 117.16 118.72 1wi0 n TYR 85 Ca -0.02 1.02 -0.16 0.00 3.32 0.00 0.00 57.90 62.06 1wi0 n TYR 85 Cb 0.08 -1.08 -0.07 0.00 -0.63 0.00 0.00 39.34 37.63 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 0.78 -0.04 2.98 0.05 -1.43 1.63 116.97 120.94 1wi0 h TYR 86 Ca 0.47 -0.32 0.01 0.00 0.05 0.00 0.00 58.73 58.95 1wi0 h TYR 86 Cb 0.90 -0.13 -0.00 0.00 1.01 0.00 0.00 36.73 38.51 1wi0 h TYR 86 CO -0.50 1.09 0.03 1.03 -1.05 0.00 0.00 178.16 178.76 1wi0 h SER 87 N 0.24 0.00 0.03 3.88 0.87 0.16 0.35 113.55 119.09 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 1.11 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.02 1wi0 h SER 87 CO 0.10 0.00 -2.22 1.07 -0.53 0.00 0.00 176.83 175.26 1wi0 n THR 88 N -4.35 1.58 -0.06 2.23 5.66 0.28 -4.00 114.28 115.62 1wi0 n THR 88 Ca -0.02 -0.49 -0.08 0.00 -3.05 0.00 0.00 64.05 60.41 1wi0 n THR 88 Cb 0.13 -1.67 -0.01 0.00 -1.55 0.00 0.00 70.33 67.22 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 -0.30 0.45 -0.43 1.08 2.07 0.27 0.32 116.25 119.71 1wi0 h VAL 89 Ca -0.54 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.11 1wi0 h VAL 89 Cb 1.81 0.45 -0.02 0.00 -1.52 0.00 0.00 31.29 32.01 1wi0 h VAL 89 CO -0.13 0.00 0.31 0.00 0.02 0.00 0.00 177.57 177.78 1wi0 h MET 90 N -0.19 0.00 -0.00 1.57 -0.00 -1.13 0.27 114.93 115.44 1wi0 h MET 90 Ca 0.15 0.00 -0.17 0.00 -0.00 0.00 0.00 59.70 59.68 1wi0 h MET 90 Cb 0.41 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 31.99 1wi0 h MET 90 CO -0.38 0.00 -0.79 0.93 -0.00 0.00 0.00 176.91 176.67 1wi0 h GLU 91 N 0.00 0.01 0.00 -0.10 5.08 -0.61 -2.52 114.58 116.44 1wi0 h GLU 91 Ca 0.20 -0.01 -0.03 0.00 -1.00 0.00 0.00 59.36 58.53 1wi0 h GLU 91 Cb 0.83 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.07 1wi0 h GLU 91 CO -0.00 0.80 -0.14 1.96 -1.00 0.00 0.00 179.01 180.63 1wi0 h GLN 92 N 0.00 0.00 0.04 2.33 4.20 0.17 -1.34 115.11 120.52 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 29.18 1wi0 h GLN 92 CO 0.10 0.14 -0.74 1.96 -0.67 0.00 0.00 178.83 179.62 1wi0 h GLN 93 N 0.00 0.09 0.00 1.46 4.20 -1.27 -2.20 115.11 117.39 1wi0 h GLN 93 Ca -0.00 -0.16 -0.01 0.00 0.06 0.00 0.00 58.65 58.54 1wi0 h GLN 93 Cb 0.61 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 28.44 1wi0 h GLN 93 CO 0.02 1.07 -0.06 -0.39 -0.67 0.00 0.00 178.83 178.80 1wi0 h VAL 94 N -0.77 0.96 0.06 -0.54 -1.51 -1.39 -3.11 116.25 109.96 1wi0 h VAL 94 Ca -0.18 -0.22 -0.00 0.00 -1.23 0.00 0.00 66.70 65.07 1wi0 h VAL 94 Cb 1.33 1.12 0.00 0.00 -2.13 0.00 0.00 31.29 31.61 1wi0 h VAL 94 CO -0.02 0.06 -0.03 0.78 -1.23 0.00 0.00 177.57 177.13 1wi0 h ASN 95 N 0.00 -0.07 0.00 4.19 2.35 -1.34 -3.50 115.58 117.22 1wi0 h ASN 95 Ca -0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1wi0 h ASN 95 Cb 0.12 0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.51 1wi0 h ASN 95 CO 0.01 0.08 0.00 0.61 -1.65 0.00 0.00 177.43 176.48 1wi0 n GLY 96 N 1.35 0.58 2.96 2.83 0.00 -0.84 -5.10 105.19 106.97 1wi0 n GLY 96 Ca -0.01 0.12 -0.35 0.00 0.00 0.00 0.00 46.02 45.78 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 -1.66 1.61 10.64 -1.18 -4.80 117.38 121.99 1wi0 n GLN 97 Ca 0.00 0.00 -0.29 0.00 -1.83 0.00 0.00 57.00 54.88 1wi0 n GLN 97 Cb 0.00 -0.95 0.10 0.00 -0.86 0.00 0.00 30.24 28.52 1wi0 n GLN 97 CO 0.00 0.00 0.00 -0.48 -1.83 0.00 0.00 177.06 174.75 1wi0 s LEU 98 N 6.54 2.45 0.20 2.61 0.05 -1.26 -4.28 118.68 124.99 1wi0 s LEU 98 Ca 0.44 1.08 -0.17 0.00 0.05 0.00 0.00 54.13 55.54 1wi0 s LEU 98 Cb -0.29 -3.61 -0.08 0.00 -2.05 0.00 0.00 46.19 40.17 1wi0 s LEU 98 CO 0.73 -2.04 0.65 -0.63 -0.55 0.00 0.00 176.35 174.51 1wi0 s ILE 99 N -3.30 4.71 0.14 1.48 -1.09 -1.26 -4.92 121.20 116.96 1wi0 s ILE 99 Ca 0.61 1.03 0.06 0.00 -2.23 0.00 0.00 60.65 60.12 1wi0 s ILE 99 Cb -0.13 -3.77 -0.04 0.00 -1.58 0.00 0.00 42.46 36.94 1wi0 s ILE 99 CO 0.53 0.17 0.04 -1.61 -1.23 0.00 0.00 174.94 172.83 1wi0 s GLU 100 N -2.12 2.59 0.29 2.79 0.41 -1.26 -5.10 118.70 116.30 1wi0 s GLU 100 Ca 0.42 -0.95 -0.29 0.00 -0.41 0.00 0.00 54.97 53.74 1wi0 s GLU 100 Cb -0.15 -2.50 -0.09 0.00 -1.78 0.00 0.00 34.13 29.61 1wi0 s GLU 100 CO 0.20 0.49 1.08 -1.25 -0.49 0.00 0.00 175.26 175.29 1wi0 s PRO 101 N -2.78 4.60 -0.85 0.39 0.04 -1.26 -4.88 135.00 130.26 1wi0 s PRO 101 Ca 0.28 1.74 -0.23 0.00 0.04 0.00 0.00 61.00 62.82 1wi0 s PRO 101 Cb -0.10 -3.12 -0.18 0.00 0.04 0.00 0.00 34.50 31.14 1wi0 s PRO 101 CO 0.20 0.20 2.26 -0.11 0.04 0.00 0.00 177.00 179.59 1wi0 n LEU 102 N 1.06 1.21 -4.61 -3.56 7.94 0.11 -4.67 117.00 114.48 1wi0 n LEU 102 Ca -0.00 -1.65 -0.43 0.00 -1.11 0.00 0.00 56.01 52.82 1wi0 n LEU 102 Cb 0.46 -1.53 -0.03 0.00 0.53 0.00 0.00 43.42 42.85 1wi0 n LEU 102 CO 0.52 -2.75 1.54 -1.58 -1.11 0.00 0.00 177.39 174.02 1wi0 s GLN 103 N 8.49 3.43 0.02 1.96 0.74 -1.26 -1.66 119.66 131.38 1wi0 s GLN 103 Ca 0.90 1.58 0.00 0.00 0.05 0.00 0.00 55.36 57.90 1wi0 s GLN 103 Cb -0.18 -4.19 0.00 0.00 1.10 0.00 0.00 33.01 29.75 1wi0 s GLN 103 CO 0.15 -1.75 0.00 0.44 -0.55 0.00 0.00 175.29 173.59 1wi0 n ILE 104 N 7.22 0.00 -3.65 -2.34 -5.35 -0.75 -3.46 119.36 111.04 1wi0 n ILE 104 Ca 0.23 -0.11 -0.03 0.00 -0.27 0.00 0.00 62.75 62.56 1wi0 n ILE 104 Cb 0.46 -0.06 -0.05 0.00 -1.74 0.00 0.00 39.64 38.24 1wi0 n ILE 104 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1wi0 s PHE 105 N -0.92 -1.21 -0.80 4.28 0.40 -0.43 -2.47 117.98 116.83 1wi0 s PHE 105 Ca 0.00 2.19 -0.25 0.00 -0.60 0.00 0.00 56.93 58.26 1wi0 s PHE 105 Cb -0.00 0.71 0.00 0.00 0.51 0.00 0.00 43.02 44.24 1wi0 s PHE 105 CO 0.00 -0.61 1.62 -1.25 0.70 0.00 0.00 175.22 175.68 1wi0 s PRO 106 N 2.54 2.99 0.13 0.24 0.04 -1.26 -1.96 135.00 137.71 1wi0 s PRO 106 Ca -0.07 -0.21 -0.32 0.00 0.04 0.00 0.00 61.00 60.44 1wi0 s PRO 106 Cb -0.10 -4.68 -0.11 0.00 0.04 0.00 0.00 34.50 29.65 1wi0 s PRO 106 CO -0.18 -2.58 1.54 0.00 0.04 0.00 0.00 177.00 175.81 1wi0 h ARG 107 N 11.63 -0.34 -1.00 4.56 3.08 -1.80 -3.48 114.38 127.01 1wi0 h ARG 107 Ca -0.09 0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.98 1wi0 h ARG 107 Cb 1.06 0.08 0.00 0.00 0.08 0.00 0.00 29.97 31.19 1wi0 h ARG 107 CO 1.28 -0.23 0.00 0.43 -1.07 0.00 0.00 179.97 180.38 1wi0 n SER 108 N -5.33 -1.88 0.00 7.04 7.64 -1.26 -5.05 113.62 114.79 1wi0 n SER 108 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.85 1wi0 n SER 108 Cb 0.33 -0.94 0.00 0.00 -1.01 0.00 0.00 64.21 62.59 1wi0 n SER 108 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1wi0 n GLY 109 N 0.18 2.60 3.80 0.23 0.00 -1.26 -4.97 105.19 105.77 1wi0 n GLY 109 Ca 0.00 -0.55 -0.30 0.00 0.00 0.00 0.00 46.02 45.17 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 1.53 1.93 0.02 1.61 0.04 -1.26 -4.62 135.00 134.25 1wi0 s PRO 110 Ca 0.00 0.58 0.04 0.00 0.04 0.00 0.00 61.00 61.66 1wi0 s PRO 110 Cb 0.00 -1.91 -0.03 0.00 0.04 0.00 0.00 34.50 32.60 1wi0 s PRO 110 CO 0.00 -1.72 -0.08 -1.12 0.04 0.00 0.00 177.00 174.13 1wi0 s SER 111 N -3.93 4.56 0.45 6.66 0.01 -1.26 -4.66 113.70 115.53 1wi0 s SER 111 Ca 0.61 -0.20 0.00 0.00 1.31 0.00 0.00 55.95 57.67 1wi0 s SER 111 Cb -0.14 -1.02 0.00 0.00 0.21 0.00 0.00 66.02 65.07 1wi0 s SER 111 CO 0.54 0.26 0.00 -1.20 0.41 0.00 0.00 173.24 173.25 1wi0 n SER 112 N 1.38 -8.35 0.00 2.44 7.64 -1.26 -5.20 113.62 110.28 1wi0 n SER 112 Ca -0.15 0.94 0.00 0.00 1.01 0.00 0.00 58.87 60.67 1wi0 n SER 112 Cb 0.52 -4.54 0.00 0.00 -1.01 0.00 0.00 64.21 59.18 1wi0 n SER 112 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64