#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 6.00 -0.16 1.61 0.01 -1.26 -4.97 113.70 114.93 1wi0 s SER 2 Ca 0.00 -1.45 -0.29 0.00 1.31 0.00 0.00 55.95 55.52 1wi0 s SER 2 Cb 0.00 -2.13 -0.02 0.00 0.21 0.00 0.00 66.02 64.09 1wi0 s SER 2 CO 0.00 -0.64 1.30 -0.55 0.41 0.00 0.00 173.24 173.76 1wi0 s SER 3 N 2.59 6.91 0.00 2.44 0.15 -1.26 -4.04 113.70 120.49 1wi0 s SER 3 Ca 0.04 1.74 0.00 0.00 0.70 0.00 0.00 55.95 58.43 1wi0 s SER 3 Cb -0.25 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.53 1wi0 s SER 3 CO 0.05 -0.78 0.00 0.61 1.20 0.00 0.00 173.24 174.31 1wi0 n GLY 4 N 3.67 0.69 0.07 9.45 0.00 -1.26 -5.04 105.19 112.76 1wi0 n GLY 4 Ca 0.14 -0.65 -0.13 0.00 0.00 0.00 0.00 46.02 45.38 1wi0 n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1wi0 h SER 5 N 0.00 -0.01 -5.81 1.61 4.64 -2.04 -3.49 113.55 108.45 1wi0 h SER 5 Ca 0.00 -0.72 -0.16 0.00 -0.47 0.00 0.00 61.79 60.44 1wi0 h SER 5 Cb 0.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.31 1wi0 h SER 5 CO 0.00 0.72 -0.61 -1.54 -0.87 0.00 0.00 176.83 174.53 1wi0 n SER 6 N -4.74 -6.90 0.00 4.97 3.41 -1.26 -4.87 113.62 104.23 1wi0 n SER 6 Ca -0.09 -0.03 0.00 0.00 -0.26 0.00 0.00 58.87 58.49 1wi0 n SER 6 Cb 0.36 -3.99 0.00 0.00 -0.26 0.00 0.00 64.21 60.32 1wi0 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1wi0 n GLY 7 N -0.91 1.74 3.45 5.00 0.00 -1.26 -4.98 105.19 108.23 1wi0 n GLY 7 Ca -0.03 -0.73 -0.37 0.00 0.00 0.00 0.00 46.02 44.89 1wi0 n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1wi0 n PRO 8 N 0.25 2.37 0.01 1.61 -0.04 -1.26 -4.08 135.00 133.86 1wi0 n PRO 8 Ca 0.00 -2.75 0.00 0.00 -0.04 0.00 0.00 63.50 60.71 1wi0 n PRO 8 Cb 0.00 -3.51 0.00 0.00 -0.04 0.00 0.00 33.50 29.95 1wi0 n PRO 8 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 1wi0 n PHE 9 N 10.47 -0.16 -2.08 0.54 7.35 -1.26 -5.13 117.46 127.19 1wi0 n PHE 9 Ca 0.48 0.03 -0.03 0.00 -0.76 0.00 0.00 57.45 57.16 1wi0 n PHE 9 Cb 0.45 0.41 -0.03 0.00 0.35 0.00 0.00 39.48 40.66 1wi0 n PHE 9 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1wi0 s ALA 11 N -0.37 3.59 -0.30 0.00 0.00 -1.26 -5.07 121.76 118.35 1wi0 s ALA 11 Ca -0.15 -0.25 -0.16 0.00 0.00 0.00 0.00 51.96 51.39 1wi0 s ALA 11 Cb 0.01 -2.43 0.19 0.00 0.00 0.00 0.00 23.12 20.88 1wi0 s ALA 11 CO 0.41 0.51 1.15 0.00 0.00 0.00 0.00 175.76 177.83 1wi0 s MET 12 N -2.52 0.17 -0.15 0.00 0.23 -1.26 -4.97 119.30 110.80 1wi0 s MET 12 Ca 0.44 0.31 -0.26 0.00 -1.03 0.00 0.00 55.69 55.15 1wi0 s MET 12 Cb -0.12 0.08 -0.23 0.00 -1.53 0.00 0.00 34.83 33.02 1wi0 s MET 12 CO 0.21 -0.04 0.63 0.93 -2.03 0.00 0.00 175.02 174.71 1wi0 h GLU 13 N 5.91 0.00 -6.80 3.16 5.08 -1.97 -3.46 114.58 116.50 1wi0 h GLU 13 Ca -0.24 0.00 -0.49 0.00 -1.00 0.00 0.00 59.36 57.63 1wi0 h GLU 13 Cb 1.16 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 1wi0 h GLU 13 CO 0.18 0.95 0.38 1.21 -1.00 0.00 0.00 179.01 180.73 1wi0 s ASN 14 N -6.30 7.45 0.99 1.42 2.47 -1.26 -5.00 114.94 114.72 1wi0 s ASN 14 Ca -0.20 2.01 -0.17 0.00 0.42 0.00 0.00 52.86 54.91 1wi0 s ASN 14 Cb -0.01 -2.61 -0.08 0.00 -1.45 0.00 0.00 41.25 37.10 1wi0 s ASN 14 CO 0.64 0.01 -0.47 0.00 -3.72 0.00 0.00 177.10 173.55 1wi0 n GLN 15 N 1.15 -0.21 -0.65 0.43 6.02 -1.26 -4.91 117.38 117.95 1wi0 n GLN 15 Ca -0.01 -0.05 -0.28 0.00 -0.01 0.00 0.00 57.00 56.65 1wi0 n GLN 15 Cb 0.47 -1.31 0.24 0.00 1.02 0.00 0.00 30.24 30.67 1wi0 n GLN 15 CO 0.00 0.00 0.00 0.14 -1.01 0.00 0.00 177.06 176.19 1wi0 s VAL 16 N -2.14 2.00 0.07 5.09 -7.23 -1.26 -4.83 120.40 112.11 1wi0 s VAL 16 Ca 0.46 0.00 0.07 0.00 -1.81 0.00 0.00 61.98 60.70 1wi0 s VAL 16 Cb -0.15 -2.14 -0.04 0.00 0.56 0.00 0.00 36.38 34.61 1wi0 s VAL 16 CO 0.75 -0.00 -0.13 -0.22 -0.31 0.00 0.00 175.10 175.19 1wi0 s LEU 17 N -7.12 2.89 -0.22 1.32 2.96 0.49 -4.95 118.68 114.05 1wi0 s LEU 17 Ca 0.68 -0.38 -0.00 0.00 -0.22 0.00 0.00 54.13 54.20 1wi0 s LEU 17 Cb -0.24 -1.70 0.06 0.00 0.50 0.00 0.00 46.19 44.81 1wi0 s LEU 17 CO 0.64 0.22 -0.03 -0.69 -1.32 0.00 0.00 176.35 175.17 1wi0 s VAL 18 N -1.09 1.22 -0.15 1.68 1.01 -1.26 -0.19 120.40 121.62 1wi0 s VAL 18 Ca 0.18 -1.01 -0.15 0.00 0.00 0.00 0.00 61.98 61.00 1wi0 s VAL 18 Cb -0.11 -1.56 -0.04 0.00 0.00 0.00 0.00 36.38 34.67 1wi0 s VAL 18 CO 0.10 -0.13 0.34 -0.63 0.00 0.00 0.00 175.10 174.78 1wi0 s ILE 19 N 1.54 5.27 -0.43 2.22 1.01 -1.14 -0.25 121.20 129.42 1wi0 s ILE 19 Ca -0.04 0.65 -0.08 0.00 0.00 0.00 0.00 60.65 61.18 1wi0 s ILE 19 Cb -0.18 -3.68 0.10 0.00 0.01 0.00 0.00 42.46 38.70 1wi0 s ILE 19 CO -0.07 0.36 0.27 -0.60 0.00 0.00 0.00 174.94 174.91 1wi0 s ARG 20 N 0.58 2.45 -0.27 2.79 3.52 -0.28 -0.02 118.95 127.72 1wi0 s ARG 20 Ca 0.19 -1.63 -0.29 0.00 -0.13 0.00 0.00 55.73 53.87 1wi0 s ARG 20 Cb -0.14 -3.78 0.01 0.00 -1.56 0.00 0.00 34.95 29.48 1wi0 s ARG 20 CO 0.06 -1.05 1.04 0.42 -0.81 0.00 0.00 175.30 174.95 1wi0 s ILE 21 N 1.35 4.62 -0.43 4.11 1.09 0.13 -0.46 121.20 131.61 1wi0 s ILE 21 Ca 0.05 1.88 -0.28 0.00 -1.10 0.00 0.00 60.65 61.19 1wi0 s ILE 21 Cb -0.24 -4.34 -0.02 0.00 -1.06 0.00 0.00 42.46 36.80 1wi0 s ILE 21 CO -0.00 -0.30 1.79 -0.54 -0.10 0.00 0.00 174.94 175.79 1wi0 s LYS 22 N 3.36 3.10 0.19 2.79 -0.14 0.20 -2.07 119.74 127.16 1wi0 s LYS 22 Ca 0.44 1.10 -0.24 0.00 -1.36 0.00 0.00 55.97 55.91 1wi0 s LYS 22 Cb -0.14 -4.25 -0.08 0.00 -1.68 0.00 0.00 37.83 31.68 1wi0 s LYS 22 CO 0.10 -2.14 0.78 0.42 -0.76 0.00 0.00 175.35 173.74 1wi0 s ILE 23 N 7.55 4.39 -0.30 2.17 -1.09 -0.04 -4.55 121.20 129.33 1wi0 s ILE 23 Ca 0.74 1.64 -0.29 0.00 -2.23 0.00 0.00 60.65 60.51 1wi0 s ILE 23 Cb -0.18 -4.08 -0.00 0.00 -1.58 0.00 0.00 42.46 36.62 1wi0 s ILE 23 CO 0.29 0.45 1.35 -2.16 -1.23 0.00 0.00 174.94 173.64 1wi0 s PRO 24 N -1.35 3.86 -1.20 2.79 0.04 -1.26 -3.71 135.00 134.18 1wi0 s PRO 24 Ca 0.38 1.26 -0.24 0.00 0.04 0.00 0.00 61.00 62.43 1wi0 s PRO 24 Cb -0.22 -3.92 0.01 0.00 0.04 0.00 0.00 34.50 30.42 1wi0 s PRO 24 CO 0.25 -1.20 0.71 0.09 0.04 0.00 0.00 177.00 176.89 1wi0 n ASN 25 N 7.87 -4.38 -1.24 6.66 4.13 -1.26 -4.82 115.26 122.22 1wi0 n ASN 25 Ca 0.15 -1.13 -0.00 0.00 1.68 0.00 0.00 54.58 55.28 1wi0 n ASN 25 Cb 0.47 -2.70 0.01 0.00 -1.54 0.00 0.00 39.78 36.01 1wi0 n ASN 25 CO 0.00 0.00 0.00 -1.20 0.28 0.00 0.00 177.26 176.34 1wi0 n SER 26 N -2.51 -0.14 0.00 6.41 7.64 -1.24 -5.13 113.62 118.64 1wi0 n SER 26 Ca -0.12 -0.80 0.00 0.00 1.01 0.00 0.00 58.87 58.96 1wi0 n SER 26 Cb 0.59 0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.85 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 -0.11 2.97 3.33 0.23 0.00 -1.26 -4.74 105.19 105.61 1wi0 n GLY 27 Ca -0.02 -0.33 -0.15 0.00 0.00 0.00 0.00 46.02 45.52 1wi0 n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1wi0 s ALA 28 N -2.00 -1.09 -0.00 4.61 0.00 -1.26 -0.86 121.76 121.15 1wi0 s ALA 28 Ca 0.00 0.65 0.01 0.00 0.00 0.00 0.00 51.96 52.62 1wi0 s ALA 28 Cb 0.00 0.03 -0.04 0.00 0.00 0.00 0.00 23.12 23.12 1wi0 s ALA 28 CO 0.00 -0.29 0.02 0.08 0.00 0.00 0.00 175.76 175.57 1wi0 s VAL 29 N -1.25 4.31 -0.26 0.00 1.01 -0.88 -4.92 120.40 118.42 1wi0 s VAL 29 Ca -0.12 -0.54 -0.08 0.00 0.00 0.00 0.00 61.98 61.24 1wi0 s VAL 29 Cb -0.04 -2.94 -0.03 0.00 0.00 0.00 0.00 36.38 33.38 1wi0 s VAL 29 CO 0.06 0.38 0.09 1.51 0.00 0.00 0.00 175.10 177.14 1wi0 s ASP 30 N -1.58 5.29 -0.55 3.32 -4.77 -1.26 -0.69 116.67 116.42 1wi0 s ASP 30 Ca 0.20 -0.20 -0.20 0.00 -3.30 0.00 0.00 52.55 49.05 1wi0 s ASP 30 Cb -0.12 -1.96 0.07 0.00 -1.09 0.00 0.00 42.92 39.83 1wi0 s ASP 30 CO 0.11 -0.05 0.70 0.86 0.70 0.00 0.00 175.17 177.49 1wi0 s TRP 31 N 1.64 2.98 -0.49 2.11 -0.00 0.97 -4.93 118.94 121.21 1wi0 s TRP 31 Ca 0.06 -0.66 -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 29.44 1wi0 s TRP 31 CO 0.05 -1.20 2.38 -0.08 -0.00 0.00 0.00 176.95 178.09 1wi0 s THR 32 N 2.86 3.03 -0.20 5.86 -1.32 -1.26 -2.86 115.64 121.74 1wi0 s THR 32 Ca 0.15 0.01 -0.06 0.00 -1.21 0.00 0.00 61.69 60.58 1wi0 s THR 32 Cb -0.20 -3.07 -0.03 0.00 -1.51 0.00 0.00 72.50 67.69 1wi0 s THR 32 CO 0.10 -0.06 0.04 -0.69 -2.21 0.00 0.00 174.62 171.80 1wi0 s VAL 33 N 11.98 4.40 -0.21 5.08 1.01 0.73 -4.96 120.40 138.42 1wi0 s VAL 33 Ca 0.96 -0.16 0.12 0.00 0.00 0.00 0.00 61.98 62.90 1wi0 s VAL 33 Cb -0.17 -2.99 -0.22 0.00 0.00 0.00 0.00 36.38 32.99 1wi0 s VAL 33 CO 0.26 0.43 -0.01 1.41 0.00 0.00 0.00 175.10 177.19 1wi0 n HIS 34 N 3.99 0.04 -1.57 5.22 8.25 -1.26 0.19 115.22 130.08 1wi0 n HIS 34 Ca -0.17 0.01 -0.29 0.00 -0.26 0.00 0.00 57.72 57.02 1wi0 n HIS 34 Cb 0.52 -1.01 -0.05 0.00 1.12 0.00 0.00 29.99 30.58 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 -2.93 6.68 -0.35 0.41 7.64 -1.26 -4.50 113.62 119.32 1wi0 n SER 35 Ca -0.37 -3.23 0.03 0.00 1.01 0.00 0.00 58.87 56.31 1wi0 n SER 35 Cb 1.10 -1.24 0.10 0.00 -1.01 0.00 0.00 64.21 63.16 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 4.05 0.47 0.63 0.23 0.00 -1.88 -0.01 103.07 106.56 1wi0 h GLY 36 Ca 0.43 0.38 -0.10 0.00 0.00 0.00 0.00 47.33 48.04 1wi0 h GLY 36 CO 0.96 -0.31 -0.38 -0.56 0.00 0.00 0.00 176.54 176.26 1wi0 h PRO 37 N -0.01 0.30 -2.26 4.80 0.13 -1.94 -3.30 132.00 129.72 1wi0 h PRO 37 Ca 0.42 -0.29 -0.35 0.00 -0.87 0.00 0.00 66.00 64.90 1wi0 h PRO 37 Cb 0.66 0.07 -0.06 0.00 0.13 0.00 0.00 31.00 31.81 1wi0 h PRO 37 CO -0.97 0.97 0.80 0.94 -0.23 0.00 0.00 178.00 179.51 1wi0 n GLN 38 N -4.39 2.54 -5.11 0.86 7.27 -0.09 -4.84 117.38 113.61 1wi0 n GLN 38 Ca -0.09 -1.50 -0.31 0.00 0.07 0.00 0.00 57.00 55.17 1wi0 n GLN 38 Cb 0.55 -2.23 -0.15 0.00 2.41 0.00 0.00 30.24 30.83 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 -0.23 2.22 0.32 1.69 2.96 -0.73 -4.78 118.68 120.13 1wi0 s LEU 39 Ca 0.67 -0.45 0.09 0.00 -0.22 0.00 0.00 54.13 54.22 1wi0 s LEU 39 Cb 0.29 -1.38 -0.05 0.00 0.50 0.00 0.00 46.19 45.55 1wi0 s LEU 39 CO -0.04 0.31 0.01 -0.76 -1.32 0.00 0.00 176.35 174.55 1wi0 s LEU 40 N -0.83 3.05 0.07 -0.68 1.43 -1.26 -4.91 118.68 115.54 1wi0 s LEU 40 Ca 0.11 -0.88 -0.25 0.00 -1.03 0.00 0.00 54.13 52.09 1wi0 s LEU 40 Cb -0.10 -1.48 -0.16 0.00 0.03 0.00 0.00 46.19 44.47 1wi0 s LEU 40 CO 0.00 -0.17 1.64 0.15 0.23 0.00 0.00 176.35 178.20 1wi0 h PHE 41 N 1.82 -0.12 -0.43 0.29 3.57 -1.93 -2.93 116.94 117.20 1wi0 h PHE 41 Ca -0.43 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.15 1wi0 h PHE 41 Cb 1.25 0.04 -0.07 0.00 2.79 0.00 0.00 35.95 39.96 1wi0 h PHE 41 CO 0.69 0.00 -0.03 0.00 -2.23 0.00 0.00 178.31 176.74 1wi0 h ARG 42 N -0.21 0.08 -0.86 1.11 2.47 -1.96 -0.80 114.38 114.20 1wi0 h ARG 42 Ca -0.01 -0.00 0.18 0.00 -1.26 0.00 0.00 59.98 58.88 1wi0 h ARG 42 Cb 0.17 -0.02 -0.16 0.00 -1.65 0.00 0.00 29.97 28.32 1wi0 h ARG 42 CO 0.02 0.05 -0.19 -0.44 0.56 0.00 0.00 179.97 179.98 1wi0 h ASP 43 N 0.08 -0.75 -0.12 7.04 5.19 -1.90 1.88 116.42 127.85 1wi0 h ASP 43 Ca 0.21 0.25 0.03 0.00 -0.62 0.00 0.00 57.03 56.91 1wi0 h ASP 43 Cb 0.32 0.52 -0.03 0.00 0.18 0.00 0.00 39.33 40.31 1wi0 h ASP 43 CO -0.38 -0.28 -0.09 0.58 -3.12 0.00 0.00 179.24 175.95 1wi0 h VAL 44 N 0.01 0.73 -0.13 -1.35 2.07 -1.04 0.30 116.25 116.84 1wi0 h VAL 44 Ca 0.42 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.91 1wi0 h VAL 44 Cb 0.67 0.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.16 1wi0 h VAL 44 CO -0.87 0.00 -0.07 -0.07 0.02 0.00 0.00 177.57 176.58 1wi0 h LEU 45 N -0.10 0.18 -1.09 2.57 -0.00 0.68 0.65 115.31 118.19 1wi0 h LEU 45 Ca 0.08 -0.03 -0.09 0.00 -0.00 0.00 0.00 57.88 57.84 1wi0 h LEU 45 Cb 0.21 -0.05 -0.01 0.00 -0.00 0.00 0.00 40.66 40.81 1wi0 h LEU 45 CO -0.18 0.28 -0.43 0.44 -0.00 0.00 0.00 178.44 178.56 1wi0 h ASP 46 N 0.19 0.05 0.00 -0.43 3.32 0.44 -1.27 116.42 118.73 1wi0 h ASP 46 Ca 0.04 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.06 1wi0 h ASP 46 Cb 0.26 -0.01 -0.00 0.00 0.22 0.00 0.00 39.33 39.79 1wi0 h ASP 46 CO 0.01 0.48 -0.25 0.58 -1.72 0.00 0.00 179.24 178.33 1wi0 h VAL 47 N 0.04 0.17 -0.96 -1.35 2.07 0.12 -3.35 116.25 112.99 1wi0 h VAL 47 Ca 0.00 -1.16 0.30 0.00 0.82 0.00 0.00 66.70 66.66 1wi0 h VAL 47 Cb 0.78 0.35 -0.15 0.00 -1.52 0.00 0.00 31.29 30.75 1wi0 h VAL 47 CO 0.06 0.06 0.41 0.40 0.02 0.00 0.00 177.57 178.51 1wi0 h ILE 48 N -1.00 0.25 -1.14 4.57 2.04 0.18 1.55 117.51 123.96 1wi0 h ILE 48 Ca -0.02 -0.08 0.33 0.00 1.00 0.00 0.00 64.86 66.09 1wi0 h ILE 48 Cb 0.33 0.01 -0.05 0.00 -0.74 0.00 0.00 36.82 36.37 1wi0 h ILE 48 CO -0.01 0.04 0.83 1.23 0.00 0.00 0.00 178.15 180.24 1wi0 h GLY 49 N 0.23 0.00 1.46 5.37 0.00 -1.36 1.71 103.07 110.47 1wi0 h GLY 49 Ca 0.67 0.00 -0.13 0.00 0.00 0.00 0.00 47.33 47.87 1wi0 h GLY 49 CO -0.67 0.00 -0.97 1.46 0.00 0.00 0.00 176.54 176.37 1wi0 h GLN 50 N 0.00 0.00 0.00 4.80 4.20 0.21 -2.93 115.11 121.39 1wi0 h GLN 50 Ca 0.54 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 59.23 1wi0 h GLN 50 Cb 2.20 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.98 1wi0 h GLN 50 CO -0.01 0.37 -0.12 0.28 -0.67 0.00 0.00 178.83 178.68 1wi0 h VAL 51 N 0.00 1.68 -2.83 -0.54 2.07 0.24 -3.40 116.25 113.47 1wi0 h VAL 51 Ca -0.08 -2.31 -0.61 0.00 0.82 0.00 0.00 66.70 64.52 1wi0 h VAL 51 Cb 1.45 3.22 -0.42 0.00 -1.52 0.00 0.00 31.29 34.02 1wi0 h VAL 51 CO 0.05 0.57 -0.59 0.18 0.02 0.00 0.00 177.57 177.80 1wi0 n LEU 52 N -4.60 3.14 0.23 2.57 4.32 0.29 -4.87 117.00 118.08 1wi0 n LEU 52 Ca -0.12 -5.26 0.12 0.00 -0.02 0.00 0.00 56.01 50.74 1wi0 n LEU 52 Cb 0.49 -0.70 0.39 0.00 -1.62 0.00 0.00 43.42 41.98 1wi0 n LEU 52 CO 0.32 1.84 0.84 1.55 -1.22 0.00 0.00 177.39 180.71 1wi0 h PRO 53 N 5.06 0.00 -0.40 3.23 0.13 -1.72 -2.75 132.00 135.55 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 0.10 0.00 0.39 -0.23 0.00 0.00 178.00 179.00 1wi0 n GLU 54 N -3.17 2.48 -3.49 0.86 1.02 -1.26 -4.78 120.64 112.31 1wi0 n GLU 54 Ca 0.02 -2.28 -0.20 0.00 -0.02 0.00 0.00 57.16 54.67 1wi0 n GLU 54 Cb 0.46 -1.50 -0.13 0.00 -0.02 0.00 0.00 31.44 30.25 1wi0 n GLU 54 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1wi0 s ALA 55 N -1.40 -0.14 1.17 0.62 0.00 -1.04 -5.15 121.76 115.83 1wi0 s ALA 55 Ca 0.38 -0.10 -0.17 0.00 0.00 0.00 0.00 51.96 52.07 1wi0 s ALA 55 Cb 0.22 -1.41 0.21 0.00 0.00 0.00 0.00 23.12 22.13 1wi0 s ALA 55 CO 0.31 -1.38 0.40 2.41 0.00 0.00 0.00 175.76 177.50 1wi0 n THR 56 N 5.30 0.00 0.00 0.00 -1.04 -1.26 -4.62 114.28 112.66 1wi0 n THR 56 Ca -0.05 -0.24 0.00 0.00 -2.04 0.00 0.00 64.05 61.72 1wi0 n THR 56 Cb 0.48 -0.72 0.00 0.00 -1.82 0.00 0.00 70.33 68.27 1wi0 n THR 56 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1wi0 n THR 57 N -4.79 0.00 0.00 12.58 -1.04 -1.26 -3.85 114.28 115.92 1wi0 n THR 57 Ca 0.04 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.05 1wi0 n THR 57 Cb 0.55 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.06 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 -1.86 0.00 -4.43 12.58 -1.04 -1.26 -4.45 114.28 113.82 1wi0 n THR 58 Ca 0.00 0.00 -0.21 0.00 -2.04 0.00 0.00 64.05 61.80 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 2.26 0.17 2.41 0.00 -1.26 -4.83 121.76 120.51 1wi0 s ALA 59 Ca 0.00 -2.02 -0.12 0.00 0.00 0.00 0.00 51.96 49.82 1wi0 s ALA 59 Cb 0.00 0.68 0.00 0.00 0.00 0.00 0.00 23.12 23.81 1wi0 s ALA 59 CO 0.00 -0.32 0.37 -0.59 0.00 0.00 0.00 175.76 175.22 1wi0 s PHE 60 N -3.35 0.21 0.23 0.00 -0.71 -1.15 -1.49 117.98 111.72 1wi0 s PHE 60 Ca 0.36 -0.57 0.12 0.00 -1.04 0.00 0.00 56.93 55.80 1wi0 s PHE 60 Cb 0.08 0.10 -0.05 0.00 -1.21 0.00 0.00 43.02 41.95 1wi0 s PHE 60 CO 0.15 -0.78 -0.21 -1.21 -1.34 0.00 0.00 175.22 171.82 1wi0 s GLU 61 N -3.93 1.62 -0.14 1.99 2.02 -0.87 -0.05 118.70 119.34 1wi0 s GLU 61 Ca 0.14 -1.62 -0.07 0.00 0.02 0.00 0.00 54.97 53.44 1wi0 s GLU 61 Cb 0.02 -1.83 0.06 0.00 0.10 0.00 0.00 34.13 32.48 1wi0 s GLU 61 CO -0.01 0.37 0.33 1.52 0.02 0.00 0.00 175.26 177.49 1wi0 s TYR 62 N -2.04 -0.50 0.27 1.61 -0.85 -0.87 -1.34 117.35 113.63 1wi0 s TYR 62 Ca 0.25 1.09 -0.31 0.00 -0.52 0.00 0.00 57.07 57.58 1wi0 s TYR 62 Cb -0.07 0.15 -0.12 0.00 0.38 0.00 0.00 41.96 42.30 1wi0 s TYR 62 CO 0.12 -0.32 1.62 0.39 -1.52 0.00 0.00 175.55 175.84 1wi0 n GLU 63 N 4.54 2.70 0.00 -3.49 1.02 -1.26 -0.53 120.64 123.62 1wi0 n GLU 63 Ca -0.20 0.96 0.00 0.00 -0.02 0.00 0.00 57.16 57.90 1wi0 n GLU 63 Cb 0.53 -2.76 0.00 0.00 -0.02 0.00 0.00 31.44 29.19 1wi0 n GLU 63 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 1wi0 n ASP 64 N 2.54 0.00 -0.07 1.62 2.03 -1.26 -4.86 116.55 116.54 1wi0 n ASP 64 Ca 0.10 0.00 -0.12 0.00 0.52 0.00 0.00 54.79 55.29 1wi0 n ASP 64 Cb 0.36 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.77 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 0.81 -0.66 -0.67 4.11 -1.98 -2.66 114.58 113.52 1wi0 h GLU 65 Ca 0.00 -0.45 0.00 0.00 0.07 0.00 0.00 59.36 58.98 1wi0 h GLU 65 Cb 0.00 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1wi0 h GLU 65 CO 0.00 1.08 0.00 -0.25 0.07 0.00 0.00 179.01 179.91 1wi0 n ASP 66 N -4.03 4.72 -4.05 3.06 9.92 -1.26 -4.93 116.55 119.99 1wi0 n ASP 66 Ca -0.03 -2.70 -0.36 0.00 -0.53 0.00 0.00 54.79 51.17 1wi0 n ASP 66 Cb 0.56 -0.63 -0.02 0.00 -0.64 0.00 0.00 41.12 40.39 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 0.57 -0.51 0.95 0.44 0.00 -1.01 -4.79 105.19 100.85 1wi0 n GLY 67 Ca 0.22 0.24 0.11 0.00 0.00 0.00 0.00 46.02 46.59 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 -1.91 3.04 -2.69 1.61 2.03 -1.26 -4.82 116.55 112.55 1wi0 n ASP 68 Ca -0.15 -1.92 -0.04 0.00 0.52 0.00 0.00 54.79 53.19 1wi0 n ASP 68 Cb 0.52 -0.12 -0.04 0.00 -0.72 0.00 0.00 41.12 40.76 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 1.27 -3.88 -2.10 -0.67 5.12 -1.26 -4.94 116.66 110.19 1wi0 n ARG 69 Ca 0.15 2.97 -0.28 0.00 -1.93 0.00 0.00 57.85 58.76 1wi0 n ARG 69 Cb 0.55 -4.07 0.15 0.00 -1.16 0.00 0.00 32.46 27.92 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 2.06 -0.04 0.55 -1.09 0.30 -4.76 121.20 117.72 1wi0 s ILE 70 Ca -0.21 -0.16 0.02 0.00 -2.23 0.00 0.00 60.65 58.07 1wi0 s ILE 70 Cb 0.01 -2.90 0.01 0.00 -1.58 0.00 0.00 42.46 38.00 1wi0 s ILE 70 CO 0.58 0.00 -0.08 -0.89 -1.23 0.00 0.00 174.94 173.32 1wi0 s THR 71 N -3.62 0.73 -0.33 2.92 2.01 -1.26 -2.05 115.64 114.03 1wi0 s THR 71 Ca 0.69 -0.29 -0.02 0.00 0.31 0.00 0.00 61.69 62.39 1wi0 s THR 71 Cb -0.06 -0.68 0.07 0.00 0.01 0.00 0.00 72.50 71.84 1wi0 s THR 71 CO 0.50 0.25 0.06 -0.69 -0.69 0.00 0.00 174.62 174.05 1wi0 s VAL 72 N 0.48 3.00 -0.11 3.82 1.01 0.93 -4.88 120.40 124.65 1wi0 s VAL 72 Ca -0.07 -1.66 0.01 0.00 0.00 0.00 0.00 61.98 60.25 1wi0 s VAL 72 Cb -0.11 -2.87 0.01 0.00 0.00 0.00 0.00 36.38 33.41 1wi0 s VAL 72 CO 0.01 -0.32 0.68 0.54 0.00 0.00 0.00 175.10 176.01 1wi0 n ARG 73 N 4.58 0.32 -3.63 2.72 1.74 -1.26 -2.92 116.66 118.20 1wi0 n ARG 73 Ca -0.08 -0.86 -0.15 0.00 -0.77 0.00 0.00 57.85 55.98 1wi0 n ARG 73 Cb 0.43 -1.02 -0.07 0.00 -1.02 0.00 0.00 32.46 30.77 1wi0 n ARG 73 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 1wi0 s SER 74 N -0.36 -0.59 0.52 0.55 1.04 -1.26 -5.00 113.70 108.59 1wi0 s SER 74 Ca 0.01 0.94 0.44 0.00 0.48 0.00 0.00 55.95 57.82 1wi0 s SER 74 Cb 0.01 0.92 1.65 0.00 0.10 0.00 0.00 66.02 68.70 1wi0 s SER 74 CO 0.01 -0.36 1.61 -0.78 0.98 0.00 0.00 173.24 174.70 1wi0 h ASP 75 N 4.35 0.06 0.08 7.02 3.58 -1.97 0.92 116.42 130.45 1wi0 h ASP 75 Ca -0.28 0.04 0.02 0.00 0.42 0.00 0.00 57.03 57.23 1wi0 h ASP 75 Cb 1.16 0.04 -0.03 0.00 1.72 0.00 0.00 39.33 42.22 1wi0 h ASP 75 CO 0.23 -0.06 -0.22 -0.08 -2.88 0.00 0.00 179.24 176.23 1wi0 h GLU 76 N 0.01 -0.38 -0.94 0.28 4.81 -2.00 -1.52 114.58 114.84 1wi0 h GLU 76 Ca 0.88 0.03 0.01 0.00 -0.13 0.00 0.00 59.36 60.14 1wi0 h GLU 76 Cb 3.33 0.09 -0.05 0.00 0.63 0.00 0.00 28.75 32.75 1wi0 h GLU 76 CO -0.13 -0.26 0.62 0.93 -0.73 0.00 0.00 179.01 179.44 1wi0 h GLU 77 N -0.40 1.24 0.07 1.92 5.08 0.51 -2.86 114.58 120.14 1wi0 h GLU 77 Ca 0.04 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1wi0 h GLU 77 Cb 0.44 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 1wi0 h GLU 77 CO -0.15 0.83 -0.15 0.52 -1.00 0.00 0.00 179.01 179.05 1wi0 h MET 78 N 1.28 -0.23 -1.52 2.33 2.86 -0.86 0.34 114.93 119.12 1wi0 h MET 78 Ca 0.34 0.02 0.45 0.00 -2.06 0.00 0.00 59.70 58.44 1wi0 h MET 78 Cb -0.14 0.05 -0.07 0.00 0.06 0.00 0.00 31.60 31.50 1wi0 h MET 78 CO -0.07 -0.15 1.08 0.87 1.06 0.00 0.00 176.91 179.70 1wi0 h LYS 79 N -0.24 0.02 0.26 1.72 1.57 -1.24 0.66 116.57 119.32 1wi0 h LYS 79 Ca -0.01 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.76 1wi0 h LYS 79 Cb 0.23 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.54 1wi0 h LYS 79 CO -0.07 0.02 -0.12 0.00 -0.57 0.00 0.00 179.45 178.71 1wi0 h ALA 80 N 1.27 -0.35 -0.96 3.86 0.00 -0.79 0.56 119.26 122.86 1wi0 h ALA 80 Ca 0.75 -0.20 0.17 0.00 0.00 0.00 0.00 54.91 55.63 1wi0 h ALA 80 Cb 2.89 0.13 -0.10 0.00 0.00 0.00 0.00 17.79 20.72 1wi0 h ALA 80 CO -0.06 -0.43 0.55 1.98 0.00 0.00 0.00 179.25 181.30 1wi0 h MET 81 N -0.87 0.70 0.00 0.00 1.85 0.40 0.48 114.93 117.49 1wi0 h MET 81 Ca -0.04 -0.04 -0.14 0.00 -0.61 0.00 0.00 59.70 58.87 1wi0 h MET 81 Cb 0.51 -0.16 -0.02 0.00 0.43 0.00 0.00 31.60 32.36 1wi0 h MET 81 CO 0.06 0.47 -0.67 -0.07 -0.40 0.00 0.00 176.91 176.29 1wi0 h LEU 82 N 0.73 0.00 -1.63 3.39 3.38 -0.96 -1.58 115.31 118.63 1wi0 h LEU 82 Ca 0.54 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.48 1wi0 h LEU 82 Cb 0.81 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 1wi0 h LEU 82 CO -0.38 0.67 -0.17 0.28 0.09 0.00 0.00 178.44 178.94 1wi0 h SER 83 N 0.00 0.00 0.00 -0.43 0.02 0.23 -2.47 113.55 110.90 1wi0 h SER 83 Ca -0.01 0.00 -0.18 0.00 -0.84 0.00 0.00 61.79 60.76 1wi0 h SER 83 Cb 1.19 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.70 1wi0 h SER 83 CO 0.09 0.17 -0.99 0.22 -1.14 0.00 0.00 176.83 175.17 1wi0 h TYR 84 N 0.00 0.01 -0.74 3.45 3.20 -0.78 -2.99 116.97 119.12 1wi0 h TYR 84 Ca -0.00 -0.01 0.17 0.00 3.14 0.00 0.00 58.73 62.03 1wi0 h TYR 84 Cb 0.48 -0.00 -0.12 0.00 1.54 0.00 0.00 36.73 38.64 1wi0 h TYR 84 CO 0.00 1.39 0.14 -0.92 -1.64 0.00 0.00 178.16 177.13 1wi0 h TYR 85 N -0.98 0.20 -0.08 -3.82 3.20 -1.24 1.03 116.97 115.28 1wi0 h TYR 85 Ca -0.27 0.05 -0.17 0.00 3.14 0.00 0.00 58.73 61.48 1wi0 h TYR 85 Cb 1.25 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.54 1wi0 h TYR 85 CO 0.14 -0.13 -0.67 1.88 -1.64 0.00 0.00 178.16 177.74 1wi0 h TYR 86 N 0.22 0.46 0.00 -3.82 0.05 -1.61 1.69 116.97 113.96 1wi0 h TYR 86 Ca 0.42 -0.19 -0.08 0.00 0.05 0.00 0.00 58.73 58.93 1wi0 h TYR 86 Cb 0.73 -0.08 -0.01 0.00 1.01 0.00 0.00 36.73 38.38 1wi0 h TYR 86 CO -0.30 0.91 -0.39 1.03 -1.05 0.00 0.00 178.16 178.37 1wi0 h SER 87 N 0.25 0.00 0.04 3.88 0.87 -0.52 -2.18 113.55 115.90 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 1.21 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.12 1wi0 h SER 87 CO 0.11 0.39 -2.26 1.07 -0.53 0.00 0.00 176.83 175.61 1wi0 n THR 88 N -3.69 1.59 0.06 2.23 5.66 0.33 -4.02 114.28 116.44 1wi0 n THR 88 Ca -0.01 -0.55 -0.12 0.00 -3.05 0.00 0.00 64.05 60.33 1wi0 n THR 88 Cb 0.48 -1.61 -0.05 0.00 -1.55 0.00 0.00 70.33 67.60 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 -0.14 0.33 -0.44 1.08 2.07 0.25 0.20 116.25 119.60 1wi0 h VAL 89 Ca -0.53 0.00 0.13 0.00 0.82 0.00 0.00 66.70 67.12 1wi0 h VAL 89 Cb 1.88 0.33 -0.02 0.00 -1.52 0.00 0.00 31.29 31.96 1wi0 h VAL 89 CO -0.08 0.00 0.40 0.00 0.02 0.00 0.00 177.57 177.91 1wi0 h MET 90 N -0.46 0.00 0.01 1.57 -0.00 -1.58 0.45 114.93 114.93 1wi0 h MET 90 Ca 0.06 0.00 -0.20 0.00 -0.00 0.00 0.00 59.70 59.56 1wi0 h MET 90 Cb 0.54 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.12 1wi0 h MET 90 CO -0.25 0.00 -0.95 0.93 -0.00 0.00 0.00 176.91 176.64 1wi0 h GLU 91 N 0.00 0.06 0.00 -0.10 5.08 -0.86 -2.58 114.58 116.18 1wi0 h GLU 91 Ca 0.21 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.48 1wi0 h GLU 91 Cb 1.00 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.28 1wi0 h GLU 91 CO -0.00 0.96 -0.05 1.96 -1.00 0.00 0.00 179.01 180.88 1wi0 h GLN 92 N 0.02 0.00 0.06 2.33 4.20 0.23 -1.99 115.11 119.96 1wi0 h GLN 92 Ca -0.03 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.51 1wi0 h GLN 92 Cb 1.65 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 29.42 1wi0 h GLN 92 CO 0.13 0.05 -0.91 1.96 -0.67 0.00 0.00 178.83 179.38 1wi0 h GLN 93 N 0.00 0.12 0.00 1.46 4.20 -1.28 -2.53 115.11 117.08 1wi0 h GLN 93 Ca -0.00 -0.20 -0.02 0.00 0.06 0.00 0.00 58.65 58.49 1wi0 h GLN 93 Cb 0.65 0.07 -0.00 0.00 0.30 0.00 0.00 27.48 28.51 1wi0 h GLN 93 CO 0.01 1.10 -0.07 -0.39 -0.67 0.00 0.00 178.83 178.80 1wi0 h VAL 94 N -0.69 0.96 0.26 -0.54 -1.51 -1.43 -2.92 116.25 110.38 1wi0 h VAL 94 Ca -0.21 -0.26 -0.01 0.00 -1.23 0.00 0.00 66.70 64.98 1wi0 h VAL 94 Cb 1.42 1.14 0.00 0.00 -2.13 0.00 0.00 31.29 31.72 1wi0 h VAL 94 CO -0.02 0.07 -0.12 0.78 -1.23 0.00 0.00 177.57 177.05 1wi0 h ASN 95 N 0.00 -0.29 0.00 4.19 2.35 -1.46 -3.49 115.58 116.87 1wi0 h ASN 95 Ca -0.00 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 1wi0 h ASN 95 Cb 0.14 0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.58 1wi0 h ASN 95 CO 0.01 0.14 0.00 0.61 -1.65 0.00 0.00 177.43 176.54 1wi0 n GLY 96 N 0.88 2.12 3.20 2.83 0.00 -0.96 -5.10 105.19 108.15 1wi0 n GLY 96 Ca -0.04 -0.23 -0.38 0.00 0.00 0.00 0.00 46.02 45.36 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 -1.82 1.61 10.64 -1.20 -4.82 117.38 121.81 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 -1.05 0.04 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 5.47 3.40 0.43 2.61 1.43 -1.26 -4.34 118.68 126.41 1wi0 s LEU 98 Ca 0.53 1.92 -0.23 0.00 -1.03 0.00 0.00 54.13 55.32 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 0.70 -1.49 1.07 -0.63 0.23 0.00 0.00 176.35 176.22 1wi0 s ILE 99 N -2.43 3.63 0.13 -0.59 -1.09 -1.26 -4.96 121.20 114.63 1wi0 s ILE 99 Ca 0.65 1.20 0.05 0.00 -2.23 0.00 0.00 60.65 60.32 1wi0 s ILE 99 Cb -0.19 -3.59 -0.04 0.00 -1.58 0.00 0.00 42.46 37.06 1wi0 s ILE 99 CO 0.41 -0.05 0.07 -1.61 -1.23 0.00 0.00 174.94 172.53 1wi0 s GLU 100 N -2.68 2.72 0.35 2.79 0.41 -1.26 -5.10 118.70 115.93 1wi0 s GLU 100 Ca 0.61 -0.87 -0.26 0.00 -0.41 0.00 0.00 54.97 54.04 1wi0 s GLU 100 Cb -0.22 -2.58 -0.09 0.00 -1.78 0.00 0.00 34.13 29.45 1wi0 s GLU 100 CO 0.27 0.51 1.06 -1.25 -0.49 0.00 0.00 175.26 175.36 1wi0 s PRO 101 N -2.73 4.37 -0.89 0.39 0.04 -1.26 -4.88 135.00 130.04 1wi0 s PRO 101 Ca 0.29 1.62 -0.25 0.00 0.04 0.00 0.00 61.00 62.70 1wi0 s PRO 101 Cb -0.11 -2.82 -0.18 0.00 0.04 0.00 0.00 34.50 31.43 1wi0 s PRO 101 CO 0.21 0.02 2.23 -0.11 0.04 0.00 0.00 177.00 179.39 1wi0 n LEU 102 N 0.47 1.33 -4.58 -3.56 7.94 0.65 -4.62 117.00 114.63 1wi0 n LEU 102 Ca 0.02 -1.86 -0.40 0.00 -1.11 0.00 0.00 56.01 52.66 1wi0 n LEU 102 Cb 0.48 -1.61 -0.03 0.00 0.53 0.00 0.00 43.42 42.79 1wi0 n LEU 102 CO 0.49 -2.99 1.82 -1.58 -1.11 0.00 0.00 177.39 174.01 1wi0 s GLN 103 N 8.57 2.76 0.23 1.96 0.74 -1.26 -1.13 119.66 131.53 1wi0 s GLN 103 Ca 0.87 1.54 0.11 0.00 0.05 0.00 0.00 55.36 57.93 1wi0 s GLN 103 Cb -0.12 -4.41 -0.05 0.00 1.10 0.00 0.00 33.01 29.53 1wi0 s GLN 103 CO 0.14 -2.54 -0.18 0.96 -0.55 0.00 0.00 175.29 173.12 1wi0 s ILE 104 N 9.47 2.61 -0.10 -2.34 -4.36 0.40 -4.05 121.20 122.83 1wi0 s ILE 104 Ca 0.92 -2.13 0.02 0.00 -0.26 0.00 0.00 60.65 59.20 1wi0 s ILE 104 Cb -0.23 -2.32 0.01 0.00 1.25 0.00 0.00 42.46 41.17 1wi0 s ILE 104 CO 0.30 -0.26 -0.15 -0.36 0.24 0.00 0.00 174.94 174.71 1wi0 s PHE 105 N -2.08 1.89 -0.77 1.37 0.40 -0.45 -0.63 117.98 117.71 1wi0 s PHE 105 Ca 0.26 -0.84 -0.26 0.00 -0.60 0.00 0.00 56.93 55.49 1wi0 s PHE 105 Cb -0.07 -1.36 0.00 0.00 0.51 0.00 0.00 43.02 42.11 1wi0 s PHE 105 CO 0.14 -0.43 1.61 -1.25 0.70 0.00 0.00 175.22 175.99 1wi0 s PRO 106 N 0.88 2.96 -0.84 0.24 0.04 -1.26 -2.04 135.00 134.98 1wi0 s PRO 106 Ca -0.09 -0.10 -0.22 0.00 0.04 0.00 0.00 61.00 60.62 1wi0 s PRO 106 Cb -0.15 -4.58 -0.19 0.00 0.04 0.00 0.00 34.50 29.62 1wi0 s PRO 106 CO 0.00 -2.55 2.31 0.54 0.04 0.00 0.00 177.00 177.34 1wi0 n ARG 107 N 9.15 0.40 -3.43 4.56 1.74 -0.56 -4.84 116.66 123.68 1wi0 n ARG 107 Ca 0.20 -0.72 -0.37 0.00 -0.77 0.00 0.00 57.85 56.18 1wi0 n ARG 107 Cb 0.50 -3.10 -0.07 0.00 -1.02 0.00 0.00 32.46 28.78 1wi0 n ARG 107 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1wi0 s SER 108 N 8.23 6.54 0.47 0.55 0.01 -1.25 -4.02 113.70 124.22 1wi0 s SER 108 Ca 0.98 0.64 0.03 0.00 1.31 0.00 0.00 55.95 58.91 1wi0 s SER 108 Cb -0.27 -2.23 -0.03 0.00 0.21 0.00 0.00 66.02 63.70 1wi0 s SER 108 CO 0.19 0.05 0.03 -0.83 0.41 0.00 0.00 173.24 173.09 1wi0 s GLY 109 N 0.56 2.82 -0.07 3.44 0.00 -1.26 -5.04 107.32 107.78 1wi0 s GLY 109 Ca 0.21 -0.92 -0.15 0.00 0.00 0.00 0.00 44.72 43.87 1wi0 s GLY 109 CO 0.07 -2.09 0.57 -0.56 0.00 0.00 0.00 173.10 171.08 1wi0 h PRO 110 N 1.54 -0.24 -7.19 2.90 0.13 -2.00 -3.44 132.00 123.69 1wi0 h PRO 110 Ca -0.42 0.02 -0.53 0.00 -0.87 0.00 0.00 66.00 64.20 1wi0 h PRO 110 Cb 1.29 0.06 0.19 0.00 0.13 0.00 0.00 31.00 32.67 1wi0 h PRO 110 CO 0.71 0.04 0.22 0.43 -0.23 0.00 0.00 178.00 179.17 1wi0 n SER 111 N -4.93 0.51 0.00 1.44 7.64 -1.26 -5.00 113.62 112.01 1wi0 n SER 111 Ca -0.06 0.50 0.00 0.00 1.01 0.00 0.00 58.87 60.32 1wi0 n SER 111 Cb 0.20 -1.47 0.00 0.00 -1.01 0.00 0.00 64.21 61.93 1wi0 n SER 111 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 1wi0 n SER 112 N -3.53 0.00 -0.72 6.43 2.88 -1.26 -4.99 113.62 112.43 1wi0 n SER 112 Ca 0.12 0.00 0.13 0.00 -1.33 0.00 0.00 58.87 57.79 1wi0 n SER 112 Cb 0.51 0.00 0.32 0.00 -0.75 0.00 0.00 64.21 64.29 1wi0 n SER 112 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42