#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ys4 n SER 2 N 0.00 -4.07 -4.90 1.61 2.88 -1.26 -4.96 113.62 102.92 2ys4 n SER 2 Ca 0.00 -0.79 -0.28 0.00 -1.33 0.00 0.00 58.87 56.47 2ys4 n SER 2 Cb 0.00 -3.92 0.04 0.00 -0.75 0.00 0.00 64.21 59.59 2ys4 n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2ys4 s SER 3 N -3.53 5.45 -0.48 -3.46 0.01 -1.26 -5.06 113.70 105.37 2ys4 s SER 3 Ca 0.53 0.92 0.03 0.00 1.31 0.00 0.00 55.95 58.74 2ys4 s SER 3 Cb -0.26 -1.79 0.16 0.00 0.21 0.00 0.00 66.02 64.34 2ys4 s SER 3 CO 0.83 -1.25 0.33 -0.83 0.41 0.00 0.00 173.24 172.73 2ys4 s GLY 4 N -4.35 1.69 -0.27 3.44 0.00 -1.26 -5.09 107.32 101.48 2ys4 s GLY 4 Ca 0.57 -2.75 -0.10 0.00 0.00 0.00 0.00 44.72 42.44 2ys4 s GLY 4 CO 0.49 1.72 0.17 -0.45 0.00 0.00 0.00 173.10 175.02 2ys4 s SER 5 N -0.09 5.86 -0.05 1.64 0.15 -1.26 -4.99 113.70 114.96 2ys4 s SER 5 Ca 0.25 -0.04 -0.24 0.00 0.70 0.00 0.00 55.95 56.62 2ys4 s SER 5 Cb -0.09 -2.08 -0.19 0.00 -1.71 0.00 0.00 66.02 61.95 2ys4 s SER 5 CO -0.11 -0.04 1.02 -1.28 1.20 0.00 0.00 173.24 174.03 2ys4 h SER 6 N 8.28 -0.10 -4.34 5.45 0.87 -2.08 -3.50 113.55 118.13 2ys4 h SER 6 Ca -0.36 -0.48 0.00 0.00 -1.23 0.00 0.00 61.79 59.72 2ys4 h SER 6 Cb 1.19 0.03 0.00 0.00 -0.44 0.00 0.00 62.40 63.17 2ys4 h SER 6 CO 0.56 0.48 0.00 0.61 -0.53 0.00 0.00 176.83 177.95 2ys4 n GLY 7 N 0.56 -2.58 3.76 5.77 0.00 -1.26 -4.90 105.19 106.53 2ys4 n GLY 7 Ca -0.08 -1.70 -0.36 0.00 0.00 0.00 0.00 46.02 43.87 2ys4 n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ys4 s THR 8 N -0.59 5.33 0.13 2.61 2.01 -1.26 -5.08 115.64 118.78 2ys4 s THR 8 Ca 0.00 0.46 -0.13 0.00 0.31 0.00 0.00 61.69 62.33 2ys4 s THR 8 Cb 0.00 -3.58 0.02 0.00 0.01 0.00 0.00 72.50 68.95 2ys4 s THR 8 CO 0.00 0.45 0.33 -1.61 -0.69 0.00 0.00 174.62 173.10 2ys4 s GLU 9 N 0.11 1.04 0.15 4.92 0.41 -1.26 -5.18 118.70 118.88 2ys4 s GLU 9 Ca 0.15 -0.86 -0.15 0.00 -0.41 0.00 0.00 54.97 53.70 2ys4 s GLU 9 Cb -0.13 0.42 0.02 0.00 -1.78 0.00 0.00 34.13 32.67 2ys4 s GLU 9 CO 0.04 -0.39 0.40 0.50 -0.49 0.00 0.00 175.26 175.31 2ys4 s ARG 10 N -3.85 1.15 -0.06 1.61 6.06 -1.26 -5.16 118.95 117.43 2ys4 s ARG 10 Ca 0.06 -0.85 0.01 0.00 -2.50 0.00 0.00 55.73 52.45 2ys4 s ARG 10 Cb 0.03 0.46 0.02 0.00 0.06 0.00 0.00 34.95 35.51 2ys4 s ARG 10 CO -0.09 -0.45 -0.07 -1.83 -2.50 0.00 0.00 175.30 170.36 2ys4 s GLU 11 N -3.86 1.15 -0.25 5.12 -1.05 -1.26 -5.12 118.70 113.44 2ys4 s GLU 11 Ca 0.07 -0.19 0.02 0.00 -0.15 0.00 0.00 54.97 54.72 2ys4 s GLU 11 Cb 0.02 -1.12 0.06 0.00 -0.44 0.00 0.00 34.13 32.65 2ys4 s GLU 11 CO -0.07 -0.10 -0.09 0.15 0.95 0.00 0.00 175.26 176.10 2ys4 s LYS 12 N 1.06 1.98 0.41 -4.83 1.02 -1.26 -5.11 119.74 113.02 2ys4 s LYS 12 Ca -0.08 -1.19 -0.24 0.00 0.02 0.00 0.00 55.97 54.48 2ys4 s LYS 12 Cb -0.14 -2.76 -0.08 0.00 -0.52 0.00 0.00 37.83 34.33 2ys4 s LYS 12 CO -0.01 -0.58 1.10 -0.59 -0.92 0.00 0.00 175.35 174.35 2ys4 s PHE 13 N 1.23 3.15 -0.02 3.18 -0.71 -1.26 -5.05 117.98 118.49 2ys4 s PHE 13 Ca -0.08 1.60 0.03 0.00 -1.04 0.00 0.00 56.93 57.45 2ys4 s PHE 13 Cb -0.19 -3.23 -0.00 0.00 -1.21 0.00 0.00 43.02 38.38 2ys4 s PHE 13 CO -0.06 -0.95 -0.10 0.42 -1.34 0.00 0.00 175.22 173.20 2ys4 s ILE 14 N -1.58 0.81 0.52 -4.49 -1.09 -1.26 -5.14 121.20 108.97 2ys4 s ILE 14 Ca 0.59 -0.40 -0.20 0.00 -2.23 0.00 0.00 60.65 58.40 2ys4 s ILE 14 Cb -0.25 -0.71 -0.07 0.00 -1.58 0.00 0.00 42.46 39.85 2ys4 s ILE 14 CO 0.31 0.24 1.12 0.68 -1.23 0.00 0.00 174.94 176.07 2ys4 s VAL 15 N 0.03 3.27 1.24 2.92 -7.23 -1.26 -5.04 120.40 114.34 2ys4 s VAL 15 Ca -0.00 0.82 -0.21 0.00 -1.81 0.00 0.00 61.98 60.78 2ys4 s VAL 15 Cb -0.07 -3.35 0.31 0.00 0.56 0.00 0.00 36.38 33.83 2ys4 s VAL 15 CO 0.00 -0.15 1.10 -0.81 -0.31 0.00 0.00 175.10 174.94 2ys4 n PRO 16 N -1.10 -3.17 -0.06 4.82 -0.04 -1.26 -5.01 135.00 129.17 2ys4 n PRO 16 Ca 0.10 -1.76 -0.17 0.00 -0.04 0.00 0.00 63.50 61.63 2ys4 n PRO 16 Cb 0.51 -1.65 -0.13 0.00 -0.04 0.00 0.00 33.50 32.19 2ys4 n PRO 16 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 2ys4 h ILE 17 N -2.75 1.47 0.07 0.52 2.04 -2.06 -3.40 117.51 113.40 2ys4 h ILE 17 Ca -0.41 -2.32 -0.37 0.00 1.00 0.00 0.00 64.86 62.75 2ys4 h ILE 17 Cb 1.27 3.00 -0.04 0.00 -0.74 0.00 0.00 36.82 40.31 2ys4 h ILE 17 CO 0.27 0.55 -2.18 1.17 0.00 0.00 0.00 178.15 177.96 2ys4 n LYS 18 N -4.46 0.71 -3.12 2.37 4.81 -1.26 -5.01 118.16 112.20 2ys4 n LYS 18 Ca -0.18 0.23 -0.14 0.00 -0.87 0.00 0.00 58.31 57.35 2ys4 n LYS 18 Cb 0.60 -1.63 0.05 0.00 0.02 0.00 0.00 35.03 34.07 2ys4 n LYS 18 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2ys4 n ALA 19 N -3.12 -0.98 -0.03 3.14 0.00 -1.26 -4.95 120.51 113.30 2ys4 n ALA 19 Ca -0.38 0.17 -0.13 0.00 0.00 0.00 0.00 53.44 53.10 2ys4 n ALA 19 Cb 1.02 -3.14 -0.10 0.00 0.00 0.00 0.00 19.45 17.23 2ys4 n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ys4 h ARG 20 N -1.59 0.08 -6.14 0.00 3.08 -1.98 -3.44 114.38 104.39 2ys4 h ARG 20 Ca -0.37 -0.05 -0.71 0.00 0.07 0.00 0.00 59.98 58.92 2ys4 h ARG 20 Cb 1.23 0.01 0.01 0.00 0.08 0.00 0.00 29.97 31.30 2ys4 h ARG 20 CO 0.35 0.62 1.03 0.41 -1.07 0.00 0.00 179.97 181.30 2ys4 n GLY 21 N 0.42 0.91 3.68 0.04 0.00 -1.26 -4.87 105.19 104.11 2ys4 n GLY 21 Ca -0.08 0.92 -0.42 0.00 0.00 0.00 0.00 46.02 46.44 2ys4 n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ys4 s ALA 22 N 4.26 3.59 -0.05 4.61 0.00 -1.26 -5.01 121.76 127.90 2ys4 s ALA 22 Ca 0.99 0.83 0.04 0.00 0.00 0.00 0.00 51.96 53.82 2ys4 s ALA 22 Cb -0.98 -3.62 -0.00 0.00 0.00 0.00 0.00 23.12 18.53 2ys4 s ALA 22 CO 0.61 -1.00 -0.17 1.03 0.00 0.00 0.00 175.76 176.23 2ys4 s ARG 23 N 2.74 1.83 0.21 0.00 0.52 -1.26 -4.97 118.95 118.02 2ys4 s ARG 23 Ca 0.64 -0.60 -0.24 0.00 -0.52 0.00 0.00 55.73 55.01 2ys4 s ARG 23 Cb -0.30 -1.56 -0.08 0.00 0.52 0.00 0.00 34.95 33.52 2ys4 s ARG 23 CO 0.25 0.22 0.79 0.00 0.02 0.00 0.00 175.30 176.58 2ys4 s ALA 24 N 0.12 3.39 0.06 2.13 0.00 -1.26 -3.70 121.76 122.50 2ys4 s ALA 24 Ca -0.06 0.33 0.04 0.00 0.00 0.00 0.00 51.96 52.27 2ys4 s ALA 24 Cb -0.12 -2.96 -0.03 0.00 0.00 0.00 0.00 23.12 20.01 2ys4 s ALA 24 CO 0.03 0.28 -0.11 0.42 0.00 0.00 0.00 175.76 176.37 2ys4 s ILE 25 N -1.36 0.86 0.36 0.00 -1.09 -1.26 -4.93 121.20 113.79 2ys4 s ILE 25 Ca 0.41 -1.19 0.04 0.00 -2.23 0.00 0.00 60.65 57.68 2ys4 s ILE 25 Cb -0.20 -0.86 -0.05 0.00 -1.58 0.00 0.00 42.46 39.76 2ys4 s ILE 25 CO 0.24 -0.28 0.07 -0.76 -1.23 0.00 0.00 174.94 172.99 2ys4 s LEU 26 N -1.63 2.15 -0.29 2.97 2.01 -1.26 -2.60 118.68 120.01 2ys4 s LEU 26 Ca -0.05 -1.48 0.03 0.00 0.01 0.00 0.00 54.13 52.64 2ys4 s LEU 26 Cb -0.10 -0.34 0.07 0.00 0.01 0.00 0.00 46.19 45.84 2ys4 s LEU 26 CO 0.01 -0.71 -0.04 -0.62 1.01 0.00 0.00 176.35 176.00 2ys4 s ASP 27 N -3.55 4.61 -0.02 2.29 2.15 -1.17 -4.77 116.67 116.20 2ys4 s ASP 27 Ca 0.31 -1.67 0.04 0.00 0.43 0.00 0.00 52.55 51.66 2ys4 s ASP 27 Cb 0.07 -1.59 -0.01 0.00 -0.30 0.00 0.00 42.92 41.08 2ys4 s ASP 27 CO 0.15 -0.27 -0.16 -0.36 -0.17 0.00 0.00 175.17 174.36 2ys4 s PHE 28 N 1.04 1.47 0.58 -5.34 0.08 -1.26 -4.41 117.98 110.14 2ys4 s PHE 28 Ca -0.01 -0.33 -0.18 0.00 0.12 0.00 0.00 56.93 56.52 2ys4 s PHE 28 Cb -0.20 -0.97 -0.04 0.00 -0.57 0.00 0.00 43.02 41.24 2ys4 s PHE 28 CO -0.06 -0.08 1.12 -1.25 -0.10 0.00 0.00 175.22 174.86 2ys4 s PRO 29 N -0.19 3.19 0.26 0.24 0.04 -1.26 -4.93 135.00 132.35 2ys4 s PRO 29 Ca 0.02 1.54 -0.02 0.00 0.04 0.00 0.00 61.00 62.59 2ys4 s PRO 29 Cb -0.08 -1.99 0.54 0.00 0.04 0.00 0.00 34.50 33.01 2ys4 s PRO 29 CO 0.00 -0.97 1.70 -0.44 0.04 0.00 0.00 177.00 177.34 2ys4 h ASP 30 N 0.84 0.19 -5.07 6.66 5.19 -1.97 -3.45 116.42 118.82 2ys4 h ASP 30 Ca -0.49 0.14 -0.01 0.00 -0.62 0.00 0.00 57.03 56.05 2ys4 h ASP 30 Cb 1.26 0.15 -0.09 0.00 0.18 0.00 0.00 39.33 40.82 2ys4 h ASP 30 CO 0.56 0.02 0.08 -1.59 -3.12 0.00 0.00 179.24 175.18 2ys4 s LYS 31 N -5.99 1.45 -0.41 3.56 -2.85 -1.26 -2.80 119.74 111.43 2ys4 s LYS 31 Ca -0.12 -0.86 -0.14 0.00 -1.00 0.00 0.00 55.97 53.85 2ys4 s LYS 31 Cb 0.22 0.54 0.04 0.00 -2.06 0.00 0.00 37.83 36.57 2ys4 s LYS 31 CO 0.77 -0.63 0.29 -1.17 0.10 0.00 0.00 175.35 174.71 2ys4 s LEU 32 N -2.88 5.11 -0.50 2.77 1.98 0.22 -4.93 118.68 120.45 2ys4 s LEU 32 Ca 0.09 -1.06 -0.24 0.00 -2.89 0.00 0.00 54.13 50.03 2ys4 s LEU 32 Cb -0.02 -2.11 0.03 0.00 0.66 0.00 0.00 46.19 44.75 2ys4 s LEU 32 CO -0.02 -0.48 0.89 0.21 -1.89 0.00 0.00 176.35 175.06 2ys4 s ASN 33 N 1.86 6.39 -0.42 3.68 3.84 -1.26 -2.30 114.94 126.73 2ys4 s ASN 33 Ca 0.04 -0.19 -0.17 0.00 0.21 0.00 0.00 52.86 52.74 2ys4 s ASN 33 Cb -0.20 -2.42 0.02 0.00 -0.55 0.00 0.00 41.25 38.10 2ys4 s ASN 33 CO 0.08 -1.10 0.42 -0.36 -2.79 0.00 0.00 177.10 173.35 2ys4 s PHE 34 N 3.70 3.18 1.14 0.43 0.40 -1.26 -5.01 117.98 120.57 2ys4 s PHE 34 Ca 0.31 -0.43 -0.17 0.00 -0.60 0.00 0.00 56.93 56.04 2ys4 s PHE 34 Cb -0.12 -2.87 0.17 0.00 0.51 0.00 0.00 43.02 40.71 2ys4 s PHE 34 CO 0.22 -0.70 0.27 -1.13 0.70 0.00 0.00 175.22 174.58 2ys4 n SER 35 N 5.54 -2.76 -4.53 1.36 3.41 -1.26 -3.81 113.62 111.57 2ys4 n SER 35 Ca -0.08 -0.31 -0.48 0.00 -0.26 0.00 0.00 58.87 57.74 2ys4 n SER 35 Cb 0.47 -0.92 -0.05 0.00 -0.26 0.00 0.00 64.21 63.45 2ys4 n SER 35 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 175.04 175.29 2ys4 n THR 36 N -4.65 0.30 -4.31 6.66 -1.04 -1.26 -4.53 114.28 105.45 2ys4 n THR 36 Ca 0.04 -0.29 -0.18 0.00 -2.04 0.00 0.00 64.05 61.57 2ys4 n THR 36 Cb 0.53 -1.95 -0.10 0.00 -1.82 0.00 0.00 70.33 66.98 2ys4 n THR 36 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2ys4 s PRO 38 N -3.28 4.42 0.03 0.00 0.04 -1.26 -2.54 135.00 132.40 2ys4 s PRO 38 Ca 0.18 2.05 -0.22 0.00 0.04 0.00 0.00 61.00 63.04 2ys4 s PRO 38 Cb -0.02 -3.17 -0.12 0.00 0.04 0.00 0.00 34.50 31.22 2ys4 s PRO 38 CO 0.05 -0.18 1.19 -0.24 0.04 0.00 0.00 177.00 177.86 2ys4 h VAL 39 N 3.54 0.00 0.24 -0.36 3.04 -1.89 -3.33 116.25 117.49 2ys4 h VAL 39 Ca -0.46 -0.09 -0.00 0.00 -1.01 0.00 0.00 66.70 65.14 2ys4 h VAL 39 Cb 1.22 0.00 -0.02 0.00 -2.01 0.00 0.00 31.29 30.47 2ys4 h VAL 39 CO 0.74 0.00 -0.35 0.11 -1.01 0.00 0.00 177.57 177.06 2ys4 h LYS 40 N -0.88 -0.59 -6.69 4.17 6.56 -1.84 -3.28 116.57 114.02 2ys4 h LYS 40 Ca -0.08 0.04 -0.47 0.00 -1.06 0.00 0.00 60.65 59.08 2ys4 h LYS 40 Cb 0.61 0.13 0.23 0.00 -0.57 0.00 0.00 32.23 32.63 2ys4 h LYS 40 CO 0.13 -0.39 -1.02 0.66 -2.06 0.00 0.00 179.45 176.77 2ys4 n TYR 41 N -4.47 -1.44 -3.73 -1.35 4.01 -1.25 -4.73 117.16 104.20 2ys4 n TYR 41 Ca -0.07 0.15 -0.26 0.00 -0.16 0.00 0.00 57.90 57.56 2ys4 n TYR 41 Cb 0.30 -1.60 -0.03 0.00 -0.31 0.00 0.00 39.34 37.71 2ys4 n TYR 41 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 2ys4 s SER 42 N -1.86 6.36 0.03 7.72 0.01 -1.26 -4.49 113.70 120.20 2ys4 s SER 42 Ca 0.56 0.33 0.06 0.00 1.31 0.00 0.00 55.95 58.21 2ys4 s SER 42 Cb -0.13 -1.98 -0.03 0.00 0.21 0.00 0.00 66.02 64.09 2ys4 s SER 42 CO 0.66 -0.06 -0.14 -0.89 0.41 0.00 0.00 173.24 173.22 2ys4 s THR 43 N -1.92 3.07 0.12 1.44 2.01 -1.12 -4.91 115.64 114.33 2ys4 s THR 43 Ca 0.37 -1.04 0.08 0.00 0.31 0.00 0.00 61.69 61.41 2ys4 s THR 43 Cb -0.11 -2.31 -0.04 0.00 0.01 0.00 0.00 72.50 70.06 2ys4 s THR 43 CO 0.30 0.36 -0.19 -1.10 -0.69 0.00 0.00 174.62 173.30 2ys4 s GLN 44 N -1.42 1.15 -0.08 4.92 1.11 -1.26 -2.64 119.66 121.44 2ys4 s GLN 44 Ca 0.15 -1.24 -0.30 0.00 0.01 0.00 0.00 55.36 53.99 2ys4 s GLN 44 Cb -0.11 -1.31 0.11 0.00 -1.01 0.00 0.00 33.01 30.70 2ys4 s GLN 44 CO 0.06 0.29 0.91 0.21 0.01 0.00 0.00 175.29 176.77 2ys4 s LYS 45 N -2.26 0.74 0.12 2.91 2.47 -1.18 -5.01 119.74 117.52 2ys4 s LYS 45 Ca 0.09 -0.04 0.08 0.00 -1.56 0.00 0.00 55.97 54.55 2ys4 s LYS 45 Cb -0.08 0.35 -0.04 0.00 -1.46 0.00 0.00 37.83 36.60 2ys4 s LYS 45 CO 0.05 -0.28 -0.20 0.42 0.16 0.00 0.00 175.35 175.50 2ys4 s ILE 46 N -2.01 1.75 -0.18 5.43 1.01 -1.26 -0.97 121.20 124.98 2ys4 s ILE 46 Ca 0.00 -1.64 -0.04 0.00 0.00 0.00 0.00 60.65 58.97 2ys4 s ILE 46 Cb -0.01 -1.64 0.06 0.00 0.01 0.00 0.00 42.46 40.88 2ys4 s ILE 46 CO -0.02 -0.12 0.05 -0.22 0.00 0.00 0.00 174.94 174.63 2ys4 s LEU 47 N -2.10 0.85 -0.13 2.97 2.96 -0.57 -4.89 118.68 117.78 2ys4 s LEU 47 Ca 0.09 -0.71 -0.29 0.00 -0.22 0.00 0.00 54.13 52.99 2ys4 s LEU 47 Cb -0.09 -0.46 -0.02 0.00 0.50 0.00 0.00 46.19 46.12 2ys4 s LEU 47 CO 0.05 -0.32 1.26 -0.22 -1.32 0.00 0.00 176.35 175.81 2ys4 s LEU 48 N 1.96 4.21 -0.17 -0.68 1.98 -1.26 -1.66 118.68 123.07 2ys4 s LEU 48 Ca 0.00 1.75 -0.04 0.00 -2.89 0.00 0.00 54.13 52.95 2ys4 s LEU 48 Cb -0.16 -3.54 -0.02 0.00 0.66 0.00 0.00 46.19 43.12 2ys4 s LEU 48 CO -0.08 -0.73 -0.04 -0.69 -1.89 0.00 0.00 176.35 172.92 2ys4 s VAL 49 N 3.20 3.77 -0.14 1.68 1.01 0.91 -4.93 120.40 125.89 2ys4 s VAL 49 Ca 0.56 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 62.15 2ys4 s VAL 49 Cb -0.23 -2.66 -0.01 0.00 0.00 0.00 0.00 36.38 33.48 2ys4 s VAL 49 CO 0.17 0.48 -0.14 -0.60 0.00 0.00 0.00 175.10 175.00 2ys4 s ARG 50 N 0.59 3.29 -0.58 2.72 3.52 -1.26 -0.88 118.95 126.34 2ys4 s ARG 50 Ca -0.03 -0.72 -0.27 0.00 -0.13 0.00 0.00 55.73 54.58 2ys4 s ARG 50 Cb -0.14 -2.62 -0.01 0.00 -1.56 0.00 0.00 34.95 30.61 2ys4 s ARG 50 CO 0.03 0.11 1.71 1.21 -0.81 0.00 0.00 175.30 177.55 2ys4 s ASN 51 N 0.59 5.60 -0.12 -2.12 3.84 -1.06 -3.05 114.94 118.62 2ys4 s ASN 51 Ca -0.08 0.35 0.16 0.00 0.21 0.00 0.00 52.86 53.49 2ys4 s ASN 51 Cb -0.16 -2.54 0.65 0.00 -0.55 0.00 0.00 41.25 38.66 2ys4 s ASN 51 CO 0.03 -2.12 1.54 2.30 -2.79 0.00 0.00 177.10 176.06 2ys4 n ILE 52 N 7.08 1.74 -2.45 -5.21 -5.35 -1.07 -3.38 119.36 110.72 2ys4 n ILE 52 Ca 0.17 -1.07 -0.02 0.00 -0.27 0.00 0.00 62.75 61.57 2ys4 n ILE 52 Cb 0.51 0.01 0.01 0.00 -1.74 0.00 0.00 39.64 38.43 2ys4 n ILE 52 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2ys4 n GLY 53 N 0.97 1.04 0.13 3.28 0.00 -1.14 -4.75 105.19 104.73 2ys4 n GLY 53 Ca 0.23 -2.00 -0.25 0.00 0.00 0.00 0.00 46.02 44.00 2ys4 n GLY 53 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2ys4 n ASN 54 N -2.98 1.96 -4.85 1.61 0.23 -1.24 -4.80 115.26 105.19 2ys4 n ASN 54 Ca 0.01 0.23 -0.23 0.00 -0.53 0.00 0.00 54.58 54.06 2ys4 n ASN 54 Cb 0.04 -0.76 -0.03 0.00 -2.08 0.00 0.00 39.78 36.95 2ys4 n ASN 54 CO 0.00 0.00 0.00 -0.75 -0.93 0.00 0.00 177.26 175.58 2ys4 s LYS 55 N -2.49 2.37 0.23 -3.83 2.20 -1.26 -4.79 119.74 112.17 2ys4 s LYS 55 Ca -0.35 -1.76 -0.31 0.00 -0.36 0.00 0.00 55.97 53.19 2ys4 s LYS 55 Cb 0.11 -2.19 -0.14 0.00 -1.51 0.00 0.00 37.83 34.10 2ys4 s LYS 55 CO 0.56 -0.30 1.27 0.27 -0.36 0.00 0.00 175.35 176.79 2ys4 n ASN 56 N -1.53 2.11 -4.61 1.43 6.94 -1.26 -4.56 115.26 113.78 2ys4 n ASN 56 Ca 0.01 1.15 -0.34 0.00 -0.02 0.00 0.00 54.58 55.38 2ys4 n ASN 56 Cb 0.63 -1.34 -0.10 0.00 -2.36 0.00 0.00 39.78 36.60 2ys4 n ASN 56 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2ys4 s ALA 57 N -0.29 3.21 -0.26 -2.53 0.00 -0.84 -4.65 121.76 116.40 2ys4 s ALA 57 Ca 0.68 -0.80 0.02 0.00 0.00 0.00 0.00 51.96 51.86 2ys4 s ALA 57 Cb -0.72 -1.58 0.06 0.00 0.00 0.00 0.00 23.12 20.89 2ys4 s ALA 57 CO 0.52 0.39 -0.07 0.08 0.00 0.00 0.00 175.76 176.68 2ys4 s VAL 58 N -0.24 1.96 0.19 0.00 1.01 -1.26 -2.52 120.40 119.55 2ys4 s VAL 58 Ca 0.06 -1.58 0.10 0.00 0.00 0.00 0.00 61.98 60.56 2ys4 s VAL 58 Cb -0.12 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 34.05 2ys4 s VAL 58 CO 0.02 -0.12 -0.18 0.72 0.00 0.00 0.00 175.10 175.54 2ys4 s PHE 59 N 1.18 2.44 -0.20 5.22 -0.71 -1.21 -1.98 117.98 122.71 2ys4 s PHE 59 Ca -0.06 -0.30 -0.04 0.00 -1.04 0.00 0.00 56.93 55.49 2ys4 s PHE 59 Cb -0.19 -1.19 0.10 0.00 -1.21 0.00 0.00 43.02 40.52 2ys4 s PHE 59 CO -0.06 0.52 0.24 -1.58 -1.34 0.00 0.00 175.22 173.00 2ys4 s HIS 60 N -1.75 -0.35 0.03 3.49 2.46 -1.03 -2.85 115.29 115.30 2ys4 s HIS 60 Ca 0.23 0.33 -0.08 0.00 0.47 0.00 0.00 55.06 56.01 2ys4 s HIS 60 Cb -0.08 -0.30 -0.05 0.00 -0.13 0.00 0.00 32.58 32.02 2ys4 s HIS 60 CO 0.12 -0.61 0.32 0.42 -2.47 0.00 0.00 174.74 172.53 2ys4 s ILE 61 N 2.36 5.21 -0.03 0.89 1.09 0.18 -1.94 121.20 128.97 2ys4 s ILE 61 Ca 0.07 0.30 0.00 0.00 -1.10 0.00 0.00 60.65 59.93 2ys4 s ILE 61 Cb -0.16 -3.60 0.03 0.00 -1.06 0.00 0.00 42.46 37.67 2ys4 s ILE 61 CO -0.12 0.34 0.02 -0.54 -0.10 0.00 0.00 174.94 174.54 2ys4 s LYS 62 N -1.79 0.13 0.23 2.79 -0.14 -1.26 -4.54 119.74 115.15 2ys4 s LYS 62 Ca 0.29 0.14 -0.19 0.00 -1.36 0.00 0.00 55.97 54.85 2ys4 s LYS 62 Cb -0.14 -0.38 0.03 0.00 -1.68 0.00 0.00 37.83 35.66 2ys4 s LYS 62 CO 0.17 -0.16 0.61 -0.08 -0.76 0.00 0.00 175.35 175.13 2ys4 s THR 63 N 1.10 0.01 0.18 2.17 -1.32 -1.26 -4.78 115.64 111.74 2ys4 s THR 63 Ca -0.09 -0.79 0.07 0.00 -1.21 0.00 0.00 61.69 59.68 2ys4 s THR 63 Cb -0.13 -1.70 -0.04 0.00 -1.51 0.00 0.00 72.50 69.11 2ys4 s THR 63 CO -0.02 -0.04 -0.15 0.00 -2.21 0.00 0.00 174.62 172.20 2ys4 n ARG 65 N -0.16 -0.58 0.00 0.00 1.74 -1.26 -2.16 116.66 114.24 2ys4 n ARG 65 Ca -0.10 -0.13 0.08 0.00 -0.77 0.00 0.00 57.85 56.93 2ys4 n ARG 65 Cb 0.59 -1.80 0.44 0.00 -1.02 0.00 0.00 32.46 30.68 2ys4 n ARG 65 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2ys4 n PRO 66 N -1.66 0.42 -3.55 5.56 -0.04 -1.26 -4.99 135.00 129.47 2ys4 n PRO 66 Ca 0.05 0.04 -0.37 0.00 -0.04 0.00 0.00 63.50 63.18 2ys4 n PRO 66 Cb 0.56 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.45 2ys4 n PRO 66 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2ys4 s PHE 67 N -2.15 3.52 0.04 0.54 0.08 -0.92 -1.78 117.98 117.30 2ys4 s PHE 67 Ca 0.21 0.66 -0.24 0.00 0.12 0.00 0.00 56.93 57.68 2ys4 s PHE 67 Cb 0.11 -2.31 0.06 0.00 -0.57 0.00 0.00 43.02 40.31 2ys4 s PHE 67 CO 0.19 0.34 0.57 -1.12 -0.10 0.00 0.00 175.22 175.10 2ys4 s SER 68 N 0.11 -0.51 0.19 1.36 0.01 0.13 -3.14 113.70 111.84 2ys4 s SER 68 Ca 0.18 0.27 -0.10 0.00 1.31 0.00 0.00 55.95 57.61 2ys4 s SER 68 Cb -0.14 0.52 -0.01 0.00 0.21 0.00 0.00 66.02 66.60 2ys4 s SER 68 CO 0.06 -0.73 0.33 0.27 0.41 0.00 0.00 173.24 173.58 2ys4 s ILE 69 N -2.33 0.04 -0.16 1.44 -0.00 -1.26 0.10 121.20 119.04 2ys4 s ILE 69 Ca -0.06 -1.38 -0.29 0.00 -0.00 0.00 0.00 60.65 58.92 2ys4 s ILE 69 Cb -0.01 -1.93 0.11 0.00 -0.00 0.00 0.00 42.46 40.63 2ys4 s ILE 69 CO -0.01 -0.20 0.93 -0.70 -0.00 0.00 0.00 174.94 174.96 2ys4 s GLU 70 N -3.98 0.68 0.15 0.37 2.12 -0.92 -3.90 118.70 113.22 2ys4 s GLU 70 Ca 0.19 0.26 -0.31 0.00 0.36 0.00 0.00 54.97 55.48 2ys4 s GLU 70 Cb 0.02 0.32 -0.08 0.00 0.26 0.00 0.00 34.13 34.65 2ys4 s GLU 70 CO 0.02 -0.19 1.33 -1.25 -0.54 0.00 0.00 175.26 174.63 2ys4 s PRO 71 N -0.87 4.37 0.59 4.30 0.04 -1.26 -2.50 135.00 139.66 2ys4 s PRO 71 Ca -0.03 2.04 0.29 0.00 0.04 0.00 0.00 61.00 63.34 2ys4 s PRO 71 Cb -0.01 -3.23 1.45 0.00 0.04 0.00 0.00 34.50 32.75 2ys4 s PRO 71 CO 0.02 -0.32 1.86 0.00 0.04 0.00 0.00 177.00 178.59 2ys4 h ALA 72 N 6.06 2.30 -2.91 8.56 0.00 -1.84 -3.41 119.26 128.02 2ys4 h ALA 72 Ca -0.43 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.30 2ys4 h ALA 72 Cb 1.21 0.04 -0.22 0.00 0.00 0.00 0.00 17.79 18.82 2ys4 h ALA 72 CO 0.81 -0.83 -0.50 -1.50 0.00 0.00 0.00 179.25 177.24 2ys4 s ILE 73 N -4.64 0.06 0.30 0.00 2.07 -1.26 0.48 121.20 118.21 2ys4 s ILE 73 Ca -0.04 -0.50 -0.18 0.00 -1.41 0.00 0.00 60.65 58.52 2ys4 s ILE 73 Cb 0.16 -0.38 0.07 0.00 0.13 0.00 0.00 42.46 42.44 2ys4 s ILE 73 CO 0.57 -0.27 0.91 -0.83 -1.91 0.00 0.00 174.94 173.41 2ys4 s GLY 74 N -0.97 0.30 -0.05 1.50 0.00 -1.13 -5.04 107.32 101.92 2ys4 s GLY 74 Ca -0.11 -0.61 0.01 0.00 0.00 0.00 0.00 44.72 44.01 2ys4 s GLY 74 CO 0.01 1.12 -0.04 -0.51 0.00 0.00 0.00 173.10 173.68 2ys4 s THR 75 N -2.09 0.56 -0.06 0.90 -4.23 -1.26 -3.31 115.64 106.15 2ys4 s THR 75 Ca 0.19 -0.11 0.05 0.00 -1.18 0.00 0.00 61.69 60.65 2ys4 s THR 75 Cb -0.04 -0.59 -0.02 0.00 1.34 0.00 0.00 72.50 73.19 2ys4 s THR 75 CO 0.09 0.24 -0.22 -0.22 -0.54 0.00 0.00 174.62 173.97 2ys4 s LEU 76 N 1.07 2.26 0.14 4.79 2.96 -1.05 -5.02 118.68 123.84 2ys4 s LEU 76 Ca -0.09 -0.42 -0.00 0.00 -0.22 0.00 0.00 54.13 53.40 2ys4 s LEU 76 Cb -0.14 -1.43 -0.04 0.00 0.50 0.00 0.00 46.19 45.08 2ys4 s LEU 76 CO -0.01 0.27 0.31 0.20 -1.32 0.00 0.00 176.35 175.80 2ys4 s ASN 77 N -0.31 6.38 0.26 3.68 0.01 -1.26 -1.98 114.94 121.72 2ys4 s ASN 77 Ca 0.01 0.34 -0.31 0.00 -0.71 0.00 0.00 52.86 52.19 2ys4 s ASN 77 Cb -0.13 -1.98 -0.12 0.00 0.41 0.00 0.00 41.25 39.43 2ys4 s ASN 77 CO 0.02 0.06 1.65 0.52 -1.51 0.00 0.00 177.10 177.84 2ys4 n VAL 78 N -0.24 0.66 0.00 1.60 0.31 -1.26 -1.88 118.33 117.52 2ys4 n VAL 78 Ca -0.05 -0.17 0.00 0.00 -0.01 0.00 0.00 64.34 64.11 2ys4 n VAL 78 Cb 0.53 -1.98 0.00 0.00 -0.91 0.00 0.00 33.84 31.48 2ys4 n VAL 78 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2ys4 n GLY 79 N 2.80 3.08 3.97 2.92 0.00 -1.22 -5.02 105.19 111.71 2ys4 n GLY 79 Ca 0.11 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 2ys4 n GLY 79 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ys4 s GLU 80 N -0.29 2.64 0.28 1.61 0.41 -0.79 -4.96 118.70 117.61 2ys4 s GLU 80 Ca 0.00 -1.42 0.02 0.00 -0.41 0.00 0.00 54.97 53.16 2ys4 s GLU 80 Cb 0.00 -2.59 -0.03 0.00 -1.78 0.00 0.00 34.13 29.73 2ys4 s GLU 80 CO 0.00 -0.34 0.26 -1.12 -0.49 0.00 0.00 175.26 173.57 2ys4 s SER 81 N -4.32 0.94 0.34 -0.19 0.01 -1.26 -2.56 113.70 106.66 2ys4 s SER 81 Ca 0.53 -1.55 -0.11 0.00 1.31 0.00 0.00 55.95 56.13 2ys4 s SER 81 Cb -0.07 0.51 0.02 0.00 0.21 0.00 0.00 66.02 66.69 2ys4 s SER 81 CO 0.32 -1.02 0.61 0.00 0.41 0.00 0.00 173.24 173.56 2ys4 s MET 82 N -3.68 1.95 0.10 12.44 0.23 -0.06 -4.96 119.30 125.32 2ys4 s MET 82 Ca 0.38 -1.49 0.10 0.00 -1.03 0.00 0.00 55.69 53.64 2ys4 s MET 82 Cb 0.04 0.53 -0.04 0.00 -1.53 0.00 0.00 34.83 33.83 2ys4 s MET 82 CO 0.20 -0.86 -0.25 -0.65 -2.03 0.00 0.00 175.02 171.44 2ys4 s GLN 83 N -3.03 1.39 -0.19 3.16 -0.21 -1.26 -0.06 119.66 119.46 2ys4 s GLN 83 Ca 0.22 -1.21 0.00 0.00 0.02 0.00 0.00 55.36 54.39 2ys4 s GLN 83 Cb -0.03 -1.73 0.04 0.00 1.00 0.00 0.00 33.01 32.30 2ys4 s GLN 83 CO 0.14 0.42 -0.07 -0.51 -2.12 0.00 0.00 175.29 173.15 2ys4 s LEU 84 N -1.78 1.95 -0.58 2.90 1.43 -0.67 -4.81 118.68 117.11 2ys4 s LEU 84 Ca 0.11 -0.81 -0.24 0.00 -1.03 0.00 0.00 54.13 52.16 2ys4 s LEU 84 Cb -0.10 -1.05 0.04 0.00 0.03 0.00 0.00 46.19 45.12 2ys4 s LEU 84 CO 0.04 -0.18 0.99 -1.61 0.23 0.00 0.00 176.35 175.82 2ys4 s GLU 85 N 1.53 3.30 -0.39 1.70 2.02 -1.04 -1.50 118.70 124.32 2ys4 s GLU 85 Ca -0.01 -0.31 -0.17 0.00 0.02 0.00 0.00 54.97 54.50 2ys4 s GLU 85 Cb -0.16 -4.09 0.01 0.00 0.10 0.00 0.00 34.13 29.99 2ys4 s GLU 85 CO -0.08 -1.60 0.43 0.08 0.02 0.00 0.00 175.26 174.11 2ys4 s VAL 86 N 4.17 5.10 -0.17 2.63 1.01 -0.14 -2.16 120.40 130.84 2ys4 s VAL 86 Ca 0.30 -0.11 -0.09 0.00 0.00 0.00 0.00 61.98 62.09 2ys4 s VAL 86 Cb -0.13 -3.96 -0.05 0.00 0.00 0.00 0.00 36.38 32.25 2ys4 s VAL 86 CO 0.18 -0.29 0.12 -0.70 0.00 0.00 0.00 175.10 174.41 2ys4 s GLU 87 N 2.15 3.92 -0.25 2.72 2.12 0.29 -3.13 118.70 126.53 2ys4 s GLU 87 Ca 0.13 -0.22 -0.02 0.00 0.36 0.00 0.00 54.97 55.22 2ys4 s GLU 87 Cb -0.17 -3.31 0.12 0.00 0.26 0.00 0.00 34.13 31.04 2ys4 s GLU 87 CO 0.13 0.44 0.31 0.12 -0.54 0.00 0.00 175.26 175.72 2ys4 s PHE 88 N -0.07 -0.56 -0.36 5.30 5.36 -1.08 0.19 117.98 126.76 2ys4 s PHE 88 Ca 0.09 0.32 0.00 0.00 -0.96 0.00 0.00 56.93 56.38 2ys4 s PHE 88 Cb -0.11 -0.25 0.09 0.00 -0.34 0.00 0.00 43.02 42.41 2ys4 s PHE 88 CO 0.00 -0.76 0.10 -2.00 -1.46 0.00 0.00 175.22 171.10 2ys4 s GLU 89 N 2.42 1.88 1.05 10.12 2.12 -0.73 -2.80 118.70 132.75 2ys4 s GLU 89 Ca 0.10 -1.74 -0.14 0.00 0.36 0.00 0.00 54.97 53.55 2ys4 s GLU 89 Cb -0.15 -3.34 0.21 0.00 0.26 0.00 0.00 34.13 31.11 2ys4 s GLU 89 CO -0.20 -0.93 1.10 -1.25 -0.54 0.00 0.00 175.26 173.43 2ys4 s PRO 90 N 1.06 0.04 -0.02 4.30 0.04 -1.24 -4.70 135.00 134.48 2ys4 s PRO 90 Ca 0.06 0.39 0.01 0.00 0.04 0.00 0.00 61.00 61.50 2ys4 s PRO 90 Cb -0.21 -1.70 -0.02 0.00 0.04 0.00 0.00 34.50 32.61 2ys4 s PRO 90 CO -0.05 -2.97 -0.01 1.04 0.04 0.00 0.00 177.00 175.05 2ys4 n GLN 91 N -4.32 1.11 -3.98 4.56 1.13 -1.26 -4.24 117.38 110.38 2ys4 n GLN 91 Ca 0.06 0.01 -0.35 0.00 -1.94 0.00 0.00 57.00 54.78 2ys4 n GLN 91 Cb 0.58 -1.05 -0.12 0.00 0.11 0.00 0.00 30.24 29.75 2ys4 n GLN 91 CO 0.00 0.00 0.00 -1.12 -1.44 0.00 0.00 177.06 174.50 2ys4 s SER 92 N -3.96 4.91 0.22 1.08 0.01 -1.26 -4.68 113.70 110.01 2ys4 s SER 92 Ca -0.03 -0.20 -0.32 0.00 1.31 0.00 0.00 55.95 56.71 2ys4 s SER 92 Cb 0.01 -1.85 -0.13 0.00 0.21 0.00 0.00 66.02 64.26 2ys4 s SER 92 CO 0.07 0.04 1.58 0.55 0.41 0.00 0.00 173.24 175.89 2ys4 n VAL 93 N 4.42 0.40 0.00 3.43 3.14 -1.26 -4.89 118.33 123.58 2ys4 n VAL 93 Ca -0.17 -0.10 0.00 0.00 -2.96 0.00 0.00 64.34 61.11 2ys4 n VAL 93 Cb 0.52 -1.72 0.00 0.00 -1.06 0.00 0.00 33.84 31.57 2ys4 n VAL 93 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 2ys4 n GLY 94 N 3.04 2.68 3.63 7.55 0.00 -1.25 -4.98 105.19 115.86 2ys4 n GLY 94 Ca 0.14 -1.33 -0.43 0.00 0.00 0.00 0.00 46.02 44.40 2ys4 n GLY 94 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2ys4 s ASP 95 N 0.00 5.95 -0.18 1.61 -4.77 -1.26 -2.76 116.67 115.26 2ys4 s ASP 95 Ca 0.00 2.15 -0.05 0.00 -3.30 0.00 0.00 52.55 51.36 2ys4 s ASP 95 Cb 0.00 -2.52 -0.03 0.00 -1.09 0.00 0.00 42.92 39.28 2ys4 s ASP 95 CO 0.00 -1.53 -0.01 -1.00 0.70 0.00 0.00 175.17 173.33 2ys4 s HIS 96 N 6.46 3.05 -0.00 2.11 3.76 -1.26 -4.98 115.29 124.43 2ys4 s HIS 96 Ca 0.92 -0.34 -0.09 0.00 -0.15 0.00 0.00 55.06 55.40 2ys4 s HIS 96 Cb -0.36 -2.02 0.01 0.00 1.11 0.00 0.00 32.58 31.32 2ys4 s HIS 96 CO 0.37 -0.11 0.18 0.45 -0.85 0.00 0.00 174.74 174.77 2ys4 s SER 97 N 0.65 -0.02 0.00 1.40 0.15 -1.26 -1.74 113.70 112.88 2ys4 s SER 97 Ca -0.01 -0.15 0.00 0.00 0.70 0.00 0.00 55.95 56.49 2ys4 s SER 97 Cb -0.14 0.23 0.00 0.00 -1.71 0.00 0.00 66.02 64.40 2ys4 s SER 97 CO 0.02 -0.39 0.00 0.61 1.20 0.00 0.00 173.24 174.68 2ys4 n GLY 98 N 1.40 3.85 3.45 9.45 0.00 -0.74 -4.89 105.19 117.72 2ys4 n GLY 98 Ca -0.23 -0.64 -0.12 0.00 0.00 0.00 0.00 46.02 45.04 2ys4 n GLY 98 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2ys4 s ARG 99 N 1.94 0.61 -0.32 1.61 3.52 -1.26 -0.64 118.95 124.41 2ys4 s ARG 99 Ca 0.00 0.86 -0.09 0.00 -0.13 0.00 0.00 55.73 56.38 2ys4 s ARG 99 Cb 0.00 0.21 0.00 0.00 -1.56 0.00 0.00 34.95 33.61 2ys4 s ARG 99 CO 0.00 -0.11 0.14 -0.51 -0.81 0.00 0.00 175.30 174.01 2ys4 s LEU 100 N 0.78 4.13 -0.43 -0.88 1.43 0.81 -4.87 118.68 119.63 2ys4 s LEU 100 Ca -0.04 -0.67 -0.14 0.00 -1.03 0.00 0.00 54.13 52.25 2ys4 s LEU 100 Cb -0.05 -1.96 0.05 0.00 0.03 0.00 0.00 46.19 44.26 2ys4 s LEU 100 CO -0.06 -0.23 0.33 -0.63 0.23 0.00 0.00 176.35 175.99 2ys4 s ILE 101 N 1.56 5.07 -0.01 -0.59 1.01 -1.26 -0.81 121.20 126.18 2ys4 s ILE 101 Ca 0.03 -0.93 -0.24 0.00 0.00 0.00 0.00 60.65 59.52 2ys4 s ILE 101 Cb -0.17 -3.94 -0.05 0.00 0.01 0.00 0.00 42.46 38.31 2ys4 s ILE 101 CO 0.05 -0.44 0.73 -0.69 0.00 0.00 0.00 174.94 174.59 2ys4 s VAL 102 N 1.62 4.88 -0.44 2.92 1.01 -0.33 -4.38 120.40 125.69 2ys4 s VAL 102 Ca 0.04 1.53 -0.11 0.00 0.00 0.00 0.00 61.98 63.45 2ys4 s VAL 102 Cb -0.22 -4.07 0.08 0.00 0.00 0.00 0.00 36.38 32.17 2ys4 s VAL 102 CO 0.07 0.32 0.30 0.00 0.00 0.00 0.00 175.10 175.79 2ys4 s TYR 104 N 1.46 2.45 -2.23 0.00 1.51 -1.05 -2.45 117.35 117.05 2ys4 s TYR 104 Ca 0.03 1.25 0.21 0.00 -1.01 0.00 0.00 57.07 57.56 2ys4 s TYR 104 Cb -0.24 -3.14 0.86 0.00 -0.11 0.00 0.00 41.96 39.33 2ys4 s TYR 104 CO 0.03 -2.20 1.60 -3.47 -1.11 0.00 0.00 175.55 170.40 2ys4 n ASP 105 N -3.75 1.28 -0.05 2.29 2.03 -0.84 -3.90 116.55 113.61 2ys4 n ASP 105 Ca 0.07 -1.62 -0.07 0.00 0.52 0.00 0.00 54.79 53.69 2ys4 n ASP 105 Cb 0.55 -0.07 -0.05 0.00 -0.72 0.00 0.00 41.12 40.82 2ys4 n ASP 105 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2ys4 n THR 106 N 0.06 0.61 0.00 5.18 -1.04 -1.26 -5.03 114.28 112.80 2ys4 n THR 106 Ca 0.16 -0.26 0.00 0.00 -2.04 0.00 0.00 64.05 61.91 2ys4 n THR 106 Cb 0.27 -0.86 0.00 0.00 -1.82 0.00 0.00 70.33 67.92 2ys4 n THR 106 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2ys4 n GLY 107 N 2.88 0.71 3.65 3.41 0.00 -1.25 -5.14 105.19 109.44 2ys4 n GLY 107 Ca -0.18 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.54 2ys4 n GLY 107 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ys4 s GLU 108 N 0.00 0.77 -0.18 1.61 2.02 -1.26 -4.82 118.70 116.83 2ys4 s GLU 108 Ca 0.00 1.36 -0.08 0.00 0.02 0.00 0.00 54.97 56.27 2ys4 s GLU 108 Cb 0.00 -1.71 0.08 0.00 0.10 0.00 0.00 34.13 32.59 2ys4 s GLU 108 CO 0.00 -2.74 0.41 0.21 0.02 0.00 0.00 175.26 173.16 2ys4 s LYS 109 N -4.65 0.35 0.10 1.61 2.20 -1.26 -2.53 119.74 115.56 2ys4 s LYS 109 Ca 0.66 0.92 0.06 0.00 -0.36 0.00 0.00 55.97 57.26 2ys4 s LYS 109 Cb -0.23 0.17 -0.04 0.00 -1.51 0.00 0.00 37.83 36.22 2ys4 s LYS 109 CO 0.59 -0.21 -0.07 0.54 -0.36 0.00 0.00 175.35 175.84 2ys4 s VAL 110 N 2.09 3.57 -0.07 4.02 0.11 -1.18 -4.94 120.40 123.99 2ys4 s VAL 110 Ca -0.05 -1.19 0.05 0.00 -2.93 0.00 0.00 61.98 57.86 2ys4 s VAL 110 Cb -0.10 -2.69 -0.01 0.00 -1.53 0.00 0.00 36.38 32.05 2ys4 s VAL 110 CO -0.13 0.10 -0.24 -0.36 -3.33 0.00 0.00 175.10 171.15 2ys4 s PHE 111 N -1.26 2.42 -0.29 1.54 0.40 -1.25 -1.18 117.98 118.35 2ys4 s PHE 111 Ca 0.23 -0.82 -0.01 0.00 -0.60 0.00 0.00 56.93 55.72 2ys4 s PHE 111 Cb -0.11 -1.60 0.09 0.00 0.51 0.00 0.00 43.02 41.91 2ys4 s PHE 111 CO 0.15 -0.29 0.08 0.08 0.70 0.00 0.00 175.22 175.95 2ys4 s VAL 112 N 0.04 0.80 0.55 -0.44 1.01 0.01 -4.88 120.40 117.50 2ys4 s VAL 112 Ca -0.09 -1.23 -0.20 0.00 0.00 0.00 0.00 61.98 60.46 2ys4 s VAL 112 Cb -0.15 -1.54 -0.07 0.00 0.00 0.00 0.00 36.38 34.62 2ys4 s VAL 112 CO 0.05 -0.58 0.91 -1.20 0.00 0.00 0.00 175.10 174.29 2ys4 n SER 113 N 4.89 0.65 -4.62 3.32 7.64 -1.12 -0.14 113.62 124.24 2ys4 n SER 113 Ca -0.04 0.86 -0.25 0.00 1.01 0.00 0.00 58.87 60.45 2ys4 n SER 113 Cb 0.43 -1.35 -0.08 0.00 -1.01 0.00 0.00 64.21 62.20 2ys4 n SER 113 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2ys4 s LEU 114 N -1.22 3.13 0.25 -3.43 1.43 0.19 -0.61 118.68 118.43 2ys4 s LEU 114 Ca 0.71 -0.57 -0.13 0.00 -1.03 0.00 0.00 54.13 53.11 2ys4 s LEU 114 Cb -0.46 -1.74 -0.00 0.00 0.03 0.00 0.00 46.19 44.02 2ys4 s LEU 114 CO 0.51 0.06 0.49 -0.31 0.23 0.00 0.00 176.35 177.32 2ys4 s TYR 115 N -1.99 0.35 0.00 0.29 2.02 -0.97 -1.80 117.35 115.26 2ys4 s TYR 115 Ca 0.28 -0.72 0.00 0.00 -0.37 0.00 0.00 57.07 56.26 2ys4 s TYR 115 Cb -0.08 0.21 0.00 0.00 -0.40 0.00 0.00 41.96 41.69 2ys4 s TYR 115 CO 0.18 -1.01 0.00 0.41 -1.57 0.00 0.00 175.55 173.56 2ys4 n GLY 116 N -0.39 -1.78 3.50 0.71 0.00 -0.71 -4.02 105.19 102.50 2ys4 n GLY 116 Ca -0.02 0.64 -0.43 0.00 0.00 0.00 0.00 46.02 46.21 2ys4 n GLY 116 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ys4 n ALA 117 N 0.00 0.83 -1.92 4.61 0.00 -1.25 -4.02 120.51 118.76 2ys4 n ALA 117 Ca 0.00 -0.44 -0.29 0.00 0.00 0.00 0.00 53.44 52.71 2ys4 n ALA 117 Cb 0.00 -2.74 0.05 0.00 0.00 0.00 0.00 19.45 16.76 2ys4 n ALA 117 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ys4 s ALA 118 N 9.55 2.95 -0.00 0.00 0.00 -1.11 -3.06 121.76 130.08 2ys4 s ALA 118 Ca 1.11 -0.46 0.00 0.00 0.00 0.00 0.00 51.96 52.61 2ys4 s ALA 118 Cb -0.68 -2.93 0.00 0.00 0.00 0.00 0.00 23.12 19.52 2ys4 s ALA 118 CO 0.40 -1.14 0.00 0.96 0.00 0.00 0.00 175.76 175.98 2ys4 s ILE 119 N -3.31 0.00 -0.31 0.00 -5.25 -1.05 -3.86 121.20 107.42 2ys4 s ILE 119 Ca 0.58 0.01 -0.32 0.00 -0.99 0.00 0.00 60.65 59.94 2ys4 s ILE 119 Cb -0.11 -0.02 -0.09 0.00 2.95 0.00 0.00 42.46 45.19 2ys4 s ILE 119 CO 0.50 0.01 2.22 0.47 -1.79 0.00 0.00 174.94 176.35 2ys4 n ASP 120 N 3.17 2.59 -0.07 4.36 9.92 -1.26 -3.23 116.55 132.02 2ys4 n ASP 120 Ca -0.13 0.27 -0.11 0.00 -0.53 0.00 0.00 54.79 54.29 2ys4 n ASP 120 Cb 0.59 -1.40 -0.08 0.00 -0.64 0.00 0.00 41.12 39.59 2ys4 n ASP 120 CO 0.00 0.00 0.00 0.24 0.13 0.00 0.00 177.20 177.57 2ys4 h MET 121 N 13.89 0.00 0.00 -1.24 2.86 -1.98 -3.50 114.93 124.97 2ys4 h MET 121 Ca -0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.32 2ys4 h MET 121 Cb 1.28 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.94 2ys4 h MET 121 CO 1.01 0.65 0.00 0.09 1.06 0.00 0.00 176.91 179.72