#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ys4 s SER 2 N 0.00 6.73 0.80 1.61 0.15 -1.26 -5.08 113.70 116.65 2ys4 s SER 2 Ca 0.00 0.86 -0.11 0.00 0.70 0.00 0.00 55.95 57.41 2ys4 s SER 2 Cb 0.00 -2.29 0.10 0.00 -1.71 0.00 0.00 66.02 62.12 2ys4 s SER 2 CO 0.00 0.07 1.15 -0.55 1.20 0.00 0.00 173.24 175.11 2ys4 s SER 3 N 0.27 4.34 0.00 5.45 0.15 -1.26 -4.80 113.70 117.84 2ys4 s SER 3 Ca 0.26 0.55 0.00 0.00 0.70 0.00 0.00 55.95 57.45 2ys4 s SER 3 Cb -0.16 -1.00 0.00 0.00 -1.71 0.00 0.00 66.02 63.16 2ys4 s SER 3 CO 0.11 -1.97 0.00 0.61 1.20 0.00 0.00 173.24 173.20 2ys4 n GLY 4 N -3.26 0.71 0.13 9.45 0.00 -1.26 -5.05 105.19 105.91 2ys4 n GLY 4 Ca 0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.90 2ys4 n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2ys4 h SER 5 N 0.00 0.64 -4.15 1.61 4.64 -2.02 -3.46 113.55 110.81 2ys4 h SER 5 Ca 0.00 -0.91 -0.51 0.00 -0.47 0.00 0.00 61.79 59.89 2ys4 h SER 5 Cb 0.00 -0.21 0.10 0.00 -0.31 0.00 0.00 62.40 61.99 2ys4 h SER 5 CO 0.00 1.50 0.41 -0.55 -0.87 0.00 0.00 176.83 177.32 2ys4 s SER 6 N -7.19 5.17 0.00 4.97 0.15 -1.26 -4.61 113.70 110.93 2ys4 s SER 6 Ca -0.12 2.16 0.00 0.00 0.70 0.00 0.00 55.95 58.69 2ys4 s SER 6 Cb 0.03 -2.57 0.00 0.00 -1.71 0.00 0.00 66.02 61.76 2ys4 s SER 6 CO 0.88 -1.59 0.00 0.61 1.20 0.00 0.00 173.24 174.34 2ys4 n GLY 7 N -0.04 0.90 3.38 9.45 0.00 -1.26 -5.15 105.19 112.47 2ys4 n GLY 7 Ca 0.12 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.93 2ys4 n GLY 7 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ys4 s THR 8 N -1.11 0.38 -1.25 2.61 -4.23 -1.26 -4.88 115.64 105.90 2ys4 s THR 8 Ca 0.00 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 58.45 2ys4 s THR 8 Cb 0.00 -2.47 0.01 0.00 1.34 0.00 0.00 72.50 71.37 2ys4 s THR 8 CO 0.00 0.00 1.08 -0.62 -0.54 0.00 0.00 174.62 174.54 2ys4 n GLU 9 N -0.68 -7.27 -3.77 3.99 1.02 -1.26 -5.00 120.64 107.67 2ys4 n GLU 9 Ca -0.00 0.79 -0.25 0.00 -0.02 0.00 0.00 57.16 57.68 2ys4 n GLU 9 Cb 0.65 -5.72 -0.17 0.00 -0.02 0.00 0.00 31.44 26.18 2ys4 n GLU 9 CO 0.00 0.00 0.00 0.50 1.18 0.00 0.00 177.13 178.81 2ys4 s ARG 10 N -6.01 0.73 -0.11 3.49 6.06 -1.26 -5.11 118.95 116.74 2ys4 s ARG 10 Ca 0.42 -0.18 -0.04 0.00 -2.50 0.00 0.00 55.73 53.43 2ys4 s ARG 10 Cb -0.18 -1.56 0.06 0.00 0.06 0.00 0.00 34.95 33.32 2ys4 s ARG 10 CO 0.69 -0.45 0.21 -1.83 -2.50 0.00 0.00 175.30 171.42 2ys4 s GLU 11 N 1.89 0.09 -0.19 5.12 4.04 -1.26 -5.13 118.70 123.27 2ys4 s GLU 11 Ca 0.02 0.65 -0.05 0.00 0.04 0.00 0.00 54.97 55.63 2ys4 s GLU 11 Cb -0.14 -0.15 -0.03 0.00 0.02 0.00 0.00 34.13 33.83 2ys4 s GLU 11 CO -0.07 -0.29 0.01 0.21 -1.84 0.00 0.00 175.26 173.28 2ys4 s LYS 12 N 2.31 3.71 -0.13 -4.83 2.20 -1.26 -5.06 119.74 116.68 2ys4 s LYS 12 Ca 0.02 -0.48 -0.29 0.00 -0.36 0.00 0.00 55.97 54.86 2ys4 s LYS 12 Cb -0.12 -3.10 -0.04 0.00 -1.51 0.00 0.00 37.83 33.06 2ys4 s LYS 12 CO -0.07 0.10 1.64 0.12 -0.36 0.00 0.00 175.35 176.78 2ys4 s PHE 13 N 0.78 2.04 -0.02 4.03 2.19 -1.26 -4.99 117.98 120.75 2ys4 s PHE 13 Ca 0.01 0.38 0.02 0.00 0.33 0.00 0.00 56.93 57.68 2ys4 s PHE 13 Cb -0.14 -3.92 0.00 0.00 -1.31 0.00 0.00 43.02 37.65 2ys4 s PHE 13 CO 0.02 -3.39 -0.08 0.42 1.83 0.00 0.00 175.22 174.02 2ys4 s ILE 14 N 4.61 0.71 0.02 3.12 1.01 -1.26 -5.15 121.20 124.26 2ys4 s ILE 14 Ca 0.73 -0.32 0.03 0.00 0.00 0.00 0.00 60.65 61.08 2ys4 s ILE 14 Cb -0.29 -0.63 -0.04 0.00 0.01 0.00 0.00 42.46 41.51 2ys4 s ILE 14 CO 0.29 0.23 -0.02 0.68 0.00 0.00 0.00 174.94 176.11 2ys4 s VAL 15 N 0.21 3.98 0.82 2.92 -7.23 -1.26 -5.12 120.40 114.72 2ys4 s VAL 15 Ca -0.03 -0.75 -0.11 0.00 -1.81 0.00 0.00 61.98 59.28 2ys4 s VAL 15 Cb -0.08 -2.79 0.08 0.00 0.56 0.00 0.00 36.38 34.15 2ys4 s VAL 15 CO 0.00 0.32 1.09 -2.16 -0.31 0.00 0.00 175.10 174.04 2ys4 s PRO 16 N -1.71 1.90 0.11 4.82 0.04 -1.26 -4.96 135.00 133.95 2ys4 s PRO 16 Ca 0.20 1.04 -0.26 0.00 0.04 0.00 0.00 61.00 62.02 2ys4 s PRO 16 Cb -0.11 -1.87 -0.08 0.00 0.04 0.00 0.00 34.50 32.48 2ys4 s PRO 16 CO 0.11 -1.86 1.44 0.82 0.04 0.00 0.00 177.00 177.55 2ys4 h ILE 17 N -1.28 0.00 -2.21 0.56 1.08 -2.09 -3.39 117.51 110.18 2ys4 h ILE 17 Ca -0.46 0.00 -0.29 0.00 -0.39 0.00 0.00 64.86 63.72 2ys4 h ILE 17 Cb 1.25 0.00 -0.33 0.00 -3.07 0.00 0.00 36.82 34.67 2ys4 h ILE 17 CO 0.53 0.00 -0.60 -0.54 -0.69 0.00 0.00 178.15 176.84 2ys4 s LYS 18 N -5.09 0.29 -0.04 2.37 -0.14 -1.26 -5.14 119.74 110.73 2ys4 s LYS 18 Ca -0.11 0.08 -0.06 0.00 -1.36 0.00 0.00 55.97 54.53 2ys4 s LYS 18 Cb 0.07 -0.78 0.01 0.00 -1.68 0.00 0.00 37.83 35.45 2ys4 s LYS 18 CO 0.49 -0.85 0.15 0.00 -0.76 0.00 0.00 175.35 174.38 2ys4 s ALA 19 N 2.39 -0.36 -0.18 5.17 0.00 -1.26 -5.15 121.76 122.36 2ys4 s ALA 19 Ca 0.09 0.26 -0.07 0.00 0.00 0.00 0.00 51.96 52.24 2ys4 s ALA 19 Cb -0.15 -0.15 0.08 0.00 0.00 0.00 0.00 23.12 22.90 2ys4 s ALA 19 CO -0.24 -0.11 0.39 0.50 0.00 0.00 0.00 175.76 176.30 2ys4 s ARG 20 N -0.36 0.30 0.00 0.00 3.00 -1.26 -5.02 118.95 115.61 2ys4 s ARG 20 Ca -0.04 0.92 0.00 0.00 -1.00 0.00 0.00 55.73 55.61 2ys4 s ARG 20 Cb -0.03 0.18 0.00 0.00 0.00 0.00 0.00 34.95 35.10 2ys4 s ARG 20 CO 0.01 -0.23 0.00 0.41 0.00 0.00 0.00 175.30 175.48 2ys4 n GLY 21 N 5.11 1.28 3.66 8.12 0.00 -1.26 -5.11 105.19 116.98 2ys4 n GLY 21 Ca -0.12 -0.98 -0.43 0.00 0.00 0.00 0.00 46.02 44.50 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 -2.00 3.63 0.46 4.61 0.00 -1.26 -5.02 121.76 122.18 2ys4 s ALA 22 Ca 0.00 0.53 0.08 0.00 0.00 0.00 0.00 51.96 52.57 2ys4 s ALA 22 Cb 0.00 -3.66 0.02 0.00 0.00 0.00 0.00 23.12 19.48 2ys4 s ALA 22 CO 0.00 -1.28 0.53 -0.98 0.00 0.00 0.00 175.76 174.04 2ys4 s ARG 23 N 3.68 2.58 0.01 0.00 1.70 -1.26 -4.87 118.95 120.79 2ys4 s ARG 23 Ca 0.59 -1.49 0.05 0.00 -0.47 0.00 0.00 55.73 54.41 2ys4 s ARG 23 Cb -0.24 -2.55 -0.02 0.00 -0.57 0.00 0.00 34.95 31.58 2ys4 s ARG 23 CO 0.18 -0.39 -0.17 0.00 -1.08 0.00 0.00 175.30 173.85 2ys4 s ALA 24 N -2.49 1.38 -0.09 7.88 0.00 -1.26 -3.13 121.76 124.05 2ys4 s ALA 24 Ca 0.52 -0.81 -0.08 0.00 0.00 0.00 0.00 51.96 51.60 2ys4 s ALA 24 Cb -0.06 -0.30 0.02 0.00 0.00 0.00 0.00 23.12 22.78 2ys4 s ALA 24 CO 0.31 0.31 0.23 0.42 0.00 0.00 0.00 175.76 177.04 2ys4 s ILE 25 N -0.59 -0.00 0.45 0.00 1.01 -1.26 -4.95 121.20 115.86 2ys4 s ILE 25 Ca 0.05 0.01 0.06 0.00 0.00 0.00 0.00 60.65 60.77 2ys4 s ILE 25 Cb -0.07 -0.33 -0.04 0.00 0.01 0.00 0.00 42.46 42.03 2ys4 s ILE 25 CO 0.00 0.00 0.16 -0.76 0.00 0.00 0.00 174.94 174.34 2ys4 s LEU 26 N 0.18 2.87 -0.31 2.97 2.01 -1.26 -1.40 118.68 123.74 2ys4 s LEU 26 Ca -0.00 -1.25 0.01 0.00 0.01 0.00 0.00 54.13 52.89 2ys4 s LEU 26 Cb -0.02 -1.20 0.07 0.00 0.01 0.00 0.00 46.19 45.05 2ys4 s LEU 26 CO -0.00 -0.67 0.01 -0.62 1.01 0.00 0.00 176.35 176.07 2ys4 s ASP 27 N -3.93 4.79 0.03 2.29 -1.08 -1.16 -4.77 116.67 112.85 2ys4 s ASP 27 Ca 0.33 -1.58 0.07 0.00 -0.52 0.00 0.00 52.55 50.85 2ys4 s ASP 27 Cb 0.03 -1.67 -0.02 0.00 -1.46 0.00 0.00 42.92 39.81 2ys4 s ASP 27 CO 0.18 -0.30 -0.20 -0.36 0.52 0.00 0.00 175.17 175.01 2ys4 s PHE 28 N 1.13 1.75 0.59 -5.34 0.40 -1.26 -4.35 117.98 110.90 2ys4 s PHE 28 Ca -0.01 -0.37 -0.18 0.00 -0.60 0.00 0.00 56.93 55.77 2ys4 s PHE 28 Cb -0.20 -1.05 -0.04 0.00 0.51 0.00 0.00 43.02 42.24 2ys4 s PHE 28 CO -0.04 0.07 1.12 -1.25 0.70 0.00 0.00 175.22 175.82 2ys4 s PRO 29 N -1.07 3.14 0.28 0.24 0.04 -1.26 -4.93 135.00 131.45 2ys4 s PRO 29 Ca 0.07 1.52 0.00 0.00 0.04 0.00 0.00 61.00 62.63 2ys4 s PRO 29 Cb -0.09 -1.99 0.64 0.00 0.04 0.00 0.00 34.50 33.11 2ys4 s PRO 29 CO 0.01 -1.00 1.66 -0.44 0.04 0.00 0.00 177.00 177.28 2ys4 h ASP 30 N 0.74 0.02 -5.05 6.66 3.32 -1.98 -3.45 116.42 116.69 2ys4 h ASP 30 Ca -0.49 0.18 0.04 0.00 0.02 0.00 0.00 57.03 56.78 2ys4 h ASP 30 Cb 1.26 0.24 -0.06 0.00 0.22 0.00 0.00 39.33 40.98 2ys4 h ASP 30 CO 0.56 -0.11 0.15 -1.59 -1.72 0.00 0.00 179.24 176.53 2ys4 s LYS 31 N -5.97 1.69 -0.42 3.56 -2.85 -1.26 -3.37 119.74 111.12 2ys4 s LYS 31 Ca -0.12 -1.00 -0.14 0.00 -1.00 0.00 0.00 55.97 53.72 2ys4 s LYS 31 Cb 0.24 0.58 0.04 0.00 -2.06 0.00 0.00 37.83 36.63 2ys4 s LYS 31 CO 0.77 -0.76 0.29 -1.17 0.10 0.00 0.00 175.35 174.58 2ys4 s LEU 32 N -2.92 5.13 -0.45 2.77 1.98 0.01 -4.93 118.68 120.28 2ys4 s LEU 32 Ca 0.12 -1.08 -0.21 0.00 -2.89 0.00 0.00 54.13 50.08 2ys4 s LEU 32 Cb -0.04 -2.11 0.03 0.00 0.66 0.00 0.00 46.19 44.72 2ys4 s LEU 32 CO 0.05 -0.49 0.66 0.54 -1.89 0.00 0.00 176.35 175.23 2ys4 s ASN 33 N 1.89 6.33 -0.44 3.68 2.20 -1.26 -2.31 114.94 125.02 2ys4 s ASN 33 Ca 0.04 -0.35 -0.15 0.00 -0.94 0.00 0.00 52.86 51.45 2ys4 s ASN 33 Cb -0.21 -2.33 0.05 0.00 -2.00 0.00 0.00 41.25 36.76 2ys4 s ASN 33 CO 0.08 -0.81 0.34 -0.36 -2.94 0.00 0.00 177.10 173.41 2ys4 s PHE 34 N 2.88 3.24 1.13 1.54 0.08 -1.26 -5.01 117.98 120.58 2ys4 s PHE 34 Ca 0.23 -0.78 -0.16 0.00 0.12 0.00 0.00 56.93 56.34 2ys4 s PHE 34 Cb -0.14 -2.87 0.22 0.00 -0.57 0.00 0.00 43.02 39.66 2ys4 s PHE 34 CO 0.19 -0.70 0.47 0.43 -0.10 0.00 0.00 175.22 175.52 2ys4 n SER 35 N 5.17 -3.24 -4.60 1.36 7.64 -1.26 -3.51 113.62 115.18 2ys4 n SER 35 Ca -0.12 -0.49 -0.51 0.00 1.01 0.00 0.00 58.87 58.76 2ys4 n SER 35 Cb 0.45 -0.84 -0.06 0.00 -1.01 0.00 0.00 64.21 62.75 2ys4 n SER 35 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2ys4 n THR 36 N -4.77 0.36 -4.29 0.44 -1.04 -1.26 -4.46 114.28 99.26 2ys4 n THR 36 Ca 0.07 -0.17 -0.19 0.00 -2.04 0.00 0.00 64.05 61.73 2ys4 n THR 36 Cb 0.42 -1.67 -0.11 0.00 -1.82 0.00 0.00 70.33 67.15 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 -3.10 4.44 0.03 0.00 0.04 -1.26 -1.28 135.00 133.85 2ys4 s PRO 38 Ca 0.15 2.05 -0.30 0.00 0.04 0.00 0.00 61.00 62.95 2ys4 s PRO 38 Cb -0.03 -3.15 -0.16 0.00 0.04 0.00 0.00 34.50 31.20 2ys4 s PRO 38 CO 0.05 -0.12 1.24 -0.24 0.04 0.00 0.00 177.00 177.97 2ys4 h VAL 39 N 3.35 0.00 0.45 -0.36 3.04 -1.71 -3.36 116.25 117.67 2ys4 h VAL 39 Ca -0.47 -0.20 -0.02 0.00 -1.01 0.00 0.00 66.70 65.01 2ys4 h VAL 39 Cb 1.22 0.00 0.00 0.00 -2.01 0.00 0.00 31.29 30.50 2ys4 h VAL 39 CO 0.71 0.00 -0.22 0.11 -1.01 0.00 0.00 177.57 177.16 2ys4 h LYS 40 N -1.26 -0.58 -6.68 4.17 6.56 -1.82 -3.28 116.57 113.67 2ys4 h LYS 40 Ca -0.11 0.04 -0.57 0.00 -1.06 0.00 0.00 60.65 58.95 2ys4 h LYS 40 Cb 0.82 0.13 0.17 0.00 -0.57 0.00 0.00 32.23 32.79 2ys4 h LYS 40 CO 0.18 -0.39 -0.20 0.66 -2.06 0.00 0.00 179.45 177.64 2ys4 n TYR 41 N -3.76 -0.16 -2.95 -1.35 4.01 -1.26 -4.76 117.16 106.93 2ys4 n TYR 41 Ca -0.08 0.41 -0.30 0.00 -0.16 0.00 0.00 57.90 57.78 2ys4 n TYR 41 Cb 0.24 -2.01 -0.03 0.00 -0.31 0.00 0.00 39.34 37.23 2ys4 n TYR 41 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 2ys4 s SER 42 N -1.31 6.50 0.09 7.72 1.04 -1.26 -4.64 113.70 121.83 2ys4 s SER 42 Ca 0.71 1.04 0.08 0.00 0.48 0.00 0.00 55.95 58.26 2ys4 s SER 42 Cb -0.40 -2.28 -0.04 0.00 0.10 0.00 0.00 66.02 63.40 2ys4 s SER 42 CO 0.52 -0.36 -0.17 -0.89 0.98 0.00 0.00 173.24 173.32 2ys4 s THR 43 N -2.32 2.88 0.04 2.02 2.01 -1.07 -4.95 115.64 114.26 2ys4 s THR 43 Ca 0.50 -1.35 0.03 0.00 0.31 0.00 0.00 61.69 61.17 2ys4 s THR 43 Cb -0.10 -2.28 -0.02 0.00 0.01 0.00 0.00 72.50 70.10 2ys4 s THR 43 CO 0.31 0.19 -0.09 -1.10 -0.69 0.00 0.00 174.62 173.25 2ys4 s GLN 44 N -1.87 0.57 0.07 4.92 1.11 -1.26 -2.76 119.66 120.44 2ys4 s GLN 44 Ca 0.17 -0.77 -0.26 0.00 0.01 0.00 0.00 55.36 54.51 2ys4 s GLN 44 Cb -0.11 -0.38 0.07 0.00 -1.01 0.00 0.00 33.01 31.59 2ys4 s GLN 44 CO 0.09 0.07 0.63 0.21 0.01 0.00 0.00 175.29 176.29 2ys4 s LYS 45 N -1.55 1.18 0.01 2.91 2.20 -1.12 -5.01 119.74 118.37 2ys4 s LYS 45 Ca -0.08 -0.18 0.07 0.00 -0.36 0.00 0.00 55.97 55.42 2ys4 s LYS 45 Cb -0.10 0.55 -0.03 0.00 -1.51 0.00 0.00 37.83 36.75 2ys4 s LYS 45 CO 0.01 -0.46 -0.22 0.42 -0.36 0.00 0.00 175.35 174.73 2ys4 s ILE 46 N -2.72 2.45 -0.23 5.43 1.01 -1.26 -1.18 121.20 124.71 2ys4 s ILE 46 Ca -0.04 -1.15 0.00 0.00 0.00 0.00 0.00 60.65 59.46 2ys4 s ILE 46 Cb -0.01 -1.95 0.06 0.00 0.01 0.00 0.00 42.46 40.57 2ys4 s ILE 46 CO -0.04 0.45 -0.05 -0.22 0.00 0.00 0.00 174.94 175.08 2ys4 s LEU 47 N -1.05 2.40 -0.14 2.97 2.96 -0.63 -4.88 118.68 120.31 2ys4 s LEU 47 Ca 0.12 -1.11 -0.29 0.00 -0.22 0.00 0.00 54.13 52.63 2ys4 s LEU 47 Cb -0.10 -1.13 -0.02 0.00 0.50 0.00 0.00 46.19 45.44 2ys4 s LEU 47 CO 0.02 -0.23 1.31 -0.22 -1.32 0.00 0.00 176.35 175.91 2ys4 s LEU 48 N 1.44 4.21 -0.08 -0.68 1.98 -1.26 -1.65 118.68 122.64 2ys4 s LEU 48 Ca -0.05 1.78 0.01 0.00 -2.89 0.00 0.00 54.13 52.98 2ys4 s LEU 48 Cb -0.18 -3.54 -0.03 0.00 0.66 0.00 0.00 46.19 43.10 2ys4 s LEU 48 CO -0.06 -0.77 -0.11 -0.69 -1.89 0.00 0.00 176.35 172.83 2ys4 s VAL 49 N 3.44 3.35 -0.12 1.68 1.01 0.95 -4.94 120.40 125.77 2ys4 s VAL 49 Ca 0.57 -0.60 0.01 0.00 0.00 0.00 0.00 61.98 61.96 2ys4 s VAL 49 Cb -0.24 -2.37 0.02 0.00 0.00 0.00 0.00 36.38 33.80 2ys4 s VAL 49 CO 0.17 0.57 -0.12 -0.60 0.00 0.00 0.00 175.10 175.12 2ys4 s ARG 50 N -0.45 1.96 -0.08 2.72 3.52 -1.26 -0.64 118.95 124.73 2ys4 s ARG 50 Ca 0.06 -0.44 -0.30 0.00 -0.13 0.00 0.00 55.73 54.92 2ys4 s ARG 50 Cb -0.12 -1.80 -0.05 0.00 -1.56 0.00 0.00 34.95 31.42 2ys4 s ARG 50 CO 0.02 -0.17 1.62 1.21 -0.81 0.00 0.00 175.30 177.17 2ys4 s ASN 51 N 1.33 6.66 -0.06 -2.12 3.84 -1.21 -2.98 114.94 120.40 2ys4 s ASN 51 Ca -0.00 2.15 0.15 0.00 0.21 0.00 0.00 52.86 55.37 2ys4 s ASN 51 Cb -0.14 -2.53 0.50 0.00 -0.55 0.00 0.00 41.25 38.54 2ys4 s ASN 51 CO -0.06 -0.94 1.43 2.30 -2.79 0.00 0.00 177.10 177.04 2ys4 n ILE 52 N 5.55 1.45 -0.87 -5.21 -5.35 -0.49 -3.72 119.36 110.72 2ys4 n ILE 52 Ca 0.17 -1.21 0.00 0.00 -0.27 0.00 0.00 62.75 61.44 2ys4 n ILE 52 Cb 0.43 0.27 0.00 0.00 -1.74 0.00 0.00 39.64 38.60 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 0.65 0.30 0.03 3.28 0.00 -0.99 -4.81 105.19 103.64 2ys4 n GLY 53 Ca 0.19 -1.80 -0.04 0.00 0.00 0.00 0.00 46.02 44.37 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 -0.21 3.59 -4.78 1.61 0.23 -1.23 -4.80 115.26 109.68 2ys4 n ASN 54 Ca 0.00 -0.02 -0.26 0.00 -0.53 0.00 0.00 54.58 53.77 2ys4 n ASN 54 Cb 0.00 0.24 -0.06 0.00 -2.08 0.00 0.00 39.78 37.88 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 -2.13 2.24 0.03 -3.83 2.20 -1.18 -4.80 119.74 112.26 2ys4 s LYS 55 Ca -0.06 -1.93 -0.36 0.00 -0.36 0.00 0.00 55.97 53.27 2ys4 s LYS 55 Cb 0.02 -1.97 -0.14 0.00 -1.51 0.00 0.00 37.83 34.23 2ys4 s LYS 55 CO 0.18 -0.24 1.60 -1.71 -0.36 0.00 0.00 175.35 174.83 2ys4 n ASN 56 N -1.35 2.70 -4.73 1.43 5.15 -1.26 -4.56 115.26 112.63 2ys4 n ASN 56 Ca -0.03 1.07 -0.37 0.00 -0.60 0.00 0.00 54.58 54.65 2ys4 n ASN 56 Cb 0.65 -1.31 -0.07 0.00 -0.53 0.00 0.00 39.78 38.51 2ys4 n ASN 56 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2ys4 s ALA 57 N 1.85 3.58 -0.26 5.20 0.00 -0.52 -4.75 121.76 126.85 2ys4 s ALA 57 Ca 0.86 -0.41 0.02 0.00 0.00 0.00 0.00 51.96 52.43 2ys4 s ALA 57 Cb -0.81 -2.42 0.07 0.00 0.00 0.00 0.00 23.12 19.96 2ys4 s ALA 57 CO 0.47 0.10 -0.05 0.08 0.00 0.00 0.00 175.76 176.35 2ys4 s VAL 58 N 0.42 1.84 0.01 0.00 1.01 -1.26 -2.42 120.40 119.99 2ys4 s VAL 58 Ca 0.18 -1.53 0.07 0.00 0.00 0.00 0.00 61.98 60.70 2ys4 s VAL 58 Cb -0.13 -2.09 -0.02 0.00 0.00 0.00 0.00 36.38 34.14 2ys4 s VAL 58 CO 0.05 -0.16 -0.20 0.72 0.00 0.00 0.00 175.10 175.51 2ys4 s PHE 59 N 1.23 1.79 -0.28 5.22 -0.71 -1.21 -2.01 117.98 122.01 2ys4 s PHE 59 Ca -0.04 -0.35 0.00 0.00 -1.04 0.00 0.00 56.93 55.50 2ys4 s PHE 59 Cb -0.19 -1.11 0.08 0.00 -1.21 0.00 0.00 43.02 40.59 2ys4 s PHE 59 CO -0.07 0.02 0.04 -1.58 -1.34 0.00 0.00 175.22 172.30 2ys4 s HIS 60 N -0.62 2.17 0.41 3.49 2.46 -0.72 -2.78 115.29 119.70 2ys4 s HIS 60 Ca 0.07 -1.85 -0.14 0.00 0.47 0.00 0.00 55.06 53.61 2ys4 s HIS 60 Cb -0.08 -1.80 -0.08 0.00 -0.13 0.00 0.00 32.58 30.49 2ys4 s HIS 60 CO 0.00 -0.83 0.83 0.42 -2.47 0.00 0.00 174.74 172.69 2ys4 s ILE 61 N 1.46 4.66 -0.08 0.89 1.01 0.82 -3.13 121.20 126.84 2ys4 s ILE 61 Ca 0.04 0.92 -0.08 0.00 0.00 0.00 0.00 60.65 61.53 2ys4 s ILE 61 Cb -0.18 -3.68 0.02 0.00 0.01 0.00 0.00 42.46 38.63 2ys4 s ILE 61 CO -0.15 -0.45 0.22 -0.54 0.00 0.00 0.00 174.94 174.02 2ys4 s LYS 62 N -3.61 0.28 0.24 2.79 -0.14 -1.25 -4.53 119.74 113.52 2ys4 s LYS 62 Ca 0.55 0.27 -0.21 0.00 -1.36 0.00 0.00 55.97 55.22 2ys4 s LYS 62 Cb -0.10 0.13 0.07 0.00 -1.68 0.00 0.00 37.83 36.25 2ys4 s LYS 62 CO 0.26 -0.04 0.95 -0.08 -0.76 0.00 0.00 175.35 175.68 2ys4 s THR 63 N 0.02 0.00 0.05 2.17 -1.32 -1.26 -4.51 115.64 110.79 2ys4 s THR 63 Ca -0.01 -0.73 -0.07 0.00 -1.21 0.00 0.00 61.69 59.68 2ys4 s THR 63 Cb -0.02 -2.68 -0.01 0.00 -1.51 0.00 0.00 72.50 68.28 2ys4 s THR 63 CO 0.00 0.00 0.13 0.00 -2.21 0.00 0.00 174.62 172.54 2ys4 n ARG 65 N 0.45 -0.05 0.00 0.00 1.74 -1.26 -1.28 116.66 116.26 2ys4 n ARG 65 Ca -0.17 0.03 0.08 0.00 -0.77 0.00 0.00 57.85 57.02 2ys4 n ARG 65 Cb 0.60 -1.85 0.45 0.00 -1.02 0.00 0.00 32.46 30.64 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 -1.30 0.49 -3.49 5.56 -0.04 -1.26 -4.99 135.00 129.96 2ys4 n PRO 66 Ca 0.08 0.00 -0.37 0.00 -0.04 0.00 0.00 63.50 63.17 2ys4 n PRO 66 Cb 0.52 -1.49 -0.07 0.00 -0.04 0.00 0.00 33.50 32.43 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 -2.00 3.47 0.06 0.54 0.08 -0.41 -3.08 117.98 116.65 2ys4 s PHE 67 Ca 0.23 0.65 -0.20 0.00 0.12 0.00 0.00 56.93 57.73 2ys4 s PHE 67 Cb 0.10 -2.38 0.05 0.00 -0.57 0.00 0.00 43.02 40.22 2ys4 s PHE 67 CO 0.18 0.23 0.48 -1.12 -0.10 0.00 0.00 175.22 174.88 2ys4 s SER 68 N 0.49 -0.37 0.25 1.36 0.01 0.16 -2.49 113.70 113.10 2ys4 s SER 68 Ca 0.18 0.05 -0.18 0.00 1.31 0.00 0.00 55.95 57.31 2ys4 s SER 68 Cb -0.13 0.47 0.02 0.00 0.21 0.00 0.00 66.02 66.59 2ys4 s SER 68 CO 0.05 -0.73 0.62 0.27 0.41 0.00 0.00 173.24 173.86 2ys4 s ILE 69 N -2.67 0.00 -0.11 1.44 -0.00 -1.26 0.71 121.20 119.30 2ys4 s ILE 69 Ca -0.04 -1.03 -0.30 0.00 -0.00 0.00 0.00 60.65 59.28 2ys4 s ILE 69 Cb -0.00 -1.95 0.12 0.00 -0.00 0.00 0.00 42.46 40.62 2ys4 s ILE 69 CO -0.04 -0.02 0.96 -1.83 -0.00 0.00 0.00 174.94 174.01 2ys4 s GLU 70 N -3.93 0.67 0.10 0.37 -1.05 -1.07 -3.95 118.70 109.85 2ys4 s GLU 70 Ca 0.13 0.03 -0.31 0.00 -0.15 0.00 0.00 54.97 54.67 2ys4 s GLU 70 Cb -0.04 0.31 -0.08 0.00 -0.44 0.00 0.00 34.13 33.89 2ys4 s GLU 70 CO 0.05 -0.24 1.37 -1.25 0.95 0.00 0.00 175.26 176.14 2ys4 s PRO 71 N -1.68 4.33 0.55 -4.83 0.04 -1.26 -2.48 135.00 129.68 2ys4 s PRO 71 Ca -0.00 2.03 0.42 0.00 0.04 0.00 0.00 61.00 63.49 2ys4 s PRO 71 Cb -0.01 -3.28 1.62 0.00 0.04 0.00 0.00 34.50 32.88 2ys4 s PRO 71 CO -0.01 -0.42 1.71 0.00 0.04 0.00 0.00 177.00 178.32 2ys4 h ALA 72 N 6.85 3.41 -2.90 8.56 0.00 -1.86 -3.40 119.26 129.92 2ys4 h ALA 72 Ca -0.42 -0.05 -0.16 0.00 0.00 0.00 0.00 54.91 54.28 2ys4 h ALA 72 Cb 1.21 0.11 -0.21 0.00 0.00 0.00 0.00 17.79 18.90 2ys4 h ALA 72 CO 0.86 -1.85 -0.65 -1.50 0.00 0.00 0.00 179.25 176.11 2ys4 s ILE 73 N -4.90 0.11 0.22 0.00 2.07 -1.26 -0.12 121.20 117.31 2ys4 s ILE 73 Ca -0.05 -0.90 -0.23 0.00 -1.41 0.00 0.00 60.65 58.07 2ys4 s ILE 73 Cb 0.24 -0.35 0.04 0.00 0.13 0.00 0.00 42.46 42.53 2ys4 s ILE 73 CO 0.83 -0.49 0.77 -0.83 -1.91 0.00 0.00 174.94 173.31 2ys4 s GLY 74 N -1.50 -0.22 -0.22 1.50 0.00 -1.12 -5.02 107.32 100.74 2ys4 s GLY 74 Ca -0.15 -0.02 0.00 0.00 0.00 0.00 0.00 44.72 44.55 2ys4 s GLY 74 CO -0.01 -0.01 -0.04 -0.51 0.00 0.00 0.00 173.10 172.53 2ys4 s THR 75 N -3.71 1.34 -0.11 0.90 -4.23 -1.26 -3.29 115.64 105.29 2ys4 s THR 75 Ca 0.09 -1.05 -0.03 0.00 -1.18 0.00 0.00 61.69 59.53 2ys4 s THR 75 Cb -0.04 -1.62 -0.03 0.00 1.34 0.00 0.00 72.50 72.15 2ys4 s THR 75 CO 0.02 -0.07 -0.01 -0.22 -0.54 0.00 0.00 174.62 173.80 2ys4 s LEU 76 N 1.49 3.47 0.33 4.79 2.96 -1.02 -4.97 118.68 125.74 2ys4 s LEU 76 Ca -0.04 0.05 0.07 0.00 -0.22 0.00 0.00 54.13 53.99 2ys4 s LEU 76 Cb -0.18 -1.81 -0.01 0.00 0.50 0.00 0.00 46.19 44.69 2ys4 s LEU 76 CO -0.07 0.31 0.44 0.54 -1.32 0.00 0.00 176.35 176.25 2ys4 s ASN 77 N -0.45 5.87 0.17 3.68 2.20 -1.26 -1.44 114.94 123.72 2ys4 s ASN 77 Ca 0.08 -0.23 -0.31 0.00 -0.94 0.00 0.00 52.86 51.46 2ys4 s ASN 77 Cb -0.12 -1.20 -0.09 0.00 -2.00 0.00 0.00 41.25 37.84 2ys4 s ASN 77 CO 0.02 -0.42 1.39 -0.69 -2.94 0.00 0.00 177.10 174.47 2ys4 s VAL 78 N -2.19 3.07 0.00 3.54 1.01 -1.26 -2.84 120.40 121.73 2ys4 s VAL 78 Ca 0.44 0.83 0.00 0.00 0.00 0.00 0.00 61.98 63.25 2ys4 s VAL 78 Cb -0.09 -3.53 0.00 0.00 0.00 0.00 0.00 36.38 32.76 2ys4 s VAL 78 CO 0.30 0.10 0.00 0.61 0.00 0.00 0.00 175.10 176.11 2ys4 n GLY 79 N 2.90 3.00 3.95 4.51 0.00 -1.24 -5.03 105.19 113.28 2ys4 n GLY 79 Ca 0.09 -0.53 -0.23 0.00 0.00 0.00 0.00 46.02 45.35 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 0.00 3.47 0.43 1.61 0.41 -1.13 -4.97 118.70 118.52 2ys4 s GLU 80 Ca 0.00 -0.39 0.03 0.00 -0.41 0.00 0.00 54.97 54.20 2ys4 s GLU 80 Cb 0.00 -2.69 -0.03 0.00 -1.78 0.00 0.00 34.13 29.64 2ys4 s GLU 80 CO 0.00 0.17 0.09 -1.12 -0.49 0.00 0.00 175.26 173.91 2ys4 s SER 81 N -4.04 3.10 0.33 -0.19 0.01 -1.26 -3.34 113.70 108.31 2ys4 s SER 81 Ca 0.39 -1.65 -0.12 0.00 1.31 0.00 0.00 55.95 55.88 2ys4 s SER 81 Cb -0.10 0.45 0.02 0.00 0.21 0.00 0.00 66.02 66.61 2ys4 s SER 81 CO 0.35 -0.88 0.64 0.00 0.41 0.00 0.00 173.24 173.76 2ys4 s MET 82 N -3.76 1.95 0.04 12.44 0.23 0.19 -4.97 119.30 125.43 2ys4 s MET 82 Ca 0.21 -1.42 0.06 0.00 -1.03 0.00 0.00 55.69 53.51 2ys4 s MET 82 Cb 0.03 0.55 -0.02 0.00 -1.53 0.00 0.00 34.83 33.85 2ys4 s MET 82 CO 0.12 -0.87 -0.18 -0.65 -2.03 0.00 0.00 175.02 171.41 2ys4 s GLN 83 N -3.09 1.21 -0.21 3.16 -0.21 -1.26 -0.04 119.66 119.22 2ys4 s GLN 83 Ca 0.20 -0.88 0.01 0.00 0.02 0.00 0.00 55.36 54.72 2ys4 s GLN 83 Cb -0.03 -1.29 0.04 0.00 1.00 0.00 0.00 33.01 32.73 2ys4 s GLN 83 CO 0.13 0.33 -0.11 -0.51 -2.12 0.00 0.00 175.29 173.00 2ys4 s LEU 84 N -1.18 2.48 -0.63 2.90 1.43 -0.66 -4.81 118.68 118.21 2ys4 s LEU 84 Ca 0.05 -0.96 -0.24 0.00 -1.03 0.00 0.00 54.13 51.95 2ys4 s LEU 84 Cb -0.08 -1.31 0.05 0.00 0.03 0.00 0.00 46.19 44.88 2ys4 s LEU 84 CO 0.02 -0.14 1.01 -1.61 0.23 0.00 0.00 176.35 175.85 2ys4 s GLU 85 N 1.33 3.22 -0.09 1.70 2.02 -1.03 -1.61 118.70 124.24 2ys4 s GLU 85 Ca -0.02 -0.49 -0.20 0.00 0.02 0.00 0.00 54.97 54.27 2ys4 s GLU 85 Cb -0.17 -4.15 -0.04 0.00 0.10 0.00 0.00 34.13 29.88 2ys4 s GLU 85 CO -0.08 -1.73 0.56 0.08 0.02 0.00 0.00 175.26 174.11 2ys4 s VAL 86 N 4.28 5.13 -0.12 2.63 1.01 -0.32 -2.58 120.40 130.42 2ys4 s VAL 86 Ca 0.28 1.14 0.00 0.00 0.00 0.00 0.00 61.98 63.40 2ys4 s VAL 86 Cb -0.14 -3.90 -0.01 0.00 0.00 0.00 0.00 36.38 32.33 2ys4 s VAL 86 CO 0.15 0.31 -0.14 -0.70 0.00 0.00 0.00 175.10 174.72 2ys4 s GLU 87 N 0.63 3.32 -0.22 2.72 2.12 0.22 -2.79 118.70 124.71 2ys4 s GLU 87 Ca 0.30 -0.70 -0.04 0.00 0.36 0.00 0.00 54.97 54.89 2ys4 s GLU 87 Cb -0.16 -2.60 0.12 0.00 0.26 0.00 0.00 34.13 31.75 2ys4 s GLU 87 CO 0.13 0.23 0.37 0.12 -0.54 0.00 0.00 175.26 175.58 2ys4 s PHE 88 N 0.30 -0.77 -0.30 5.30 5.36 -1.11 -0.67 117.98 126.09 2ys4 s PHE 88 Ca -0.11 0.98 0.01 0.00 -0.96 0.00 0.00 56.93 56.85 2ys4 s PHE 88 Cb -0.16 0.07 0.09 0.00 -0.34 0.00 0.00 43.02 42.68 2ys4 s PHE 88 CO 0.06 -0.63 0.06 -2.00 -1.46 0.00 0.00 175.22 171.24 2ys4 s GLU 89 N 2.54 1.11 1.07 10.12 2.12 -1.18 -2.61 118.70 131.88 2ys4 s GLU 89 Ca 0.08 -1.30 -0.14 0.00 0.36 0.00 0.00 54.97 53.97 2ys4 s GLU 89 Cb -0.14 -2.49 0.22 0.00 0.26 0.00 0.00 34.13 31.98 2ys4 s GLU 89 CO -0.14 -0.90 1.10 -1.25 -0.54 0.00 0.00 175.26 173.53 2ys4 s PRO 90 N 1.36 -0.16 -0.02 4.30 0.04 -1.24 -4.85 135.00 134.43 2ys4 s PRO 90 Ca 0.07 0.32 0.01 0.00 0.04 0.00 0.00 61.00 61.45 2ys4 s PRO 90 Cb -0.18 -1.69 -0.02 0.00 0.04 0.00 0.00 34.50 32.65 2ys4 s PRO 90 CO -0.16 -3.08 -0.01 1.04 0.04 0.00 0.00 177.00 174.83 2ys4 n GLN 91 N -4.39 2.09 -4.23 4.56 1.13 -1.26 -4.26 117.38 111.02 2ys4 n GLN 91 Ca 0.07 0.01 -0.34 0.00 -1.94 0.00 0.00 57.00 54.80 2ys4 n GLN 91 Cb 0.58 -1.05 -0.15 0.00 0.11 0.00 0.00 30.24 29.73 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 -3.69 3.98 0.18 1.08 0.01 -1.26 -4.73 113.70 109.27 2ys4 s SER 92 Ca -0.02 -0.42 -0.33 0.00 1.31 0.00 0.00 55.95 56.49 2ys4 s SER 92 Cb 0.01 -1.65 -0.14 0.00 0.21 0.00 0.00 66.02 64.45 2ys4 s SER 92 CO 0.07 0.04 1.48 0.55 0.41 0.00 0.00 173.24 175.79 2ys4 n VAL 93 N 4.35 0.38 -2.83 3.43 3.14 -1.26 -4.83 118.33 120.71 2ys4 n VAL 93 Ca -0.19 -0.10 0.00 0.00 -2.96 0.00 0.00 64.34 61.10 2ys4 n VAL 93 Cb 0.51 -1.42 0.00 0.00 -1.06 0.00 0.00 33.84 31.87 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 2.81 -0.51 3.03 7.55 0.00 -0.90 -4.98 105.19 112.18 2ys4 n GLY 94 Ca 0.15 -0.94 -0.31 0.00 0.00 0.00 0.00 46.02 44.92 2ys4 n GLY 94 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2ys4 s ASP 95 N -4.00 3.90 0.13 1.61 1.01 -1.26 -0.84 116.67 117.22 2ys4 s ASP 95 Ca 0.00 -1.13 0.04 0.00 0.71 0.00 0.00 52.55 52.17 2ys4 s ASP 95 Cb 0.00 -1.38 -0.04 0.00 1.01 0.00 0.00 42.92 42.51 2ys4 s ASP 95 CO 0.00 -0.17 0.09 -1.00 0.21 0.00 0.00 175.17 174.31 2ys4 s HIS 96 N 1.26 3.13 -0.12 4.23 3.76 -1.26 -5.04 115.29 121.25 2ys4 s HIS 96 Ca -0.05 0.01 -0.05 0.00 -0.15 0.00 0.00 55.06 54.82 2ys4 s HIS 96 Cb -0.18 -1.54 0.06 0.00 1.11 0.00 0.00 32.58 32.03 2ys4 s HIS 96 CO -0.07 0.52 0.25 -1.54 -0.85 0.00 0.00 174.74 173.05 2ys4 s SER 97 N -2.77 0.15 0.00 1.40 1.04 -1.26 -3.92 113.70 108.34 2ys4 s SER 97 Ca 0.30 0.55 0.00 0.00 0.48 0.00 0.00 55.95 57.28 2ys4 s SER 97 Cb -0.11 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.58 2ys4 s SER 97 CO 0.22 -0.21 0.00 0.61 0.98 0.00 0.00 173.24 174.84 2ys4 n GLY 98 N 4.94 5.37 3.55 7.32 0.00 -0.65 -4.88 105.19 120.84 2ys4 n GLY 98 Ca -0.13 -1.30 -0.12 0.00 0.00 0.00 0.00 46.02 44.47 2ys4 n GLY 98 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2ys4 s ARG 99 N 2.66 0.74 -0.16 1.61 1.70 -1.26 -0.01 118.95 124.23 2ys4 s ARG 99 Ca 0.00 0.07 -0.01 0.00 -0.47 0.00 0.00 55.73 55.33 2ys4 s ARG 99 Cb 0.00 0.35 -0.01 0.00 -0.57 0.00 0.00 34.95 34.72 2ys4 s ARG 99 CO 0.00 -0.25 -0.13 -0.51 -1.08 0.00 0.00 175.30 173.33 2ys4 s LEU 100 N -1.41 2.63 -0.27 -1.89 1.43 0.46 -4.85 118.68 114.78 2ys4 s LEU 100 Ca -0.02 -0.40 -0.10 0.00 -1.03 0.00 0.00 54.13 52.57 2ys4 s LEU 100 Cb -0.00 -1.61 -0.05 0.00 0.03 0.00 0.00 46.19 44.56 2ys4 s LEU 100 CO 0.01 0.10 0.16 -0.63 0.23 0.00 0.00 176.35 176.22 2ys4 s ILE 101 N 0.74 5.15 -0.25 -0.59 1.01 -1.26 -1.88 121.20 124.12 2ys4 s ILE 101 Ca -0.06 0.11 -0.06 0.00 0.00 0.00 0.00 60.65 60.65 2ys4 s ILE 101 Cb -0.15 -3.44 -0.01 0.00 0.01 0.00 0.00 42.46 38.87 2ys4 s ILE 101 CO 0.01 0.29 0.03 -0.69 0.00 0.00 0.00 174.94 174.58 2ys4 s VAL 102 N 1.57 3.87 -0.12 2.92 1.01 -1.09 -3.80 120.40 124.77 2ys4 s VAL 102 Ca 0.07 -0.43 -0.19 0.00 0.00 0.00 0.00 61.98 61.43 2ys4 s VAL 102 Cb -0.15 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.34 2ys4 s VAL 102 CO 0.08 0.30 0.50 0.00 0.00 0.00 0.00 175.10 175.98 2ys4 s TYR 104 N 0.69 3.53 0.30 0.00 1.51 -0.15 -1.76 117.35 121.46 2ys4 s TYR 104 Ca 0.27 0.31 0.05 0.00 -1.01 0.00 0.00 57.07 56.69 2ys4 s TYR 104 Cb -0.15 -1.80 0.73 0.00 -0.11 0.00 0.00 41.96 40.62 2ys4 s TYR 104 CO 0.11 0.59 1.75 0.22 -1.11 0.00 0.00 175.55 177.11 2ys4 h ASP 105 N 3.27 0.62 -0.21 2.29 3.58 -1.73 -0.21 116.42 124.03 2ys4 h ASP 105 Ca -0.46 0.12 -0.20 0.00 0.42 0.00 0.00 57.03 56.90 2ys4 h ASP 105 Cb 1.17 0.02 0.01 0.00 1.72 0.00 0.00 39.33 42.24 2ys4 h ASP 105 CO 0.74 0.17 -0.66 0.00 -2.88 0.00 0.00 179.24 176.60 2ys4 h THR 106 N 0.62 1.28 0.00 2.25 1.03 -1.94 -3.47 112.91 112.67 2ys4 h THR 106 Ca 0.57 -1.85 0.00 0.00 -0.01 0.00 0.00 66.41 65.12 2ys4 h THR 106 Cb 0.96 1.83 0.00 0.00 -1.07 0.00 0.00 68.15 69.87 2ys4 h THR 106 CO -0.43 0.59 0.00 0.61 -0.01 0.00 0.00 175.52 176.28 2ys4 n GLY 107 N 0.56 0.79 3.55 2.99 0.00 -0.09 -5.13 105.19 107.85 2ys4 n GLY 107 Ca -0.06 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.58 2ys4 n GLY 107 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2ys4 n GLU 108 N 0.00 0.75 -3.98 1.61 1.02 -1.26 -4.53 120.64 114.26 2ys4 n GLU 108 Ca 0.00 0.29 -0.11 0.00 -0.02 0.00 0.00 57.16 57.32 2ys4 n GLU 108 Cb 0.00 -1.94 -0.12 0.00 -0.02 0.00 0.00 31.44 29.36 2ys4 n GLU 108 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 2ys4 s LYS 109 N -2.38 0.26 0.14 3.49 2.20 -1.26 -0.98 119.74 121.22 2ys4 s LYS 109 Ca 0.72 -0.43 0.07 0.00 -0.36 0.00 0.00 55.97 55.97 2ys4 s LYS 109 Cb -0.44 -0.02 -0.04 0.00 -1.51 0.00 0.00 37.83 35.81 2ys4 s LYS 109 CO 0.51 -0.01 -0.16 0.54 -0.36 0.00 0.00 175.35 175.88 2ys4 s VAL 110 N -0.93 1.51 -0.19 4.02 0.11 -1.14 -4.96 120.40 118.81 2ys4 s VAL 110 Ca -0.09 -1.78 0.01 0.00 -2.93 0.00 0.00 61.98 57.18 2ys4 s VAL 110 Cb -0.07 -1.64 0.04 0.00 -1.53 0.00 0.00 36.38 33.19 2ys4 s VAL 110 CO -0.00 -0.37 -0.09 -0.36 -3.33 0.00 0.00 175.10 170.94 2ys4 s PHE 111 N -2.09 2.26 -0.36 1.54 0.08 -1.26 -2.68 117.98 115.48 2ys4 s PHE 111 Ca 0.11 -1.47 -0.02 0.00 0.12 0.00 0.00 56.93 55.67 2ys4 s PHE 111 Cb -0.05 -1.57 0.09 0.00 -0.57 0.00 0.00 43.02 40.91 2ys4 s PHE 111 CO 0.04 -0.71 0.11 0.08 -0.10 0.00 0.00 175.22 174.64 2ys4 s VAL 112 N 1.45 3.07 0.42 -0.44 1.01 -0.79 -4.88 120.40 120.24 2ys4 s VAL 112 Ca -0.01 -1.83 -0.24 0.00 0.00 0.00 0.00 61.98 59.90 2ys4 s VAL 112 Cb -0.16 -2.99 -0.11 0.00 0.00 0.00 0.00 36.38 33.12 2ys4 s VAL 112 CO -0.08 -0.46 0.96 -0.24 0.00 0.00 0.00 175.10 175.28 2ys4 n SER 113 N 4.57 1.05 -4.64 3.32 2.88 -1.22 -0.41 113.62 119.17 2ys4 n SER 113 Ca -0.06 1.03 -0.31 0.00 -1.33 0.00 0.00 58.87 58.20 2ys4 n SER 113 Cb 0.42 -1.33 -0.09 0.00 -0.75 0.00 0.00 64.21 62.46 2ys4 n SER 113 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 2ys4 s LEU 114 N -0.30 3.33 0.21 2.46 1.43 0.98 -0.81 118.68 125.98 2ys4 s LEU 114 Ca 0.63 -0.16 -0.08 0.00 -1.03 0.00 0.00 54.13 53.49 2ys4 s LEU 114 Cb -0.57 -1.99 -0.02 0.00 0.03 0.00 0.00 46.19 43.64 2ys4 s LEU 114 CO 0.57 0.23 0.32 -0.31 0.23 0.00 0.00 176.35 177.38 2ys4 s TYR 115 N -1.15 0.61 0.00 0.29 2.02 -0.98 -1.63 117.35 116.51 2ys4 s TYR 115 Ca 0.21 -0.94 0.00 0.00 -0.37 0.00 0.00 57.07 55.98 2ys4 s TYR 115 Cb -0.11 -0.11 0.00 0.00 -0.40 0.00 0.00 41.96 41.34 2ys4 s TYR 115 CO 0.13 -0.81 0.00 0.41 -1.57 0.00 0.00 175.55 173.71 2ys4 n GLY 116 N -0.30 -1.80 3.51 0.71 0.00 -1.25 -4.09 105.19 101.98 2ys4 n GLY 116 Ca -0.02 0.69 -0.41 0.00 0.00 0.00 0.00 46.02 46.29 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 0.70 -2.26 4.61 0.00 -1.23 -4.56 120.51 117.77 2ys4 n ALA 117 Ca 0.00 -0.55 -0.33 0.00 0.00 0.00 0.00 53.44 52.56 2ys4 n ALA 117 Cb 0.00 -2.78 -0.06 0.00 0.00 0.00 0.00 19.45 16.61 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 10.21 3.46 0.51 0.00 0.00 -0.02 -2.46 121.76 133.46 2ys4 s ALA 118 Ca 1.12 -0.07 0.02 0.00 0.00 0.00 0.00 51.96 53.04 2ys4 s ALA 118 Cb -0.65 -2.63 -0.01 0.00 0.00 0.00 0.00 23.12 19.83 2ys4 s ALA 118 CO 0.38 0.41 0.07 0.96 0.00 0.00 0.00 175.76 177.58 2ys4 s ILE 119 N -1.76 1.27 -0.31 0.00 -4.36 -0.41 -2.13 121.20 113.50 2ys4 s ILE 119 Ca 0.47 -1.91 -0.03 0.00 -0.26 0.00 0.00 60.65 58.92 2ys4 s ILE 119 Cb -0.12 -2.18 0.05 0.00 1.25 0.00 0.00 42.46 41.45 2ys4 s ILE 119 CO 0.19 0.00 0.02 -0.62 0.24 0.00 0.00 174.94 174.77 2ys4 s ASP 120 N -3.94 4.96 -0.01 4.36 2.15 -1.26 -1.91 116.67 121.01 2ys4 s ASP 120 Ca 0.11 -1.21 0.17 0.00 0.43 0.00 0.00 52.55 52.05 2ys4 s ASP 120 Cb 0.01 -1.75 -0.23 0.00 -0.30 0.00 0.00 42.92 40.65 2ys4 s ASP 120 CO 0.06 -0.27 0.52 0.23 -0.17 0.00 0.00 175.17 175.55 2ys4 n MET 121 N 4.67 0.95 0.00 4.34 2.81 -1.26 -5.07 117.12 123.56 2ys4 n MET 121 Ca -0.13 -0.09 0.00 0.00 -1.81 0.00 0.00 57.70 55.67 2ys4 n MET 121 Cb 0.44 -1.36 0.00 0.00 -0.71 0.00 0.00 33.22 31.59 2ys4 n MET 121 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75