#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 -0.59 0.29 1.61 0.15 -1.26 -5.18 113.70 108.73 2ys4 s SER 2 Ca 0.00 0.87 -0.09 0.00 0.70 0.00 0.00 55.95 57.43 2ys4 s SER 2 Cb 0.00 0.84 0.00 0.00 -1.71 0.00 0.00 66.02 65.15 2ys4 s SER 2 CO 0.00 -0.41 0.48 -0.44 1.20 0.00 0.00 173.24 174.07 2ys4 s SER 3 N -0.53 0.29 0.00 5.45 0.01 -1.26 -5.13 113.70 112.54 2ys4 s SER 3 Ca -0.06 -1.18 0.00 0.00 1.31 0.00 0.00 55.95 56.02 2ys4 s SER 3 Cb -0.03 0.62 0.00 0.00 0.21 0.00 0.00 66.02 66.83 2ys4 s SER 3 CO 0.05 -1.23 0.00 0.61 0.41 0.00 0.00 173.24 173.08 2ys4 n GLY 4 N -0.45 0.33 3.14 3.44 0.00 -1.26 -5.03 105.19 105.35 2ys4 n GLY 4 Ca -0.01 -0.70 -0.18 0.00 0.00 0.00 0.00 46.02 45.13 2ys4 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ys4 n SER 5 N 0.00 -4.78 -0.23 1.61 7.64 -1.26 -4.91 113.62 111.69 2ys4 n SER 5 Ca 0.00 -0.45 -0.06 0.00 1.01 0.00 0.00 58.87 59.37 2ys4 n SER 5 Cb 0.00 -4.16 -0.01 0.00 -1.01 0.00 0.00 64.21 59.03 2ys4 n SER 5 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2ys4 h SER 6 N -2.04 -1.33 -1.62 6.43 0.02 -2.08 -3.46 113.55 109.46 2ys4 h SER 6 Ca -0.46 0.25 0.18 0.00 -0.84 0.00 0.00 61.79 60.91 2ys4 h SER 6 Cb 1.29 0.64 -0.04 0.00 0.14 0.00 0.00 62.40 64.43 2ys4 h SER 6 CO 0.44 -0.31 -0.23 0.61 -1.14 0.00 0.00 176.83 176.19 2ys4 n GLY 7 N -1.43 -1.00 3.17 -3.77 0.00 -1.26 -4.96 105.19 95.93 2ys4 n GLY 7 Ca 0.04 -0.69 -0.09 0.00 0.00 0.00 0.00 46.02 45.28 2ys4 n GLY 7 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2ys4 s THR 8 N -1.26 0.13 -0.85 2.61 -1.32 -1.26 -5.04 115.64 108.65 2ys4 s THR 8 Ca 0.00 -1.75 0.14 0.00 -1.21 0.00 0.00 61.69 58.86 2ys4 s THR 8 Cb 0.00 -1.84 0.64 0.00 -1.51 0.00 0.00 72.50 69.79 2ys4 s THR 8 CO 0.00 -0.58 1.50 -0.62 -2.21 0.00 0.00 174.62 172.72 2ys4 n GLU 9 N -0.06 3.69 -2.85 7.08 -0.58 -1.26 -4.90 120.64 121.76 2ys4 n GLU 9 Ca -0.08 -2.48 -0.14 0.00 -0.42 0.00 0.00 57.16 54.04 2ys4 n GLU 9 Cb 0.63 -1.94 -0.01 0.00 -0.57 0.00 0.00 31.44 29.55 2ys4 n GLU 9 CO 0.00 0.00 0.00 2.89 -0.48 0.00 0.00 177.13 179.54 2ys4 n ARG 10 N 0.74 -2.69 -3.56 3.49 1.85 -1.26 -4.90 116.66 110.32 2ys4 n ARG 10 Ca 0.22 0.36 -0.37 0.00 -1.00 0.00 0.00 57.85 57.06 2ys4 n ARG 10 Cb 0.88 -4.96 -0.08 0.00 -1.05 0.00 0.00 32.46 27.25 2ys4 n ARG 10 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 2ys4 s GLU 11 N -5.43 4.16 0.01 2.89 0.41 -1.26 -5.03 118.70 114.44 2ys4 s GLU 11 Ca 0.16 -0.04 -0.31 0.00 -0.41 0.00 0.00 54.97 54.37 2ys4 s GLU 11 Cb -0.09 -3.50 -0.09 0.00 -1.78 0.00 0.00 34.13 28.67 2ys4 s GLU 11 CO 0.20 0.10 1.97 1.63 -0.49 0.00 0.00 175.26 178.67 2ys4 n LYS 12 N 4.08 2.73 -3.63 1.61 4.76 -1.26 -4.96 118.16 121.49 2ys4 n LYS 12 Ca -0.12 1.00 -0.17 0.00 -2.87 0.00 0.00 58.31 56.15 2ys4 n LYS 12 Cb 0.52 -2.95 -0.15 0.00 -1.84 0.00 0.00 35.03 30.61 2ys4 n LYS 12 CO 0.00 0.00 0.00 0.12 -1.37 0.00 0.00 177.40 176.15 2ys4 s PHE 13 N 4.49 -0.24 0.47 2.13 5.36 -1.26 -5.14 117.98 123.79 2ys4 s PHE 13 Ca 0.90 0.60 -0.23 0.00 -0.96 0.00 0.00 56.93 57.23 2ys4 s PHE 13 Cb -0.48 -0.24 -0.08 0.00 -0.34 0.00 0.00 43.02 41.88 2ys4 s PHE 13 CO 0.44 -0.36 1.16 -0.89 -1.46 0.00 0.00 175.22 174.11 2ys4 n ILE 14 N 5.33 2.92 -1.49 3.12 5.41 -1.26 -4.93 119.36 128.47 2ys4 n ILE 14 Ca -0.05 -0.50 -0.36 0.00 1.00 0.00 0.00 62.75 62.84 2ys4 n ILE 14 Cb 0.50 -1.40 0.09 0.00 -0.71 0.00 0.00 39.64 38.12 2ys4 n ILE 14 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 176.55 177.88 2ys4 n VAL 15 N -0.68 3.79 -0.76 1.39 0.24 -1.26 -5.01 118.33 116.04 2ys4 n VAL 15 Ca 0.09 -0.39 -0.15 0.00 -2.04 0.00 0.00 64.34 61.85 2ys4 n VAL 15 Cb 0.42 -1.36 0.12 0.00 -1.47 0.00 0.00 33.84 31.55 2ys4 n VAL 15 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2ys4 n PRO 16 N -2.35 -2.09 -0.16 7.34 -0.04 -1.26 -4.93 135.00 131.51 2ys4 n PRO 16 Ca 0.15 -0.86 -0.12 0.00 -0.04 0.00 0.00 63.50 62.63 2ys4 n PRO 16 Cb 0.49 -0.81 -0.08 0.00 -0.04 0.00 0.00 33.50 33.06 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 -2.12 0.04 -3.63 0.52 1.08 -2.05 -3.34 117.51 108.00 2ys4 h ILE 17 Ca -0.20 0.00 -0.70 0.00 -0.39 0.00 0.00 64.86 63.57 2ys4 h ILE 17 Cb 0.62 0.04 -0.30 0.00 -3.07 0.00 0.00 36.82 34.11 2ys4 h ILE 17 CO 0.13 0.00 -0.59 -0.75 -0.69 0.00 0.00 178.15 176.25 2ys4 s LYS 18 N -5.72 2.52 -0.14 2.37 2.47 -1.26 -4.94 119.74 115.03 2ys4 s LYS 18 Ca -0.14 -1.31 -0.08 0.00 -1.56 0.00 0.00 55.97 52.88 2ys4 s LYS 18 Cb 0.10 -3.49 -0.24 0.00 -1.46 0.00 0.00 37.83 32.74 2ys4 s LYS 18 CO 0.63 -0.75 0.28 0.00 0.16 0.00 0.00 175.35 175.67 2ys4 n ALA 19 N 4.78 0.93 -1.63 3.13 0.00 -1.26 -4.89 120.51 121.57 2ys4 n ALA 19 Ca -0.11 -0.63 -0.51 0.00 0.00 0.00 0.00 53.44 52.19 2ys4 n ALA 19 Cb 0.44 -0.60 -0.06 0.00 0.00 0.00 0.00 19.45 19.23 2ys4 n ALA 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2ys4 n ARG 20 N -3.58 1.71 0.00 0.00 5.12 -1.26 -4.80 116.66 113.85 2ys4 n ARG 20 Ca -0.34 0.59 0.00 0.00 -1.93 0.00 0.00 57.85 56.18 2ys4 n ARG 20 Cb 1.00 -2.52 0.00 0.00 -1.16 0.00 0.00 32.46 29.78 2ys4 n ARG 20 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2ys4 n GLY 21 N 4.91 0.81 0.86 -0.13 0.00 -1.26 -4.98 105.19 105.40 2ys4 n GLY 21 Ca 0.28 -0.07 0.08 0.00 0.00 0.00 0.00 46.02 46.31 2ys4 n GLY 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ys4 n ALA 22 N -3.00 2.84 -2.44 4.61 0.00 -1.26 -4.61 120.51 116.65 2ys4 n ALA 22 Ca 0.00 -2.07 -0.42 0.00 0.00 0.00 0.00 53.44 50.95 2ys4 n ALA 22 Cb 0.00 -0.66 -0.03 0.00 0.00 0.00 0.00 19.45 18.76 2ys4 n ALA 22 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.50 176.52 2ys4 s ARG 23 N -2.46 4.43 0.01 0.00 1.70 -1.26 -4.58 118.95 116.80 2ys4 s ARG 23 Ca 0.39 1.74 -0.10 0.00 -0.47 0.00 0.00 55.73 57.28 2ys4 s ARG 23 Cb 0.30 -3.38 -0.05 0.00 -0.57 0.00 0.00 34.95 31.25 2ys4 s ARG 23 CO 0.10 -0.27 0.34 0.00 -1.08 0.00 0.00 175.30 174.39 2ys4 s ALA 24 N 1.19 3.77 -0.14 7.88 0.00 -1.26 -3.27 121.76 129.93 2ys4 s ALA 24 Ca 0.58 -0.41 -0.07 0.00 0.00 0.00 0.00 51.96 52.06 2ys4 s ALA 24 Cb -0.28 -2.22 0.06 0.00 0.00 0.00 0.00 23.12 20.67 2ys4 s ALA 24 CO 0.28 0.57 0.32 0.42 0.00 0.00 0.00 175.76 177.35 2ys4 s ILE 25 N -1.23 -0.14 0.57 0.00 1.01 -1.26 -4.93 121.20 115.23 2ys4 s ILE 25 Ca 0.27 0.15 0.09 0.00 0.00 0.00 0.00 60.65 61.15 2ys4 s ILE 25 Cb -0.14 -0.49 0.08 0.00 0.01 0.00 0.00 42.46 41.92 2ys4 s ILE 25 CO 0.14 0.06 0.71 -0.76 0.00 0.00 0.00 174.94 175.09 2ys4 s LEU 26 N 1.58 2.97 -0.31 2.97 2.01 -1.26 -0.31 118.68 126.34 2ys4 s LEU 26 Ca -0.07 -0.97 0.02 0.00 0.01 0.00 0.00 54.13 53.12 2ys4 s LEU 26 Cb -0.10 -1.47 0.09 0.00 0.01 0.00 0.00 46.19 44.72 2ys4 s LEU 26 CO -0.10 -1.31 0.04 -0.62 1.01 0.00 0.00 176.35 175.36 2ys4 s ASP 27 N -4.59 4.38 0.05 2.29 -1.08 -1.16 -4.75 116.67 111.82 2ys4 s ASP 27 Ca 0.55 -1.81 0.09 0.00 -0.52 0.00 0.00 52.55 50.86 2ys4 s ASP 27 Cb -0.05 -1.33 -0.03 0.00 -1.46 0.00 0.00 42.92 40.06 2ys4 s ASP 27 CO 0.35 -0.36 -0.24 -0.36 0.52 0.00 0.00 175.17 175.08 2ys4 s PHE 28 N 1.20 2.39 0.68 -5.34 0.40 -1.26 -4.45 117.98 111.59 2ys4 s PHE 28 Ca 0.07 -0.37 -0.14 0.00 -0.60 0.00 0.00 56.93 55.89 2ys4 s PHE 28 Cb -0.18 -1.40 0.01 0.00 0.51 0.00 0.00 43.02 41.96 2ys4 s PHE 28 CO -0.13 0.18 1.11 -1.25 0.70 0.00 0.00 175.22 175.84 2ys4 s PRO 29 N -1.39 2.72 0.26 0.24 0.04 -1.26 -4.93 135.00 130.68 2ys4 s PRO 29 Ca 0.13 1.35 -0.01 0.00 0.04 0.00 0.00 61.00 62.51 2ys4 s PRO 29 Cb -0.10 -1.94 0.55 0.00 0.04 0.00 0.00 34.50 33.05 2ys4 s PRO 29 CO 0.03 -1.31 1.73 -0.44 0.04 0.00 0.00 177.00 177.06 2ys4 h ASP 30 N -0.15 0.37 -5.05 6.66 5.19 -1.97 -3.45 116.42 118.01 2ys4 h ASP 30 Ca -0.46 0.12 0.04 0.00 -0.62 0.00 0.00 57.03 56.10 2ys4 h ASP 30 Cb 1.24 0.08 -0.06 0.00 0.18 0.00 0.00 39.33 40.77 2ys4 h ASP 30 CO 0.54 0.11 0.15 -1.59 -3.12 0.00 0.00 179.24 175.33 2ys4 s LYS 31 N -5.97 1.71 -0.40 3.56 -2.85 -1.26 -3.34 119.74 111.19 2ys4 s LYS 31 Ca -0.12 -1.02 -0.14 0.00 -1.00 0.00 0.00 55.97 53.69 2ys4 s LYS 31 Cb 0.22 0.58 0.02 0.00 -2.06 0.00 0.00 37.83 36.59 2ys4 s LYS 31 CO 0.77 -0.77 0.28 -1.17 0.10 0.00 0.00 175.35 174.57 2ys4 s LEU 32 N -2.93 5.03 -0.39 2.77 1.98 -0.61 -4.95 118.68 119.57 2ys4 s LEU 32 Ca 0.13 -0.91 -0.19 0.00 -2.89 0.00 0.00 54.13 50.27 2ys4 s LEU 32 Cb -0.05 -2.13 0.01 0.00 0.66 0.00 0.00 46.19 44.68 2ys4 s LEU 32 CO 0.06 -0.44 0.56 0.21 -1.89 0.00 0.00 176.35 174.86 2ys4 s ASN 33 N 1.66 6.31 -0.42 3.68 3.84 -1.26 -1.94 114.94 126.81 2ys4 s ASN 33 Ca 0.04 -0.23 -0.13 0.00 0.21 0.00 0.00 52.86 52.75 2ys4 s ASN 33 Cb -0.19 -2.29 0.05 0.00 -0.55 0.00 0.00 41.25 38.27 2ys4 s ASN 33 CO 0.09 -0.62 0.29 -0.36 -2.79 0.00 0.00 177.10 173.71 2ys4 s PHE 34 N 2.54 3.26 1.11 0.43 0.08 -1.26 -5.00 117.98 119.14 2ys4 s PHE 34 Ca 0.20 -0.96 -0.16 0.00 0.12 0.00 0.00 56.93 56.13 2ys4 s PHE 34 Cb -0.15 -2.76 0.22 0.00 -0.57 0.00 0.00 43.02 39.76 2ys4 s PHE 34 CO 0.16 -0.71 0.46 0.43 -0.10 0.00 0.00 175.22 175.46 2ys4 n SER 35 N 5.08 -3.23 -4.62 1.36 7.64 -1.26 -3.55 113.62 115.04 2ys4 n SER 35 Ca -0.11 -0.49 -0.51 0.00 1.01 0.00 0.00 58.87 58.76 2ys4 n SER 35 Cb 0.45 -0.82 -0.06 0.00 -1.01 0.00 0.00 64.21 62.77 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 -4.71 0.39 -4.16 0.44 -1.04 -1.26 -4.45 114.28 99.49 2ys4 n THR 36 Ca 0.07 -0.15 -0.13 0.00 -2.04 0.00 0.00 64.05 61.81 2ys4 n THR 36 Cb 0.40 -1.65 -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 -3.08 4.46 0.00 0.00 0.04 -1.26 -2.69 135.00 132.47 2ys4 s PRO 38 Ca 0.06 2.05 -0.17 0.00 0.04 0.00 0.00 61.00 62.98 2ys4 s PRO 38 Cb -0.00 -3.13 -0.10 0.00 0.04 0.00 0.00 34.50 31.31 2ys4 s PRO 38 CO -0.02 -0.06 0.89 -0.24 0.04 0.00 0.00 177.00 177.61 2ys4 h VAL 39 N 3.16 0.00 0.49 -0.36 3.04 -1.88 -3.36 116.25 117.33 2ys4 h VAL 39 Ca -0.48 -0.28 -0.02 0.00 -1.01 0.00 0.00 66.70 64.92 2ys4 h VAL 39 Cb 1.22 0.00 -0.01 0.00 -2.01 0.00 0.00 31.29 30.49 2ys4 h VAL 39 CO 0.68 0.00 -0.35 0.11 -1.01 0.00 0.00 177.57 176.99 2ys4 h LYS 40 N -0.90 -0.77 -6.71 4.17 6.56 -1.85 -3.27 116.57 113.79 2ys4 h LYS 40 Ca -0.06 0.05 -0.56 0.00 -1.06 0.00 0.00 60.65 59.02 2ys4 h LYS 40 Cb 0.48 0.18 0.19 0.00 -0.57 0.00 0.00 32.23 32.51 2ys4 h LYS 40 CO 0.11 -0.51 -0.37 0.66 -2.06 0.00 0.00 179.45 177.28 2ys4 n TYR 41 N -4.55 -0.72 -2.89 -1.35 4.02 -1.26 -4.78 117.16 105.62 2ys4 n TYR 41 Ca -0.10 0.34 -0.30 0.00 -0.01 0.00 0.00 57.90 57.84 2ys4 n TYR 41 Cb 0.34 -1.92 -0.03 0.00 -0.02 0.00 0.00 39.34 37.72 2ys4 n TYR 41 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 2ys4 s SER 42 N -1.57 6.48 0.11 7.72 1.04 -1.26 -4.69 113.70 121.52 2ys4 s SER 42 Ca 0.65 1.05 0.10 0.00 0.48 0.00 0.00 55.95 58.23 2ys4 s SER 42 Cb -0.33 -2.29 -0.04 0.00 0.10 0.00 0.00 66.02 63.47 2ys4 s SER 42 CO 0.59 -0.39 -0.26 -0.89 0.98 0.00 0.00 173.24 173.26 2ys4 s THR 43 N -2.38 2.17 0.03 2.02 2.01 -1.17 -4.95 115.64 113.38 2ys4 s THR 43 Ca 0.50 -1.67 -0.01 0.00 0.31 0.00 0.00 61.69 60.82 2ys4 s THR 43 Cb -0.10 -1.92 -0.02 0.00 0.01 0.00 0.00 72.50 70.47 2ys4 s THR 43 CO 0.33 0.12 -0.01 -1.10 -0.69 0.00 0.00 174.62 173.27 2ys4 s GLN 44 N -1.90 0.44 0.09 4.92 1.11 -1.26 -2.75 119.66 120.31 2ys4 s GLN 44 Ca 0.13 -0.79 -0.26 0.00 0.01 0.00 0.00 55.36 54.45 2ys4 s GLN 44 Cb -0.10 0.16 0.08 0.00 -1.01 0.00 0.00 33.01 32.14 2ys4 s GLN 44 CO 0.05 -0.08 0.74 0.21 0.01 0.00 0.00 175.29 176.22 2ys4 s LYS 45 N -2.29 1.09 0.05 2.91 2.20 -1.13 -4.99 119.74 117.58 2ys4 s LYS 45 Ca -0.08 -0.41 0.09 0.00 -0.36 0.00 0.00 55.97 55.21 2ys4 s LYS 45 Cb -0.04 0.49 -0.03 0.00 -1.51 0.00 0.00 37.83 36.74 2ys4 s LYS 45 CO -0.04 -0.48 -0.24 0.42 -0.36 0.00 0.00 175.35 174.65 2ys4 s ILE 46 N -3.46 2.31 -0.20 5.43 1.01 -1.26 -1.27 121.20 123.76 2ys4 s ILE 46 Ca 0.03 -1.38 -0.01 0.00 0.00 0.00 0.00 60.65 59.30 2ys4 s ILE 46 Cb -0.01 -1.93 0.05 0.00 0.01 0.00 0.00 42.46 40.58 2ys4 s ILE 46 CO -0.10 0.33 -0.04 -0.22 0.00 0.00 0.00 174.94 174.91 2ys4 s LEU 47 N -1.37 1.87 -0.15 2.97 2.96 -0.13 -4.91 118.68 119.92 2ys4 s LEU 47 Ca 0.13 -0.87 -0.29 0.00 -0.22 0.00 0.00 54.13 52.87 2ys4 s LEU 47 Cb -0.10 -0.95 -0.02 0.00 0.50 0.00 0.00 46.19 45.62 2ys4 s LEU 47 CO 0.03 -0.22 1.30 -0.22 -1.32 0.00 0.00 176.35 175.92 2ys4 s LEU 48 N 1.59 4.20 -0.16 -0.68 1.98 -1.26 -1.52 118.68 122.83 2ys4 s LEU 48 Ca -0.02 1.75 -0.01 0.00 -2.89 0.00 0.00 54.13 52.96 2ys4 s LEU 48 Cb -0.17 -3.54 -0.01 0.00 0.66 0.00 0.00 46.19 43.13 2ys4 s LEU 48 CO -0.07 -0.78 -0.11 -0.69 -1.89 0.00 0.00 176.35 172.81 2ys4 s VAL 49 N 3.54 3.10 -0.13 1.68 1.01 0.85 -4.95 120.40 125.50 2ys4 s VAL 49 Ca 0.57 -0.62 0.01 0.00 0.00 0.00 0.00 61.98 61.93 2ys4 s VAL 49 Cb -0.23 -2.34 -0.01 0.00 0.00 0.00 0.00 36.38 33.81 2ys4 s VAL 49 CO 0.16 0.50 -0.15 -0.60 0.00 0.00 0.00 175.10 175.01 2ys4 s ARG 50 N 0.71 3.30 -0.30 2.72 3.52 -1.26 -0.52 118.95 127.11 2ys4 s ARG 50 Ca -0.05 -0.73 -0.29 0.00 -0.13 0.00 0.00 55.73 54.53 2ys4 s ARG 50 Cb -0.15 -2.58 -0.00 0.00 -1.56 0.00 0.00 34.95 30.65 2ys4 s ARG 50 CO 0.02 0.16 1.41 1.21 -0.81 0.00 0.00 175.30 177.29 2ys4 s ASN 51 N 0.46 6.51 -0.17 -2.12 3.84 -1.12 -3.00 114.94 119.36 2ys4 s ASN 51 Ca -0.11 1.24 0.16 0.00 0.21 0.00 0.00 52.86 54.36 2ys4 s ASN 51 Cb -0.16 -2.54 0.72 0.00 -0.55 0.00 0.00 41.25 38.72 2ys4 s ASN 51 CO 0.05 -1.21 1.63 2.30 -2.79 0.00 0.00 177.10 177.08 2ys4 n ILE 52 N 6.46 2.25 -0.98 -5.21 -5.35 0.58 -3.28 119.36 113.83 2ys4 n ILE 52 Ca 0.16 -1.39 0.00 0.00 -0.27 0.00 0.00 62.75 61.26 2ys4 n ILE 52 Cb 0.47 -0.08 0.00 0.00 -1.74 0.00 0.00 39.64 38.29 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 0.64 0.69 0.03 3.28 0.00 -0.82 -4.74 105.19 104.27 2ys4 n GLY 53 Ca 0.25 -1.83 -0.04 0.00 0.00 0.00 0.00 46.02 44.41 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 0.00 3.26 -4.52 1.61 6.94 -1.20 -4.82 115.26 116.53 2ys4 n ASN 54 Ca 0.00 -0.00 -0.27 0.00 -0.02 0.00 0.00 54.58 54.29 2ys4 n ASN 54 Cb 0.00 0.66 -0.09 0.00 -2.36 0.00 0.00 39.78 37.99 2ys4 n ASN 54 CO 0.00 0.00 0.00 -0.75 -1.03 0.00 0.00 177.26 175.48 2ys4 s LYS 55 N -2.17 1.93 -0.21 -3.83 2.20 -1.26 -4.85 119.74 111.55 2ys4 s LYS 55 Ca -0.04 -2.15 -0.36 0.00 -0.36 0.00 0.00 55.97 53.07 2ys4 s LYS 55 Cb 0.02 -1.21 -0.13 0.00 -1.51 0.00 0.00 37.83 35.00 2ys4 s LYS 55 CO 0.29 -0.25 1.91 -1.71 -0.36 0.00 0.00 175.35 175.23 2ys4 n ASN 56 N -1.03 2.82 -4.80 1.43 5.15 -1.26 -4.47 115.26 113.10 2ys4 n ASN 56 Ca -0.08 0.87 -0.38 0.00 -0.60 0.00 0.00 54.58 54.39 2ys4 n ASN 56 Cb 0.66 -1.28 -0.06 0.00 -0.53 0.00 0.00 39.78 38.58 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 4.71 3.45 -0.26 5.20 0.00 -0.02 -4.84 121.76 129.99 2ys4 s ALA 57 Ca 0.98 0.22 -0.01 0.00 0.00 0.00 0.00 51.96 53.16 2ys4 s ALA 57 Cb -0.85 -2.84 0.08 0.00 0.00 0.00 0.00 23.12 19.51 2ys4 s ALA 57 CO 0.56 0.32 0.04 0.08 0.00 0.00 0.00 175.76 176.76 2ys4 s VAL 58 N -1.34 1.04 0.12 0.00 1.01 -1.26 -1.76 120.40 118.21 2ys4 s VAL 58 Ca 0.39 -1.21 0.08 0.00 0.00 0.00 0.00 61.98 61.23 2ys4 s VAL 58 Cb -0.19 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 2ys4 s VAL 58 CO 0.23 -0.42 -0.11 0.72 0.00 0.00 0.00 175.10 175.51 2ys4 s PHE 59 N 1.57 2.69 -0.27 5.22 -0.71 -1.14 -2.28 117.98 123.06 2ys4 s PHE 59 Ca 0.03 -0.19 -0.04 0.00 -1.04 0.00 0.00 56.93 55.70 2ys4 s PHE 59 Cb -0.18 -1.39 0.09 0.00 -1.21 0.00 0.00 43.02 40.33 2ys4 s PHE 59 CO -0.15 0.43 0.11 -1.58 -1.34 0.00 0.00 175.22 172.70 2ys4 s HIS 60 N -1.27 0.52 0.26 3.49 2.46 0.19 -2.67 115.29 118.27 2ys4 s HIS 60 Ca 0.21 -0.91 -0.16 0.00 0.47 0.00 0.00 55.06 54.67 2ys4 s HIS 60 Cb -0.11 -0.98 -0.08 0.00 -0.13 0.00 0.00 32.58 31.28 2ys4 s HIS 60 CO 0.13 -0.78 0.70 0.42 -2.47 0.00 0.00 174.74 172.74 2ys4 s ILE 61 N 2.03 4.68 -0.03 0.89 1.01 0.11 -1.08 121.20 128.81 2ys4 s ILE 61 Ca 0.08 1.01 -0.02 0.00 0.00 0.00 0.00 60.65 61.72 2ys4 s ILE 61 Cb -0.16 -3.71 0.02 0.00 0.01 0.00 0.00 42.46 38.61 2ys4 s ILE 61 CO -0.30 0.00 0.07 -1.59 0.00 0.00 0.00 174.94 173.13 2ys4 s LYS 62 N -2.52 0.06 0.29 2.79 0.00 -1.13 -4.55 119.74 114.68 2ys4 s LYS 62 Ca 0.48 0.15 -0.19 0.00 0.00 0.00 0.00 55.97 56.41 2ys4 s LYS 62 Cb -0.13 -0.05 0.05 0.00 0.00 0.00 0.00 37.83 37.70 2ys4 s LYS 62 CO 0.19 -0.06 0.84 -0.08 0.00 0.00 0.00 175.35 176.24 2ys4 s THR 63 N 0.42 0.00 0.05 3.79 -1.32 -1.26 -4.28 115.64 113.04 2ys4 s THR 63 Ca -0.03 -0.88 0.02 0.00 -1.21 0.00 0.00 61.69 59.58 2ys4 s THR 63 Cb -0.05 -2.55 -0.03 0.00 -1.51 0.00 0.00 72.50 68.37 2ys4 s THR 63 CO -0.02 0.00 -0.07 0.00 -2.21 0.00 0.00 174.62 172.33 2ys4 n ARG 65 N 1.13 -0.19 0.00 0.00 1.85 -1.26 -1.61 116.66 116.57 2ys4 n ARG 65 Ca -0.21 -0.01 0.08 0.00 -1.00 0.00 0.00 57.85 56.71 2ys4 n ARG 65 Cb 0.56 -1.84 0.45 0.00 -1.05 0.00 0.00 32.46 30.58 2ys4 n ARG 65 CO 0.00 0.00 0.00 -0.35 -0.01 0.00 0.00 177.63 177.27 2ys4 n PRO 66 N -1.49 0.45 -3.37 2.89 -0.04 -1.26 -4.99 135.00 127.19 2ys4 n PRO 66 Ca 0.07 0.02 -0.38 0.00 -0.04 0.00 0.00 63.50 63.17 2ys4 n PRO 66 Cb 0.53 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.41 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 -2.09 3.36 -0.03 0.54 0.08 -0.63 -3.06 117.98 116.15 2ys4 s PHE 67 Ca 0.22 0.62 -0.27 0.00 0.12 0.00 0.00 56.93 57.61 2ys4 s PHE 67 Cb 0.11 -2.55 0.06 0.00 -0.57 0.00 0.00 43.02 40.06 2ys4 s PHE 67 CO 0.19 -0.05 0.60 -1.12 -0.10 0.00 0.00 175.22 174.74 2ys4 s SER 68 N 1.13 -0.56 0.10 1.36 0.01 -0.34 -2.48 113.70 112.92 2ys4 s SER 68 Ca 0.19 0.55 -0.00 0.00 1.31 0.00 0.00 55.95 57.99 2ys4 s SER 68 Cb -0.15 0.50 -0.04 0.00 0.21 0.00 0.00 66.02 66.54 2ys4 s SER 68 CO 0.08 -0.60 0.01 0.27 0.41 0.00 0.00 173.24 173.41 2ys4 s ILE 69 N -1.39 0.27 -0.24 1.44 -0.00 -1.26 0.65 121.20 120.67 2ys4 s ILE 69 Ca -0.11 -1.89 -0.22 0.00 -0.00 0.00 0.00 60.65 58.44 2ys4 s ILE 69 Cb -0.01 -1.84 0.06 0.00 -0.00 0.00 0.00 42.46 40.68 2ys4 s ILE 69 CO 0.07 -0.69 0.64 -0.70 -0.00 0.00 0.00 174.94 174.27 2ys4 s GLU 70 N -3.97 0.75 0.46 0.37 2.12 -0.53 -3.83 118.70 114.06 2ys4 s GLU 70 Ca 0.17 0.91 -0.23 0.00 0.36 0.00 0.00 54.97 56.18 2ys4 s GLU 70 Cb 0.07 0.35 -0.07 0.00 0.26 0.00 0.00 34.13 34.74 2ys4 s GLU 70 CO -0.03 -0.09 1.17 -1.25 -0.54 0.00 0.00 175.26 174.51 2ys4 s PRO 71 N 0.41 3.78 0.46 4.30 0.04 -1.26 -2.77 135.00 139.96 2ys4 s PRO 71 Ca -0.01 1.78 0.20 0.00 0.04 0.00 0.00 61.00 63.01 2ys4 s PRO 71 Cb -0.05 -2.42 1.14 0.00 0.04 0.00 0.00 34.50 33.21 2ys4 s PRO 71 CO -0.00 -0.54 1.99 0.00 0.04 0.00 0.00 177.00 178.49 2ys4 h ALA 72 N 2.09 1.41 -3.05 8.56 0.00 -1.86 -3.44 119.26 122.97 2ys4 h ALA 72 Ca -0.49 -0.18 -0.17 0.00 0.00 0.00 0.00 54.91 54.07 2ys4 h ALA 72 Cb 1.25 -0.03 -0.23 0.00 0.00 0.00 0.00 17.79 18.78 2ys4 h ALA 72 CO 0.60 0.25 -0.59 -1.50 0.00 0.00 0.00 179.25 178.01 2ys4 s ILE 73 N -4.30 0.07 0.02 0.00 2.07 -1.26 -0.71 121.20 117.09 2ys4 s ILE 73 Ca -0.03 -0.54 -0.28 0.00 -1.41 0.00 0.00 60.65 58.38 2ys4 s ILE 73 Cb 0.14 -0.29 0.10 0.00 0.13 0.00 0.00 42.46 42.53 2ys4 s ILE 73 CO 0.65 -0.30 0.92 -0.83 -1.91 0.00 0.00 174.94 173.47 2ys4 s GLY 74 N -0.97 -0.41 -0.14 1.50 0.00 -1.09 -5.03 107.32 101.18 2ys4 s GLY 74 Ca -0.11 0.84 0.02 0.00 0.00 0.00 0.00 44.72 45.47 2ys4 s GLY 74 CO 0.00 0.27 -0.19 -0.51 0.00 0.00 0.00 173.10 172.67 2ys4 s THR 75 N -3.13 2.37 -0.09 0.90 -4.23 -1.26 -2.87 115.64 107.33 2ys4 s THR 75 Ca 0.07 -0.88 0.00 0.00 -1.18 0.00 0.00 61.69 59.70 2ys4 s THR 75 Cb -0.01 -1.97 -0.03 0.00 1.34 0.00 0.00 72.50 71.84 2ys4 s THR 75 CO -0.07 0.54 -0.07 -0.22 -0.54 0.00 0.00 174.62 174.26 2ys4 s LEU 76 N 0.73 3.11 0.37 4.79 2.96 -0.72 -4.97 118.68 124.95 2ys4 s LEU 76 Ca -0.08 -0.08 -0.07 0.00 -0.22 0.00 0.00 54.13 53.68 2ys4 s LEU 76 Cb -0.16 -1.69 -0.05 0.00 0.50 0.00 0.00 46.19 44.79 2ys4 s LEU 76 CO 0.01 0.31 0.68 0.20 -1.32 0.00 0.00 176.35 176.23 2ys4 s ASN 77 N -0.51 6.44 0.52 3.68 0.01 -1.26 -0.84 114.94 122.98 2ys4 s ASN 77 Ca 0.08 0.90 -0.22 0.00 -0.71 0.00 0.00 52.86 52.91 2ys4 s ASN 77 Cb -0.12 -2.23 -0.06 0.00 0.41 0.00 0.00 41.25 39.26 2ys4 s ASN 77 CO 0.02 -0.35 1.25 0.68 -1.51 0.00 0.00 177.10 177.20 2ys4 s VAL 78 N -2.32 2.58 0.00 1.60 -7.23 -1.26 -2.80 120.40 110.97 2ys4 s VAL 78 Ca 0.47 0.42 0.00 0.00 -1.81 0.00 0.00 61.98 61.06 2ys4 s VAL 78 Cb -0.10 -3.21 0.00 0.00 0.56 0.00 0.00 36.38 33.63 2ys4 s VAL 78 CO 0.33 -0.02 0.00 0.61 -0.31 0.00 0.00 175.10 175.71 2ys4 n GLY 79 N 0.58 1.69 3.98 2.32 0.00 -1.20 -4.94 105.19 107.61 2ys4 n GLY 79 Ca 0.10 -0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.89 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 2.14 0.29 1.61 0.41 -1.12 -4.92 118.70 117.12 2ys4 s GLU 80 Ca 0.00 -0.87 0.05 0.00 -0.41 0.00 0.00 54.97 53.74 2ys4 s GLU 80 Cb 0.00 -2.39 -0.03 0.00 -1.78 0.00 0.00 34.13 29.93 2ys4 s GLU 80 CO 0.00 -1.07 0.23 -1.12 -0.49 0.00 0.00 175.26 172.80 2ys4 s SER 81 N -4.57 1.26 0.31 -0.19 0.01 -1.26 -2.77 113.70 106.49 2ys4 s SER 81 Ca 0.61 -1.64 -0.12 0.00 1.31 0.00 0.00 55.95 56.11 2ys4 s SER 81 Cb -0.08 0.50 0.01 0.00 0.21 0.00 0.00 66.02 66.66 2ys4 s SER 81 CO 0.41 -0.99 0.57 0.00 0.41 0.00 0.00 173.24 173.65 2ys4 s MET 82 N -3.67 1.82 0.04 12.44 0.23 0.32 -4.98 119.30 125.50 2ys4 s MET 82 Ca 0.40 -1.39 0.09 0.00 -1.03 0.00 0.00 55.69 53.75 2ys4 s MET 82 Cb 0.04 0.51 -0.03 0.00 -1.53 0.00 0.00 34.83 33.82 2ys4 s MET 82 CO 0.22 -0.79 -0.25 -0.65 -2.03 0.00 0.00 175.02 171.53 2ys4 s GLN 83 N -3.40 1.87 -0.15 3.16 -0.21 -1.26 -0.10 119.66 119.57 2ys4 s GLN 83 Ca 0.22 -1.08 -0.01 0.00 0.02 0.00 0.00 55.36 54.52 2ys4 s GLN 83 Cb -0.02 -2.03 0.04 0.00 1.00 0.00 0.00 33.01 32.00 2ys4 s GLN 83 CO 0.12 0.52 -0.05 -0.51 -2.12 0.00 0.00 175.29 173.26 2ys4 s LEU 84 N -1.26 1.40 0.11 2.90 1.43 -0.58 -4.88 118.68 117.80 2ys4 s LEU 84 Ca 0.12 -0.55 -0.23 0.00 -1.03 0.00 0.00 54.13 52.45 2ys4 s LEU 84 Cb -0.10 -0.84 -0.07 0.00 0.03 0.00 0.00 46.19 45.21 2ys4 s LEU 84 CO 0.03 -0.18 0.68 -1.61 0.23 0.00 0.00 176.35 175.50 2ys4 s GLU 85 N 1.69 4.40 -0.06 1.70 8.01 -1.11 -0.95 118.70 132.38 2ys4 s GLU 85 Ca 0.02 0.96 0.04 0.00 0.01 0.00 0.00 54.97 56.00 2ys4 s GLU 85 Cb -0.15 -3.27 0.00 0.00 -4.31 0.00 0.00 34.13 26.41 2ys4 s GLU 85 CO -0.08 0.55 -0.18 0.08 0.01 0.00 0.00 175.26 175.65 2ys4 s VAL 86 N -0.95 1.54 -0.10 2.63 1.01 -0.40 -1.46 120.40 122.67 2ys4 s VAL 86 Ca 0.33 -0.75 0.01 0.00 0.00 0.00 0.00 61.98 61.57 2ys4 s VAL 86 Cb -0.21 -1.34 -0.02 0.00 0.00 0.00 0.00 36.38 34.81 2ys4 s VAL 86 CO 0.23 0.44 -0.12 -0.70 0.00 0.00 0.00 175.10 174.95 2ys4 s GLU 87 N 0.22 3.03 -0.25 2.72 2.12 0.21 -2.83 118.70 123.91 2ys4 s GLU 87 Ca -0.09 -0.66 -0.03 0.00 0.36 0.00 0.00 54.97 54.55 2ys4 s GLU 87 Cb -0.14 -2.56 0.14 0.00 0.26 0.00 0.00 34.13 31.84 2ys4 s GLU 87 CO 0.04 0.41 0.42 0.12 -0.54 0.00 0.00 175.26 175.71 2ys4 s PHE 88 N -0.16 -0.97 -0.31 5.30 5.36 -1.11 -1.20 117.98 124.89 2ys4 s PHE 88 Ca -0.00 1.04 0.02 0.00 -0.96 0.00 0.00 56.93 57.03 2ys4 s PHE 88 Cb -0.13 0.14 0.09 0.00 -0.34 0.00 0.00 43.02 42.78 2ys4 s PHE 88 CO 0.03 -0.73 0.05 -2.00 -1.46 0.00 0.00 175.22 171.11 2ys4 s GLU 89 N 2.61 1.21 1.19 10.12 -6.30 -1.17 -3.02 118.70 123.34 2ys4 s GLU 89 Ca 0.13 -1.39 -0.19 0.00 -2.50 0.00 0.00 54.97 51.03 2ys4 s GLU 89 Cb -0.15 -2.62 0.28 0.00 0.00 0.00 0.00 34.13 31.64 2ys4 s GLU 89 CO -0.17 -0.89 1.11 -1.25 0.02 0.00 0.00 175.26 174.08 2ys4 s PRO 90 N 1.27 -1.09 -0.02 4.30 0.04 -1.23 -4.79 135.00 133.48 2ys4 s PRO 90 Ca 0.07 -0.02 0.01 0.00 0.04 0.00 0.00 61.00 61.10 2ys4 s PRO 90 Cb -0.18 -1.61 -0.02 0.00 0.04 0.00 0.00 34.50 32.73 2ys4 s PRO 90 CO -0.14 -3.63 -0.01 1.04 0.04 0.00 0.00 177.00 174.29 2ys4 n GLN 91 N -4.71 1.09 -4.32 4.56 1.13 -1.26 -4.34 117.38 109.52 2ys4 n GLN 91 Ca 0.12 0.01 -0.30 0.00 -1.94 0.00 0.00 57.00 54.89 2ys4 n GLN 91 Cb 0.59 -1.05 -0.10 0.00 0.11 0.00 0.00 30.24 29.79 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 -3.97 4.42 0.38 1.08 0.01 -1.26 -4.73 113.70 109.63 2ys4 s SER 92 Ca -0.03 -0.33 -0.27 0.00 1.31 0.00 0.00 55.95 56.64 2ys4 s SER 92 Cb 0.01 -0.89 -0.09 0.00 0.21 0.00 0.00 66.02 65.26 2ys4 s SER 92 CO 0.07 0.21 1.28 -0.69 0.41 0.00 0.00 173.24 174.52 2ys4 s VAL 93 N -1.14 2.75 0.00 3.43 1.01 -1.26 -4.91 120.40 120.27 2ys4 s VAL 93 Ca 0.20 0.69 0.00 0.00 0.00 0.00 0.00 61.98 62.87 2ys4 s VAL 93 Cb -0.11 -3.42 0.00 0.00 0.00 0.00 0.00 36.38 32.85 2ys4 s VAL 93 CO 0.12 0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.95 2ys4 n GLY 94 N 0.72 4.08 3.74 4.51 0.00 -1.22 -4.99 105.19 112.03 2ys4 n GLY 94 Ca 0.02 -1.60 -0.42 0.00 0.00 0.00 0.00 46.02 44.03 2ys4 n GLY 94 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2ys4 s ASP 95 N 0.00 6.59 -0.21 1.61 -1.08 -1.26 -3.20 116.67 119.11 2ys4 s ASP 95 Ca 0.00 2.70 0.00 0.00 -0.52 0.00 0.00 52.55 54.73 2ys4 s ASP 95 Cb 0.00 -2.62 0.05 0.00 -1.46 0.00 0.00 42.92 38.90 2ys4 s ASP 95 CO 0.00 -0.77 -0.06 -1.00 0.52 0.00 0.00 175.17 173.86 2ys4 s HIS 96 N 0.29 2.21 0.14 -5.34 3.76 -1.26 -4.98 115.29 110.11 2ys4 s HIS 96 Ca 0.63 -1.56 0.05 0.00 -0.15 0.00 0.00 55.06 54.03 2ys4 s HIS 96 Cb -0.43 -1.52 -0.04 0.00 1.11 0.00 0.00 32.58 31.70 2ys4 s HIS 96 CO 0.41 -0.73 0.09 -1.54 -0.85 0.00 0.00 174.74 172.12 2ys4 s SER 97 N 1.46 5.36 0.00 1.40 1.04 -1.26 -3.32 113.70 118.38 2ys4 s SER 97 Ca -0.03 -0.15 0.00 0.00 0.48 0.00 0.00 55.95 56.24 2ys4 s SER 97 Cb -0.18 -1.36 0.00 0.00 0.10 0.00 0.00 66.02 64.59 2ys4 s SER 97 CO -0.07 0.10 0.00 0.61 0.98 0.00 0.00 173.24 174.86 2ys4 n GLY 98 N -0.07 4.47 3.54 7.32 0.00 -1.10 -4.84 105.19 114.50 2ys4 n GLY 98 Ca -0.09 -1.02 -0.04 0.00 0.00 0.00 0.00 46.02 44.87 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 1.49 0.53 -0.28 1.61 3.52 -1.26 -1.10 118.95 123.46 2ys4 s ARG 99 Ca 0.00 1.30 -0.13 0.00 -0.13 0.00 0.00 55.73 56.77 2ys4 s ARG 99 Cb 0.00 0.62 -0.04 0.00 -1.56 0.00 0.00 34.95 33.97 2ys4 s ARG 99 CO 0.00 -0.20 0.28 -0.51 -0.81 0.00 0.00 175.30 174.06 2ys4 s LEU 100 N 2.61 4.07 -0.22 -0.88 1.43 0.86 -4.85 118.68 121.70 2ys4 s LEU 100 Ca -0.06 0.09 -0.09 0.00 -1.03 0.00 0.00 54.13 53.04 2ys4 s LEU 100 Cb -0.11 -2.26 -0.05 0.00 0.03 0.00 0.00 46.19 43.80 2ys4 s LEU 100 CO -0.17 -0.13 0.12 -0.63 0.23 0.00 0.00 176.35 175.77 2ys4 s ILE 101 N 1.91 5.14 -0.00 -0.59 1.01 -1.26 -0.90 121.20 126.51 2ys4 s ILE 101 Ca 0.11 0.10 0.03 0.00 0.00 0.00 0.00 60.65 60.88 2ys4 s ILE 101 Cb -0.16 -3.37 -0.03 0.00 0.01 0.00 0.00 42.46 38.90 2ys4 s ILE 101 CO 0.11 0.39 -0.05 -0.69 0.00 0.00 0.00 174.94 174.69 2ys4 s VAL 102 N 0.82 3.77 -0.09 2.92 1.01 -0.20 -2.85 120.40 125.78 2ys4 s VAL 102 Ca 0.06 -0.71 0.02 0.00 0.00 0.00 0.00 61.98 61.35 2ys4 s VAL 102 Cb -0.13 -2.64 -0.02 0.00 0.00 0.00 0.00 36.38 33.59 2ys4 s VAL 102 CO 0.02 0.40 -0.16 0.00 0.00 0.00 0.00 175.10 175.37 2ys4 s TYR 104 N -0.13 2.93 0.21 0.00 2.02 -0.57 0.53 117.35 122.34 2ys4 s TYR 104 Ca -0.02 -0.09 -0.05 0.00 -0.37 0.00 0.00 57.07 56.54 2ys4 s TYR 104 Cb -0.14 -1.44 0.17 0.00 -0.40 0.00 0.00 41.96 40.15 2ys4 s TYR 104 CO 0.04 0.50 1.63 0.22 -1.57 0.00 0.00 175.55 176.37 2ys4 h ASP 105 N 2.87 0.84 -0.16 2.29 1.82 -1.80 -2.94 116.42 119.35 2ys4 h ASP 105 Ca -0.47 -0.29 -0.08 0.00 -0.39 0.00 0.00 57.03 55.80 2ys4 h ASP 105 Cb 1.19 -0.23 -0.02 0.00 0.68 0.00 0.00 39.33 40.96 2ys4 h ASP 105 CO 0.59 1.01 -0.15 0.00 -1.61 0.00 0.00 179.24 179.08 2ys4 h THR 106 N 0.73 1.24 0.00 2.25 1.03 -1.96 -3.47 112.91 112.74 2ys4 h THR 106 Ca 0.11 -1.10 0.00 0.00 -0.01 0.00 0.00 66.41 65.40 2ys4 h THR 106 Cb 0.70 1.17 0.00 0.00 -1.07 0.00 0.00 68.15 68.95 2ys4 h THR 106 CO 0.05 0.36 0.00 0.61 -0.01 0.00 0.00 175.52 176.53 2ys4 n GLY 107 N -0.54 0.50 3.14 2.99 0.00 -1.11 -5.16 105.19 105.01 2ys4 n GLY 107 Ca 0.01 -0.39 -0.18 0.00 0.00 0.00 0.00 46.02 45.45 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 0.82 -0.08 1.61 2.02 -1.26 -4.97 118.70 116.84 2ys4 s GLU 108 Ca 0.00 -0.83 0.00 0.00 0.02 0.00 0.00 54.97 54.16 2ys4 s GLU 108 Cb 0.00 -0.80 0.02 0.00 0.10 0.00 0.00 34.13 33.45 2ys4 s GLU 108 CO 0.00 0.19 -0.06 0.15 0.02 0.00 0.00 175.26 175.55 2ys4 s LYS 109 N -1.43 1.23 0.11 1.61 1.02 -1.26 -1.51 119.74 119.51 2ys4 s LYS 109 Ca -0.01 -0.17 0.09 0.00 0.02 0.00 0.00 55.97 55.89 2ys4 s LYS 109 Cb -0.09 -1.29 -0.04 0.00 -0.52 0.00 0.00 37.83 35.89 2ys4 s LYS 109 CO 0.02 -0.20 -0.18 0.54 -0.92 0.00 0.00 175.35 174.61 2ys4 s VAL 110 N 1.46 2.85 -0.07 3.17 0.11 -1.05 -4.94 120.40 121.92 2ys4 s VAL 110 Ca -0.01 -1.47 0.03 0.00 -2.93 0.00 0.00 61.98 57.59 2ys4 s VAL 110 Cb -0.13 -2.30 0.01 0.00 -1.53 0.00 0.00 36.38 32.43 2ys4 s VAL 110 CO -0.04 0.12 -0.15 -0.36 -3.33 0.00 0.00 175.10 171.34 2ys4 s PHE 111 N -1.13 1.73 -0.21 1.54 0.40 -1.25 -1.04 117.98 118.02 2ys4 s PHE 111 Ca 0.18 -0.67 -0.00 0.00 -0.60 0.00 0.00 56.93 55.84 2ys4 s PHE 111 Cb -0.11 -1.23 0.05 0.00 0.51 0.00 0.00 43.02 42.25 2ys4 s PHE 111 CO 0.10 -0.32 -0.04 0.08 0.70 0.00 0.00 175.22 175.74 2ys4 s VAL 112 N 0.60 1.24 0.97 -0.44 1.01 -0.08 -4.89 120.40 118.82 2ys4 s VAL 112 Ca -0.15 -0.93 -0.13 0.00 0.00 0.00 0.00 61.98 60.76 2ys4 s VAL 112 Cb -0.16 -1.52 0.05 0.00 0.00 0.00 0.00 36.38 34.74 2ys4 s VAL 112 CO 0.05 -0.05 0.35 -1.20 0.00 0.00 0.00 175.10 174.26 2ys4 n SER 113 N 4.79 -2.13 -4.45 3.32 7.64 -1.21 -0.10 113.62 121.48 2ys4 n SER 113 Ca -0.12 0.27 -0.22 0.00 1.01 0.00 0.00 58.87 59.81 2ys4 n SER 113 Cb 0.46 -1.17 -0.10 0.00 -1.01 0.00 0.00 64.21 62.38 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 -1.12 2.57 0.26 -3.43 1.43 -0.26 -1.58 118.68 116.56 2ys4 s LEU 114 Ca 0.57 -1.15 -0.20 0.00 -1.03 0.00 0.00 54.13 52.31 2ys4 s LEU 114 Cb -0.20 -0.79 0.02 0.00 0.03 0.00 0.00 46.19 45.25 2ys4 s LEU 114 CO 0.67 -0.24 0.67 -0.31 0.23 0.00 0.00 176.35 177.38 2ys4 s TYR 115 N -2.84 -0.15 0.00 0.29 2.02 -0.82 -2.71 117.35 113.14 2ys4 s TYR 115 Ca 0.29 -0.28 0.00 0.00 -0.37 0.00 0.00 57.07 56.72 2ys4 s TYR 115 Cb 0.02 0.62 0.00 0.00 -0.40 0.00 0.00 41.96 42.20 2ys4 s TYR 115 CO 0.13 -1.17 0.00 0.41 -1.57 0.00 0.00 175.55 173.35 2ys4 n GLY 116 N -0.44 -1.77 3.66 0.71 0.00 -1.21 -4.04 105.19 102.11 2ys4 n GLY 116 Ca -0.05 0.67 -0.52 0.00 0.00 0.00 0.00 46.02 46.12 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 0.55 -2.69 4.61 0.00 -1.23 -4.17 120.51 117.57 2ys4 n ALA 117 Ca 0.00 0.26 -0.22 0.00 0.00 0.00 0.00 53.44 53.48 2ys4 n ALA 117 Cb 0.00 -2.42 -0.01 0.00 0.00 0.00 0.00 19.45 17.02 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 4.49 3.90 -0.02 0.00 0.00 -1.19 -2.27 121.76 126.68 2ys4 s ALA 118 Ca 0.98 -1.16 -0.12 0.00 0.00 0.00 0.00 51.96 51.65 2ys4 s ALA 118 Cb -0.85 -1.88 0.02 0.00 0.00 0.00 0.00 23.12 20.41 2ys4 s ALA 118 CO 0.56 0.03 0.25 0.96 0.00 0.00 0.00 175.76 177.56 2ys4 s ILE 119 N -2.19 0.06 -0.19 0.00 -5.25 -1.09 -3.46 121.20 109.07 2ys4 s ILE 119 Ca 0.40 -0.50 -0.29 0.00 -0.99 0.00 0.00 60.65 59.27 2ys4 s ILE 119 Cb -0.09 -0.53 -0.00 0.00 2.95 0.00 0.00 42.46 44.78 2ys4 s ILE 119 CO 0.33 -0.27 1.13 -0.62 -1.79 0.00 0.00 174.94 173.71 2ys4 s ASP 120 N -1.21 7.05 -0.20 4.36 -1.08 -1.26 -3.08 116.67 121.25 2ys4 s ASP 120 Ca -0.13 1.52 0.04 0.00 -0.52 0.00 0.00 52.55 53.47 2ys4 s ASP 120 Cb -0.06 -2.54 -0.15 0.00 -1.46 0.00 0.00 42.92 38.72 2ys4 s ASP 120 CO 0.03 -0.69 -0.13 0.23 0.52 0.00 0.00 175.17 175.13 2ys4 n MET 121 N 6.31 0.69 0.00 4.34 2.81 -1.26 -5.08 117.12 124.93 2ys4 n MET 121 Ca 0.12 0.09 0.00 0.00 -1.81 0.00 0.00 57.70 56.11 2ys4 n MET 121 Cb 0.46 -1.41 0.00 0.00 -0.71 0.00 0.00 33.22 31.56 2ys4 n MET 121 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77