#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 -4.63 -3.89 1.61 2.88 -1.26 -5.02 113.62 103.31 2ys4 n SER 2 Ca 0.00 -0.41 -0.25 0.00 -1.33 0.00 0.00 58.87 56.88 2ys4 n SER 2 Cb 0.00 -3.89 -0.17 0.00 -0.75 0.00 0.00 64.21 59.40 2ys4 n SER 2 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2ys4 s SER 3 N -3.39 1.81 0.00 -3.46 0.15 -1.26 -5.10 113.70 102.45 2ys4 s SER 3 Ca 0.35 -0.23 0.00 0.00 0.70 0.00 0.00 55.95 56.77 2ys4 s SER 3 Cb -0.15 -0.69 0.00 0.00 -1.71 0.00 0.00 66.02 63.46 2ys4 s SER 3 CO 0.54 -0.10 0.00 0.61 1.20 0.00 0.00 173.24 175.49 2ys4 n GLY 4 N 4.70 1.45 3.81 9.45 0.00 -1.26 -5.18 105.19 118.16 2ys4 n GLY 4 Ca -0.14 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.82 2ys4 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ys4 s SER 5 N 0.64 -0.14 0.31 1.61 0.01 -1.26 -5.14 113.70 109.73 2ys4 s SER 5 Ca 0.00 -0.62 -0.29 0.00 1.31 0.00 0.00 55.95 56.34 2ys4 s SER 5 Cb 0.00 0.61 -0.12 0.00 0.21 0.00 0.00 66.02 66.72 2ys4 s SER 5 CO 0.00 -1.16 1.43 -0.24 0.41 0.00 0.00 173.24 173.68 2ys4 n SER 6 N -0.74 3.22 -4.85 2.44 2.88 -1.26 -4.97 113.62 110.34 2ys4 n SER 6 Ca -0.05 1.18 -0.36 0.00 -1.33 0.00 0.00 58.87 58.31 2ys4 n SER 6 Cb 0.60 -1.52 -0.06 0.00 -0.75 0.00 0.00 64.21 62.48 2ys4 n SER 6 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2ys4 s GLY 7 N 0.07 2.44 0.14 0.46 0.00 -1.26 -5.00 107.32 104.16 2ys4 s GLY 7 Ca 0.60 -0.22 -0.21 0.00 0.00 0.00 0.00 44.72 44.89 2ys4 s GLY 7 CO 0.56 0.07 1.68 -0.91 0.00 0.00 0.00 173.10 174.49 2ys4 h THR 8 N 3.06 0.64 -2.40 0.90 1.35 -2.09 -3.40 112.91 110.97 2ys4 h THR 8 Ca -0.49 0.00 -0.54 0.00 -0.55 0.00 0.00 66.41 64.83 2ys4 h THR 8 Cb 1.20 0.64 0.03 0.00 -1.73 0.00 0.00 68.15 68.29 2ys4 h THR 8 CO 0.65 0.00 1.16 1.21 -0.25 0.00 0.00 175.52 178.29 2ys4 n GLU 9 N -5.28 2.78 -3.88 4.72 2.13 -1.26 -4.98 120.64 114.87 2ys4 n GLU 9 Ca -0.02 1.01 -0.26 0.00 0.66 0.00 0.00 57.16 58.56 2ys4 n GLU 9 Cb 0.20 -2.93 -0.17 0.00 0.27 0.00 0.00 31.44 28.80 2ys4 n GLU 9 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2ys4 s ARG 10 N 3.51 1.38 0.30 5.31 0.52 -1.26 -5.14 118.95 123.57 2ys4 s ARG 10 Ca 0.86 -0.19 0.08 0.00 -0.52 0.00 0.00 55.73 55.95 2ys4 s ARG 10 Cb -0.48 -1.49 -0.04 0.00 0.52 0.00 0.00 34.95 33.46 2ys4 s ARG 10 CO 0.40 -0.27 0.12 -1.21 0.02 0.00 0.00 175.30 174.36 2ys4 s GLU 11 N 1.75 2.47 -0.50 3.54 2.02 -1.26 -5.06 118.70 121.66 2ys4 s GLU 11 Ca 0.05 -1.41 -0.28 0.00 0.02 0.00 0.00 54.97 53.35 2ys4 s GLU 11 Cb -0.12 -2.26 -0.01 0.00 0.10 0.00 0.00 34.13 31.84 2ys4 s GLU 11 CO -0.08 0.23 1.65 0.15 0.02 0.00 0.00 175.26 177.23 2ys4 s LYS 12 N -3.81 3.13 -0.06 1.61 -0.14 -1.26 -4.83 119.74 114.38 2ys4 s LYS 12 Ca 0.35 0.80 0.05 0.00 -1.36 0.00 0.00 55.97 55.81 2ys4 s LYS 12 Cb -0.05 -4.21 0.23 0.00 -1.68 0.00 0.00 37.83 32.12 2ys4 s LYS 12 CO 0.23 -2.12 0.92 1.97 -0.76 0.00 0.00 175.35 175.59 2ys4 n PHE 13 N 10.65 0.54 -4.35 3.18 1.16 -1.26 -4.79 117.46 122.59 2ys4 n PHE 13 Ca 0.18 -0.20 -0.19 0.00 -1.87 0.00 0.00 57.45 55.37 2ys4 n PHE 13 Cb 0.49 -0.18 -0.15 0.00 -1.61 0.00 0.00 39.48 38.04 2ys4 n PHE 13 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 2ys4 s ILE 14 N -1.55 0.70 0.47 1.97 1.01 -1.26 -5.15 121.20 117.39 2ys4 s ILE 14 Ca 0.16 -0.36 -0.20 0.00 0.00 0.00 0.00 60.65 60.25 2ys4 s ILE 14 Cb 0.11 -0.60 -0.09 0.00 0.01 0.00 0.00 42.46 41.89 2ys4 s ILE 14 CO 0.06 0.20 0.99 0.68 0.00 0.00 0.00 174.94 176.87 2ys4 s VAL 15 N -0.10 4.20 0.60 2.92 -7.23 -1.26 -5.04 120.40 114.50 2ys4 s VAL 15 Ca 0.02 1.30 -0.17 0.00 -1.81 0.00 0.00 61.98 61.32 2ys4 s VAL 15 Cb -0.05 -3.56 -0.03 0.00 0.56 0.00 0.00 36.38 33.31 2ys4 s VAL 15 CO -0.00 -0.37 1.12 -2.16 -0.31 0.00 0.00 175.10 173.38 2ys4 s PRO 16 N -3.39 3.06 0.32 4.82 0.04 -1.26 -4.89 135.00 133.70 2ys4 s PRO 16 Ca 0.63 1.49 0.19 0.00 0.04 0.00 0.00 61.00 63.36 2ys4 s PRO 16 Cb -0.12 -1.98 1.05 0.00 0.04 0.00 0.00 34.50 33.49 2ys4 s PRO 16 CO 0.19 -1.06 1.56 -0.89 0.04 0.00 0.00 177.00 176.84 2ys4 n ILE 17 N -1.90 0.92 -0.34 0.56 5.41 -1.26 0.12 119.36 122.86 2ys4 n ILE 17 Ca 0.11 0.74 0.08 0.00 1.00 0.00 0.00 62.75 64.68 2ys4 n ILE 17 Cb 0.51 -1.74 0.32 0.00 -0.71 0.00 0.00 39.64 38.02 2ys4 n ILE 17 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.55 177.72 2ys4 n LYS 18 N -2.20 3.50 -0.07 0.38 4.81 -1.26 -4.15 118.16 119.17 2ys4 n LYS 18 Ca -0.01 -2.50 -0.09 0.00 -0.87 0.00 0.00 58.31 54.84 2ys4 n LYS 18 Cb 0.11 -1.86 -0.07 0.00 0.02 0.00 0.00 35.03 33.23 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 0.90 1.71 -2.43 3.14 0.00 0.12 -5.08 120.51 118.87 2ys4 n ALA 19 Ca 0.23 -0.63 -0.13 0.00 0.00 0.00 0.00 53.44 52.90 2ys4 n ALA 19 Cb 0.82 0.13 -0.08 0.00 0.00 0.00 0.00 19.45 20.32 2ys4 n ALA 19 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2ys4 s ARG 20 N -2.28 1.44 0.00 0.00 1.81 -1.24 -5.05 118.95 113.64 2ys4 s ARG 20 Ca -0.15 -1.67 0.00 0.00 -1.72 0.00 0.00 55.73 52.18 2ys4 s ARG 20 Cb 0.04 0.33 0.00 0.00 -0.45 0.00 0.00 34.95 34.87 2ys4 s ARG 20 CO 0.36 -0.52 0.00 0.41 -0.68 0.00 0.00 175.30 174.86 2ys4 n GLY 21 N -0.39 0.57 3.62 -3.53 0.00 -1.26 -4.80 105.19 99.40 2ys4 n GLY 21 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.58 3.08 0.42 4.61 0.00 -1.26 -4.98 121.76 121.05 2ys4 s ALA 22 Ca 0.00 0.66 0.08 0.00 0.00 0.00 0.00 51.96 52.70 2ys4 s ALA 22 Cb 0.00 -3.95 -0.02 0.00 0.00 0.00 0.00 23.12 19.15 2ys4 s ALA 22 CO 0.00 -2.27 0.40 1.03 0.00 0.00 0.00 175.76 174.91 2ys4 s ARG 23 N 5.33 2.55 -0.07 0.00 0.52 -1.26 -4.88 118.95 121.14 2ys4 s ARG 23 Ca 0.85 -1.52 -0.03 0.00 -0.52 0.00 0.00 55.73 54.50 2ys4 s ARG 23 Cb -0.30 -2.41 0.04 0.00 0.52 0.00 0.00 34.95 32.81 2ys4 s ARG 23 CO 0.34 -0.22 0.14 0.00 0.02 0.00 0.00 175.30 175.58 2ys4 s ALA 24 N -2.47 -0.20 0.03 2.13 0.00 -1.26 -0.74 121.76 119.25 2ys4 s ALA 24 Ca 0.49 0.61 -0.07 0.00 0.00 0.00 0.00 51.96 52.99 2ys4 s ALA 24 Cb -0.04 -0.56 -0.01 0.00 0.00 0.00 0.00 23.12 22.52 2ys4 s ALA 24 CO 0.28 -0.29 0.12 0.42 0.00 0.00 0.00 175.76 176.30 2ys4 s ILE 25 N 1.54 0.11 0.48 0.00 1.01 -1.26 -4.96 121.20 118.13 2ys4 s ILE 25 Ca -0.05 -0.95 0.03 0.00 0.00 0.00 0.00 60.65 59.68 2ys4 s ILE 25 Cb -0.12 -0.76 -0.03 0.00 0.01 0.00 0.00 42.46 41.56 2ys4 s ILE 25 CO -0.06 -0.52 0.01 -0.76 0.00 0.00 0.00 174.94 173.61 2ys4 s LEU 26 N -1.91 2.44 -0.35 2.97 2.01 -1.26 -2.38 118.68 120.20 2ys4 s LEU 26 Ca -0.08 -1.58 0.01 0.00 0.01 0.00 0.00 54.13 52.49 2ys4 s LEU 26 Cb -0.03 -0.77 0.09 0.00 0.01 0.00 0.00 46.19 45.50 2ys4 s LEU 26 CO -0.03 -0.75 0.08 -0.62 1.01 0.00 0.00 176.35 176.04 2ys4 s ASP 27 N -3.83 4.91 0.01 2.29 2.15 -0.78 -4.68 116.67 116.75 2ys4 s ASP 27 Ca 0.14 -1.95 0.05 0.00 0.43 0.00 0.00 52.55 51.22 2ys4 s ASP 27 Cb 0.04 -1.70 -0.02 0.00 -0.30 0.00 0.00 42.92 40.94 2ys4 s ASP 27 CO 0.07 -0.40 -0.16 -0.36 -0.17 0.00 0.00 175.17 174.15 2ys4 s PHE 28 N 1.04 1.39 0.85 -5.34 0.40 -1.26 -4.22 117.98 110.84 2ys4 s PHE 28 Ca 0.06 -0.31 -0.11 0.00 -0.60 0.00 0.00 56.93 55.98 2ys4 s PHE 28 Cb -0.20 -0.86 0.10 0.00 0.51 0.00 0.00 43.02 42.56 2ys4 s PHE 28 CO -0.06 0.01 1.09 -1.25 0.70 0.00 0.00 175.22 175.72 2ys4 s PRO 29 N -0.73 1.67 0.16 0.24 0.04 -1.26 -4.96 135.00 130.15 2ys4 s PRO 29 Ca 0.05 0.96 -0.13 0.00 0.04 0.00 0.00 61.00 61.91 2ys4 s PRO 29 Cb -0.07 -1.85 0.06 0.00 0.04 0.00 0.00 34.50 32.68 2ys4 s PRO 29 CO 0.00 -1.99 1.73 -0.44 0.04 0.00 0.00 177.00 176.34 2ys4 h ASP 30 N -1.37 0.73 -5.05 6.66 3.32 -1.97 -3.46 116.42 115.27 2ys4 h ASP 30 Ca -0.47 -0.15 0.02 0.00 0.02 0.00 0.00 57.03 56.45 2ys4 h ASP 30 Cb 1.26 -0.19 -0.08 0.00 0.22 0.00 0.00 39.33 40.55 2ys4 h ASP 30 CO 0.53 0.68 0.13 -1.59 -1.72 0.00 0.00 179.24 177.28 2ys4 s LYS 31 N -5.62 1.60 0.10 3.56 -2.85 -1.26 -3.24 119.74 112.03 2ys4 s LYS 31 Ca -0.13 -0.93 0.02 0.00 -1.00 0.00 0.00 55.97 53.92 2ys4 s LYS 31 Cb 0.12 0.57 -0.04 0.00 -2.06 0.00 0.00 37.83 36.42 2ys4 s LYS 31 CO 0.78 -0.71 0.21 -1.17 0.10 0.00 0.00 175.35 174.56 2ys4 s LEU 32 N -2.90 4.22 -0.21 2.77 2.96 -0.02 -4.93 118.68 120.56 2ys4 s LEU 32 Ca 0.11 0.16 -0.02 0.00 -0.22 0.00 0.00 54.13 54.16 2ys4 s LEU 32 Cb -0.03 -2.83 0.06 0.00 0.50 0.00 0.00 46.19 43.89 2ys4 s LEU 32 CO 0.03 0.12 0.01 0.54 -1.32 0.00 0.00 176.35 175.72 2ys4 s ASN 33 N -2.81 3.28 -0.42 3.68 2.20 -1.26 -3.71 114.94 115.90 2ys4 s ASN 33 Ca 0.34 -0.98 -0.13 0.00 -0.94 0.00 0.00 52.86 51.15 2ys4 s ASN 33 Cb -0.12 -0.80 0.05 0.00 -2.00 0.00 0.00 41.25 38.37 2ys4 s ASN 33 CO 0.27 -0.29 0.29 -0.36 -2.94 0.00 0.00 177.10 174.07 2ys4 s PHE 34 N 1.69 3.26 1.11 1.54 0.08 -1.26 -5.00 117.98 119.40 2ys4 s PHE 34 Ca -0.02 -0.97 -0.16 0.00 0.12 0.00 0.00 56.93 55.89 2ys4 s PHE 34 Cb -0.18 -2.76 0.19 0.00 -0.57 0.00 0.00 43.02 39.70 2ys4 s PHE 34 CO -0.08 -0.71 0.32 0.43 -0.10 0.00 0.00 175.22 175.08 2ys4 n SER 35 N 5.07 -2.99 -4.63 1.36 7.64 -1.26 -3.42 113.62 115.39 2ys4 n SER 35 Ca -0.11 -0.39 -0.52 0.00 1.01 0.00 0.00 58.87 58.86 2ys4 n SER 35 Cb 0.45 -0.86 -0.06 0.00 -1.01 0.00 0.00 64.21 62.73 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 -4.63 0.40 -4.19 0.44 -1.04 -1.26 -4.44 114.28 99.56 2ys4 n THR 36 Ca 0.05 -0.14 -0.13 0.00 -2.04 0.00 0.00 64.05 61.80 2ys4 n THR 36 Cb 0.46 -1.64 -0.10 0.00 -1.82 0.00 0.00 70.33 67.22 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 -3.33 4.45 0.01 0.00 0.04 -1.26 -2.49 135.00 132.42 2ys4 s PRO 38 Ca 0.10 2.06 -0.07 0.00 0.04 0.00 0.00 61.00 63.12 2ys4 s PRO 38 Cb 0.01 -3.13 -0.04 0.00 0.04 0.00 0.00 34.50 31.38 2ys4 s PRO 38 CO -0.01 -0.07 0.93 -0.24 0.04 0.00 0.00 177.00 177.64 2ys4 h VAL 39 N 3.18 0.00 -0.13 -0.36 3.04 -1.83 -3.33 116.25 116.82 2ys4 h VAL 39 Ca -0.47 -0.04 0.03 0.00 -1.01 0.00 0.00 66.70 65.20 2ys4 h VAL 39 Cb 1.22 0.00 -0.06 0.00 -2.01 0.00 0.00 31.29 30.44 2ys4 h VAL 39 CO 0.68 0.00 -0.46 0.11 -1.01 0.00 0.00 177.57 176.89 2ys4 h LYS 40 N -0.30 -0.47 -6.73 4.17 6.56 -1.82 -3.29 116.57 114.69 2ys4 h LYS 40 Ca -0.03 0.03 -0.53 0.00 -1.06 0.00 0.00 60.65 59.07 2ys4 h LYS 40 Cb 0.20 0.11 0.22 0.00 -0.57 0.00 0.00 32.23 32.18 2ys4 h LYS 40 CO 0.04 -0.31 -0.70 0.66 -2.06 0.00 0.00 179.45 177.09 2ys4 n TYR 41 N -4.98 -1.69 -3.48 -1.35 4.01 -1.25 -4.72 117.16 103.69 2ys4 n TYR 41 Ca -0.05 0.21 -0.28 0.00 -0.16 0.00 0.00 57.90 57.62 2ys4 n TYR 41 Cb 0.32 -1.74 -0.03 0.00 -0.31 0.00 0.00 39.34 37.57 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 -1.94 6.41 -0.02 7.72 1.04 -1.26 -4.39 113.70 121.26 2ys4 s SER 42 Ca 0.56 0.57 0.07 0.00 0.48 0.00 0.00 55.95 57.62 2ys4 s SER 42 Cb -0.20 -2.08 -0.02 0.00 0.10 0.00 0.00 66.02 63.82 2ys4 s SER 42 CO 0.68 -0.14 -0.22 -0.89 0.98 0.00 0.00 173.24 173.64 2ys4 s THR 43 N -2.02 2.36 0.04 2.02 2.01 -0.77 -4.94 115.64 114.35 2ys4 s THR 43 Ca 0.41 -1.01 0.00 0.00 0.31 0.00 0.00 61.69 61.40 2ys4 s THR 43 Cb -0.11 -1.86 -0.03 0.00 0.01 0.00 0.00 72.50 70.51 2ys4 s THR 43 CO 0.30 0.57 -0.04 -1.10 -0.69 0.00 0.00 174.62 173.66 2ys4 s GLN 44 N -0.69 0.47 0.15 4.92 1.11 -1.26 -0.53 119.66 123.83 2ys4 s GLN 44 Ca 0.11 -0.87 -0.22 0.00 0.01 0.00 0.00 55.36 54.39 2ys4 s GLN 44 Cb -0.10 0.07 0.06 0.00 -1.01 0.00 0.00 33.01 32.03 2ys4 s GLN 44 CO -0.00 -0.05 0.57 0.21 0.01 0.00 0.00 175.29 176.02 2ys4 s LYS 45 N -2.41 1.24 0.01 2.91 2.20 -1.06 -4.99 119.74 117.66 2ys4 s LYS 45 Ca -0.06 -0.50 0.02 0.00 -0.36 0.00 0.00 55.97 55.07 2ys4 s LYS 45 Cb -0.03 0.57 -0.04 0.00 -1.51 0.00 0.00 37.83 36.82 2ys4 s LYS 45 CO -0.04 -0.53 -0.02 0.42 -0.36 0.00 0.00 175.35 174.82 2ys4 s ILE 46 N -3.73 3.99 -0.24 5.43 -1.09 -1.26 -1.77 121.20 122.53 2ys4 s ILE 46 Ca 0.01 -0.70 -0.02 0.00 -2.23 0.00 0.00 60.65 57.71 2ys4 s ILE 46 Cb -0.01 -2.79 0.08 0.00 -1.58 0.00 0.00 42.46 38.16 2ys4 s ILE 46 CO -0.13 0.35 0.05 -0.22 -1.23 0.00 0.00 174.94 173.77 2ys4 s LEU 47 N -1.62 1.58 -0.00 2.97 2.96 -0.09 -4.91 118.68 119.56 2ys4 s LEU 47 Ca 0.20 -1.14 -0.30 0.00 -0.22 0.00 0.00 54.13 52.67 2ys4 s LEU 47 Cb -0.11 -0.71 -0.04 0.00 0.50 0.00 0.00 46.19 45.82 2ys4 s LEU 47 CO 0.10 -0.34 1.21 -0.22 -1.32 0.00 0.00 176.35 175.78 2ys4 s LEU 48 N 1.76 4.32 0.05 -0.68 1.98 -1.26 -0.78 118.68 124.07 2ys4 s LEU 48 Ca 0.03 1.91 0.08 0.00 -2.89 0.00 0.00 54.13 53.25 2ys4 s LEU 48 Cb -0.17 -3.57 -0.03 0.00 0.66 0.00 0.00 46.19 43.08 2ys4 s LEU 48 CO -0.15 -0.54 -0.20 -0.69 -1.89 0.00 0.00 176.35 172.88 2ys4 s VAL 49 N 1.75 2.64 -0.02 1.68 1.01 0.77 -4.95 120.40 123.27 2ys4 s VAL 49 Ca 0.57 -1.27 0.01 0.00 0.00 0.00 0.00 61.98 61.30 2ys4 s VAL 49 Cb -0.27 -2.10 0.01 0.00 0.00 0.00 0.00 36.38 34.02 2ys4 s VAL 49 CO 0.25 0.32 -0.03 -0.60 0.00 0.00 0.00 175.10 175.05 2ys4 s ARG 50 N -1.46 0.40 -0.21 2.72 3.00 -1.26 -1.09 118.95 121.05 2ys4 s ARG 50 Ca 0.14 -0.06 -0.29 0.00 -1.00 0.00 0.00 55.73 54.52 2ys4 s ARG 50 Cb -0.10 -0.46 -0.01 0.00 0.00 0.00 0.00 34.95 34.37 2ys4 s ARG 50 CO 0.05 -0.02 1.31 1.21 0.00 0.00 0.00 175.30 177.84 2ys4 s ASN 51 N 0.48 6.82 -0.12 -2.12 3.84 -1.24 -1.86 114.94 120.73 2ys4 s ASN 51 Ca -0.05 1.56 0.15 0.00 0.21 0.00 0.00 52.86 54.73 2ys4 s ASN 51 Cb -0.08 -2.54 0.56 0.00 -0.55 0.00 0.00 41.25 38.64 2ys4 s ASN 51 CO -0.01 -0.89 1.47 2.30 -2.79 0.00 0.00 177.10 177.19 2ys4 n ILE 52 N 5.69 1.89 -1.79 -5.21 -5.35 -1.00 -4.60 119.36 108.98 2ys4 n ILE 52 Ca 0.15 -1.42 0.00 0.00 -0.27 0.00 0.00 62.75 61.20 2ys4 n ILE 52 Cb 0.45 0.04 0.00 0.00 -1.74 0.00 0.00 39.64 38.39 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 0.33 2.11 0.01 3.28 0.00 -1.17 -4.81 105.19 104.93 2ys4 n GLY 53 Ca 0.21 -2.00 -0.01 0.00 0.00 0.00 0.00 46.02 44.21 2ys4 n GLY 53 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2ys4 n ASN 54 N 0.00 4.19 -4.70 1.61 5.15 -1.19 -4.90 115.26 115.42 2ys4 n ASN 54 Ca 0.00 -0.01 -0.23 0.00 -0.60 0.00 0.00 54.58 53.75 2ys4 n ASN 54 Cb 0.00 0.34 -0.06 0.00 -0.53 0.00 0.00 39.78 39.52 2ys4 n ASN 54 CO 0.00 0.00 0.00 -0.75 1.40 0.00 0.00 177.26 177.91 2ys4 s LYS 55 N -2.06 2.46 -0.20 1.20 2.36 0.09 -4.81 119.74 118.77 2ys4 s LYS 55 Ca -0.02 -1.35 -0.36 0.00 -2.55 0.00 0.00 55.97 51.68 2ys4 s LYS 55 Cb 0.01 -2.26 -0.13 0.00 -1.05 0.00 0.00 37.83 34.40 2ys4 s LYS 55 CO 0.08 0.33 1.90 -1.71 1.55 0.00 0.00 175.35 177.50 2ys4 n ASN 56 N -1.01 2.87 -4.84 1.43 5.15 -1.26 -4.50 115.26 113.08 2ys4 n ASN 56 Ca -0.06 0.89 -0.38 0.00 -0.60 0.00 0.00 54.58 54.43 2ys4 n ASN 56 Cb 0.59 -1.28 -0.06 0.00 -0.53 0.00 0.00 39.78 38.50 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 4.61 3.73 -0.21 5.20 0.00 -1.21 -4.86 121.76 129.02 2ys4 s ALA 57 Ca 0.98 -0.29 0.01 0.00 0.00 0.00 0.00 51.96 52.66 2ys4 s ALA 57 Cb -0.84 -2.31 0.05 0.00 0.00 0.00 0.00 23.12 20.01 2ys4 s ALA 57 CO 0.56 0.51 -0.09 0.08 0.00 0.00 0.00 175.76 176.82 2ys4 s VAL 58 N -1.09 1.59 -0.03 0.00 1.01 -1.26 -2.94 120.40 117.68 2ys4 s VAL 58 Ca 0.23 -1.06 0.04 0.00 0.00 0.00 0.00 61.98 61.18 2ys4 s VAL 58 Cb -0.16 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 2ys4 s VAL 58 CO 0.12 0.09 -0.12 0.72 0.00 0.00 0.00 175.10 175.90 2ys4 s PHE 59 N 1.40 2.75 -0.28 5.22 -0.71 -1.16 -2.38 117.98 122.83 2ys4 s PHE 59 Ca -0.03 -0.12 -0.01 0.00 -1.04 0.00 0.00 56.93 55.73 2ys4 s PHE 59 Cb -0.17 -1.62 0.09 0.00 -1.21 0.00 0.00 43.02 40.11 2ys4 s PHE 59 CO -0.07 0.25 0.07 -1.58 -1.34 0.00 0.00 175.22 172.55 2ys4 s HIS 60 N -0.81 1.66 0.26 3.49 2.46 0.68 -2.56 115.29 120.47 2ys4 s HIS 60 Ca 0.13 -1.57 -0.09 0.00 0.47 0.00 0.00 55.06 53.99 2ys4 s HIS 60 Cb -0.11 -1.58 -0.07 0.00 -0.13 0.00 0.00 32.58 30.70 2ys4 s HIS 60 CO 0.02 -0.81 0.58 0.42 -2.47 0.00 0.00 174.74 172.48 2ys4 s ILE 61 N 1.64 4.91 -0.12 0.89 1.01 0.83 0.10 121.20 130.47 2ys4 s ILE 61 Ca 0.06 0.47 -0.05 0.00 0.00 0.00 0.00 60.65 61.13 2ys4 s ILE 61 Cb -0.17 -3.64 0.06 0.00 0.01 0.00 0.00 42.46 38.71 2ys4 s ILE 61 CO -0.20 -0.15 0.24 -0.75 0.00 0.00 0.00 174.94 174.09 2ys4 s LYS 62 N -3.01 0.15 0.23 2.79 2.36 -1.24 -4.51 119.74 116.52 2ys4 s LYS 62 Ca 0.48 0.66 -0.03 0.00 -2.55 0.00 0.00 55.97 54.52 2ys4 s LYS 62 Cb -0.11 -0.09 -0.03 0.00 -1.05 0.00 0.00 37.83 36.56 2ys4 s LYS 62 CO 0.23 -0.25 0.25 -0.08 1.55 0.00 0.00 175.35 177.05 2ys4 s THR 63 N 2.03 0.00 0.08 3.43 -1.32 -1.26 -4.52 115.64 114.07 2ys4 s THR 63 Ca -0.02 -1.83 0.03 0.00 -1.21 0.00 0.00 61.69 58.66 2ys4 s THR 63 Cb -0.11 -2.44 -0.03 0.00 -1.51 0.00 0.00 72.50 68.41 2ys4 s THR 63 CO -0.08 0.00 -0.10 0.00 -2.21 0.00 0.00 174.62 172.23 2ys4 n ARG 65 N 0.90 -0.07 0.00 0.00 1.85 -1.26 -1.22 116.66 116.87 2ys4 n ARG 65 Ca -0.19 0.03 0.07 0.00 -1.00 0.00 0.00 57.85 56.76 2ys4 n ARG 65 Cb 0.56 -1.88 0.40 0.00 -1.05 0.00 0.00 32.46 30.50 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 -1.46 0.48 -3.31 2.89 -0.04 -1.26 -4.99 135.00 127.31 2ys4 n PRO 66 Ca 0.08 0.00 -0.39 0.00 -0.04 0.00 0.00 63.50 63.15 2ys4 n PRO 66 Cb 0.52 -1.44 -0.08 0.00 -0.04 0.00 0.00 33.50 32.46 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 3.26 -0.12 0.54 0.08 -0.36 -2.56 117.98 116.83 2ys4 s PHE 67 Ca 0.20 0.53 -0.09 0.00 0.12 0.00 0.00 56.93 57.70 2ys4 s PHE 67 Cb 0.09 -2.64 0.04 0.00 -0.57 0.00 0.00 43.02 39.94 2ys4 s PHE 67 CO 0.16 -0.25 0.30 -1.12 -0.10 0.00 0.00 175.22 174.21 2ys4 s SER 68 N 1.57 -0.32 0.24 1.36 0.01 0.46 -2.30 113.70 114.71 2ys4 s SER 68 Ca 0.18 0.62 0.01 0.00 1.31 0.00 0.00 55.95 58.07 2ys4 s SER 68 Cb -0.16 0.57 -0.05 0.00 0.21 0.00 0.00 66.02 66.60 2ys4 s SER 68 CO 0.09 -0.13 0.08 0.27 0.41 0.00 0.00 173.24 173.96 2ys4 s ILE 69 N 0.61 0.57 -0.12 1.44 -0.00 -1.26 0.13 121.20 122.57 2ys4 s ILE 69 Ca -0.04 -2.00 -0.30 0.00 -0.00 0.00 0.00 60.65 58.32 2ys4 s ILE 69 Cb -0.05 -2.55 0.12 0.00 -0.00 0.00 0.00 42.46 39.98 2ys4 s ILE 69 CO -0.04 -0.08 0.96 -1.83 -0.00 0.00 0.00 174.94 173.95 2ys4 s GLU 70 N -4.02 0.66 0.09 0.37 1.03 -0.32 -3.92 118.70 112.59 2ys4 s GLU 70 Ca 0.36 0.06 -0.31 0.00 0.03 0.00 0.00 54.97 55.11 2ys4 s GLU 70 Cb 0.07 0.31 -0.07 0.00 -0.80 0.00 0.00 34.13 33.64 2ys4 s GLU 70 CO 0.12 -0.23 1.38 -1.25 -1.33 0.00 0.00 175.26 173.95 2ys4 s PRO 71 N -1.53 4.32 0.55 -4.83 0.04 -1.26 -2.20 135.00 130.10 2ys4 s PRO 71 Ca -0.01 2.03 0.43 0.00 0.04 0.00 0.00 61.00 63.49 2ys4 s PRO 71 Cb -0.01 -3.32 1.64 0.00 0.04 0.00 0.00 34.50 32.85 2ys4 s PRO 71 CO 0.00 -0.45 1.70 0.00 0.04 0.00 0.00 177.00 178.29 2ys4 h ALA 72 N 7.01 3.47 -2.84 8.56 0.00 -1.85 -3.40 119.26 130.21 2ys4 h ALA 72 Ca -0.41 -0.05 -0.15 0.00 0.00 0.00 0.00 54.91 54.29 2ys4 h ALA 72 Cb 1.20 0.12 -0.21 0.00 0.00 0.00 0.00 17.79 18.90 2ys4 h ALA 72 CO 0.87 -1.92 -0.55 -1.50 0.00 0.00 0.00 179.25 176.15 2ys4 s ILE 73 N -4.91 0.09 0.14 0.00 2.07 -1.26 -0.12 121.20 117.21 2ys4 s ILE 73 Ca -0.05 -0.71 -0.25 0.00 -1.41 0.00 0.00 60.65 58.23 2ys4 s ILE 73 Cb 0.25 -0.38 0.07 0.00 0.13 0.00 0.00 42.46 42.53 2ys4 s ILE 73 CO 0.85 -0.39 1.02 -0.83 -1.91 0.00 0.00 174.94 173.68 2ys4 s GLY 74 N -1.34 -0.15 -0.05 1.50 0.00 -1.06 -5.03 107.32 101.19 2ys4 s GLY 74 Ca -0.14 0.06 0.03 0.00 0.00 0.00 0.00 44.72 44.66 2ys4 s GLY 74 CO 0.01 0.68 -0.13 -0.51 0.00 0.00 0.00 173.10 173.15 2ys4 s THR 75 N -2.87 1.16 -0.10 0.90 -4.23 -1.26 -2.97 115.64 106.27 2ys4 s THR 75 Ca 0.15 -0.54 0.03 0.00 -1.18 0.00 0.00 61.69 60.16 2ys4 s THR 75 Cb -0.01 -1.02 -0.01 0.00 1.34 0.00 0.00 72.50 72.80 2ys4 s THR 75 CO 0.02 0.35 -0.21 -0.22 -0.54 0.00 0.00 174.62 174.02 2ys4 s LEU 76 N 0.30 2.28 0.81 4.79 2.96 -1.15 -5.05 118.68 123.62 2ys4 s LEU 76 Ca -0.08 -0.47 -0.11 0.00 -0.22 0.00 0.00 54.13 53.26 2ys4 s LEU 76 Cb -0.12 -1.46 0.08 0.00 0.50 0.00 0.00 46.19 45.18 2ys4 s LEU 76 CO 0.02 0.19 1.10 0.20 -1.32 0.00 0.00 176.35 176.54 2ys4 s ASN 77 N 0.18 4.14 0.00 3.68 -0.87 -1.26 -3.29 114.94 117.52 2ys4 s ASN 77 Ca -0.12 1.84 0.00 0.00 -1.57 0.00 0.00 52.86 53.01 2ys4 s ASN 77 Cb -0.16 -2.49 0.00 0.00 -0.02 0.00 0.00 41.25 38.58 2ys4 s ASN 77 CO 0.07 -2.27 0.51 1.33 -2.57 0.00 0.00 177.10 174.16 2ys4 n VAL 78 N -3.67 0.00 -2.01 1.60 0.24 -1.26 -3.00 118.33 110.22 2ys4 n VAL 78 Ca 0.09 0.00 -0.01 0.00 -2.04 0.00 0.00 64.34 62.39 2ys4 n VAL 78 Cb 0.53 -0.35 -0.01 0.00 -1.47 0.00 0.00 33.84 32.54 2ys4 n VAL 78 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2ys4 n GLY 79 N 0.13 0.90 3.08 7.63 0.00 -1.26 -4.86 105.19 110.81 2ys4 n GLY 79 Ca 0.00 -0.01 -0.10 0.00 0.00 0.00 0.00 46.02 45.91 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 0.48 0.32 1.61 0.41 -1.16 -5.06 118.70 115.29 2ys4 s GLU 80 Ca 0.00 -0.62 0.09 0.00 -0.41 0.00 0.00 54.97 54.03 2ys4 s GLU 80 Cb 0.00 0.19 -0.05 0.00 -1.78 0.00 0.00 34.13 32.50 2ys4 s GLU 80 CO -0.00 -0.11 0.06 -1.12 -0.49 0.00 0.00 175.26 173.60 2ys4 s SER 81 N -1.74 4.49 0.26 -0.19 0.01 -1.26 -3.72 113.70 111.54 2ys4 s SER 81 Ca -0.11 -0.80 -0.03 0.00 1.31 0.00 0.00 55.95 56.32 2ys4 s SER 81 Cb -0.05 -0.70 -0.02 0.00 0.21 0.00 0.00 66.02 65.45 2ys4 s SER 81 CO -0.02 -0.19 0.30 0.00 0.41 0.00 0.00 173.24 173.74 2ys4 s MET 82 N -3.76 1.50 -0.02 12.44 0.23 -0.25 -4.96 119.30 124.48 2ys4 s MET 82 Ca 0.35 -1.62 0.06 0.00 -1.03 0.00 0.00 55.69 53.46 2ys4 s MET 82 Cb -0.03 0.36 -0.02 0.00 -1.53 0.00 0.00 34.83 33.61 2ys4 s MET 82 CO 0.21 -0.57 -0.20 -0.65 -2.03 0.00 0.00 175.02 171.78 2ys4 s GLN 83 N -3.82 2.25 -0.19 3.16 -0.21 -1.26 -0.16 119.66 119.43 2ys4 s GLN 83 Ca 0.34 -0.85 0.01 0.00 0.02 0.00 0.00 55.36 54.88 2ys4 s GLN 83 Cb 0.03 -2.20 0.03 0.00 1.00 0.00 0.00 33.01 31.86 2ys4 s GLN 83 CO 0.15 0.58 -0.18 -0.51 -2.12 0.00 0.00 175.29 173.21 2ys4 s LEU 84 N -0.84 2.29 -0.13 2.90 1.43 0.04 -4.84 118.68 119.53 2ys4 s LEU 84 Ca 0.11 -0.74 -0.19 0.00 -1.03 0.00 0.00 54.13 52.28 2ys4 s LEU 84 Cb -0.10 -1.47 -0.04 0.00 0.03 0.00 0.00 46.19 44.60 2ys4 s LEU 84 CO 0.01 -0.03 0.54 -1.61 0.23 0.00 0.00 176.35 175.49 2ys4 s GLU 85 N 1.27 4.33 -0.21 1.70 2.02 -0.93 -0.92 118.70 125.96 2ys4 s GLU 85 Ca 0.03 0.54 0.00 0.00 0.02 0.00 0.00 54.97 55.56 2ys4 s GLU 85 Cb -0.14 -3.47 0.02 0.00 0.10 0.00 0.00 34.13 30.65 2ys4 s GLU 85 CO -0.12 0.06 -0.14 0.08 0.02 0.00 0.00 175.26 175.16 2ys4 s VAL 86 N 0.90 2.37 -0.22 2.63 1.01 -0.73 -1.17 120.40 125.18 2ys4 s VAL 86 Ca 0.28 -1.02 -0.06 0.00 0.00 0.00 0.00 61.98 61.18 2ys4 s VAL 86 Cb -0.16 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.09 2ys4 s VAL 86 CO 0.12 0.38 0.04 -0.70 0.00 0.00 0.00 175.10 174.93 2ys4 s GLU 87 N 1.29 3.66 -0.22 2.72 2.12 0.35 -2.55 118.70 126.07 2ys4 s GLU 87 Ca 0.02 -0.49 -0.04 0.00 0.36 0.00 0.00 54.97 54.82 2ys4 s GLU 87 Cb -0.15 -3.21 0.09 0.00 0.26 0.00 0.00 34.13 31.11 2ys4 s GLU 87 CO -0.09 -0.08 0.16 0.12 -0.54 0.00 0.00 175.26 174.83 2ys4 s PHE 88 N 1.28 0.01 -0.40 5.30 5.36 0.31 -0.41 117.98 129.44 2ys4 s PHE 88 Ca 0.04 -0.26 -0.04 0.00 -0.96 0.00 0.00 56.93 55.71 2ys4 s PHE 88 Cb -0.15 -0.62 0.10 0.00 -0.34 0.00 0.00 43.02 42.02 2ys4 s PHE 88 CO 0.02 -0.65 0.20 -2.00 -1.46 0.00 0.00 175.22 171.33 2ys4 s GLU 89 N 2.21 2.18 0.44 10.12 2.12 -1.06 -1.84 118.70 132.87 2ys4 s GLU 89 Ca 0.06 -1.69 -0.24 0.00 0.36 0.00 0.00 54.97 53.46 2ys4 s GLU 89 Cb -0.16 -3.59 -0.08 0.00 0.26 0.00 0.00 34.13 30.57 2ys4 s GLU 89 CO -0.18 -1.01 1.17 -1.25 -0.54 0.00 0.00 175.26 173.45 2ys4 s PRO 90 N 1.21 3.86 -0.18 4.30 0.04 -1.24 -4.77 135.00 138.23 2ys4 s PRO 90 Ca 0.06 1.81 -0.02 0.00 0.04 0.00 0.00 61.00 62.89 2ys4 s PRO 90 Cb -0.23 -2.51 -0.22 0.00 0.04 0.00 0.00 34.50 31.58 2ys4 s PRO 90 CO -0.03 -0.48 0.13 0.94 0.04 0.00 0.00 177.00 177.60 2ys4 n GLN 91 N -0.29 0.71 -4.12 4.56 -0.06 -1.26 -3.75 117.38 113.18 2ys4 n GLN 91 Ca 0.06 0.21 -0.26 0.00 -2.00 0.00 0.00 57.00 55.02 2ys4 n GLN 91 Cb 0.47 -1.63 -0.06 0.00 -4.06 0.00 0.00 30.24 24.96 2ys4 n GLN 91 CO 0.00 0.00 0.00 0.45 -0.20 0.00 0.00 177.06 177.31 2ys4 s SER 92 N -6.77 5.35 0.64 1.69 0.15 -1.26 -4.63 113.70 108.87 2ys4 s SER 92 Ca -0.27 -0.21 -0.14 0.00 0.70 0.00 0.00 55.95 56.04 2ys4 s SER 92 Cb 0.08 -1.34 -0.02 0.00 -1.71 0.00 0.00 66.02 63.03 2ys4 s SER 92 CO 0.70 0.06 1.06 -0.69 1.20 0.00 0.00 173.24 175.57 2ys4 s VAL 93 N -1.81 3.90 0.00 4.45 1.01 -1.26 -4.90 120.40 121.79 2ys4 s VAL 93 Ca 0.30 0.77 0.00 0.00 0.00 0.00 0.00 61.98 63.06 2ys4 s VAL 93 Cb -0.10 -3.38 0.00 0.00 0.00 0.00 0.00 36.38 32.90 2ys4 s VAL 93 CO 0.23 -0.66 0.00 0.61 0.00 0.00 0.00 175.10 175.28 2ys4 n GLY 94 N -1.42 2.49 3.75 4.51 0.00 0.72 -4.97 105.19 110.27 2ys4 n GLY 94 Ca 0.08 -2.09 -0.41 0.00 0.00 0.00 0.00 46.02 43.60 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 7.29 -0.19 1.61 2.15 -1.26 -2.27 116.67 123.99 2ys4 s ASP 95 Ca 0.00 2.15 0.00 0.00 0.43 0.00 0.00 52.55 55.13 2ys4 s ASP 95 Cb 0.00 -2.61 0.04 0.00 -0.30 0.00 0.00 42.92 40.05 2ys4 s ASP 95 CO 0.00 -0.17 -0.08 -1.00 -0.17 0.00 0.00 175.17 173.75 2ys4 s HIS 96 N -0.62 2.18 -0.10 -5.34 3.76 -1.26 -4.97 115.29 108.94 2ys4 s HIS 96 Ca 0.47 -1.44 0.02 0.00 -0.15 0.00 0.00 55.06 53.95 2ys4 s HIS 96 Cb -0.30 -1.53 -0.02 0.00 1.11 0.00 0.00 32.58 31.84 2ys4 s HIS 96 CO 0.37 -0.71 -0.15 -1.54 -0.85 0.00 0.00 174.74 171.86 2ys4 s SER 97 N 1.47 3.90 0.00 1.40 1.04 -1.26 -3.36 113.70 116.90 2ys4 s SER 97 Ca -0.01 -0.32 0.00 0.00 0.48 0.00 0.00 55.95 56.10 2ys4 s SER 97 Cb -0.16 -1.34 0.00 0.00 0.10 0.00 0.00 66.02 64.62 2ys4 s SER 97 CO -0.08 0.22 0.00 0.61 0.98 0.00 0.00 173.24 174.97 2ys4 n GLY 98 N 3.15 5.54 3.54 7.32 0.00 -1.15 -4.85 105.19 118.73 2ys4 n GLY 98 Ca -0.18 -1.50 -0.07 0.00 0.00 0.00 0.00 46.02 44.28 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 1.75 0.59 -0.40 1.61 3.52 -1.26 -1.74 118.95 123.02 2ys4 s ARG 99 Ca 0.00 1.17 -0.16 0.00 -0.13 0.00 0.00 55.73 56.62 2ys4 s ARG 99 Cb 0.00 0.27 0.01 0.00 -1.56 0.00 0.00 34.95 33.67 2ys4 s ARG 99 CO 0.00 -0.17 0.35 -0.51 -0.81 0.00 0.00 175.30 174.16 2ys4 s LEU 100 N 1.92 4.88 -0.52 -0.88 1.43 -0.30 -4.85 118.68 120.36 2ys4 s LEU 100 Ca -0.08 -0.69 -0.19 0.00 -1.03 0.00 0.00 54.13 52.13 2ys4 s LEU 100 Cb -0.08 -2.26 0.06 0.00 0.03 0.00 0.00 46.19 43.94 2ys4 s LEU 100 CO -0.18 -0.46 0.66 -0.63 0.23 0.00 0.00 176.35 175.97 2ys4 s ILE 101 N 1.89 4.83 -0.43 -0.59 1.01 -1.25 -1.88 121.20 124.78 2ys4 s ILE 101 Ca 0.09 -0.49 -0.24 0.00 0.00 0.00 0.00 60.65 60.00 2ys4 s ILE 101 Cb -0.18 -4.34 0.02 0.00 0.01 0.00 0.00 42.46 37.97 2ys4 s ILE 101 CO 0.12 -0.87 0.84 -0.69 0.00 0.00 0.00 174.94 174.33 2ys4 s VAL 102 N 2.74 4.61 -0.39 2.92 1.01 0.00 -3.72 120.40 127.57 2ys4 s VAL 102 Ca 0.16 0.66 -0.19 0.00 0.00 0.00 0.00 61.98 62.62 2ys4 s VAL 102 Cb -0.19 -4.34 0.01 0.00 0.00 0.00 0.00 36.38 31.86 2ys4 s VAL 102 CO 0.12 -0.69 0.53 0.00 0.00 0.00 0.00 175.10 175.06 2ys4 s TYR 104 N 2.45 2.04 -0.17 0.00 1.51 0.01 -0.23 117.35 122.96 2ys4 s TYR 104 Ca 0.18 0.44 0.05 0.00 -1.01 0.00 0.00 57.07 56.73 2ys4 s TYR 104 Cb -0.15 -3.89 -0.22 0.00 -0.11 0.00 0.00 41.96 37.58 2ys4 s TYR 104 CO 0.15 -2.34 0.17 -0.25 -1.11 0.00 0.00 175.55 172.17 2ys4 n ASP 105 N -3.60 1.42 0.11 2.29 9.92 -1.00 -4.30 116.55 121.38 2ys4 n ASP 105 Ca 0.13 0.09 -0.04 0.00 -0.53 0.00 0.00 54.79 54.44 2ys4 n ASP 105 Cb 0.60 -0.19 0.08 0.00 -0.64 0.00 0.00 41.12 40.96 2ys4 n ASP 105 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2ys4 h THR 106 N 0.02 1.50 0.00 -3.53 1.03 -1.96 -3.47 112.91 106.50 2ys4 h THR 106 Ca -0.47 -2.44 0.00 0.00 -0.01 0.00 0.00 66.41 63.48 2ys4 h THR 106 Cb 2.03 2.32 0.00 0.00 -1.07 0.00 0.00 68.15 71.43 2ys4 h THR 106 CO 0.02 0.70 0.00 0.61 -0.01 0.00 0.00 175.52 176.84 2ys4 n GLY 107 N 0.56 0.29 3.25 2.99 0.00 -1.26 -5.18 105.19 105.84 2ys4 n GLY 107 Ca -0.01 -0.40 -0.13 0.00 0.00 0.00 0.00 46.02 45.47 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 0.58 -0.05 1.61 2.02 -1.26 -4.99 118.70 116.61 2ys4 s GLU 108 Ca 0.00 0.09 0.00 0.00 0.02 0.00 0.00 54.97 55.09 2ys4 s GLU 108 Cb 0.00 0.27 0.02 0.00 0.10 0.00 0.00 34.13 34.52 2ys4 s GLU 108 CO 0.00 -0.13 -0.03 0.21 0.02 0.00 0.00 175.26 175.33 2ys4 s LYS 109 N -0.72 0.69 0.07 1.61 2.20 -1.25 -0.81 119.74 121.52 2ys4 s LYS 109 Ca -0.08 -0.03 0.09 0.00 -0.36 0.00 0.00 55.97 55.58 2ys4 s LYS 109 Cb -0.04 -0.80 -0.03 0.00 -1.51 0.00 0.00 37.83 35.45 2ys4 s LYS 109 CO 0.03 -0.13 -0.24 0.08 -0.36 0.00 0.00 175.35 174.73 2ys4 s VAL 110 N 1.12 1.96 -0.13 4.02 1.01 -1.00 -4.93 120.40 122.45 2ys4 s VAL 110 Ca -0.08 -1.42 0.02 0.00 0.00 0.00 0.00 61.98 60.50 2ys4 s VAL 110 Cb -0.14 -1.71 0.01 0.00 0.00 0.00 0.00 36.38 34.54 2ys4 s VAL 110 CO -0.01 0.21 -0.21 -0.36 0.00 0.00 0.00 175.10 174.73 2ys4 s PHE 111 N -0.90 2.52 -0.28 5.22 0.40 -1.25 -0.82 117.98 122.88 2ys4 s PHE 111 Ca 0.10 -1.24 0.01 0.00 -0.60 0.00 0.00 56.93 55.20 2ys4 s PHE 111 Cb -0.10 -1.73 0.08 0.00 0.51 0.00 0.00 43.02 41.79 2ys4 s PHE 111 CO 0.03 -0.57 0.02 0.08 0.70 0.00 0.00 175.22 175.49 2ys4 s VAL 112 N 0.80 1.40 0.55 -0.44 1.01 -0.79 -4.88 120.40 118.06 2ys4 s VAL 112 Ca -0.08 -1.47 -0.20 0.00 0.00 0.00 0.00 61.98 60.24 2ys4 s VAL 112 Cb -0.16 -1.89 -0.07 0.00 0.00 0.00 0.00 36.38 34.27 2ys4 s VAL 112 CO -0.01 -0.40 0.86 -1.20 0.00 0.00 0.00 175.10 174.35 2ys4 n SER 113 N 4.67 0.40 -4.69 3.32 7.64 -1.20 -1.15 113.62 122.60 2ys4 n SER 113 Ca -0.05 0.84 -0.23 0.00 1.01 0.00 0.00 58.87 60.43 2ys4 n SER 113 Cb 0.43 -1.32 -0.07 0.00 -1.01 0.00 0.00 64.21 62.24 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 -0.97 3.21 0.24 -3.43 1.43 -0.71 -0.84 118.68 117.60 2ys4 s LEU 114 Ca 0.71 -0.75 -0.13 0.00 -1.03 0.00 0.00 54.13 52.92 2ys4 s LEU 114 Cb -0.46 -1.69 -0.00 0.00 0.03 0.00 0.00 46.19 44.08 2ys4 s LEU 114 CO 0.51 -0.19 0.49 -0.31 0.23 0.00 0.00 176.35 177.08 2ys4 s TYR 115 N -2.40 0.29 0.00 0.29 2.02 -1.24 -2.94 117.35 113.37 2ys4 s TYR 115 Ca 0.35 -0.66 0.00 0.00 -0.37 0.00 0.00 57.07 56.39 2ys4 s TYR 115 Cb -0.03 0.23 0.00 0.00 -0.40 0.00 0.00 41.96 41.75 2ys4 s TYR 115 CO 0.21 -0.99 0.00 0.41 -1.57 0.00 0.00 175.55 173.61 2ys4 n GLY 116 N -0.38 -1.79 3.52 0.71 0.00 -1.21 -4.17 105.19 101.86 2ys4 n GLY 116 Ca -0.03 0.69 -0.41 0.00 0.00 0.00 0.00 46.02 46.28 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 0.72 -2.66 4.61 0.00 -1.22 -4.11 120.51 117.84 2ys4 n ALA 117 Ca 0.00 -0.55 -0.37 0.00 0.00 0.00 0.00 53.44 52.52 2ys4 n ALA 117 Cb 0.00 -2.79 -0.06 0.00 0.00 0.00 0.00 19.45 16.60 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 3.64 0.47 0.00 0.00 -0.96 -2.43 121.76 132.68 2ys4 s ALA 118 Ca 1.12 -0.35 0.08 0.00 0.00 0.00 0.00 51.96 52.81 2ys4 s ALA 118 Cb -0.64 -2.39 0.01 0.00 0.00 0.00 0.00 23.12 20.10 2ys4 s ALA 118 CO 0.38 0.26 0.49 0.96 0.00 0.00 0.00 175.76 177.85 2ys4 s ILE 119 N -0.19 2.47 -2.03 0.00 -4.36 -1.04 -0.20 121.20 115.85 2ys4 s ILE 119 Ca 0.20 -1.24 0.30 0.00 -0.26 0.00 0.00 60.65 59.65 2ys4 s ILE 119 Cb -0.14 -2.71 0.65 0.00 1.25 0.00 0.00 42.46 41.51 2ys4 s ILE 119 CO 0.08 0.00 1.97 -0.90 0.24 0.00 0.00 174.94 176.33 2ys4 n ASP 120 N -1.76 0.60 -2.96 4.36 5.68 -1.26 -3.14 116.55 118.07 2ys4 n ASP 120 Ca 0.06 -1.01 -0.19 0.00 -0.50 0.00 0.00 54.79 53.15 2ys4 n ASP 120 Cb 0.62 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.57 2ys4 n ASP 120 CO 0.00 0.00 0.00 0.23 -1.33 0.00 0.00 177.20 176.10 2ys4 n MET 121 N -0.63 -3.16 0.00 0.11 2.81 -1.26 -4.99 117.12 110.00 2ys4 n MET 121 Ca 0.19 0.59 0.14 0.00 -1.81 0.00 0.00 57.70 56.81 2ys4 n MET 121 Cb 0.24 -5.28 0.81 0.00 -0.71 0.00 0.00 33.22 28.28 2ys4 n MET 121 CO 0.00 0.00 0.00 -1.71 1.51 0.00 0.00 175.97 175.77