#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yqg n SER 2 N 0.00 5.09 -2.22 1.61 2.88 -1.26 -4.81 113.62 114.91 2yqg n SER 2 Ca 0.00 -3.75 -0.26 0.00 -1.33 0.00 0.00 58.87 53.53 2yqg n SER 2 Cb 0.00 -0.42 0.03 0.00 -0.75 0.00 0.00 64.21 63.08 2yqg n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2yqg n SER 3 N -0.67 6.94 -1.57 -3.46 2.88 -1.26 -4.92 113.62 111.57 2yqg n SER 3 Ca 0.44 -3.38 0.00 0.00 -1.33 0.00 0.00 58.87 54.61 2yqg n SER 3 Cb 0.87 -1.07 0.00 0.00 -0.75 0.00 0.00 64.21 63.26 2yqg n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yqg n GLY 4 N -0.02 -4.48 3.42 0.46 0.00 -1.26 -5.11 105.19 98.20 2yqg n GLY 4 Ca 0.45 -0.33 -0.10 0.00 0.00 0.00 0.00 46.02 46.04 2yqg n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yqg s SER 5 N -0.30 -0.32 0.34 1.61 0.01 -1.26 -5.19 113.70 108.60 2yqg s SER 5 Ca 0.00 -0.31 -0.12 0.00 1.31 0.00 0.00 55.95 56.83 2yqg s SER 5 Cb 0.00 0.54 0.05 0.00 0.21 0.00 0.00 66.02 66.82 2yqg s SER 5 CO 0.00 -0.95 0.66 -1.54 0.41 0.00 0.00 173.24 171.81 2yqg n SER 6 N -0.30 -1.91 0.00 2.44 3.41 -1.26 -5.16 113.62 110.83 2yqg n SER 6 Ca -0.14 -2.40 0.00 0.00 -0.26 0.00 0.00 58.87 56.07 2yqg n SER 6 Cb 0.63 3.20 0.00 0.00 -0.26 0.00 0.00 64.21 67.79 2yqg n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yqg n GLY 7 N -0.47 0.13 3.74 5.00 0.00 -1.26 -5.10 105.19 107.23 2yqg n GLY 7 Ca -0.07 -1.03 -0.41 0.00 0.00 0.00 0.00 46.02 44.51 2yqg n GLY 7 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2yqg s GLN 8 N -2.00 4.39 -0.99 1.61 2.00 -1.26 -4.95 119.66 118.45 2yqg s GLN 8 Ca 0.00 2.05 -0.19 0.00 -2.00 0.00 0.00 55.36 55.22 2yqg s GLN 8 Cb 0.00 -3.20 0.12 0.00 0.80 0.00 0.00 33.01 30.73 2yqg s GLN 8 CO 0.00 -0.25 1.25 0.15 -0.50 0.00 0.00 175.29 175.94 2yqg s LYS 9 N -0.12 3.67 0.32 1.67 1.02 -1.26 -5.00 119.74 120.04 2yqg s LYS 9 Ca 0.57 -1.74 0.02 0.00 0.02 0.00 0.00 55.97 54.84 2yqg s LYS 9 Cb -0.36 -5.05 -0.03 0.00 -0.52 0.00 0.00 37.83 31.87 2yqg s LYS 9 CO 0.38 -1.88 0.50 0.50 -0.92 0.00 0.00 175.35 173.93 2yqg s ARG 10 N 3.07 3.39 -0.99 1.68 3.52 -1.26 -5.04 118.95 123.32 2yqg s ARG 10 Ca 0.37 -0.55 -0.14 0.00 -0.13 0.00 0.00 55.73 55.29 2yqg s ARG 10 Cb -0.03 -2.74 0.21 0.00 -1.56 0.00 0.00 34.95 30.83 2yqg s ARG 10 CO -0.08 0.18 1.04 0.00 -0.81 0.00 0.00 175.30 175.64 2yqg s ALA 11 N -2.22 4.12 -0.03 6.12 0.00 -1.26 -4.69 121.76 123.79 2yqg s ALA 11 Ca 0.39 -3.37 0.09 0.00 0.00 0.00 0.00 51.96 49.08 2yqg s ALA 11 Cb -0.09 -3.74 -0.14 0.00 0.00 0.00 0.00 23.12 19.15 2yqg s ALA 11 CO 0.34 -2.48 0.18 1.87 0.00 0.00 0.00 175.76 175.67 2yqg n TRP 12 N 4.38 0.00 -2.41 0.00 -0.00 -1.26 -4.98 117.44 113.18 2yqg n TRP 12 Ca 0.22 0.00 -0.42 0.00 -0.00 0.00 0.00 57.50 57.30 2yqg n TRP 12 Cb 0.45 -0.26 -0.03 0.00 -0.00 0.00 0.00 31.31 31.47 2yqg n TRP 12 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 177.69 178.11 2yqg s ILE 13 N -2.58 4.11 0.38 5.87 1.01 -1.26 -4.88 121.20 123.85 2yqg s ILE 13 Ca -0.04 1.47 -0.02 0.00 0.00 0.00 0.00 60.65 62.06 2yqg s ILE 13 Cb 0.05 -3.94 -0.04 0.00 0.01 0.00 0.00 42.46 38.55 2yqg s ILE 13 CO 0.39 0.02 0.62 -0.89 0.00 0.00 0.00 174.94 175.07 2yqg s THR 14 N 2.02 5.04 0.42 2.92 2.01 -1.26 -5.08 115.64 121.71 2yqg s THR 14 Ca 0.58 -0.21 -0.21 0.00 0.31 0.00 0.00 61.69 62.16 2yqg s THR 14 Cb -0.27 -3.85 -0.11 0.00 0.01 0.00 0.00 72.50 68.29 2yqg s THR 14 CO 0.24 -0.61 0.94 0.00 -0.69 0.00 0.00 174.62 174.50 2yqg s ALA 15 N -2.41 3.05 -0.01 7.40 0.00 -1.26 -5.00 121.76 123.53 2yqg s ALA 15 Ca 0.43 0.39 -0.30 0.00 0.00 0.00 0.00 51.96 52.48 2yqg s ALA 15 Cb -0.10 -3.14 -0.05 0.00 0.00 0.00 0.00 23.12 19.83 2yqg s ALA 15 CO 0.38 0.14 1.46 -1.25 0.00 0.00 0.00 175.76 176.48 2yqg s PRO 16 N -3.14 4.25 0.14 0.00 0.04 -1.26 -4.84 135.00 130.19 2yqg s PRO 16 Ca 0.61 2.02 -0.28 0.00 0.04 0.00 0.00 61.00 63.39 2yqg s PRO 16 Cb -0.09 -3.66 -0.07 0.00 0.04 0.00 0.00 34.50 30.72 2yqg s PRO 16 CO 0.13 -0.65 0.90 0.08 0.04 0.00 0.00 177.00 177.50 2yqg s VAL 17 N 2.77 4.42 -0.05 -0.36 1.01 -0.99 -4.96 120.40 122.24 2yqg s VAL 17 Ca 0.66 1.95 -0.02 0.00 0.00 0.00 0.00 61.98 64.56 2yqg s VAL 17 Cb -0.32 -4.26 0.03 0.00 0.00 0.00 0.00 36.38 31.83 2yqg s VAL 17 CO 0.27 0.40 0.06 0.00 0.00 0.00 0.00 175.10 175.82 2yqg s ALA 18 N -0.45 0.27 0.30 5.51 0.00 -1.26 -0.15 121.76 125.97 2yqg s ALA 18 Ca 0.42 0.14 0.01 0.00 0.00 0.00 0.00 51.96 52.53 2yqg s ALA 18 Cb -0.23 -0.66 -0.00 0.00 0.00 0.00 0.00 23.12 22.23 2yqg s ALA 18 CO 0.29 -0.54 0.03 1.28 0.00 0.00 0.00 175.76 176.82 2yqg n LEU 19 N 5.29 0.00 -4.18 0.00 4.77 -1.07 -4.96 117.00 116.86 2yqg n LEU 19 Ca -0.03 -1.98 -0.28 0.00 -0.03 0.00 0.00 56.01 53.68 2yqg n LEU 19 Cb 0.50 0.35 -0.16 0.00 -2.33 0.00 0.00 43.42 41.77 2yqg n LEU 19 CO 0.06 -0.29 -0.53 -0.60 -1.33 0.00 0.00 177.39 174.71 2yqg s ARG 20 N -3.10 2.20 0.47 3.23 3.52 -1.26 -0.37 118.95 123.64 2yqg s ARG 20 Ca 0.04 -0.72 -0.16 0.00 -0.13 0.00 0.00 55.73 54.75 2yqg s ARG 20 Cb 0.00 -1.84 -0.08 0.00 -1.56 0.00 0.00 34.95 31.47 2yqg s ARG 20 CO 0.03 0.25 0.93 -1.83 -0.81 0.00 0.00 175.30 173.87 2yqg s GLU 21 N 0.09 3.98 0.00 5.12 -1.05 -1.19 -4.63 118.70 121.01 2yqg s GLU 21 Ca -0.07 0.89 0.00 0.00 -0.15 0.00 0.00 54.97 55.64 2yqg s GLU 21 Cb -0.14 -2.21 0.00 0.00 -0.44 0.00 0.00 34.13 31.35 2yqg s GLU 21 CO 0.04 -0.15 0.00 0.41 0.95 0.00 0.00 175.26 176.50 2yqg n GLY 22 N -1.26 1.73 3.80 -3.83 0.00 -1.26 -4.62 105.19 99.75 2yqg n GLY 22 Ca 0.06 -0.42 -0.30 0.00 0.00 0.00 0.00 46.02 45.36 2yqg n GLY 22 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2yqg s GLU 23 N 0.00 2.96 0.08 1.61 2.12 -1.26 -4.96 118.70 119.25 2yqg s GLU 23 Ca 0.00 -0.68 -0.37 0.00 0.36 0.00 0.00 54.97 54.28 2yqg s GLU 23 Cb 0.00 -2.76 -0.17 0.00 0.26 0.00 0.00 34.13 31.46 2yqg s GLU 23 CO 0.00 0.56 1.26 -3.47 -0.54 0.00 0.00 175.26 173.07 2yqg n ASP 24 N 0.32 1.28 -4.11 -1.70 2.03 -1.26 -4.82 116.55 108.28 2yqg n ASP 24 Ca -0.08 1.13 -0.43 0.00 0.52 0.00 0.00 54.79 55.92 2yqg n ASP 24 Cb 0.52 -1.14 0.00 0.00 -0.72 0.00 0.00 41.12 39.78 2yqg n ASP 24 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 2yqg n LEU 25 N 2.28 6.10 -0.09 -2.67 7.99 -1.26 -4.64 117.00 124.69 2yqg n LEU 25 Ca 0.18 -4.83 -0.15 0.00 -0.01 0.00 0.00 56.01 51.20 2yqg n LEU 25 Cb 0.18 -1.45 -0.14 0.00 -0.11 0.00 0.00 43.42 41.90 2yqg n LEU 25 CO 0.62 1.32 -1.14 -1.54 -1.51 0.00 0.00 177.39 175.14 2yqg n SER 26 N 3.34 1.21 -0.05 -1.43 3.41 -1.26 -4.30 113.62 114.55 2yqg n SER 26 Ca 0.33 0.00 -0.14 0.00 -0.26 0.00 0.00 58.87 58.80 2yqg n SER 26 Cb 0.37 0.05 -0.02 0.00 -0.26 0.00 0.00 64.21 64.36 2yqg n SER 26 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 2yqg h LYS 27 N 0.01 0.77 -0.05 4.33 1.79 -1.95 -3.28 116.57 118.20 2yqg h LYS 27 Ca -0.52 -0.51 0.03 0.00 -2.18 0.00 0.00 60.65 57.47 2yqg h LYS 27 Cb 2.05 0.07 -0.06 0.00 -1.58 0.00 0.00 32.23 32.71 2yqg h LYS 27 CO -0.01 1.14 -0.42 0.87 -1.08 0.00 0.00 179.45 179.94 2yqg h LYS 28 N 0.58 -0.53 -6.74 3.15 1.79 -1.93 -3.42 116.57 109.48 2yqg h LYS 28 Ca 0.00 0.04 -0.57 0.00 -2.18 0.00 0.00 60.65 57.94 2yqg h LYS 28 Cb 1.18 0.12 0.17 0.00 -1.58 0.00 0.00 32.23 32.12 2yqg h LYS 28 CO 0.12 -0.35 -0.12 0.27 -1.08 0.00 0.00 179.45 178.29 2yqg n ASN 29 N -5.44 -0.16 -4.77 0.86 0.23 -1.24 -4.38 115.26 100.35 2yqg n ASN 29 Ca -0.05 0.71 -0.40 0.00 -0.53 0.00 0.00 54.58 54.31 2yqg n ASN 29 Cb 0.37 -1.30 -0.02 0.00 -2.08 0.00 0.00 39.78 36.74 2yqg n ASN 29 CO 0.00 0.00 0.00 -2.16 -0.93 0.00 0.00 177.26 174.17 2yqg s PRO 30 N -2.72 4.26 0.00 -0.53 0.04 -1.26 -5.01 135.00 129.78 2yqg s PRO 30 Ca 0.72 1.98 0.20 0.00 0.04 0.00 0.00 61.00 63.93 2yqg s PRO 30 Cb -0.39 -2.91 -0.00 0.00 0.04 0.00 0.00 34.50 31.23 2yqg s PRO 30 CO 0.51 -0.18 0.99 0.44 0.04 0.00 0.00 177.00 178.80 2yqg n ILE 31 N 0.54 0.00 -3.38 0.56 -5.35 -1.20 -4.93 119.36 105.60 2yqg n ILE 31 Ca 0.02 -0.30 0.02 0.00 -0.27 0.00 0.00 62.75 62.22 2yqg n ILE 31 Cb 0.44 1.23 -0.05 0.00 -1.74 0.00 0.00 39.64 39.53 2yqg n ILE 31 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2yqg s ALA 32 N -2.21 -2.88 -0.53 -1.28 0.00 -1.26 -4.93 121.76 108.67 2yqg s ALA 32 Ca 0.16 1.96 0.07 0.00 0.00 0.00 0.00 51.96 54.15 2yqg s ALA 32 Cb 0.16 -2.10 0.26 0.00 0.00 0.00 0.00 23.12 21.44 2yqg s ALA 32 CO 0.49 -0.80 0.67 1.17 0.00 0.00 0.00 175.76 177.29 2yqg n LYS 33 N 4.40 1.83 -2.20 0.00 4.81 -1.26 -3.18 118.16 122.56 2yqg n LYS 33 Ca -0.10 -4.09 -0.38 0.00 -0.87 0.00 0.00 58.31 52.87 2yqg n LYS 33 Cb 0.55 -1.84 -0.01 0.00 0.02 0.00 0.00 35.03 33.75 2yqg n LYS 33 CO 0.00 0.00 0.00 0.96 1.17 0.00 0.00 177.40 179.53 2yqg s ILE 34 N -2.10 2.96 0.33 3.15 -5.25 -1.26 -5.05 121.20 113.98 2yqg s ILE 34 Ca 0.39 0.80 0.03 0.00 -0.99 0.00 0.00 60.65 60.88 2yqg s ILE 34 Cb 0.17 -3.45 -0.05 0.00 2.95 0.00 0.00 42.46 42.08 2yqg s ILE 34 CO -0.06 0.07 0.08 -1.00 -1.79 0.00 0.00 174.94 172.24 2yqg s HIS 35 N -1.39 1.83 -0.18 1.37 0.09 -1.26 -4.97 115.29 110.78 2yqg s HIS 35 Ca 0.59 -1.08 -0.09 0.00 -0.00 0.00 0.00 55.06 54.48 2yqg s HIS 35 Cb -0.33 -1.17 -0.05 0.00 -0.00 0.00 0.00 32.58 31.04 2yqg s HIS 35 CO 0.41 -0.13 0.11 0.45 -0.00 0.00 0.00 174.74 175.57 2yqg s SER 36 N -3.47 6.02 0.29 1.40 0.15 -1.26 -4.99 113.70 111.83 2yqg s SER 36 Ca 0.34 0.21 -0.01 0.00 0.70 0.00 0.00 55.95 57.19 2yqg s SER 36 Cb 0.07 -2.03 0.65 0.00 -1.71 0.00 0.00 66.02 63.00 2yqg s SER 36 CO 0.15 0.21 1.60 -2.24 1.20 0.00 0.00 173.24 174.16 2yqg h ASP 37 N 6.42 -0.37 -0.44 5.45 2.03 -2.00 0.93 116.42 128.45 2yqg h ASP 37 Ca -0.42 0.24 -0.04 0.00 -0.73 0.00 0.00 57.03 56.09 2yqg h ASP 37 Cb 1.17 0.41 -0.02 0.00 -0.83 0.00 0.00 39.33 40.05 2yqg h ASP 37 CO 0.71 -0.27 0.16 -0.07 -1.03 0.00 0.00 179.24 178.74 2yqg h LEU 38 N 0.07 0.66 -0.50 0.15 3.38 -1.97 0.25 115.31 117.37 2yqg h LEU 38 Ca 0.53 -0.09 0.09 0.00 0.09 0.00 0.00 57.88 58.51 2yqg h LEU 38 Cb 1.05 -0.17 -0.08 0.00 0.09 0.00 0.00 40.66 41.55 2yqg h LEU 38 CO -0.80 0.63 0.02 0.00 0.09 0.00 0.00 178.44 178.38 2yqg h ALA 39 N 1.46 0.49 0.01 1.53 0.00 0.60 -0.44 119.26 122.91 2yqg h ALA 39 Ca 0.17 0.14 -0.12 0.00 0.00 0.00 0.00 54.91 55.10 2yqg h ALA 39 Cb 0.20 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 2yqg h ALA 39 CO -0.01 -0.37 -0.62 1.49 0.00 0.00 0.00 179.25 179.74 2yqg h GLU 40 N 0.14 0.02 -0.87 0.00 4.22 -1.28 -1.40 114.58 115.41 2yqg h GLU 40 Ca 0.25 -0.04 0.21 0.00 0.08 0.00 0.00 59.36 59.86 2yqg h GLU 40 Cb 0.37 0.02 -0.16 0.00 0.50 0.00 0.00 28.75 29.48 2yqg h GLU 40 CO -0.40 1.02 -0.03 0.93 -2.18 0.00 0.00 179.01 178.35 2yqg h GLU 41 N -0.94 0.05 0.00 1.92 4.39 -0.42 -3.33 114.58 116.26 2yqg h GLU 41 Ca -0.16 -0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.53 2yqg h GLU 41 Cb 1.19 -0.01 0.00 0.00 -0.10 0.00 0.00 28.75 29.83 2yqg h GLU 41 CO -0.08 0.03 0.00 0.54 -1.16 0.00 0.00 179.01 178.35 2yqg n ARG 42 N -5.44 0.00 0.00 2.33 5.12 -0.18 -5.06 116.66 113.42 2yqg n ARG 42 Ca 0.17 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.09 2yqg n ARG 42 Cb 0.57 -0.31 0.00 0.00 -1.16 0.00 0.00 32.46 31.56 2yqg n ARG 42 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2yqg n GLY 43 N 1.90 0.22 4.02 -0.13 0.00 -0.53 -5.05 105.19 105.62 2yqg n GLY 43 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.81 2yqg n GLY 43 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2yqg s LEU 44 N 0.00 2.96 -0.87 0.99 1.02 -1.19 -5.04 118.68 116.55 2yqg s LEU 44 Ca 0.00 -0.97 -0.14 0.00 0.02 0.00 0.00 54.13 53.04 2yqg s LEU 44 Cb 0.00 -1.44 0.22 0.00 0.02 0.00 0.00 46.19 44.99 2yqg s LEU 44 CO 0.00 -1.37 0.83 -0.75 0.02 0.00 0.00 176.35 175.09 2yqg s LYS 45 N -4.63 3.67 0.16 1.70 2.20 -1.26 -4.76 119.74 116.81 2yqg s LYS 45 Ca 0.57 -2.48 -0.30 0.00 -0.36 0.00 0.00 55.97 53.40 2yqg s LYS 45 Cb -0.05 -4.48 -0.07 0.00 -1.51 0.00 0.00 37.83 31.72 2yqg s LYS 45 CO 0.36 -1.33 0.97 0.42 -0.36 0.00 0.00 175.35 175.41 2yqg s ILE 46 N 0.23 4.31 -0.03 5.43 -1.09 -1.26 -4.77 121.20 124.02 2yqg s ILE 46 Ca 0.21 2.04 -0.10 0.00 -2.23 0.00 0.00 60.65 60.56 2yqg s ILE 46 Cb -0.10 -4.30 -0.05 0.00 -1.58 0.00 0.00 42.46 36.43 2yqg s ILE 46 CO -0.09 0.37 0.29 -0.89 -1.23 0.00 0.00 174.94 173.40 2yqg s THR 47 N -0.41 5.24 0.43 2.92 2.01 -0.66 -4.95 115.64 120.22 2yqg s THR 47 Ca 0.45 0.48 0.02 0.00 0.31 0.00 0.00 61.69 62.95 2yqg s THR 47 Cb -0.25 -3.58 0.02 0.00 0.01 0.00 0.00 72.50 68.71 2yqg s THR 47 CO 0.31 0.53 0.18 -1.22 -0.69 0.00 0.00 174.62 173.73 2yqg n TYR 48 N 1.67 0.02 -3.60 4.92 4.01 -1.26 -0.01 117.16 122.91 2yqg n TYR 48 Ca -0.15 -1.97 -0.10 0.00 -0.16 0.00 0.00 57.90 55.52 2yqg n TYR 48 Cb 0.53 -0.33 -0.06 0.00 -0.31 0.00 0.00 39.34 39.18 2yqg n TYR 48 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 2yqg s LYS 49 N -3.69 0.56 -0.07 -0.72 2.20 -1.21 -4.91 119.74 111.89 2yqg s LYS 49 Ca 0.14 0.29 0.03 0.00 -0.36 0.00 0.00 55.97 56.06 2yqg s LYS 49 Cb -0.01 0.26 0.01 0.00 -1.51 0.00 0.00 37.83 36.58 2yqg s LYS 49 CO 0.09 -0.14 -0.15 0.71 -0.36 0.00 0.00 175.35 175.50 2yqg s TYR 50 N -0.67 1.73 -0.19 4.03 1.51 -1.26 -2.28 117.35 120.23 2yqg s TYR 50 Ca -0.00 -0.67 -0.02 0.00 -1.01 0.00 0.00 57.07 55.37 2yqg s TYR 50 Cb -0.02 -1.23 0.06 0.00 -0.11 0.00 0.00 41.96 40.65 2yqg s TYR 50 CO -0.01 -0.32 0.00 0.95 -1.11 0.00 0.00 175.55 175.06 2yqg s THR 51 N 0.60 0.79 0.00 -0.71 -4.23 -1.19 -4.89 115.64 106.02 2yqg s THR 51 Ca -0.15 -0.65 0.00 0.00 -1.18 0.00 0.00 61.69 59.70 2yqg s THR 51 Cb -0.16 -1.19 0.00 0.00 1.34 0.00 0.00 72.50 72.49 2yqg s THR 51 CO 0.05 -0.11 0.00 0.61 -0.54 0.00 0.00 174.62 174.63 2yqg n GLY 52 N 4.96 0.33 3.34 3.99 0.00 -1.26 -3.70 105.19 112.84 2yqg n GLY 52 Ca -0.10 -1.04 -0.50 0.00 0.00 0.00 0.00 46.02 44.39 2yqg n GLY 52 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2yqg n LYS 53 N -0.49 0.00 0.00 1.61 4.81 -1.18 -1.83 118.16 121.08 2yqg n LYS 53 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 2yqg n LYS 53 Cb 0.00 -1.10 0.00 0.00 0.02 0.00 0.00 35.03 33.95 2yqg n LYS 53 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2yqg n GLY 54 N 1.83 3.07 0.09 3.14 0.00 0.09 -4.75 105.19 108.65 2yqg n GLY 54 Ca 0.18 -0.87 -0.11 0.00 0.00 0.00 0.00 46.02 45.22 2yqg n GLY 54 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2yqg n ILE 55 N 0.00 1.48 -0.06 -0.61 5.41 -0.76 -3.98 119.36 120.84 2yqg n ILE 55 Ca 0.00 0.10 -0.16 0.00 1.00 0.00 0.00 62.75 63.69 2yqg n ILE 55 Cb 0.00 -2.29 -0.13 0.00 -0.71 0.00 0.00 39.64 36.51 2yqg n ILE 55 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 2yqg h THR 56 N -1.00 1.61 -2.68 1.39 1.35 -1.83 -3.47 112.91 108.27 2yqg h THR 56 Ca -0.10 -2.35 -0.57 0.00 -0.55 0.00 0.00 66.41 62.84 2yqg h THR 56 Cb 0.93 3.18 -0.05 0.00 -1.73 0.00 0.00 68.15 70.48 2yqg h THR 56 CO -0.06 0.58 -0.52 -1.61 -0.25 0.00 0.00 175.52 173.66 2yqg s GLU 57 N -2.28 3.14 0.78 4.72 2.02 -1.26 -5.05 118.70 120.77 2yqg s GLU 57 Ca -0.20 -0.73 -0.11 0.00 0.02 0.00 0.00 54.97 53.96 2yqg s GLU 57 Cb -0.01 -2.80 0.06 0.00 0.10 0.00 0.00 34.13 31.48 2yqg s GLU 57 CO 0.70 0.51 1.09 -1.25 0.02 0.00 0.00 175.26 176.33 2yqg s PRO 58 N -3.09 2.23 0.50 0.39 0.04 -1.26 -0.74 135.00 133.07 2yqg s PRO 58 Ca 0.32 1.16 -0.21 0.00 0.04 0.00 0.00 61.00 62.32 2yqg s PRO 58 Cb -0.11 -1.89 -0.07 0.00 0.04 0.00 0.00 34.50 32.47 2yqg s PRO 58 CO 0.26 -1.66 1.15 -1.25 0.04 0.00 0.00 177.00 175.53 2yqg s PRO 59 N -4.90 3.55 0.79 0.56 0.04 -1.26 -4.46 135.00 129.32 2yqg s PRO 59 Ca 0.61 1.69 -0.06 0.00 0.04 0.00 0.00 61.00 63.28 2yqg s PRO 59 Cb -0.17 -2.20 0.14 0.00 0.04 0.00 0.00 34.50 32.31 2yqg s PRO 59 CO 0.56 -0.70 1.09 -0.06 0.04 0.00 0.00 177.00 177.93 2yqg s PHE 60 N -1.66 1.80 -1.41 0.56 0.40 -1.26 -4.02 117.98 112.38 2yqg s PHE 60 Ca 0.68 0.00 -0.08 0.00 -0.60 0.00 0.00 56.93 56.94 2yqg s PHE 60 Cb -0.26 -3.35 0.04 0.00 0.51 0.00 0.00 43.02 39.96 2yqg s PHE 60 CO 0.31 -1.93 0.95 0.41 0.70 0.00 0.00 175.22 175.65 2yqg n GLY 61 N -3.11 -0.44 0.43 4.36 0.00 -1.26 -4.91 105.19 100.26 2yqg n GLY 61 Ca 0.14 0.18 -0.12 0.00 0.00 0.00 0.00 46.02 46.22 2yqg n GLY 61 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2yqg n ILE 62 N -4.60 1.23 -4.92 -0.61 2.08 -1.26 -4.44 119.36 106.84 2yqg n ILE 62 Ca -0.08 0.01 -0.27 0.00 0.56 0.00 0.00 62.75 62.97 2yqg n ILE 62 Cb 0.58 -1.94 -0.15 0.00 -0.75 0.00 0.00 39.64 37.39 2yqg n ILE 62 CO 0.00 0.00 0.00 -0.36 0.56 0.00 0.00 176.55 176.75 2yqg s PHE 63 N -2.48 1.91 0.22 1.39 0.08 -1.26 -1.11 117.98 116.74 2yqg s PHE 63 Ca -0.22 -0.37 0.09 0.00 0.12 0.00 0.00 56.93 56.55 2yqg s PHE 63 Cb 0.06 -1.20 -0.05 0.00 -0.57 0.00 0.00 43.02 41.26 2yqg s PHE 63 CO 0.30 0.01 -0.16 0.14 -0.10 0.00 0.00 175.22 175.42 2yqg s VAL 64 N -0.61 1.91 -0.27 -0.44 -7.23 -0.91 -4.72 120.40 108.14 2yqg s VAL 64 Ca 0.08 -2.26 -0.22 0.00 -1.81 0.00 0.00 61.98 57.77 2yqg s VAL 64 Cb -0.08 -2.12 0.07 0.00 0.56 0.00 0.00 36.38 34.81 2yqg s VAL 64 CO 0.00 -0.54 0.70 0.72 -0.31 0.00 0.00 175.10 175.67 2yqg s PHE 65 N -2.86 -0.85 -0.01 2.82 -0.12 -1.26 -2.41 117.98 113.28 2yqg s PHE 65 Ca 0.24 1.96 0.04 0.00 -0.05 0.00 0.00 56.93 59.13 2yqg s PHE 65 Cb -0.02 0.37 -0.01 0.00 -0.63 0.00 0.00 43.02 42.73 2yqg s PHE 65 CO 0.09 -0.42 -0.14 1.21 -0.05 0.00 0.00 175.22 175.91 2yqg s ASN 66 N 0.73 1.72 0.11 1.98 3.84 -1.23 -4.99 114.94 117.09 2yqg s ASN 66 Ca -0.03 -0.27 -0.04 0.00 0.21 0.00 0.00 52.86 52.74 2yqg s ASN 66 Cb -0.05 -0.23 -0.15 0.00 -0.55 0.00 0.00 41.25 40.27 2yqg s ASN 66 CO -0.05 0.17 1.25 0.07 -2.79 0.00 0.00 177.10 175.75 2yqg h LYS 67 N 5.85 0.33 -1.05 0.43 2.10 -1.92 0.65 116.57 122.96 2yqg h LYS 67 Ca -0.34 -0.42 0.42 0.00 -2.00 0.00 0.00 60.65 58.30 2yqg h LYS 67 Cb 1.16 0.14 -0.17 0.00 -0.90 0.00 0.00 32.23 32.45 2yqg h LYS 67 CO 0.49 1.13 0.59 -0.44 -2.00 0.00 0.00 179.45 179.21 2yqg h ASP 68 N 0.16 0.31 0.00 7.07 5.19 -1.97 -2.03 116.42 125.14 2yqg h ASP 68 Ca -0.10 0.24 0.00 0.00 -0.62 0.00 0.00 57.03 56.56 2yqg h ASP 68 Cb 1.72 0.25 0.00 0.00 0.18 0.00 0.00 39.33 41.48 2yqg h ASP 68 CO 0.18 -0.40 -0.20 1.07 -3.12 0.00 0.00 179.24 176.76 2yqg n THR 69 N -5.18 0.00 -2.69 0.35 5.66 -1.24 -5.10 114.28 106.07 2yqg n THR 69 Ca 0.38 -0.26 -0.04 0.00 -3.05 0.00 0.00 64.05 61.09 2yqg n THR 69 Cb 1.31 0.82 -0.03 0.00 -1.55 0.00 0.00 70.33 70.88 2yqg n THR 69 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2yqg n GLY 70 N 1.01 -4.43 3.58 1.09 0.00 0.23 -5.06 105.19 101.60 2yqg n GLY 70 Ca 0.00 1.33 -0.07 0.00 0.00 0.00 0.00 46.02 47.28 2yqg n GLY 70 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2yqg s GLU 71 N -0.82 0.49 -0.13 1.61 -1.05 -1.18 -4.96 118.70 112.65 2yqg s GLU 71 Ca -0.20 -0.02 0.03 0.00 -0.15 0.00 0.00 54.97 54.63 2yqg s GLU 71 Cb 0.01 0.23 0.00 0.00 -0.44 0.00 0.00 34.13 33.93 2yqg s GLU 71 CO 0.70 -0.18 -0.21 -1.17 0.95 0.00 0.00 175.26 175.35 2yqg s LEU 72 N -1.60 2.18 0.28 1.83 2.96 -1.19 -3.53 118.68 119.61 2yqg s LEU 72 Ca 0.04 -0.56 0.02 0.00 -0.22 0.00 0.00 54.13 53.41 2yqg s LEU 72 Cb -0.01 -1.46 -0.04 0.00 0.50 0.00 0.00 46.19 45.18 2yqg s LEU 72 CO -0.03 0.11 0.13 0.20 -1.32 0.00 0.00 176.35 175.43 2yqg s ASN 73 N 0.64 1.29 -0.09 3.68 0.01 -1.01 -3.24 114.94 116.22 2yqg s ASN 73 Ca -0.11 -1.47 0.04 0.00 -0.71 0.00 0.00 52.86 50.62 2yqg s ASN 73 Cb -0.16 0.28 -0.00 0.00 0.41 0.00 0.00 41.25 41.78 2yqg s ASN 73 CO 0.02 -0.81 -0.23 0.54 -1.51 0.00 0.00 177.10 175.11 2yqg s VAL 74 N -3.71 1.99 -0.27 1.60 0.11 -1.26 -2.14 120.40 116.71 2yqg s VAL 74 Ca 0.37 -0.99 0.08 0.00 -2.93 0.00 0.00 61.98 58.51 2yqg s VAL 74 Cb 0.06 -1.71 0.45 0.00 -1.53 0.00 0.00 36.38 33.66 2yqg s VAL 74 CO 0.15 0.55 1.20 0.35 -3.33 0.00 0.00 175.10 174.01 2yqg n THR 75 N 3.37 2.42 -3.52 5.04 -2.24 -0.26 -4.46 114.28 114.64 2yqg n THR 75 Ca -0.19 -3.96 -0.12 0.00 -2.27 0.00 0.00 64.05 57.51 2yqg n THR 75 Cb 0.53 -0.88 -0.04 0.00 -2.10 0.00 0.00 70.33 67.84 2yqg n THR 75 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2yqg s SER 76 N -3.51 -0.45 -0.43 3.42 0.01 -1.24 -4.78 113.70 106.72 2yqg s SER 76 Ca 0.48 -0.01 -0.22 0.00 1.31 0.00 0.00 55.95 57.51 2yqg s SER 76 Cb 0.40 0.54 0.02 0.00 0.21 0.00 0.00 66.02 67.19 2yqg s SER 76 CO 0.01 -0.86 0.70 -0.63 0.41 0.00 0.00 173.24 172.87 2yqg s ILE 77 N -3.34 4.77 0.26 1.44 1.01 -1.26 -4.22 121.20 119.86 2yqg s ILE 77 Ca -0.01 0.34 -0.29 0.00 0.00 0.00 0.00 60.65 60.69 2yqg s ILE 77 Cb -0.00 -4.23 -0.14 0.00 0.01 0.00 0.00 42.46 38.10 2yqg s ILE 77 CO -0.09 -0.59 1.06 0.18 0.00 0.00 0.00 174.94 175.51 2yqg n LEU 78 N 6.40 1.81 -3.81 2.97 4.77 -1.26 -4.86 117.00 123.01 2yqg n LEU 78 Ca 0.00 1.17 -0.30 0.00 -0.03 0.00 0.00 56.01 56.85 2yqg n LEU 78 Cb 0.48 -1.28 -0.13 0.00 -2.33 0.00 0.00 43.42 40.16 2yqg n LEU 78 CO 0.55 -1.33 -0.22 1.51 -1.33 0.00 0.00 177.39 176.57 2yqg s ASP 79 N -0.39 3.93 0.19 -1.43 1.47 -1.26 -4.11 116.67 115.06 2yqg s ASP 79 Ca 0.62 -2.78 -0.24 0.00 1.18 0.00 0.00 52.55 51.33 2yqg s ASP 79 Cb -0.73 -1.28 0.08 0.00 -0.34 0.00 0.00 42.92 40.65 2yqg s ASP 79 CO 0.58 -0.25 1.56 -0.09 0.68 0.00 0.00 175.17 177.64 2yqg h ARG 80 N 6.64 -0.10 -0.88 2.11 2.43 -1.92 0.34 114.38 123.01 2yqg h ARG 80 Ca -0.04 0.01 0.10 0.00 -0.81 0.00 0.00 59.98 59.24 2yqg h ARG 80 Cb 0.91 0.02 -0.12 0.00 -0.42 0.00 0.00 29.97 30.36 2yqg h ARG 80 CO 0.57 -0.07 -0.52 0.93 -1.51 0.00 0.00 179.97 179.37 2yqg h GLU 81 N -0.11 -0.07 0.24 0.20 5.08 -1.97 -2.54 114.58 115.41 2yqg h GLU 81 Ca 0.23 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.58 2yqg h GLU 81 Cb 0.54 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.81 2yqg h GLU 81 CO -0.84 -0.05 -0.12 1.49 -1.00 0.00 0.00 179.01 178.50 2yqg h GLU 82 N -0.07 -0.31 -4.83 2.33 4.81 -1.54 -3.42 114.58 111.54 2yqg h GLU 82 Ca 0.20 0.02 -0.67 0.00 -0.13 0.00 0.00 59.36 58.77 2yqg h GLU 82 Cb 0.49 0.07 -0.36 0.00 0.63 0.00 0.00 28.75 29.59 2yqg h GLU 82 CO -0.88 -0.21 -0.77 0.95 -0.73 0.00 0.00 179.01 177.38 2yqg s THR 83 N -3.07 2.42 0.30 0.32 -4.23 0.10 -4.98 115.64 106.50 2yqg s THR 83 Ca -0.05 -1.61 0.08 0.00 -1.18 0.00 0.00 61.69 58.94 2yqg s THR 83 Cb 0.00 -2.43 0.02 0.00 1.34 0.00 0.00 72.50 71.44 2yqg s THR 83 CO 0.14 -0.09 1.69 1.55 -0.54 0.00 0.00 174.62 177.37 2yqg h PRO 84 N 7.83 0.14 -3.18 3.99 0.13 -1.67 -3.30 132.00 135.94 2yqg h PRO 84 Ca -0.19 -0.07 -0.06 0.00 -0.87 0.00 0.00 66.00 64.81 2yqg h PRO 84 Cb 1.04 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.03 2yqg h PRO 84 CO 0.49 0.58 -0.06 -0.59 -0.23 0.00 0.00 178.00 178.19 2yqg s PHE 85 N -3.99 -0.26 -0.14 1.56 -0.12 -1.26 -3.22 117.98 110.55 2yqg s PHE 85 Ca -0.03 0.09 0.01 0.00 -0.05 0.00 0.00 56.93 56.95 2yqg s PHE 85 Cb 0.13 0.26 0.02 0.00 -0.63 0.00 0.00 43.02 42.80 2yqg s PHE 85 CO 0.76 -0.65 -0.18 -0.06 -0.05 0.00 0.00 175.22 175.04 2yqg s PHE 86 N -3.17 2.36 -0.33 3.49 0.08 -1.02 -5.00 117.98 114.40 2yqg s PHE 86 Ca -0.01 -1.24 -0.13 0.00 0.12 0.00 0.00 56.93 55.67 2yqg s PHE 86 Cb 0.01 -1.66 -0.02 0.00 -0.57 0.00 0.00 43.02 40.77 2yqg s PHE 86 CO -0.07 -0.62 0.27 -0.51 -0.10 0.00 0.00 175.22 174.18 2yqg s LEU 87 N 1.11 4.38 0.00 -0.37 1.43 -1.26 -2.09 118.68 121.87 2yqg s LEU 87 Ca -0.02 -0.26 0.00 0.00 -1.03 0.00 0.00 54.13 52.83 2yqg s LEU 87 Cb -0.14 -2.20 -0.00 0.00 0.03 0.00 0.00 46.19 43.88 2yqg s LEU 87 CO -0.06 -0.22 0.02 0.18 0.23 0.00 0.00 176.35 176.50 2yqg n LEU 88 N 5.17 0.00 -3.65 1.79 4.77 -0.88 -3.10 117.00 121.10 2yqg n LEU 88 Ca -0.12 -2.08 -0.09 0.00 -0.03 0.00 0.00 56.01 53.70 2yqg n LEU 88 Cb 0.50 0.30 -0.08 0.00 -2.33 0.00 0.00 43.42 41.82 2yqg n LEU 88 CO 0.37 -0.30 0.30 -0.89 -1.33 0.00 0.00 177.39 175.54 2yqg s THR 89 N -2.25 -0.00 -0.13 -5.08 2.01 -1.24 -3.40 115.64 105.54 2yqg s THR 89 Ca 0.02 0.01 -0.05 0.00 0.31 0.00 0.00 61.69 61.98 2yqg s THR 89 Cb 0.00 -0.93 -0.04 0.00 0.01 0.00 0.00 72.50 71.55 2yqg s THR 89 CO 0.02 0.01 0.07 -0.83 -0.69 0.00 0.00 174.62 173.19 2yqg s GLY 90 N 1.42 1.97 0.14 4.40 0.00 -1.26 -3.17 107.32 110.82 2yqg s GLY 90 Ca -0.08 -0.73 0.10 0.00 0.00 0.00 0.00 44.72 44.00 2yqg s GLY 90 CO -0.16 -0.29 -0.23 -0.19 0.00 0.00 0.00 173.10 172.23 2yqg s TYR 91 N -0.50 2.07 -0.38 1.90 1.51 -0.96 -3.34 117.35 117.65 2yqg s TYR 91 Ca 0.10 -0.40 0.02 0.00 -1.01 0.00 0.00 57.07 55.78 2yqg s TYR 91 Cb -0.12 -1.09 0.11 0.00 -0.11 0.00 0.00 41.96 40.75 2yqg s TYR 91 CO 0.02 0.33 0.12 0.00 -1.11 0.00 0.00 175.55 174.91 2yqg s ALA 92 N -1.37 3.03 -0.22 3.71 0.00 -1.26 -3.32 121.76 122.32 2yqg s ALA 92 Ca 0.13 -2.62 -0.17 0.00 0.00 0.00 0.00 51.96 49.31 2yqg s ALA 92 Cb -0.09 -2.13 -0.03 0.00 0.00 0.00 0.00 23.12 20.86 2yqg s ALA 92 CO 0.06 -1.76 0.44 -0.51 0.00 0.00 0.00 175.76 174.00 2yqg s LEU 93 N 0.84 4.12 0.00 0.00 1.43 0.98 -2.71 118.68 123.35 2yqg s LEU 93 Ca 0.11 0.52 -0.15 0.00 -1.03 0.00 0.00 54.13 53.58 2yqg s LEU 93 Cb -0.21 -2.58 0.22 0.00 0.03 0.00 0.00 46.19 43.66 2yqg s LEU 93 CO -0.06 -0.16 0.87 -0.90 0.23 0.00 0.00 176.35 176.34 2yqg n ASP 94 N 4.87 -1.47 -0.33 2.29 5.68 -0.66 -1.65 116.55 125.28 2yqg n ASP 94 Ca -0.07 -1.08 0.18 0.00 -0.50 0.00 0.00 54.79 53.32 2yqg n ASP 94 Cb 0.51 -0.77 0.38 0.00 -1.14 0.00 0.00 41.12 40.09 2yqg n ASP 94 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2yqg h ALA 95 N -2.43 1.69 -0.41 2.12 0.00 -1.91 0.44 119.26 118.76 2yqg h ALA 95 Ca -0.32 0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.66 2yqg h ALA 95 Cb 0.95 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.84 2yqg h ALA 95 CO 0.21 -0.39 -0.10 0.00 0.00 0.00 0.00 179.25 178.97 2yqg h ARG 96 N 0.43 0.74 0.00 0.00 3.08 -1.99 -3.47 114.38 113.17 2yqg h ARG 96 Ca 0.64 -0.24 0.00 0.00 0.07 0.00 0.00 59.98 60.45 2yqg h ARG 96 Cb 1.29 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 31.27 2yqg h ARG 96 CO -0.54 0.82 0.00 0.41 -1.07 0.00 0.00 179.97 179.59 2yqg n GLY 97 N -0.48 1.85 3.37 0.04 0.00 0.15 -5.13 105.19 105.00 2yqg n GLY 97 Ca 0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 2yqg n GLY 97 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yqg s ASN 98 N -2.00 3.27 -0.37 1.61 2.20 -1.26 -4.78 114.94 113.61 2yqg s ASN 98 Ca 0.00 -0.69 -0.29 0.00 -0.94 0.00 0.00 52.86 50.95 2yqg s ASN 98 Cb 0.00 -0.25 0.00 0.00 -2.00 0.00 0.00 41.25 39.00 2yqg s ASN 98 CO 0.00 0.21 1.49 0.54 -2.94 0.00 0.00 177.10 176.40 2yqg s ASN 99 N -1.74 6.28 0.13 3.54 4.22 -1.26 -1.66 114.94 124.46 2yqg s ASN 99 Ca 0.13 1.02 0.13 0.00 -2.14 0.00 0.00 52.86 51.99 2yqg s ASN 99 Cb -0.10 -2.54 -0.11 0.00 1.28 0.00 0.00 41.25 39.78 2yqg s ASN 99 CO 0.05 -1.44 1.12 -0.37 -2.04 0.00 0.00 177.10 174.42 2yqg h VAL 100 N 6.46 1.02 -3.26 3.54 -1.51 -1.91 -3.45 116.25 117.15 2yqg h VAL 100 Ca -0.29 -2.60 -0.50 0.00 -1.23 0.00 0.00 66.70 62.08 2yqg h VAL 100 Cb 1.12 2.46 -0.36 0.00 -2.13 0.00 0.00 31.29 32.37 2yqg h VAL 100 CO 1.06 0.58 -0.80 -1.61 -1.23 0.00 0.00 177.57 175.58 2yqg s GLU 101 N -2.82 1.37 0.51 5.19 0.41 -1.26 -5.12 118.70 116.97 2yqg s GLU 101 Ca 0.00 -0.22 -0.17 0.00 -0.41 0.00 0.00 54.97 54.17 2yqg s GLU 101 Cb 0.09 -1.40 -0.14 0.00 -1.78 0.00 0.00 34.13 30.90 2yqg s GLU 101 CO 0.80 -0.20 -0.16 0.36 -0.49 0.00 0.00 175.26 175.57 2yqg n LYS 102 N 4.66 0.00 -1.10 1.61 0.00 -1.26 -4.49 118.16 117.58 2yqg n LYS 102 Ca -0.15 0.00 -0.30 0.00 -0.00 0.00 0.00 58.31 57.86 2yqg n LYS 102 Cb 0.50 -0.93 0.23 0.00 -0.00 0.00 0.00 35.03 34.83 2yqg n LYS 102 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2yqg s PRO 103 N -1.01 -1.03 0.48 -1.58 0.04 -1.26 -4.92 135.00 125.72 2yqg s PRO 103 Ca 0.52 -0.01 0.02 0.00 0.04 0.00 0.00 61.00 61.57 2yqg s PRO 103 Cb -0.44 -1.61 -0.02 0.00 0.04 0.00 0.00 34.50 32.47 2yqg s PRO 103 CO 0.63 -3.60 0.03 -0.48 0.04 0.00 0.00 177.00 173.62 2yqg s LEU 104 N -6.88 2.26 -0.29 -3.56 0.05 -1.21 -4.99 118.68 104.06 2yqg s LEU 104 Ca 0.70 -1.64 -0.07 0.00 0.05 0.00 0.00 54.13 53.16 2yqg s LEU 104 Cb -0.11 -0.61 -0.00 0.00 -2.05 0.00 0.00 46.19 43.42 2yqg s LEU 104 CO 0.56 -0.85 0.09 -0.70 -0.55 0.00 0.00 176.35 174.90 2yqg s GLU 105 N -3.84 3.28 -0.30 1.48 2.12 -1.26 -4.15 118.70 116.03 2yqg s GLU 105 Ca 0.11 -0.74 -0.02 0.00 0.36 0.00 0.00 54.97 54.68 2yqg s GLU 105 Cb 0.02 -3.40 0.04 0.00 0.26 0.00 0.00 34.13 31.06 2yqg s GLU 105 CO 0.06 -0.37 0.00 -1.17 -0.54 0.00 0.00 175.26 173.24 2yqg s LEU 106 N 1.55 3.84 -0.25 2.70 2.96 -1.22 -4.64 118.68 123.62 2yqg s LEU 106 Ca 0.04 -1.18 -0.05 0.00 -0.22 0.00 0.00 54.13 52.71 2yqg s LEU 106 Cb -0.17 -1.73 -0.01 0.00 0.50 0.00 0.00 46.19 44.79 2yqg s LEU 106 CO 0.03 -0.25 0.02 -0.60 -1.32 0.00 0.00 176.35 174.24 2yqg s ARG 107 N 1.29 3.37 -0.49 1.98 3.52 -1.26 -2.07 118.95 125.28 2yqg s ARG 107 Ca -0.04 -0.65 -0.14 0.00 -0.13 0.00 0.00 55.73 54.77 2yqg s ARG 107 Cb -0.19 -3.18 0.10 0.00 -1.56 0.00 0.00 34.95 30.11 2yqg s ARG 107 CO -0.01 -0.26 0.41 0.42 -0.81 0.00 0.00 175.30 175.05 2yqg s ILE 108 N 1.52 4.94 0.23 4.11 1.01 -0.89 -2.35 121.20 129.77 2yqg s ILE 108 Ca 0.05 -1.37 -0.27 0.00 0.00 0.00 0.00 60.65 59.06 2yqg s ILE 108 Cb -0.15 -4.08 -0.09 0.00 0.01 0.00 0.00 42.46 38.15 2yqg s ILE 108 CO -0.00 -0.70 0.87 -0.75 0.00 0.00 0.00 174.94 174.36 2yqg s LYS 109 N 1.56 4.67 -0.41 2.79 2.20 0.78 -2.43 119.74 128.90 2yqg s LYS 109 Ca 0.04 1.31 -0.11 0.00 -0.36 0.00 0.00 55.97 56.84 2yqg s LYS 109 Cb -0.26 -3.14 0.05 0.00 -1.51 0.00 0.00 37.83 32.96 2yqg s LYS 109 CO 0.04 0.48 0.26 0.08 -0.36 0.00 0.00 175.35 175.84 2yqg s VAL 110 N -1.29 4.60 0.42 4.02 1.01 -1.20 -2.58 120.40 125.39 2yqg s VAL 110 Ca 0.41 -1.06 -0.24 0.00 0.00 0.00 0.00 61.98 61.09 2yqg s VAL 110 Cb -0.23 -3.68 -0.08 0.00 0.00 0.00 0.00 36.38 32.39 2yqg s VAL 110 CO 0.28 -0.39 1.12 -0.76 0.00 0.00 0.00 175.10 175.35 2yqg s LEU 111 N 1.53 4.11 1.05 3.92 1.43 0.50 -4.94 118.68 126.28 2yqg s LEU 111 Ca 0.03 2.22 -0.12 0.00 -1.03 0.00 0.00 54.13 55.23 2yqg s LEU 111 Cb -0.21 -4.16 0.22 0.00 0.03 0.00 0.00 46.19 42.07 2yqg s LEU 111 CO 0.05 -0.70 1.07 1.51 0.23 0.00 0.00 176.35 178.52 2yqg s ASP 112 N -1.37 1.99 0.33 2.29 -4.77 -1.26 -3.19 116.67 110.69 2yqg s ASP 112 Ca 0.60 1.59 0.07 0.00 -3.30 0.00 0.00 52.55 51.51 2yqg s ASP 112 Cb -0.27 -2.27 0.59 0.00 -1.09 0.00 0.00 42.92 39.88 2yqg s ASP 112 CO 0.33 -3.59 1.80 -0.29 0.70 0.00 0.00 175.17 174.12 2yqg h ILE 113 N -2.20 1.25 -0.67 2.11 6.09 -1.96 -2.52 117.51 119.60 2yqg h ILE 113 Ca -0.55 -1.16 -0.34 0.00 -1.37 0.00 0.00 64.86 61.45 2yqg h ILE 113 Cb 1.31 1.41 -0.20 0.00 0.47 0.00 0.00 36.82 39.81 2yqg h ILE 113 CO 0.50 0.35 0.43 0.59 -3.07 0.00 0.00 178.15 176.95 2yqg n ASN 114 N -4.15 3.57 -4.47 2.19 3.02 -1.26 -4.78 115.26 109.39 2yqg n ASN 114 Ca -0.01 -3.08 -0.44 0.00 -0.03 0.00 0.00 54.58 51.02 2yqg n ASN 114 Cb 0.37 -0.73 -0.00 0.00 -0.61 0.00 0.00 39.78 38.81 2yqg n ASN 114 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2yqg s ASP 115 N -0.59 7.06 -0.30 6.41 2.15 -0.95 -4.73 116.67 125.72 2yqg s ASP 115 Ca 0.39 -2.98 0.08 0.00 0.43 0.00 0.00 52.55 50.48 2yqg s ASP 115 Cb 0.33 -2.40 0.50 0.00 -0.30 0.00 0.00 42.92 41.04 2yqg s ASP 115 CO 0.08 -0.76 1.45 -3.20 -0.17 0.00 0.00 175.17 172.58 2yqg n ASN 116 N 5.70 2.73 -4.48 -0.34 2.85 -1.26 -4.96 115.26 115.50 2yqg n ASN 116 Ca 0.37 -3.81 -0.34 0.00 -0.11 0.00 0.00 54.58 50.69 2yqg n ASN 116 Cb 0.43 -0.62 0.11 0.00 1.24 0.00 0.00 39.78 40.93 2yqg n ASN 116 CO 0.00 0.00 0.00 -0.62 -2.11 0.00 0.00 177.26 174.53 2yqg n GLU 117 N -1.10 -0.04 -2.25 1.20 1.02 -1.26 -4.92 120.64 113.29 2yqg n GLU 117 Ca 0.34 0.04 -0.40 0.00 -0.02 0.00 0.00 57.16 57.12 2yqg n GLU 117 Cb 1.00 -1.95 -0.03 0.00 -0.02 0.00 0.00 31.44 30.44 2yqg n GLU 117 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 2yqg s PRO 118 N -3.47 4.38 -0.09 3.49 0.04 -1.26 -5.04 135.00 133.05 2yqg s PRO 118 Ca 0.62 2.02 0.01 0.00 0.04 0.00 0.00 61.00 63.70 2yqg s PRO 118 Cb -0.27 -3.03 0.02 0.00 0.04 0.00 0.00 34.50 31.26 2yqg s PRO 118 CO 0.62 -0.10 -0.11 0.08 0.04 0.00 0.00 177.00 177.53 2yqg s VAL 119 N -1.20 1.19 -0.48 -0.36 1.01 -1.26 -5.08 120.40 114.22 2yqg s VAL 119 Ca 0.49 -0.45 -0.45 0.00 0.00 0.00 0.00 61.98 61.57 2yqg s VAL 119 Cb -0.36 -1.12 -0.19 0.00 0.00 0.00 0.00 36.38 34.71 2yqg s VAL 119 CO 0.47 0.38 1.54 2.22 0.00 0.00 0.00 175.10 179.71 2yqg n PHE 120 N 4.31 1.68 -1.81 5.22 -1.74 -1.26 -4.81 117.46 119.04 2yqg n PHE 120 Ca -0.18 1.09 -0.41 0.00 -0.56 0.00 0.00 57.45 57.39 2yqg n PHE 120 Cb 0.51 -2.14 -0.00 0.00 1.52 0.00 0.00 39.48 39.37 2yqg n PHE 120 CO 0.00 0.00 0.00 0.99 -0.56 0.00 0.00 176.76 177.19 2yqg s THR 121 N 2.93 2.06 0.01 1.97 2.01 -1.26 -5.01 115.64 118.36 2yqg s THR 121 Ca 1.01 0.06 0.02 0.00 0.31 0.00 0.00 61.69 63.09 2yqg s THR 121 Cb -1.44 -3.04 -0.04 0.00 0.01 0.00 0.00 72.50 68.00 2yqg s THR 121 CO 0.78 0.01 -0.01 -1.58 -0.69 0.00 0.00 174.62 173.14 2yqg s GLN 122 N -1.98 2.71 0.00 4.92 0.74 -1.26 -5.35 119.66 119.44 2yqg s GLN 122 Ca 0.53 -0.66 0.00 0.00 0.05 0.00 0.00 55.36 55.28 2yqg s GLN 122 Cb -0.46 -2.62 0.00 0.00 1.10 0.00 0.00 33.01 31.02 2yqg s GLN 122 CO 0.62 0.61 0.26 -0.40 -0.55 0.00 0.00 175.29 175.83