#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yqg s SER 2 N 0.00 6.37 0.26 1.61 0.15 -1.26 -5.07 113.70 115.76 2yqg s SER 2 Ca 0.00 1.69 0.07 0.00 0.70 0.00 0.00 55.95 58.41 2yqg s SER 2 Cb 0.00 -2.52 -0.04 0.00 -1.71 0.00 0.00 66.02 61.75 2yqg s SER 2 CO 0.00 -0.76 0.20 -0.55 1.20 0.00 0.00 173.24 173.32 2yqg s SER 3 N -2.82 5.45 0.35 5.45 0.15 -1.26 -5.14 113.70 115.88 2yqg s SER 3 Ca 0.61 -0.29 0.06 0.00 0.70 0.00 0.00 55.95 57.03 2yqg s SER 3 Cb -0.12 -1.34 -0.07 0.00 -1.71 0.00 0.00 66.02 62.78 2yqg s SER 3 CO 0.31 -0.07 -0.00 -0.83 1.20 0.00 0.00 173.24 173.85 2yqg s GLY 4 N -3.85 2.18 0.63 9.45 0.00 -1.26 -5.16 107.32 109.32 2yqg s GLY 4 Ca 0.34 -2.11 -0.00 0.00 0.00 0.00 0.00 44.72 42.94 2yqg s GLY 4 CO 0.25 -1.94 0.88 -1.35 0.00 0.00 0.00 173.10 170.94 2yqg s SER 5 N -3.57 4.86 0.08 1.64 1.04 -1.26 -5.12 113.70 111.38 2yqg s SER 5 Ca 0.34 -0.11 0.09 0.00 0.48 0.00 0.00 55.95 56.75 2yqg s SER 5 Cb 0.07 -0.55 -0.03 0.00 0.10 0.00 0.00 66.02 65.61 2yqg s SER 5 CO 0.16 -1.47 -0.24 -0.55 0.98 0.00 0.00 173.24 172.11 2yqg s SER 6 N -4.56 2.96 0.00 7.02 0.15 -1.26 -5.06 113.70 112.96 2yqg s SER 6 Ca 0.61 -0.65 0.00 0.00 0.70 0.00 0.00 55.95 56.61 2yqg s SER 6 Cb -0.08 -0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.01 2yqg s SER 6 CO 0.41 0.18 0.00 0.61 1.20 0.00 0.00 173.24 175.64 2yqg n GLY 7 N 1.37 -0.17 3.77 9.45 0.00 -1.26 -5.14 105.19 113.22 2yqg n GLY 7 Ca -0.18 0.50 -0.39 0.00 0.00 0.00 0.00 46.02 45.95 2yqg n GLY 7 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2yqg s GLN 8 N 0.00 4.00 -0.27 1.61 1.03 -1.26 -4.96 119.66 119.81 2yqg s GLN 8 Ca 0.00 2.13 0.12 0.00 0.04 0.00 0.00 55.36 57.65 2yqg s GLN 8 Cb 0.00 -2.77 0.47 0.00 0.03 0.00 0.00 33.01 30.74 2yqg s GLN 8 CO 0.00 -0.46 1.17 0.36 -2.54 0.00 0.00 175.29 173.82 2yqg n LYS 9 N 0.17 2.87 -3.65 9.60 0.00 -1.26 -4.94 118.16 120.96 2yqg n LYS 9 Ca 0.03 -3.88 -0.35 0.00 -0.00 0.00 0.00 58.31 54.12 2yqg n LYS 9 Cb 0.44 -1.99 -0.07 0.00 -0.00 0.00 0.00 35.03 33.40 2yqg n LYS 9 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 2yqg n ARG 10 N -0.67 2.58 -3.42 -1.58 1.85 -1.26 -5.02 116.66 109.13 2yqg n ARG 10 Ca 0.31 -4.50 -0.12 0.00 -1.00 0.00 0.00 57.85 52.54 2yqg n ARG 10 Cb 0.91 -2.39 -0.02 0.00 -1.05 0.00 0.00 32.46 29.91 2yqg n ARG 10 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2yqg s ALA 11 N -1.51 -1.61 -0.44 2.89 0.00 -1.26 -5.04 121.76 114.78 2yqg s ALA 11 Ca 0.28 0.52 -0.02 0.00 0.00 0.00 0.00 51.96 52.75 2yqg s ALA 11 Cb -0.05 0.86 0.27 0.00 0.00 0.00 0.00 23.12 24.20 2yqg s ALA 11 CO -0.12 -0.76 2.09 -2.67 0.00 0.00 0.00 175.76 174.30 2yqg n TRP 12 N -0.36 2.04 -0.50 0.00 4.27 -1.26 -4.98 117.44 116.65 2yqg n TRP 12 Ca -0.17 -2.27 -0.29 0.00 -3.89 0.00 0.00 57.50 50.89 2yqg n TRP 12 Cb 0.65 -1.14 0.23 0.00 -1.36 0.00 0.00 31.31 29.69 2yqg n TRP 12 CO 0.00 0.00 0.00 0.44 -2.29 0.00 0.00 177.69 175.84 2yqg n ILE 13 N 0.03 0.00 -4.49 -1.67 -5.35 -1.26 -4.66 119.36 101.96 2yqg n ILE 13 Ca 0.41 -0.33 -0.24 0.00 -0.27 0.00 0.00 62.75 62.33 2yqg n ILE 13 Cb 0.59 -0.82 -0.09 0.00 -1.74 0.00 0.00 39.64 37.57 2yqg n ILE 13 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2yqg s THR 14 N -2.27 0.77 0.04 7.28 -4.23 -1.26 -4.82 115.64 111.14 2yqg s THR 14 Ca 0.62 -2.00 -0.04 0.00 -1.18 0.00 0.00 61.69 59.08 2yqg s THR 14 Cb -0.17 -2.49 -0.05 0.00 1.34 0.00 0.00 72.50 71.13 2yqg s THR 14 CO 0.62 0.00 0.26 0.00 -0.54 0.00 0.00 174.62 174.96 2yqg s ALA 15 N -3.27 3.89 0.16 3.99 0.00 -1.26 -5.07 121.76 120.20 2yqg s ALA 15 Ca 0.28 -0.65 -0.31 0.00 0.00 0.00 0.00 51.96 51.28 2yqg s ALA 15 Cb 0.05 -2.00 -0.08 0.00 0.00 0.00 0.00 23.12 21.08 2yqg s ALA 15 CO 0.14 0.70 1.33 -1.25 0.00 0.00 0.00 175.76 176.69 2yqg s PRO 16 N -2.06 4.36 -0.50 0.00 0.04 -1.26 -4.92 135.00 130.67 2yqg s PRO 16 Ca 0.31 2.04 -0.16 0.00 0.04 0.00 0.00 61.00 63.23 2yqg s PRO 16 Cb -0.13 -3.23 0.10 0.00 0.04 0.00 0.00 34.50 31.28 2yqg s PRO 16 CO 0.20 -0.33 0.44 0.08 0.04 0.00 0.00 177.00 177.43 2yqg s VAL 17 N 0.57 5.23 -0.28 -0.36 1.01 -1.22 -5.02 120.40 120.33 2yqg s VAL 17 Ca 0.60 -1.23 -0.09 0.00 0.00 0.00 0.00 61.98 61.26 2yqg s VAL 17 Cb -0.36 -4.21 -0.02 0.00 0.00 0.00 0.00 36.38 31.79 2yqg s VAL 17 CO 0.34 -0.69 0.12 0.00 0.00 0.00 0.00 175.10 174.87 2yqg s ALA 18 N 1.63 3.27 0.46 5.51 0.00 -1.26 -2.47 121.76 128.89 2yqg s ALA 18 Ca 0.04 -1.22 0.05 0.00 0.00 0.00 0.00 51.96 50.82 2yqg s ALA 18 Cb -0.27 -2.27 -0.04 0.00 0.00 0.00 0.00 23.12 20.54 2yqg s ALA 18 CO 0.05 -0.66 0.05 -0.51 0.00 0.00 0.00 175.76 174.69 2yqg s LEU 19 N 1.64 2.67 -0.18 0.00 1.43 -1.11 -5.00 118.68 118.13 2yqg s LEU 19 Ca 0.06 -1.44 -0.02 0.00 -1.03 0.00 0.00 54.13 51.70 2yqg s LEU 19 Cb -0.16 -0.92 -0.01 0.00 0.03 0.00 0.00 46.19 45.13 2yqg s LEU 19 CO 0.06 -0.65 -0.08 -0.60 0.23 0.00 0.00 176.35 175.31 2yqg s ARG 20 N -3.83 3.39 0.45 1.70 3.52 -1.26 -1.72 118.95 121.20 2yqg s ARG 20 Ca 0.24 -0.64 -0.23 0.00 -0.13 0.00 0.00 55.73 54.98 2yqg s ARG 20 Cb 0.05 -2.86 -0.08 0.00 -1.56 0.00 0.00 34.95 30.51 2yqg s ARG 20 CO 0.13 -0.02 1.11 -1.83 -0.81 0.00 0.00 175.30 173.88 2yqg s GLU 21 N 0.98 3.87 0.00 5.12 -1.05 -1.05 -3.80 118.70 122.77 2yqg s GLU 21 Ca -0.01 1.62 0.00 0.00 -0.15 0.00 0.00 54.97 56.44 2yqg s GLU 21 Cb -0.15 -2.38 0.00 0.00 -0.44 0.00 0.00 34.13 31.16 2yqg s GLU 21 CO -0.00 -0.42 0.00 0.41 0.95 0.00 0.00 175.26 176.19 2yqg n GLY 22 N 0.30 3.14 3.71 -3.83 0.00 -1.25 -4.51 105.19 102.76 2yqg n GLY 22 Ca 0.07 -0.89 -0.35 0.00 0.00 0.00 0.00 46.02 44.85 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 3.61 0.24 1.61 2.12 -1.25 -5.03 118.70 120.00 2yqg s GLU 23 Ca 0.00 -0.30 -0.30 0.00 0.36 0.00 0.00 54.97 54.73 2yqg s GLU 23 Cb 0.00 -3.11 -0.10 0.00 0.26 0.00 0.00 34.13 31.18 2yqg s GLU 23 CO 0.00 0.51 1.46 0.16 -0.54 0.00 0.00 175.26 176.85 2yqg s ASP 24 N -0.29 6.64 -1.24 -1.70 1.47 -1.26 -4.85 116.67 115.44 2yqg s ASP 24 Ca 0.09 2.66 -0.10 0.00 1.18 0.00 0.00 52.55 56.38 2yqg s ASP 24 Cb -0.12 -2.62 0.19 0.00 -0.34 0.00 0.00 42.92 40.03 2yqg s ASP 24 CO 0.01 -0.72 1.69 0.18 0.68 0.00 0.00 175.17 177.01 2yqg n LEU 25 N 2.58 6.21 -4.95 2.11 7.99 -1.26 -4.98 117.00 124.69 2yqg n LEU 25 Ca 0.08 -4.66 -0.19 0.00 -0.01 0.00 0.00 56.01 51.23 2yqg n LEU 25 Cb 0.40 -1.50 -0.01 0.00 -0.11 0.00 0.00 43.42 42.20 2yqg n LEU 25 CO 0.61 1.23 0.08 -0.94 -1.51 0.00 0.00 177.39 176.86 2yqg s SER 26 N 1.15 5.45 -0.77 -1.43 1.04 -1.26 -4.44 113.70 113.45 2yqg s SER 26 Ca 0.39 -0.52 0.00 0.00 0.48 0.00 0.00 55.95 56.30 2yqg s SER 26 Cb 0.05 -0.69 0.00 0.00 0.10 0.00 0.00 66.02 65.48 2yqg s SER 26 CO 0.01 -0.67 0.00 1.17 0.98 0.00 0.00 173.24 174.73 2yqg n LYS 27 N -1.70 -1.96 0.00 4.02 3.00 -1.26 -4.67 118.16 115.59 2yqg n LYS 27 Ca 0.05 0.43 0.00 0.00 -0.00 0.00 0.00 58.31 58.80 2yqg n LYS 27 Cb 0.60 -4.83 0.00 0.00 0.00 0.00 0.00 35.03 30.80 2yqg n LYS 27 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2yqg n LYS 28 N -2.24 3.19 -0.99 1.64 5.02 -1.26 -5.06 118.16 118.46 2yqg n LYS 28 Ca -0.09 0.00 -0.33 0.00 -2.02 0.00 0.00 58.31 55.87 2yqg n LYS 28 Cb 0.45 -0.99 0.14 0.00 -0.02 0.00 0.00 35.03 34.61 2yqg n LYS 28 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 2yqg n ASN 29 N -2.06 0.84 -4.76 4.39 0.23 -1.26 -4.39 115.26 108.26 2yqg n ASN 29 Ca 0.00 0.54 -0.41 0.00 -0.53 0.00 0.00 54.58 54.19 2yqg n ASN 29 Cb 0.49 -1.50 -0.03 0.00 -2.08 0.00 0.00 39.78 36.66 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 -4.24 4.45 0.00 -0.53 0.04 -1.26 -5.11 135.00 128.35 2yqg s PRO 30 Ca 0.72 2.06 0.21 0.00 0.04 0.00 0.00 61.00 64.02 2yqg s PRO 30 Cb -0.28 -3.14 -0.25 0.00 0.04 0.00 0.00 34.50 30.88 2yqg s PRO 30 CO 0.53 -0.09 0.56 0.44 0.04 0.00 0.00 177.00 178.48 2yqg n ILE 31 N 1.35 0.40 -3.62 0.56 -5.35 -1.22 -4.97 119.36 106.51 2yqg n ILE 31 Ca 0.01 -0.57 -0.14 0.00 -0.27 0.00 0.00 62.75 61.77 2yqg n ILE 31 Cb 0.43 -0.19 -0.07 0.00 -1.74 0.00 0.00 39.64 38.07 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 -3.30 -1.77 -0.01 -1.28 0.00 -1.25 -4.87 121.76 109.28 2yqg s ALA 32 Ca -0.06 1.95 -0.15 0.00 0.00 0.00 0.00 51.96 53.70 2yqg s ALA 32 Cb 0.12 -1.06 0.02 0.00 0.00 0.00 0.00 23.12 22.20 2yqg s ALA 32 CO 0.87 -0.34 0.32 -1.59 0.00 0.00 0.00 175.76 175.02 2yqg s LYS 33 N 0.23 0.70 0.03 0.00 -2.85 -1.26 -2.86 119.74 113.73 2yqg s LYS 33 Ca -0.01 -0.23 -0.30 0.00 -1.00 0.00 0.00 55.97 54.43 2yqg s LYS 33 Cb -0.05 0.31 -0.06 0.00 -2.06 0.00 0.00 37.83 35.97 2yqg s LYS 33 CO 0.02 -0.20 1.42 0.42 0.10 0.00 0.00 175.35 177.11 2yqg s ILE 34 N -1.52 3.57 -0.52 3.79 1.01 -1.26 -4.89 121.20 121.37 2yqg s ILE 34 Ca -0.12 1.01 -0.07 0.00 0.00 0.00 0.00 60.65 61.47 2yqg s ILE 34 Cb -0.04 -3.65 -0.18 0.00 0.01 0.00 0.00 42.46 38.60 2yqg s ILE 34 CO 0.03 0.01 3.08 1.41 0.00 0.00 0.00 174.94 179.48 2yqg n HIS 35 N 5.10 0.78 -0.68 3.97 8.25 -1.26 -4.91 115.22 126.46 2yqg n HIS 35 Ca 0.13 -1.86 -0.20 0.00 -0.26 0.00 0.00 57.72 55.53 2yqg n HIS 35 Cb 0.43 -1.76 0.17 0.00 1.12 0.00 0.00 29.99 29.96 2yqg n HIS 35 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2yqg n SER 36 N 2.99 -2.17 -3.33 0.41 2.88 -1.26 -4.92 113.62 108.21 2yqg n SER 36 Ca 0.50 -0.85 -0.04 0.00 -1.33 0.00 0.00 58.87 57.15 2yqg n SER 36 Cb 0.59 -0.66 0.02 0.00 -0.75 0.00 0.00 64.21 63.41 2yqg n SER 36 CO 0.00 0.00 0.00 -1.81 -1.23 0.00 0.00 175.04 172.00 2yqg s ASP 37 N -3.27 -0.01 -1.92 -3.46 1.01 -1.26 -4.96 116.67 102.79 2yqg s ASP 37 Ca 0.46 -0.73 0.00 0.00 0.71 0.00 0.00 52.55 53.00 2yqg s ASP 37 Cb -0.05 0.56 0.00 0.00 1.01 0.00 0.00 42.92 44.43 2yqg s ASP 37 CO 0.36 -1.10 0.00 0.18 0.21 0.00 0.00 175.17 174.83 2yqg n LEU 38 N -0.65 -1.69 -0.03 1.23 4.77 -1.26 -4.90 117.00 114.46 2yqg n LEU 38 Ca -0.04 0.24 -0.00 0.00 -0.03 0.00 0.00 56.01 56.18 2yqg n LEU 38 Cb 0.60 -2.81 -0.00 0.00 -2.33 0.00 0.00 43.42 38.87 2yqg n LEU 38 CO 0.21 -0.63 -0.01 0.00 -1.33 0.00 0.00 177.39 175.64 2yqg h ALA 39 N 0.48 0.00 0.01 -1.18 0.00 -1.93 -3.32 119.26 113.32 2yqg h ALA 39 Ca -0.44 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.14 2yqg h ALA 39 Cb 1.33 0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.08 2yqg h ALA 39 CO 0.58 0.01 -1.81 -0.85 0.00 0.00 0.00 179.25 177.18 2yqg n GLU 40 N -3.74 0.65 -0.32 0.00 0.28 -1.26 0.12 120.64 116.37 2yqg n GLU 40 Ca -0.00 0.26 0.22 0.00 -0.16 0.00 0.00 57.16 57.49 2yqg n GLU 40 Cb 0.01 -1.76 0.44 0.00 1.43 0.00 0.00 31.44 31.56 2yqg n GLU 40 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 2yqg h GLU 41 N 0.01 0.21 0.00 3.44 4.39 -1.97 -3.21 114.58 117.45 2yqg h GLU 41 Ca -0.33 -0.01 -0.12 0.00 0.34 0.00 0.00 59.36 59.24 2yqg h GLU 41 Cb 2.04 -0.05 -0.02 0.00 -0.10 0.00 0.00 28.75 30.62 2yqg h GLU 41 CO 0.07 0.14 -1.41 0.54 -1.16 0.00 0.00 179.01 177.19 2yqg n ARG 42 N -5.16 0.16 0.00 2.33 1.74 -1.26 -5.06 116.66 109.41 2yqg n ARG 42 Ca 0.30 0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.44 2yqg n ARG 42 Cb 0.96 -0.87 0.00 0.00 -1.02 0.00 0.00 32.46 31.52 2yqg n ARG 42 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2yqg n GLY 43 N 2.73 0.45 3.91 -0.13 0.00 -0.76 -5.10 105.19 106.29 2yqg n GLY 43 Ca -0.14 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.61 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 4.00 -0.54 0.99 1.43 0.33 -4.98 118.68 119.91 2yqg s LEU 44 Ca 0.00 0.67 0.02 0.00 -1.03 0.00 0.00 54.13 53.79 2yqg s LEU 44 Cb 0.00 -3.52 0.14 0.00 0.03 0.00 0.00 46.19 42.84 2yqg s LEU 44 CO 0.00 -0.26 0.31 -0.54 0.23 0.00 0.00 176.35 176.08 2yqg s LYS 45 N -3.88 2.15 0.11 1.70 1.02 -1.26 -4.54 119.74 115.04 2yqg s LYS 45 Ca 0.43 -2.54 -0.30 0.00 0.02 0.00 0.00 55.97 53.58 2yqg s LYS 45 Cb -0.10 -3.46 -0.07 0.00 -0.52 0.00 0.00 37.83 33.68 2yqg s LYS 45 CO 0.33 -1.12 1.22 0.42 -0.92 0.00 0.00 175.35 175.28 2yqg s ILE 46 N -0.13 3.78 -0.48 2.17 1.09 -1.25 -3.65 121.20 122.75 2yqg s ILE 46 Ca 0.16 1.35 0.25 0.00 -1.10 0.00 0.00 60.65 61.31 2yqg s ILE 46 Cb -0.24 -3.86 0.33 0.00 -1.06 0.00 0.00 42.46 37.63 2yqg s ILE 46 CO -0.02 0.14 1.68 0.74 -0.10 0.00 0.00 174.94 177.38 2yqg h THR 47 N 4.23 0.00 -5.35 2.92 2.02 -1.79 -3.46 112.91 111.47 2yqg h THR 47 Ca -0.43 -0.82 -0.40 0.00 0.77 0.00 0.00 66.41 65.54 2yqg h THR 47 Cb 1.21 1.81 -0.04 0.00 -1.74 0.00 0.00 68.15 69.39 2yqg h THR 47 CO 0.80 0.00 -0.60 -1.22 0.37 0.00 0.00 175.52 174.87 2yqg n TYR 48 N -2.87 -1.91 -0.69 3.16 4.01 -1.25 -3.92 117.16 113.69 2yqg n TYR 48 Ca 0.04 0.55 -0.30 0.00 -0.16 0.00 0.00 57.90 58.03 2yqg n TYR 48 Cb 0.48 -3.47 0.18 0.00 -0.31 0.00 0.00 39.34 36.22 2yqg n TYR 48 CO 0.00 0.00 0.00 -1.59 -0.46 0.00 0.00 176.86 174.81 2yqg s LYS 49 N -6.04 0.66 0.19 -0.72 -2.85 -1.06 -4.75 119.74 105.16 2yqg s LYS 49 Ca 0.42 1.38 0.00 0.00 -1.00 0.00 0.00 55.97 56.78 2yqg s LYS 49 Cb -0.21 -1.70 -0.04 0.00 -2.06 0.00 0.00 37.83 33.82 2yqg s LYS 49 CO 0.52 -2.83 0.07 0.71 0.10 0.00 0.00 175.35 173.92 2yqg s TYR 50 N -2.62 1.18 0.04 1.78 1.51 -1.26 -1.17 117.35 116.81 2yqg s TYR 50 Ca 0.67 -1.21 -0.16 0.00 -1.01 0.00 0.00 57.07 55.36 2yqg s TYR 50 Cb -0.23 -0.65 0.03 0.00 -0.11 0.00 0.00 41.96 41.00 2yqg s TYR 50 CO 0.59 -0.43 0.35 0.95 -1.11 0.00 0.00 175.55 175.90 2yqg s THR 51 N -3.91 0.07 0.00 -0.71 -4.23 0.11 -4.95 115.64 102.02 2yqg s THR 51 Ca 0.31 -0.58 0.00 0.00 -1.18 0.00 0.00 61.69 60.24 2yqg s THR 51 Cb 0.07 -0.94 0.00 0.00 1.34 0.00 0.00 72.50 72.97 2yqg s THR 51 CO 0.08 -0.32 0.00 0.61 -0.54 0.00 0.00 174.62 174.45 2yqg n GLY 52 N 0.55 2.71 3.10 3.99 0.00 -1.26 -1.55 105.19 112.74 2yqg n GLY 52 Ca -0.19 -2.08 -0.36 0.00 0.00 0.00 0.00 46.02 43.39 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 -0.76 -0.01 0.00 1.61 4.81 -1.26 -1.49 118.16 121.06 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 3.07 2.58 0.52 3.14 0.00 0.16 -4.50 105.19 110.15 2yqg n GLY 54 Ca 0.01 -0.01 -0.01 0.00 0.00 0.00 0.00 46.02 46.02 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 0.06 -0.10 -0.61 5.41 -0.84 -3.58 119.36 119.70 2yqg n ILE 55 Ca 0.00 -0.02 -0.14 0.00 1.00 0.00 0.00 62.75 63.59 2yqg n ILE 55 Cb 0.00 -1.06 -0.14 0.00 -0.71 0.00 0.00 39.64 37.73 2yqg n ILE 55 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 176.55 176.90 2yqg n THR 56 N -2.81 1.48 -4.33 1.39 -2.24 -0.56 -4.98 114.28 102.24 2yqg n THR 56 Ca -0.02 -0.72 -0.24 0.00 -2.27 0.00 0.00 64.05 60.80 2yqg n THR 56 Cb 0.52 -1.00 -0.12 0.00 -2.10 0.00 0.00 70.33 67.63 2yqg n THR 56 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2yqg s GLU 57 N -2.52 1.25 0.75 -0.78 0.41 -1.25 -4.98 118.70 111.58 2yqg s GLU 57 Ca -0.20 -1.30 -0.11 0.00 -0.41 0.00 0.00 54.97 52.94 2yqg s GLU 57 Cb 0.07 -1.48 0.04 0.00 -1.78 0.00 0.00 34.13 30.98 2yqg s GLU 57 CO 0.73 0.33 1.10 -1.25 -0.49 0.00 0.00 175.26 175.68 2yqg s PRO 58 N -2.29 2.37 0.35 0.39 0.04 -1.26 0.35 135.00 134.95 2yqg s PRO 58 Ca 0.12 1.22 -0.27 0.00 0.04 0.00 0.00 61.00 62.11 2yqg s PRO 58 Cb -0.08 -1.91 -0.09 0.00 0.04 0.00 0.00 34.50 32.46 2yqg s PRO 58 CO 0.06 -1.56 1.21 -1.25 0.04 0.00 0.00 177.00 175.49 2yqg s PRO 59 N -4.72 4.27 0.41 0.56 0.04 -1.26 -4.58 135.00 129.72 2yqg s PRO 59 Ca 0.62 1.98 0.01 0.00 0.04 0.00 0.00 61.00 63.66 2yqg s PRO 59 Cb -0.18 -2.92 -0.01 0.00 0.04 0.00 0.00 34.50 31.43 2yqg s PRO 59 CO 0.53 -0.17 0.62 -0.06 0.04 0.00 0.00 177.00 177.95 2yqg s PHE 60 N -1.26 3.26 0.00 0.56 0.08 -1.26 -3.54 117.98 115.82 2yqg s PHE 60 Ca 0.52 0.18 0.00 0.00 0.12 0.00 0.00 56.93 57.75 2yqg s PHE 60 Cb -0.34 -2.18 0.00 0.00 -0.57 0.00 0.00 43.02 39.92 2yqg s PHE 60 CO 0.45 -0.21 0.00 0.41 -0.10 0.00 0.00 175.22 175.76 2yqg n GLY 61 N -1.95 0.64 1.13 4.36 0.00 -1.23 -5.01 105.19 103.12 2yqg n GLY 61 Ca -0.00 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 -1.38 0.46 -4.77 -0.61 5.41 -1.25 -4.70 119.36 112.51 2yqg n ILE 62 Ca 0.00 0.15 -0.33 0.00 1.00 0.00 0.00 62.75 63.57 2yqg n ILE 62 Cb 0.44 -1.42 -0.13 0.00 -0.71 0.00 0.00 39.64 37.82 2yqg n ILE 62 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 2yqg s PHE 63 N -2.00 2.80 0.03 1.39 0.08 -1.26 -0.55 117.98 118.48 2yqg s PHE 63 Ca 0.00 -0.31 0.08 0.00 0.12 0.00 0.00 56.93 56.83 2yqg s PHE 63 Cb 0.00 -1.74 -0.03 0.00 -0.57 0.00 0.00 43.02 40.68 2yqg s PHE 63 CO 0.00 0.06 -0.25 0.14 -0.10 0.00 0.00 175.22 175.07 2yqg s VAL 64 N -0.29 1.97 0.01 -0.44 -7.23 -1.15 -4.78 120.40 108.50 2yqg s VAL 64 Ca 0.03 -1.26 -0.22 0.00 -1.81 0.00 0.00 61.98 58.72 2yqg s VAL 64 Cb -0.13 -1.68 0.05 0.00 0.56 0.00 0.00 36.38 35.18 2yqg s VAL 64 CO 0.03 0.37 0.48 0.72 -0.31 0.00 0.00 175.10 176.39 2yqg s PHE 65 N -0.75 -0.38 0.28 2.82 -0.12 -1.26 -2.97 117.98 115.59 2yqg s PHE 65 Ca 0.10 0.52 0.06 0.00 -0.05 0.00 0.00 56.93 57.56 2yqg s PHE 65 Cb -0.10 0.27 -0.02 0.00 -0.63 0.00 0.00 43.02 42.54 2yqg s PHE 65 CO 0.01 -0.56 0.21 0.09 -0.05 0.00 0.00 175.22 174.93 2yqg n ASN 66 N 0.76 -0.35 -0.00 1.98 3.02 -1.26 -5.02 115.26 114.39 2yqg n ASN 66 Ca -0.19 -2.78 0.06 0.00 -0.03 0.00 0.00 54.58 51.64 2yqg n ASN 66 Cb 0.58 1.29 -0.08 0.00 -0.61 0.00 0.00 39.78 40.96 2yqg n ASN 66 CO 0.00 0.00 0.00 2.29 -2.62 0.00 0.00 177.26 176.93 2yqg n LYS 67 N -0.55 2.02 -0.05 3.52 0.00 -1.25 -3.66 118.16 118.19 2yqg n LYS 67 Ca 0.05 -0.03 -0.00 0.00 -0.00 0.00 0.00 58.31 58.32 2yqg n LYS 67 Cb 0.49 -1.18 -0.00 0.00 -0.00 0.00 0.00 35.03 34.34 2yqg n LYS 67 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.40 177.62 2yqg h ASP 68 N 0.00 0.00 0.06 -5.58 3.58 -1.89 -3.42 116.42 109.17 2yqg h ASP 68 Ca 0.00 -0.02 -0.21 0.00 0.42 0.00 0.00 57.03 57.23 2yqg h ASP 68 Cb 0.40 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.44 2yqg h ASP 68 CO 0.00 0.51 -1.09 0.00 -2.88 0.00 0.00 179.24 175.78 2yqg h THR 69 N -1.00 1.14 -3.48 2.25 1.03 -1.99 -3.50 112.91 107.36 2yqg h THR 69 Ca -0.00 -2.32 0.00 0.00 -0.01 0.00 0.00 66.41 64.08 2yqg h THR 69 Cb 0.02 2.69 0.00 0.00 -1.07 0.00 0.00 68.15 69.79 2yqg h THR 69 CO -0.00 0.56 -0.01 0.61 -0.01 0.00 0.00 175.52 176.67 2yqg n GLY 70 N 1.62 -0.52 3.35 2.99 0.00 -1.24 -5.05 105.19 106.33 2yqg n GLY 70 Ca -0.24 -0.04 -0.12 0.00 0.00 0.00 0.00 46.02 45.62 2yqg n GLY 70 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yqg s GLU 71 N -2.83 0.50 -0.64 1.61 0.41 -1.26 -4.95 118.70 111.54 2yqg s GLU 71 Ca 0.01 0.76 -0.15 0.00 -0.41 0.00 0.00 54.97 55.17 2yqg s GLU 71 Cb -0.00 0.14 0.16 0.00 -1.78 0.00 0.00 34.13 32.65 2yqg s GLU 71 CO 0.15 -0.11 0.59 -1.17 -0.49 0.00 0.00 175.26 174.23 2yqg s LEU 72 N 0.84 6.38 -0.18 1.80 2.96 -1.14 -4.25 118.68 125.09 2yqg s LEU 72 Ca -0.05 -2.11 -0.08 0.00 -0.22 0.00 0.00 54.13 51.68 2yqg s LEU 72 Cb -0.05 -2.21 -0.04 0.00 0.50 0.00 0.00 46.19 44.39 2yqg s LEU 72 CO -0.07 -0.76 0.09 0.21 -1.32 0.00 0.00 176.35 174.50 2yqg s ASN 73 N 3.08 5.84 0.15 3.68 2.47 -1.16 -3.42 114.94 125.59 2yqg s ASN 73 Ca 0.08 0.15 -0.29 0.00 0.42 0.00 0.00 52.86 53.23 2yqg s ASN 73 Cb -0.23 -1.99 -0.07 0.00 -1.45 0.00 0.00 41.25 37.51 2yqg s ASN 73 CO -0.01 0.20 0.91 0.54 -3.72 0.00 0.00 177.10 175.02 2yqg s VAL 74 N 0.23 4.37 -0.20 -5.21 0.11 -1.26 -2.92 120.40 115.52 2yqg s VAL 74 Ca 0.06 1.99 0.16 0.00 -2.93 0.00 0.00 61.98 61.26 2yqg s VAL 74 Cb -0.12 -4.28 0.46 0.00 -1.53 0.00 0.00 36.38 30.90 2yqg s VAL 74 CO -0.00 0.41 1.17 0.35 -3.33 0.00 0.00 175.10 173.70 2yqg n THR 75 N 2.22 1.58 -3.66 5.04 -2.24 0.29 -4.83 114.28 112.69 2yqg n THR 75 Ca -0.01 -2.94 -0.11 0.00 -2.27 0.00 0.00 64.05 58.73 2yqg n THR 75 Cb 0.48 0.16 -0.05 0.00 -2.10 0.00 0.00 70.33 68.82 2yqg n THR 75 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2yqg s SER 76 N -3.20 -0.21 -0.64 3.42 0.15 -1.26 -4.80 113.70 107.17 2yqg s SER 76 Ca 0.38 -0.31 -0.18 0.00 0.70 0.00 0.00 55.95 56.54 2yqg s SER 76 Cb 0.37 0.46 0.12 0.00 -1.71 0.00 0.00 66.02 65.26 2yqg s SER 76 CO -0.05 -0.82 0.71 -0.63 1.20 0.00 0.00 173.24 173.65 2yqg s ILE 77 N -3.66 4.96 0.42 6.45 1.09 -1.26 -4.67 121.20 124.54 2yqg s ILE 77 Ca 0.02 -1.29 -0.21 0.00 -1.10 0.00 0.00 60.65 58.07 2yqg s ILE 77 Cb 0.02 -4.49 -0.14 0.00 -1.06 0.00 0.00 42.46 36.79 2yqg s ILE 77 CO -0.11 -1.11 0.25 0.18 -0.10 0.00 0.00 174.94 174.05 2yqg n LEU 78 N 5.91 -1.78 -3.62 2.97 4.77 -1.26 -4.74 117.00 119.25 2yqg n LEU 78 Ca -0.05 0.83 -0.22 0.00 -0.03 0.00 0.00 56.01 56.54 2yqg n LEU 78 Cb 0.43 -0.97 -0.17 0.00 -2.33 0.00 0.00 43.42 40.38 2yqg n LEU 78 CO 0.54 -3.74 -0.31 -1.81 -1.33 0.00 0.00 177.39 170.74 2yqg s ASP 79 N -1.00 1.71 0.18 -1.43 1.01 -1.26 -3.75 116.67 112.13 2yqg s ASP 79 Ca 0.61 -0.26 -0.11 0.00 0.71 0.00 0.00 52.55 53.50 2yqg s ASP 79 Cb -0.61 -0.09 0.10 0.00 1.01 0.00 0.00 42.92 43.32 2yqg s ASP 79 CO 0.61 -0.31 1.75 -0.09 0.21 0.00 0.00 175.17 177.34 2yqg h ARG 80 N 8.41 0.95 -0.80 8.23 2.43 -1.88 0.76 114.38 132.48 2yqg h ARG 80 Ca -0.14 -0.16 0.19 0.00 -0.81 0.00 0.00 59.98 59.06 2yqg h ARG 80 Cb 1.14 -0.16 -0.13 0.00 -0.42 0.00 0.00 29.97 30.40 2yqg h ARG 80 CO 0.23 0.78 0.16 0.93 -1.51 0.00 0.00 179.97 180.56 2yqg h GLU 81 N 0.90 0.21 0.00 0.20 4.39 -1.98 -3.16 114.58 115.14 2yqg h GLU 81 Ca 0.22 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.90 2yqg h GLU 81 Cb 0.17 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 28.77 2yqg h GLU 81 CO -0.02 0.14 -0.56 -1.91 -1.16 0.00 0.00 179.01 175.49 2yqg n GLU 82 N -5.22 0.40 -3.73 2.33 2.13 -1.07 -4.86 120.64 110.61 2yqg n GLU 82 Ca 0.17 0.38 -0.38 0.00 0.66 0.00 0.00 57.16 57.99 2yqg n GLU 82 Cb 0.54 -1.46 -0.11 0.00 0.27 0.00 0.00 31.44 30.68 2yqg n GLU 82 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2yqg s THR 83 N -2.23 3.63 0.15 6.31 -4.23 0.26 -4.95 115.64 114.60 2yqg s THR 83 Ca -0.16 -1.61 0.32 0.00 -1.18 0.00 0.00 61.69 59.05 2yqg s THR 83 Cb 0.02 -3.28 0.35 0.00 1.34 0.00 0.00 72.50 70.94 2yqg s THR 83 CO 0.24 -0.48 1.97 1.55 -0.54 0.00 0.00 174.62 177.37 2yqg h PRO 84 N 8.19 0.00 -2.16 3.99 0.13 -1.70 -3.24 132.00 137.22 2yqg h PRO 84 Ca -0.19 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 65.06 2yqg h PRO 84 Cb 1.07 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.03 2yqg h PRO 84 CO 0.68 0.06 0.52 -0.59 -0.23 0.00 0.00 178.00 178.45 2yqg s PHE 85 N -3.72 -0.33 -0.30 1.56 -0.12 -1.26 -3.79 117.98 110.01 2yqg s PHE 85 Ca 0.00 0.24 0.02 0.00 -0.05 0.00 0.00 56.93 57.14 2yqg s PHE 85 Cb 0.10 0.53 0.09 0.00 -0.63 0.00 0.00 43.02 43.10 2yqg s PHE 85 CO 0.56 -0.50 0.03 -0.06 -0.05 0.00 0.00 175.22 175.20 2yqg s PHE 86 N -2.90 2.83 -0.42 3.49 0.08 -1.22 -4.99 117.98 114.86 2yqg s PHE 86 Ca 0.05 -2.32 -0.20 0.00 0.12 0.00 0.00 56.93 54.57 2yqg s PHE 86 Cb -0.01 -2.22 0.02 0.00 -0.57 0.00 0.00 43.02 40.24 2yqg s PHE 86 CO -0.08 -0.89 0.62 -0.51 -0.10 0.00 0.00 175.22 174.27 2yqg s LEU 87 N 1.23 4.47 0.25 -0.37 1.43 -1.26 -2.39 118.68 122.04 2yqg s LEU 87 Ca 0.06 -0.27 0.11 0.00 -1.03 0.00 0.00 54.13 53.00 2yqg s LEU 87 Cb -0.18 -2.71 -0.05 0.00 0.03 0.00 0.00 46.19 43.28 2yqg s LEU 87 CO -0.12 -0.72 -0.20 -0.76 0.23 0.00 0.00 176.35 174.77 2yqg s LEU 88 N 2.74 2.55 -0.05 1.79 1.43 -0.55 -4.32 118.68 122.28 2yqg s LEU 88 Ca 0.22 -0.99 -0.02 0.00 -1.03 0.00 0.00 54.13 52.31 2yqg s LEU 88 Cb -0.14 -1.04 0.04 0.00 0.03 0.00 0.00 46.19 45.07 2yqg s LEU 88 CO 0.18 0.02 0.09 -0.89 0.23 0.00 0.00 176.35 175.98 2yqg s THR 89 N -2.40 -0.09 0.12 5.49 2.01 -0.59 -2.86 115.64 117.33 2yqg s THR 89 Ca 0.27 0.24 0.03 0.00 0.31 0.00 0.00 61.69 62.54 2yqg s THR 89 Cb -0.05 -0.18 -0.04 0.00 0.01 0.00 0.00 72.50 72.25 2yqg s THR 89 CO 0.13 0.10 0.21 -0.83 -0.69 0.00 0.00 174.62 173.54 2yqg s GLY 90 N 1.38 1.85 -0.07 4.40 0.00 -1.26 -0.71 107.32 112.92 2yqg s GLY 90 Ca -0.06 -1.03 -0.00 0.00 0.00 0.00 0.00 44.72 43.63 2yqg s GLY 90 CO -0.04 -1.02 -0.02 -0.19 0.00 0.00 0.00 173.10 171.82 2yqg s TYR 91 N -1.65 0.78 -0.83 1.90 1.51 -0.31 -3.64 117.35 115.10 2yqg s TYR 91 Ca 0.33 -0.24 -0.22 0.00 -1.01 0.00 0.00 57.07 55.92 2yqg s TYR 91 Cb -0.11 -0.81 0.07 0.00 -0.11 0.00 0.00 41.96 41.00 2yqg s TYR 91 CO 0.27 -0.31 1.18 0.00 -1.11 0.00 0.00 175.55 175.58 2yqg s ALA 92 N 1.61 3.02 -0.20 3.71 0.00 -1.26 -2.58 121.76 126.06 2yqg s ALA 92 Ca -0.00 -2.10 -0.27 0.00 0.00 0.00 0.00 51.96 49.59 2yqg s ALA 92 Cb -0.13 -4.14 -0.01 0.00 0.00 0.00 0.00 23.12 18.84 2yqg s ALA 92 CO -0.04 -3.12 0.91 -0.51 0.00 0.00 0.00 175.76 173.00 2yqg s LEU 93 N 4.22 4.14 0.00 0.00 1.43 -1.26 -3.93 118.68 123.27 2yqg s LEU 93 Ca 0.33 1.24 -0.11 0.00 -1.03 0.00 0.00 54.13 54.56 2yqg s LEU 93 Cb -0.08 -3.35 0.16 0.00 0.03 0.00 0.00 46.19 42.96 2yqg s LEU 93 CO 0.01 -0.51 0.37 -0.67 0.23 0.00 0.00 176.35 175.78 2yqg n ASP 94 N 5.70 -2.75 0.32 2.29 2.03 -1.21 -2.80 116.55 120.13 2yqg n ASP 94 Ca 0.07 -0.37 0.19 0.00 0.52 0.00 0.00 54.79 55.20 2yqg n ASP 94 Cb 0.48 -0.61 0.99 0.00 -0.72 0.00 0.00 41.12 41.26 2yqg n ASP 94 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2yqg h ALA 95 N -2.61 1.27 0.18 -1.67 0.00 -1.91 -1.02 119.26 113.50 2yqg h ALA 95 Ca -0.17 -0.00 -0.28 0.00 0.00 0.00 0.00 54.91 54.46 2yqg h ALA 95 Cb 0.57 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.38 2yqg h ALA 95 CO 0.10 -0.19 -1.28 0.00 0.00 0.00 0.00 179.25 177.88 2yqg h ARG 96 N 0.00 0.39 0.00 0.00 3.08 -1.86 -3.47 114.38 112.52 2yqg h ARG 96 Ca 0.01 -0.66 0.00 0.00 0.07 0.00 0.00 59.98 59.41 2yqg h ARG 96 Cb 0.37 0.25 0.00 0.00 0.08 0.00 0.00 29.97 30.66 2yqg h ARG 96 CO -0.00 1.32 0.00 0.41 -1.07 0.00 0.00 179.97 180.62 2yqg n GLY 97 N 1.73 1.12 3.19 0.04 0.00 -0.39 -5.14 105.19 105.75 2yqg n GLY 97 Ca -0.19 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.67 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 1.67 -0.83 1.61 2.20 -1.26 -4.90 114.94 111.44 2yqg s ASN 98 Ca 0.00 -0.76 -0.20 0.00 -0.94 0.00 0.00 52.86 50.96 2yqg s ASN 98 Cb 0.00 -0.03 -0.19 0.00 -2.00 0.00 0.00 41.25 39.03 2yqg s ASN 98 CO 0.00 -0.18 2.18 -0.46 -2.94 0.00 0.00 177.10 175.70 2yqg n ASN 99 N 0.73 0.61 0.05 3.54 6.94 -1.26 -3.29 115.26 122.59 2yqg n ASN 99 Ca -0.17 -1.45 0.01 0.00 -0.02 0.00 0.00 54.58 52.95 2yqg n ASN 99 Cb 0.57 -1.32 -0.07 0.00 -2.36 0.00 0.00 39.78 36.60 2yqg n ASN 99 CO 0.00 0.00 0.00 1.62 -1.03 0.00 0.00 177.26 177.85 2yqg h VAL 100 N 7.29 0.51 -3.47 3.53 3.04 -1.95 -3.46 116.25 121.74 2yqg h VAL 100 Ca 0.01 -1.96 -0.33 0.00 -1.01 0.00 0.00 66.70 63.41 2yqg h VAL 100 Cb 1.03 2.04 -0.35 0.00 -2.01 0.00 0.00 31.29 32.00 2yqg h VAL 100 CO 1.15 0.29 -0.74 -1.61 -1.01 0.00 0.00 177.57 175.65 2yqg s GLU 101 N -2.95 0.12 0.43 4.17 0.41 -1.25 -5.04 118.70 114.59 2yqg s GLU 101 Ca -0.02 0.16 -0.21 0.00 -0.41 0.00 0.00 54.97 54.49 2yqg s GLU 101 Cb 0.09 -0.41 -0.13 0.00 -1.78 0.00 0.00 34.13 31.89 2yqg s GLU 101 CO 0.80 -0.18 0.38 0.36 -0.49 0.00 0.00 175.26 176.13 2yqg n LYS 102 N 4.36 0.37 -0.11 1.61 2.85 -1.26 -4.39 118.16 121.58 2yqg n LYS 102 Ca -0.23 0.14 -0.03 0.00 -1.05 0.00 0.00 58.31 57.13 2yqg n LYS 102 Cb 0.50 -1.35 0.03 0.00 -0.65 0.00 0.00 35.03 33.55 2yqg n LYS 102 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 177.40 177.00 2yqg n PRO 103 N 0.78 -1.26 -3.89 -1.58 -0.04 -1.26 -4.85 135.00 122.91 2yqg n PRO 103 Ca 0.11 -0.19 -0.10 0.00 -0.04 0.00 0.00 63.50 63.28 2yqg n PRO 103 Cb 0.41 -0.17 -0.10 0.00 -0.04 0.00 0.00 33.50 33.60 2yqg n PRO 103 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2yqg s LEU 104 N 0.00 1.63 0.15 1.53 -0.00 -1.24 -5.04 118.68 115.71 2yqg s LEU 104 Ca 0.08 -0.34 -0.25 0.00 -0.00 0.00 0.00 54.13 53.61 2yqg s LEU 104 Cb -0.01 0.67 -0.08 0.00 -0.00 0.00 0.00 46.19 46.78 2yqg s LEU 104 CO 0.06 -0.44 0.78 -0.70 -0.00 0.00 0.00 176.35 176.05 2yqg s GLU 105 N -1.94 4.56 -0.19 1.48 2.12 -1.26 -4.14 118.70 119.33 2yqg s GLU 105 Ca -0.10 1.15 -0.05 0.00 0.36 0.00 0.00 54.97 56.32 2yqg s GLU 105 Cb -0.05 -3.28 0.09 0.00 0.26 0.00 0.00 34.13 31.16 2yqg s GLU 105 CO -0.01 0.52 0.35 -1.17 -0.54 0.00 0.00 175.26 174.41 2yqg s LEU 106 N -0.96 -0.50 -0.04 2.70 2.96 -1.13 -4.60 118.68 117.09 2yqg s LEU 106 Ca 0.36 0.59 0.06 0.00 -0.22 0.00 0.00 54.13 54.93 2yqg s LEU 106 Cb -0.23 1.03 -0.01 0.00 0.50 0.00 0.00 46.19 47.48 2yqg s LEU 106 CO 0.26 -0.26 -0.24 0.00 -1.32 0.00 0.00 176.35 174.79 2yqg s ARG 107 N 2.52 2.27 -0.45 1.98 1.70 -1.26 -1.48 118.95 124.22 2yqg s ARG 107 Ca 0.04 -0.86 -0.08 0.00 -0.47 0.00 0.00 55.73 54.35 2yqg s ARG 107 Cb -0.13 -2.00 0.11 0.00 -0.57 0.00 0.00 34.95 32.36 2yqg s ARG 107 CO -0.12 0.41 0.31 0.42 -1.08 0.00 0.00 175.30 175.24 2yqg s ILE 108 N -0.27 4.08 -0.02 4.99 1.01 -1.01 -3.38 121.20 126.59 2yqg s ILE 108 Ca 0.01 -1.77 -0.30 0.00 0.00 0.00 0.00 60.65 58.59 2yqg s ILE 108 Cb -0.12 -3.67 -0.07 0.00 0.01 0.00 0.00 42.46 38.61 2yqg s ILE 108 CO 0.02 -0.73 1.79 -0.75 0.00 0.00 0.00 174.94 175.28 2yqg s LYS 109 N 1.34 4.13 -0.99 2.79 2.20 -1.03 -3.38 119.74 124.80 2yqg s LYS 109 Ca 0.06 2.35 -0.19 0.00 -0.36 0.00 0.00 55.97 57.82 2yqg s LYS 109 Cb -0.25 -4.07 0.11 0.00 -1.51 0.00 0.00 37.83 32.11 2yqg s LYS 109 CO -0.01 -0.93 1.25 0.08 -0.36 0.00 0.00 175.35 175.38 2yqg s VAL 110 N 4.33 4.56 0.52 4.02 1.01 -1.25 -2.76 120.40 130.83 2yqg s VAL 110 Ca 0.80 -1.51 -0.23 0.00 0.00 0.00 0.00 61.98 61.04 2yqg s VAL 110 Cb -0.37 -4.87 -0.06 0.00 0.00 0.00 0.00 36.38 31.08 2yqg s VAL 110 CO 0.35 -1.63 1.39 0.18 0.00 0.00 0.00 175.10 175.39 2yqg n LEU 111 N 7.04 5.49 -4.65 3.92 4.77 -0.70 -4.84 117.00 128.02 2yqg n LEU 111 Ca 0.28 1.02 -0.29 0.00 -0.03 0.00 0.00 56.01 56.99 2yqg n LEU 111 Cb 0.49 -1.59 0.21 0.00 -2.33 0.00 0.00 43.42 40.19 2yqg n LEU 111 CO 0.56 -0.42 0.65 -1.81 -1.33 0.00 0.00 177.39 175.04 2yqg s ASP 112 N -0.77 1.76 0.19 -1.43 1.11 -1.26 -2.52 116.67 113.75 2yqg s ASP 112 Ca 0.69 0.82 0.08 0.00 0.18 0.00 0.00 52.55 54.32 2yqg s ASP 112 Cb -0.42 -1.23 0.06 0.00 1.07 0.00 0.00 42.92 42.39 2yqg s ASP 112 CO 0.52 -3.62 1.44 -0.29 1.18 0.00 0.00 175.17 174.39 2yqg h ILE 113 N -2.24 1.58 -1.22 0.77 6.09 -1.95 -3.25 117.51 117.31 2yqg h ILE 113 Ca -0.49 -2.78 -0.69 0.00 -1.37 0.00 0.00 64.86 59.53 2yqg h ILE 113 Cb 1.31 2.50 -0.29 0.00 0.47 0.00 0.00 36.82 40.81 2yqg h ILE 113 CO 0.45 0.80 0.83 0.59 -3.07 0.00 0.00 178.15 177.74 2yqg n ASN 114 N -3.58 7.52 -4.89 2.19 3.02 -1.26 -4.97 115.26 113.30 2yqg n ASN 114 Ca -0.01 -3.80 -0.23 0.00 -0.03 0.00 0.00 54.58 50.51 2yqg n ASN 114 Cb 0.78 -0.97 -0.02 0.00 -0.61 0.00 0.00 39.78 38.97 2yqg n ASN 114 CO 0.00 0.00 0.00 -1.81 -2.62 0.00 0.00 177.26 172.83 2yqg s ASP 115 N -1.76 4.83 -0.04 6.41 1.11 -1.23 -5.15 116.67 120.84 2yqg s ASP 115 Ca 0.61 -0.98 -0.05 0.00 0.18 0.00 0.00 52.55 52.31 2yqg s ASP 115 Cb 0.49 -0.11 0.01 0.00 1.07 0.00 0.00 42.92 44.38 2yqg s ASP 115 CO -0.10 -0.87 0.13 0.21 1.18 0.00 0.00 175.17 175.71 2yqg s ASN 116 N -4.21 -0.10 0.10 0.27 2.47 -1.26 -5.04 114.94 107.17 2yqg s ASN 116 Ca 0.43 0.16 0.10 0.00 0.42 0.00 0.00 52.86 53.97 2yqg s ASN 116 Cb -0.02 0.25 -0.04 0.00 -1.45 0.00 0.00 41.25 39.99 2yqg s ASN 116 CO 0.26 -0.10 -0.24 -1.61 -3.72 0.00 0.00 177.10 171.69 2yqg s GLU 117 N -0.21 1.65 0.77 0.43 2.02 -1.26 -5.13 118.70 116.97 2yqg s GLU 117 Ca -0.03 -1.22 -0.11 0.00 0.02 0.00 0.00 54.97 53.64 2yqg s GLU 117 Cb -0.02 -2.00 0.05 0.00 0.10 0.00 0.00 34.13 32.26 2yqg s GLU 117 CO 0.00 0.48 1.09 -1.25 0.02 0.00 0.00 175.26 175.61 2yqg s PRO 118 N -1.85 2.29 0.44 0.39 0.04 -1.26 -4.96 135.00 130.09 2yqg s PRO 118 Ca 0.15 1.18 -0.23 0.00 0.04 0.00 0.00 61.00 62.14 2yqg s PRO 118 Cb -0.10 -1.90 -0.10 0.00 0.04 0.00 0.00 34.50 32.44 2yqg s PRO 118 CO 0.06 -1.62 0.94 1.55 0.04 0.00 0.00 177.00 177.97 2yqg n VAL 119 N -3.46 2.48 -1.10 -0.36 3.14 -1.26 -4.74 118.33 113.04 2yqg n VAL 119 Ca 0.09 -0.50 -0.43 0.00 -2.96 0.00 0.00 64.34 60.54 2yqg n VAL 119 Cb 0.53 -1.07 -0.06 0.00 -1.06 0.00 0.00 33.84 32.18 2yqg n VAL 119 CO 0.00 0.00 0.00 0.49 -6.46 0.00 0.00 176.83 170.86 2yqg n PHE 120 N -0.68 0.48 -0.93 1.45 3.72 -1.26 -4.67 117.46 115.57 2yqg n PHE 120 Ca 0.10 0.78 -0.30 0.00 -0.05 0.00 0.00 57.45 57.97 2yqg n PHE 120 Cb 0.40 -1.53 -0.01 0.00 -0.94 0.00 0.00 39.48 37.40 2yqg n PHE 120 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 176.76 174.34 2yqg n THR 121 N 1.12 0.63 -1.39 4.37 5.66 -1.26 -4.67 114.28 118.75 2yqg n THR 121 Ca 0.15 -0.35 -0.47 0.00 -3.05 0.00 0.00 64.05 60.33 2yqg n THR 121 Cb 0.06 0.00 -0.02 0.00 -1.55 0.00 0.00 70.33 68.81 2yqg n THR 121 CO 0.00 0.00 0.00 1.67 -3.05 0.00 0.00 175.07 173.69 2yqg n GLN 122 N 0.90 0.05 0.00 1.09 -0.06 -1.26 -5.27 117.38 112.84 2yqg n GLN 122 Ca 0.09 0.02 0.00 0.00 -2.00 0.00 0.00 57.00 55.11 2yqg n GLN 122 Cb 0.26 -1.03 0.00 0.00 -4.06 0.00 0.00 30.24 25.41 2yqg n GLN 122 CO 0.00 0.00 0.00 -3.47 -0.20 0.00 0.00 177.06 173.39