#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 -0.82 -0.25 1.61 0.01 -1.26 -5.16 113.70 107.83 2yqg s SER 2 Ca 0.00 1.43 -0.16 0.00 1.31 0.00 0.00 55.95 58.54 2yqg s SER 2 Cb 0.00 1.38 0.07 0.00 0.21 0.00 0.00 66.02 67.68 2yqg s SER 2 CO 0.00 -0.24 0.62 -0.44 0.41 0.00 0.00 173.24 173.59 2yqg s SER 3 N 1.03 -0.80 0.00 2.44 0.01 -1.26 -5.16 113.70 109.96 2yqg s SER 3 Ca -0.05 1.34 0.00 0.00 1.31 0.00 0.00 55.95 58.55 2yqg s SER 3 Cb -0.05 1.25 0.00 0.00 0.21 0.00 0.00 66.02 67.43 2yqg s SER 3 CO -0.10 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 173.93 2yqg n GLY 4 N 3.97 4.45 3.16 3.44 0.00 -1.26 -5.10 105.19 113.85 2yqg n GLY 4 Ca -0.19 -0.72 -0.36 0.00 0.00 0.00 0.00 46.02 44.75 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 0.00 5.09 0.15 1.61 0.01 -1.26 -5.09 113.70 114.22 2yqg s SER 5 Ca 0.00 -1.57 0.06 0.00 1.31 0.00 0.00 55.95 55.76 2yqg s SER 5 Cb 0.00 -1.78 -0.04 0.00 0.21 0.00 0.00 66.02 64.41 2yqg s SER 5 CO 0.00 -0.38 -0.14 -0.55 0.41 0.00 0.00 173.24 172.58 2yqg s SER 6 N 1.49 2.20 0.00 2.44 0.15 -1.26 -5.02 113.70 113.69 2yqg s SER 6 Ca 0.01 -0.90 0.00 0.00 0.70 0.00 0.00 55.95 55.75 2yqg s SER 6 Cb -0.21 -0.09 0.00 0.00 -1.71 0.00 0.00 66.02 64.01 2yqg s SER 6 CO -0.02 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 174.86 2yqg n GLY 7 N 0.15 -0.44 2.43 9.45 0.00 -1.26 -5.05 105.19 110.47 2yqg n GLY 7 Ca -0.12 -0.70 -0.14 0.00 0.00 0.00 0.00 46.02 45.05 2yqg n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yqg n GLN 8 N 0.08 2.68 -4.61 1.61 10.64 -1.26 -5.06 117.38 121.46 2yqg n GLN 8 Ca 0.00 -3.87 -0.25 0.00 -1.83 0.00 0.00 57.00 51.05 2yqg n GLN 8 Cb 0.00 -1.94 -0.14 0.00 -0.86 0.00 0.00 30.24 27.30 2yqg n GLN 8 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.06 175.44 2yqg s LYS 9 N -3.64 1.32 -1.03 2.61 2.47 -1.26 -5.07 119.74 115.14 2yqg s LYS 9 Ca 0.40 -0.90 -0.23 0.00 -1.56 0.00 0.00 55.97 53.68 2yqg s LYS 9 Cb 0.38 -1.41 0.04 0.00 -1.46 0.00 0.00 37.83 35.37 2yqg s LYS 9 CO -0.01 0.36 1.56 1.03 0.16 0.00 0.00 175.35 178.44 2yqg s ARG 10 N -1.14 3.45 0.08 4.03 0.52 -1.26 -4.94 118.95 119.69 2yqg s ARG 10 Ca 0.06 -1.08 0.05 0.00 -0.52 0.00 0.00 55.73 54.25 2yqg s ARG 10 Cb -0.09 -5.33 -0.03 0.00 0.52 0.00 0.00 34.95 30.02 2yqg s ARG 10 CO 0.02 -2.42 -0.15 0.00 0.02 0.00 0.00 175.30 172.77 2yqg s ALA 11 N 5.77 1.24 0.30 2.13 0.00 -1.26 -5.03 121.76 124.90 2yqg s ALA 11 Ca 0.51 -1.03 -0.00 0.00 0.00 0.00 0.00 51.96 51.43 2yqg s ALA 11 Cb -0.01 -0.11 0.69 0.00 0.00 0.00 0.00 23.12 23.69 2yqg s ALA 11 CO -0.07 0.18 1.53 1.87 0.00 0.00 0.00 175.76 179.28 2yqg n TRP 12 N 1.24 0.57 -1.68 0.00 -0.00 -1.26 -4.42 117.44 111.89 2yqg n TRP 12 Ca -0.21 1.18 -0.44 0.00 -0.00 0.00 0.00 57.50 58.03 2yqg n TRP 12 Cb 0.54 -1.20 -0.03 0.00 -0.00 0.00 0.00 31.31 30.63 2yqg n TRP 12 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 177.69 176.80 2yqg n ILE 13 N -5.49 0.96 -4.36 5.87 5.41 -1.26 -4.90 119.36 115.58 2yqg n ILE 13 Ca 0.22 -0.24 -0.26 0.00 1.00 0.00 0.00 62.75 63.46 2yqg n ILE 13 Cb 0.70 -1.52 -0.10 0.00 -0.71 0.00 0.00 39.64 38.00 2yqg n ILE 13 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 176.55 176.97 2yqg s THR 14 N -0.06 2.78 0.74 1.39 -4.23 -1.26 -5.05 115.64 109.94 2yqg s THR 14 Ca 0.68 -1.91 -0.11 0.00 -1.18 0.00 0.00 61.69 59.17 2yqg s THR 14 Cb -0.63 -2.37 0.03 0.00 1.34 0.00 0.00 72.50 70.87 2yqg s THR 14 CO 0.50 -0.16 1.10 0.00 -0.54 0.00 0.00 174.62 175.52 2yqg s ALA 15 N -1.80 2.69 0.71 3.99 0.00 -1.26 -4.94 121.76 121.15 2yqg s ALA 15 Ca 0.24 -0.31 -0.13 0.00 0.00 0.00 0.00 51.96 51.76 2yqg s ALA 15 Cb -0.08 -3.05 0.03 0.00 0.00 0.00 0.00 23.12 20.02 2yqg s ALA 15 CO 0.13 -1.34 1.10 -1.25 0.00 0.00 0.00 175.76 174.40 2yqg s PRO 16 N -5.31 2.55 -0.18 0.00 0.04 -1.26 -4.83 135.00 126.01 2yqg s PRO 16 Ca 0.59 1.29 -0.00 0.00 0.04 0.00 0.00 61.00 62.92 2yqg s PRO 16 Cb -0.12 -1.93 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2yqg s PRO 16 CO 0.52 -1.43 -0.15 0.08 0.04 0.00 0.00 177.00 176.07 2yqg s VAL 17 N -2.59 2.61 -0.31 -0.36 1.01 -0.57 -5.03 120.40 115.16 2yqg s VAL 17 Ca 0.64 -0.77 0.04 0.00 0.00 0.00 0.00 61.98 61.89 2yqg s VAL 17 Cb -0.19 -2.12 0.09 0.00 0.00 0.00 0.00 36.38 34.16 2yqg s VAL 17 CO 0.48 0.50 -0.00 0.00 0.00 0.00 0.00 175.10 176.08 2yqg s ALA 18 N 1.10 2.79 0.28 5.51 0.00 -1.26 -2.02 121.76 128.16 2yqg s ALA 18 Ca 0.00 -2.29 0.08 0.00 0.00 0.00 0.00 51.96 49.75 2yqg s ALA 18 Cb -0.14 -1.85 -0.04 0.00 0.00 0.00 0.00 23.12 21.09 2yqg s ALA 18 CO -0.05 -1.53 0.18 -0.51 0.00 0.00 0.00 175.76 173.86 2yqg s LEU 19 N 0.97 3.64 0.49 0.00 1.43 -1.22 -4.98 118.68 119.00 2yqg s LEU 19 Ca 0.04 -0.39 -0.01 0.00 -1.03 0.00 0.00 54.13 52.74 2yqg s LEU 19 Cb -0.19 -2.19 0.00 0.00 0.03 0.00 0.00 46.19 43.84 2yqg s LEU 19 CO -0.07 -0.11 0.73 -0.13 0.23 0.00 0.00 176.35 177.00 2yqg s ARG 20 N -3.85 3.01 -0.19 1.70 0.52 -1.26 -0.73 118.95 118.15 2yqg s ARG 20 Ca 0.35 -0.39 -0.01 0.00 -0.52 0.00 0.00 55.73 55.16 2yqg s ARG 20 Cb -0.07 -2.49 0.00 0.00 0.52 0.00 0.00 34.95 32.92 2yqg s ARG 20 CO 0.24 -0.39 -0.13 -1.83 0.02 0.00 0.00 175.30 173.21 2yqg s GLU 21 N -4.67 3.18 0.00 3.54 4.04 -0.73 -4.59 118.70 119.48 2yqg s GLU 21 Ca 0.50 -0.74 0.00 0.00 0.04 0.00 0.00 54.97 54.77 2yqg s GLU 21 Cb -0.10 -2.73 0.00 0.00 0.02 0.00 0.00 34.13 31.32 2yqg s GLU 21 CO 0.40 -0.14 0.00 0.41 -1.84 0.00 0.00 175.26 174.08 2yqg n GLY 22 N 4.53 3.15 3.79 -3.83 0.00 -1.21 -3.43 105.19 108.19 2yqg n GLY 22 Ca -0.20 -1.02 -0.35 0.00 0.00 0.00 0.00 46.02 44.46 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 3.80 -1.13 1.61 2.12 -1.26 -4.94 118.70 118.91 2yqg s GLU 23 Ca 0.00 1.43 -0.21 0.00 0.36 0.00 0.00 54.97 56.55 2yqg s GLU 23 Cb 0.00 -2.17 0.03 0.00 0.26 0.00 0.00 34.13 32.25 2yqg s GLU 23 CO 0.00 -0.44 1.66 -0.51 -0.54 0.00 0.00 175.26 175.44 2yqg s ASP 24 N -1.86 6.31 -0.07 -1.70 1.11 -1.26 -4.77 116.67 114.42 2yqg s ASP 24 Ca 0.66 -1.75 -0.03 0.00 0.18 0.00 0.00 52.55 51.61 2yqg s ASP 24 Cb -0.19 -2.57 -0.10 0.00 1.07 0.00 0.00 42.92 41.13 2yqg s ASP 24 CO 0.23 -1.70 2.81 0.18 1.18 0.00 0.00 175.17 177.87 2yqg n LEU 25 N 9.89 5.51 -0.01 1.23 4.77 -1.26 -4.22 117.00 132.91 2yqg n LEU 25 Ca 0.41 -3.00 -0.21 0.00 -0.03 0.00 0.00 56.01 53.18 2yqg n LEU 25 Cb 0.48 -1.26 -0.13 0.00 -2.33 0.00 0.00 43.42 40.17 2yqg n LEU 25 CO 0.69 1.41 -0.33 0.77 -1.33 0.00 0.00 177.39 178.60 2yqg h SER 26 N 2.14 0.30 -0.20 -1.43 4.64 -1.88 -3.36 113.55 113.76 2yqg h SER 26 Ca 0.15 -0.83 -0.05 0.00 -0.47 0.00 0.00 61.79 60.59 2yqg h SER 26 Cb 1.20 -0.10 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 2yqg h SER 26 CO 0.26 1.53 -0.07 0.11 -0.87 0.00 0.00 176.83 177.79 2yqg h LYS 27 N -0.46 0.41 -0.97 4.77 1.57 -1.95 -3.12 116.57 116.81 2yqg h LYS 27 Ca -0.27 -0.17 0.30 0.00 -1.87 0.00 0.00 60.65 58.64 2yqg h LYS 27 Cb 1.62 -0.02 -0.18 0.00 0.08 0.00 0.00 32.23 33.74 2yqg h LYS 27 CO 0.02 0.68 0.19 0.87 -0.57 0.00 0.00 179.45 180.64 2yqg h LYS 28 N 0.12 0.04 -5.72 3.15 1.57 -1.86 -3.41 116.57 110.45 2yqg h LYS 28 Ca 0.05 -0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.26 2yqg h LYS 28 Cb 0.54 -0.01 0.18 0.00 0.08 0.00 0.00 32.23 33.02 2yqg h LYS 28 CO 0.02 0.03 -1.21 0.09 -0.57 0.00 0.00 179.45 177.81 2yqg n ASN 29 N -5.39 -3.87 -4.77 0.86 3.02 -1.18 -4.61 115.26 99.32 2yqg n ASN 29 Ca 0.26 0.55 -0.36 0.00 -0.03 0.00 0.00 54.58 55.01 2yqg n ASN 29 Cb 0.87 -0.80 -0.00 0.00 -0.61 0.00 0.00 39.78 39.25 2yqg n ASN 29 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2yqg s PRO 30 N -1.11 3.48 0.03 3.52 0.04 -1.26 -5.09 135.00 134.61 2yqg s PRO 30 Ca 0.52 1.66 0.22 0.00 0.04 0.00 0.00 61.00 63.44 2yqg s PRO 30 Cb -0.43 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 31.95 2yqg s PRO 30 CO 0.66 -0.75 0.95 0.44 0.04 0.00 0.00 177.00 178.33 2yqg n ILE 31 N -1.05 0.11 -3.63 0.56 -5.35 -1.24 -4.95 119.36 103.81 2yqg n ILE 31 Ca 0.10 -0.22 -0.12 0.00 -0.27 0.00 0.00 62.75 62.25 2yqg n ILE 31 Cb 0.50 0.33 -0.07 0.00 -1.74 0.00 0.00 39.64 38.67 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 -3.19 -1.88 -0.02 -1.28 0.00 -1.25 -4.97 121.76 109.16 2yqg s ALA 32 Ca 0.03 1.91 0.02 0.00 0.00 0.00 0.00 51.96 53.92 2yqg s ALA 32 Cb 0.15 -1.25 0.01 0.00 0.00 0.00 0.00 23.12 22.02 2yqg s ALA 32 CO 0.82 -0.29 -0.05 0.15 0.00 0.00 0.00 175.76 176.40 2yqg s LYS 33 N 0.19 0.55 -0.01 0.00 1.02 -1.26 -2.54 119.74 117.68 2yqg s LYS 33 Ca 0.01 -0.16 0.01 0.00 0.02 0.00 0.00 55.97 55.86 2yqg s LYS 33 Cb -0.05 -0.56 0.01 0.00 -0.52 0.00 0.00 37.83 36.71 2yqg s LYS 33 CO -0.02 0.05 -0.03 0.96 -0.92 0.00 0.00 175.35 175.39 2yqg s ILE 34 N 0.24 0.30 -0.24 2.17 -4.36 -1.26 -5.06 121.20 112.99 2yqg s ILE 34 Ca -0.03 -0.10 -0.17 0.00 -0.26 0.00 0.00 60.65 60.10 2yqg s ILE 34 Cb -0.07 -0.30 0.07 0.00 1.25 0.00 0.00 42.46 43.41 2yqg s ILE 34 CO -0.00 0.12 0.60 -1.38 0.24 0.00 0.00 174.94 174.51 2yqg s HIS 35 N 0.27 -0.81 0.82 1.37 -3.43 -1.26 -4.62 115.29 107.63 2yqg s HIS 35 Ca -0.03 1.76 -0.12 0.00 -0.80 0.00 0.00 55.06 55.87 2yqg s HIS 35 Cb -0.06 0.40 0.09 0.00 -1.43 0.00 0.00 32.58 31.59 2yqg s HIS 35 CO -0.00 -0.41 1.19 -1.54 -2.00 0.00 0.00 174.74 171.98 2yqg s SER 36 N 1.08 4.34 -0.16 7.38 1.04 -1.26 -4.95 113.70 121.17 2yqg s SER 36 Ca -0.06 0.70 -0.13 0.00 0.48 0.00 0.00 55.95 56.94 2yqg s SER 36 Cb -0.05 -1.14 -0.07 0.00 0.10 0.00 0.00 66.02 64.86 2yqg s SER 36 CO -0.10 -2.00 -0.28 0.47 0.98 0.00 0.00 173.24 172.31 2yqg n ASP 37 N -3.36 1.69 -0.35 7.02 8.00 -1.26 -4.55 116.55 123.75 2yqg n ASP 37 Ca 0.09 0.28 -0.09 0.00 0.71 0.00 0.00 54.79 55.78 2yqg n ASP 37 Cb 0.61 -0.66 -0.08 0.00 -0.02 0.00 0.00 41.12 40.97 2yqg n ASP 37 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2yqg n LEU 38 N -4.16 -0.88 -0.36 0.64 4.77 -1.26 0.32 117.00 116.07 2yqg n LEU 38 Ca -0.24 1.49 -0.02 0.00 -0.03 0.00 0.00 56.01 57.21 2yqg n LEU 38 Cb 0.57 -0.20 0.02 0.00 -2.33 0.00 0.00 43.42 41.48 2yqg n LEU 38 CO 0.11 -1.21 0.53 0.00 -1.33 0.00 0.00 177.39 175.49 2yqg n ALA 39 N -3.36 -0.19 0.14 -1.18 0.00 -1.26 -0.06 120.51 114.60 2yqg n ALA 39 Ca 0.02 0.90 -0.06 0.00 0.00 0.00 0.00 53.44 54.29 2yqg n ALA 39 Cb 0.22 -0.37 -0.03 0.00 0.00 0.00 0.00 19.45 19.27 2yqg n ALA 39 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2yqg h GLU 40 N 0.00 -0.39 -0.64 0.00 4.57 -0.68 0.88 114.58 118.32 2yqg h GLU 40 Ca 0.29 0.03 0.06 0.00 -1.18 0.00 0.00 59.36 58.56 2yqg h GLU 40 Cb 0.53 0.09 -0.08 0.00 -0.16 0.00 0.00 28.75 29.13 2yqg h GLU 40 CO -0.91 -0.26 -0.38 0.39 -1.18 0.00 0.00 179.01 176.67 2yqg n GLU 41 N -4.42 -0.28 -0.05 1.92 -0.58 0.15 -2.83 120.64 114.54 2yqg n GLU 41 Ca -0.05 1.17 -0.02 0.00 -0.42 0.00 0.00 57.16 57.84 2yqg n GLU 41 Cb 0.16 -1.73 -0.01 0.00 -0.57 0.00 0.00 31.44 29.29 2yqg n GLU 41 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2yqg h ARG 42 N 0.00 0.00 0.00 3.49 3.08 -0.61 -3.50 114.38 116.84 2yqg h ARG 42 Ca 0.10 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.15 2yqg h ARG 42 Cb 0.26 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.31 2yqg h ARG 42 CO -0.60 0.10 0.00 0.41 -1.07 0.00 0.00 179.97 178.80 2yqg n GLY 43 N 1.76 0.61 3.93 0.04 0.00 0.26 -5.05 105.19 106.74 2yqg n GLY 43 Ca -0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 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 3.69 -0.37 0.99 1.43 0.13 -4.98 118.68 119.57 2yqg s LEU 44 Ca 0.00 0.55 0.04 0.00 -1.03 0.00 0.00 54.13 53.69 2yqg s LEU 44 Cb 0.00 -3.44 0.57 0.00 0.03 0.00 0.00 46.19 43.35 2yqg s LEU 44 CO 0.00 -0.61 1.77 2.29 0.23 0.00 0.00 176.35 180.03 2yqg n LYS 45 N -2.11 2.15 -1.58 1.70 2.85 -1.26 -4.67 118.16 115.23 2yqg n LYS 45 Ca -0.00 -2.54 -0.50 0.00 -1.05 0.00 0.00 58.31 54.22 2yqg n LYS 45 Cb 0.57 -2.00 -0.05 0.00 -0.65 0.00 0.00 35.03 32.90 2yqg n LYS 45 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 177.40 176.46 2yqg n ILE 46 N -0.83 0.57 -4.59 0.58 5.41 -1.26 -4.96 119.36 114.27 2yqg n ILE 46 Ca 0.49 -0.14 -0.32 0.00 1.00 0.00 0.00 62.75 63.79 2yqg n ILE 46 Cb 1.48 -0.84 -0.12 0.00 -0.71 0.00 0.00 39.64 39.45 2yqg n ILE 46 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 176.55 175.66 2yqg s THR 47 N 0.06 3.19 0.49 1.39 2.01 -0.97 -4.97 115.64 116.84 2yqg s THR 47 Ca 0.77 -0.96 0.04 0.00 0.31 0.00 0.00 61.69 61.85 2yqg s THR 47 Cb -0.89 -2.36 0.02 0.00 0.01 0.00 0.00 72.50 69.29 2yqg s THR 47 CO 0.50 0.38 0.69 -0.31 -0.69 0.00 0.00 174.62 175.19 2yqg s TYR 48 N -0.94 2.84 -0.12 4.92 2.02 -0.09 -0.45 117.35 125.52 2yqg s TYR 48 Ca 0.15 -0.18 -0.29 0.00 -0.37 0.00 0.00 57.07 56.38 2yqg s TYR 48 Cb -0.11 -2.59 0.08 0.00 -0.40 0.00 0.00 41.96 38.94 2yqg s TYR 48 CO 0.06 -0.68 0.75 0.21 -1.57 0.00 0.00 175.55 174.32 2yqg s LYS 49 N -4.58 0.92 -0.05 -0.62 2.20 -1.09 -4.47 119.74 112.05 2yqg s LYS 49 Ca 0.56 0.41 0.06 0.00 -0.36 0.00 0.00 55.97 56.64 2yqg s LYS 49 Cb -0.10 0.44 -0.02 0.00 -1.51 0.00 0.00 37.83 36.64 2yqg s LYS 49 CO 0.36 -0.25 -0.22 0.71 -0.36 0.00 0.00 175.35 175.60 2yqg s TYR 50 N -0.78 2.50 -0.06 4.03 1.51 -1.26 -1.75 117.35 121.54 2yqg s TYR 50 Ca -0.07 -0.48 0.01 0.00 -1.01 0.00 0.00 57.07 55.52 2yqg s TYR 50 Cb -0.01 -1.60 0.02 0.00 -0.11 0.00 0.00 41.96 40.26 2yqg s TYR 50 CO 0.06 -0.06 -0.04 0.95 -1.11 0.00 0.00 175.55 175.35 2yqg s THR 51 N -0.41 0.59 0.00 -0.71 -4.23 -1.11 -4.79 115.64 104.98 2yqg s THR 51 Ca 0.04 -0.12 0.00 0.00 -1.18 0.00 0.00 61.69 60.43 2yqg s THR 51 Cb -0.12 -0.63 0.00 0.00 1.34 0.00 0.00 72.50 73.09 2yqg s THR 51 CO 0.02 0.25 0.00 0.61 -0.54 0.00 0.00 174.62 174.96 2yqg n GLY 52 N 4.31 3.75 3.54 3.99 0.00 -1.26 -2.64 105.19 116.87 2yqg n GLY 52 Ca -0.20 -1.19 -0.46 0.00 0.00 0.00 0.00 46.02 44.16 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 -1.50 0.99 0.00 1.61 4.81 -1.26 -2.01 118.16 120.80 2yqg n LYS 53 Ca 0.00 0.35 0.00 0.00 -0.87 0.00 0.00 58.31 57.79 2yqg n LYS 53 Cb 0.00 -1.65 0.00 0.00 0.02 0.00 0.00 35.03 33.40 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 1.54 2.71 0.44 3.14 0.00 -0.69 -4.79 105.19 107.53 2yqg n GLY 54 Ca 0.13 -0.37 -0.16 0.00 0.00 0.00 0.00 46.02 45.62 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 1.11 -0.10 -0.61 5.41 -0.85 -2.20 119.36 122.12 2yqg n ILE 55 Ca 0.00 -0.12 -0.14 0.00 1.00 0.00 0.00 62.75 63.49 2yqg n ILE 55 Cb 0.00 -1.84 -0.05 0.00 -0.71 0.00 0.00 39.64 37.04 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 -3.90 1.50 -3.04 1.39 -2.24 -1.10 -4.57 114.28 102.32 2yqg n THR 56 Ca -0.28 0.01 -0.33 0.00 -2.27 0.00 0.00 64.05 61.18 2yqg n THR 56 Cb 0.64 -2.22 -0.06 0.00 -2.10 0.00 0.00 70.33 66.58 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 -2.66 4.11 0.44 -0.78 0.41 -1.26 -4.85 118.70 114.12 2yqg s GLU 57 Ca -0.29 0.83 -0.24 0.00 -0.41 0.00 0.00 54.97 54.87 2yqg s GLU 57 Cb 0.06 -2.44 -0.08 0.00 -1.78 0.00 0.00 34.13 29.89 2yqg s GLU 57 CO 0.42 0.15 1.17 -1.25 -0.49 0.00 0.00 175.26 175.26 2yqg s PRO 58 N -2.86 3.84 0.26 0.39 0.04 -1.26 -1.70 135.00 133.71 2yqg s PRO 58 Ca 0.54 1.80 -0.30 0.00 0.04 0.00 0.00 61.00 63.09 2yqg s PRO 58 Cb -0.11 -2.49 -0.09 0.00 0.04 0.00 0.00 34.50 31.85 2yqg s PRO 58 CO 0.17 -0.49 1.26 -1.25 0.04 0.00 0.00 177.00 176.73 2yqg s PRO 59 N -2.58 4.43 0.02 0.56 0.04 -1.26 -4.71 135.00 131.50 2yqg s PRO 59 Ca 0.62 2.05 0.03 0.00 0.04 0.00 0.00 61.00 63.74 2yqg s PRO 59 Cb -0.29 -3.15 -0.03 0.00 0.04 0.00 0.00 34.50 31.06 2yqg s PRO 59 CO 0.36 -0.13 -0.06 -0.59 0.04 0.00 0.00 177.00 176.62 2yqg s PHE 60 N -0.55 2.89 0.00 0.56 -0.12 -1.25 -2.83 117.98 116.68 2yqg s PHE 60 Ca 0.52 -0.04 0.00 0.00 -0.05 0.00 0.00 56.93 57.35 2yqg s PHE 60 Cb -0.36 -1.59 0.00 0.00 -0.63 0.00 0.00 43.02 40.43 2yqg s PHE 60 CO 0.43 0.39 0.00 0.41 -0.05 0.00 0.00 175.22 176.40 2yqg n GLY 61 N 1.43 1.95 0.19 1.99 0.00 -0.93 -4.96 105.19 104.85 2yqg n GLY 61 Ca -0.15 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.84 2yqg n GLY 61 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 2yqg h ILE 62 N 0.00 0.77 -2.88 -0.61 2.04 -1.81 -3.41 117.51 111.62 2yqg h ILE 62 Ca 0.00 -0.08 -0.63 0.00 1.00 0.00 0.00 64.86 65.14 2yqg h ILE 62 Cb 0.00 0.50 -0.06 0.00 -0.74 0.00 0.00 36.82 36.53 2yqg h ILE 62 CO 0.00 0.04 -0.31 -0.36 0.00 0.00 0.00 178.15 177.53 2yqg s PHE 63 N -6.15 3.68 -0.02 1.37 0.08 -1.22 -1.59 117.98 114.13 2yqg s PHE 63 Ca -0.13 0.82 0.07 0.00 0.12 0.00 0.00 56.93 57.81 2yqg s PHE 63 Cb 0.14 -2.16 -0.02 0.00 -0.57 0.00 0.00 43.02 40.42 2yqg s PHE 63 CO 0.72 0.68 -0.24 0.14 -0.10 0.00 0.00 175.22 176.42 2yqg s VAL 64 N -1.07 1.87 -0.01 -0.44 -7.23 -0.48 -4.79 120.40 108.24 2yqg s VAL 64 Ca 0.21 -1.02 -0.30 0.00 -1.81 0.00 0.00 61.98 59.06 2yqg s VAL 64 Cb -0.15 -1.55 0.10 0.00 0.56 0.00 0.00 36.38 35.34 2yqg s VAL 64 CO 0.10 0.52 1.09 0.72 -0.31 0.00 0.00 175.10 177.22 2yqg s PHE 65 N -0.56 -0.16 0.21 2.82 -0.71 -1.26 -1.28 117.98 117.04 2yqg s PHE 65 Ca 0.09 0.00 0.09 0.00 -1.04 0.00 0.00 56.93 56.08 2yqg s PHE 65 Cb -0.09 0.56 -0.05 0.00 -1.21 0.00 0.00 43.02 42.24 2yqg s PHE 65 CO -0.01 -0.47 -0.18 1.21 -1.34 0.00 0.00 175.22 174.43 2yqg s ASN 66 N -2.68 2.93 0.38 1.98 2.47 -1.25 -4.98 114.94 113.80 2yqg s ASN 66 Ca 0.10 -0.96 0.20 0.00 0.42 0.00 0.00 52.86 52.62 2yqg s ASN 66 Cb 0.00 -0.19 0.32 0.00 -1.45 0.00 0.00 41.25 39.93 2yqg s ASN 66 CO -0.04 -0.05 1.58 0.07 -3.72 0.00 0.00 177.10 174.94 2yqg h LYS 67 N 2.74 0.00 0.00 0.43 -0.00 -1.95 0.12 116.57 117.91 2yqg h LYS 67 Ca -0.40 0.00 -0.02 0.00 -0.00 0.00 0.00 60.65 60.22 2yqg h LYS 67 Cb 1.23 0.00 -0.00 0.00 -0.00 0.00 0.00 32.23 33.45 2yqg h LYS 67 CO 0.57 0.23 -0.26 0.22 -0.00 0.00 0.00 179.45 180.21 2yqg h ASP 68 N 0.00 0.00 0.09 7.07 3.58 -1.94 -0.22 116.42 125.00 2yqg h ASP 68 Ca -0.00 -0.24 -0.24 0.00 0.42 0.00 0.00 57.03 56.97 2yqg h ASP 68 Cb 1.12 0.00 0.02 0.00 1.72 0.00 0.00 39.33 42.19 2yqg h ASP 68 CO 0.03 0.76 -0.97 0.71 -2.88 0.00 0.00 179.24 176.88 2yqg h THR 69 N -1.00 1.37 0.00 2.25 1.35 -1.97 -3.45 112.91 111.46 2yqg h THR 69 Ca -0.04 -2.36 0.00 0.00 -0.55 0.00 0.00 66.41 63.47 2yqg h THR 69 Cb 0.45 2.76 0.00 0.00 -1.73 0.00 0.00 68.15 69.62 2yqg h THR 69 CO -0.02 0.70 0.00 0.61 -0.25 0.00 0.00 175.52 176.56 2yqg n GLY 70 N 1.34 3.02 3.59 5.82 0.00 0.40 -4.78 105.19 114.57 2yqg n GLY 70 Ca -0.13 0.00 -0.49 0.00 0.00 0.00 0.00 46.02 45.40 2yqg n GLY 70 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2yqg n GLU 71 N -2.00 1.22 -4.20 1.61 2.13 -1.26 -4.62 120.64 113.53 2yqg n GLU 71 Ca 0.00 0.44 -0.30 0.00 0.66 0.00 0.00 57.16 57.95 2yqg n GLU 71 Cb 0.00 -1.96 -0.09 0.00 0.27 0.00 0.00 31.44 29.66 2yqg n GLU 71 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 2yqg s LEU 72 N 0.61 3.29 0.14 4.31 2.96 -1.05 -3.83 118.68 125.11 2yqg s LEU 72 Ca 0.74 -0.24 -0.14 0.00 -0.22 0.00 0.00 54.13 54.26 2yqg s LEU 72 Cb -0.85 -2.03 0.02 0.00 0.50 0.00 0.00 46.19 43.84 2yqg s LEU 72 CO 0.51 0.19 0.39 0.20 -1.32 0.00 0.00 176.35 176.32 2yqg s ASN 73 N -2.16 -0.16 -0.18 3.68 -0.87 -0.41 -3.66 114.94 111.19 2yqg s ASN 73 Ca 0.23 -0.48 0.01 0.00 -1.57 0.00 0.00 52.86 51.05 2yqg s ASN 73 Cb -0.11 0.48 0.02 0.00 -0.02 0.00 0.00 41.25 41.62 2yqg s ASN 73 CO 0.15 -0.89 -0.18 0.54 -2.57 0.00 0.00 177.10 174.15 2yqg s VAL 74 N -3.85 1.95 -0.56 1.60 0.11 -1.26 -1.39 120.40 117.00 2yqg s VAL 74 Ca 0.07 -0.92 0.02 0.00 -2.93 0.00 0.00 61.98 58.21 2yqg s VAL 74 Cb 0.02 -1.80 0.42 0.00 -1.53 0.00 0.00 36.38 33.49 2yqg s VAL 74 CO -0.08 0.48 1.62 0.35 -3.33 0.00 0.00 175.10 174.13 2yqg n THR 75 N 4.64 3.07 -3.50 5.04 -2.24 -0.62 -4.55 114.28 116.13 2yqg n THR 75 Ca -0.20 -4.00 -0.14 0.00 -2.27 0.00 0.00 64.05 57.45 2yqg n THR 75 Cb 0.49 -1.19 -0.04 0.00 -2.10 0.00 0.00 70.33 67.49 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 -2.50 -0.54 -0.94 3.42 0.15 -1.26 -4.94 113.70 107.08 2yqg s SER 76 Ca 0.55 0.35 -0.24 0.00 0.70 0.00 0.00 55.95 57.30 2yqg s SER 76 Cb 0.44 0.50 0.04 0.00 -1.71 0.00 0.00 66.02 65.29 2yqg s SER 76 CO -0.12 -0.68 1.46 -0.63 1.20 0.00 0.00 173.24 174.47 2yqg s ILE 77 N -2.24 3.83 -0.19 6.45 -1.09 -1.26 -4.82 121.20 121.87 2yqg s ILE 77 Ca -0.04 -0.45 -0.33 0.00 -2.23 0.00 0.00 60.65 57.60 2yqg s ILE 77 Cb -0.01 -4.93 -0.15 0.00 -1.58 0.00 0.00 42.46 35.80 2yqg s ILE 77 CO -0.01 -1.83 1.02 0.18 -1.23 0.00 0.00 174.94 173.07 2yqg n LEU 78 N 9.46 0.46 -4.28 2.97 4.77 -1.26 -4.60 117.00 124.53 2yqg n LEU 78 Ca 0.27 0.89 -0.42 0.00 -0.03 0.00 0.00 56.01 56.72 2yqg n LEU 78 Cb 0.50 -0.68 -0.09 0.00 -2.33 0.00 0.00 43.42 40.82 2yqg n LEU 78 CO 0.67 -1.04 -0.03 -1.81 -1.33 0.00 0.00 177.39 173.85 2yqg s ASP 79 N 1.16 5.80 0.12 -1.43 1.01 -1.26 -3.28 116.67 118.78 2yqg s ASP 79 Ca 0.75 -1.63 -0.21 0.00 0.71 0.00 0.00 52.55 52.17 2yqg s ASP 79 Cb -1.05 -2.05 -0.07 0.00 1.01 0.00 0.00 42.92 40.76 2yqg s ASP 79 CO 0.53 -0.64 1.73 -0.09 0.21 0.00 0.00 175.17 176.91 2yqg h ARG 80 N 8.53 0.04 -0.59 8.23 2.43 -1.90 0.30 114.38 131.43 2yqg h ARG 80 Ca -0.24 -0.00 0.12 0.00 -0.81 0.00 0.00 59.98 59.05 2yqg h ARG 80 Cb 1.09 -0.01 -0.10 0.00 -0.42 0.00 0.00 29.97 30.53 2yqg h ARG 80 CO 0.84 0.03 0.03 1.05 -1.51 0.00 0.00 179.97 180.40 2yqg h GLU 81 N 0.04 0.14 0.00 0.20 4.11 -1.98 -3.15 114.58 113.95 2yqg h GLU 81 Ca 0.06 -0.01 0.00 0.00 0.07 0.00 0.00 59.36 59.49 2yqg h GLU 81 Cb 0.08 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.30 2yqg h GLU 81 CO -0.11 0.09 0.00 -1.91 0.07 0.00 0.00 179.01 177.15 2yqg n GLU 82 N -5.24 0.00 -3.47 1.06 2.13 -0.99 -4.72 120.64 109.41 2yqg n GLU 82 Ca 0.08 0.41 -0.43 0.00 0.66 0.00 0.00 57.16 57.88 2yqg n GLU 82 Cb 0.33 -1.05 -0.09 0.00 0.27 0.00 0.00 31.44 30.90 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 -1.32 5.06 0.29 6.31 -4.23 0.10 -4.94 115.64 116.90 2yqg s THR 83 Ca 0.00 -0.89 0.16 0.00 -1.18 0.00 0.00 61.69 59.79 2yqg s THR 83 Cb 0.00 -3.91 0.11 0.00 1.34 0.00 0.00 72.50 70.04 2yqg s THR 83 CO 0.00 -0.40 1.78 1.55 -0.54 0.00 0.00 174.62 177.01 2yqg h PRO 84 N 8.62 0.00 -2.14 3.99 0.13 -1.76 -3.35 132.00 137.50 2yqg h PRO 84 Ca -0.27 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.87 2yqg h PRO 84 Cb 1.11 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.06 2yqg h PRO 84 CO 0.77 0.39 0.33 -0.59 -0.23 0.00 0.00 178.00 178.67 2yqg s PHE 85 N -3.87 -0.51 -0.74 1.56 -0.71 -1.26 -3.60 117.98 108.84 2yqg s PHE 85 Ca -0.01 0.70 0.03 0.00 -1.04 0.00 0.00 56.93 56.60 2yqg s PHE 85 Cb 0.13 0.47 0.18 0.00 -1.21 0.00 0.00 43.02 42.59 2yqg s PHE 85 CO 0.70 -0.58 0.55 -0.06 -1.34 0.00 0.00 175.22 174.49 2yqg s PHE 86 N -2.00 3.64 -0.43 3.49 0.08 -1.19 -5.02 117.98 116.54 2yqg s PHE 86 Ca -0.04 -3.26 -0.28 0.00 0.12 0.00 0.00 56.93 53.48 2yqg s PHE 86 Cb -0.00 -2.85 -0.02 0.00 -0.57 0.00 0.00 43.02 39.58 2yqg s PHE 86 CO 0.00 -0.60 1.87 -1.17 -0.10 0.00 0.00 175.22 175.22 2yqg s LEU 87 N -1.38 3.43 0.41 -0.37 1.98 -1.26 -3.68 118.68 117.81 2yqg s LEU 87 Ca 0.25 0.97 0.07 0.00 -2.89 0.00 0.00 54.13 52.53 2yqg s LEU 87 Cb -0.06 -3.11 -0.06 0.00 0.66 0.00 0.00 46.19 43.62 2yqg s LEU 87 CO -0.15 -2.02 0.12 -0.76 -1.89 0.00 0.00 176.35 171.65 2yqg s LEU 88 N 8.03 3.03 -0.20 -0.68 1.43 -0.78 -4.34 118.68 125.18 2yqg s LEU 88 Ca 0.77 -1.18 -0.17 0.00 -1.03 0.00 0.00 54.13 52.52 2yqg s LEU 88 Cb -0.19 -1.25 0.05 0.00 0.03 0.00 0.00 46.19 44.83 2yqg s LEU 88 CO 0.29 -0.51 0.51 -0.89 0.23 0.00 0.00 176.35 175.98 2yqg s THR 89 N -2.64 -0.00 0.04 5.49 2.01 -1.08 -2.77 115.64 116.69 2yqg s THR 89 Ca 0.39 0.01 -0.08 0.00 0.31 0.00 0.00 61.69 62.32 2yqg s THR 89 Cb 0.06 -0.72 -0.05 0.00 0.01 0.00 0.00 72.50 71.80 2yqg s THR 89 CO 0.21 0.00 0.32 -0.83 -0.69 0.00 0.00 174.62 173.63 2yqg s GLY 90 N 0.44 2.28 0.11 4.40 0.00 -1.17 -2.74 107.32 110.65 2yqg s GLY 90 Ca -0.01 -0.51 0.08 0.00 0.00 0.00 0.00 44.72 44.28 2yqg s GLY 90 CO -0.02 -0.31 -0.19 -0.19 0.00 0.00 0.00 173.10 172.39 2yqg s TYR 91 N -1.35 1.70 -0.69 1.90 2.02 -0.72 -3.62 117.35 116.60 2yqg s TYR 91 Ca 0.30 -0.44 0.04 0.00 -0.37 0.00 0.00 57.07 56.60 2yqg s TYR 91 Cb -0.13 -0.92 0.17 0.00 -0.40 0.00 0.00 41.96 40.68 2yqg s TYR 91 CO 0.17 0.20 0.48 0.00 -1.57 0.00 0.00 175.55 174.83 2yqg s ALA 92 N -1.38 3.77 0.72 3.71 0.00 -1.26 -2.67 121.76 124.64 2yqg s ALA 92 Ca 0.07 -3.72 -0.13 0.00 0.00 0.00 0.00 51.96 48.18 2yqg s ALA 92 Cb -0.09 -2.25 0.03 0.00 0.00 0.00 0.00 23.12 20.81 2yqg s ALA 92 CO 0.04 -2.09 1.12 -0.51 0.00 0.00 0.00 175.76 174.32 2yqg s LEU 93 N -1.19 3.24 0.00 0.00 1.43 0.41 -3.75 118.68 118.81 2yqg s LEU 93 Ca 0.23 2.01 0.00 0.00 -1.03 0.00 0.00 54.13 55.34 2yqg s LEU 93 Cb -0.09 -4.55 0.00 0.00 0.03 0.00 0.00 46.19 41.58 2yqg s LEU 93 CO -0.13 -1.94 0.00 -0.67 0.23 0.00 0.00 176.35 173.84 2yqg n ASP 94 N -2.91 0.00 0.06 2.29 2.03 -1.26 -2.30 116.55 114.46 2yqg n ASP 94 Ca 0.10 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.42 2yqg n ASP 94 Cb 0.52 -0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.92 2yqg n ASP 94 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2yqg n ALA 95 N -2.51 3.00 -0.09 -1.67 0.00 -1.26 -4.77 120.51 113.21 2yqg n ALA 95 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 53.44 53.41 2yqg n ALA 95 Cb 0.00 0.06 0.20 0.00 0.00 0.00 0.00 19.45 19.71 2yqg n ALA 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yqg h ARG 96 N 0.00 0.75 0.00 0.00 2.47 -2.02 -3.47 114.38 112.11 2yqg h ARG 96 Ca 0.00 -0.17 0.00 0.00 -1.26 0.00 0.00 59.98 58.55 2yqg h ARG 96 Cb 0.00 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.22 2yqg h ARG 96 CO 0.00 0.73 0.00 0.41 0.56 0.00 0.00 179.97 181.67 2yqg n GLY 97 N -0.77 1.86 3.16 0.04 0.00 -1.26 -5.11 105.19 103.10 2yqg n GLY 97 Ca 0.03 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.72 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 3.22 -0.50 1.61 2.20 -1.26 -4.96 114.94 113.25 2yqg s ASN 98 Ca 0.00 -0.61 -0.33 0.00 -0.94 0.00 0.00 52.86 50.99 2yqg s ASN 98 Cb 0.00 -1.48 -0.16 0.00 -2.00 0.00 0.00 41.25 37.61 2yqg s ASN 98 CO 0.00 0.04 1.82 -0.46 -2.94 0.00 0.00 177.10 175.55 2yqg n ASN 99 N 4.37 0.51 -0.03 3.54 0.23 -1.26 -4.69 115.26 117.93 2yqg n ASN 99 Ca -0.20 0.45 0.04 0.00 -0.53 0.00 0.00 54.58 54.34 2yqg n ASN 99 Cb 0.51 -0.72 -0.15 0.00 -2.08 0.00 0.00 39.78 37.33 2yqg n ASN 99 CO 0.00 0.00 0.00 1.33 -0.93 0.00 0.00 177.26 177.66 2yqg n VAL 100 N 5.38 0.49 -4.35 3.53 0.24 -1.25 -4.96 118.33 117.42 2yqg n VAL 100 Ca 0.46 -0.62 -0.28 0.00 -2.04 0.00 0.00 64.34 61.86 2yqg n VAL 100 Cb -0.02 -0.19 -0.11 0.00 -1.47 0.00 0.00 33.84 32.05 2yqg n VAL 100 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 2yqg s GLU 101 N -3.18 1.68 -0.45 7.34 2.02 -1.26 -5.05 118.70 119.79 2yqg s GLU 101 Ca -0.08 -1.34 -0.33 0.00 0.02 0.00 0.00 54.97 53.24 2yqg s GLU 101 Cb 0.11 -2.00 -0.12 0.00 0.10 0.00 0.00 34.13 32.22 2yqg s GLU 101 CO 0.88 0.44 2.29 1.17 0.02 0.00 0.00 175.26 180.06 2yqg n LYS 102 N 0.51 0.92 -2.20 1.61 0.00 -1.26 -4.70 118.16 113.04 2yqg n LYS 102 Ca -0.14 0.20 -0.42 0.00 0.00 0.00 0.00 58.31 57.95 2yqg n LYS 102 Cb 0.54 -2.48 -0.03 0.00 0.00 0.00 0.00 35.03 33.07 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 6.88 4.32 0.87 1.64 0.04 -1.26 -5.00 135.00 142.49 2yqg s PRO 103 Ca 1.11 2.03 -0.11 0.00 0.04 0.00 0.00 61.00 64.07 2yqg s PRO 103 Cb -0.81 -3.32 0.11 0.00 0.04 0.00 0.00 34.50 30.52 2yqg s PRO 103 CO 0.46 -0.45 1.09 -0.48 0.04 0.00 0.00 177.00 177.66 2yqg s LEU 104 N 1.34 2.36 -0.23 -3.56 0.05 -1.24 -4.90 118.68 112.51 2yqg s LEU 104 Ca 0.64 1.46 -0.02 0.00 0.05 0.00 0.00 54.13 56.26 2yqg s LEU 104 Cb -0.35 -3.93 0.01 0.00 -2.05 0.00 0.00 46.19 39.86 2yqg s LEU 104 CO 0.30 -2.47 -0.08 -0.70 -0.55 0.00 0.00 176.35 172.85 2yqg s GLU 105 N -4.98 3.09 -0.20 1.48 2.56 -1.26 -3.04 118.70 116.34 2yqg s GLU 105 Ca 0.63 -0.80 -0.04 0.00 0.00 0.00 0.00 54.97 54.75 2yqg s GLU 105 Cb -0.17 -2.93 -0.02 0.00 2.00 0.00 0.00 34.13 33.01 2yqg s GLU 105 CO 0.56 -0.28 -0.03 -1.17 -0.56 0.00 0.00 175.26 173.78 2yqg s LEU 106 N 1.38 3.09 -0.03 2.70 2.96 -1.11 -4.78 118.68 122.90 2yqg s LEU 106 Ca 0.03 -0.28 0.07 0.00 -0.22 0.00 0.00 54.13 53.73 2yqg s LEU 106 Cb -0.15 -1.78 -0.02 0.00 0.50 0.00 0.00 46.19 44.75 2yqg s LEU 106 CO -0.05 0.04 -0.23 -0.13 -1.32 0.00 0.00 176.35 174.66 2yqg s ARG 107 N 1.11 1.95 -0.56 1.98 0.52 -1.26 -1.86 118.95 120.82 2yqg s ARG 107 Ca 0.02 -0.81 0.04 0.00 -0.52 0.00 0.00 55.73 54.46 2yqg s ARG 107 Cb -0.15 -1.82 0.16 0.00 0.52 0.00 0.00 34.95 33.66 2yqg s ARG 107 CO 0.01 0.45 0.38 0.42 0.02 0.00 0.00 175.30 176.58 2yqg s ILE 108 N -0.42 1.93 -0.22 1.52 1.01 -1.24 -1.51 121.20 122.26 2yqg s ILE 108 Ca 0.06 -3.44 -0.29 0.00 0.00 0.00 0.00 60.65 56.98 2yqg s ILE 108 Cb -0.10 -2.30 -0.03 0.00 0.01 0.00 0.00 42.46 40.05 2yqg s ILE 108 CO 0.00 -1.02 1.63 -0.75 0.00 0.00 0.00 174.94 174.80 2yqg s LYS 109 N -0.61 3.77 -0.12 2.79 2.20 -0.85 -3.15 119.74 123.76 2yqg s LYS 109 Ca 0.25 1.66 -0.29 0.00 -0.36 0.00 0.00 55.97 57.22 2yqg s LYS 109 Cb -0.08 -4.05 -0.03 0.00 -1.51 0.00 0.00 37.83 32.16 2yqg s LYS 109 CO -0.12 -1.32 1.40 0.08 -0.36 0.00 0.00 175.35 175.02 2yqg s VAL 110 N 5.29 4.03 0.50 4.02 1.01 -1.24 -3.44 120.40 130.57 2yqg s VAL 110 Ca 0.72 1.25 0.03 0.00 0.00 0.00 0.00 61.98 63.97 2yqg s VAL 110 Cb -0.25 -3.80 0.02 0.00 0.00 0.00 0.00 36.38 32.35 2yqg s VAL 110 CO 0.30 -0.11 0.70 -0.76 0.00 0.00 0.00 175.10 175.23 2yqg s LEU 111 N 3.66 3.43 0.47 3.92 1.43 0.09 -4.96 118.68 126.72 2yqg s LEU 111 Ca 0.61 -0.07 -0.07 0.00 -1.03 0.00 0.00 54.13 53.57 2yqg s LEU 111 Cb -0.26 -2.85 -0.04 0.00 0.03 0.00 0.00 46.19 43.06 2yqg s LEU 111 CO 0.20 -0.98 0.80 -0.62 0.23 0.00 0.00 176.35 175.98 2yqg s ASP 112 N -4.37 6.32 0.25 2.29 -1.08 -1.26 -1.77 116.67 117.05 2yqg s ASP 112 Ca 0.55 1.01 -0.05 0.00 -0.52 0.00 0.00 52.55 53.54 2yqg s ASP 112 Cb -0.10 -2.28 0.29 0.00 -1.46 0.00 0.00 42.92 39.36 2yqg s ASP 112 CO 0.37 -0.56 1.89 -0.29 0.52 0.00 0.00 175.17 177.11 2yqg h ILE 113 N 0.39 1.25 -0.05 4.11 6.09 -1.95 -2.89 117.51 124.46 2yqg h ILE 113 Ca -0.47 -0.57 -0.00 0.00 -1.37 0.00 0.00 64.86 62.45 2yqg h ILE 113 Cb 1.20 0.02 -0.00 0.00 0.47 0.00 0.00 36.82 38.51 2yqg h ILE 113 CO 0.62 0.27 0.01 0.78 -3.07 0.00 0.00 178.15 176.76 2yqg h ASN 114 N 1.22 0.07 -1.45 2.19 4.21 -1.94 -3.44 115.58 116.45 2yqg h ASN 114 Ca 0.31 -0.23 -0.74 0.00 1.21 0.00 0.00 56.30 56.86 2yqg h ASN 114 Cb -0.02 -0.02 0.04 0.00 -1.12 0.00 0.00 38.32 37.19 2yqg h ASN 114 CO -0.06 0.28 0.57 -0.67 -1.29 0.00 0.00 177.43 176.27 2yqg n ASP 115 N -4.93 1.59 -4.21 5.81 2.03 -1.09 -4.96 116.55 110.80 2yqg n ASP 115 Ca -0.07 1.12 -0.20 0.00 0.52 0.00 0.00 54.79 56.16 2yqg n ASP 115 Cb 0.14 -1.10 -0.12 0.00 -0.72 0.00 0.00 41.12 39.32 2yqg n ASP 115 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 2yqg s ASN 116 N 1.73 1.95 0.10 1.67 3.04 -1.26 -4.82 114.94 117.35 2yqg s ASN 116 Ca 0.92 -0.63 0.04 0.00 0.04 0.00 0.00 52.86 53.23 2yqg s ASN 116 Cb -1.10 -0.08 -0.04 0.00 -1.54 0.00 0.00 41.25 38.49 2yqg s ASN 116 CO 0.59 -0.03 0.09 -1.61 -3.04 0.00 0.00 177.10 173.10 2yqg s GLU 117 N -1.77 2.88 0.94 0.43 2.02 -1.26 -5.11 118.70 116.82 2yqg s GLU 117 Ca 0.01 -0.74 -0.12 0.00 0.02 0.00 0.00 54.97 54.14 2yqg s GLU 117 Cb -0.10 -2.70 0.15 0.00 0.10 0.00 0.00 34.13 31.59 2yqg s GLU 117 CO 0.03 0.54 1.09 -1.25 0.02 0.00 0.00 175.26 175.69 2yqg s PRO 118 N -2.58 0.89 0.36 0.39 0.04 -1.26 -4.95 135.00 127.89 2yqg s PRO 118 Ca 0.30 0.69 -0.25 0.00 0.04 0.00 0.00 61.00 61.77 2yqg s PRO 118 Cb -0.12 -1.78 -0.13 0.00 0.04 0.00 0.00 34.50 32.52 2yqg s PRO 118 CO 0.22 -2.46 0.86 1.55 0.04 0.00 0.00 177.00 177.22 2yqg n VAL 119 N -4.01 2.08 -4.06 -0.36 3.14 -1.26 -4.97 118.33 108.89 2yqg n VAL 119 Ca 0.06 -0.50 -0.35 0.00 -2.96 0.00 0.00 64.34 60.59 2yqg n VAL 119 Cb 0.56 -0.87 -0.07 0.00 -1.06 0.00 0.00 33.84 32.40 2yqg n VAL 119 CO 0.00 0.00 0.00 0.72 -6.46 0.00 0.00 176.83 171.09 2yqg s PHE 120 N -1.23 3.42 -0.08 1.45 -0.71 -1.26 -5.11 117.98 114.46 2yqg s PHE 120 Ca 0.62 0.36 0.04 0.00 -1.04 0.00 0.00 56.93 56.91 2yqg s PHE 120 Cb -0.65 -1.85 -0.01 0.00 -1.21 0.00 0.00 43.02 39.30 2yqg s PHE 120 CO 0.58 0.62 -0.21 0.95 -1.34 0.00 0.00 175.22 175.82 2yqg s THR 121 N -1.04 2.38 -0.02 -4.49 -4.23 -1.26 -5.11 115.64 101.88 2yqg s THR 121 Ca 0.17 -0.93 -0.30 0.00 -1.18 0.00 0.00 61.69 59.45 2yqg s THR 121 Cb -0.12 -1.92 0.12 0.00 1.34 0.00 0.00 72.50 71.92 2yqg s THR 121 CO 0.06 0.56 1.25 0.00 -0.54 0.00 0.00 174.62 175.96 2yqg s GLN 122 N 0.02 0.45 0.00 3.99 -2.07 -1.26 -5.29 119.66 115.50 2yqg s GLN 122 Ca -0.08 -0.25 0.00 0.00 -1.82 0.00 0.00 55.36 53.22 2yqg s GLN 122 Cb -0.15 0.16 0.00 0.00 -1.09 0.00 0.00 33.01 31.93 2yqg s GLN 122 CO 0.05 -0.21 0.09 -3.47 -1.32 0.00 0.00 175.29 170.44