#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 -0.18 -0.04 1.61 1.04 -1.26 -5.17 113.70 109.70 2yqg s SER 2 Ca 0.00 -0.02 0.02 0.00 0.48 0.00 0.00 55.95 56.43 2yqg s SER 2 Cb 0.00 0.21 0.01 0.00 0.10 0.00 0.00 66.02 66.34 2yqg s SER 2 CO 0.00 -0.34 -0.09 -0.44 0.98 0.00 0.00 173.24 173.36 2yqg s SER 3 N -2.32 1.28 -0.70 7.02 0.01 -1.26 -5.04 113.70 112.69 2yqg s SER 3 Ca 0.09 -0.20 -0.02 0.00 1.31 0.00 0.00 55.95 57.12 2yqg s SER 3 Cb -0.01 -0.49 0.28 0.00 0.21 0.00 0.00 66.02 66.01 2yqg s SER 3 CO -0.05 0.03 2.22 0.61 0.41 0.00 0.00 173.24 176.45 2yqg n GLY 4 N 3.63 5.19 2.83 3.44 0.00 -1.26 -4.83 105.19 114.20 2yqg n GLY 4 Ca -0.22 -2.24 -0.14 0.00 0.00 0.00 0.00 46.02 43.42 2yqg n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2yqg s SER 5 N -0.74 0.84 -0.22 1.61 0.15 -1.26 -5.13 113.70 108.96 2yqg s SER 5 Ca 0.54 -0.01 -0.02 0.00 0.70 0.00 0.00 55.95 57.16 2yqg s SER 5 Cb 0.42 0.73 0.01 0.00 -1.71 0.00 0.00 66.02 65.47 2yqg s SER 5 CO -0.30 -0.31 -0.09 -0.55 1.20 0.00 0.00 173.24 173.19 2yqg s SER 6 N 2.43 3.98 0.00 5.45 0.15 -1.26 -4.90 113.70 119.55 2yqg s SER 6 Ca 0.10 -0.58 0.00 0.00 0.70 0.00 0.00 55.95 56.16 2yqg s SER 6 Cb -0.16 -1.65 0.00 0.00 -1.71 0.00 0.00 66.02 62.51 2yqg s SER 6 CO -0.14 -0.04 0.00 0.61 1.20 0.00 0.00 173.24 174.87 2yqg n GLY 7 N 4.72 -1.39 3.82 9.45 0.00 -1.26 -5.13 105.19 115.40 2yqg n GLY 7 Ca -0.19 0.51 -0.35 0.00 0.00 0.00 0.00 46.02 45.99 2yqg n GLY 7 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2yqg s GLN 8 N 0.00 3.26 -0.57 1.61 1.11 -1.26 -5.07 119.66 118.74 2yqg s GLN 8 Ca 0.00 -0.28 0.01 0.00 0.01 0.00 0.00 55.36 55.09 2yqg s GLN 8 Cb 0.00 -3.02 0.15 0.00 -1.01 0.00 0.00 33.01 29.12 2yqg s GLN 8 CO 0.00 0.72 0.35 0.15 0.01 0.00 0.00 175.29 176.52 2yqg s LYS 9 N -1.24 2.26 -0.17 2.91 1.02 -1.26 -4.92 119.74 118.35 2yqg s LYS 9 Ca 0.18 -2.58 0.05 0.00 0.02 0.00 0.00 55.97 53.64 2yqg s LYS 9 Cb -0.12 -3.52 0.41 0.00 -0.52 0.00 0.00 37.83 34.08 2yqg s LYS 9 CO 0.07 -1.14 1.29 2.89 -0.92 0.00 0.00 175.35 177.54 2yqg n ARG 10 N 3.29 2.57 -4.18 1.68 1.85 -1.26 -4.86 116.66 115.75 2yqg n ARG 10 Ca 0.06 -1.66 -0.18 0.00 -1.00 0.00 0.00 57.85 55.07 2yqg n ARG 10 Cb 0.35 -1.81 -0.12 0.00 -1.05 0.00 0.00 32.46 29.83 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 -1.88 1.22 -0.16 2.89 0.00 -1.26 -5.14 121.76 117.42 2yqg s ALA 11 Ca 0.30 -1.04 -0.01 0.00 0.00 0.00 0.00 51.96 51.20 2yqg s ALA 11 Cb 0.24 -0.09 -0.01 0.00 0.00 0.00 0.00 23.12 23.25 2yqg s ALA 11 CO 0.08 0.15 -0.11 1.67 0.00 0.00 0.00 175.76 177.56 2yqg s TRP 12 N -1.41 2.86 0.02 0.00 1.48 -1.26 -5.11 118.94 115.52 2yqg s TRP 12 Ca -0.00 -0.82 -0.04 0.00 -1.06 0.00 0.00 56.10 54.19 2yqg s TRP 12 Cb -0.09 -1.94 -0.01 0.00 -1.16 0.00 0.00 33.47 30.27 2yqg s TRP 12 CO 0.02 -0.37 0.05 0.42 -4.06 0.00 0.00 176.95 173.02 2yqg s ILE 13 N 0.80 0.12 0.29 0.66 1.09 -1.26 -4.58 121.20 118.31 2yqg s ILE 13 Ca -0.04 -0.95 0.04 0.00 -1.10 0.00 0.00 60.65 58.60 2yqg s ILE 13 Cb -0.15 -0.55 0.04 0.00 -1.06 0.00 0.00 42.46 40.74 2yqg s ILE 13 CO 0.01 -0.53 0.35 1.07 -0.10 0.00 0.00 174.94 175.75 2yqg n THR 14 N 1.25 0.00 -4.03 2.92 5.66 -1.26 -5.05 114.28 113.76 2yqg n THR 14 Ca -0.22 -1.01 -0.28 0.00 -3.05 0.00 0.00 64.05 59.50 2yqg n THR 14 Cb 0.56 -0.63 -0.05 0.00 -1.55 0.00 0.00 70.33 68.67 2yqg n THR 14 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2yqg s ALA 15 N -2.36 3.68 -0.30 1.79 0.00 -1.26 -4.94 121.76 118.36 2yqg s ALA 15 Ca 0.27 -1.10 -0.29 0.00 0.00 0.00 0.00 51.96 50.84 2yqg s ALA 15 Cb -0.02 -1.50 -0.02 0.00 0.00 0.00 0.00 23.12 21.59 2yqg s ALA 15 CO 0.17 0.60 1.67 -1.25 0.00 0.00 0.00 175.76 176.95 2yqg s PRO 16 N -2.89 3.54 0.62 0.00 0.04 -1.26 -4.84 135.00 130.21 2yqg s PRO 16 Ca 0.31 1.43 0.30 0.00 0.04 0.00 0.00 61.00 63.08 2yqg s PRO 16 Cb -0.11 -4.11 1.64 0.00 0.04 0.00 0.00 34.50 31.96 2yqg s PRO 16 CO 0.24 -1.60 1.91 0.28 0.04 0.00 0.00 177.00 177.87 2yqg h VAL 17 N 6.52 0.00 -6.61 -0.36 2.07 -1.92 -3.46 116.25 112.50 2yqg h VAL 17 Ca -0.33 0.00 -0.52 0.00 0.82 0.00 0.00 66.70 66.67 2yqg h VAL 17 Cb 1.15 0.67 -0.06 0.00 -1.52 0.00 0.00 31.29 31.53 2yqg h VAL 17 CO 1.03 0.00 -0.92 0.00 0.02 0.00 0.00 177.57 177.70 2yqg n ALA 18 N -1.88 -2.14 -1.74 1.67 0.00 -1.26 -4.86 120.51 110.32 2yqg n ALA 18 Ca -0.02 -0.32 -0.39 0.00 0.00 0.00 0.00 53.44 52.70 2yqg n ALA 18 Cb 0.31 -1.80 0.03 0.00 0.00 0.00 0.00 19.45 18.00 2yqg n ALA 18 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2yqg n LEU 19 N -4.46 5.03 -4.96 0.00 4.77 -1.00 -4.56 117.00 111.82 2yqg n LEU 19 Ca -0.27 1.04 -0.24 0.00 -0.03 0.00 0.00 56.01 56.52 2yqg n LEU 19 Cb 0.67 -1.56 0.08 0.00 -2.33 0.00 0.00 43.42 40.27 2yqg n LEU 19 CO 0.76 -0.50 0.54 -0.13 -1.33 0.00 0.00 177.39 176.72 2yqg s ARG 20 N -2.60 2.04 0.07 3.23 0.52 -1.26 -0.11 118.95 120.85 2yqg s ARG 20 Ca 0.66 -0.68 0.07 0.00 -0.52 0.00 0.00 55.73 55.25 2yqg s ARG 20 Cb -0.44 -2.29 -0.03 0.00 0.52 0.00 0.00 34.95 32.70 2yqg s ARG 20 CO 0.54 -1.22 -0.18 -1.83 0.02 0.00 0.00 175.30 172.63 2yqg s GLU 21 N -5.11 1.03 0.00 3.54 4.04 -1.08 -4.62 118.70 116.50 2yqg s GLU 21 Ca 0.62 -1.00 0.00 0.00 0.04 0.00 0.00 54.97 54.63 2yqg s GLU 21 Cb -0.09 -1.16 0.00 0.00 0.02 0.00 0.00 34.13 32.91 2yqg s GLU 21 CO 0.43 0.27 0.00 0.41 -1.84 0.00 0.00 175.26 174.53 2yqg n GLY 22 N 1.38 3.08 3.83 -3.83 0.00 -1.21 -3.99 105.19 104.45 2yqg n GLY 22 Ca -0.19 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.49 2yqg n GLY 22 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yqg s GLU 23 N -0.32 3.22 -0.80 1.61 0.41 -1.26 -5.03 118.70 116.54 2yqg s GLU 23 Ca 0.00 -0.40 -0.25 0.00 -0.41 0.00 0.00 54.97 53.91 2yqg s GLU 23 Cb 0.00 -2.97 -0.03 0.00 -1.78 0.00 0.00 34.13 29.35 2yqg s GLU 23 CO 0.00 0.67 1.88 0.16 -0.49 0.00 0.00 175.26 177.47 2yqg s ASP 24 N -1.76 5.28 -1.05 -0.19 1.47 -1.26 -4.81 116.67 114.35 2yqg s ASP 24 Ca 0.24 -0.33 -0.17 0.00 1.18 0.00 0.00 52.55 53.47 2yqg s ASP 24 Cb -0.12 -2.55 -0.08 0.00 -0.34 0.00 0.00 42.92 39.83 2yqg s ASP 24 CO 0.15 -2.53 2.11 0.18 0.68 0.00 0.00 175.17 175.76 2yqg n LEU 25 N 13.18 5.33 0.00 2.11 4.77 -1.26 -4.28 117.00 136.85 2yqg n LEU 25 Ca 0.32 -3.35 -0.03 0.00 -0.03 0.00 0.00 56.01 52.92 2yqg n LEU 25 Cb 0.49 -1.30 -0.01 0.00 -2.33 0.00 0.00 43.42 40.27 2yqg n LEU 25 CO 0.65 0.37 -0.19 -1.54 -1.33 0.00 0.00 177.39 175.34 2yqg n SER 26 N 6.35 1.15 -0.24 -1.43 3.41 -1.26 -4.50 113.62 117.10 2yqg n SER 26 Ca 0.52 0.17 -0.02 0.00 -0.26 0.00 0.00 58.87 59.27 2yqg n SER 26 Cb 0.35 -0.42 0.04 0.00 -0.26 0.00 0.00 64.21 63.91 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 -0.29 -0.09 -0.93 4.33 1.79 -1.99 0.23 116.57 119.63 2yqg h LYS 27 Ca 0.00 0.01 0.27 0.00 -2.18 0.00 0.00 60.65 58.75 2yqg h LYS 27 Cb 0.29 0.02 -0.15 0.00 -1.58 0.00 0.00 32.23 30.81 2yqg h LYS 27 CO 0.00 -0.06 0.31 0.87 -1.08 0.00 0.00 179.45 179.49 2yqg h LYS 28 N -0.09 0.19 -6.01 3.15 6.56 -1.88 -3.42 116.57 115.08 2yqg h LYS 28 Ca 0.29 -0.01 -0.67 0.00 -1.06 0.00 0.00 60.65 59.20 2yqg h LYS 28 Cb 0.55 -0.04 0.11 0.00 -0.57 0.00 0.00 32.23 32.28 2yqg h LYS 28 CO -0.74 0.13 -0.50 0.09 -2.06 0.00 0.00 179.45 176.37 2yqg n ASN 29 N -5.22 -1.16 -4.77 0.86 4.13 0.82 -4.36 115.26 105.57 2yqg n ASN 29 Ca 0.25 1.13 -0.37 0.00 1.68 0.00 0.00 54.58 57.27 2yqg n ASN 29 Cb 0.81 -0.96 -0.01 0.00 -1.54 0.00 0.00 39.78 38.08 2yqg n ASN 29 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 2yqg s PRO 30 N -0.98 3.80 -0.01 3.52 0.04 -1.26 -5.07 135.00 135.04 2yqg s PRO 30 Ca 0.65 1.79 0.17 0.00 0.04 0.00 0.00 61.00 63.65 2yqg s PRO 30 Cb -0.93 -2.45 -0.22 0.00 0.04 0.00 0.00 34.50 30.93 2yqg s PRO 30 CO 0.56 -0.52 0.57 0.44 0.04 0.00 0.00 177.00 178.09 2yqg n ILE 31 N -0.40 0.00 -4.17 0.56 -5.35 -1.18 -4.95 119.36 103.87 2yqg n ILE 31 Ca 0.07 -0.23 -0.17 0.00 -0.27 0.00 0.00 62.75 62.14 2yqg n ILE 31 Cb 0.48 0.61 -0.15 0.00 -1.74 0.00 0.00 39.64 38.83 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 -2.86 0.54 -0.04 -1.28 0.00 -1.26 -4.92 121.76 111.93 2yqg s ALA 32 Ca 0.01 -0.16 -0.02 0.00 0.00 0.00 0.00 51.96 51.79 2yqg s ALA 32 Cb 0.12 -0.23 0.03 0.00 0.00 0.00 0.00 23.12 23.05 2yqg s ALA 32 CO 0.71 0.07 0.08 -1.59 0.00 0.00 0.00 175.76 175.03 2yqg s LYS 33 N 0.25 -0.03 0.01 0.00 0.00 -1.26 -3.73 119.74 114.98 2yqg s LYS 33 Ca -0.03 0.36 -0.00 0.00 0.00 0.00 0.00 55.97 56.30 2yqg s LYS 33 Cb -0.07 -0.37 -0.01 0.00 0.00 0.00 0.00 37.83 37.38 2yqg s LYS 33 CO -0.00 -0.27 -0.02 0.96 0.00 0.00 0.00 175.35 176.03 2yqg s ILE 34 N 1.80 0.06 -0.29 3.79 -4.36 -1.26 -5.14 121.20 115.80 2yqg s ILE 34 Ca -0.01 -0.47 -0.23 0.00 -0.26 0.00 0.00 60.65 59.69 2yqg s ILE 34 Cb -0.12 -0.14 0.14 0.00 1.25 0.00 0.00 42.46 43.59 2yqg s ILE 34 CO -0.04 -0.26 1.10 -1.38 0.24 0.00 0.00 174.94 174.60 2yqg s HIS 35 N -0.75 -0.41 0.04 1.37 -3.43 -1.26 -5.06 115.29 105.79 2yqg s HIS 35 Ca -0.08 0.95 -0.27 0.00 -0.80 0.00 0.00 55.06 54.86 2yqg s HIS 35 Cb -0.05 0.37 -0.05 0.00 -1.43 0.00 0.00 32.58 31.42 2yqg s HIS 35 CO -0.01 -0.20 0.85 -1.54 -2.00 0.00 0.00 174.74 171.85 2yqg s SER 36 N 0.46 7.29 0.17 7.38 1.04 -1.26 -4.97 113.70 123.81 2yqg s SER 36 Ca 0.01 1.55 -0.23 0.00 0.48 0.00 0.00 55.95 57.76 2yqg s SER 36 Cb -0.05 -2.51 0.07 0.00 0.10 0.00 0.00 66.02 63.63 2yqg s SER 36 CO -0.10 -0.07 1.59 0.44 0.98 0.00 0.00 173.24 176.08 2yqg h ASP 37 N 5.97 -1.21 -0.95 7.02 5.19 -2.01 0.28 116.42 130.71 2yqg h ASP 37 Ca -0.43 0.21 0.27 0.00 -0.62 0.00 0.00 57.03 56.47 2yqg h ASP 37 Cb 1.21 0.57 -0.17 0.00 0.18 0.00 0.00 39.33 41.12 2yqg h ASP 37 CO 0.72 -0.32 0.15 -0.07 -3.12 0.00 0.00 179.24 176.60 2yqg h LEU 38 N -0.23 -0.24 -0.91 1.55 3.38 -1.96 0.64 115.31 117.53 2yqg h LEU 38 Ca 0.19 0.25 0.26 0.00 0.09 0.00 0.00 57.88 58.67 2yqg h LEU 38 Cb 0.55 0.39 -0.14 0.00 0.09 0.00 0.00 40.66 41.55 2yqg h LEU 38 CO -0.61 -0.30 0.32 0.00 0.09 0.00 0.00 178.44 177.93 2yqg h ALA 39 N 1.92 1.45 0.00 1.53 0.00 -1.13 -0.20 119.26 122.82 2yqg h ALA 39 Ca 0.61 0.22 -0.05 0.00 0.00 0.00 0.00 54.91 55.69 2yqg h ALA 39 Cb 1.30 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 19.36 2yqg h ALA 39 CO -0.82 -0.49 -0.76 -1.91 0.00 0.00 0.00 179.25 175.28 2yqg n GLU 40 N -5.18 0.48 -0.30 0.00 2.13 0.19 -0.43 120.64 117.53 2yqg n GLU 40 Ca 0.24 0.48 0.02 0.00 0.66 0.00 0.00 57.16 58.57 2yqg n GLU 40 Cb 0.76 -1.66 0.08 0.00 0.27 0.00 0.00 31.44 30.89 2yqg n GLU 40 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2yqg n GLU 41 N -4.56 -0.12 -0.09 5.31 -0.58 0.85 -1.54 120.64 119.92 2yqg n GLU 41 Ca -0.13 1.24 -0.16 0.00 -0.42 0.00 0.00 57.16 57.69 2yqg n GLU 41 Cb 0.38 -1.85 -0.13 0.00 -0.57 0.00 0.00 31.44 29.27 2yqg n GLU 41 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2yqg n ARG 42 N -5.25 0.68 0.00 3.49 5.12 -0.11 -5.01 116.66 115.57 2yqg n ARG 42 Ca 0.11 0.15 0.00 0.00 -1.93 0.00 0.00 57.85 56.18 2yqg n ARG 42 Cb 0.37 -1.58 0.00 0.00 -1.16 0.00 0.00 32.46 30.09 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 2.04 1.41 3.81 -0.13 0.00 -0.24 -5.05 105.19 107.03 2yqg n GLY 43 Ca -0.38 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.34 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 2.56 -0.05 0.99 1.43 0.43 -4.89 118.68 119.15 2yqg s LEU 44 Ca 0.00 1.25 0.00 0.00 -1.03 0.00 0.00 54.13 54.35 2yqg s LEU 44 Cb 0.00 -3.84 -0.03 0.00 0.03 0.00 0.00 46.19 42.34 2yqg s LEU 44 CO 0.00 -1.99 -0.03 -1.59 0.23 0.00 0.00 176.35 172.98 2yqg s LYS 45 N -5.19 2.82 0.07 1.70 -2.85 -1.26 -4.34 119.74 110.68 2yqg s LYS 45 Ca 0.61 -0.53 0.04 0.00 -1.00 0.00 0.00 55.97 55.10 2yqg s LYS 45 Cb -0.14 -2.67 -0.03 0.00 -2.06 0.00 0.00 37.83 32.93 2yqg s LYS 45 CO 0.54 0.66 -0.12 0.42 0.10 0.00 0.00 175.35 176.95 2yqg s ILE 46 N -0.92 0.95 -0.05 3.79 -1.09 -1.26 -4.35 121.20 118.28 2yqg s ILE 46 Ca 0.15 -1.28 -0.02 0.00 -2.23 0.00 0.00 60.65 57.27 2yqg s ILE 46 Cb -0.11 -0.98 -0.04 0.00 -1.58 0.00 0.00 42.46 39.75 2yqg s ILE 46 CO 0.04 -0.29 0.08 -0.89 -1.23 0.00 0.00 174.94 172.65 2yqg s THR 47 N -1.40 4.84 -0.17 2.92 2.01 -0.28 -5.00 115.64 118.56 2yqg s THR 47 Ca -0.03 -0.23 -0.06 0.00 0.31 0.00 0.00 61.69 61.68 2yqg s THR 47 Cb -0.09 -3.16 -0.04 0.00 0.01 0.00 0.00 72.50 69.22 2yqg s THR 47 CO 0.02 0.46 0.02 -0.31 -0.69 0.00 0.00 174.62 174.12 2yqg s TYR 48 N -1.10 3.16 -0.03 4.92 2.02 -1.26 -2.87 117.35 122.18 2yqg s TYR 48 Ca 0.19 -0.07 0.01 0.00 -0.37 0.00 0.00 57.07 56.84 2yqg s TYR 48 Cb -0.12 -2.03 0.01 0.00 -0.40 0.00 0.00 41.96 39.43 2yqg s TYR 48 CO 0.10 0.09 -0.06 0.21 -1.57 0.00 0.00 175.55 174.32 2yqg s LYS 49 N 0.34 0.81 -0.07 -0.62 2.20 -1.23 -4.57 119.74 116.60 2yqg s LYS 49 Ca 0.00 -0.16 0.05 0.00 -0.36 0.00 0.00 55.97 55.50 2yqg s LYS 49 Cb -0.13 -0.79 -0.01 0.00 -1.51 0.00 0.00 37.83 35.38 2yqg s LYS 49 CO 0.01 -0.01 -0.21 0.71 -0.36 0.00 0.00 175.35 175.49 2yqg s TYR 50 N 0.61 2.54 -0.09 4.03 1.51 -1.26 -1.34 117.35 123.35 2yqg s TYR 50 Ca -0.08 -0.64 -0.03 0.00 -1.01 0.00 0.00 57.07 55.31 2yqg s TYR 50 Cb -0.12 -1.65 0.05 0.00 -0.11 0.00 0.00 41.96 40.14 2yqg s TYR 50 CO 0.00 -0.16 0.17 0.95 -1.11 0.00 0.00 175.55 175.40 2yqg s THR 51 N -0.16 -0.26 0.00 -0.71 -4.23 -1.23 -4.88 115.64 104.18 2yqg s THR 51 Ca -0.03 0.33 0.00 0.00 -1.18 0.00 0.00 61.69 60.81 2yqg s THR 51 Cb -0.14 -0.31 0.00 0.00 1.34 0.00 0.00 72.50 73.39 2yqg s THR 51 CO 0.04 0.14 0.00 0.61 -0.54 0.00 0.00 174.62 174.86 2yqg n GLY 52 N 5.21 0.10 3.52 3.99 0.00 -1.26 -3.42 105.19 113.32 2yqg n GLY 52 Ca -0.07 -1.21 -0.63 0.00 0.00 0.00 0.00 46.02 44.11 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 -0.88 0.00 0.00 1.61 4.81 -1.25 -0.69 118.16 121.75 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 -1.43 0.00 0.00 0.02 0.00 0.00 35.03 33.62 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 3.22 1.81 0.72 3.14 0.00 -0.78 -4.74 105.19 108.56 2yqg n GLY 54 Ca 0.27 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.28 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 -0.24 0.34 -0.06 -0.61 5.41 0.13 -2.78 119.36 121.55 2yqg n ILE 55 Ca 0.00 0.19 -0.15 0.00 1.00 0.00 0.00 62.75 63.79 2yqg n ILE 55 Cb 0.00 -1.32 -0.06 0.00 -0.71 0.00 0.00 39.64 37.55 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 -0.08 1.31 -3.49 1.39 1.35 -1.88 -3.45 112.91 108.07 2yqg h THR 56 Ca 0.00 -1.71 -0.67 0.00 -0.55 0.00 0.00 66.41 63.48 2yqg h THR 56 Cb 0.08 1.83 -0.15 0.00 -1.73 0.00 0.00 68.15 68.17 2yqg h THR 56 CO 0.00 0.54 -0.69 -1.61 -0.25 0.00 0.00 175.52 173.52 2yqg s GLU 57 N -4.01 2.54 0.69 4.72 0.41 -1.26 -5.03 118.70 116.77 2yqg s GLU 57 Ca -0.12 -0.77 -0.14 0.00 -0.41 0.00 0.00 54.97 53.54 2yqg s GLU 57 Cb 0.08 -2.52 0.02 0.00 -1.78 0.00 0.00 34.13 29.93 2yqg s GLU 57 CO 0.86 0.58 1.10 -1.25 -0.49 0.00 0.00 175.26 176.06 2yqg s PRO 58 N -1.76 2.64 0.09 0.39 0.04 -1.26 -1.87 135.00 133.27 2yqg s PRO 58 Ca 0.20 1.32 -0.31 0.00 0.04 0.00 0.00 61.00 62.26 2yqg s PRO 58 Cb -0.11 -1.93 -0.07 0.00 0.04 0.00 0.00 34.50 32.42 2yqg s PRO 58 CO 0.11 -1.37 1.38 -1.25 0.04 0.00 0.00 177.00 175.92 2yqg s PRO 59 N -4.34 4.32 0.08 0.56 0.04 -1.26 -4.69 135.00 129.71 2yqg s PRO 59 Ca 0.65 2.03 -0.08 0.00 0.04 0.00 0.00 61.00 63.65 2yqg s PRO 59 Cb -0.19 -3.33 -0.05 0.00 0.04 0.00 0.00 34.50 30.96 2yqg s PRO 59 CO 0.46 -0.46 0.36 -0.59 0.04 0.00 0.00 177.00 176.81 2yqg s PHE 60 N 1.40 3.55 0.00 0.56 -0.12 -1.26 -4.11 117.98 118.01 2yqg s PHE 60 Ca 0.64 0.67 0.00 0.00 -0.05 0.00 0.00 56.93 58.19 2yqg s PHE 60 Cb -0.35 -2.08 0.00 0.00 -0.63 0.00 0.00 43.02 39.96 2yqg s PHE 60 CO 0.29 0.52 0.00 0.41 -0.05 0.00 0.00 175.22 176.39 2yqg n GLY 61 N 0.73 1.28 0.01 1.99 0.00 -1.12 -5.04 105.19 103.05 2yqg n GLY 61 Ca -0.07 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.94 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 0.00 -3.13 -0.61 1.08 -1.78 -3.43 117.51 109.64 2yqg h ILE 62 Ca 0.00 -0.08 -0.64 0.00 -0.39 0.00 0.00 64.86 63.75 2yqg h ILE 62 Cb 0.00 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 33.67 2yqg h ILE 62 CO 0.00 0.00 -0.58 -0.36 -0.69 0.00 0.00 178.15 176.52 2yqg s PHE 63 N -1.44 3.25 -0.04 1.37 0.08 -1.26 -0.99 117.98 118.94 2yqg s PHE 63 Ca -0.00 0.11 0.03 0.00 0.12 0.00 0.00 56.93 57.19 2yqg s PHE 63 Cb 0.00 -1.65 0.00 0.00 -0.57 0.00 0.00 43.02 40.81 2yqg s PHE 63 CO 0.01 0.53 -0.13 0.14 -0.10 0.00 0.00 175.22 175.68 2yqg s VAL 64 N -1.40 1.12 0.12 -0.44 -7.23 -1.19 -4.86 120.40 106.51 2yqg s VAL 64 Ca 0.30 -0.52 0.09 0.00 -1.81 0.00 0.00 61.98 60.03 2yqg s VAL 64 Cb -0.12 -0.99 -0.04 0.00 0.56 0.00 0.00 36.38 35.79 2yqg s VAL 64 CO 0.23 0.34 -0.21 0.72 -0.31 0.00 0.00 175.10 175.86 2yqg s PHE 65 N 0.26 1.85 0.10 2.82 -0.12 -1.26 -2.73 117.98 118.91 2yqg s PHE 65 Ca -0.06 -0.42 0.03 0.00 -0.05 0.00 0.00 56.93 56.42 2yqg s PHE 65 Cb -0.12 -0.99 -0.04 0.00 -0.63 0.00 0.00 43.02 41.24 2yqg s PHE 65 CO 0.02 0.25 -0.08 -0.80 -0.05 0.00 0.00 175.22 174.56 2yqg s ASN 66 N -2.09 1.30 -0.01 1.98 0.01 -1.26 -5.02 114.94 109.85 2yqg s ASN 66 Ca 0.09 -0.92 0.19 0.00 -0.71 0.00 0.00 52.86 51.51 2yqg s ASN 66 Cb -0.09 0.05 -0.23 0.00 0.41 0.00 0.00 41.25 41.39 2yqg s ASN 66 CO 0.05 -0.37 0.69 2.29 -1.51 0.00 0.00 177.10 178.25 2yqg n LYS 67 N 0.22 0.72 -0.04 -0.60 2.85 -1.26 -3.22 118.16 116.83 2yqg n LYS 67 Ca -0.14 -0.05 -0.00 0.00 -1.05 0.00 0.00 58.31 57.07 2yqg n LYS 67 Cb 0.59 -1.41 -0.00 0.00 -0.65 0.00 0.00 35.03 33.56 2yqg n LYS 67 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 177.40 176.91 2yqg h ASP 68 N 0.00 0.00 0.48 -5.58 3.32 -1.96 -3.40 116.42 109.27 2yqg h ASP 68 Ca 0.00 0.00 -0.30 0.00 0.02 0.00 0.00 57.03 56.75 2yqg h ASP 68 Cb 0.58 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.11 2yqg h ASP 68 CO 0.00 0.36 -1.55 0.00 -1.72 0.00 0.00 179.24 176.32 2yqg h THR 69 N -0.72 1.10 -4.06 0.35 1.03 -2.01 -3.50 112.91 105.11 2yqg h THR 69 Ca 0.00 -2.79 0.00 0.00 -0.01 0.00 0.00 66.41 63.61 2yqg h THR 69 Cb 0.00 2.69 0.00 0.00 -1.07 0.00 0.00 68.15 69.77 2yqg h THR 69 CO 0.00 0.78 -0.42 0.61 -0.01 0.00 0.00 175.52 176.48 2yqg n GLY 70 N 1.65 -2.91 3.60 2.99 0.00 -1.20 -5.08 105.19 104.25 2yqg n GLY 70 Ca -0.16 0.22 -0.07 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.05 0.40 -0.43 1.61 -1.05 -1.26 -4.95 118.70 111.97 2yqg s GLU 71 Ca 0.03 0.12 -0.11 0.00 -0.15 0.00 0.00 54.97 54.86 2yqg s GLU 71 Cb -0.01 0.19 0.07 0.00 -0.44 0.00 0.00 34.13 33.94 2yqg s GLU 71 CO 0.38 -0.12 0.30 -1.17 0.95 0.00 0.00 175.26 175.60 2yqg s LEU 72 N -0.97 5.29 -0.33 1.83 2.96 -1.24 -3.98 118.68 122.24 2yqg s LEU 72 Ca 0.02 -1.42 -0.04 0.00 -0.22 0.00 0.00 54.13 52.47 2yqg s LEU 72 Cb -0.01 -2.05 0.06 0.00 0.50 0.00 0.00 46.19 44.68 2yqg s LEU 72 CO -0.02 -0.57 0.07 0.21 -1.32 0.00 0.00 176.35 174.72 2yqg s ASN 73 N 2.26 5.09 0.03 3.68 2.47 -1.11 -3.12 114.94 124.25 2yqg s ASN 73 Ca 0.03 -1.34 -0.30 0.00 0.42 0.00 0.00 52.86 51.66 2yqg s ASN 73 Cb -0.23 -1.78 -0.06 0.00 -1.45 0.00 0.00 41.25 37.72 2yqg s ASN 73 CO 0.04 -0.33 1.44 0.54 -3.72 0.00 0.00 177.10 175.07 2yqg s VAL 74 N 1.29 3.55 -0.39 -5.21 0.11 -1.26 -3.20 120.40 115.29 2yqg s VAL 74 Ca -0.02 0.98 0.05 0.00 -2.93 0.00 0.00 61.98 60.06 2yqg s VAL 74 Cb -0.20 -3.63 0.47 0.00 -1.53 0.00 0.00 36.38 31.49 2yqg s VAL 74 CO -0.00 0.01 1.47 0.35 -3.33 0.00 0.00 175.10 173.60 2yqg n THR 75 N 4.57 2.82 -3.46 5.04 -2.24 -0.16 -4.72 114.28 116.13 2yqg n THR 75 Ca 0.13 -3.58 -0.11 0.00 -2.27 0.00 0.00 64.05 58.22 2yqg n THR 75 Cb 0.43 -0.97 -0.02 0.00 -2.10 0.00 0.00 70.33 67.66 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 -2.92 -0.51 -0.50 3.42 0.01 -1.24 -4.87 113.70 107.08 2yqg s SER 76 Ca 0.53 0.07 -0.17 0.00 1.31 0.00 0.00 55.95 57.69 2yqg s SER 76 Cb 0.44 0.53 0.07 0.00 0.21 0.00 0.00 66.02 67.27 2yqg s SER 76 CO 0.02 -0.83 0.51 -0.63 0.41 0.00 0.00 173.24 172.72 2yqg s ILE 77 N -3.29 5.07 0.75 1.44 -1.09 -1.26 -4.73 121.20 118.09 2yqg s ILE 77 Ca 0.01 -0.89 -0.16 0.00 -2.23 0.00 0.00 60.65 57.39 2yqg s ILE 77 Cb -0.01 -4.24 -0.03 0.00 -1.58 0.00 0.00 42.46 36.61 2yqg s ILE 77 CO -0.10 -0.73 0.53 0.18 -1.23 0.00 0.00 174.94 173.60 2yqg n LEU 78 N 5.65 0.83 -3.63 2.97 4.77 -1.26 -4.78 117.00 121.55 2yqg n LEU 78 Ca -0.10 0.56 -0.29 0.00 -0.03 0.00 0.00 56.01 56.15 2yqg n LEU 78 Cb 0.44 -1.22 -0.13 0.00 -2.33 0.00 0.00 43.42 40.18 2yqg n LEU 78 CO 0.51 -3.13 -0.27 1.51 -1.33 0.00 0.00 177.39 174.68 2yqg s ASP 79 N -1.54 3.43 0.29 -1.43 1.47 -1.26 -3.30 116.67 114.33 2yqg s ASP 79 Ca 0.65 -2.43 0.01 0.00 1.18 0.00 0.00 52.55 51.95 2yqg s ASP 79 Cb -0.33 -0.81 0.70 0.00 -0.34 0.00 0.00 42.92 42.14 2yqg s ASP 79 CO 0.59 -0.29 1.50 -1.14 0.68 0.00 0.00 175.17 176.51 2yqg n ARG 80 N 3.77 -0.08 -0.30 2.11 0.63 -1.25 0.12 116.66 121.66 2yqg n ARG 80 Ca 0.09 1.44 0.14 0.00 -0.92 0.00 0.00 57.85 58.60 2yqg n ARG 80 Cb 0.36 -2.27 0.32 0.00 0.45 0.00 0.00 32.46 31.31 2yqg n ARG 80 CO 0.00 0.00 0.00 1.05 -2.51 0.00 0.00 177.63 176.17 2yqg h GLU 81 N 0.00 0.29 0.00 -0.14 4.11 -1.97 -3.10 114.58 113.77 2yqg h GLU 81 Ca 0.57 -0.02 0.00 0.00 0.07 0.00 0.00 59.36 59.98 2yqg h GLU 81 Cb 1.15 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.33 2yqg h GLU 81 CO -0.91 0.19 -0.23 -1.91 0.07 0.00 0.00 179.01 176.22 2yqg n GLU 82 N -5.13 0.19 -3.32 1.06 4.07 0.33 -4.81 120.64 113.02 2yqg n GLU 82 Ca 0.23 0.33 -0.46 0.00 -0.06 0.00 0.00 57.16 57.20 2yqg n GLU 82 Cb 0.70 -1.10 -0.05 0.00 -0.06 0.00 0.00 31.44 30.93 2yqg n GLU 82 CO 0.00 0.00 0.00 0.95 -0.06 0.00 0.00 177.13 178.02 2yqg s THR 83 N -1.54 5.18 -0.14 6.31 -4.23 0.67 -4.91 115.64 116.99 2yqg s THR 83 Ca -0.07 -1.53 0.30 0.00 -1.18 0.00 0.00 61.69 59.20 2yqg s THR 83 Cb 0.01 -4.32 0.33 0.00 1.34 0.00 0.00 72.50 69.86 2yqg s THR 83 CO 0.10 -0.87 1.87 1.55 -0.54 0.00 0.00 174.62 176.73 2yqg h PRO 84 N 8.85 0.00 -1.56 3.99 0.13 -1.77 -3.31 132.00 138.33 2yqg h PRO 84 Ca -0.29 0.00 0.18 0.00 -0.87 0.00 0.00 66.00 65.02 2yqg h PRO 84 Cb 1.10 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.02 2yqg h PRO 84 CO 1.03 0.00 0.71 -0.59 -0.23 0.00 0.00 178.00 178.91 2yqg s PHE 85 N -3.53 -0.22 -0.35 1.56 -0.12 -1.26 -2.68 117.98 111.38 2yqg s PHE 85 Ca 0.02 0.26 0.02 0.00 -0.05 0.00 0.00 56.93 57.18 2yqg s PHE 85 Cb 0.09 0.50 0.11 0.00 -0.63 0.00 0.00 43.02 43.08 2yqg s PHE 85 CO 0.47 -0.27 0.10 -0.06 -0.05 0.00 0.00 175.22 175.41 2yqg s PHE 86 N -1.90 2.86 -0.38 3.49 0.08 0.81 -4.95 117.98 117.99 2yqg s PHE 86 Ca 0.05 -2.53 -0.26 0.00 0.12 0.00 0.00 56.93 54.31 2yqg s PHE 86 Cb -0.01 -2.41 0.02 0.00 -0.57 0.00 0.00 43.02 40.05 2yqg s PHE 86 CO -0.04 -0.90 0.95 -0.51 -0.10 0.00 0.00 175.22 174.62 2yqg s LEU 87 N 1.02 3.97 0.54 -0.37 1.43 -1.26 -2.08 118.68 121.93 2yqg s LEU 87 Ca 0.12 0.56 0.03 0.00 -1.03 0.00 0.00 54.13 53.80 2yqg s LEU 87 Cb -0.19 -3.29 0.02 0.00 0.03 0.00 0.00 46.19 42.76 2yqg s LEU 87 CO -0.13 -0.90 0.23 -0.76 0.23 0.00 0.00 176.35 175.02 2yqg s LEU 88 N 3.57 2.45 -0.18 1.79 1.43 -0.45 -3.90 118.68 123.39 2yqg s LEU 88 Ca 0.39 -1.47 -0.05 0.00 -1.03 0.00 0.00 54.13 51.98 2yqg s LEU 88 Cb -0.11 -0.94 0.09 0.00 0.03 0.00 0.00 46.19 45.25 2yqg s LEU 88 CO 0.20 -1.04 0.31 -0.89 0.23 0.00 0.00 176.35 175.16 2yqg s THR 89 N -2.84 -0.49 -0.60 5.49 2.01 -1.22 -2.85 115.64 115.14 2yqg s THR 89 Ca 0.19 0.12 -0.24 0.00 0.31 0.00 0.00 61.69 62.07 2yqg s THR 89 Cb -0.01 -0.60 0.05 0.00 0.01 0.00 0.00 72.50 71.94 2yqg s THR 89 CO 0.12 0.01 0.98 -0.83 -0.69 0.00 0.00 174.62 174.21 2yqg s GLY 90 N 2.47 1.34 -0.85 4.40 0.00 -1.24 -3.50 107.32 109.94 2yqg s GLY 90 Ca 0.04 -1.41 -0.21 0.00 0.00 0.00 0.00 44.72 43.14 2yqg s GLY 90 CO -0.11 2.12 1.13 -0.19 0.00 0.00 0.00 173.10 176.05 2yqg s TYR 91 N 4.17 2.86 -1.00 1.90 2.02 -0.45 -3.14 117.35 123.71 2yqg s TYR 91 Ca 0.29 -0.99 -0.23 0.00 -0.37 0.00 0.00 57.07 55.76 2yqg s TYR 91 Cb -0.13 -4.37 0.02 0.00 -0.40 0.00 0.00 41.96 37.08 2yqg s TYR 91 CO 0.16 -1.63 1.61 0.00 -1.57 0.00 0.00 175.55 174.12 2yqg s ALA 92 N 3.59 2.41 0.31 3.71 0.00 -1.26 -3.56 121.76 126.97 2yqg s ALA 92 Ca 0.32 -2.06 0.07 0.00 0.00 0.00 0.00 51.96 50.28 2yqg s ALA 92 Cb -0.08 -4.54 -0.02 0.00 0.00 0.00 0.00 23.12 18.48 2yqg s ALA 92 CO -0.03 -3.98 0.39 -0.51 0.00 0.00 0.00 175.76 171.63 2yqg s LEU 93 N 6.54 3.93 0.59 0.00 1.43 -1.14 -3.75 118.68 126.28 2yqg s LEU 93 Ca 0.54 -0.22 0.09 0.00 -1.03 0.00 0.00 54.13 53.50 2yqg s LEU 93 Cb -0.02 -2.61 0.09 0.00 0.03 0.00 0.00 46.19 43.68 2yqg s LEU 93 CO -0.06 -0.32 0.73 -1.81 0.23 0.00 0.00 176.35 175.11 2yqg s ASP 94 N -4.07 4.92 0.65 2.29 1.11 -1.26 -1.13 116.67 119.18 2yqg s ASP 94 Ca 0.41 -1.01 0.32 0.00 0.18 0.00 0.00 52.55 52.45 2yqg s ASP 94 Cb -0.08 0.47 1.74 0.00 1.07 0.00 0.00 42.92 46.12 2yqg s ASP 94 CO 0.29 -1.37 2.00 0.00 1.18 0.00 0.00 175.17 177.27 2yqg h ALA 95 N 0.25 1.39 0.00 5.23 0.00 -1.97 0.33 119.26 124.49 2yqg h ALA 95 Ca -0.30 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.53 2yqg h ALA 95 Cb 1.29 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 2yqg h ALA 95 CO 0.44 -0.31 -1.69 0.54 0.00 0.00 0.00 179.25 178.22 2yqg n ARG 96 N -3.06 0.64 -2.87 0.00 5.12 -1.26 -5.00 116.66 110.23 2yqg n ARG 96 Ca -0.01 -0.02 -0.09 0.00 -1.93 0.00 0.00 57.85 55.81 2yqg n ARG 96 Cb 0.35 -1.65 0.03 0.00 -1.16 0.00 0.00 32.46 30.04 2yqg n ARG 96 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2yqg n GLY 97 N 1.33 0.37 1.50 -0.13 0.00 0.12 -4.94 105.19 103.44 2yqg n GLY 97 Ca -0.08 -0.32 0.11 0.00 0.00 0.00 0.00 46.02 45.72 2yqg n GLY 97 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2yqg n ASN 98 N -0.34 4.42 -3.75 1.61 3.02 -1.26 -4.89 115.26 114.07 2yqg n ASN 98 Ca -0.01 -2.23 -0.25 0.00 -0.03 0.00 0.00 54.58 52.06 2yqg n ASN 98 Cb 0.53 -0.55 0.04 0.00 -0.61 0.00 0.00 39.78 39.19 2yqg n ASN 98 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2yqg n ASN 99 N 1.41 -3.10 0.29 6.41 3.02 -1.26 -4.78 115.26 117.25 2yqg n ASN 99 Ca 0.26 -0.76 0.09 0.00 -0.03 0.00 0.00 54.58 54.14 2yqg n ASN 99 Cb 0.77 -4.16 0.41 0.00 -0.61 0.00 0.00 39.78 36.19 2yqg n ASN 99 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 2yqg h VAL 100 N -2.04 0.02 -3.60 2.41 -1.51 -1.93 -3.36 116.25 106.24 2yqg h VAL 100 Ca -0.59 0.00 -0.31 0.00 -1.23 0.00 0.00 66.70 64.56 2yqg h VAL 100 Cb 1.36 0.32 -0.32 0.00 -2.13 0.00 0.00 31.29 30.52 2yqg h VAL 100 CO 0.60 0.00 -0.74 -1.61 -1.23 0.00 0.00 177.57 174.59 2yqg s GLU 101 N -4.09 0.21 0.43 5.19 0.41 -1.25 -5.12 118.70 114.48 2yqg s GLU 101 Ca -0.02 0.04 -0.25 0.00 -0.41 0.00 0.00 54.97 54.34 2yqg s GLU 101 Cb 0.05 -0.35 -0.08 0.00 -1.78 0.00 0.00 34.13 31.98 2yqg s GLU 101 CO 0.17 -0.08 1.31 -1.59 -0.49 0.00 0.00 175.26 174.58 2yqg s LYS 102 N 0.69 3.82 0.90 1.61 -2.85 -1.26 -4.36 119.74 118.29 2yqg s LYS 102 Ca -0.07 2.16 -0.12 0.00 -1.00 0.00 0.00 55.97 56.95 2yqg s LYS 102 Cb -0.10 -2.65 0.13 0.00 -2.06 0.00 0.00 37.83 33.15 2yqg s LYS 102 CO -0.01 -0.62 1.09 -1.25 0.10 0.00 0.00 175.35 174.66 2yqg s PRO 103 N -2.39 1.23 0.46 1.78 0.04 -1.26 -4.77 135.00 130.09 2yqg s PRO 103 Ca 0.60 0.81 0.07 0.00 0.04 0.00 0.00 61.00 62.51 2yqg s PRO 103 Cb -0.38 -1.81 -0.01 0.00 0.04 0.00 0.00 34.50 32.34 2yqg s PRO 103 CO 0.48 -2.26 0.32 -0.48 0.04 0.00 0.00 177.00 175.11 2yqg s LEU 104 N -6.23 3.08 -0.77 -3.56 0.05 -1.19 -4.95 118.68 105.13 2yqg s LEU 104 Ca 0.63 -1.01 -0.04 0.00 0.05 0.00 0.00 54.13 53.77 2yqg s LEU 104 Cb -0.18 -1.58 0.19 0.00 -2.05 0.00 0.00 46.19 42.57 2yqg s LEU 104 CO 0.57 -0.76 0.63 -0.70 -0.55 0.00 0.00 176.35 175.54 2yqg s GLU 105 N -4.10 2.99 -0.83 1.48 2.12 -1.26 -3.64 118.70 115.46 2yqg s GLU 105 Ca 0.41 -2.85 -0.25 0.00 0.36 0.00 0.00 54.97 52.64 2yqg s GLU 105 Cb -0.01 -3.91 0.05 0.00 0.26 0.00 0.00 34.13 30.52 2yqg s GLU 105 CO 0.24 -1.22 1.28 -1.17 -0.54 0.00 0.00 175.26 173.85 2yqg s LEU 106 N -0.60 3.53 -0.47 2.70 2.96 -1.13 -4.63 118.68 121.04 2yqg s LEU 106 Ca 0.22 -0.92 -0.20 0.00 -0.22 0.00 0.00 54.13 53.01 2yqg s LEU 106 Cb -0.14 -2.54 0.04 0.00 0.50 0.00 0.00 46.19 44.06 2yqg s LEU 106 CO -0.08 -1.64 0.63 0.00 -1.32 0.00 0.00 176.35 173.94 2yqg s ARG 107 N 5.11 3.20 -0.36 1.98 1.70 -1.26 -1.35 118.95 127.97 2yqg s ARG 107 Ca 0.37 -0.62 -0.19 0.00 -0.47 0.00 0.00 55.73 54.82 2yqg s ARG 107 Cb -0.06 -4.02 0.00 0.00 -0.57 0.00 0.00 34.95 30.30 2yqg s ARG 107 CO 0.05 -1.11 0.56 0.42 -1.08 0.00 0.00 175.30 174.14 2yqg s ILE 108 N 2.74 4.97 -0.35 4.99 1.01 -0.88 -4.31 121.20 129.37 2yqg s ILE 108 Ca 0.19 0.38 -0.15 0.00 0.00 0.00 0.00 60.65 61.06 2yqg s ILE 108 Cb -0.16 -4.02 -0.01 0.00 0.01 0.00 0.00 42.46 38.28 2yqg s ILE 108 CO 0.15 -0.28 0.35 -0.75 0.00 0.00 0.00 174.94 174.42 2yqg s LYS 109 N 2.51 3.52 -0.44 2.79 2.20 -1.26 -0.13 119.74 128.92 2yqg s LYS 109 Ca 0.20 -0.47 -0.29 0.00 -0.36 0.00 0.00 55.97 55.05 2yqg s LYS 109 Cb -0.15 -3.82 0.02 0.00 -1.51 0.00 0.00 37.83 32.37 2yqg s LYS 109 CO 0.14 -0.54 1.28 0.08 -0.36 0.00 0.00 175.35 175.95 2yqg s VAL 110 N 1.99 4.05 0.71 4.02 1.01 -1.09 -2.38 120.40 128.70 2yqg s VAL 110 Ca 0.11 1.07 -0.11 0.00 0.00 0.00 0.00 61.98 63.05 2yqg s VAL 110 Cb -0.17 -4.39 0.02 0.00 0.00 0.00 0.00 36.38 31.83 2yqg s VAL 110 CO 0.12 -0.87 1.10 -0.76 0.00 0.00 0.00 175.10 174.68 2yqg s LEU 111 N 4.96 2.89 0.25 3.92 1.43 0.85 -4.85 118.68 128.13 2yqg s LEU 111 Ca 0.55 1.12 -0.11 0.00 -1.03 0.00 0.00 54.13 54.66 2yqg s LEU 111 Cb -0.11 -3.91 -0.08 0.00 0.03 0.00 0.00 46.19 42.13 2yqg s LEU 111 CO 0.32 -1.35 0.60 1.51 0.23 0.00 0.00 176.35 177.66 2yqg s ASP 112 N -4.37 6.68 0.64 2.29 -4.77 -1.26 -2.65 116.67 113.23 2yqg s ASP 112 Ca 0.58 1.03 0.35 0.00 -3.30 0.00 0.00 52.55 51.21 2yqg s ASP 112 Cb -0.11 -2.27 1.96 0.00 -1.09 0.00 0.00 42.92 41.41 2yqg s ASP 112 CO 0.52 -0.10 2.18 -0.29 0.70 0.00 0.00 175.17 178.18 2yqg h ILE 113 N 2.05 0.20 0.02 2.11 6.09 -1.98 -0.67 117.51 125.33 2yqg h ILE 113 Ca -0.47 0.00 -0.27 0.00 -1.37 0.00 0.00 64.86 62.75 2yqg h ILE 113 Cb 1.17 0.87 0.02 0.00 0.47 0.00 0.00 36.82 39.36 2yqg h ILE 113 CO 0.68 0.00 -1.07 0.78 -3.07 0.00 0.00 178.15 175.47 2yqg h ASN 114 N 0.00 0.83 -0.83 2.19 2.35 -1.92 -3.42 115.58 114.78 2yqg h ASN 114 Ca 0.03 -0.69 -0.23 0.00 -0.55 0.00 0.00 56.30 54.86 2yqg h ASN 114 Cb 0.30 -0.26 -0.01 0.00 0.05 0.00 0.00 38.32 38.41 2yqg h ASN 114 CO -0.00 1.49 0.86 -0.67 -1.65 0.00 0.00 177.43 177.46 2yqg n ASP 115 N -3.81 1.78 -4.25 5.81 2.03 -0.26 -4.87 116.55 112.97 2yqg n ASP 115 Ca -0.11 -0.97 -0.44 0.00 0.52 0.00 0.00 54.79 53.80 2yqg n ASP 115 Cb 0.90 -1.54 -0.04 0.00 -0.72 0.00 0.00 41.12 39.71 2yqg n ASP 115 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2yqg s ASN 116 N 10.83 6.27 0.15 1.67 4.22 -1.26 -4.85 114.94 131.98 2yqg s ASN 116 Ca 0.99 -2.74 -0.15 0.00 -2.14 0.00 0.00 52.86 48.83 2yqg s ASN 116 Cb -0.24 -2.10 -0.07 0.00 1.28 0.00 0.00 41.25 40.13 2yqg s ASN 116 CO 0.20 -0.51 0.57 -1.61 -2.04 0.00 0.00 177.10 173.70 2yqg s GLU 117 N 0.10 4.01 0.68 3.55 2.02 -1.26 -5.07 118.70 122.72 2yqg s GLU 117 Ca 0.17 0.53 -0.14 0.00 0.02 0.00 0.00 54.97 55.55 2yqg s GLU 117 Cb -0.14 -2.93 0.01 0.00 0.10 0.00 0.00 34.13 31.17 2yqg s GLU 117 CO -0.07 0.47 1.11 -1.25 0.02 0.00 0.00 175.26 175.54 2yqg s PRO 118 N -1.95 2.72 0.25 0.39 0.04 -1.26 -4.98 135.00 130.21 2yqg s PRO 118 Ca 0.38 1.36 -0.30 0.00 0.04 0.00 0.00 61.00 62.48 2yqg s PRO 118 Cb -0.15 -1.94 -0.10 0.00 0.04 0.00 0.00 34.50 32.35 2yqg s PRO 118 CO 0.19 -1.31 1.40 0.54 0.04 0.00 0.00 177.00 177.86 2yqg s VAL 119 N -2.42 2.78 0.46 -0.36 0.11 -1.26 -5.03 120.40 114.68 2yqg s VAL 119 Ca 0.66 0.67 0.06 0.00 -2.93 0.00 0.00 61.98 60.44 2yqg s VAL 119 Cb -0.20 -3.43 -0.01 0.00 -1.53 0.00 0.00 36.38 31.21 2yqg s VAL 119 CO 0.44 0.11 0.28 0.72 -3.33 0.00 0.00 175.10 173.32 2yqg s PHE 120 N -0.11 2.26 0.01 1.54 -0.12 -1.26 -5.15 117.98 115.15 2yqg s PHE 120 Ca 0.58 -0.67 0.01 0.00 -0.05 0.00 0.00 56.93 56.79 2yqg s PHE 120 Cb -0.40 -1.97 -0.01 0.00 -0.63 0.00 0.00 43.02 40.00 2yqg s PHE 120 CO 0.43 -0.10 -0.05 -0.08 -0.05 0.00 0.00 175.22 175.38 2yqg s THR 121 N -2.65 0.36 -0.48 -4.49 -1.32 -1.26 -5.11 115.64 100.69 2yqg s THR 121 Ca 0.38 -0.53 -0.28 0.00 -1.21 0.00 0.00 61.69 60.04 2yqg s THR 121 Cb 0.00 -0.37 0.01 0.00 -1.51 0.00 0.00 72.50 70.63 2yqg s THR 121 CO 0.22 -0.12 1.37 -1.10 -2.21 0.00 0.00 174.62 172.78 2yqg s GLN 122 N -0.70 3.48 0.00 7.08 1.11 -1.26 -5.35 119.66 124.02 2yqg s GLN 122 Ca -0.04 0.68 0.00 0.00 0.01 0.00 0.00 55.36 56.01 2yqg s GLN 122 Cb -0.05 -4.05 0.00 0.00 -1.01 0.00 0.00 33.01 27.90 2yqg s GLN 122 CO -0.00 -1.70 0.00 -0.40 0.01 0.00 0.00 175.29 173.20