#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 1.17 -0.24 1.61 0.01 -1.26 -4.84 113.70 110.15 2yqg s SER 2 Ca 0.00 -0.86 -0.16 0.00 1.31 0.00 0.00 55.95 56.24 2yqg s SER 2 Cb 0.00 0.06 -0.11 0.00 0.21 0.00 0.00 66.02 66.18 2yqg s SER 2 CO 0.00 -0.36 -0.29 -1.20 0.41 0.00 0.00 173.24 171.81 2yqg n SER 3 N 0.42 1.94 -0.85 2.44 7.64 -1.26 -5.09 113.62 118.85 2yqg n SER 3 Ca -0.15 0.36 0.00 0.00 1.01 0.00 0.00 58.87 60.09 2yqg n SER 3 Cb 0.59 -0.82 0.00 0.00 -1.01 0.00 0.00 64.21 62.97 2yqg n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yqg n GLY 4 N 1.34 -0.00 0.34 0.23 0.00 -1.26 -4.93 105.19 100.91 2yqg n GLY 4 Ca -0.40 -0.37 0.16 0.00 0.00 0.00 0.00 46.02 45.41 2yqg n GLY 4 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2yqg h SER 5 N 0.00 -0.38 -4.03 1.61 0.02 -2.07 -3.39 113.55 105.32 2yqg h SER 5 Ca 0.00 0.27 -0.69 0.00 -0.84 0.00 0.00 61.79 60.53 2yqg h SER 5 Cb 0.19 0.45 -0.23 0.00 0.14 0.00 0.00 62.40 62.95 2yqg h SER 5 CO 0.00 -0.35 -0.86 -0.94 -1.14 0.00 0.00 176.83 173.54 2yqg s SER 6 N -4.98 3.35 -0.31 3.07 1.04 -1.26 -5.04 113.70 109.57 2yqg s SER 6 Ca -0.13 -0.66 0.08 0.00 0.48 0.00 0.00 55.95 55.72 2yqg s SER 6 Cb 0.29 -0.30 0.29 0.00 0.10 0.00 0.00 66.02 66.41 2yqg s SER 6 CO 0.78 0.21 1.27 0.61 0.98 0.00 0.00 173.24 177.09 2yqg n GLY 7 N 1.22 0.96 3.79 7.32 0.00 -1.26 -5.00 105.19 112.23 2yqg n GLY 7 Ca -0.17 -0.11 -0.23 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.86 -0.94 -3.61 1.61 10.64 -1.26 -4.88 117.38 118.09 2yqg n GLN 8 Ca -0.12 0.07 -0.28 0.00 -1.83 0.00 0.00 57.00 54.84 2yqg n GLN 8 Cb 0.78 -2.67 -0.03 0.00 -0.86 0.00 0.00 30.24 27.46 2yqg n GLN 8 CO 0.00 0.00 0.00 -1.59 -1.83 0.00 0.00 177.06 173.64 2yqg s LYS 9 N -6.06 3.55 -0.64 2.61 0.00 -1.26 -5.07 119.74 112.87 2yqg s LYS 9 Ca 0.08 -0.25 0.05 0.00 0.00 0.00 0.00 55.97 55.84 2yqg s LYS 9 Cb -0.04 -2.79 0.17 0.00 0.00 0.00 0.00 37.83 35.16 2yqg s LYS 9 CO 0.72 0.35 0.45 0.50 0.00 0.00 0.00 175.35 177.37 2yqg s ARG 10 N -3.37 2.13 0.29 1.78 3.52 -1.26 -5.06 118.95 116.96 2yqg s ARG 10 Ca 0.40 -3.06 -0.20 0.00 -0.13 0.00 0.00 55.73 52.74 2yqg s ARG 10 Cb -0.11 -3.02 0.04 0.00 -1.56 0.00 0.00 34.95 30.30 2yqg s ARG 10 CO 0.29 -1.29 0.79 0.00 -0.81 0.00 0.00 175.30 174.28 2yqg s ALA 11 N -1.08 -1.17 -0.28 6.12 0.00 -1.26 -5.06 121.76 119.03 2yqg s ALA 11 Ca 0.26 -0.37 0.09 0.00 0.00 0.00 0.00 51.96 51.93 2yqg s ALA 11 Cb -0.04 0.77 0.46 0.00 0.00 0.00 0.00 23.12 24.30 2yqg s ALA 11 CO -0.16 -1.03 1.18 -2.67 0.00 0.00 0.00 175.76 173.09 2yqg n TRP 12 N -0.50 2.35 -2.38 0.00 4.27 -1.26 -5.07 117.44 114.86 2yqg n TRP 12 Ca -0.05 -2.13 -0.34 0.00 -3.89 0.00 0.00 57.50 51.08 2yqg n TRP 12 Cb 0.60 -0.32 -0.02 0.00 -1.36 0.00 0.00 31.31 30.21 2yqg n TRP 12 CO 0.00 0.00 0.00 -1.50 -2.29 0.00 0.00 177.69 173.90 2yqg s ILE 13 N -4.37 3.73 0.44 -1.67 2.07 -1.26 -5.04 121.20 115.11 2yqg s ILE 13 Ca 0.47 1.00 0.07 0.00 -1.41 0.00 0.00 60.65 60.79 2yqg s ILE 13 Cb 0.40 -3.41 -0.03 0.00 0.13 0.00 0.00 42.46 39.55 2yqg s ILE 13 CO 0.02 -0.30 0.24 0.42 -1.91 0.00 0.00 174.94 173.41 2yqg s THR 14 N -2.09 2.17 0.38 4.00 -4.23 -1.26 -5.14 115.64 109.48 2yqg s THR 14 Ca 0.67 -1.62 -0.05 0.00 -1.18 0.00 0.00 61.69 59.51 2yqg s THR 14 Cb -0.17 -2.79 -0.05 0.00 1.34 0.00 0.00 72.50 70.83 2yqg s THR 14 CO 0.25 0.00 0.66 0.00 -0.54 0.00 0.00 174.62 175.00 2yqg s ALA 15 N -2.63 3.52 -0.30 3.99 0.00 -1.26 -5.02 121.76 120.06 2yqg s ALA 15 Ca 0.39 -0.54 -0.29 0.00 0.00 0.00 0.00 51.96 51.53 2yqg s ALA 15 Cb 0.01 -2.43 -0.02 0.00 0.00 0.00 0.00 23.12 20.69 2yqg s ALA 15 CO 0.22 -0.03 1.66 -1.25 0.00 0.00 0.00 175.76 176.36 2yqg s PRO 16 N -4.10 3.55 -0.09 0.00 0.04 -1.26 -4.88 135.00 128.25 2yqg s PRO 16 Ca 0.46 1.43 -0.29 0.00 0.04 0.00 0.00 61.00 62.63 2yqg s PRO 16 Cb -0.10 -4.11 -0.05 0.00 0.04 0.00 0.00 34.50 30.28 2yqg s PRO 16 CO 0.36 -1.60 1.64 0.08 0.04 0.00 0.00 177.00 177.52 2yqg s VAL 17 N 6.01 3.62 -0.54 -0.36 1.01 -1.21 -4.92 120.40 124.00 2yqg s VAL 17 Ca 0.74 0.74 0.04 0.00 0.00 0.00 0.00 61.98 63.49 2yqg s VAL 17 Cb -0.22 -3.51 0.14 0.00 0.00 0.00 0.00 36.38 32.79 2yqg s VAL 17 CO 0.32 -0.11 0.30 0.00 0.00 0.00 0.00 175.10 175.61 2yqg s ALA 18 N 4.33 3.28 0.61 5.51 0.00 -1.26 -1.46 121.76 132.76 2yqg s ALA 18 Ca 0.73 -3.30 0.00 0.00 0.00 0.00 0.00 51.96 49.39 2yqg s ALA 18 Cb -0.31 -2.13 0.06 0.00 0.00 0.00 0.00 23.12 20.74 2yqg s ALA 18 CO 0.29 -2.04 0.86 -0.51 0.00 0.00 0.00 175.76 174.36 2yqg s LEU 19 N -0.42 3.15 0.09 0.00 1.43 -1.23 -4.95 118.68 116.74 2yqg s LEU 19 Ca 0.18 -0.11 0.05 0.00 -1.03 0.00 0.00 54.13 53.23 2yqg s LEU 19 Cb -0.22 -2.59 -0.04 0.00 0.03 0.00 0.00 46.19 43.37 2yqg s LEU 19 CO -0.03 -1.40 -0.02 -0.60 0.23 0.00 0.00 176.35 174.54 2yqg s ARG 20 N -4.91 2.48 0.13 1.70 3.52 -1.26 -2.40 118.95 118.21 2yqg s ARG 20 Ca 0.60 -0.86 0.02 0.00 -0.13 0.00 0.00 55.73 55.36 2yqg s ARG 20 Cb -0.09 -2.50 -0.04 0.00 -1.56 0.00 0.00 34.95 30.76 2yqg s ARG 20 CO 0.41 0.54 0.25 -1.83 -0.81 0.00 0.00 175.30 173.86 2yqg s GLU 21 N -2.24 3.39 0.00 5.12 1.03 -1.26 -4.73 118.70 120.00 2yqg s GLU 21 Ca 0.25 -0.58 0.00 0.00 0.03 0.00 0.00 54.97 54.66 2yqg s GLU 21 Cb -0.12 -2.96 0.00 0.00 -0.80 0.00 0.00 34.13 30.26 2yqg s GLU 21 CO 0.17 0.54 0.00 0.41 -1.33 0.00 0.00 175.26 175.05 2yqg n GLY 22 N -0.32 2.04 3.99 -3.83 0.00 -1.20 -4.57 105.19 101.31 2yqg n GLY 22 Ca -0.07 -0.56 -0.21 0.00 0.00 0.00 0.00 46.02 45.19 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 0.00 2.25 -0.21 1.61 2.02 -1.26 -4.92 118.70 118.20 2yqg s GLU 23 Ca 0.00 -1.09 -0.28 0.00 0.02 0.00 0.00 54.97 53.63 2yqg s GLU 23 Cb 0.00 -2.49 0.00 0.00 0.10 0.00 0.00 34.13 31.74 2yqg s GLU 23 CO 0.00 -0.93 0.97 0.34 0.02 0.00 0.00 175.26 175.66 2yqg s ASP 24 N -4.56 7.05 -0.76 -0.19 2.15 -1.26 -4.62 116.67 114.48 2yqg s ASP 24 Ca 0.61 1.30 -0.02 0.00 0.43 0.00 0.00 52.55 54.87 2yqg s ASP 24 Cb -0.08 -2.51 0.39 0.00 -0.30 0.00 0.00 42.92 40.42 2yqg s ASP 24 CO 0.40 -0.57 2.00 0.18 -0.17 0.00 0.00 175.17 177.00 2yqg n LEU 25 N 5.94 7.51 -1.76 -1.34 4.32 -1.26 -4.67 117.00 125.73 2yqg n LEU 25 Ca 0.09 -4.63 -0.15 0.00 -0.02 0.00 0.00 56.01 51.30 2yqg n LEU 25 Cb 0.47 -1.01 0.08 0.00 -1.62 0.00 0.00 43.42 41.34 2yqg n LEU 25 CO 0.51 1.66 1.03 -1.54 -1.22 0.00 0.00 177.39 177.83 2yqg n SER 26 N -0.69 4.45 0.00 -1.43 3.41 -1.26 -3.94 113.62 114.17 2yqg n SER 26 Ca 0.57 -2.97 0.00 0.00 -0.26 0.00 0.00 58.87 56.21 2yqg n SER 26 Cb 0.42 -0.80 0.00 0.00 -0.26 0.00 0.00 64.21 63.57 2yqg n SER 26 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2yqg n LYS 27 N -0.21 0.00 -0.11 4.33 3.00 -1.26 -4.81 118.16 119.11 2yqg n LYS 27 Ca 0.33 0.00 -0.05 0.00 -0.00 0.00 0.00 58.31 58.59 2yqg n LYS 27 Cb 0.96 -0.76 0.02 0.00 0.00 0.00 0.00 35.03 35.25 2yqg n LYS 27 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 2yqg h LYS 28 N 0.00 0.07 -4.55 1.64 6.56 -1.95 -3.43 116.57 114.90 2yqg h LYS 28 Ca 0.00 -0.00 -0.45 0.00 -1.06 0.00 0.00 60.65 59.14 2yqg h LYS 28 Cb 0.71 -0.02 0.14 0.00 -0.57 0.00 0.00 32.23 32.50 2yqg h LYS 28 CO 0.00 0.05 -0.94 0.09 -2.06 0.00 0.00 179.45 176.58 2yqg n ASN 29 N -5.21 -3.01 -4.77 0.86 3.02 -1.26 -4.59 115.26 100.30 2yqg n ASN 29 Ca 0.02 0.45 -0.40 0.00 -0.03 0.00 0.00 54.58 54.62 2yqg n ASN 29 Cb 0.19 -0.64 -0.03 0.00 -0.61 0.00 0.00 39.78 38.70 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 -0.86 4.40 -0.12 3.52 0.04 -1.26 -5.09 135.00 135.62 2yqg s PRO 30 Ca 0.42 2.04 0.18 0.00 0.04 0.00 0.00 61.00 63.67 2yqg s PRO 30 Cb -0.35 -3.05 -0.25 0.00 0.04 0.00 0.00 34.50 30.89 2yqg s PRO 30 CO 0.52 -0.08 0.29 0.44 0.04 0.00 0.00 177.00 178.21 2yqg n ILE 31 N 0.81 1.14 -4.87 0.56 -5.35 -1.09 -4.93 119.36 105.63 2yqg n ILE 31 Ca 0.00 -0.77 -0.27 0.00 -0.27 0.00 0.00 62.75 61.45 2yqg n ILE 31 Cb 0.43 -0.47 -0.16 0.00 -1.74 0.00 0.00 39.64 37.70 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 -2.74 1.60 -0.21 -1.28 0.00 -1.26 -5.05 121.76 112.82 2yqg s ALA 32 Ca -0.08 -0.70 -0.03 0.00 0.00 0.00 0.00 51.96 51.15 2yqg s ALA 32 Cb 0.08 -0.57 0.06 0.00 0.00 0.00 0.00 23.12 22.70 2yqg s ALA 32 CO 0.84 0.26 0.04 0.15 0.00 0.00 0.00 175.76 177.05 2yqg s LYS 33 N 0.17 0.69 -0.09 0.00 3.01 -1.26 -3.87 119.74 118.40 2yqg s LYS 33 Ca -0.08 -0.51 0.03 0.00 -1.01 0.00 0.00 55.97 54.40 2yqg s LYS 33 Cb -0.13 -2.10 -0.02 0.00 -1.01 0.00 0.00 37.83 34.58 2yqg s LYS 33 CO 0.03 -0.68 -0.17 0.96 0.51 0.00 0.00 175.35 176.00 2yqg s ILE 34 N 1.82 2.72 -0.32 2.17 -4.36 -1.26 -5.09 121.20 116.88 2yqg s ILE 34 Ca 0.00 -0.81 -0.01 0.00 -0.26 0.00 0.00 60.65 59.57 2yqg s ILE 34 Cb -0.17 -2.08 0.11 0.00 1.25 0.00 0.00 42.46 41.56 2yqg s ILE 34 CO -0.10 0.56 0.12 -1.00 0.24 0.00 0.00 174.94 174.76 2yqg s HIS 35 N -0.07 1.42 0.28 1.37 3.76 -1.26 -5.01 115.29 115.78 2yqg s HIS 35 Ca -0.04 -1.64 -0.27 0.00 -0.15 0.00 0.00 55.06 52.96 2yqg s HIS 35 Cb -0.14 -1.54 -0.15 0.00 1.11 0.00 0.00 32.58 31.87 2yqg s HIS 35 CO 0.04 -0.86 0.84 0.45 -0.85 0.00 0.00 174.74 174.36 2yqg n SER 36 N 4.75 0.44 0.23 1.40 2.88 -1.26 -4.92 113.62 117.15 2yqg n SER 36 Ca -0.01 1.14 -0.12 0.00 -1.33 0.00 0.00 58.87 58.55 2yqg n SER 36 Cb 0.41 -1.19 -0.06 0.00 -0.75 0.00 0.00 64.21 62.62 2yqg n SER 36 CO 0.00 0.00 0.00 -2.24 -1.23 0.00 0.00 175.04 171.57 2yqg h ASP 37 N 1.61 -0.54 -0.64 -3.46 2.03 -2.00 -3.25 116.42 110.16 2yqg h ASP 37 Ca -0.37 -0.06 0.13 0.00 -0.73 0.00 0.00 57.03 56.01 2yqg h ASP 37 Cb 1.37 0.14 -0.10 0.00 -0.83 0.00 0.00 39.33 39.91 2yqg h ASP 37 CO 0.59 -0.13 0.09 -0.07 -1.03 0.00 0.00 179.24 178.69 2yqg h LEU 38 N -1.07 -0.11 -0.91 0.15 3.38 -1.97 0.32 115.31 115.11 2yqg h LEU 38 Ca -0.06 0.14 0.21 0.00 0.09 0.00 0.00 57.88 58.25 2yqg h LEU 38 Cb 0.56 0.21 -0.17 0.00 0.09 0.00 0.00 40.66 41.36 2yqg h LEU 38 CO 0.11 -0.05 -0.10 0.00 0.09 0.00 0.00 178.44 178.48 2yqg h ALA 39 N 1.55 0.82 0.00 1.53 0.00 -1.76 0.51 119.26 121.91 2yqg h ALA 39 Ca 0.35 0.33 0.00 0.00 0.00 0.00 0.00 54.91 55.58 2yqg h ALA 39 Cb 0.56 0.61 0.00 0.00 0.00 0.00 0.00 17.79 18.95 2yqg h ALA 39 CO -0.48 -0.45 -0.24 0.93 0.00 0.00 0.00 179.25 179.00 2yqg h GLU 40 N 0.02 0.00 -0.72 0.00 5.08 -1.23 -0.40 114.58 117.33 2yqg h GLU 40 Ca 0.48 0.00 0.09 0.00 -1.00 0.00 0.00 59.36 58.93 2yqg h GLU 40 Cb 0.86 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.01 2yqg h GLU 40 CO -0.88 0.00 -0.35 0.39 -1.00 0.00 0.00 179.01 177.17 2yqg n GLU 41 N -4.55 -0.24 -0.05 2.33 -0.58 0.10 -3.10 120.64 114.56 2yqg n GLU 41 Ca -0.03 1.10 -0.03 0.00 -0.42 0.00 0.00 57.16 57.78 2yqg n GLU 41 Cb 0.13 -1.63 -0.01 0.00 -0.57 0.00 0.00 31.44 29.35 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 -4.99 0.29 0.00 3.49 1.74 0.15 -5.06 116.66 112.28 2yqg n ARG 42 Ca 0.05 0.39 0.00 0.00 -0.77 0.00 0.00 57.85 57.52 2yqg n ARG 42 Cb 0.24 -1.31 0.00 0.00 -1.02 0.00 0.00 32.46 30.37 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 1.64 0.33 3.76 -0.13 0.00 -0.40 -5.05 105.19 105.34 2yqg n GLY 43 Ca -0.05 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.72 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 3.63 -1.05 0.99 1.43 -0.30 -4.99 118.68 118.39 2yqg s LEU 44 Ca 0.00 -0.28 -0.14 0.00 -1.03 0.00 0.00 54.13 52.68 2yqg s LEU 44 Cb 0.00 -2.22 0.19 0.00 0.03 0.00 0.00 46.19 44.19 2yqg s LEU 44 CO 0.00 0.04 1.16 -0.75 0.23 0.00 0.00 176.35 177.03 2yqg s LYS 45 N -3.30 3.90 0.30 1.70 2.20 -1.26 -4.37 119.74 118.91 2yqg s LYS 45 Ca 0.31 -2.49 -0.29 0.00 -0.36 0.00 0.00 55.97 53.14 2yqg s LYS 45 Cb -0.09 -4.80 -0.10 0.00 -1.51 0.00 0.00 37.83 31.34 2yqg s LYS 45 CO 0.22 -1.57 1.16 0.42 -0.36 0.00 0.00 175.35 175.23 2yqg s ILE 46 N 0.98 3.26 0.02 5.43 -1.09 -1.26 -4.40 121.20 124.13 2yqg s ILE 46 Ca 0.33 1.25 -0.08 0.00 -2.23 0.00 0.00 60.65 59.92 2yqg s ILE 46 Cb -0.06 -3.79 -0.05 0.00 -1.58 0.00 0.00 42.46 36.98 2yqg s ILE 46 CO -0.06 0.28 0.30 -0.89 -1.23 0.00 0.00 174.94 173.34 2yqg s THR 47 N -1.18 5.25 0.17 2.92 2.01 0.91 -4.94 115.64 120.79 2yqg s THR 47 Ca 0.47 0.26 0.06 0.00 0.31 0.00 0.00 61.69 62.79 2yqg s THR 47 Cb -0.34 -3.58 -0.04 0.00 0.01 0.00 0.00 72.50 68.55 2yqg s THR 47 CO 0.44 0.37 0.07 -0.31 -0.69 0.00 0.00 174.62 174.50 2yqg s TYR 48 N -1.29 3.00 -0.29 4.92 2.02 -1.26 -0.81 117.35 123.63 2yqg s TYR 48 Ca 0.28 -0.08 -0.14 0.00 -0.37 0.00 0.00 57.07 56.76 2yqg s TYR 48 Cb -0.13 -1.44 0.12 0.00 -0.40 0.00 0.00 41.96 40.10 2yqg s TYR 48 CO 0.16 0.52 0.78 0.21 -1.57 0.00 0.00 175.55 175.65 2yqg s LYS 49 N -3.07 0.55 -0.65 -0.62 2.20 -0.67 -4.66 119.74 112.82 2yqg s LYS 49 Ca 0.29 1.10 -0.04 0.00 -0.36 0.00 0.00 55.97 56.97 2yqg s LYS 49 Cb -0.10 0.36 0.17 0.00 -1.51 0.00 0.00 37.83 36.75 2yqg s LYS 49 CO 0.21 -0.14 0.48 0.71 -0.36 0.00 0.00 175.35 176.25 2yqg s TYR 50 N 2.01 3.44 0.45 4.03 1.51 -1.26 -0.24 117.35 127.28 2yqg s TYR 50 Ca -0.08 -2.66 -0.22 0.00 -1.01 0.00 0.00 57.07 53.10 2yqg s TYR 50 Cb -0.07 -3.26 -0.09 0.00 -0.11 0.00 0.00 41.96 38.44 2yqg s TYR 50 CO -0.18 -0.85 1.02 0.99 -1.11 0.00 0.00 175.55 175.42 2yqg s THR 51 N -0.10 3.90 -4.26 -0.71 2.01 -1.18 -4.53 115.64 110.77 2yqg s THR 51 Ca 0.17 1.27 0.00 0.00 0.31 0.00 0.00 61.69 63.44 2yqg s THR 51 Cb -0.19 -3.56 0.00 0.00 0.01 0.00 0.00 72.50 68.76 2yqg s THR 51 CO -0.04 -0.18 0.00 0.61 -0.69 0.00 0.00 174.62 174.32 2yqg n GLY 52 N -0.14 0.96 3.75 4.40 0.00 -1.26 -2.75 105.19 110.15 2yqg n GLY 52 Ca 0.07 -1.99 -0.40 0.00 0.00 0.00 0.00 46.02 43.70 2yqg n GLY 52 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2yqg s LYS 53 N -1.24 4.64 0.00 1.61 2.20 -1.26 -0.23 119.74 125.46 2yqg s LYS 53 Ca 0.00 1.77 0.00 0.00 -0.36 0.00 0.00 55.97 57.38 2yqg s LYS 53 Cb 0.00 -3.21 0.00 0.00 -1.51 0.00 0.00 37.83 33.11 2yqg s LYS 53 CO 0.00 0.20 0.00 0.41 -0.36 0.00 0.00 175.35 175.60 2yqg n GLY 54 N 1.40 3.16 0.33 5.54 0.00 0.05 -4.77 105.19 110.90 2yqg n GLY 54 Ca -0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 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 -0.95 0.86 0.00 -0.61 5.41 -1.20 -1.47 119.36 121.39 2yqg n ILE 55 Ca 0.00 -0.26 0.00 0.00 1.00 0.00 0.00 62.75 63.49 2yqg n ILE 55 Cb 0.00 -1.43 0.00 0.00 -0.71 0.00 0.00 39.64 37.50 2yqg n ILE 55 CO 0.00 0.00 0.00 1.07 0.00 0.00 0.00 176.55 177.62 2yqg n THR 56 N -3.38 0.00 -3.02 1.39 5.66 -0.79 -4.50 114.28 109.63 2yqg n THR 56 Ca -0.29 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.37 2yqg n THR 56 Cb 0.74 -0.22 -0.06 0.00 -1.55 0.00 0.00 70.33 69.24 2yqg n THR 56 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 2yqg s GLU 57 N -1.39 4.16 0.19 1.09 2.02 0.68 -4.75 118.70 120.70 2yqg s GLU 57 Ca 0.00 0.88 -0.30 0.00 0.02 0.00 0.00 54.97 55.56 2yqg s GLU 57 Cb 0.00 -2.51 -0.09 0.00 0.10 0.00 0.00 34.13 31.64 2yqg s GLU 57 CO 0.00 0.18 1.31 -1.25 0.02 0.00 0.00 175.26 175.52 2yqg s PRO 58 N -2.72 4.38 0.33 0.39 0.04 -1.26 -1.91 135.00 134.25 2yqg s PRO 58 Ca 0.53 2.04 -0.28 0.00 0.04 0.00 0.00 61.00 63.33 2yqg s PRO 58 Cb -0.12 -3.21 -0.10 0.00 0.04 0.00 0.00 34.50 31.12 2yqg s PRO 58 CO 0.18 -0.27 1.22 -1.25 0.04 0.00 0.00 177.00 176.92 2yqg s PRO 59 N 0.04 4.38 0.06 0.56 0.04 -1.26 -4.79 135.00 134.03 2yqg s PRO 59 Ca 0.57 2.03 0.08 0.00 0.04 0.00 0.00 61.00 63.72 2yqg s PRO 59 Cb -0.36 -3.03 -0.03 0.00 0.04 0.00 0.00 34.50 31.12 2yqg s PRO 59 CO 0.37 -0.10 -0.18 -0.59 0.04 0.00 0.00 177.00 176.54 2yqg s PHE 60 N -1.20 2.54 0.00 0.56 -0.12 -1.14 -0.77 117.98 117.85 2yqg s PHE 60 Ca 0.49 -0.26 0.00 0.00 -0.05 0.00 0.00 56.93 57.11 2yqg s PHE 60 Cb -0.36 -1.42 0.00 0.00 -0.63 0.00 0.00 43.02 40.61 2yqg s PHE 60 CO 0.47 0.29 0.00 0.41 -0.05 0.00 0.00 175.22 176.34 2yqg n GLY 61 N 1.33 0.82 0.03 1.99 0.00 -1.18 -4.99 105.19 103.19 2yqg n GLY 61 Ca -0.16 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.82 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 0.00 0.40 -4.25 -0.61 5.41 -0.54 -4.95 119.36 114.82 2yqg n ILE 62 Ca 0.00 -0.19 -0.25 0.00 1.00 0.00 0.00 62.75 63.31 2yqg n ILE 62 Cb 0.00 -0.79 -0.08 0.00 -0.71 0.00 0.00 39.64 38.06 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 -2.14 2.59 -0.02 1.39 0.08 -1.08 -0.28 117.98 118.52 2yqg s PHE 63 Ca -0.07 -0.58 -0.01 0.00 0.12 0.00 0.00 56.93 56.38 2yqg s PHE 63 Cb 0.02 -1.86 0.01 0.00 -0.57 0.00 0.00 43.02 40.62 2yqg s PHE 63 CO 0.19 0.27 0.05 0.14 -0.10 0.00 0.00 175.22 175.78 2yqg s VAL 64 N -2.61 -0.01 0.25 -0.44 -7.23 0.12 -4.84 120.40 105.64 2yqg s VAL 64 Ca 0.39 0.05 -0.22 0.00 -1.81 0.00 0.00 61.98 60.39 2yqg s VAL 64 Cb 0.04 -0.09 0.03 0.00 0.56 0.00 0.00 36.38 36.93 2yqg s VAL 64 CO 0.21 0.02 0.75 0.72 -0.31 0.00 0.00 175.10 176.49 2yqg s PHE 65 N 0.27 -0.21 0.25 2.82 -0.12 -1.26 -1.22 117.98 118.52 2yqg s PHE 65 Ca -0.02 -0.21 -0.09 0.00 -0.05 0.00 0.00 56.93 56.57 2yqg s PHE 65 Cb -0.03 0.69 -0.01 0.00 -0.63 0.00 0.00 43.02 43.03 2yqg s PHE 65 CO -0.01 -1.14 0.41 -0.80 -0.05 0.00 0.00 175.22 173.63 2yqg s ASN 66 N -2.91 0.12 -0.00 1.98 0.01 -1.25 -4.99 114.94 107.90 2yqg s ASN 66 Ca 0.10 -1.12 0.22 0.00 -0.71 0.00 0.00 52.86 51.35 2yqg s ASN 66 Cb -0.05 0.56 -0.24 0.00 0.41 0.00 0.00 41.25 41.93 2yqg s ASN 66 CO 0.05 -1.11 0.72 2.29 -1.51 0.00 0.00 177.10 177.54 2yqg n LYS 67 N -0.39 0.38 0.03 -0.60 0.00 -1.26 -2.32 118.16 114.00 2yqg n LYS 67 Ca -0.00 -0.09 -0.21 0.00 -0.00 0.00 0.00 58.31 58.00 2yqg n LYS 67 Cb 0.63 -1.53 -0.14 0.00 -0.00 0.00 0.00 35.03 33.98 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 0.44 0.12 -5.58 3.58 -1.97 -3.39 116.42 109.62 2yqg h ASP 68 Ca 0.00 -0.90 -0.35 0.00 0.42 0.00 0.00 57.03 56.20 2yqg h ASP 68 Cb 0.79 -0.14 -0.06 0.00 1.72 0.00 0.00 39.33 41.64 2yqg h ASP 68 CO 0.00 1.51 -2.22 0.35 -2.88 0.00 0.00 179.24 176.01 2yqg n THR 69 N -4.02 1.48 -3.31 2.25 -2.24 -1.26 -5.01 114.28 102.17 2yqg n THR 69 Ca -0.19 -0.79 -0.17 0.00 -2.27 0.00 0.00 64.05 60.62 2yqg n THR 69 Cb 0.87 -0.83 0.07 0.00 -2.10 0.00 0.00 70.33 68.33 2yqg n THR 69 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yqg n GLY 70 N 1.80 -0.24 3.34 3.38 0.00 -0.98 -5.01 105.19 107.47 2yqg n GLY 70 Ca -0.31 0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 2yqg n GLY 70 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2yqg s GLU 71 N -5.75 3.18 -0.27 1.61 2.12 -1.26 -4.58 118.70 113.76 2yqg s GLU 71 Ca 0.32 -0.75 -0.08 0.00 0.36 0.00 0.00 54.97 54.82 2yqg s GLU 71 Cb -0.14 -2.50 -0.03 0.00 0.26 0.00 0.00 34.13 31.72 2yqg s GLU 71 CO 0.59 0.25 0.11 -1.17 -0.54 0.00 0.00 175.26 174.49 2yqg s LEU 72 N 0.23 3.68 -0.01 2.70 2.96 -1.25 -3.97 118.68 123.02 2yqg s LEU 72 Ca -0.11 -0.26 0.02 0.00 -0.22 0.00 0.00 54.13 53.56 2yqg s LEU 72 Cb -0.16 -1.97 -0.00 0.00 0.50 0.00 0.00 46.19 44.56 2yqg s LEU 72 CO 0.06 -0.08 -0.07 0.21 -1.32 0.00 0.00 176.35 175.15 2yqg s ASN 73 N 1.63 0.89 -0.18 3.68 3.84 -0.35 -2.68 114.94 121.77 2yqg s ASN 73 Ca 0.06 -0.14 -0.15 0.00 0.21 0.00 0.00 52.86 52.84 2yqg s ASN 73 Cb -0.16 -0.12 -0.04 0.00 -0.55 0.00 0.00 41.25 40.38 2yqg s ASN 73 CO 0.05 0.09 0.36 0.54 -2.79 0.00 0.00 177.10 175.35 2yqg s VAL 74 N -0.12 5.24 -0.48 -5.21 0.11 -1.26 0.13 120.40 118.81 2yqg s VAL 74 Ca 0.02 0.66 0.03 0.00 -2.93 0.00 0.00 61.98 59.76 2yqg s VAL 74 Cb -0.04 -3.70 0.45 0.00 -1.53 0.00 0.00 36.38 31.57 2yqg s VAL 74 CO -0.00 0.31 1.59 0.35 -3.33 0.00 0.00 175.10 174.01 2yqg n THR 75 N 3.99 3.04 -3.53 5.04 -2.24 0.62 -4.32 114.28 116.88 2yqg n THR 75 Ca -0.10 -3.69 -0.13 0.00 -2.27 0.00 0.00 64.05 57.86 2yqg n THR 75 Cb 0.51 -1.16 -0.05 0.00 -2.10 0.00 0.00 70.33 67.54 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 -2.74 -0.50 -0.32 3.42 0.01 -1.22 -4.91 113.70 107.44 2yqg s SER 76 Ca 0.57 0.46 -0.26 0.00 1.31 0.00 0.00 55.95 58.03 2yqg s SER 76 Cb 0.45 0.43 0.01 0.00 0.21 0.00 0.00 66.02 67.12 2yqg s SER 76 CO -0.01 -0.53 0.91 -0.63 0.41 0.00 0.00 173.24 173.39 2yqg s ILE 77 N -1.57 4.67 0.61 1.44 1.01 -1.26 -4.68 121.20 121.42 2yqg s ILE 77 Ca -0.05 1.40 -0.19 0.00 0.00 0.00 0.00 60.65 61.81 2yqg s ILE 77 Cb -0.00 -4.27 -0.02 0.00 0.01 0.00 0.00 42.46 38.18 2yqg s ILE 77 CO 0.03 -0.36 1.31 -0.76 0.00 0.00 0.00 174.94 175.15 2yqg s LEU 78 N 3.26 3.67 -0.01 2.97 1.43 -1.26 -4.88 118.68 123.86 2yqg s LEU 78 Ca 0.38 2.65 -0.00 0.00 -1.03 0.00 0.00 54.13 56.13 2yqg s LEU 78 Cb -0.13 -4.51 0.02 0.00 0.03 0.00 0.00 46.19 41.60 2yqg s LEU 78 CO 0.14 -1.83 0.02 -0.62 0.23 0.00 0.00 176.35 174.28 2yqg s ASP 79 N -1.27 0.04 -0.04 2.29 -1.08 -1.26 -3.21 116.67 112.14 2yqg s ASP 79 Ca 0.79 0.02 -0.18 0.00 -0.52 0.00 0.00 52.55 52.67 2yqg s ASP 79 Cb -0.38 -0.04 -0.11 0.00 -1.46 0.00 0.00 42.92 40.93 2yqg s ASP 79 CO 0.42 -0.07 0.74 -0.09 0.52 0.00 0.00 175.17 176.68 2yqg h ARG 80 N 6.79 -0.41 -0.81 4.34 2.43 -1.84 -1.68 114.38 123.20 2yqg h ARG 80 Ca -0.36 0.03 0.20 0.00 -0.81 0.00 0.00 59.98 59.03 2yqg h ARG 80 Cb 1.16 0.09 -0.13 0.00 -0.42 0.00 0.00 29.97 30.67 2yqg h ARG 80 CO 0.49 -0.15 0.14 1.05 -1.51 0.00 0.00 179.97 180.00 2yqg h GLU 81 N -1.03 0.18 0.18 0.20 4.11 -1.97 -2.76 114.58 113.49 2yqg h GLU 81 Ca -0.04 -0.01 -0.01 0.00 0.07 0.00 0.00 59.36 59.37 2yqg h GLU 81 Cb 0.46 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2yqg h GLU 81 CO 0.07 0.12 -0.09 1.49 0.07 0.00 0.00 179.01 180.68 2yqg h GLU 82 N 0.19 -0.23 -4.70 1.06 4.57 -2.00 -3.45 114.58 110.02 2yqg h GLU 82 Ca 0.47 0.02 -0.57 0.00 -1.18 0.00 0.00 59.36 58.10 2yqg h GLU 82 Cb 0.88 0.05 -0.34 0.00 -0.16 0.00 0.00 28.75 29.18 2yqg h GLU 82 CO -0.63 -0.15 -0.83 0.95 -1.18 0.00 0.00 179.01 177.17 2yqg s THR 83 N -2.89 1.42 0.19 0.32 -4.23 -0.63 -5.03 115.64 104.79 2yqg s THR 83 Ca -0.04 -0.61 -0.05 0.00 -1.18 0.00 0.00 61.69 59.82 2yqg s THR 83 Cb 0.00 -1.30 -0.02 0.00 1.34 0.00 0.00 72.50 72.52 2yqg s THR 83 CO 0.11 0.42 1.54 1.55 -0.54 0.00 0.00 174.62 177.70 2yqg h PRO 84 N 7.31 0.70 -2.91 3.99 0.13 -1.77 -3.35 132.00 136.09 2yqg h PRO 84 Ca -0.30 -0.37 0.05 0.00 -0.87 0.00 0.00 66.00 64.51 2yqg h PRO 84 Cb 1.18 0.01 -0.08 0.00 0.13 0.00 0.00 31.00 32.24 2yqg h PRO 84 CO 0.48 0.98 0.26 -0.59 -0.23 0.00 0.00 178.00 178.90 2yqg s PHE 85 N -4.28 -0.30 -0.43 1.56 -0.12 -1.26 -3.33 117.98 109.82 2yqg s PHE 85 Ca -0.09 -0.05 0.03 0.00 -0.05 0.00 0.00 56.93 56.78 2yqg s PHE 85 Cb 0.12 0.65 0.12 0.00 -0.63 0.00 0.00 43.02 43.28 2yqg s PHE 85 CO 0.85 -1.05 0.18 -0.06 -0.05 0.00 0.00 175.22 175.08 2yqg s PHE 86 N -3.78 3.04 -0.57 3.49 0.08 -1.20 -5.01 117.98 114.03 2yqg s PHE 86 Ca 0.08 -2.88 -0.28 0.00 0.12 0.00 0.00 56.93 53.97 2yqg s PHE 86 Cb -0.04 -2.61 0.01 0.00 -0.57 0.00 0.00 43.02 39.82 2yqg s PHE 86 CO -0.00 -0.82 1.42 -0.51 -0.10 0.00 0.00 175.22 175.20 2yqg s LEU 87 N 0.34 3.39 0.42 -0.37 1.43 -1.26 -3.28 118.68 119.36 2yqg s LEU 87 Ca 0.15 0.26 0.07 0.00 -1.03 0.00 0.00 54.13 53.58 2yqg s LEU 87 Cb -0.23 -3.03 -0.04 0.00 0.03 0.00 0.00 46.19 42.92 2yqg s LEU 87 CO -0.05 -1.73 0.22 -0.76 0.23 0.00 0.00 176.35 174.27 2yqg s LEU 88 N 6.10 3.12 -0.19 1.79 1.43 -0.88 -4.34 118.68 125.70 2yqg s LEU 88 Ca 0.52 -1.05 -0.05 0.00 -1.03 0.00 0.00 54.13 52.52 2yqg s LEU 88 Cb -0.11 -1.51 0.09 0.00 0.03 0.00 0.00 46.19 44.70 2yqg s LEU 88 CO 0.25 -0.61 0.36 -0.89 0.23 0.00 0.00 176.35 175.69 2yqg s THR 89 N -2.60 -0.56 -0.20 5.49 2.01 -1.11 -2.49 115.64 116.18 2yqg s THR 89 Ca 0.41 0.14 -0.29 0.00 0.31 0.00 0.00 61.69 62.26 2yqg s THR 89 Cb 0.02 -0.63 -0.01 0.00 0.01 0.00 0.00 72.50 71.89 2yqg s THR 89 CO 0.23 0.03 1.33 -0.83 -0.69 0.00 0.00 174.62 174.69 2yqg s GLY 90 N 2.53 1.53 -0.25 4.40 0.00 -0.94 -3.12 107.32 111.47 2yqg s GLY 90 Ca 0.02 0.38 -0.03 0.00 0.00 0.00 0.00 44.72 45.09 2yqg s GLY 90 CO -0.12 2.60 -0.03 -0.19 0.00 0.00 0.00 173.10 175.36 2yqg s TYR 91 N 3.93 3.04 -0.93 1.90 2.02 0.67 -2.85 117.35 125.12 2yqg s TYR 91 Ca 0.58 -1.22 -0.14 0.00 -0.37 0.00 0.00 57.07 55.92 2yqg s TYR 91 Cb -0.21 -2.11 0.21 0.00 -0.40 0.00 0.00 41.96 39.44 2yqg s TYR 91 CO 0.19 -0.63 0.96 0.00 -1.57 0.00 0.00 175.55 174.50 2yqg s ALA 92 N 1.42 4.06 0.23 3.71 0.00 -1.26 -1.67 121.76 128.24 2yqg s ALA 92 Ca 0.03 -3.32 -0.30 0.00 0.00 0.00 0.00 51.96 48.37 2yqg s ALA 92 Cb -0.16 -3.69 -0.09 0.00 0.00 0.00 0.00 23.12 19.19 2yqg s ALA 92 CO -0.03 -2.45 1.01 -0.51 0.00 0.00 0.00 175.76 173.79 2yqg s LEU 93 N 0.51 4.58 0.68 0.00 1.43 0.01 -3.60 118.68 122.29 2yqg s LEU 93 Ca 0.25 2.05 -0.09 0.00 -1.03 0.00 0.00 54.13 55.32 2yqg s LEU 93 Cb -0.08 -3.61 0.03 0.00 0.03 0.00 0.00 46.19 42.56 2yqg s LEU 93 CO -0.08 -0.01 1.03 -0.62 0.23 0.00 0.00 176.35 176.89 2yqg s ASP 94 N -0.80 5.21 0.32 2.29 2.15 -1.15 -0.06 116.67 124.62 2yqg s ASP 94 Ca 0.44 0.78 0.17 0.00 0.43 0.00 0.00 52.55 54.37 2yqg s ASP 94 Cb -0.28 -1.57 1.14 0.00 -0.30 0.00 0.00 42.92 41.92 2yqg s ASP 94 CO 0.35 -1.39 1.40 0.00 -0.17 0.00 0.00 175.17 175.36 2yqg n ALA 95 N -2.89 0.87 -0.06 3.66 0.00 -1.26 0.21 120.51 121.03 2yqg n ALA 95 Ca 0.07 0.91 -0.16 0.00 0.00 0.00 0.00 53.44 54.25 2yqg n ALA 95 Cb 0.59 -0.88 -0.06 0.00 0.00 0.00 0.00 19.45 19.10 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 0.85 0.00 0.00 3.08 -1.96 -3.48 114.38 112.87 2yqg h ARG 96 Ca 0.73 -0.61 0.00 0.00 0.07 0.00 0.00 59.98 60.17 2yqg h ARG 96 Cb 1.90 0.10 0.00 0.00 0.08 0.00 0.00 29.97 32.05 2yqg h ARG 96 CO -0.70 1.23 0.00 0.41 -1.07 0.00 0.00 179.97 179.84 2yqg n GLY 97 N 0.52 1.18 2.94 0.04 0.00 0.56 -5.13 105.19 105.30 2yqg n GLY 97 Ca -0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.70 2yqg n GLY 97 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2yqg s ASN 98 N -2.00 2.04 -0.85 1.61 0.01 -1.26 -4.78 114.94 109.72 2yqg s ASN 98 Ca 0.00 -0.30 -0.21 0.00 -0.71 0.00 0.00 52.86 51.64 2yqg s ASN 98 Cb 0.00 -0.83 -0.19 0.00 0.41 0.00 0.00 41.25 40.64 2yqg s ASN 98 CO 0.00 -0.07 2.34 -0.46 -1.51 0.00 0.00 177.10 177.39 2yqg n ASN 99 N 4.60 0.92 -0.01 -1.22 0.23 -1.26 -2.94 115.26 115.58 2yqg n ASN 99 Ca -0.16 -1.26 -0.18 0.00 -0.53 0.00 0.00 54.58 52.45 2yqg n ASN 99 Cb 0.50 -1.36 -0.08 0.00 -2.08 0.00 0.00 39.78 36.76 2yqg n ASN 99 CO 0.00 0.00 0.00 -0.37 -0.93 0.00 0.00 177.26 175.96 2yqg h VAL 100 N 7.50 1.29 -2.53 3.53 -1.51 -1.94 -3.45 116.25 119.13 2yqg h VAL 100 Ca 0.01 -2.01 -0.48 0.00 -1.23 0.00 0.00 66.70 62.99 2yqg h VAL 100 Cb 1.03 2.11 -0.00 0.00 -2.13 0.00 0.00 31.29 32.30 2yqg h VAL 100 CO 1.17 0.63 -0.33 -1.61 -1.23 0.00 0.00 177.57 176.20 2yqg s GLU 101 N -3.63 3.47 0.13 5.19 0.41 -1.26 -5.07 118.70 117.94 2yqg s GLU 101 Ca -0.11 -0.53 -0.30 0.00 -0.41 0.00 0.00 54.97 53.62 2yqg s GLU 101 Cb 0.08 -2.80 -0.07 0.00 -1.78 0.00 0.00 34.13 29.56 2yqg s GLU 101 CO 0.90 0.32 1.24 0.15 -0.49 0.00 0.00 175.26 177.38 2yqg s LYS 102 N -3.98 4.43 0.95 1.61 1.02 -1.26 -4.72 119.74 117.79 2yqg s LYS 102 Ca 0.37 1.89 -0.12 0.00 0.02 0.00 0.00 55.97 58.13 2yqg s LYS 102 Cb -0.10 -3.27 0.16 0.00 -0.52 0.00 0.00 37.83 34.10 2yqg s LYS 102 CO 0.32 -0.22 1.09 -1.25 -0.92 0.00 0.00 175.35 174.37 2yqg s PRO 103 N 0.45 0.81 -0.06 -1.68 0.04 -1.26 -4.94 135.00 128.37 2yqg s PRO 103 Ca 0.57 0.67 0.04 0.00 0.04 0.00 0.00 61.00 62.32 2yqg s PRO 103 Cb -0.33 -1.77 -0.02 0.00 0.04 0.00 0.00 34.50 32.42 2yqg s PRO 103 CO 0.33 -2.51 -0.18 -0.51 0.04 0.00 0.00 177.00 174.18 2yqg s LEU 104 N -6.35 2.50 -1.18 -3.56 1.43 -1.13 -4.94 118.68 105.44 2yqg s LEU 104 Ca 0.64 -0.32 -0.14 0.00 -1.03 0.00 0.00 54.13 53.28 2yqg s LEU 104 Cb -0.18 -1.50 0.17 0.00 0.03 0.00 0.00 46.19 44.71 2yqg s LEU 104 CO 0.57 0.29 1.40 -0.70 0.23 0.00 0.00 176.35 178.15 2yqg s GLU 105 N -0.41 4.06 0.06 1.70 2.12 -1.26 -2.21 118.70 122.76 2yqg s GLU 105 Ca 0.04 -2.54 -0.30 0.00 0.36 0.00 0.00 54.97 52.53 2yqg s GLU 105 Cb -0.12 -5.04 -0.05 0.00 0.26 0.00 0.00 34.13 29.18 2yqg s GLU 105 CO 0.02 -1.75 1.12 -1.17 -0.54 0.00 0.00 175.26 172.93 2yqg s LEU 106 N 1.59 4.39 -0.29 2.70 2.96 -1.04 -4.99 118.68 124.01 2yqg s LEU 106 Ca 0.42 1.92 0.02 0.00 -0.22 0.00 0.00 54.13 56.27 2yqg s LEU 106 Cb -0.03 -3.58 0.08 0.00 0.50 0.00 0.00 46.19 43.16 2yqg s LEU 106 CO -0.01 -0.36 0.01 -0.60 -1.32 0.00 0.00 176.35 174.07 2yqg s ARG 107 N 0.80 1.39 -1.06 1.98 3.52 -1.26 -2.08 118.95 122.23 2yqg s ARG 107 Ca 0.55 -1.31 -0.18 0.00 -0.13 0.00 0.00 55.73 54.66 2yqg s ARG 107 Cb -0.27 -2.66 0.13 0.00 -1.56 0.00 0.00 34.95 30.59 2yqg s ARG 107 CO 0.30 -0.80 1.31 0.42 -0.81 0.00 0.00 175.30 175.72 2yqg s ILE 108 N 1.28 4.66 -0.15 4.11 1.01 -1.21 -3.35 121.20 127.55 2yqg s ILE 108 Ca 0.03 -1.82 -0.29 0.00 0.00 0.00 0.00 60.65 58.57 2yqg s ILE 108 Cb -0.19 -4.89 -0.05 0.00 0.01 0.00 0.00 42.46 37.34 2yqg s ILE 108 CO -0.11 -1.64 1.93 -0.75 0.00 0.00 0.00 174.94 174.36 2yqg s LYS 109 N 2.78 3.64 -0.49 2.79 2.20 -0.53 -3.23 119.74 126.90 2yqg s LYS 109 Ca 0.39 2.04 -0.29 0.00 -0.36 0.00 0.00 55.97 57.76 2yqg s LYS 109 Cb -0.03 -4.19 0.03 0.00 -1.51 0.00 0.00 37.83 32.13 2yqg s LYS 109 CO -0.05 -1.50 1.14 0.08 -0.36 0.00 0.00 175.35 174.65 2yqg s VAL 110 N 6.13 4.19 0.61 4.02 1.01 -1.21 -3.56 120.40 131.60 2yqg s VAL 110 Ca 0.86 1.16 -0.10 0.00 0.00 0.00 0.00 61.98 63.90 2yqg s VAL 110 Cb -0.32 -4.62 0.15 0.00 0.00 0.00 0.00 36.38 31.59 2yqg s VAL 110 CO 0.35 -1.05 0.57 0.18 0.00 0.00 0.00 175.10 175.15 2yqg n LEU 111 N 7.89 0.00 -4.50 3.92 4.77 -1.01 -4.93 117.00 123.15 2yqg n LEU 111 Ca 0.11 -0.61 -0.24 0.00 -0.03 0.00 0.00 56.01 55.24 2yqg n LEU 111 Cb 0.49 -0.52 -0.11 0.00 -2.33 0.00 0.00 43.42 40.96 2yqg n LEU 111 CO 0.72 -1.53 -0.33 -0.62 -1.33 0.00 0.00 177.39 174.30 2yqg s ASP 112 N -3.07 3.07 0.18 -1.43 2.15 -1.26 -4.23 116.67 112.07 2yqg s ASP 112 Ca 0.37 -1.28 -0.12 0.00 0.43 0.00 0.00 52.55 51.95 2yqg s ASP 112 Cb -0.03 -0.23 0.10 0.00 -0.30 0.00 0.00 42.92 42.46 2yqg s ASP 112 CO 0.28 -0.41 1.79 -0.29 -0.17 0.00 0.00 175.17 176.36 2yqg h ILE 113 N 2.08 1.21 -0.71 4.11 6.09 -1.99 -2.55 117.51 125.75 2yqg h ILE 113 Ca -0.41 -0.54 -0.47 0.00 -1.37 0.00 0.00 64.86 62.07 2yqg h ILE 113 Cb 1.24 0.41 -0.21 0.00 0.47 0.00 0.00 36.82 38.73 2yqg h ILE 113 CO 0.72 0.23 0.61 0.59 -3.07 0.00 0.00 178.15 177.22 2yqg n ASN 114 N -4.53 6.61 -4.72 2.19 4.13 -1.26 -4.95 115.26 112.73 2yqg n ASN 114 Ca 0.04 -3.36 -0.42 0.00 1.68 0.00 0.00 54.58 52.53 2yqg n ASN 114 Cb 0.10 -0.99 -0.04 0.00 -1.54 0.00 0.00 39.78 37.31 2yqg n ASN 114 CO 0.00 0.00 0.00 -0.62 0.28 0.00 0.00 177.26 176.92 2yqg s ASP 115 N -0.71 7.41 -0.16 6.41 -1.08 -0.96 -4.95 116.67 122.64 2yqg s ASP 115 Ca 0.45 1.75 0.18 0.00 -0.52 0.00 0.00 52.55 54.41 2yqg s ASP 115 Cb 0.36 -2.58 0.44 0.00 -1.46 0.00 0.00 42.92 39.68 2yqg s ASP 115 CO 0.00 -0.18 1.18 -3.20 0.52 0.00 0.00 175.17 173.50 2yqg n ASN 116 N 3.33 1.92 -4.49 -0.34 5.15 -1.26 -5.01 115.26 114.56 2yqg n ASN 116 Ca 0.04 -2.88 -0.41 0.00 -0.60 0.00 0.00 54.58 50.72 2yqg n ASN 116 Cb 0.50 -0.41 -0.10 0.00 -0.53 0.00 0.00 39.78 39.23 2yqg n ASN 116 CO 0.00 0.00 0.00 -1.61 1.40 0.00 0.00 177.26 177.05 2yqg s GLU 117 N -2.24 3.24 1.08 1.20 0.41 -1.26 -5.08 118.70 116.05 2yqg s GLU 117 Ca 0.37 -0.83 -0.15 0.00 -0.41 0.00 0.00 54.97 53.95 2yqg s GLU 117 Cb 0.37 -3.86 0.23 0.00 -1.78 0.00 0.00 34.13 29.09 2yqg s GLU 117 CO -0.08 -0.58 1.10 -1.25 -0.49 0.00 0.00 175.26 173.95 2yqg s PRO 118 N 1.69 -0.25 0.17 0.39 0.04 -1.26 -5.04 135.00 130.75 2yqg s PRO 118 Ca 0.05 0.28 -0.10 0.00 0.04 0.00 0.00 61.00 61.27 2yqg s PRO 118 Cb -0.18 -1.68 -0.07 0.00 0.04 0.00 0.00 34.50 32.61 2yqg s PRO 118 CO 0.10 -3.14 0.51 0.54 0.04 0.00 0.00 177.00 175.05 2yqg s VAL 119 N -2.98 4.97 -1.59 -0.36 0.11 -1.26 -4.29 120.40 114.99 2yqg s VAL 119 Ca 0.67 0.50 -0.03 0.00 -2.93 0.00 0.00 61.98 60.20 2yqg s VAL 119 Cb -0.15 -3.65 0.03 0.00 -1.53 0.00 0.00 36.38 31.08 2yqg s VAL 119 CO 0.57 0.08 0.10 0.49 -3.33 0.00 0.00 175.10 173.01 2yqg n PHE 120 N 0.29 -1.26 -1.40 1.54 3.72 -1.26 -4.77 117.46 114.32 2yqg n PHE 120 Ca -0.03 0.63 -0.43 0.00 -0.05 0.00 0.00 57.45 57.57 2yqg n PHE 120 Cb 0.52 -2.71 -0.00 0.00 -0.94 0.00 0.00 39.48 36.35 2yqg n PHE 120 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2yqg n THR 121 N -4.51 1.43 -3.61 4.37 -2.24 -1.26 -4.99 114.28 103.47 2yqg n THR 121 Ca -0.27 -0.50 -0.13 0.00 -2.27 0.00 0.00 64.05 60.88 2yqg n THR 121 Cb 0.66 -0.31 -0.12 0.00 -2.10 0.00 0.00 70.33 68.46 2yqg n THR 121 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2yqg s GLN 122 N -1.31 0.19 0.00 -0.78 -0.21 -1.26 -4.94 119.66 111.35 2yqg s GLN 122 Ca 0.62 0.69 0.00 0.00 0.02 0.00 0.00 55.36 56.69 2yqg s GLN 122 Cb -0.66 -0.20 0.00 0.00 1.00 0.00 0.00 33.01 33.15 2yqg s GLN 122 CO 0.59 -0.37 0.00 -0.40 -2.12 0.00 0.00 175.29 173.00