#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 7.50 0.35 1.61 1.04 -1.26 -5.06 113.70 117.88 2yqg s SER 2 Ca 0.00 1.86 0.04 0.00 0.48 0.00 0.00 55.95 58.33 2yqg s SER 2 Cb 0.00 -2.58 -0.03 0.00 0.10 0.00 0.00 66.02 63.51 2yqg s SER 2 CO 0.00 0.09 0.16 -0.94 0.98 0.00 0.00 173.24 173.53 2yqg s SER 3 N -1.33 2.03 0.11 7.02 1.04 -1.26 -5.17 113.70 116.15 2yqg s SER 3 Ca 0.43 -1.62 0.03 0.00 0.48 0.00 0.00 55.95 55.28 2yqg s SER 3 Cb -0.23 0.43 -0.04 0.00 0.10 0.00 0.00 66.02 66.29 2yqg s SER 3 CO 0.28 -0.92 0.12 -0.83 0.98 0.00 0.00 173.24 172.88 2yqg s GLY 4 N -3.46 1.90 0.27 7.32 0.00 -1.26 -5.12 107.32 106.96 2yqg s GLY 4 Ca 0.32 -1.07 0.03 0.00 0.00 0.00 0.00 44.72 44.00 2yqg s GLY 4 CO 0.18 -1.07 0.19 -0.45 0.00 0.00 0.00 173.10 171.95 2yqg s SER 5 N -2.72 0.95 -0.64 1.64 0.15 -1.26 -4.94 113.70 106.88 2yqg s SER 5 Ca 0.31 -1.56 -0.01 0.00 0.70 0.00 0.00 55.95 55.39 2yqg s SER 5 Cb -0.11 0.45 -0.01 0.00 -1.71 0.00 0.00 66.02 64.63 2yqg s SER 5 CO 0.23 -0.93 0.54 -0.24 1.20 0.00 0.00 173.24 174.04 2yqg n SER 6 N -0.86 -2.81 -0.21 5.45 2.88 -1.26 -4.93 113.62 111.88 2yqg n SER 6 Ca 0.04 -0.36 0.01 0.00 -1.33 0.00 0.00 58.87 57.23 2yqg n SER 6 Cb 0.64 -3.08 0.12 0.00 -0.75 0.00 0.00 64.21 61.15 2yqg n SER 6 CO 0.00 0.00 0.00 1.23 -1.23 0.00 0.00 175.04 175.04 2yqg h GLY 7 N -0.91 0.85 -5.99 0.46 0.00 -2.05 -3.46 103.07 91.98 2yqg h GLY 7 Ca -0.33 -0.07 -0.42 0.00 0.00 0.00 0.00 47.33 46.51 2yqg h GLY 7 CO 0.27 -0.08 -0.72 -1.06 0.00 0.00 0.00 176.54 174.94 2yqg n GLN 8 N -5.07 -6.97 -4.19 4.80 6.02 -1.26 -4.99 117.38 105.73 2yqg n GLN 8 Ca 0.10 0.75 -0.33 0.00 -0.01 0.00 0.00 57.00 57.50 2yqg n GLN 8 Cb 0.32 -5.73 -0.08 0.00 1.02 0.00 0.00 30.24 25.78 2yqg n GLN 8 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 177.06 176.20 2yqg s LYS 9 N -6.31 2.96 -0.03 -1.09 1.02 -1.26 -5.00 119.74 110.02 2yqg s LYS 9 Ca 0.53 -0.51 -0.04 0.00 0.02 0.00 0.00 55.97 55.96 2yqg s LYS 9 Cb -0.25 -2.79 -0.17 0.00 -0.52 0.00 0.00 37.83 34.10 2yqg s LYS 9 CO 0.77 0.65 3.15 2.89 -0.92 0.00 0.00 175.35 181.89 2yqg n ARG 10 N 1.38 1.78 -4.27 1.68 1.85 -1.26 -4.83 116.66 112.99 2yqg n ARG 10 Ca -0.14 -0.86 -0.15 0.00 -1.00 0.00 0.00 57.85 55.70 2yqg n ARG 10 Cb 0.53 -1.76 -0.10 0.00 -1.05 0.00 0.00 32.46 30.08 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 0.53 1.52 0.69 2.89 0.00 -1.26 -5.14 121.76 120.99 2yqg s ALA 11 Ca 0.50 -1.72 -0.16 0.00 0.00 0.00 0.00 51.96 50.58 2yqg s ALA 11 Cb 0.25 0.81 0.02 0.00 0.00 0.00 0.00 23.12 24.19 2yqg s ALA 11 CO -0.01 -0.39 1.19 1.67 0.00 0.00 0.00 175.76 178.21 2yqg s TRP 12 N -3.72 2.20 0.31 0.00 1.48 -1.26 -5.05 118.94 112.90 2yqg s TRP 12 Ca 0.31 1.58 0.10 0.00 -1.06 0.00 0.00 56.10 57.03 2yqg s TRP 12 Cb 0.07 -3.43 -0.06 0.00 -1.16 0.00 0.00 33.47 28.90 2yqg s TRP 12 CO 0.09 -2.39 -0.14 0.96 -4.06 0.00 0.00 176.95 171.41 2yqg s ILE 13 N -1.97 2.27 0.10 0.66 -4.36 -1.26 -5.06 121.20 111.58 2yqg s ILE 13 Ca 0.74 -2.28 0.06 0.00 -0.26 0.00 0.00 60.65 58.91 2yqg s ILE 13 Cb -0.28 -2.46 -0.03 0.00 1.25 0.00 0.00 42.46 40.94 2yqg s ILE 13 CO 0.42 -0.31 -0.16 -0.89 0.24 0.00 0.00 174.94 174.24 2yqg s THR 14 N -2.62 1.38 0.33 8.37 2.01 -1.26 -5.09 115.64 118.76 2yqg s THR 14 Ca 0.31 -1.51 -0.27 0.00 0.31 0.00 0.00 61.69 60.53 2yqg s THR 14 Cb -0.01 -1.37 -0.09 0.00 0.01 0.00 0.00 72.50 71.04 2yqg s THR 14 CO 0.15 -0.23 1.01 0.00 -0.69 0.00 0.00 174.62 174.87 2yqg s ALA 15 N -1.50 3.23 0.79 7.40 0.00 -1.26 -5.04 121.76 125.39 2yqg s ALA 15 Ca 0.04 0.68 -0.11 0.00 0.00 0.00 0.00 51.96 52.57 2yqg s ALA 15 Cb -0.09 -3.25 0.07 0.00 0.00 0.00 0.00 23.12 19.85 2yqg s ALA 15 CO 0.03 -0.03 1.09 -1.25 0.00 0.00 0.00 175.76 175.61 2yqg s PRO 16 N -1.96 2.11 -0.10 0.00 0.04 -1.26 -4.95 135.00 128.89 2yqg s PRO 16 Ca 0.50 1.12 -0.01 0.00 0.04 0.00 0.00 61.00 62.65 2yqg s PRO 16 Cb -0.24 -1.88 0.03 0.00 0.04 0.00 0.00 34.50 32.45 2yqg s PRO 16 CO 0.30 -1.73 -0.02 0.08 0.04 0.00 0.00 177.00 175.67 2yqg s VAL 17 N -2.91 0.59 -0.36 -0.36 1.01 -1.26 -5.03 120.40 112.08 2yqg s VAL 17 Ca 0.61 -0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.52 2yqg s VAL 17 Cb -0.17 -0.74 0.12 0.00 0.00 0.00 0.00 36.38 35.59 2yqg s VAL 17 CO 0.56 0.24 0.17 0.00 0.00 0.00 0.00 175.10 176.07 2yqg s ALA 18 N 1.88 1.57 0.08 5.51 0.00 -1.26 -3.44 121.76 126.10 2yqg s ALA 18 Ca 0.04 -1.99 -0.12 0.00 0.00 0.00 0.00 51.96 49.89 2yqg s ALA 18 Cb -0.13 -1.70 -0.06 0.00 0.00 0.00 0.00 23.12 21.23 2yqg s ALA 18 CO -0.06 -1.89 0.45 -0.51 0.00 0.00 0.00 175.76 173.75 2yqg s LEU 19 N 1.11 4.38 -0.54 0.00 1.43 -1.23 -4.93 118.68 118.89 2yqg s LEU 19 Ca 0.14 0.92 -0.16 0.00 -1.03 0.00 0.00 54.13 54.00 2yqg s LEU 19 Cb -0.21 -2.98 0.13 0.00 0.03 0.00 0.00 46.19 43.16 2yqg s LEU 19 CO -0.12 0.19 0.50 -0.60 0.23 0.00 0.00 176.35 176.54 2yqg s ARG 20 N -1.73 2.98 1.08 1.70 3.52 -1.26 -1.93 118.95 123.31 2yqg s ARG 20 Ca 0.32 -1.71 -0.21 0.00 -0.13 0.00 0.00 55.73 54.00 2yqg s ARG 20 Cb -0.15 -4.29 0.01 0.00 -1.56 0.00 0.00 34.95 28.96 2yqg s ARG 20 CO 0.17 -1.33 -0.47 -0.85 -0.81 0.00 0.00 175.30 172.02 2yqg n GLU 21 N 5.25 -1.09 0.00 5.12 -0.00 -1.20 -4.47 120.64 124.25 2yqg n GLU 21 Ca -0.14 -0.31 0.00 0.00 -0.00 0.00 0.00 57.16 56.71 2yqg n GLU 21 Cb 0.40 -1.48 0.00 0.00 -0.00 0.00 0.00 31.44 30.36 2yqg n GLU 21 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2yqg n GLY 22 N 2.48 2.18 3.82 -1.84 0.00 -1.26 -4.73 105.19 105.85 2yqg n GLY 22 Ca -0.00 -0.73 -0.28 0.00 0.00 0.00 0.00 46.02 45.01 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 3.02 0.55 1.61 2.56 -1.26 -4.94 118.70 120.23 2yqg s GLU 23 Ca 0.00 -0.72 -0.18 0.00 0.00 0.00 0.00 54.97 54.07 2yqg s GLU 23 Cb 0.00 -2.76 -0.15 0.00 2.00 0.00 0.00 34.13 33.22 2yqg s GLU 23 CO 0.00 0.53 -0.16 -3.47 -0.56 0.00 0.00 175.26 171.60 2yqg n ASP 24 N 0.01 -3.78 -2.51 -1.70 -0.08 -1.26 -4.92 116.55 102.30 2yqg n ASP 24 Ca -0.08 0.62 -0.15 0.00 -1.51 0.00 0.00 54.79 53.67 2yqg n ASP 24 Cb 0.53 -0.85 0.02 0.00 2.34 0.00 0.00 41.12 43.16 2yqg n ASP 24 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 2yqg n LEU 25 N 2.52 3.13 0.17 -2.67 4.77 -1.26 -4.89 117.00 118.77 2yqg n LEU 25 Ca 0.07 -4.20 -0.14 0.00 -0.03 0.00 0.00 56.01 51.71 2yqg n LEU 25 Cb 0.48 0.03 -0.08 0.00 -2.33 0.00 0.00 43.42 41.52 2yqg n LEU 25 CO 0.54 1.75 0.67 -1.28 -1.33 0.00 0.00 177.39 177.74 2yqg h SER 26 N 2.62 -0.34 -0.56 -1.43 0.87 -1.91 -3.10 113.55 109.70 2yqg h SER 26 Ca 0.10 -0.09 0.08 0.00 -1.23 0.00 0.00 61.79 60.65 2yqg h SER 26 Cb 1.21 0.09 -0.06 0.00 -0.44 0.00 0.00 62.40 63.19 2yqg h SER 26 CO 0.58 -0.11 0.20 0.50 -0.53 0.00 0.00 176.83 177.48 2yqg h LYS 27 N -0.57 0.38 -0.94 2.24 1.63 -1.97 -2.22 116.57 115.12 2yqg h LYS 27 Ca -0.04 -0.02 0.20 0.00 -0.85 0.00 0.00 60.65 59.94 2yqg h LYS 27 Cb 0.41 -0.08 -0.18 0.00 -0.60 0.00 0.00 32.23 31.78 2yqg h LYS 27 CO 0.07 0.25 -0.18 1.63 -3.45 0.00 0.00 179.45 177.76 2yqg n LYS 28 N -5.00 -0.08 -1.68 1.90 4.76 -1.17 -4.43 118.16 112.45 2yqg n LYS 28 Ca 0.07 1.46 -0.36 0.00 -2.87 0.00 0.00 58.31 56.61 2yqg n LYS 28 Cb 0.24 -2.21 0.07 0.00 -1.84 0.00 0.00 35.03 31.29 2yqg n LYS 28 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2yqg s ASN 29 N -5.20 4.55 0.79 4.39 2.20 -0.84 -4.42 114.94 116.42 2yqg s ASN 29 Ca -0.14 2.51 -0.11 0.00 -0.94 0.00 0.00 52.86 54.19 2yqg s ASN 29 Cb 0.26 -2.61 0.07 0.00 -2.00 0.00 0.00 41.25 36.97 2yqg s ASN 29 CO 0.74 -2.03 1.09 -2.16 -2.94 0.00 0.00 177.10 171.79 2yqg s PRO 30 N -3.53 2.14 0.00 3.55 0.04 -1.26 -5.04 135.00 130.90 2yqg s PRO 30 Ca 0.79 1.13 0.00 0.00 0.04 0.00 0.00 61.00 62.96 2yqg s PRO 30 Cb -0.34 -1.89 0.00 0.00 0.04 0.00 0.00 34.50 32.31 2yqg s PRO 30 CO 0.40 -1.72 0.00 0.44 0.04 0.00 0.00 177.00 176.17 2yqg n ILE 31 N -3.57 0.00 -4.41 0.56 -5.35 -1.11 -5.04 119.36 100.45 2yqg n ILE 31 Ca 0.09 0.00 -0.34 0.00 -0.27 0.00 0.00 62.75 62.23 2yqg n ILE 31 Cb 0.53 -0.70 -0.11 0.00 -1.74 0.00 0.00 39.64 37.62 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 -1.85 3.14 -0.21 -1.28 0.00 -1.23 -4.90 121.76 115.44 2yqg s ALA 32 Ca 0.00 -0.82 -0.05 0.00 0.00 0.00 0.00 51.96 51.09 2yqg s ALA 32 Cb 0.00 -1.49 0.07 0.00 0.00 0.00 0.00 23.12 21.71 2yqg s ALA 32 CO 0.00 0.43 0.11 0.15 0.00 0.00 0.00 175.76 176.45 2yqg s LYS 33 N -0.36 0.11 -0.29 0.00 -0.14 -1.26 -3.26 119.74 114.54 2yqg s LYS 33 Ca 0.06 -0.18 0.11 0.00 -1.36 0.00 0.00 55.97 54.60 2yqg s LYS 33 Cb -0.12 -1.60 0.47 0.00 -1.68 0.00 0.00 37.83 34.90 2yqg s LYS 33 CO 0.02 -0.77 1.16 0.44 -0.76 0.00 0.00 175.35 175.45 2yqg n ILE 34 N 5.27 2.18 -1.61 2.17 -5.35 -1.26 -4.77 119.36 116.00 2yqg n ILE 34 Ca -0.07 -3.90 -0.44 0.00 -0.27 0.00 0.00 62.75 58.08 2yqg n ILE 34 Cb 0.47 -0.49 -0.04 0.00 -1.74 0.00 0.00 39.64 37.84 2yqg n ILE 34 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2yqg n HIS 35 N -0.66 2.12 -1.31 4.28 1.44 -1.26 -4.94 115.22 114.89 2yqg n HIS 35 Ca 0.34 -0.15 -0.32 0.00 -2.01 0.00 0.00 57.72 55.57 2yqg n HIS 35 Cb 0.91 -2.73 0.10 0.00 0.12 0.00 0.00 29.99 28.39 2yqg n HIS 35 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 2yqg s SER 36 N 6.82 4.22 -0.00 4.39 0.15 -1.26 -4.98 113.70 123.03 2yqg s SER 36 Ca 0.98 2.09 -0.22 0.00 0.70 0.00 0.00 55.95 59.49 2yqg s SER 36 Cb -0.44 -2.56 -0.12 0.00 -1.71 0.00 0.00 66.02 61.19 2yqg s SER 36 CO 0.40 -2.23 0.94 0.44 1.20 0.00 0.00 173.24 173.99 2yqg h ASP 37 N -0.78 -0.69 -0.98 5.45 3.32 -2.01 -3.21 116.42 117.53 2yqg h ASP 37 Ca -0.45 0.02 0.33 0.00 0.02 0.00 0.00 57.03 56.95 2yqg h ASP 37 Cb 1.26 0.18 -0.18 0.00 0.22 0.00 0.00 39.33 40.81 2yqg h ASP 37 CO 0.49 -0.30 0.24 0.18 -1.72 0.00 0.00 179.24 178.14 2yqg n LEU 38 N -5.26 0.09 -0.32 1.55 4.77 -1.26 0.79 117.00 117.36 2yqg n LEU 38 Ca -0.10 1.64 0.18 0.00 -0.03 0.00 0.00 56.01 57.70 2yqg n LEU 38 Cb 0.32 -0.69 0.36 0.00 -2.33 0.00 0.00 43.42 41.09 2yqg n LEU 38 CO 0.24 -1.74 0.95 0.00 -1.33 0.00 0.00 177.39 175.51 2yqg h ALA 39 N 1.95 1.48 0.00 -1.18 0.00 -1.78 0.36 119.26 120.10 2yqg h ALA 39 Ca 0.70 0.26 -0.24 0.00 0.00 0.00 0.00 54.91 55.62 2yqg h ALA 39 Cb 1.65 0.37 -0.04 0.00 0.00 0.00 0.00 17.79 19.77 2yqg h ALA 39 CO -0.85 -0.59 -1.61 -1.91 0.00 0.00 0.00 179.25 174.29 2yqg n GLU 40 N -5.28 0.55 -0.34 0.00 4.07 0.24 -2.39 120.64 117.49 2yqg n GLU 40 Ca 0.26 0.36 0.06 0.00 -0.06 0.00 0.00 57.16 57.78 2yqg n GLU 40 Cb 0.84 -1.56 0.14 0.00 -0.06 0.00 0.00 31.44 30.80 2yqg n GLU 40 CO 0.00 0.00 0.00 0.39 -0.06 0.00 0.00 177.13 177.46 2yqg n GLU 41 N -4.39 -0.08 -0.06 5.31 -0.58 0.42 -3.46 120.64 117.79 2yqg n GLU 41 Ca -0.34 1.47 -0.06 0.00 -0.42 0.00 0.00 57.16 57.81 2yqg n GLU 41 Cb 0.67 -2.21 -0.02 0.00 -0.57 0.00 0.00 31.44 29.31 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 -5.53 0.36 0.00 3.49 1.74 0.08 -5.04 116.66 111.76 2yqg n ARG 42 Ca 0.16 0.14 0.00 0.00 -0.77 0.00 0.00 57.85 57.38 2yqg n ARG 42 Cb 0.49 -1.13 0.00 0.00 -1.02 0.00 0.00 32.46 30.81 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 1.61 0.49 3.83 -0.13 0.00 -0.99 -5.05 105.19 104.96 2yqg n GLY 43 Ca -0.10 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.71 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 3.82 -0.61 0.99 1.02 -1.02 -5.01 118.68 117.87 2yqg s LEU 44 Ca 0.00 -0.26 -0.01 0.00 0.02 0.00 0.00 54.13 53.88 2yqg s LEU 44 Cb 0.00 -2.36 0.45 0.00 0.02 0.00 0.00 46.19 44.30 2yqg s LEU 44 CO 0.00 -0.06 2.02 2.29 0.02 0.00 0.00 176.35 180.62 2yqg n LYS 45 N -1.20 2.56 -0.77 1.70 2.85 -1.26 -4.49 118.16 117.54 2yqg n LYS 45 Ca -0.07 -3.10 -0.25 0.00 -1.05 0.00 0.00 58.31 53.84 2yqg n LYS 45 Cb 0.58 -2.21 0.00 0.00 -0.65 0.00 0.00 35.03 32.75 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 0.30 -4.87 0.58 -0.00 -1.26 -4.84 119.36 108.44 2yqg n ILE 46 Ca 0.60 -0.30 -0.27 0.00 -0.00 0.00 0.00 62.75 62.77 2yqg n ILE 46 Cb 0.76 0.00 -0.16 0.00 -0.00 0.00 0.00 39.64 40.23 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 -1.06 1.51 0.29 1.39 2.01 -1.03 -4.77 115.64 113.98 2yqg s THR 47 Ca 0.35 -0.73 0.03 0.00 0.31 0.00 0.00 61.69 61.66 2yqg s THR 47 Cb -0.36 -1.32 0.03 0.00 0.01 0.00 0.00 72.50 70.86 2yqg s THR 47 CO 0.38 0.44 0.28 -1.22 -0.69 0.00 0.00 174.62 173.81 2yqg n TYR 48 N 3.42 -1.58 -3.70 4.92 4.01 -1.26 0.34 117.16 123.30 2yqg n TYR 48 Ca -0.20 -1.16 -0.13 0.00 -0.16 0.00 0.00 57.90 56.25 2yqg n TYR 48 Cb 0.53 -0.25 -0.07 0.00 -0.31 0.00 0.00 39.34 39.23 2yqg n TYR 48 CO 0.00 0.00 0.00 0.21 -0.46 0.00 0.00 176.86 176.61 2yqg s LYS 49 N -3.22 0.83 -0.09 -0.72 2.20 -0.76 -4.82 119.74 113.15 2yqg s LYS 49 Ca 0.21 -0.30 0.00 0.00 -0.36 0.00 0.00 55.97 55.52 2yqg s LYS 49 Cb -0.02 0.37 0.02 0.00 -1.51 0.00 0.00 37.83 36.69 2yqg s LYS 49 CO 0.13 -0.26 -0.08 0.71 -0.36 0.00 0.00 175.35 175.49 2yqg s TYR 50 N -2.06 1.40 -0.08 4.03 1.51 -1.26 -0.63 117.35 120.25 2yqg s TYR 50 Ca -0.08 -0.63 0.04 0.00 -1.01 0.00 0.00 57.07 55.39 2yqg s TYR 50 Cb -0.02 -1.14 0.00 0.00 -0.11 0.00 0.00 41.96 40.69 2yqg s TYR 50 CO 0.00 -0.42 -0.22 0.95 -1.11 0.00 0.00 175.55 174.76 2yqg s THR 51 N 1.38 1.85 -5.00 -0.71 -4.23 -1.20 -4.65 115.64 103.08 2yqg s THR 51 Ca -0.01 -0.91 0.00 0.00 -1.18 0.00 0.00 61.69 59.58 2yqg s THR 51 Cb -0.14 -1.60 0.00 0.00 1.34 0.00 0.00 72.50 72.10 2yqg s THR 51 CO -0.04 0.52 0.00 0.61 -0.54 0.00 0.00 174.62 175.16 2yqg n GLY 52 N 3.46 -1.44 3.64 3.99 0.00 -1.26 -3.15 105.19 110.43 2yqg n GLY 52 Ca -0.19 -1.52 -0.43 0.00 0.00 0.00 0.00 46.02 43.88 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 -1.73 3.80 0.00 1.61 2.20 -1.26 -2.34 119.74 122.01 2yqg s LYS 53 Ca 0.00 2.12 0.00 0.00 -0.36 0.00 0.00 55.97 57.73 2yqg s LYS 53 Cb 0.00 -4.15 0.00 0.00 -1.51 0.00 0.00 37.83 32.17 2yqg s LYS 53 CO 0.00 -1.32 0.00 0.41 -0.36 0.00 0.00 175.35 174.08 2yqg n GLY 54 N 4.82 1.88 1.30 5.54 0.00 -0.50 -4.76 105.19 113.46 2yqg n GLY 54 Ca 0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.24 2yqg n GLY 54 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2yqg n ILE 55 N 0.00 0.65 -0.03 -0.61 5.41 -0.99 -2.82 119.36 120.97 2yqg n ILE 55 Ca 0.00 0.21 -0.16 0.00 1.00 0.00 0.00 62.75 63.81 2yqg n ILE 55 Cb 0.00 -1.27 -0.14 0.00 -0.71 0.00 0.00 39.64 37.52 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 -3.32 1.66 -4.43 1.39 -2.24 -1.00 -4.70 114.28 101.64 2yqg n THR 56 Ca 0.00 -0.71 -0.33 0.00 -2.27 0.00 0.00 64.05 60.74 2yqg n THR 56 Cb 0.10 -1.36 -0.10 0.00 -2.10 0.00 0.00 70.33 66.88 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 -2.56 2.77 0.54 -0.78 0.41 -1.16 -5.01 118.70 112.91 2yqg s GLU 57 Ca -0.17 -0.57 -0.19 0.00 -0.41 0.00 0.00 54.97 53.62 2yqg s GLU 57 Cb 0.07 -2.64 -0.06 0.00 -1.78 0.00 0.00 34.13 29.73 2yqg s GLU 57 CO 0.77 0.65 1.13 -1.25 -0.49 0.00 0.00 175.26 176.07 2yqg s PRO 58 N -1.19 3.35 0.15 0.39 0.04 -1.26 -1.41 135.00 135.07 2yqg s PRO 58 Ca 0.16 1.61 -0.31 0.00 0.04 0.00 0.00 61.00 62.50 2yqg s PRO 58 Cb -0.11 -2.00 -0.08 0.00 0.04 0.00 0.00 34.50 32.34 2yqg s PRO 58 CO 0.06 -0.85 1.34 -1.25 0.04 0.00 0.00 177.00 176.33 2yqg s PRO 59 N -3.29 4.36 0.33 0.56 0.04 -1.26 -4.75 135.00 130.99 2yqg s PRO 59 Ca 0.73 2.04 0.07 0.00 0.04 0.00 0.00 61.00 63.88 2yqg s PRO 59 Cb -0.24 -3.23 -0.02 0.00 0.04 0.00 0.00 34.50 31.06 2yqg s PRO 59 CO 0.27 -0.34 0.40 -0.59 0.04 0.00 0.00 177.00 176.78 2yqg s PHE 60 N 0.65 3.04 0.00 0.56 -0.12 -1.25 -3.47 117.98 117.38 2yqg s PHE 60 Ca 0.61 -0.25 0.00 0.00 -0.05 0.00 0.00 56.93 57.24 2yqg s PHE 60 Cb -0.36 -1.92 0.00 0.00 -0.63 0.00 0.00 43.02 40.11 2yqg s PHE 60 CO 0.34 0.07 0.00 0.41 -0.05 0.00 0.00 175.22 175.98 2yqg n GLY 61 N -1.54 2.87 0.32 1.99 0.00 -1.13 -4.89 105.19 102.81 2yqg n GLY 61 Ca -0.01 -0.25 -0.05 0.00 0.00 0.00 0.00 46.02 45.72 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 0.24 -2.68 -0.61 2.04 -1.80 -3.40 117.51 111.30 2yqg h ILE 62 Ca 0.00 0.00 -0.66 0.00 1.00 0.00 0.00 64.86 65.20 2yqg h ILE 62 Cb 0.00 0.24 -0.07 0.00 -0.74 0.00 0.00 36.82 36.25 2yqg h ILE 62 CO 0.00 0.00 -0.48 -0.36 0.00 0.00 0.00 178.15 177.31 2yqg s PHE 63 N -6.05 3.59 0.02 1.37 0.08 -1.20 -0.60 117.98 115.18 2yqg s PHE 63 Ca -0.14 0.49 0.02 0.00 0.12 0.00 0.00 56.93 57.41 2yqg s PHE 63 Cb 0.16 -1.92 -0.01 0.00 -0.57 0.00 0.00 43.02 40.68 2yqg s PHE 63 CO 0.70 0.72 -0.06 0.14 -0.10 0.00 0.00 175.22 176.62 2yqg s VAL 64 N -1.09 0.42 -0.02 -0.44 -7.23 -0.91 -4.74 120.40 106.39 2yqg s VAL 64 Ca 0.17 -0.60 -0.09 0.00 -1.81 0.00 0.00 61.98 59.66 2yqg s VAL 64 Cb -0.12 -0.43 0.01 0.00 0.56 0.00 0.00 36.38 36.40 2yqg s VAL 64 CO 0.07 -0.13 0.18 0.72 -0.31 0.00 0.00 175.10 175.63 2yqg s PHE 65 N -0.71 -0.05 0.48 2.82 -0.12 -1.26 -1.22 117.98 117.91 2yqg s PHE 65 Ca -0.04 0.08 0.08 0.00 -0.05 0.00 0.00 56.93 57.00 2yqg s PHE 65 Cb -0.06 0.00 0.03 0.00 -0.63 0.00 0.00 43.02 42.37 2yqg s PHE 65 CO 0.00 -0.27 0.57 1.21 -0.05 0.00 0.00 175.22 176.68 2yqg s ASN 66 N -1.08 5.25 -0.08 1.98 2.47 -1.20 -4.97 114.94 117.32 2yqg s ASN 66 Ca -0.12 -0.70 0.12 0.00 0.42 0.00 0.00 52.86 52.58 2yqg s ASN 66 Cb -0.06 -0.26 -0.17 0.00 -1.45 0.00 0.00 41.25 39.31 2yqg s ASN 66 CO 0.02 -0.93 0.13 2.29 -3.72 0.00 0.00 177.10 174.89 2yqg n LYS 67 N -1.88 1.42 0.06 0.43 2.85 -1.26 -3.24 118.16 116.54 2yqg n LYS 67 Ca 0.08 -0.05 -0.20 0.00 -1.05 0.00 0.00 58.31 57.09 2yqg n LYS 67 Cb 0.61 -1.31 -0.13 0.00 -0.65 0.00 0.00 35.03 33.54 2yqg n LYS 67 CO 0.00 0.00 0.00 0.22 -0.05 0.00 0.00 177.40 177.57 2yqg h ASP 68 N 0.00 0.63 0.15 -5.58 3.58 -1.88 -3.38 116.42 109.94 2yqg h ASP 68 Ca -0.21 -0.86 -0.36 0.00 0.42 0.00 0.00 57.03 56.02 2yqg h ASP 68 Cb 1.33 -0.20 -0.04 0.00 1.72 0.00 0.00 39.33 42.14 2yqg h ASP 68 CO 0.01 1.43 -2.12 0.35 -2.88 0.00 0.00 179.24 176.04 2yqg n THR 69 N -4.03 1.63 -2.52 2.25 -2.24 -1.26 -4.98 114.28 103.12 2yqg n THR 69 Ca -0.13 -0.68 -0.08 0.00 -2.27 0.00 0.00 64.05 60.88 2yqg n THR 69 Cb 0.85 -1.37 0.04 0.00 -2.10 0.00 0.00 70.33 67.75 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 1.95 -0.13 3.09 3.38 0.00 -1.20 -4.87 105.19 107.41 2yqg n GLY 70 Ca -0.33 0.08 -0.13 0.00 0.00 0.00 0.00 46.02 45.64 2yqg n GLY 70 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yqg s GLU 71 N -4.01 0.61 0.02 1.61 2.02 -1.26 -4.10 118.70 113.59 2yqg s GLU 71 Ca 0.17 -0.87 0.01 0.00 0.02 0.00 0.00 54.97 54.30 2yqg s GLU 71 Cb -0.02 -0.35 -0.04 0.00 0.10 0.00 0.00 34.13 33.82 2yqg s GLU 71 CO 0.39 0.06 0.08 -1.17 0.02 0.00 0.00 175.26 174.63 2yqg s LEU 72 N -1.83 3.84 0.10 1.80 2.96 -1.20 -3.23 118.68 121.13 2yqg s LEU 72 Ca -0.06 0.09 -0.05 0.00 -0.22 0.00 0.00 54.13 53.89 2yqg s LEU 72 Cb -0.08 -2.33 -0.02 0.00 0.50 0.00 0.00 46.19 44.26 2yqg s LEU 72 CO -0.00 0.24 0.13 0.20 -1.32 0.00 0.00 176.35 175.60 2yqg s ASN 73 N -1.94 0.23 -0.17 3.68 0.01 -0.36 -2.75 114.94 113.65 2yqg s ASN 73 Ca 0.25 -0.89 -0.01 0.00 -0.71 0.00 0.00 52.86 51.50 2yqg s ASN 73 Cb -0.12 0.32 -0.00 0.00 0.41 0.00 0.00 41.25 41.85 2yqg s ASN 73 CO 0.16 -0.73 -0.13 0.54 -1.51 0.00 0.00 177.10 175.43 2yqg s VAL 74 N -3.93 2.81 -0.38 1.60 0.11 -1.26 -2.15 120.40 117.19 2yqg s VAL 74 Ca 0.12 -0.71 0.05 0.00 -2.93 0.00 0.00 61.98 58.50 2yqg s VAL 74 Cb 0.06 -2.21 0.45 0.00 -1.53 0.00 0.00 36.38 33.16 2yqg s VAL 74 CO -0.06 0.50 1.35 0.35 -3.33 0.00 0.00 175.10 173.91 2yqg n THR 75 N 4.21 2.74 -3.61 5.04 -2.24 0.24 -4.63 114.28 116.02 2yqg n THR 75 Ca -0.19 -4.04 -0.07 0.00 -2.27 0.00 0.00 64.05 57.48 2yqg n THR 75 Cb 0.51 -1.16 -0.02 0.00 -2.10 0.00 0.00 70.33 67.57 2yqg n THR 75 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 2yqg s SER 76 N -3.23 -0.31 -0.64 3.42 0.15 -1.26 -4.83 113.70 107.00 2yqg s SER 76 Ca 0.53 -0.20 -0.19 0.00 0.70 0.00 0.00 55.95 56.80 2yqg s SER 76 Cb 0.43 0.48 0.11 0.00 -1.71 0.00 0.00 66.02 65.32 2yqg s SER 76 CO 0.01 -0.82 0.78 -0.63 1.20 0.00 0.00 173.24 173.78 2yqg s ILE 77 N -3.32 4.77 0.10 6.45 1.09 -1.26 -4.76 121.20 124.27 2yqg s ILE 77 Ca 0.08 -1.01 -0.24 0.00 -1.10 0.00 0.00 60.65 58.38 2yqg s ILE 77 Cb -0.02 -4.55 -0.13 0.00 -1.06 0.00 0.00 42.46 36.71 2yqg s ILE 77 CO -0.04 -1.21 0.52 0.18 -0.10 0.00 0.00 174.94 174.29 2yqg n LEU 78 N 6.46 -0.61 -3.87 2.97 4.77 -1.26 -4.81 117.00 120.64 2yqg n LEU 78 Ca -0.05 0.84 -0.29 0.00 -0.03 0.00 0.00 56.01 56.48 2yqg n LEU 78 Cb 0.44 -0.70 -0.13 0.00 -2.33 0.00 0.00 43.42 40.70 2yqg n LEU 78 CO 0.57 -1.94 -0.16 -1.81 -1.33 0.00 0.00 177.39 172.72 2yqg s ASP 79 N -0.49 4.21 0.19 -1.43 1.01 -1.26 -4.35 116.67 114.55 2yqg s ASP 79 Ca 0.54 -3.16 -0.17 0.00 0.71 0.00 0.00 52.55 50.48 2yqg s ASP 79 Cb -0.77 -1.48 0.16 0.00 1.01 0.00 0.00 42.92 41.84 2yqg s ASP 79 CO 0.42 -0.20 1.63 -0.09 0.21 0.00 0.00 175.17 177.13 2yqg h ARG 80 N 6.23 -0.07 -0.72 8.23 2.43 -1.90 0.89 114.38 129.46 2yqg h ARG 80 Ca 0.00 0.00 0.22 0.00 -0.81 0.00 0.00 59.98 59.40 2yqg h ARG 80 Cb 0.86 0.02 -0.13 0.00 -0.42 0.00 0.00 29.97 30.30 2yqg h ARG 80 CO 0.64 -0.05 0.10 -0.85 -1.51 0.00 0.00 179.97 178.31 2yqg n GLU 81 N -5.40 -0.05 -0.07 0.20 0.28 -1.26 -2.69 120.64 111.63 2yqg n GLU 81 Ca 0.05 1.06 -0.08 0.00 -0.16 0.00 0.00 57.16 58.03 2yqg n GLU 81 Cb 0.31 -1.73 -0.03 0.00 1.43 0.00 0.00 31.44 31.42 2yqg n GLU 81 CO 0.00 0.00 0.00 -1.91 -0.16 0.00 0.00 177.13 175.06 2yqg n GLU 82 N -4.90 0.46 -3.41 3.44 2.13 -0.30 -4.87 120.64 113.19 2yqg n GLU 82 Ca 0.19 0.18 -0.44 0.00 0.66 0.00 0.00 57.16 57.75 2yqg n GLU 82 Cb 0.64 -1.31 -0.05 0.00 0.27 0.00 0.00 31.44 30.99 2yqg n GLU 82 CO 0.00 0.00 0.00 0.95 -0.41 0.00 0.00 177.13 177.67 2yqg s THR 83 N -2.77 4.97 0.22 6.31 -4.23 0.29 -4.91 115.64 115.53 2yqg s THR 83 Ca -0.25 -1.98 0.24 0.00 -1.18 0.00 0.00 61.69 58.51 2yqg s THR 83 Cb 0.03 -4.17 0.23 0.00 1.34 0.00 0.00 72.50 69.93 2yqg s THR 83 CO 0.37 -0.90 1.87 1.55 -0.54 0.00 0.00 174.62 176.98 2yqg h PRO 84 N 8.30 0.00 -2.45 3.99 0.13 -1.72 -3.19 132.00 137.06 2yqg h PRO 84 Ca -0.13 0.00 0.18 0.00 -0.87 0.00 0.00 66.00 65.17 2yqg h PRO 84 Cb 1.06 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.15 2yqg h PRO 84 CO 0.88 0.23 0.59 -0.59 -0.23 0.00 0.00 178.00 178.88 2yqg s PHE 85 N -3.80 0.03 -0.04 1.56 -0.12 -1.26 -2.64 117.98 111.71 2yqg s PHE 85 Ca -0.01 -0.40 -0.02 0.00 -0.05 0.00 0.00 56.93 56.46 2yqg s PHE 85 Cb 0.11 0.68 0.03 0.00 -0.63 0.00 0.00 43.02 43.22 2yqg s PHE 85 CO 0.63 -0.86 0.08 -0.06 -0.05 0.00 0.00 175.22 174.96 2yqg s PHE 86 N -2.36 -0.01 -0.48 3.49 0.40 -1.11 -4.96 117.98 112.96 2yqg s PHE 86 Ca 0.20 0.30 -0.10 0.00 -0.60 0.00 0.00 56.93 56.73 2yqg s PHE 86 Cb -0.02 -0.33 0.12 0.00 0.51 0.00 0.00 43.02 43.30 2yqg s PHE 86 CO 0.04 -0.17 0.36 -0.51 0.70 0.00 0.00 175.22 175.64 2yqg s LEU 87 N 1.77 5.75 0.55 -0.37 1.43 -1.26 -1.88 118.68 124.67 2yqg s LEU 87 Ca -0.01 -1.89 0.08 0.00 -1.03 0.00 0.00 54.13 51.28 2yqg s LEU 87 Cb -0.12 -2.04 0.06 0.00 0.03 0.00 0.00 46.19 44.12 2yqg s LEU 87 CO -0.04 -0.71 0.60 -0.76 0.23 0.00 0.00 176.35 175.67 2yqg s LEU 88 N 1.39 2.98 -0.14 1.79 1.43 0.27 -4.42 118.68 121.99 2yqg s LEU 88 Ca 0.05 -0.99 -0.06 0.00 -1.03 0.00 0.00 54.13 52.11 2yqg s LEU 88 Cb -0.27 -1.52 0.06 0.00 0.03 0.00 0.00 46.19 44.50 2yqg s LEU 88 CO -0.00 -1.18 0.30 -0.89 0.23 0.00 0.00 176.35 174.81 2yqg s THR 89 N -2.69 -0.26 -0.48 5.49 2.01 -1.19 -1.25 115.64 117.28 2yqg s THR 89 Ca 0.49 0.19 -0.22 0.00 0.31 0.00 0.00 61.69 62.46 2yqg s THR 89 Cb -0.04 -0.48 0.03 0.00 0.01 0.00 0.00 72.50 72.02 2yqg s THR 89 CO 0.31 0.08 0.76 -0.83 -0.69 0.00 0.00 174.62 174.25 2yqg s GLY 90 N 1.90 1.61 -0.72 4.40 0.00 -1.24 -3.24 107.32 110.03 2yqg s GLY 90 Ca -0.04 -1.20 -0.12 0.00 0.00 0.00 0.00 44.72 43.35 2yqg s GLY 90 CO -0.10 1.74 0.64 -0.19 0.00 0.00 0.00 173.10 175.20 2yqg s TYR 91 N 3.23 3.60 -0.12 1.90 2.02 0.19 -4.04 117.35 124.14 2yqg s TYR 91 Ca 0.26 -1.99 -0.29 0.00 -0.37 0.00 0.00 57.07 54.68 2yqg s TYR 91 Cb -0.14 -3.69 -0.05 0.00 -0.40 0.00 0.00 41.96 37.68 2yqg s TYR 91 CO 0.20 -0.97 1.71 0.00 -1.57 0.00 0.00 175.55 174.92 2yqg s ALA 92 N 0.45 3.41 0.09 3.71 0.00 -1.26 -1.83 121.76 126.32 2yqg s ALA 92 Ca 0.14 0.77 0.04 0.00 0.00 0.00 0.00 51.96 52.92 2yqg s ALA 92 Cb -0.16 -3.82 -0.04 0.00 0.00 0.00 0.00 23.12 19.10 2yqg s ALA 92 CO -0.06 -1.74 0.02 -0.51 0.00 0.00 0.00 175.76 173.48 2yqg s LEU 93 N 4.87 3.57 -0.06 0.00 1.43 0.15 -4.38 118.68 124.26 2yqg s LEU 93 Ca 0.76 -0.13 -0.09 0.00 -1.03 0.00 0.00 54.13 53.64 2yqg s LEU 93 Cb -0.31 -2.28 -0.04 0.00 0.03 0.00 0.00 46.19 43.60 2yqg s LEU 93 CO 0.31 0.17 -0.18 -0.67 0.23 0.00 0.00 176.35 176.21 2yqg n ASP 94 N 0.51 1.48 0.05 2.29 2.03 -1.26 -2.45 116.55 119.19 2yqg n ASP 94 Ca -0.10 0.23 0.00 0.00 0.52 0.00 0.00 54.79 55.44 2yqg n ASP 94 Cb 0.52 -0.53 0.00 0.00 -0.72 0.00 0.00 41.12 40.38 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 -3.96 3.00 -1.40 -1.67 0.00 -1.26 -4.77 120.51 110.45 2yqg n ALA 95 Ca -0.10 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.11 2yqg n ALA 95 Cb 0.33 0.03 0.14 0.00 0.00 0.00 0.00 19.45 19.94 2yqg n ALA 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2yqg n ARG 96 N -2.91 2.44 -4.35 0.00 1.74 -1.26 -4.92 116.66 107.39 2yqg n ARG 96 Ca 0.00 -3.27 -0.37 0.00 -0.77 0.00 0.00 57.85 53.44 2yqg n ARG 96 Cb 0.00 -2.14 -0.07 0.00 -1.02 0.00 0.00 32.46 29.23 2yqg n ARG 96 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2yqg n GLY 97 N -1.03 -0.32 0.27 -0.13 0.00 -1.26 -4.76 105.19 97.96 2yqg n GLY 97 Ca 0.53 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.67 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 -2.67 0.60 -4.08 1.61 3.02 -1.26 -4.86 115.26 107.61 2yqg n ASN 98 Ca -0.05 -2.02 -0.30 0.00 -0.03 0.00 0.00 54.58 52.19 2yqg n ASN 98 Cb 0.55 -0.22 -0.03 0.00 -0.61 0.00 0.00 39.78 39.46 2yqg n ASN 98 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2yqg n ASN 99 N -0.23 -1.42 0.11 6.41 0.23 -1.26 -4.73 115.26 114.37 2yqg n ASN 99 Ca 0.01 -1.02 0.15 0.00 -0.53 0.00 0.00 54.58 53.19 2yqg n ASN 99 Cb 0.14 -2.85 0.40 0.00 -2.08 0.00 0.00 39.78 35.38 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 -1.71 0.05 -1.34 3.53 -1.51 -1.89 -3.40 116.25 109.98 2yqg h VAL 100 Ca -0.62 0.00 -0.63 0.00 -1.23 0.00 0.00 66.70 64.22 2yqg h VAL 100 Cb 1.38 0.21 -0.13 0.00 -2.13 0.00 0.00 31.29 30.62 2yqg h VAL 100 CO 0.69 0.00 -0.57 -1.61 -1.23 0.00 0.00 177.57 174.85 2yqg s GLU 101 N -4.25 2.02 -0.16 5.19 2.02 -1.26 -5.13 118.70 117.12 2yqg s GLU 101 Ca -0.02 -2.20 -0.16 0.00 0.02 0.00 0.00 54.97 52.61 2yqg s GLU 101 Cb 0.08 -1.53 -0.04 0.00 0.10 0.00 0.00 34.13 32.75 2yqg s GLU 101 CO 0.29 -0.17 0.40 0.21 0.02 0.00 0.00 175.26 176.00 2yqg s LYS 102 N -3.78 4.26 0.43 1.61 2.20 -1.26 -4.92 119.74 118.28 2yqg s LYS 102 Ca 0.25 0.26 -0.07 0.00 -0.36 0.00 0.00 55.97 56.05 2yqg s LYS 102 Cb 0.07 -3.47 0.11 0.00 -1.51 0.00 0.00 37.83 33.03 2yqg s LYS 102 CO 0.13 0.11 0.38 -0.35 -0.36 0.00 0.00 175.35 175.26 2yqg n PRO 103 N 3.93 -1.76 -3.76 4.03 -0.04 -1.26 -4.97 135.00 131.17 2yqg n PRO 103 Ca -0.09 -0.61 -0.11 0.00 -0.04 0.00 0.00 63.50 62.66 2yqg n PRO 103 Cb 0.51 -0.57 -0.07 0.00 -0.04 0.00 0.00 33.50 33.34 2yqg n PRO 103 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2yqg s LEU 104 N 0.00 0.95 -0.28 1.53 -0.00 -1.26 -5.03 118.68 114.60 2yqg s LEU 104 Ca 0.25 -0.34 -0.19 0.00 -0.00 0.00 0.00 54.13 53.85 2yqg s LEU 104 Cb -0.02 1.34 -0.02 0.00 -0.00 0.00 0.00 46.19 47.49 2yqg s LEU 104 CO 0.19 -0.69 0.55 -0.70 -0.00 0.00 0.00 176.35 175.70 2yqg s GLU 105 N -3.13 4.00 -0.18 1.48 -6.30 -1.26 -3.60 118.70 109.71 2yqg s GLU 105 Ca -0.01 0.29 -0.06 0.00 -2.50 0.00 0.00 54.97 52.69 2yqg s GLU 105 Cb 0.01 -3.68 -0.03 0.00 0.00 0.00 0.00 34.13 30.43 2yqg s GLU 105 CO -0.07 -0.43 0.03 -1.17 0.02 0.00 0.00 175.26 173.65 2yqg s LEU 106 N 2.39 3.59 0.04 2.70 2.96 -0.38 -5.00 118.68 124.98 2yqg s LEU 106 Ca 0.22 -0.02 0.07 0.00 -0.22 0.00 0.00 54.13 54.18 2yqg s LEU 106 Cb -0.15 -1.90 -0.02 0.00 0.50 0.00 0.00 46.19 44.61 2yqg s LEU 106 CO 0.10 0.14 -0.19 0.00 -1.32 0.00 0.00 176.35 175.08 2yqg s ARG 107 N 0.54 1.29 -0.27 1.98 3.03 -1.26 -0.56 118.95 123.70 2yqg s ARG 107 Ca 0.01 -0.90 -0.01 0.00 2.03 0.00 0.00 55.73 56.87 2yqg s ARG 107 Cb -0.13 -1.38 0.08 0.00 -1.03 0.00 0.00 34.95 32.49 2yqg s ARG 107 CO 0.02 0.35 0.05 0.42 -1.13 0.00 0.00 175.30 175.00 2yqg s ILE 108 N -0.81 0.99 -0.06 4.99 1.01 -0.79 -4.19 121.20 122.35 2yqg s ILE 108 Ca 0.06 -1.20 -0.27 0.00 0.00 0.00 0.00 60.65 59.25 2yqg s ILE 108 Cb -0.09 -1.58 -0.03 0.00 0.01 0.00 0.00 42.46 40.77 2yqg s ILE 108 CO 0.02 -0.44 0.86 -0.75 0.00 0.00 0.00 174.94 174.63 2yqg s LYS 109 N 1.60 4.46 -0.73 2.79 2.20 -1.22 -2.73 119.74 126.10 2yqg s LYS 109 Ca 0.04 1.16 -0.24 0.00 -0.36 0.00 0.00 55.97 56.58 2yqg s LYS 109 Cb -0.18 -3.48 0.06 0.00 -1.51 0.00 0.00 37.83 32.73 2yqg s LYS 109 CO -0.16 -0.08 1.11 0.08 -0.36 0.00 0.00 175.35 175.94 2yqg s VAL 110 N 1.20 4.15 0.26 4.02 1.01 -1.08 -3.58 120.40 126.37 2yqg s VAL 110 Ca 0.44 -0.27 -0.30 0.00 0.00 0.00 0.00 61.98 61.85 2yqg s VAL 110 Cb -0.19 -4.79 -0.11 0.00 0.00 0.00 0.00 36.38 31.30 2yqg s VAL 110 CO 0.21 -1.62 1.54 -0.76 0.00 0.00 0.00 175.10 174.47 2yqg s LEU 111 N 4.50 4.37 0.42 3.92 1.43 -0.82 -4.88 118.68 127.62 2yqg s LEU 111 Ca 0.28 2.80 -0.23 0.00 -1.03 0.00 0.00 54.13 55.95 2yqg s LEU 111 Cb -0.12 -3.62 -0.09 0.00 0.03 0.00 0.00 46.19 42.39 2yqg s LEU 111 CO 0.08 -0.82 1.03 1.51 0.23 0.00 0.00 176.35 178.38 2yqg s ASP 112 N 0.55 6.70 0.46 2.29 -4.77 -1.26 -3.24 116.67 117.40 2yqg s ASP 112 Ca 0.63 1.97 0.31 0.00 -3.30 0.00 0.00 52.55 52.16 2yqg s ASP 112 Cb -0.45 -2.57 1.42 0.00 -1.09 0.00 0.00 42.92 40.23 2yqg s ASP 112 CO 0.43 -0.53 1.66 -0.29 0.70 0.00 0.00 175.17 177.14 2yqg h ILE 113 N 2.03 0.21 -1.36 2.11 6.09 -1.93 0.42 117.51 125.07 2yqg h ILE 113 Ca -0.49 -0.04 -0.62 0.00 -1.37 0.00 0.00 64.86 62.35 2yqg h ILE 113 Cb 1.21 0.08 -0.39 0.00 0.47 0.00 0.00 36.82 38.19 2yqg h ILE 113 CO 0.61 0.02 -0.34 0.59 -3.07 0.00 0.00 178.15 175.97 2yqg n ASN 114 N -4.53 5.46 0.06 2.19 3.02 -1.26 -4.77 115.26 115.42 2yqg n ASN 114 Ca 0.35 -3.75 0.04 0.00 -0.03 0.00 0.00 54.58 51.18 2yqg n ASN 114 Cb 1.39 -0.57 0.20 0.00 -0.61 0.00 0.00 39.78 40.19 2yqg n ASN 114 CO 0.00 0.00 0.00 -0.90 -2.62 0.00 0.00 177.26 173.74 2yqg n ASP 115 N -0.58 0.19 -3.29 6.41 5.68 0.15 -4.80 116.55 120.31 2yqg n ASP 115 Ca 0.45 0.58 -0.22 0.00 -0.50 0.00 0.00 54.79 55.10 2yqg n ASP 115 Cb 0.67 -0.60 -0.01 0.00 -1.14 0.00 0.00 41.12 40.04 2yqg n ASP 115 CO 0.00 0.00 0.00 -3.20 -1.33 0.00 0.00 177.20 172.67 2yqg n ASN 116 N -1.75 -3.37 -4.64 -1.12 2.85 -1.26 -4.84 115.26 101.13 2yqg n ASN 116 Ca -0.00 -0.32 -0.43 0.00 -0.11 0.00 0.00 54.58 53.72 2yqg n ASN 116 Cb 0.02 -2.82 -0.03 0.00 1.24 0.00 0.00 39.78 38.20 2yqg n ASN 116 CO 0.00 0.00 0.00 -1.61 -2.11 0.00 0.00 177.26 173.54 2yqg s GLU 117 N -5.92 3.88 0.96 1.20 2.02 -1.26 -4.99 118.70 114.59 2yqg s GLU 117 Ca 0.36 1.92 -0.12 0.00 0.02 0.00 0.00 54.97 57.15 2yqg s GLU 117 Cb -0.19 -4.06 0.16 0.00 0.10 0.00 0.00 34.13 30.14 2yqg s GLU 117 CO 0.44 -1.20 1.09 -1.25 0.02 0.00 0.00 175.26 174.36 2yqg s PRO 118 N 4.60 0.77 -0.07 0.39 0.04 -1.26 -5.01 135.00 134.46 2yqg s PRO 118 Ca 0.76 0.64 -0.22 0.00 0.04 0.00 0.00 61.00 62.21 2yqg s PRO 118 Cb -0.29 -1.77 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 2yqg s PRO 118 CO 0.31 -2.53 0.66 0.14 0.04 0.00 0.00 177.00 175.62 2yqg s VAL 119 N -2.95 5.06 0.57 -0.36 -7.23 -1.26 -5.07 120.40 109.15 2yqg s VAL 119 Ca 0.65 1.36 0.08 0.00 -1.81 0.00 0.00 61.98 62.26 2yqg s VAL 119 Cb -0.18 -4.00 0.08 0.00 0.56 0.00 0.00 36.38 32.84 2yqg s VAL 119 CO 0.57 0.27 0.79 0.72 -0.31 0.00 0.00 175.10 177.14 2yqg s PHE 120 N 0.71 1.63 -0.05 2.82 -0.12 -1.26 -5.13 117.98 116.58 2yqg s PHE 120 Ca 0.35 -0.63 0.02 0.00 -0.05 0.00 0.00 56.93 56.63 2yqg s PHE 120 Cb -0.17 -2.32 0.01 0.00 -0.63 0.00 0.00 43.02 39.90 2yqg s PHE 120 CO 0.17 -1.12 -0.11 0.99 -0.05 0.00 0.00 175.22 175.11 2yqg s THR 121 N -2.68 0.99 0.00 -4.49 2.01 -1.26 -5.14 115.64 105.07 2yqg s THR 121 Ca 0.61 -0.41 0.03 0.00 0.31 0.00 0.00 61.69 62.23 2yqg s THR 121 Cb -0.06 -0.91 -0.01 0.00 0.01 0.00 0.00 72.50 71.53 2yqg s THR 121 CO 0.39 0.32 -0.09 -1.58 -0.69 0.00 0.00 174.62 172.96 2yqg s GLN 122 N 0.56 0.69 0.00 4.92 2.00 -1.26 -5.36 119.66 121.21 2yqg s GLN 122 Ca -0.11 -0.39 0.02 0.00 -2.00 0.00 0.00 55.36 52.88 2yqg s GLN 122 Cb -0.14 -0.65 0.11 0.00 0.80 0.00 0.00 33.01 33.13 2yqg s GLN 122 CO 0.02 0.17 0.60 -0.40 -0.50 0.00 0.00 175.29 175.19