#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yqi s SER 2 N 0.00 2.41 -0.01 1.61 0.15 -1.26 -5.15 113.70 111.46 2yqi s SER 2 Ca 0.00 -0.56 0.01 0.00 0.70 0.00 0.00 55.95 56.10 2yqi s SER 2 Cb 0.00 -0.18 0.00 0.00 -1.71 0.00 0.00 66.02 64.13 2yqi s SER 2 CO 0.00 0.12 -0.03 -0.94 1.20 0.00 0.00 173.24 173.59 2yqi s SER 3 N -1.35 0.42 -0.30 5.45 1.04 -1.26 -5.13 113.70 112.56 2yqi s SER 3 Ca 0.07 -0.06 -0.08 0.00 0.48 0.00 0.00 55.95 56.36 2yqi s SER 3 Cb -0.09 -0.07 0.16 0.00 0.10 0.00 0.00 66.02 66.13 2yqi s SER 3 CO 0.02 0.03 0.73 -0.83 0.98 0.00 0.00 173.24 174.17 2yqi s GLY 4 N 0.03 -0.70 -0.09 7.32 0.00 -1.26 -5.15 107.32 107.48 2yqi s GLY 4 Ca 0.00 2.33 0.02 0.00 0.00 0.00 0.00 44.72 47.07 2yqi s GLY 4 CO -0.00 3.29 -0.14 -0.56 0.00 0.00 0.00 173.10 175.68 2yqi s SER 5 N 2.82 2.17 -0.05 1.64 0.01 -1.26 -5.13 113.70 113.89 2yqi s SER 5 Ca 0.05 -0.37 0.01 0.00 1.31 0.00 0.00 55.95 56.95 2yqi s SER 5 Cb -0.12 -0.98 -0.03 0.00 0.21 0.00 0.00 66.02 65.10 2yqi s SER 5 CO -0.19 0.03 -0.04 -0.94 0.41 0.00 0.00 173.24 172.51 2yqi s SER 6 N 0.81 4.82 0.00 2.44 1.04 -1.26 -4.89 113.70 116.66 2yqi s SER 6 Ca -0.11 -0.01 0.00 0.00 0.48 0.00 0.00 55.95 56.30 2yqi s SER 6 Cb -0.16 -1.23 0.00 0.00 0.10 0.00 0.00 66.02 64.73 2yqi s SER 6 CO 0.02 0.34 0.00 0.61 0.98 0.00 0.00 173.24 175.18 2yqi n GLY 7 N 1.94 -2.04 3.53 7.32 0.00 -1.26 -4.95 105.19 109.73 2yqi n GLY 7 Ca -0.17 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 2yqi n GLY 7 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2yqi s ASN 8 N 0.00 6.41 0.01 1.61 0.01 -1.26 -4.99 114.94 116.73 2yqi s ASN 8 Ca 0.00 -1.27 0.05 0.00 -0.71 0.00 0.00 52.86 50.93 2yqi s ASN 8 Cb 0.00 -2.53 -0.03 0.00 0.41 0.00 0.00 41.25 39.10 2yqi s ASN 8 CO 0.00 -1.51 -0.14 0.00 -1.51 0.00 0.00 177.10 173.94 2yqi s ALA 9 N 4.71 2.72 0.94 0.60 0.00 -1.26 -5.08 121.76 124.40 2yqi s ALA 9 Ca 0.39 -1.09 -0.12 0.00 0.00 0.00 0.00 51.96 51.14 2yqi s ALA 9 Cb -0.04 -0.90 0.16 0.00 0.00 0.00 0.00 23.12 22.34 2yqi s ALA 9 CO -0.02 0.58 1.09 -1.25 0.00 0.00 0.00 175.76 176.16 2yqi s PRO 10 N -1.26 0.88 0.03 0.00 0.04 -1.26 -5.08 135.00 128.35 2yqi s PRO 10 Ca 0.15 0.68 0.02 0.00 0.04 0.00 0.00 61.00 61.88 2yqi s PRO 10 Cb -0.11 -1.78 -0.02 0.00 0.04 0.00 0.00 34.50 32.64 2yqi s PRO 10 CO 0.05 -2.46 -0.06 -1.59 0.04 0.00 0.00 177.00 172.97 2yqi s LYS 11 N -4.95 0.45 0.29 4.56 0.00 -1.26 -5.09 119.74 113.75 2yqi s LYS 11 Ca 0.64 -0.65 -0.25 0.00 0.00 0.00 0.00 55.97 55.71 2yqi s LYS 11 Cb -0.18 -0.19 -0.16 0.00 0.00 0.00 0.00 37.83 37.30 2yqi s LYS 11 CO 0.57 0.03 0.40 0.54 0.00 0.00 0.00 175.35 176.89 2yqi n ARG 12 N 1.67 0.13 -2.26 1.78 1.74 -1.26 -4.88 116.66 113.58 2yqi n ARG 12 Ca -0.22 0.05 -0.36 0.00 -0.77 0.00 0.00 57.85 56.55 2yqi n ARG 12 Cb 0.55 -1.09 -0.00 0.00 -1.02 0.00 0.00 32.46 30.90 2yqi n ARG 12 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2yqi s PRO 13 N -1.08 3.53 0.57 5.56 0.04 -1.26 -5.01 135.00 137.34 2yqi s PRO 13 Ca 0.62 1.68 -0.18 0.00 0.04 0.00 0.00 61.00 63.15 2yqi s PRO 13 Cb -0.79 -2.17 -0.05 0.00 0.04 0.00 0.00 34.50 31.54 2yqi s PRO 13 CO 0.59 -0.72 1.12 -1.25 0.04 0.00 0.00 177.00 176.78 2yqi s PRO 14 N -3.04 3.23 0.06 0.56 0.04 -1.26 -5.02 135.00 129.57 2yqi s PRO 14 Ca 0.69 1.56 0.00 0.00 0.04 0.00 0.00 61.00 63.29 2yqi s PRO 14 Cb -0.26 -1.99 -0.04 0.00 0.04 0.00 0.00 34.50 32.25 2yqi s PRO 14 CO 0.30 -0.94 0.18 -1.54 0.04 0.00 0.00 177.00 175.04 2yqi s SER 15 N -1.96 6.18 0.41 6.66 1.04 -1.26 -4.71 113.70 120.06 2yqi s SER 15 Ca 0.71 0.22 0.32 0.00 0.48 0.00 0.00 55.95 57.68 2yqi s SER 15 Cb -0.23 -1.86 1.37 0.00 0.10 0.00 0.00 66.02 65.39 2yqi s SER 15 CO 0.30 0.18 1.37 0.61 0.98 0.00 0.00 173.24 176.68 2yqi n GLY 16 N 0.39 -0.77 0.21 7.32 0.00 -1.25 0.18 105.19 111.27 2yqi n GLY 16 Ca -0.06 0.66 -0.10 0.00 0.00 0.00 0.00 46.02 46.52 2yqi n GLY 16 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2yqi h PHE 17 N 0.00 0.69 0.21 1.61 3.57 -1.93 -2.81 116.94 118.28 2yqi h PHE 17 Ca 0.79 -0.09 -0.01 0.00 3.53 0.00 0.00 57.97 62.19 2yqi h PHE 17 Cb 2.70 -0.19 0.00 0.00 2.79 0.00 0.00 35.95 41.25 2yqi h PHE 17 CO -0.00 0.67 -0.10 0.35 -2.23 0.00 0.00 178.31 177.00 2yqi h PHE 18 N 0.52 -0.26 -1.08 0.41 3.04 0.16 -2.57 116.94 117.16 2yqi h PHE 18 Ca 0.13 -0.01 0.42 0.00 3.98 0.00 0.00 57.97 62.49 2yqi h PHE 18 Cb 0.34 0.09 -0.17 0.00 2.56 0.00 0.00 35.95 38.76 2yqi h PHE 18 CO 0.02 0.11 0.62 -0.07 -2.02 0.00 0.00 178.31 176.97 2yqi h LEU 19 N -0.92 0.32 -0.05 0.59 3.38 -1.27 1.31 115.31 118.66 2yqi h LEU 19 Ca -0.03 0.23 -0.25 0.00 0.09 0.00 0.00 57.88 57.91 2yqi h LEU 19 Cb 0.49 0.23 0.01 0.00 0.09 0.00 0.00 40.66 41.48 2yqi h LEU 19 CO 0.05 -0.36 -1.05 0.15 0.09 0.00 0.00 178.44 177.31 2yqi h PHE 20 N 0.04 0.79 -0.13 1.13 3.04 -1.53 -2.77 116.94 117.51 2yqi h PHE 20 Ca 0.84 -0.45 -0.06 0.00 3.98 0.00 0.00 57.97 62.28 2yqi h PHE 20 Cb 2.30 -0.08 -0.01 0.00 2.56 0.00 0.00 35.95 40.72 2yqi h PHE 20 CO -0.01 1.29 -0.20 0.00 -2.02 0.00 0.00 178.31 177.37 2yqi h SER 22 N 0.21 0.00 1.24 0.00 0.87 -0.70 -0.40 113.55 114.77 2yqi h SER 22 Ca 0.04 0.00 -0.08 0.00 -1.23 0.00 0.00 61.79 60.52 2yqi h SER 22 Cb 0.47 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.42 2yqi h SER 22 CO 0.03 0.76 -0.79 -0.08 -0.53 0.00 0.00 176.83 176.22 2yqi h GLU 23 N 0.00 0.00 0.00 2.24 4.81 -1.14 -3.31 114.58 117.18 2yqi h GLU 23 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 2yqi h GLU 23 Cb 1.53 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.91 2yqi h GLU 23 CO 0.10 0.22 -1.45 1.19 -0.73 0.00 0.00 179.01 178.34 2yqi n PHE 24 N -2.97 0.16 -0.23 0.92 3.01 0.25 -4.35 117.46 114.25 2yqi n PHE 24 Ca -0.01 0.05 0.03 0.00 1.01 0.00 0.00 57.45 58.52 2yqi n PHE 24 Cb 0.68 -0.43 0.14 0.00 -0.01 0.00 0.00 39.48 39.87 2yqi n PHE 24 CO 0.00 0.00 0.00 -0.09 1.01 0.00 0.00 176.76 177.68 2yqi h ARG 25 N 0.00 0.38 -0.37 -1.08 2.43 -1.15 -2.47 114.38 112.12 2yqi h ARG 25 Ca 0.00 -0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.22 2yqi h ARG 25 Cb 0.83 -0.09 -0.09 0.00 -0.42 0.00 0.00 29.97 30.20 2yqi h ARG 25 CO 0.00 0.25 -0.38 -1.35 -1.51 0.00 0.00 179.97 176.98 2yqi h PRO 26 N 0.39 -0.30 -0.19 0.20 0.11 -1.77 0.82 132.00 131.27 2yqi h PRO 26 Ca 0.36 0.02 0.05 0.00 0.11 0.00 0.00 66.00 66.54 2yqi h PRO 26 Cb 0.51 0.07 -0.05 0.00 0.11 0.00 0.00 31.00 31.64 2yqi h PRO 26 CO -0.38 -0.20 -0.12 0.87 -0.21 0.00 0.00 178.00 177.97 2yqi h LYS 27 N -0.31 -0.10 -0.69 1.05 1.57 -1.72 0.10 116.57 116.46 2yqi h LYS 27 Ca 0.15 0.01 0.08 0.00 -1.87 0.00 0.00 60.65 59.02 2yqi h LYS 27 Cb 0.57 0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.84 2yqi h LYS 27 CO -0.53 -0.07 0.35 0.82 -0.57 0.00 0.00 179.45 179.45 2yqi h ILE 28 N -0.11 0.88 0.00 1.86 2.04 -1.11 0.70 117.51 121.78 2yqi h ILE 28 Ca 0.11 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.76 2yqi h ILE 28 Cb 0.27 0.21 0.00 0.00 -0.74 0.00 0.00 36.82 36.56 2yqi h ILE 28 CO -0.26 0.11 0.00 0.11 0.00 0.00 0.00 178.15 178.12 2yqi h LYS 29 N 0.62 0.00 0.00 2.37 1.57 -0.14 0.21 116.57 121.20 2yqi h LYS 29 Ca 0.33 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.11 2yqi h LYS 29 Cb 0.31 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.62 2yqi h LYS 29 CO -0.24 0.00 -1.45 0.45 -0.57 0.00 0.00 179.45 177.64 2yqi n SER 30 N -2.78 0.43 -0.08 0.86 2.88 0.33 -4.42 113.62 110.84 2yqi n SER 30 Ca 0.02 -0.15 -0.22 0.00 -1.33 0.00 0.00 58.87 57.18 2yqi n SER 30 Cb 0.30 1.30 -0.12 0.00 -0.75 0.00 0.00 64.21 64.94 2yqi n SER 30 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 2yqi n THR 31 N -2.13 1.60 -3.23 2.46 -2.24 0.22 -4.89 114.28 106.07 2yqi n THR 31 Ca -0.01 -0.45 -0.39 0.00 -2.27 0.00 0.00 64.05 60.93 2yqi n THR 31 Cb 0.50 -1.74 -0.06 0.00 -2.10 0.00 0.00 70.33 66.92 2yqi n THR 31 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2yqi s ASN 32 N -6.95 6.64 0.22 3.42 0.01 0.03 -5.05 114.94 113.27 2yqi s ASN 32 Ca -0.30 0.77 -0.30 0.00 -0.71 0.00 0.00 52.86 52.32 2yqi s ASN 32 Cb 0.09 -2.31 -0.09 0.00 0.41 0.00 0.00 41.25 39.35 2yqi s ASN 32 CO 0.63 -0.14 1.29 -2.16 -1.51 0.00 0.00 177.10 175.21 2yqi s PRO 33 N 1.34 4.41 -1.19 -0.60 0.04 -1.26 -3.60 135.00 134.15 2yqi s PRO 33 Ca 0.26 2.05 -0.00 0.00 0.04 0.00 0.00 61.00 63.35 2yqi s PRO 33 Cb -0.16 -3.18 0.00 0.00 0.04 0.00 0.00 34.50 31.21 2yqi s PRO 33 CO 0.10 -0.20 0.01 0.41 0.04 0.00 0.00 177.00 177.36 2yqi n GLY 34 N 2.04 -0.10 3.81 0.56 0.00 -1.26 -4.87 105.19 105.36 2yqi n GLY 34 Ca 0.05 0.14 -0.30 0.00 0.00 0.00 0.00 46.02 45.90 2yqi n GLY 34 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2yqi s ILE 35 N -4.06 3.34 0.00 -0.61 2.07 -1.24 -5.07 121.20 115.63 2yqi s ILE 35 Ca 0.00 0.43 0.07 0.00 -1.41 0.00 0.00 60.65 59.75 2yqi s ILE 35 Cb -0.00 -3.17 -0.02 0.00 0.13 0.00 0.00 42.46 39.40 2yqi s ILE 35 CO 0.77 -0.57 -0.21 -0.44 -1.91 0.00 0.00 174.94 172.58 2yqi s SER 36 N -3.86 2.51 0.32 4.50 0.01 -1.26 -5.01 113.70 110.91 2yqi s SER 36 Ca 0.60 -0.43 0.21 0.00 1.31 0.00 0.00 55.95 57.64 2yqi s SER 36 Cb -0.14 -0.26 1.12 0.00 0.21 0.00 0.00 66.02 66.95 2yqi s SER 36 CO 0.54 0.23 1.23 -0.38 0.41 0.00 0.00 173.24 175.28 2yqi n ILE 37 N 2.33 -0.26 -0.04 1.44 5.41 -1.26 0.12 119.36 127.10 2yqi n ILE 37 Ca -0.16 1.50 -0.09 0.00 1.00 0.00 0.00 62.75 65.01 2yqi n ILE 37 Cb 0.53 -2.45 -0.03 0.00 -0.71 0.00 0.00 39.64 36.98 2yqi n ILE 37 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 2yqi h GLY 38 N 0.00 0.17 0.76 7.39 0.00 -2.00 -0.55 103.07 108.85 2yqi h GLY 38 Ca 0.68 0.04 -0.00 0.00 0.00 0.00 0.00 47.33 48.05 2yqi h GLY 38 CO -0.48 -0.05 -0.01 -0.55 0.00 0.00 0.00 176.54 175.45 2yqi h ASP 39 N 0.04 -0.02 -0.63 0.19 3.32 0.52 -2.98 116.42 116.86 2yqi h ASP 39 Ca 0.09 -0.23 0.12 0.00 0.02 0.00 0.00 57.03 57.04 2yqi h ASP 39 Cb 0.13 0.01 -0.09 0.00 0.22 0.00 0.00 39.33 39.59 2yqi h ASP 39 CO -0.17 0.22 0.14 0.58 -1.72 0.00 0.00 179.24 178.28 2yqi h VAL 40 N -0.27 0.62 -0.34 -1.35 2.07 -1.29 -1.49 116.25 114.20 2yqi h VAL 40 Ca -0.00 -0.09 0.07 0.00 0.82 0.00 0.00 66.70 67.49 2yqi h VAL 40 Cb 0.25 0.33 -0.07 0.00 -1.52 0.00 0.00 31.29 30.28 2yqi h VAL 40 CO 0.00 0.05 -0.10 0.00 0.02 0.00 0.00 177.57 177.54 2yqi h ALA 41 N 1.50 0.20 -0.22 1.67 0.00 -1.02 0.19 119.26 121.59 2yqi h ALA 41 Ca 0.33 0.13 0.05 0.00 0.00 0.00 0.00 54.91 55.42 2yqi h ALA 41 Cb 0.51 0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.54 2yqi h ALA 41 CO -0.42 -0.48 -0.07 -0.22 0.00 0.00 0.00 179.25 178.06 2yqi h LYS 42 N -0.02 -0.03 0.55 0.00 3.64 -1.14 -1.92 116.57 117.64 2yqi h LYS 42 Ca 0.17 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.52 2yqi h LYS 42 Cb 0.27 0.01 0.01 0.00 -0.41 0.00 0.00 32.23 32.11 2yqi h LYS 42 CO -0.36 -0.02 -0.26 0.87 -2.27 0.00 0.00 179.45 177.41 2yqi h LYS 43 N -0.03 -0.71 -0.32 1.90 1.57 -0.78 -3.12 116.57 115.08 2yqi h LYS 43 Ca 0.11 0.05 0.03 0.00 -1.87 0.00 0.00 60.65 58.97 2yqi h LYS 43 Cb 0.20 0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.62 2yqi h LYS 43 CO -0.24 -0.46 -0.29 -0.07 -0.57 0.00 0.00 179.45 177.81 2yqi h LEU 44 N -0.75 -1.02 -0.90 2.94 3.38 -0.44 0.13 115.31 118.66 2yqi h LEU 44 Ca -0.07 0.14 0.32 0.00 0.09 0.00 0.00 57.88 58.36 2yqi h LEU 44 Cb 0.57 0.43 -0.16 0.00 0.09 0.00 0.00 40.66 41.59 2yqi h LEU 44 CO 0.12 -0.17 0.29 0.61 0.09 0.00 0.00 178.44 179.38 2yqi n GLY 45 N -1.17 -0.91 0.18 0.83 0.00 -0.74 -0.18 105.19 103.20 2yqi n GLY 45 Ca -0.01 0.79 -0.12 0.00 0.00 0.00 0.00 46.02 46.68 2yqi n GLY 45 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2yqi h GLU 46 N 0.00 -0.35 -1.02 1.61 4.39 -0.75 -2.73 114.58 115.74 2yqi h GLU 46 Ca 0.67 0.02 0.25 0.00 0.34 0.00 0.00 59.36 60.65 2yqi h GLU 46 Cb 1.64 0.08 -0.11 0.00 -0.10 0.00 0.00 28.75 30.25 2yqi h GLU 46 CO -0.76 0.01 0.62 0.52 -1.16 0.00 0.00 179.01 178.24 2yqi h MET 47 N -0.83 0.51 0.56 2.33 2.86 0.11 0.02 114.93 120.49 2yqi h MET 47 Ca -0.04 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.55 2yqi h MET 47 Cb 0.51 -0.11 0.01 0.00 0.06 0.00 0.00 31.60 32.06 2yqi h MET 47 CO 0.06 0.34 -0.27 2.35 1.06 0.00 0.00 176.91 180.45 2yqi h TRP 48 N 0.52 -0.69 -0.75 -0.22 2.91 -0.99 -2.81 115.95 113.93 2yqi h TRP 48 Ca 0.63 -0.02 0.14 0.00 1.13 0.00 0.00 58.89 60.77 2yqi h TRP 48 Cb 1.32 0.23 -0.05 0.00 -0.51 0.00 0.00 29.16 30.15 2yqi h TRP 48 CO -0.00 -0.37 0.50 -0.97 -1.03 0.00 0.00 178.44 176.57 2yqi h ASN 49 N -0.95 0.43 -0.64 2.65 -0.73 -0.94 -0.98 115.58 114.41 2yqi h ASN 49 Ca -0.08 0.02 0.02 0.00 1.87 0.00 0.00 56.30 58.13 2yqi h ASN 49 Cb 0.64 -0.06 -0.04 0.00 0.27 0.00 0.00 38.32 39.13 2yqi h ASN 49 CO 0.13 0.23 0.41 0.78 -0.37 0.00 0.00 177.43 178.61 2yqi h ASN 50 N 0.46 0.70 -2.82 1.15 2.35 -0.87 -3.44 115.58 113.12 2yqi h ASN 50 Ca 0.37 -0.01 -0.53 0.00 -0.55 0.00 0.00 56.30 55.57 2yqi h ASN 50 Cb 0.77 -0.16 0.23 0.00 0.05 0.00 0.00 38.32 39.21 2yqi h ASN 50 CO -0.12 0.50 -1.09 0.18 -1.65 0.00 0.00 177.43 175.24 2yqi n LEU 51 N -4.67 -2.36 -4.91 1.61 4.77 -0.37 -5.00 117.00 106.07 2yqi n LEU 51 Ca 0.06 0.25 -0.21 0.00 -0.03 0.00 0.00 56.01 56.08 2yqi n LEU 51 Cb 0.05 -1.03 -0.02 0.00 -2.33 0.00 0.00 43.42 40.09 2yqi n LEU 51 CO 0.34 -4.39 -0.04 0.20 -1.33 0.00 0.00 177.39 172.17 2yqi s ASN 52 N -1.64 5.70 0.35 -1.43 0.01 -1.26 -4.96 114.94 111.71 2yqi s ASN 52 Ca 0.51 -0.27 0.21 0.00 -0.71 0.00 0.00 52.86 52.59 2yqi s ASN 52 Cb -0.19 -1.26 1.12 0.00 0.41 0.00 0.00 41.25 41.33 2yqi s ASN 52 CO 0.73 -0.28 1.60 0.44 -1.51 0.00 0.00 177.10 178.07 2yqi h ASP 53 N 1.16 0.00 0.39 -1.22 3.32 -1.97 0.23 116.42 118.34 2yqi h ASP 53 Ca -0.47 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.45 2yqi h ASP 53 Cb 1.25 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.77 2yqi h ASP 53 CO 0.57 0.00 -1.73 -1.20 -1.72 0.00 0.00 179.24 175.16 2yqi n SER 54 N -2.26 0.42 0.09 6.45 7.64 -1.26 -3.60 113.62 121.11 2yqi n SER 54 Ca -0.01 0.18 -0.14 0.00 1.01 0.00 0.00 58.87 59.91 2yqi n SER 54 Cb 0.13 0.92 -0.11 0.00 -1.01 0.00 0.00 64.21 64.15 2yqi n SER 54 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 2yqi h GLU 55 N 0.00 0.27 0.00 1.43 4.39 -0.94 -3.23 114.58 116.51 2yqi h GLU 55 Ca -0.17 -0.40 0.00 0.00 0.34 0.00 0.00 59.36 59.13 2yqi h GLU 55 Cb 1.46 0.14 0.00 0.00 -0.10 0.00 0.00 28.75 30.25 2yqi h GLU 55 CO 0.02 1.15 0.00 0.87 -1.16 0.00 0.00 179.01 179.90 2yqi h LYS 56 N 0.10 0.00 -0.38 2.33 1.57 -1.55 -3.35 116.57 115.29 2yqi h LYS 56 Ca -0.11 0.00 0.06 0.00 -1.87 0.00 0.00 60.65 58.73 2yqi h LYS 56 Cb 1.83 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 34.06 2yqi h LYS 56 CO 0.18 0.00 -0.48 1.96 -0.57 0.00 0.00 179.45 180.54 2yqi h GLN 57 N 0.00 -0.36 0.00 3.15 1.08 -1.61 0.83 115.11 118.19 2yqi h GLN 57 Ca 0.00 0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 2yqi h GLN 57 Cb 0.94 0.08 0.00 0.00 -0.05 0.00 0.00 27.48 28.45 2yqi h GLN 57 CO 0.00 -0.24 0.00 -0.35 -0.95 0.00 0.00 178.83 177.29 2yqi n PRO 58 N -5.41 0.03 -0.02 1.46 -0.04 -1.25 -2.00 135.00 127.76 2yqi n PRO 58 Ca -0.02 0.28 -0.02 0.00 -0.04 0.00 0.00 63.50 63.70 2yqi n PRO 58 Cb 0.35 -1.55 -0.13 0.00 -0.04 0.00 0.00 33.50 32.13 2yqi n PRO 58 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2yqi n TYR 59 N -1.60 0.47 0.09 0.54 4.01 0.11 -3.96 117.16 116.81 2yqi n TYR 59 Ca 0.03 0.16 -0.23 0.00 -0.16 0.00 0.00 57.90 57.70 2yqi n TYR 59 Cb 0.17 -0.95 -0.15 0.00 -0.31 0.00 0.00 39.34 38.10 2yqi n TYR 59 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 2yqi h ILE 60 N 0.00 0.99 -0.84 -0.72 2.04 0.83 -3.31 117.51 116.50 2yqi h ILE 60 Ca -0.27 -2.54 0.02 0.00 1.00 0.00 0.00 64.86 63.07 2yqi h ILE 60 Cb 1.71 2.81 -0.04 0.00 -0.74 0.00 0.00 36.82 40.56 2yqi h ILE 60 CO 0.03 0.85 0.55 0.74 0.00 0.00 0.00 178.15 180.33 2yqi h THR 61 N 0.12 1.18 -0.68 -0.27 2.02 -1.60 -1.86 112.91 111.81 2yqi h THR 61 Ca -0.33 -0.38 0.05 0.00 0.77 0.00 0.00 66.41 66.52 2yqi h THR 61 Cb 2.12 -0.02 -0.04 0.00 -1.74 0.00 0.00 68.15 68.47 2yqi h THR 61 CO 0.20 0.20 0.45 0.50 0.37 0.00 0.00 175.52 177.24 2yqi h LYS 62 N 1.10 0.71 -0.48 6.66 3.64 -1.70 -1.87 116.57 124.64 2yqi h LYS 62 Ca 0.32 -0.04 -0.11 0.00 -1.27 0.00 0.00 60.65 59.54 2yqi h LYS 62 Cb -0.08 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 31.57 2yqi h LYS 62 CO -0.08 0.47 -0.13 0.00 -2.27 0.00 0.00 179.45 177.43 2yqi h ALA 63 N 1.62 0.66 -0.64 5.00 0.00 -1.45 -2.84 119.26 121.61 2yqi h ALA 63 Ca 0.29 -0.35 0.16 0.00 0.00 0.00 0.00 54.91 55.01 2yqi h ALA 63 Cb 0.20 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 2yqi h ALA 63 CO -0.09 0.58 0.45 0.00 0.00 0.00 0.00 179.25 180.19 2yqi h ALA 64 N 0.88 2.43 0.00 0.00 0.00 -0.98 0.31 119.26 121.90 2yqi h ALA 64 Ca 0.12 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.92 2yqi h ALA 64 Cb 0.69 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 2yqi h ALA 64 CO 0.05 -0.61 -0.45 0.87 0.00 0.00 0.00 179.25 179.11 2yqi h LYS 65 N 0.12 0.00 0.00 0.00 1.79 -1.40 -2.97 116.57 114.11 2yqi h LYS 65 Ca 0.31 0.00 -0.18 0.00 -2.18 0.00 0.00 60.65 58.60 2yqi h LYS 65 Cb 1.05 0.00 -0.03 0.00 -1.58 0.00 0.00 32.23 31.67 2yqi h LYS 65 CO -0.04 0.45 -0.87 -0.07 -1.08 0.00 0.00 179.45 177.85 2yqi h LEU 66 N 0.00 0.00 0.01 2.94 3.38 -0.39 -3.25 115.31 118.00 2yqi h LEU 66 Ca -0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2yqi h LEU 66 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 2yqi h LEU 66 CO 0.06 0.87 -0.00 0.50 0.09 0.00 0.00 178.44 179.95 2yqi h LYS 67 N 0.00 -0.01 -1.00 1.13 3.11 -1.28 -1.33 116.57 117.20 2yqi h LYS 67 Ca -0.01 0.00 0.19 0.00 -2.81 0.00 0.00 60.65 58.03 2yqi h LYS 67 Cb 1.61 0.00 -0.10 0.00 -1.00 0.00 0.00 32.23 32.74 2yqi h LYS 67 CO 0.11 0.53 0.61 1.05 -2.81 0.00 0.00 179.45 178.95 2yqi h GLU 68 N -0.55 0.69 -0.04 1.90 4.11 -1.63 -0.27 114.58 118.80 2yqi h GLU 68 Ca -0.00 -0.04 -0.26 0.00 0.07 0.00 0.00 59.36 59.13 2yqi h GLU 68 Cb 0.54 -0.16 0.02 0.00 0.50 0.00 0.00 28.75 29.65 2yqi h GLU 68 CO 0.00 0.46 -0.99 -0.22 0.07 0.00 0.00 179.01 178.34 2yqi h LYS 69 N 0.72 0.73 -0.58 1.06 3.64 -1.58 -3.28 116.57 117.26 2yqi h LYS 69 Ca 0.57 -0.74 0.09 0.00 -1.27 0.00 0.00 60.65 59.30 2yqi h LYS 69 Cb 0.95 0.20 -0.07 0.00 -0.41 0.00 0.00 32.23 32.90 2yqi h LYS 69 CO -0.36 1.32 0.21 -0.92 -2.27 0.00 0.00 179.45 177.43 2yqi h TYR 70 N 0.43 0.37 -0.71 1.91 3.20 0.12 -1.66 116.97 120.64 2yqi h TYR 70 Ca -0.11 0.03 0.15 0.00 3.14 0.00 0.00 58.73 61.94 2yqi h TYR 70 Cb 1.63 -0.08 -0.11 0.00 1.54 0.00 0.00 36.73 39.72 2yqi h TYR 70 CO 0.10 0.10 0.13 0.93 -1.64 0.00 0.00 178.16 177.78 2yqi h GLU 71 N 0.39 0.22 0.09 1.82 5.08 -1.37 0.41 114.58 121.23 2yqi h GLU 71 Ca 0.29 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.64 2yqi h GLU 71 Cb 0.35 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 2yqi h GLU 71 CO -0.29 0.15 -0.10 0.87 -1.00 0.00 0.00 179.01 178.64 2yqi h LYS 72 N 0.23 -0.20 -0.27 2.33 1.79 -1.42 -0.03 116.57 119.00 2yqi h LYS 72 Ca 0.39 0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.84 2yqi h LYS 72 Cb 0.67 0.05 -0.01 0.00 -1.58 0.00 0.00 32.23 31.35 2yqi h LYS 72 CO -0.52 -0.14 0.01 0.22 -1.08 0.00 0.00 179.45 177.94 2yqi h ASP 73 N -0.21 0.36 -0.41 0.86 1.82 -0.95 -2.01 116.42 115.88 2yqi h ASP 73 Ca 0.01 -0.05 -0.10 0.00 -0.39 0.00 0.00 57.03 56.50 2yqi h ASP 73 Cb 0.21 -0.09 -0.01 0.00 0.68 0.00 0.00 39.33 40.11 2yqi h ASP 73 CO -0.03 0.42 -0.12 0.58 -1.61 0.00 0.00 179.24 178.47 2yqi h VAL 74 N 0.39 1.28 0.12 2.25 2.07 0.33 -1.32 116.25 121.36 2yqi h VAL 74 Ca 0.09 -1.23 -0.01 0.00 0.82 0.00 0.00 66.70 66.37 2yqi h VAL 74 Cb 0.24 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 31.22 2yqi h VAL 74 CO 0.00 0.41 -0.06 0.00 0.02 0.00 0.00 177.57 177.95 2yqi h ALA 75 N 0.84 -0.17 -0.30 1.67 0.00 -0.64 -1.76 119.26 118.91 2yqi h ALA 75 Ca 0.10 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 54.89 2yqi h ALA 75 Cb 0.66 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.49 2yqi h ALA 75 CO 0.05 -0.47 0.13 0.22 0.00 0.00 0.00 179.25 179.18 2yqi h ASP 76 N -0.42 0.17 -0.89 0.00 1.82 -1.40 -2.38 116.42 113.32 2yqi h ASP 76 Ca -0.02 0.02 0.06 0.00 -0.39 0.00 0.00 57.03 56.70 2yqi h ASP 76 Cb 0.34 -0.01 -0.06 0.00 0.68 0.00 0.00 39.33 40.28 2yqi h ASP 76 CO 0.03 0.14 0.56 0.22 -1.61 0.00 0.00 179.24 178.57 2yqi h TYR 77 N 0.27 1.03 -0.31 0.28 3.20 -1.22 -1.50 116.97 118.72 2yqi h TYR 77 Ca 0.13 0.03 -0.20 0.00 3.14 0.00 0.00 58.73 61.82 2yqi h TYR 77 Cb 0.07 -0.34 -0.09 0.00 1.54 0.00 0.00 36.73 37.91 2yqi h TYR 77 CO -0.11 0.53 0.26 1.63 -1.64 0.00 0.00 178.16 178.83 2yqi n LYS 78 N -4.59 1.50 0.02 1.82 5.02 -0.67 -3.96 118.16 117.31 2yqi n LYS 78 Ca 0.13 -1.01 0.00 0.00 -2.02 0.00 0.00 58.31 55.40 2yqi n LYS 78 Cb 0.17 -1.40 0.00 0.00 -0.02 0.00 0.00 35.03 33.78 2yqi n LYS 78 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2yqi n SER 79 N 0.56 0.37 -3.71 4.39 2.88 -0.56 -4.98 113.62 112.56 2yqi n SER 79 Ca 0.20 0.07 -0.21 0.00 -1.33 0.00 0.00 58.87 57.60 2yqi n SER 79 Cb 0.63 -0.09 -0.07 0.00 -0.75 0.00 0.00 64.21 63.93 2yqi n SER 79 CO 0.00 0.00 0.00 2.29 -1.23 0.00 0.00 175.04 176.10 2yqi n LYS 80 N -3.15 -0.96 0.00 -1.46 0.00 -1.24 -5.14 118.16 106.21 2yqi n LYS 80 Ca 0.00 0.06 0.04 0.00 -0.00 0.00 0.00 58.31 58.41 2yqi n LYS 80 Cb 0.27 -2.38 0.22 0.00 -0.00 0.00 0.00 35.03 33.15 2yqi n LYS 80 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81