#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cuq s SER 2 N 0.00 -0.83 -0.05 1.61 1.04 -1.26 -5.16 113.70 109.06 2cuq s SER 2 Ca 0.00 0.60 -0.02 0.00 0.48 0.00 0.00 55.95 57.01 2cuq s SER 2 Cb 0.00 1.73 0.03 0.00 0.10 0.00 0.00 66.02 67.88 2cuq s SER 2 CO 0.00 -0.16 0.10 -0.94 0.98 0.00 0.00 173.24 173.23 2cuq s SER 3 N 2.86 -0.06 0.00 7.02 1.04 -1.26 -4.97 113.70 118.33 2cuq s SER 3 Ca 0.06 0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.70 2cuq s SER 3 Cb -0.12 0.12 0.00 0.00 0.10 0.00 0.00 66.02 66.13 2cuq s SER 3 CO -0.16 -0.11 0.00 0.61 0.98 0.00 0.00 173.24 174.56 2cuq n GLY 4 N 3.91 0.02 3.20 7.32 0.00 -1.26 -5.10 105.19 113.28 2cuq n GLY 4 Ca -0.23 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.39 2cuq n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2cuq s SER 5 N -0.03 6.44 -0.21 1.61 0.15 -1.26 -4.98 113.70 115.41 2cuq s SER 5 Ca 0.00 -3.56 -0.08 0.00 0.70 0.00 0.00 55.95 53.01 2cuq s SER 5 Cb 0.00 -2.03 0.09 0.00 -1.71 0.00 0.00 66.02 62.38 2cuq s SER 5 CO 0.00 -0.25 0.46 -0.55 1.20 0.00 0.00 173.24 174.10 2cuq s SER 6 N 0.55 -0.43 -0.13 5.45 0.15 -1.26 -5.15 113.70 112.88 2cuq s SER 6 Ca 0.27 1.09 -0.08 0.00 0.70 0.00 0.00 55.95 57.93 2cuq s SER 6 Cb -0.09 1.47 -0.04 0.00 -1.71 0.00 0.00 66.02 65.64 2cuq s SER 6 CO -0.10 -0.23 0.17 -0.83 1.20 0.00 0.00 173.24 173.45 2cuq s GLY 7 N 2.56 2.17 -0.66 9.45 0.00 -1.26 -5.03 107.32 114.54 2cuq s GLY 7 Ca -0.03 -0.61 -0.26 0.00 0.00 0.00 0.00 44.72 43.82 2cuq s GLY 7 CO -0.14 -0.22 1.88 2.56 0.00 0.00 0.00 173.10 177.18 2cuq s PRO 8 N -0.74 2.61 -0.33 2.90 0.04 -1.26 -4.91 135.00 133.32 2cuq s PRO 8 Ca 0.15 0.45 -0.36 0.00 0.04 0.00 0.00 61.00 61.28 2cuq s PRO 8 Cb -0.12 -4.51 -0.12 0.00 0.04 0.00 0.00 34.50 29.79 2cuq s PRO 8 CO 0.04 -2.85 2.13 0.00 0.04 0.00 0.00 177.00 176.35 2cuq s TYR 10 N 6.71 3.45 -0.30 0.00 1.13 -1.26 -5.08 117.35 121.99 2cuq s TYR 10 Ca 1.08 0.39 -0.11 0.00 -1.41 0.00 0.00 57.07 57.01 2cuq s TYR 10 Cb -0.88 -1.94 0.15 0.00 -1.10 0.00 0.00 41.96 38.19 2cuq s TYR 10 CO 0.51 0.58 0.78 -1.83 -2.51 0.00 0.00 175.55 173.08 2cuq s GLU 11 N -0.73 0.46 -0.75 -3.49 -1.05 -1.26 -5.11 118.70 106.78 2cuq s GLU 11 Ca 0.13 1.13 -0.04 0.00 -0.15 0.00 0.00 54.97 56.04 2cuq s GLU 11 Cb -0.12 0.67 0.19 0.00 -0.44 0.00 0.00 34.13 34.44 2cuq s GLU 11 CO 0.03 -0.20 0.60 -0.80 0.95 0.00 0.00 175.26 175.84 2cuq s ASN 12 N 2.74 5.69 -0.03 0.83 -0.87 -1.26 -5.04 114.94 117.00 2cuq s ASN 12 Ca -0.02 -3.15 0.02 0.00 -1.57 0.00 0.00 52.86 48.13 2cuq s ASN 12 Cb -0.10 -1.92 0.01 0.00 -0.02 0.00 0.00 41.25 39.22 2cuq s ASN 12 CO -0.18 -0.33 -0.06 -0.75 -2.57 0.00 0.00 177.10 173.21 2cuq s LYS 13 N -0.51 0.87 -0.23 -0.60 2.36 -1.26 -5.12 119.74 115.26 2cuq s LYS 13 Ca 0.21 -0.19 -0.02 0.00 -2.55 0.00 0.00 55.97 53.41 2cuq s LYS 13 Cb -0.15 -0.83 0.07 0.00 -1.05 0.00 0.00 37.83 35.87 2cuq s LYS 13 CO -0.07 0.01 0.05 -0.06 1.55 0.00 0.00 175.35 176.83 2cuq s PHE 14 N 0.55 1.12 0.08 4.03 0.08 -1.26 -5.13 117.98 117.45 2cuq s PHE 14 Ca -0.08 -1.04 0.05 0.00 0.12 0.00 0.00 56.93 55.98 2cuq s PHE 14 Cb -0.11 -1.16 -0.03 0.00 -0.57 0.00 0.00 43.02 41.15 2cuq s PHE 14 CO 0.01 -0.68 -0.14 0.00 -0.10 0.00 0.00 175.22 174.30 2cuq s ALA 15 N 1.82 1.21 0.59 5.36 0.00 -1.26 -5.14 121.76 124.34 2cuq s ALA 15 Ca 0.02 -1.03 -0.17 0.00 0.00 0.00 0.00 51.96 50.77 2cuq s ALA 15 Cb -0.17 -0.10 -0.03 0.00 0.00 0.00 0.00 23.12 22.82 2cuq s ALA 15 CO -0.14 0.16 1.12 -1.25 0.00 0.00 0.00 175.76 175.66 2cuq s PRO 16 N -1.83 3.11 -0.01 0.00 0.04 -1.26 -4.86 135.00 130.19 2cuq s PRO 16 Ca -0.01 1.51 0.03 0.00 0.04 0.00 0.00 61.00 62.57 2cuq s PRO 16 Cb -0.09 -1.98 -0.01 0.00 0.04 0.00 0.00 34.50 32.46 2cuq s PRO 16 CO 0.02 -1.02 -0.09 1.03 0.04 0.00 0.00 177.00 176.98 2cuq s ARG 17 N -3.64 0.77 -0.25 4.56 0.52 -1.26 -0.94 118.95 118.71 2cuq s ARG 17 Ca 0.70 -0.33 -0.43 0.00 -0.52 0.00 0.00 55.73 55.15 2cuq s ARG 17 Cb -0.22 -0.74 -0.19 0.00 0.52 0.00 0.00 34.95 34.32 2cuq s ARG 17 CO 0.33 0.20 1.45 0.00 0.02 0.00 0.00 175.30 177.29 2cuq h ALA 19 N 4.79 1.00 0.00 0.00 0.00 -0.50 2.24 119.26 126.80 2cuq h ALA 19 Ca -0.47 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.44 2cuq h ALA 19 Cb 1.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.16 2cuq h ALA 19 CO 0.86 -0.00 -0.41 -2.13 0.00 0.00 0.00 179.25 177.57 2cuq n ARG 20 N -2.42 0.31 0.02 0.00 3.00 -1.26 -4.70 116.66 111.61 2cuq n ARG 20 Ca -0.02 0.36 -0.18 0.00 -0.00 0.00 0.00 57.85 58.02 2cuq n ARG 20 Cb 0.04 -1.31 -0.14 0.00 0.00 0.00 0.00 32.46 31.06 2cuq n ARG 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 2cuq n SER 22 N -3.40 -2.04 0.00 0.00 2.88 0.76 -4.91 113.62 106.91 2cuq n SER 22 Ca -0.24 -0.46 0.00 0.00 -1.33 0.00 0.00 58.87 56.84 2cuq n SER 22 Cb 1.05 -3.92 0.00 0.00 -0.75 0.00 0.00 64.21 60.60 2cuq n SER 22 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2cuq n LYS 23 N -3.31 0.00 -3.62 -1.46 4.76 -1.26 -4.75 118.16 108.52 2cuq n LYS 23 Ca -0.21 0.07 -0.08 0.00 -2.87 0.00 0.00 58.31 55.22 2cuq n LYS 23 Cb 0.63 -0.38 -0.06 0.00 -1.84 0.00 0.00 35.03 33.37 2cuq n LYS 23 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 2cuq s THR 24 N -0.43 0.00 -0.35 -0.18 -4.23 -1.26 -4.86 115.64 104.33 2cuq s THR 24 Ca 0.00 0.00 -0.00 0.00 -1.18 0.00 0.00 61.69 60.51 2cuq s THR 24 Cb 0.00 -1.00 0.12 0.00 1.34 0.00 0.00 72.50 72.96 2cuq s THR 24 CO 0.00 0.00 0.17 -0.76 -0.54 0.00 0.00 174.62 173.49 2cuq s LEU 25 N -0.43 1.77 -0.04 4.79 1.43 -0.12 -4.69 118.68 121.39 2cuq s LEU 25 Ca 0.03 -1.96 -0.07 0.00 -1.03 0.00 0.00 54.13 51.10 2cuq s LEU 25 Cb -0.03 -0.71 -0.03 0.00 0.03 0.00 0.00 46.19 45.45 2cuq s LEU 25 CO -0.05 -0.36 -0.15 0.35 0.23 0.00 0.00 176.35 176.38 2cuq n THR 26 N 4.40 1.17 -4.98 5.49 -2.24 -1.26 -4.39 114.28 112.46 2cuq n THR 26 Ca 0.03 0.18 -0.32 0.00 -2.27 0.00 0.00 64.05 61.67 2cuq n THR 26 Cb 0.39 -1.84 -0.15 0.00 -2.10 0.00 0.00 70.33 66.62 2cuq n THR 26 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2cuq s GLN 27 N -2.34 3.16 -0.24 -0.78 -0.21 -1.26 -4.87 119.66 113.12 2cuq s GLN 27 Ca -0.13 -0.77 -0.04 0.00 0.02 0.00 0.00 55.36 54.44 2cuq s GLN 27 Cb 0.03 -2.47 0.00 0.00 1.00 0.00 0.00 33.01 31.58 2cuq s GLN 27 CO 0.19 0.24 0.13 0.41 -2.12 0.00 0.00 175.29 174.14 2cuq n GLY 28 N 3.41 -2.98 3.43 3.09 0.00 -1.26 -5.09 105.19 105.79 2cuq n GLY 28 Ca -0.18 0.44 -0.10 0.00 0.00 0.00 0.00 46.02 46.18 2cuq n GLY 28 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2cuq s GLY 29 N -1.44 0.55 0.31 -0.02 0.00 -1.26 -4.66 107.32 100.80 2cuq s GLY 29 Ca 0.06 -0.91 0.06 0.00 0.00 0.00 0.00 44.72 43.93 2cuq s GLY 29 CO 0.54 -0.77 0.26 -1.34 0.00 0.00 0.00 173.10 171.79 2cuq s VAL 30 N -4.00 0.01 -0.05 1.40 -7.23 -1.00 -4.90 120.40 104.63 2cuq s VAL 30 Ca 0.21 -2.00 -0.02 0.00 -1.81 0.00 0.00 61.98 58.36 2cuq s VAL 30 Cb 0.02 -2.50 0.03 0.00 0.56 0.00 0.00 36.38 34.50 2cuq s VAL 30 CO 0.04 0.00 0.09 0.28 -0.31 0.00 0.00 175.10 175.20 2cuq s THR 31 N -3.54 -0.11 -0.17 5.32 -1.32 -1.26 -0.40 115.64 114.16 2cuq s THR 31 Ca 0.40 0.29 0.01 0.00 -1.21 0.00 0.00 61.69 61.18 2cuq s THR 31 Cb 0.03 -0.17 0.01 0.00 -1.51 0.00 0.00 72.50 70.86 2cuq s THR 31 CO 0.26 0.12 -0.18 -0.47 -2.21 0.00 0.00 174.62 172.13 2cuq s TYR 32 N 1.60 2.77 -0.99 9.09 5.04 0.40 -4.73 117.35 130.54 2cuq s TYR 32 Ca -0.03 -1.44 -0.02 0.00 -2.44 0.00 0.00 57.07 53.13 2cuq s TYR 32 Cb -0.12 -1.91 -0.03 0.00 0.35 0.00 0.00 41.96 40.25 2cuq s TYR 32 CO -0.04 -0.70 0.84 0.54 -1.34 0.00 0.00 175.55 174.85 2cuq n ARG 33 N 4.45 -4.06 -3.33 4.97 1.74 -1.26 -2.59 116.66 116.58 2cuq n ARG 33 Ca -0.20 0.75 -0.24 0.00 -0.77 0.00 0.00 57.85 57.39 2cuq n ARG 33 Cb 0.51 -5.37 0.01 0.00 -1.02 0.00 0.00 32.46 26.59 2cuq n ARG 33 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 2cuq n ASP 34 N -2.92 -4.66 -3.79 0.55 8.00 -1.26 -4.95 116.55 107.51 2cuq n ASP 34 Ca -0.17 -0.41 -0.13 0.00 0.71 0.00 0.00 54.79 54.80 2cuq n ASP 34 Cb 0.63 -3.79 -0.11 0.00 -0.02 0.00 0.00 41.12 37.83 2cuq n ASP 34 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2cuq s GLN 35 N -6.00 0.39 0.05 -1.24 -0.21 -1.07 -5.14 119.66 106.44 2cuq s GLN 35 Ca 0.41 0.17 -0.31 0.00 0.02 0.00 0.00 55.36 55.65 2cuq s GLN 35 Cb -0.20 0.18 -0.07 0.00 1.00 0.00 0.00 33.01 33.92 2cuq s GLN 35 CO 0.50 -0.07 1.41 -1.25 -2.12 0.00 0.00 175.29 173.77 2cuq s PRO 36 N -0.31 4.29 0.04 2.91 0.04 -1.26 0.15 135.00 140.86 2cuq s PRO 36 Ca -0.04 2.03 0.04 0.00 0.04 0.00 0.00 61.00 63.07 2cuq s PRO 36 Cb -0.03 -3.45 -0.02 0.00 0.04 0.00 0.00 34.50 31.04 2cuq s PRO 36 CO 0.01 -0.53 -0.12 -1.58 0.04 0.00 0.00 177.00 174.82 2cuq s TRP 37 N 1.91 1.03 -0.18 0.56 0.52 0.46 0.32 118.94 123.56 2cuq s TRP 37 Ca 0.65 -0.37 -0.29 0.00 0.02 0.00 0.00 56.10 56.11 2cuq s TRP 37 Cb -0.34 -0.61 -0.01 0.00 -1.15 0.00 0.00 33.47 31.35 2cuq s TRP 37 CO 0.28 0.01 1.29 -1.01 0.02 0.00 0.00 176.95 177.55 2cuq s HIS 38 N -0.93 2.77 0.32 -1.98 3.76 -1.26 -2.38 115.29 115.59 2cuq s HIS 38 Ca -0.01 0.94 0.20 0.00 -0.15 0.00 0.00 55.06 56.03 2cuq s HIS 38 Cb -0.08 -3.59 1.16 0.00 1.11 0.00 0.00 32.58 31.18 2cuq s HIS 38 CO 0.01 -1.83 1.32 0.54 -0.85 0.00 0.00 174.74 173.93 2cuq n ARG 39 N 6.75 -0.05 -0.02 1.40 1.74 -1.26 0.13 116.66 125.36 2cuq n ARG 39 Ca 0.14 1.13 -0.16 0.00 -0.77 0.00 0.00 57.85 58.20 2cuq n ARG 39 Cb 0.45 -2.08 -0.11 0.00 -1.02 0.00 0.00 32.46 29.70 2cuq n ARG 39 CO 0.00 0.00 0.00 1.05 -1.52 0.00 0.00 177.63 177.16 2cuq h GLU 40 N 0.00 0.23 0.34 5.56 4.11 -1.95 -3.34 114.58 119.52 2cuq h GLU 40 Ca 0.72 -0.25 -0.01 0.00 0.07 0.00 0.00 59.36 59.89 2cuq h GLU 40 Cb 1.99 0.07 -0.00 0.00 0.50 0.00 0.00 28.75 31.31 2cuq h GLU 40 CO -0.59 0.97 -0.18 0.00 0.07 0.00 0.00 179.01 179.28 2cuq n LEU 42 N -5.31 0.06 -4.04 0.00 7.94 0.10 -4.83 117.00 110.92 2cuq n LEU 42 Ca -0.10 -1.00 -0.08 0.00 -1.11 0.00 0.00 56.01 53.72 2cuq n LEU 42 Cb 0.22 -1.06 -0.10 0.00 0.53 0.00 0.00 43.42 43.00 2cuq n LEU 42 CO 0.35 -2.01 -0.36 0.68 -1.11 0.00 0.00 177.39 174.94 2cuq s VAL 43 N 6.99 0.20 0.47 1.96 -7.23 -1.26 -2.98 120.40 118.55 2cuq s VAL 43 Ca 1.13 -1.40 -0.23 0.00 -1.81 0.00 0.00 61.98 59.67 2cuq s VAL 43 Cb -0.51 -0.95 -0.09 0.00 0.56 0.00 0.00 36.38 35.40 2cuq s VAL 43 CO 0.34 -0.76 1.07 0.00 -0.31 0.00 0.00 175.10 175.45 2cuq n THR 45 N -0.73 1.27 0.04 0.00 -1.04 -0.79 -2.32 114.28 110.72 2cuq n THR 45 Ca 0.10 -0.64 0.00 0.00 -2.04 0.00 0.00 64.05 61.46 2cuq n THR 45 Cb 0.41 -0.40 0.00 0.00 -1.82 0.00 0.00 70.33 68.53 2cuq n THR 45 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2cuq n GLY 46 N 0.29 -0.07 0.12 3.41 0.00 -1.26 -4.88 105.19 102.80 2cuq n GLY 46 Ca 0.13 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.23 2cuq n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cuq n GLN 48 N -0.98 -3.71 -4.72 0.00 1.13 -0.98 -4.97 117.38 103.15 2cuq n GLN 48 Ca 0.04 0.72 -0.33 0.00 -1.94 0.00 0.00 57.00 55.49 2cuq n GLN 48 Cb 0.29 -5.21 -0.12 0.00 0.11 0.00 0.00 30.24 25.30 2cuq n GLN 48 CO 0.00 0.00 0.00 -0.08 -1.44 0.00 0.00 177.06 175.54 2cuq s THR 49 N -3.31 3.41 -0.34 5.09 -1.32 -1.26 -4.72 115.64 113.19 2cuq s THR 49 Ca 0.19 -0.62 -0.29 0.00 -1.21 0.00 0.00 61.69 59.77 2cuq s THR 49 Cb -0.02 -2.38 -0.01 0.00 -1.51 0.00 0.00 72.50 68.57 2cuq s THR 49 CO 0.61 0.57 1.69 -2.16 -2.21 0.00 0.00 174.62 173.13 2cuq s PRO 50 N -0.84 3.42 0.00 7.08 0.04 -1.26 -0.40 135.00 143.04 2cuq s PRO 50 Ca 0.12 1.33 0.08 0.00 0.04 0.00 0.00 61.00 62.57 2cuq s PRO 50 Cb -0.11 -4.15 0.32 0.00 0.04 0.00 0.00 34.50 30.61 2cuq s PRO 50 CO 0.02 -1.75 1.23 1.28 0.04 0.00 0.00 177.00 177.82 2cuq n LEU 51 N 9.81 0.76 -4.51 -3.56 4.77 -1.16 -4.85 117.00 118.27 2cuq n LEU 51 Ca 0.21 -0.37 -0.40 0.00 -0.03 0.00 0.00 56.01 55.42 2cuq n LEU 51 Cb 0.47 -0.09 -0.10 0.00 -2.33 0.00 0.00 43.42 41.38 2cuq n LEU 51 CO 0.69 0.18 2.11 0.00 -1.33 0.00 0.00 177.39 179.04 2cuq n ALA 52 N -0.13 0.54 -2.35 -1.18 0.00 -1.26 0.63 120.51 116.76 2cuq n ALA 52 Ca 0.07 -0.50 -0.07 0.00 0.00 0.00 0.00 53.44 52.94 2cuq n ALA 52 Cb 0.13 -2.65 0.01 0.00 0.00 0.00 0.00 19.45 16.94 2cuq n ALA 52 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cuq n GLY 53 N 6.35 0.20 3.27 0.00 0.00 -1.26 -5.04 105.19 108.70 2cuq n GLY 53 Ca 0.53 -0.53 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 2cuq n GLY 53 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2cuq s GLN 54 N -4.66 1.10 -0.19 1.61 0.74 0.21 -5.11 119.66 113.35 2cuq s GLN 54 Ca 0.06 -1.21 -0.29 0.00 0.05 0.00 0.00 55.36 53.96 2cuq s GLN 54 Cb -0.03 -1.18 -0.01 0.00 1.10 0.00 0.00 33.01 32.90 2cuq s GLN 54 CO 0.07 0.26 1.19 -0.65 -0.55 0.00 0.00 175.29 175.60 2cuq s GLN 55 N -2.29 4.24 0.36 1.67 -1.52 -1.26 -4.96 119.66 115.90 2cuq s GLN 55 Ca 0.08 1.56 -0.02 0.00 -1.95 0.00 0.00 55.36 55.03 2cuq s GLN 55 Cb -0.08 -3.72 0.01 0.00 -0.22 0.00 0.00 33.01 29.00 2cuq s GLN 55 CO 0.04 -0.68 0.51 1.97 -0.25 0.00 0.00 175.29 176.89 2cuq n PHE 56 N 6.50 -1.52 -4.13 0.91 1.16 -1.26 -4.02 117.46 115.10 2cuq n PHE 56 Ca 0.13 -2.37 -0.10 0.00 -1.87 0.00 0.00 57.45 53.24 2cuq n PHE 56 Cb 0.45 0.58 -0.10 0.00 -1.61 0.00 0.00 39.48 38.80 2cuq n PHE 56 CO 0.00 0.00 0.00 -0.08 -1.87 0.00 0.00 176.76 174.81 2cuq s THR 57 N -2.79 0.56 -0.08 1.97 -1.32 -0.19 -4.92 115.64 108.86 2cuq s THR 57 Ca 0.29 -1.74 -0.01 0.00 -1.21 0.00 0.00 61.69 59.03 2cuq s THR 57 Cb -0.01 -1.43 -0.03 0.00 -1.51 0.00 0.00 72.50 69.52 2cuq s THR 57 CO 0.21 -0.80 -0.03 -0.94 -2.21 0.00 0.00 174.62 170.84 2cuq s SER 58 N -2.73 4.97 -0.02 8.08 1.04 -1.26 0.21 113.70 123.98 2cuq s SER 58 Ca 0.06 0.07 -0.00 0.00 0.48 0.00 0.00 55.95 56.55 2cuq s SER 58 Cb 0.03 -1.35 0.03 0.00 0.10 0.00 0.00 66.02 64.83 2cuq s SER 58 CO -0.05 0.37 0.04 -0.60 0.98 0.00 0.00 173.24 173.98 2cuq s ARG 59 N -0.82 -0.02 -1.71 4.02 6.06 0.21 -4.85 118.95 121.85 2cuq s ARG 59 Ca 0.12 0.18 -0.19 0.00 -2.50 0.00 0.00 55.73 53.35 2cuq s ARG 59 Cb -0.11 -0.20 0.16 0.00 0.06 0.00 0.00 34.95 34.86 2cuq s ARG 59 CO 0.02 -0.14 0.80 -0.25 -2.50 0.00 0.00 175.30 173.23 2cuq n ASP 60 N 4.00 -3.39 -2.70 -2.12 8.00 -1.26 -0.23 116.55 118.84 2cuq n ASP 60 Ca -0.25 -1.01 -0.14 0.00 0.71 0.00 0.00 54.79 54.10 2cuq n ASP 60 Cb 0.52 -2.78 0.06 0.00 -0.02 0.00 0.00 41.12 38.90 2cuq n ASP 60 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2cuq n GLU 61 N -4.39 -5.15 -3.67 -1.24 1.02 -1.26 -5.03 120.64 100.93 2cuq n GLU 61 Ca 0.08 0.59 -0.10 0.00 -0.02 0.00 0.00 57.16 57.71 2cuq n GLU 61 Cb 0.49 -4.88 -0.11 0.00 -0.02 0.00 0.00 31.44 26.92 2cuq n GLU 61 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2cuq s ASP 62 N -3.61 -0.15 -0.35 1.62 1.01 0.67 -5.12 116.67 110.75 2cuq s ASP 62 Ca 0.20 0.86 -0.28 0.00 0.71 0.00 0.00 52.55 54.03 2cuq s ASP 62 Cb -0.09 1.05 -0.01 0.00 1.01 0.00 0.00 42.92 44.88 2cuq s ASP 62 CO 0.52 -0.22 1.70 -2.16 0.21 0.00 0.00 175.17 175.21 2cuq s PRO 63 N 2.29 3.40 -0.11 8.23 0.04 -1.26 -0.62 135.00 146.97 2cuq s PRO 63 Ca -0.03 1.31 0.02 0.00 0.04 0.00 0.00 61.00 62.34 2cuq s PRO 63 Cb -0.11 -4.15 -0.01 0.00 0.04 0.00 0.00 34.50 30.27 2cuq s PRO 63 CO -0.12 -1.78 -0.19 0.71 0.04 0.00 0.00 177.00 175.66 2cuq s TYR 64 N 6.51 2.66 0.67 0.56 2.02 0.13 -1.88 117.35 128.02 2cuq s TYR 64 Ca 0.75 -0.85 -0.14 0.00 -0.37 0.00 0.00 57.07 56.46 2cuq s TYR 64 Cb -0.20 -1.75 0.00 0.00 -0.40 0.00 0.00 41.96 39.61 2cuq s TYR 64 CO 0.33 -0.31 1.10 0.00 -1.57 0.00 0.00 175.55 175.10 2cuq h VAL 66 N -0.12 0.76 -0.11 0.00 2.07 -1.92 0.43 116.25 117.36 2cuq h VAL 66 Ca -0.46 -0.24 -0.02 0.00 0.82 0.00 0.00 66.70 66.80 2cuq h VAL 66 Cb 1.24 0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 31.01 2cuq h VAL 66 CO 0.54 0.13 -0.03 0.00 0.02 0.00 0.00 177.57 178.23 2cuq h ALA 67 N 1.61 1.75 0.01 1.67 0.00 -1.91 -2.33 119.26 120.05 2cuq h ALA 67 Ca 0.51 -0.10 -0.21 0.00 0.00 0.00 0.00 54.91 55.11 2cuq h ALA 67 Cb 0.86 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.57 2cuq h ALA 67 CO -0.27 0.20 -1.15 0.00 0.00 0.00 0.00 179.25 178.03 2cuq h PHE 69 N -0.93 -0.52 -0.34 0.00 3.57 -0.28 0.67 116.94 119.11 2cuq h PHE 69 Ca -0.31 0.06 -0.15 0.00 3.53 0.00 0.00 57.97 61.11 2cuq h PHE 69 Cb 1.32 0.33 -0.09 0.00 2.79 0.00 0.00 35.95 40.30 2cuq h PHE 69 CO 0.12 -0.32 0.19 0.41 -2.23 0.00 0.00 178.31 176.48 2cuq n GLY 70 N -1.46 2.73 0.00 2.40 0.00 -0.88 -2.52 105.19 105.46 2cuq n GLY 70 Ca 0.08 -0.39 0.00 0.00 0.00 0.00 0.00 46.02 45.70 2cuq n GLY 70 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2cuq n GLU 71 N -0.03 0.50 -0.06 1.61 -0.58 0.19 -4.65 120.64 117.62 2cuq n GLU 71 Ca 0.20 0.00 -0.05 0.00 -0.42 0.00 0.00 57.16 56.89 2cuq n GLU 71 Cb 0.86 -0.63 -0.02 0.00 -0.57 0.00 0.00 31.44 31.09 2cuq n GLU 71 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2cuq n LEU 72 N -1.31 1.31 -0.08 -4.62 4.32 0.13 -3.82 117.00 112.93 2cuq n LEU 72 Ca 0.00 0.39 -0.13 0.00 -0.02 0.00 0.00 56.01 56.25 2cuq n LEU 72 Cb 0.13 -0.72 -0.05 0.00 -1.62 0.00 0.00 43.42 41.15 2cuq n LEU 72 CO 0.00 -0.42 0.56 -0.26 -1.22 0.00 0.00 177.39 176.05 2cuq h PHE 73 N -0.70 0.75 -0.39 -1.77 0.04 -1.72 0.57 116.94 113.73 2cuq h PHE 73 Ca 0.00 -0.24 0.03 0.00 2.80 0.00 0.00 57.97 60.56 2cuq h PHE 73 Cb 0.51 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 38.47 2cuq h PHE 73 CO -0.22 0.96 0.19 0.00 -0.60 0.00 0.00 178.31 178.64 2cuq h ALA 74 N 0.66 0.48 -0.10 2.45 0.00 -1.75 -2.97 119.26 118.03 2cuq h ALA 74 Ca 0.03 0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 2cuq h ALA 74 Cb 0.85 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.59 2cuq h ALA 74 CO 0.07 -0.18 -0.30 0.77 0.00 0.00 0.00 179.25 179.61 2cuq h SER 75 N 0.39 0.43 0.00 0.00 0.02 -1.65 -3.49 113.55 109.25 2cuq h SER 75 Ca 0.17 -0.61 0.00 0.00 -0.84 0.00 0.00 61.79 60.51 2cuq h SER 75 Cb 0.08 -0.13 0.00 0.00 0.14 0.00 0.00 62.40 62.49 2cuq h SER 75 CO -0.12 0.96 0.00 0.61 -1.14 0.00 0.00 176.83 177.14 2cuq n GLY 76 N 0.57 3.81 3.72 -3.77 0.00 0.19 -5.07 105.19 104.64 2cuq n GLY 76 Ca -0.08 -0.75 -0.42 0.00 0.00 0.00 0.00 46.02 44.78 2cuq n GLY 76 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cuq s PRO 77 N -4.08 4.35 0.08 1.61 0.04 -1.22 -4.84 135.00 130.94 2cuq s PRO 77 Ca 0.00 2.04 -0.30 0.00 0.04 0.00 0.00 61.00 62.77 2cuq s PRO 77 Cb 0.00 -3.24 -0.16 0.00 0.04 0.00 0.00 34.50 31.14 2cuq s PRO 77 CO 0.00 -0.37 1.64 0.77 0.04 0.00 0.00 177.00 179.08 2cuq h SER 78 N 6.44 -0.69 -3.96 6.66 0.02 -1.99 -3.45 113.55 116.58 2cuq h SER 78 Ca -0.43 0.04 -0.10 0.00 -0.84 0.00 0.00 61.79 60.46 2cuq h SER 78 Cb 1.21 0.21 -0.23 0.00 0.14 0.00 0.00 62.40 63.73 2cuq h SER 78 CO 0.84 -0.43 -0.14 -0.44 -1.14 0.00 0.00 176.83 175.51 2cuq s SER 79 N -4.60 -0.51 0.00 3.07 0.01 -1.26 -5.31 113.70 105.10 2cuq s SER 79 Ca -0.17 0.96 0.00 0.00 1.31 0.00 0.00 55.95 58.06 2cuq s SER 79 Cb 0.05 0.98 0.00 0.00 0.21 0.00 0.00 66.02 67.26 2cuq s SER 79 CO 0.63 -0.18 0.25 0.61 0.41 0.00 0.00 173.24 174.96