#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 3.81 0.25 1.61 0.15 -1.26 -5.12 113.70 113.13 2cuq s SER 2 Ca 0.00 -1.28 0.11 0.00 0.70 0.00 0.00 55.95 55.48 2cuq s SER 2 Cb 0.00 -1.07 -0.05 0.00 -1.71 0.00 0.00 66.02 63.19 2cuq s SER 2 CO 0.00 -0.29 -0.12 -0.94 1.20 0.00 0.00 173.24 173.09 2cuq s SER 3 N 1.46 4.03 0.31 5.45 1.04 -1.26 -5.14 113.70 119.59 2cuq s SER 3 Ca -0.01 -0.80 0.04 0.00 0.48 0.00 0.00 55.95 55.66 2cuq s SER 3 Cb -0.18 -0.56 -0.02 0.00 0.10 0.00 0.00 66.02 65.35 2cuq s SER 3 CO -0.10 0.05 0.46 -0.83 0.98 0.00 0.00 173.24 173.80 2cuq s GLY 4 N -3.36 1.37 -0.38 7.32 0.00 -1.26 -5.09 107.32 105.92 2cuq s GLY 4 Ca 0.29 -1.21 0.01 0.00 0.00 0.00 0.00 44.72 43.80 2cuq s GLY 4 CO 0.16 -1.17 0.19 -0.56 0.00 0.00 0.00 173.10 171.72 2cuq s SER 5 N -4.07 3.65 -0.20 1.64 0.01 -1.26 -5.09 113.70 108.38 2cuq s SER 5 Ca 0.39 -2.21 -0.11 0.00 1.31 0.00 0.00 55.95 55.34 2cuq s SER 5 Cb -0.09 -0.85 0.07 0.00 0.21 0.00 0.00 66.02 65.35 2cuq s SER 5 CO 0.32 -0.33 0.49 -0.55 0.41 0.00 0.00 173.24 173.59 2cuq s SER 6 N 0.92 -0.64 -0.05 2.44 0.15 -1.26 -5.15 113.70 110.10 2cuq s SER 6 Ca 0.15 1.09 -0.18 0.00 0.70 0.00 0.00 55.95 57.71 2cuq s SER 6 Cb -0.22 0.99 -0.05 0.00 -1.71 0.00 0.00 66.02 65.03 2cuq s SER 6 CO -0.08 -0.21 0.50 -0.83 1.20 0.00 0.00 173.24 173.82 2cuq s GLY 7 N 1.53 2.48 -0.94 9.45 0.00 -1.26 -4.99 107.32 113.59 2cuq s GLY 7 Ca -0.09 -0.13 -0.24 0.00 0.00 0.00 0.00 44.72 44.26 2cuq s GLY 7 CO -0.15 0.62 1.95 2.56 0.00 0.00 0.00 173.10 178.08 2cuq s PRO 8 N -0.03 2.55 -0.70 2.90 0.04 -1.26 -4.92 135.00 133.58 2cuq s PRO 8 Ca 0.27 -0.41 -0.21 0.00 0.04 0.00 0.00 61.00 60.69 2cuq s PRO 8 Cb -0.16 -5.09 0.09 0.00 0.04 0.00 0.00 34.50 29.38 2cuq s PRO 8 CO 0.13 -3.46 0.94 0.00 0.04 0.00 0.00 177.00 174.65 2cuq s TYR 10 N 3.46 2.05 -0.83 0.00 2.02 -1.26 -5.07 117.35 117.72 2cuq s TYR 10 Ca 0.22 -0.59 -0.05 0.00 -0.37 0.00 0.00 57.07 56.28 2cuq s TYR 10 Cb -0.16 -2.27 0.21 0.00 -0.40 0.00 0.00 41.96 39.34 2cuq s TYR 10 CO 0.05 -0.79 0.71 -1.21 -1.57 0.00 0.00 175.55 172.75 2cuq s GLU 11 N -4.50 3.22 -0.44 -0.62 2.02 -1.26 -5.04 118.70 112.08 2cuq s GLU 11 Ca 0.57 -2.91 -0.43 0.00 0.02 0.00 0.00 54.97 52.22 2cuq s GLU 11 Cb -0.07 -4.03 -0.18 0.00 0.10 0.00 0.00 34.13 29.95 2cuq s GLU 11 CO 0.35 -1.24 1.89 0.09 0.02 0.00 0.00 175.26 176.38 2cuq n ASN 12 N 3.00 1.39 -4.91 -0.19 4.13 -1.26 -4.91 115.26 112.51 2cuq n ASN 12 Ca 0.16 0.89 -0.28 0.00 1.68 0.00 0.00 54.58 57.03 2cuq n ASN 12 Cb 0.39 -0.98 -0.03 0.00 -1.54 0.00 0.00 39.78 37.62 2cuq n ASN 12 CO 0.00 0.00 0.00 -1.59 0.28 0.00 0.00 177.26 175.95 2cuq s LYS 13 N 4.56 3.60 0.00 3.52 -2.85 -1.26 -5.00 119.74 122.31 2cuq s LYS 13 Ca 1.10 -0.09 0.00 0.00 -1.00 0.00 0.00 55.97 55.98 2cuq s LYS 13 Cb -1.34 -2.68 0.00 0.00 -2.06 0.00 0.00 37.83 31.75 2cuq s LYS 13 CO 0.69 0.24 0.00 0.34 0.10 0.00 0.00 175.35 176.73 2cuq n PHE 14 N -0.94 0.00 -3.56 1.78 -0.00 -1.26 -5.09 117.46 108.39 2cuq n PHE 14 Ca -0.02 0.00 -0.07 0.00 -0.00 0.00 0.00 57.45 57.36 2cuq n PHE 14 Cb 0.54 0.00 -0.03 0.00 -0.00 0.00 0.00 39.48 39.99 2cuq n PHE 14 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2cuq s ALA 15 N -1.32 -1.96 0.51 3.13 0.00 -1.26 -5.15 121.76 115.70 2cuq s ALA 15 Ca 0.00 1.39 -0.21 0.00 0.00 0.00 0.00 51.96 53.15 2cuq s ALA 15 Cb 0.00 -0.07 -0.06 0.00 0.00 0.00 0.00 23.12 22.99 2cuq s ALA 15 CO 0.00 -0.57 1.14 -1.25 0.00 0.00 0.00 175.76 175.08 2cuq s PRO 16 N -2.43 3.51 -0.01 0.00 0.04 -1.26 -4.86 135.00 129.99 2cuq s PRO 16 Ca 0.06 1.67 0.05 0.00 0.04 0.00 0.00 61.00 62.81 2cuq s PRO 16 Cb -0.01 -2.15 -0.01 0.00 0.04 0.00 0.00 34.50 32.37 2cuq s PRO 16 CO -0.06 -0.73 -0.15 1.03 0.04 0.00 0.00 177.00 177.14 2cuq s ARG 17 N -3.07 1.18 -0.08 4.56 0.52 -1.26 -1.06 118.95 119.74 2cuq s ARG 17 Ca 0.69 -0.54 -0.39 0.00 -0.52 0.00 0.00 55.73 54.97 2cuq s ARG 17 Cb -0.25 -1.14 -0.18 0.00 0.52 0.00 0.00 34.95 33.89 2cuq s ARG 17 CO 0.30 0.31 1.38 0.00 0.02 0.00 0.00 175.30 177.31 2cuq h ALA 19 N 4.75 1.00 0.00 0.00 0.00 0.02 2.23 119.26 127.25 2cuq h ALA 19 Ca -0.48 0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.35 2cuq h ALA 19 Cb 1.36 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.14 2cuq h ALA 19 CO 0.81 0.00 -0.82 -2.13 0.00 0.00 0.00 179.25 177.10 2cuq n ARG 20 N -2.50 0.49 -0.04 0.00 3.00 -1.26 -4.69 116.66 111.66 2cuq n ARG 20 Ca -0.01 0.51 -0.21 0.00 -0.00 0.00 0.00 57.85 58.15 2cuq n ARG 20 Cb 0.12 -1.69 -0.13 0.00 0.00 0.00 0.00 32.46 30.76 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 -3.48 -2.56 0.00 0.00 2.88 0.75 -4.92 113.62 106.28 2cuq n SER 22 Ca -0.36 -0.32 0.00 0.00 -1.33 0.00 0.00 58.87 56.86 2cuq n SER 22 Cb 1.01 -2.99 0.00 0.00 -0.75 0.00 0.00 64.21 61.48 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 -2.75 0.00 -3.58 -1.46 5.02 -1.26 -4.77 118.16 109.36 2cuq n LYS 23 Ca -0.12 0.04 -0.10 0.00 -2.02 0.00 0.00 58.31 56.11 2cuq n LYS 23 Cb 0.58 -0.31 -0.05 0.00 -0.02 0.00 0.00 35.03 35.23 2cuq n LYS 23 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2cuq s THR 24 N -0.42 0.00 -0.34 -0.18 -4.23 -1.26 -4.85 115.64 104.35 2cuq s THR 24 Ca 0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 61.69 60.50 2cuq s THR 24 Cb 0.00 -1.00 0.11 0.00 1.34 0.00 0.00 72.50 72.95 2cuq s THR 24 CO 0.00 0.00 0.15 -0.76 -0.54 0.00 0.00 174.62 173.47 2cuq s LEU 25 N -1.13 1.69 0.03 4.79 1.43 -0.22 -4.62 118.68 120.65 2cuq s LEU 25 Ca -0.01 -1.86 -0.04 0.00 -1.03 0.00 0.00 54.13 51.20 2cuq s LEU 25 Cb -0.00 -0.69 -0.01 0.00 0.03 0.00 0.00 46.19 45.51 2cuq s LEU 25 CO 0.01 -0.37 -0.07 0.35 0.23 0.00 0.00 176.35 176.49 2cuq n THR 26 N 4.53 1.21 -3.36 5.49 -2.24 -1.26 -4.50 114.28 114.14 2cuq n THR 26 Ca 0.02 0.31 -0.39 0.00 -2.27 0.00 0.00 64.05 61.72 2cuq n THR 26 Cb 0.40 -1.73 -0.08 0.00 -2.10 0.00 0.00 70.33 66.81 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 -2.18 4.06 -0.16 -0.78 -1.52 -1.26 -4.73 119.66 113.10 2cuq s GLN 27 Ca -0.06 0.13 -0.08 0.00 -1.95 0.00 0.00 55.36 53.40 2cuq s GLN 27 Cb 0.01 -3.62 0.03 0.00 -0.22 0.00 0.00 33.01 29.21 2cuq s GLN 27 CO 0.09 -0.23 0.15 0.41 -0.25 0.00 0.00 175.29 175.47 2cuq n GLY 28 N 4.44 -3.81 3.09 3.09 0.00 -1.26 -5.05 105.19 105.70 2cuq n GLY 28 Ca -0.08 1.18 -0.10 0.00 0.00 0.00 0.00 46.02 47.02 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 -0.69 0.54 0.32 -0.02 0.00 -1.26 -4.60 107.32 101.60 2cuq s GLY 29 Ca -0.18 -1.04 0.04 0.00 0.00 0.00 0.00 44.72 43.54 2cuq s GLY 29 CO 0.60 -1.13 0.18 -1.34 0.00 0.00 0.00 173.10 171.40 2cuq s VAL 30 N -2.79 0.29 -0.04 1.40 -7.23 -1.13 -4.96 120.40 105.94 2cuq s VAL 30 Ca 0.01 -2.00 -0.00 0.00 -1.81 0.00 0.00 61.98 58.17 2cuq s VAL 30 Cb -0.00 -2.49 0.03 0.00 0.56 0.00 0.00 36.38 34.48 2cuq s VAL 30 CO -0.04 0.00 0.01 0.28 -0.31 0.00 0.00 175.10 175.04 2cuq s THR 31 N -3.54 0.15 -0.21 5.32 -1.32 -1.26 -0.45 115.64 114.33 2cuq s THR 31 Ca 0.35 0.17 0.01 0.00 -1.21 0.00 0.00 61.69 61.01 2cuq s THR 31 Cb 0.04 -0.30 0.03 0.00 -1.51 0.00 0.00 72.50 70.76 2cuq s THR 31 CO 0.19 0.18 -0.15 -0.47 -2.21 0.00 0.00 174.62 172.16 2cuq s TYR 32 N 1.48 2.94 -0.74 9.09 5.04 0.41 -4.72 117.35 130.85 2cuq s TYR 32 Ca -0.03 -1.74 -0.02 0.00 -2.44 0.00 0.00 57.07 52.84 2cuq s TYR 32 Cb -0.13 -1.96 -0.02 0.00 0.35 0.00 0.00 41.96 40.21 2cuq s TYR 32 CO -0.03 -0.80 0.63 0.54 -1.34 0.00 0.00 175.55 174.55 2cuq n ARG 33 N 4.60 -3.09 -3.40 4.97 1.74 -1.26 -3.04 116.66 117.17 2cuq n ARG 33 Ca -0.19 0.56 -0.25 0.00 -0.77 0.00 0.00 57.85 57.20 2cuq n ARG 33 Cb 0.48 -4.53 0.02 0.00 -1.02 0.00 0.00 32.46 27.41 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 -2.48 -4.74 -3.74 0.55 8.00 -1.26 -4.95 116.55 107.92 2cuq n ASP 34 Ca -0.13 -0.45 -0.13 0.00 0.71 0.00 0.00 54.79 54.79 2cuq n ASP 34 Cb 0.60 -3.85 -0.09 0.00 -0.02 0.00 0.00 41.12 37.76 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 -6.07 0.57 0.09 -1.24 -0.21 -1.17 -5.14 119.66 106.48 2cuq s GLN 35 Ca 0.44 0.17 -0.31 0.00 0.02 0.00 0.00 55.36 55.68 2cuq s GLN 35 Cb -0.22 0.26 -0.07 0.00 1.00 0.00 0.00 33.01 33.98 2cuq s GLN 35 CO 0.54 -0.13 1.38 -1.25 -2.12 0.00 0.00 175.29 173.71 2cuq s PRO 36 N -0.59 4.32 0.08 2.91 0.04 -1.26 0.16 135.00 140.66 2cuq s PRO 36 Ca -0.07 2.03 0.04 0.00 0.04 0.00 0.00 61.00 63.04 2cuq s PRO 36 Cb -0.04 -3.32 -0.03 0.00 0.04 0.00 0.00 34.50 31.15 2cuq s PRO 36 CO 0.03 -0.45 -0.12 -1.58 0.04 0.00 0.00 177.00 174.92 2cuq s TRP 37 N 1.35 1.10 -0.22 0.56 0.52 0.41 0.79 118.94 123.45 2cuq s TRP 37 Ca 0.64 -0.55 -0.29 0.00 0.02 0.00 0.00 56.10 55.92 2cuq s TRP 37 Cb -0.35 -0.61 0.01 0.00 -1.15 0.00 0.00 33.47 31.37 2cuq s TRP 37 CO 0.30 0.03 1.07 -1.01 0.02 0.00 0.00 176.95 177.35 2cuq s HIS 38 N -1.83 3.28 0.37 -1.98 3.76 -1.26 -2.84 115.29 114.79 2cuq s HIS 38 Ca 0.01 1.42 0.25 0.00 -0.15 0.00 0.00 55.06 56.58 2cuq s HIS 38 Cb -0.07 -3.30 1.31 0.00 1.11 0.00 0.00 32.58 31.64 2cuq s HIS 38 CO 0.01 -0.62 1.45 0.54 -0.85 0.00 0.00 174.74 175.27 2cuq n ARG 39 N 6.35 -0.04 -0.01 1.40 1.74 -1.26 0.10 116.66 124.93 2cuq n ARG 39 Ca 0.12 1.21 -0.17 0.00 -0.77 0.00 0.00 57.85 58.25 2cuq n ARG 39 Cb 0.46 -2.28 -0.12 0.00 -1.02 0.00 0.00 32.46 29.49 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 0.31 5.56 4.11 -1.95 -3.35 114.58 119.50 2cuq h GLU 40 Ca 0.80 -0.29 -0.02 0.00 0.07 0.00 0.00 59.36 59.92 2cuq h GLU 40 Cb 2.34 0.09 0.00 0.00 0.50 0.00 0.00 28.75 31.69 2cuq h GLU 40 CO -0.57 1.05 -0.15 0.00 0.07 0.00 0.00 179.01 179.40 2cuq n LEU 42 N -5.26 0.77 -4.04 0.00 7.94 0.14 -4.85 117.00 111.71 2cuq n LEU 42 Ca -0.10 -0.67 -0.08 0.00 -1.11 0.00 0.00 56.01 54.05 2cuq n LEU 42 Cb 0.20 -1.20 -0.10 0.00 0.53 0.00 0.00 43.42 42.85 2cuq n LEU 42 CO 0.35 -1.68 -0.32 0.68 -1.11 0.00 0.00 177.39 175.32 2cuq s VAL 43 N 9.22 0.19 0.40 1.96 -7.23 -1.26 -2.79 120.40 120.89 2cuq s VAL 43 Ca 1.13 -1.59 -0.26 0.00 -1.81 0.00 0.00 61.98 59.45 2cuq s VAL 43 Cb -0.56 -1.33 -0.10 0.00 0.56 0.00 0.00 36.38 34.95 2cuq s VAL 43 CO 0.34 -0.88 1.30 0.00 -0.31 0.00 0.00 175.10 175.55 2cuq n THR 45 N -0.04 0.65 0.09 0.00 -1.04 -0.42 -2.11 114.28 111.42 2cuq n THR 45 Ca 0.06 -0.33 0.00 0.00 -2.04 0.00 0.00 64.05 61.74 2cuq n THR 45 Cb 0.39 -0.45 0.00 0.00 -1.82 0.00 0.00 70.33 68.45 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 0.15 -0.19 0.08 3.41 0.00 -1.26 -4.88 105.19 102.50 2cuq n GLY 46 Ca 0.07 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.19 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 -1.26 -5.68 -4.23 0.00 1.13 -0.90 -4.96 117.38 101.49 2cuq n GLN 48 Ca 0.05 0.72 -0.35 0.00 -1.94 0.00 0.00 57.00 55.49 2cuq n GLN 48 Cb 0.35 -5.37 -0.08 0.00 0.11 0.00 0.00 30.24 25.25 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 4.59 -0.29 5.09 -1.32 -1.26 -4.70 115.64 114.44 2cuq s THR 49 Ca 0.02 -0.23 -0.29 0.00 -1.21 0.00 0.00 61.69 59.98 2cuq s THR 49 Cb -0.01 -2.99 -0.02 0.00 -1.51 0.00 0.00 72.50 67.98 2cuq s THR 49 CO 0.62 0.54 1.66 -2.16 -2.21 0.00 0.00 174.62 173.07 2cuq s PRO 50 N -1.14 3.57 -0.10 7.08 0.04 -1.26 -0.54 135.00 142.65 2cuq s PRO 50 Ca 0.16 1.46 0.12 0.00 0.04 0.00 0.00 61.00 62.78 2cuq s PRO 50 Cb -0.12 -4.10 0.53 0.00 0.04 0.00 0.00 34.50 30.85 2cuq s PRO 50 CO 0.06 -1.57 1.38 1.28 0.04 0.00 0.00 177.00 178.18 2cuq n LEU 51 N 9.28 3.69 -4.52 -3.56 4.77 -1.12 -4.88 117.00 120.66 2cuq n LEU 51 Ca 0.20 -1.86 -0.30 0.00 -0.03 0.00 0.00 56.01 54.03 2cuq n LEU 51 Cb 0.46 -0.51 -0.15 0.00 -2.33 0.00 0.00 43.42 40.89 2cuq n LEU 51 CO 0.67 0.59 2.00 0.00 -1.33 0.00 0.00 177.39 179.32 2cuq n ALA 52 N 0.68 0.67 -2.80 -1.18 0.00 -1.26 0.62 120.51 117.24 2cuq n ALA 52 Ca 0.19 -0.73 -0.12 0.00 0.00 0.00 0.00 53.44 52.77 2cuq n ALA 52 Cb 0.72 -2.61 0.03 0.00 0.00 0.00 0.00 19.45 17.59 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 6.13 0.07 3.52 0.00 0.00 -1.26 -5.03 105.19 108.62 2cuq n GLY 53 Ca 0.60 -0.26 -0.26 0.00 0.00 0.00 0.00 46.02 46.10 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 -5.32 1.88 -0.46 1.61 0.74 0.20 -5.08 119.66 113.24 2cuq s GLN 54 Ca 0.21 -1.42 -0.28 0.00 0.05 0.00 0.00 55.36 53.92 2cuq s GLN 54 Cb -0.09 -2.02 0.01 0.00 1.10 0.00 0.00 33.01 32.00 2cuq s GLN 54 CO 0.26 0.40 1.45 -1.14 -0.55 0.00 0.00 175.29 175.71 2cuq s GLN 55 N -2.95 3.46 0.35 1.67 0.74 -1.26 -4.95 119.66 116.71 2cuq s GLN 55 Ca 0.25 0.82 -0.03 0.00 0.05 0.00 0.00 55.36 56.45 2cuq s GLN 55 Cb -0.08 -4.07 0.01 0.00 1.10 0.00 0.00 33.01 29.96 2cuq s GLN 55 CO 0.14 -1.72 0.49 -0.59 -0.55 0.00 0.00 175.29 173.06 2cuq s PHE 56 N 5.80 1.02 0.15 1.67 -0.12 -1.26 -4.28 117.98 120.95 2cuq s PHE 56 Ca 0.60 -1.27 0.03 0.00 -0.05 0.00 0.00 56.93 56.23 2cuq s PHE 56 Cb -0.13 -0.04 -0.04 0.00 -0.63 0.00 0.00 43.02 42.17 2cuq s PHE 56 CO 0.30 -1.16 -0.05 -0.08 -0.05 0.00 0.00 175.22 174.18 2cuq s THR 57 N -3.01 0.84 0.02 -4.49 -1.32 -0.19 -4.96 115.64 102.53 2cuq s THR 57 Ca 0.30 -1.99 0.05 0.00 -1.21 0.00 0.00 61.69 58.84 2cuq s THR 57 Cb -0.01 -1.92 -0.03 0.00 -1.51 0.00 0.00 72.50 69.04 2cuq s THR 57 CO 0.20 -0.67 -0.14 -0.94 -2.21 0.00 0.00 174.62 170.86 2cuq s SER 58 N -3.14 4.09 -0.02 8.08 1.04 -1.26 0.21 113.70 122.70 2cuq s SER 58 Ca 0.18 -0.30 -0.01 0.00 0.48 0.00 0.00 55.95 56.30 2cuq s SER 58 Cb 0.05 -0.79 0.02 0.00 0.10 0.00 0.00 66.02 65.40 2cuq s SER 58 CO 0.00 0.28 0.04 -0.60 0.98 0.00 0.00 173.24 173.94 2cuq s ARG 59 N -1.34 -0.00 -1.64 4.02 6.06 0.37 -4.85 118.95 121.56 2cuq s ARG 59 Ca 0.15 0.15 -0.17 0.00 -2.50 0.00 0.00 55.73 53.37 2cuq s ARG 59 Cb -0.11 -0.15 0.13 0.00 0.06 0.00 0.00 34.95 34.89 2cuq s ARG 59 CO 0.05 -0.11 0.84 -0.25 -2.50 0.00 0.00 175.30 173.33 2cuq n ASP 60 N 3.79 -3.65 -2.85 -2.12 8.00 -1.26 -0.79 116.55 117.67 2cuq n ASP 60 Ca -0.22 -0.94 -0.14 0.00 0.71 0.00 0.00 54.79 54.19 2cuq n ASP 60 Cb 0.54 -3.11 0.07 0.00 -0.02 0.00 0.00 41.12 38.60 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 -4.48 -5.33 -3.67 -1.24 1.02 -1.26 -5.03 120.64 100.65 2cuq n GLU 61 Ca 0.05 0.64 -0.09 0.00 -0.02 0.00 0.00 57.16 57.74 2cuq n GLU 61 Cb 0.51 -5.06 -0.10 0.00 -0.02 0.00 0.00 31.44 26.76 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 -3.81 -0.37 -0.24 1.62 1.01 0.03 -5.13 116.67 109.78 2cuq s ASP 62 Ca 0.12 0.96 -0.29 0.00 0.71 0.00 0.00 52.55 54.05 2cuq s ASP 62 Cb -0.05 1.10 -0.02 0.00 1.01 0.00 0.00 42.92 44.95 2cuq s ASP 62 CO 0.55 -0.22 1.62 -2.16 0.21 0.00 0.00 175.17 175.18 2cuq s PRO 63 N 2.08 3.74 -0.02 8.23 0.04 -1.26 -0.48 135.00 147.34 2cuq s PRO 63 Ca -0.05 1.60 0.07 0.00 0.04 0.00 0.00 61.00 62.66 2cuq s PRO 63 Cb -0.10 -4.05 -0.02 0.00 0.04 0.00 0.00 34.50 30.37 2cuq s PRO 63 CO -0.13 -1.36 -0.23 0.71 0.04 0.00 0.00 177.00 176.03 2cuq s TYR 64 N 5.37 2.07 0.41 0.56 2.02 0.13 -1.30 117.35 126.62 2cuq s TYR 64 Ca 0.72 -0.41 -0.15 0.00 -0.37 0.00 0.00 57.07 56.86 2cuq s TYR 64 Cb -0.24 -1.34 -0.08 0.00 -0.40 0.00 0.00 41.96 39.90 2cuq s TYR 64 CO 0.30 -0.05 0.84 0.00 -1.57 0.00 0.00 175.55 175.07 2cuq h VAL 66 N 1.44 0.40 -0.91 0.00 2.07 -1.92 0.61 116.25 117.94 2cuq h VAL 66 Ca -0.48 -0.13 0.03 0.00 0.82 0.00 0.00 66.70 66.94 2cuq h VAL 66 Cb 1.18 -0.02 -0.05 0.00 -1.52 0.00 0.00 31.29 30.88 2cuq h VAL 66 CO 0.63 0.07 0.60 0.00 0.02 0.00 0.00 177.57 178.90 2cuq h ALA 67 N 1.74 1.40 0.00 1.67 0.00 -1.93 -1.65 119.26 120.48 2cuq h ALA 67 Ca 0.69 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 55.48 2cuq h ALA 67 Cb 1.60 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 2cuq h ALA 67 CO -0.48 0.53 -0.41 0.00 0.00 0.00 0.00 179.25 178.89 2cuq h PHE 69 N -1.00 -0.36 -0.45 0.00 3.57 -0.39 0.85 116.94 119.15 2cuq h PHE 69 Ca -0.10 0.07 -0.21 0.00 3.53 0.00 0.00 57.97 61.25 2cuq h PHE 69 Cb 0.92 0.28 -0.13 0.00 2.79 0.00 0.00 35.95 39.82 2cuq h PHE 69 CO 0.15 -0.32 0.27 0.41 -2.23 0.00 0.00 178.31 176.59 2cuq n GLY 70 N -1.50 3.05 0.87 2.40 0.00 -0.63 -2.91 105.19 106.48 2cuq n GLY 70 Ca 0.11 -0.50 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 -0.20 0.00 -0.05 1.61 -0.58 0.25 -4.63 120.64 117.04 2cuq n GLU 71 Ca 0.26 0.00 -0.03 0.00 -0.42 0.00 0.00 57.16 56.98 2cuq n GLU 71 Cb 1.01 -0.38 -0.02 0.00 -0.57 0.00 0.00 31.44 31.48 2cuq n GLU 71 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 2cuq h LEU 72 N 0.00 0.00 0.06 -4.62 4.07 -0.50 -3.40 115.31 110.91 2cuq h LEU 72 Ca 0.00 -0.17 -0.17 0.00 0.08 0.00 0.00 57.88 57.61 2cuq h LEU 72 Cb 0.25 0.00 0.02 0.00 1.08 0.00 0.00 40.66 42.01 2cuq h LEU 72 CO 0.00 0.60 -0.71 -0.26 -1.08 0.00 0.00 178.44 176.98 2cuq h PHE 73 N -1.00 0.61 -3.06 1.13 0.04 -1.73 -3.45 116.94 109.49 2cuq h PHE 73 Ca -0.00 -0.37 -0.61 0.00 2.80 0.00 0.00 57.97 59.79 2cuq h PHE 73 Cb 0.19 -0.05 -0.07 0.00 2.20 0.00 0.00 35.95 38.22 2cuq h PHE 73 CO 0.04 1.22 -0.24 0.00 -0.60 0.00 0.00 178.31 178.73 2cuq s ALA 74 N -2.93 3.67 0.13 2.45 0.00 -1.15 -5.07 121.76 118.88 2cuq s ALA 74 Ca -0.13 -0.30 0.00 0.00 0.00 0.00 0.00 51.96 51.53 2cuq s ALA 74 Cb 0.03 -2.37 -0.04 0.00 0.00 0.00 0.00 23.12 20.73 2cuq s ALA 74 CO 0.83 0.37 0.01 0.45 0.00 0.00 0.00 175.76 177.43 2cuq s SER 75 N -0.62 0.74 0.00 0.00 0.15 -1.26 -3.06 113.70 109.65 2cuq s SER 75 Ca 0.22 -1.15 0.00 0.00 0.70 0.00 0.00 55.95 55.72 2cuq s SER 75 Cb -0.15 0.20 0.00 0.00 -1.71 0.00 0.00 66.02 64.36 2cuq s SER 75 CO 0.10 -0.63 0.00 0.61 1.20 0.00 0.00 173.24 174.52 2cuq n GLY 76 N -0.12 0.14 3.70 9.45 0.00 -1.26 -5.06 105.19 112.04 2cuq n GLY 76 Ca -0.07 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 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 -0.20 4.30 -0.14 1.61 0.04 -1.26 -5.02 135.00 134.33 2cuq s PRO 77 Ca 0.00 2.03 -0.04 0.00 0.04 0.00 0.00 61.00 63.04 2cuq s PRO 77 Cb 0.00 -3.44 -0.03 0.00 0.04 0.00 0.00 34.50 31.07 2cuq s PRO 77 CO 0.00 -0.52 -0.02 0.45 0.04 0.00 0.00 177.00 176.95 2cuq s SER 78 N 1.59 4.97 0.94 6.66 0.15 -1.26 -5.11 113.70 121.64 2cuq s SER 78 Ca 0.65 -0.05 -0.15 0.00 0.70 0.00 0.00 55.95 57.10 2cuq s SER 78 Cb -0.34 -1.71 0.19 0.00 -1.71 0.00 0.00 66.02 62.44 2cuq s SER 78 CO 0.29 0.22 1.30 -0.55 1.20 0.00 0.00 173.24 175.70 2cuq s SER 79 N 0.07 3.28 0.00 5.45 0.15 -1.26 -5.33 113.70 116.06 2cuq s SER 79 Ca 0.01 0.31 0.00 0.00 0.70 0.00 0.00 55.95 56.97 2cuq s SER 79 Cb -0.13 -0.40 0.00 0.00 -1.71 0.00 0.00 66.02 63.78 2cuq s SER 79 CO 0.02 -2.64 0.00 0.61 1.20 0.00 0.00 173.24 172.44