#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 4.19 -0.30 1.61 1.04 -1.26 -5.14 113.70 113.84 2cuq s SER 2 Ca 0.00 -1.28 -0.02 0.00 0.48 0.00 0.00 55.95 55.13 2cuq s SER 2 Cb 0.00 -0.26 0.19 0.00 0.10 0.00 0.00 66.02 66.04 2cuq s SER 2 CO 0.00 -0.58 0.63 -0.44 0.98 0.00 0.00 173.24 173.83 2cuq s SER 3 N -3.85 -1.31 0.00 7.02 0.01 -1.26 -5.03 113.70 109.28 2cuq s SER 3 Ca 0.34 0.88 0.00 0.00 1.31 0.00 0.00 55.95 58.48 2cuq s SER 3 Cb 0.06 2.13 0.00 0.00 0.21 0.00 0.00 66.02 68.41 2cuq s SER 3 CO 0.18 -0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.20 2cuq n GLY 4 N 5.43 0.00 2.64 3.44 0.00 -1.26 -5.10 105.19 110.34 2cuq n GLY 4 Ca -0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.72 2cuq n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cuq s SER 5 N 0.00 3.07 0.05 1.61 0.01 -1.26 -4.88 113.70 112.30 2cuq s SER 5 Ca 0.00 -3.42 0.00 0.00 1.31 0.00 0.00 55.95 53.84 2cuq s SER 5 Cb 0.00 -1.01 0.00 0.00 0.21 0.00 0.00 66.02 65.22 2cuq s SER 5 CO 0.00 -0.13 0.00 -0.24 0.41 0.00 0.00 173.24 173.28 2cuq n SER 6 N 2.47 0.10 0.00 2.44 2.88 -1.26 -5.17 113.62 115.08 2cuq n SER 6 Ca 0.24 0.09 0.00 0.00 -1.33 0.00 0.00 58.87 57.87 2cuq n SER 6 Cb 0.41 0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.89 2cuq n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cuq n GLY 7 N 2.25 4.39 3.77 0.46 0.00 -1.26 -5.12 105.19 109.68 2cuq n GLY 7 Ca 0.00 -1.45 -0.35 0.00 0.00 0.00 0.00 46.02 44.22 2cuq n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cuq s PRO 8 N -3.38 3.37 -0.05 1.61 0.04 -1.26 -5.05 135.00 130.28 2cuq s PRO 8 Ca 0.00 1.62 0.06 0.00 0.04 0.00 0.00 61.00 62.72 2cuq s PRO 8 Cb 0.00 -2.02 -0.01 0.00 0.04 0.00 0.00 34.50 32.51 2cuq s PRO 8 CO 0.00 -0.83 -0.24 0.00 0.04 0.00 0.00 177.00 175.97 2cuq n TYR 10 N 2.92 2.51 -3.10 0.00 4.02 -1.26 -5.01 117.16 117.24 2cuq n TYR 10 Ca -0.17 -2.25 -0.44 0.00 -0.01 0.00 0.00 57.90 55.03 2cuq n TYR 10 Cb 0.52 -0.31 -0.06 0.00 -0.02 0.00 0.00 39.34 39.47 2cuq n TYR 10 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 2cuq s GLU 11 N -3.63 3.13 -0.18 -0.72 8.01 -1.26 -4.88 118.70 119.17 2cuq s GLU 11 Ca 0.47 -0.89 -0.11 0.00 0.01 0.00 0.00 54.97 54.45 2cuq s GLU 11 Cb 0.39 -4.13 -0.21 0.00 -4.31 0.00 0.00 34.13 25.87 2cuq s GLU 11 CO 0.02 -1.33 0.16 0.09 0.01 0.00 0.00 175.26 174.21 2cuq n ASN 12 N 6.41 2.01 -4.34 -0.19 4.13 -1.26 -4.98 115.26 117.04 2cuq n ASN 12 Ca -0.06 0.24 -0.20 0.00 1.68 0.00 0.00 54.58 56.24 2cuq n ASN 12 Cb 0.45 -0.83 -0.11 0.00 -1.54 0.00 0.00 39.78 37.75 2cuq n ASN 12 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 2cuq s LYS 13 N -2.49 1.29 -0.26 3.52 -0.14 -1.26 -5.13 119.74 115.28 2cuq s LYS 13 Ca -0.28 -1.48 -0.07 0.00 -1.36 0.00 0.00 55.97 52.79 2cuq s LYS 13 Cb 0.08 -1.24 -0.01 0.00 -1.68 0.00 0.00 37.83 34.97 2cuq s LYS 13 CO 0.66 0.23 0.05 0.12 -0.76 0.00 0.00 175.35 175.66 2cuq s PHE 14 N -2.43 3.08 0.05 3.18 5.36 -1.26 -5.09 117.98 120.87 2cuq s PHE 14 Ca 0.18 -0.66 -0.04 0.00 -0.96 0.00 0.00 56.93 55.45 2cuq s PHE 14 Cb -0.04 -2.22 -0.02 0.00 -0.34 0.00 0.00 43.02 40.40 2cuq s PHE 14 CO 0.07 -0.45 0.06 0.00 -1.46 0.00 0.00 175.22 173.43 2cuq s ALA 15 N 1.56 0.13 0.84 11.12 0.00 -1.26 -5.14 121.76 129.01 2cuq s ALA 15 Ca 0.05 -0.81 -0.11 0.00 0.00 0.00 0.00 51.96 51.09 2cuq s ALA 15 Cb -0.15 0.29 0.10 0.00 0.00 0.00 0.00 23.12 23.35 2cuq s ALA 15 CO 0.02 -0.36 1.09 -1.25 0.00 0.00 0.00 175.76 175.26 2cuq s PRO 16 N -3.23 1.71 -0.01 0.00 0.04 -1.26 -4.85 135.00 127.41 2cuq s PRO 16 Ca 0.00 0.98 0.01 0.00 0.04 0.00 0.00 61.00 62.04 2cuq s PRO 16 Cb 0.03 -1.85 -0.00 0.00 0.04 0.00 0.00 34.50 32.72 2cuq s PRO 16 CO -0.07 -1.97 -0.03 1.03 0.04 0.00 0.00 177.00 175.99 2cuq s ARG 17 N -4.92 0.31 -0.06 4.56 0.52 -1.26 -1.55 118.95 116.55 2cuq s ARG 17 Ca 0.62 -0.12 -0.40 0.00 -0.52 0.00 0.00 55.73 55.32 2cuq s ARG 17 Cb -0.18 -0.32 -0.19 0.00 0.52 0.00 0.00 34.95 34.79 2cuq s ARG 17 CO 0.57 0.06 1.25 0.00 0.02 0.00 0.00 175.30 177.20 2cuq h ALA 19 N 3.94 1.00 0.00 0.00 0.00 0.15 2.12 119.26 126.47 2cuq h ALA 19 Ca -0.49 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.37 2cuq h ALA 19 Cb 1.39 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 2cuq h ALA 19 CO 0.75 0.00 -0.69 -2.13 0.00 0.00 0.00 179.25 177.17 2cuq n ARG 20 N -2.63 0.48 -0.01 0.00 3.00 -1.26 -4.68 116.66 111.55 2cuq n ARG 20 Ca -0.01 0.52 -0.21 0.00 -0.00 0.00 0.00 57.85 58.15 2cuq n ARG 20 Cb 0.13 -1.69 -0.14 0.00 0.00 0.00 0.00 32.46 30.77 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 -3.50 -2.54 0.00 0.00 2.88 0.71 -4.92 113.62 106.25 2cuq n SER 22 Ca -0.33 -0.38 0.00 0.00 -1.33 0.00 0.00 58.87 56.83 2cuq n SER 22 Cb 1.03 -3.40 0.00 0.00 -0.75 0.00 0.00 64.21 61.09 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 -3.04 0.00 -3.58 -1.46 5.02 -1.26 -4.78 118.16 109.06 2cuq n LYS 23 Ca -0.15 0.04 -0.10 0.00 -2.02 0.00 0.00 58.31 56.08 2cuq n LYS 23 Cb 0.59 -0.31 -0.05 0.00 -0.02 0.00 0.00 35.03 35.24 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 -0.31 -0.18 -4.23 -1.26 -4.85 115.64 104.39 2cuq s THR 24 Ca 0.00 0.00 0.17 0.00 -1.18 0.00 0.00 61.69 60.68 2cuq s THR 24 Cb 0.00 -1.00 0.47 0.00 1.34 0.00 0.00 72.50 73.31 2cuq s THR 24 CO 0.00 0.00 1.05 0.18 -0.54 0.00 0.00 174.62 175.31 2cuq n LEU 25 N 0.79 2.32 0.01 4.79 4.77 -0.60 -4.64 117.00 124.44 2cuq n LEU 25 Ca -0.10 -3.80 -0.13 0.00 -0.03 0.00 0.00 56.01 51.95 2cuq n LEU 25 Cb 0.58 0.24 -0.07 0.00 -2.33 0.00 0.00 43.42 41.84 2cuq n LEU 25 CO 0.15 1.53 0.57 0.71 -1.33 0.00 0.00 177.39 179.02 2cuq h THR 26 N 3.74 0.11 -0.69 -5.08 1.35 -1.96 -3.28 112.91 107.09 2cuq h THR 26 Ca -0.01 0.00 -0.40 0.00 -0.55 0.00 0.00 66.41 65.46 2cuq h THR 26 Cb 1.22 0.11 -0.06 0.00 -1.73 0.00 0.00 68.15 67.69 2cuq h THR 26 CO 0.47 0.00 1.14 -1.10 -0.25 0.00 0.00 175.52 175.78 2cuq s GLN 27 N -5.85 2.85 0.00 4.72 -0.21 -1.26 -4.89 119.66 115.02 2cuq s GLN 27 Ca -0.16 -0.94 0.00 0.00 0.02 0.00 0.00 55.36 54.29 2cuq s GLN 27 Cb 0.09 -5.23 0.00 0.00 1.00 0.00 0.00 33.01 28.87 2cuq s GLN 27 CO 0.63 -3.31 0.00 0.41 -2.12 0.00 0.00 175.29 170.90 2cuq n GLY 28 N 6.29 1.67 0.00 3.09 0.00 -1.24 -4.97 105.19 110.03 2cuq n GLY 28 Ca 0.42 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2cuq n GLY 28 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2cuq n GLY 29 N 0.00 0.81 3.68 -0.02 0.00 -1.26 -4.79 105.19 103.61 2cuq n GLY 29 Ca 0.00 -2.01 -0.31 0.00 0.00 0.00 0.00 46.02 43.70 2cuq n GLY 29 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2cuq s VAL 30 N -1.56 0.91 -0.12 1.61 -7.23 -1.22 -5.04 120.40 107.75 2cuq s VAL 30 Ca 0.00 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.13 2cuq s VAL 30 Cb 0.00 -2.18 0.06 0.00 0.56 0.00 0.00 36.38 34.83 2cuq s VAL 30 CO 0.00 0.00 0.22 0.28 -0.31 0.00 0.00 175.10 175.29 2cuq s THR 31 N -2.99 -0.35 -0.21 5.32 -1.32 -1.26 -1.80 115.64 113.03 2cuq s THR 31 Ca 0.10 0.26 -0.03 0.00 -1.21 0.00 0.00 61.69 60.82 2cuq s THR 31 Cb 0.01 -0.42 -0.00 0.00 -1.51 0.00 0.00 72.50 70.58 2cuq s THR 31 CO 0.06 0.09 -0.09 -0.47 -2.21 0.00 0.00 174.62 172.01 2cuq s TYR 32 N 2.37 2.91 -0.93 9.09 6.14 0.44 -4.67 117.35 132.70 2cuq s TYR 32 Ca 0.03 -1.13 -0.02 0.00 0.64 0.00 0.00 57.07 56.59 2cuq s TYR 32 Cb -0.12 -2.05 -0.02 0.00 0.42 0.00 0.00 41.96 40.18 2cuq s TYR 32 CO -0.08 -0.62 0.79 0.54 0.64 0.00 0.00 175.55 176.82 2cuq n ARG 33 N 4.74 -3.99 -3.53 4.97 1.74 -1.26 -2.75 116.66 116.58 2cuq n ARG 33 Ca -0.19 0.70 -0.26 0.00 -0.77 0.00 0.00 57.85 57.33 2cuq n ARG 33 Cb 0.51 -5.15 0.02 0.00 -1.02 0.00 0.00 32.46 26.82 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 -2.80 -4.77 -3.73 0.55 9.92 -1.26 -4.96 116.55 109.51 2cuq n ASP 34 Ca -0.17 -0.54 -0.13 0.00 -0.53 0.00 0.00 54.79 53.42 2cuq n ASP 34 Cb 0.62 -3.86 -0.09 0.00 -0.64 0.00 0.00 41.12 37.15 2cuq n ASP 34 CO 0.00 0.00 0.00 -1.10 0.13 0.00 0.00 177.20 176.23 2cuq s GLN 35 N -6.22 0.55 0.16 -1.24 -0.21 -1.11 -5.15 119.66 106.44 2cuq s GLN 35 Ca 0.50 0.42 -0.31 0.00 0.02 0.00 0.00 55.36 56.00 2cuq s GLN 35 Cb -0.25 0.26 -0.08 0.00 1.00 0.00 0.00 33.01 33.94 2cuq s GLN 35 CO 0.62 -0.09 1.33 -1.25 -2.12 0.00 0.00 175.29 173.77 2cuq s PRO 36 N -0.13 4.36 0.10 2.91 0.04 -1.26 0.17 135.00 141.19 2cuq s PRO 36 Ca -0.03 2.04 0.04 0.00 0.04 0.00 0.00 61.00 63.09 2cuq s PRO 36 Cb -0.03 -3.23 -0.04 0.00 0.04 0.00 0.00 34.50 31.25 2cuq s PRO 36 CO 0.02 -0.33 -0.10 -1.58 0.04 0.00 0.00 177.00 175.05 2cuq s TRP 37 N 0.57 1.10 -0.24 0.56 0.52 -0.74 0.89 118.94 121.59 2cuq s TRP 37 Ca 0.60 -0.66 -0.25 0.00 0.02 0.00 0.00 56.10 55.80 2cuq s TRP 37 Cb -0.36 -0.59 -0.00 0.00 -1.15 0.00 0.00 33.47 31.36 2cuq s TRP 37 CO 0.34 0.01 0.86 -1.01 0.02 0.00 0.00 176.95 177.18 2cuq s HIS 38 N -2.52 3.31 0.35 -1.98 3.76 -1.26 -3.38 115.29 113.56 2cuq s HIS 38 Ca 0.07 1.18 0.20 0.00 -0.15 0.00 0.00 55.06 56.35 2cuq s HIS 38 Cb -0.02 -3.10 1.27 0.00 1.11 0.00 0.00 32.58 31.84 2cuq s HIS 38 CO 0.00 -0.43 1.48 0.54 -0.85 0.00 0.00 174.74 175.49 2cuq n ARG 39 N 6.08 -0.06 0.03 1.40 3.00 -1.26 0.22 116.66 126.07 2cuq n ARG 39 Ca 0.07 1.29 -0.16 0.00 -0.01 0.00 0.00 57.85 59.04 2cuq n ARG 39 Cb 0.47 -2.33 -0.05 0.00 0.00 0.00 0.00 32.46 30.55 2cuq n ARG 39 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.63 178.68 2cuq h GLU 40 N 0.00 0.59 0.15 5.56 4.11 -2.02 -3.33 114.58 119.65 2cuq h GLU 40 Ca 0.80 -0.56 -0.01 0.00 0.07 0.00 0.00 59.36 59.66 2cuq h GLU 40 Cb 2.13 0.14 0.00 0.00 0.50 0.00 0.00 28.75 31.53 2cuq h GLU 40 CO -0.71 1.18 -0.07 0.00 0.07 0.00 0.00 179.01 179.47 2cuq n LEU 42 N -4.98 0.50 -4.09 0.00 7.94 0.14 -4.84 117.00 111.68 2cuq n LEU 42 Ca -0.09 -1.26 -0.12 0.00 -1.11 0.00 0.00 56.01 53.44 2cuq n LEU 42 Cb 0.25 -1.25 -0.11 0.00 0.53 0.00 0.00 43.42 42.85 2cuq n LEU 42 CO 0.30 -2.28 -0.39 0.68 -1.11 0.00 0.00 177.39 174.59 2cuq s VAL 43 N 9.48 0.52 0.51 1.96 -7.23 -1.26 -2.43 120.40 121.95 2cuq s VAL 43 Ca 1.00 -1.36 -0.21 0.00 -1.81 0.00 0.00 61.98 59.60 2cuq s VAL 43 Cb -0.35 -0.95 -0.08 0.00 0.56 0.00 0.00 36.38 35.56 2cuq s VAL 43 CO 0.25 -0.58 0.98 0.00 -0.31 0.00 0.00 175.10 175.44 2cuq n THR 45 N -1.07 1.42 0.05 0.00 -1.04 -0.96 -2.54 114.28 110.14 2cuq n THR 45 Ca 0.11 -0.71 0.00 0.00 -2.04 0.00 0.00 64.05 61.41 2cuq n THR 45 Cb 0.43 -0.40 0.00 0.00 -1.82 0.00 0.00 70.33 68.54 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 0.30 -0.11 0.00 3.41 0.00 -1.26 -4.88 105.19 102.64 2cuq n GLY 46 Ca 0.14 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.26 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 -1.54 -4.40 -4.41 0.00 1.13 -1.05 -4.97 117.38 102.14 2cuq n GLN 48 Ca 0.03 0.65 -0.34 0.00 -1.94 0.00 0.00 57.00 55.40 2cuq n GLN 48 Cb 0.33 -5.01 -0.10 0.00 0.11 0.00 0.00 30.24 25.57 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 -3.28 4.14 -0.28 5.09 -1.32 -1.26 -4.71 115.64 114.02 2cuq s THR 49 Ca 0.07 -0.38 -0.29 0.00 -1.21 0.00 0.00 61.69 59.88 2cuq s THR 49 Cb -0.01 -2.76 -0.02 0.00 -1.51 0.00 0.00 72.50 68.21 2cuq s THR 49 CO 0.56 0.55 1.64 -2.16 -2.21 0.00 0.00 174.62 173.00 2cuq s PRO 50 N -1.03 3.63 -0.03 7.08 0.04 -1.26 -0.62 135.00 142.82 2cuq s PRO 50 Ca 0.15 1.51 0.14 0.00 0.04 0.00 0.00 61.00 62.83 2cuq s PRO 50 Cb -0.11 -4.08 0.44 0.00 0.04 0.00 0.00 34.50 30.79 2cuq s PRO 50 CO 0.04 -1.49 1.34 1.28 0.04 0.00 0.00 177.00 178.21 2cuq n LEU 51 N 9.03 2.84 -4.52 -3.56 4.77 -1.02 -4.87 117.00 119.67 2cuq n LEU 51 Ca 0.20 -1.43 -0.34 0.00 -0.03 0.00 0.00 56.01 54.41 2cuq n LEU 51 Cb 0.46 -0.38 -0.13 0.00 -2.33 0.00 0.00 43.42 41.04 2cuq n LEU 51 CO 0.66 0.61 2.07 0.00 -1.33 0.00 0.00 177.39 179.40 2cuq n ALA 52 N 0.80 0.56 -2.65 -1.18 0.00 -1.26 0.69 120.51 117.47 2cuq n ALA 52 Ca 0.16 -0.64 -0.11 0.00 0.00 0.00 0.00 53.44 52.86 2cuq n ALA 52 Cb 0.49 -2.61 0.02 0.00 0.00 0.00 0.00 19.45 17.35 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 6.23 0.10 3.48 0.00 0.00 -1.26 -5.04 105.19 108.70 2cuq n GLY 53 Ca 0.58 -0.33 -0.25 0.00 0.00 0.00 0.00 46.02 46.01 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 -5.13 1.72 -0.46 1.61 0.74 0.22 -5.09 119.66 113.27 2cuq s GLN 54 Ca 0.16 -1.58 -0.29 0.00 0.05 0.00 0.00 55.36 53.70 2cuq s GLN 54 Cb -0.07 -1.88 0.02 0.00 1.10 0.00 0.00 33.01 32.18 2cuq s GLN 54 CO 0.19 0.37 1.31 1.14 -0.55 0.00 0.00 175.29 177.76 2cuq s GLN 55 N -3.11 3.58 0.36 1.67 -2.07 -1.26 -4.96 119.66 113.87 2cuq s GLN 55 Ca 0.26 0.71 -0.03 0.00 -1.82 0.00 0.00 55.36 54.48 2cuq s GLN 55 Cb -0.07 -4.00 0.01 0.00 -1.09 0.00 0.00 33.01 27.86 2cuq s GLN 55 CO 0.13 -1.56 0.51 -0.59 -1.32 0.00 0.00 175.29 172.46 2cuq s PHE 56 N 5.16 1.04 0.16 9.60 -0.12 -1.26 -4.18 117.98 128.38 2cuq s PHE 56 Ca 0.55 -1.30 0.01 0.00 -0.05 0.00 0.00 56.93 56.14 2cuq s PHE 56 Cb -0.11 -0.02 -0.04 0.00 -0.63 0.00 0.00 43.02 42.22 2cuq s PHE 56 CO 0.31 -1.20 0.01 -0.08 -0.05 0.00 0.00 175.22 174.21 2cuq s THR 57 N -2.87 0.52 -0.11 -4.49 -1.32 -0.37 -4.95 115.64 102.05 2cuq s THR 57 Ca 0.30 -1.96 -0.00 0.00 -1.21 0.00 0.00 61.69 58.82 2cuq s THR 57 Cb -0.01 -2.07 -0.02 0.00 -1.51 0.00 0.00 72.50 68.89 2cuq s THR 57 CO 0.21 -0.50 -0.09 -0.44 -2.21 0.00 0.00 174.62 171.58 2cuq s SER 58 N -3.13 4.39 -0.03 8.08 0.01 -1.26 0.26 113.70 122.03 2cuq s SER 58 Ca 0.23 -0.18 0.03 0.00 1.31 0.00 0.00 55.95 57.34 2cuq s SER 58 Cb 0.06 -1.44 -0.00 0.00 0.21 0.00 0.00 66.02 64.85 2cuq s SER 58 CO 0.03 0.24 -0.11 -0.13 0.41 0.00 0.00 173.24 173.68 2cuq s ARG 59 N -0.08 1.11 -1.50 12.44 1.81 0.81 -4.79 118.95 128.76 2cuq s ARG 59 Ca -0.00 -0.38 -0.14 0.00 -1.72 0.00 0.00 55.73 53.48 2cuq s ARG 59 Cb -0.13 -1.03 0.12 0.00 -0.45 0.00 0.00 34.95 33.46 2cuq s ARG 59 CO 0.03 0.16 0.69 -0.25 -0.68 0.00 0.00 175.30 175.25 2cuq n ASP 60 N 3.18 -3.64 -2.67 0.23 8.00 -1.26 -0.67 116.55 119.71 2cuq n ASP 60 Ca -0.17 -0.72 -0.13 0.00 0.71 0.00 0.00 54.79 54.48 2cuq n ASP 60 Cb 0.54 -2.98 0.06 0.00 -0.02 0.00 0.00 41.12 38.72 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 -4.14 -4.82 -3.67 -1.24 1.02 -1.26 -5.04 120.64 101.50 2cuq n GLU 61 Ca 0.04 0.58 -0.09 0.00 -0.02 0.00 0.00 57.16 57.68 2cuq n GLU 61 Cb 0.51 -4.84 -0.09 0.00 -0.02 0.00 0.00 31.44 27.00 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 -3.77 -0.70 -0.31 1.62 1.11 0.15 -5.12 116.67 109.64 2cuq s ASP 62 Ca 0.10 1.16 -0.29 0.00 0.18 0.00 0.00 52.55 53.70 2cuq s ASP 62 Cb -0.04 1.04 -0.02 0.00 1.07 0.00 0.00 42.92 44.97 2cuq s ASP 62 CO 0.51 -0.21 1.68 -2.16 1.18 0.00 0.00 175.17 176.16 2cuq s PRO 63 N 1.51 3.51 -0.03 8.23 0.04 -1.26 -0.13 135.00 146.86 2cuq s PRO 63 Ca -0.10 1.41 0.07 0.00 0.04 0.00 0.00 61.00 62.41 2cuq s PRO 63 Cb -0.07 -4.12 -0.02 0.00 0.04 0.00 0.00 34.50 30.33 2cuq s PRO 63 CO -0.16 -1.64 -0.22 0.71 0.04 0.00 0.00 177.00 175.72 2cuq s TYR 64 N 6.14 2.45 0.38 0.56 2.02 0.14 -2.28 117.35 126.76 2cuq s TYR 64 Ca 0.74 -0.38 -0.20 0.00 -0.37 0.00 0.00 57.07 56.87 2cuq s TYR 64 Cb -0.22 -1.55 -0.10 0.00 -0.40 0.00 0.00 41.96 39.70 2cuq s TYR 64 CO 0.32 0.01 0.88 0.00 -1.57 0.00 0.00 175.55 175.20 2cuq h VAL 66 N 2.03 0.24 -0.92 0.00 2.07 -1.93 0.90 116.25 118.64 2cuq h VAL 66 Ca -0.48 -0.06 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 2cuq h VAL 66 Cb 1.18 0.06 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 2cuq h VAL 66 CO 0.63 0.03 0.54 0.00 0.02 0.00 0.00 177.57 178.79 2cuq h ALA 67 N 1.59 1.17 0.09 1.67 0.00 -1.93 -2.20 119.26 119.65 2cuq h ALA 67 Ca 0.75 -0.11 -0.21 0.00 0.00 0.00 0.00 54.91 55.35 2cuq h ALA 67 Cb 2.30 -0.37 -0.00 0.00 0.00 0.00 0.00 17.79 19.72 2cuq h ALA 67 CO -0.37 0.63 -1.04 0.00 0.00 0.00 0.00 179.25 178.47 2cuq h PHE 69 N -0.51 -0.60 -0.51 0.00 3.57 -0.42 0.56 116.94 119.02 2cuq h PHE 69 Ca -0.23 0.06 -0.26 0.00 3.53 0.00 0.00 57.97 61.08 2cuq h PHE 69 Cb 1.56 0.36 -0.15 0.00 2.79 0.00 0.00 35.95 40.51 2cuq h PHE 69 CO 0.16 -0.33 0.33 0.41 -2.23 0.00 0.00 178.31 176.65 2cuq n GLY 70 N -1.44 3.25 0.00 2.40 0.00 -0.83 -2.91 105.19 105.66 2cuq n GLY 70 Ca 0.06 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.51 2cuq n GLY 70 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2cuq n GLU 71 N -0.32 0.18 -0.06 1.61 4.07 0.12 -4.64 120.64 121.60 2cuq n GLU 71 Ca 0.31 0.00 -0.03 0.00 -0.06 0.00 0.00 57.16 57.37 2cuq n GLU 71 Cb 1.10 -0.63 -0.01 0.00 -0.06 0.00 0.00 31.44 31.84 2cuq n GLU 71 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 2cuq h LEU 72 N 0.00 0.00 -0.04 4.31 4.07 -0.26 -3.42 115.31 119.98 2cuq h LEU 72 Ca 0.00 0.00 -0.16 0.00 0.08 0.00 0.00 57.88 57.80 2cuq h LEU 72 Cb 0.25 0.00 0.01 0.00 1.08 0.00 0.00 40.66 42.01 2cuq h LEU 72 CO 0.00 0.66 -0.59 -0.26 -1.08 0.00 0.00 178.44 177.17 2cuq h PHE 73 N -0.94 0.66 -3.79 1.13 0.04 -1.72 -3.43 116.94 108.89 2cuq h PHE 73 Ca 0.00 -0.33 -0.48 0.00 2.80 0.00 0.00 57.97 59.95 2cuq h PHE 73 Cb 0.39 -0.09 0.05 0.00 2.20 0.00 0.00 35.95 38.50 2cuq h PHE 73 CO -0.17 1.14 0.21 0.00 -0.60 0.00 0.00 178.31 178.89 2cuq s ALA 74 N -3.38 3.26 -1.14 2.45 0.00 -1.15 -3.88 121.76 117.92 2cuq s ALA 74 Ca -0.13 -0.57 -0.07 0.00 0.00 0.00 0.00 51.96 51.19 2cuq s ALA 74 Cb 0.04 -2.69 0.01 0.00 0.00 0.00 0.00 23.12 20.48 2cuq s ALA 74 CO 0.83 -0.74 0.99 0.45 0.00 0.00 0.00 175.76 177.29 2cuq n SER 75 N -2.58 -5.24 0.00 0.00 2.88 -1.26 -4.09 113.62 103.33 2cuq n SER 75 Ca 0.04 -0.47 0.00 0.00 -1.33 0.00 0.00 58.87 57.11 2cuq n SER 75 Cb 0.57 -4.39 0.00 0.00 -0.75 0.00 0.00 64.21 59.64 2cuq n SER 75 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2cuq n GLY 76 N -1.70 -1.44 1.65 0.46 0.00 -1.26 -5.01 105.19 97.88 2cuq n GLY 76 Ca -0.03 0.75 -0.14 0.00 0.00 0.00 0.00 46.02 46.60 2cuq n GLY 76 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cuq n PRO 77 N 0.00 -2.02 -3.19 1.61 -0.04 -1.25 -5.07 135.00 125.04 2cuq n PRO 77 Ca 0.00 -0.82 -0.19 0.00 -0.04 0.00 0.00 63.50 62.45 2cuq n PRO 77 Cb 0.00 -0.77 0.01 0.00 -0.04 0.00 0.00 33.50 32.70 2cuq n PRO 77 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2cuq s SER 78 N -2.89 5.79 -0.19 3.54 1.04 -1.26 -4.81 113.70 114.92 2cuq s SER 78 Ca 0.33 -0.18 -0.07 0.00 0.48 0.00 0.00 55.95 56.51 2cuq s SER 78 Cb -0.03 -1.06 0.09 0.00 0.10 0.00 0.00 66.02 65.11 2cuq s SER 78 CO 0.26 -0.64 0.40 -0.44 0.98 0.00 0.00 173.24 173.80 2cuq s SER 79 N -4.26 -0.19 0.00 7.02 0.01 -1.26 -5.03 113.70 109.99 2cuq s SER 79 Ca 0.50 0.94 0.00 0.00 1.31 0.00 0.00 55.95 58.69 2cuq s SER 79 Cb -0.10 1.23 0.00 0.00 0.21 0.00 0.00 66.02 67.36 2cuq s SER 79 CO 0.33 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.36