#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 -0.94 -0.28 1.61 0.01 -1.26 -5.16 113.70 107.68 2cuq s SER 2 Ca 0.00 1.45 -0.22 0.00 1.31 0.00 0.00 55.95 58.49 2cuq s SER 2 Cb 0.00 1.54 0.12 0.00 0.21 0.00 0.00 66.02 67.90 2cuq s SER 2 CO 0.00 -0.22 0.99 -0.94 0.41 0.00 0.00 173.24 173.48 2cuq s SER 3 N 1.86 -0.50 0.10 2.44 1.04 -1.26 -5.18 113.70 112.20 2cuq s SER 3 Ca -0.09 0.91 -0.25 0.00 0.48 0.00 0.00 55.95 57.00 2cuq s SER 3 Cb -0.06 1.00 0.08 0.00 0.10 0.00 0.00 66.02 67.14 2cuq s SER 3 CO -0.19 -0.15 0.74 -0.83 0.98 0.00 0.00 173.24 173.78 2cuq s GLY 4 N 0.56 -0.51 -0.26 7.32 0.00 -1.26 -5.16 107.32 108.01 2cuq s GLY 4 Ca -0.00 0.62 -0.09 0.00 0.00 0.00 0.00 44.72 45.25 2cuq s GLY 4 CO -0.09 0.20 0.57 -0.56 0.00 0.00 0.00 173.10 173.23 2cuq s SER 5 N -2.67 -0.84 0.03 1.64 0.01 -1.26 -5.17 113.70 105.44 2cuq s SER 5 Ca 0.04 1.38 -0.12 0.00 1.31 0.00 0.00 55.95 58.55 2cuq s SER 5 Cb -0.01 1.96 0.01 0.00 0.21 0.00 0.00 66.02 68.19 2cuq s SER 5 CO -0.10 -0.22 0.26 -0.94 0.41 0.00 0.00 173.24 172.65 2cuq s SER 6 N 2.76 -0.07 0.00 2.44 1.04 -1.26 -5.16 113.70 113.44 2cuq s SER 6 Ca -0.05 -0.20 0.00 0.00 0.48 0.00 0.00 55.95 56.18 2cuq s SER 6 Cb -0.12 0.32 0.00 0.00 0.10 0.00 0.00 66.02 66.32 2cuq s SER 6 CO -0.17 -0.55 0.00 0.61 0.98 0.00 0.00 173.24 174.11 2cuq n GLY 7 N 0.80 3.12 3.55 7.32 0.00 -1.26 -5.06 105.19 113.67 2cuq n GLY 7 Ca -0.20 -0.07 -0.29 0.00 0.00 0.00 0.00 46.02 45.46 2cuq n GLY 7 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2cuq n PRO 8 N -0.53 1.60 -1.67 1.61 -0.04 -1.26 -4.94 135.00 129.77 2cuq n PRO 8 Ca 0.00 -2.43 -0.40 0.00 -0.04 0.00 0.00 63.50 60.63 2cuq n PRO 8 Cb 0.00 -3.68 0.02 0.00 -0.04 0.00 0.00 33.50 29.81 2cuq n PRO 8 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2cuq s TYR 10 N -1.29 3.12 -0.51 0.00 2.02 -1.26 -4.92 117.35 114.50 2cuq s TYR 10 Ca 0.66 -3.15 0.02 0.00 -0.37 0.00 0.00 57.07 54.23 2cuq s TYR 10 Cb -0.49 -2.39 0.45 0.00 -0.40 0.00 0.00 41.96 39.13 2cuq s TYR 10 CO 0.54 -0.60 1.67 -0.85 -1.57 0.00 0.00 175.55 174.74 2cuq n GLU 11 N 2.17 3.09 0.04 -0.62 0.00 -1.26 -4.59 120.64 119.47 2cuq n GLU 11 Ca 0.21 -3.68 0.00 0.00 0.00 0.00 0.00 57.16 53.69 2cuq n GLU 11 Cb 0.37 -2.28 0.00 0.00 0.00 0.00 0.00 31.44 29.53 2cuq n GLU 11 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.13 175.42 2cuq n ASN 12 N -0.82 0.69 -2.20 -1.84 5.15 -1.26 -4.79 115.26 110.19 2cuq n ASN 12 Ca 0.55 0.13 -0.23 0.00 -0.60 0.00 0.00 54.58 54.43 2cuq n ASN 12 Cb 0.78 -0.18 -0.00 0.00 -0.53 0.00 0.00 39.78 39.85 2cuq n ASN 12 CO 0.00 0.00 0.00 1.17 1.40 0.00 0.00 177.26 179.83 2cuq n LYS 13 N -3.34 2.14 0.10 1.20 3.00 -1.26 -4.37 118.16 115.62 2cuq n LYS 13 Ca 0.00 -2.05 0.13 0.00 -0.00 0.00 0.00 58.31 56.39 2cuq n LYS 13 Cb 0.13 -1.90 0.34 0.00 0.00 0.00 0.00 35.03 33.59 2cuq n LYS 13 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.40 177.75 2cuq h PHE 14 N 2.21 0.00 -1.95 5.64 3.57 -1.87 -3.46 116.94 121.08 2cuq h PHE 14 Ca 0.36 0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.91 2cuq h PHE 14 Cb 0.81 0.00 -0.19 0.00 2.79 0.00 0.00 35.95 39.36 2cuq h PHE 14 CO 1.15 0.00 0.42 0.00 -2.23 0.00 0.00 178.31 177.65 2cuq s ALA 15 N -3.12 -1.84 0.46 2.41 0.00 -1.26 -5.10 121.76 113.31 2cuq s ALA 15 Ca 0.09 1.31 -0.23 0.00 0.00 0.00 0.00 51.96 53.13 2cuq s ALA 15 Cb 0.12 -0.15 -0.07 0.00 0.00 0.00 0.00 23.12 23.02 2cuq s ALA 15 CO 0.63 -0.45 1.16 -1.25 0.00 0.00 0.00 175.76 175.86 2cuq s PRO 16 N -1.81 3.77 -0.02 0.00 0.04 -1.26 -4.86 135.00 130.86 2cuq s PRO 16 Ca -0.02 1.77 0.07 0.00 0.04 0.00 0.00 61.00 62.86 2cuq s PRO 16 Cb -0.01 -2.41 -0.02 0.00 0.04 0.00 0.00 34.50 32.10 2cuq s PRO 16 CO 0.00 -0.55 -0.23 1.03 0.04 0.00 0.00 177.00 177.29 2cuq s ARG 17 N -2.69 1.90 -0.21 4.56 0.52 -1.26 -1.42 118.95 120.34 2cuq s ARG 17 Ca 0.63 -0.84 -0.41 0.00 -0.52 0.00 0.00 55.73 54.59 2cuq s ARG 17 Cb -0.29 -1.83 -0.18 0.00 0.52 0.00 0.00 34.95 33.17 2cuq s ARG 17 CO 0.35 0.50 1.52 0.00 0.02 0.00 0.00 175.30 177.69 2cuq n ALA 19 N 3.83 1.09 -0.08 0.00 0.00 0.13 0.26 120.51 125.74 2cuq n ALA 19 Ca 0.25 0.08 -0.08 0.00 0.00 0.00 0.00 53.44 53.69 2cuq n ALA 19 Cb 0.09 -1.16 -0.03 0.00 0.00 0.00 0.00 19.45 18.35 2cuq n ALA 19 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2cuq n ARG 20 N -1.84 0.50 -0.04 0.00 3.00 -1.26 -4.74 116.66 112.28 2cuq n ARG 20 Ca -0.00 0.37 -0.17 0.00 -0.00 0.00 0.00 57.85 58.05 2cuq n ARG 20 Cb 0.03 -1.57 -0.14 0.00 0.00 0.00 0.00 32.46 30.79 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 -3.29 -3.17 0.00 0.00 2.88 0.73 -4.91 113.62 105.86 2cuq n SER 22 Ca -0.33 -0.35 0.00 0.00 -1.33 0.00 0.00 58.87 56.86 2cuq n SER 22 Cb 1.04 -3.22 0.00 0.00 -0.75 0.00 0.00 64.21 61.29 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 -3.00 0.00 -3.59 -1.46 4.76 -1.26 -4.74 118.16 108.87 2cuq n LYS 23 Ca -0.09 0.09 -0.09 0.00 -2.87 0.00 0.00 58.31 55.35 2cuq n LYS 23 Cb 0.57 -0.43 -0.05 0.00 -1.84 0.00 0.00 35.03 33.28 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 -0.48 0.00 -0.14 -0.18 -4.23 -1.26 -4.86 115.64 104.49 2cuq s THR 24 Ca 0.00 0.00 0.21 0.00 -1.18 0.00 0.00 61.69 60.72 2cuq s THR 24 Cb 0.00 -1.00 0.46 0.00 1.34 0.00 0.00 72.50 73.30 2cuq s THR 24 CO 0.00 0.00 1.16 0.18 -0.54 0.00 0.00 174.62 175.42 2cuq n LEU 25 N 0.79 1.81 -0.13 4.79 4.77 -0.51 -4.64 117.00 123.89 2cuq n LEU 25 Ca -0.09 -2.86 -0.10 0.00 -0.03 0.00 0.00 56.01 52.92 2cuq n LEU 25 Cb 0.58 0.03 -0.02 0.00 -2.33 0.00 0.00 43.42 41.68 2cuq n LEU 25 CO 0.14 0.95 0.79 0.00 -1.33 0.00 0.00 177.39 177.95 2cuq h THR 26 N 5.21 1.25 -3.07 -5.08 1.03 -1.96 -3.39 112.91 106.90 2cuq h THR 26 Ca -0.11 -0.95 -0.74 0.00 -0.01 0.00 0.00 66.41 64.60 2cuq h THR 26 Cb 1.54 1.16 -0.22 0.00 -1.07 0.00 0.00 68.15 69.55 2cuq h THR 26 CO 0.17 0.32 -0.01 -1.10 -0.01 0.00 0.00 175.52 174.89 2cuq s GLN 27 N -5.04 3.11 0.60 0.00 -1.52 -1.26 -4.95 119.66 110.59 2cuq s GLN 27 Ca -0.13 -1.65 0.00 0.00 -1.95 0.00 0.00 55.36 51.63 2cuq s GLN 27 Cb 0.09 -4.32 0.00 0.00 -0.22 0.00 0.00 33.01 28.56 2cuq s GLN 27 CO 0.78 -1.43 0.00 0.41 -0.25 0.00 0.00 175.29 174.80 2cuq n GLY 28 N 5.12 -3.58 0.00 3.09 0.00 -1.26 -5.09 105.19 103.47 2cuq n GLY 28 Ca -0.08 -1.00 0.00 0.00 0.00 0.00 0.00 46.02 44.94 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 -3.76 1.54 3.41 -0.02 0.00 -1.26 -4.79 105.19 100.30 2cuq n GLY 29 Ca -0.07 -1.06 -0.22 0.00 0.00 0.00 0.00 46.02 44.68 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 -2.00 0.44 -0.05 1.61 -7.23 -0.96 -4.91 120.40 107.30 2cuq s VAL 30 Ca 0.00 -2.00 -0.01 0.00 -1.81 0.00 0.00 61.98 58.16 2cuq s VAL 30 Cb 0.00 -2.46 0.03 0.00 0.56 0.00 0.00 36.38 34.51 2cuq s VAL 30 CO 0.00 0.00 0.03 0.28 -0.31 0.00 0.00 175.10 175.10 2cuq s THR 31 N -3.40 0.10 -0.15 5.32 -1.32 -1.26 -0.22 115.64 114.71 2cuq s THR 31 Ca 0.31 0.25 0.01 0.00 -1.21 0.00 0.00 61.69 61.05 2cuq s THR 31 Cb 0.04 -0.28 -0.00 0.00 -1.51 0.00 0.00 72.50 70.74 2cuq s THR 31 CO 0.18 0.19 -0.16 -0.47 -2.21 0.00 0.00 174.62 172.14 2cuq s TYR 32 N 1.78 2.77 -1.17 9.09 6.14 0.40 -4.70 117.35 131.65 2cuq s TYR 32 Ca 0.01 -1.08 -0.02 0.00 0.64 0.00 0.00 57.07 56.62 2cuq s TYR 32 Cb -0.12 -1.88 -0.02 0.00 0.42 0.00 0.00 41.96 40.36 2cuq s TYR 32 CO -0.03 -0.49 0.96 0.54 0.64 0.00 0.00 175.55 177.16 2cuq n ARG 33 N 4.06 -5.48 -3.25 4.97 1.74 -1.26 -2.13 116.66 115.31 2cuq n ARG 33 Ca -0.19 0.83 -0.23 0.00 -0.77 0.00 0.00 57.85 57.49 2cuq n ARG 33 Cb 0.52 -5.79 0.02 0.00 -1.02 0.00 0.00 32.46 26.19 2cuq n ARG 33 CO 0.00 0.00 0.00 -3.47 -1.52 0.00 0.00 177.63 172.64 2cuq n ASP 34 N -3.14 -4.98 -3.80 0.55 2.03 -1.26 -4.96 116.55 100.98 2cuq n ASP 34 Ca -0.24 -0.37 -0.12 0.00 0.52 0.00 0.00 54.79 54.57 2cuq n ASP 34 Cb 0.66 -4.05 -0.11 0.00 -0.72 0.00 0.00 41.12 36.90 2cuq n ASP 34 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 2cuq s GLN 35 N -5.92 0.34 0.07 -0.67 -0.21 -0.90 -5.14 119.66 107.23 2cuq s GLN 35 Ca 0.38 0.15 -0.31 0.00 0.02 0.00 0.00 55.36 55.60 2cuq s GLN 35 Cb -0.19 0.16 -0.07 0.00 1.00 0.00 0.00 33.01 33.91 2cuq s GLN 35 CO 0.47 -0.06 1.39 -1.25 -2.12 0.00 0.00 175.29 173.72 2cuq s PRO 36 N -0.27 4.31 0.05 2.91 0.04 -1.26 0.15 135.00 140.93 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 -3.39 -0.03 0.00 0.04 0.00 0.00 34.50 31.10 2cuq s PRO 36 CO 0.01 -0.49 -0.12 -1.58 0.04 0.00 0.00 177.00 174.86 2cuq s TRP 37 N 1.63 1.03 -0.20 0.56 0.52 0.70 0.22 118.94 123.39 2cuq s TRP 37 Ca 0.64 -0.44 -0.29 0.00 0.02 0.00 0.00 56.10 56.04 2cuq s TRP 37 Cb -0.35 -0.59 -0.01 0.00 -1.15 0.00 0.00 33.47 31.37 2cuq s TRP 37 CO 0.29 0.01 1.23 -1.01 0.02 0.00 0.00 176.95 177.49 2cuq s HIS 38 N -1.18 2.90 0.28 -1.98 3.76 -1.26 -2.26 115.29 115.54 2cuq s HIS 38 Ca -0.04 1.06 0.13 0.00 -0.15 0.00 0.00 55.06 56.06 2cuq s HIS 38 Cb -0.09 -3.54 0.95 0.00 1.11 0.00 0.00 32.58 31.00 2cuq s HIS 38 CO 0.01 -1.49 1.23 0.54 -0.85 0.00 0.00 174.74 174.19 2cuq n ARG 39 N 6.69 -0.05 -0.04 1.40 1.74 -1.26 0.96 116.66 126.10 2cuq n ARG 39 Ca 0.14 1.10 -0.13 0.00 -0.77 0.00 0.00 57.85 58.18 2cuq n ARG 39 Cb 0.45 -1.92 -0.11 0.00 -1.02 0.00 0.00 32.46 29.86 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 -0.00 0.03 5.56 4.11 -2.02 -3.34 114.58 118.93 2cuq h GLU 40 Ca 0.62 0.00 0.02 0.00 0.07 0.00 0.00 59.36 60.07 2cuq h GLU 40 Cb 1.57 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.79 2cuq h GLU 40 CO -0.63 0.73 -0.21 0.00 0.07 0.00 0.00 179.01 178.97 2cuq n LEU 42 N -5.33 1.47 -3.64 0.00 7.94 0.11 -4.87 117.00 112.68 2cuq n LEU 42 Ca -0.05 0.15 -0.10 0.00 -1.11 0.00 0.00 56.01 54.89 2cuq n LEU 42 Cb 0.25 -1.20 -0.04 0.00 0.53 0.00 0.00 43.42 42.96 2cuq n LEU 42 CO 0.25 -0.93 0.19 0.68 -1.11 0.00 0.00 177.39 176.46 2cuq s VAL 43 N 8.87 0.06 0.51 1.96 -7.23 -1.26 -3.49 120.40 119.82 2cuq s VAL 43 Ca 1.16 -0.59 -0.23 0.00 -1.81 0.00 0.00 61.98 60.51 2cuq s VAL 43 Cb -0.88 -1.23 -0.06 0.00 0.56 0.00 0.00 36.38 34.76 2cuq s VAL 43 CO 0.45 -0.27 1.32 0.00 -0.31 0.00 0.00 175.10 176.30 2cuq n THR 45 N -0.81 1.21 0.09 0.00 -1.04 -0.44 -2.52 114.28 110.77 2cuq n THR 45 Ca 0.09 -0.61 0.00 0.00 -2.04 0.00 0.00 64.05 61.49 2cuq n THR 45 Cb 0.43 -0.42 0.00 0.00 -1.82 0.00 0.00 70.33 68.52 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 0.25 -0.18 0.01 3.41 0.00 -1.26 -4.89 105.19 102.53 2cuq n GLY 46 Ca 0.12 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.25 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 -1.69 -3.83 -4.56 0.00 1.13 -1.05 -4.97 117.38 102.42 2cuq n GLN 48 Ca 0.03 0.61 -0.34 0.00 -1.94 0.00 0.00 57.00 55.37 2cuq n GLN 48 Cb 0.38 -4.83 -0.11 0.00 0.11 0.00 0.00 30.24 25.80 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 -3.26 3.76 -0.38 5.09 -1.32 -1.26 -4.72 115.64 113.55 2cuq s THR 49 Ca 0.10 -0.52 -0.28 0.00 -1.21 0.00 0.00 61.69 59.78 2cuq s THR 49 Cb -0.01 -2.56 -0.01 0.00 -1.51 0.00 0.00 72.50 68.40 2cuq s THR 49 CO 0.53 0.56 1.72 -2.16 -2.21 0.00 0.00 174.62 173.05 2cuq s PRO 50 N -0.95 3.32 -0.02 7.08 0.04 -1.26 -0.51 135.00 142.69 2cuq s PRO 50 Ca 0.14 1.23 0.05 0.00 0.04 0.00 0.00 61.00 62.46 2cuq s PRO 50 Cb -0.11 -4.18 0.20 0.00 0.04 0.00 0.00 34.50 30.45 2cuq s PRO 50 CO 0.03 -1.88 1.04 1.28 0.04 0.00 0.00 177.00 177.51 2cuq n LEU 51 N 10.20 1.57 -4.51 -3.56 4.77 -1.23 -4.87 117.00 119.37 2cuq n LEU 51 Ca 0.21 -0.79 -0.37 0.00 -0.03 0.00 0.00 56.01 55.03 2cuq n LEU 51 Cb 0.48 -0.29 -0.14 0.00 -2.33 0.00 0.00 43.42 41.13 2cuq n LEU 51 CO 0.69 0.31 2.15 0.00 -1.33 0.00 0.00 177.39 179.21 2cuq n ALA 52 N 0.13 0.47 -3.15 -1.18 0.00 -1.26 0.93 120.51 116.46 2cuq n ALA 52 Ca 0.07 -0.48 -0.17 0.00 0.00 0.00 0.00 53.44 52.86 2cuq n ALA 52 Cb 0.30 -2.46 0.05 0.00 0.00 0.00 0.00 19.45 17.34 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 6.31 -0.15 3.48 0.00 0.00 -1.26 -5.02 105.19 108.54 2cuq n GLY 53 Ca 0.61 -0.03 -0.25 0.00 0.00 0.00 0.00 46.02 46.35 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 -5.78 1.71 -0.38 1.61 0.74 0.26 -5.09 119.66 112.74 2cuq s GLN 54 Ca 0.37 -1.58 -0.29 0.00 0.05 0.00 0.00 55.36 53.90 2cuq s GLN 54 Cb -0.16 -1.88 0.01 0.00 1.10 0.00 0.00 33.01 32.08 2cuq s GLN 54 CO 0.45 0.37 1.24 1.14 -0.55 0.00 0.00 175.29 177.95 2cuq s GLN 55 N -3.10 3.81 0.33 1.67 -2.07 -1.26 -4.97 119.66 114.07 2cuq s GLN 55 Ca 0.26 0.96 -0.02 0.00 -1.82 0.00 0.00 55.36 54.74 2cuq s GLN 55 Cb -0.07 -3.90 0.01 0.00 -1.09 0.00 0.00 33.01 27.97 2cuq s GLN 55 CO 0.13 -1.26 0.46 1.97 -1.32 0.00 0.00 175.29 175.28 2cuq n PHE 56 N 7.83 -1.39 -4.02 9.60 1.16 -1.26 -4.12 117.46 125.25 2cuq n PHE 56 Ca 0.14 -2.22 -0.10 0.00 -1.87 0.00 0.00 57.45 53.40 2cuq n PHE 56 Cb 0.48 0.52 -0.11 0.00 -1.61 0.00 0.00 39.48 38.76 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 0.27 -0.09 1.97 -1.32 -0.75 -4.95 115.64 107.97 2cuq s THR 57 Ca 0.27 -1.06 -0.13 0.00 -1.21 0.00 0.00 61.69 59.56 2cuq s THR 57 Cb -0.01 -0.50 -0.05 0.00 -1.51 0.00 0.00 72.50 70.43 2cuq s THR 57 CO 0.20 -0.51 0.32 -0.44 -2.21 0.00 0.00 174.62 171.97 2cuq s SER 58 N -1.66 6.58 -0.01 8.08 0.01 -1.26 -1.18 113.70 124.27 2cuq s SER 58 Ca -0.12 0.69 0.00 0.00 1.31 0.00 0.00 55.95 57.84 2cuq s SER 58 Cb -0.08 -2.19 0.01 0.00 0.21 0.00 0.00 66.02 63.96 2cuq s SER 58 CO -0.01 0.24 0.00 -0.60 0.41 0.00 0.00 173.24 173.28 2cuq s ARG 59 N -0.41 0.04 -1.41 12.44 6.06 0.63 -4.84 118.95 131.46 2cuq s ARG 59 Ca 0.19 0.03 -0.13 0.00 -2.50 0.00 0.00 55.73 53.33 2cuq s ARG 59 Cb -0.14 -0.11 0.10 0.00 0.06 0.00 0.00 34.95 34.86 2cuq s ARG 59 CO 0.08 -0.04 0.62 -0.40 -2.50 0.00 0.00 175.30 173.06 2cuq n ASP 60 N 3.37 -3.64 -2.11 -2.12 5.75 -1.26 0.67 116.55 117.21 2cuq n ASP 60 Ca -0.16 -0.60 -0.16 0.00 -0.01 0.00 0.00 54.79 53.85 2cuq n ASP 60 Cb 0.57 -2.99 0.01 0.00 -1.03 0.00 0.00 41.12 37.68 2cuq n ASP 60 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 2cuq n GLU 61 N -3.99 -2.74 -3.77 0.11 1.02 -1.26 -5.01 120.64 105.01 2cuq n GLU 61 Ca 0.02 0.72 -0.13 0.00 -0.02 0.00 0.00 57.16 57.75 2cuq n GLU 61 Cb 0.52 -5.10 -0.14 0.00 -0.02 0.00 0.00 31.44 26.70 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 -2.59 -0.13 -0.03 1.62 1.11 0.21 -5.13 116.67 111.73 2cuq s ASP 62 Ca 0.14 0.31 -0.30 0.00 0.18 0.00 0.00 52.55 52.88 2cuq s ASP 62 Cb -0.06 0.23 -0.05 0.00 1.07 0.00 0.00 42.92 44.11 2cuq s ASP 62 CO 0.17 -0.12 1.47 -2.16 1.18 0.00 0.00 175.17 175.71 2cuq s PRO 63 N 0.89 4.24 -0.05 8.23 0.04 -1.26 -0.27 135.00 146.82 2cuq s PRO 63 Ca -0.07 2.01 0.02 0.00 0.04 0.00 0.00 61.00 63.01 2cuq s PRO 63 Cb -0.09 -3.72 0.01 0.00 0.04 0.00 0.00 34.50 30.74 2cuq s PRO 63 CO -0.05 -0.69 -0.11 0.71 0.04 0.00 0.00 177.00 176.91 2cuq s TYR 64 N 3.05 1.32 0.49 0.56 2.02 -0.33 -1.33 117.35 123.13 2cuq s TYR 64 Ca 0.66 -0.44 -0.20 0.00 -0.37 0.00 0.00 57.07 56.72 2cuq s TYR 64 Cb -0.31 -0.96 -0.08 0.00 -0.40 0.00 0.00 41.96 40.20 2cuq s TYR 64 CO 0.26 -0.22 1.05 0.00 -1.57 0.00 0.00 175.55 175.07 2cuq h VAL 66 N 1.56 0.24 -0.78 0.00 2.07 -1.93 1.03 116.25 118.43 2cuq h VAL 66 Ca -0.49 -0.07 -0.01 0.00 0.82 0.00 0.00 66.70 66.95 2cuq h VAL 66 Cb 1.23 0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 2cuq h VAL 66 CO 0.59 0.04 0.46 0.00 0.02 0.00 0.00 177.57 178.67 2cuq h ALA 67 N 1.72 1.34 0.00 1.67 0.00 -1.92 -1.62 119.26 120.45 2cuq h ALA 67 Ca 0.76 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 55.48 2cuq h ALA 67 Cb 2.07 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 19.53 2cuq h ALA 67 CO -0.49 0.56 -0.57 0.00 0.00 0.00 0.00 179.25 178.75 2cuq h PHE 69 N -1.00 -0.02 -0.58 0.00 3.57 -0.40 0.73 116.94 119.23 2cuq h PHE 69 Ca -0.14 0.06 -0.26 0.00 3.53 0.00 0.00 57.97 61.15 2cuq h PHE 69 Cb 0.96 0.13 -0.16 0.00 2.79 0.00 0.00 35.95 39.68 2cuq h PHE 69 CO 0.12 -0.25 0.33 0.41 -2.23 0.00 0.00 178.31 176.70 2cuq n GLY 70 N -1.42 3.36 0.00 2.40 0.00 -0.61 -3.07 105.19 105.85 2cuq n GLY 70 Ca 0.15 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.49 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 -0.36 0.46 -0.03 1.61 4.07 0.21 -4.41 120.64 122.19 2cuq n GLU 71 Ca 0.34 0.00 -0.02 0.00 -0.06 0.00 0.00 57.16 57.42 2cuq n GLU 71 Cb 1.17 -0.62 -0.01 0.00 -0.06 0.00 0.00 31.44 31.92 2cuq n GLU 71 CO 0.00 0.00 0.00 1.28 -0.06 0.00 0.00 177.13 178.35 2cuq n LEU 72 N -1.35 0.76 -0.12 4.31 4.32 0.13 -4.49 117.00 120.56 2cuq n LEU 72 Ca 0.00 0.36 -0.11 0.00 -0.02 0.00 0.00 56.01 56.25 2cuq n LEU 72 Cb 0.12 -0.65 -0.02 0.00 -1.62 0.00 0.00 43.42 41.26 2cuq n LEU 72 CO 0.00 -0.47 0.78 -0.26 -1.22 0.00 0.00 177.39 176.22 2cuq h PHE 73 N -0.42 0.69 -2.26 -1.77 0.04 -1.74 -3.44 116.94 108.04 2cuq h PHE 73 Ca 0.00 -0.12 -0.46 0.00 2.80 0.00 0.00 57.97 60.20 2cuq h PHE 73 Cb 0.25 -0.18 0.00 0.00 2.20 0.00 0.00 35.95 38.22 2cuq h PHE 73 CO -0.11 0.73 -0.32 0.00 -0.60 0.00 0.00 178.31 178.01 2cuq s ALA 74 N -5.01 3.95 0.38 2.45 0.00 -1.17 -5.08 121.76 117.28 2cuq s ALA 74 Ca -0.13 -1.21 -0.26 0.00 0.00 0.00 0.00 51.96 50.36 2cuq s ALA 74 Cb 0.09 -1.84 -0.09 0.00 0.00 0.00 0.00 23.12 21.29 2cuq s ALA 74 CO 0.78 0.04 1.15 -1.54 0.00 0.00 0.00 175.76 176.19 2cuq s SER 75 N -4.08 6.67 0.00 0.00 1.04 -1.26 -3.71 113.70 112.36 2cuq s SER 75 Ca 0.40 2.32 0.00 0.00 0.48 0.00 0.00 55.95 59.15 2cuq s SER 75 Cb -0.09 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.41 2cuq s SER 75 CO 0.32 -0.57 0.00 0.61 0.98 0.00 0.00 173.24 174.58 2cuq n GLY 76 N 0.69 4.60 0.00 7.32 0.00 -1.26 -4.71 105.19 111.83 2cuq n GLY 76 Ca 0.03 -1.75 0.01 0.00 0.00 0.00 0.00 46.02 44.31 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 0.49 -2.99 1.61 -0.04 -1.26 -4.51 135.00 128.30 2cuq n PRO 77 Ca 0.00 0.00 -0.44 0.00 -0.04 0.00 0.00 63.50 63.02 2cuq n PRO 77 Cb 0.00 -1.05 -0.02 0.00 -0.04 0.00 0.00 33.50 32.39 2cuq n PRO 77 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2cuq s SER 78 N -1.56 6.65 0.22 3.54 0.01 -1.26 -5.02 113.70 116.29 2cuq s SER 78 Ca 0.02 -2.15 -0.20 0.00 1.31 0.00 0.00 55.95 54.93 2cuq s SER 78 Cb 0.01 -2.37 -0.08 0.00 0.21 0.00 0.00 66.02 63.79 2cuq s SER 78 CO 0.02 -0.99 0.73 -0.55 0.41 0.00 0.00 173.24 172.87 2cuq s SER 79 N 3.41 7.09 0.00 2.44 0.15 -1.26 -5.15 113.70 120.38 2cuq s SER 79 Ca 0.31 1.45 0.03 0.00 0.70 0.00 0.00 55.95 58.44 2cuq s SER 79 Cb -0.05 -2.43 0.03 0.00 -1.71 0.00 0.00 66.02 61.85 2cuq s SER 79 CO -0.09 0.04 0.61 0.61 1.20 0.00 0.00 173.24 175.60