#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hlq n PRO 3 N 0.00 0.15 -3.26 0.00 -0.04 -1.26 -4.61 135.00 125.98 1hlq n PRO 3 Ca 0.00 0.07 -0.37 0.00 -0.04 0.00 0.00 63.50 63.16 1hlq n PRO 3 Cb 0.00 -1.41 -0.06 0.00 -0.04 0.00 0.00 33.50 31.99 1hlq n PRO 3 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1hlq s LEU 4 N 2.97 4.41 0.30 1.53 1.43 -1.26 -0.42 118.68 127.63 1hlq s LEU 4 Ca 0.58 1.24 -0.30 0.00 -1.03 0.00 0.00 54.13 54.62 1hlq s LEU 4 Cb -0.37 -3.23 -0.12 0.00 0.03 0.00 0.00 46.19 42.50 1hlq s LEU 4 CO 0.65 0.14 1.50 0.52 0.23 0.00 0.00 176.35 179.39 1hlq n VAL 5 N 1.09 1.24 -3.95 -1.59 0.31 0.12 -4.82 118.33 110.74 1hlq n VAL 5 Ca -0.06 -0.31 -0.33 0.00 -0.01 0.00 0.00 64.34 63.63 1hlq n VAL 5 Cb 0.51 -1.80 -0.05 0.00 -0.91 0.00 0.00 33.84 31.59 1hlq n VAL 5 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1hlq s ALA 6 N -0.28 3.89 0.06 3.52 0.00 -1.26 -4.94 121.76 122.74 1hlq s ALA 6 Ca 0.63 -0.80 0.33 0.00 0.00 0.00 0.00 51.96 52.11 1hlq s ALA 6 Cb -0.54 -1.80 1.49 0.00 0.00 0.00 0.00 23.12 22.26 1hlq s ALA 6 CO 0.52 0.75 1.98 0.93 0.00 0.00 0.00 175.76 179.94 1hlq h GLU 7 N 3.73 0.00 0.00 0.00 5.08 -1.94 -1.70 114.58 119.75 1hlq h GLU 7 Ca -0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.88 1hlq h GLU 7 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1hlq h GLU 7 CO 0.69 0.00 -0.40 1.79 -1.00 0.00 0.00 179.01 180.09 1hlq h THR 8 N 0.00 0.00 -3.49 1.13 1.35 -1.94 -3.36 112.91 106.61 1hlq h THR 8 Ca 0.00 -0.51 -0.56 0.00 -0.55 0.00 0.00 66.41 64.79 1hlq h THR 8 Cb 0.34 1.25 0.11 0.00 -1.73 0.00 0.00 68.15 68.12 1hlq h THR 8 CO 0.00 0.00 0.55 0.47 -0.25 0.00 0.00 175.52 176.29 1hlq n ASP 9 N -2.20 2.87 -0.27 5.36 8.00 -0.64 -4.78 116.55 124.88 1hlq n ASP 9 Ca 0.04 1.18 0.04 0.00 0.71 0.00 0.00 54.79 56.76 1hlq n ASP 9 Cb 0.44 -1.51 0.17 0.00 -0.02 0.00 0.00 41.12 40.20 1hlq n ASP 9 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1hlq h ALA 10 N 2.47 1.12 -0.24 2.24 0.00 -1.90 -1.11 119.26 121.83 1hlq h ALA 10 Ca -0.47 0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.37 1hlq h ALA 10 Cb 1.28 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1hlq h ALA 10 CO 0.62 -0.04 -0.37 -2.95 0.00 0.00 0.00 179.25 176.52 1hlq h ASN 11 N 0.64 0.57 -0.15 0.00 7.08 -1.95 -2.14 115.58 119.64 1hlq h ASN 11 Ca 0.40 -0.24 -0.00 0.00 -3.08 0.00 0.00 56.30 53.38 1hlq h ASN 11 Cb 0.47 -0.16 -0.01 0.00 -2.08 0.00 0.00 38.32 36.54 1hlq h ASN 11 CO -0.30 0.89 0.08 0.00 -2.08 0.00 0.00 177.43 176.02 1hlq h ALA 12 N 1.15 0.19 -0.71 4.14 0.00 -1.63 -2.89 119.26 119.51 1hlq h ALA 12 Ca 0.05 -0.06 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1hlq h ALA 12 Cb 0.85 -0.06 -0.06 0.00 0.00 0.00 0.00 17.79 18.53 1hlq h ALA 12 CO 0.07 -0.28 0.41 0.87 0.00 0.00 0.00 179.25 180.33 1hlq h LYS 13 N 0.14 0.74 0.00 0.00 1.57 -1.03 0.33 116.57 118.32 1hlq h LYS 13 Ca 0.05 -0.04 -0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1hlq h LYS 13 Cb 0.07 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.21 1hlq h LYS 13 CO -0.01 0.49 -0.15 1.03 -0.57 0.00 0.00 179.45 180.25 1hlq h SER 14 N 0.76 0.00 -0.21 0.86 0.87 -1.25 -2.71 113.55 111.87 1hlq h SER 14 Ca 0.31 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.87 1hlq h SER 14 Cb 0.17 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.13 1hlq h SER 14 CO -0.17 0.15 0.00 0.18 -0.53 0.00 0.00 176.83 176.45 1hlq n LEU 15 N -4.35 2.65 -1.69 2.23 4.77 -0.95 -4.99 117.00 114.67 1hlq n LEU 15 Ca -0.03 -1.45 -0.14 0.00 -0.03 0.00 0.00 56.01 54.37 1hlq n LEU 15 Cb 0.22 -0.13 -0.00 0.00 -2.33 0.00 0.00 43.42 41.17 1hlq n LEU 15 CO 0.36 0.58 -0.14 0.61 -1.33 0.00 0.00 177.39 177.47 1hlq n GLY 16 N 0.81 -0.19 3.76 -0.72 0.00 -0.21 0.03 105.19 108.68 1hlq n GLY 16 Ca 0.11 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.44 1hlq n GLY 16 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1hlq s TYR 17 N -2.75 2.81 0.04 1.61 5.04 -0.07 -4.59 117.35 119.43 1hlq s TYR 17 Ca 0.04 1.01 0.03 0.00 -2.44 0.00 0.00 57.07 55.71 1hlq s TYR 17 Cb -0.02 -3.96 -0.02 0.00 0.35 0.00 0.00 41.96 38.32 1hlq s TYR 17 CO 0.05 -3.03 -0.10 0.14 -1.34 0.00 0.00 175.55 171.27 1hlq s VAL 18 N -0.41 0.77 -1.16 3.14 -7.23 -0.09 -4.74 120.40 110.68 1hlq s VAL 18 Ca 0.58 -0.92 0.26 0.00 -1.81 0.00 0.00 61.98 60.09 1hlq s VAL 18 Cb -0.45 -0.75 0.30 0.00 0.56 0.00 0.00 36.38 36.04 1hlq s VAL 18 CO 0.51 -0.14 1.84 0.00 -0.31 0.00 0.00 175.10 177.00 1hlq n ALA 19 N 1.86 2.22 -3.64 1.32 0.00 -1.26 -1.22 120.51 119.79 1hlq n ALA 19 Ca -0.19 -0.10 -0.24 0.00 0.00 0.00 0.00 53.44 52.90 1hlq n ALA 19 Cb 0.55 -1.42 -0.17 0.00 0.00 0.00 0.00 19.45 18.41 1hlq n ALA 19 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1hlq s ASP 20 N -2.84 2.05 0.61 0.00 3.68 -1.26 -3.32 116.67 115.60 1hlq s ASP 20 Ca 0.17 -0.43 0.31 0.00 2.13 0.00 0.00 52.55 54.73 1hlq s ASP 20 Cb 0.17 -0.26 1.78 0.00 -1.45 0.00 0.00 42.92 43.16 1hlq s ASP 20 CO 0.44 -0.31 2.13 0.00 0.13 0.00 0.00 175.17 177.55 1hlq h THR 21 N 6.43 0.35 0.00 1.71 1.03 -1.08 -0.25 112.91 121.10 1hlq h THR 21 Ca -0.15 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 66.25 1hlq h THR 21 Cb 1.14 0.85 0.00 0.00 -1.07 0.00 0.00 68.15 69.07 1hlq h THR 21 CO 0.26 0.00 0.00 0.35 -0.01 0.00 0.00 175.52 176.12 1hlq n THR 22 N -3.60 0.87 -0.05 0.00 -2.24 -1.26 -0.11 114.28 107.89 1hlq n THR 22 Ca 0.00 0.27 0.11 0.00 -2.27 0.00 0.00 64.05 62.16 1hlq n THR 22 Cb 0.28 -1.19 0.25 0.00 -2.10 0.00 0.00 70.33 67.57 1hlq n THR 22 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1hlq n LYS 23 N -2.17 2.59 -1.68 -0.78 5.02 -0.10 -5.01 118.16 116.03 1hlq n LYS 23 Ca 0.02 -2.41 -0.37 0.00 -2.02 0.00 0.00 58.31 53.52 1hlq n LYS 23 Cb 0.21 -1.51 0.06 0.00 -0.02 0.00 0.00 35.03 33.77 1hlq n LYS 23 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1hlq n ALA 24 N 1.45 0.72 -2.71 7.82 0.00 0.84 -4.88 120.51 123.75 1hlq n ALA 24 Ca 0.21 0.01 -0.42 0.00 0.00 0.00 0.00 53.44 53.24 1hlq n ALA 24 Cb 0.59 -2.22 -0.03 0.00 0.00 0.00 0.00 19.45 17.78 1hlq n ALA 24 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1hlq s ASP 25 N -1.28 6.32 0.37 0.00 3.68 -1.26 -4.85 116.67 119.64 1hlq s ASP 25 Ca 0.79 -1.10 0.27 0.00 2.13 0.00 0.00 52.55 54.64 1hlq s ASP 25 Cb -0.40 -2.49 1.15 0.00 -1.45 0.00 0.00 42.92 39.72 1hlq s ASP 25 CO 0.44 -1.52 1.82 0.11 0.13 0.00 0.00 175.17 176.15 1hlq h LYS 26 N 9.64 0.00 -0.14 4.34 1.57 -1.90 -0.74 116.57 129.34 1hlq h LYS 26 Ca -0.10 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 58.52 1hlq h LYS 26 Cb 1.04 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.35 1hlq h LYS 26 CO 1.26 0.00 -0.58 1.79 -0.57 0.00 0.00 179.45 181.35 1hlq h THR 27 N 0.00 1.34 0.11 -0.16 1.35 -1.98 -2.97 112.91 110.60 1hlq h THR 27 Ca 0.00 -1.87 -0.31 0.00 -0.55 0.00 0.00 66.41 63.68 1hlq h THR 27 Cb 0.40 1.86 -0.01 0.00 -1.73 0.00 0.00 68.15 68.67 1hlq h THR 27 CO 0.00 0.57 -1.59 0.11 -0.25 0.00 0.00 175.52 174.36 1hlq h LYS 28 N 0.34 0.24 -2.66 4.72 1.57 -1.82 -3.42 116.57 115.52 1hlq h LYS 28 Ca 0.00 -0.40 -0.61 0.00 -1.87 0.00 0.00 60.65 57.77 1hlq h LYS 28 Cb 1.11 0.15 -0.41 0.00 0.08 0.00 0.00 32.23 33.15 1hlq h LYS 28 CO 0.10 1.08 -0.67 0.66 -0.57 0.00 0.00 179.45 180.05 1hlq n TYR 29 N -3.43 2.50 0.30 -1.35 4.02 -0.34 -4.95 117.16 113.90 1hlq n TYR 29 Ca -0.18 -4.07 0.16 0.00 -0.01 0.00 0.00 57.90 53.80 1hlq n TYR 29 Cb 1.04 -0.46 0.77 0.00 -0.02 0.00 0.00 39.34 40.67 1hlq n TYR 29 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 176.86 174.85 1hlq h PRO 30 N 4.99 0.00 -0.02 -0.72 0.13 -1.79 -1.81 132.00 132.78 1hlq h PRO 30 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 1hlq h PRO 30 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 1hlq h PRO 30 CO 0.68 0.00 -0.09 1.63 -0.23 0.00 0.00 178.00 179.99 1hlq n LYS 31 N -2.73 1.53 -1.72 0.86 5.02 -1.26 -4.90 118.16 114.97 1hlq n LYS 31 Ca -0.00 -0.99 -0.39 0.00 -2.02 0.00 0.00 58.31 54.91 1hlq n LYS 31 Cb 0.17 -1.48 0.04 0.00 -0.02 0.00 0.00 35.03 33.74 1hlq n LYS 31 CO 0.00 0.00 0.00 1.58 -0.52 0.00 0.00 177.40 178.46 1hlq n HIS 32 N 0.13 2.05 -4.21 2.13 -0.00 -0.68 -5.07 115.22 109.56 1hlq n HIS 32 Ca 0.16 0.45 -0.12 0.00 -0.00 0.00 0.00 57.72 58.21 1hlq n HIS 32 Cb 0.39 -2.33 -0.10 0.00 -0.00 0.00 0.00 29.99 27.95 1hlq n HIS 32 CO 0.00 0.00 0.00 0.95 -0.00 0.00 0.00 176.34 177.29 1hlq s THR 33 N -1.30 0.71 -1.07 3.57 -4.23 -1.26 -5.03 115.64 107.03 1hlq s THR 33 Ca 0.70 -1.97 0.20 0.00 -1.18 0.00 0.00 61.69 59.45 1hlq s THR 33 Cb -0.43 -1.90 0.20 0.00 1.34 0.00 0.00 72.50 71.71 1hlq s THR 33 CO 0.50 -0.68 1.65 0.29 -0.54 0.00 0.00 174.62 175.85 1hlq n LYS 34 N -0.15 0.05 0.06 3.99 5.02 -1.26 -1.71 118.16 124.16 1hlq n LYS 34 Ca -0.09 0.14 0.13 0.00 -2.02 0.00 0.00 58.31 56.46 1hlq n LYS 34 Cb 0.62 -1.50 0.48 0.00 -0.02 0.00 0.00 35.03 34.61 1hlq n LYS 34 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1hlq n ASP 35 N -1.46 0.41 -4.66 4.39 10.43 -1.26 -4.72 116.55 119.67 1hlq n ASP 35 Ca 0.06 0.55 -0.38 0.00 2.57 0.00 0.00 54.79 57.59 1hlq n ASP 35 Cb 0.22 -0.66 -0.08 0.00 1.84 0.00 0.00 41.12 42.45 1hlq n ASP 35 CO 0.00 0.00 0.00 -1.10 -1.07 0.00 0.00 177.20 175.03 1hlq s GLN 36 N -3.08 4.13 0.21 -1.24 -0.21 -0.69 -4.90 119.66 113.88 1hlq s GLN 36 Ca 0.11 0.05 -0.18 0.00 0.02 0.00 0.00 55.36 55.36 1hlq s GLN 36 Cb 0.14 -3.55 0.03 0.00 1.00 0.00 0.00 33.01 30.63 1hlq s GLN 36 CO 0.51 -0.03 0.55 -1.54 -2.12 0.00 0.00 175.29 172.65 1hlq s SER 37 N 1.10 -0.26 0.38 5.90 1.04 -1.26 -4.83 113.70 115.78 1hlq s SER 37 Ca 0.15 -0.52 0.13 0.00 0.48 0.00 0.00 55.95 56.19 1hlq s SER 37 Cb -0.14 0.60 0.96 0.00 0.10 0.00 0.00 66.02 67.53 1hlq s SER 37 CO 0.07 -1.10 1.83 0.00 0.98 0.00 0.00 173.24 175.02 1hlq h SER 39 N 0.54 0.06 -0.37 0.00 4.64 -1.42 -1.21 113.55 115.79 1hlq h SER 39 Ca 0.51 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.83 1hlq h SER 39 Cb 1.07 -0.01 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1hlq h SER 39 CO -0.24 0.03 0.00 0.35 -0.87 0.00 0.00 176.83 176.09 1hlq n THR 40 N -4.34 1.11 -3.15 2.95 -2.24 -0.01 -5.00 114.28 103.60 1hlq n THR 40 Ca 0.16 -1.07 -0.39 0.00 -2.27 0.00 0.00 64.05 60.48 1hlq n THR 40 Cb 0.80 0.44 -0.06 0.00 -2.10 0.00 0.00 70.33 69.41 1hlq n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hlq h ALA 42 N 4.53 1.00 0.00 0.00 0.00 -0.80 -2.61 119.26 121.39 1hlq h ALA 42 Ca -0.48 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.43 1hlq h ALA 42 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1hlq h ALA 42 CO 0.65 0.00 -1.26 1.28 0.00 0.00 0.00 179.25 179.92 1hlq n LEU 43 N -2.44 0.56 -4.76 0.00 4.77 -1.26 -4.96 117.00 108.91 1hlq n LEU 43 Ca 0.01 0.13 -0.41 0.00 -0.03 0.00 0.00 56.01 55.70 1hlq n LEU 43 Cb 0.20 -0.06 -0.02 0.00 -2.33 0.00 0.00 43.42 41.22 1hlq n LEU 43 CO 0.19 -0.06 1.11 -0.47 -1.33 0.00 0.00 177.39 176.83 1hlq s TYR 44 N -3.34 2.87 -1.84 -1.77 5.04 -0.99 -4.32 117.35 113.00 1hlq s TYR 44 Ca -0.01 1.10 0.18 0.00 -2.44 0.00 0.00 57.07 55.90 1hlq s TYR 44 Cb 0.12 -3.88 0.36 0.00 0.35 0.00 0.00 41.96 38.91 1hlq s TYR 44 CO 0.82 -2.74 1.28 1.04 -1.34 0.00 0.00 175.55 174.62 1hlq n GLN 45 N 1.53 2.29 -0.08 4.97 6.02 0.77 -4.56 117.38 128.31 1hlq n GLN 45 Ca 0.04 -2.08 0.11 0.00 -0.01 0.00 0.00 57.00 55.06 1hlq n GLN 45 Cb 0.40 -1.41 0.37 0.00 1.02 0.00 0.00 30.24 30.62 1hlq n GLN 45 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1hlq n GLY 46 N 1.12 0.39 7.00 1.08 0.00 -1.26 -4.64 105.19 108.89 1hlq n GLY 46 Ca 0.16 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1hlq n GLY 46 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1hlq n LYS 47 N 0.42 0.00 -0.10 1.61 5.02 -1.26 -0.95 118.16 122.90 1hlq n LYS 47 Ca 0.16 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.56 1hlq n LYS 47 Cb 0.36 0.00 0.34 0.00 -0.02 0.00 0.00 35.03 35.70 1hlq n LYS 47 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1hlq n THR 48 N 0.00 0.26 -2.53 -0.18 -2.24 -1.26 -4.93 114.28 103.40 1hlq n THR 48 Ca 0.00 -0.42 -0.34 0.00 -2.27 0.00 0.00 64.05 61.02 1hlq n THR 48 Cb 0.00 0.49 -0.04 0.00 -2.10 0.00 0.00 70.33 68.68 1hlq n THR 48 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1hlq s ALA 49 N -1.74 2.89 -1.04 6.98 0.00 -0.12 -4.95 121.76 123.79 1hlq s ALA 49 Ca 0.33 0.55 0.19 0.00 0.00 0.00 0.00 51.96 53.03 1hlq s ALA 49 Cb 0.18 -3.23 0.82 0.00 0.00 0.00 0.00 23.12 20.88 1hlq s ALA 49 CO 0.27 -0.29 1.60 -0.35 0.00 0.00 0.00 175.76 176.99 1hlq n PRO 50 N -1.03 0.02 -3.85 0.00 -0.04 -1.26 -4.61 135.00 124.23 1hlq n PRO 50 Ca 0.09 0.17 -0.11 0.00 -0.04 0.00 0.00 63.50 63.61 1hlq n PRO 50 Cb 0.53 -1.50 -0.09 0.00 -0.04 0.00 0.00 33.50 32.40 1hlq n PRO 50 CO 0.00 0.00 0.00 1.14 -0.04 0.00 0.00 175.50 176.60 1hlq s GLN 51 N -2.96 0.61 -0.04 0.54 -2.07 -1.26 -0.62 119.66 113.85 1hlq s GLN 51 Ca 0.10 -0.51 -0.30 0.00 -1.82 0.00 0.00 55.36 52.83 1hlq s GLN 51 Cb 0.12 0.26 0.12 0.00 -1.09 0.00 0.00 33.01 32.41 1hlq s GLN 51 CO 0.34 -0.17 1.33 0.20 -1.32 0.00 0.00 175.29 175.67 1hlq s GLY 52 N -1.76 -0.31 0.52 2.60 0.00 -0.55 -4.71 107.32 103.11 1hlq s GLY 52 Ca -0.09 0.45 -0.15 0.00 0.00 0.00 0.00 44.72 44.93 1hlq s GLY 52 CO -0.01 2.87 0.96 0.00 0.00 0.00 0.00 173.10 176.92 1hlq s ALA 53 N -2.15 3.11 -0.02 3.20 0.00 -1.26 -0.26 121.76 124.39 1hlq s ALA 53 Ca 0.22 0.07 0.01 0.00 0.00 0.00 0.00 51.96 52.26 1hlq s ALA 53 Cb 0.03 -3.05 0.01 0.00 0.00 0.00 0.00 23.12 20.11 1hlq s ALA 53 CO -0.03 -0.29 -0.04 0.00 0.00 0.00 0.00 175.76 175.40 1hlq h PRO 55 N 6.71 0.00 0.00 0.00 0.13 -1.99 -2.19 132.00 134.65 1hlq h PRO 55 Ca -0.35 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.78 1hlq h PRO 55 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1hlq h PRO 55 CO 0.49 0.00 -0.42 1.28 -0.23 0.00 0.00 178.00 179.12 1hlq n LEU 56 N -2.44 0.47 -3.86 1.56 4.77 -1.26 -4.67 117.00 111.57 1hlq n LEU 56 Ca 0.00 0.18 -0.29 0.00 -0.03 0.00 0.00 56.01 55.88 1hlq n LEU 56 Cb 0.16 -0.28 -0.13 0.00 -2.33 0.00 0.00 43.42 40.84 1hlq n LEU 56 CO 0.18 0.04 -0.15 -0.36 -1.33 0.00 0.00 177.39 175.76 1hlq s PHE 57 N -3.05 2.97 0.28 -1.77 0.40 -0.83 -5.03 117.98 110.95 1hlq s PHE 57 Ca 0.10 -3.05 -0.30 0.00 -0.60 0.00 0.00 56.93 53.08 1hlq s PHE 57 Cb 0.16 -2.51 -0.11 0.00 0.51 0.00 0.00 43.02 41.07 1hlq s PHE 57 CO 0.67 -0.69 1.60 0.00 0.70 0.00 0.00 175.22 177.49 1hlq s ALA 58 N -0.53 3.76 -0.22 5.36 0.00 -1.26 -3.25 121.76 125.61 1hlq s ALA 58 Ca 0.20 1.55 0.00 0.00 0.00 0.00 0.00 51.96 53.71 1hlq s ALA 58 Cb -0.17 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.30 1hlq s ALA 58 CO -0.06 -0.95 0.00 0.41 0.00 0.00 0.00 175.76 175.16 1hlq n GLY 59 N 2.42 0.32 3.38 0.00 0.00 -1.26 -4.95 105.19 105.09 1hlq n GLY 59 Ca 0.09 -0.04 -0.19 0.00 0.00 0.00 0.00 46.02 45.89 1hlq n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1hlq s LYS 60 N -1.75 1.52 0.17 1.61 -0.14 -1.20 -4.50 119.74 115.45 1hlq s LYS 60 Ca 0.00 -1.83 0.10 0.00 -1.36 0.00 0.00 55.97 52.88 1hlq s LYS 60 Cb 0.00 -0.54 -0.04 0.00 -1.68 0.00 0.00 37.83 35.57 1hlq s LYS 60 CO 0.00 -0.24 -0.21 -1.21 -0.76 0.00 0.00 175.35 172.92 1hlq s GLU 61 N -3.97 1.37 0.28 1.68 2.02 0.43 -4.60 118.70 115.92 1hlq s GLU 61 Ca 0.37 -1.43 0.09 0.00 0.02 0.00 0.00 54.97 54.02 1hlq s GLU 61 Cb 0.08 -1.58 -0.04 0.00 0.10 0.00 0.00 34.13 32.69 1hlq s GLU 61 CO 0.14 0.34 0.08 0.14 0.02 0.00 0.00 175.26 175.98 1hlq s VAL 62 N -1.74 3.51 -0.03 2.63 -7.23 0.65 -0.70 120.40 117.48 1hlq s VAL 62 Ca 0.17 -1.75 -0.13 0.00 -1.81 0.00 0.00 61.98 58.45 1hlq s VAL 62 Cb -0.07 -2.99 -0.05 0.00 0.56 0.00 0.00 36.38 33.83 1hlq s VAL 62 CO 0.08 -0.31 0.35 -0.69 -0.31 0.00 0.00 175.10 174.22 1hlq s VAL 63 N -2.32 5.14 0.46 1.32 1.01 -1.26 -1.48 120.40 123.26 1hlq s VAL 63 Ca 0.34 0.71 0.17 0.00 0.00 0.00 0.00 61.98 63.19 1hlq s VAL 63 Cb -0.06 -3.65 0.34 0.00 0.00 0.00 0.00 36.38 33.02 1hlq s VAL 63 CO 0.22 0.57 1.98 0.00 0.00 0.00 0.00 175.10 177.87 1hlq h ALA 64 N 4.91 2.14 -0.00 5.51 0.00 -1.12 -0.05 119.26 130.65 1hlq h ALA 64 Ca -0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.38 1hlq h ALA 64 Cb 1.22 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.96 1hlq h ALA 64 CO 0.62 -0.27 -0.02 0.36 0.00 0.00 0.00 179.25 179.94 1hlq n LYS 65 N -4.45 0.62 -1.33 0.00 2.85 -1.26 -1.15 118.16 113.43 1hlq n LYS 65 Ca 0.10 -0.04 -0.19 0.00 -1.05 0.00 0.00 58.31 57.13 1hlq n LYS 65 Cb 0.43 -1.50 0.13 0.00 -0.65 0.00 0.00 35.03 33.44 1hlq n LYS 65 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1hlq n GLY 66 N 1.21 -1.14 3.53 2.58 0.00 -0.03 -0.63 105.19 110.72 1hlq n GLY 66 Ca 0.17 -1.73 -0.12 0.00 0.00 0.00 0.00 46.02 44.33 1hlq n GLY 66 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1hlq s TRP 67 N -2.81 -0.46 0.18 1.61 -0.00 -0.36 -0.96 118.94 116.14 1hlq s TRP 67 Ca 0.49 0.63 -0.06 0.00 -0.00 0.00 0.00 56.10 57.16 1hlq s TRP 67 Cb -0.01 0.47 -0.02 0.00 -0.00 0.00 0.00 33.47 33.91 1hlq s TRP 67 CO 0.34 -0.51 0.24 0.00 -0.00 0.00 0.00 176.95 177.02 1hlq h SER 69 N 2.58 0.00 -0.16 0.00 4.64 -0.65 -1.30 113.55 118.66 1hlq h SER 69 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1hlq h SER 69 Cb 1.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.32 1hlq h SER 69 CO 0.49 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.45 1hlq n ALA 70 N -1.86 2.52 -1.62 5.18 0.00 -1.26 -4.94 120.51 118.53 1hlq n ALA 70 Ca -0.00 -0.42 -0.59 0.00 0.00 0.00 0.00 53.44 52.42 1hlq n ALA 70 Cb 0.13 -1.10 -0.08 0.00 0.00 0.00 0.00 19.45 18.41 1hlq n ALA 70 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1hlq n TRP 71 N 0.09 1.37 -4.04 0.00 -0.00 -0.49 -4.89 117.44 109.47 1hlq n TRP 71 Ca 0.13 0.90 -0.32 0.00 -0.00 0.00 0.00 57.50 58.21 1hlq n TRP 71 Cb 0.24 -2.24 -0.15 0.00 -0.00 0.00 0.00 31.31 29.16 1hlq n TRP 71 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 177.69 177.69 1hlq s ALA 72 N 1.48 2.70 0.25 5.87 0.00 -1.26 -5.02 121.76 125.78 1hlq s ALA 72 Ca 0.94 -2.01 -0.31 0.00 0.00 0.00 0.00 51.96 50.58 1hlq s ALA 72 Cb -1.22 -1.74 -0.13 0.00 0.00 0.00 0.00 23.12 20.02 1hlq s ALA 72 CO 0.63 -1.36 1.38 1.17 0.00 0.00 0.00 175.76 177.57 1hlq n LYS 73 N 4.39 2.00 -2.22 0.00 4.81 -1.26 -0.12 118.16 125.77 1hlq n LYS 73 Ca -0.08 0.71 -0.34 0.00 -0.87 0.00 0.00 58.31 57.73 1hlq n LYS 73 Cb 0.42 -2.35 -0.00 0.00 0.02 0.00 0.00 35.03 33.12 1hlq n LYS 73 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 1hlq s LYS 74 N -0.55 3.42 0.00 1.64 1.02 -1.26 -4.69 119.74 119.32 1hlq s LYS 74 Ca 0.67 1.37 0.18 0.00 0.02 0.00 0.00 55.97 58.21 1hlq s LYS 74 Cb -0.65 -2.04 1.05 0.00 -0.52 0.00 0.00 37.83 35.67 1hlq s LYS 74 CO 0.51 -0.75 1.45 0.00 -0.92 0.00 0.00 175.35 175.64