#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hrj s PRO 2 N 0.00 -2.81 -0.15 4.33 0.04 -1.26 -4.96 135.00 130.19 1hrj s PRO 2 Ca 0.00 0.16 -0.19 0.00 0.04 0.00 0.00 61.00 61.00 1hrj s PRO 2 Cb 0.00 -1.39 -0.04 0.00 0.04 0.00 0.00 34.50 33.11 1hrj s PRO 2 CO 0.00 -4.80 0.54 0.71 0.04 0.00 0.00 177.00 173.49 1hrj s TYR 3 N -2.31 3.46 -0.41 0.56 2.02 -1.26 -5.04 117.35 114.37 1hrj s TYR 3 Ca 0.69 0.90 -0.09 0.00 -0.37 0.00 0.00 57.07 58.20 1hrj s TYR 3 Cb -0.13 -2.65 0.07 0.00 -0.40 0.00 0.00 41.96 38.84 1hrj s TYR 3 CO 0.58 0.03 0.24 0.45 -1.57 0.00 0.00 175.55 175.28 1hrj s SER 4 N 0.89 5.62 -0.87 2.29 0.15 -1.26 -5.00 113.70 115.52 1hrj s SER 4 Ca 0.27 -1.44 0.00 0.00 0.70 0.00 0.00 55.95 55.48 1hrj s SER 4 Cb -0.16 -1.98 0.26 0.00 -1.71 0.00 0.00 66.02 62.43 1hrj s SER 4 CO 0.11 -0.51 0.98 -1.54 1.20 0.00 0.00 173.24 173.48 1hrj n SER 5 N 4.91 4.72 0.00 5.45 3.41 -1.26 -4.97 113.62 125.87 1hrj n SER 5 Ca -0.10 -3.32 0.00 0.00 -0.26 0.00 0.00 58.87 55.19 1hrj n SER 5 Cb 0.43 -0.99 0.00 0.00 -0.26 0.00 0.00 64.21 63.39 1hrj n SER 5 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 1hrj n ASP 6 N 1.53 0.00 -4.43 4.04 5.75 -1.26 -5.16 116.55 117.02 1hrj n ASP 6 Ca 0.26 0.00 -0.29 0.00 -0.01 0.00 0.00 54.79 54.74 1hrj n ASP 6 Cb 0.37 0.00 0.16 0.00 -1.03 0.00 0.00 41.12 40.62 1hrj n ASP 6 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1hrj s THR 7 N -1.22 1.95 -0.24 2.12 -1.32 -1.26 -5.08 115.64 110.59 1hrj s THR 7 Ca 0.00 0.00 -0.03 0.00 -1.21 0.00 0.00 61.69 60.45 1hrj s THR 7 Cb 0.00 -2.88 0.13 0.00 -1.51 0.00 0.00 72.50 68.24 1hrj s THR 7 CO 0.00 0.00 0.40 -0.89 -2.21 0.00 0.00 174.62 171.92 1hrj s THR 8 N -3.57 -0.63 -0.48 5.08 2.01 -1.26 -5.09 115.64 111.70 1hrj s THR 8 Ca 0.68 -0.02 -0.26 0.00 0.31 0.00 0.00 61.69 62.40 1hrj s THR 8 Cb -0.09 -0.80 -0.06 0.00 0.01 0.00 0.00 72.50 71.56 1hrj s THR 8 CO 0.52 -0.08 2.36 -2.16 -0.69 0.00 0.00 174.62 174.57 1hrj s PRO 9 N 2.57 2.20 0.07 4.92 0.04 -1.26 -4.91 135.00 138.63 1hrj s PRO 9 Ca 0.11 1.40 -0.08 0.00 0.04 0.00 0.00 61.00 62.47 1hrj s PRO 9 Cb -0.15 -4.56 -0.01 0.00 0.04 0.00 0.00 34.50 29.83 1hrj s PRO 9 CO -0.16 -3.17 0.16 0.00 0.04 0.00 0.00 177.00 173.88 1hrj n PHE 12 N -1.94 0.00 -4.30 0.00 7.35 -1.26 -4.69 117.46 112.62 1hrj n PHE 12 Ca 0.03 0.00 -0.26 0.00 -0.76 0.00 0.00 57.45 56.46 1hrj n PHE 12 Cb 0.58 -0.11 -0.09 0.00 0.35 0.00 0.00 39.48 40.22 1hrj n PHE 12 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1hrj s ALA 13 N -2.60 2.96 -0.09 3.13 0.00 -1.26 -4.97 121.76 118.92 1hrj s ALA 13 Ca -0.06 -1.50 -0.05 0.00 0.00 0.00 0.00 51.96 50.35 1hrj s ALA 13 Cb 0.01 -0.72 -0.04 0.00 0.00 0.00 0.00 23.12 22.37 1hrj s ALA 13 CO 0.09 0.44 0.10 0.71 0.00 0.00 0.00 175.76 177.11 1hrj s TYR 14 N -1.78 3.46 -0.17 0.00 2.02 -1.26 -4.60 117.35 115.02 1hrj s TYR 14 Ca 0.25 0.40 -0.29 0.00 -0.37 0.00 0.00 57.07 57.06 1hrj s TYR 14 Cb -0.08 -1.87 -0.01 0.00 -0.40 0.00 0.00 41.96 39.60 1hrj s TYR 14 CO 0.16 0.65 1.14 -1.50 -1.57 0.00 0.00 175.55 174.42 1hrj s ILE 15 N -1.04 4.49 -1.14 2.71 2.07 -1.23 -4.90 121.20 122.16 1hrj s ILE 15 Ca 0.16 1.80 -0.21 0.00 -1.41 0.00 0.00 60.65 60.99 1hrj s ILE 15 Cb -0.12 -4.16 0.02 0.00 0.13 0.00 0.00 42.46 38.33 1hrj s ILE 15 CO 0.06 -0.12 1.72 0.00 -1.91 0.00 0.00 174.94 174.69 1hrj s ALA 16 N 3.08 2.63 0.00 1.50 0.00 -1.26 -4.69 121.76 123.02 1hrj s ALA 16 Ca 0.50 -2.39 0.00 0.00 0.00 0.00 0.00 51.96 50.06 1hrj s ALA 16 Cb -0.19 -4.61 0.00 0.00 0.00 0.00 0.00 23.12 18.32 1hrj s ALA 16 CO 0.12 -3.97 0.00 0.54 0.00 0.00 0.00 175.76 172.45 1hrj n ARG 17 N 8.58 0.00 -1.53 0.00 5.12 -1.26 -5.08 116.66 122.49 1hrj n ARG 17 Ca 0.42 0.00 -0.39 0.00 -1.93 0.00 0.00 57.85 55.96 1hrj n ARG 17 Cb 0.48 0.00 -0.06 0.00 -1.16 0.00 0.00 32.46 31.71 1hrj n ARG 17 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 1hrj n PRO 18 N 0.00 0.81 -1.47 5.56 -0.01 -1.26 -4.86 135.00 133.77 1hrj n PRO 18 Ca 0.00 0.04 -0.40 0.00 -0.01 0.00 0.00 63.50 63.12 1hrj n PRO 18 Cb 0.00 -2.87 0.02 0.00 -0.01 0.00 0.00 33.50 30.64 1hrj n PRO 18 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 175.50 176.77 1hrj n LEU 19 N 13.95 0.42 -4.68 2.45 4.77 -1.26 -4.81 117.00 127.84 1hrj n LEU 19 Ca 0.45 0.86 -0.42 0.00 -0.03 0.00 0.00 56.01 56.86 1hrj n LEU 19 Cb 0.39 -1.15 -0.03 0.00 -2.33 0.00 0.00 43.42 40.30 1hrj n LEU 19 CO 0.77 -2.85 1.44 -2.84 -1.33 0.00 0.00 177.39 172.58 1hrj s PRO 20 N -1.78 4.16 0.56 3.23 0.02 -1.26 -4.85 135.00 135.08 1hrj s PRO 20 Ca 0.65 2.45 0.37 0.00 0.02 0.00 0.00 61.00 64.49 1hrj s PRO 20 Cb -0.54 -3.81 1.90 0.00 0.02 0.00 0.00 34.50 32.07 1hrj s PRO 20 CO 0.57 -0.84 2.12 -0.09 -0.33 0.00 0.00 177.00 178.43 1hrj h ARG 21 N 9.19 0.00 0.00 5.54 2.43 -1.93 -0.97 114.38 128.64 1hrj h ARG 21 Ca -0.45 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 58.67 1hrj h ARG 21 Cb 1.21 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.75 1hrj h ARG 21 CO 0.94 0.00 -1.10 0.00 -1.51 0.00 0.00 179.97 178.30 1hrj h ALA 22 N 2.02 0.55 0.00 2.80 0.00 -2.01 -3.33 119.26 119.29 1hrj h ALA 22 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1hrj h ALA 22 Cb 0.13 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.00 1hrj h ALA 22 CO 0.00 0.26 -1.06 0.72 0.00 0.00 0.00 179.25 179.17 1hrj n HIS 23 N -2.75 0.47 -2.51 0.00 8.25 -0.46 -4.91 115.22 113.31 1hrj n HIS 23 Ca -0.03 0.14 -0.27 0.00 -0.26 0.00 0.00 57.72 57.30 1hrj n HIS 23 Cb 0.63 -0.62 0.01 0.00 1.12 0.00 0.00 29.99 31.14 1hrj n HIS 23 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1hrj s ILE 24 N -3.27 4.46 0.00 1.59 1.01 -0.65 -1.65 121.20 122.70 1hrj s ILE 24 Ca 0.02 0.16 0.00 0.00 0.00 0.00 0.00 60.65 60.83 1hrj s ILE 24 Cb 0.13 -3.72 0.00 0.00 0.01 0.00 0.00 42.46 38.88 1hrj s ILE 24 CO 0.80 -0.73 0.00 1.17 0.00 0.00 0.00 174.94 176.18 1hrj n LYS 25 N -2.40 0.00 0.00 2.79 4.81 -1.03 -4.76 118.16 117.57 1hrj n LYS 25 Ca 0.02 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.46 1hrj n LYS 25 Cb 0.56 -0.21 0.00 0.00 0.02 0.00 0.00 35.03 35.40 1hrj n LYS 25 CO 0.00 0.00 0.00 -1.91 1.17 0.00 0.00 177.40 176.66 1hrj n GLU 26 N -2.30 2.89 -3.83 1.64 2.13 -1.20 -4.95 120.64 115.01 1hrj n GLU 26 Ca 0.00 0.00 -0.07 0.00 0.66 0.00 0.00 57.16 57.75 1hrj n GLU 26 Cb 0.00 0.00 0.02 0.00 0.27 0.00 0.00 31.44 31.73 1hrj n GLU 26 CO 0.00 0.00 0.00 1.52 -0.41 0.00 0.00 177.13 178.24 1hrj s TYR 27 N 2.50 0.09 -0.39 4.31 1.13 -1.26 -3.09 117.35 120.63 1hrj s TYR 27 Ca 0.00 -0.67 0.07 0.00 -1.41 0.00 0.00 57.07 55.06 1hrj s TYR 27 Cb 0.00 0.79 0.18 0.00 -1.10 0.00 0.00 41.96 41.83 1hrj s TYR 27 CO 0.00 -1.35 0.61 0.12 -2.51 0.00 0.00 175.55 172.42 1hrj s PHE 28 N -2.34 -1.69 0.19 -3.49 5.36 0.48 -4.78 117.98 111.71 1hrj s PHE 28 Ca 0.17 0.33 -0.33 0.00 -0.96 0.00 0.00 56.93 56.14 1hrj s PHE 28 Cb -0.04 0.29 -0.13 0.00 -0.34 0.00 0.00 43.02 42.79 1hrj s PHE 28 CO 0.09 -1.16 1.63 0.98 -1.46 0.00 0.00 175.22 175.30 1hrj n TYR 29 N 4.56 2.49 -0.53 10.12 9.36 -1.26 -0.98 117.16 140.91 1hrj n TYR 29 Ca 0.10 0.19 -0.29 0.00 3.32 0.00 0.00 57.90 61.22 1hrj n TYR 29 Cb 0.56 -2.59 0.22 0.00 -0.63 0.00 0.00 39.34 36.89 1hrj n TYR 29 CO 0.00 0.00 0.00 2.41 0.22 0.00 0.00 176.86 179.49 1hrj n THR 30 N 3.48 0.00 -0.71 2.97 -1.04 -0.87 -4.89 114.28 113.22 1hrj n THR 30 Ca 0.16 -0.30 0.00 0.00 -2.04 0.00 0.00 64.05 61.86 1hrj n THR 30 Cb 0.32 -0.76 0.00 0.00 -1.82 0.00 0.00 70.33 68.06 1hrj n THR 30 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1hrj n SER 31 N -3.20 0.00 -0.52 8.00 2.88 -1.26 -4.91 113.62 114.61 1hrj n SER 31 Ca 0.03 0.00 0.08 0.00 -1.33 0.00 0.00 58.87 57.65 1hrj n SER 31 Cb 0.57 0.00 0.20 0.00 -0.75 0.00 0.00 64.21 64.22 1hrj n SER 31 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1hrj n GLY 32 N 5.00 4.57 2.39 0.46 0.00 -1.26 -4.76 105.19 111.60 1hrj n GLY 32 Ca 0.00 -1.12 -0.25 0.00 0.00 0.00 0.00 46.02 44.65 1hrj n GLY 32 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1hrj n LYS 33 N -1.03 1.87 -3.81 1.61 5.02 -1.26 -5.07 118.16 115.49 1hrj n LYS 33 Ca 0.20 -4.09 -0.05 0.00 -2.02 0.00 0.00 58.31 52.35 1hrj n LYS 33 Cb 0.78 -1.85 -0.00 0.00 -0.02 0.00 0.00 35.03 33.93 1hrj n LYS 33 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1hrj n SER 35 N -0.81 3.66 -3.19 0.00 2.88 -1.26 -4.65 113.62 110.24 1hrj n SER 35 Ca -0.05 -2.73 -0.19 0.00 -1.33 0.00 0.00 58.87 54.57 1hrj n SER 35 Cb 0.60 -0.46 -0.04 0.00 -0.75 0.00 0.00 64.21 63.56 1hrj n SER 35 CO 0.00 0.00 0.00 -3.20 -1.23 0.00 0.00 175.04 170.61 1hrj n ASN 36 N -0.19 0.77 -4.70 -3.46 2.85 -1.26 -5.11 115.26 104.16 1hrj n ASN 36 Ca 0.19 -2.97 -0.43 0.00 -0.11 0.00 0.00 54.58 51.26 1hrj n ASN 36 Cb 0.77 -0.62 -0.01 0.00 1.24 0.00 0.00 39.78 41.15 1hrj n ASN 36 CO 0.00 0.00 0.00 -2.65 -2.11 0.00 0.00 177.26 172.50 1hrj n PRO 37 N 0.45 2.23 0.00 1.20 -0.02 -1.26 -4.35 135.00 133.25 1hrj n PRO 37 Ca 0.24 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.51 1hrj n PRO 37 Cb 0.64 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 1hrj n PRO 37 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1hrj n ALA 38 N 1.14 0.00 -2.78 3.55 0.00 -1.26 -4.38 120.51 116.79 1hrj n ALA 38 Ca 0.07 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.42 1hrj n ALA 38 Cb 0.35 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.70 1hrj n ALA 38 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1hrj s VAL 39 N -1.11 0.13 -0.17 0.00 0.11 -1.26 -2.05 120.40 116.06 1hrj s VAL 39 Ca 0.00 -1.07 -0.00 0.00 -2.93 0.00 0.00 61.98 57.98 1hrj s VAL 39 Cb 0.00 -0.68 0.04 0.00 -1.53 0.00 0.00 36.38 34.20 1hrj s VAL 39 CO 0.00 -0.59 -0.07 -0.69 -3.33 0.00 0.00 175.10 170.42 1hrj s VAL 40 N -2.20 1.25 0.14 2.04 1.01 -0.15 -2.80 120.40 119.69 1hrj s VAL 40 Ca -0.09 -0.69 -0.26 0.00 0.00 0.00 0.00 61.98 60.94 1hrj s VAL 40 Cb -0.04 -1.38 -0.07 0.00 0.00 0.00 0.00 36.38 34.89 1hrj s VAL 40 CO -0.03 0.18 0.82 -0.36 0.00 0.00 0.00 175.10 175.70 1hrj s PHE 41 N 1.58 3.87 -0.92 5.22 0.08 0.22 0.18 117.98 128.21 1hrj s PHE 41 Ca 0.01 1.65 -0.01 0.00 0.12 0.00 0.00 56.93 58.70 1hrj s PHE 41 Cb -0.15 -2.84 0.27 0.00 -0.57 0.00 0.00 43.02 39.73 1hrj s PHE 41 CO -0.08 0.42 1.11 1.33 -0.10 0.00 0.00 175.22 177.90 1hrj n VAL 42 N 2.00 3.98 -0.04 -0.44 0.24 -1.18 -0.62 118.33 122.27 1hrj n VAL 42 Ca -0.03 -5.53 0.00 0.00 -2.04 0.00 0.00 64.34 56.73 1hrj n VAL 42 Cb 0.49 -2.18 0.00 0.00 -1.47 0.00 0.00 33.84 30.68 1hrj n VAL 42 CO 0.00 0.00 0.00 0.35 -2.14 0.00 0.00 176.83 175.04 1hrj n THR 43 N 1.47 0.00 -0.04 3.34 -2.24 -1.26 -2.48 114.28 113.07 1hrj n THR 43 Ca 0.26 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.92 1hrj n THR 43 Cb 0.36 -0.42 -0.08 0.00 -2.10 0.00 0.00 70.33 68.09 1hrj n THR 43 CO 0.00 0.00 0.00 0.08 -0.57 0.00 0.00 175.07 174.58 1hrj h ARG 44 N 0.00 -0.40 -0.61 -0.78 0.11 -1.61 1.23 114.38 112.32 1hrj h ARG 44 Ca 0.00 0.03 0.14 0.00 0.10 0.00 0.00 59.98 60.25 1hrj h ARG 44 Cb 0.00 0.09 -0.03 0.00 1.11 0.00 0.00 29.97 31.14 1hrj h ARG 44 CO 0.00 -0.27 0.42 0.87 0.10 0.00 0.00 179.97 181.09 1hrj h LYS 45 N -0.42 0.19 -0.07 0.08 1.57 -1.89 -3.44 116.57 112.58 1hrj h LYS 45 Ca 0.04 -0.01 -0.03 0.00 -1.87 0.00 0.00 60.65 58.77 1hrj h LYS 45 Cb 0.52 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.78 1hrj h LYS 45 CO -0.39 0.12 -0.03 -1.71 -0.57 0.00 0.00 179.45 176.88 1hrj n ASN 46 N -4.42 -3.92 -4.50 0.86 5.15 0.42 -5.00 115.26 103.85 1hrj n ASN 46 Ca 0.11 0.04 -0.30 0.00 -0.60 0.00 0.00 54.58 53.83 1hrj n ASN 46 Cb 0.55 -1.56 0.23 0.00 -0.53 0.00 0.00 39.78 38.46 1hrj n ASN 46 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1hrj n ARG 47 N -1.97 -1.86 -2.69 1.20 0.63 -1.26 -4.57 116.66 106.14 1hrj n ARG 47 Ca -0.02 -0.50 -0.43 0.00 -0.92 0.00 0.00 57.85 55.98 1hrj n ARG 47 Cb 0.17 -2.16 0.00 0.00 0.45 0.00 0.00 32.46 30.93 1hrj n ARG 47 CO 0.00 0.00 0.00 1.04 -2.51 0.00 0.00 177.63 176.16 1hrj n GLN 48 N -4.41 3.44 -1.06 -0.14 6.02 -1.26 -4.14 117.38 115.83 1hrj n GLN 48 Ca 0.05 -3.68 -0.32 0.00 -0.01 0.00 0.00 57.00 53.04 1hrj n GLN 48 Cb 0.54 -3.03 0.13 0.00 1.02 0.00 0.00 30.24 28.90 1hrj n GLN 48 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 1hrj s VAL 49 N 1.32 2.47 0.40 5.09 1.01 0.20 -4.76 120.40 126.13 1hrj s VAL 49 Ca 0.42 0.17 0.08 0.00 0.00 0.00 0.00 61.98 62.65 1hrj s VAL 49 Cb 0.02 -2.46 -0.04 0.00 0.00 0.00 0.00 36.38 33.90 1hrj s VAL 49 CO 0.01 -0.18 0.23 0.00 0.00 0.00 0.00 175.10 175.16 1hrj n ALA 51 N -1.31 1.38 -1.25 0.00 0.00 -1.12 -3.55 120.51 114.65 1hrj n ALA 51 Ca -0.00 -0.20 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1hrj n ALA 51 Cb 0.63 -0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.93 1hrj n ALA 51 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1hrj n ASN 52 N 0.00 -6.92 -0.03 0.00 2.85 -1.26 -4.70 115.26 105.20 1hrj n ASN 52 Ca -0.08 1.09 -0.00 0.00 -0.11 0.00 0.00 54.58 55.48 1hrj n ASN 52 Cb 0.40 -3.62 -0.00 0.00 1.24 0.00 0.00 39.78 37.80 1hrj n ASN 52 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1hrj h PRO 53 N 1.04 0.00 -1.85 1.20 0.13 -1.82 -3.38 132.00 127.33 1hrj h PRO 53 Ca 0.00 0.00 -0.26 0.00 -0.87 0.00 0.00 66.00 64.87 1hrj h PRO 53 Cb 0.17 0.00 -0.10 0.00 0.13 0.00 0.00 31.00 31.20 1hrj h PRO 53 CO 0.00 0.00 0.14 -1.91 -0.23 0.00 0.00 178.00 176.00 1hrj n GLU 54 N -3.72 1.80 -0.58 0.86 0.00 -1.26 -4.35 120.64 113.40 1hrj n GLU 54 Ca -0.00 -1.26 0.06 0.00 0.00 0.00 0.00 57.16 55.95 1hrj n GLU 54 Cb 0.00 -1.68 0.28 0.00 0.00 0.00 0.00 31.44 30.05 1hrj n GLU 54 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1hrj n LYS 55 N 1.21 3.52 0.00 5.31 5.02 -1.26 -4.97 118.16 126.99 1hrj n LYS 55 Ca 0.30 -2.19 0.00 0.00 -2.02 0.00 0.00 58.31 54.40 1hrj n LYS 55 Cb 0.63 -1.94 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 1hrj n LYS 55 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1hrj n LYS 56 N 0.55 0.00 -0.03 1.97 5.02 -1.26 -3.79 118.16 120.62 1hrj n LYS 56 Ca 0.19 0.00 0.23 0.00 -2.02 0.00 0.00 58.31 56.72 1hrj n LYS 56 Cb 0.84 0.00 0.59 0.00 -0.02 0.00 0.00 35.03 36.45 1hrj n LYS 56 CO 0.00 0.00 0.00 0.11 -0.52 0.00 0.00 177.40 176.99 1hrj h TRP 57 N 0.00 0.00 -0.18 2.13 5.08 -1.94 0.12 115.95 121.17 1hrj h TRP 57 Ca 0.00 0.00 -0.07 0.00 1.08 0.00 0.00 58.89 59.90 1hrj h TRP 57 Cb 0.00 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 26.16 1hrj h TRP 57 CO 0.00 0.00 -0.16 -0.39 -1.28 0.00 0.00 178.44 176.61 1hrj h VAL 58 N 0.00 1.33 -0.22 0.12 -1.51 -1.86 -1.85 116.25 112.26 1hrj h VAL 58 Ca 0.32 -1.31 -0.09 0.00 -1.23 0.00 0.00 66.70 64.39 1hrj h VAL 58 Cb 1.94 1.80 -0.01 0.00 -2.13 0.00 0.00 31.29 32.88 1hrj h VAL 58 CO -0.00 0.39 -0.25 0.03 -1.23 0.00 0.00 177.57 176.50 1hrj h ARG 59 N 0.08 0.41 0.00 5.19 3.08 -0.97 -0.45 114.38 121.72 1hrj h ARG 59 Ca 0.03 -0.15 0.00 0.00 0.07 0.00 0.00 59.98 59.93 1hrj h ARG 59 Cb 0.69 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.71 1hrj h ARG 59 CO 0.04 0.64 0.00 0.93 -1.07 0.00 0.00 179.97 180.51 1hrj h GLU 60 N 0.37 0.00 0.01 0.04 5.08 -1.26 -2.19 114.58 116.63 1hrj h GLU 60 Ca 0.06 0.00 -0.31 0.00 -1.00 0.00 0.00 59.36 58.10 1hrj h GLU 60 Cb 0.65 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.85 1hrj h GLU 60 CO 0.05 0.00 -1.85 0.66 -1.00 0.00 0.00 179.01 176.86 1hrj n TYR 61 N -2.36 0.87 -0.19 4.33 4.02 -0.31 -2.91 117.16 120.61 1hrj n TYR 61 Ca 0.02 0.29 -0.08 0.00 -0.01 0.00 0.00 57.90 58.12 1hrj n TYR 61 Cb 0.23 -1.15 0.02 0.00 -0.02 0.00 0.00 39.34 38.41 1hrj n TYR 61 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 176.86 176.67 1hrj h ILE 62 N 0.01 1.21 0.02 -0.72 2.04 -0.56 -2.07 117.51 117.44 1hrj h ILE 62 Ca -0.34 -0.62 -0.26 0.00 1.00 0.00 0.00 64.86 64.64 1hrj h ILE 62 Cb 2.05 0.63 0.02 0.00 -0.74 0.00 0.00 36.82 38.78 1hrj h ILE 62 CO 0.07 0.24 -1.03 0.78 0.00 0.00 0.00 178.15 178.21 1hrj h ASN 63 N 0.71 0.87 -0.48 1.72 -0.26 -1.66 -2.61 115.58 113.87 1hrj h ASN 63 Ca 0.18 -0.76 0.13 0.00 -0.56 0.00 0.00 56.30 55.29 1hrj h ASN 63 Cb 0.16 -0.27 -0.02 0.00 -1.06 0.00 0.00 38.32 37.13 1hrj h ASN 63 CO -0.02 1.52 0.34 0.28 -1.06 0.00 0.00 177.43 178.49 1hrj h SER 64 N 0.32 0.05 0.00 5.81 0.02 -1.40 -2.15 113.55 116.20 1hrj h SER 64 Ca -0.14 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.80 1hrj h SER 64 Cb 1.70 -0.01 -0.00 0.00 0.14 0.00 0.00 62.40 64.22 1hrj h SER 64 CO 0.20 0.03 -0.13 -0.07 -1.14 0.00 0.00 176.83 175.72 1hrj h LEU 65 N 0.06 0.00 -6.86 5.07 3.38 -1.33 -3.44 115.31 112.19 1hrj h LEU 65 Ca 0.23 -0.73 -0.56 0.00 0.09 0.00 0.00 57.88 56.91 1hrj h LEU 65 Cb 0.84 0.00 -0.40 0.00 0.09 0.00 0.00 40.66 41.20 1hrj h LEU 65 CO -0.01 0.94 -0.78 -0.70 0.09 0.00 0.00 178.44 177.97 1hrj s GLU 66 N -2.10 0.51 -1.08 1.13 2.12 -0.93 -5.05 118.70 113.30 1hrj s GLU 66 Ca -0.16 -0.99 -0.09 0.00 0.36 0.00 0.00 54.97 54.09 1hrj s GLU 66 Cb -0.01 -1.53 0.27 0.00 0.26 0.00 0.00 34.13 33.12 1hrj s GLU 66 CO 0.53 -1.07 1.07 1.41 -0.54 0.00 0.00 175.26 176.66 1hrj s MET 67 N 1.58 4.09 0.00 4.30 1.75 -0.86 -4.52 119.30 125.64 1hrj s MET 67 Ca 0.12 -3.20 0.28 0.00 -1.25 0.00 0.00 55.69 51.65 1hrj s MET 67 Cb -0.19 -4.50 1.07 0.00 2.84 0.00 0.00 34.83 34.06 1hrj s MET 67 CO -0.22 -1.25 1.75 0.45 -0.65 0.00 0.00 175.02 175.11