#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 4.14 -0.13 1.43 0.02 -1.26 -4.92 135.00 134.28 1hrj s PRO 2 Ca 0.00 2.57 -0.09 0.00 0.02 0.00 0.00 61.00 63.50 1hrj s PRO 2 Cb 0.00 -3.08 -0.06 0.00 0.02 0.00 0.00 34.50 31.38 1hrj s PRO 2 CO 0.00 -0.72 -0.20 0.66 -0.33 0.00 0.00 177.00 176.41 1hrj n TYR 3 N 3.78 0.00 -3.04 6.54 4.02 -1.26 -5.07 117.16 122.13 1hrj n TYR 3 Ca 0.15 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.94 1hrj n TYR 3 Cb 0.36 -0.49 0.01 0.00 -0.02 0.00 0.00 39.34 39.20 1hrj n TYR 3 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 176.86 176.28 1hrj n SER 4 N -3.82 -7.48 0.00 7.72 7.64 -1.26 -4.89 113.62 111.53 1hrj n SER 4 Ca -0.24 0.17 0.00 0.00 1.01 0.00 0.00 58.87 59.81 1hrj n SER 4 Cb 0.59 -4.78 0.00 0.00 -1.01 0.00 0.00 64.21 59.01 1hrj n SER 4 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1hrj n SER 5 N -0.94 0.00 0.00 6.43 3.41 -1.26 -5.14 113.62 116.12 1hrj n SER 5 Ca 0.03 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.64 1hrj n SER 5 Cb 0.51 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.46 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 -0.91 0.05 -4.62 4.04 5.75 -1.26 -5.10 116.55 114.50 1hrj n ASP 6 Ca 0.00 0.00 -0.29 0.00 -0.01 0.00 0.00 54.79 54.49 1hrj n ASP 6 Cb 0.00 0.00 0.12 0.00 -1.03 0.00 0.00 41.12 40.21 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 2.68 2.01 -0.08 2.12 -1.32 -1.26 -5.08 115.64 114.70 1hrj s THR 7 Ca 0.00 -0.01 -0.03 0.00 -1.21 0.00 0.00 61.69 60.43 1hrj s THR 7 Cb 0.00 -3.00 0.05 0.00 -1.51 0.00 0.00 72.50 68.04 1hrj s THR 7 CO 0.00 0.00 0.16 -0.89 -2.21 0.00 0.00 174.62 171.68 1hrj s THR 8 N -3.68 -0.25 0.15 5.08 2.01 -1.26 -5.00 115.64 112.69 1hrj s THR 8 Ca 0.66 0.34 -0.31 0.00 0.31 0.00 0.00 61.69 62.69 1hrj s THR 8 Cb -0.08 -0.30 -0.11 0.00 0.01 0.00 0.00 72.50 72.02 1hrj s THR 8 CO 0.50 0.14 1.80 -2.84 -0.69 0.00 0.00 174.62 173.54 1hrj s PRO 9 N 2.22 4.13 -0.20 4.92 0.01 -1.26 -4.96 135.00 139.85 1hrj s PRO 9 Ca 0.02 2.60 -0.28 0.00 0.01 0.00 0.00 61.00 63.35 1hrj s PRO 9 Cb -0.12 -3.46 0.13 0.00 0.01 0.00 0.00 34.50 31.05 1hrj s PRO 9 CO -0.06 -0.82 1.02 0.00 0.01 0.00 0.00 177.00 177.15 1hrj n PHE 12 N -0.73 0.00 -3.56 0.00 7.35 -1.26 -4.70 117.46 114.56 1hrj n PHE 12 Ca 0.08 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.61 1hrj n PHE 12 Cb 0.53 -0.51 -0.06 0.00 0.35 0.00 0.00 39.48 39.79 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 -2.52 -1.79 -0.10 3.13 0.00 -1.26 -5.04 121.76 114.18 1hrj s ALA 13 Ca -0.06 1.59 -0.06 0.00 0.00 0.00 0.00 51.96 53.44 1hrj s ALA 13 Cb 0.05 -0.49 -0.04 0.00 0.00 0.00 0.00 23.12 22.65 1hrj s ALA 13 CO 0.53 -0.35 0.13 1.52 0.00 0.00 0.00 175.76 177.58 1hrj s TYR 14 N -0.60 3.53 1.09 0.00 -0.85 -1.26 -4.71 117.35 114.55 1hrj s TYR 14 Ca -0.06 0.46 -0.17 0.00 -0.52 0.00 0.00 57.07 56.78 1hrj s TYR 14 Cb -0.02 -1.91 0.24 0.00 0.38 0.00 0.00 41.96 40.66 1hrj s TYR 14 CO 0.06 0.69 1.18 0.96 -1.52 0.00 0.00 175.55 176.93 1hrj s ILE 15 N -1.05 1.77 -0.90 -3.49 -4.36 -1.26 -4.98 121.20 106.93 1hrj s ILE 15 Ca 0.16 0.00 -0.01 0.00 -0.26 0.00 0.00 60.65 60.54 1hrj s ILE 15 Cb -0.12 -2.68 0.24 0.00 1.25 0.00 0.00 42.46 41.15 1hrj s ILE 15 CO 0.06 0.00 0.90 0.00 0.24 0.00 0.00 174.94 176.13 1hrj n ALA 16 N -4.34 4.06 0.00 2.27 0.00 -1.26 -4.90 120.51 116.34 1hrj n ALA 16 Ca 0.13 -4.66 0.00 0.00 0.00 0.00 0.00 53.44 48.91 1hrj n ALA 16 Cb 0.59 -1.72 0.00 0.00 0.00 0.00 0.00 19.45 18.33 1hrj n ALA 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1hrj n ARG 17 N 1.97 0.00 -1.67 0.00 1.74 -1.26 -5.12 116.66 112.31 1hrj n ARG 17 Ca 0.24 0.00 -0.50 0.00 -0.77 0.00 0.00 57.85 56.82 1hrj n ARG 17 Cb 0.37 0.00 -0.05 0.00 -1.02 0.00 0.00 32.46 31.76 1hrj n ARG 17 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1hrj n PRO 18 N 0.00 1.89 -2.73 5.56 -0.01 -1.26 -4.92 135.00 133.53 1hrj n PRO 18 Ca 0.00 0.69 -0.42 0.00 -0.01 0.00 0.00 63.50 63.76 1hrj n PRO 18 Cb 0.00 -2.47 -0.03 0.00 -0.01 0.00 0.00 33.50 30.99 1hrj n PRO 18 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 175.50 174.98 1hrj s LEU 19 N 2.86 4.19 -0.02 2.45 1.43 -1.26 -4.96 118.68 123.36 1hrj s LEU 19 Ca 0.90 1.40 -0.34 0.00 -1.03 0.00 0.00 54.13 55.06 1hrj s LEU 19 Cb -0.78 -3.47 -0.12 0.00 0.03 0.00 0.00 46.19 41.85 1hrj s LEU 19 CO 0.50 -0.49 1.82 -2.65 0.23 0.00 0.00 176.35 175.77 1hrj n PRO 20 N 5.40 2.23 -0.14 1.29 -0.02 -1.26 -4.79 135.00 137.71 1hrj n PRO 20 Ca 0.09 0.82 0.28 0.00 -2.02 0.00 0.00 63.50 62.66 1hrj n PRO 20 Cb 0.48 -2.66 0.67 0.00 -0.02 0.00 0.00 33.50 31.97 1hrj n PRO 20 CO 0.00 0.00 0.00 0.07 1.98 0.00 0.00 175.50 177.55 1hrj h ARG 21 N 8.61 0.00 -0.08 -0.52 -0.00 -1.91 0.27 114.38 120.76 1hrj h ARG 21 Ca -0.48 0.00 -0.03 0.00 -0.00 0.00 0.00 59.98 59.47 1hrj h ARG 21 Cb 1.26 0.00 -0.00 0.00 -0.00 0.00 0.00 29.97 31.23 1hrj h ARG 21 CO 0.94 0.00 -0.08 0.00 -0.00 0.00 0.00 179.97 180.83 1hrj h ALA 22 N 1.18 0.11 0.00 0.08 0.00 -1.94 -2.93 119.26 115.76 1hrj h ALA 22 Ca 0.41 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1hrj h ALA 22 Cb 2.04 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 19.80 1hrj h ALA 22 CO -0.00 -0.07 -0.15 0.45 0.00 0.00 0.00 179.25 179.48 1hrj h HIS 23 N -0.23 0.00 -4.08 0.00 3.86 -0.84 -3.43 115.15 110.43 1hrj h HIS 23 Ca 0.01 0.00 -0.50 0.00 -1.16 0.00 0.00 60.37 58.72 1hrj h HIS 23 Cb 0.59 0.00 0.05 0.00 1.06 0.00 0.00 27.41 29.11 1hrj h HIS 23 CO 0.09 0.15 0.31 0.42 0.86 0.00 0.00 177.93 179.75 1hrj s ILE 24 N -4.49 4.78 -0.00 2.45 1.01 -0.78 -1.70 121.20 122.47 1hrj s ILE 24 Ca -0.04 0.65 0.00 0.00 0.00 0.00 0.00 60.65 61.26 1hrj s ILE 24 Cb 0.15 -3.86 -0.00 0.00 0.01 0.00 0.00 42.46 38.75 1hrj s ILE 24 CO 0.65 -1.03 0.00 0.29 0.00 0.00 0.00 174.94 174.85 1hrj n LYS 25 N -2.55 0.45 -0.49 2.79 4.76 -0.63 -4.79 118.16 117.70 1hrj n LYS 25 Ca 0.04 -0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.48 1hrj n LYS 25 Cb 0.54 -1.00 0.00 0.00 -1.84 0.00 0.00 35.03 32.73 1hrj n LYS 25 CO 0.00 0.00 0.00 -0.85 -1.37 0.00 0.00 177.40 175.18 1hrj n GLU 26 N -1.56 0.00 -3.82 1.97 0.00 -1.03 -5.00 120.64 111.20 1hrj n GLU 26 Ca -0.00 0.00 -0.08 0.00 0.00 0.00 0.00 57.16 57.08 1hrj n GLU 26 Cb 0.06 0.00 0.01 0.00 0.00 0.00 0.00 31.44 31.51 1hrj n GLU 26 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.13 178.65 1hrj s TYR 27 N -3.94 0.04 -0.44 -1.84 1.13 -1.26 -2.45 117.35 108.58 1hrj s TYR 27 Ca 0.00 -0.63 0.05 0.00 -1.41 0.00 0.00 57.07 55.08 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 -1.41 0.48 0.12 -2.51 0.00 0.00 175.55 172.22 1hrj s PHE 28 N -2.68 0.01 0.21 -3.49 5.36 0.41 -4.81 117.98 112.98 1hrj s PHE 28 Ca 0.15 -1.57 -0.32 0.00 -0.96 0.00 0.00 56.93 54.23 1hrj s PHE 28 Cb -0.05 -0.44 -0.13 0.00 -0.34 0.00 0.00 43.02 42.06 1hrj s PHE 28 CO 0.10 -1.00 1.53 0.98 -1.46 0.00 0.00 175.22 175.37 1hrj n TYR 29 N 3.02 2.32 -2.98 10.12 4.19 -1.26 -1.60 117.16 130.97 1hrj n TYR 29 Ca 0.24 0.31 -0.40 0.00 3.31 0.00 0.00 57.90 61.36 1hrj n TYR 29 Cb 0.50 -2.53 -0.04 0.00 0.49 0.00 0.00 39.34 37.76 1hrj n TYR 29 CO 0.00 0.00 0.00 0.95 0.91 0.00 0.00 176.86 178.72 1hrj s THR 30 N 0.49 4.94 0.00 2.97 -4.23 -1.17 -4.91 115.64 113.73 1hrj s THR 30 Ca 0.73 1.58 0.00 0.00 -1.18 0.00 0.00 61.69 62.82 1hrj s THR 30 Cb -0.64 -4.10 0.00 0.00 1.34 0.00 0.00 72.50 69.10 1hrj s THR 30 CO 0.43 0.27 0.00 -0.24 -0.54 0.00 0.00 174.62 174.53 1hrj n SER 31 N 3.54 0.00 -1.74 3.99 2.88 -1.26 -4.55 113.62 116.49 1hrj n SER 31 Ca -0.01 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.46 1hrj n SER 31 Cb 0.51 0.00 0.21 0.00 -0.75 0.00 0.00 64.21 64.18 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 1.20 3.29 0.00 0.46 0.00 -1.26 -4.52 105.19 104.37 1hrj n GLY 32 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.27 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 -0.20 0.00 -1.82 1.61 5.02 -1.26 -4.87 118.16 116.63 1hrj n LYS 33 Ca 0.34 0.48 -0.30 0.00 -2.02 0.00 0.00 58.31 56.80 1hrj n LYS 33 Cb 1.18 -1.06 0.06 0.00 -0.02 0.00 0.00 35.03 35.19 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 -3.11 3.53 -3.16 0.00 7.64 -1.26 -4.45 113.62 112.82 1hrj n SER 35 Ca 0.07 -3.06 -0.24 0.00 1.01 0.00 0.00 58.87 56.65 1hrj n SER 35 Cb 0.57 -0.72 -0.05 0.00 -1.01 0.00 0.00 64.21 63.00 1hrj n SER 35 CO 0.00 0.00 0.00 0.59 -3.01 0.00 0.00 175.04 172.62 1hrj n ASN 36 N -0.57 2.40 -4.74 6.43 4.13 -1.26 -5.09 115.26 116.55 1hrj n ASN 36 Ca 0.39 -3.24 -0.40 0.00 1.68 0.00 0.00 54.58 53.01 1hrj n ASN 36 Cb 1.28 -0.61 0.01 0.00 -1.54 0.00 0.00 39.78 38.92 1hrj n ASN 36 CO 0.00 0.00 0.00 -2.65 0.28 0.00 0.00 177.26 174.89 1hrj n PRO 37 N 0.43 2.19 0.00 3.52 -0.02 -1.26 -4.49 135.00 135.37 1hrj n PRO 37 Ca 0.27 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.53 1hrj n PRO 37 Cb 0.50 -2.55 0.00 0.00 -0.02 0.00 0.00 33.50 31.43 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 -0.14 0.00 -3.27 3.55 0.00 -1.26 -4.11 120.51 115.28 1hrj n ALA 38 Ca 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.43 1hrj n ALA 38 Cb 0.40 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.81 1hrj n ALA 38 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.50 177.64 1hrj s VAL 39 N -4.00 -0.72 -0.23 0.00 -7.23 0.55 -3.07 120.40 105.70 1hrj s VAL 39 Ca 0.00 -0.30 -0.28 0.00 -1.81 0.00 0.00 61.98 59.58 1hrj s VAL 39 Cb 0.00 -0.77 -0.04 0.00 0.56 0.00 0.00 36.38 36.12 1hrj s VAL 39 CO 0.00 -0.23 1.98 -0.69 -0.31 0.00 0.00 175.10 175.85 1hrj s VAL 40 N 2.30 3.25 0.43 1.32 1.01 -0.63 -2.40 120.40 125.68 1hrj s VAL 40 Ca 0.12 0.27 -0.22 0.00 0.00 0.00 0.00 61.98 62.14 1hrj s VAL 40 Cb -0.11 -3.31 -0.09 0.00 0.00 0.00 0.00 36.38 32.87 1hrj s VAL 40 CO -0.21 -0.17 1.01 -0.36 0.00 0.00 0.00 175.10 175.37 1hrj s PHE 41 N 7.04 3.23 -0.57 5.22 0.08 -0.21 0.16 117.98 132.93 1hrj s PHE 41 Ca 0.89 1.63 0.04 0.00 0.12 0.00 0.00 56.93 59.61 1hrj s PHE 41 Cb -0.29 -3.03 0.16 0.00 -0.57 0.00 0.00 43.02 39.29 1hrj s PHE 41 CO 0.34 -0.50 0.40 0.14 -0.10 0.00 0.00 175.22 175.50 1hrj s VAL 42 N -1.86 1.92 0.00 -0.44 -7.23 -1.03 0.89 120.40 112.65 1hrj s VAL 42 Ca 0.61 -3.50 0.00 0.00 -1.81 0.00 0.00 61.98 57.28 1hrj s VAL 42 Cb -0.17 -2.28 0.00 0.00 0.56 0.00 0.00 36.38 34.48 1hrj s VAL 42 CO 0.22 -1.04 0.00 0.35 -0.31 0.00 0.00 175.10 174.31 1hrj n THR 43 N 2.52 0.00 -0.03 5.32 -2.24 -1.26 -1.60 114.28 116.99 1hrj n THR 43 Ca 0.20 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.88 1hrj n THR 43 Cb 0.38 -1.50 -0.07 0.00 -2.10 0.00 0.00 70.33 67.05 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 -0.35 -0.38 -0.78 0.11 -1.64 1.43 114.38 112.77 1hrj h ARG 44 Ca 0.00 0.02 0.10 0.00 0.10 0.00 0.00 59.98 60.20 1hrj h ARG 44 Cb 0.00 0.08 -0.02 0.00 1.11 0.00 0.00 29.97 31.14 1hrj h ARG 44 CO 0.00 -0.23 0.27 -0.22 0.10 0.00 0.00 179.97 179.88 1hrj h LYS 45 N -0.37 0.08 -0.26 0.08 3.64 -1.93 -3.45 116.57 114.37 1hrj h LYS 45 Ca 0.03 -0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.29 1hrj h LYS 45 Cb 0.45 -0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.21 1hrj h LYS 45 CO -0.33 0.05 -0.10 0.09 -2.27 0.00 0.00 179.45 176.89 1hrj n ASN 46 N -4.44 -4.13 -4.53 4.20 3.02 0.49 -4.99 115.26 104.87 1hrj n ASN 46 Ca 0.06 0.13 -0.31 0.00 -0.03 0.00 0.00 54.58 54.43 1hrj n ASN 46 Cb 0.40 -2.11 0.18 0.00 -0.61 0.00 0.00 39.78 37.64 1hrj n ASN 46 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 1hrj n ARG 47 N -2.20 -1.04 -2.13 3.52 1.85 -1.26 -4.47 116.66 110.93 1hrj n ARG 47 Ca -0.05 -0.26 -0.42 0.00 -1.00 0.00 0.00 57.85 56.12 1hrj n ARG 47 Cb 0.26 -2.15 0.00 0.00 -1.05 0.00 0.00 32.46 29.51 1hrj n ARG 47 CO 0.00 0.00 0.00 1.04 -0.01 0.00 0.00 177.63 178.66 1hrj n GLN 48 N -3.71 3.76 -0.65 2.89 6.02 -1.26 -3.98 117.38 120.46 1hrj n GLN 48 Ca 0.08 -3.33 -0.24 0.00 -0.01 0.00 0.00 57.00 53.49 1hrj n GLN 48 Cb 0.54 -2.89 0.13 0.00 1.02 0.00 0.00 30.24 29.04 1hrj n GLN 48 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1hrj n VAL 49 N 3.18 0.00 -4.41 5.09 0.31 0.26 -4.55 118.33 118.21 1hrj n VAL 49 Ca 0.48 -0.12 -0.27 0.00 -0.01 0.00 0.00 64.34 64.43 1hrj n VAL 49 Cb 0.33 -0.44 -0.13 0.00 -0.91 0.00 0.00 33.84 32.70 1hrj n VAL 49 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1hrj s ALA 51 N -1.06 -1.29 0.40 0.00 0.00 -1.01 -4.44 121.76 114.36 1hrj s ALA 51 Ca 0.11 0.80 -0.22 0.00 0.00 0.00 0.00 51.96 52.65 1hrj s ALA 51 Cb -0.10 -1.88 -0.15 0.00 0.00 0.00 0.00 23.12 21.00 1hrj s ALA 51 CO 0.05 -1.44 0.28 -1.71 0.00 0.00 0.00 175.76 172.94 1hrj n ASN 52 N 5.37 -2.04 -0.01 0.00 2.85 -1.26 -0.33 115.26 119.84 1hrj n ASN 52 Ca -0.02 0.87 -0.17 0.00 -0.11 0.00 0.00 54.58 55.15 1hrj n ASN 52 Cb 0.50 -0.97 -0.10 0.00 1.24 0.00 0.00 39.78 40.45 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 0.53 0.46 -1.99 1.20 0.13 -1.83 -3.34 132.00 127.17 1hrj h PRO 53 Ca -0.37 -0.44 -0.76 0.00 -0.87 0.00 0.00 66.00 63.55 1hrj h PRO 53 Cb 1.43 0.11 -0.28 0.00 0.13 0.00 0.00 31.00 32.39 1hrj h PRO 53 CO 0.49 1.09 0.94 0.39 -0.23 0.00 0.00 178.00 180.68 1hrj n GLU 54 N -4.21 2.97 -0.62 0.86 -0.58 -1.26 -4.40 120.64 113.39 1hrj n GLU 54 Ca -0.09 -3.66 0.02 0.00 -0.42 0.00 0.00 57.16 53.00 1hrj n GLU 54 Cb 0.65 -2.28 0.23 0.00 -0.57 0.00 0.00 31.44 29.46 1hrj n GLU 54 CO 0.00 0.00 0.00 1.17 -0.48 0.00 0.00 177.13 177.82 1hrj n LYS 55 N -0.50 2.36 0.00 3.49 4.81 -1.25 -5.02 118.16 122.04 1hrj n LYS 55 Ca 0.52 -2.99 0.00 0.00 -0.87 0.00 0.00 58.31 54.97 1hrj n LYS 55 Cb 0.26 -1.83 0.00 0.00 0.02 0.00 0.00 35.03 33.48 1hrj n LYS 55 CO 0.00 0.00 0.00 1.63 1.17 0.00 0.00 177.40 180.20 1hrj n LYS 56 N -0.84 0.00 -0.31 1.64 4.76 -1.26 -3.71 118.16 118.43 1hrj n LYS 56 Ca 0.28 0.00 0.17 0.00 -2.87 0.00 0.00 58.31 55.89 1hrj n LYS 56 Cb 0.98 0.00 0.36 0.00 -1.84 0.00 0.00 35.03 34.53 1hrj n LYS 56 CO 0.00 0.00 0.00 0.11 -1.37 0.00 0.00 177.40 176.14 1hrj h TRP 57 N 0.00 0.63 -0.23 2.13 5.08 -1.95 -1.39 115.95 120.22 1hrj h TRP 57 Ca 0.00 0.04 0.06 0.00 1.08 0.00 0.00 58.89 60.07 1hrj h TRP 57 Cb 0.00 -0.13 -0.07 0.00 -3.00 0.00 0.00 29.16 25.96 1hrj h TRP 57 CO 0.00 -0.15 -0.32 -0.39 -1.28 0.00 0.00 178.44 176.29 1hrj h VAL 58 N 0.30 0.27 -0.22 0.12 -1.51 -1.83 0.51 116.25 113.89 1hrj h VAL 58 Ca 0.62 0.00 -0.09 0.00 -1.23 0.00 0.00 66.70 66.00 1hrj h VAL 58 Cb 1.29 0.27 -0.01 0.00 -2.13 0.00 0.00 31.29 30.71 1hrj h VAL 58 CO -0.61 0.00 -0.25 0.08 -1.23 0.00 0.00 177.57 175.57 1hrj h ARG 59 N -0.34 0.40 0.00 5.19 0.11 -1.49 -0.92 114.38 117.34 1hrj h ARG 59 Ca 0.12 -0.14 0.00 0.00 0.10 0.00 0.00 59.98 60.06 1hrj h ARG 59 Cb 0.54 -0.03 0.00 0.00 1.11 0.00 0.00 29.97 31.59 1hrj h ARG 59 CO -0.42 0.62 0.00 0.39 0.10 0.00 0.00 179.97 180.66 1hrj n GLU 60 N -4.14 0.45 -0.10 0.08 1.02 -0.46 -2.97 120.64 114.53 1hrj n GLU 60 Ca -0.00 0.03 -0.11 0.00 -0.02 0.00 0.00 57.16 57.06 1hrj n GLU 60 Cb 0.39 -1.50 -0.15 0.00 -0.02 0.00 0.00 31.44 30.16 1hrj n GLU 60 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 1hrj n TYR 61 N -1.24 0.00 -0.05 -0.32 4.02 0.17 -3.55 117.16 116.18 1hrj n TYR 61 Ca 0.14 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.92 1hrj n TYR 61 Cb 0.19 -0.96 -0.04 0.00 -0.02 0.00 0.00 39.34 38.51 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 0.00 1.12 -0.10 -0.72 1.08 -1.13 -0.25 117.51 117.51 1hrj h ILE 62 Ca -0.53 -0.34 -0.17 0.00 -0.39 0.00 0.00 64.86 63.42 1hrj h ILE 62 Cb 2.13 1.00 -0.01 0.00 -3.07 0.00 0.00 36.82 36.87 1hrj h ILE 62 CO 0.01 0.12 -0.66 -1.13 -0.69 0.00 0.00 178.15 175.80 1hrj h ASN 63 N 0.19 0.48 0.91 1.72 -0.73 -1.76 -2.85 115.58 113.53 1hrj h ASN 63 Ca 0.07 -0.29 0.00 0.00 1.87 0.00 0.00 56.30 57.95 1hrj h ASN 63 Cb 0.10 -0.14 0.00 0.00 0.27 0.00 0.00 38.32 38.55 1hrj h ASN 63 CO -0.01 1.00 0.00 -1.28 -0.37 0.00 0.00 177.43 176.78 1hrj h SER 64 N 0.30 0.00 -0.11 1.15 0.87 -1.55 -3.17 113.55 111.03 1hrj h SER 64 Ca -0.02 0.00 0.04 0.00 -1.23 0.00 0.00 61.79 60.59 1hrj h SER 64 Cb 1.21 0.00 -0.05 0.00 -0.44 0.00 0.00 62.40 63.12 1hrj h SER 64 CO 0.11 0.00 -0.20 -0.07 -0.53 0.00 0.00 176.83 176.15 1hrj h LEU 65 N 0.00 -0.60 -0.99 2.23 3.38 -0.79 -3.49 115.31 115.05 1hrj h LEU 65 Ca 0.00 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1hrj h LEU 65 Cb 0.45 0.27 0.00 0.00 0.09 0.00 0.00 40.66 41.48 1hrj h LEU 65 CO 0.00 -0.25 -0.75 1.21 0.09 0.00 0.00 178.44 178.75 1hrj n GLU 66 N -5.33 -4.09 -0.02 1.13 2.13 -1.20 -4.92 120.64 108.33 1hrj n GLU 66 Ca -0.03 2.95 -0.21 0.00 0.66 0.00 0.00 57.16 60.53 1hrj n GLU 66 Cb 0.25 -3.24 -0.13 0.00 0.27 0.00 0.00 31.44 28.58 1hrj n GLU 66 CO 0.00 0.00 0.00 -1.33 -0.41 0.00 0.00 177.13 175.39 1hrj n MET 67 N 0.36 0.72 0.00 5.31 2.81 -1.26 -5.05 117.12 120.01 1hrj n MET 67 Ca 0.00 0.29 0.00 0.00 -1.81 0.00 0.00 57.70 56.18 1hrj n MET 67 Cb 0.00 -1.70 0.00 0.00 -0.71 0.00 0.00 33.22 30.81 1hrj n MET 67 CO 0.00 0.00 0.00 0.43 1.51 0.00 0.00 175.97 177.91