#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 3.77 0.97 4.33 0.04 -1.26 -4.98 135.00 137.88 1hrj s PRO 2 Ca 0.00 2.32 -0.15 0.00 0.04 0.00 0.00 61.00 63.21 1hrj s PRO 2 Cb 0.00 -4.22 0.18 0.00 0.04 0.00 0.00 34.50 30.51 1hrj s PRO 2 CO 0.00 -1.37 1.23 0.71 0.04 0.00 0.00 177.00 177.62 1hrj s TYR 3 N 5.80 1.80 -0.07 0.56 2.02 -1.26 -5.01 117.35 121.19 1hrj s TYR 3 Ca 0.91 0.51 0.03 0.00 -0.37 0.00 0.00 57.07 58.14 1hrj s TYR 3 Cb -0.38 -3.79 0.08 0.00 -0.40 0.00 0.00 41.96 37.48 1hrj s TYR 3 CO 0.38 -2.65 0.65 0.45 -1.57 0.00 0.00 175.55 172.80 1hrj n SER 4 N -3.85 -0.37 -4.55 2.29 2.88 -1.26 -5.08 113.62 103.68 1hrj n SER 4 Ca 0.12 -1.12 -0.26 0.00 -1.33 0.00 0.00 58.87 56.29 1hrj n SER 4 Cb 0.60 0.16 -0.07 0.00 -0.75 0.00 0.00 64.21 64.15 1hrj n SER 4 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1hrj n SER 5 N -0.31 1.71 0.00 -3.46 7.64 -1.26 -4.69 113.62 113.25 1hrj n SER 5 Ca -0.06 -0.88 0.00 0.00 1.01 0.00 0.00 58.87 58.94 1hrj n SER 5 Cb 0.54 -1.50 0.00 0.00 -1.01 0.00 0.00 64.21 62.24 1hrj n SER 5 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1hrj n ASP 6 N 16.08 0.00 -4.71 6.43 5.68 -1.26 -5.16 116.55 133.62 1hrj n ASP 6 Ca 0.45 0.00 -0.29 0.00 -0.50 0.00 0.00 54.79 54.46 1hrj n ASP 6 Cb 0.44 0.00 0.15 0.00 -1.14 0.00 0.00 41.12 40.57 1hrj n ASP 6 CO 0.00 0.00 0.00 0.28 -1.33 0.00 0.00 177.20 176.15 1hrj s THR 7 N -1.40 1.99 -0.26 2.12 -1.32 -1.26 -5.05 115.64 110.45 1hrj s THR 7 Ca 0.00 0.00 -0.04 0.00 -1.21 0.00 0.00 61.69 60.44 1hrj s THR 7 Cb 0.00 -2.66 0.09 0.00 -1.51 0.00 0.00 72.50 68.42 1hrj s THR 7 CO 0.00 0.00 0.12 -0.89 -2.21 0.00 0.00 174.62 171.64 1hrj s THR 8 N -3.18 0.01 -0.79 5.08 2.01 -1.26 -5.06 115.64 112.45 1hrj s THR 8 Ca 0.65 -0.68 -0.25 0.00 0.31 0.00 0.00 61.69 61.73 1hrj s THR 8 Cb -0.16 -0.95 -0.15 0.00 0.01 0.00 0.00 72.50 71.25 1hrj s THR 8 CO 0.55 -0.62 2.40 -2.65 -0.69 0.00 0.00 174.62 173.61 1hrj n PRO 9 N 5.22 0.54 -3.75 4.92 -0.01 -1.26 -4.85 135.00 135.80 1hrj n PRO 9 Ca -0.06 -0.72 -0.13 0.00 -0.01 0.00 0.00 63.50 62.58 1hrj n PRO 9 Cb 0.44 -3.43 -0.10 0.00 -0.01 0.00 0.00 33.50 30.39 1hrj n PRO 9 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 1hrj n PHE 12 N -3.20 0.00 -3.71 0.00 7.35 -1.26 -4.73 117.46 111.91 1hrj n PHE 12 Ca 0.07 0.00 -0.32 0.00 -0.76 0.00 0.00 57.45 56.44 1hrj n PHE 12 Cb 0.57 0.00 -0.05 0.00 0.35 0.00 0.00 39.48 40.35 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 -2.23 3.82 0.16 3.13 0.00 -1.26 -4.98 121.76 120.40 1hrj s ALA 13 Ca 0.00 -0.58 0.08 0.00 0.00 0.00 0.00 51.96 51.46 1hrj s ALA 13 Cb 0.00 -2.10 -0.04 0.00 0.00 0.00 0.00 23.12 20.98 1hrj s ALA 13 CO 0.00 0.68 -0.07 1.52 0.00 0.00 0.00 175.76 177.88 1hrj s TYR 14 N -1.55 2.71 0.74 0.00 1.13 -1.26 -4.72 117.35 114.39 1hrj s TYR 14 Ca 0.37 -0.18 -0.11 0.00 -1.41 0.00 0.00 57.07 55.73 1hrj s TYR 14 Cb -0.13 -1.34 0.03 0.00 -1.10 0.00 0.00 41.96 39.42 1hrj s TYR 14 CO 0.23 0.49 1.09 -1.50 -2.51 0.00 0.00 175.55 173.36 1hrj s ILE 15 N -1.59 3.39 -0.82 -3.49 2.07 -1.26 -4.91 121.20 114.59 1hrj s ILE 15 Ca 0.25 0.45 0.02 0.00 -1.41 0.00 0.00 60.65 59.96 1hrj s ILE 15 Cb -0.09 -3.34 0.27 0.00 0.13 0.00 0.00 42.46 39.42 1hrj s ILE 15 CO 0.16 -0.59 1.01 0.00 -1.91 0.00 0.00 174.94 173.61 1hrj n ALA 16 N -3.16 4.44 0.00 1.50 0.00 -1.26 -4.74 120.51 117.29 1hrj n ALA 16 Ca 0.07 -4.77 0.00 0.00 0.00 0.00 0.00 53.44 48.74 1hrj n ALA 16 Cb 0.57 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.53 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 1.15 0.00 -1.67 0.00 1.74 -1.26 -5.12 116.66 111.51 1hrj n ARG 17 Ca 0.28 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.91 1hrj n ARG 17 Cb 0.38 0.00 -0.04 0.00 -1.02 0.00 0.00 32.46 31.78 1hrj n ARG 17 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 1hrj n PRO 18 N 0.00 2.63 -2.30 5.56 -0.04 -1.26 -4.93 135.00 134.66 1hrj n PRO 18 Ca 0.00 0.96 -0.41 0.00 -0.04 0.00 0.00 63.50 64.01 1hrj n PRO 18 Cb 0.00 -2.87 -0.03 0.00 -0.04 0.00 0.00 33.50 30.55 1hrj n PRO 18 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1hrj s LEU 19 N 4.14 4.42 0.10 1.53 1.43 -1.26 -4.94 118.68 124.09 1hrj s LEU 19 Ca 0.90 2.27 -0.31 0.00 -1.03 0.00 0.00 54.13 55.96 1hrj s LEU 19 Cb -0.53 -3.60 -0.10 0.00 0.03 0.00 0.00 46.19 41.99 1hrj s LEU 19 CO 0.45 -0.48 1.81 -2.84 0.23 0.00 0.00 176.35 175.52 1hrj s PRO 20 N 0.16 4.15 0.58 1.29 0.02 -1.26 -4.84 135.00 135.11 1hrj s PRO 20 Ca 0.56 2.54 0.29 0.00 0.02 0.00 0.00 61.00 64.41 1hrj s PRO 20 Cb -0.34 -3.69 1.51 0.00 0.02 0.00 0.00 34.50 32.00 1hrj s PRO 20 CO 0.35 -0.84 1.94 0.00 -0.33 0.00 0.00 177.00 178.12 1hrj h ARG 21 N 8.86 0.00 -0.16 5.54 -0.00 -1.92 0.75 114.38 127.45 1hrj h ARG 21 Ca -0.46 0.00 -0.21 0.00 -0.50 0.00 0.00 59.98 58.82 1hrj h ARG 21 Cb 1.22 0.00 0.00 0.00 0.00 0.00 0.00 29.97 31.19 1hrj h ARG 21 CO 0.94 0.00 -0.72 0.00 0.00 0.00 0.00 179.97 180.19 1hrj h ALA 22 N 1.54 0.42 0.00 0.04 0.00 -2.02 -3.08 119.26 116.16 1hrj h ALA 22 Ca 0.20 -0.58 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 1hrj h ALA 22 Cb 1.05 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.80 1hrj h ALA 22 CO -0.00 0.70 -0.06 0.45 0.00 0.00 0.00 179.25 180.33 1hrj h HIS 23 N 0.50 0.00 -3.04 0.00 3.86 -1.25 -3.45 115.15 111.78 1hrj h HIS 23 Ca -0.03 0.00 -0.47 0.00 -1.16 0.00 0.00 60.37 58.70 1hrj h HIS 23 Cb 1.33 0.00 0.03 0.00 1.06 0.00 0.00 27.41 29.83 1hrj h HIS 23 CO 0.07 0.06 -0.04 0.42 0.86 0.00 0.00 177.93 179.31 1hrj s ILE 24 N -3.34 4.37 0.00 2.45 1.01 -0.75 -1.52 121.20 123.42 1hrj s ILE 24 Ca 0.05 -0.29 0.00 0.00 0.00 0.00 0.00 60.65 60.41 1hrj s ILE 24 Cb 0.07 -3.64 0.00 0.00 0.01 0.00 0.00 42.46 38.90 1hrj s ILE 24 CO 0.64 -0.50 0.00 0.29 0.00 0.00 0.00 174.94 175.37 1hrj n LYS 25 N -2.12 2.86 -0.40 2.79 4.76 -0.98 -4.78 118.16 120.29 1hrj n LYS 25 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1hrj n LYS 25 Cb 0.57 -0.92 0.00 0.00 -1.84 0.00 0.00 35.03 32.84 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 -1.65 0.00 -3.32 1.97 0.00 -1.06 -4.70 120.64 111.88 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 0.33 0.00 0.02 0.00 0.00 0.00 0.00 31.44 31.79 1hrj n GLU 26 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.13 179.61 1hrj n TYR 27 N 0.00 -2.04 -2.89 -1.84 4.11 -1.26 -2.02 117.16 111.22 1hrj n TYR 27 Ca 0.00 -1.58 -0.09 0.00 -0.00 0.00 0.00 57.90 56.23 1hrj n TYR 27 Cb 0.00 0.73 -0.01 0.00 -0.00 0.00 0.00 39.34 40.06 1hrj n TYR 27 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.86 177.20 1hrj n PHE 28 N -0.45 -3.23 -1.69 -3.48 7.35 0.49 -4.79 117.46 111.66 1hrj n PHE 28 Ca -0.06 -1.78 -0.44 0.00 -0.76 0.00 0.00 57.45 54.41 1hrj n PHE 28 Cb 0.49 1.24 -0.03 0.00 0.35 0.00 0.00 39.48 41.52 1hrj n PHE 28 CO 0.00 0.00 0.00 0.98 -0.76 0.00 0.00 176.76 176.98 1hrj n TYR 29 N 2.85 2.46 -2.65 -5.13 9.36 -1.26 -1.73 117.16 121.06 1hrj n TYR 29 Ca 0.20 0.23 -0.35 0.00 3.32 0.00 0.00 57.90 61.30 1hrj n TYR 29 Cb 0.55 -2.57 -0.05 0.00 -0.63 0.00 0.00 39.34 36.63 1hrj n TYR 29 CO 0.00 0.00 0.00 0.99 0.22 0.00 0.00 176.86 178.07 1hrj s THR 30 N 0.70 3.97 -0.03 2.97 2.01 -0.94 -4.91 115.64 119.41 1hrj s THR 30 Ca 0.74 1.42 -0.01 0.00 0.31 0.00 0.00 61.69 64.15 1hrj s THR 30 Cb -0.60 -3.69 -0.00 0.00 0.01 0.00 0.00 72.50 68.21 1hrj s THR 30 CO 0.40 -0.08 -0.01 -1.28 -0.69 0.00 0.00 174.62 172.96 1hrj h SER 31 N 2.35 0.00 0.00 3.53 0.87 -1.91 -3.44 113.55 114.95 1hrj h SER 31 Ca -0.48 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.08 1hrj h SER 31 Cb 1.20 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.16 1hrj h SER 31 CO 0.62 0.15 0.00 0.61 -0.53 0.00 0.00 176.83 177.68 1hrj n GLY 32 N 1.88 -0.61 0.00 5.77 0.00 -1.26 -5.04 105.19 105.93 1hrj n GLY 32 Ca -0.01 0.25 0.00 0.00 0.00 0.00 0.00 46.02 46.26 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 0.00 0.00 -1.01 1.61 4.76 -1.26 -5.01 118.16 117.25 1hrj n LYS 33 Ca 0.00 0.01 -0.31 0.00 -2.87 0.00 0.00 58.31 55.14 1hrj n LYS 33 Cb 0.00 -0.44 0.26 0.00 -1.84 0.00 0.00 35.03 33.01 1hrj n LYS 33 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1hrj n SER 35 N -4.96 3.74 -3.20 0.00 7.64 -1.26 -4.50 113.62 111.07 1hrj n SER 35 Ca 0.15 -3.25 -0.23 0.00 1.01 0.00 0.00 58.87 56.56 1hrj n SER 35 Cb 0.60 -0.76 -0.06 0.00 -1.01 0.00 0.00 64.21 62.98 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 -0.69 0.80 -4.71 6.43 3.02 -1.26 -5.11 115.26 113.74 1hrj n ASN 36 Ca 0.46 -2.87 -0.40 0.00 -0.03 0.00 0.00 54.58 51.75 1hrj n ASN 36 Cb 1.41 -0.64 0.03 0.00 -0.61 0.00 0.00 39.78 39.97 1hrj n ASN 36 CO 0.00 0.00 0.00 -2.65 -2.62 0.00 0.00 177.26 171.99 1hrj n PRO 37 N 1.05 1.74 0.00 3.52 -0.02 -1.26 -4.58 135.00 135.44 1hrj n PRO 37 Ca 0.23 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.34 1hrj n PRO 37 Cb 0.54 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 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 -0.68 0.00 -3.24 3.55 0.00 -1.26 -4.56 120.51 114.31 1hrj n ALA 38 Ca 0.09 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.40 1hrj n ALA 38 Cb 0.42 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.75 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 -0.60 -0.01 -0.32 0.00 0.11 -1.26 -2.21 120.40 116.12 1hrj s VAL 39 Ca 0.00 0.03 -0.03 0.00 -2.93 0.00 0.00 61.98 59.05 1hrj s VAL 39 Cb 0.00 -0.35 0.05 0.00 -1.53 0.00 0.00 36.38 34.55 1hrj s VAL 39 CO 0.00 0.01 0.03 -0.69 -3.33 0.00 0.00 175.10 171.13 1hrj s VAL 40 N 0.35 3.16 0.11 2.04 1.01 -0.71 -3.05 120.40 123.31 1hrj s VAL 40 Ca -0.02 -1.38 -0.27 0.00 0.00 0.00 0.00 61.98 60.31 1hrj s VAL 40 Cb -0.03 -2.84 -0.06 0.00 0.00 0.00 0.00 36.38 33.44 1hrj s VAL 40 CO -0.01 -0.16 0.85 -0.36 0.00 0.00 0.00 175.10 175.41 1hrj s PHE 41 N 1.27 3.82 -0.84 5.22 0.08 0.94 0.18 117.98 128.66 1hrj s PHE 41 Ca -0.04 1.65 -0.02 0.00 0.12 0.00 0.00 56.93 58.64 1hrj s PHE 41 Cb -0.20 -2.90 0.21 0.00 -0.57 0.00 0.00 43.02 39.56 1hrj s PHE 41 CO -0.01 0.31 0.71 0.14 -0.10 0.00 0.00 175.22 176.27 1hrj s VAL 42 N -0.34 4.23 0.00 -0.44 -7.23 -0.86 0.02 120.40 115.78 1hrj s VAL 42 Ca 0.41 -3.67 0.00 0.00 -1.81 0.00 0.00 61.98 56.91 1hrj s VAL 42 Cb -0.22 -3.65 0.00 0.00 0.56 0.00 0.00 36.38 33.07 1hrj s VAL 42 CO 0.27 -1.04 0.00 0.35 -0.31 0.00 0.00 175.10 174.36 1hrj n THR 43 N 2.58 0.00 -0.01 5.32 -2.24 -1.26 -2.32 114.28 116.35 1hrj n THR 43 Ca 0.19 0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.83 1hrj n THR 43 Cb 0.37 -1.74 -0.09 0.00 -2.10 0.00 0.00 70.33 66.77 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 -0.50 -0.63 -0.78 0.11 -1.58 1.21 114.38 112.21 1hrj h ARG 44 Ca 0.00 0.03 0.15 0.00 0.10 0.00 0.00 59.98 60.27 1hrj h ARG 44 Cb 0.00 0.11 -0.03 0.00 1.11 0.00 0.00 29.97 31.16 1hrj h ARG 44 CO 0.00 -0.34 0.44 0.87 0.10 0.00 0.00 179.97 181.04 1hrj h LYS 45 N -0.52 0.16 -0.03 0.08 1.57 -1.92 -3.44 116.57 112.47 1hrj h LYS 45 Ca 0.03 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1hrj h LYS 45 Cb 0.61 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.88 1hrj h LYS 45 CO -0.40 0.11 -0.01 0.09 -0.57 0.00 0.00 179.45 178.67 1hrj n ASN 46 N -4.41 -4.19 -4.46 0.86 4.13 0.42 -5.00 115.26 102.61 1hrj n ASN 46 Ca 0.12 0.01 -0.28 0.00 1.68 0.00 0.00 54.58 56.11 1hrj n ASN 46 Cb 0.58 -1.73 0.26 0.00 -1.54 0.00 0.00 39.78 37.35 1hrj n ASN 46 CO 0.00 0.00 0.00 -0.60 0.28 0.00 0.00 177.26 176.94 1hrj s ARG 47 N -0.92 -1.16 -1.27 3.52 3.52 -1.26 -4.58 118.95 116.80 1hrj s ARG 47 Ca 0.00 0.86 -0.10 0.00 -0.13 0.00 0.00 55.73 56.36 1hrj s ARG 47 Cb 0.00 -1.52 0.17 0.00 -1.56 0.00 0.00 34.95 32.03 1hrj s ARG 47 CO 0.00 -3.89 1.82 1.04 -0.81 0.00 0.00 175.30 173.46 1hrj n GLN 48 N -5.04 3.59 -0.75 5.12 6.02 -1.26 -4.12 117.38 120.95 1hrj n GLN 48 Ca 0.03 -3.57 -0.32 0.00 -0.01 0.00 0.00 57.00 53.12 1hrj n GLN 48 Cb 0.54 -2.94 0.14 0.00 1.02 0.00 0.00 30.24 29.00 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 3.49 0.06 -4.71 5.09 0.31 0.10 -4.68 118.33 117.99 1hrj n VAL 49 Ca 0.39 -0.10 -0.32 0.00 -0.01 0.00 0.00 64.34 64.30 1hrj n VAL 49 Cb 0.37 -0.81 -0.08 0.00 -0.91 0.00 0.00 33.84 32.41 1hrj n VAL 49 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1hrj n ALA 51 N -1.26 0.00 -1.18 0.00 0.00 -1.17 -4.05 120.51 112.84 1hrj n ALA 51 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 1hrj n ALA 51 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.12 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 -6.59 -0.06 0.00 2.85 -1.26 -4.74 115.26 105.46 1hrj n ASN 52 Ca 0.00 1.04 -0.04 0.00 -0.11 0.00 0.00 54.58 55.47 1hrj n ASN 52 Cb 0.00 -3.38 -0.03 0.00 1.24 0.00 0.00 39.78 37.61 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 0.97 0.00 -1.70 1.20 0.13 -1.80 -3.35 132.00 127.44 1hrj h PRO 53 Ca 0.00 0.00 -0.74 0.00 -0.87 0.00 0.00 66.00 64.39 1hrj h PRO 53 Cb 0.17 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 31.02 1hrj h PRO 53 CO 0.00 0.20 1.00 0.39 -0.23 0.00 0.00 178.00 179.36 1hrj n GLU 54 N -4.70 2.74 -0.75 0.86 1.02 -1.26 -4.46 120.64 114.08 1hrj n GLU 54 Ca -0.05 -3.46 -0.08 0.00 -0.02 0.00 0.00 57.16 53.56 1hrj n GLU 54 Cb 0.16 -2.28 0.19 0.00 -0.02 0.00 0.00 31.44 29.50 1hrj n GLU 54 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1hrj n LYS 55 N -0.65 2.63 0.00 3.49 4.76 -1.26 -4.96 118.16 122.16 1hrj n LYS 55 Ca 0.57 -2.11 0.00 0.00 -2.87 0.00 0.00 58.31 53.89 1hrj n LYS 55 Cb 0.36 -1.90 0.00 0.00 -1.84 0.00 0.00 35.03 31.65 1hrj n LYS 55 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1hrj n LYS 56 N -0.19 0.00 -0.33 1.97 5.02 -1.26 -3.89 118.16 119.48 1hrj n LYS 56 Ca 0.32 0.00 0.25 0.00 -2.02 0.00 0.00 58.31 56.86 1hrj n LYS 56 Cb 1.14 0.00 0.48 0.00 -0.02 0.00 0.00 35.03 36.63 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 0.84 -0.27 2.13 5.08 -1.96 0.12 115.95 121.89 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 -0.21 -0.06 0.00 -3.00 0.00 0.00 29.16 25.89 1hrj h TRP 57 CO 0.00 -0.25 -0.14 -0.39 -1.28 0.00 0.00 178.44 176.38 1hrj h VAL 58 N 0.24 0.58 0.00 0.12 -1.51 -1.87 0.12 116.25 113.94 1hrj h VAL 58 Ca 0.74 0.00 -0.05 0.00 -1.23 0.00 0.00 66.70 66.16 1hrj h VAL 58 Cb 1.74 0.58 -0.01 0.00 -2.13 0.00 0.00 31.29 31.47 1hrj h VAL 58 CO -0.65 0.00 -0.25 0.03 -1.23 0.00 0.00 177.57 175.47 1hrj h ARG 59 N -0.10 0.00 0.00 5.19 3.08 -1.02 -0.78 114.38 120.74 1hrj h ARG 59 Ca 0.14 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 1hrj h ARG 59 Cb 0.32 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.37 1hrj h ARG 59 CO -0.34 0.25 -0.11 0.93 -1.07 0.00 0.00 179.97 179.64 1hrj h GLU 60 N 0.00 0.00 0.00 0.04 5.08 0.08 -2.42 114.58 117.36 1hrj h GLU 60 Ca -0.00 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.22 1hrj h GLU 60 Cb 0.55 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.77 1hrj h GLU 60 CO 0.03 0.11 -2.05 0.66 -1.00 0.00 0.00 179.01 176.76 1hrj n TYR 61 N -3.49 0.11 -0.05 4.33 4.01 -0.64 -3.27 117.16 118.16 1hrj n TYR 61 Ca -0.01 0.03 -0.09 0.00 -0.16 0.00 0.00 57.90 57.67 1hrj n TYR 61 Cb 0.26 -0.73 -0.02 0.00 -0.31 0.00 0.00 39.34 38.54 1hrj n TYR 61 CO 0.00 0.00 0.00 0.82 -0.46 0.00 0.00 176.86 177.22 1hrj h ILE 62 N 0.00 0.94 0.20 -0.72 2.04 -0.67 -0.24 117.51 119.06 1hrj h ILE 62 Ca -0.20 -0.06 -0.29 0.00 1.00 0.00 0.00 64.86 65.32 1hrj h ILE 62 Cb 1.46 0.76 0.02 0.00 -0.74 0.00 0.00 36.82 38.33 1hrj h ILE 62 CO 0.01 0.03 -1.31 -1.13 0.00 0.00 0.00 178.15 175.76 1hrj h ASN 63 N 0.17 0.65 0.00 1.72 -1.24 -1.72 -3.24 115.58 111.92 1hrj h ASN 63 Ca 0.09 -0.93 0.00 0.00 0.71 0.00 0.00 56.30 56.18 1hrj h ASN 63 Cb 0.07 -0.21 0.00 0.00 0.73 0.00 0.00 38.32 38.90 1hrj h ASN 63 CO -0.10 1.62 0.06 -1.28 -1.29 0.00 0.00 177.43 176.44 1hrj h SER 64 N -0.07 0.00 -4.10 1.15 0.87 -1.52 -3.42 113.55 106.46 1hrj h SER 64 Ca -0.24 0.00 -0.52 0.00 -1.23 0.00 0.00 61.79 59.80 1hrj h SER 64 Cb 1.95 0.00 0.11 0.00 -0.44 0.00 0.00 62.40 64.02 1hrj h SER 64 CO 0.20 0.00 0.46 -0.76 -0.53 0.00 0.00 176.83 176.20 1hrj s LEU 65 N -5.83 3.66 -0.32 2.23 1.43 -0.11 -5.00 118.68 114.75 1hrj s LEU 65 Ca -0.04 2.34 0.03 0.00 -1.03 0.00 0.00 54.13 55.43 1hrj s LEU 65 Cb 0.11 -4.59 0.09 0.00 0.03 0.00 0.00 46.19 41.83 1hrj s LEU 65 CO 0.35 -1.54 0.01 -1.61 0.23 0.00 0.00 176.35 173.80 1hrj s GLU 66 N -3.36 1.71 -0.18 1.70 0.41 -1.26 -4.93 118.70 112.78 1hrj s GLU 66 Ca 0.76 -1.73 0.16 0.00 -0.41 0.00 0.00 54.97 53.75 1hrj s GLU 66 Cb -0.29 -3.14 0.45 0.00 -1.78 0.00 0.00 34.13 29.37 1hrj s GLU 66 CO 0.32 -0.85 1.18 -1.33 -0.49 0.00 0.00 175.26 174.10 1hrj n MET 67 N 4.31 1.66 0.00 1.61 2.81 -1.26 -5.01 117.12 121.25 1hrj n MET 67 Ca -0.01 -3.20 0.15 0.00 -1.81 0.00 0.00 57.70 52.83 1hrj n MET 67 Cb 0.42 -1.35 0.80 0.00 -0.71 0.00 0.00 33.22 32.38 1hrj n MET 67 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93