#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 4.15 -1.06 1.43 0.04 -1.26 -4.88 135.00 133.43 1hrj s PRO 2 Ca 0.00 2.52 -0.23 0.00 0.04 0.00 0.00 61.00 63.33 1hrj s PRO 2 Cb 0.00 -3.60 -0.01 0.00 0.04 0.00 0.00 34.50 30.93 1hrj s PRO 2 CO 0.00 -0.81 1.79 0.71 0.04 0.00 0.00 177.00 178.72 1hrj s TYR 3 N 2.72 2.17 -0.07 0.56 2.02 -1.26 -4.93 117.35 118.57 1hrj s TYR 3 Ca 0.79 -0.13 0.03 0.00 -0.37 0.00 0.00 57.07 57.39 1hrj s TYR 3 Cb -0.44 -4.31 -0.02 0.00 -0.40 0.00 0.00 41.96 36.79 1hrj s TYR 3 CO 0.35 -1.68 -0.15 0.45 -1.57 0.00 0.00 175.55 172.95 1hrj s SER 4 N 6.33 3.95 -0.30 2.29 0.15 -1.26 -5.08 113.70 119.78 1hrj s SER 4 Ca 0.61 -0.25 -0.08 0.00 0.70 0.00 0.00 55.95 56.93 1hrj s SER 4 Cb -0.02 -1.01 0.18 0.00 -1.71 0.00 0.00 66.02 63.46 1hrj s SER 4 CO 0.01 0.30 0.92 -0.94 1.20 0.00 0.00 173.24 174.73 1hrj s SER 5 N -0.45 -0.75 0.00 5.45 1.04 -1.26 -5.16 113.70 112.57 1hrj s SER 5 Ca 0.06 0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.83 1hrj s SER 5 Cb -0.12 1.58 0.00 0.00 0.10 0.00 0.00 66.02 67.58 1hrj s SER 5 CO 0.02 -0.14 0.00 -0.90 0.98 0.00 0.00 173.24 173.20 1hrj n ASP 6 N 5.39 0.00 -4.14 7.02 5.75 -1.26 -5.16 116.55 124.15 1hrj n ASP 6 Ca -0.01 0.00 -0.30 0.00 -0.01 0.00 0.00 54.79 54.47 1hrj n ASP 6 Cb 0.54 0.00 0.21 0.00 -1.03 0.00 0.00 41.12 40.84 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 -1.09 1.79 -0.26 2.12 -1.32 -1.26 -5.07 115.64 110.55 1hrj s THR 7 Ca 0.00 0.00 -0.01 0.00 -1.21 0.00 0.00 61.69 60.47 1hrj s THR 7 Cb 0.00 -2.62 0.15 0.00 -1.51 0.00 0.00 72.50 68.52 1hrj s THR 7 CO 0.00 0.00 0.43 -0.89 -2.21 0.00 0.00 174.62 171.95 1hrj s THR 8 N -3.20 -0.69 -0.70 5.08 2.01 -1.26 -5.08 115.64 111.80 1hrj s THR 8 Ca 0.70 -0.11 -0.25 0.00 0.31 0.00 0.00 61.69 62.34 1hrj s THR 8 Cb -0.11 -0.89 -0.14 0.00 0.01 0.00 0.00 72.50 71.38 1hrj s THR 8 CO 0.55 -0.13 2.44 -2.65 -0.69 0.00 0.00 174.62 174.14 1hrj n PRO 9 N 5.37 0.64 -4.15 4.92 -0.02 -1.26 -4.89 135.00 135.62 1hrj n PRO 9 Ca -0.02 -0.23 -0.17 0.00 -2.02 0.00 0.00 63.50 61.07 1hrj n PRO 9 Cb 0.50 -2.96 -0.12 0.00 -0.02 0.00 0.00 33.50 30.91 1hrj n PRO 9 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1hrj n PHE 12 N 2.29 0.00 -3.39 0.00 7.35 -1.26 -4.87 117.46 117.58 1hrj n PHE 12 Ca -0.18 0.00 -0.40 0.00 -0.76 0.00 0.00 57.45 56.11 1hrj n PHE 12 Cb 0.53 -0.53 -0.09 0.00 0.35 0.00 0.00 39.48 39.74 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 -2.72 3.52 -0.31 3.13 0.00 -1.26 -5.03 121.76 119.09 1hrj s ALA 13 Ca -0.27 -1.04 0.03 0.00 0.00 0.00 0.00 51.96 50.69 1hrj s ALA 13 Cb 0.05 -2.79 0.09 0.00 0.00 0.00 0.00 23.12 20.47 1hrj s ALA 13 CO 0.38 -0.92 -0.00 1.52 0.00 0.00 0.00 175.76 176.75 1hrj s TYR 14 N 2.07 3.59 0.00 0.00 -0.85 -1.26 -4.55 117.35 116.35 1hrj s TYR 14 Ca 0.14 -2.76 0.00 0.00 -0.52 0.00 0.00 57.07 53.93 1hrj s TYR 14 Cb -0.16 -2.59 0.00 0.00 0.38 0.00 0.00 41.96 39.59 1hrj s TYR 14 CO 0.11 -0.93 0.00 1.51 -1.52 0.00 0.00 175.55 174.73 1hrj n ILE 15 N 4.32 0.00 0.00 -3.49 3.06 -1.26 -4.56 119.36 117.43 1hrj n ILE 15 Ca -0.02 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.23 1hrj n ILE 15 Cb 0.42 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.60 1hrj n ILE 15 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1hrj n ALA 16 N -0.00 0.00 -1.17 1.51 0.00 -1.26 -5.03 120.51 114.56 1hrj n ALA 16 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1hrj n ALA 16 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 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 0.00 -3.35 -1.53 0.00 1.74 -1.26 -4.51 116.66 107.75 1hrj n ARG 17 Ca 0.00 2.50 -0.38 0.00 -0.77 0.00 0.00 57.85 59.19 1hrj n ARG 17 Cb 0.00 -2.81 -0.09 0.00 -1.02 0.00 0.00 32.46 28.54 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 -0.91 0.56 -1.66 5.56 -0.02 -1.26 -4.80 135.00 132.48 1hrj n PRO 18 Ca 0.00 -0.01 -0.59 0.00 -2.02 0.00 0.00 63.50 60.88 1hrj n PRO 18 Cb 0.00 -2.55 -0.08 0.00 -0.02 0.00 0.00 33.50 30.85 1hrj n PRO 18 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1hrj n LEU 19 N 13.46 1.53 -4.72 2.45 4.77 -1.26 -4.88 117.00 128.35 1hrj n LEU 19 Ca 0.50 1.13 -0.34 0.00 -0.03 0.00 0.00 56.01 57.27 1hrj n LEU 19 Cb 0.31 -1.05 0.10 0.00 -2.33 0.00 0.00 43.42 40.44 1hrj n LEU 19 CO 0.82 -0.92 0.80 -2.16 -1.33 0.00 0.00 177.39 174.60 1hrj s PRO 20 N 2.09 2.07 0.31 3.23 0.05 -1.26 -4.90 135.00 136.60 1hrj s PRO 20 Ca 0.95 1.78 0.26 0.00 0.05 0.00 0.00 61.00 64.05 1hrj s PRO 20 Cb -1.18 -1.82 0.93 0.00 0.05 0.00 0.00 34.50 32.48 1hrj s PRO 20 CO 0.64 -1.89 1.77 -0.09 0.05 0.00 0.00 177.00 177.47 1hrj h ARG 21 N -0.35 0.00 -0.16 4.56 2.43 -1.94 -2.80 114.38 116.12 1hrj h ARG 21 Ca -0.48 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.69 1hrj h ARG 21 Cb 1.30 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.85 1hrj h ARG 21 CO 0.49 0.00 0.00 0.00 -1.51 0.00 0.00 179.97 178.95 1hrj n ALA 22 N -1.87 2.52 0.00 2.80 0.00 -1.26 -3.85 120.51 118.86 1hrj n ALA 22 Ca 0.03 -0.51 0.00 0.00 0.00 0.00 0.00 53.44 52.96 1hrj n ALA 22 Cb 0.33 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.69 1hrj n ALA 22 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1hrj n HIS 23 N 0.28 0.00 -3.76 0.00 8.25 -1.06 -5.05 115.22 113.88 1hrj n HIS 23 Ca 0.16 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.42 1hrj n HIS 23 Cb 0.32 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.41 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 -0.88 4.37 0.00 1.59 1.01 -1.18 -1.59 121.20 124.51 1hrj s ILE 24 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 60.65 59.53 1hrj s ILE 24 Cb 0.00 -3.50 0.00 0.00 0.01 0.00 0.00 42.46 38.97 1hrj s ILE 24 CO 0.00 -0.24 0.00 1.17 0.00 0.00 0.00 174.94 175.87 1hrj n LYS 25 N -1.46 0.00 0.00 2.79 3.00 -0.54 -4.80 118.16 117.14 1hrj n LYS 25 Ca -0.04 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.27 1hrj n LYS 25 Cb 0.58 -0.15 0.00 0.00 0.00 0.00 0.00 35.03 35.46 1hrj n LYS 25 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.40 175.49 1hrj n GLU 26 N -1.95 3.23 -3.82 1.64 2.13 -1.14 -4.97 120.64 115.75 1hrj n GLU 26 Ca 0.00 0.00 -0.09 0.00 0.66 0.00 0.00 57.16 57.73 1hrj n GLU 26 Cb 0.00 0.00 0.01 0.00 0.27 0.00 0.00 31.44 31.72 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 2.41 0.08 -0.37 4.31 1.13 -1.26 -3.00 117.35 120.65 1hrj s TYR 27 Ca 0.00 -0.70 0.05 0.00 -1.41 0.00 0.00 57.07 55.00 1hrj s TYR 27 Cb 0.00 0.79 0.19 0.00 -1.10 0.00 0.00 41.96 41.84 1hrj s TYR 27 CO 0.00 -1.50 0.69 0.12 -2.51 0.00 0.00 175.55 172.35 1hrj s PHE 28 N -2.65 -1.55 0.23 -3.49 5.36 0.50 -4.79 117.98 111.60 1hrj s PHE 28 Ca 0.15 0.40 -0.31 0.00 -0.96 0.00 0.00 56.93 56.20 1hrj s PHE 28 Cb -0.05 0.28 -0.12 0.00 -0.34 0.00 0.00 43.02 42.79 1hrj s PHE 28 CO 0.11 -1.01 1.66 -0.47 -1.46 0.00 0.00 175.22 174.05 1hrj s TYR 29 N 2.10 2.87 0.97 10.12 5.04 -1.26 -0.93 117.35 136.27 1hrj s TYR 29 Ca 0.15 0.52 -0.16 0.00 -2.44 0.00 0.00 57.07 55.13 1hrj s TYR 29 Cb -0.04 -4.09 0.25 0.00 0.35 0.00 0.00 41.96 38.42 1hrj s TYR 29 CO -0.12 -3.99 0.64 0.25 -1.34 0.00 0.00 175.55 170.99 1hrj n THR 30 N 3.39 0.00 -1.68 4.34 -2.24 -1.06 -4.89 114.28 112.14 1hrj n THR 30 Ca 0.13 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1hrj n THR 30 Cb 0.36 -0.82 0.00 0.00 -2.10 0.00 0.00 70.33 67.78 1hrj n THR 30 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 1hrj n SER 31 N -4.78 0.13 -0.06 3.42 3.41 -1.26 -4.91 113.62 109.56 1hrj n SER 31 Ca 0.10 0.00 0.08 0.00 -0.26 0.00 0.00 58.87 58.79 1hrj n SER 31 Cb 0.41 0.00 0.12 0.00 -0.26 0.00 0.00 64.21 64.48 1hrj n SER 31 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1hrj n GLY 32 N 5.00 4.60 0.12 5.00 0.00 -1.26 -4.72 105.19 113.93 1hrj n GLY 32 Ca 0.00 -0.97 -0.21 0.00 0.00 0.00 0.00 46.02 44.84 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 -1.30 0.56 -0.95 1.61 5.02 -1.26 -4.97 118.16 116.88 1hrj n LYS 33 Ca 0.14 0.33 -0.33 0.00 -2.02 0.00 0.00 58.31 56.43 1hrj n LYS 33 Cb 0.58 -1.54 0.14 0.00 -0.02 0.00 0.00 35.03 34.20 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 -3.53 7.40 -2.71 0.00 7.64 -1.26 -4.56 113.62 116.60 1hrj n SER 35 Ca 0.13 -3.50 -0.06 0.00 1.01 0.00 0.00 58.87 56.45 1hrj n SER 35 Cb 0.51 -1.21 0.06 0.00 -1.01 0.00 0.00 64.21 62.56 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 0.45 -2.17 -4.70 6.43 3.02 -1.26 -5.12 115.26 111.90 1hrj n ASN 36 Ca 0.53 -2.53 -0.39 0.00 -0.03 0.00 0.00 54.58 52.16 1hrj n ASN 36 Cb 0.31 1.30 0.04 0.00 -0.61 0.00 0.00 39.78 40.82 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 1.69 1.49 -2.52 3.52 -0.02 -1.26 -4.51 135.00 133.38 1hrj n PRO 37 Ca 0.06 0.55 0.00 0.00 -2.02 0.00 0.00 63.50 62.09 1hrj n PRO 37 Cb 0.66 -2.43 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 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 -1.11 0.00 -3.01 3.55 0.00 -1.26 -4.61 120.51 114.07 1hrj n ALA 38 Ca 0.11 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.44 1hrj n ALA 38 Cb 0.44 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.80 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 -3.20 0.10 -0.15 0.00 0.11 -1.26 -2.56 120.40 113.45 1hrj s VAL 39 Ca 0.00 -0.79 -0.00 0.00 -2.93 0.00 0.00 61.98 58.26 1hrj s VAL 39 Cb 0.00 -0.55 0.04 0.00 -1.53 0.00 0.00 36.38 34.33 1hrj s VAL 39 CO 0.00 -0.43 -0.06 -0.69 -3.33 0.00 0.00 175.10 170.58 1hrj s VAL 40 N -1.71 1.10 0.01 2.04 1.01 -0.11 -3.10 120.40 119.63 1hrj s VAL 40 Ca -0.12 -0.51 -0.22 0.00 0.00 0.00 0.00 61.98 61.12 1hrj s VAL 40 Cb -0.06 -1.21 -0.05 0.00 0.00 0.00 0.00 36.38 35.06 1hrj s VAL 40 CO -0.00 0.22 0.67 -0.36 0.00 0.00 0.00 175.10 175.63 1hrj s PHE 41 N 1.65 3.69 -1.04 5.22 0.08 0.80 0.19 117.98 128.58 1hrj s PHE 41 Ca 0.02 1.30 -0.08 0.00 0.12 0.00 0.00 56.93 58.30 1hrj s PHE 41 Cb -0.14 -2.71 0.26 0.00 -0.57 0.00 0.00 43.02 39.86 1hrj s PHE 41 CO -0.08 0.30 1.00 0.14 -0.10 0.00 0.00 175.22 176.48 1hrj s VAL 42 N -0.05 5.62 0.00 -0.44 -7.23 -1.16 -1.06 120.40 116.07 1hrj s VAL 42 Ca 0.34 -3.42 0.00 0.00 -1.81 0.00 0.00 61.98 57.10 1hrj s VAL 42 Cb -0.19 -4.40 0.00 0.00 0.56 0.00 0.00 36.38 32.35 1hrj s VAL 42 CO 0.19 -1.15 0.00 0.35 -0.31 0.00 0.00 175.10 174.19 1hrj n THR 43 N 2.76 0.00 -0.06 5.32 -2.24 -1.26 -1.47 114.28 117.33 1hrj n THR 43 Ca 0.22 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.92 1hrj n THR 43 Cb 0.39 -1.63 -0.05 0.00 -2.10 0.00 0.00 70.33 66.94 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 -0.23 -0.56 -0.78 0.11 -1.61 1.28 114.38 112.59 1hrj h ARG 44 Ca 0.00 0.02 0.16 0.00 0.10 0.00 0.00 59.98 60.26 1hrj h ARG 44 Cb 0.00 0.05 -0.02 0.00 1.11 0.00 0.00 29.97 31.11 1hrj h ARG 44 CO 0.00 -0.16 0.40 -0.22 0.10 0.00 0.00 179.97 180.10 1hrj h LYS 45 N -0.24 0.02 0.00 0.08 3.11 -1.92 -3.44 116.57 114.17 1hrj h LYS 45 Ca 0.03 -0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.87 1hrj h LYS 45 Cb 0.33 -0.00 0.00 0.00 -1.00 0.00 0.00 32.23 31.56 1hrj h LYS 45 CO -0.30 0.01 0.00 0.09 -2.81 0.00 0.00 179.45 176.44 1hrj n ASN 46 N -4.38 -3.42 -4.56 4.20 3.02 0.44 -4.99 115.26 105.58 1hrj n ASN 46 Ca 0.10 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.35 1hrj n ASN 46 Cb 0.62 -1.64 0.20 0.00 -0.61 0.00 0.00 39.78 38.36 1hrj n ASN 46 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1hrj n ARG 47 N -1.43 -1.27 -2.75 3.52 1.74 -1.26 -4.53 116.66 110.67 1hrj n ARG 47 Ca 0.00 -0.32 -0.43 0.00 -0.77 0.00 0.00 57.85 56.32 1hrj n ARG 47 Cb 0.17 -2.23 -0.00 0.00 -1.02 0.00 0.00 32.46 29.38 1hrj n ARG 47 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 1hrj s GLN 48 N -4.42 4.01 0.74 5.56 -0.21 -1.26 -4.13 119.66 119.95 1hrj s GLN 48 Ca 0.66 -2.22 -0.12 0.00 0.02 0.00 0.00 55.36 53.70 1hrj s GLN 48 Cb -0.23 -5.31 0.04 0.00 1.00 0.00 0.00 33.01 28.51 1hrj s GLN 48 CO 0.62 -2.03 1.11 0.08 -2.12 0.00 0.00 175.29 172.95 1hrj s VAL 49 N 3.05 3.20 0.13 1.09 1.01 -0.23 -4.79 120.40 123.85 1hrj s VAL 49 Ca 0.48 0.46 0.01 0.00 0.00 0.00 0.00 61.98 62.93 1hrj s VAL 49 Cb 0.01 -2.93 0.01 0.00 0.00 0.00 0.00 36.38 33.46 1hrj s VAL 49 CO 0.03 -0.44 0.08 0.00 0.00 0.00 0.00 175.10 174.77 1hrj n ALA 51 N -2.71 0.00 -1.30 0.00 0.00 -1.18 -4.54 120.51 110.78 1hrj n ALA 51 Ca -0.04 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.40 1hrj n ALA 51 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.60 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 -7.19 -0.02 0.00 2.85 -1.26 -4.69 115.26 104.95 1hrj n ASN 52 Ca 0.00 1.06 -0.20 0.00 -0.11 0.00 0.00 54.58 55.33 1hrj n ASN 52 Cb 0.00 -3.76 -0.13 0.00 1.24 0.00 0.00 39.78 37.13 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 1.25 0.16 -1.32 1.20 0.13 -1.81 -3.38 132.00 128.23 1hrj h PRO 53 Ca 0.00 -0.27 -0.68 0.00 -0.87 0.00 0.00 66.00 64.18 1hrj h PRO 53 Cb 0.06 0.10 -0.31 0.00 0.13 0.00 0.00 31.00 30.98 1hrj h PRO 53 CO 0.00 1.13 0.58 0.39 -0.23 0.00 0.00 178.00 179.86 1hrj n GLU 54 N -4.20 2.89 -0.83 0.86 1.02 -1.26 -4.41 120.64 114.71 1hrj n GLU 54 Ca -0.21 -3.58 -0.14 0.00 -0.02 0.00 0.00 57.16 53.20 1hrj n GLU 54 Cb 0.76 -2.28 0.14 0.00 -0.02 0.00 0.00 31.44 30.04 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 -0.74 2.05 0.00 3.49 4.76 -1.26 -4.96 118.16 121.49 1hrj n LYS 55 Ca 0.56 -2.09 0.00 0.00 -2.87 0.00 0.00 58.31 53.90 1hrj n LYS 55 Cb 0.57 -1.84 0.00 0.00 -1.84 0.00 0.00 35.03 31.92 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 -0.53 0.00 -0.31 1.97 4.01 -1.26 -3.84 118.16 118.20 1hrj n LYS 56 Ca 0.39 0.00 0.16 0.00 -0.51 0.00 0.00 58.31 58.35 1hrj n LYS 56 Cb 1.28 0.00 0.34 0.00 -0.51 0.00 0.00 35.03 36.14 1hrj n LYS 56 CO 0.00 0.00 0.00 0.11 -1.11 0.00 0.00 177.40 176.40 1hrj h TRP 57 N 0.00 0.48 -0.56 2.13 5.08 -1.96 0.49 115.95 121.60 1hrj h TRP 57 Ca 0.00 0.05 0.11 0.00 1.08 0.00 0.00 58.89 60.13 1hrj h TRP 57 Cb 0.00 -0.06 -0.10 0.00 -3.00 0.00 0.00 29.16 26.00 1hrj h TRP 57 CO 0.00 -0.22 -0.01 -0.39 -1.28 0.00 0.00 178.44 176.54 1hrj h VAL 58 N 0.22 0.53 -0.27 0.12 -1.51 -1.87 0.20 116.25 113.68 1hrj h VAL 58 Ca 0.60 -0.04 -0.10 0.00 -1.23 0.00 0.00 66.70 65.94 1hrj h VAL 58 Cb 1.28 0.42 -0.01 0.00 -2.13 0.00 0.00 31.29 30.84 1hrj h VAL 58 CO -0.66 0.02 -0.25 0.03 -1.23 0.00 0.00 177.57 175.48 1hrj h ARG 59 N 0.10 0.51 0.00 5.19 3.08 -1.13 -0.69 114.38 121.45 1hrj h ARG 59 Ca 0.29 -0.20 0.00 0.00 0.07 0.00 0.00 59.98 60.14 1hrj h ARG 59 Cb 0.45 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1hrj h ARG 59 CO -0.49 0.73 0.00 0.39 -1.07 0.00 0.00 179.97 179.53 1hrj n GLU 60 N -4.12 0.18 -0.05 0.04 1.02 0.41 -1.86 120.64 116.26 1hrj n GLU 60 Ca -0.00 0.46 -0.10 0.00 -0.02 0.00 0.00 57.16 57.50 1hrj n GLU 60 Cb 0.41 -1.89 -0.15 0.00 -0.02 0.00 0.00 31.44 29.80 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 -2.24 0.59 0.24 -0.32 4.02 0.41 -3.02 117.16 116.84 1hrj n TYR 61 Ca 0.01 0.21 0.06 0.00 -0.01 0.00 0.00 57.90 58.18 1hrj n TYR 61 Cb 0.19 -1.11 0.55 0.00 -0.02 0.00 0.00 39.34 38.96 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 1.07 0.04 -0.72 2.04 -0.44 -2.16 117.51 117.34 1hrj h ILE 62 Ca -0.40 -0.44 -0.31 0.00 1.00 0.00 0.00 64.86 64.70 1hrj h ILE 62 Cb 2.10 1.24 -0.04 0.00 -0.74 0.00 0.00 36.82 39.38 1hrj h ILE 62 CO 0.06 0.12 -1.81 0.59 0.00 0.00 0.00 178.15 177.11 1hrj n ASN 63 N -4.36 1.21 0.25 1.72 3.02 -1.13 -3.24 115.26 112.74 1hrj n ASN 63 Ca -0.03 0.35 0.09 0.00 -0.03 0.00 0.00 54.58 54.96 1hrj n ASN 63 Cb 0.20 -0.27 0.65 0.00 -0.61 0.00 0.00 39.78 39.75 1hrj n ASN 63 CO 0.00 0.00 0.00 -1.28 -2.62 0.00 0.00 177.26 173.36 1hrj h SER 64 N 0.02 0.00 0.04 6.41 0.87 -1.37 -2.91 113.55 116.61 1hrj h SER 64 Ca -0.33 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.11 1hrj h SER 64 Cb 2.03 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.98 1hrj h SER 64 CO 0.08 0.10 -0.60 -0.07 -0.53 0.00 0.00 176.83 175.80 1hrj h LEU 65 N 0.00 0.12 -9.52 2.23 3.38 -1.52 -3.42 115.31 106.58 1hrj h LEU 65 Ca -0.00 -0.86 -0.55 0.00 0.09 0.00 0.00 57.88 56.55 1hrj h LEU 65 Cb 0.19 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 40.85 1hrj h LEU 65 CO 0.01 1.26 0.09 -0.70 0.09 0.00 0.00 178.44 179.19 1hrj s GLU 66 N -2.32 4.43 -0.41 1.13 2.12 -1.10 -4.41 118.70 118.14 1hrj s GLU 66 Ca -0.21 0.93 -0.09 0.00 0.36 0.00 0.00 54.97 55.97 1hrj s GLU 66 Cb 0.01 -3.36 0.01 0.00 0.26 0.00 0.00 34.13 31.05 1hrj s GLU 66 CO 0.70 0.30 0.49 -0.12 -0.54 0.00 0.00 175.26 176.09 1hrj n MET 67 N 2.83 -1.62 0.00 4.30 1.56 -1.26 -4.72 117.12 118.21 1hrj n MET 67 Ca -0.04 1.63 0.00 0.00 -0.27 0.00 0.00 57.70 59.02 1hrj n MET 67 Cb 0.51 -4.80 0.00 0.00 2.15 0.00 0.00 33.22 31.07 1hrj n MET 67 CO 0.00 0.00 0.00 -1.13 -0.73 0.00 0.00 175.97 174.11