#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jrp n GLU 2 N 0.00 0.00 -4.19 3.17 -0.58 -1.26 -4.81 120.64 112.97 2jrp n GLU 2 Ca 0.00 0.00 -0.24 0.00 -0.42 0.00 0.00 57.16 56.50 2jrp n GLU 2 Cb 0.00 0.00 -0.17 0.00 -0.57 0.00 0.00 31.44 30.70 2jrp n GLU 2 CO 0.00 0.00 0.00 0.96 -0.48 0.00 0.00 177.13 177.61 2jrp s ILE 3 N 0.00 0.93 0.12 -3.67 -4.36 -1.26 -5.11 121.20 107.85 2jrp s ILE 3 Ca 0.00 -0.29 0.02 0.00 -0.26 0.00 0.00 60.65 60.12 2jrp s ILE 3 Cb 0.00 -0.91 -0.04 0.00 1.25 0.00 0.00 42.46 42.75 2jrp s ILE 3 CO 0.00 0.33 -0.05 0.42 0.24 0.00 0.00 174.94 175.87 2jrp s THR 4 N 1.21 0.77 -0.11 8.37 -4.23 -1.26 -1.17 115.64 119.21 2jrp s THR 4 Ca -0.05 -1.97 -0.29 0.00 -1.18 0.00 0.00 61.69 58.20 2jrp s THR 4 Cb -0.14 -1.82 -0.05 0.00 1.34 0.00 0.00 72.50 71.84 2jrp s THR 4 CO -0.02 -0.75 1.67 0.00 -0.54 0.00 0.00 174.62 174.97 2jrp h PRO 6 N 10.15 0.00 0.00 0.00 0.13 -1.90 -0.85 132.00 139.53 2jrp h PRO 6 Ca -0.38 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.61 2jrp h PRO 6 Cb 1.17 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.28 2jrp h PRO 6 CO 0.97 0.23 -1.55 1.55 -0.23 0.00 0.00 178.00 178.97 2jrp n VAL 7 N -3.71 0.55 0.78 1.56 3.14 -1.26 -4.68 118.33 114.70 2jrp n VAL 7 Ca -0.01 -0.26 0.11 0.00 -2.96 0.00 0.00 64.34 61.22 2jrp n VAL 7 Cb 0.34 -0.83 -0.05 0.00 -1.06 0.00 0.00 33.84 32.25 2jrp n VAL 7 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2jrp n HIS 9 N -1.70 -3.41 -0.44 0.00 8.25 -0.32 -4.96 115.22 112.63 2jrp n HIS 9 Ca 0.03 1.54 0.05 0.00 -0.26 0.00 0.00 57.72 59.09 2jrp n HIS 9 Cb 0.38 -2.82 -0.03 0.00 1.12 0.00 0.00 29.99 28.65 2jrp n HIS 9 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2jrp n HIS 10 N -3.91 -1.18 -1.89 4.41 8.25 -1.26 -4.12 115.22 115.52 2jrp n HIS 10 Ca 0.01 0.64 -0.29 0.00 -0.26 0.00 0.00 57.72 57.81 2jrp n HIS 10 Cb 0.57 -1.07 0.07 0.00 1.12 0.00 0.00 29.99 30.67 2jrp n HIS 10 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2jrp s ALA 11 N -3.01 2.74 0.23 -1.41 0.00 -1.26 0.33 121.76 119.37 2jrp s ALA 11 Ca 0.00 -0.52 0.10 0.00 0.00 0.00 0.00 51.96 51.54 2jrp s ALA 11 Cb 0.00 -2.99 -0.04 0.00 0.00 0.00 0.00 23.12 20.09 2jrp s ALA 11 CO 0.00 -1.46 -0.12 -0.51 0.00 0.00 0.00 175.76 173.67 2jrp s LEU 12 N -5.50 2.86 -0.16 0.00 1.43 -0.32 -3.84 118.68 113.16 2jrp s LEU 12 Ca 0.60 -0.75 -0.05 0.00 -1.03 0.00 0.00 54.13 52.90 2jrp s LEU 12 Cb -0.11 -1.47 -0.04 0.00 0.03 0.00 0.00 46.19 44.61 2jrp s LEU 12 CO 0.50 0.06 0.02 -0.70 0.23 0.00 0.00 176.35 176.47 2jrp s GLU 13 N -3.21 3.73 -0.70 1.70 2.12 0.14 -4.86 118.70 117.63 2jrp s GLU 13 Ca 0.27 -0.40 -0.26 0.00 0.36 0.00 0.00 54.97 54.94 2jrp s GLU 13 Cb -0.07 -3.06 0.04 0.00 0.26 0.00 0.00 34.13 31.30 2jrp s GLU 13 CO 0.16 0.33 1.21 0.50 -0.54 0.00 0.00 175.26 176.92 2jrp s ARG 14 N 0.16 3.22 0.31 4.30 3.52 -1.26 -0.51 118.95 128.69 2jrp s ARG 14 Ca 0.02 -0.28 0.12 0.00 -0.13 0.00 0.00 55.73 55.46 2jrp s ARG 14 Cb -0.13 -4.17 0.49 0.00 -1.56 0.00 0.00 34.95 29.58 2jrp s ARG 14 CO 0.01 -2.02 1.68 -0.97 -0.81 0.00 0.00 175.30 173.19 2jrp h ASN 15 N 9.88 0.00 0.00 -2.12 -1.24 -1.47 -3.49 115.58 117.14 2jrp h ASN 15 Ca -0.28 0.00 0.00 0.00 0.71 0.00 0.00 56.30 56.73 2jrp h ASN 15 Cb 1.05 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.10 2jrp h ASN 15 CO 1.25 0.53 0.00 0.61 -1.29 0.00 0.00 177.43 178.53 2jrp n GLY 16 N 0.07 1.40 0.04 1.57 0.00 -1.26 -4.79 105.19 102.23 2jrp n GLY 16 Ca -0.01 -0.27 0.11 0.00 0.00 0.00 0.00 46.02 45.85 2jrp n GLY 16 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2jrp n ASP 17 N 0.00 0.91 -4.19 1.61 5.75 -1.26 -4.95 116.55 114.42 2jrp n ASP 17 Ca 0.00 -0.79 -0.15 0.00 -0.01 0.00 0.00 54.79 53.84 2jrp n ASP 17 Cb 0.00 0.69 -0.11 0.00 -1.03 0.00 0.00 41.12 40.67 2jrp n ASP 17 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 2jrp s THR 18 N -2.94 0.99 -0.19 2.12 -4.23 -1.26 -1.83 115.64 108.31 2jrp s THR 18 Ca 0.10 -1.69 -0.03 0.00 -1.18 0.00 0.00 61.69 58.89 2jrp s THR 18 Cb 0.17 -1.42 -0.02 0.00 1.34 0.00 0.00 72.50 72.57 2jrp s THR 18 CO 0.78 -0.56 -0.05 0.00 -0.54 0.00 0.00 174.62 174.25 2jrp s ALA 19 N -2.50 2.86 -0.18 3.99 0.00 0.74 -1.06 121.76 125.61 2jrp s ALA 19 Ca 0.07 -1.01 -0.09 0.00 0.00 0.00 0.00 51.96 50.92 2jrp s ALA 19 Cb -0.02 -1.60 -0.05 0.00 0.00 0.00 0.00 23.12 21.45 2jrp s ALA 19 CO 0.00 -0.12 0.13 -1.58 0.00 0.00 0.00 175.76 174.19 2jrp s HIS 20 N 0.96 3.45 0.21 0.00 2.46 0.34 -0.35 115.29 122.35 2jrp s HIS 20 Ca -0.00 0.37 -0.30 0.00 0.47 0.00 0.00 55.06 55.60 2jrp s HIS 20 Cb -0.15 -2.10 -0.08 0.00 -0.13 0.00 0.00 32.58 30.12 2jrp s HIS 20 CO 0.01 0.40 0.97 0.00 -2.47 0.00 0.00 174.74 173.64 2jrp h GLU 22 N 4.53 -0.19 -0.46 0.00 5.08 -1.91 -3.37 114.58 118.26 2jrp h GLU 22 Ca -0.45 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2jrp h GLU 22 Cb 1.20 0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.50 2jrp h GLU 22 CO 0.69 -0.12 0.00 0.25 -1.00 0.00 0.00 179.01 178.83 2jrp n THR 23 N -4.88 0.44 -3.58 1.13 -2.24 -1.26 -4.83 114.28 99.07 2jrp n THR 23 Ca -0.02 -0.30 -0.15 0.00 -2.27 0.00 0.00 64.05 61.30 2jrp n THR 23 Cb 0.08 -0.09 -0.06 0.00 -2.10 0.00 0.00 70.33 68.15 2jrp n THR 23 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2jrp n ALA 25 N 1.70 4.77 -3.73 0.00 0.00 -1.26 -4.28 120.51 117.71 2jrp n ALA 25 Ca -0.16 -4.11 -0.15 0.00 0.00 0.00 0.00 53.44 49.02 2jrp n ALA 25 Cb 0.56 -3.24 -0.15 0.00 0.00 0.00 0.00 19.45 16.62 2jrp n ALA 25 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 2jrp s LYS 26 N 2.00 0.07 -0.16 0.00 1.02 -1.26 -5.06 119.74 116.35 2jrp s LYS 26 Ca 0.45 0.42 -0.00 0.00 0.02 0.00 0.00 55.97 56.85 2jrp s LYS 26 Cb 0.07 -0.21 -0.00 0.00 -0.52 0.00 0.00 37.83 37.16 2jrp s LYS 26 CO -0.01 -0.21 -0.14 -0.51 -0.92 0.00 0.00 175.35 173.57 2jrp s ASP 27 N 1.49 3.78 -0.18 2.83 1.11 -1.26 -1.40 116.67 123.04 2jrp s ASP 27 Ca -0.06 -0.44 -0.09 0.00 0.18 0.00 0.00 52.55 52.15 2jrp s ASP 27 Cb -0.12 -1.59 -0.05 0.00 1.07 0.00 0.00 42.92 42.24 2jrp s ASP 27 CO -0.06 0.09 0.11 -0.36 1.18 0.00 0.00 175.17 176.13 2jrp s PHE 28 N 0.81 3.40 -0.07 4.23 0.08 0.52 -4.90 117.98 122.04 2jrp s PHE 28 Ca -0.05 0.30 -0.30 0.00 0.12 0.00 0.00 56.93 57.00 2jrp s PHE 28 Cb -0.15 -2.10 -0.03 0.00 -0.57 0.00 0.00 43.02 40.17 2jrp s PHE 28 CO 0.00 0.33 1.16 -1.12 -0.10 0.00 0.00 175.22 175.49 2jrp s SER 29 N 0.14 7.09 -0.06 1.36 0.01 -1.26 -0.18 113.70 120.80 2jrp s SER 29 Ca 0.08 1.74 -0.04 0.00 1.31 0.00 0.00 55.95 59.04 2jrp s SER 29 Cb -0.11 -2.56 -0.04 0.00 0.21 0.00 0.00 66.02 63.52 2jrp s SER 29 CO -0.01 -0.56 0.16 -0.76 0.41 0.00 0.00 173.24 172.48 2jrp s LEU 30 N 2.24 4.35 -0.07 2.44 1.43 -0.76 -0.92 118.68 127.38 2jrp s LEU 30 Ca 0.54 0.39 -0.00 0.00 -1.03 0.00 0.00 54.13 54.02 2jrp s LEU 30 Cb -0.23 -2.37 0.02 0.00 0.03 0.00 0.00 46.19 43.65 2jrp s LEU 30 CO 0.20 0.33 -0.03 -1.58 0.23 0.00 0.00 176.35 175.50 2jrp s GLN 31 N -1.54 0.88 -0.58 1.70 2.00 -0.25 -4.86 119.66 117.00 2jrp s GLN 31 Ca 0.22 -0.05 -0.28 0.00 -2.00 0.00 0.00 55.36 53.26 2jrp s GLN 31 Cb -0.12 -1.05 0.01 0.00 0.80 0.00 0.00 33.01 32.65 2jrp s GLN 31 CO 0.12 -0.21 1.47 0.00 -0.50 0.00 0.00 175.29 176.18 2jrp s ALA 32 N 1.51 2.71 0.21 1.58 0.00 -1.26 -0.44 121.76 126.07 2jrp s ALA 32 Ca -0.01 -0.73 0.08 0.00 0.00 0.00 0.00 51.96 51.30 2jrp s ALA 32 Cb -0.13 -4.15 -0.04 0.00 0.00 0.00 0.00 23.12 18.80 2jrp s ALA 32 CO -0.04 -3.11 -0.02 -1.17 0.00 0.00 0.00 175.76 171.43 2jrp s LEU 33 N 6.48 3.20 -0.05 0.00 2.96 0.65 -4.65 118.68 127.27 2jrp s LEU 33 Ca 0.53 -0.52 -0.07 0.00 -0.22 0.00 0.00 54.13 53.85 2jrp s LEU 33 Cb -0.11 -1.82 -0.04 0.00 0.50 0.00 0.00 46.19 44.72 2jrp s LEU 33 CO 0.23 0.06 0.22 0.00 -1.32 0.00 0.00 176.35 175.54 2jrp h PRO 35 N 4.47 0.22 0.00 0.00 0.11 -1.94 -3.02 132.00 131.83 2jrp h PRO 35 Ca -0.52 -0.01 -0.32 0.00 0.11 0.00 0.00 66.00 65.26 2jrp h PRO 35 Cb 1.21 -0.05 -0.06 0.00 0.11 0.00 0.00 31.00 32.21 2jrp h PRO 35 CO 0.63 0.14 -2.20 -0.40 -0.21 0.00 0.00 178.00 175.95 2jrp n ASP 36 N -4.42 1.31 -4.22 -2.05 5.75 -1.26 -4.97 116.55 106.68 2jrp n ASP 36 Ca 0.15 -0.04 -0.30 0.00 -0.01 0.00 0.00 54.79 54.58 2jrp n ASP 36 Cb 0.66 0.47 -0.16 0.00 -1.03 0.00 0.00 41.12 41.05 2jrp n ASP 36 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2jrp n ARG 38 N 3.10 2.32 0.10 0.00 1.74 -1.26 -2.55 116.66 120.11 2jrp n ARG 38 Ca -0.18 -2.58 0.00 0.00 -0.77 0.00 0.00 57.85 54.32 2jrp n ARG 38 Cb 0.52 -1.60 0.00 0.00 -1.02 0.00 0.00 32.46 30.36 2jrp n ARG 38 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 2jrp n GLN 39 N -0.76 0.00 0.00 5.56 6.02 -1.26 -4.94 117.38 122.00 2jrp n GLN 39 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.16 2jrp n GLN 39 Cb 0.71 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.97 2jrp n GLN 39 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 2jrp n PRO 40 N -3.04 0.62 -2.93 -1.09 -0.02 -1.26 -4.79 135.00 122.49 2jrp n PRO 40 Ca 0.00 0.00 -0.40 0.00 -2.02 0.00 0.00 63.50 61.08 2jrp n PRO 40 Cb 0.00 -1.25 -0.05 0.00 -0.02 0.00 0.00 33.50 32.18 2jrp n PRO 40 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2jrp s LEU 41 N 0.00 4.40 0.21 2.45 1.02 -1.26 -4.61 118.68 120.88 2jrp s LEU 41 Ca 0.00 1.44 -0.24 0.00 0.02 0.00 0.00 54.13 55.35 2jrp s LEU 41 Cb 0.00 -3.28 -0.08 0.00 0.02 0.00 0.00 46.19 42.85 2jrp s LEU 41 CO 0.00 -0.07 0.78 -1.10 0.02 0.00 0.00 176.35 175.98 2jrp s GLN 42 N 0.37 4.47 -0.72 1.70 -1.52 -1.20 -4.76 119.66 118.00 2jrp s GLN 42 Ca 0.41 1.09 -0.22 0.00 -1.95 0.00 0.00 55.36 54.69 2jrp s GLN 42 Cb -0.20 -3.07 0.08 0.00 -0.22 0.00 0.00 33.01 29.60 2jrp s GLN 42 CO 0.23 0.47 0.99 0.08 -0.25 0.00 0.00 175.29 176.82 2jrp s VAL 43 N -1.33 4.43 -0.29 1.09 1.01 -1.26 -0.56 120.40 123.48 2jrp s VAL 43 Ca 0.40 -0.66 -0.22 0.00 0.00 0.00 0.00 61.98 61.50 2jrp s VAL 43 Cb -0.20 -4.70 -0.01 0.00 0.00 0.00 0.00 36.38 31.47 2jrp s VAL 43 CO 0.24 -1.46 0.71 -0.76 0.00 0.00 0.00 175.10 173.83 2jrp s LEU 44 N 3.72 4.11 -0.30 3.92 1.43 0.53 -4.89 118.68 127.19 2jrp s LEU 44 Ca 0.24 0.60 -0.12 0.00 -1.03 0.00 0.00 54.13 53.83 2jrp s LEU 44 Cb -0.14 -2.95 -0.04 0.00 0.03 0.00 0.00 46.19 43.09 2jrp s LEU 44 CO 0.05 -0.52 0.22 -0.54 0.23 0.00 0.00 176.35 175.79 2jrp s LYS 45 N 2.75 3.78 -1.07 1.70 1.02 -1.26 -0.31 119.74 126.35 2jrp s LYS 45 Ca 0.29 -0.43 -0.13 0.00 0.02 0.00 0.00 55.97 55.72 2jrp s LYS 45 Cb -0.15 -3.72 0.21 0.00 -0.52 0.00 0.00 37.83 33.66 2jrp s LYS 45 CO 0.11 -0.28 1.17 0.00 -0.92 0.00 0.00 175.35 175.43 2jrp s ALA 46 N 1.76 4.16 0.00 5.17 0.00 0.14 -4.84 121.76 128.15 2jrp s ALA 46 Ca 0.07 -3.42 0.00 0.00 0.00 0.00 0.00 51.96 48.61 2jrp s ALA 46 Cb -0.16 -3.83 0.00 0.00 0.00 0.00 0.00 23.12 19.12 2jrp s ALA 46 CO 0.11 -2.54 0.00 0.00 0.00 0.00 0.00 175.76 173.33 2jrp n GLY 48 N 0.00 0.22 3.84 0.00 0.00 -1.26 -5.05 105.19 102.94 2jrp n GLY 48 Ca 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 2jrp n GLY 48 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2jrp s ALA 49 N -1.27 3.48 -0.07 4.61 0.00 -0.77 -5.08 121.76 122.66 2jrp s ALA 49 Ca 0.00 -0.04 0.03 0.00 0.00 0.00 0.00 51.96 51.95 2jrp s ALA 49 Cb 0.00 -2.64 -0.02 0.00 0.00 0.00 0.00 23.12 20.46 2jrp s ALA 49 CO 0.00 0.40 -0.15 0.14 0.00 0.00 0.00 175.76 176.16 2jrp s VAL 50 N -1.64 2.99 -0.07 0.00 -7.23 -1.26 0.24 120.40 113.42 2jrp s VAL 50 Ca 0.44 -0.74 -0.00 0.00 -1.81 0.00 0.00 61.98 59.87 2jrp s VAL 50 Cb -0.14 -2.18 0.02 0.00 0.56 0.00 0.00 36.38 34.64 2jrp s VAL 50 CO 0.20 0.58 -0.03 -0.62 -0.31 0.00 0.00 175.10 174.91 2jrp s ASP 51 N -0.46 1.55 -0.31 4.85 2.15 0.58 -4.97 116.67 120.05 2jrp s ASP 51 Ca 0.06 -0.16 -0.24 0.00 0.43 0.00 0.00 52.55 52.65 2jrp s ASP 51 Cb -0.12 -0.55 0.00 0.00 -0.30 0.00 0.00 42.92 41.95 2jrp s ASP 51 CO 0.02 -0.13 0.79 -0.31 -0.17 0.00 0.00 175.17 175.37 2jrp s TYR 52 N 1.55 3.19 -0.29 -5.34 1.51 -1.26 -0.35 117.35 116.37 2jrp s TYR 52 Ca -0.00 0.80 0.01 0.00 -1.01 0.00 0.00 57.07 56.86 2jrp s TYR 52 Cb -0.13 -3.24 0.15 0.00 -0.11 0.00 0.00 41.96 38.62 2jrp s TYR 52 CO -0.04 -0.58 0.34 0.12 -1.11 0.00 0.00 175.55 174.28 2jrp s PHE 53 N 2.98 -0.67 -1.05 2.71 5.36 0.28 -4.85 117.98 122.74 2jrp s PHE 53 Ca 0.33 -0.01 -0.22 0.00 -0.96 0.00 0.00 56.93 56.06 2jrp s PHE 53 Cb -0.14 -0.34 0.04 0.00 -0.34 0.00 0.00 43.02 42.24 2jrp s PHE 53 CO 0.13 -0.95 1.56 0.00 -1.46 0.00 0.00 175.22 174.50 2jrp h GLN 55 N 9.63 0.27 -5.11 0.00 4.20 -1.86 0.46 115.11 122.70 2jrp h GLN 55 Ca 0.23 -0.34 -0.65 0.00 0.06 0.00 0.00 58.65 57.94 2jrp h GLN 55 Cb 0.99 0.11 -0.26 0.00 0.30 0.00 0.00 27.48 28.62 2jrp h GLN 55 CO 1.41 1.07 -0.71 -0.80 -0.67 0.00 0.00 178.83 179.13 2jrp s ASN 56 N -7.02 4.41 0.00 1.46 0.01 -1.26 -3.34 114.94 109.19 2jrp s ASN 56 Ca -0.04 -0.31 0.00 0.00 -0.71 0.00 0.00 52.86 51.80 2jrp s ASN 56 Cb 0.09 -1.74 0.00 0.00 0.41 0.00 0.00 41.25 40.01 2jrp s ASN 56 CO 0.85 0.05 0.00 0.61 -1.51 0.00 0.00 177.10 177.11 2jrp n GLY 57 N 4.32 0.78 0.52 0.66 0.00 -1.26 -4.77 105.19 105.44 2jrp n GLY 57 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.84 2jrp n GLY 57 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 2jrp n HIS 58 N -1.45 -0.65 0.00 1.61 -0.00 -1.26 -4.97 115.22 108.50 2jrp n HIS 58 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2jrp n HIS 58 Cb 0.00 0.13 0.00 0.00 -0.00 0.00 0.00 29.99 30.12 2jrp n HIS 58 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2jrp n GLY 59 N -1.24 3.75 3.70 1.57 0.00 0.16 -4.99 105.19 108.14 2jrp n GLY 59 Ca 0.00 -1.75 -0.44 0.00 0.00 0.00 0.00 46.02 43.84 2jrp n GLY 59 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2jrp n LEU 60 N 0.00 3.65 -4.86 0.99 -0.00 -1.25 -4.46 117.00 111.06 2jrp n LEU 60 Ca 0.00 1.09 -0.24 0.00 -0.00 0.00 0.00 56.01 56.86 2jrp n LEU 60 Cb 0.00 -1.51 -0.04 0.00 -0.00 0.00 0.00 43.42 41.87 2jrp n LEU 60 CO 0.00 -0.06 -0.15 -0.63 -0.00 0.00 0.00 177.39 176.56 2jrp s ILE 61 N 0.77 4.75 -0.15 1.47 1.09 -1.26 -5.07 121.20 122.80 2jrp s ILE 61 Ca 0.74 -1.11 -0.29 0.00 -1.10 0.00 0.00 60.65 58.89 2jrp s ILE 61 Cb -0.58 -3.51 -0.02 0.00 -1.06 0.00 0.00 42.46 37.29 2jrp s ILE 61 CO 0.39 -0.23 1.36 -0.55 -0.10 0.00 0.00 174.94 175.80 2jrp s SER 62 N -3.54 6.86 0.00 3.58 0.15 -1.26 -4.87 113.70 114.63 2jrp s SER 62 Ca 0.33 1.79 0.04 0.00 0.70 0.00 0.00 55.95 58.80 2jrp s SER 62 Cb -0.09 -2.54 0.22 0.00 -1.71 0.00 0.00 66.02 61.90 2jrp s SER 62 CO 0.26 -0.82 0.85 2.29 1.20 0.00 0.00 173.24 177.02 2jrp n LYS 63 N 6.77 0.68 0.00 5.44 -0.00 -1.26 0.01 118.16 129.80 2jrp n LYS 63 Ca 0.15 0.00 0.12 0.00 -0.00 0.00 0.00 58.31 58.57 2jrp n LYS 63 Cb 0.44 -1.08 0.16 0.00 -0.00 0.00 0.00 35.03 34.55 2jrp n LYS 63 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2jrp n LYS 64 N -0.58 0.37 -0.00 -1.58 5.02 -1.26 -4.27 118.16 115.86 2jrp n LYS 64 Ca 0.03 -0.26 0.02 0.00 -2.02 0.00 0.00 58.31 56.08 2jrp n LYS 64 Cb 0.01 -1.49 -0.04 0.00 -0.02 0.00 0.00 35.03 33.49 2jrp n LYS 64 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2jrp n ARG 65 N -1.09 1.96 -1.76 1.97 5.12 0.10 -5.04 116.66 117.93 2jrp n ARG 65 Ca 0.07 -0.03 -0.39 0.00 -1.93 0.00 0.00 57.85 55.57 2jrp n ARG 65 Cb 0.36 -0.99 0.03 0.00 -1.16 0.00 0.00 32.46 30.70 2jrp n ARG 65 CO 0.00 0.00 0.00 0.14 -1.93 0.00 0.00 177.63 175.84 2jrp s VAL 66 N -2.04 2.01 -0.53 1.55 -7.23 -0.88 -4.91 120.40 108.36 2jrp s VAL 66 Ca -0.01 0.01 -0.16 0.00 -1.81 0.00 0.00 61.98 60.01 2jrp s VAL 66 Cb 0.03 -3.00 0.11 0.00 0.56 0.00 0.00 36.38 34.08 2jrp s VAL 66 CO 0.21 0.00 0.50 0.20 -0.31 0.00 0.00 175.10 175.70 2jrp s ASN 67 N -0.64 6.18 -0.62 4.85 0.02 -0.39 -4.91 114.94 119.43 2jrp s ASN 67 Ca 0.65 -1.59 -0.27 0.00 -1.02 0.00 0.00 52.86 50.63 2jrp s ASN 67 Cb -0.43 -2.22 0.01 0.00 0.02 0.00 0.00 41.25 38.63 2jrp s ASN 67 CO 0.54 -0.83 1.48 -0.36 0.02 0.00 0.00 177.10 177.95 2jrp s PHE 68 N 1.76 2.14 0.09 2.20 0.40 -1.26 -0.25 117.98 123.06 2jrp s PHE 68 Ca 0.05 0.39 -0.03 0.00 -0.60 0.00 0.00 56.93 56.73 2jrp s PHE 68 Cb -0.27 -4.39 -0.05 0.00 0.51 0.00 0.00 43.02 38.82 2jrp s PHE 68 CO 0.05 -2.10 0.29 0.14 0.70 0.00 0.00 175.22 174.30 2jrp s VAL 69 N 6.65 5.28 -0.21 -0.44 -7.23 0.42 -4.81 120.40 120.05 2jrp s VAL 69 Ca 0.51 -0.10 -0.25 0.00 -1.81 0.00 0.00 61.98 60.33 2jrp s VAL 69 Cb -0.11 -3.61 -0.01 0.00 0.56 0.00 0.00 36.38 33.21 2jrp s VAL 69 CO 0.21 0.14 0.84 -0.63 -0.31 0.00 0.00 175.10 175.35 2jrp s ILE 70 N -1.53 4.85 -1.23 -0.62 1.01 -1.26 -1.09 121.20 121.32 2jrp s ILE 70 Ca 0.36 1.61 -0.17 0.00 0.00 0.00 0.00 60.65 62.44 2jrp s ILE 70 Cb -0.13 -4.13 0.10 0.00 0.01 0.00 0.00 42.46 38.31 2jrp s ILE 70 CO 0.24 -0.03 1.60 -0.44 0.00 0.00 0.00 174.94 176.31 2jrp s SER 71 N 1.26 6.86 -0.03 3.58 0.01 -0.10 -4.49 113.70 120.78 2jrp s SER 71 Ca 0.36 -2.47 0.10 0.00 1.31 0.00 0.00 55.95 55.25 2jrp s SER 71 Cb -0.16 -2.53 -0.15 0.00 0.21 0.00 0.00 66.02 63.40 2jrp s SER 71 CO 0.09 -1.09 0.18 -0.90 0.41 0.00 0.00 173.24 171.94 2jrp n ASP 72 N 7.66 2.72 -4.30 2.44 5.75 -1.26 -4.60 116.55 124.96 2jrp n ASP 72 Ca 0.43 0.00 -0.44 0.00 -0.01 0.00 0.00 54.79 54.77 2jrp n ASP 72 Cb 0.46 1.32 0.00 0.00 -1.03 0.00 0.00 41.12 41.87 2jrp n ASP 72 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2jrp n GLN 73 N -1.94 3.46 -0.00 0.11 1.13 -1.26 -4.54 117.38 114.33 2jrp n GLN 73 Ca -0.04 -3.79 0.07 0.00 -1.94 0.00 0.00 57.00 51.30 2jrp n GLN 73 Cb 0.36 -2.99 -0.10 0.00 0.11 0.00 0.00 30.24 27.61 2jrp n GLN 73 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 2jrp n LEU 74 N 5.05 0.28 -4.77 1.08 7.94 -1.26 -4.96 117.00 120.35 2jrp n LEU 74 Ca 0.37 -0.20 -0.38 0.00 -1.11 0.00 0.00 56.01 54.69 2jrp n LEU 74 Cb 0.41 0.00 -0.06 0.00 0.53 0.00 0.00 43.42 44.30 2jrp n LEU 74 CO 0.67 0.07 0.67 -1.61 -1.11 0.00 0.00 177.39 176.08 2jrp s GLU 75 N -2.78 4.59 -0.87 1.96 8.01 -1.26 -3.99 118.70 124.35 2jrp s GLU 75 Ca -0.01 1.41 -0.03 0.00 0.01 0.00 0.00 54.97 56.35 2jrp s GLU 75 Cb 0.10 -2.88 -0.03 0.00 -4.31 0.00 0.00 34.13 27.01 2jrp s GLU 75 CO 0.62 0.27 0.79 1.58 0.01 0.00 0.00 175.26 178.53 2jrp n HIS 76 N 0.70 -2.74 -1.96 1.61 -0.00 -1.26 -4.90 115.22 106.66 2jrp n HIS 76 Ca 0.01 1.01 -0.42 0.00 0.46 0.00 0.00 57.72 58.78 2jrp n HIS 76 Cb 0.49 -4.08 -0.03 0.00 -0.12 0.00 0.00 29.99 26.25 2jrp n HIS 76 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2jrp s HIS 77 N -3.16 3.07 -0.21 1.57 2.46 -1.26 -4.86 115.29 112.90 2jrp s HIS 77 Ca 0.19 0.70 -0.30 0.00 0.47 0.00 0.00 55.06 56.12 2jrp s HIS 77 Cb -0.03 -3.90 -0.07 0.00 -0.13 0.00 0.00 32.58 28.46 2jrp s HIS 77 CO 0.75 -3.25 2.19 0.72 -2.47 0.00 0.00 174.74 172.68 2jrp n HIS 78 N 3.77 1.96 -3.52 3.88 8.25 -1.26 -4.91 115.22 123.38 2jrp n HIS 78 Ca 0.13 -0.08 -0.10 0.00 -0.26 0.00 0.00 57.72 57.41 2jrp n HIS 78 Cb 0.39 -2.70 -0.02 0.00 1.12 0.00 0.00 29.99 28.78 2jrp n HIS 78 CO 0.00 0.00 0.00 -3.38 0.64 0.00 0.00 176.34 173.60 2jrp s HIS 79 N 7.71 -0.41 -0.17 4.41 -3.43 -1.26 -5.08 115.29 117.05 2jrp s HIS 79 Ca 1.01 0.18 -0.07 0.00 -0.80 0.00 0.00 55.06 55.38 2jrp s HIS 79 Cb -0.44 0.58 -0.22 0.00 -1.43 0.00 0.00 32.58 31.06 2jrp s HIS 79 CO 0.39 -0.83 0.18 1.58 -2.00 0.00 0.00 174.74 174.06 2jrp n HIS 80 N -0.36 0.89 -1.59 0.38 -0.00 -1.26 -5.23 115.22 108.05 2jrp n HIS 80 Ca -0.12 0.22 0.00 0.00 0.46 0.00 0.00 57.72 58.28 2jrp n HIS 80 Cb 0.63 -1.11 0.00 0.00 -0.12 0.00 0.00 29.99 29.39 2jrp n HIS 80 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38