#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jns h SER 2 N 0.00 0.00 -4.45 1.61 0.02 -2.15 -3.42 113.55 105.16 2jns h SER 2 Ca 0.00 0.00 -0.35 0.00 -0.84 0.00 0.00 61.79 60.60 2jns h SER 2 Cb 0.00 0.00 -0.14 0.00 0.14 0.00 0.00 62.40 62.40 2jns h SER 2 CO 0.00 0.00 -0.62 -0.44 -1.14 0.00 0.00 176.83 174.63 2jns s SER 3 N -6.36 1.23 -0.03 3.07 0.01 -1.26 -5.18 113.70 105.19 2jns s SER 3 Ca -0.05 -1.36 -0.31 0.00 1.31 0.00 0.00 55.95 55.54 2jns s SER 3 Cb 0.16 0.15 0.12 0.00 0.21 0.00 0.00 66.02 66.66 2jns s SER 3 CO 0.58 -0.71 1.27 -0.83 0.41 0.00 0.00 173.24 173.96 2jns s GLY 4 N -3.31 -0.40 0.05 3.44 0.00 -1.26 -5.20 107.32 100.64 2jns s GLY 4 Ca 0.36 0.75 -0.27 0.00 0.00 0.00 0.00 44.72 45.57 2jns s GLY 4 CO 0.13 0.15 0.80 -0.56 0.00 0.00 0.00 173.10 173.62 2jns s SER 5 N -2.91 -0.43 0.10 1.64 0.01 -1.26 -5.08 113.70 105.77 2jns s SER 5 Ca 0.14 -0.01 0.02 0.00 1.31 0.00 0.00 55.95 57.41 2jns s SER 5 Cb 0.04 0.46 -0.01 0.00 0.21 0.00 0.00 66.02 66.72 2jns s SER 5 CO -0.04 -0.74 0.08 -1.20 0.41 0.00 0.00 173.24 171.75 2jns n SER 6 N -0.29 -0.15 0.00 2.44 7.64 -1.26 -5.02 113.62 116.98 2jns n SER 6 Ca -0.11 -1.63 0.00 0.00 1.01 0.00 0.00 58.87 58.14 2jns n SER 6 Cb 0.63 0.47 0.00 0.00 -1.01 0.00 0.00 64.21 64.30 2jns n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2jns n GLY 7 N -0.11 0.76 3.71 0.23 0.00 -1.26 -5.12 105.19 103.40 2jns n GLY 7 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 2jns n GLY 7 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2jns s GLU 8 N 0.00 4.42 0.00 1.61 2.12 -1.26 -4.93 118.70 120.66 2jns s GLU 8 Ca 0.00 1.71 0.13 0.00 0.36 0.00 0.00 54.97 57.17 2jns s GLU 8 Cb 0.00 -3.42 0.63 0.00 0.26 0.00 0.00 34.13 31.61 2jns s GLU 8 CO 0.00 -0.29 1.35 0.45 -0.54 0.00 0.00 175.26 176.23 2jns n SER 9 N 4.28 0.00 0.01 -1.70 2.88 -1.26 -3.63 113.62 114.20 2jns n SER 9 Ca 0.09 0.19 -0.12 0.00 -1.33 0.00 0.00 58.87 57.70 2jns n SER 9 Cb 0.47 -0.33 -0.07 0.00 -0.75 0.00 0.00 64.21 63.53 2jns n SER 9 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 2jns h GLU 10 N 0.00 0.07 -0.32 -1.46 4.81 -1.97 -3.15 114.58 112.57 2jns h GLU 10 Ca 0.00 -0.01 -0.03 0.00 -0.13 0.00 0.00 59.36 59.19 2jns h GLU 10 Cb 0.14 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.49 2jns h GLU 10 CO 0.00 0.12 0.07 1.49 -0.73 0.00 0.00 179.01 179.96 2jns h GLU 11 N -0.00 0.46 -0.00 1.92 4.81 -2.00 -2.78 114.58 116.98 2jns h GLU 11 Ca 0.02 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 2jns h GLU 11 Cb 0.07 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.37 2jns h GLU 11 CO -0.00 0.44 -0.14 -0.85 -0.73 0.00 0.00 179.01 177.72 2jns n GLU 12 N -4.36 0.53 -0.54 1.92 0.28 -1.20 -4.05 120.64 113.22 2jns n GLU 12 Ca 0.01 -0.18 0.04 0.00 -0.16 0.00 0.00 57.16 56.87 2jns n GLU 12 Cb 0.18 -1.50 0.06 0.00 1.43 0.00 0.00 31.44 31.61 2jns n GLU 12 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2jns n ASP 13 N -1.08 0.90 -0.33 -1.84 2.03 -1.10 -4.92 116.55 110.21 2jns n ASP 13 Ca 0.12 -2.43 0.06 0.00 0.52 0.00 0.00 54.79 53.07 2jns n ASP 13 Cb 0.29 -0.30 0.15 0.00 -0.72 0.00 0.00 41.12 40.55 2jns n ASP 13 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2jns h LYS 14 N 0.22 0.01 -0.42 -0.67 1.57 -1.64 -3.41 116.57 112.23 2jns h LYS 14 Ca -0.03 -0.00 0.23 0.00 -1.87 0.00 0.00 60.65 58.98 2jns h LYS 14 Cb 1.34 -0.00 -0.23 0.00 0.08 0.00 0.00 32.23 33.42 2jns h LYS 14 CO 0.01 0.00 0.25 0.00 -0.57 0.00 0.00 179.45 179.15 2jns s LYS 16 N 2.65 2.76 1.05 0.00 1.02 -1.26 -4.91 119.74 121.06 2jns s LYS 16 Ca -0.02 1.13 -0.12 0.00 0.02 0.00 0.00 55.97 56.98 2jns s LYS 16 Cb -0.07 -1.96 0.22 0.00 -0.52 0.00 0.00 37.83 35.50 2jns s LYS 16 CO -0.13 -1.25 1.07 -1.25 -0.92 0.00 0.00 175.35 172.87 2jns s PRO 17 N -4.70 -0.03 -0.13 -1.68 0.04 -1.26 -4.70 135.00 122.54 2jns s PRO 17 Ca 0.61 0.79 0.00 0.00 0.04 0.00 0.00 61.00 62.44 2jns s PRO 17 Cb -0.16 -1.66 0.02 0.00 0.04 0.00 0.00 34.50 32.74 2jns s PRO 17 CO 0.50 -3.11 -0.12 -1.64 0.04 0.00 0.00 177.00 172.67 2jns s MET 18 N -4.71 2.00 0.88 4.56 -1.94 -1.26 -5.06 119.30 113.77 2jns s MET 18 Ca 0.67 -0.44 -0.12 0.00 -1.71 0.00 0.00 55.69 54.08 2jns s MET 18 Cb -0.22 -1.89 0.12 0.00 2.01 0.00 0.00 34.83 34.85 2jns s MET 18 CO 0.61 -0.23 1.13 -1.12 -0.01 0.00 0.00 175.02 175.40 2jns s SER 19 N 1.52 3.77 0.24 3.03 0.01 -1.26 -4.87 113.70 116.14 2jns s SER 19 Ca 0.04 1.00 -0.06 0.00 1.31 0.00 0.00 55.95 58.24 2jns s SER 19 Cb -0.13 -1.60 0.23 0.00 0.21 0.00 0.00 66.02 64.73 2jns s SER 19 CO -0.09 -2.39 1.87 0.22 0.41 0.00 0.00 173.24 173.26 2jns h TYR 20 N -1.38 1.23 -0.26 2.43 3.20 -2.00 -2.13 116.97 118.05 2jns h TYR 20 Ca -0.50 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 61.31 2jns h TYR 20 Cb 1.32 -0.40 -0.01 0.00 1.54 0.00 0.00 36.73 39.18 2jns h TYR 20 CO 0.32 0.84 -0.04 0.93 -1.64 0.00 0.00 178.16 178.58 2jns h GLU 21 N 1.27 0.40 0.24 1.82 4.39 -1.98 -0.11 114.58 120.60 2jns h GLU 21 Ca 0.32 -0.08 -0.01 0.00 0.34 0.00 0.00 59.36 59.93 2jns h GLU 21 Cb 0.01 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 28.60 2jns h GLU 21 CO -0.05 0.46 -0.11 0.93 -1.16 0.00 0.00 179.01 179.08 2jns h GLU 22 N 0.39 -0.31 -0.66 2.33 4.39 -1.77 -0.09 114.58 118.86 2jns h GLU 22 Ca 0.08 0.02 0.09 0.00 0.34 0.00 0.00 59.36 59.90 2jns h GLU 22 Cb 0.32 0.07 -0.07 0.00 -0.10 0.00 0.00 28.75 28.97 2jns h GLU 22 CO 0.01 0.04 0.30 0.87 -1.16 0.00 0.00 179.01 179.08 2jns h LYS 23 N -0.71 0.51 -0.04 2.33 1.57 -1.19 0.09 116.57 119.13 2jns h LYS 23 Ca -0.03 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.71 2jns h LYS 23 Cb 0.49 -0.11 -0.00 0.00 0.08 0.00 0.00 32.23 32.68 2jns h LYS 23 CO 0.05 0.34 -0.01 0.00 -0.57 0.00 0.00 179.45 179.26 2jns h ARG 24 N 0.52 0.07 -0.72 3.15 2.47 -0.98 -2.59 114.38 116.30 2jns h ARG 24 Ca 0.33 -0.03 0.10 0.00 -1.26 0.00 0.00 59.98 59.12 2jns h ARG 24 Cb 0.36 -0.01 -0.07 0.00 -1.65 0.00 0.00 29.97 28.60 2jns h ARG 24 CO -0.28 0.40 0.35 0.37 0.56 0.00 0.00 179.97 181.38 2jns h GLN 25 N -0.26 0.57 -0.78 0.04 5.75 -0.33 0.39 115.11 120.48 2jns h GLN 25 Ca 0.01 -0.03 0.04 0.00 -0.15 0.00 0.00 58.65 58.52 2jns h GLN 25 Cb 0.37 -0.13 -0.05 0.00 1.07 0.00 0.00 27.48 28.74 2jns h GLN 25 CO 0.00 0.38 0.51 1.25 -2.65 0.00 0.00 178.83 178.33 2jns h LEU 26 N 0.59 0.81 -0.62 -2.39 5.85 -0.96 -1.45 115.31 117.14 2jns h LEU 26 Ca 0.36 -0.01 -0.03 0.00 0.84 0.00 0.00 57.88 59.04 2jns h LEU 26 Cb 0.41 -0.18 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 2jns h LEU 26 CO -0.29 0.55 0.27 -1.28 -0.34 0.00 0.00 178.44 177.35 2jns h SER 27 N 0.93 0.84 0.48 1.25 0.87 -0.52 -0.77 113.55 116.63 2jns h SER 27 Ca 0.32 -0.16 -0.02 0.00 -1.23 0.00 0.00 61.79 60.70 2jns h SER 27 Cb 0.09 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 61.83 2jns h SER 27 CO -0.10 0.76 -0.26 -0.07 -0.53 0.00 0.00 176.83 176.63 2jns h LEU 28 N 0.86 -0.64 -1.34 2.23 -0.00 -0.77 0.23 115.31 115.88 2jns h LEU 28 Ca 0.21 0.03 -0.01 0.00 -0.00 0.00 0.00 57.88 58.11 2jns h LEU 28 Cb 0.17 0.18 -0.03 0.00 -0.00 0.00 0.00 40.66 40.99 2jns h LEU 28 CO -0.02 -0.43 0.31 0.44 -0.00 0.00 0.00 178.44 178.74 2jns h ASP 29 N -0.69 0.68 -0.65 -0.43 3.32 -1.40 -1.10 116.42 116.14 2jns h ASP 29 Ca -0.06 -0.04 -0.03 0.00 0.02 0.00 0.00 57.03 56.91 2jns h ASP 29 Cb 0.55 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.90 2jns h ASP 29 CO 0.08 0.54 0.28 0.40 -1.72 0.00 0.00 179.24 178.82 2jns h ILE 30 N 0.77 1.23 0.00 0.35 2.04 -0.82 -1.94 117.51 119.15 2jns h ILE 30 Ca 0.20 -0.70 0.00 0.00 1.00 0.00 0.00 64.86 65.36 2jns h ILE 30 Cb 0.01 0.48 0.00 0.00 -0.74 0.00 0.00 36.82 36.57 2jns h ILE 30 CO -0.03 0.28 0.00 0.59 0.00 0.00 0.00 178.15 178.99 2jns n ASN 31 N -4.44 0.48 -0.05 1.72 3.02 0.04 -1.66 115.26 114.38 2jns n ASN 31 Ca 0.05 0.65 0.12 0.00 -0.03 0.00 0.00 54.58 55.37 2jns n ASN 31 Cb 0.15 -0.74 0.26 0.00 -0.61 0.00 0.00 39.78 38.84 2jns n ASN 31 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2jns n LYS 32 N -2.07 0.15 -2.48 3.52 4.76 -0.73 -4.95 118.16 116.36 2jns n LYS 32 Ca 0.01 -0.09 -0.40 0.00 -2.87 0.00 0.00 58.31 54.96 2jns n LYS 32 Cb 0.15 -1.50 -0.04 0.00 -1.84 0.00 0.00 35.03 31.80 2jns n LYS 32 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2jns s LEU 33 N -2.91 4.55 0.65 -0.35 1.43 -0.66 -5.04 118.68 116.36 2jns s LEU 33 Ca 0.13 2.26 -0.15 0.00 -1.03 0.00 0.00 54.13 55.34 2jns s LEU 33 Cb 0.18 -3.63 -0.00 0.00 0.03 0.00 0.00 46.19 42.77 2jns s LEU 33 CO 0.67 -0.14 1.12 -2.16 0.23 0.00 0.00 176.35 176.08 2jns s PRO 34 N -1.44 2.81 0.20 1.29 0.04 -1.26 -4.67 135.00 131.97 2jns s PRO 34 Ca 0.44 1.43 -0.16 0.00 0.04 0.00 0.00 61.00 62.75 2jns s PRO 34 Cb -0.32 -1.95 0.18 0.00 0.04 0.00 0.00 34.50 32.46 2jns s PRO 34 CO 0.41 -1.24 1.62 0.78 0.04 0.00 0.00 177.00 178.60 2jns h GLY 35 N 0.11 0.26 2.00 0.56 0.00 -1.99 0.12 103.07 104.13 2jns h GLY 35 Ca -0.47 0.26 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 2jns h GLY 35 CO 0.54 -0.23 -0.03 1.05 0.00 0.00 0.00 176.54 177.87 2jns h GLU 36 N -0.06 0.00 0.00 4.80 9.09 -2.02 -2.27 114.58 124.11 2jns h GLU 36 Ca 0.26 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.67 2jns h GLU 36 Cb 0.47 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.57 2jns h GLU 36 CO -0.62 0.03 -1.79 1.63 0.05 0.00 0.00 179.01 178.31 2jns n LYS 37 N -3.30 0.56 -0.06 1.06 5.02 0.01 -4.41 118.16 117.04 2jns n LYS 37 Ca -0.02 -0.15 -0.15 0.00 -2.02 0.00 0.00 58.31 55.97 2jns n LYS 37 Cb 0.17 -1.54 -0.06 0.00 -0.02 0.00 0.00 35.03 33.59 2jns n LYS 37 CO 0.00 0.00 0.00 1.25 -0.52 0.00 0.00 177.40 178.13 2jns h LEU 38 N 0.00 0.72 0.00 -0.35 6.46 -0.26 -3.06 115.31 118.81 2jns h LEU 38 Ca 0.00 -0.54 0.00 0.00 -0.12 0.00 0.00 57.88 57.22 2jns h LEU 38 Cb 0.93 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 40.65 2jns h LEU 38 CO 0.00 1.13 0.00 0.61 -0.62 0.00 0.00 178.44 179.56 2jns n GLY 39 N 0.40 -0.29 0.13 3.75 0.00 -1.15 -0.62 105.19 107.41 2jns n GLY 39 Ca -0.06 -0.01 0.12 0.00 0.00 0.00 0.00 46.02 46.07 2jns n GLY 39 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 2jns h ARG 40 N 0.00 0.00 0.35 1.61 9.65 -1.78 -3.38 114.38 120.82 2jns h ARG 40 Ca 0.00 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 58.86 2jns h ARG 40 Cb 0.02 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.60 2jns h ARG 40 CO 0.00 0.00 -0.17 0.28 2.80 0.00 0.00 179.97 182.88 2jns h VAL 41 N 0.00 0.67 -0.96 0.20 2.07 -1.01 -3.05 116.25 114.18 2jns h VAL 41 Ca 0.00 -0.26 0.19 0.00 0.82 0.00 0.00 66.70 67.44 2jns h VAL 41 Cb 1.00 0.81 -0.08 0.00 -1.52 0.00 0.00 31.29 31.50 2jns h VAL 41 CO 0.00 0.05 0.61 1.62 0.02 0.00 0.00 177.57 179.87 2jns h VAL 42 N -0.61 0.71 0.00 2.57 3.04 -1.74 0.91 116.25 121.14 2jns h VAL 42 Ca -0.05 -0.21 -0.02 0.00 -1.01 0.00 0.00 66.70 65.41 2jns h VAL 42 Cb 0.44 0.05 -0.00 0.00 -2.01 0.00 0.00 31.29 29.77 2jns h VAL 42 CO 0.08 0.11 -0.10 0.45 -1.01 0.00 0.00 177.57 177.10 2jns h HIS 43 N 0.61 0.00 -0.36 3.17 -0.00 -1.71 -1.53 115.15 115.33 2jns h HIS 43 Ca 0.52 0.00 -0.13 0.00 -0.00 0.00 0.00 60.37 60.76 2jns h HIS 43 Cb 0.99 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.39 2jns h HIS 43 CO -0.00 0.10 -0.29 0.82 -0.00 0.00 0.00 177.93 178.56 2jns h ILE 44 N 0.00 1.28 -0.53 2.45 2.04 -0.84 -2.70 117.51 119.22 2jns h ILE 44 Ca -0.00 -1.45 -0.05 0.00 1.00 0.00 0.00 64.86 64.36 2jns h ILE 44 Cb 0.22 1.40 -0.02 0.00 -0.74 0.00 0.00 36.82 37.68 2jns h ILE 44 CO 0.01 0.48 0.15 0.40 0.00 0.00 0.00 178.15 179.19 2jns h ILE 45 N 0.64 1.24 -0.09 -0.67 5.03 -1.32 -1.95 117.51 120.38 2jns h ILE 45 Ca 0.07 -0.83 0.03 0.00 -0.12 0.00 0.00 64.86 64.01 2jns h ILE 45 Cb 0.87 0.77 -0.00 0.00 -3.03 0.00 0.00 36.82 35.43 2jns h ILE 45 CO 0.08 0.30 0.10 1.56 -0.68 0.00 0.00 178.15 179.51 2jns h GLN 46 N 0.73 0.00 0.00 2.37 4.20 -1.31 0.25 115.11 121.35 2jns h GLN 46 Ca 0.17 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.88 2jns h GLN 46 Cb 0.31 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.09 2jns h GLN 46 CO -0.00 0.00 0.00 1.03 -0.67 0.00 0.00 178.83 179.19 2jns h SER 47 N 0.00 0.00 0.00 1.46 0.87 -1.02 -3.25 113.55 111.61 2jns h SER 47 Ca 0.04 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.49 2jns h SER 47 Cb 0.25 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.19 2jns h SER 47 CO -0.00 0.00 -1.44 0.54 -0.53 0.00 0.00 176.83 175.40 2jns n ARG 48 N -2.42 2.86 -3.59 2.24 5.12 0.60 -4.91 116.66 116.55 2jns n ARG 48 Ca 0.02 -0.01 -0.40 0.00 -1.93 0.00 0.00 57.85 55.54 2jns n ARG 48 Cb 0.27 -1.17 -0.08 0.00 -1.16 0.00 0.00 32.46 30.33 2jns n ARG 48 CO 0.00 0.00 0.00 -1.21 -1.93 0.00 0.00 177.63 174.49 2jns s GLU 49 N -2.17 2.63 0.50 5.56 0.41 0.46 -4.92 118.70 121.17 2jns s GLU 49 Ca -0.03 -2.11 0.22 0.00 -0.41 0.00 0.00 54.97 52.63 2jns s GLU 49 Cb 0.02 -3.91 1.30 0.00 -1.78 0.00 0.00 34.13 29.76 2jns s GLU 49 CO 0.27 -1.19 2.06 -1.00 -0.49 0.00 0.00 175.26 174.90 2jns h PRO 50 N 7.87 0.00 0.00 0.39 0.13 -1.88 -1.31 132.00 137.21 2jns h PRO 50 Ca -0.09 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.03 2jns h PRO 50 Cb 1.03 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.16 2jns h PRO 50 CO 0.78 0.13 -0.02 0.77 -0.23 0.00 0.00 178.00 179.44 2jns h SER 51 N 0.00 0.00 -0.01 1.44 0.02 -1.92 -2.62 113.55 110.45 2jns h SER 51 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2jns h SER 51 Cb 0.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.83 2jns h SER 51 CO 0.02 0.02 -0.28 0.18 -1.14 0.00 0.00 176.83 175.63 2jns n LEU 52 N -3.16 1.45 0.00 5.07 7.99 -0.53 -4.67 117.00 123.16 2jns n LEU 52 Ca -0.01 -0.77 0.05 0.00 -0.01 0.00 0.00 56.01 55.27 2jns n LEU 52 Cb 0.21 0.00 0.27 0.00 -0.11 0.00 0.00 43.42 43.79 2jns n LEU 52 CO 0.25 0.28 0.60 2.29 -1.51 0.00 0.00 177.39 179.30 2jns n LYS 53 N -0.17 0.17 -0.04 3.23 2.85 -0.99 -2.37 118.16 120.84 2jns n LYS 53 Ca 0.06 0.17 0.03 0.00 -1.05 0.00 0.00 58.31 57.52 2jns n LYS 53 Cb 0.28 -1.50 0.05 0.00 -0.65 0.00 0.00 35.03 33.21 2jns n LYS 53 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 2jns n ASN 54 N -1.26 1.98 -4.95 -5.58 3.02 -1.26 -5.05 115.26 102.17 2jns n ASN 54 Ca 0.05 -2.33 -0.23 0.00 -0.03 0.00 0.00 54.58 52.04 2jns n ASN 54 Cb 0.08 -0.15 -0.03 0.00 -0.61 0.00 0.00 39.78 39.07 2jns n ASN 54 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 2jns s SER 55 N -1.60 6.24 0.48 6.41 0.01 -1.00 -5.11 113.70 119.13 2jns s SER 55 Ca 0.11 0.07 -0.21 0.00 1.31 0.00 0.00 55.95 57.23 2jns s SER 55 Cb 0.10 -1.83 -0.08 0.00 0.21 0.00 0.00 66.02 64.42 2jns s SER 55 CO 0.01 -0.03 1.05 0.21 0.41 0.00 0.00 173.24 174.90 2jns s ASN 56 N -3.73 6.35 0.58 2.44 2.47 -1.26 -4.94 114.94 116.84 2jns s ASN 56 Ca 0.34 1.99 0.36 0.00 0.42 0.00 0.00 52.86 55.96 2jns s ASN 56 Cb -0.10 -2.57 1.68 0.00 -1.45 0.00 0.00 41.25 38.81 2jns s ASN 56 CO 0.28 -0.78 2.11 1.55 -3.72 0.00 0.00 177.10 176.54 2jns h PRO 57 N 1.71 0.00 -0.28 0.43 0.13 -1.96 -1.82 132.00 130.21 2jns h PRO 57 Ca -0.49 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.64 2jns h PRO 57 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2jns h PRO 57 CO 0.59 0.03 0.00 -3.47 -0.23 0.00 0.00 178.00 174.92 2jns n ASP 58 N -3.18 2.66 -0.04 1.44 2.03 -1.26 -3.98 116.55 114.21 2jns n ASP 58 Ca -0.01 -1.88 0.00 0.00 0.52 0.00 0.00 54.79 53.43 2jns n ASP 58 Cb 0.23 -0.18 0.01 0.00 -0.72 0.00 0.00 41.12 40.46 2jns n ASP 58 CO 0.00 0.00 0.00 -0.62 -1.92 0.00 0.00 177.20 174.66 2jns n GLU 59 N 0.98 0.25 -3.73 -0.67 -0.58 -0.69 -4.97 120.64 111.23 2jns n GLU 59 Ca 0.18 -0.84 -0.38 0.00 -0.42 0.00 0.00 57.16 55.70 2jns n GLU 59 Cb 0.48 -1.02 -0.12 0.00 -0.57 0.00 0.00 31.44 30.21 2jns n GLU 59 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 2jns s ILE 60 N -0.34 4.07 0.16 -3.67 1.01 -1.18 -4.89 121.20 116.35 2jns s ILE 60 Ca 0.01 -0.79 -0.16 0.00 0.00 0.00 0.00 60.65 59.71 2jns s ILE 60 Cb 0.01 -3.17 -0.07 0.00 0.01 0.00 0.00 42.46 39.24 2jns s ILE 60 CO 0.01 -0.03 0.59 -1.61 0.00 0.00 0.00 174.94 173.91 2jns s GLU 61 N 1.49 4.06 -0.49 2.79 0.41 -1.26 -5.02 118.70 120.68 2jns s GLU 61 Ca 0.02 0.60 -0.16 0.00 -0.41 0.00 0.00 54.97 55.02 2jns s GLU 61 Cb -0.18 -2.94 0.09 0.00 -1.78 0.00 0.00 34.13 29.32 2jns s GLU 61 CO 0.03 0.47 0.43 0.42 -0.49 0.00 0.00 175.26 176.12 2jns s ILE 62 N -1.45 5.22 -0.60 -1.63 1.01 -1.26 -5.01 121.20 117.47 2jns s ILE 62 Ca 0.38 -1.21 -0.13 0.00 0.00 0.00 0.00 60.65 59.70 2jns s ILE 62 Cb -0.16 -4.19 0.15 0.00 0.01 0.00 0.00 42.46 38.27 2jns s ILE 62 CO 0.20 -0.67 0.52 1.51 0.00 0.00 0.00 174.94 176.49 2jns s ASP 63 N 2.93 6.13 0.54 3.58 -4.77 -1.26 -4.93 116.67 118.89 2jns s ASP 63 Ca 0.04 -2.14 0.35 0.00 -3.30 0.00 0.00 52.55 47.49 2jns s ASP 63 Cb -0.26 -2.13 1.55 0.00 -1.09 0.00 0.00 42.92 40.99 2jns s ASP 63 CO 0.05 -0.70 2.03 -0.26 0.70 0.00 0.00 175.17 176.99 2jns h PHE 64 N 8.34 0.00 0.00 2.11 0.04 -1.95 -1.97 116.94 123.51 2jns h PHE 64 Ca -0.15 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.62 2jns h PHE 64 Cb 1.07 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.22 2jns h PHE 64 CO 0.78 0.00 0.00 1.05 -0.60 0.00 0.00 178.31 179.54 2jns h GLU 65 N 0.00 0.00 0.00 1.51 4.11 -2.01 -3.33 114.58 114.86 2jns h GLU 65 Ca 0.00 0.00 -0.00 0.00 0.07 0.00 0.00 59.36 59.43 2jns h GLU 65 Cb 0.37 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.62 2jns h GLU 65 CO 0.00 0.00 -1.06 0.25 0.07 0.00 0.00 179.01 178.27 2jns n THR 66 N -2.72 0.02 -1.80 -1.06 -2.24 -0.88 -5.05 114.28 100.54 2jns n THR 66 Ca 0.04 -0.03 -0.33 0.00 -2.27 0.00 0.00 64.05 61.46 2jns n THR 66 Cb 0.42 0.17 0.04 0.00 -2.10 0.00 0.00 70.33 68.86 2jns n THR 66 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2jns s LEU 67 N -3.29 3.39 0.51 3.22 1.43 -0.79 -5.04 118.68 118.11 2jns s LEU 67 Ca -0.00 1.91 -0.17 0.00 -1.03 0.00 0.00 54.13 54.84 2jns s LEU 67 Cb 0.01 -4.54 -0.08 0.00 0.03 0.00 0.00 46.19 41.61 2jns s LEU 67 CO 0.05 -1.51 0.99 -0.54 0.23 0.00 0.00 176.35 175.57 2jns s LYS 68 N -4.19 3.95 0.35 1.70 1.02 -1.26 -4.96 119.74 116.36 2jns s LYS 68 Ca 0.65 0.96 0.03 0.00 0.02 0.00 0.00 55.97 57.63 2jns s LYS 68 Cb -0.19 -2.14 0.67 0.00 -0.52 0.00 0.00 37.83 35.65 2jns s LYS 68 CO 0.42 -0.27 2.00 -1.00 -0.92 0.00 0.00 175.35 175.58 2jns h PRO 69 N 0.92 0.81 -0.80 -1.68 0.13 -1.95 -2.14 132.00 127.29 2jns h PRO 69 Ca -0.47 -0.05 -0.02 0.00 -0.87 0.00 0.00 66.00 64.59 2jns h PRO 69 Cb 1.18 -0.18 -0.04 0.00 0.13 0.00 0.00 31.00 32.10 2jns h PRO 69 CO 0.61 0.53 0.42 0.66 -0.23 0.00 0.00 178.00 180.00 2jns h SER 70 N 0.83 1.01 -0.27 1.44 4.64 -1.91 -2.07 113.55 117.22 2jns h SER 70 Ca 0.25 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.46 2jns h SER 70 Cb -0.01 -0.26 -0.01 0.00 -0.31 0.00 0.00 62.40 61.81 2jns h SER 70 CO -0.06 0.83 0.18 0.74 -0.87 0.00 0.00 176.83 177.65 2jns h THR 71 N 1.11 1.08 -0.81 2.95 2.02 -1.78 -2.41 112.91 115.08 2jns h THR 71 Ca 0.28 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 67.29 2jns h THR 71 Cb 0.06 0.70 -0.04 0.00 -1.74 0.00 0.00 68.15 67.13 2jns h THR 71 CO -0.04 0.08 0.45 -0.07 0.37 0.00 0.00 175.52 176.31 2jns h LEU 72 N 0.36 1.00 -1.50 2.58 3.38 -1.35 -1.77 115.31 118.01 2jns h LEU 72 Ca 0.10 -0.09 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2jns h LEU 72 Cb -0.03 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 2jns h LEU 72 CO -0.02 0.80 0.25 0.03 0.09 0.00 0.00 178.44 179.59 2jns h ARG 73 N 1.12 0.59 -0.17 1.13 2.47 -0.91 0.14 114.38 118.74 2jns h ARG 73 Ca 0.29 -0.05 -0.16 0.00 -1.26 0.00 0.00 59.98 58.79 2jns h ARG 73 Cb 0.02 -0.13 0.00 0.00 -1.65 0.00 0.00 29.97 28.21 2jns h ARG 73 CO -0.05 0.42 -0.53 0.93 0.56 0.00 0.00 179.97 181.30 2jns h GLU 74 N 0.60 0.67 -0.44 0.04 3.07 -0.96 -2.74 114.58 114.81 2jns h GLU 74 Ca 0.16 -0.49 -0.02 0.00 -0.50 0.00 0.00 59.36 58.51 2jns h GLU 74 Cb -0.01 0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 27.97 2jns h GLU 74 CO -0.03 1.11 0.21 -0.07 -1.40 0.00 0.00 179.01 178.83 2jns h LEU 75 N 0.36 0.57 -1.13 1.33 3.38 -0.73 -2.57 115.31 116.52 2jns h LEU 75 Ca -0.02 -0.13 0.06 0.00 0.09 0.00 0.00 57.88 57.89 2jns h LEU 75 Cb 1.16 -0.15 -0.06 0.00 0.09 0.00 0.00 40.66 41.70 2jns h LEU 75 CO 0.11 0.54 0.59 -0.08 0.09 0.00 0.00 178.44 179.70 2jns h GLU 76 N 0.57 1.03 -0.57 1.13 4.81 -0.77 -1.68 114.58 119.10 2jns h GLU 76 Ca 0.15 -0.06 -0.08 0.00 -0.13 0.00 0.00 59.36 59.24 2jns h GLU 76 Cb 0.11 -0.23 -0.02 0.00 0.63 0.00 0.00 28.75 29.24 2jns h GLU 76 CO -0.02 0.68 0.03 -0.09 -0.73 0.00 0.00 179.01 178.89 2jns h ARG 77 N 1.06 0.98 0.07 1.92 2.43 -1.16 -1.41 114.38 118.27 2jns h ARG 77 Ca 0.39 -0.29 -0.00 0.00 -0.81 0.00 0.00 59.98 59.26 2jns h ARG 77 Cb 0.16 -0.10 -0.00 0.00 -0.42 0.00 0.00 29.97 29.61 2jns h ARG 77 CO -0.14 0.96 -0.05 -0.92 -1.51 0.00 0.00 179.97 178.31 2jns h TYR 78 N 0.87 -0.13 -0.05 2.20 3.20 -0.93 -1.05 116.97 121.07 2jns h TYR 78 Ca 0.17 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.03 2jns h TYR 78 Cb 0.50 0.05 -0.00 0.00 1.54 0.00 0.00 36.73 38.82 2jns h TYR 78 CO 0.04 -0.08 -0.01 -0.39 -1.64 0.00 0.00 178.16 176.08 2jns h VAL 79 N -0.13 1.28 0.00 1.81 -1.51 -1.41 -1.74 116.25 114.55 2jns h VAL 79 Ca -0.00 -0.86 -0.02 0.00 -1.23 0.00 0.00 66.70 64.59 2jns h VAL 79 Cb 0.11 1.77 -0.00 0.00 -2.13 0.00 0.00 31.29 31.04 2jns h VAL 79 CO -0.00 0.23 -0.08 0.74 -1.23 0.00 0.00 177.57 177.23 2jns h THR 80 N -0.24 0.38 0.00 7.19 2.02 -1.25 0.16 112.91 121.17 2jns h THR 80 Ca 0.01 -0.47 0.00 0.00 0.77 0.00 0.00 66.41 66.72 2jns h THR 80 Cb 0.38 1.33 0.00 0.00 -1.74 0.00 0.00 68.15 68.12 2jns h THR 80 CO 0.00 0.08 -0.73 -1.20 0.37 0.00 0.00 175.52 174.05 2jns n SER 81 N -3.45 0.68 -0.08 4.18 7.64 -0.40 -2.76 113.62 119.43 2jns n SER 81 Ca -0.01 -0.50 -0.11 0.00 1.01 0.00 0.00 58.87 59.26 2jns n SER 81 Cb 0.23 0.56 -0.05 0.00 -1.01 0.00 0.00 64.21 63.94 2jns n SER 81 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jns h LEU 83 N -1.00 0.00 -8.48 0.00 3.38 -1.23 -3.46 115.31 104.52 2jns h LEU 83 Ca -0.13 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.63 2jns h LEU 83 Cb 0.80 0.00 -0.11 0.00 0.09 0.00 0.00 40.66 41.44 2jns h LEU 83 CO -0.08 0.04 -0.33 -0.60 0.09 0.00 0.00 178.44 177.55 2jns s ARG 84 N -3.46 1.53 0.27 1.13 3.52 -1.11 -5.07 118.95 115.75 2jns s ARG 84 Ca 0.03 -1.56 -0.21 0.00 -0.13 0.00 0.00 55.73 53.86 2jns s ARG 84 Cb 0.07 0.38 0.03 0.00 -1.56 0.00 0.00 34.95 33.88 2jns s ARG 84 CO 0.61 -0.59 0.75 -1.59 -0.81 0.00 0.00 175.30 173.67 2jns s LYS 85 N -3.79 1.72 -0.50 5.12 -2.85 -1.26 -3.84 119.74 114.35 2jns s LYS 85 Ca 0.31 -0.95 0.03 0.00 -1.00 0.00 0.00 55.97 54.36 2jns s LYS 85 Cb 0.02 0.58 0.14 0.00 -2.06 0.00 0.00 37.83 36.52 2jns s LYS 85 CO 0.14 -0.79 0.29 0.21 0.10 0.00 0.00 175.35 175.31 2jns s LYS 86 N -3.82 1.63 -0.07 1.78 2.47 -1.26 -5.08 119.74 115.38 2jns s LYS 86 Ca 0.11 -2.39 -0.08 0.00 -1.56 0.00 0.00 55.97 52.06 2jns s LYS 86 Cb -0.05 -2.69 0.02 0.00 -1.46 0.00 0.00 37.83 33.64 2jns s LYS 86 CO 0.06 -1.19 0.21 0.50 0.16 0.00 0.00 175.35 175.10 2jns s ARG 87 N -0.13 0.27 -0.56 4.03 3.52 -1.26 -5.10 118.95 119.73 2jns s ARG 87 Ca 0.20 0.25 0.05 0.00 -0.13 0.00 0.00 55.73 56.09 2jns s ARG 87 Cb -0.19 0.13 0.17 0.00 -1.56 0.00 0.00 34.95 33.50 2jns s ARG 87 CO -0.04 -0.04 0.43 1.63 -0.81 0.00 0.00 175.30 176.47 2jns n LYS 88 N 2.85 1.05 -1.46 5.12 5.02 -1.26 -5.12 118.16 124.36 2jns n LYS 88 Ca -0.13 -3.85 -0.29 0.00 -2.02 0.00 0.00 58.31 52.01 2jns n LYS 88 Cb 0.58 -1.97 0.19 0.00 -0.02 0.00 0.00 35.03 33.80 2jns n LYS 88 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 2jns s PRO 89 N -0.77 0.18 0.00 1.97 0.04 -1.26 -5.37 135.00 129.79 2jns s PRO 89 Ca 0.29 0.01 0.00 0.00 0.04 0.00 0.00 61.00 61.35 2jns s PRO 89 Cb 0.01 -1.75 0.00 0.00 0.04 0.00 0.00 34.50 32.79 2jns s PRO 89 CO -0.18 -2.79 0.06 1.04 0.04 0.00 0.00 177.00 175.17