#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 -0.49 0.00 1.61 0.87 -2.12 -3.46 113.55 109.96 2jns h SER 2 Ca 0.00 0.02 0.00 0.00 -1.23 0.00 0.00 61.79 60.58 2jns h SER 2 Cb 0.00 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.09 2jns h SER 2 CO 0.00 -0.17 0.00 -1.20 -0.53 0.00 0.00 176.83 174.93 2jns n SER 3 N -4.52 0.00 -4.56 6.23 7.64 -1.26 -4.87 113.62 112.27 2jns n SER 3 Ca -0.07 0.00 -0.43 0.00 1.01 0.00 0.00 58.87 59.38 2jns n SER 3 Cb 0.23 -0.64 -0.00 0.00 -1.01 0.00 0.00 64.21 62.78 2jns n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2jns s GLY 4 N -1.21 1.70 0.49 0.23 0.00 -1.26 -4.96 107.32 102.31 2jns s GLY 4 Ca 0.00 -2.92 0.09 0.00 0.00 0.00 0.00 44.72 41.89 2jns s GLY 4 CO 0.00 2.65 0.67 -0.56 0.00 0.00 0.00 173.10 175.85 2jns s SER 5 N 4.13 5.42 0.29 1.64 0.01 -1.26 -5.15 113.70 118.78 2jns s SER 5 Ca 0.52 -0.60 -0.19 0.00 1.31 0.00 0.00 55.95 56.99 2jns s SER 5 Cb 0.03 -0.26 0.02 0.00 0.21 0.00 0.00 66.02 66.02 2jns s SER 5 CO 0.06 -1.01 0.69 -0.44 0.41 0.00 0.00 173.24 172.95 2jns s SER 6 N -4.49 -0.19 0.00 2.44 0.01 -1.26 -5.15 113.70 105.07 2jns s SER 6 Ca 0.58 -0.73 0.00 0.00 1.31 0.00 0.00 55.95 57.11 2jns s SER 6 Cb -0.08 0.72 0.00 0.00 0.21 0.00 0.00 66.02 66.87 2jns s SER 6 CO 0.36 -1.36 0.00 0.61 0.41 0.00 0.00 173.24 173.26 2jns n GLY 7 N -0.46 1.66 2.88 3.44 0.00 -1.26 -5.17 105.19 106.28 2jns n GLY 7 Ca -0.04 -0.01 -0.15 0.00 0.00 0.00 0.00 46.02 45.82 2jns n GLY 7 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2jns s GLU 8 N 0.00 0.06 -0.23 1.61 0.41 -1.26 -5.16 118.70 114.14 2jns s GLU 8 Ca 0.00 0.50 -0.13 0.00 -0.41 0.00 0.00 54.97 54.93 2jns s GLU 8 Cb 0.00 -0.23 0.07 0.00 -1.78 0.00 0.00 34.13 32.20 2jns s GLU 8 CO 0.00 -0.25 0.57 0.45 -0.49 0.00 0.00 175.26 175.53 2jns s SER 9 N 1.86 -0.76 0.49 -0.19 0.15 -1.26 -5.02 113.70 108.97 2jns s SER 9 Ca -0.02 1.24 0.31 0.00 0.70 0.00 0.00 55.95 58.19 2jns s SER 9 Cb -0.12 1.13 1.69 0.00 -1.71 0.00 0.00 66.02 67.02 2jns s SER 9 CO -0.06 -0.22 1.95 -0.33 1.20 0.00 0.00 173.24 175.78 2jns h GLU 10 N 7.08 0.00 0.00 5.44 5.08 -2.02 -1.57 114.58 128.60 2jns h GLU 10 Ca -0.33 0.00 -0.06 0.00 -1.00 0.00 0.00 59.36 57.98 2jns h GLU 10 Cb 1.21 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.45 2jns h GLU 10 CO 0.22 0.00 -0.26 0.93 -1.00 0.00 0.00 179.01 178.89 2jns h GLU 11 N 0.00 0.00 0.00 2.33 4.39 -2.03 -3.06 114.58 116.20 2jns h GLU 11 Ca 0.00 0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.66 2jns h GLU 11 Cb 0.08 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.73 2jns h GLU 11 CO 0.00 0.26 -2.03 -0.85 -1.16 0.00 0.00 179.01 175.23 2jns n GLU 12 N -3.84 0.66 -1.76 2.33 0.28 -0.60 -4.64 120.64 113.08 2jns n GLU 12 Ca -0.02 -0.17 -0.41 0.00 -0.16 0.00 0.00 57.16 56.40 2jns n GLU 12 Cb 0.35 -1.52 -0.01 0.00 1.43 0.00 0.00 31.44 31.69 2jns n GLU 12 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2jns n ASP 13 N -2.32 6.02 -4.34 -1.84 8.00 -1.16 -4.89 116.55 116.02 2jns n ASP 13 Ca -0.07 -2.85 -0.17 0.00 0.71 0.00 0.00 54.79 52.40 2jns n ASP 13 Cb 0.64 -1.56 -0.10 0.00 -0.02 0.00 0.00 41.12 40.08 2jns n ASP 13 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2jns s LYS 14 N 1.83 1.34 -0.44 -1.24 -0.14 -1.26 -4.93 119.74 114.89 2jns s LYS 14 Ca 0.53 -1.66 -0.17 0.00 -1.36 0.00 0.00 55.97 53.31 2jns s LYS 14 Cb 0.15 -0.73 0.03 0.00 -1.68 0.00 0.00 37.83 35.60 2jns s LYS 14 CO -0.06 -0.04 0.47 0.00 -0.76 0.00 0.00 175.35 174.95 2jns s LYS 16 N 2.18 2.01 -0.33 0.00 1.02 -1.26 -4.64 119.74 118.71 2jns s LYS 16 Ca 0.12 1.72 -0.29 0.00 0.02 0.00 0.00 55.97 57.54 2jns s LYS 16 Cb -0.18 -1.82 -0.01 0.00 -0.52 0.00 0.00 37.83 35.29 2jns s LYS 16 CO 0.13 -1.93 1.70 -1.25 -0.92 0.00 0.00 175.35 173.08 2jns s PRO 17 N -4.03 3.44 0.26 -1.68 0.04 -1.26 -4.80 135.00 126.97 2jns s PRO 17 Ca 0.73 1.37 -0.31 0.00 0.04 0.00 0.00 61.00 62.83 2jns s PRO 17 Cb -0.28 -4.14 -0.12 0.00 0.04 0.00 0.00 34.50 30.00 2jns s PRO 17 CO 0.47 -1.73 1.64 -1.33 0.04 0.00 0.00 177.00 176.09 2jns n MET 18 N 8.27 2.71 -2.02 4.56 2.81 -1.26 -5.02 117.12 127.17 2jns n MET 18 Ca 0.21 0.97 -0.29 0.00 -1.81 0.00 0.00 57.70 56.78 2jns n MET 18 Cb 0.47 -2.77 0.16 0.00 -0.71 0.00 0.00 33.22 30.36 2jns n MET 18 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2jns s SER 19 N 0.75 3.52 0.15 7.83 0.15 -1.26 -4.87 113.70 119.97 2jns s SER 19 Ca 0.68 0.27 -0.13 0.00 0.70 0.00 0.00 55.95 57.47 2jns s SER 19 Cb -0.51 -0.43 0.04 0.00 -1.71 0.00 0.00 66.02 63.41 2jns s SER 19 CO 0.42 -2.47 1.68 0.22 1.20 0.00 0.00 173.24 174.29 2jns h TYR 20 N -1.39 0.83 0.00 3.44 3.20 -1.99 -2.09 116.97 118.97 2jns h TYR 20 Ca -0.44 -0.09 -0.05 0.00 3.14 0.00 0.00 58.73 61.30 2jns h TYR 20 Cb 1.25 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 39.28 2jns h TYR 20 CO -0.78 0.72 -0.23 0.93 -1.64 0.00 0.00 178.16 177.16 2jns h GLU 21 N 0.70 0.00 0.11 1.82 5.08 -1.99 -0.69 114.58 119.62 2jns h GLU 21 Ca 0.16 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.52 2jns h GLU 21 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 2jns h GLU 21 CO -0.00 0.23 -0.05 0.93 -1.00 0.00 0.00 179.01 179.11 2jns h GLU 22 N 0.00 -0.14 -0.60 2.33 4.39 -1.87 -1.68 114.58 117.01 2jns h GLU 22 Ca -0.00 0.01 0.10 0.00 0.34 0.00 0.00 59.36 59.81 2jns h GLU 22 Cb 0.43 0.03 -0.08 0.00 -0.10 0.00 0.00 28.75 29.03 2jns h GLU 22 CO 0.03 0.35 0.17 0.87 -1.16 0.00 0.00 179.01 179.27 2jns h LYS 23 N -0.81 0.31 0.25 2.33 1.57 -1.07 -0.45 116.57 118.71 2jns h LYS 23 Ca -0.02 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.73 2jns h LYS 23 Cb 0.56 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.81 2jns h LYS 23 CO 0.03 0.20 -0.12 0.00 -0.57 0.00 0.00 179.45 178.99 2jns h ARG 24 N 0.32 -0.33 -0.83 3.15 2.47 -1.20 -2.69 114.38 115.27 2jns h ARG 24 Ca 0.31 0.02 0.12 0.00 -1.26 0.00 0.00 59.98 59.17 2jns h ARG 24 Cb 0.43 0.07 -0.08 0.00 -1.65 0.00 0.00 29.97 28.74 2jns h ARG 24 CO -0.36 -0.01 0.45 0.37 0.56 0.00 0.00 179.97 180.98 2jns h GLN 25 N -0.67 0.69 -0.65 0.04 5.75 -0.90 0.12 115.11 119.48 2jns h GLN 25 Ca -0.03 -0.04 0.07 0.00 -0.15 0.00 0.00 58.65 58.49 2jns h GLN 25 Cb 0.47 -0.15 -0.06 0.00 1.07 0.00 0.00 27.48 28.80 2jns h GLN 25 CO 0.06 0.45 0.34 1.25 -2.65 0.00 0.00 178.83 178.28 2jns h LEU 26 N 0.71 0.48 -0.43 -2.39 6.46 -1.08 -1.45 115.31 117.61 2jns h LEU 26 Ca 0.42 0.04 -0.05 0.00 -0.12 0.00 0.00 57.88 58.17 2jns h LEU 26 Cb 0.49 -0.05 -0.02 0.00 -0.73 0.00 0.00 40.66 40.35 2jns h LEU 26 CO -0.30 0.30 0.07 -1.28 -0.62 0.00 0.00 178.44 176.62 2jns h SER 27 N 0.62 0.68 -0.81 1.25 0.87 -0.70 -1.82 113.55 113.63 2jns h SER 27 Ca 0.30 -0.26 0.09 0.00 -1.23 0.00 0.00 61.79 60.69 2jns h SER 27 Cb 0.24 -0.18 -0.07 0.00 -0.44 0.00 0.00 62.40 61.95 2jns h SER 27 CO -0.21 0.77 0.47 -0.07 -0.53 0.00 0.00 176.83 177.25 2jns h LEU 28 N 0.56 0.67 -0.49 2.23 -0.00 -0.10 -0.23 115.31 117.96 2jns h LEU 28 Ca 0.13 0.04 -0.16 0.00 -0.00 0.00 0.00 57.88 57.89 2jns h LEU 28 Cb 0.38 -0.09 -0.01 0.00 -0.00 0.00 0.00 40.66 40.95 2jns h LEU 28 CO 0.01 0.39 -0.54 0.44 -0.00 0.00 0.00 178.44 178.74 2jns h ASP 29 N 0.79 0.67 -0.55 -0.43 5.19 -1.17 -3.05 116.42 117.86 2jns h ASP 29 Ca 0.39 -0.35 -0.05 0.00 -0.62 0.00 0.00 57.03 56.40 2jns h ASP 29 Cb 0.34 -0.19 -0.03 0.00 0.18 0.00 0.00 39.33 39.63 2jns h ASP 29 CO -0.24 1.08 0.19 0.40 -3.12 0.00 0.00 179.24 177.54 2jns h ILE 30 N 0.46 1.23 0.00 0.35 2.04 -0.39 -1.96 117.51 119.24 2jns h ILE 30 Ca 0.01 -0.77 0.00 0.00 1.00 0.00 0.00 64.86 65.10 2jns h ILE 30 Cb 1.09 0.57 0.00 0.00 -0.74 0.00 0.00 36.82 37.74 2jns h ILE 30 CO 0.10 0.30 0.00 0.59 0.00 0.00 0.00 178.15 179.14 2jns n ASN 31 N -4.29 0.59 -0.44 1.72 3.02 -0.20 -1.42 115.26 114.25 2jns n ASN 31 Ca 0.05 0.72 0.13 0.00 -0.03 0.00 0.00 54.58 55.45 2jns n ASN 31 Cb 0.20 -0.82 0.35 0.00 -0.61 0.00 0.00 39.78 38.90 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 -2.23 1.34 -2.93 3.52 4.76 -0.74 -4.93 118.16 116.95 2jns n LYS 32 Ca -0.00 -0.88 -0.36 0.00 -2.87 0.00 0.00 58.31 54.20 2jns n LYS 32 Cb 0.11 -1.48 -0.06 0.00 -1.84 0.00 0.00 35.03 31.75 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 -2.27 4.24 0.65 -0.35 1.43 -0.51 -5.06 118.68 116.81 2jns s LEU 33 Ca 0.29 1.62 -0.14 0.00 -1.03 0.00 0.00 54.13 54.86 2jns s LEU 33 Cb 0.20 -3.98 -0.01 0.00 0.03 0.00 0.00 46.19 42.43 2jns s LEU 33 CO 0.44 -0.10 1.08 -2.16 0.23 0.00 0.00 176.35 175.84 2jns s PRO 34 N -2.32 2.96 0.36 1.29 0.04 -1.26 -4.79 135.00 131.29 2jns s PRO 34 Ca 0.50 1.26 0.08 0.00 0.04 0.00 0.00 61.00 62.89 2jns s PRO 34 Cb -0.15 -1.98 0.81 0.00 0.04 0.00 0.00 34.50 33.21 2jns s PRO 34 CO 0.20 -1.10 1.88 0.78 0.04 0.00 0.00 177.00 178.81 2jns h GLY 35 N 0.02 1.15 1.74 0.56 0.00 -1.98 -0.49 103.07 104.07 2jns h GLY 35 Ca -0.46 -0.30 0.03 0.00 0.00 0.00 0.00 47.33 46.60 2jns h GLY 35 CO 0.55 0.12 0.11 -2.09 0.00 0.00 0.00 176.54 175.23 2jns h GLU 36 N 0.70 0.06 -0.01 4.80 4.81 -2.04 -2.07 114.58 120.84 2jns h GLU 36 Ca 0.42 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.65 2jns h GLU 36 Cb 0.64 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.01 2jns h GLU 36 CO -0.19 0.04 -0.15 1.63 -0.73 0.00 0.00 179.01 179.62 2jns n LYS 37 N -4.50 1.45 0.01 1.92 5.02 -0.34 -4.59 118.16 117.13 2jns n LYS 37 Ca 0.00 -0.94 -0.18 0.00 -2.02 0.00 0.00 58.31 55.18 2jns n LYS 37 Cb 0.19 -1.20 -0.13 0.00 -0.02 0.00 0.00 35.03 33.88 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 1.88 0.42 -1.20 -0.35 7.12 -0.42 -3.32 115.31 119.43 2jns h LEU 38 Ca 0.00 -0.85 0.21 0.00 0.13 0.00 0.00 57.88 57.37 2jns h LEU 38 Cb 0.47 -0.13 -0.09 0.00 -0.53 0.00 0.00 40.66 40.38 2jns h LEU 38 CO 0.00 1.23 0.62 1.23 -0.13 0.00 0.00 178.44 181.39 2jns h GLY 39 N -0.33 1.45 1.39 3.75 0.00 -1.80 0.14 103.07 107.68 2jns h GLY 39 Ca -0.09 -0.29 0.05 0.00 0.00 0.00 0.00 47.33 47.00 2jns h GLY 39 CO 0.11 -0.06 0.30 -0.09 0.00 0.00 0.00 176.54 176.79 2jns h ARG 40 N 0.60 0.39 0.47 4.80 9.65 -1.86 -1.86 114.38 126.58 2jns h ARG 40 Ca 0.56 -0.02 -0.02 0.00 -1.10 0.00 0.00 59.98 59.39 2jns h ARG 40 Cb 1.09 -0.09 0.00 0.00 -1.39 0.00 0.00 29.97 29.58 2jns h ARG 40 CO -0.32 0.26 -0.23 0.28 2.80 0.00 0.00 179.97 182.77 2jns h VAL 41 N 0.40 0.53 -0.93 0.20 2.07 -0.85 -2.54 116.25 115.13 2jns h VAL 41 Ca 0.19 -0.04 0.11 0.00 0.82 0.00 0.00 66.70 67.78 2jns h VAL 41 Cb 0.24 0.55 -0.07 0.00 -1.52 0.00 0.00 31.29 30.49 2jns h VAL 41 CO -0.05 0.01 0.60 0.58 0.02 0.00 0.00 177.57 178.73 2jns h VAL 42 N -0.66 0.95 0.00 2.57 2.07 -1.38 -0.40 116.25 119.40 2jns h VAL 42 Ca -0.07 -0.32 -0.00 0.00 0.82 0.00 0.00 66.70 67.14 2jns h VAL 42 Cb 0.50 -0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.22 2jns h VAL 42 CO 0.11 0.17 -0.01 0.45 0.02 0.00 0.00 177.57 178.30 2jns h HIS 43 N 0.92 0.00 -0.13 1.57 -0.00 -1.01 -1.63 115.15 114.87 2jns h HIS 43 Ca 0.44 0.00 -0.05 0.00 -0.00 0.00 0.00 60.37 60.76 2jns h HIS 43 Cb 0.44 0.00 -0.00 0.00 -0.00 0.00 0.00 27.41 27.85 2jns h HIS 43 CO -0.00 0.01 -0.12 0.82 -0.00 0.00 0.00 177.93 178.64 2jns h ILE 44 N 0.00 1.35 -0.73 2.45 2.04 -0.75 -3.14 117.51 118.73 2jns h ILE 44 Ca -0.00 -1.26 -0.00 0.00 1.00 0.00 0.00 64.86 64.60 2jns h ILE 44 Cb 0.02 1.88 -0.04 0.00 -0.74 0.00 0.00 36.82 37.95 2jns h ILE 44 CO 0.00 0.37 0.45 0.40 0.00 0.00 0.00 178.15 179.37 2jns h ILE 45 N -0.06 1.20 -0.27 -0.67 5.03 -1.31 -2.06 117.51 119.37 2jns h ILE 45 Ca 0.02 -0.43 0.08 0.00 -0.12 0.00 0.00 64.86 64.41 2jns h ILE 45 Cb 0.64 0.18 -0.01 0.00 -3.03 0.00 0.00 36.82 34.60 2jns h ILE 45 CO 0.03 0.21 0.25 1.56 -0.68 0.00 0.00 178.15 179.51 2jns h GLN 46 N 0.99 0.00 0.00 2.37 4.20 -1.36 0.39 115.11 121.70 2jns h GLN 46 Ca 0.26 0.00 -0.08 0.00 0.06 0.00 0.00 58.65 58.89 2jns h GLN 46 Cb -0.05 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 2jns h GLN 46 CO -0.05 0.00 -0.40 1.03 -0.67 0.00 0.00 178.83 178.74 2jns h SER 47 N 0.00 0.00 0.08 1.46 0.87 -1.32 -3.31 113.55 111.33 2jns h SER 47 Ca 0.13 0.00 -0.22 0.00 -1.23 0.00 0.00 61.79 60.47 2jns h SER 47 Cb 0.62 0.00 -0.04 0.00 -0.44 0.00 0.00 62.40 62.54 2jns h SER 47 CO -0.00 0.40 -2.14 0.54 -0.53 0.00 0.00 176.83 175.10 2jns n ARG 48 N -3.44 0.67 -3.86 2.24 5.12 0.11 -4.78 116.66 112.71 2jns n ARG 48 Ca 0.00 -0.05 -0.33 0.00 -1.93 0.00 0.00 57.85 55.55 2jns n ARG 48 Cb 0.56 -1.55 -0.12 0.00 -1.16 0.00 0.00 32.46 30.18 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 -2.90 2.17 0.49 5.56 0.41 0.41 -4.97 118.70 119.86 2jns s GLU 49 Ca -0.08 -2.51 0.18 0.00 -0.41 0.00 0.00 54.97 52.15 2jns s GLU 49 Cb 0.09 -3.48 1.22 0.00 -1.78 0.00 0.00 34.13 30.18 2jns s GLU 49 CO 0.86 -1.12 2.03 -1.00 -0.49 0.00 0.00 175.26 175.54 2jns h PRO 50 N 6.83 0.15 0.00 0.39 0.13 -1.87 -1.34 132.00 136.30 2jns h PRO 50 Ca -0.05 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2jns h PRO 50 Cb 0.93 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.02 2jns h PRO 50 CO 0.69 0.10 0.00 0.77 -0.23 0.00 0.00 178.00 179.33 2jns h SER 51 N 0.16 0.00 -0.00 1.44 0.02 -1.93 -2.82 113.55 110.42 2jns h SER 51 Ca 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.14 2jns h SER 51 Cb 0.54 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.08 2jns h SER 51 CO -0.03 0.00 -0.67 0.18 -1.14 0.00 0.00 176.83 175.17 2jns n LEU 52 N -3.08 0.93 -4.67 5.07 7.99 -0.58 -4.95 117.00 117.71 2jns n LEU 52 Ca 0.01 -0.55 -0.30 0.00 -0.01 0.00 0.00 56.01 55.15 2jns n LEU 52 Cb 0.30 0.00 0.16 0.00 -0.11 0.00 0.00 43.42 43.77 2jns n LEU 52 CO 0.27 0.21 0.66 -0.75 -1.51 0.00 0.00 177.39 176.27 2jns s LYS 53 N -2.39 1.03 0.00 3.23 2.20 -0.77 -3.03 119.74 120.01 2jns s LYS 53 Ca 0.08 1.26 0.00 0.00 -0.36 0.00 0.00 55.97 56.94 2jns s LYS 53 Cb 0.12 -1.75 0.00 0.00 -1.51 0.00 0.00 37.83 34.69 2jns s LYS 53 CO 0.61 -2.53 0.00 0.09 -0.36 0.00 0.00 175.35 173.16 2jns n ASN 54 N -4.13 0.00 -4.69 1.43 3.02 -1.26 -4.96 115.26 104.67 2jns n ASN 54 Ca 0.09 0.00 -0.30 0.00 -0.03 0.00 0.00 54.58 54.34 2jns n ASN 54 Cb 0.53 -0.30 0.15 0.00 -0.61 0.00 0.00 39.78 39.55 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 -0.97 3.20 0.17 6.41 0.01 -1.17 -5.03 113.70 116.32 2jns s SER 55 Ca 0.00 1.62 -0.07 0.00 1.31 0.00 0.00 55.95 58.82 2jns s SER 55 Cb 0.00 -2.28 -0.06 0.00 0.21 0.00 0.00 66.02 63.89 2jns s SER 55 CO 0.00 -2.83 0.44 0.21 0.41 0.00 0.00 173.24 171.47 2jns s ASN 56 N -3.20 6.54 0.42 2.44 2.47 -1.26 -5.00 114.94 117.35 2jns s ASN 56 Ca 0.64 0.72 0.12 0.00 0.42 0.00 0.00 52.86 54.76 2jns s ASN 56 Cb -0.19 -2.14 0.98 0.00 -1.45 0.00 0.00 41.25 38.44 2jns s ASN 56 CO 0.58 0.01 1.97 1.55 -3.72 0.00 0.00 177.10 177.48 2jns h PRO 57 N 2.73 0.46 0.00 0.43 0.13 -1.93 -1.33 132.00 132.49 2jns h PRO 57 Ca -0.46 -0.03 -0.04 0.00 -0.87 0.00 0.00 66.00 64.59 2jns h PRO 57 Cb 1.17 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 32.19 2jns h PRO 57 CO 0.71 0.30 -0.21 -0.44 -0.23 0.00 0.00 178.00 178.14 2jns h ASP 58 N 0.47 0.00 1.59 1.44 3.32 -2.00 -3.11 116.42 118.13 2jns h ASP 58 Ca 0.29 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.34 2jns h ASP 58 Cb 0.52 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.07 2jns h ASP 58 CO -0.09 0.21 -0.31 -0.33 -1.72 0.00 0.00 179.24 177.01 2jns h GLU 59 N 0.00 0.00 -6.08 3.56 4.39 -1.65 -3.45 114.58 111.35 2jns h GLU 59 Ca -0.00 0.00 -0.60 0.00 0.34 0.00 0.00 59.36 59.10 2jns h GLU 59 Cb 1.02 0.00 -0.05 0.00 -0.10 0.00 0.00 28.75 29.62 2jns h GLU 59 CO 0.03 0.00 -0.18 0.42 -1.16 0.00 0.00 179.01 178.12 2jns s ILE 60 N -3.23 4.99 -0.26 3.13 1.01 -1.04 -4.98 121.20 120.82 2jns s ILE 60 Ca 0.05 0.82 0.03 0.00 0.00 0.00 0.00 60.65 61.55 2jns s ILE 60 Cb 0.08 -3.72 0.06 0.00 0.01 0.00 0.00 42.46 38.89 2jns s ILE 60 CO 0.70 0.50 -0.11 -1.61 0.00 0.00 0.00 174.94 174.42 2jns s GLU 61 N -1.29 2.22 0.03 2.79 2.02 -1.26 -4.95 118.70 118.25 2jns s GLU 61 Ca 0.27 -1.36 -0.30 0.00 0.02 0.00 0.00 54.97 53.59 2jns s GLU 61 Cb -0.16 -2.90 -0.07 0.00 0.10 0.00 0.00 34.13 31.10 2jns s GLU 61 CO 0.15 -0.58 1.50 0.42 0.02 0.00 0.00 175.26 176.77 2jns s ILE 62 N 1.10 3.44 -0.53 -1.63 1.01 -1.26 -4.98 121.20 118.35 2jns s ILE 62 Ca -0.08 0.85 -0.03 0.00 0.00 0.00 0.00 60.65 61.39 2jns s ILE 62 Cb -0.20 -3.55 0.14 0.00 0.01 0.00 0.00 42.46 38.86 2jns s ILE 62 CO -0.05 -0.00 0.34 1.51 0.00 0.00 0.00 174.94 176.73 2jns s ASP 63 N 2.08 5.26 0.39 3.58 1.47 -1.26 -4.93 116.67 123.26 2jns s ASP 63 Ca 0.68 -2.47 0.20 0.00 1.18 0.00 0.00 52.55 52.13 2jns s ASP 63 Cb -0.35 -1.85 0.71 0.00 -0.34 0.00 0.00 42.92 41.10 2jns s ASP 63 CO 0.29 -0.45 1.75 -0.26 0.68 0.00 0.00 175.17 177.17 2jns h PHE 64 N 7.51 0.00 0.00 2.11 -1.00 -1.94 -2.13 116.94 121.50 2jns h PHE 64 Ca -0.07 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.71 2jns h PHE 64 Cb 1.00 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.56 2jns h PHE 64 CO 0.64 0.34 0.00 -0.85 -1.61 0.00 0.00 178.31 176.83 2jns n GLU 65 N -3.50 0.12 0.00 1.51 0.28 -1.26 -3.50 120.64 114.29 2jns n GLU 65 Ca -0.00 0.35 0.00 0.00 -0.16 0.00 0.00 57.16 57.35 2jns n GLU 65 Cb 0.50 -1.72 0.00 0.00 1.43 0.00 0.00 31.44 31.64 2jns n GLU 65 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 177.13 177.22 2jns n THR 66 N -1.94 0.00 -1.48 3.84 -2.24 -1.16 -5.09 114.28 106.22 2jns n THR 66 Ca 0.03 -0.08 -0.33 0.00 -2.27 0.00 0.00 64.05 61.40 2jns n THR 66 Cb 0.21 0.49 0.08 0.00 -2.10 0.00 0.00 70.33 69.00 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 -1.62 3.26 0.54 3.22 1.43 -0.81 -5.00 118.68 119.70 2jns s LEU 67 Ca 0.00 2.12 -0.19 0.00 -1.03 0.00 0.00 54.13 55.02 2jns s LEU 67 Cb 0.00 -4.56 -0.06 0.00 0.03 0.00 0.00 46.19 41.60 2jns s LEU 67 CO 0.00 -2.04 1.11 -0.54 0.23 0.00 0.00 176.35 175.11 2jns s LYS 68 N -4.19 3.40 0.35 1.70 1.02 -1.26 -4.94 119.74 115.82 2jns s LYS 68 Ca 0.69 1.54 0.04 0.00 0.02 0.00 0.00 55.97 58.26 2jns s LYS 68 Cb -0.23 -2.02 0.64 0.00 -0.52 0.00 0.00 37.83 35.70 2jns s LYS 68 CO 0.46 -0.80 1.92 -1.00 -0.92 0.00 0.00 175.35 175.02 2jns h PRO 69 N 1.17 0.57 -0.00 -1.68 0.13 -1.92 -1.82 132.00 128.45 2jns h PRO 69 Ca -0.50 -0.09 -0.07 0.00 -0.87 0.00 0.00 66.00 64.47 2jns h PRO 69 Cb 1.25 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 32.28 2jns h PRO 69 CO 0.57 0.52 -0.33 0.66 -0.23 0.00 0.00 178.00 179.19 2jns h SER 70 N 0.56 0.01 -0.19 1.44 4.64 -1.87 -1.40 113.55 116.73 2jns h SER 70 Ca 0.13 -0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.39 2jns h SER 70 Cb 0.22 -0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.30 2jns h SER 70 CO -0.00 0.34 -0.11 0.74 -0.87 0.00 0.00 176.83 176.93 2jns h THR 71 N 0.01 1.31 -0.64 2.95 2.02 -1.71 -3.15 112.91 113.70 2jns h THR 71 Ca -0.00 -1.18 -0.07 0.00 0.77 0.00 0.00 66.41 65.93 2jns h THR 71 Cb 0.59 1.67 -0.03 0.00 -1.74 0.00 0.00 68.15 68.65 2jns h THR 71 CO 0.04 0.36 0.14 -0.07 0.37 0.00 0.00 175.52 176.36 2jns h LEU 72 N 0.10 0.99 -1.59 2.58 3.38 -1.31 -2.64 115.31 116.82 2jns h LEU 72 Ca 0.04 -0.24 0.07 0.00 0.09 0.00 0.00 57.88 57.84 2jns h LEU 72 Cb 0.60 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.06 2jns h LEU 72 CO 0.03 0.98 0.38 -0.09 0.09 0.00 0.00 178.44 179.83 2jns h ARG 73 N 0.96 0.47 -0.19 1.13 9.65 -1.25 0.20 114.38 125.35 2jns h ARG 73 Ca 0.20 -0.03 -0.21 0.00 -1.10 0.00 0.00 59.98 58.84 2jns h ARG 73 Cb 0.39 -0.11 0.01 0.00 -1.39 0.00 0.00 29.97 28.87 2jns h ARG 73 CO 0.01 0.31 -0.70 0.93 2.80 0.00 0.00 179.97 183.32 2jns h GLU 74 N 0.49 0.81 -0.65 0.20 4.39 -1.44 -2.21 114.58 116.17 2jns h GLU 74 Ca 0.25 -0.62 -0.09 0.00 0.34 0.00 0.00 59.36 59.25 2jns h GLU 74 Cb 0.36 0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 29.10 2jns h GLU 74 CO -0.07 1.23 0.07 -0.07 -1.16 0.00 0.00 179.01 179.01 2jns h LEU 75 N 0.57 1.07 0.17 1.33 3.38 -0.98 -1.70 115.31 119.15 2jns h LEU 75 Ca -0.03 -0.27 -0.00 0.00 0.09 0.00 0.00 57.88 57.66 2jns h LEU 75 Cb 1.32 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 41.78 2jns h LEU 75 CO 0.15 1.07 -0.13 -0.08 0.09 0.00 0.00 178.44 179.54 2jns h GLU 76 N 1.02 -0.30 -0.09 1.13 4.57 -0.62 -1.85 114.58 118.45 2jns h GLU 76 Ca 0.19 0.02 -0.00 0.00 -1.18 0.00 0.00 59.36 58.39 2jns h GLU 76 Cb 0.48 0.07 -0.00 0.00 -0.16 0.00 0.00 28.75 29.14 2jns h GLU 76 CO 0.02 -0.20 0.04 0.00 -1.18 0.00 0.00 179.01 177.69 2jns h ARG 77 N -0.31 0.12 -0.29 1.92 -0.00 -1.20 0.06 114.38 114.68 2jns h ARG 77 Ca -0.01 -0.01 -0.02 0.00 -0.50 0.00 0.00 59.98 59.44 2jns h ARG 77 Cb 0.27 -0.03 -0.01 0.00 0.00 0.00 0.00 29.97 30.20 2jns h ARG 77 CO -0.00 0.09 0.10 -0.92 0.00 0.00 0.00 179.97 179.24 2jns h TYR 78 N 0.12 0.46 -0.25 3.04 3.20 -0.49 -0.23 116.97 122.82 2jns h TYR 78 Ca 0.03 -0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.82 2jns h TYR 78 Cb 0.02 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 2jns h TYR 78 CO 0.00 0.47 -0.01 -0.39 -1.64 0.00 0.00 178.16 176.59 2jns h VAL 79 N 0.31 1.26 0.00 1.81 -1.51 -0.82 -1.78 116.25 115.52 2jns h VAL 79 Ca 0.09 -0.94 -0.00 0.00 -1.23 0.00 0.00 66.70 64.62 2jns h VAL 79 Cb 0.22 1.39 -0.00 0.00 -2.13 0.00 0.00 31.29 30.78 2jns h VAL 79 CO -0.00 0.30 -0.01 0.74 -1.23 0.00 0.00 177.57 177.36 2jns h THR 80 N 0.21 0.54 0.00 7.19 2.02 -0.86 0.85 112.91 122.87 2jns h THR 80 Ca 0.07 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.19 2jns h THR 80 Cb 0.44 1.03 0.00 0.00 -1.74 0.00 0.00 68.15 67.88 2jns h THR 80 CO 0.02 0.01 -1.11 -1.20 0.37 0.00 0.00 175.52 173.61 2jns n SER 81 N -3.84 0.67 -0.10 4.18 7.64 -0.11 -2.76 113.62 119.29 2jns n SER 81 Ca -0.03 0.16 -0.17 0.00 1.01 0.00 0.00 58.87 59.85 2jns n SER 81 Cb 0.10 0.70 -0.07 0.00 -1.01 0.00 0.00 64.21 63.92 2jns n SER 81 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2jns n LEU 83 N -4.46 0.70 -3.90 0.00 4.77 0.19 -4.82 117.00 109.49 2jns n LEU 83 Ca -0.26 0.61 -0.10 0.00 -0.03 0.00 0.00 56.01 56.23 2jns n LEU 83 Cb 0.57 -0.44 -0.09 0.00 -2.33 0.00 0.00 43.42 41.14 2jns n LEU 83 CO 0.14 -0.33 -0.16 -0.60 -1.33 0.00 0.00 177.39 175.11 2jns s ARG 84 N -3.18 0.67 0.33 3.23 3.52 -1.11 -5.05 118.95 117.35 2jns s ARG 84 Ca 0.08 -0.76 0.06 0.00 -0.13 0.00 0.00 55.73 54.97 2jns s ARG 84 Cb 0.11 0.27 -0.07 0.00 -1.56 0.00 0.00 34.95 33.70 2jns s ARG 84 CO 0.50 -0.18 0.00 -1.59 -0.81 0.00 0.00 175.30 173.22 2jns s LYS 85 N -2.85 1.69 0.33 5.12 -2.85 -1.26 -3.86 119.74 116.05 2jns s LYS 85 Ca -0.03 -1.91 0.04 0.00 -1.00 0.00 0.00 55.97 53.07 2jns s LYS 85 Cb 0.00 -1.16 -0.02 0.00 -2.06 0.00 0.00 37.83 34.59 2jns s LYS 85 CO -0.06 -0.07 0.33 -1.59 0.10 0.00 0.00 175.35 174.07 2jns s LYS 86 N -3.79 1.80 0.99 1.78 -2.85 -1.26 -5.09 119.74 111.33 2jns s LYS 86 Ca 0.34 -1.94 -0.11 0.00 -1.00 0.00 0.00 55.97 53.25 2jns s LYS 86 Cb 0.07 0.36 0.19 0.00 -2.06 0.00 0.00 37.83 36.39 2jns s LYS 86 CO 0.15 -0.69 1.09 -0.98 0.10 0.00 0.00 175.35 175.02 2jns s ARG 87 N -3.33 0.43 -1.12 1.78 1.70 -1.26 -3.92 118.95 113.23 2jns s ARG 87 Ca 0.38 1.17 -0.19 0.00 -0.47 0.00 0.00 55.73 56.62 2jns s ARG 87 Cb 0.02 -1.69 -0.02 0.00 -0.57 0.00 0.00 34.95 32.69 2jns s ARG 87 CO 0.26 -2.91 0.81 1.63 -1.08 0.00 0.00 175.30 174.01 2jns n LYS 88 N -4.39 -1.36 -2.01 3.89 4.76 -1.26 -4.87 118.16 112.92 2jns n LYS 88 Ca 0.08 0.53 -0.43 0.00 -2.87 0.00 0.00 58.31 55.62 2jns n LYS 88 Cb 0.53 -4.37 -0.03 0.00 -1.84 0.00 0.00 35.03 29.33 2jns n LYS 88 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 2jns s PRO 89 N -5.72 3.92 0.00 1.97 0.04 -1.25 -5.26 135.00 128.70 2jns s PRO 89 Ca 0.47 1.95 0.29 0.00 0.04 0.00 0.00 61.00 63.75 2jns s PRO 89 Cb -0.15 -4.04 1.23 0.00 0.04 0.00 0.00 34.50 31.57 2jns s PRO 89 CO 0.84 -1.15 1.85 1.04 0.04 0.00 0.00 177.00 179.62