#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jns n SER 2 N 0.00 -1.83 -4.69 1.61 2.88 -1.26 -5.15 113.62 105.19 2jns n SER 2 Ca 0.00 -3.51 -0.29 0.00 -1.33 0.00 0.00 58.87 53.73 2jns n SER 2 Cb 0.00 1.43 0.16 0.00 -0.75 0.00 0.00 64.21 65.05 2jns n SER 2 CO 0.00 0.00 0.00 -0.44 -1.23 0.00 0.00 175.04 173.37 2jns s SER 3 N -1.51 2.93 0.00 -3.46 0.01 -1.26 -5.05 113.70 105.36 2jns s SER 3 Ca 0.27 1.32 0.00 0.00 1.31 0.00 0.00 55.95 58.85 2jns s SER 3 Cb 0.29 -2.00 0.00 0.00 0.21 0.00 0.00 66.02 64.52 2jns s SER 3 CO -0.08 -2.96 0.00 0.61 0.41 0.00 0.00 173.24 171.22 2jns n GLY 4 N -1.06 -0.24 0.00 3.44 0.00 -1.26 -5.08 105.19 100.99 2jns n GLY 4 Ca 0.06 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.92 2jns n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2jns n SER 5 N 0.00 3.19 -3.69 1.61 3.41 -1.26 -5.10 113.62 111.77 2jns n SER 5 Ca 0.00 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.50 2jns n SER 5 Cb 0.00 0.00 -0.10 0.00 -0.26 0.00 0.00 64.21 63.85 2jns n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2jns s SER 6 N 1.84 -0.56 0.00 4.04 0.01 -1.26 -5.01 113.70 112.75 2jns s SER 6 Ca 0.00 0.99 0.00 0.00 1.31 0.00 0.00 55.95 58.25 2jns s SER 6 Cb 0.00 0.92 0.00 0.00 0.21 0.00 0.00 66.02 67.15 2jns s SER 6 CO 0.00 -0.19 0.00 0.61 0.41 0.00 0.00 173.24 174.07 2jns n GLY 7 N 3.79 1.84 3.17 3.44 0.00 -1.26 -4.64 105.19 111.53 2jns n GLY 7 Ca -0.20 0.12 -0.43 0.00 0.00 0.00 0.00 46.02 45.52 2jns n GLY 7 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2jns n GLU 8 N 0.00 3.14 -1.42 1.61 1.02 -1.26 -4.86 120.64 118.87 2jns n GLU 8 Ca 0.00 -3.13 -0.39 0.00 -0.02 0.00 0.00 57.16 53.62 2jns n GLU 8 Cb 0.00 -3.30 -0.02 0.00 -0.02 0.00 0.00 31.44 28.10 2jns n GLU 8 CO 0.00 0.00 0.00 0.43 1.18 0.00 0.00 177.13 178.74 2jns n SER 9 N 6.69 5.47 -0.02 1.62 7.64 -1.26 -4.79 113.62 128.97 2jns n SER 9 Ca 0.48 -2.68 0.19 0.00 1.01 0.00 0.00 58.87 57.86 2jns n SER 9 Cb 0.42 -1.50 0.65 0.00 -1.01 0.00 0.00 64.21 62.77 2jns n SER 9 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 2jns h GLU 10 N 5.92 0.08 -0.07 1.43 4.39 -1.98 -0.73 114.58 123.62 2jns h GLU 10 Ca 0.65 -0.00 0.02 0.00 0.34 0.00 0.00 59.36 60.36 2jns h GLU 10 Cb 0.47 -0.02 -0.00 0.00 -0.10 0.00 0.00 28.75 29.10 2jns h GLU 10 CO 1.82 0.05 0.09 1.49 -1.16 0.00 0.00 179.01 181.30 2jns h GLU 11 N 0.08 0.00 0.00 2.33 4.81 -1.92 -1.11 114.58 118.77 2jns h GLU 11 Ca 0.26 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.45 2jns h GLU 11 Cb 0.94 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.31 2jns h GLU 11 CO -0.02 0.00 -0.22 1.49 -0.73 0.00 0.00 179.01 179.53 2jns h GLU 12 N 0.00 0.00 0.00 1.92 4.81 -1.54 -3.29 114.58 116.48 2jns h GLU 12 Ca 0.03 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.26 2jns h GLU 12 Cb 0.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.59 2jns h GLU 12 CO -0.00 0.22 0.00 -3.47 -0.73 0.00 0.00 179.01 175.03 2jns n ASP 13 N -4.27 0.58 -4.86 1.04 2.03 -0.72 -5.05 116.55 105.30 2jns n ASP 13 Ca -0.02 -0.87 -0.25 0.00 0.52 0.00 0.00 54.79 54.17 2jns n ASP 13 Cb 0.28 0.15 0.07 0.00 -0.72 0.00 0.00 41.12 40.90 2jns n ASP 13 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2jns s LYS 14 N -0.15 2.10 0.21 -0.67 3.01 -0.50 -5.12 119.74 118.62 2jns s LYS 14 Ca 0.00 -0.44 -0.08 0.00 -1.01 0.00 0.00 55.97 54.44 2jns s LYS 14 Cb 0.00 -2.22 -0.02 0.00 -1.01 0.00 0.00 37.83 34.59 2jns s LYS 14 CO 0.00 -1.25 0.32 0.00 0.51 0.00 0.00 175.35 174.93 2jns s LYS 16 N -4.04 0.46 -0.23 0.00 -0.14 -1.26 -5.12 119.74 109.41 2jns s LYS 16 Ca 0.25 -0.44 -0.29 0.00 -1.36 0.00 0.00 55.97 54.13 2jns s LYS 16 Cb 0.03 0.19 -0.01 0.00 -1.68 0.00 0.00 37.83 36.35 2jns s LYS 16 CO 0.07 -0.11 1.38 -1.25 -0.76 0.00 0.00 175.35 174.69 2jns s PRO 17 N -1.43 3.99 -0.02 -1.68 0.04 -1.26 -4.65 135.00 129.99 2jns s PRO 17 Ca -0.15 1.51 -0.30 0.00 0.04 0.00 0.00 61.00 62.10 2jns s PRO 17 Cb -0.08 -3.89 -0.05 0.00 0.04 0.00 0.00 34.50 30.53 2jns s PRO 17 CO 0.01 -1.03 1.33 -1.64 0.04 0.00 0.00 177.00 175.72 2jns s MET 18 N 4.08 4.30 0.87 4.56 -1.94 -1.26 -5.03 119.30 124.89 2jns s MET 18 Ca 0.60 1.86 -0.13 0.00 -1.71 0.00 0.00 55.69 56.32 2jns s MET 18 Cb -0.21 -3.58 0.12 0.00 2.01 0.00 0.00 34.83 33.17 2jns s MET 18 CO 0.22 -0.54 1.18 0.45 -0.01 0.00 0.00 175.02 176.32 2jns s SER 19 N 1.78 3.89 0.26 3.03 0.15 -1.26 -4.85 113.70 116.69 2jns s SER 19 Ca 0.61 0.77 -0.05 0.00 0.70 0.00 0.00 55.95 57.98 2jns s SER 19 Cb -0.29 -1.22 0.31 0.00 -1.71 0.00 0.00 66.02 63.11 2jns s SER 19 CO 0.25 -2.29 1.94 0.22 1.20 0.00 0.00 173.24 174.55 2jns h TYR 20 N -1.32 1.22 -0.43 3.44 3.20 -1.99 -1.50 116.97 119.58 2jns h TYR 20 Ca -0.47 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.38 2jns h TYR 20 Cb 1.32 -0.41 -0.02 0.00 1.54 0.00 0.00 36.73 39.16 2jns h TYR 20 CO 0.04 0.76 0.06 0.93 -1.64 0.00 0.00 178.16 178.31 2jns h GLU 21 N 1.30 0.66 -0.10 1.82 4.39 -1.99 -0.28 114.58 120.40 2jns h GLU 21 Ca 0.36 -0.13 -0.05 0.00 0.34 0.00 0.00 59.36 59.88 2jns h GLU 21 Cb -0.13 -0.10 -0.00 0.00 -0.10 0.00 0.00 28.75 28.42 2jns h GLU 21 CO -0.08 0.63 -0.13 0.93 -1.16 0.00 0.00 179.01 179.21 2jns h GLU 22 N 0.64 0.25 -0.40 2.33 4.39 -1.68 -0.45 114.58 119.66 2jns h GLU 22 Ca 0.14 -0.14 0.05 0.00 0.34 0.00 0.00 59.36 59.75 2jns h GLU 22 Cb 0.30 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.92 2jns h GLU 22 CO 0.00 0.70 0.12 0.87 -1.16 0.00 0.00 179.01 179.54 2jns h LYS 23 N -0.18 0.26 0.04 2.33 1.57 -0.98 -0.48 116.57 119.14 2jns h LYS 23 Ca 0.01 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2jns h LYS 23 Cb 0.67 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.92 2jns h LYS 23 CO 0.03 0.17 -0.02 0.00 -0.57 0.00 0.00 179.45 179.06 2jns h ARG 24 N 0.27 -0.06 -0.83 3.15 2.47 -1.06 -3.18 114.38 115.14 2jns h ARG 24 Ca 0.19 0.00 0.12 0.00 -1.26 0.00 0.00 59.98 59.03 2jns h ARG 24 Cb 0.19 0.01 -0.08 0.00 -1.65 0.00 0.00 29.97 28.44 2jns h ARG 24 CO -0.21 0.42 0.45 0.37 0.56 0.00 0.00 179.97 181.56 2jns h GLN 25 N -0.56 0.68 -0.69 0.04 5.75 -0.92 -0.74 115.11 118.67 2jns h GLN 25 Ca -0.01 -0.04 0.05 0.00 -0.15 0.00 0.00 58.65 58.50 2jns h GLN 25 Cb 0.50 -0.15 -0.04 0.00 1.07 0.00 0.00 27.48 28.86 2jns h GLN 25 CO 0.01 0.45 0.46 1.25 -2.65 0.00 0.00 178.83 178.35 2jns h LEU 26 N 0.70 0.68 -0.42 -2.39 5.85 -1.13 -2.09 115.31 116.51 2jns h LEU 26 Ca 0.43 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 59.10 2jns h LEU 26 Cb 0.50 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.37 2jns h LEU 26 CO -0.30 0.45 0.08 -1.28 -0.34 0.00 0.00 178.44 177.05 2jns h SER 27 N 0.78 0.65 -0.60 1.25 0.87 -1.11 -0.61 113.55 114.77 2jns h SER 27 Ca 0.29 -0.25 0.06 0.00 -1.23 0.00 0.00 61.79 60.66 2jns h SER 27 Cb 0.16 -0.17 -0.05 0.00 -0.44 0.00 0.00 62.40 61.89 2jns h SER 27 CO -0.09 0.73 0.31 -0.07 -0.53 0.00 0.00 176.83 177.19 2jns h LEU 28 N 0.54 0.45 -0.28 2.23 -0.00 -1.22 -1.65 115.31 115.39 2jns h LEU 28 Ca 0.13 0.03 -0.21 0.00 -0.00 0.00 0.00 57.88 57.84 2jns h LEU 28 Cb 0.35 -0.05 0.00 0.00 -0.00 0.00 0.00 40.66 40.96 2jns h LEU 28 CO 0.01 0.29 -0.83 0.44 -0.00 0.00 0.00 178.44 178.35 2jns h ASP 29 N 0.59 0.56 -0.95 -0.43 3.32 -1.38 -3.15 116.42 114.98 2jns h ASP 29 Ca 0.27 -0.40 0.08 0.00 0.02 0.00 0.00 57.03 57.01 2jns h ASP 29 Cb 0.19 -0.17 -0.07 0.00 0.22 0.00 0.00 39.33 39.50 2jns h ASP 29 CO -0.19 1.17 0.60 0.40 -1.72 0.00 0.00 179.24 179.50 2jns h ILE 30 N 0.29 1.00 0.00 0.35 2.04 -0.58 -0.08 117.51 120.53 2jns h ILE 30 Ca -0.05 -0.35 0.00 0.00 1.00 0.00 0.00 64.86 65.45 2jns h ILE 30 Cb 1.44 -0.11 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 2jns h ILE 30 CO 0.15 0.19 0.00 0.59 0.00 0.00 0.00 178.15 179.07 2jns n ASN 31 N -4.60 0.44 0.18 1.72 3.02 -0.67 -1.94 115.26 113.42 2jns n ASN 31 Ca 0.16 0.64 0.07 0.00 -0.03 0.00 0.00 54.58 55.42 2jns n ASN 31 Cb 0.25 -0.72 0.22 0.00 -0.61 0.00 0.00 39.78 38.92 2jns n ASN 31 CO 0.00 0.00 0.00 0.11 -2.62 0.00 0.00 177.26 174.75 2jns h LYS 32 N 0.00 0.00 -7.01 3.52 1.79 -1.08 -3.45 116.57 110.34 2jns h LYS 32 Ca 0.00 0.00 -0.51 0.00 -2.18 0.00 0.00 60.65 57.96 2jns h LYS 32 Cb 0.20 0.00 0.08 0.00 -1.58 0.00 0.00 32.23 30.92 2jns h LYS 32 CO 0.00 0.32 0.51 -0.51 -1.08 0.00 0.00 179.45 178.69 2jns s LEU 33 N -6.57 3.99 0.72 2.94 1.43 -0.82 -5.01 118.68 115.35 2jns s LEU 33 Ca 0.03 2.38 -0.11 0.00 -1.03 0.00 0.00 54.13 55.40 2jns s LEU 33 Cb 0.08 -4.24 0.02 0.00 0.03 0.00 0.00 46.19 42.08 2jns s LEU 33 CO 0.69 -1.02 1.08 -2.16 0.23 0.00 0.00 176.35 175.17 2jns s PRO 34 N -2.73 2.67 0.27 1.29 0.04 -1.26 -4.77 135.00 130.51 2jns s PRO 34 Ca 0.65 1.10 0.00 0.00 0.04 0.00 0.00 61.00 62.79 2jns s PRO 34 Cb -0.31 -1.95 0.52 0.00 0.04 0.00 0.00 34.50 32.80 2jns s PRO 34 CO 0.37 -1.32 1.83 0.78 0.04 0.00 0.00 177.00 178.70 2jns h GLY 35 N -0.74 1.58 2.00 0.56 0.00 -1.96 -0.03 103.07 104.48 2jns h GLY 35 Ca -0.44 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 46.48 2jns h GLY 35 CO 0.54 0.17 -0.02 1.05 0.00 0.00 0.00 176.54 178.28 2jns h GLU 36 N 0.97 0.00 0.00 4.80 4.11 -2.03 -2.34 114.58 120.08 2jns h GLU 36 Ca 0.48 0.00 -0.07 0.00 0.07 0.00 0.00 59.36 59.84 2jns h GLU 36 Cb 0.45 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2jns h GLU 36 CO -0.26 0.02 -2.00 1.63 0.07 0.00 0.00 179.01 178.47 2jns n LYS 37 N -3.85 0.68 -0.35 1.06 5.02 -0.19 -4.48 118.16 116.05 2jns n LYS 37 Ca -0.03 -0.15 0.04 0.00 -2.02 0.00 0.00 58.31 56.15 2jns n LYS 37 Cb 0.10 -1.48 0.19 0.00 -0.02 0.00 0.00 35.03 33.82 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 0.94 0.00 -0.35 5.85 -0.54 -1.18 115.31 120.02 2jns h LEU 38 Ca -0.10 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.64 2jns h LEU 38 Cb 1.18 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 42.04 2jns h LEU 38 CO 0.01 0.57 0.00 0.61 -0.34 0.00 0.00 178.44 179.28 2jns n GLY 39 N -1.35 -0.46 0.08 3.75 0.00 -1.24 -0.71 105.19 105.26 2jns n GLY 39 Ca 0.16 -0.03 0.01 0.00 0.00 0.00 0.00 46.02 46.16 2jns n GLY 39 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2jns n ARG 40 N -1.25 0.64 0.22 1.61 0.63 -0.45 -4.20 116.66 113.87 2jns n ARG 40 Ca 0.03 0.09 -0.15 0.00 -0.92 0.00 0.00 57.85 56.90 2jns n ARG 40 Cb 0.05 -1.70 -0.08 0.00 0.45 0.00 0.00 32.46 31.18 2jns n ARG 40 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2jns h VAL 41 N 0.00 0.57 -1.01 5.15 2.07 -0.97 -2.76 116.25 119.31 2jns h VAL 41 Ca -0.19 0.00 0.25 0.00 0.82 0.00 0.00 66.70 67.58 2jns h VAL 41 Cb 1.55 0.57 -0.09 0.00 -1.52 0.00 0.00 31.29 31.81 2jns h VAL 41 CO 0.03 0.00 0.65 1.62 0.02 0.00 0.00 177.57 179.89 2jns h VAL 42 N -0.54 0.57 -0.16 2.57 3.04 -1.74 0.05 116.25 120.04 2jns h VAL 42 Ca -0.04 -0.14 -0.03 0.00 -1.01 0.00 0.00 66.70 65.47 2jns h VAL 42 Cb 0.43 0.13 -0.01 0.00 -2.01 0.00 0.00 31.29 29.83 2jns h VAL 42 CO 0.06 0.07 -0.05 -0.74 -1.01 0.00 0.00 177.57 175.91 2jns h HIS 43 N 0.41 0.23 -0.07 3.17 6.17 -1.66 -0.88 115.15 122.53 2jns h HIS 43 Ca 0.56 -0.01 -0.01 0.00 0.71 0.00 0.00 60.37 61.61 2jns h HIS 43 Cb 1.41 -0.07 -0.00 0.00 2.52 0.00 0.00 27.41 31.27 2jns h HIS 43 CO -0.00 0.29 -0.01 0.82 0.71 0.00 0.00 177.93 179.73 2jns h ILE 44 N 0.23 1.28 -0.85 6.26 2.04 -1.01 -3.05 117.51 122.41 2jns h ILE 44 Ca 0.05 -0.89 -0.03 0.00 1.00 0.00 0.00 64.86 64.99 2jns h ILE 44 Cb 0.23 1.74 -0.04 0.00 -0.74 0.00 0.00 36.82 38.02 2jns h ILE 44 CO 0.01 0.25 0.43 0.40 0.00 0.00 0.00 178.15 179.23 2jns h ILE 45 N -0.19 1.26 -0.03 -0.67 5.03 -1.45 -1.82 117.51 119.63 2jns h ILE 45 Ca 0.02 -0.69 0.01 0.00 -0.12 0.00 0.00 64.86 64.08 2jns h ILE 45 Cb 0.40 0.15 -0.00 0.00 -3.03 0.00 0.00 36.82 34.33 2jns h ILE 45 CO 0.01 0.30 0.08 1.56 -0.68 0.00 0.00 178.15 179.42 2jns h GLN 46 N 1.20 0.00 0.02 2.37 4.20 -1.09 0.19 115.11 122.01 2jns h GLN 46 Ca 0.29 0.00 -0.22 0.00 0.06 0.00 0.00 58.65 58.79 2jns h GLN 46 Cb 0.09 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.86 2jns h GLN 46 CO -0.04 0.00 -0.96 1.03 -0.67 0.00 0.00 178.83 178.19 2jns h SER 47 N 0.00 0.35 0.28 1.46 0.87 -1.22 -3.34 113.55 111.94 2jns h SER 47 Ca 0.02 -0.30 -0.34 0.00 -1.23 0.00 0.00 61.79 59.94 2jns h SER 47 Cb 0.17 -0.11 0.02 0.00 -0.44 0.00 0.00 62.40 62.04 2jns h SER 47 CO -0.00 1.13 -1.60 0.03 -0.53 0.00 0.00 176.83 175.86 2jns h ARG 48 N 0.13 0.42 -4.11 2.24 2.47 -0.83 -3.42 114.38 111.29 2jns h ARG 48 Ca -0.07 -0.72 -0.72 0.00 -1.26 0.00 0.00 59.98 57.21 2jns h ARG 48 Cb 1.62 0.27 -0.31 0.00 -1.65 0.00 0.00 29.97 29.90 2jns h ARG 48 CO 0.15 1.33 -0.35 -1.21 0.56 0.00 0.00 179.97 180.46 2jns s GLU 49 N -2.60 2.57 0.16 0.04 0.41 0.42 -4.99 118.70 114.71 2jns s GLU 49 Ca -0.12 -2.03 -0.15 0.00 -0.41 0.00 0.00 54.97 52.26 2jns s GLU 49 Cb 0.05 -3.90 0.05 0.00 -1.78 0.00 0.00 34.13 28.55 2jns s GLU 49 CO 0.89 -1.19 1.81 -1.00 -0.49 0.00 0.00 175.26 175.29 2jns h PRO 50 N 8.01 0.54 -0.17 0.39 0.13 -1.83 -3.01 132.00 136.06 2jns h PRO 50 Ca -0.12 -0.03 0.05 0.00 -0.87 0.00 0.00 66.00 65.03 2jns h PRO 50 Cb 1.04 -0.12 -0.05 0.00 0.13 0.00 0.00 31.00 31.99 2jns h PRO 50 CO 0.80 0.36 -0.18 0.66 -0.23 0.00 0.00 178.00 179.41 2jns h SER 51 N 0.56 -0.55 0.00 1.44 4.64 -1.94 -1.49 113.55 116.21 2jns h SER 51 Ca 0.17 0.10 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 2jns h SER 51 Cb -0.03 0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2jns h SER 51 CO -0.06 -0.22 0.04 -0.07 -0.87 0.00 0.00 176.83 175.65 2jns h LEU 52 N -0.20 0.00 -0.34 5.97 -0.00 -1.88 -0.84 115.31 118.02 2jns h LEU 52 Ca 0.11 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.99 2jns h LEU 52 Cb 0.37 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.03 2jns h LEU 52 CO -0.29 0.00 0.00 1.17 -0.00 0.00 0.00 178.44 179.32 2jns n LYS 53 N -2.55 0.11 -1.14 1.13 4.81 -0.56 -2.86 118.16 117.09 2jns n LYS 53 Ca -0.02 0.32 -0.19 0.00 -0.87 0.00 0.00 58.31 57.55 2jns n LYS 53 Cb 0.08 -1.70 0.17 0.00 0.02 0.00 0.00 35.03 33.60 2jns n LYS 53 CO 0.00 0.00 0.00 0.09 1.17 0.00 0.00 177.40 178.66 2jns n ASN 54 N -1.90 3.87 -4.16 3.14 3.02 -0.32 -4.95 115.26 113.95 2jns n ASN 54 Ca 0.03 -3.70 -0.16 0.00 -0.03 0.00 0.00 54.58 50.72 2jns n ASN 54 Cb 0.23 -0.77 -0.11 0.00 -0.61 0.00 0.00 39.78 38.51 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 -1.87 1.51 0.40 6.41 0.01 -1.14 -5.13 113.70 113.89 2jns s SER 55 Ca 0.54 -0.69 -0.25 0.00 1.31 0.00 0.00 55.95 56.86 2jns s SER 55 Cb 0.46 -0.02 -0.08 0.00 0.21 0.00 0.00 66.02 66.58 2jns s SER 55 CO 0.05 -0.16 1.17 0.21 0.41 0.00 0.00 173.24 174.92 2jns s ASN 56 N -2.01 6.52 0.50 2.44 2.47 -1.26 -4.93 114.94 118.67 2jns s ASN 56 Ca 0.00 2.35 0.21 0.00 0.42 0.00 0.00 52.86 55.84 2jns s ASN 56 Cb -0.07 -2.61 1.28 0.00 -1.45 0.00 0.00 41.25 38.40 2jns s ASN 56 CO 0.01 -0.68 2.01 -0.65 -3.72 0.00 0.00 177.10 174.07 2jns h PRO 57 N 2.63 0.11 0.00 0.43 0.11 -1.95 -0.97 132.00 132.36 2jns h PRO 57 Ca -0.49 -0.01 -0.11 0.00 0.11 0.00 0.00 66.00 65.51 2jns h PRO 57 Cb 1.23 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 32.31 2jns h PRO 57 CO 0.62 0.07 -0.51 0.22 -0.21 0.00 0.00 178.00 178.20 2jns h ASP 58 N 0.11 0.00 1.53 -2.05 3.58 -2.00 -3.22 116.42 114.37 2jns h ASP 58 Ca 0.23 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.68 2jns h ASP 58 Cb 0.78 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.83 2jns h ASP 58 CO -0.03 0.51 -0.17 -0.33 -2.88 0.00 0.00 179.24 176.34 2jns h GLU 59 N 0.00 0.00 -5.92 0.28 5.08 -1.55 -3.44 114.58 109.03 2jns h GLU 59 Ca -0.01 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.77 2jns h GLU 59 Cb 1.23 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 30.40 2jns h GLU 59 CO 0.07 0.00 0.37 0.42 -1.00 0.00 0.00 179.01 178.87 2jns s ILE 60 N -3.17 4.89 0.18 3.13 1.01 -1.11 -4.97 121.20 121.16 2jns s ILE 60 Ca 0.08 1.59 -0.03 0.00 0.00 0.00 0.00 60.65 62.29 2jns s ILE 60 Cb 0.10 -4.12 -0.05 0.00 0.01 0.00 0.00 42.46 38.40 2jns s ILE 60 CO 0.66 0.03 0.40 -1.61 0.00 0.00 0.00 174.94 174.41 2jns s GLU 61 N 2.16 3.58 -0.33 2.79 2.02 -1.26 -5.01 118.70 122.65 2jns s GLU 61 Ca 0.37 -0.17 -0.18 0.00 0.02 0.00 0.00 54.97 55.00 2jns s GLU 61 Cb -0.16 -2.82 -0.01 0.00 0.10 0.00 0.00 34.13 31.23 2jns s GLU 61 CO 0.12 0.42 0.53 0.42 0.02 0.00 0.00 175.26 176.77 2jns s ILE 62 N -1.78 5.01 -0.27 -1.63 1.01 -1.26 -5.03 121.20 117.24 2jns s ILE 62 Ca 0.40 0.50 -0.01 0.00 0.00 0.00 0.00 60.65 61.54 2jns s ILE 62 Cb -0.12 -3.95 0.08 0.00 0.01 0.00 0.00 42.46 38.48 2jns s ILE 62 CO 0.27 -0.17 0.05 -0.62 0.00 0.00 0.00 174.94 174.47 2jns s ASP 63 N 1.72 3.78 0.22 3.58 -1.08 -1.26 -4.98 116.67 118.66 2jns s ASP 63 Ca 0.20 -1.38 0.24 0.00 -0.52 0.00 0.00 52.55 51.09 2jns s ASP 63 Cb -0.15 -0.93 0.91 0.00 -1.46 0.00 0.00 42.92 41.29 2jns s ASP 63 CO 0.13 -0.35 1.74 0.49 0.52 0.00 0.00 175.17 177.69 2jns n PHE 64 N 4.81 0.80 0.90 -5.34 3.01 -1.26 -2.24 117.46 118.15 2jns n PHE 64 Ca -0.05 0.28 0.14 0.00 1.01 0.00 0.00 57.45 58.82 2jns n PHE 64 Cb 0.44 -0.95 0.56 0.00 -0.01 0.00 0.00 39.48 39.52 2jns n PHE 64 CO 0.00 0.00 0.00 -0.85 1.01 0.00 0.00 176.76 176.92 2jns n GLU 65 N -2.20 0.07 0.00 -1.08 0.28 -1.26 -3.94 120.64 112.51 2jns n GLU 65 Ca 0.04 0.06 0.00 0.00 -0.16 0.00 0.00 57.16 57.09 2jns n GLU 65 Cb 0.31 -1.58 0.00 0.00 1.43 0.00 0.00 31.44 31.60 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 -1.70 0.00 -1.87 3.84 -2.24 -1.12 -5.08 114.28 106.10 2jns n THR 66 Ca 0.07 -0.03 -0.32 0.00 -2.27 0.00 0.00 64.05 61.50 2jns n THR 66 Cb 0.36 0.41 0.02 0.00 -2.10 0.00 0.00 70.33 69.03 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 -2.06 3.35 0.52 3.22 1.43 -0.95 -5.05 118.68 119.14 2jns s LEU 67 Ca 0.00 1.71 -0.17 0.00 -1.03 0.00 0.00 54.13 54.65 2jns s LEU 67 Cb 0.00 -4.52 -0.07 0.00 0.03 0.00 0.00 46.19 41.63 2jns s LEU 67 CO 0.00 -1.23 0.99 -0.54 0.23 0.00 0.00 176.35 175.80 2jns s LYS 68 N -4.48 3.88 0.28 1.70 1.02 -1.26 -4.97 119.74 115.90 2jns s LYS 68 Ca 0.61 1.00 -0.02 0.00 0.02 0.00 0.00 55.97 57.58 2jns s LYS 68 Cb -0.15 -2.12 0.39 0.00 -0.52 0.00 0.00 37.83 35.43 2jns s LYS 68 CO 0.44 -0.33 1.83 -1.00 -0.92 0.00 0.00 175.35 175.37 2jns h PRO 69 N 0.91 0.88 -0.77 -1.68 0.13 -1.95 -2.52 132.00 127.00 2jns h PRO 69 Ca -0.47 -0.17 -0.02 0.00 -0.87 0.00 0.00 66.00 64.48 2jns h PRO 69 Cb 1.19 -0.14 -0.04 0.00 0.13 0.00 0.00 31.00 32.14 2jns h PRO 69 CO 0.61 0.76 0.42 0.66 -0.23 0.00 0.00 178.00 180.22 2jns h SER 70 N 0.85 0.96 0.27 1.44 4.64 -1.94 -1.83 113.55 117.93 2jns h SER 70 Ca 0.19 -0.08 -0.01 0.00 -0.47 0.00 0.00 61.79 61.42 2jns h SER 70 Cb 0.26 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.10 2jns h SER 70 CO -0.01 0.78 -0.13 0.74 -0.87 0.00 0.00 176.83 177.34 2jns h THR 71 N 1.08 0.75 -0.91 2.95 2.02 -1.85 -2.86 112.91 114.09 2jns h THR 71 Ca 0.27 -0.06 0.03 0.00 0.77 0.00 0.00 66.41 67.42 2jns h THR 71 Cb 0.04 0.79 -0.05 0.00 -1.74 0.00 0.00 68.15 67.18 2jns h THR 71 CO -0.04 0.01 0.59 -0.07 0.37 0.00 0.00 175.52 176.38 2jns h LEU 72 N -0.39 0.99 -1.18 2.58 3.38 -1.36 -2.42 115.31 116.90 2jns h LEU 72 Ca -0.04 -0.01 0.17 0.00 0.09 0.00 0.00 57.88 58.09 2jns h LEU 72 Cb 0.30 -0.22 -0.08 0.00 0.09 0.00 0.00 40.66 40.74 2jns h LEU 72 CO 0.06 0.68 0.60 0.03 0.09 0.00 0.00 178.44 179.90 2jns h ARG 73 N 1.15 0.70 -0.03 1.13 2.47 -1.11 -1.11 114.38 117.59 2jns h ARG 73 Ca 0.36 -0.04 -0.21 0.00 -1.26 0.00 0.00 59.98 58.83 2jns h ARG 73 Cb -0.01 -0.16 -0.00 0.00 -1.65 0.00 0.00 29.97 28.16 2jns h ARG 73 CO -0.12 0.46 -0.87 0.93 0.56 0.00 0.00 179.97 180.94 2jns h GLU 74 N 0.72 0.40 -0.55 0.04 5.08 -1.33 -2.64 114.58 116.30 2jns h GLU 74 Ca 0.51 -0.39 -0.08 0.00 -1.00 0.00 0.00 59.36 58.39 2jns h GLU 74 Cb 0.82 0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.16 2jns h GLU 74 CO -0.27 1.06 0.02 -0.07 -1.00 0.00 0.00 179.01 178.74 2jns h LEU 75 N 0.24 0.94 -0.53 1.33 3.38 -1.26 -1.16 115.31 118.25 2jns h LEU 75 Ca -0.06 -0.30 0.02 0.00 0.09 0.00 0.00 57.88 57.64 2jns h LEU 75 Cb 1.48 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.95 2jns h LEU 75 CO 0.15 1.01 0.32 -0.08 0.09 0.00 0.00 178.44 179.93 2jns h GLU 76 N 0.84 0.62 -0.68 1.13 4.81 -1.22 0.26 114.58 120.34 2jns h GLU 76 Ca 0.16 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.32 2jns h GLU 76 Cb 0.51 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.72 2jns h GLU 76 CO 0.02 0.41 0.32 0.00 -0.73 0.00 0.00 179.01 179.04 2jns h ARG 77 N 0.64 0.99 0.31 1.92 3.08 -1.20 -1.42 114.38 118.70 2jns h ARG 77 Ca 0.21 -0.15 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 2jns h ARG 77 Cb 0.02 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 29.89 2jns h ARG 77 CO -0.09 0.78 -0.15 -0.92 -1.07 0.00 0.00 179.97 178.52 2jns h TYR 78 N 0.95 -0.39 -0.71 3.04 3.20 -0.35 -2.59 116.97 120.13 2jns h TYR 78 Ca 0.23 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 62.09 2jns h TYR 78 Cb 0.13 0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.49 2jns h TYR 78 CO 0.01 -0.18 0.44 -0.39 -1.64 0.00 0.00 178.16 176.39 2jns h VAL 79 N -0.51 1.20 -0.00 1.81 -1.51 -0.91 -1.76 116.25 114.57 2jns h VAL 79 Ca -0.04 -0.42 0.00 0.00 -1.23 0.00 0.00 66.70 65.01 2jns h VAL 79 Cb 0.38 0.20 -0.00 0.00 -2.13 0.00 0.00 31.29 29.74 2jns h VAL 79 CO 0.07 0.20 0.00 0.74 -1.23 0.00 0.00 177.57 177.36 2jns h THR 80 N 0.97 0.33 0.00 7.19 2.02 -1.17 -0.60 112.91 121.65 2jns h THR 80 Ca 0.26 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.40 2jns h THR 80 Cb -0.05 1.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 2jns h THR 80 CO -0.05 0.00 -0.52 0.28 0.37 0.00 0.00 175.52 175.60 2jns h SER 81 N 0.00 0.00 0.07 4.18 0.02 -0.91 -2.78 113.55 114.13 2jns h SER 81 Ca 0.00 0.00 -0.13 0.00 -0.84 0.00 0.00 61.79 60.83 2jns h SER 81 Cb 0.01 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.55 2jns h SER 81 CO -0.00 0.13 -0.59 0.00 -1.14 0.00 0.00 176.83 175.23 2jns n LEU 83 N -4.32 0.00 -3.93 0.00 4.77 -0.60 -4.78 117.00 108.13 2jns n LEU 83 Ca -0.15 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.72 2jns n LEU 83 Cb 0.68 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.64 2jns n LEU 83 CO 0.39 0.00 -0.37 -0.60 -1.33 0.00 0.00 177.39 175.49 2jns s ARG 84 N -2.00 0.18 0.00 3.23 6.06 -1.05 -5.02 118.95 120.36 2jns s ARG 84 Ca 0.31 -0.28 -0.00 0.00 -2.50 0.00 0.00 55.73 53.26 2jns s ARG 84 Cb 0.14 -0.02 -0.00 0.00 0.06 0.00 0.00 34.95 35.13 2jns s ARG 84 CO 0.24 -0.00 1.00 0.87 -2.50 0.00 0.00 175.30 174.91 2jns h LYS 85 N 5.50 -0.00 -3.38 5.12 1.57 -1.86 -3.44 116.57 120.08 2jns h LYS 85 Ca -0.28 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.44 2jns h LYS 85 Cb 1.21 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.38 2jns h LYS 85 CO 0.47 -0.00 -0.11 0.21 -0.57 0.00 0.00 179.45 179.44 2jns s LYS 86 N -3.01 1.02 0.20 3.15 2.47 -1.26 -5.02 119.74 117.28 2jns s LYS 86 Ca -0.00 -0.68 -0.01 0.00 -1.56 0.00 0.00 55.97 53.72 2jns s LYS 86 Cb 0.00 0.45 -0.04 0.00 -1.46 0.00 0.00 37.83 36.78 2jns s LYS 86 CO 0.00 -0.38 0.12 1.03 0.16 0.00 0.00 175.35 176.28 2jns s ARG 87 N -3.58 1.19 -0.40 4.03 1.81 -1.26 -5.00 118.95 115.73 2jns s ARG 87 Ca 0.02 -1.62 -0.12 0.00 -1.72 0.00 0.00 55.73 52.28 2jns s ARG 87 Cb 0.02 0.23 0.02 0.00 -0.45 0.00 0.00 34.95 34.76 2jns s ARG 87 CO -0.10 -0.37 0.39 1.63 -0.68 0.00 0.00 175.30 176.17 2jns n LYS 88 N -0.27 -1.08 -1.60 3.54 4.76 -1.26 -4.94 118.16 117.32 2jns n LYS 88 Ca 0.01 0.67 -0.29 0.00 -2.87 0.00 0.00 58.31 55.82 2jns n LYS 88 Cb 0.66 -1.30 0.10 0.00 -1.84 0.00 0.00 35.03 32.65 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 -2.70 1.84 0.00 1.97 0.04 -1.26 -5.32 135.00 129.57 2jns s PRO 89 Ca 0.12 0.47 0.29 0.00 0.04 0.00 0.00 61.00 61.93 2jns s PRO 89 Cb -0.01 -1.90 1.36 0.00 0.04 0.00 0.00 34.50 33.98 2jns s PRO 89 CO 0.55 -1.76 1.92 1.04 0.04 0.00 0.00 177.00 178.80