#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2klg h GLN 2 N 0.00 0.31 -4.49 2.12 1.08 -2.00 -3.48 115.11 108.66 2klg h GLN 2 Ca 0.00 -0.54 -0.20 0.00 -1.45 0.00 0.00 58.65 56.46 2klg h GLN 2 Cb 0.00 0.20 -0.15 0.00 -0.05 0.00 0.00 27.48 27.48 2klg h GLN 2 CO 0.00 1.26 -0.65 0.96 -0.95 0.00 0.00 178.83 179.44 2klg s ILE 3 N -2.50 0.23 -0.20 2.54 -5.25 -1.26 -0.43 121.20 114.32 2klg s ILE 3 Ca -0.17 -1.92 -0.01 0.00 -0.99 0.00 0.00 60.65 57.57 2klg s ILE 3 Cb 0.04 -2.02 0.05 0.00 2.95 0.00 0.00 42.46 43.48 2klg s ILE 3 CO 0.81 -0.51 -0.03 -0.36 -1.79 0.00 0.00 174.94 173.06 2klg s PHE 4 N -3.96 1.81 0.18 1.37 0.40 -1.26 -4.25 117.98 112.28 2klg s PHE 4 Ca 0.23 -1.29 0.08 0.00 -0.60 0.00 0.00 56.93 55.34 2klg s PHE 4 Cb 0.07 -1.35 -0.04 0.00 0.51 0.00 0.00 43.02 42.21 2klg s PHE 4 CO 0.01 -0.68 -0.01 0.08 0.70 0.00 0.00 175.22 175.33 2klg s VAL 5 N 1.59 3.64 0.34 -0.44 1.01 -1.25 -4.58 120.40 120.72 2klg s VAL 5 Ca -0.02 -1.49 0.08 0.00 0.00 0.00 0.00 61.98 60.54 2klg s VAL 5 Cb -0.17 -2.84 -0.03 0.00 0.00 0.00 0.00 36.38 33.34 2klg s VAL 5 CO -0.07 -0.13 0.29 -0.54 0.00 0.00 0.00 175.10 174.65 2klg s LYS 6 N -3.00 2.69 0.00 2.72 3.01 -1.26 -3.53 119.74 120.37 2klg s LYS 6 Ca 0.27 -1.33 0.00 0.00 -1.01 0.00 0.00 55.97 53.90 2klg s LYS 6 Cb -0.09 -2.45 0.00 0.00 -1.01 0.00 0.00 37.83 34.28 2klg s LYS 6 CO 0.18 0.07 0.00 0.25 0.51 0.00 0.00 175.35 176.36 2klg n THR 7 N -1.38 0.00 -0.18 2.17 -2.24 -1.26 -4.75 114.28 106.65 2klg n THR 7 Ca -0.01 0.00 -0.06 0.00 -2.27 0.00 0.00 64.05 61.70 2klg n THR 7 Cb 0.60 0.00 0.10 0.00 -2.10 0.00 0.00 70.33 68.93 2klg n THR 7 CO 0.00 0.00 0.00 0.17 -0.57 0.00 0.00 175.07 174.67 2klg h LEU 8 N 0.00 0.93 0.00 3.22 -0.00 -1.97 -3.39 115.31 114.09 2klg h LEU 8 Ca 0.00 -0.23 0.00 0.00 -0.00 0.00 0.00 57.88 57.65 2klg h LEU 8 Cb 0.00 -0.25 0.00 0.00 -0.00 0.00 0.00 40.66 40.41 2klg h LEU 8 CO 0.00 0.95 -0.57 0.41 -0.00 0.00 0.00 178.44 179.24 2klg n THR 9 N -4.21 1.32 0.00 0.15 -1.04 -1.26 -4.51 114.28 104.73 2klg n THR 9 Ca 0.03 0.25 0.00 0.00 -2.04 0.00 0.00 64.05 62.30 2klg n THR 9 Cb 0.30 -2.01 0.00 0.00 -1.82 0.00 0.00 70.33 66.80 2klg n THR 9 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2klg n GLY 10 N 2.28 -0.60 3.89 3.41 0.00 -1.26 -5.08 105.19 107.83 2klg n GLY 10 Ca -0.08 0.22 -0.29 0.00 0.00 0.00 0.00 46.02 45.88 2klg n GLY 10 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2klg s LYS 11 N 0.00 3.54 -0.51 1.61 2.20 -1.26 -4.85 119.74 120.46 2klg s LYS 11 Ca 0.00 0.42 -0.19 0.00 -0.36 0.00 0.00 55.97 55.84 2klg s LYS 11 Cb 0.00 -2.25 0.07 0.00 -1.51 0.00 0.00 37.83 34.14 2klg s LYS 11 CO 0.00 -0.38 0.61 0.95 -0.36 0.00 0.00 175.35 176.18 2klg s THR 12 N -2.93 4.91 0.17 3.43 -4.23 -1.26 -4.17 115.64 111.55 2klg s THR 12 Ca 0.51 -0.62 0.09 0.00 -1.18 0.00 0.00 61.69 60.48 2klg s THR 12 Cb -0.11 -4.31 -0.04 0.00 1.34 0.00 0.00 72.50 69.38 2klg s THR 12 CO 0.49 -0.83 -0.12 0.27 -0.54 0.00 0.00 174.62 173.89 2klg s ILE 13 N 2.53 3.10 0.08 2.99 -4.36 -1.23 -5.07 121.20 119.23 2klg s ILE 13 Ca 0.13 -1.64 0.03 0.00 -0.26 0.00 0.00 60.65 58.91 2klg s ILE 13 Cb -0.20 -2.51 -0.04 0.00 1.25 0.00 0.00 42.46 40.95 2klg s ILE 13 CO 0.11 -0.07 0.06 0.42 0.24 0.00 0.00 174.94 175.70 2klg s THR 14 N -1.61 4.44 -0.47 8.37 -4.23 -1.26 -3.82 115.64 117.06 2klg s THR 14 Ca 0.24 -0.80 0.03 0.00 -1.18 0.00 0.00 61.69 59.97 2klg s THR 14 Cb -0.09 -3.13 0.14 0.00 1.34 0.00 0.00 72.50 70.75 2klg s THR 14 CO 0.14 0.13 0.26 -0.22 -0.54 0.00 0.00 174.62 174.39 2klg s LEU 15 N -2.36 3.02 -0.67 4.79 2.96 -1.26 -5.02 118.68 120.14 2klg s LEU 15 Ca 0.28 -2.77 -0.14 0.00 -0.22 0.00 0.00 54.13 51.29 2klg s LEU 15 Cb -0.12 -1.14 0.17 0.00 0.50 0.00 0.00 46.19 45.60 2klg s LEU 15 CO 0.21 -0.25 0.61 -1.83 -1.32 0.00 0.00 176.35 173.77 2klg s GLU 16 N 0.14 3.22 0.36 1.98 -1.05 -1.26 -4.58 118.70 117.51 2klg s GLU 16 Ca 0.18 -2.11 0.03 0.00 -0.15 0.00 0.00 54.97 52.93 2klg s GLU 16 Cb -0.22 -4.30 -0.04 0.00 -0.44 0.00 0.00 34.13 29.12 2klg s GLU 16 CO -0.01 -1.29 0.10 0.14 0.95 0.00 0.00 175.26 175.14 2klg s VAL 17 N 0.83 0.80 0.25 1.83 -7.23 -1.26 -5.17 120.40 110.45 2klg s VAL 17 Ca 0.11 -2.00 0.06 0.00 -1.81 0.00 0.00 61.98 58.34 2klg s VAL 17 Cb -0.20 -2.54 -0.03 0.00 0.56 0.00 0.00 36.38 34.16 2klg s VAL 17 CO -0.03 0.00 0.30 -1.83 -0.31 0.00 0.00 175.10 173.23 2klg s GLU 18 N -3.82 3.26 0.54 4.82 1.03 -1.26 -5.00 118.70 118.27 2klg s GLU 18 Ca 0.30 -0.87 0.25 0.00 0.03 0.00 0.00 54.97 54.68 2klg s GLU 18 Cb 0.05 -2.77 1.42 0.00 -0.80 0.00 0.00 34.13 32.03 2klg s GLU 18 CO 0.15 0.42 2.02 -1.35 -1.33 0.00 0.00 175.26 175.16 2klg h PRO 19 N 1.28 0.00 0.00 -4.83 0.11 -2.04 0.75 132.00 127.27 2klg h PRO 19 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2klg h PRO 19 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 2klg h PRO 19 CO 0.61 0.00 0.00 1.03 -0.21 0.00 0.00 178.00 179.43 2klg h SER 20 N 0.00 0.00 -2.60 -2.05 0.87 -2.04 -3.44 113.55 104.28 2klg h SER 20 Ca 0.20 0.00 -0.54 0.00 -1.23 0.00 0.00 61.79 60.22 2klg h SER 20 Cb 0.84 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.81 2klg h SER 20 CO -0.00 0.00 1.08 -0.62 -0.53 0.00 0.00 176.83 176.75 2klg s ASP 21 N -4.60 6.61 0.87 6.23 2.15 0.25 -5.00 116.67 123.19 2klg s ASP 21 Ca 0.10 2.41 -0.10 0.00 0.43 0.00 0.00 52.55 55.39 2klg s ASP 21 Cb 0.12 -2.54 0.18 0.00 -0.30 0.00 0.00 42.92 40.37 2klg s ASP 21 CO 0.58 -0.93 1.20 -0.89 -0.17 0.00 0.00 175.17 174.96 2klg s THR 22 N 3.56 2.03 0.18 1.71 2.01 -1.26 -4.27 115.64 119.59 2klg s THR 22 Ca 0.76 -0.25 -0.08 0.00 0.31 0.00 0.00 61.69 62.42 2klg s THR 22 Cb -0.37 -2.78 0.01 0.00 0.01 0.00 0.00 72.50 69.37 2klg s THR 22 CO 0.33 0.00 1.57 0.40 -0.69 0.00 0.00 174.62 176.23 2klg h ILE 23 N -1.22 1.27 -0.52 1.82 2.04 -1.13 -2.46 117.51 117.32 2klg h ILE 23 Ca -0.41 -1.38 -0.09 0.00 1.00 0.00 0.00 64.86 63.98 2klg h ILE 23 Cb 1.24 1.16 -0.02 0.00 -0.74 0.00 0.00 36.82 38.46 2klg h ILE 23 CO 0.37 0.47 -0.04 -0.33 0.00 0.00 0.00 178.15 178.62 2klg h GLU 24 N 0.80 0.94 -0.34 2.37 4.39 -1.84 -2.29 114.58 118.61 2klg h GLU 24 Ca 0.10 -0.32 -0.02 0.00 0.34 0.00 0.00 59.36 59.47 2klg h GLU 24 Cb 0.79 -0.07 -0.02 0.00 -0.10 0.00 0.00 28.75 29.35 2klg h GLU 24 CO 0.07 0.98 0.15 -0.91 -1.16 0.00 0.00 179.01 178.13 2klg h ASN 25 N 0.81 0.47 0.21 1.42 4.21 -1.92 -2.64 115.58 118.13 2klg h ASN 25 Ca 0.14 -0.15 -0.04 0.00 1.21 0.00 0.00 56.30 57.46 2klg h ASN 25 Cb 0.58 -0.12 -0.01 0.00 -1.12 0.00 0.00 38.32 37.65 2klg h ASN 25 CO 0.03 0.49 -0.19 -0.37 -1.29 0.00 0.00 177.43 176.10 2klg h VAL 26 N 0.41 1.11 -0.69 2.81 -1.51 -1.38 -2.79 116.25 114.20 2klg h VAL 26 Ca 0.12 -0.67 0.08 0.00 -1.23 0.00 0.00 66.70 64.99 2klg h VAL 26 Cb 0.16 1.36 -0.06 0.00 -2.13 0.00 0.00 31.29 30.62 2klg h VAL 26 CO -0.01 0.19 0.36 0.50 -1.23 0.00 0.00 177.57 177.38 2klg h LYS 27 N 0.00 0.62 -0.16 5.19 3.11 -1.02 -0.97 116.57 123.35 2klg h LYS 27 Ca -0.00 -0.04 -0.10 0.00 -2.81 0.00 0.00 60.65 57.70 2klg h LYS 27 Cb 0.35 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 31.42 2klg h LYS 27 CO 0.03 0.41 -0.33 0.00 -2.81 0.00 0.00 179.45 176.75 2klg h ALA 28 N 1.39 1.15 0.00 5.00 0.00 -1.52 -2.65 119.26 122.64 2klg h ALA 28 Ca 0.33 -0.37 -0.03 0.00 0.00 0.00 0.00 54.91 54.84 2klg h ALA 28 Cb 0.28 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 2klg h ALA 28 CO -0.23 0.55 -0.16 -0.22 0.00 0.00 0.00 179.25 179.19 2klg h LYS 29 N 0.27 0.00 -0.02 0.00 3.64 -1.16 0.24 116.57 119.56 2klg h LYS 29 Ca 0.03 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.31 2klg h LYS 29 Cb 0.72 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.54 2klg h LYS 29 CO 0.05 0.16 -0.39 0.82 -2.27 0.00 0.00 179.45 177.83 2klg h ILE 30 N 0.00 1.48 -0.64 2.00 1.08 -1.06 -2.81 117.51 117.56 2klg h ILE 30 Ca -0.00 -1.94 -0.08 0.00 -0.39 0.00 0.00 64.86 62.45 2klg h ILE 30 Cb 0.32 2.61 -0.02 0.00 -3.07 0.00 0.00 36.82 36.65 2klg h ILE 30 CO 0.02 0.55 0.09 -0.61 -0.69 0.00 0.00 178.15 177.51 2klg h GLN 31 N -0.29 1.06 0.00 2.37 4.15 -1.30 -2.27 115.11 118.84 2klg h GLN 31 Ca -0.04 -0.29 -0.01 0.00 0.77 0.00 0.00 58.65 59.08 2klg h GLN 31 Cb 1.10 -0.12 -0.00 0.00 0.21 0.00 0.00 27.48 28.67 2klg h GLN 31 CO 0.08 0.99 -0.03 0.22 -1.93 0.00 0.00 178.83 178.16 2klg h ASP 32 N 0.98 0.00 0.15 -0.69 1.82 -0.57 0.47 116.42 118.58 2klg h ASP 32 Ca 0.19 0.00 -0.01 0.00 -0.39 0.00 0.00 57.03 56.82 2klg h ASP 32 Cb 0.46 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.47 2klg h ASP 32 CO 0.02 0.03 -0.07 0.11 -1.61 0.00 0.00 179.24 177.72 2klg h LYS 33 N 0.00 -0.19 0.00 0.28 1.79 -1.13 -3.44 116.57 113.88 2klg h LYS 33 Ca -0.00 0.01 -0.11 0.00 -2.18 0.00 0.00 60.65 58.38 2klg h LYS 33 Cb 0.09 0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.76 2klg h LYS 33 CO 0.00 0.21 -1.35 -1.91 -1.08 0.00 0.00 179.45 175.32 2klg n GLU 34 N -4.89 0.13 0.00 3.15 2.13 -1.14 -5.09 120.64 114.93 2klg n GLU 34 Ca -0.07 0.06 0.00 0.00 0.66 0.00 0.00 57.16 57.81 2klg n GLU 34 Cb 0.24 -0.73 0.00 0.00 0.27 0.00 0.00 31.44 31.22 2klg n GLU 34 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2klg n GLY 35 N 2.62 0.59 3.61 8.31 0.00 0.16 -5.05 105.19 115.44 2klg n GLY 35 Ca -0.12 -0.77 -0.43 0.00 0.00 0.00 0.00 46.02 44.69 2klg n GLY 35 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2klg s ILE 36 N -0.63 4.14 0.20 -0.61 -5.25 -1.26 -4.93 121.20 112.85 2klg s ILE 36 Ca 0.00 1.21 -0.11 0.00 -0.99 0.00 0.00 60.65 60.75 2klg s ILE 36 Cb 0.00 -4.40 0.12 0.00 2.95 0.00 0.00 42.46 41.13 2klg s ILE 36 CO 0.00 -0.79 1.85 -0.65 -1.79 0.00 0.00 174.94 173.56 2klg h PRO 37 N 9.54 0.82 -6.39 0.37 0.11 -1.97 -3.41 132.00 131.06 2klg h PRO 37 Ca -0.24 -0.05 -0.57 0.00 0.11 0.00 0.00 66.00 65.25 2klg h PRO 37 Cb 1.08 -0.19 -0.04 0.00 0.11 0.00 0.00 31.00 31.96 2klg h PRO 37 CO 1.09 0.54 1.14 -1.25 -0.21 0.00 0.00 178.00 179.31 2klg s PRO 38 N -6.13 3.56 0.21 1.05 0.04 -1.26 -4.87 135.00 127.59 2klg s PRO 38 Ca -0.13 1.25 0.21 0.00 0.04 0.00 0.00 61.00 62.37 2klg s PRO 38 Cb 0.14 -4.07 0.90 0.00 0.04 0.00 0.00 34.50 31.51 2klg s PRO 38 CO 0.76 -1.58 1.64 -0.40 0.04 0.00 0.00 177.00 177.46 2klg n ASP 39 N 9.13 0.51 -1.36 6.66 5.75 -1.26 -2.76 116.55 133.22 2klg n ASP 39 Ca 0.19 0.64 0.01 0.00 -0.01 0.00 0.00 54.79 55.61 2klg n ASP 39 Cb 0.47 -0.74 0.20 0.00 -1.03 0.00 0.00 41.12 40.02 2klg n ASP 39 CO 0.00 0.00 0.00 1.67 -0.11 0.00 0.00 177.20 178.76 2klg n GLN 40 N -2.07 2.90 -3.05 0.11 7.27 -1.26 -4.80 117.38 116.47 2klg n GLN 40 Ca 0.02 -1.74 -0.44 0.00 0.07 0.00 0.00 57.00 54.90 2klg n GLN 40 Cb 0.19 -1.88 -0.04 0.00 2.41 0.00 0.00 30.24 30.92 2klg n GLN 40 CO 0.00 0.00 0.00 -1.14 0.07 0.00 0.00 177.06 175.99 2klg s GLN 41 N -1.96 3.18 0.21 3.69 0.74 -1.11 -4.99 119.66 119.42 2klg s GLN 41 Ca 0.31 -1.38 0.04 0.00 0.05 0.00 0.00 55.36 54.38 2klg s GLN 41 Cb 0.24 -4.37 -0.02 0.00 1.10 0.00 0.00 33.01 29.97 2klg s GLN 41 CO 0.08 -1.61 0.15 0.54 -0.55 0.00 0.00 175.29 173.90 2klg n ARG 42 N 6.45 0.36 -3.99 1.67 1.74 -1.26 -5.01 116.66 116.62 2klg n ARG 42 Ca -0.02 -2.02 -0.36 0.00 -0.77 0.00 0.00 57.85 54.69 2klg n ARG 42 Cb 0.44 1.52 -0.06 0.00 -1.02 0.00 0.00 32.46 33.33 2klg n ARG 42 CO 0.00 0.00 0.00 -0.48 -1.52 0.00 0.00 177.63 175.63 2klg s LEU 43 N 0.00 4.20 -0.29 0.55 0.05 -1.26 -2.45 118.68 119.49 2klg s LEU 43 Ca 0.21 0.36 -0.05 0.00 0.05 0.00 0.00 54.13 54.71 2klg s LEU 43 Cb 0.01 -2.14 0.02 0.00 -2.05 0.00 0.00 46.19 42.04 2klg s LEU 43 CO 0.15 0.37 0.03 -0.51 -0.55 0.00 0.00 176.35 175.84 2klg s ILE 44 N -1.07 3.52 -0.18 1.48 2.07 -0.42 -4.93 121.20 121.67 2klg s ILE 44 Ca 0.17 -0.91 -0.11 0.00 -1.41 0.00 0.00 60.65 58.40 2klg s ILE 44 Cb -0.12 -2.85 0.06 0.00 0.13 0.00 0.00 42.46 39.68 2klg s ILE 44 CO 0.07 0.07 0.44 0.12 -1.91 0.00 0.00 174.94 173.73 2klg s PHE 45 N 1.41 -0.64 -1.46 3.50 5.36 -1.26 -4.68 117.98 120.20 2klg s PHE 45 Ca 0.01 1.37 0.00 0.00 -0.96 0.00 0.00 56.93 57.35 2klg s PHE 45 Cb -0.18 0.30 0.00 0.00 -0.34 0.00 0.00 43.02 42.80 2klg s PHE 45 CO 0.00 -0.35 0.00 0.00 -1.46 0.00 0.00 175.22 173.41 2klg n ALA 46 N 4.13 -0.65 -4.13 11.12 0.00 -1.26 -2.43 120.51 127.29 2klg n ALA 46 Ca -0.22 0.15 -0.29 0.00 0.00 0.00 0.00 53.44 53.07 2klg n ALA 46 Cb 0.56 -1.83 -0.05 0.00 0.00 0.00 0.00 19.45 18.12 2klg n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2klg n GLY 47 N -0.84 -0.23 3.88 0.00 0.00 -1.26 -4.94 105.19 101.80 2klg n GLY 47 Ca -0.19 0.15 -0.37 0.00 0.00 0.00 0.00 46.02 45.61 2klg n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2klg s LYS 48 N -6.90 3.45 -0.66 1.61 3.01 -1.02 -5.05 119.74 114.18 2klg s LYS 48 Ca 0.14 -0.14 -0.22 0.00 -1.01 0.00 0.00 55.97 54.74 2klg s LYS 48 Cb -0.08 -3.18 0.08 0.00 -1.01 0.00 0.00 37.83 33.64 2klg s LYS 48 CO 0.94 0.77 0.93 -0.65 0.51 0.00 0.00 175.35 177.84 2klg s GLN 49 N -1.14 3.12 0.00 1.68 1.11 -1.26 -4.80 119.66 118.37 2klg s GLN 49 Ca 0.17 -0.94 0.29 0.00 0.01 0.00 0.00 55.36 54.88 2klg s GLN 49 Cb -0.12 -4.26 1.32 0.00 -1.01 0.00 0.00 33.01 28.94 2klg s GLN 49 CO 0.06 -1.78 1.95 1.47 0.01 0.00 0.00 175.29 177.00 2klg n LEU 50 N 7.46 0.00 0.08 2.90 -0.00 -1.26 -3.39 117.00 122.78 2klg n LEU 50 Ca -0.04 0.40 -0.07 0.00 -0.00 0.00 0.00 56.01 56.31 2klg n LEU 50 Cb 0.45 -0.40 -0.07 0.00 -0.00 0.00 0.00 43.42 43.40 2klg n LEU 50 CO 0.63 -0.01 0.19 -0.33 -0.00 0.00 0.00 177.39 177.86 2klg h GLU 51 N 0.00 0.03 -1.04 1.47 4.39 -1.99 -3.30 114.58 114.15 2klg h GLU 51 Ca 0.00 -0.04 0.32 0.00 0.34 0.00 0.00 59.36 59.98 2klg h GLU 51 Cb 0.39 0.01 -0.14 0.00 -0.10 0.00 0.00 28.75 28.91 2klg h GLU 51 CO 0.00 0.95 0.61 -0.44 -1.16 0.00 0.00 179.01 178.97 2klg h ASP 52 N 0.01 0.51 0.00 1.42 5.19 -1.99 -3.45 116.42 118.11 2klg h ASP 52 Ca -0.02 0.17 0.00 0.00 -0.62 0.00 0.00 57.03 56.56 2klg h ASP 52 Cb 1.66 0.11 0.00 0.00 0.18 0.00 0.00 39.33 41.28 2klg h ASP 52 CO 0.13 -0.09 0.00 0.61 -3.12 0.00 0.00 179.24 176.77 2klg n GLY 53 N -1.33 0.65 3.60 2.75 0.00 -1.24 -5.11 105.19 104.50 2klg n GLY 53 Ca 0.31 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.10 2klg n GLY 53 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 2klg n ARG 54 N 0.00 0.70 -3.83 1.61 3.00 -1.26 -4.87 116.66 112.01 2klg n ARG 54 Ca 0.00 -3.15 -0.37 0.00 -0.00 0.00 0.00 57.85 54.33 2klg n ARG 54 Cb 0.00 0.20 -0.06 0.00 0.00 0.00 0.00 32.46 32.60 2klg n ARG 54 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.63 178.62 2klg s THR 55 N -2.52 5.44 0.19 5.15 2.01 -1.26 -0.50 115.64 124.15 2klg s THR 55 Ca 0.36 0.25 -0.13 0.00 0.31 0.00 0.00 61.69 62.49 2klg s THR 55 Cb -0.03 -3.46 0.14 0.00 0.01 0.00 0.00 72.50 69.16 2klg s THR 55 CO 0.23 0.58 1.69 -0.07 -0.69 0.00 0.00 174.62 176.36 2klg h LEU 56 N 4.80 -0.17 -1.31 4.42 4.07 -1.86 -0.14 115.31 125.13 2klg h LEU 56 Ca -0.54 0.12 0.12 0.00 0.08 0.00 0.00 57.88 57.65 2klg h LEU 56 Cb 1.22 0.20 -0.06 0.00 1.08 0.00 0.00 40.66 43.10 2klg h LEU 56 CO 0.60 -0.06 0.55 -1.28 -1.08 0.00 0.00 178.44 177.17 2klg h SER 57 N 0.14 0.67 -0.82 -0.43 0.87 -1.86 -0.91 113.55 111.21 2klg h SER 57 Ca 0.26 0.03 0.14 0.00 -1.23 0.00 0.00 61.79 60.99 2klg h SER 57 Cb 0.39 -0.11 -0.06 0.00 -0.44 0.00 0.00 62.40 62.18 2klg h SER 57 CO -0.41 0.38 0.54 0.44 -0.53 0.00 0.00 176.83 177.24 2klg h ASP 58 N 0.73 0.52 -0.63 6.23 3.32 -1.40 0.52 116.42 125.72 2klg h ASP 58 Ca 0.40 0.03 -0.07 0.00 0.02 0.00 0.00 57.03 57.42 2klg h ASP 58 Cb 0.55 -0.07 -0.04 0.00 0.22 0.00 0.00 39.33 39.99 2klg h ASP 58 CO -0.17 0.27 0.08 -1.22 -1.72 0.00 0.00 179.24 176.48 2klg n TYR 59 N -4.52 2.22 -0.95 4.55 4.01 -0.44 -4.91 117.16 117.12 2klg n TYR 59 Ca 0.16 -0.87 0.00 0.00 -0.16 0.00 0.00 57.90 57.02 2klg n TYR 59 Cb 0.49 -0.57 0.00 0.00 -0.31 0.00 0.00 39.34 38.95 2klg n TYR 59 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 2klg n ASN 60 N 0.40 -4.47 -3.60 7.72 4.13 0.18 -4.89 115.26 114.72 2klg n ASN 60 Ca 0.32 0.00 -0.41 0.00 1.68 0.00 0.00 54.58 56.17 2klg n ASN 60 Cb 1.27 -2.55 -0.00 0.00 -1.54 0.00 0.00 39.78 36.96 2klg n ASN 60 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2klg n ILE 61 N -2.24 4.99 -2.56 2.41 3.06 -0.63 -4.95 119.36 119.43 2klg n ILE 61 Ca 0.00 -4.37 -0.08 0.00 -2.50 0.00 0.00 62.75 55.80 2klg n ILE 61 Cb 0.31 -2.16 0.04 0.00 0.54 0.00 0.00 39.64 38.37 2klg n ILE 61 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 2klg n GLN 62 N 2.34 0.50 -1.28 9.51 10.64 -1.26 -4.29 117.38 133.53 2klg n GLN 62 Ca 0.55 -1.03 -0.41 0.00 -1.83 0.00 0.00 57.00 54.28 2klg n GLN 62 Cb 0.28 -0.20 0.00 0.00 -0.86 0.00 0.00 30.24 29.46 2klg n GLN 62 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 2klg n LYS 63 N -1.61 0.00 -1.22 2.61 4.01 -1.26 -1.14 118.16 119.55 2klg n LYS 63 Ca 0.06 0.00 -0.08 0.00 -0.51 0.00 0.00 58.31 57.78 2klg n LYS 63 Cb 0.22 -1.00 -0.03 0.00 -0.51 0.00 0.00 35.03 33.70 2klg n LYS 63 CO 0.00 0.00 0.00 -0.85 -1.11 0.00 0.00 177.40 175.44 2klg n GLU 64 N 1.38 -1.25 -1.62 1.97 0.28 0.42 -4.99 120.64 116.83 2klg n GLU 64 Ca 0.10 0.70 -0.29 0.00 -0.16 0.00 0.00 57.16 57.51 2klg n GLU 64 Cb 0.42 -4.81 0.17 0.00 1.43 0.00 0.00 31.44 28.64 2klg n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.16 0.00 0.00 177.13 175.85 2klg s SER 65 N -2.42 2.99 -0.70 -1.84 0.01 -0.29 -5.01 113.70 106.44 2klg s SER 65 Ca 0.00 0.64 -0.08 0.00 1.31 0.00 0.00 55.95 57.83 2klg s SER 65 Cb 0.00 -0.97 0.18 0.00 0.21 0.00 0.00 66.02 65.45 2klg s SER 65 CO 0.00 -2.84 0.57 0.28 0.41 0.00 0.00 173.24 171.65 2klg s THR 66 N -3.47 4.50 -0.36 1.44 -1.32 -1.26 -4.68 115.64 110.49 2klg s THR 66 Ca 0.68 -2.72 -0.14 0.00 -1.21 0.00 0.00 61.69 58.30 2klg s THR 66 Cb -0.10 -3.86 -0.01 0.00 -1.51 0.00 0.00 72.50 67.03 2klg s THR 66 CO 0.53 -0.94 0.30 -0.76 -2.21 0.00 0.00 174.62 171.55 2klg s LEU 67 N 0.08 4.64 -0.24 9.08 1.43 -1.26 -4.99 118.68 127.42 2klg s LEU 67 Ca 0.17 -0.48 -0.07 0.00 -1.03 0.00 0.00 54.13 52.72 2klg s LEU 67 Cb -0.16 -2.22 -0.03 0.00 0.03 0.00 0.00 46.19 43.81 2klg s LEU 67 CO -0.05 -0.34 0.04 -2.28 0.23 0.00 0.00 176.35 173.95 2klg s HIS 68 N 1.84 3.06 0.29 0.29 2.46 -1.26 -4.60 115.29 117.37 2klg s HIS 68 Ca 0.08 -0.49 -0.02 0.00 0.47 0.00 0.00 55.06 55.10 2klg s HIS 68 Cb -0.17 -2.19 -0.04 0.00 -0.13 0.00 0.00 32.58 30.04 2klg s HIS 68 CO 0.11 -0.36 0.52 -1.17 -2.47 0.00 0.00 174.74 171.38 2klg s LEU 69 N 1.48 4.07 0.35 8.88 2.96 -1.26 -1.30 118.68 133.86 2klg s LEU 69 Ca 0.06 0.57 0.07 0.00 -0.22 0.00 0.00 54.13 54.61 2klg s LEU 69 Cb -0.15 -3.39 -0.02 0.00 0.50 0.00 0.00 46.19 43.13 2klg s LEU 69 CO 0.02 -0.20 0.38 -0.69 -1.32 0.00 0.00 176.35 174.54 2klg s VAL 70 N -2.13 3.51 0.30 1.68 1.01 -1.03 -4.90 120.40 118.85 2klg s VAL 70 Ca 0.42 -1.23 -0.28 0.00 0.00 0.00 0.00 61.98 60.88 2klg s VAL 70 Cb -0.10 -3.21 -0.09 0.00 0.00 0.00 0.00 36.38 32.98 2klg s VAL 70 CO 0.32 -0.13 1.03 -0.76 0.00 0.00 0.00 175.10 175.56 2klg s LEU 71 N -4.09 4.46 -0.55 3.92 1.02 -1.26 -4.79 118.68 117.38 2klg s LEU 71 Ca 0.44 2.08 -0.26 0.00 0.02 0.00 0.00 54.13 56.41 2klg s LEU 71 Cb -0.07 -3.80 0.03 0.00 0.02 0.00 0.00 46.19 42.38 2klg s LEU 71 CO 0.29 -0.13 1.06 0.00 0.02 0.00 0.00 176.35 177.58 2klg s ARG 72 N -1.69 3.45 -0.02 1.70 1.70 -1.26 -4.89 118.95 117.95 2klg s ARG 72 Ca 0.47 0.04 -0.19 0.00 -0.47 0.00 0.00 55.73 55.58 2klg s ARG 72 Cb -0.27 -4.02 -0.33 0.00 -0.57 0.00 0.00 34.95 29.77 2klg s ARG 72 CO 0.34 -1.54 0.93 -0.07 -1.08 0.00 0.00 175.30 173.88 2klg h LEU 73 N 11.36 0.64 -9.51 -1.89 3.38 -1.95 -3.45 115.31 113.89 2klg h LEU 73 Ca -0.25 -0.94 -0.53 0.00 0.09 0.00 0.00 57.88 56.25 2klg h LEU 73 Cb 1.07 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.58 2klg h LEU 73 CO 1.13 1.54 0.32 -0.60 0.09 0.00 0.00 178.44 180.92 2klg s ARG 74 N -2.50 4.62 0.00 1.13 3.52 -1.26 -4.90 118.95 119.56 2klg s ARG 74 Ca -0.12 1.36 0.00 0.00 -0.13 0.00 0.00 55.73 56.84 2klg s ARG 74 Cb 0.02 -3.40 0.00 0.00 -1.56 0.00 0.00 34.95 30.01 2klg s ARG 74 CO 0.88 0.14 0.00 0.41 -0.81 0.00 0.00 175.30 175.93 2klg n GLY 75 N 2.49 2.58 0.00 8.12 0.00 -1.26 -4.48 105.19 112.65 2klg n GLY 75 Ca 0.02 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.66 2klg n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93