#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2klg s GLN 2 N 0.00 4.17 0.05 2.12 0.00 -1.26 -4.18 119.66 120.56 2klg s GLN 2 Ca 0.00 0.21 -0.00 0.00 -0.00 0.00 0.00 55.36 55.57 2klg s GLN 2 Cb 0.00 -3.38 -0.03 0.00 0.00 0.00 0.00 33.01 29.59 2klg s GLN 2 CO 0.00 0.33 -0.04 -1.50 0.00 0.00 0.00 175.29 174.08 2klg s ILE 3 N 0.16 0.31 -0.33 3.63 2.07 -1.26 0.12 121.20 125.89 2klg s ILE 3 Ca 0.20 -1.58 0.02 0.00 -1.41 0.00 0.00 60.65 57.87 2klg s ILE 3 Cb -0.14 -1.21 0.09 0.00 0.13 0.00 0.00 42.46 41.33 2klg s ILE 3 CO 0.07 -0.82 0.04 -0.36 -1.91 0.00 0.00 174.94 171.95 2klg s PHE 4 N -3.15 3.59 0.14 3.50 0.40 -1.24 -4.72 117.98 116.50 2klg s PHE 4 Ca 0.02 -2.67 0.10 0.00 -0.60 0.00 0.00 56.93 53.77 2klg s PHE 4 Cb 0.02 -2.69 -0.04 0.00 0.51 0.00 0.00 43.02 40.82 2klg s PHE 4 CO -0.06 -0.93 -0.23 0.08 0.70 0.00 0.00 175.22 174.78 2klg s VAL 5 N 1.01 2.05 -0.12 -0.44 1.01 -1.26 -4.19 120.40 118.46 2klg s VAL 5 Ca 0.05 -1.76 -0.04 0.00 0.00 0.00 0.00 61.98 60.23 2klg s VAL 5 Cb -0.20 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.28 2klg s VAL 5 CO -0.06 -0.05 0.00 -0.54 0.00 0.00 0.00 175.10 174.46 2klg s LYS 6 N -2.22 3.38 0.00 2.72 3.01 -1.26 -4.21 119.74 121.16 2klg s LYS 6 Ca 0.13 -0.42 0.00 0.00 -1.01 0.00 0.00 55.97 54.67 2klg s LYS 6 Cb -0.09 -2.91 0.00 0.00 -1.01 0.00 0.00 37.83 33.81 2klg s LYS 6 CO 0.06 0.49 0.00 2.41 0.51 0.00 0.00 175.35 178.82 2klg n THR 7 N 2.81 0.00 0.11 2.17 -1.04 -1.19 -4.80 114.28 112.34 2klg n THR 7 Ca -0.18 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.71 2klg n THR 7 Cb 0.53 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.96 2klg n THR 7 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 2klg h LEU 8 N 0.00 -0.27 -3.97 -4.42 5.85 -2.00 -3.26 115.31 107.24 2klg h LEU 8 Ca 0.00 -0.24 -0.65 0.00 0.84 0.00 0.00 57.88 57.82 2klg h LEU 8 Cb 0.00 0.07 -0.30 0.00 0.37 0.00 0.00 40.66 40.80 2klg h LEU 8 CO 0.00 0.15 0.73 0.35 -0.34 0.00 0.00 178.44 179.33 2klg n THR 9 N -5.05 3.51 -3.64 1.05 -2.24 -1.26 -4.88 114.28 101.77 2klg n THR 9 Ca -0.09 -2.94 -0.27 0.00 -2.27 0.00 0.00 64.05 58.49 2klg n THR 9 Cb 0.26 -1.09 0.04 0.00 -2.10 0.00 0.00 70.33 67.43 2klg n THR 9 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2klg n GLY 10 N -0.93 -0.51 3.79 3.38 0.00 -1.23 -4.95 105.19 104.73 2klg n GLY 10 Ca 0.61 0.19 -0.38 0.00 0.00 0.00 0.00 46.02 46.43 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 -6.34 4.48 -0.24 1.61 2.20 -1.26 -4.75 119.74 115.44 2klg s LYS 11 Ca 0.56 1.09 -0.17 0.00 -0.36 0.00 0.00 55.97 57.10 2klg s LYS 11 Cb -0.27 -3.11 -0.03 0.00 -1.51 0.00 0.00 37.83 32.90 2klg s LYS 11 CO 0.70 0.50 0.48 -0.08 -0.36 0.00 0.00 175.35 176.58 2klg s THR 12 N -1.29 5.11 -0.04 3.43 -1.32 -1.26 -3.18 115.64 117.09 2klg s THR 12 Ca 0.39 0.83 0.05 0.00 -1.21 0.00 0.00 61.69 61.75 2klg s THR 12 Cb -0.21 -3.80 -0.01 0.00 -1.51 0.00 0.00 72.50 66.98 2klg s THR 12 CO 0.25 0.15 -0.18 0.27 -2.21 0.00 0.00 174.62 172.89 2klg s ILE 13 N 1.93 1.52 -0.19 5.08 -4.36 -1.26 -5.08 121.20 118.85 2klg s ILE 13 Ca 0.21 -0.78 -0.11 0.00 -0.26 0.00 0.00 60.65 59.71 2klg s ILE 13 Cb -0.15 -1.30 -0.05 0.00 1.25 0.00 0.00 42.46 42.21 2klg s ILE 13 CO 0.09 0.43 0.18 0.42 0.24 0.00 0.00 174.94 176.30 2klg s THR 14 N -0.07 5.38 0.04 8.37 -4.23 -1.26 -4.49 115.64 119.38 2klg s THR 14 Ca -0.02 0.30 0.01 0.00 -1.18 0.00 0.00 61.69 60.80 2klg s THR 14 Cb -0.11 -3.52 -0.03 0.00 1.34 0.00 0.00 72.50 70.19 2klg s THR 14 CO 0.02 0.43 -0.05 -1.48 -0.54 0.00 0.00 174.62 173.00 2klg s LEU 15 N 0.35 2.29 0.17 4.79 0.05 -1.26 -5.05 118.68 120.03 2klg s LEU 15 Ca 0.11 -0.61 0.04 0.00 0.05 0.00 0.00 54.13 53.71 2klg s LEU 15 Cb -0.12 -0.01 -0.03 0.00 -2.05 0.00 0.00 46.19 43.98 2klg s LEU 15 CO -0.00 -0.31 0.27 -0.70 -0.55 0.00 0.00 176.35 175.07 2klg s GLU 16 N -1.96 3.33 -0.14 1.48 2.12 -1.26 -4.47 118.70 117.80 2klg s GLU 16 Ca -0.09 -0.69 -0.03 0.00 0.36 0.00 0.00 54.97 54.52 2klg s GLU 16 Cb -0.07 -2.88 0.05 0.00 0.26 0.00 0.00 34.13 31.49 2klg s GLU 16 CO -0.02 0.49 0.04 0.08 -0.54 0.00 0.00 175.26 175.31 2klg s VAL 17 N -1.81 0.33 0.35 3.70 1.01 -1.26 -5.01 120.40 117.71 2klg s VAL 17 Ca 0.34 -0.23 0.08 0.00 0.00 0.00 0.00 61.98 62.16 2klg s VAL 17 Cb -0.10 -0.75 -0.03 0.00 0.00 0.00 0.00 36.38 35.50 2klg s VAL 17 CO 0.28 -0.06 0.29 -1.61 0.00 0.00 0.00 175.10 173.99 2klg s GLU 18 N 1.96 2.65 0.41 2.72 8.01 -1.26 -4.95 118.70 128.24 2klg s GLU 18 Ca 0.02 -1.36 0.14 0.00 0.01 0.00 0.00 54.97 53.77 2klg s GLU 18 Cb -0.15 -2.42 0.86 0.00 -4.31 0.00 0.00 34.13 28.11 2klg s GLU 18 CO -0.07 0.05 1.91 -1.00 0.01 0.00 0.00 175.26 176.16 2klg h PRO 19 N 1.25 0.00 0.04 0.39 0.13 -2.03 -2.85 132.00 128.93 2klg h PRO 19 Ca -0.44 0.00 -0.23 0.00 -0.87 0.00 0.00 66.00 64.46 2klg h PRO 19 Cb 1.26 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.37 2klg h PRO 19 CO 0.59 0.27 -1.04 0.66 -0.23 0.00 0.00 178.00 178.25 2klg h SER 20 N 0.00 0.22 -2.57 1.44 4.64 -2.03 -3.45 113.55 111.80 2klg h SER 20 Ca -0.00 -0.21 -0.54 0.00 -0.47 0.00 0.00 61.79 60.56 2klg h SER 20 Cb 0.49 -0.07 0.01 0.00 -0.31 0.00 0.00 62.40 62.51 2klg h SER 20 CO 0.04 1.12 1.10 -1.81 -0.87 0.00 0.00 176.83 176.40 2klg s ASP 21 N -6.92 6.60 0.33 4.97 1.11 -1.08 -4.98 116.67 116.70 2klg s ASP 21 Ca -0.02 2.40 -0.16 0.00 0.18 0.00 0.00 52.55 54.95 2klg s ASP 21 Cb 0.09 -2.54 -0.09 0.00 1.07 0.00 0.00 42.92 41.45 2klg s ASP 21 CO 0.84 -0.94 0.76 -0.89 1.18 0.00 0.00 175.17 176.12 2klg s THR 22 N 3.79 4.64 0.35 -1.27 2.01 -1.26 -4.37 115.64 119.53 2klg s THR 22 Ca 0.77 1.03 0.14 0.00 0.31 0.00 0.00 61.69 63.93 2klg s THR 22 Cb -0.37 -3.62 0.10 0.00 0.01 0.00 0.00 72.50 68.62 2klg s THR 22 CO 0.33 -0.19 1.82 -0.29 -0.69 0.00 0.00 174.62 175.60 2klg h ILE 23 N 1.98 1.21 0.31 1.82 2.10 -0.28 -3.26 117.51 121.39 2klg h ILE 23 Ca -0.48 -1.32 -0.00 0.00 1.08 0.00 0.00 64.86 64.14 2klg h ILE 23 Cb 1.18 1.72 -0.03 0.00 -1.09 0.00 0.00 36.82 38.59 2klg h ILE 23 CO 0.65 0.37 -0.51 -0.08 -1.08 0.00 0.00 178.15 177.50 2klg h GLU 24 N 0.00 -0.83 -2.11 2.19 4.22 -1.70 -2.31 114.58 114.04 2klg h GLU 24 Ca -0.00 0.06 -0.06 0.00 0.08 0.00 0.00 59.36 59.44 2klg h GLU 24 Cb 0.69 0.19 -0.02 0.00 0.50 0.00 0.00 28.75 30.11 2klg h GLU 24 CO 0.05 -0.56 -0.07 0.09 -2.18 0.00 0.00 179.01 176.35 2klg n ASN 25 N -5.43 3.94 -0.14 1.04 3.02 -1.23 -4.34 115.26 112.13 2klg n ASN 25 Ca -0.10 -2.12 -0.12 0.00 -0.03 0.00 0.00 54.58 52.20 2klg n ASN 25 Cb 0.43 -0.93 -0.01 0.00 -0.61 0.00 0.00 39.78 38.66 2klg n ASN 25 CO 0.00 0.00 0.00 1.62 -2.62 0.00 0.00 177.26 176.26 2klg h VAL 26 N 1.67 1.27 -0.33 2.41 3.04 -1.58 -1.87 116.25 120.85 2klg h VAL 26 Ca 0.06 -1.48 -0.05 0.00 -1.01 0.00 0.00 66.70 64.22 2klg h VAL 26 Cb 0.90 1.28 -0.01 0.00 -2.01 0.00 0.00 31.29 31.45 2klg h VAL 26 CO 0.12 0.50 0.01 0.11 -1.01 0.00 0.00 177.57 177.30 2klg h LYS 27 N 0.79 0.58 -0.73 4.17 6.56 -1.86 -1.91 116.57 124.17 2klg h LYS 27 Ca 0.08 -0.18 -0.04 0.00 -1.06 0.00 0.00 60.65 59.45 2klg h LYS 27 Cb 0.90 -0.05 -0.03 0.00 -0.57 0.00 0.00 32.23 32.47 2klg h LYS 27 CO 0.08 0.70 0.29 0.00 -2.06 0.00 0.00 179.45 178.46 2klg h ALA 28 N 0.86 0.95 -0.68 3.86 0.00 -1.89 0.32 119.26 122.69 2klg h ALA 28 Ca 0.09 -0.19 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 2klg h ALA 28 Cb 0.43 -0.29 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 2klg h ALA 28 CO 0.02 0.58 0.22 -0.22 0.00 0.00 0.00 179.25 179.85 2klg h LYS 29 N 1.06 1.05 -0.04 0.00 3.11 -1.24 -2.23 116.57 118.28 2klg h LYS 29 Ca 0.24 -0.22 -0.19 0.00 -2.81 0.00 0.00 60.65 57.68 2klg h LYS 29 Cb 0.22 -0.15 0.01 0.00 -1.00 0.00 0.00 32.23 31.31 2klg h LYS 29 CO -0.02 0.90 -0.70 0.82 -2.81 0.00 0.00 179.45 177.64 2klg h ILE 30 N 0.99 1.36 -0.90 2.00 2.04 -1.08 -3.24 117.51 118.67 2klg h ILE 30 Ca 0.22 -2.05 0.12 0.00 1.00 0.00 0.00 64.86 64.15 2klg h ILE 30 Cb 0.28 2.38 -0.07 0.00 -0.74 0.00 0.00 36.82 38.68 2klg h ILE 30 CO -0.01 0.62 0.58 -0.61 0.00 0.00 0.00 178.15 178.72 2klg h GLN 31 N 0.14 0.78 0.00 2.37 4.15 -0.28 0.90 115.11 123.18 2klg h GLN 31 Ca -0.08 -0.05 0.00 0.00 0.77 0.00 0.00 58.65 59.30 2klg h GLN 31 Cb 1.38 -0.18 0.00 0.00 0.21 0.00 0.00 27.48 28.89 2klg h GLN 31 CO 0.14 0.52 0.00 0.22 -1.93 0.00 0.00 178.83 177.78 2klg h ASP 32 N 0.81 0.00 0.36 -0.69 3.58 -1.43 -1.72 116.42 117.32 2klg h ASP 32 Ca 0.43 0.00 -0.20 0.00 0.42 0.00 0.00 57.03 57.68 2klg h ASP 32 Cb 0.55 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.59 2klg h ASP 32 CO -0.20 0.00 -0.83 0.11 -2.88 0.00 0.00 179.24 175.44 2klg h LYS 33 N 0.00 0.36 0.00 0.28 1.79 -0.94 -3.46 116.57 114.60 2klg h LYS 33 Ca 0.00 -0.34 0.00 0.00 -2.18 0.00 0.00 60.65 58.13 2klg h LYS 33 Cb 0.06 0.09 0.00 0.00 -1.58 0.00 0.00 32.23 30.80 2klg h LYS 33 CO 0.00 1.00 0.00 -1.91 -1.08 0.00 0.00 179.45 177.46 2klg n GLU 34 N -3.77 0.00 0.00 3.15 2.13 -0.82 -5.10 120.64 116.23 2klg n GLU 34 Ca -0.05 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.77 2klg n GLU 34 Cb 0.77 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.48 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 -1.25 0.27 3.62 8.31 0.00 -0.71 -5.06 105.19 110.37 2klg n GLY 35 Ca 0.00 -0.06 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 2klg n GLY 35 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2klg s ILE 36 N 0.00 4.25 0.15 -0.61 2.07 -1.26 -4.95 121.20 120.84 2klg s ILE 36 Ca 0.00 1.36 -0.20 0.00 -1.41 0.00 0.00 60.65 60.40 2klg s ILE 36 Cb 0.00 -4.39 0.02 0.00 0.13 0.00 0.00 42.46 38.23 2klg s ILE 36 CO 0.00 -0.68 1.66 -0.65 -1.91 0.00 0.00 174.94 173.36 2klg h PRO 37 N 9.07 -0.11 -5.46 3.50 0.11 -2.00 -3.36 132.00 133.74 2klg h PRO 37 Ca -0.24 0.01 -0.18 0.00 0.11 0.00 0.00 66.00 65.70 2klg h PRO 37 Cb 1.07 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.18 2klg h PRO 37 CO 1.07 -0.08 0.50 -1.25 -0.21 0.00 0.00 178.00 178.04 2klg s PRO 38 N -6.16 2.04 0.54 1.05 0.04 -1.26 -4.74 135.00 126.51 2klg s PRO 38 Ca -0.14 -0.30 0.32 0.00 0.04 0.00 0.00 61.00 60.92 2klg s PRO 38 Cb 0.12 -5.02 1.43 0.00 0.04 0.00 0.00 34.50 31.08 2klg s PRO 38 CO 0.69 -4.17 2.02 -0.44 0.04 0.00 0.00 177.00 175.13 2klg h ASP 39 N 11.37 0.00 -0.99 6.66 5.19 -2.00 -2.89 116.42 133.75 2klg h ASP 39 Ca 0.08 0.00 -0.62 0.00 -0.62 0.00 0.00 57.03 55.88 2klg h ASP 39 Cb 0.99 0.00 -0.30 0.00 0.18 0.00 0.00 39.33 40.20 2klg h ASP 39 CO 1.12 0.06 0.78 0.00 -3.12 0.00 0.00 179.24 178.09 2klg n GLN 40 N -3.24 2.52 -3.14 3.56 6.02 -1.26 -4.92 117.38 116.93 2klg n GLN 40 Ca -0.00 -3.19 -0.39 0.00 -0.01 0.00 0.00 57.00 53.41 2klg n GLN 40 Cb 0.29 -2.25 -0.05 0.00 1.02 0.00 0.00 30.24 29.25 2klg n GLN 40 CO 0.00 0.00 0.00 1.14 -1.01 0.00 0.00 177.06 177.19 2klg s GLN 41 N -3.63 4.39 0.21 -1.09 -2.07 -1.09 -4.50 119.66 111.88 2klg s GLN 41 Ca 0.62 0.76 -0.00 0.00 -1.82 0.00 0.00 55.36 54.91 2klg s GLN 41 Cb 0.50 -3.42 -0.04 0.00 -1.09 0.00 0.00 33.01 28.96 2klg s GLN 41 CO 0.04 0.16 0.10 1.03 -1.32 0.00 0.00 175.29 175.30 2klg s ARG 42 N 0.51 1.23 0.09 9.60 0.52 -1.26 -4.88 118.95 124.76 2klg s ARG 42 Ca 0.33 -1.64 0.00 0.00 -0.52 0.00 0.00 55.73 53.91 2klg s ARG 42 Cb -0.17 0.06 -0.04 0.00 0.52 0.00 0.00 34.95 35.32 2klg s ARG 42 CO 0.16 -0.33 0.24 -0.51 0.02 0.00 0.00 175.30 174.89 2klg s LEU 43 N -3.19 4.35 -0.80 2.53 1.43 -1.26 -2.64 118.68 119.09 2klg s LEU 43 Ca 0.36 0.27 -0.02 0.00 -1.03 0.00 0.00 54.13 53.70 2klg s LEU 43 Cb 0.07 -2.97 0.20 0.00 0.03 0.00 0.00 46.19 43.52 2klg s LEU 43 CO 0.11 0.13 0.66 -0.51 0.23 0.00 0.00 176.35 176.97 2klg s ILE 44 N -1.58 4.16 -0.16 -0.59 2.07 0.21 -4.79 121.20 120.52 2klg s ILE 44 Ca 0.35 -3.52 -0.10 0.00 -1.41 0.00 0.00 60.65 55.98 2klg s ILE 44 Cb -0.12 -3.62 0.05 0.00 0.13 0.00 0.00 42.46 38.89 2klg s ILE 44 CO 0.28 -1.01 0.39 0.12 -1.91 0.00 0.00 174.94 172.81 2klg s PHE 45 N -0.86 -0.54 -1.91 3.50 2.19 -1.26 -4.73 117.98 114.36 2klg s PHE 45 Ca 0.23 1.19 0.00 0.00 0.33 0.00 0.00 56.93 58.69 2klg s PHE 45 Cb -0.12 0.22 0.00 0.00 -1.31 0.00 0.00 43.02 41.82 2klg s PHE 45 CO -0.09 -0.31 0.00 0.00 1.83 0.00 0.00 175.22 176.65 2klg n ALA 46 N 4.02 -0.47 -3.75 11.12 0.00 -1.26 -2.67 120.51 127.50 2klg n ALA 46 Ca -0.22 0.23 -0.28 0.00 0.00 0.00 0.00 53.44 53.18 2klg n ALA 46 Cb 0.55 -2.09 -0.03 0.00 0.00 0.00 0.00 19.45 17.88 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 -0.79 -0.45 3.55 0.00 0.00 -1.26 -4.92 105.19 101.31 2klg n GLY 47 Ca -0.22 0.08 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 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 -6.40 3.07 0.50 1.61 -0.14 -1.09 -5.12 119.74 112.18 2klg s LYS 48 Ca 0.54 -0.54 -0.03 0.00 -1.36 0.00 0.00 55.97 54.57 2klg s LYS 48 Cb -0.30 -2.70 -0.01 0.00 -1.68 0.00 0.00 37.83 33.14 2klg s LYS 48 CO 0.66 0.52 0.78 -1.14 -0.76 0.00 0.00 175.35 175.40 2klg s GLN 49 N -0.41 3.18 -0.01 1.68 2.00 -1.26 -4.68 119.66 120.17 2klg s GLN 49 Ca 0.06 -0.11 0.00 0.00 -2.00 0.00 0.00 55.36 53.32 2klg s GLN 49 Cb -0.12 -2.41 0.02 0.00 0.80 0.00 0.00 33.01 31.30 2klg s GLN 49 CO 0.02 -0.38 0.55 1.28 -0.50 0.00 0.00 175.29 176.27 2klg n LEU 50 N -2.29 1.07 0.01 3.68 7.99 -1.26 -3.81 117.00 122.39 2klg n LEU 50 Ca 0.02 -0.54 -0.22 0.00 -0.01 0.00 0.00 56.01 55.26 2klg n LEU 50 Cb 0.57 -0.48 -0.14 0.00 -0.11 0.00 0.00 43.42 43.26 2klg n LEU 50 CO 0.51 0.25 -0.71 -0.08 -1.51 0.00 0.00 177.39 175.85 2klg h GLU 51 N 0.10 0.26 -6.06 3.23 4.81 -1.90 -3.35 114.58 111.66 2klg h GLU 51 Ca 0.00 -0.45 -0.71 0.00 -0.13 0.00 0.00 59.36 58.07 2klg h GLU 51 Cb 0.51 0.17 -0.01 0.00 0.63 0.00 0.00 28.75 30.06 2klg h GLU 51 CO 0.01 1.22 1.18 -0.25 -0.73 0.00 0.00 179.01 180.44 2klg n ASP 52 N -3.63 2.08 -2.29 1.04 9.92 -1.25 -4.72 116.55 117.71 2klg n ASP 52 Ca -0.30 0.74 -0.07 0.00 -0.53 0.00 0.00 54.79 54.64 2klg n ASP 52 Cb 1.01 -1.16 -0.08 0.00 -0.64 0.00 0.00 41.12 40.24 2klg n ASP 52 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 2klg n GLY 53 N 5.64 2.04 3.47 0.44 0.00 -1.26 -4.00 105.19 111.52 2klg n GLY 53 Ca 0.36 -0.61 -0.20 0.00 0.00 0.00 0.00 46.02 45.57 2klg n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2klg n ARG 54 N 2.82 0.70 -3.63 1.61 5.12 -1.26 -4.87 116.66 117.15 2klg n ARG 54 Ca 0.22 -2.94 -0.32 0.00 -1.93 0.00 0.00 57.85 52.88 2klg n ARG 54 Cb 0.44 0.03 -0.05 0.00 -1.16 0.00 0.00 32.46 31.73 2klg n ARG 54 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 2klg s THR 55 N -2.34 5.13 0.18 0.55 2.01 -1.26 0.45 115.64 120.35 2klg s THR 55 Ca 0.42 0.16 -0.14 0.00 0.31 0.00 0.00 61.69 62.45 2klg s THR 55 Cb -0.03 -3.62 0.08 0.00 0.01 0.00 0.00 72.50 68.94 2klg s THR 55 CO 0.27 0.08 1.73 -0.07 -0.69 0.00 0.00 174.62 175.94 2klg h LEU 56 N 2.97 0.07 -1.97 4.42 4.07 -1.89 -0.52 115.31 122.46 2klg h LEU 56 Ca -0.47 0.07 0.22 0.00 0.08 0.00 0.00 57.88 57.78 2klg h LEU 56 Cb 1.17 0.08 -0.03 0.00 1.08 0.00 0.00 40.66 42.96 2klg h LEU 56 CO 0.71 0.07 0.55 0.77 -1.08 0.00 0.00 178.44 179.46 2klg h SER 57 N 0.27 0.02 -0.52 -0.43 4.64 -1.93 0.38 113.55 115.98 2klg h SER 57 Ca 0.23 0.00 0.15 0.00 -0.47 0.00 0.00 61.79 61.70 2klg h SER 57 Cb 0.27 -0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.34 2klg h SER 57 CO -0.27 0.01 0.42 -0.78 -0.87 0.00 0.00 176.83 175.34 2klg h ASP 58 N 0.02 0.00 -0.69 4.97 1.82 -1.45 0.15 116.42 121.24 2klg h ASP 58 Ca 0.37 0.00 -0.20 0.00 -0.39 0.00 0.00 57.03 56.80 2klg h ASP 58 Cb 1.44 0.00 -0.12 0.00 0.68 0.00 0.00 39.33 41.33 2klg h ASP 58 CO -0.01 0.00 0.26 -1.22 -1.61 0.00 0.00 179.24 176.66 2klg n TYR 59 N -4.14 2.29 -1.72 0.28 4.01 0.12 -4.90 117.16 113.11 2klg n TYR 59 Ca 0.10 -1.12 -0.20 0.00 -0.16 0.00 0.00 57.90 56.52 2klg n TYR 59 Cb 0.64 -0.65 -0.07 0.00 -0.31 0.00 0.00 39.34 38.94 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 -0.11 -5.40 -4.45 7.72 4.13 0.51 -4.92 115.26 112.74 2klg n ASN 60 Ca 0.38 0.39 -0.44 0.00 1.68 0.00 0.00 54.58 56.59 2klg n ASN 60 Cb 1.31 -4.59 -0.03 0.00 -1.54 0.00 0.00 39.78 34.94 2klg n ASN 60 CO 0.00 0.00 0.00 -0.51 0.28 0.00 0.00 177.26 177.03 2klg s ILE 61 N -2.77 4.66 0.53 2.41 -1.16 -1.24 -5.01 121.20 118.61 2klg s ILE 61 Ca 0.00 -1.32 0.09 0.00 -0.51 0.00 0.00 60.65 58.91 2klg s ILE 61 Cb 0.00 -4.74 0.06 0.00 0.61 0.00 0.00 42.46 38.38 2klg s ILE 61 CO 0.00 -1.48 0.67 -1.10 -2.81 0.00 0.00 174.94 170.22 2klg s GLN 62 N 2.94 2.42 0.46 3.50 -1.52 -1.26 -4.32 119.66 121.88 2klg s GLN 62 Ca 0.29 -1.60 -0.22 0.00 -1.95 0.00 0.00 55.36 51.88 2klg s GLN 62 Cb -0.08 -2.58 -0.10 0.00 -0.22 0.00 0.00 33.01 30.02 2klg s GLN 62 CO -0.05 -0.67 0.78 0.36 -0.25 0.00 0.00 175.29 175.47 2klg n LYS 63 N -2.06 0.92 -1.63 2.91 2.85 -1.26 -1.60 118.16 118.29 2klg n LYS 63 Ca 0.11 0.34 -0.16 0.00 -1.05 0.00 0.00 58.31 57.54 2klg n LYS 63 Cb 0.61 -1.83 -0.06 0.00 -0.65 0.00 0.00 35.03 33.11 2klg n LYS 63 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 177.40 175.44 2klg n GLU 64 N 0.14 -1.16 -2.58 -1.58 2.13 0.32 -4.98 120.64 112.93 2klg n GLU 64 Ca 0.11 1.02 -0.34 0.00 0.66 0.00 0.00 57.16 58.61 2klg n GLU 64 Cb 0.41 -5.25 -0.04 0.00 0.27 0.00 0.00 31.44 26.83 2klg n GLU 64 CO 0.00 0.00 0.00 -1.54 -0.41 0.00 0.00 177.13 175.18 2klg s SER 65 N -2.72 6.48 -0.72 4.31 1.04 -0.63 -4.91 113.70 116.55 2klg s SER 65 Ca 0.00 1.91 -0.08 0.00 0.48 0.00 0.00 55.95 58.27 2klg s SER 65 Cb 0.00 -2.56 0.19 0.00 0.10 0.00 0.00 66.02 63.75 2klg s SER 65 CO 0.00 -0.68 0.58 -0.89 0.98 0.00 0.00 173.24 173.23 2klg s THR 66 N -1.96 4.54 -0.11 2.02 2.01 -1.26 -3.71 115.64 117.17 2klg s THR 66 Ca 0.65 -2.76 -0.02 0.00 0.31 0.00 0.00 61.69 59.87 2klg s THR 66 Cb -0.16 -3.88 -0.03 0.00 0.01 0.00 0.00 72.50 68.44 2klg s THR 66 CO 0.20 -0.95 -0.04 -1.48 -0.69 0.00 0.00 174.62 171.66 2klg s LEU 67 N 0.02 3.26 -0.05 4.42 0.05 -1.26 -5.11 118.68 120.01 2klg s LEU 67 Ca 0.17 -0.05 -0.00 0.00 0.05 0.00 0.00 54.13 54.30 2klg s LEU 67 Cb -0.16 -1.75 -0.03 0.00 -2.05 0.00 0.00 46.19 42.20 2klg s LEU 67 CO -0.06 0.27 0.00 -1.00 -0.55 0.00 0.00 176.35 175.02 2klg s HIS 68 N -0.27 3.12 0.22 3.48 3.76 -1.26 -4.67 115.29 119.67 2klg s HIS 68 Ca 0.04 0.14 0.06 0.00 -0.15 0.00 0.00 55.06 55.16 2klg s HIS 68 Cb -0.13 -1.74 -0.04 0.00 1.11 0.00 0.00 32.58 31.79 2klg s HIS 68 CO 0.02 0.46 0.21 -0.48 -0.85 0.00 0.00 174.74 174.10 2klg s LEU 69 N -1.18 3.90 0.15 0.89 -0.00 -1.26 -0.62 118.68 120.56 2klg s LEU 69 Ca 0.16 -0.16 0.08 0.00 -0.00 0.00 0.00 54.13 54.22 2klg s LEU 69 Cb -0.11 -2.46 -0.04 0.00 -0.00 0.00 0.00 46.19 43.58 2klg s LEU 69 CO 0.06 -0.01 -0.11 0.54 -0.00 0.00 0.00 176.35 176.83 2klg s VAL 70 N -1.99 3.21 -1.01 1.48 0.11 -1.08 -4.81 120.40 116.31 2klg s VAL 70 Ca 0.33 -1.51 -0.23 0.00 -2.93 0.00 0.00 61.98 57.64 2klg s VAL 70 Cb -0.09 -2.55 0.06 0.00 -1.53 0.00 0.00 36.38 32.27 2klg s VAL 70 CO 0.25 -0.01 1.41 -0.76 -3.33 0.00 0.00 175.10 172.66 2klg s LEU 71 N -2.55 3.68 -0.53 2.54 1.02 -1.26 -4.39 118.68 117.19 2klg s LEU 71 Ca 0.23 -1.51 -0.03 0.00 0.02 0.00 0.00 54.13 52.84 2klg s LEU 71 Cb -0.10 -2.55 0.21 0.00 0.02 0.00 0.00 46.19 43.77 2klg s LEU 71 CO 0.14 -1.46 2.35 -1.14 0.02 0.00 0.00 176.35 176.26 2klg n ARG 72 N 8.62 2.38 0.05 1.70 0.00 -1.26 -4.51 116.66 123.64 2klg n ARG 72 Ca 0.32 -2.54 -0.20 0.00 -0.00 0.00 0.00 57.85 55.42 2klg n ARG 72 Cb 0.51 -2.07 -0.15 0.00 0.00 0.00 0.00 32.46 30.75 2klg n ARG 72 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.63 177.56 2klg h LEU 73 N 3.15 0.46 -8.52 6.15 3.38 -1.89 -3.43 115.31 114.61 2klg h LEU 73 Ca 0.44 -0.95 -0.64 0.00 0.09 0.00 0.00 57.88 56.82 2klg h LEU 73 Cb 0.64 -0.15 -0.15 0.00 0.09 0.00 0.00 40.66 41.09 2klg h LEU 73 CO 1.07 1.40 0.28 -0.60 0.09 0.00 0.00 178.44 180.68 2klg s ARG 74 N -2.43 3.28 -1.09 1.13 3.52 -1.26 -4.96 118.95 117.14 2klg s ARG 74 Ca -0.14 -0.40 -0.02 0.00 -0.13 0.00 0.00 55.73 55.03 2klg s ARG 74 Cb 0.01 -4.01 0.28 0.00 -1.56 0.00 0.00 34.95 29.67 2klg s ARG 74 CO 0.83 -1.22 1.85 0.41 -0.81 0.00 0.00 175.30 176.36 2klg n GLY 75 N 5.08 5.79 0.21 8.12 0.00 -1.26 -5.18 105.19 117.95 2klg n GLY 75 Ca -0.01 -2.50 0.15 0.00 0.00 0.00 0.00 46.02 43.66 2klg n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93