#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2klg n GLN 2 N 0.00 0.62 -3.10 2.12 1.13 -1.26 -5.06 117.38 111.83 2klg n GLN 2 Ca 0.00 0.35 -0.10 0.00 -1.94 0.00 0.00 57.00 55.32 2klg n GLN 2 Cb 0.00 -1.62 -0.03 0.00 0.11 0.00 0.00 30.24 28.70 2klg n GLN 2 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 2klg n ILE 3 N -4.02 0.00 -3.97 5.09 -0.00 -1.26 -3.40 119.36 111.80 2klg n ILE 3 Ca -0.42 -1.17 -0.32 0.00 -0.00 0.00 0.00 62.75 60.84 2klg n ILE 3 Cb 0.86 0.68 -0.14 0.00 -0.00 0.00 0.00 39.64 41.04 2klg n ILE 3 CO 0.00 0.00 0.00 -0.36 -0.00 0.00 0.00 176.55 176.19 2klg s PHE 4 N -3.49 3.70 -0.19 4.28 0.40 -1.26 -4.85 117.98 116.57 2klg s PHE 4 Ca 0.19 -2.91 -0.01 0.00 -0.60 0.00 0.00 56.93 53.60 2klg s PHE 4 Cb -0.00 -2.98 0.01 0.00 0.51 0.00 0.00 43.02 40.56 2klg s PHE 4 CO 0.14 -0.94 -0.14 0.08 0.70 0.00 0.00 175.22 175.05 2klg s VAL 5 N 0.85 2.57 -0.23 -0.44 1.01 -1.26 -4.55 120.40 118.36 2klg s VAL 5 Ca 0.11 -0.77 -0.06 0.00 0.00 0.00 0.00 61.98 61.25 2klg s VAL 5 Cb -0.20 -2.11 -0.03 0.00 0.00 0.00 0.00 36.38 34.04 2klg s VAL 5 CO -0.07 0.50 0.04 -0.54 0.00 0.00 0.00 175.10 175.04 2klg s LYS 6 N 1.24 3.66 0.00 2.72 1.02 -1.25 -3.29 119.74 123.84 2klg s LYS 6 Ca 0.03 -0.48 0.00 0.00 0.02 0.00 0.00 55.97 55.53 2klg s LYS 6 Cb -0.14 -3.23 0.00 0.00 -0.52 0.00 0.00 37.83 33.94 2klg s LYS 6 CO -0.07 -0.09 0.00 0.25 -0.92 0.00 0.00 175.35 174.52 2klg n THR 7 N 4.58 0.00 0.00 2.17 -2.24 -1.25 -4.12 114.28 113.42 2klg n THR 7 Ca -0.17 0.25 0.00 0.00 -2.27 0.00 0.00 64.05 61.86 2klg n THR 7 Cb 0.52 -1.24 0.00 0.00 -2.10 0.00 0.00 70.33 67.50 2klg n THR 7 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2klg n LEU 8 N -1.99 0.00 -3.10 3.22 -0.00 -1.26 -4.77 117.00 109.10 2klg n LEU 8 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 56.01 55.68 2klg n LEU 8 Cb 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.41 2klg n LEU 8 CO 0.00 0.00 0.71 1.07 -0.00 0.00 0.00 177.39 179.17 2klg n THR 9 N 0.00 4.03 -0.83 1.47 5.66 -1.26 -4.76 114.28 118.58 2klg n THR 9 Ca 0.00 -5.50 0.00 0.00 -3.05 0.00 0.00 64.05 55.50 2klg n THR 9 Cb 0.00 -1.41 0.00 0.00 -1.55 0.00 0.00 70.33 67.37 2klg n THR 9 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2klg n GLY 10 N -0.25 1.12 3.79 1.09 0.00 -1.26 -5.08 105.19 104.60 2klg n GLY 10 Ca 0.40 -0.26 -0.38 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.85 4.45 -0.31 1.61 2.20 -1.26 -4.97 119.74 119.60 2klg s LYS 11 Ca 0.00 1.06 -0.13 0.00 -0.36 0.00 0.00 55.97 56.54 2klg s LYS 11 Cb 0.00 -3.07 -0.03 0.00 -1.51 0.00 0.00 37.83 33.22 2klg s LYS 11 CO 0.00 0.48 0.29 -0.08 -0.36 0.00 0.00 175.35 175.68 2klg s THR 12 N -1.33 5.24 0.06 3.43 -1.32 -1.26 -3.90 115.64 116.55 2klg s THR 12 Ca 0.40 0.16 0.07 0.00 -1.21 0.00 0.00 61.69 61.11 2klg s THR 12 Cb -0.20 -3.68 -0.03 0.00 -1.51 0.00 0.00 72.50 67.08 2klg s THR 12 CO 0.24 0.09 -0.20 0.27 -2.21 0.00 0.00 174.62 172.80 2klg s ILE 13 N 1.90 1.65 -0.17 5.08 -4.36 -1.21 -5.05 121.20 119.04 2klg s ILE 13 Ca 0.10 -1.28 -0.12 0.00 -0.26 0.00 0.00 60.65 59.08 2klg s ILE 13 Cb -0.16 -1.45 -0.05 0.00 1.25 0.00 0.00 42.46 42.05 2klg s ILE 13 CO 0.11 0.12 0.24 0.28 0.24 0.00 0.00 174.94 175.93 2klg s THR 14 N -0.90 5.34 -0.04 8.37 -1.32 -1.26 -4.23 115.64 121.59 2klg s THR 14 Ca 0.07 0.44 0.03 0.00 -1.21 0.00 0.00 61.69 61.01 2klg s THR 14 Cb -0.09 -3.58 0.01 0.00 -1.51 0.00 0.00 72.50 67.33 2klg s THR 14 CO 0.02 0.42 -0.12 -0.22 -2.21 0.00 0.00 174.62 172.52 2klg s LEU 15 N 0.33 1.74 0.53 9.08 1.98 -1.26 -5.05 118.68 126.02 2klg s LEU 15 Ca 0.14 -0.26 0.09 0.00 -2.89 0.00 0.00 54.13 51.21 2klg s LEU 15 Cb -0.12 -0.73 0.06 0.00 0.66 0.00 0.00 46.19 46.06 2klg s LEU 15 CO 0.02 0.07 0.70 -1.83 -1.89 0.00 0.00 176.35 173.42 2klg s GLU 16 N 0.36 2.45 -0.27 1.98 -1.05 -1.26 -4.60 118.70 116.30 2klg s GLU 16 Ca -0.08 -1.55 -0.00 0.00 -0.15 0.00 0.00 54.97 53.19 2klg s GLU 16 Cb -0.12 -2.64 0.08 0.00 -0.44 0.00 0.00 34.13 31.01 2klg s GLU 16 CO 0.02 -0.67 0.04 0.08 0.95 0.00 0.00 175.26 175.68 2klg s VAL 17 N -2.58 1.08 0.28 1.83 1.01 -1.26 -4.99 120.40 115.76 2klg s VAL 17 Ca 0.58 -1.26 0.08 0.00 0.00 0.00 0.00 61.98 61.38 2klg s VAL 17 Cb -0.07 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.63 2klg s VAL 17 CO 0.36 -0.43 0.19 -1.83 0.00 0.00 0.00 175.10 173.39 2klg s GLU 18 N 1.55 2.77 0.12 2.72 -1.05 -1.26 -4.97 118.70 118.58 2klg s GLU 18 Ca 0.04 -1.19 -0.29 0.00 -0.15 0.00 0.00 54.97 53.38 2klg s GLU 18 Cb -0.18 -2.47 -0.07 0.00 -0.44 0.00 0.00 34.13 30.97 2klg s GLU 18 CO -0.15 0.30 1.59 -1.35 0.95 0.00 0.00 175.26 176.60 2klg h PRO 19 N 1.48 -0.52 -1.40 -4.83 0.11 -2.05 -2.13 132.00 122.65 2klg h PRO 19 Ca -0.47 0.04 -0.34 0.00 0.11 0.00 0.00 66.00 65.34 2klg h PRO 19 Cb 1.24 0.12 -0.15 0.00 0.11 0.00 0.00 31.00 32.32 2klg h PRO 19 CO 0.60 -0.35 0.43 -1.13 -0.21 0.00 0.00 178.00 177.35 2klg n SER 20 N -5.44 6.02 -4.57 -2.05 3.41 -1.26 -4.85 113.62 104.88 2klg n SER 20 Ca -0.05 -3.07 -0.35 0.00 -0.26 0.00 0.00 58.87 55.13 2klg n SER 20 Cb 0.36 -0.99 -0.03 0.00 -0.26 0.00 0.00 64.21 63.29 2klg n SER 20 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2klg s ASP 21 N -0.01 5.94 0.58 4.04 2.15 -0.80 -4.96 116.67 123.61 2klg s ASP 21 Ca 0.33 -1.60 -0.07 0.00 0.43 0.00 0.00 52.55 51.64 2klg s ASP 21 Cb 0.26 -2.58 -0.01 0.00 -0.30 0.00 0.00 42.92 40.30 2klg s ASP 21 CO 0.01 -2.07 0.91 0.42 -0.17 0.00 0.00 175.17 174.27 2klg s THR 22 N 7.36 4.01 0.11 1.71 -4.23 -1.26 -0.27 115.64 123.07 2klg s THR 22 Ca 0.59 0.20 -0.15 0.00 -1.18 0.00 0.00 61.69 61.15 2klg s THR 22 Cb -0.01 -3.59 -0.05 0.00 1.34 0.00 0.00 72.50 70.20 2klg s THR 22 CO 0.02 -0.64 1.49 0.40 -0.54 0.00 0.00 174.62 175.36 2klg h ILE 23 N -0.17 1.28 -0.87 2.99 1.08 -1.76 -2.56 117.51 117.51 2klg h ILE 23 Ca -0.46 -1.25 0.12 0.00 -0.39 0.00 0.00 64.86 62.88 2klg h ILE 23 Cb 1.24 1.35 -0.08 0.00 -3.07 0.00 0.00 36.82 36.26 2klg h ILE 23 CO 0.61 0.41 0.50 -0.08 -0.69 0.00 0.00 178.15 178.90 2klg h GLU 24 N 0.50 0.76 -0.43 2.37 4.57 -1.91 0.34 114.58 120.79 2klg h GLU 24 Ca 0.08 -0.05 -0.14 0.00 -1.18 0.00 0.00 59.36 58.08 2klg h GLU 24 Cb 0.68 -0.17 -0.01 0.00 -0.16 0.00 0.00 28.75 29.09 2klg h GLU 24 CO 0.05 0.50 -0.28 -0.91 -1.18 0.00 0.00 179.01 177.19 2klg h ASN 25 N 0.78 0.97 -0.41 1.04 4.21 -1.93 -2.66 115.58 117.59 2klg h ASN 25 Ca 0.44 -0.39 -0.03 0.00 1.21 0.00 0.00 56.30 57.53 2klg h ASN 25 Cb 0.49 -0.27 -0.02 0.00 -1.12 0.00 0.00 38.32 37.40 2klg h ASN 25 CO -0.29 1.18 0.13 0.58 -1.29 0.00 0.00 177.43 177.74 2klg h VAL 26 N 0.79 1.21 -0.62 2.81 2.07 -0.81 -2.66 116.25 119.04 2klg h VAL 26 Ca 0.09 -0.70 0.02 0.00 0.82 0.00 0.00 66.70 66.92 2klg h VAL 26 Cb 0.85 0.91 -0.03 0.00 -1.52 0.00 0.00 31.29 31.50 2klg h VAL 26 CO 0.08 0.25 0.40 0.11 0.02 0.00 0.00 177.57 178.42 2klg h LYS 27 N 0.51 0.78 -0.77 1.57 1.57 -0.94 -2.01 116.57 117.27 2klg h LYS 27 Ca 0.13 -0.05 0.05 0.00 -1.87 0.00 0.00 60.65 58.92 2klg h LYS 27 Cb 0.25 -0.18 -0.05 0.00 0.08 0.00 0.00 32.23 32.34 2klg h LYS 27 CO -0.00 0.52 0.51 0.00 -0.57 0.00 0.00 179.45 179.90 2klg h ALA 28 N 1.25 1.60 -0.55 3.86 0.00 -1.30 0.10 119.26 124.22 2klg h ALA 28 Ca 0.24 -0.03 -0.11 0.00 0.00 0.00 0.00 54.91 55.01 2klg h ALA 28 Cb -0.04 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2klg h ALA 28 CO -0.07 0.29 -0.07 -0.22 0.00 0.00 0.00 179.25 179.18 2klg h LYS 29 N 0.88 1.01 -0.01 0.00 3.11 -1.03 -0.11 116.57 120.42 2klg h LYS 29 Ca 0.32 -0.36 -0.00 0.00 -2.81 0.00 0.00 60.65 57.80 2klg h LYS 29 Cb 0.16 -0.07 -0.00 0.00 -1.00 0.00 0.00 32.23 31.32 2klg h LYS 29 CO -0.11 1.04 -0.01 0.82 -2.81 0.00 0.00 179.45 178.39 2klg h ILE 30 N 0.89 1.39 0.00 2.00 1.08 -0.86 -3.11 117.51 118.90 2klg h ILE 30 Ca 0.15 -1.16 -0.03 0.00 -0.39 0.00 0.00 64.86 63.43 2klg h ILE 30 Cb 0.63 2.16 -0.00 0.00 -3.07 0.00 0.00 36.82 36.54 2klg h ILE 30 CO 0.04 0.30 -0.13 0.06 -0.69 0.00 0.00 178.15 177.74 2klg h GLN 31 N -0.46 0.00 -0.93 2.37 3.07 -1.02 -2.85 115.11 115.29 2klg h GLN 31 Ca 0.00 0.00 0.25 0.00 0.09 0.00 0.00 58.65 58.99 2klg h GLN 31 Cb 0.50 0.00 -0.05 0.00 0.08 0.00 0.00 27.48 28.01 2klg h GLN 31 CO 0.00 0.13 0.64 0.22 0.09 0.00 0.00 178.83 179.91 2klg h ASP 32 N 0.00 0.18 0.93 0.06 3.58 -0.93 0.17 116.42 120.40 2klg h ASP 32 Ca -0.00 0.02 -0.19 0.00 0.42 0.00 0.00 57.03 57.28 2klg h ASP 32 Cb 0.35 -0.01 -0.03 0.00 1.72 0.00 0.00 39.33 41.36 2klg h ASP 32 CO 0.02 0.06 -1.15 0.07 -2.88 0.00 0.00 179.24 175.36 2klg h LYS 33 N 0.17 0.00 -2.17 0.28 2.10 -1.65 -3.48 116.57 111.82 2klg h LYS 33 Ca 0.47 0.00 -0.25 0.00 -2.00 0.00 0.00 60.65 58.86 2klg h LYS 33 Cb 1.55 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.89 2klg h LYS 33 CO -0.09 0.59 -0.34 -1.91 -2.00 0.00 0.00 179.45 175.70 2klg n GLU 34 N -3.14 -1.66 -0.07 0.07 4.07 0.59 -4.93 120.64 115.58 2klg n GLU 34 Ca -0.06 0.60 -0.21 0.00 -0.06 0.00 0.00 57.16 57.43 2klg n GLU 34 Cb 0.89 -4.78 -0.13 0.00 -0.06 0.00 0.00 31.44 27.36 2klg n GLU 34 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2klg n GLY 35 N -1.08 -0.52 3.54 8.31 0.00 -1.26 -4.83 105.19 109.35 2klg n GLY 35 Ca -0.13 -0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.28 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 -2.52 4.71 0.13 -0.61 2.07 -1.26 -4.95 121.20 118.77 2klg s ILE 36 Ca -0.29 0.43 -0.19 0.00 -1.41 0.00 0.00 60.65 59.19 2klg s ILE 36 Cb 0.08 -4.27 -0.05 0.00 0.13 0.00 0.00 42.46 38.35 2klg s ILE 36 CO 0.66 -0.63 1.75 -0.65 -1.91 0.00 0.00 174.94 174.17 2klg h PRO 37 N 8.86 0.18 -5.10 3.50 0.11 -1.98 -3.41 132.00 134.16 2klg h PRO 37 Ca -0.25 -0.01 -0.37 0.00 0.11 0.00 0.00 66.00 65.48 2klg h PRO 37 Cb 1.09 -0.04 -0.08 0.00 0.11 0.00 0.00 31.00 32.08 2klg h PRO 37 CO 0.93 0.12 1.65 -2.30 -0.21 0.00 0.00 178.00 178.19 2klg n PRO 38 N -5.03 0.17 0.12 1.05 -0.02 -1.26 -4.75 135.00 125.28 2klg n PRO 38 Ca -0.03 -0.11 -0.01 0.00 -2.02 0.00 0.00 63.50 61.34 2klg n PRO 38 Cb 0.07 -1.75 0.27 0.00 -0.02 0.00 0.00 33.50 32.07 2klg n PRO 38 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2klg h ASP 39 N 12.37 0.18 -1.27 2.55 1.82 -1.80 -3.05 116.42 127.22 2klg h ASP 39 Ca -0.02 -0.07 -0.70 0.00 -0.39 0.00 0.00 57.03 55.85 2klg h ASP 39 Cb 1.19 -0.05 -0.29 0.00 0.68 0.00 0.00 39.33 40.85 2klg h ASP 39 CO 1.43 0.55 0.85 0.00 -1.61 0.00 0.00 179.24 180.45 2klg n GLN 40 N -4.06 2.75 -2.87 0.28 1.13 -1.26 -4.98 117.38 108.37 2klg n GLN 40 Ca -0.01 -3.40 -0.41 0.00 -1.94 0.00 0.00 57.00 51.24 2klg n GLN 40 Cb 0.44 -2.28 -0.04 0.00 0.11 0.00 0.00 30.24 28.47 2klg n GLN 40 CO 0.00 0.00 0.00 1.14 -1.44 0.00 0.00 177.06 176.76 2klg s GLN 41 N -3.89 4.53 0.32 -1.09 1.03 -1.16 -4.64 119.66 114.77 2klg s GLN 41 Ca 0.61 1.20 0.05 0.00 0.04 0.00 0.00 55.36 57.25 2klg s GLN 41 Cb 0.49 -3.42 -0.02 0.00 0.03 0.00 0.00 33.01 30.09 2klg s GLN 41 CO -0.12 0.10 0.18 0.54 -2.54 0.00 0.00 175.29 173.44 2klg n ARG 42 N 3.43 0.50 -3.58 9.60 3.00 -1.26 -5.06 116.66 123.30 2klg n ARG 42 Ca 0.01 -2.89 -0.37 0.00 -0.01 0.00 0.00 57.85 54.60 2klg n ARG 42 Cb 0.51 1.92 -0.08 0.00 0.00 0.00 0.00 32.46 34.81 2klg n ARG 42 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.63 176.46 2klg s LEU 43 N 0.00 4.16 -0.85 0.55 1.98 -1.26 -3.53 118.68 119.73 2klg s LEU 43 Ca 0.25 0.30 -0.12 0.00 -2.89 0.00 0.00 54.13 51.66 2klg s LEU 43 Cb 0.01 -2.26 0.22 0.00 0.66 0.00 0.00 46.19 44.83 2klg s LEU 43 CO 0.18 0.05 0.78 -0.51 -1.89 0.00 0.00 176.35 174.96 2klg s ILE 44 N 0.94 5.51 -0.16 6.68 1.10 -0.96 -4.67 121.20 129.64 2klg s ILE 44 Ca 0.12 -2.64 -0.10 0.00 -0.51 0.00 0.00 60.65 57.52 2klg s ILE 44 Cb -0.13 -4.40 0.05 0.00 0.15 0.00 0.00 42.46 38.13 2klg s ILE 44 CO 0.04 -1.04 0.39 0.12 -2.11 0.00 0.00 174.94 172.35 2klg s PHE 45 N -0.05 -0.54 -1.76 3.50 5.36 -1.26 -4.69 117.98 118.54 2klg s PHE 45 Ca 0.19 1.19 0.00 0.00 -0.96 0.00 0.00 56.93 57.35 2klg s PHE 45 Cb -0.11 0.22 0.00 0.00 -0.34 0.00 0.00 43.02 42.79 2klg s PHE 45 CO -0.09 -0.31 0.00 0.00 -1.46 0.00 0.00 175.22 173.37 2klg n ALA 46 N 3.99 -0.59 -4.27 11.12 0.00 -1.26 -2.62 120.51 126.88 2klg n ALA 46 Ca -0.22 0.17 -0.37 0.00 0.00 0.00 0.00 53.44 53.03 2klg n ALA 46 Cb 0.55 -2.15 -0.04 0.00 0.00 0.00 0.00 19.45 17.81 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 -1.00 -0.42 3.62 0.00 0.00 -1.26 -4.94 105.19 101.19 2klg n GLY 47 Ca -0.24 0.13 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 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 -6.98 2.99 -0.24 1.61 1.02 -1.08 -5.09 119.74 111.97 2klg s LYS 48 Ca 0.70 -0.48 -0.21 0.00 0.02 0.00 0.00 55.97 56.00 2klg s LYS 48 Cb -0.39 -2.73 -0.02 0.00 -0.52 0.00 0.00 37.83 34.17 2klg s LYS 48 CO 0.94 0.62 0.65 -1.14 -0.92 0.00 0.00 175.35 175.51 2klg s GLN 49 N -0.68 4.13 0.00 1.68 2.00 -1.26 -4.64 119.66 120.90 2klg s GLN 49 Ca 0.10 0.60 0.30 0.00 -2.00 0.00 0.00 55.36 54.36 2klg s GLN 49 Cb -0.12 -3.64 1.47 0.00 0.80 0.00 0.00 33.01 31.53 2klg s GLN 49 CO 0.02 -0.40 2.02 1.28 -0.50 0.00 0.00 175.29 177.71 2klg n LEU 50 N 5.64 0.00 0.23 3.68 4.32 -1.26 -3.36 117.00 126.24 2klg n LEU 50 Ca -0.00 0.31 0.13 0.00 -0.02 0.00 0.00 56.01 56.42 2klg n LEU 50 Cb 0.49 -0.31 0.23 0.00 -1.62 0.00 0.00 43.42 42.22 2klg n LEU 50 CO 0.43 -0.01 0.83 -0.33 -1.22 0.00 0.00 177.39 177.10 2klg h GLU 51 N 0.00 0.00 -1.06 3.23 4.39 -1.98 -3.30 114.58 115.85 2klg h GLU 51 Ca 0.00 0.00 0.31 0.00 0.34 0.00 0.00 59.36 60.01 2klg h GLU 51 Cb 0.30 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 28.82 2klg h GLU 51 CO 0.00 0.01 0.65 -0.44 -1.16 0.00 0.00 179.01 178.06 2klg h ASP 52 N 0.00 0.49 -0.00 1.42 5.19 -1.99 -3.45 116.42 118.08 2klg h ASP 52 Ca -0.00 0.14 0.00 0.00 -0.62 0.00 0.00 57.03 56.55 2klg h ASP 52 Cb 0.94 0.07 0.00 0.00 0.18 0.00 0.00 39.33 40.53 2klg h ASP 52 CO 0.00 -0.02 0.00 0.61 -3.12 0.00 0.00 179.24 176.71 2klg n GLY 53 N -1.38 0.85 2.58 2.75 0.00 -1.24 -5.13 105.19 103.61 2klg n GLY 53 Ca 0.30 -0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.00 0.89 -2.87 1.61 5.12 -1.26 -4.85 116.66 115.30 2klg n ARG 54 Ca 0.00 -2.26 -0.19 0.00 -1.93 0.00 0.00 57.85 53.47 2klg n ARG 54 Cb 0.00 0.13 0.04 0.00 -1.16 0.00 0.00 32.46 31.47 2klg n ARG 54 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 2klg s THR 55 N -1.72 2.67 0.04 0.55 -1.32 -1.26 -2.19 115.64 112.41 2klg s THR 55 Ca 0.27 -0.86 -0.32 0.00 -1.21 0.00 0.00 61.69 59.56 2klg s THR 55 Cb -0.02 -2.81 -0.18 0.00 -1.51 0.00 0.00 72.50 67.98 2klg s THR 55 CO 0.17 0.00 1.42 -0.07 -2.21 0.00 0.00 174.62 173.93 2klg h LEU 56 N 0.28 -0.86 -2.00 9.08 4.07 -0.95 -2.92 115.31 122.02 2klg h LEU 56 Ca -0.38 0.01 0.19 0.00 0.08 0.00 0.00 57.88 57.78 2klg h LEU 56 Cb 1.29 0.22 -0.03 0.00 1.08 0.00 0.00 40.66 43.22 2klg h LEU 56 CO 0.46 -0.55 0.50 -1.28 -1.08 0.00 0.00 178.44 176.49 2klg h SER 57 N -1.13 0.00 -0.95 -0.43 0.87 -1.85 -1.35 113.55 108.70 2klg h SER 57 Ca -0.10 0.00 0.15 0.00 -1.23 0.00 0.00 61.79 60.60 2klg h SER 57 Cb 0.80 0.00 -0.08 0.00 -0.44 0.00 0.00 62.40 62.68 2klg h SER 57 CO 0.17 0.00 0.60 0.44 -0.53 0.00 0.00 176.83 177.51 2klg h ASP 58 N 0.00 0.77 -0.56 6.23 5.19 -1.90 -0.04 116.42 126.11 2klg h ASP 58 Ca 0.31 0.05 -0.02 0.00 -0.62 0.00 0.00 57.03 56.75 2klg h ASP 58 Cb 1.30 -0.10 -0.01 0.00 0.18 0.00 0.00 39.33 40.70 2klg h ASP 58 CO -0.00 0.37 0.03 -1.22 -3.12 0.00 0.00 179.24 175.30 2klg n TYR 59 N -4.61 1.99 -1.36 4.55 4.01 -0.53 -4.92 117.16 116.29 2klg n TYR 59 Ca 0.19 -0.81 -0.12 0.00 -0.16 0.00 0.00 57.90 57.00 2klg n TYR 59 Cb 0.46 -0.51 -0.05 0.00 -0.31 0.00 0.00 39.34 38.92 2klg n TYR 59 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2klg n ASN 60 N 0.39 -5.28 -3.86 7.72 2.85 -0.03 -4.90 115.26 112.15 2klg n ASN 60 Ca 0.29 0.31 -0.42 0.00 -0.11 0.00 0.00 54.58 54.64 2klg n ASN 60 Cb 1.19 -3.87 0.00 0.00 1.24 0.00 0.00 39.78 38.34 2klg n ASN 60 CO 0.00 0.00 0.00 2.30 -2.11 0.00 0.00 177.26 177.45 2klg n ILE 61 N -2.38 4.40 -2.61 -1.44 -5.35 -1.07 -4.96 119.36 105.95 2klg n ILE 61 Ca -0.12 -4.46 -0.09 0.00 -0.27 0.00 0.00 62.75 57.80 2klg n ILE 61 Cb 0.54 -2.34 0.04 0.00 -1.74 0.00 0.00 39.64 36.14 2klg n ILE 61 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2klg n GLN 62 N 3.71 0.49 -1.41 6.28 6.02 -1.26 -4.44 117.38 126.77 2klg n GLN 62 Ca 0.39 -1.18 -0.40 0.00 -0.01 0.00 0.00 57.00 55.80 2klg n GLN 62 Cb 0.36 -0.22 0.02 0.00 1.02 0.00 0.00 30.24 31.42 2klg n GLN 62 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 2klg n LYS 63 N -1.68 0.42 -1.27 -1.09 -0.00 -1.26 -1.26 118.16 112.02 2klg n LYS 63 Ca 0.07 0.16 -0.09 0.00 -0.00 0.00 0.00 58.31 58.44 2klg n LYS 63 Cb 0.25 -1.45 -0.04 0.00 -0.00 0.00 0.00 35.03 33.79 2klg n LYS 63 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.40 177.79 2klg n GLU 64 N 0.61 -1.23 -1.63 -1.58 -0.58 -1.22 -4.98 120.64 110.02 2klg n GLU 64 Ca 0.11 0.78 -0.29 0.00 -0.42 0.00 0.00 57.16 57.33 2klg n GLU 64 Cb 0.43 -4.91 0.10 0.00 -0.57 0.00 0.00 31.44 26.49 2klg n GLU 64 CO 0.00 0.00 0.00 -1.12 -0.48 0.00 0.00 177.13 175.53 2klg s SER 65 N -2.51 4.32 -0.84 1.62 0.01 -0.39 -5.01 113.70 110.91 2klg s SER 65 Ca 0.00 1.12 -0.07 0.00 1.31 0.00 0.00 55.95 58.32 2klg s SER 65 Cb 0.00 -1.79 0.21 0.00 0.21 0.00 0.00 66.02 64.65 2klg s SER 65 CO 0.00 -2.06 0.74 0.28 0.41 0.00 0.00 173.24 172.61 2klg s THR 66 N -3.27 4.80 -0.35 1.44 -1.32 -1.26 -4.58 115.64 111.10 2klg s THR 66 Ca 0.61 -3.16 -0.14 0.00 -1.21 0.00 0.00 61.69 57.79 2klg s THR 66 Cb -0.14 -3.99 -0.01 0.00 -1.51 0.00 0.00 72.50 66.86 2klg s THR 66 CO 0.53 -1.03 0.30 -0.76 -2.21 0.00 0.00 174.62 171.45 2klg s LEU 67 N -0.57 4.59 -0.22 9.08 1.02 -1.26 -4.99 118.68 126.34 2klg s LEU 67 Ca 0.22 -0.44 -0.06 0.00 0.02 0.00 0.00 54.13 53.87 2klg s LEU 67 Cb -0.12 -2.22 -0.03 0.00 0.02 0.00 0.00 46.19 43.84 2klg s LEU 67 CO -0.08 -0.31 0.03 -2.28 0.02 0.00 0.00 176.35 173.73 2klg s HIS 68 N 1.83 3.08 0.02 0.29 2.46 -1.26 -4.46 115.29 117.26 2klg s HIS 68 Ca 0.08 -0.39 -0.13 0.00 0.47 0.00 0.00 55.06 55.09 2klg s HIS 68 Cb -0.17 -2.14 -0.06 0.00 -0.13 0.00 0.00 32.58 30.08 2klg s HIS 68 CO 0.11 -0.25 0.40 -0.51 -2.47 0.00 0.00 174.74 172.02 2klg s LEU 69 N 1.16 4.43 0.15 8.88 1.43 -1.26 -2.26 118.68 131.21 2klg s LEU 69 Ca 0.04 0.89 0.08 0.00 -1.03 0.00 0.00 54.13 54.11 2klg s LEU 69 Cb -0.14 -2.71 -0.04 0.00 0.03 0.00 0.00 46.19 43.32 2klg s LEU 69 CO 0.02 0.27 -0.10 0.54 0.23 0.00 0.00 176.35 177.31 2klg s VAL 70 N -1.19 3.22 -1.00 -1.59 0.11 -1.23 -4.92 120.40 113.80 2klg s VAL 70 Ca 0.27 -1.53 -0.23 0.00 -2.93 0.00 0.00 61.98 57.56 2klg s VAL 70 Cb -0.16 -2.56 0.03 0.00 -1.53 0.00 0.00 36.38 32.16 2klg s VAL 70 CO 0.15 -0.03 1.58 -0.22 -3.33 0.00 0.00 175.10 173.25 2klg s LEU 71 N -2.59 3.43 -0.73 2.54 1.98 -1.26 -4.52 118.68 117.52 2klg s LEU 71 Ca 0.23 -1.29 -0.19 0.00 -2.89 0.00 0.00 54.13 49.99 2klg s LEU 71 Cb -0.10 -2.57 0.12 0.00 0.66 0.00 0.00 46.19 44.31 2klg s LEU 71 CO 0.14 -1.81 0.87 -0.60 -1.89 0.00 0.00 176.35 173.07 2klg s ARG 72 N 5.46 3.29 -0.11 1.98 6.06 -1.26 -4.89 118.95 129.48 2klg s ARG 72 Ca 0.52 -1.54 -0.04 0.00 -2.50 0.00 0.00 55.73 52.17 2klg s ARG 72 Cb -0.01 -4.47 -0.04 0.00 0.06 0.00 0.00 34.95 30.49 2klg s ARG 72 CO -0.07 -1.61 0.11 -0.07 -2.50 0.00 0.00 175.30 171.15 2klg h LEU 73 N 9.98 0.00 -9.82 -0.88 3.38 -1.92 -3.37 115.31 112.69 2klg h LEU 73 Ca -0.11 -0.14 -0.56 0.00 0.09 0.00 0.00 57.88 57.17 2klg h LEU 73 Cb 1.06 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 2klg h LEU 73 CO 1.06 0.57 -0.07 -0.13 0.09 0.00 0.00 178.44 179.97 2klg s ARG 74 N -1.65 4.01 0.04 1.13 1.81 -1.26 -4.79 118.95 118.24 2klg s ARG 74 Ca -0.03 0.53 0.01 0.00 -1.72 0.00 0.00 55.73 54.52 2klg s ARG 74 Cb -0.00 -2.96 -0.00 0.00 -0.45 0.00 0.00 34.95 31.53 2klg s ARG 74 CO 0.10 0.49 0.04 0.41 -0.68 0.00 0.00 175.30 175.67 2klg n GLY 75 N 0.91 3.64 3.68 -3.53 0.00 -1.26 -5.00 105.19 103.62 2klg n GLY 75 Ca -0.06 -1.61 0.00 0.00 0.00 0.00 0.00 46.02 44.35 2klg n GLY 75 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93