#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2klc s LYS 24 N 0.00 4.25 0.29 -0.52 2.20 -1.26 -5.08 119.74 119.63 2klc s LYS 24 Ca 0.00 1.41 -0.10 0.00 -0.36 0.00 0.00 55.97 56.91 2klc s LYS 24 Cb 0.00 -2.53 -0.07 0.00 -1.51 0.00 0.00 37.83 33.72 2klc s LYS 24 CO 0.00 -0.04 0.63 -1.50 -0.36 0.00 0.00 175.35 174.08 2klc s ILE 25 N -1.74 4.86 -0.45 5.43 2.07 -1.26 -5.03 121.20 125.08 2klc s ILE 25 Ca 0.57 0.55 -0.29 0.00 -1.41 0.00 0.00 60.65 60.07 2klc s ILE 25 Cb -0.19 -3.65 0.03 0.00 0.13 0.00 0.00 42.46 38.77 2klc s ILE 25 CO 0.24 -0.22 1.14 -0.32 -1.91 0.00 0.00 174.94 173.88 2klc s MET 26 N -3.15 3.76 -0.84 3.50 -2.45 -0.14 -4.85 119.30 115.14 2klc s MET 26 Ca 0.49 0.65 -0.24 0.00 -1.25 0.00 0.00 55.69 55.34 2klc s MET 26 Cb -0.11 -3.89 0.05 0.00 1.25 0.00 0.00 34.83 32.14 2klc s MET 26 CO 0.23 -1.33 1.26 0.15 1.05 0.00 0.00 175.02 176.39 2klc s LYS 27 N 4.37 3.35 -0.44 4.11 -0.14 -1.26 -1.65 119.74 128.08 2klc s LYS 27 Ca 0.48 -0.79 -0.16 0.00 -1.36 0.00 0.00 55.97 54.14 2klc s LYS 27 Cb -0.08 -4.65 0.04 0.00 -1.68 0.00 0.00 37.83 31.47 2klc s LYS 27 CO 0.30 -2.07 0.39 0.08 -0.76 0.00 0.00 175.35 173.28 2klc s VAL 28 N 4.88 5.19 0.11 3.17 1.01 -0.38 -2.38 120.40 132.00 2klc s VAL 28 Ca 0.36 -0.72 -0.25 0.00 0.00 0.00 0.00 61.98 61.37 2klc s VAL 28 Cb -0.07 -4.05 -0.07 0.00 0.00 0.00 0.00 36.38 32.20 2klc s VAL 28 CO 0.04 -0.47 0.77 -0.89 0.00 0.00 0.00 175.10 174.55 2klc s THR 29 N 1.84 4.53 -0.23 3.92 2.01 -1.07 -0.84 115.64 125.80 2klc s THR 29 Ca 0.07 1.67 0.02 0.00 0.31 0.00 0.00 61.69 63.76 2klc s THR 29 Cb -0.20 -4.12 0.04 0.00 0.01 0.00 0.00 72.50 68.23 2klc s THR 29 CO 0.10 0.46 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.65 2klc s VAL 30 N -0.67 2.10 -0.12 3.82 1.01 -0.47 -1.01 120.40 125.06 2klc s VAL 30 Ca 0.37 -1.35 -0.09 0.00 0.00 0.00 0.00 61.98 60.91 2klc s VAL 30 Cb -0.22 -2.10 -0.04 0.00 0.00 0.00 0.00 36.38 34.02 2klc s VAL 30 CO 0.25 0.19 0.19 -0.75 0.00 0.00 0.00 175.10 174.97 2klc s LYS 31 N 1.18 3.70 0.35 2.72 2.36 -0.59 -1.99 119.74 127.48 2klc s LYS 31 Ca -0.03 -0.06 0.04 0.00 -2.55 0.00 0.00 55.97 53.37 2klc s LYS 31 Cb -0.17 -3.25 -0.07 0.00 -1.05 0.00 0.00 37.83 33.29 2klc s LYS 31 CO -0.08 0.64 0.05 0.95 1.55 0.00 0.00 175.35 178.45 2klc s THR 32 N -0.66 1.37 0.00 3.43 -4.23 -0.15 -1.73 115.64 113.67 2klc s THR 32 Ca 0.15 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.66 2klc s THR 32 Cb -0.13 -2.83 0.00 0.00 1.34 0.00 0.00 72.50 70.89 2klc s THR 32 CO 0.04 0.00 1.10 -0.81 -0.54 0.00 0.00 174.62 174.41 2klc n PRO 33 N -0.77 0.60 0.18 3.99 -0.04 -1.26 -3.76 135.00 133.94 2klc n PRO 33 Ca -0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.43 2klc n PRO 33 Cb 0.67 -1.20 0.00 0.00 -0.04 0.00 0.00 33.50 32.93 2klc n PRO 33 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2klc n LYS 34 N 1.55 0.00 -0.92 0.54 5.02 -1.26 -5.11 118.16 117.98 2klc n LYS 34 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2klc n LYS 34 Cb 0.30 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.31 2klc n LYS 34 CO 0.00 0.00 0.00 -0.85 -0.52 0.00 0.00 177.40 176.03 2klc n GLU 35 N -3.34 0.00 -3.81 1.97 0.28 -1.25 -5.19 120.64 109.30 2klc n GLU 35 Ca 0.00 0.00 -0.13 0.00 -0.16 0.00 0.00 57.16 56.87 2klc n GLU 35 Cb 0.00 0.00 -0.15 0.00 1.43 0.00 0.00 31.44 32.72 2klc n GLU 35 CO 0.00 0.00 0.00 -1.59 -0.16 0.00 0.00 177.13 175.38 2klc s LYS 36 N -1.27 0.01 -0.05 3.44 -2.85 -1.26 -0.97 119.74 116.78 2klc s LYS 36 Ca 0.00 0.14 0.03 0.00 -1.00 0.00 0.00 55.97 55.13 2klc s LYS 36 Cb 0.00 -0.12 0.01 0.00 -2.06 0.00 0.00 37.83 35.66 2klc s LYS 36 CO 0.00 -0.09 -0.12 -1.21 0.10 0.00 0.00 175.35 174.02 2klc s GLU 37 N 0.59 1.53 -0.25 1.78 0.41 -0.84 -4.99 118.70 116.93 2klc s GLU 37 Ca -0.05 -0.42 -0.12 0.00 -0.41 0.00 0.00 54.97 53.97 2klc s GLU 37 Cb -0.07 -1.31 -0.05 0.00 -1.78 0.00 0.00 34.13 30.93 2klc s GLU 37 CO -0.02 0.09 0.22 -2.00 -0.49 0.00 0.00 175.26 173.06 2klc s GLU 38 N 0.43 4.04 0.31 1.61 2.12 -1.26 -1.37 118.70 124.58 2klc s GLU 38 Ca -0.10 -0.20 0.06 0.00 0.36 0.00 0.00 54.97 55.09 2klc s GLU 38 Cb -0.13 -3.59 -0.02 0.00 0.26 0.00 0.00 34.13 30.65 2klc s GLU 38 CO 0.03 -0.06 0.40 -0.06 -0.54 0.00 0.00 175.26 175.03 2klc s PHE 39 N 1.41 3.13 -0.17 5.30 0.08 -0.02 -4.95 117.98 122.76 2klc s PHE 39 Ca 0.09 -0.20 -0.01 0.00 0.12 0.00 0.00 56.93 56.94 2klc s PHE 39 Cb -0.15 -1.85 0.05 0.00 -0.57 0.00 0.00 43.02 40.50 2klc s PHE 39 CO 0.07 0.13 -0.02 0.00 -0.10 0.00 0.00 175.22 175.31 2klc s ALA 40 N -2.16 1.27 -0.01 5.36 0.00 -1.26 -1.25 121.76 123.72 2klc s ALA 40 Ca 0.42 -0.75 0.03 0.00 0.00 0.00 0.00 51.96 51.66 2klc s ALA 40 Cb -0.09 -1.12 -0.01 0.00 0.00 0.00 0.00 23.12 21.90 2klc s ALA 40 CO 0.30 -0.91 -0.09 0.14 0.00 0.00 0.00 175.76 175.19 2klc s VAL 41 N 1.73 0.72 -0.15 0.00 -7.23 -0.66 -4.93 120.40 109.89 2klc s VAL 41 Ca 0.00 -0.39 -0.01 0.00 -1.81 0.00 0.00 61.98 59.76 2klc s VAL 41 Cb -0.16 -0.61 0.04 0.00 0.56 0.00 0.00 36.38 36.22 2klc s VAL 41 CO -0.07 0.20 2.28 -0.81 -0.31 0.00 0.00 175.10 176.39 2klc n PRO 42 N 2.85 1.52 -0.56 4.82 -0.04 -1.26 -0.96 135.00 141.37 2klc n PRO 42 Ca -0.13 -0.86 0.00 0.00 -0.04 0.00 0.00 63.50 62.47 2klc n PRO 42 Cb 0.57 -1.43 0.00 0.00 -0.04 0.00 0.00 33.50 32.60 2klc n PRO 42 CO 0.00 0.00 0.00 -0.85 -0.04 0.00 0.00 175.50 174.61 2klc n GLU 43 N 1.18 -1.46 -0.08 0.54 0.28 -1.26 -4.72 120.64 115.12 2klc n GLU 43 Ca 0.20 0.24 -0.08 0.00 -0.16 0.00 0.00 57.16 57.36 2klc n GLU 43 Cb 0.58 -3.89 -0.16 0.00 1.43 0.00 0.00 31.44 29.41 2klc n GLU 43 CO 0.00 0.00 0.00 -1.71 -0.16 0.00 0.00 177.13 175.26 2klc n ASN 44 N 0.30 0.12 -4.60 -1.84 5.15 -1.26 -4.87 115.26 108.26 2klc n ASN 44 Ca 0.00 0.06 -0.43 0.00 -0.60 0.00 0.00 54.58 53.61 2klc n ASN 44 Cb 0.24 0.95 -0.03 0.00 -0.53 0.00 0.00 39.78 40.40 2klc n ASN 44 CO 0.00 0.00 0.00 -0.44 1.40 0.00 0.00 177.26 178.22 2klc s SER 45 N -5.48 5.84 1.04 1.20 0.01 -1.26 -5.00 113.70 110.04 2klc s SER 45 Ca -0.09 1.55 -0.12 0.00 1.31 0.00 0.00 55.95 58.60 2klc s SER 45 Cb 0.07 -2.52 0.21 0.00 0.21 0.00 0.00 66.02 63.99 2klc s SER 45 CO 0.84 -1.71 1.07 -0.94 0.41 0.00 0.00 173.24 172.91 2klc s SER 46 N 6.47 2.19 0.48 2.44 1.04 -1.26 -4.49 113.70 120.56 2klc s SER 46 Ca 0.85 1.38 0.15 0.00 0.48 0.00 0.00 55.95 58.82 2klc s SER 46 Cb -0.26 -2.08 1.12 0.00 0.10 0.00 0.00 66.02 64.89 2klc s SER 46 CO 0.34 -3.43 2.06 0.58 0.98 0.00 0.00 173.24 173.76 2klc h VAL 47 N -2.10 1.07 -0.76 5.02 2.07 -1.68 0.10 116.25 119.98 2klc h VAL 47 Ca -0.56 -0.38 0.02 0.00 0.82 0.00 0.00 66.70 66.60 2klc h VAL 47 Cb 1.32 1.21 -0.04 0.00 -1.52 0.00 0.00 31.29 32.26 2klc h VAL 47 CO 0.54 0.11 0.50 -0.61 0.02 0.00 0.00 177.57 178.13 2klc h GLN 48 N 0.00 0.97 0.00 1.57 5.75 -1.76 -1.39 115.11 120.26 2klc h GLN 48 Ca -0.00 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.44 2klc h GLN 48 Cb 0.20 -0.22 0.00 0.00 1.07 0.00 0.00 27.48 28.53 2klc h GLN 48 CO 0.01 0.64 -0.86 1.96 -2.65 0.00 0.00 178.83 177.94 2klc h GLN 49 N 1.00 0.00 0.12 1.69 4.20 -1.59 -3.40 115.11 117.12 2klc h GLN 49 Ca 0.29 0.00 -0.34 0.00 0.06 0.00 0.00 58.65 58.65 2klc h GLN 49 Cb -0.07 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.70 2klc h GLN 49 CO -0.07 0.00 -1.85 0.35 -0.67 0.00 0.00 178.83 176.60 2klc h PHE 50 N 0.00 0.45 0.00 2.96 3.57 -0.44 -3.35 116.94 120.14 2klc h PHE 50 Ca 0.00 -0.33 0.00 0.00 3.53 0.00 0.00 57.97 61.17 2klc h PHE 50 Cb 0.87 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.59 2klc h PHE 50 CO 0.00 1.73 0.00 1.57 -2.23 0.00 0.00 178.31 179.38 2klc h LYS 51 N -0.08 0.00 -0.57 1.11 -0.00 -1.48 -1.13 116.57 114.43 2klc h LYS 51 Ca -0.40 0.00 -0.11 0.00 -0.00 0.00 0.00 60.65 60.15 2klc h LYS 51 Cb 1.94 0.00 -0.02 0.00 -0.00 0.00 0.00 32.23 34.15 2klc h LYS 51 CO 0.06 0.00 -0.06 0.93 -0.00 0.00 0.00 179.45 180.39 2klc h GLU 52 N 0.00 1.04 -0.05 0.07 4.39 -1.77 -1.34 114.58 116.91 2klc h GLU 52 Ca 0.00 -0.36 -0.15 0.00 0.34 0.00 0.00 59.36 59.19 2klc h GLU 52 Cb 0.39 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.95 2klc h GLU 52 CO 0.00 1.05 -0.65 0.93 -1.16 0.00 0.00 179.01 179.19 2klc h GLU 53 N 0.92 0.19 -0.53 2.33 4.39 -1.37 -3.16 114.58 117.36 2klc h GLU 53 Ca 0.15 -0.14 -0.03 0.00 0.34 0.00 0.00 59.36 59.68 2klc h GLU 53 Cb 0.62 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.27 2klc h GLU 53 CO 0.04 0.77 0.20 0.82 -1.16 0.00 0.00 179.01 179.68 2klc h ILE 54 N 0.14 1.22 0.00 3.13 2.04 -1.31 -3.27 117.51 119.46 2klc h ILE 54 Ca -0.01 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.13 2klc h ILE 54 Cb 1.17 0.68 -0.00 0.00 -0.74 0.00 0.00 36.82 37.93 2klc h ILE 54 CO 0.10 0.27 -0.06 0.77 0.00 0.00 0.00 178.15 179.23 2klc h SER 55 N 0.72 0.00 0.68 1.72 4.64 -1.20 -1.09 113.55 119.03 2klc h SER 55 Ca 0.18 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.25 2klc h SER 55 Cb 0.22 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.27 2klc h SER 55 CO -0.01 0.06 -1.45 0.07 -0.87 0.00 0.00 176.83 174.62 2klc h LYS 56 N 0.00 0.00 0.00 4.77 2.10 -1.65 -2.45 116.57 119.34 2klc h LYS 56 Ca -0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.64 2klc h LYS 56 Cb 0.30 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 31.62 2klc h LYS 56 CO 0.01 0.56 -0.04 0.00 -2.00 0.00 0.00 179.45 177.98 2klc h ARG 57 N 0.00 0.00 -0.08 0.07 2.47 -1.41 -3.33 114.38 112.11 2klc h ARG 57 Ca -0.19 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.53 2klc h ARG 57 Cb 1.86 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 30.18 2klc h ARG 57 CO 0.08 0.74 0.00 1.19 0.56 0.00 0.00 179.97 182.54 2klc n PHE 58 N -4.65 0.09 -1.46 3.04 3.72 -0.49 -4.93 117.46 112.78 2klc n PHE 58 Ca -0.08 -0.04 -0.16 0.00 -0.05 0.00 0.00 57.45 57.12 2klc n PHE 58 Cb 0.36 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.83 2klc n PHE 58 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2klc n LYS 59 N 0.08 -1.35 -4.20 -1.08 4.76 -0.94 -4.69 118.16 110.74 2klc n LYS 59 Ca 0.18 0.94 -0.33 0.00 -2.87 0.00 0.00 58.31 56.23 2klc n LYS 59 Cb 0.31 -5.23 -0.08 0.00 -1.84 0.00 0.00 35.03 28.18 2klc n LYS 59 CO 0.00 0.00 0.00 -1.12 -1.37 0.00 0.00 177.40 174.91 2klc s SER 60 N -2.35 5.34 0.30 4.39 0.01 -1.12 -4.98 113.70 115.30 2klc s SER 60 Ca 0.00 0.04 -0.29 0.00 1.31 0.00 0.00 55.95 57.01 2klc s SER 60 Cb 0.00 -1.45 -0.10 0.00 0.21 0.00 0.00 66.02 64.68 2klc s SER 60 CO 0.00 0.27 1.36 -2.28 0.41 0.00 0.00 173.24 173.00 2klc s HIS 61 N -1.14 3.02 0.22 2.43 2.46 -1.26 -4.38 115.29 116.64 2klc s HIS 61 Ca 0.21 1.26 -0.08 0.00 0.47 0.00 0.00 55.06 56.92 2klc s HIS 61 Cb -0.12 -3.74 0.24 0.00 -0.13 0.00 0.00 32.58 28.83 2klc s HIS 61 CO 0.12 -2.19 1.86 1.79 -2.47 0.00 0.00 174.74 173.85 2klc h THR 62 N 3.24 1.10 -0.14 0.89 1.35 -1.90 -0.93 112.91 116.51 2klc h THR 62 Ca -0.48 -0.33 0.04 0.00 -0.55 0.00 0.00 66.41 65.09 2klc h THR 62 Cb 1.22 0.06 -0.01 0.00 -1.73 0.00 0.00 68.15 67.70 2klc h THR 62 CO 0.70 0.17 0.10 -0.78 -0.25 0.00 0.00 175.52 175.47 2klc h ASP 63 N 0.96 0.02 0.05 5.36 3.58 -1.97 -2.24 116.42 122.18 2klc h ASP 63 Ca 0.32 -0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.77 2klc h ASP 63 Cb 0.04 -0.01 0.00 0.00 1.72 0.00 0.00 39.33 41.08 2klc h ASP 63 CO -0.12 0.02 -0.04 0.00 -2.88 0.00 0.00 179.24 176.22 2klc n GLN 64 N -4.50 1.35 -4.45 0.28 6.02 -0.36 -4.81 117.38 110.90 2klc n GLN 64 Ca 0.00 -0.64 -0.22 0.00 -0.01 0.00 0.00 57.00 56.13 2klc n GLN 64 Cb 0.21 -1.49 -0.16 0.00 1.02 0.00 0.00 30.24 29.82 2klc n GLN 64 CO 0.00 0.00 0.00 -0.48 -1.01 0.00 0.00 177.06 175.57 2klc s LEU 65 N -2.10 1.66 -0.04 1.08 0.05 -0.84 -0.54 118.68 117.94 2klc s LEU 65 Ca 0.38 -0.23 0.01 0.00 0.05 0.00 0.00 54.13 54.35 2klc s LEU 65 Cb 0.21 -0.66 0.02 0.00 -2.05 0.00 0.00 46.19 43.70 2klc s LEU 65 CO 0.37 0.04 -0.06 0.68 -0.55 0.00 0.00 176.35 176.83 2klc s VAL 66 N 0.49 0.63 0.48 1.48 -7.23 -0.94 -4.90 120.40 110.41 2klc s VAL 66 Ca -0.09 -0.21 -0.14 0.00 -1.81 0.00 0.00 61.98 59.73 2klc s VAL 66 Cb -0.13 -0.61 -0.07 0.00 0.56 0.00 0.00 36.38 36.13 2klc s VAL 66 CO 0.02 0.23 0.91 -0.76 -0.31 0.00 0.00 175.10 175.19 2klc s LEU 67 N 0.67 3.69 -0.04 1.32 1.02 -1.23 -1.20 118.68 122.91 2klc s LEU 67 Ca -0.10 1.42 0.02 0.00 0.02 0.00 0.00 54.13 55.49 2klc s LEU 67 Cb -0.13 -4.34 0.01 0.00 0.02 0.00 0.00 46.19 41.75 2klc s LEU 67 CO 0.01 -0.53 -0.09 -0.63 0.02 0.00 0.00 176.35 175.13 2klc s ILE 68 N -2.55 0.81 -0.14 -0.59 1.09 0.36 0.14 121.20 120.33 2klc s ILE 68 Ca 0.56 -0.34 -0.30 0.00 -1.10 0.00 0.00 60.65 59.47 2klc s ILE 68 Cb -0.10 -0.74 0.12 0.00 -1.06 0.00 0.00 42.46 40.68 2klc s ILE 68 CO 0.32 0.26 0.94 0.12 -0.10 0.00 0.00 174.94 176.48 2klc s PHE 69 N 0.42 -0.41 -1.25 3.97 2.19 -0.60 -2.73 117.98 119.57 2klc s PHE 69 Ca -0.07 0.69 0.00 0.00 0.33 0.00 0.00 56.93 57.88 2klc s PHE 69 Cb -0.11 0.45 0.00 0.00 -1.31 0.00 0.00 43.02 42.05 2klc s PHE 69 CO 0.01 -0.39 0.00 0.00 1.83 0.00 0.00 175.22 176.67 2klc n ALA 70 N 0.71 -0.18 -0.45 11.12 0.00 -1.26 -2.61 120.51 127.84 2klc n ALA 70 Ca -0.11 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.52 2klc n ALA 70 Cb 0.58 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.54 2klc n ALA 70 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2klc n GLY 71 N -0.97 0.77 3.24 0.00 0.00 -1.26 -5.07 105.19 101.90 2klc n GLY 71 Ca -0.12 -0.05 -0.09 0.00 0.00 0.00 0.00 46.02 45.76 2klc n GLY 71 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2klc s LYS 72 N -0.59 0.91 -0.21 1.61 0.00 -1.07 -5.13 119.74 115.25 2klc s LYS 72 Ca 0.00 -0.86 -0.29 0.00 0.00 0.00 0.00 55.97 54.82 2klc s LYS 72 Cb 0.00 0.38 -0.03 0.00 0.00 0.00 0.00 37.83 38.18 2klc s LYS 72 CO 0.00 -0.31 1.62 0.96 0.00 0.00 0.00 175.35 177.62 2klc s ILE 73 N -3.78 3.68 0.01 3.79 -0.00 -1.26 -1.56 121.20 122.08 2klc s ILE 73 Ca 0.04 0.77 -0.30 0.00 -0.00 0.00 0.00 60.65 61.15 2klc s ILE 73 Cb 0.04 -3.69 -0.05 0.00 -0.00 0.00 0.00 42.46 38.76 2klc s ILE 73 CO -0.11 -0.28 1.33 -0.76 -0.00 0.00 0.00 174.94 175.12 2klc s LEU 74 N 5.19 4.32 0.00 0.37 1.43 0.12 -4.96 118.68 125.16 2klc s LEU 74 Ca 0.72 2.06 0.00 0.00 -1.03 0.00 0.00 54.13 55.88 2klc s LEU 74 Cb -0.25 -3.56 -0.00 0.00 0.03 0.00 0.00 46.19 42.40 2klc s LEU 74 CO 0.29 -0.65 0.02 0.29 0.23 0.00 0.00 176.35 176.52 2klc n LYS 75 N 5.02 1.09 0.23 1.70 4.76 -1.26 -3.52 118.16 126.17 2klc n LYS 75 Ca 0.12 -0.49 0.10 0.00 -2.87 0.00 0.00 58.31 55.17 2klc n LYS 75 Cb 0.44 0.24 0.66 0.00 -1.84 0.00 0.00 35.03 34.53 2klc n LYS 75 CO 0.00 0.00 0.00 0.38 -1.37 0.00 0.00 177.40 176.41 2klc h ASP 76 N 0.21 0.00 1.15 4.39 2.03 -1.96 -1.43 116.42 120.82 2klc h ASP 76 Ca -0.05 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.25 2klc h ASP 76 Cb 0.17 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.67 2klc h ASP 76 CO 0.08 0.00 0.00 0.00 -1.03 0.00 0.00 179.24 178.29 2klc n GLN 77 N -4.47 0.20 -4.07 4.15 10.64 -1.26 -4.43 117.38 118.14 2klc n GLN 77 Ca -0.01 0.25 -0.26 0.00 -1.83 0.00 0.00 57.00 55.15 2klc n GLN 77 Cb 0.16 -1.77 -0.05 0.00 -0.86 0.00 0.00 30.24 27.72 2klc n GLN 77 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2klc s ASP 78 N -4.18 5.57 0.02 2.61 1.01 -0.54 -5.08 116.67 116.09 2klc s ASP 78 Ca 0.09 -0.10 0.08 0.00 0.71 0.00 0.00 52.55 53.33 2klc s ASP 78 Cb 0.12 -1.47 -0.03 0.00 1.01 0.00 0.00 42.92 42.55 2klc s ASP 78 CO 0.51 0.07 -0.24 0.42 0.21 0.00 0.00 175.17 176.14 2klc s THR 79 N -1.73 2.28 0.17 -1.27 -4.23 -1.26 -2.33 115.64 107.27 2klc s THR 79 Ca 0.31 -1.26 -0.12 0.00 -1.18 0.00 0.00 61.69 59.44 2klc s THR 79 Cb -0.10 -1.88 0.07 0.00 1.34 0.00 0.00 72.50 71.93 2klc s THR 79 CO 0.24 0.42 1.74 0.17 -0.54 0.00 0.00 174.62 176.65 2klc h LEU 80 N 4.94 0.78 -1.08 4.79 8.10 -1.89 -2.93 115.31 128.02 2klc h LEU 80 Ca -0.46 -0.15 -0.09 0.00 0.11 0.00 0.00 57.88 57.29 2klc h LEU 80 Cb 1.14 -0.20 -0.01 0.00 -0.44 0.00 0.00 40.66 41.15 2klc h LEU 80 CO 0.45 0.72 -0.32 -1.28 -4.11 0.00 0.00 178.44 173.90 2klc h SER 81 N 0.80 0.24 0.91 0.17 0.87 -1.89 -2.14 113.55 112.50 2klc h SER 81 Ca 0.20 -0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 60.66 2klc h SER 81 Cb 0.16 -0.07 -0.00 0.00 -0.44 0.00 0.00 62.40 62.05 2klc h SER 81 CO -0.02 0.56 -0.07 -0.61 -0.53 0.00 0.00 176.83 176.16 2klc h GLN 82 N 0.21 0.00 -0.56 2.24 5.75 -1.83 -1.78 115.11 119.15 2klc h GLN 82 Ca 0.03 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.53 2klc h GLN 82 Cb 0.68 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.23 2klc h GLN 82 CO 0.05 0.07 0.00 0.72 -2.65 0.00 0.00 178.83 177.02 2klc n HIS 83 N -3.21 0.78 -0.28 3.99 8.25 -0.84 -4.93 115.22 118.98 2klc n HIS 83 Ca 0.00 -0.37 0.00 0.00 -0.26 0.00 0.00 57.72 57.09 2klc n HIS 83 Cb 0.32 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.41 2klc n HIS 83 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2klc n GLY 84 N 1.32 0.80 3.65 -1.41 0.00 -0.67 -4.57 105.19 104.30 2klc n GLY 84 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 2klc n GLY 84 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2klc s ILE 85 N -2.16 4.75 0.36 -0.61 1.01 -1.00 -5.00 121.20 118.55 2klc s ILE 85 Ca 0.00 1.78 0.05 0.00 0.00 0.00 0.00 60.65 62.48 2klc s ILE 85 Cb 0.00 -4.22 -0.03 0.00 0.01 0.00 0.00 42.46 38.22 2klc s ILE 85 CO 0.00 -0.15 0.18 -1.00 0.00 0.00 0.00 174.94 173.97 2klc s HIS 86 N 3.05 1.73 0.10 3.97 3.76 -1.26 -3.86 115.29 122.77 2klc s HIS 86 Ca 0.40 -1.41 -0.31 0.00 -0.15 0.00 0.00 55.06 53.59 2klc s HIS 86 Cb -0.15 -0.96 -0.10 0.00 1.11 0.00 0.00 32.58 32.48 2klc s HIS 86 CO 0.07 -0.51 1.82 0.16 -0.85 0.00 0.00 174.74 175.43 2klc s ASP 87 N -3.48 6.46 0.00 1.40 -4.77 -1.26 -1.98 116.67 113.03 2klc s ASP 87 Ca 0.31 2.69 0.00 0.00 -3.30 0.00 0.00 52.55 52.26 2klc s ASP 87 Cb 0.03 -2.56 0.00 0.00 -1.09 0.00 0.00 42.92 39.30 2klc s ASP 87 CO 0.19 -1.00 0.00 0.61 0.70 0.00 0.00 175.17 175.67 2klc n GLY 88 N 4.25 2.40 3.95 2.12 0.00 -1.00 -4.89 105.19 112.02 2klc n GLY 88 Ca 0.18 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 2klc n GLY 88 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2klc s LEU 89 N 0.00 3.17 0.01 0.99 1.43 -0.84 -4.98 118.68 118.46 2klc s LEU 89 Ca 0.00 0.25 0.03 0.00 -1.03 0.00 0.00 54.13 53.37 2klc s LEU 89 Cb 0.00 -3.05 -0.01 0.00 0.03 0.00 0.00 46.19 43.16 2klc s LEU 89 CO 0.00 -1.22 -0.08 -0.89 0.23 0.00 0.00 176.35 174.39 2klc s THR 90 N -2.91 0.63 0.12 5.49 2.01 -1.26 -2.59 115.64 117.13 2klc s THR 90 Ca 0.57 -0.52 0.04 0.00 0.31 0.00 0.00 61.69 62.09 2klc s THR 90 Cb -0.10 -0.56 -0.04 0.00 0.01 0.00 0.00 72.50 71.80 2klc s THR 90 CO 0.41 0.05 0.08 -0.69 -0.69 0.00 0.00 174.62 173.78 2klc s VAL 91 N -0.45 4.39 -0.41 3.82 1.01 -0.18 -4.98 120.40 123.59 2klc s VAL 91 Ca 0.01 -0.95 -0.12 0.00 0.00 0.00 0.00 61.98 60.91 2klc s VAL 91 Cb -0.05 -3.16 0.05 0.00 0.00 0.00 0.00 36.38 33.22 2klc s VAL 91 CO 0.00 0.03 0.28 -1.00 0.00 0.00 0.00 175.10 174.40 2klc s HIS 92 N -1.53 3.27 -0.11 5.22 3.76 -1.10 -1.54 115.29 123.25 2klc s HIS 92 Ca 0.29 -1.04 -0.16 0.00 -0.15 0.00 0.00 55.06 54.01 2klc s HIS 92 Cb -0.11 -2.75 -0.05 0.00 1.11 0.00 0.00 32.58 30.79 2klc s HIS 92 CO 0.22 -0.72 0.39 -1.17 -0.85 0.00 0.00 174.74 172.61 2klc s LEU 93 N 1.56 4.30 -0.32 0.89 2.96 -0.70 -0.49 118.68 126.88 2klc s LEU 93 Ca 0.03 0.72 -0.05 0.00 -0.22 0.00 0.00 54.13 54.60 2klc s LEU 93 Cb -0.21 -2.54 0.04 0.00 0.50 0.00 0.00 46.19 43.97 2klc s LEU 93 CO 0.06 0.10 0.08 -0.69 -1.32 0.00 0.00 176.35 174.58 2klc s VAL 94 N 0.25 3.62 -0.08 1.68 1.01 -0.34 -4.25 120.40 122.29 2klc s VAL 94 Ca 0.22 -1.12 -0.08 0.00 0.00 0.00 0.00 61.98 60.99 2klc s VAL 94 Cb -0.14 -3.02 -0.04 0.00 0.00 0.00 0.00 36.38 33.17 2klc s VAL 94 CO 0.08 -0.12 0.21 -0.63 0.00 0.00 0.00 175.10 174.64 2klc s ILE 95 N 1.38 5.39 -0.39 2.22 1.01 -1.26 -2.21 121.20 127.35 2klc s ILE 95 Ca -0.02 0.32 0.08 0.00 0.00 0.00 0.00 60.65 61.04 2klc s ILE 95 Cb -0.19 -3.48 0.60 0.00 0.01 0.00 0.00 42.46 39.40 2klc s ILE 95 CO 0.02 0.58 1.57 0.29 0.00 0.00 0.00 174.94 177.40 2klc n LYS 96 N 1.84 3.32 -3.34 2.79 4.01 0.30 -4.68 118.16 122.40 2klc n LYS 96 Ca -0.18 -2.44 -0.13 0.00 -0.51 0.00 0.00 58.31 55.05 2klc n LYS 96 Cb 0.54 -2.04 -0.07 0.00 -0.51 0.00 0.00 35.03 32.95 2klc n LYS 96 CO 0.00 0.00 0.00 -0.08 -1.11 0.00 0.00 177.40 176.21 2klc s THR 97 N -2.47 -0.51 0.27 -0.18 -1.32 -1.26 -5.02 115.64 105.15 2klc s THR 97 Ca 0.44 -0.53 0.04 0.00 -1.21 0.00 0.00 61.69 60.43 2klc s THR 97 Cb 0.35 -0.85 0.02 0.00 -1.51 0.00 0.00 72.50 70.51 2klc s THR 97 CO 0.11 -0.40 1.65 0.06 -2.21 0.00 0.00 174.62 173.83 2klc h GLN 98 N 7.82 0.33 0.00 7.08 3.07 -2.00 -3.15 115.11 128.25 2klc h GLN 98 Ca -0.05 -0.17 0.00 0.00 0.09 0.00 0.00 58.65 58.52 2klc h GLN 98 Cb 1.09 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.66 2klc h GLN 98 CO 0.26 0.70 0.00 0.27 0.09 0.00 0.00 178.83 180.15 2klc n ASN 99 N -4.01 0.00 -4.22 0.06 0.23 -1.26 -4.46 115.26 101.60 2klc n ASN 99 Ca -0.02 -0.84 -0.42 0.00 -0.53 0.00 0.00 54.58 52.78 2klc n ASN 99 Cb 0.51 -0.03 -0.07 0.00 -2.08 0.00 0.00 39.78 38.11 2klc n ASN 99 CO 0.00 0.00 0.00 -0.60 -0.93 0.00 0.00 177.26 175.73 2klc s ARG 100 N -2.05 2.90 0.00 -3.83 6.06 -1.19 -5.23 118.95 115.60 2klc s ARG 100 Ca 0.42 -2.22 0.28 0.00 -2.50 0.00 0.00 55.73 51.71 2klc s ARG 100 Cb 0.20 -4.05 1.04 0.00 0.06 0.00 0.00 34.95 32.20 2klc s ARG 100 CO 0.35 -1.23 1.74 -0.35 -2.50 0.00 0.00 175.30 173.31