#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 3.60 0.35 0.54 2.20 -1.26 -5.07 119.74 120.11 2klc s LYS 24 Ca 0.00 1.19 -0.21 0.00 -0.36 0.00 0.00 55.97 56.59 2klc s LYS 24 Cb 0.00 -2.07 -0.10 0.00 -1.51 0.00 0.00 37.83 34.15 2klc s LYS 24 CO 0.00 -0.57 0.87 -1.50 -0.36 0.00 0.00 175.35 173.79 2klc s ILE 25 N -2.35 4.43 -0.29 5.43 2.07 -1.26 -5.00 121.20 124.23 2klc s ILE 25 Ca 0.64 1.43 -0.27 0.00 -1.41 0.00 0.00 60.65 61.04 2klc s ILE 25 Cb -0.15 -3.74 0.01 0.00 0.13 0.00 0.00 42.46 38.71 2klc s ILE 25 CO 0.30 -0.11 0.97 -0.32 -1.91 0.00 0.00 174.94 173.88 2klc s MET 26 N -2.70 4.10 -0.54 3.50 -2.45 -0.00 -4.83 119.30 116.38 2klc s MET 26 Ca 0.55 1.01 -0.20 0.00 -1.25 0.00 0.00 55.69 55.80 2klc s MET 26 Cb -0.13 -3.70 0.06 0.00 1.25 0.00 0.00 34.83 32.32 2klc s MET 26 CO 0.18 -0.74 0.74 0.15 1.05 0.00 0.00 175.02 176.40 2klc s LYS 27 N 3.28 3.15 -0.32 4.11 -0.14 -1.26 -1.76 119.74 126.80 2klc s LYS 27 Ca 0.41 -0.82 -0.13 0.00 -1.36 0.00 0.00 55.97 54.07 2klc s LYS 27 Cb -0.14 -4.13 -0.03 0.00 -1.68 0.00 0.00 37.83 31.86 2klc s LYS 27 CO 0.11 -1.38 0.27 0.08 -0.76 0.00 0.00 175.35 173.67 2klc s VAL 28 N 3.06 5.25 0.04 3.17 1.01 -0.46 -2.48 120.40 129.99 2klc s VAL 28 Ca 0.18 0.05 -0.26 0.00 0.00 0.00 0.00 61.98 61.95 2klc s VAL 28 Cb -0.18 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.46 2klc s VAL 28 CO 0.12 0.06 0.79 -0.89 0.00 0.00 0.00 175.10 175.19 2klc s THR 29 N 1.84 4.74 -0.22 3.92 2.01 -0.87 -1.20 115.64 125.87 2klc s THR 29 Ca 0.09 1.69 -0.02 0.00 0.31 0.00 0.00 61.69 63.75 2klc s THR 29 Cb -0.17 -4.14 0.01 0.00 0.01 0.00 0.00 72.50 68.21 2klc s THR 29 CO 0.11 0.34 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.60 2klc s VAL 30 N 0.09 2.93 -0.32 3.82 1.01 0.11 -1.26 120.40 126.79 2klc s VAL 30 Ca 0.40 -0.72 -0.15 0.00 0.00 0.00 0.00 61.98 61.52 2klc s VAL 30 Cb -0.21 -2.35 -0.02 0.00 0.00 0.00 0.00 36.38 33.81 2klc s VAL 30 CO 0.24 0.41 0.34 -0.75 0.00 0.00 0.00 175.10 175.33 2klc s LYS 31 N 1.40 3.67 0.35 2.72 2.36 -0.40 -1.56 119.74 128.28 2klc s LYS 31 Ca 0.04 -0.35 0.09 0.00 -2.55 0.00 0.00 55.97 53.21 2klc s LYS 31 Cb -0.14 -3.77 -0.06 0.00 -1.05 0.00 0.00 37.83 32.81 2klc s LYS 31 CO -0.06 -0.45 -0.03 0.95 1.55 0.00 0.00 175.35 177.32 2klc s THR 32 N 1.98 2.42 0.64 3.43 -4.23 -0.55 -1.06 115.64 118.28 2klc s THR 32 Ca 0.11 -2.06 0.38 0.00 -1.18 0.00 0.00 61.69 58.94 2klc s THR 32 Cb -0.16 -2.75 0.41 0.00 1.34 0.00 0.00 72.50 71.33 2klc s THR 32 CO 0.11 -0.18 2.30 1.55 -0.54 0.00 0.00 174.62 177.86 2klc h PRO 33 N 1.88 0.00 0.00 3.99 0.13 -1.95 -3.21 132.00 132.84 2klc h PRO 33 Ca -0.43 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.59 2klc h PRO 33 Cb 1.25 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.36 2klc h PRO 33 CO 0.69 0.00 -0.70 0.87 -0.23 0.00 0.00 178.00 178.63 2klc h LYS 34 N 0.00 0.00 0.00 0.86 1.57 -1.95 -3.51 116.57 113.54 2klc h LYS 34 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2klc h LYS 34 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 2klc h LYS 34 CO -0.00 0.81 0.00 -0.85 -0.57 0.00 0.00 179.45 178.84 2klc n GLU 35 N -4.53 0.00 -4.17 3.15 0.28 -1.22 -5.17 120.64 108.98 2klc n GLU 35 Ca -0.20 0.00 -0.24 0.00 -0.16 0.00 0.00 57.16 56.56 2klc n GLU 35 Cb 0.52 0.00 -0.17 0.00 1.43 0.00 0.00 31.44 33.22 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 -0.40 1.24 0.39 3.44 -2.85 -1.26 -1.48 119.74 118.82 2klc s LYS 36 Ca 0.00 -0.21 0.06 0.00 -1.00 0.00 0.00 55.97 54.82 2klc s LYS 36 Cb 0.00 -1.22 -0.07 0.00 -2.06 0.00 0.00 37.83 34.48 2klc s LYS 36 CO 0.00 -0.13 0.03 -2.00 0.10 0.00 0.00 175.35 173.35 2klc s GLU 37 N 1.18 1.87 -0.14 1.78 2.56 -0.60 -4.99 118.70 120.37 2klc s GLU 37 Ca -0.06 -2.06 -0.05 0.00 0.00 0.00 0.00 54.97 52.80 2klc s GLU 37 Cb -0.14 -1.40 0.07 0.00 2.00 0.00 0.00 34.13 34.66 2klc s GLU 37 CO -0.02 -0.10 0.29 -2.00 -0.56 0.00 0.00 175.26 172.87 2klc s GLU 38 N -3.77 0.19 0.24 4.30 2.12 -1.26 -0.71 118.70 119.82 2klc s GLU 38 Ca 0.35 0.77 0.06 0.00 0.36 0.00 0.00 54.97 56.51 2klc s GLU 38 Cb 0.09 0.01 -0.03 0.00 0.26 0.00 0.00 34.13 34.46 2klc s GLU 38 CO 0.17 -0.26 0.23 -0.06 -0.54 0.00 0.00 175.26 174.80 2klc s PHE 39 N 2.25 3.19 -0.26 5.30 0.08 -0.34 -4.92 117.98 123.29 2klc s PHE 39 Ca -0.01 -0.08 -0.05 0.00 0.12 0.00 0.00 56.93 56.91 2klc s PHE 39 Cb -0.12 -1.45 0.01 0.00 -0.57 0.00 0.00 43.02 40.89 2klc s PHE 39 CO -0.09 0.50 0.01 0.00 -0.10 0.00 0.00 175.22 175.54 2klc s ALA 40 N -2.07 2.90 0.02 5.36 0.00 -1.26 -1.35 121.76 125.36 2klc s ALA 40 Ca 0.33 -1.34 0.01 0.00 0.00 0.00 0.00 51.96 50.96 2klc s ALA 40 Cb -0.08 -1.89 -0.02 0.00 0.00 0.00 0.00 23.12 21.13 2klc s ALA 40 CO 0.26 -0.71 -0.05 0.14 0.00 0.00 0.00 175.76 175.40 2klc s VAL 41 N 1.46 0.31 -0.10 0.00 -7.23 -0.73 -4.95 120.40 109.16 2klc s VAL 41 Ca 0.03 -0.70 -0.00 0.00 -1.81 0.00 0.00 61.98 59.51 2klc s VAL 41 Cb -0.16 -0.36 0.08 0.00 0.56 0.00 0.00 36.38 36.50 2klc s VAL 41 CO -0.01 -0.26 1.73 -0.81 -0.31 0.00 0.00 175.10 175.44 2klc n PRO 42 N 2.04 1.25 -0.54 4.82 -0.04 -1.26 -0.82 135.00 140.45 2klc n PRO 42 Ca -0.20 -0.52 -0.01 0.00 -0.04 0.00 0.00 63.50 62.73 2klc n PRO 42 Cb 0.56 -1.20 -0.01 0.00 -0.04 0.00 0.00 33.50 32.81 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 0.83 -1.85 -0.06 0.54 0.28 -1.26 -4.72 120.64 114.39 2klc n GLU 43 Ca 0.10 0.24 -0.06 0.00 -0.16 0.00 0.00 57.16 57.29 2klc n GLU 43 Cb 0.58 -3.67 -0.15 0.00 1.43 0.00 0.00 31.44 29.63 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 1.21 0.28 -4.57 -1.84 5.15 -1.26 -4.74 115.26 109.50 2klc n ASN 44 Ca -0.01 0.13 -0.39 0.00 -0.60 0.00 0.00 54.58 53.71 2klc n ASN 44 Cb 0.21 0.81 -0.03 0.00 -0.53 0.00 0.00 39.78 40.23 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 -5.52 4.95 1.01 1.20 0.01 -1.26 -4.97 113.70 109.11 2klc s SER 45 Ca -0.08 1.12 -0.17 0.00 1.31 0.00 0.00 55.95 58.13 2klc s SER 45 Cb 0.08 -2.51 0.22 0.00 0.21 0.00 0.00 66.02 64.01 2klc s SER 45 CO 0.84 -2.48 1.28 -0.44 0.41 0.00 0.00 173.24 172.84 2klc s SER 46 N 9.99 2.66 0.20 2.44 0.01 -1.26 -4.56 113.70 123.18 2klc s SER 46 Ca 0.90 0.35 -0.10 0.00 1.31 0.00 0.00 55.95 58.42 2klc s SER 46 Cb -0.20 -0.44 0.21 0.00 0.21 0.00 0.00 66.02 65.80 2klc s SER 46 CO 0.28 -3.02 1.82 0.58 0.41 0.00 0.00 173.24 173.30 2klc h VAL 47 N -1.84 1.01 -0.14 3.43 2.07 -1.80 0.93 116.25 119.90 2klc h VAL 47 Ca -0.45 -0.25 0.04 0.00 0.82 0.00 0.00 66.70 66.87 2klc h VAL 47 Cb 1.25 0.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.24 2klc h VAL 47 CO 0.38 0.13 0.12 0.06 0.02 0.00 0.00 177.57 178.28 2klc h GLN 48 N 0.72 0.00 0.02 1.57 -0.00 -1.81 -1.52 115.11 114.09 2klc h GLN 48 Ca 0.28 0.00 -0.32 0.00 -0.00 0.00 0.00 58.65 58.61 2klc h GLN 48 Cb 0.12 0.00 -0.05 0.00 -0.00 0.00 0.00 27.48 27.55 2klc h GLN 48 CO -0.15 0.00 -1.88 1.04 -0.00 0.00 0.00 178.83 177.84 2klc n GLN 49 N -4.20 0.66 0.09 0.06 6.02 -0.54 -4.49 117.38 114.98 2klc n GLN 49 Ca 0.00 0.25 -0.22 0.00 -0.01 0.00 0.00 57.00 57.02 2klc n GLN 49 Cb 0.24 -1.73 -0.14 0.00 1.02 0.00 0.00 30.24 29.63 2klc n GLN 49 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.06 176.40 2klc h PHE 50 N 0.01 0.81 0.00 1.08 3.57 -0.36 -3.24 116.94 118.81 2klc h PHE 50 Ca -0.36 -0.55 0.00 0.00 3.53 0.00 0.00 57.97 60.59 2klc h PHE 50 Cb 2.05 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 40.74 2klc h PHE 50 CO 0.01 1.41 0.00 1.57 -2.23 0.00 0.00 178.31 179.08 2klc h LYS 51 N -0.03 0.00 -0.46 1.11 -0.00 -1.54 -1.60 116.57 114.06 2klc h LYS 51 Ca -0.18 0.00 -0.13 0.00 -0.00 0.00 0.00 60.65 60.34 2klc h LYS 51 Cb 1.84 0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 34.06 2klc h LYS 51 CO 0.21 0.00 -0.23 0.93 -0.00 0.00 0.00 179.45 180.36 2klc h GLU 52 N 0.00 0.96 -0.28 0.07 5.08 -1.78 -0.67 114.58 117.96 2klc h GLU 52 Ca 0.00 -0.43 -0.10 0.00 -1.00 0.00 0.00 59.36 57.83 2klc h GLU 52 Cb 0.40 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.62 2klc h GLU 52 CO 0.00 1.09 -0.27 0.93 -1.00 0.00 0.00 179.01 179.77 2klc h GLU 53 N 0.80 0.55 0.09 2.33 4.39 -1.40 -2.81 114.58 118.53 2klc h GLU 53 Ca 0.10 -0.22 -0.00 0.00 0.34 0.00 0.00 59.36 59.58 2klc h GLU 53 Cb 0.81 -0.03 0.00 0.00 -0.10 0.00 0.00 28.75 29.44 2klc h GLU 53 CO 0.07 0.76 -0.04 0.82 -1.16 0.00 0.00 179.01 179.46 2klc h ILE 54 N 0.48 1.05 -0.40 3.13 2.04 -1.42 -3.19 117.51 119.20 2klc h ILE 54 Ca 0.07 -0.49 0.01 0.00 1.00 0.00 0.00 64.86 65.45 2klc h ILE 54 Cb 0.71 1.36 -0.02 0.00 -0.74 0.00 0.00 36.82 38.13 2klc h ILE 54 CO 0.05 0.12 0.26 0.77 0.00 0.00 0.00 178.15 179.35 2klc h SER 55 N -0.34 0.44 0.08 1.72 4.64 -0.96 -0.25 113.55 118.89 2klc h SER 55 Ca -0.01 -0.01 -0.08 0.00 -0.47 0.00 0.00 61.79 61.22 2klc h SER 55 Cb 0.29 -0.11 -0.01 0.00 -0.31 0.00 0.00 62.40 62.26 2klc h SER 55 CO 0.02 0.32 -0.24 0.07 -0.87 0.00 0.00 176.83 176.13 2klc h LYS 56 N 0.53 0.28 0.11 4.77 2.10 -1.63 0.11 116.57 122.84 2klc h LYS 56 Ca 0.15 -0.09 -0.15 0.00 -2.00 0.00 0.00 60.65 58.55 2klc h LYS 56 Cb -0.05 -0.02 0.02 0.00 -0.90 0.00 0.00 32.23 31.27 2klc h LYS 56 CO -0.04 0.51 -0.67 -0.09 -2.00 0.00 0.00 179.45 177.16 2klc h ARG 57 N 0.25 0.24 -0.00 0.07 1.12 -1.38 -3.28 114.38 111.41 2klc h ARG 57 Ca 0.04 -0.41 0.00 0.00 -1.11 0.00 0.00 59.98 58.50 2klc h ARG 57 Cb 0.57 0.15 0.00 0.00 -0.01 0.00 0.00 29.97 30.69 2klc h ARG 57 CO 0.04 1.20 -0.07 1.19 -3.11 0.00 0.00 179.97 179.22 2klc n PHE 58 N -4.21 0.00 -3.05 2.20 3.01 -0.16 -4.93 117.46 110.31 2klc n PHE 58 Ca -0.13 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 58.10 2klc n PHE 58 Cb 0.76 -0.17 0.04 0.00 -0.01 0.00 0.00 39.48 40.10 2klc n PHE 58 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 2klc n LYS 59 N -0.96 -5.11 -3.93 -1.08 4.76 0.19 -5.01 118.16 107.02 2klc n LYS 59 Ca 0.16 0.92 -0.22 0.00 -2.87 0.00 0.00 58.31 56.30 2klc n LYS 59 Cb 0.25 -5.80 -0.05 0.00 -1.84 0.00 0.00 35.03 27.60 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 -2.74 5.03 0.24 4.39 0.01 -0.02 -4.98 113.70 115.63 2klc s SER 60 Ca 0.32 -0.62 -0.17 0.00 1.31 0.00 0.00 55.95 56.79 2klc s SER 60 Cb -0.14 -0.86 -0.08 0.00 0.21 0.00 0.00 66.02 65.15 2klc s SER 60 CO 0.40 -0.34 0.70 -1.00 0.41 0.00 0.00 173.24 173.41 2klc s HIS 61 N -2.36 3.56 0.39 2.43 3.76 -1.26 -4.44 115.29 117.37 2klc s HIS 61 Ca 0.40 1.29 0.16 0.00 -0.15 0.00 0.00 55.06 56.75 2klc s HIS 61 Cb -0.04 -2.56 0.92 0.00 1.11 0.00 0.00 32.58 32.02 2klc s HIS 61 CO 0.25 0.28 1.91 1.79 -0.85 0.00 0.00 174.74 178.12 2klc h THR 62 N 2.51 1.09 0.00 1.30 1.35 -1.93 -1.84 112.91 115.39 2klc h THR 62 Ca -0.48 -0.96 -0.08 0.00 -0.55 0.00 0.00 66.41 64.35 2klc h THR 62 Cb 1.19 1.53 -0.01 0.00 -1.73 0.00 0.00 68.15 69.13 2klc h THR 62 CO 0.65 0.27 -0.36 -0.78 -0.25 0.00 0.00 175.52 175.05 2klc h ASP 63 N 0.00 0.00 0.66 5.36 3.58 -1.96 -2.59 116.42 121.46 2klc h ASP 63 Ca -0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2klc h ASP 63 Cb 0.51 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.56 2klc h ASP 63 CO 0.04 0.36 -0.10 0.00 -2.88 0.00 0.00 179.24 176.66 2klc n GLN 64 N -3.91 0.28 -3.55 0.28 6.02 -0.70 -4.77 117.38 111.03 2klc n GLN 64 Ca -0.02 -0.06 -0.38 0.00 -0.01 0.00 0.00 57.00 56.53 2klc n GLN 64 Cb 0.42 -1.50 -0.11 0.00 1.02 0.00 0.00 30.24 30.08 2klc n GLN 64 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 2klc s LEU 65 N -2.76 4.04 -0.20 1.08 1.43 -0.98 -1.49 118.68 119.80 2klc s LEU 65 Ca 0.21 0.04 0.01 0.00 -1.03 0.00 0.00 54.13 53.36 2klc s LEU 65 Cb 0.19 -2.19 0.04 0.00 0.03 0.00 0.00 46.19 44.26 2klc s LEU 65 CO 0.52 -0.08 -0.14 0.68 0.23 0.00 0.00 176.35 177.56 2klc s VAL 66 N 1.83 1.86 0.28 -1.59 -7.23 -1.03 -4.97 120.40 109.54 2klc s VAL 66 Ca 0.09 -1.06 -0.23 0.00 -1.81 0.00 0.00 61.98 58.97 2klc s VAL 66 Cb -0.16 -1.84 -0.09 0.00 0.56 0.00 0.00 36.38 34.85 2klc s VAL 66 CO 0.11 0.29 0.84 -0.76 -0.31 0.00 0.00 175.10 175.26 2klc s LEU 67 N 1.32 4.32 -0.03 1.32 1.43 -1.26 -1.83 118.68 123.95 2klc s LEU 67 Ca 0.00 1.62 0.02 0.00 -1.03 0.00 0.00 54.13 54.74 2klc s LEU 67 Cb -0.15 -3.84 0.01 0.00 0.03 0.00 0.00 46.19 42.24 2klc s LEU 67 CO -0.09 -0.04 -0.06 -0.63 0.23 0.00 0.00 176.35 175.76 2klc s ILE 68 N -1.60 0.58 -0.16 -0.59 1.09 0.61 -0.67 121.20 120.47 2klc s ILE 68 Ca 0.47 -0.21 -0.28 0.00 -1.10 0.00 0.00 60.65 59.53 2klc s ILE 68 Cb -0.17 -0.56 0.07 0.00 -1.06 0.00 0.00 42.46 40.74 2klc s ILE 68 CO 0.22 0.21 0.69 0.12 -0.10 0.00 0.00 174.94 176.07 2klc s PHE 69 N 0.48 -0.71 -0.91 3.97 2.19 -0.47 -1.44 117.98 121.10 2klc s PHE 69 Ca -0.07 1.49 0.00 0.00 0.33 0.00 0.00 56.93 58.69 2klc s PHE 69 Cb -0.10 0.33 0.00 0.00 -1.31 0.00 0.00 43.02 41.94 2klc s PHE 69 CO 0.00 -0.49 0.00 0.00 1.83 0.00 0.00 175.22 176.56 2klc n ALA 70 N 1.80 -0.13 -0.29 11.12 0.00 -1.26 -2.32 120.51 129.43 2klc n ALA 70 Ca -0.17 0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.41 2klc n ALA 70 Cb 0.56 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.66 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 -0.82 1.15 3.43 0.00 0.00 -1.26 -5.05 105.19 102.63 2klc n GLY 71 Ca -0.09 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.47 1.55 0.08 1.61 0.00 -0.98 -5.12 119.74 116.40 2klc s LYS 72 Ca 0.00 -1.59 -0.30 0.00 0.00 0.00 0.00 55.97 54.08 2klc s LYS 72 Cb 0.00 -1.79 -0.05 0.00 0.00 0.00 0.00 37.83 35.98 2klc s LYS 72 CO 0.00 0.37 1.09 0.96 0.00 0.00 0.00 175.35 177.77 2klc s ILE 73 N -1.93 4.29 -0.49 3.79 -0.00 -1.26 -1.36 121.20 124.24 2klc s ILE 73 Ca 0.23 1.74 -0.25 0.00 -0.00 0.00 0.00 60.65 62.37 2klc s ILE 73 Cb -0.07 -4.11 0.03 0.00 -0.00 0.00 0.00 42.46 38.31 2klc s ILE 73 CO 0.11 0.19 0.93 -0.76 -0.00 0.00 0.00 174.94 175.41 2klc s LEU 74 N 0.59 4.01 0.00 0.37 1.43 0.15 -4.94 118.68 120.29 2klc s LEU 74 Ca 0.53 0.01 -0.02 0.00 -1.03 0.00 0.00 54.13 53.62 2klc s LEU 74 Cb -0.26 -3.11 0.12 0.00 0.03 0.00 0.00 46.19 42.97 2klc s LEU 74 CO 0.30 -1.10 0.83 0.29 0.23 0.00 0.00 176.35 176.90 2klc n LYS 75 N 7.27 -0.13 0.26 1.70 4.76 -1.26 -4.26 118.16 126.49 2klc n LYS 75 Ca 0.05 -2.05 0.14 0.00 -2.87 0.00 0.00 58.31 53.58 2klc n LYS 75 Cb 0.48 -0.61 0.66 0.00 -1.84 0.00 0.00 35.03 33.73 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 -0.62 0.00 1.24 4.39 2.03 -1.96 -1.71 116.42 119.80 2klc h ASP 76 Ca -0.27 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.03 2klc h ASP 76 Cb 0.95 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.45 2klc h ASP 76 CO 0.27 0.11 0.00 0.06 -1.03 0.00 0.00 179.24 178.65 2klc h GLN 77 N 0.00 0.00 -6.37 4.15 3.07 -2.00 -3.41 115.11 110.54 2klc h GLN 77 Ca -0.00 0.00 -0.55 0.00 0.09 0.00 0.00 58.65 58.19 2klc h GLN 77 Cb 0.50 0.00 -0.04 0.00 0.08 0.00 0.00 27.48 28.03 2klc h GLN 77 CO 0.01 0.00 -0.04 -0.51 0.09 0.00 0.00 178.83 178.38 2klc s ASP 78 N -5.64 6.89 0.00 0.06 1.11 -0.64 -5.08 116.67 113.37 2klc s ASP 78 Ca 0.03 1.16 0.06 0.00 0.18 0.00 0.00 52.55 53.98 2klc s ASP 78 Cb 0.08 -2.32 -0.03 0.00 1.07 0.00 0.00 42.92 41.72 2klc s ASP 78 CO 0.56 0.10 -0.17 0.42 1.18 0.00 0.00 175.17 177.26 2klc s THR 79 N -1.46 2.83 0.22 -1.27 -4.23 -1.26 -3.08 115.64 107.40 2klc s THR 79 Ca 0.38 -1.00 -0.07 0.00 -1.18 0.00 0.00 61.69 59.82 2klc s THR 79 Cb -0.16 -2.14 0.18 0.00 1.34 0.00 0.00 72.50 71.72 2klc s THR 79 CO 0.19 0.45 1.81 0.17 -0.54 0.00 0.00 174.62 176.71 2klc h LEU 80 N 4.92 1.12 -1.24 4.79 8.10 -1.89 -3.02 115.31 128.09 2klc h LEU 80 Ca -0.47 -0.14 -0.04 0.00 0.11 0.00 0.00 57.88 57.34 2klc h LEU 80 Cb 1.15 -0.29 -0.02 0.00 -0.44 0.00 0.00 40.66 41.06 2klc h LEU 80 CO 0.49 0.95 0.09 -1.28 -4.11 0.00 0.00 178.44 174.58 2klc h SER 81 N 1.21 0.57 0.57 0.17 0.87 -1.85 -1.78 113.55 113.31 2klc h SER 81 Ca 0.29 -0.09 -0.05 0.00 -1.23 0.00 0.00 61.79 60.72 2klc h SER 81 Cb 0.13 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 61.94 2klc h SER 81 CO -0.03 0.58 -0.22 -0.61 -0.53 0.00 0.00 176.83 176.01 2klc h GLN 82 N 0.60 0.00 -0.33 2.24 5.75 -1.86 -2.43 115.11 119.08 2klc h GLN 82 Ca 0.14 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.64 2klc h GLN 82 Cb 0.24 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.79 2klc h GLN 82 CO -0.00 0.22 0.00 0.72 -2.65 0.00 0.00 178.83 177.12 2klc n HIS 83 N -3.63 0.44 -1.36 3.99 8.25 -0.74 -4.90 115.22 117.27 2klc n HIS 83 Ca -0.01 -0.22 -0.03 0.00 -0.26 0.00 0.00 57.72 57.20 2klc n HIS 83 Cb 0.35 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.45 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 1.14 0.53 3.44 -1.41 0.00 -0.91 -4.96 105.19 103.01 2klc n GLY 84 Ca 0.14 -0.88 -0.44 0.00 0.00 0.00 0.00 46.02 44.84 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 -2.13 4.68 0.00 -0.61 1.01 -0.79 -4.94 121.20 118.41 2klc s ILE 85 Ca 0.00 -1.35 0.00 0.00 0.00 0.00 0.00 60.65 59.30 2klc s ILE 85 Cb 0.00 -4.74 0.00 0.00 0.01 0.00 0.00 42.46 37.73 2klc s ILE 85 CO 0.00 -1.47 0.00 1.41 0.00 0.00 0.00 174.94 174.88 2klc n HIS 86 N 6.69 -0.04 -1.65 3.97 8.25 -1.26 -3.79 115.22 127.39 2klc n HIS 86 Ca 0.17 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.20 2klc n HIS 86 Cb 0.48 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.56 2klc n HIS 86 CO 0.00 0.00 0.00 -3.47 0.64 0.00 0.00 176.34 173.51 2klc n ASP 87 N -0.18 3.91 0.00 0.41 2.03 -1.26 -1.72 116.55 119.74 2klc n ASP 87 Ca 0.00 0.79 0.00 0.00 0.52 0.00 0.00 54.79 56.10 2klc n ASP 87 Cb 0.00 -1.51 0.00 0.00 -0.72 0.00 0.00 41.12 38.89 2klc n ASP 87 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2klc n GLY 88 N 4.76 0.54 3.90 0.27 0.00 -1.04 -4.96 105.19 108.66 2klc n GLY 88 Ca 0.22 0.00 -0.28 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 3.42 -0.05 0.99 2.01 -0.70 -4.92 118.68 119.43 2klc s LEU 89 Ca 0.00 1.04 0.01 0.00 0.01 0.00 0.00 54.13 55.19 2klc s LEU 89 Cb 0.00 -4.00 0.02 0.00 0.01 0.00 0.00 46.19 42.22 2klc s LEU 89 CO 0.00 -0.77 -0.06 -0.89 1.01 0.00 0.00 176.35 175.64 2klc s THR 90 N -2.93 0.67 0.01 5.49 2.01 -1.26 -2.06 115.64 117.57 2klc s THR 90 Ca 0.51 -0.19 -0.12 0.00 0.31 0.00 0.00 61.69 62.20 2klc s THR 90 Cb -0.11 -0.67 -0.05 0.00 0.01 0.00 0.00 72.50 71.68 2klc s THR 90 CO 0.48 0.26 0.37 -0.69 -0.69 0.00 0.00 174.62 174.35 2klc s VAL 91 N 0.95 5.11 -0.49 3.82 1.01 -0.39 -4.95 120.40 125.46 2klc s VAL 91 Ca -0.10 0.64 -0.20 0.00 0.00 0.00 0.00 61.98 62.31 2klc s VAL 91 Cb -0.14 -3.65 0.04 0.00 0.00 0.00 0.00 36.38 32.63 2klc s VAL 91 CO 0.00 0.49 0.66 -1.00 0.00 0.00 0.00 175.10 175.26 2klc s HIS 92 N -1.18 3.02 -0.10 5.22 3.76 -0.52 -1.27 115.29 124.22 2klc s HIS 92 Ca 0.26 -0.33 -0.06 0.00 -0.15 0.00 0.00 55.06 54.77 2klc s HIS 92 Cb -0.15 -3.53 -0.04 0.00 1.11 0.00 0.00 32.58 29.97 2klc s HIS 92 CO 0.14 -1.02 0.15 -1.17 -0.85 0.00 0.00 174.74 171.99 2klc s LEU 93 N 2.84 4.39 -0.23 0.89 2.96 -0.23 -0.28 118.68 129.02 2klc s LEU 93 Ca 0.19 0.45 0.02 0.00 -0.22 0.00 0.00 54.13 54.56 2klc s LEU 93 Cb -0.17 -2.19 0.05 0.00 0.50 0.00 0.00 46.19 44.38 2klc s LEU 93 CO 0.15 0.38 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.76 2klc s VAL 94 N -1.09 1.90 -0.09 1.68 1.01 -0.76 -4.13 120.40 118.91 2klc s VAL 94 Ca 0.18 -1.32 -0.12 0.00 0.00 0.00 0.00 61.98 60.71 2klc s VAL 94 Cb -0.12 -2.00 -0.05 0.00 0.00 0.00 0.00 36.38 34.21 2klc s VAL 94 CO 0.07 0.07 0.29 -0.63 0.00 0.00 0.00 175.10 174.90 2klc s ILE 95 N 1.25 5.26 -0.34 2.22 1.01 -1.26 -2.47 121.20 126.88 2klc s ILE 95 Ca -0.05 0.56 0.09 0.00 0.00 0.00 0.00 60.65 61.25 2klc s ILE 95 Cb -0.18 -3.60 0.45 0.00 0.01 0.00 0.00 42.46 39.15 2klc s ILE 95 CO -0.07 0.52 1.13 0.29 0.00 0.00 0.00 174.94 176.81 2klc n LYS 96 N 2.55 3.12 0.07 2.79 5.02 -0.55 -4.77 118.16 126.38 2klc n LYS 96 Ca -0.15 -4.12 -0.19 0.00 -2.02 0.00 0.00 58.31 51.84 2klc n LYS 96 Cb 0.53 -2.10 -0.10 0.00 -0.02 0.00 0.00 35.03 33.34 2klc n LYS 96 CO 0.00 0.00 0.00 1.79 -0.52 0.00 0.00 177.40 178.67 2klc h THR 97 N 2.80 1.32 0.00 -0.18 1.35 -1.89 -3.47 112.91 112.84 2klc h THR 97 Ca 0.25 -2.40 0.00 0.00 -0.55 0.00 0.00 66.41 63.70 2klc h THR 97 Cb 1.28 2.50 0.00 0.00 -1.73 0.00 0.00 68.15 70.20 2klc h THR 97 CO 0.70 0.73 0.00 0.00 -0.25 0.00 0.00 175.52 176.70 2klc n GLN 98 N -3.79 0.00 0.00 4.72 10.64 -1.26 -4.43 117.38 123.26 2klc n GLN 98 Ca -0.10 0.00 0.14 0.00 -1.83 0.00 0.00 57.00 55.20 2klc n GLN 98 Cb 0.91 0.00 0.80 0.00 -0.86 0.00 0.00 30.24 31.09 2klc n GLN 98 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 2klc n ASN 99 N 0.66 0.00 -4.01 2.61 4.13 -1.26 -3.86 115.26 113.52 2klc n ASN 99 Ca 0.00 -0.78 -0.32 0.00 1.68 0.00 0.00 54.58 55.16 2klc n ASN 99 Cb 0.00 -0.03 -0.10 0.00 -1.54 0.00 0.00 39.78 38.11 2klc n ASN 99 CO 0.00 0.00 0.00 -0.13 0.28 0.00 0.00 177.26 177.41 2klc s ARG 100 N -2.06 2.73 0.00 3.52 3.00 -1.26 -5.20 118.95 119.68 2klc s ARG 100 Ca 0.40 -3.13 0.32 0.00 0.00 0.00 0.00 55.73 53.31 2klc s ARG 100 Cb 0.19 -3.66 1.89 0.00 0.00 0.00 0.00 34.95 33.37 2klc s ARG 100 CO 0.33 -1.24 2.21 -0.35 0.00 0.00 0.00 175.30 176.25