#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 3.86 0.40 0.54 2.20 -1.26 -5.08 119.74 120.40 2klc s LYS 24 Ca 0.00 1.30 -0.07 0.00 -0.36 0.00 0.00 55.97 56.85 2klc s LYS 24 Cb 0.00 -2.11 -0.05 0.00 -1.51 0.00 0.00 37.83 34.16 2klc s LYS 24 CO 0.00 -0.37 0.71 -1.50 -0.36 0.00 0.00 175.35 173.83 2klc s ILE 25 N -2.05 4.91 -0.61 5.43 2.07 -1.26 -5.03 121.20 124.66 2klc s ILE 25 Ca 0.66 0.26 -0.27 0.00 -1.41 0.00 0.00 60.65 59.88 2klc s ILE 25 Cb -0.15 -3.79 0.03 0.00 0.13 0.00 0.00 42.46 38.69 2klc s ILE 25 CO 0.19 -0.59 1.17 -0.32 -1.91 0.00 0.00 174.94 173.49 2klc s MET 26 N -4.11 3.43 -0.99 3.50 -2.45 -0.27 -4.84 119.30 113.56 2klc s MET 26 Ca 0.47 0.08 -0.21 0.00 -1.25 0.00 0.00 55.69 54.78 2klc s MET 26 Cb -0.10 -4.05 0.08 0.00 1.25 0.00 0.00 34.83 32.01 2klc s MET 26 CO 0.36 -1.74 1.33 0.15 1.05 0.00 0.00 175.02 176.17 2klc s LYS 27 N 4.95 3.61 -0.42 4.11 -0.14 -1.26 -1.57 119.74 129.02 2klc s LYS 27 Ca 0.40 -1.41 -0.19 0.00 -1.36 0.00 0.00 55.97 53.40 2klc s LYS 27 Cb -0.08 -5.19 0.02 0.00 -1.68 0.00 0.00 37.83 30.90 2klc s LYS 27 CO 0.23 -2.04 0.56 0.08 -0.76 0.00 0.00 175.35 173.42 2klc s VAL 28 N 4.03 4.93 -0.01 3.17 1.01 -0.52 -2.76 120.40 130.25 2klc s VAL 28 Ca 0.41 0.02 -0.28 0.00 0.00 0.00 0.00 61.98 62.13 2klc s VAL 28 Cb -0.02 -4.12 -0.04 0.00 0.00 0.00 0.00 36.38 32.21 2klc s VAL 28 CO -0.09 -0.49 0.88 -0.89 0.00 0.00 0.00 175.10 174.51 2klc s THR 29 N 2.56 4.90 -0.23 3.92 2.01 -1.02 -0.72 115.64 127.05 2klc s THR 29 Ca 0.19 1.84 0.00 0.00 0.31 0.00 0.00 61.69 64.04 2klc s THR 29 Cb -0.15 -4.22 0.03 0.00 0.01 0.00 0.00 72.50 68.17 2klc s THR 29 CO 0.17 0.21 -0.11 -0.69 -0.69 0.00 0.00 174.62 173.50 2klc s VAL 30 N 0.82 2.47 0.02 3.82 1.01 -0.30 -1.69 120.40 126.56 2klc s VAL 30 Ca 0.46 -1.16 -0.06 0.00 0.00 0.00 0.00 61.98 61.22 2klc s VAL 30 Cb -0.20 -2.25 -0.05 0.00 0.00 0.00 0.00 36.38 33.88 2klc s VAL 30 CO 0.25 0.23 0.27 -0.75 0.00 0.00 0.00 175.10 175.10 2klc s LYS 31 N 1.26 3.57 0.14 2.72 2.36 -0.38 -1.35 119.74 128.07 2klc s LYS 31 Ca -0.01 -0.10 0.03 0.00 -2.55 0.00 0.00 55.97 53.34 2klc s LYS 31 Cb -0.17 -3.06 -0.04 0.00 -1.05 0.00 0.00 37.83 33.51 2klc s LYS 31 CO -0.07 0.63 -0.05 0.95 1.55 0.00 0.00 175.35 178.36 2klc s THR 32 N -1.34 0.85 0.00 3.43 -4.23 -0.49 -1.20 115.64 112.66 2klc s THR 32 Ca 0.29 -1.99 -0.00 0.00 -1.18 0.00 0.00 61.69 58.81 2klc s THR 32 Cb -0.13 -1.90 -0.00 0.00 1.34 0.00 0.00 72.50 71.81 2klc s THR 32 CO 0.17 -0.68 1.57 -0.81 -0.54 0.00 0.00 174.62 174.33 2klc n PRO 33 N -0.17 0.79 0.00 3.99 -0.04 -1.26 -3.33 135.00 134.97 2klc n PRO 33 Ca -0.09 -0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.36 2klc n PRO 33 Cb 0.62 -1.11 0.00 0.00 -0.04 0.00 0.00 33.50 32.96 2klc n PRO 33 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2klc n LYS 34 N 1.61 0.00 -0.59 0.54 2.85 -1.26 -5.17 118.16 116.15 2klc n LYS 34 Ca 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.26 2klc n LYS 34 Cb 0.39 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.77 2klc n LYS 34 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 177.40 176.50 2klc n GLU 35 N -1.46 0.00 -3.61 -1.58 0.28 -1.21 -5.19 120.64 107.87 2klc n GLU 35 Ca 0.00 0.00 -0.16 0.00 -0.16 0.00 0.00 57.16 56.84 2klc n GLU 35 Cb 0.00 0.00 -0.07 0.00 1.43 0.00 0.00 31.44 32.80 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 -0.48 0.92 0.25 3.44 -2.85 -1.26 -1.39 119.74 118.37 2klc s LYS 36 Ca 0.00 0.03 0.04 0.00 -1.00 0.00 0.00 55.97 55.03 2klc s LYS 36 Cb 0.00 0.43 -0.01 0.00 -2.06 0.00 0.00 37.83 36.18 2klc s LYS 36 CO 0.00 -0.29 0.13 0.39 0.10 0.00 0.00 175.35 175.68 2klc n GLU 37 N 0.96 0.53 -3.89 1.78 -0.58 -0.45 -5.01 120.64 113.97 2klc n GLU 37 Ca -0.20 -2.22 -0.11 0.00 -0.42 0.00 0.00 57.16 54.21 2klc n GLU 37 Cb 0.57 1.44 -0.11 0.00 -0.57 0.00 0.00 31.44 32.77 2klc n GLU 37 CO 0.00 0.00 0.00 -2.00 -0.48 0.00 0.00 177.13 174.65 2klc s GLU 38 N -2.96 0.30 -0.10 3.49 2.12 -1.26 -1.15 118.70 119.13 2klc s GLU 38 Ca 0.18 -0.26 -0.01 0.00 0.36 0.00 0.00 54.97 55.24 2klc s GLU 38 Cb 0.01 0.12 0.03 0.00 0.26 0.00 0.00 34.13 34.55 2klc s GLU 38 CO 0.13 -0.06 -0.02 -0.06 -0.54 0.00 0.00 175.26 174.71 2klc s PHE 39 N -0.87 0.98 -0.38 5.30 0.08 0.11 -4.97 117.98 118.23 2klc s PHE 39 Ca -0.10 -0.46 -0.22 0.00 0.12 0.00 0.00 56.93 56.28 2klc s PHE 39 Cb -0.06 -0.97 0.01 0.00 -0.57 0.00 0.00 43.02 41.43 2klc s PHE 39 CO 0.00 -0.43 0.72 0.00 -0.10 0.00 0.00 175.22 175.41 2klc s ALA 40 N 1.87 3.41 0.00 5.36 0.00 -1.26 -1.44 121.76 129.71 2klc s ALA 40 Ca 0.04 -0.82 0.03 0.00 0.00 0.00 0.00 51.96 51.21 2klc s ALA 40 Cb -0.13 -3.30 -0.01 0.00 0.00 0.00 0.00 23.12 19.68 2klc s ALA 40 CO -0.06 -1.51 -0.09 0.14 0.00 0.00 0.00 175.76 174.23 2klc s VAL 41 N 2.96 0.72 -0.07 0.00 -7.23 -0.61 -4.93 120.40 111.24 2klc s VAL 41 Ca 0.28 -0.51 -0.01 0.00 -1.81 0.00 0.00 61.98 59.93 2klc s VAL 41 Cb -0.14 -0.63 -0.00 0.00 0.56 0.00 0.00 36.38 36.17 2klc s VAL 41 CO 0.17 0.12 2.29 -0.81 -0.31 0.00 0.00 175.10 176.57 2klc n PRO 42 N 2.63 1.36 -0.92 4.82 -0.04 -1.26 -1.12 135.00 140.48 2klc n PRO 42 Ca -0.15 -0.53 -0.05 0.00 -0.04 0.00 0.00 63.50 62.73 2klc n PRO 42 Cb 0.57 -1.31 -0.02 0.00 -0.04 0.00 0.00 33.50 32.69 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 1.43 -1.44 -0.01 0.54 0.28 -1.26 -4.66 120.64 115.51 2klc n GLU 43 Ca 0.14 0.34 0.02 0.00 -0.16 0.00 0.00 57.16 57.50 2klc n GLU 43 Cb 0.58 -4.15 -0.06 0.00 1.43 0.00 0.00 31.44 29.24 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 0.67 3.25 -4.55 -1.84 5.15 -1.26 -4.92 115.26 111.76 2klc n ASN 44 Ca -0.05 0.00 -0.34 0.00 -0.60 0.00 0.00 54.58 53.59 2klc n ASN 44 Cb 0.21 1.16 -0.03 0.00 -0.53 0.00 0.00 39.78 40.59 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 -3.15 4.51 0.94 1.20 0.01 -1.26 -4.98 113.70 110.97 2klc s SER 45 Ca -0.03 0.86 -0.12 0.00 1.31 0.00 0.00 55.95 57.97 2klc s SER 45 Cb 0.04 -2.51 0.16 0.00 0.21 0.00 0.00 66.02 63.92 2klc s SER 45 CO 0.31 -2.90 1.09 -0.94 0.41 0.00 0.00 173.24 171.21 2klc s SER 46 N 11.45 3.05 0.38 2.44 1.04 -1.26 -4.68 113.70 126.13 2klc s SER 46 Ca 0.92 1.40 0.08 0.00 0.48 0.00 0.00 55.95 58.83 2klc s SER 46 Cb -0.16 -2.07 0.82 0.00 0.10 0.00 0.00 66.02 64.71 2klc s SER 46 CO 0.23 -2.89 1.98 0.58 0.98 0.00 0.00 173.24 174.12 2klc h VAL 47 N -1.72 1.00 -0.09 5.02 2.07 -1.79 0.32 116.25 121.06 2klc h VAL 47 Ca -0.52 -0.22 -0.04 0.00 0.82 0.00 0.00 66.70 66.74 2klc h VAL 47 Cb 1.30 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 31.36 2klc h VAL 47 CO 0.55 0.12 -0.13 -0.61 0.02 0.00 0.00 177.57 177.52 2klc h GLN 48 N 0.65 0.13 0.00 1.57 5.75 -1.88 -1.66 115.11 119.67 2klc h GLN 48 Ca 0.28 -0.03 0.00 0.00 -0.15 0.00 0.00 58.65 58.76 2klc h GLN 48 Cb 0.28 -0.02 0.00 0.00 1.07 0.00 0.00 27.48 28.81 2klc h GLN 48 CO -0.09 0.27 -1.41 1.04 -2.65 0.00 0.00 178.83 176.00 2klc n GLN 49 N -4.32 0.57 0.01 1.69 6.02 -0.03 -4.43 117.38 116.91 2klc n GLN 49 Ca -0.01 -0.03 -0.22 0.00 -0.01 0.00 0.00 57.00 56.73 2klc n GLN 49 Cb 0.24 -1.67 -0.14 0.00 1.02 0.00 0.00 30.24 29.69 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 0.00 0.48 0.00 1.08 3.57 -0.17 -3.33 116.94 118.57 2klc h PHE 50 Ca 0.00 -0.35 0.00 0.00 3.53 0.00 0.00 57.97 61.15 2klc h PHE 50 Cb 0.96 -0.02 0.00 0.00 2.79 0.00 0.00 35.95 39.68 2klc h PHE 50 CO 0.00 1.66 0.00 1.57 -2.23 0.00 0.00 178.31 179.31 2klc h LYS 51 N -0.14 0.00 -0.16 1.11 -0.00 -1.55 -1.88 116.57 113.96 2klc h LYS 51 Ca -0.36 0.00 -0.00 0.00 -0.00 0.00 0.00 60.65 60.29 2klc h LYS 51 Cb 1.89 0.00 -0.01 0.00 -0.00 0.00 0.00 32.23 34.12 2klc h LYS 51 CO 0.07 0.00 0.09 0.93 -0.00 0.00 0.00 179.45 180.54 2klc h GLU 52 N 0.00 0.22 -0.29 0.07 4.39 -1.77 -1.49 114.58 115.70 2klc h GLU 52 Ca 0.00 -0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 2klc h GLU 52 Cb 0.39 -0.04 -0.02 0.00 -0.10 0.00 0.00 28.75 28.98 2klc h GLU 52 CO 0.00 0.21 0.01 0.93 -1.16 0.00 0.00 179.01 179.00 2klc h GLU 53 N 0.16 0.43 -0.37 2.33 4.39 -1.48 -2.80 114.58 117.24 2klc h GLU 53 Ca 0.06 -0.08 -0.12 0.00 0.34 0.00 0.00 59.36 59.56 2klc h GLU 53 Cb 0.06 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 2klc h GLU 53 CO -0.01 0.45 -0.23 0.82 -1.16 0.00 0.00 179.01 178.88 2klc h ILE 54 N 0.42 1.28 0.07 3.13 2.04 -1.41 -3.16 117.51 119.89 2klc h ILE 54 Ca 0.10 -1.38 -0.00 0.00 1.00 0.00 0.00 64.86 64.57 2klc h ILE 54 Cb 0.26 1.36 0.00 0.00 -0.74 0.00 0.00 36.82 37.70 2klc h ILE 54 CO 0.01 0.46 -0.03 0.77 0.00 0.00 0.00 178.15 179.35 2klc h SER 55 N 0.61 -0.08 -0.41 1.72 4.64 -0.99 -0.60 113.55 118.44 2klc h SER 55 Ca 0.08 -0.14 -0.04 0.00 -0.47 0.00 0.00 61.79 61.22 2klc h SER 55 Cb 0.80 0.02 -0.02 0.00 -0.31 0.00 0.00 62.40 62.89 2klc h SER 55 CO 0.07 0.09 0.14 0.07 -0.87 0.00 0.00 176.83 176.33 2klc h LYS 56 N -0.24 0.70 0.00 4.77 2.10 -1.70 0.45 116.57 122.64 2klc h LYS 56 Ca -0.01 -0.12 -0.00 0.00 -2.00 0.00 0.00 60.65 58.52 2klc h LYS 56 Cb 0.21 -0.12 0.00 0.00 -0.90 0.00 0.00 32.23 31.42 2klc h LYS 56 CO 0.02 0.61 -0.00 -0.09 -2.00 0.00 0.00 179.45 177.99 2klc h ARG 57 N 0.68 -0.00 -0.12 0.07 9.65 -1.41 -3.08 114.38 120.17 2klc h ARG 57 Ca 0.16 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.04 2klc h ARG 57 Cb 0.21 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.79 2klc h ARG 57 CO -0.01 0.23 0.00 1.19 2.80 0.00 0.00 179.97 184.19 2klc n PHE 58 N -4.98 0.15 -2.54 2.20 3.01 -0.27 -4.94 117.46 110.10 2klc n PHE 58 Ca -0.08 -0.07 -0.19 0.00 1.01 0.00 0.00 57.45 58.12 2klc n PHE 58 Cb 0.14 0.00 -0.00 0.00 -0.01 0.00 0.00 39.48 39.60 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 0.51 -2.34 -4.43 -1.08 4.76 0.01 -4.82 118.16 110.78 2klc n LYS 59 Ca 0.17 0.88 -0.27 0.00 -2.87 0.00 0.00 58.31 56.22 2klc n LYS 59 Cb 0.40 -5.56 -0.12 0.00 -1.84 0.00 0.00 35.03 27.92 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 -2.16 3.45 0.36 4.39 0.01 -0.40 -4.80 113.70 114.55 2klc s SER 60 Ca 0.06 -0.88 -0.26 0.00 1.31 0.00 0.00 55.95 56.18 2klc s SER 60 Cb -0.03 -0.26 -0.09 0.00 0.21 0.00 0.00 66.02 65.85 2klc s SER 60 CO 0.07 0.11 1.07 -1.00 0.41 0.00 0.00 173.24 173.91 2klc s HIS 61 N -1.73 3.38 0.26 2.43 3.76 -1.26 -4.38 115.29 117.74 2klc s HIS 61 Ca 0.21 1.67 -0.02 0.00 -0.15 0.00 0.00 55.06 56.77 2klc s HIS 61 Cb -0.08 -3.19 0.42 0.00 1.11 0.00 0.00 32.58 30.84 2klc s HIS 61 CO 0.10 -0.61 1.87 1.79 -0.85 0.00 0.00 174.74 177.04 2klc h THR 62 N 2.52 1.05 -0.86 1.30 1.35 -1.91 -1.95 112.91 114.42 2klc h THR 62 Ca -0.48 -0.38 0.05 0.00 -0.55 0.00 0.00 66.41 65.05 2klc h THR 62 Cb 1.21 -0.16 -0.05 0.00 -1.73 0.00 0.00 68.15 67.42 2klc h THR 62 CO 0.64 0.20 0.56 -0.78 -0.25 0.00 0.00 175.52 175.89 2klc h ASP 63 N 1.11 0.89 0.56 5.36 3.58 -1.96 -2.79 116.42 123.16 2klc h ASP 63 Ca 0.43 -0.00 -0.11 0.00 0.42 0.00 0.00 57.03 57.77 2klc h ASP 63 Cb 0.22 -0.20 -0.02 0.00 1.72 0.00 0.00 39.33 41.06 2klc h ASP 63 CO -0.19 0.59 -0.53 1.56 -2.88 0.00 0.00 179.24 177.79 2klc h GLN 64 N 1.02 0.00 -5.66 0.28 4.20 -1.68 -3.44 115.11 109.83 2klc h GLN 64 Ca 0.35 0.00 -0.66 0.00 0.06 0.00 0.00 58.65 58.40 2klc h GLN 64 Cb 0.11 0.00 -0.12 0.00 0.30 0.00 0.00 27.48 27.76 2klc h GLN 64 CO -0.12 0.53 -0.55 -0.48 -0.67 0.00 0.00 178.83 177.54 2klc s LEU 65 N -7.75 3.93 -0.02 1.46 0.05 -1.05 -1.41 118.68 113.89 2klc s LEU 65 Ca -0.02 0.24 0.02 0.00 0.05 0.00 0.00 54.13 54.43 2klc s LEU 65 Cb 0.13 -1.95 0.00 0.00 -2.05 0.00 0.00 46.19 42.32 2klc s LEU 65 CO 0.75 0.33 -0.08 0.68 -0.55 0.00 0.00 176.35 177.48 2klc s VAL 66 N -0.57 0.69 0.14 1.48 -7.23 -0.81 -4.92 120.40 109.18 2klc s VAL 66 Ca 0.11 -0.32 -0.21 0.00 -1.81 0.00 0.00 61.98 59.74 2klc s VAL 66 Cb -0.12 -0.61 -0.07 0.00 0.56 0.00 0.00 36.38 36.13 2klc s VAL 66 CO 0.02 0.22 0.67 -0.76 -0.31 0.00 0.00 175.10 174.94 2klc s LEU 67 N 0.14 4.51 -0.02 1.32 1.43 -1.26 -1.69 118.68 123.10 2klc s LEU 67 Ca -0.02 1.42 0.02 0.00 -1.03 0.00 0.00 54.13 54.52 2klc s LEU 67 Cb -0.07 -3.19 0.01 0.00 0.03 0.00 0.00 46.19 42.97 2klc s LEU 67 CO 0.00 0.20 -0.05 -0.63 0.23 0.00 0.00 176.35 176.10 2klc s ILE 68 N -1.22 0.50 -0.20 -0.59 1.09 0.11 -1.11 121.20 119.78 2klc s ILE 68 Ca 0.34 -0.20 -0.18 0.00 -1.10 0.00 0.00 60.65 59.51 2klc s ILE 68 Cb -0.20 -0.46 0.05 0.00 -1.06 0.00 0.00 42.46 40.79 2klc s ILE 68 CO 0.22 0.17 0.52 0.12 -0.10 0.00 0.00 174.94 175.87 2klc s PHE 69 N 0.27 -0.58 -1.09 3.97 5.36 -0.21 -0.87 117.98 124.82 2klc s PHE 69 Ca -0.03 1.41 0.00 0.00 -0.96 0.00 0.00 56.93 57.34 2klc s PHE 69 Cb -0.07 0.21 0.00 0.00 -0.34 0.00 0.00 43.02 42.82 2klc s PHE 69 CO -0.00 -0.28 0.00 0.00 -1.46 0.00 0.00 175.22 173.48 2klc n ALA 70 N 2.89 -0.16 -0.02 11.12 0.00 -1.26 -2.22 120.51 130.87 2klc n ALA 70 Ca -0.14 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.47 2klc n ALA 70 Cb 0.56 -1.53 0.00 0.00 0.00 0.00 0.00 19.45 18.48 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 -0.50 0.28 3.38 0.00 0.00 -1.26 -5.08 105.19 102.01 2klc n GLY 71 Ca -0.10 0.00 -0.23 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 -0.94 1.41 0.16 1.61 0.00 -0.94 -5.12 119.74 115.92 2klc s LYS 72 Ca 0.00 -1.51 -0.30 0.00 0.00 0.00 0.00 55.97 54.16 2klc s LYS 72 Cb 0.00 -1.52 -0.07 0.00 0.00 0.00 0.00 37.83 36.24 2klc s LYS 72 CO 0.00 0.31 0.95 0.96 0.00 0.00 0.00 175.35 177.57 2klc s ILE 73 N -2.10 4.33 -0.06 3.79 -0.00 -1.26 -1.05 121.20 124.86 2klc s ILE 73 Ca 0.20 2.07 -0.20 0.00 -0.00 0.00 0.00 60.65 62.72 2klc s ILE 73 Cb -0.06 -4.32 -0.05 0.00 -0.00 0.00 0.00 42.46 38.03 2klc s ILE 73 CO 0.09 0.39 0.57 -0.76 -0.00 0.00 0.00 174.94 175.23 2klc s LEU 74 N -0.47 4.35 0.35 0.37 1.43 -0.27 -4.94 118.68 119.50 2klc s LEU 74 Ca 0.44 1.04 0.07 0.00 -1.03 0.00 0.00 54.13 54.66 2klc s LEU 74 Cb -0.24 -2.87 -0.07 0.00 0.03 0.00 0.00 46.19 43.04 2klc s LEU 74 CO 0.31 0.02 -0.02 -0.54 0.23 0.00 0.00 176.35 176.35 2klc s LYS 75 N 0.28 1.77 0.28 1.70 -0.14 -1.25 -4.61 119.74 117.78 2klc s LYS 75 Ca 0.31 -1.96 0.02 0.00 -1.36 0.00 0.00 55.97 52.98 2klc s LYS 75 Cb -0.17 -1.39 0.63 0.00 -1.68 0.00 0.00 37.83 35.21 2klc s LYS 75 CO 0.15 -0.01 1.77 0.22 -0.76 0.00 0.00 175.35 176.72 2klc h ASP 76 N 2.01 0.65 0.41 2.83 3.58 -1.95 -1.50 116.42 122.45 2klc h ASP 76 Ca -0.42 0.09 -0.04 0.00 0.42 0.00 0.00 57.03 57.09 2klc h ASP 76 Cb 1.24 -0.02 -0.01 0.00 1.72 0.00 0.00 39.33 42.27 2klc h ASP 76 CO 0.73 0.25 -0.17 0.06 -2.88 0.00 0.00 179.24 177.23 2klc h GLN 77 N 0.70 0.00 -3.28 0.28 3.07 -2.01 -3.33 115.11 110.53 2klc h GLN 77 Ca 0.52 0.00 -0.63 0.00 0.09 0.00 0.00 58.65 58.62 2klc h GLN 77 Cb 0.76 0.00 -0.41 0.00 0.08 0.00 0.00 27.48 27.91 2klc h GLN 77 CO -0.37 0.17 -0.65 0.16 0.09 0.00 0.00 178.83 178.23 2klc s ASP 78 N -6.35 4.21 0.51 0.06 -4.77 -0.56 -5.11 116.67 104.66 2klc s ASP 78 Ca -0.03 -3.01 -0.22 0.00 -3.30 0.00 0.00 52.55 46.00 2klc s ASP 78 Cb 0.13 -1.52 -0.06 0.00 -1.09 0.00 0.00 42.92 40.38 2klc s ASP 78 CO 0.62 -0.23 1.21 0.42 0.70 0.00 0.00 175.17 177.90 2klc s THR 79 N -0.27 2.79 0.24 2.11 -4.23 -1.25 -3.93 115.64 111.10 2klc s THR 79 Ca 0.18 0.57 -0.07 0.00 -1.18 0.00 0.00 61.69 61.19 2klc s THR 79 Cb -0.24 -3.27 0.26 0.00 1.34 0.00 0.00 72.50 70.59 2klc s THR 79 CO -0.01 -0.03 1.65 0.17 -0.54 0.00 0.00 174.62 175.85 2klc h LEU 80 N 1.64 -0.26 -1.28 4.79 -0.00 -1.88 -0.85 115.31 117.47 2klc h LEU 80 Ca -0.50 0.18 -0.04 0.00 -0.00 0.00 0.00 57.88 57.52 2klc h LEU 80 Cb 1.27 0.30 -0.02 0.00 -0.00 0.00 0.00 40.66 42.21 2klc h LEU 80 CO 0.58 -0.14 0.08 0.77 -0.00 0.00 0.00 178.44 179.73 2klc h SER 81 N 0.14 0.52 0.41 0.17 4.64 -1.91 -1.21 113.55 116.31 2klc h SER 81 Ca 0.41 -0.08 -0.04 0.00 -0.47 0.00 0.00 61.79 61.60 2klc h SER 81 Cb 0.71 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.66 2klc h SER 81 CO -0.62 0.54 -0.21 -0.61 -0.87 0.00 0.00 176.83 175.07 2klc h GLN 82 N 0.55 0.00 -0.00 4.77 5.75 -1.50 -2.08 115.11 122.60 2klc h GLN 82 Ca 0.13 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.63 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 0.21 -0.08 0.72 -2.65 0.00 0.00 178.83 177.03 2klc n HIS 83 N -3.82 0.00 -0.80 3.99 8.25 -0.56 -4.91 115.22 117.38 2klc n HIS 83 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2klc n HIS 83 Cb 0.30 -0.20 0.00 0.00 1.12 0.00 0.00 29.99 31.21 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 1.27 0.57 3.49 -1.41 0.00 -0.78 -5.03 105.19 103.29 2klc n GLY 84 Ca 0.15 -0.79 -0.43 0.00 0.00 0.00 0.00 46.02 44.95 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 -2.00 4.39 0.00 -0.61 1.01 -0.61 -4.96 121.20 118.42 2klc s ILE 85 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.64 2klc s ILE 85 Cb 0.00 -4.58 0.00 0.00 0.01 0.00 0.00 42.46 37.89 2klc s ILE 85 CO 0.00 -1.23 0.00 1.41 0.00 0.00 0.00 174.94 175.12 2klc n HIS 86 N 7.48 0.00 -1.75 3.97 8.25 -1.26 -3.72 115.22 128.20 2klc n HIS 86 Ca -0.01 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.03 2klc n HIS 86 Cb 0.47 0.00 -0.03 0.00 1.12 0.00 0.00 29.99 31.55 2klc n HIS 86 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 2klc s ASP 87 N 0.70 6.46 0.00 0.41 -4.77 -1.25 -1.82 116.67 116.41 2klc s ASP 87 Ca 0.00 2.68 0.00 0.00 -3.30 0.00 0.00 52.55 51.93 2klc s ASP 87 Cb 0.00 -2.56 0.00 0.00 -1.09 0.00 0.00 42.92 39.27 2klc s ASP 87 CO 0.00 -1.00 0.00 0.61 0.70 0.00 0.00 175.17 175.48 2klc n GLY 88 N 4.27 3.28 3.90 2.12 0.00 -1.11 -4.92 105.19 112.73 2klc n GLY 88 Ca 0.18 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.92 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 3.25 -0.01 0.99 2.01 -0.75 -4.94 118.68 119.23 2klc s LEU 89 Ca 0.00 0.96 0.01 0.00 0.01 0.00 0.00 54.13 55.10 2klc s LEU 89 Cb 0.00 -3.84 0.01 0.00 0.01 0.00 0.00 46.19 42.36 2klc s LEU 89 CO 0.00 -0.98 -0.01 -0.89 1.01 0.00 0.00 176.35 175.48 2klc s THR 90 N -3.04 0.14 0.09 5.49 2.01 -1.26 -2.43 115.64 116.64 2klc s THR 90 Ca 0.53 -0.02 -0.00 0.00 0.31 0.00 0.00 61.69 62.52 2klc s THR 90 Cb -0.11 -0.16 -0.04 0.00 0.01 0.00 0.00 72.50 72.21 2klc s THR 90 CO 0.48 0.07 0.25 -0.69 -0.69 0.00 0.00 174.62 174.04 2klc s VAL 91 N 0.28 5.34 -0.44 3.82 1.01 -0.68 -4.96 120.40 124.77 2klc s VAL 91 Ca -0.02 -0.40 -0.16 0.00 0.00 0.00 0.00 61.98 61.39 2klc s VAL 91 Cb -0.05 -3.66 0.04 0.00 0.00 0.00 0.00 36.38 32.71 2klc s VAL 91 CO -0.01 0.06 0.40 -1.00 0.00 0.00 0.00 175.10 174.55 2klc s HIS 92 N -1.59 3.20 -0.14 5.22 3.76 -0.05 -1.24 115.29 124.44 2klc s HIS 92 Ca 0.36 -0.61 -0.06 0.00 -0.15 0.00 0.00 55.06 54.60 2klc s HIS 92 Cb -0.12 -2.92 -0.04 0.00 1.11 0.00 0.00 32.58 30.61 2klc s HIS 92 CO 0.28 -0.72 0.08 -1.17 -0.85 0.00 0.00 174.74 172.36 2klc s LEU 93 N 1.90 3.99 -0.20 0.89 2.96 -0.34 0.06 118.68 127.93 2klc s LEU 93 Ca 0.08 0.24 0.01 0.00 -0.22 0.00 0.00 54.13 54.23 2klc s LEU 93 Cb -0.20 -1.98 0.05 0.00 0.50 0.00 0.00 46.19 44.56 2klc s LEU 93 CO 0.10 0.30 -0.09 -0.69 -1.32 0.00 0.00 176.35 174.65 2klc s VAL 94 N -0.38 1.57 -0.16 1.68 1.01 -0.68 -4.28 120.40 119.16 2klc s VAL 94 Ca 0.10 -1.01 -0.04 0.00 0.00 0.00 0.00 61.98 61.03 2klc s VAL 94 Cb -0.12 -1.69 -0.03 0.00 0.00 0.00 0.00 36.38 34.55 2klc s VAL 94 CO 0.02 0.12 -0.03 -0.63 0.00 0.00 0.00 175.10 174.57 2klc s ILE 95 N 1.42 3.91 -1.22 2.22 1.01 -1.26 -1.92 121.20 125.35 2klc s ILE 95 Ca -0.02 -0.35 -0.10 0.00 0.00 0.00 0.00 60.65 60.18 2klc s ILE 95 Cb -0.17 -2.71 0.19 0.00 0.01 0.00 0.00 42.46 39.78 2klc s ILE 95 CO -0.08 0.49 1.62 1.17 0.00 0.00 0.00 174.94 178.14 2klc n LYS 96 N 3.56 3.62 -4.37 2.79 4.81 -0.50 -4.94 118.16 123.13 2klc n LYS 96 Ca -0.17 -3.83 -0.20 0.00 -0.87 0.00 0.00 58.31 53.24 2klc n LYS 96 Cb 0.52 -2.89 -0.09 0.00 0.02 0.00 0.00 35.03 32.59 2klc n LYS 96 CO 0.00 0.00 0.00 -0.08 1.17 0.00 0.00 177.40 178.49 2klc s THR 97 N 0.34 0.39 -0.09 3.15 -1.32 -1.26 -4.84 115.64 112.01 2klc s THR 97 Ca 0.39 -2.00 -0.30 0.00 -1.21 0.00 0.00 61.69 58.57 2klc s THR 97 Cb 0.03 -2.49 0.08 0.00 -1.51 0.00 0.00 72.50 68.61 2klc s THR 97 CO 0.01 0.00 0.74 0.00 -2.21 0.00 0.00 174.62 173.16 2klc s GLN 98 N -3.77 0.95 -1.46 7.08 -2.07 -1.26 -4.97 119.66 114.17 2klc s GLN 98 Ca 0.34 0.32 -0.09 0.00 -1.82 0.00 0.00 55.36 54.11 2klc s GLN 98 Cb 0.04 0.45 0.05 0.00 -1.09 0.00 0.00 33.01 32.46 2klc s GLN 98 CO 0.18 -0.28 0.76 0.09 -1.32 0.00 0.00 175.29 174.72 2klc n ASN 99 N 1.09 -5.21 -4.74 12.60 3.02 -1.26 -4.97 115.26 115.79 2klc n ASN 99 Ca -0.17 -0.48 -0.41 0.00 -0.03 0.00 0.00 54.58 53.48 2klc n ASN 99 Cb 0.57 -4.19 -0.03 0.00 -0.61 0.00 0.00 39.78 35.52 2klc n ASN 99 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2klc s ARG 100 N -6.12 4.41 0.00 3.52 1.70 -1.26 -5.20 118.95 116.00 2klc s ARG 100 Ca 0.47 2.01 0.16 0.00 -0.47 0.00 0.00 55.73 57.90 2klc s ARG 100 Cb -0.23 -3.21 0.93 0.00 -0.57 0.00 0.00 34.95 31.88 2klc s ARG 100 CO 0.58 -0.22 1.34 -0.35 -1.08 0.00 0.00 175.30 175.57