#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lhc n GLY 2 N 0.00 0.78 2.26 -0.72 0.00 -1.26 -4.95 105.19 101.30 3lhc n GLY 2 Ca 0.00 -0.63 -0.09 0.00 0.00 0.00 0.00 46.02 45.30 3lhc n GLY 2 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3lhc n LYS 3 N 12.10 -0.67 -0.24 1.61 5.02 -1.26 -4.92 118.16 129.80 3lhc n LYS 3 Ca 0.00 0.78 0.14 0.00 -2.02 0.00 0.00 58.31 57.20 3lhc n LYS 3 Cb 0.00 -4.70 0.42 0.00 -0.02 0.00 0.00 35.03 30.74 3lhc n LYS 3 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 3lhc h PHE 4 N 0.00 0.71 0.00 2.13 -0.00 -2.00 -2.46 116.94 115.32 3lhc h PHE 4 Ca -0.20 0.02 -0.01 0.00 -0.00 0.00 0.00 57.97 57.78 3lhc h PHE 4 Cb 0.70 -0.22 -0.00 0.00 -0.00 0.00 0.00 35.95 36.42 3lhc h PHE 4 CO 0.26 0.25 -0.04 0.66 -0.00 0.00 0.00 178.31 179.45 3lhc h SER 5 N 0.59 0.00 0.48 -0.68 4.64 -1.91 -2.12 113.55 114.55 3lhc h SER 5 Ca 0.43 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.71 3lhc h SER 5 Cb 0.80 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.89 3lhc h SER 5 CO -0.18 0.04 -0.19 1.56 -0.87 0.00 0.00 176.83 177.18 3lhc h GLN 6 N 0.00 0.00 -0.07 4.77 1.08 -1.85 -3.23 115.11 115.81 3lhc h GLN 6 Ca -0.00 0.00 -0.15 0.00 -1.45 0.00 0.00 58.65 57.05 3lhc h GLN 6 Cb 0.24 0.00 -0.27 0.00 -0.05 0.00 0.00 27.48 27.39 3lhc h GLN 6 CO 0.01 0.19 -0.87 0.25 -0.95 0.00 0.00 178.83 177.45 3lhc n THR 7 N -3.69 0.88 -4.26 -0.54 -2.24 -0.82 -5.05 114.28 98.55 3lhc n THR 7 Ca -0.01 -1.97 -0.14 0.00 -2.27 0.00 0.00 64.05 59.65 3lhc n THR 7 Cb 0.31 0.56 -0.10 0.00 -2.10 0.00 0.00 70.33 69.00 3lhc n THR 7 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3lhc s TYR 9 N -3.44 0.62 -1.46 0.00 1.13 0.47 -4.88 117.35 109.79 3lhc s TYR 9 Ca 0.21 -0.97 -0.08 0.00 -1.41 0.00 0.00 57.07 54.82 3lhc s TYR 9 Cb 0.04 0.15 0.03 0.00 -1.10 0.00 0.00 41.96 41.09 3lhc s TYR 9 CO 0.03 -1.12 0.81 0.09 -2.51 0.00 0.00 175.55 172.86 3lhc n ASN 10 N -0.91 -5.63 -4.78 -0.18 4.13 -1.26 -1.38 115.26 105.25 3lhc n ASN 10 Ca -0.01 -0.46 -0.36 0.00 1.68 0.00 0.00 54.58 55.43 3lhc n ASN 10 Cb 0.62 -4.51 -0.02 0.00 -1.54 0.00 0.00 39.78 34.32 3lhc n ASN 10 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 3lhc s SER 11 N -2.97 6.34 -0.05 6.41 0.01 -1.26 -4.46 113.70 117.71 3lhc s SER 11 Ca 0.46 2.09 -0.18 0.00 1.31 0.00 0.00 55.95 59.63 3lhc s SER 11 Cb -0.22 -2.58 0.04 0.00 0.21 0.00 0.00 66.02 63.47 3lhc s SER 11 CO 0.57 -0.79 0.40 0.00 0.41 0.00 0.00 173.24 173.83 3lhc s ALA 12 N -1.75 -1.02 -0.14 1.44 0.00 0.04 -4.99 121.76 115.34 3lhc s ALA 12 Ca 0.64 0.70 -0.00 0.00 0.00 0.00 0.00 51.96 53.31 3lhc s ALA 12 Cb -0.22 -0.12 -0.01 0.00 0.00 0.00 0.00 23.12 22.77 3lhc s ALA 12 CO 0.27 -0.27 -0.14 0.42 0.00 0.00 0.00 175.76 176.05 3lhc s ILE 13 N -0.94 2.95 -0.09 0.00 1.01 -1.26 -0.71 121.20 122.17 3lhc s ILE 13 Ca -0.10 -0.69 -0.01 0.00 0.00 0.00 0.00 60.65 59.85 3lhc s ILE 13 Cb -0.04 -2.24 0.03 0.00 0.01 0.00 0.00 42.46 40.22 3lhc s ILE 13 CO 0.04 0.52 -0.02 -1.58 0.00 0.00 0.00 174.94 173.90 3lhc s GLN 14 N 0.48 0.91 7.99 2.79 2.00 -0.53 -4.99 119.66 128.30 3lhc s GLN 14 Ca -0.10 -0.03 0.00 0.00 -2.00 0.00 0.00 55.36 53.24 3lhc s GLN 14 Cb -0.16 -1.21 0.00 0.00 0.80 0.00 0.00 33.01 32.44 3lhc s GLN 14 CO 0.05 -0.30 0.00 0.41 -0.50 0.00 0.00 175.29 174.94 3lhc n GLY 15 N 5.08 4.25 1.17 2.59 0.00 -1.26 -1.40 105.19 115.62 3lhc n GLY 15 Ca -0.09 0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.16 3lhc n GLY 15 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3lhc n SER 16 N 8.36 3.47 -4.45 1.61 3.41 -1.26 -4.95 113.62 119.80 3lhc n SER 16 Ca 0.00 -1.98 -0.35 0.00 -0.26 0.00 0.00 58.87 56.28 3lhc n SER 16 Cb 0.00 -0.31 -0.12 0.00 -0.26 0.00 0.00 64.21 63.52 3lhc n SER 16 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 3lhc s VAL 17 N -1.39 3.92 -0.16 -3.33 1.01 -0.49 -0.41 120.40 119.55 3lhc s VAL 17 Ca 0.41 -0.33 -0.14 0.00 0.00 0.00 0.00 61.98 61.92 3lhc s VAL 17 Cb 0.23 -2.76 -0.05 0.00 0.00 0.00 0.00 36.38 33.80 3lhc s VAL 17 CO 0.32 0.44 0.32 -0.22 0.00 0.00 0.00 175.10 175.96 3lhc s LEU 18 N 0.88 4.24 -0.02 3.92 2.96 -0.43 -1.45 118.68 128.78 3lhc s LEU 18 Ca 0.01 0.54 0.07 0.00 -0.22 0.00 0.00 54.13 54.53 3lhc s LEU 18 Cb -0.14 -2.42 -0.02 0.00 0.50 0.00 0.00 46.19 44.11 3lhc s LEU 18 CO 0.02 0.08 -0.22 -0.89 -1.32 0.00 0.00 176.35 174.01 3lhc s THR 19 N 0.52 1.77 0.13 3.68 2.01 0.12 -0.83 115.64 123.04 3lhc s THR 19 Ca 0.18 -0.96 -0.18 0.00 0.31 0.00 0.00 61.69 61.03 3lhc s THR 19 Cb -0.13 -1.47 0.05 0.00 0.01 0.00 0.00 72.50 70.96 3lhc s THR 19 CO 0.05 0.50 0.46 -0.55 -0.69 0.00 0.00 174.62 174.39 3lhc s SER 20 N -0.54 -0.34 -0.25 3.53 0.15 -0.61 -0.78 113.70 114.86 3lhc s SER 20 Ca 0.09 -0.21 -0.04 0.00 0.70 0.00 0.00 55.95 56.49 3lhc s SER 20 Cb -0.09 0.51 0.01 0.00 -1.71 0.00 0.00 66.02 64.75 3lhc s SER 20 CO -0.01 -0.88 -0.02 -0.89 1.20 0.00 0.00 173.24 172.64 3lhc s THR 21 N -3.75 3.32 0.08 6.45 2.01 -0.48 -1.75 115.64 121.52 3lhc s THR 21 Ca 0.02 -0.79 0.09 0.00 0.31 0.00 0.00 61.69 61.32 3lhc s THR 21 Cb 0.01 -2.65 -0.03 0.00 0.01 0.00 0.00 72.50 69.84 3lhc s THR 21 CO -0.12 0.22 -0.24 0.00 -0.69 0.00 0.00 174.62 173.80 3lhc s GLU 23 N -1.57 4.47 0.41 0.00 2.02 -0.17 -1.36 118.70 122.48 3lhc s GLU 23 Ca 0.10 1.94 -0.03 0.00 0.02 0.00 0.00 54.97 57.00 3lhc s GLU 23 Cb -0.10 -3.21 -0.04 0.00 0.10 0.00 0.00 34.13 30.89 3lhc s GLU 23 CO 0.03 -0.12 0.67 1.03 0.02 0.00 0.00 175.26 176.90 3lhc s ARG 24 N -0.42 3.53 0.25 1.61 0.52 -0.14 -4.93 118.95 119.38 3lhc s ARG 24 Ca 0.53 -0.04 -0.02 0.00 -0.52 0.00 0.00 55.73 55.67 3lhc s ARG 24 Cb -0.34 -2.52 0.49 0.00 0.52 0.00 0.00 34.95 33.10 3lhc s ARG 24 CO 0.39 -0.02 1.76 1.15 0.02 0.00 0.00 175.30 178.60 3lhc h THR 25 N 0.54 0.74 0.00 0.02 2.02 -1.96 -2.23 112.91 112.05 3lhc h THR 25 Ca -0.48 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 66.49 3lhc h THR 25 Cb 1.21 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.71 3lhc h THR 25 CO 0.62 0.11 0.00 -0.46 0.37 0.00 0.00 175.52 176.16 3lhc n ASN 26 N -4.88 0.00 0.00 4.18 2.04 -1.26 -5.00 115.26 110.34 3lhc n ASN 26 Ca 0.16 -0.81 0.00 0.00 -0.44 0.00 0.00 54.58 53.49 3lhc n ASN 26 Cb 0.40 -0.05 0.00 0.00 -2.53 0.00 0.00 39.78 37.61 3lhc n ASN 26 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3lhc n GLY 27 N 0.93 1.38 0.53 4.83 0.00 -0.84 -5.11 105.19 106.92 3lhc n GLY 27 Ca 0.21 -1.91 0.07 0.00 0.00 0.00 0.00 46.02 44.40 3lhc n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3lhc n GLY 28 N 1.59 -1.54 3.17 -0.02 0.00 -1.26 -4.41 105.19 102.72 3lhc n GLY 28 Ca 0.00 -1.40 -0.11 0.00 0.00 0.00 0.00 46.02 44.52 3lhc n GLY 28 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3lhc s TYR 29 N -1.50 0.89 0.00 1.61 2.02 -1.26 -0.97 117.35 118.14 3lhc s TYR 29 Ca 0.00 -0.97 0.01 0.00 -0.37 0.00 0.00 57.07 55.73 3lhc s TYR 29 Cb 0.00 -0.53 -0.01 0.00 -0.40 0.00 0.00 41.96 41.03 3lhc s TYR 29 CO 0.00 -0.22 -0.03 1.21 -1.57 0.00 0.00 175.55 174.95 3lhc s ASN 30 N -3.05 0.27 -0.16 2.29 2.47 -0.47 -4.90 114.94 111.40 3lhc s ASN 30 Ca 0.14 -0.13 -0.06 0.00 0.42 0.00 0.00 52.86 53.22 3lhc s ASN 30 Cb 0.06 -0.00 -0.04 0.00 -1.45 0.00 0.00 41.25 39.82 3lhc s ASN 30 CO -0.04 -0.03 0.05 -0.89 -3.72 0.00 0.00 177.10 172.47 3lhc s THR 31 N -0.33 4.72 0.18 -5.21 2.01 -1.26 -0.58 115.64 115.18 3lhc s THR 31 Ca -0.02 -0.07 -0.07 0.00 0.31 0.00 0.00 61.69 61.84 3lhc s THR 31 Cb -0.03 -3.10 -0.02 0.00 0.01 0.00 0.00 72.50 69.37 3lhc s THR 31 CO -0.00 0.50 0.26 -0.94 -0.69 0.00 0.00 174.62 173.74 3lhc s SER 32 N 0.09 0.07 0.10 3.53 1.04 -0.71 -5.01 113.70 112.81 3lhc s SER 32 Ca 0.05 -1.01 0.04 0.00 0.48 0.00 0.00 55.95 55.51 3lhc s SER 32 Cb -0.12 0.43 -0.04 0.00 0.10 0.00 0.00 66.02 66.39 3lhc s SER 32 CO 0.01 -0.90 -0.10 -0.94 0.98 0.00 0.00 173.24 172.29 3lhc s SER 33 N -3.02 1.44 -0.02 7.02 1.04 -1.26 -1.57 113.70 117.34 3lhc s SER 33 Ca 0.22 -0.86 -0.00 0.00 0.48 0.00 0.00 55.95 55.80 3lhc s SER 33 Cb 0.04 0.02 0.03 0.00 0.10 0.00 0.00 66.02 66.20 3lhc s SER 33 CO 0.04 -0.29 0.02 -0.51 0.98 0.00 0.00 173.24 173.48 3lhc s ILE 34 N -2.67 -0.00 -0.40 -1.02 2.07 -0.01 -4.99 121.20 114.18 3lhc s ILE 34 Ca 0.07 0.20 -0.23 0.00 -1.41 0.00 0.00 60.65 59.28 3lhc s ILE 34 Cb -0.01 -0.14 0.01 0.00 0.13 0.00 0.00 42.46 42.45 3lhc s ILE 34 CO -0.01 0.11 0.77 -0.62 -1.91 0.00 0.00 174.94 173.29 3lhc s ASP 35 N 1.14 6.49 0.00 4.50 -1.08 -1.26 -1.31 116.67 125.15 3lhc s ASP 35 Ca -0.08 0.17 0.28 0.00 -0.52 0.00 0.00 52.55 52.40 3lhc s ASP 35 Cb -0.13 -2.39 1.08 0.00 -1.46 0.00 0.00 42.92 40.03 3lhc s ASP 35 CO -0.03 -0.79 1.76 0.18 0.52 0.00 0.00 175.17 176.82 3lhc n LEU 36 N 6.51 1.27 -0.32 -1.34 4.77 0.45 -4.47 117.00 123.87 3lhc n LEU 36 Ca 0.02 -0.41 0.03 0.00 -0.03 0.00 0.00 56.01 55.63 3lhc n LEU 36 Cb 0.48 -0.02 0.22 0.00 -2.33 0.00 0.00 43.42 41.77 3lhc n LEU 36 CO 0.55 0.22 1.25 -1.13 -1.33 0.00 0.00 177.39 176.95 3lhc h ASN 37 N 1.93 0.94 0.18 -1.43 -1.24 -1.88 -1.21 115.58 112.88 3lhc h ASN 37 Ca 0.00 0.01 0.00 0.00 0.71 0.00 0.00 56.30 57.02 3lhc h ASN 37 Cb 0.46 -0.20 0.00 0.00 0.73 0.00 0.00 38.32 39.31 3lhc h ASN 37 CO 0.00 0.61 -0.48 -1.54 -1.29 0.00 0.00 177.43 174.73 3lhc n SER 38 N -4.49 1.19 -0.10 1.15 3.41 -1.26 -4.53 113.62 109.00 3lhc n SER 38 Ca 0.14 -0.96 -0.13 0.00 -0.26 0.00 0.00 58.87 57.66 3lhc n SER 38 Cb 0.19 0.38 -0.04 0.00 -0.26 0.00 0.00 64.21 64.48 3lhc n SER 38 CO 0.00 0.00 0.00 1.33 -0.16 0.00 0.00 175.04 176.21 3lhc n VAL 39 N -0.77 1.49 -2.42 -3.33 0.24 -0.66 -4.97 118.33 107.91 3lhc n VAL 39 Ca 0.09 0.03 -0.41 0.00 -2.04 0.00 0.00 64.34 62.01 3lhc n VAL 39 Cb 0.38 -2.23 -0.04 0.00 -1.47 0.00 0.00 33.84 30.48 3lhc n VAL 39 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 3lhc s ILE 40 N -2.80 3.59 0.13 1.34 1.01 -0.55 -3.90 121.20 120.03 3lhc s ILE 40 Ca -0.30 1.40 0.08 0.00 0.00 0.00 0.00 60.65 61.83 3lhc s ILE 40 Cb 0.06 -3.89 -0.04 0.00 0.01 0.00 0.00 42.46 38.60 3lhc s ILE 40 CO 0.43 0.25 -0.11 0.00 0.00 0.00 0.00 174.94 175.51 3lhc s ALA 41 N -0.34 2.90 -0.29 9.38 0.00 0.15 -4.81 121.76 128.75 3lhc s ALA 41 Ca 0.50 -1.34 -0.09 0.00 0.00 0.00 0.00 51.96 51.03 3lhc s ALA 41 Cb -0.32 -0.79 -0.01 0.00 0.00 0.00 0.00 23.12 22.00 3lhc s ALA 41 CO 0.38 0.57 0.12 0.00 0.00 0.00 0.00 175.76 176.83 3lhc s ALA 42 N -1.37 3.21 -0.24 0.00 0.00 -1.26 -0.39 121.76 121.72 3lhc s ALA 42 Ca 0.22 -1.33 0.02 0.00 0.00 0.00 0.00 51.96 50.87 3lhc s ALA 42 Cb -0.10 -2.26 0.05 0.00 0.00 0.00 0.00 23.12 20.81 3lhc s ALA 42 CO 0.14 -0.79 -0.10 0.08 0.00 0.00 0.00 175.76 175.08 3lhc s VAL 43 N 1.60 1.89 -1.58 0.00 1.01 -0.01 -4.78 120.40 118.53 3lhc s VAL 43 Ca 0.05 -1.37 -0.09 0.00 0.00 0.00 0.00 61.98 60.57 3lhc s VAL 43 Cb -0.17 -2.02 0.08 0.00 0.00 0.00 0.00 36.38 34.27 3lhc s VAL 43 CO 0.05 0.02 0.51 -0.67 0.00 0.00 0.00 175.10 175.01 3lhc n ASP 44 N 4.55 -1.41 0.00 3.32 2.03 -1.26 -1.55 116.55 122.23 3lhc n ASP 44 Ca -0.14 -1.07 0.00 0.00 0.52 0.00 0.00 54.79 54.10 3lhc n ASP 44 Cb 0.44 -2.61 0.00 0.00 -0.72 0.00 0.00 41.12 38.23 3lhc n ASP 44 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3lhc n GLY 45 N -1.79 0.75 3.09 0.27 0.00 -1.26 -5.04 105.19 101.21 3lhc n GLY 45 Ca -0.13 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.62 3lhc n GLY 45 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3lhc s SER 46 N -2.56 2.19 0.11 1.61 0.15 -0.60 -5.12 113.70 109.49 3lhc s SER 46 Ca 0.00 -0.38 -0.30 0.00 0.70 0.00 0.00 55.95 55.97 3lhc s SER 46 Cb 0.00 -0.97 -0.06 0.00 -1.71 0.00 0.00 66.02 63.27 3lhc s SER 46 CO 0.00 0.08 1.14 -0.76 1.20 0.00 0.00 173.24 174.90 3lhc s LEU 47 N 0.51 4.42 0.08 3.45 1.43 -1.26 -0.83 118.68 126.48 3lhc s LEU 47 Ca -0.15 2.03 0.01 0.00 -1.03 0.00 0.00 54.13 54.99 3lhc s LEU 47 Cb -0.16 -3.59 -0.04 0.00 0.03 0.00 0.00 46.19 42.43 3lhc s LEU 47 CO 0.05 -0.34 -0.06 -0.54 0.23 0.00 0.00 176.35 175.69 3lhc s LYS 48 N 0.38 0.76 -0.46 1.70 -0.14 0.48 -4.97 119.74 117.50 3lhc s LYS 48 Ca 0.54 -1.28 -0.19 0.00 -1.36 0.00 0.00 55.97 53.68 3lhc s LYS 48 Cb -0.29 -0.11 0.04 0.00 -1.68 0.00 0.00 37.83 35.79 3lhc s LYS 48 CO 0.32 -0.04 0.58 -1.58 -0.76 0.00 0.00 175.35 173.87 3lhc s TRP 49 N -3.57 3.09 0.07 3.18 0.52 -1.26 -0.67 118.94 120.30 3lhc s TRP 49 Ca 0.09 -0.34 -0.14 0.00 0.02 0.00 0.00 56.10 55.74 3lhc s TRP 49 Cb 0.05 -3.30 -0.25 0.00 -1.15 0.00 0.00 33.47 28.83 3lhc s TRP 49 CO -0.06 -0.89 1.16 -1.00 0.02 0.00 0.00 176.95 176.19 3lhc h PRO 50 N 8.88 0.65 -2.69 4.98 0.13 -1.93 -3.49 132.00 138.53 3lhc h PRO 50 Ca -0.26 -0.77 0.00 0.00 -0.87 0.00 0.00 66.00 64.10 3lhc h PRO 50 Cb 1.10 0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.46 3lhc h PRO 50 CO 0.89 1.34 -0.69 -1.13 -0.23 0.00 0.00 178.00 178.18 3lhc n SER 51 N -3.82 -6.15 -4.58 1.44 3.41 -1.26 -4.88 113.62 97.79 3lhc n SER 51 Ca -0.12 1.30 -0.55 0.00 -0.26 0.00 0.00 58.87 59.24 3lhc n SER 51 Cb 0.92 -3.37 -0.07 0.00 -0.26 0.00 0.00 64.21 61.44 3lhc n SER 51 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 3lhc n ASN 52 N -2.15 1.14 0.26 4.04 3.02 -1.26 -4.85 115.26 115.47 3lhc n ASN 52 Ca 0.00 1.13 0.13 0.00 -0.03 0.00 0.00 54.58 55.81 3lhc n ASN 52 Cb 0.31 -1.09 0.68 0.00 -0.61 0.00 0.00 39.78 39.08 3lhc n ASN 52 CO 0.00 0.00 0.00 2.19 -2.62 0.00 0.00 177.26 176.83 3lhc h PHE 53 N 4.26 0.00 0.00 3.10 -5.15 -2.01 0.15 116.94 117.29 3lhc h PHE 53 Ca -0.49 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.28 3lhc h PHE 53 Cb 1.37 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.54 3lhc h PHE 53 CO 0.60 0.13 0.00 1.51 -2.00 0.00 0.00 178.31 178.55 3lhc n ILE 54 N -3.47 1.00 1.79 0.88 0.13 -1.26 -1.85 119.36 116.57 3lhc n ILE 54 Ca -0.01 0.26 0.16 0.00 -1.10 0.00 0.00 62.75 62.06 3lhc n ILE 54 Cb 0.29 -1.08 0.87 0.00 -0.84 0.00 0.00 39.64 38.87 3lhc n ILE 54 CO 0.00 0.00 0.00 -0.62 2.80 0.00 0.00 176.55 178.73 3lhc n GLU 55 N -1.72 0.83 0.00 9.51 1.02 0.52 -3.85 120.64 126.95 3lhc n GLU 55 Ca 0.03 -0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 3lhc n GLU 55 Cb 0.18 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.10 3lhc n GLU 55 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 3lhc n ALA 56 N -1.05 0.32 -2.51 0.62 0.00 -0.77 -5.07 120.51 112.05 3lhc n ALA 56 Ca 0.20 -0.06 -0.15 0.00 0.00 0.00 0.00 53.44 53.44 3lhc n ALA 56 Cb 0.16 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.51 3lhc n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3lhc s ARG 58 N -2.67 1.16 -1.21 0.00 1.70 0.41 -4.81 118.95 113.53 3lhc s ARG 58 Ca 0.05 -1.55 -0.00 0.00 -0.47 0.00 0.00 55.73 53.75 3lhc s ARG 58 Cb -0.04 -0.48 -0.00 0.00 -0.57 0.00 0.00 34.95 33.86 3lhc s ARG 58 CO 0.00 -0.06 0.95 -1.71 -1.08 0.00 0.00 175.30 173.41 3lhc n ASN 59 N -0.28 -2.13 -4.74 -2.89 4.05 -1.26 -1.59 115.26 106.41 3lhc n ASN 59 Ca -0.07 -0.65 -0.41 0.00 0.45 0.00 0.00 54.58 53.89 3lhc n ASN 59 Cb 0.63 -4.98 -0.03 0.00 1.23 0.00 0.00 39.78 36.63 3lhc n ASN 59 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 177.26 174.63 3lhc s THR 60 N -3.41 3.25 0.05 -0.44 -4.23 -1.26 -4.34 115.64 105.26 3lhc s THR 60 Ca 0.02 1.06 -0.06 0.00 -1.18 0.00 0.00 61.69 61.53 3lhc s THR 60 Cb -0.00 -3.68 -0.01 0.00 1.34 0.00 0.00 72.50 70.15 3lhc s THR 60 CO 0.74 0.17 0.10 -1.10 -0.54 0.00 0.00 174.62 174.00 3lhc s GLN 61 N -0.34 0.63 -0.17 3.99 -0.21 -0.24 -5.00 119.66 118.32 3lhc s GLN 61 Ca 0.55 -0.81 -0.23 0.00 0.02 0.00 0.00 55.36 54.89 3lhc s GLN 61 Cb -0.36 0.25 -0.02 0.00 1.00 0.00 0.00 33.01 33.88 3lhc s GLN 61 CO 0.39 -0.16 0.74 -1.17 -2.12 0.00 0.00 175.29 172.97 3lhc s LEU 62 N -2.28 4.18 -0.23 2.90 2.96 -1.26 -0.99 118.68 123.96 3lhc s LEU 62 Ca -0.03 1.04 -0.07 0.00 -0.22 0.00 0.00 54.13 54.85 3lhc s LEU 62 Cb 0.00 -3.08 -0.03 0.00 0.50 0.00 0.00 46.19 43.58 3lhc s LEU 62 CO -0.06 -0.32 0.07 0.00 -1.32 0.00 0.00 176.35 174.72 3lhc s ALA 63 N 1.92 3.24 0.00 5.97 0.00 0.62 -4.94 121.76 128.57 3lhc s ALA 63 Ca 0.34 -1.02 0.00 0.00 0.00 0.00 0.00 51.96 51.28 3lhc s ALA 63 Cb -0.16 -2.04 0.00 0.00 0.00 0.00 0.00 23.12 20.91 3lhc s ALA 63 CO 0.12 -0.30 0.00 0.41 0.00 0.00 0.00 175.76 175.99 3lhc n GLY 64 N 4.53 2.64 0.02 0.00 0.00 -1.26 -1.68 105.19 109.44 3lhc n GLY 64 Ca -0.16 -0.41 0.11 0.00 0.00 0.00 0.00 46.02 45.55 3lhc n GLY 64 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3lhc n SER 65 N 2.25 0.42 0.00 1.61 3.41 -1.26 -4.75 113.62 115.30 3lhc n SER 65 Ca 0.00 -0.23 0.00 0.00 -0.26 0.00 0.00 58.87 58.38 3lhc n SER 65 Cb 0.00 1.39 0.00 0.00 -0.26 0.00 0.00 64.21 65.34 3lhc n SER 65 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3lhc n SER 66 N -2.07 0.00 -4.82 4.04 3.41 -1.22 -5.05 113.62 107.91 3lhc n SER 66 Ca -0.01 -1.00 -0.37 0.00 -0.26 0.00 0.00 58.87 57.24 3lhc n SER 66 Cb 0.49 0.00 -0.06 0.00 -0.26 0.00 0.00 64.21 64.37 3lhc n SER 66 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 3lhc s GLU 67 N 0.00 3.78 -0.24 4.33 0.41 -0.68 -0.27 118.70 126.03 3lhc s GLU 67 Ca 0.00 0.00 -0.16 0.00 -0.41 0.00 0.00 54.97 54.41 3lhc s GLU 67 Cb 0.00 -3.27 -0.04 0.00 -1.78 0.00 0.00 34.13 29.05 3lhc s GLU 67 CO 0.00 0.61 0.40 -1.17 -0.49 0.00 0.00 175.26 174.61 3lhc s LEU 68 N -0.60 4.08 0.07 1.80 2.96 -0.02 -0.27 118.68 126.71 3lhc s LEU 68 Ca 0.16 0.41 0.06 0.00 -0.22 0.00 0.00 54.13 54.54 3lhc s LEU 68 Cb -0.13 -2.50 -0.04 0.00 0.50 0.00 0.00 46.19 44.03 3lhc s LEU 68 CO 0.05 -0.16 -0.10 0.00 -1.32 0.00 0.00 176.35 174.82 3lhc s ALA 69 N 1.82 2.92 0.29 5.97 0.00 -0.16 -1.01 121.76 131.60 3lhc s ALA 69 Ca 0.17 -1.18 -0.20 0.00 0.00 0.00 0.00 51.96 50.75 3lhc s ALA 69 Cb -0.15 -0.93 0.02 0.00 0.00 0.00 0.00 23.12 22.06 3lhc s ALA 69 CO 0.09 0.63 0.73 0.00 0.00 0.00 0.00 175.76 177.20 3lhc s ALA 70 N -1.12 -1.15 -0.16 0.00 0.00 -0.63 -1.08 121.76 117.61 3lhc s ALA 70 Ca 0.19 -0.37 -0.02 0.00 0.00 0.00 0.00 51.96 51.76 3lhc s ALA 70 Cb -0.11 0.83 -0.02 0.00 0.00 0.00 0.00 23.12 23.83 3lhc s ALA 70 CO 0.11 -1.03 -0.08 -1.21 0.00 0.00 0.00 175.76 173.55 3lhc s GLU 71 N -3.73 3.47 -0.03 0.00 2.02 -0.62 -1.36 118.70 118.44 3lhc s GLU 71 Ca 0.12 -0.62 0.05 0.00 0.02 0.00 0.00 54.97 54.53 3lhc s GLU 71 Cb -0.06 -2.81 -0.01 0.00 0.10 0.00 0.00 34.13 31.35 3lhc s GLU 71 CO 0.08 0.12 -0.17 0.00 0.02 0.00 0.00 175.26 175.30 3lhc s LYS 73 N -0.11 4.42 0.78 0.00 2.20 0.24 -1.33 119.74 125.93 3lhc s LYS 73 Ca -0.00 1.63 -0.12 0.00 -0.36 0.00 0.00 55.97 57.12 3lhc s LYS 73 Cb -0.10 -3.47 0.06 0.00 -1.51 0.00 0.00 37.83 32.81 3lhc s LYS 73 CO 0.01 -0.30 1.15 0.95 -0.36 0.00 0.00 175.35 176.80 3lhc s THR 74 N 1.62 2.43 0.51 3.43 -4.23 0.42 -4.91 115.64 114.91 3lhc s THR 74 Ca 0.55 0.12 0.17 0.00 -1.18 0.00 0.00 61.69 61.36 3lhc s THR 74 Cb -0.25 -3.13 0.31 0.00 1.34 0.00 0.00 72.50 70.76 3lhc s THR 74 CO 0.25 -0.17 2.09 0.00 -0.54 0.00 0.00 174.62 176.24 3lhc h ALA 75 N -0.93 2.10 0.00 3.99 0.00 -1.96 -0.45 119.26 122.01 3lhc h ALA 75 Ca -0.46 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.45 3lhc h ALA 75 Cb 1.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 3lhc h ALA 75 CO 0.65 -0.15 0.00 0.00 0.00 0.00 0.00 179.25 179.76 3lhc h ALA 76 N 1.89 1.00 0.00 0.00 0.00 -2.02 -3.47 119.26 116.66 3lhc h ALA 76 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 3lhc h ALA 76 Cb 0.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3lhc h ALA 76 CO -0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.65 3lhc n GLY 77 N 0.49 0.76 3.90 0.00 0.00 -0.18 -5.10 105.19 105.07 3lhc n GLY 77 Ca 0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 3lhc n GLY 77 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3lhc s GLN 78 N -0.49 3.59 -0.12 1.61 -2.07 -1.26 -4.75 119.66 116.17 3lhc s GLN 78 Ca 0.00 -0.14 -0.20 0.00 -1.82 0.00 0.00 55.36 53.20 3lhc s GLN 78 Cb 0.00 -2.86 -0.04 0.00 -1.09 0.00 0.00 33.01 29.02 3lhc s GLN 78 CO 0.00 0.47 0.54 -0.06 -1.32 0.00 0.00 175.29 174.92 3lhc s PHE 79 N -1.67 3.50 0.20 9.60 0.40 -1.26 -0.43 117.98 128.32 3lhc s PHE 79 Ca 0.40 0.96 0.10 0.00 -0.60 0.00 0.00 56.93 57.79 3lhc s PHE 79 Cb -0.12 -2.64 -0.05 0.00 0.51 0.00 0.00 43.02 40.73 3lhc s PHE 79 CO 0.25 0.10 -0.19 0.14 0.70 0.00 0.00 175.22 176.23 3lhc s VAL 80 N 0.85 2.02 0.26 -0.44 -7.23 -0.45 -4.84 120.40 110.59 3lhc s VAL 80 Ca 0.28 -2.12 -0.30 0.00 -1.81 0.00 0.00 61.98 58.04 3lhc s VAL 80 Cb -0.16 -2.04 -0.09 0.00 0.56 0.00 0.00 36.38 34.66 3lhc s VAL 80 CO 0.12 -0.38 1.09 -0.44 -0.31 0.00 0.00 175.10 175.18 3lhc s SER 81 N -3.02 7.29 0.07 4.85 0.01 -1.26 -0.55 113.70 121.10 3lhc s SER 81 Ca 0.21 2.22 -0.11 0.00 1.31 0.00 0.00 55.95 59.58 3lhc s SER 81 Cb -0.05 -2.62 0.01 0.00 0.21 0.00 0.00 66.02 63.57 3lhc s SER 81 CO 0.09 -0.13 0.24 0.28 0.41 0.00 0.00 173.24 174.13 3lhc s THR 82 N -1.01 0.11 0.13 1.44 -1.32 -0.46 -4.93 115.64 109.61 3lhc s THR 82 Ca 0.45 -0.94 -0.14 0.00 -1.21 0.00 0.00 61.69 59.85 3lhc s THR 82 Cb -0.31 -1.14 0.02 0.00 -1.51 0.00 0.00 72.50 69.56 3lhc s THR 82 CO 0.39 -0.52 0.36 -1.59 -2.21 0.00 0.00 174.62 171.06 3lhc s LYS 83 N -3.31 1.08 -0.11 7.08 -2.85 -1.26 -1.61 119.74 118.76 3lhc s LYS 83 Ca 0.01 -0.84 -0.10 0.00 -1.00 0.00 0.00 55.97 54.04 3lhc s LYS 83 Cb 0.02 0.44 0.03 0.00 -2.06 0.00 0.00 37.83 36.26 3lhc s LYS 83 CO -0.08 -0.41 0.29 -1.50 0.10 0.00 0.00 175.35 173.75 3lhc s ILE 84 N -3.85 -0.01 -0.50 3.79 2.07 -0.18 -4.99 121.20 117.54 3lhc s ILE 84 Ca 0.06 0.02 -0.26 0.00 -1.41 0.00 0.00 60.65 59.06 3lhc s ILE 84 Cb 0.02 -0.41 0.03 0.00 0.13 0.00 0.00 42.46 42.23 3lhc s ILE 84 CO -0.09 0.01 1.01 0.21 -1.91 0.00 0.00 174.94 174.17 3lhc s ASN 85 N 0.32 6.48 0.57 4.50 3.84 -1.26 -0.84 114.94 128.55 3lhc s ASN 85 Ca -0.01 0.07 0.32 0.00 0.21 0.00 0.00 52.86 53.45 3lhc s ASN 85 Cb -0.03 -2.48 1.75 0.00 -0.55 0.00 0.00 41.25 39.94 3lhc s ASN 85 CO -0.01 -1.20 2.18 -0.07 -2.79 0.00 0.00 177.10 175.22 3lhc h LEU 86 N 11.00 0.00 -1.31 3.21 3.38 -0.99 -0.40 115.31 130.21 3lhc h LEU 86 Ca -0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.73 3lhc h LEU 86 Cb 1.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.82 3lhc h LEU 86 CO 1.09 0.05 0.00 0.47 0.09 0.00 0.00 178.44 180.14 3lhc n ASP 87 N -3.57 0.54 -0.00 -0.43 8.00 -1.25 -0.98 116.55 118.86 3lhc n ASP 87 Ca -0.02 0.74 0.01 0.00 0.71 0.00 0.00 54.79 56.23 3lhc n ASP 87 Cb 0.16 -0.82 0.33 0.00 -0.02 0.00 0.00 41.12 40.77 3lhc n ASP 87 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 3lhc h ASP 88 N 0.00 0.49 0.00 -2.24 3.32 -1.43 -3.39 116.42 113.17 3lhc h ASP 88 Ca 0.00 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 56.98 3lhc h ASP 88 Cb 0.03 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.45 3lhc h ASP 88 CO 0.00 0.51 0.00 1.41 -1.72 0.00 0.00 179.24 179.44 3lhc n HIS 89 N -4.33 0.00 -3.63 4.55 8.25 -0.96 -5.01 115.22 114.10 3lhc n HIS 89 Ca 0.02 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.11 3lhc n HIS 89 Cb 0.20 0.00 -0.10 0.00 1.12 0.00 0.00 29.99 31.21 3lhc n HIS 89 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 3lhc s ILE 90 N 0.00 5.31 0.12 1.59 -1.09 -0.15 -0.72 121.20 126.26 3lhc s ILE 90 Ca 0.00 0.17 0.08 0.00 -2.23 0.00 0.00 60.65 58.67 3lhc s ILE 90 Cb 0.00 -3.50 -0.04 0.00 -1.58 0.00 0.00 42.46 37.34 3lhc s ILE 90 CO 0.00 0.30 -0.13 0.00 -1.23 0.00 0.00 174.94 173.88 3lhc s ALA 91 N 1.42 2.85 -0.62 9.38 0.00 0.06 -4.65 121.76 130.21 3lhc s ALA 91 Ca 0.07 -1.32 -0.22 0.00 0.00 0.00 0.00 51.96 50.48 3lhc s ALA 91 Cb -0.15 -0.78 0.06 0.00 0.00 0.00 0.00 23.12 22.26 3lhc s ALA 91 CO 0.08 0.60 0.91 1.21 0.00 0.00 0.00 175.76 178.56 3lhc s ASN 92 N -2.29 6.22 -0.53 0.00 2.47 -1.26 -1.14 114.94 118.41 3lhc s ASN 92 Ca 0.21 -0.86 -0.16 0.00 0.42 0.00 0.00 52.86 52.47 3lhc s ASN 92 Cb -0.11 -2.40 0.12 0.00 -1.45 0.00 0.00 41.25 37.41 3lhc s ASN 92 CO 0.13 -1.32 0.48 -0.63 -3.72 0.00 0.00 177.10 172.04 3lhc s ILE 93 N 3.83 5.19 -1.54 -5.21 -1.09 -0.20 -4.63 121.20 117.54 3lhc s ILE 93 Ca 0.23 -1.45 -0.05 0.00 -2.23 0.00 0.00 60.65 57.14 3lhc s ILE 93 Cb -0.16 -4.30 0.05 0.00 -1.58 0.00 0.00 42.46 36.47 3lhc s ILE 93 CO 0.12 -0.83 0.39 -0.67 -1.23 0.00 0.00 174.94 172.73 3lhc n ASP 94 N 5.23 -0.68 0.00 3.58 2.03 -1.26 -1.73 116.55 123.72 3lhc n ASP 94 Ca -0.14 -1.10 0.00 0.00 0.52 0.00 0.00 54.79 54.08 3lhc n ASP 94 Cb 0.40 -2.51 0.00 0.00 -0.72 0.00 0.00 41.12 38.30 3lhc n ASP 94 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3lhc n GLY 95 N -1.97 0.59 3.16 0.27 0.00 -1.26 -5.06 105.19 100.92 3lhc n GLY 95 Ca -0.21 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.54 3lhc n GLY 95 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3lhc s THR 96 N -2.33 1.58 0.03 2.61 2.01 -0.70 -5.10 115.64 113.73 3lhc s THR 96 Ca 0.00 -0.79 -0.30 0.00 0.31 0.00 0.00 61.69 60.90 3lhc s THR 96 Cb 0.00 -1.35 -0.06 0.00 0.01 0.00 0.00 72.50 71.10 3lhc s THR 96 CO 0.00 0.45 1.34 -0.76 -0.69 0.00 0.00 174.62 174.96 3lhc s LEU 97 N 0.04 4.33 0.00 4.42 1.43 -1.26 -1.03 118.68 126.61 3lhc s LEU 97 Ca -0.05 2.12 0.01 0.00 -1.03 0.00 0.00 54.13 55.17 3lhc s LEU 97 Cb -0.12 -3.57 -0.01 0.00 0.03 0.00 0.00 46.19 42.52 3lhc s LEU 97 CO 0.03 -0.65 -0.03 -0.54 0.23 0.00 0.00 176.35 175.40 3lhc s LYS 98 N 1.85 0.21 0.20 1.70 1.02 -0.29 -4.95 119.74 119.49 3lhc s LYS 98 Ca 0.62 -0.18 -0.30 0.00 0.02 0.00 0.00 55.97 56.14 3lhc s LYS 98 Cb -0.32 -0.15 -0.08 0.00 -0.52 0.00 0.00 37.83 36.76 3lhc s LYS 98 CO 0.27 0.04 1.04 -0.47 -0.92 0.00 0.00 175.35 175.31 3lhc s TYR 99 N -0.28 3.73 0.00 3.18 5.04 -1.26 -0.76 117.35 126.99 3lhc s TYR 99 Ca -0.02 1.73 0.00 0.00 -2.44 0.00 0.00 57.07 56.35 3lhc s TYR 99 Cb -0.02 -3.16 0.00 0.00 0.35 0.00 0.00 41.96 39.12 3lhc s TYR 99 CO -0.00 -0.19 0.00 -0.85 -1.34 0.00 0.00 175.55 173.17