#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lfb n PHE 14 N 0.00 0.00 -4.10 2.89 7.35 -1.26 -4.99 117.46 117.35 1lfb n PHE 14 Ca 0.00 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.58 1lfb n PHE 14 Cb 0.00 0.00 -0.11 0.00 0.35 0.00 0.00 39.48 39.72 1lfb n PHE 14 CO 0.00 0.00 0.00 0.21 -0.76 0.00 0.00 176.76 176.21 1lfb s LYS 15 N -3.83 0.63 0.24 -4.13 2.47 -1.26 -5.04 119.74 108.82 1lfb s LYS 15 Ca 0.00 -1.00 -0.30 0.00 -1.56 0.00 0.00 55.97 53.11 1lfb s LYS 15 Cb 0.00 -0.17 -0.09 0.00 -1.46 0.00 0.00 37.83 36.11 1lfb s LYS 15 CO 0.00 -0.00 1.09 -1.58 0.16 0.00 0.00 175.35 175.02 1lfb s TRP 16 N -2.46 3.62 0.13 4.03 0.52 -1.26 -4.92 118.94 118.60 1lfb s TRP 16 Ca -0.01 1.68 -0.05 0.00 0.02 0.00 0.00 56.10 57.74 1lfb s TRP 16 Cb -0.03 -3.26 -0.06 0.00 -1.15 0.00 0.00 33.47 28.98 1lfb s TRP 16 CO -0.03 -0.49 0.37 0.20 0.02 0.00 0.00 176.95 177.02 1lfb s GLY 17 N -0.63 2.24 0.53 0.98 0.00 -1.26 -4.95 107.32 104.23 1lfb s GLY 17 Ca 0.46 -0.55 0.34 0.00 0.00 0.00 0.00 44.72 44.97 1lfb s GLY 17 CO 0.38 -0.46 1.82 -0.56 0.00 0.00 0.00 173.10 174.28 1lfb h PRO 18 N 2.93 0.04 -0.06 2.90 0.13 -1.98 0.20 132.00 136.16 1lfb h PRO 18 Ca -0.46 -0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.66 1lfb h PRO 18 Cb 1.17 -0.01 -0.00 0.00 0.13 0.00 0.00 31.00 32.29 1lfb h PRO 18 CO 0.72 0.03 0.00 0.00 -0.23 0.00 0.00 178.00 178.52 1lfb h ALA 19 N 1.45 0.08 0.00 -0.56 0.00 -1.93 -2.37 119.26 115.93 1lfb h ALA 19 Ca 0.55 -0.17 -0.10 0.00 0.00 0.00 0.00 54.91 55.19 1lfb h ALA 19 Cb 2.10 -0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.85 1lfb h ALA 19 CO -0.04 -0.25 -0.47 0.66 0.00 0.00 0.00 179.25 179.16 1lfb h SER 20 N -0.18 0.00 -0.19 0.00 4.64 -1.17 -3.18 113.55 113.47 1lfb h SER 20 Ca 0.02 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.16 1lfb h SER 20 Cb 0.33 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.42 1lfb h SER 20 CO 0.00 0.47 -0.55 1.56 -0.87 0.00 0.00 176.83 177.44 1lfb h GLN 21 N 0.00 0.78 0.00 4.77 4.20 -0.60 -1.45 115.11 122.81 1lfb h GLN 21 Ca -0.00 -0.50 -0.04 0.00 0.06 0.00 0.00 58.65 58.17 1lfb h GLN 21 Cb 0.86 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.69 1lfb h GLN 21 CO 0.06 1.12 -0.21 -0.56 -0.67 0.00 0.00 178.83 178.58 1lfb h GLN 22 N 0.60 0.00 0.04 1.46 3.07 -1.43 0.83 115.11 119.67 1lfb h GLN 22 Ca 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.75 1lfb h GLN 22 Cb 1.14 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.70 1lfb h GLN 22 CO 0.12 0.21 -0.02 0.82 0.09 0.00 0.00 178.83 180.04 1lfb h ILE 23 N 0.00 1.08 0.02 1.86 5.03 -1.44 -2.29 117.51 121.77 1lfb h ILE 23 Ca -0.00 -0.38 -0.00 0.00 -0.12 0.00 0.00 64.86 64.36 1lfb h ILE 23 Cb 0.65 1.33 0.00 0.00 -3.03 0.00 0.00 36.82 35.77 1lfb h ILE 23 CO 0.03 0.10 -0.01 0.25 -0.68 0.00 0.00 178.15 177.84 1lfb h LEU 24 N -0.22 -0.02 -0.48 1.44 5.85 -0.70 -2.86 115.31 118.32 1lfb h LEU 24 Ca -0.01 -0.33 0.01 0.00 0.84 0.00 0.00 57.88 58.40 1lfb h LEU 24 Cb 0.20 0.01 -0.03 0.00 0.37 0.00 0.00 40.66 41.21 1lfb h LEU 24 CO 0.01 0.32 0.31 -0.26 -0.34 0.00 0.00 178.44 178.47 1lfb h PHE 25 N -0.36 0.58 -1.17 1.25 0.04 -0.94 -2.08 116.94 114.26 1lfb h PHE 25 Ca -0.00 0.02 0.37 0.00 2.80 0.00 0.00 57.97 61.15 1lfb h PHE 25 Cb 0.34 -0.19 -0.13 0.00 2.20 0.00 0.00 35.95 38.17 1lfb h PHE 25 CO 0.04 0.36 0.74 0.37 -0.60 0.00 0.00 178.31 179.21 1lfb h GLN 26 N 0.63 0.20 0.02 1.51 5.75 -1.34 -2.43 115.11 119.45 1lfb h GLN 26 Ca 0.18 -0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.63 1lfb h GLN 26 Cb -0.04 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.47 1lfb h GLN 26 CO -0.06 0.13 -0.19 0.00 -2.65 0.00 0.00 178.83 176.07 1lfb h ALA 27 N 1.67 -0.01 -0.88 3.38 0.00 -1.15 -3.35 119.26 118.91 1lfb h ALA 27 Ca 0.75 -0.51 0.19 0.00 0.00 0.00 0.00 54.91 55.34 1lfb h ALA 27 Cb 2.12 0.02 -0.07 0.00 0.00 0.00 0.00 17.79 19.86 1lfb h ALA 27 CO -0.44 0.07 0.58 -0.92 0.00 0.00 0.00 179.25 178.54 1lfb h TYR 28 N -0.76 0.57 -0.18 0.00 5.03 -1.07 -0.76 116.97 119.80 1lfb h TYR 28 Ca -0.03 0.02 0.00 0.00 2.58 0.00 0.00 58.73 61.30 1lfb h TYR 28 Cb 1.08 -0.18 0.00 0.00 1.55 0.00 0.00 36.73 39.18 1lfb h TYR 28 CO 0.23 0.17 0.00 -0.85 -1.32 0.00 0.00 178.16 176.39 1lfb n GLU 29 N -4.52 1.58 -0.02 1.82 0.28 -1.21 -2.33 120.64 116.24 1lfb n GLU 29 Ca 0.18 -0.71 -0.03 0.00 -0.16 0.00 0.00 57.16 56.44 1lfb n GLU 29 Cb 0.65 -1.29 -0.03 0.00 1.43 0.00 0.00 31.44 32.20 1lfb n GLU 29 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 1lfb n ARG 30 N 0.08 1.78 -3.46 3.44 3.00 -0.38 -5.01 116.66 116.11 1lfb n ARG 30 Ca 0.07 0.01 -0.04 0.00 -0.01 0.00 0.00 57.85 57.88 1lfb n ARG 30 Cb 0.24 -1.11 -0.06 0.00 0.00 0.00 0.00 32.46 31.53 1lfb n ARG 30 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.63 176.49 1lfb s GLN 31 N -2.11 0.44 0.00 5.56 -0.44 -0.66 -5.04 119.66 117.41 1lfb s GLN 31 Ca -0.05 0.99 0.20 0.00 -2.50 0.00 0.00 55.36 54.00 1lfb s GLN 31 Cb 0.02 0.30 0.66 0.00 -1.64 0.00 0.00 33.01 32.34 1lfb s GLN 31 CO 0.16 -0.42 1.50 0.36 0.50 0.00 0.00 175.29 177.38 1lfb n LYS 32 N 5.41 1.81 -3.15 1.67 2.85 -0.98 -3.73 118.16 122.03 1lfb n LYS 32 Ca -0.06 -1.23 -0.23 0.00 -1.05 0.00 0.00 58.31 55.74 1lfb n LYS 32 Cb 0.50 -1.39 -0.05 0.00 -0.65 0.00 0.00 35.03 33.44 1lfb n LYS 32 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1lfb n ASN 33 N 0.45 2.27 -4.77 -5.58 4.13 -1.26 -4.81 115.26 105.69 1lfb n ASN 33 Ca 0.16 -3.22 -0.40 0.00 1.68 0.00 0.00 54.58 52.80 1lfb n ASN 33 Cb 0.35 -0.61 0.01 0.00 -1.54 0.00 0.00 39.78 37.98 1lfb n ASN 33 CO 0.00 0.00 0.00 -2.16 0.28 0.00 0.00 177.26 175.38 1lfb s PRO 34 N -2.51 3.86 0.53 3.52 0.04 -1.26 -4.99 135.00 134.19 1lfb s PRO 34 Ca 0.42 2.33 -0.09 0.00 0.04 0.00 0.00 61.00 63.69 1lfb s PRO 34 Cb 0.26 -2.74 0.13 0.00 0.04 0.00 0.00 34.50 32.19 1lfb s PRO 34 CO -0.09 -0.64 0.59 -1.13 0.04 0.00 0.00 177.00 175.77 1lfb n SER 35 N 0.03 -0.68 0.26 6.66 3.41 -1.26 -4.74 113.62 117.31 1lfb n SER 35 Ca 0.04 -1.04 -0.16 0.00 -0.26 0.00 0.00 58.87 57.45 1lfb n SER 35 Cb 0.42 -0.49 -0.08 0.00 -0.26 0.00 0.00 64.21 63.80 1lfb n SER 35 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1lfb h LYS 36 N 0.00 -0.68 -0.69 4.33 1.79 -2.00 -1.39 116.57 117.93 1lfb h LYS 36 Ca -0.20 0.05 -0.07 0.00 -2.18 0.00 0.00 60.65 58.24 1lfb h LYS 36 Cb 0.59 0.15 -0.03 0.00 -1.58 0.00 0.00 32.23 31.37 1lfb h LYS 36 CO 0.14 -0.45 0.15 0.93 -1.08 0.00 0.00 179.45 179.14 1lfb h GLU 37 N -0.71 1.12 -0.48 3.15 3.07 -2.00 -2.65 114.58 116.08 1lfb h GLU 37 Ca -0.05 -0.28 -0.02 0.00 -0.50 0.00 0.00 59.36 58.51 1lfb h GLU 37 Cb 0.59 -0.14 -0.02 0.00 -0.84 0.00 0.00 28.75 28.33 1lfb h GLU 37 CO 0.04 1.00 0.21 0.93 -1.40 0.00 0.00 179.01 179.79 1lfb h GLU 38 N 1.05 0.70 -0.33 2.33 3.07 -1.85 -2.75 114.58 116.81 1lfb h GLU 38 Ca 0.22 -0.11 0.07 0.00 -0.50 0.00 0.00 59.36 59.03 1lfb h GLU 38 Cb 0.39 -0.12 -0.06 0.00 -0.84 0.00 0.00 28.75 28.12 1lfb h GLU 38 CO 0.01 0.61 -0.07 -0.09 -1.40 0.00 0.00 179.01 178.06 1lfb h ARG 39 N 0.63 0.01 0.00 2.33 2.43 -0.98 0.33 114.38 119.13 1lfb h ARG 39 Ca 0.16 -0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.32 1lfb h ARG 39 Cb 0.15 -0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.70 1lfb h ARG 39 CO -0.02 0.01 -0.04 0.93 -1.51 0.00 0.00 179.97 179.34 1lfb h GLU 40 N 0.01 0.00 0.35 0.20 4.39 -1.33 -0.84 114.58 117.35 1lfb h GLU 40 Ca 0.16 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.84 1lfb h GLU 40 Cb 0.24 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.89 1lfb h GLU 40 CO -0.33 0.04 -0.17 1.15 -1.16 0.00 0.00 179.01 178.54 1lfb h THR 41 N 0.00 0.65 -0.04 1.13 2.02 -0.67 -3.03 112.91 112.96 1lfb h THR 41 Ca -0.00 -0.48 0.01 0.00 0.77 0.00 0.00 66.41 66.71 1lfb h THR 41 Cb 0.08 0.88 -0.00 0.00 -1.74 0.00 0.00 68.15 67.37 1lfb h THR 41 CO 0.01 0.09 0.10 -0.07 0.37 0.00 0.00 175.52 176.01 1lfb h LEU 42 N -0.74 0.00 0.08 2.58 -0.00 -0.40 -0.37 115.31 116.46 1lfb h LEU 42 Ca -0.05 0.00 -0.00 0.00 -0.00 0.00 0.00 57.88 57.83 1lfb h LEU 42 Cb 0.50 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 41.17 1lfb h LEU 42 CO 0.08 0.00 -0.04 0.58 -0.00 0.00 0.00 178.44 179.06 1lfb h VAL 43 N 0.00 1.19 -0.19 1.22 2.07 -1.25 -1.45 116.25 117.84 1lfb h VAL 43 Ca 0.02 -1.18 0.03 0.00 0.82 0.00 0.00 66.70 66.39 1lfb h VAL 43 Cb 0.21 1.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.85 1lfb h VAL 43 CO -0.00 0.28 -0.42 -0.08 0.02 0.00 0.00 177.57 177.37 1lfb h GLU 44 N -0.66 -0.37 -0.02 1.57 4.22 -0.98 -0.77 114.58 117.55 1lfb h GLU 44 Ca -0.01 0.03 0.01 0.00 0.08 0.00 0.00 59.36 59.46 1lfb h GLU 44 Cb 0.54 0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.87 1lfb h GLU 44 CO 0.02 -0.25 0.33 0.93 -2.18 0.00 0.00 179.01 177.86 1lfb h GLU 45 N -0.39 0.00 0.04 1.92 4.39 -1.38 -1.46 114.58 117.70 1lfb h GLU 45 Ca 0.04 0.00 -0.27 0.00 0.34 0.00 0.00 59.36 59.47 1lfb h GLU 45 Cb 0.49 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.11 1lfb h GLU 45 CO -0.38 0.00 -1.44 0.00 -1.16 0.00 0.00 179.01 176.03 1lfb h ASN 47 N -0.69 -0.21 0.56 0.00 2.35 -0.27 0.27 115.58 117.59 1lfb h ASN 47 Ca -0.36 0.01 -0.02 0.00 -0.55 0.00 0.00 56.30 55.38 1lfb h ASN 47 Cb 1.51 0.06 -0.01 0.00 0.05 0.00 0.00 38.32 39.94 1lfb h ASN 47 CO -0.12 -0.14 -0.40 -0.09 -1.65 0.00 0.00 177.43 175.03 1lfb h ARG 48 N -0.22 -0.89 -1.20 0.81 2.43 -1.51 0.31 114.38 114.11 1lfb h ARG 48 Ca -0.01 0.06 0.34 0.00 -0.81 0.00 0.00 59.98 59.56 1lfb h ARG 48 Cb 0.19 0.20 -0.09 0.00 -0.42 0.00 0.00 29.97 29.85 1lfb h ARG 48 CO 0.01 -0.59 0.80 0.00 -1.51 0.00 0.00 179.97 178.68 1lfb h ALA 49 N -1.25 2.66 -0.16 2.80 0.00 -1.53 0.21 119.26 122.00 1lfb h ALA 49 Ca -0.07 0.04 -0.19 0.00 0.00 0.00 0.00 54.91 54.69 1lfb h ALA 49 Cb 0.75 0.10 0.01 0.00 0.00 0.00 0.00 17.79 18.65 1lfb h ALA 49 CO 0.04 -1.12 -0.64 0.93 0.00 0.00 0.00 179.25 178.47 1lfb h GLU 50 N 0.20 0.71 0.40 0.00 4.39 0.14 -3.23 114.58 117.19 1lfb h GLU 50 Ca 0.66 -0.55 -0.01 0.00 0.34 0.00 0.00 59.36 59.81 1lfb h GLU 50 Cb 2.08 0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 30.82 1lfb h GLU 50 CO -0.25 1.17 -0.36 0.00 -1.16 0.00 0.00 179.01 178.41 1lfb n ILE 52 N -5.47 0.00 -0.07 0.00 -5.35 -0.22 0.74 119.36 108.98 1lfb n ILE 52 Ca -0.10 0.00 -0.15 0.00 -0.27 0.00 0.00 62.75 62.22 1lfb n ILE 52 Cb 0.37 -0.79 -0.14 0.00 -1.74 0.00 0.00 39.64 37.35 1lfb n ILE 52 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1lfb n GLN 53 N -0.94 0.68 -0.03 6.28 1.13 -0.92 -4.25 117.38 119.33 1lfb n GLN 53 Ca 0.06 0.16 0.01 0.00 -1.94 0.00 0.00 57.00 55.29 1lfb n GLN 53 Cb 0.03 -1.61 0.03 0.00 0.11 0.00 0.00 30.24 28.80 1lfb n GLN 53 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1lfb n ARG 54 N -3.16 1.15 -3.58 -1.09 1.74 0.23 -4.84 116.66 107.11 1lfb n ARG 54 Ca -0.35 -0.21 -0.26 0.00 -0.77 0.00 0.00 57.85 56.26 1lfb n ARG 54 Cb 1.05 -1.10 0.04 0.00 -1.02 0.00 0.00 32.46 31.42 1lfb n ARG 54 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1lfb n GLY 55 N 0.53 -0.51 3.48 -0.13 0.00 -1.12 -4.97 105.19 102.46 1lfb n GLY 55 Ca 0.02 0.18 -0.30 0.00 0.00 0.00 0.00 46.02 45.92 1lfb n GLY 55 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1lfb s VAL 56 N -3.22 2.82 0.15 1.61 1.01 -1.14 -5.06 120.40 116.56 1lfb s VAL 56 Ca 0.54 -1.40 -0.29 0.00 0.00 0.00 0.00 61.98 60.83 1lfb s VAL 56 Cb -0.26 -2.25 -0.07 0.00 0.00 0.00 0.00 36.38 33.80 1lfb s VAL 56 CO 0.66 0.18 0.90 -0.55 0.00 0.00 0.00 175.10 176.30 1lfb s SER 57 N -1.90 7.49 0.35 3.32 0.15 -1.26 -3.95 113.70 117.91 1lfb s SER 57 Ca 0.17 1.78 0.18 0.00 0.70 0.00 0.00 55.95 58.77 1lfb s SER 57 Cb -0.11 -2.57 1.23 0.00 -1.71 0.00 0.00 66.02 62.87 1lfb s SER 57 CO 0.08 0.06 1.52 -2.65 1.20 0.00 0.00 173.24 173.45 1lfb n PRO 58 N 2.19 -0.06 0.18 5.44 -0.02 -1.26 -1.10 135.00 140.37 1lfb n PRO 58 Ca -0.01 1.34 0.02 0.00 -2.02 0.00 0.00 63.50 62.83 1lfb n PRO 58 Cb 0.49 -2.37 0.34 0.00 -0.02 0.00 0.00 33.50 31.94 1lfb n PRO 58 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1lfb h SER 59 N 0.00 0.01 -2.31 2.55 4.64 -2.00 -3.00 113.55 113.44 1lfb h SER 59 Ca 0.79 -0.00 -0.79 0.00 -0.47 0.00 0.00 61.79 61.32 1lfb h SER 59 Cb 2.05 -0.00 -0.23 0.00 -0.31 0.00 0.00 62.40 63.91 1lfb h SER 59 CO -0.76 0.40 1.26 0.00 -0.87 0.00 0.00 176.83 176.86 1lfb n GLN 60 N -4.08 4.34 0.14 4.77 1.13 -0.26 -4.61 117.38 118.81 1lfb n GLN 60 Ca -0.02 -4.21 0.13 0.00 -1.94 0.00 0.00 57.00 50.96 1lfb n GLN 60 Cb 0.42 -2.63 0.47 0.00 0.11 0.00 0.00 30.24 28.61 1lfb n GLN 60 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1lfb h ALA 61 N 5.36 1.00 -0.00 -1.58 0.00 -1.65 -1.74 119.26 120.65 1lfb h ALA 61 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1lfb h ALA 61 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1lfb h ALA 61 CO 1.42 0.00 -0.08 0.94 0.00 0.00 0.00 179.25 181.53 1lfb n GLN 62 N -2.36 0.31 -0.33 0.00 0.00 -1.26 -3.72 117.38 110.02 1lfb n GLN 62 Ca 0.03 -0.06 0.01 0.00 -0.00 0.00 0.00 57.00 56.99 1lfb n GLN 62 Cb 0.31 -1.50 0.19 0.00 0.00 0.00 0.00 30.24 29.24 1lfb n GLN 62 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.06 177.84 1lfb h GLY 63 N 4.99 1.35 -0.63 1.69 0.00 -1.68 -2.97 103.07 105.83 1lfb h GLY 63 Ca 0.00 -0.46 0.35 0.00 0.00 0.00 0.00 47.33 47.22 1lfb h GLY 63 CO 0.00 0.39 0.68 1.41 0.00 0.00 0.00 176.54 179.02 1lfb h LEU 64 N 1.16 0.41 0.00 3.11 3.38 -1.77 -3.48 115.31 118.12 1lfb h LEU 64 Ca 0.38 0.15 0.00 0.00 0.09 0.00 0.00 57.88 58.50 1lfb h LEU 64 Cb 0.04 0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1lfb h LEU 64 CO -0.12 -0.10 0.00 0.61 0.09 0.00 0.00 178.44 178.92 1lfb n GLY 65 N -1.41 0.56 0.58 0.83 0.00 -1.12 -3.31 105.19 101.32 1lfb n GLY 65 Ca 0.32 -0.86 0.43 0.00 0.00 0.00 0.00 46.02 45.91 1lfb n GLY 65 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1lfb h SER 66 N 8.75 0.11 -0.03 1.61 0.02 -1.93 -1.88 113.55 120.19 1lfb h SER 66 Ca 0.00 0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 60.99 1lfb h SER 66 Cb 0.00 0.05 -0.01 0.00 0.14 0.00 0.00 62.40 62.58 1lfb h SER 66 CO 0.00 -0.07 0.02 0.59 -1.14 0.00 0.00 176.83 176.24 1lfb n ASN 67 N -4.29 3.95 -4.61 3.07 3.02 -1.21 -4.75 115.26 110.45 1lfb n ASN 67 Ca 0.38 -2.21 -0.40 0.00 -0.03 0.00 0.00 54.58 52.32 1lfb n ASN 67 Cb 1.62 -0.75 -0.08 0.00 -0.61 0.00 0.00 39.78 39.96 1lfb n ASN 67 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 1lfb s LEU 68 N -0.11 4.10 -0.66 3.41 2.96 -0.71 -4.93 118.68 122.74 1lfb s LEU 68 Ca 0.02 0.41 -0.27 0.00 -0.22 0.00 0.00 54.13 54.07 1lfb s LEU 68 Cb 0.02 -2.64 -0.00 0.00 0.50 0.00 0.00 46.19 44.06 1lfb s LEU 68 CO 0.00 -0.32 1.66 -0.69 -1.32 0.00 0.00 176.35 175.68 1lfb s VAL 69 N 2.33 3.48 0.54 1.68 1.01 -1.26 -4.96 120.40 123.22 1lfb s VAL 69 Ca 0.21 0.27 -0.19 0.00 0.00 0.00 0.00 61.98 62.26 1lfb s VAL 69 Cb -0.16 -4.28 -0.06 0.00 0.00 0.00 0.00 36.38 31.89 1lfb s VAL 69 CO 0.10 -1.24 1.12 0.42 0.00 0.00 0.00 175.10 175.51 1lfb s THR 70 N 7.94 3.21 -0.04 3.92 -4.23 -1.26 -4.89 115.64 120.28 1lfb s THR 70 Ca 0.56 0.75 0.30 0.00 -1.18 0.00 0.00 61.69 62.12 1lfb s THR 70 Cb -0.11 -3.30 0.32 0.00 1.34 0.00 0.00 72.50 70.75 1lfb s THR 70 CO 0.18 -0.17 1.90 1.05 -0.54 0.00 0.00 174.62 177.05 1lfb h GLU 71 N 1.21 0.00 -0.35 3.99 -0.00 -1.94 -2.17 114.58 115.31 1lfb h GLU 71 Ca -0.50 0.00 -0.08 0.00 -0.00 0.00 0.00 59.36 58.78 1lfb h GLU 71 Cb 1.26 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 29.99 1lfb h GLU 71 CO 0.57 0.00 -0.11 0.28 -0.00 0.00 0.00 179.01 179.75 1lfb h VAL 72 N 0.00 1.24 0.00 -1.06 2.07 -1.99 -1.40 116.25 115.11 1lfb h VAL 72 Ca 0.00 -1.07 -0.10 0.00 0.82 0.00 0.00 66.70 66.35 1lfb h VAL 72 Cb 0.25 1.09 -0.01 0.00 -1.52 0.00 0.00 31.29 31.09 1lfb h VAL 72 CO 0.00 0.36 -0.49 0.03 0.02 0.00 0.00 177.57 177.49 1lfb h ARG 73 N 0.56 0.00 -0.13 1.57 3.08 -1.77 0.62 114.38 118.31 1lfb h ARG 73 Ca 0.10 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.99 1lfb h ARG 73 Cb 0.52 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.58 1lfb h ARG 73 CO 0.03 0.49 -0.56 0.28 -1.07 0.00 0.00 179.97 179.14 1lfb h VAL 74 N 0.00 1.34 0.66 2.04 2.07 -1.48 -1.01 116.25 119.87 1lfb h VAL 74 Ca -0.00 -1.84 -0.03 0.00 0.82 0.00 0.00 66.70 65.65 1lfb h VAL 74 Cb 0.99 2.08 -0.01 0.00 -1.52 0.00 0.00 31.29 32.84 1lfb h VAL 74 CO 0.06 0.56 -0.46 0.22 0.02 0.00 0.00 177.57 177.98 1lfb h TYR 75 N 0.27 -1.24 -0.69 1.57 3.20 -0.59 -2.57 116.97 116.92 1lfb h TYR 75 Ca -0.03 -0.01 0.10 0.00 3.14 0.00 0.00 58.73 61.94 1lfb h TYR 75 Cb 1.20 0.46 -0.08 0.00 1.54 0.00 0.00 36.73 39.85 1lfb h TYR 75 CO 0.10 -0.66 0.31 -0.91 -1.64 0.00 0.00 178.16 175.35 1lfb h ASN 76 N -1.07 0.35 -0.71 -2.11 -0.26 -0.92 -0.37 115.58 110.49 1lfb h ASN 76 Ca -0.09 0.08 0.14 0.00 -0.56 0.00 0.00 56.30 55.87 1lfb h ASN 76 Cb 0.87 0.03 -0.10 0.00 -1.06 0.00 0.00 38.32 38.06 1lfb h ASN 76 CO 0.05 0.19 0.24 -0.25 -1.06 0.00 0.00 177.43 176.60 1lfb h TRP 77 N 0.51 0.40 -0.02 1.19 7.01 -0.98 0.22 115.95 124.28 1lfb h TRP 77 Ca 0.35 0.04 -0.01 0.00 2.11 0.00 0.00 58.89 61.38 1lfb h TRP 77 Cb 0.43 -0.07 -0.00 0.00 -2.10 0.00 0.00 29.16 27.42 1lfb h TRP 77 CO -0.14 0.02 -0.01 0.74 -2.79 0.00 0.00 178.44 176.26 1lfb h PHE 78 N 0.37 0.05 -0.64 2.65 0.04 -0.75 0.22 116.94 118.89 1lfb h PHE 78 Ca 0.39 -0.01 0.12 0.00 2.80 0.00 0.00 57.97 61.27 1lfb h PHE 78 Cb 0.60 -0.01 -0.12 0.00 2.20 0.00 0.00 35.95 38.62 1lfb h PHE 78 CO -0.20 0.48 -0.22 0.00 -0.60 0.00 0.00 178.31 177.78 1lfb h ALA 79 N 0.56 0.30 -0.02 2.45 0.00 -0.11 0.08 119.26 122.51 1lfb h ALA 79 Ca 0.00 0.23 -0.16 0.00 0.00 0.00 0.00 54.91 54.99 1lfb h ALA 79 Cb 0.47 0.59 -0.02 0.00 0.00 0.00 0.00 17.79 18.83 1lfb h ALA 79 CO 0.00 -0.50 -0.72 -0.97 0.00 0.00 0.00 179.25 177.07 1lfb h ASN 80 N -0.05 0.13 0.64 0.00 -1.24 -0.50 -1.30 115.58 113.25 1lfb h ASN 80 Ca 0.29 -0.09 -0.16 0.00 0.71 0.00 0.00 56.30 57.06 1lfb h ASN 80 Cb 0.51 -0.04 -0.02 0.00 0.73 0.00 0.00 38.32 39.50 1lfb h ASN 80 CO -0.68 0.80 -0.73 -0.09 -1.29 0.00 0.00 177.43 175.44 1lfb h ARG 81 N 0.07 0.07 -0.34 6.67 9.65 0.08 -2.85 114.38 127.73 1lfb h ARG 81 Ca -0.02 -0.06 -0.14 0.00 -1.10 0.00 0.00 59.98 58.66 1lfb h ARG 81 Cb 1.27 0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 29.85 1lfb h ARG 81 CO 0.10 0.77 -0.37 0.00 2.80 0.00 0.00 179.97 183.27 1lfb h ARG 82 N 0.05 0.79 -0.68 0.20 3.08 -0.23 -2.88 114.38 114.71 1lfb h ARG 82 Ca -0.01 -0.40 0.15 0.00 0.07 0.00 0.00 59.98 59.78 1lfb h ARG 82 Cb 1.29 0.00 -0.11 0.00 0.08 0.00 0.00 29.97 31.23 1lfb h ARG 82 CO 0.10 1.03 0.05 0.87 -1.07 0.00 0.00 179.97 180.95 1lfb h LYS 83 N 0.66 0.15 0.00 0.04 1.57 -1.14 -1.31 116.57 116.54 1lfb h LYS 83 Ca 0.06 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1lfb h LYS 83 Cb 0.92 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 33.20 1lfb h LYS 83 CO 0.08 0.10 0.00 0.39 -0.57 0.00 0.00 179.45 179.45 1lfb n GLU 84 N -5.26 0.18 0.11 3.15 1.02 -1.09 0.42 120.64 119.18 1lfb n GLU 84 Ca 0.11 0.48 0.04 0.00 -0.02 0.00 0.00 57.16 57.78 1lfb n GLU 84 Cb 0.41 -1.90 0.01 0.00 -0.02 0.00 0.00 31.44 29.93 1lfb n GLU 84 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1lfb h GLU 85 N 0.00 0.00 -5.65 3.49 5.08 -1.27 -3.41 114.58 112.81 1lfb h GLU 85 Ca 0.00 0.00 -0.48 0.00 -1.00 0.00 0.00 59.36 57.88 1lfb h GLU 85 Cb 0.27 0.00 -0.06 0.00 0.50 0.00 0.00 28.75 29.46 1lfb h GLU 85 CO 0.00 0.29 1.56 0.00 -1.00 0.00 0.00 179.01 179.86 1lfb s ALA 86 N -3.04 2.47 0.00 3.43 0.00 0.17 -4.87 121.76 119.91 1lfb s ALA 86 Ca 0.02 -2.47 0.00 0.00 0.00 0.00 0.00 51.96 49.50 1lfb s ALA 86 Cb 0.08 -4.66 0.00 0.00 0.00 0.00 0.00 23.12 18.54 1lfb s ALA 86 CO 0.76 -4.37 0.00 1.97 0.00 0.00 0.00 175.76 174.13 1lfb n PHE 87 N 11.71 0.00 -0.04 0.00 1.16 -1.26 -4.98 117.46 124.05 1lfb n PHE 87 Ca 0.46 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 56.04 1lfb n PHE 87 Cb 0.46 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.33 1lfb n PHE 87 CO 0.00 0.00 0.00 2.89 -1.87 0.00 0.00 176.76 177.78 1lfb n ARG 88 N 0.00 3.03 0.00 3.97 0.00 -1.26 -4.97 116.66 117.43 1lfb n ARG 88 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1lfb n ARG 88 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 32.46 32.46 1lfb n ARG 88 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 1lfb n HIS 89 N 0.00 0.00 0.00 2.89 -0.00 -1.26 -5.23 115.22 111.62 1lfb n HIS 89 Ca 0.00 0.00 0.00 0.00 0.46 0.00 0.00 57.72 58.18 1lfb n HIS 89 Cb 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 29.99 29.87 1lfb n HIS 89 CO 0.00 0.00 0.00 1.17 0.46 0.00 0.00 176.34 177.97