#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3lb6 n PRO 6 N 0.00 0.66 0.00 0.52 -0.05 -1.26 -4.35 135.00 130.52 3lb6 n PRO 6 Ca 0.00 -0.05 0.13 0.00 -0.05 0.00 0.00 63.50 63.53 3lb6 n PRO 6 Cb 0.00 -1.59 0.35 0.00 -0.05 0.00 0.00 33.50 32.21 3lb6 n PRO 6 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 175.50 174.32 3lb6 n SER 7 N -2.54 1.48 -0.35 3.54 3.41 -1.26 -4.28 113.62 113.62 3lb6 n SER 7 Ca -0.13 -1.26 0.01 0.00 -0.26 0.00 0.00 58.87 57.23 3lb6 n SER 7 Cb 0.78 0.12 0.14 0.00 -0.26 0.00 0.00 64.21 64.99 3lb6 n SER 7 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3lb6 h THR 8 N 2.04 1.12 -0.04 6.66 1.35 -1.98 0.40 112.91 122.46 3lb6 h THR 8 Ca 0.00 -0.40 0.03 0.00 -0.55 0.00 0.00 66.41 65.49 3lb6 h THR 8 Cb 0.58 -0.14 -0.03 0.00 -1.73 0.00 0.00 68.15 66.83 3lb6 h THR 8 CO 0.00 0.21 -0.13 0.00 -0.25 0.00 0.00 175.52 175.36 3lb6 h ALA 9 N 1.41 -0.11 -0.39 6.62 0.00 -1.90 -1.74 119.26 123.15 3lb6 h ALA 9 Ca 0.39 0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.29 3lb6 h ALA 9 Cb 0.07 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 3lb6 h ALA 9 CO -0.14 -0.60 0.09 1.25 0.00 0.00 0.00 179.25 179.84 3lb6 h LEU 10 N -0.19 0.60 -0.61 0.00 5.85 -1.71 -2.36 115.31 116.89 3lb6 h LEU 10 Ca 0.06 -0.24 0.13 0.00 0.84 0.00 0.00 57.88 58.67 3lb6 h LEU 10 Cb 0.27 -0.16 -0.10 0.00 0.37 0.00 0.00 40.66 41.04 3lb6 h LEU 10 CO -0.15 0.68 0.04 -0.09 -0.34 0.00 0.00 178.44 178.58 3lb6 h ARG 11 N 0.49 0.15 0.11 1.25 2.43 0.23 -1.28 114.38 117.78 3lb6 h ARG 11 Ca 0.12 -0.01 -0.30 0.00 -0.81 0.00 0.00 59.98 58.98 3lb6 h ARG 11 Cb 0.32 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 29.82 3lb6 h ARG 11 CO 0.00 0.10 -1.49 1.05 -1.51 0.00 0.00 179.97 178.13 3lb6 h GLU 12 N 0.16 0.24 -0.48 0.20 4.11 -1.23 -2.70 114.58 114.88 3lb6 h GLU 12 Ca 0.32 -0.41 0.07 0.00 0.07 0.00 0.00 59.36 59.41 3lb6 h GLU 12 Cb 0.52 0.15 -0.06 0.00 0.50 0.00 0.00 28.75 29.86 3lb6 h GLU 12 CO -0.49 1.11 0.16 1.25 0.07 0.00 0.00 179.01 181.11 3lb6 h LEU 13 N 0.07 0.14 -0.61 3.06 5.85 -1.29 -1.70 115.31 120.84 3lb6 h LEU 13 Ca -0.22 0.06 0.03 0.00 0.84 0.00 0.00 57.88 58.59 3lb6 h LEU 13 Cb 2.00 0.06 -0.04 0.00 0.37 0.00 0.00 40.66 43.05 3lb6 h LEU 13 CO 0.16 0.11 0.36 0.40 -0.34 0.00 0.00 178.44 179.14 3lb6 h ILE 14 N 0.32 1.05 -0.57 4.05 2.04 -1.21 -1.63 117.51 121.56 3lb6 h ILE 14 Ca 0.23 -0.24 0.08 0.00 1.00 0.00 0.00 64.86 65.92 3lb6 h ILE 14 Cb 0.25 0.28 -0.06 0.00 -0.74 0.00 0.00 36.82 36.55 3lb6 h ILE 14 CO -0.25 0.13 0.24 -0.33 0.00 0.00 0.00 178.15 177.94 3lb6 h GLU 15 N 0.71 0.43 0.50 2.37 5.08 -1.11 0.34 114.58 122.90 3lb6 h GLU 15 Ca 0.25 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.57 3lb6 h GLU 15 Cb 0.05 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.19 3lb6 h GLU 15 CO -0.12 0.28 -0.39 1.49 -1.00 0.00 0.00 179.01 179.27 3lb6 h GLU 16 N 0.44 -0.85 -0.94 2.33 4.57 -0.85 0.52 114.58 119.81 3lb6 h GLU 16 Ca 0.28 0.06 0.12 0.00 -1.18 0.00 0.00 59.36 58.64 3lb6 h GLU 16 Cb 0.29 0.19 -0.08 0.00 -0.16 0.00 0.00 28.75 29.00 3lb6 h GLU 16 CO -0.25 -0.57 0.60 -0.07 -1.18 0.00 0.00 179.01 177.54 3lb6 h LEU 17 N -0.88 0.80 -1.19 1.64 3.38 -0.95 0.16 115.31 118.28 3lb6 h LEU 17 Ca -0.05 0.04 -0.05 0.00 0.09 0.00 0.00 57.88 57.91 3lb6 h LEU 17 Cb 0.75 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.36 3lb6 h LEU 17 CO -0.00 0.43 0.03 0.58 0.09 0.00 0.00 178.44 179.57 3lb6 h VAL 18 N 0.86 1.20 0.42 1.22 2.07 -0.57 -2.80 116.25 118.65 3lb6 h VAL 18 Ca 0.46 -0.78 -0.02 0.00 0.82 0.00 0.00 66.70 67.18 3lb6 h VAL 18 Cb 0.55 0.88 0.00 0.00 -1.52 0.00 0.00 31.29 31.20 3lb6 h VAL 18 CO -0.22 0.27 -0.20 -1.13 0.02 0.00 0.00 177.57 176.31 3lb6 h ASN 19 N 0.57 -0.47 0.00 0.57 -0.73 0.16 -2.59 115.58 113.08 3lb6 h ASN 19 Ca 0.12 0.02 0.00 0.00 1.87 0.00 0.00 56.30 58.31 3lb6 h ASN 19 Cb 0.32 0.12 0.00 0.00 0.27 0.00 0.00 38.32 39.03 3lb6 h ASN 19 CO 0.01 -0.27 0.00 2.30 -0.37 0.00 0.00 177.43 179.10 3lb6 n ILE 20 N -3.89 0.00 0.00 2.57 -5.35 -0.52 0.54 119.36 112.71 3lb6 n ILE 20 Ca -0.07 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.41 3lb6 n ILE 20 Cb 0.22 -0.26 0.00 0.00 -1.74 0.00 0.00 39.64 37.86 3lb6 n ILE 20 CO 0.00 0.00 0.00 0.41 -1.76 0.00 0.00 176.55 175.20 3lb6 n THR 21 N -0.14 0.00 -0.03 7.28 -1.04 -1.06 -4.34 114.28 114.96 3lb6 n THR 21 Ca 0.00 -0.43 -0.01 0.00 -2.04 0.00 0.00 64.05 61.57 3lb6 n THR 21 Cb 0.04 0.99 -0.06 0.00 -1.82 0.00 0.00 70.33 69.48 3lb6 n THR 21 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3lb6 n GLN 22 N -0.88 1.87 -1.25 -2.82 1.13 -0.58 -4.64 117.38 110.21 3lb6 n GLN 22 Ca 0.00 -0.03 -0.30 0.00 -1.94 0.00 0.00 57.00 54.73 3lb6 n GLN 22 Cb 0.00 -1.20 0.11 0.00 0.11 0.00 0.00 30.24 29.26 3lb6 n GLN 22 CO 0.00 0.00 0.00 0.09 -1.44 0.00 0.00 177.06 175.71 3lb6 n ASN 23 N -2.11 6.37 -4.15 1.08 5.03 0.19 -4.77 115.26 116.91 3lb6 n ASN 23 Ca -0.09 -3.65 -0.38 0.00 0.87 0.00 0.00 54.58 51.33 3lb6 n ASN 23 Cb 0.56 -0.94 -0.09 0.00 -1.02 0.00 0.00 39.78 38.30 3lb6 n ASN 23 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3lb6 s GLN 24 N -3.46 2.63 0.03 3.52 0.00 -1.26 -4.81 119.66 116.31 3lb6 s GLN 24 Ca 0.59 -2.34 -0.29 0.00 -0.00 0.00 0.00 55.36 53.32 3lb6 s GLN 24 Cb 0.47 -3.84 -0.16 0.00 0.00 0.00 0.00 33.01 29.48 3lb6 s GLN 24 CO 0.03 -1.18 1.23 0.87 0.00 0.00 0.00 175.29 176.24 3lb6 h LYS 25 N 7.45 -1.01 -6.23 9.60 1.57 -1.97 -3.44 116.57 122.54 3lb6 h LYS 25 Ca -0.04 0.07 -0.51 0.00 -1.87 0.00 0.00 60.65 58.30 3lb6 h LYS 25 Cb 0.99 0.23 -0.01 0.00 0.08 0.00 0.00 32.23 33.52 3lb6 h LYS 25 CO 0.74 -0.68 -0.35 0.00 -0.57 0.00 0.00 179.45 178.59 3lb6 s ALA 26 N -5.20 3.85 0.02 3.86 0.00 -1.26 -5.01 121.76 118.02 3lb6 s ALA 26 Ca -0.15 -0.95 -0.39 0.00 0.00 0.00 0.00 51.96 50.47 3lb6 s ALA 26 Cb 0.02 -1.93 -0.19 0.00 0.00 0.00 0.00 23.12 21.02 3lb6 s ALA 26 CO 0.46 0.36 1.07 -2.30 0.00 0.00 0.00 175.76 175.35 3lb6 n PRO 27 N -0.93 0.15 -2.11 0.00 -0.02 -1.26 -4.78 135.00 126.04 3lb6 n PRO 27 Ca -0.06 0.05 -0.42 0.00 -2.02 0.00 0.00 63.50 61.05 3lb6 n PRO 27 Cb 0.55 -1.54 -0.03 0.00 -0.02 0.00 0.00 33.50 32.46 3lb6 n PRO 27 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 3lb6 s LEU 28 N 0.23 4.35 -1.28 2.45 2.96 -1.26 -2.94 118.68 123.19 3lb6 s LEU 28 Ca 0.88 2.32 -0.06 0.00 -0.22 0.00 0.00 54.13 57.06 3lb6 s LEU 28 Cb -1.21 -3.58 0.01 0.00 0.50 0.00 0.00 46.19 41.91 3lb6 s LEU 28 CO 0.56 -0.73 1.10 0.00 -1.32 0.00 0.00 176.35 175.96 3lb6 n ASN 30 N -3.01 -3.56 -1.04 0.00 5.15 -1.15 -0.37 115.26 111.28 3lb6 n ASN 30 Ca -0.10 0.23 -0.13 0.00 -0.60 0.00 0.00 54.58 53.99 3lb6 n ASN 30 Cb 0.60 -3.05 -0.05 0.00 -0.53 0.00 0.00 39.78 36.75 3lb6 n ASN 30 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3lb6 n GLY 31 N -0.76 1.19 3.67 8.20 0.00 -1.09 -4.96 105.19 111.43 3lb6 n GLY 31 Ca -0.13 -0.42 -0.35 0.00 0.00 0.00 0.00 46.02 45.12 3lb6 n GLY 31 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3lb6 n SER 32 N -0.12 1.04 -4.72 1.61 2.88 0.50 -4.73 113.62 110.08 3lb6 n SER 32 Ca -0.13 0.68 -0.31 0.00 -1.33 0.00 0.00 58.87 57.78 3lb6 n SER 32 Cb 0.45 -1.48 -0.08 0.00 -0.75 0.00 0.00 64.21 62.35 3lb6 n SER 32 CO 0.00 0.00 0.00 -0.04 -1.23 0.00 0.00 175.04 173.77 3lb6 s MET 33 N -3.58 2.70 0.04 -1.46 -1.94 -1.26 -0.96 119.30 112.84 3lb6 s MET 33 Ca 0.76 -0.75 0.01 0.00 -1.71 0.00 0.00 55.69 53.99 3lb6 s MET 33 Cb -0.34 -2.63 -0.03 0.00 2.01 0.00 0.00 34.83 33.85 3lb6 s MET 33 CO 0.48 0.56 -0.05 0.14 -0.01 0.00 0.00 175.02 176.15 3lb6 s VAL 34 N -1.31 0.29 0.23 -6.03 -7.23 0.01 -4.89 120.40 101.48 3lb6 s VAL 34 Ca 0.26 -1.21 -0.32 0.00 -1.81 0.00 0.00 61.98 58.91 3lb6 s VAL 34 Cb -0.12 -0.70 -0.13 0.00 0.56 0.00 0.00 36.38 35.99 3lb6 s VAL 34 CO 0.18 -0.59 1.49 0.79 -0.31 0.00 0.00 175.10 176.66 3lb6 n TRP 35 N 1.15 2.33 -2.95 2.82 7.02 -1.26 -0.85 117.44 125.70 3lb6 n TRP 35 Ca -0.21 0.35 -0.35 0.00 -1.02 0.00 0.00 57.50 56.27 3lb6 n TRP 35 Cb 0.56 -2.51 -0.06 0.00 -2.42 0.00 0.00 31.31 26.88 3lb6 n TRP 35 CO 0.00 0.00 0.00 -1.54 -2.02 0.00 0.00 177.69 174.13 3lb6 s SER 36 N 0.49 7.09 0.12 -0.99 1.04 0.47 -4.85 113.70 117.07 3lb6 s SER 36 Ca 0.70 1.58 0.07 0.00 0.48 0.00 0.00 55.95 58.78 3lb6 s SER 36 Cb -0.62 -2.49 -0.04 0.00 0.10 0.00 0.00 66.02 62.97 3lb6 s SER 36 CO 0.46 -0.10 -0.06 0.27 0.98 0.00 0.00 173.24 174.79 3lb6 s ILE 37 N -1.74 3.57 -0.28 -1.02 -4.36 -1.26 -4.65 121.20 111.47 3lb6 s ILE 37 Ca 0.50 -1.26 -0.29 0.00 -0.26 0.00 0.00 60.65 59.34 3lb6 s ILE 37 Cb -0.15 -2.71 -0.02 0.00 1.25 0.00 0.00 42.46 40.84 3lb6 s ILE 37 CO 0.20 0.06 1.59 0.21 0.24 0.00 0.00 174.94 177.24 3lb6 s ASN 38 N -2.41 6.30 -1.27 4.36 3.84 -1.26 -4.93 114.94 119.57 3lb6 s ASN 38 Ca 0.24 1.40 -0.19 0.00 0.21 0.00 0.00 52.86 54.52 3lb6 s ASN 38 Cb -0.11 -2.53 0.02 0.00 -0.55 0.00 0.00 41.25 38.08 3lb6 s ASN 38 CO 0.16 -1.36 1.84 0.18 -2.79 0.00 0.00 177.10 175.13 3lb6 n LEU 39 N 8.80 4.63 0.00 3.21 4.77 -1.26 -4.78 117.00 132.37 3lb6 n LEU 39 Ca 0.19 -3.72 0.00 0.00 -0.03 0.00 0.00 56.01 52.45 3lb6 n LEU 39 Cb 0.46 -1.71 0.00 0.00 -2.33 0.00 0.00 43.42 39.84 3lb6 n LEU 39 CO 0.66 -0.27 0.00 0.35 -1.33 0.00 0.00 177.39 176.80 3lb6 n THR 40 N 6.60 0.00 -2.27 -5.08 -2.24 -1.26 -5.11 114.28 104.92 3lb6 n THR 40 Ca 0.48 0.00 -0.40 0.00 -2.27 0.00 0.00 64.05 61.87 3lb6 n THR 40 Cb 0.45 0.00 -0.03 0.00 -2.10 0.00 0.00 70.33 68.66 3lb6 n THR 40 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3lb6 s ALA 41 N -1.32 3.36 -0.76 6.98 0.00 -1.26 -3.10 121.76 125.66 3lb6 s ALA 41 Ca 0.00 1.07 -0.01 0.00 0.00 0.00 0.00 51.96 53.02 3lb6 s ALA 41 Cb 0.00 -3.41 -0.01 0.00 0.00 0.00 0.00 23.12 19.71 3lb6 s ALA 41 CO 0.00 -0.47 0.64 0.41 0.00 0.00 0.00 175.76 176.33 3lb6 n GLY 42 N 0.85 -0.13 0.00 0.00 0.00 -1.26 -4.98 105.19 99.68 3lb6 n GLY 42 Ca 0.01 -0.05 0.02 0.00 0.00 0.00 0.00 46.02 46.00 3lb6 n GLY 42 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 3lb6 n MET 43 N -2.95 2.66 -0.16 1.61 3.85 -1.18 -3.85 117.12 117.09 3lb6 n MET 43 Ca -0.17 -0.02 -0.08 0.00 -1.00 0.00 0.00 57.70 56.43 3lb6 n MET 43 Cb 0.60 -0.91 0.01 0.00 -1.05 0.00 0.00 33.22 31.88 3lb6 n MET 43 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 175.97 177.85 3lb6 h TYR 44 N 0.00 0.70 -0.17 3.17 0.05 -1.93 0.28 116.97 119.06 3lb6 h TYR 44 Ca 0.00 -0.04 -0.19 0.00 0.05 0.00 0.00 58.73 58.55 3lb6 h TYR 44 Cb 0.14 -0.21 0.01 0.00 1.01 0.00 0.00 36.73 37.67 3lb6 h TYR 44 CO 0.00 0.57 -0.63 0.00 -1.05 0.00 0.00 178.16 177.06 3lb6 h ALA 46 N 0.56 1.18 -0.37 0.00 0.00 -1.63 0.13 119.26 119.13 3lb6 h ALA 46 Ca -0.03 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 3lb6 h ALA 46 Cb 1.25 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 3lb6 h ALA 46 CO 0.13 0.34 0.06 0.00 0.00 0.00 0.00 179.25 179.78 3lb6 h ALA 47 N 1.39 1.41 0.12 0.00 0.00 -0.31 -2.12 119.26 119.73 3lb6 h ALA 47 Ca 0.37 -0.17 -0.31 0.00 0.00 0.00 0.00 54.91 54.79 3lb6 h ALA 47 Cb 0.10 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3lb6 h ALA 47 CO -0.15 0.42 -1.55 1.25 0.00 0.00 0.00 179.25 179.22 3lb6 h LEU 48 N 0.54 0.38 -2.07 0.00 5.85 -1.01 -2.69 115.31 116.31 3lb6 h LEU 48 Ca 0.12 -0.54 -0.01 0.00 0.84 0.00 0.00 57.88 58.29 3lb6 h LEU 48 Cb 0.26 -0.12 -0.00 0.00 0.37 0.00 0.00 40.66 41.17 3lb6 h LEU 48 CO 0.00 1.45 -0.06 -0.33 -0.34 0.00 0.00 178.44 179.16 3lb6 h GLU 49 N 0.07 0.00 0.00 1.25 5.08 -0.64 0.50 114.58 120.83 3lb6 h GLU 49 Ca -0.25 0.00 -0.03 0.00 -1.00 0.00 0.00 59.36 58.08 3lb6 h GLU 49 Cb 2.02 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 31.26 3lb6 h GLU 49 CO 0.16 0.06 -0.33 1.03 -1.00 0.00 0.00 179.01 178.93 3lb6 h SER 50 N 0.00 0.00 1.13 1.42 0.87 -1.39 -3.39 113.55 112.20 3lb6 h SER 50 Ca -0.00 -0.24 -0.02 0.00 -1.23 0.00 0.00 61.79 60.29 3lb6 h SER 50 Cb 0.29 0.00 -0.00 0.00 -0.44 0.00 0.00 62.40 62.25 3lb6 h SER 50 CO 0.01 0.80 -0.11 -0.07 -0.53 0.00 0.00 176.83 176.93 3lb6 h LEU 51 N -1.00 0.00 -2.16 2.23 3.38 -1.42 -3.06 115.31 113.28 3lb6 h LEU 51 Ca -0.05 0.00 0.07 0.00 0.09 0.00 0.00 57.88 57.99 3lb6 h LEU 51 Cb 0.51 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 3lb6 h LEU 51 CO -0.03 0.11 0.27 -0.29 0.09 0.00 0.00 178.44 178.59 3lb6 h ILE 52 N 0.00 0.41 0.00 1.22 6.09 -1.08 0.25 117.51 124.40 3lb6 h ILE 52 Ca -0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 3lb6 h ILE 52 Cb 0.70 0.78 0.00 0.00 0.47 0.00 0.00 36.82 38.77 3lb6 h ILE 52 CO 0.01 0.00 0.00 0.59 -3.07 0.00 0.00 178.15 175.68 3lb6 n ASN 53 N -3.72 0.58 -4.48 2.19 3.02 -1.16 -4.42 115.26 107.28 3lb6 n ASN 53 Ca 0.03 0.59 -0.43 0.00 -0.03 0.00 0.00 54.58 54.74 3lb6 n ASN 53 Cb 0.40 -0.73 -0.02 0.00 -0.61 0.00 0.00 39.78 38.82 3lb6 n ASN 53 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3lb6 s VAL 54 N -3.16 4.60 -0.13 2.41 1.01 0.89 -4.99 120.40 121.05 3lb6 s VAL 54 Ca 0.08 -1.70 -0.17 0.00 0.00 0.00 0.00 61.98 60.19 3lb6 s VAL 54 Cb 0.12 -4.89 -0.04 0.00 0.00 0.00 0.00 36.38 31.56 3lb6 s VAL 54 CO 0.48 -1.65 0.44 -0.94 0.00 0.00 0.00 175.10 173.44 3lb6 s SER 55 N 3.74 6.64 0.00 3.32 1.04 -1.26 -4.08 113.70 123.11 3lb6 s SER 55 Ca 0.39 0.76 0.00 0.00 0.48 0.00 0.00 55.95 57.58 3lb6 s SER 55 Cb -0.03 -2.27 0.00 0.00 0.10 0.00 0.00 66.02 63.82 3lb6 s SER 55 CO -0.06 0.02 0.00 0.61 0.98 0.00 0.00 173.24 174.79 3lb6 n GLY 56 N 3.28 0.69 3.34 7.32 0.00 -1.26 -5.06 105.19 113.49 3lb6 n GLY 56 Ca -0.08 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.56 3lb6 n GLY 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3lb6 h SER 58 N 8.26 0.25 -0.39 0.00 4.64 -1.97 -3.29 113.55 121.06 3lb6 h SER 58 Ca -0.29 -0.33 0.11 0.00 -0.47 0.00 0.00 61.79 60.81 3lb6 h SER 58 Cb 1.12 -0.08 -0.02 0.00 -0.31 0.00 0.00 62.40 63.11 3lb6 h SER 58 CO 0.61 1.27 0.74 0.00 -0.87 0.00 0.00 176.83 178.58 3lb6 h ALA 59 N 0.69 2.12 -0.13 5.18 0.00 -2.01 0.54 119.26 125.65 3lb6 h ALA 59 Ca -0.18 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.72 3lb6 h ALA 59 Cb 1.95 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.77 3lb6 h ALA 59 CO 0.15 -0.94 0.00 0.44 0.00 0.00 0.00 179.25 178.90 3lb6 n ILE 60 N -3.13 0.37 0.06 0.00 -5.35 -1.24 -4.72 119.36 105.36 3lb6 n ILE 60 Ca 0.08 -0.69 -0.12 0.00 -0.27 0.00 0.00 62.75 61.75 3lb6 n ILE 60 Cb 0.88 0.95 -0.07 0.00 -1.74 0.00 0.00 39.64 39.66 3lb6 n ILE 60 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 3lb6 h GLU 61 N 2.00 -0.50 -0.04 6.28 4.57 -0.00 -1.82 114.58 125.06 3lb6 h GLU 61 Ca 0.00 0.03 0.01 0.00 -1.18 0.00 0.00 59.36 58.22 3lb6 h GLU 61 Cb 0.54 0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 29.23 3lb6 h GLU 61 CO 0.00 -0.34 -0.16 0.87 -1.18 0.00 0.00 179.01 178.20 3lb6 h LYS 62 N -0.52 -0.16 -0.58 1.92 1.57 -1.85 -0.93 116.57 116.02 3lb6 h LYS 62 Ca 0.00 0.01 0.13 0.00 -1.87 0.00 0.00 60.65 58.92 3lb6 h LYS 62 Cb 0.54 0.04 -0.11 0.00 0.08 0.00 0.00 32.23 32.78 3lb6 h LYS 62 CO -0.24 -0.11 -0.09 2.41 -0.57 0.00 0.00 179.45 180.85 3lb6 n THR 63 N -3.41 -0.24 -0.07 -0.16 -1.04 -1.17 0.66 114.28 108.84 3lb6 n THR 63 Ca -0.02 1.31 -0.12 0.00 -2.04 0.00 0.00 64.05 63.19 3lb6 n THR 63 Cb 0.11 -1.85 0.01 0.00 -1.82 0.00 0.00 70.33 66.78 3lb6 n THR 63 CO 0.00 0.00 0.00 1.56 -0.64 0.00 0.00 175.07 175.99 3lb6 h GLN 64 N 0.00 0.79 0.66 -2.82 4.20 -0.32 -0.39 115.11 117.23 3lb6 h GLN 64 Ca 0.30 -0.44 -0.03 0.00 0.06 0.00 0.00 58.65 58.54 3lb6 h GLN 64 Cb 0.52 0.03 0.01 0.00 0.30 0.00 0.00 27.48 28.34 3lb6 h GLN 64 CO -0.58 1.07 -0.32 -0.09 -0.67 0.00 0.00 178.83 178.24 3lb6 h ARG 65 N 0.63 -0.86 -0.81 1.46 2.43 0.13 -2.08 114.38 115.28 3lb6 h ARG 65 Ca 0.04 0.06 0.19 0.00 -0.81 0.00 0.00 59.98 59.46 3lb6 h ARG 65 Cb 1.02 0.20 -0.12 0.00 -0.42 0.00 0.00 29.97 30.64 3lb6 h ARG 65 CO 0.10 -0.56 0.24 0.52 -1.51 0.00 0.00 179.97 178.76 3lb6 h MET 66 N -0.93 0.28 -0.72 0.20 2.86 -0.97 0.89 114.93 116.54 3lb6 h MET 66 Ca -0.09 -0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.55 3lb6 h MET 66 Cb 0.70 -0.06 -0.04 0.00 0.06 0.00 0.00 31.60 32.26 3lb6 h MET 66 CO 0.15 0.19 0.48 -0.07 1.06 0.00 0.00 176.91 178.71 3lb6 h LEU 67 N 0.29 0.80 -2.36 1.22 3.38 -0.72 -2.94 115.31 114.98 3lb6 h LEU 67 Ca 0.48 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.44 3lb6 h LEU 67 Cb 0.88 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 3lb6 h LEU 67 CO -0.55 0.57 0.00 0.77 0.09 0.00 0.00 178.44 179.32 3lb6 h SER 68 N 0.94 0.00 1.14 -0.43 4.64 -0.12 -0.21 113.55 119.51 3lb6 h SER 68 Ca 0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.59 3lb6 h SER 68 Cb -0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 3lb6 h SER 68 CO -0.07 0.00 -0.49 1.23 -0.87 0.00 0.00 176.83 176.63 3lb6 h GLY 69 N 0.00 0.00 1.52 -0.77 0.00 -1.56 -3.12 103.07 99.14 3lb6 h GLY 69 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 3lb6 h GLY 69 CO -0.00 0.00 -0.51 0.74 0.00 0.00 0.00 176.54 176.77 3lb6 h PHE 70 N 0.00 0.00 -3.62 5.60 0.04 -1.12 -3.44 116.94 114.40 3lb6 h PHE 70 Ca 0.00 0.00 -0.69 0.00 2.80 0.00 0.00 57.97 60.08 3lb6 h PHE 70 Cb 0.82 0.00 -0.21 0.00 2.20 0.00 0.00 35.95 38.75 3lb6 h PHE 70 CO 0.00 0.03 -0.49 0.00 -0.60 0.00 0.00 178.31 177.25 3lb6 n PRO 72 N 5.08 -0.21 -3.60 0.00 -0.02 -1.26 -4.55 135.00 130.43 3lb6 n PRO 72 Ca -0.12 1.50 -0.22 0.00 -2.02 0.00 0.00 63.50 62.64 3lb6 n PRO 72 Cb 0.48 -2.23 -0.01 0.00 -0.02 0.00 0.00 33.50 31.72 3lb6 n PRO 72 CO 0.00 0.00 0.00 -3.38 1.98 0.00 0.00 175.50 174.10 3lb6 s HIS 73 N -5.95 3.43 0.31 6.00 -3.43 -1.26 -5.08 115.29 109.30 3lb6 s HIS 73 Ca -0.14 0.14 -0.28 0.00 -0.80 0.00 0.00 55.06 53.98 3lb6 s HIS 73 Cb 0.21 -1.80 -0.09 0.00 -1.43 0.00 0.00 32.58 29.46 3lb6 s HIS 73 CO 0.70 0.21 1.12 -1.59 -2.00 0.00 0.00 174.74 173.18 3lb6 s LYS 74 N -4.18 4.49 -0.15 -0.38 0.00 -1.26 -5.00 119.74 113.26 3lb6 s LYS 74 Ca 0.39 1.81 0.00 0.00 0.00 0.00 0.00 55.97 58.16 3lb6 s LYS 74 Cb -0.09 -3.04 -0.00 0.00 0.00 0.00 0.00 37.83 34.69 3lb6 s LYS 74 CO 0.33 0.08 -0.15 0.08 0.00 0.00 0.00 175.35 175.69 3lb6 s VAL 75 N -1.25 2.75 0.08 1.79 1.01 -1.26 -5.13 120.40 118.39 3lb6 s VAL 75 Ca 0.48 -0.75 0.03 0.00 0.00 0.00 0.00 61.98 61.74 3lb6 s VAL 75 Cb -0.31 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.87 3lb6 s VAL 75 CO 0.40 0.52 0.10 -0.44 0.00 0.00 0.00 175.10 175.68 3lb6 s SER 76 N 0.70 5.63 0.35 3.32 0.01 -1.26 -5.02 113.70 117.44 3lb6 s SER 76 Ca -0.07 0.02 -0.28 0.00 1.31 0.00 0.00 55.95 56.92 3lb6 s SER 76 Cb -0.16 -1.54 -0.11 0.00 0.21 0.00 0.00 66.02 64.43 3lb6 s SER 76 CO 0.02 0.16 1.45 0.00 0.41 0.00 0.00 173.24 175.28 3lb6 s ALA 77 N -1.43 3.57 0.00 1.44 0.00 -1.26 -1.52 121.76 122.57 3lb6 s ALA 77 Ca 0.30 1.49 0.00 0.00 0.00 0.00 0.00 51.96 53.75 3lb6 s ALA 77 Cb -0.12 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.42 3lb6 s ALA 77 CO 0.23 -0.93 0.00 0.41 0.00 0.00 0.00 175.76 175.46 3lb6 n GLY 78 N 0.78 0.76 3.64 0.00 0.00 -1.26 -5.02 105.19 104.09 3lb6 n GLY 78 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 3lb6 n GLY 78 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3lb6 s GLN 79 N -0.22 3.66 -0.41 1.61 0.74 -0.57 -5.06 119.66 119.41 3lb6 s GLN 79 Ca 0.00 -0.37 0.05 0.00 0.05 0.00 0.00 55.36 55.09 3lb6 s GLN 79 Cb 0.00 -3.06 0.19 0.00 1.10 0.00 0.00 33.01 31.24 3lb6 s GLN 79 CO 0.00 0.41 0.39 1.19 -0.55 0.00 0.00 175.29 176.73 3lb6 n PHE 80 N 3.09 -0.91 -0.04 1.67 3.72 -1.26 -4.80 117.46 118.91 3lb6 n PHE 80 Ca -0.17 -3.30 -0.02 0.00 -0.05 0.00 0.00 57.45 53.91 3lb6 n PHE 80 Cb 0.53 0.17 -0.01 0.00 -0.94 0.00 0.00 39.48 39.24 3lb6 n PHE 80 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 3lb6 h SER 81 N 5.24 0.00 0.34 4.37 4.64 -1.97 -3.40 113.55 122.77 3lb6 h SER 81 Ca 0.22 0.00 -0.08 0.00 -0.47 0.00 0.00 61.79 61.46 3lb6 h SER 81 Cb 0.91 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.99 3lb6 h SER 81 CO 0.38 0.45 -0.36 0.28 -0.87 0.00 0.00 176.83 176.71 3lb6 h SER 82 N -0.71 0.02 -2.13 4.97 0.02 -1.89 -3.40 113.55 110.44 3lb6 h SER 82 Ca 0.00 -0.01 -0.60 0.00 -0.84 0.00 0.00 61.79 60.34 3lb6 h SER 82 Cb 0.19 -0.01 -0.12 0.00 0.14 0.00 0.00 62.40 62.60 3lb6 h SER 82 CO 0.00 0.38 1.00 -0.22 -1.14 0.00 0.00 176.83 176.85 3lb6 s LEU 83 N -8.24 3.85 -0.21 5.07 2.96 -1.26 -4.69 118.68 116.17 3lb6 s LEU 83 Ca -0.03 -1.09 -0.17 0.00 -0.22 0.00 0.00 54.13 52.62 3lb6 s LEU 83 Cb 0.14 -2.50 -0.19 0.00 0.50 0.00 0.00 46.19 44.14 3lb6 s LEU 83 CO 0.73 -1.54 0.14 1.41 -1.32 0.00 0.00 176.35 175.77 3lb6 n HIS 84 N 8.39 0.87 -2.04 5.38 8.25 -1.26 -4.67 115.22 130.14 3lb6 n HIS 84 Ca 0.12 0.33 -0.32 0.00 -0.26 0.00 0.00 57.72 57.59 3lb6 n HIS 84 Cb 0.49 -1.09 -0.04 0.00 1.12 0.00 0.00 29.99 30.46 3lb6 n HIS 84 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 3lb6 s VAL 85 N -2.43 3.41 -0.48 1.59 1.01 -1.26 -4.81 120.40 117.43 3lb6 s VAL 85 Ca -0.29 -0.13 0.08 0.00 0.00 0.00 0.00 61.98 61.63 3lb6 s VAL 85 Cb 0.08 -3.97 0.27 0.00 0.00 0.00 0.00 36.38 32.76 3lb6 s VAL 85 CO 0.61 -0.93 0.66 -1.14 0.00 0.00 0.00 175.10 174.30 3lb6 n ARG 86 N 8.99 1.52 0.00 2.72 0.63 -1.26 -4.62 116.66 124.64 3lb6 n ARG 86 Ca 0.32 -3.82 0.00 0.00 -0.92 0.00 0.00 57.85 53.43 3lb6 n ARG 86 Cb 0.49 -1.69 0.00 0.00 0.45 0.00 0.00 32.46 31.71 3lb6 n ARG 86 CO 0.00 0.00 0.00 -0.40 -2.51 0.00 0.00 177.63 174.72 3lb6 n ASP 87 N 0.91 0.48 -3.73 6.15 3.85 -1.26 -5.06 116.55 117.89 3lb6 n ASP 87 Ca 0.25 -1.15 -0.12 0.00 -0.71 0.00 0.00 54.79 53.06 3lb6 n ASP 87 Cb 0.50 0.00 -0.11 0.00 -1.35 0.00 0.00 41.12 40.16 3lb6 n ASP 87 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 3lb6 s THR 88 N -0.15 -0.02 0.02 2.12 2.01 -1.26 -5.10 115.64 113.27 3lb6 s THR 88 Ca 0.00 0.06 0.05 0.00 0.31 0.00 0.00 61.69 62.11 3lb6 s THR 88 Cb 0.00 -0.52 -0.03 0.00 0.01 0.00 0.00 72.50 71.95 3lb6 s THR 88 CO 0.00 0.02 -0.12 -0.54 -0.69 0.00 0.00 174.62 173.29 3lb6 s LYS 89 N 0.81 2.32 0.17 4.92 1.02 -1.26 -0.39 119.74 127.32 3lb6 s LYS 89 Ca -0.05 -0.85 0.05 0.00 0.02 0.00 0.00 55.97 55.14 3lb6 s LYS 89 Cb -0.06 -2.35 -0.05 0.00 -0.52 0.00 0.00 37.83 34.86 3lb6 s LYS 89 CO -0.06 0.57 -0.10 0.96 -0.92 0.00 0.00 175.35 175.80 3lb6 s ILE 90 N -0.97 1.31 0.57 2.17 -4.36 -0.03 -4.82 121.20 115.08 3lb6 s ILE 90 Ca 0.16 -2.10 -0.20 0.00 -0.26 0.00 0.00 60.65 58.25 3lb6 s ILE 90 Cb -0.11 -1.94 -0.04 0.00 1.25 0.00 0.00 42.46 41.62 3lb6 s ILE 90 CO 0.07 -0.67 1.23 -1.61 0.24 0.00 0.00 174.94 174.20 3lb6 s GLU 91 N -3.73 3.06 0.24 0.37 2.02 -1.26 -0.81 118.70 118.59 3lb6 s GLU 91 Ca 0.19 1.91 -0.05 0.00 0.02 0.00 0.00 54.97 57.04 3lb6 s GLU 91 Cb 0.02 -2.03 0.37 0.00 0.10 0.00 0.00 34.13 32.59 3lb6 s GLU 91 CO 0.03 -1.15 1.82 0.28 0.02 0.00 0.00 175.26 176.25 3lb6 h VAL 92 N 1.07 0.95 0.00 2.63 2.07 -1.31 -1.73 116.25 119.93 3lb6 h VAL 92 Ca -0.50 -0.28 -0.01 0.00 0.82 0.00 0.00 66.70 66.72 3lb6 h VAL 92 Cb 1.30 0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 31.11 3lb6 h VAL 92 CO 0.56 0.15 -0.05 0.00 0.02 0.00 0.00 177.57 178.25 3lb6 h ALA 93 N 1.43 1.41 0.14 1.67 0.00 -1.86 0.04 119.26 122.09 3lb6 h ALA 93 Ca 0.38 -0.05 -0.30 0.00 0.00 0.00 0.00 54.91 54.95 3lb6 h ALA 93 Cb 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3lb6 h ALA 93 CO -0.22 0.07 -1.44 0.37 0.00 0.00 0.00 179.25 178.02 3lb6 h GLN 94 N 0.00 0.29 -0.56 0.00 5.75 -1.71 -3.05 115.11 115.83 3lb6 h GLN 94 Ca -0.00 -0.49 0.00 0.00 -0.15 0.00 0.00 58.65 58.01 3lb6 h GLN 94 Cb 0.15 0.18 -0.03 0.00 1.07 0.00 0.00 27.48 28.85 3lb6 h GLN 94 CO 0.01 1.18 0.35 0.35 -2.65 0.00 0.00 178.83 178.07 3lb6 h PHE 95 N 0.08 0.72 -0.05 3.99 3.57 -0.33 0.49 116.94 125.42 3lb6 h PHE 95 Ca -0.21 0.01 -0.17 0.00 3.53 0.00 0.00 57.97 61.13 3lb6 h PHE 95 Cb 2.02 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 40.51 3lb6 h PHE 95 CO 0.07 0.48 -0.71 -0.39 -2.23 0.00 0.00 178.31 175.53 3lb6 h VAL 96 N 0.76 1.42 -0.46 1.41 -1.51 -1.18 0.43 116.25 117.12 3lb6 h VAL 96 Ca 0.20 -2.21 -0.04 0.00 -1.23 0.00 0.00 66.70 63.42 3lb6 h VAL 96 Cb -0.05 2.17 -0.02 0.00 -2.13 0.00 0.00 31.29 31.26 3lb6 h VAL 96 CO -0.04 0.65 0.13 0.11 -1.23 0.00 0.00 177.57 177.19 3lb6 h LYS 97 N 0.17 0.72 0.09 5.19 1.57 -1.38 1.24 116.57 124.17 3lb6 h LYS 97 Ca -0.02 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.59 3lb6 h LYS 97 Cb 1.26 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 33.47 3lb6 h LYS 97 CO 0.11 0.70 -0.04 -0.44 -0.57 0.00 0.00 179.45 179.21 3lb6 h ASP 98 N 0.61 -0.10 0.42 0.86 3.32 -0.79 -0.68 116.42 120.06 3lb6 h ASP 98 Ca 0.15 -0.27 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 3lb6 h ASP 98 Cb 0.29 0.03 -0.02 0.00 0.22 0.00 0.00 39.33 39.85 3lb6 h ASP 98 CO -0.00 0.22 -0.43 0.25 -1.72 0.00 0.00 179.24 177.56 3lb6 h LEU 99 N -0.44 -1.19 -0.90 1.55 5.85 -0.04 -1.72 115.31 118.42 3lb6 h LEU 99 Ca -0.01 0.10 0.13 0.00 0.84 0.00 0.00 57.88 58.93 3lb6 h LEU 99 Cb 0.37 0.39 -0.14 0.00 0.37 0.00 0.00 40.66 41.65 3lb6 h LEU 99 CO 0.02 -0.57 -0.43 0.25 -0.34 0.00 0.00 178.44 177.37 3lb6 h LEU 100 N -0.86 -1.58 -0.26 2.25 5.85 0.16 0.12 115.31 121.00 3lb6 h LEU 100 Ca -0.05 0.30 0.06 0.00 0.84 0.00 0.00 57.88 59.03 3lb6 h LEU 100 Cb 0.74 0.77 -0.07 0.00 0.37 0.00 0.00 40.66 42.48 3lb6 h LEU 100 CO -0.06 -0.29 -0.24 0.25 -0.34 0.00 0.00 178.44 177.77 3lb6 h LEU 101 N -0.05 -0.76 -1.48 2.25 5.85 -0.93 -1.17 115.31 119.01 3lb6 h LEU 101 Ca 0.27 0.14 0.10 0.00 0.84 0.00 0.00 57.88 59.23 3lb6 h LEU 101 Cb 0.55 0.36 -0.05 0.00 0.37 0.00 0.00 40.66 41.90 3lb6 h LEU 101 CO -0.91 -0.27 0.47 -0.74 -0.34 0.00 0.00 178.44 176.65 3lb6 h HIS 102 N -0.23 0.62 0.51 1.25 2.76 0.14 -1.93 115.15 118.26 3lb6 h HIS 102 Ca 0.14 0.02 -0.03 0.00 -2.20 0.00 0.00 60.37 58.30 3lb6 h HIS 102 Cb 0.45 -0.20 0.01 0.00 1.55 0.00 0.00 27.41 29.22 3lb6 h HIS 102 CO -0.40 0.29 -0.25 -0.07 -1.30 0.00 0.00 177.93 176.21 3lb6 h LEU 103 N 0.58 -0.58 -1.22 0.26 3.38 -0.03 -2.16 115.31 115.54 3lb6 h LEU 103 Ca 0.33 -0.04 0.35 0.00 0.09 0.00 0.00 57.88 58.60 3lb6 h LEU 103 Cb 0.50 0.15 -0.13 0.00 0.09 0.00 0.00 40.66 41.27 3lb6 h LEU 103 CO -0.11 -0.30 0.69 0.11 0.09 0.00 0.00 178.44 178.91 3lb6 h LYS 104 N -0.85 0.25 -0.37 1.13 1.57 -0.66 0.47 116.57 118.12 3lb6 h LYS 104 Ca -0.07 -0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.67 3lb6 h LYS 104 Cb 0.59 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.83 3lb6 h LYS 104 CO 0.12 0.17 0.15 -0.22 -0.57 0.00 0.00 179.45 179.09 3lb6 h LYS 105 N 0.26 0.56 -0.39 3.15 3.64 -1.02 -0.30 116.57 122.47 3lb6 h LYS 105 Ca 0.73 -0.10 -0.12 0.00 -1.27 0.00 0.00 60.65 59.89 3lb6 h LYS 105 Cb 1.94 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 33.66 3lb6 h LYS 105 CO -0.47 0.54 -0.22 -0.07 -2.27 0.00 0.00 179.45 176.96 3lb6 h LEU 106 N 0.46 0.80 0.69 5.20 3.38 0.46 -0.75 115.31 125.54 3lb6 h LEU 106 Ca 0.12 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 3lb6 h LEU 106 Cb 0.19 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.73 3lb6 h LEU 106 CO -0.01 1.00 -0.33 0.15 0.09 0.00 0.00 178.44 179.34 3lb6 h PHE 107 N 0.69 -0.86 -1.01 1.13 3.04 -0.66 0.22 116.94 119.49 3lb6 h PHE 107 Ca 0.09 -0.02 0.26 0.00 3.98 0.00 0.00 57.97 62.29 3lb6 h PHE 107 Cb 0.74 0.29 -0.13 0.00 2.56 0.00 0.00 35.95 39.41 3lb6 h PHE 107 CO 0.04 -0.53 0.60 -0.09 -2.02 0.00 0.00 178.31 176.30 3lb6 h ARG 108 N -0.92 0.51 -0.09 1.11 9.65 -0.94 0.49 114.38 124.19 3lb6 h ARG 108 Ca -0.09 -0.03 0.00 0.00 -1.10 0.00 0.00 59.98 58.76 3lb6 h ARG 108 Cb 0.71 -0.11 0.00 0.00 -1.39 0.00 0.00 29.97 29.18 3lb6 h ARG 108 CO 0.15 0.34 0.00 0.39 2.80 0.00 0.00 179.97 183.65 3lb6 n GLU 109 N -4.89 1.20 -3.79 0.20 1.02 -0.30 -4.90 120.64 109.18 3lb6 n GLU 109 Ca 0.28 -0.31 -0.23 0.00 -0.02 0.00 0.00 57.16 56.87 3lb6 n GLU 109 Cb 0.80 -1.08 0.02 0.00 -0.02 0.00 0.00 31.44 31.16 3lb6 n GLU 109 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3lb6 n GLY 110 N 0.65 -0.29 3.05 0.62 0.00 0.17 -4.98 105.19 104.41 3lb6 n GLY 110 Ca 0.03 0.14 -0.31 0.00 0.00 0.00 0.00 46.02 45.88 3lb6 n GLY 110 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3lb6 s ARG 111 N -6.18 2.46 -0.16 1.61 0.52 0.68 -5.01 118.95 112.86 3lb6 s ARG 111 Ca 0.06 -0.74 0.15 0.00 -0.52 0.00 0.00 55.73 54.68 3lb6 s ARG 111 Cb -0.03 -2.35 0.35 0.00 0.52 0.00 0.00 34.95 33.44 3lb6 s ARG 111 CO 0.83 -0.28 1.18 1.19 0.02 0.00 0.00 175.30 178.24 3lb6 n PHE 112 N 4.69 0.00 0.00 -0.53 3.72 -1.26 -4.17 117.46 119.91 3lb6 n PHE 112 Ca -0.18 -1.16 0.00 0.00 -0.05 0.00 0.00 57.45 56.06 3lb6 n PHE 112 Cb 0.49 -0.19 0.00 0.00 -0.94 0.00 0.00 39.48 38.84 3lb6 n PHE 112 CO 0.00 0.00 0.00 0.27 -0.05 0.00 0.00 176.76 176.98